A0A096N1C0_PAPAN Loading...

ADAM metallopeptidase with thrombospondin type 1 motif 8

AlphaFold DB , UniProt , Accession A0A096N1C0, Species PAPAN (Papio anubis, Olive baboon), Gene ADAMTS8, Length 888 aa.

						>A0A096N1C0_PAPAN|A0A096N1C0|ADAMTS8
MLPAPAAPRWPPLLLLLLLLPLARGAPARPAAGGQASELVVPTRLPGSAGELALHLSAFGKGFVLRLAPDDSFLAPEFKIERLGGSGRSTGGERGLRGCFFSGTVNGEPESLAAVSLCRGLSGSFLLDGEEFTIQPQGAGGSLGQPHRLQRWGPAGARPLPRGPEWEVETGEGQRQERGDNEEDSEEESQEEEAEGASELPPPLGATSRTKRFVSEARFVETLLVADASMAAFYGADLQNHILTLMSVAARIYKHPSIKNSINLMVVKVLIVEDEKWGPEVSDNGGLTLRNFCNWQRRFNQPSDRHPEHYDTAILLTRQNFCGQEGLCDTLGVADIGTICDPNKSCSVIEDEGLQAAHTLAHELGHVLSMPHDDSKPCTRLFGPMGKHHMMAPLFVHLNQTLPWSPCSAMYLTELLDGGHGDCLLDAPAAALPLPTGLPGRMALYQLDQQCRQIFGPDFHHCPNTSAQDVCAQLWCHTDGAEPLCHTKNGSLPWADGTPCGPGHLCSEGSCLPEEEVERPKPVVDGGWAPWGPWGECSRTCGGGVQFSHRECKDPEPQNGGRYCLGRRAKYQSCHTEECPPDGKSFREQQCEKYNAYNYTDMDGNLLQWVPKYAGVSPRDRCKLFCRARGRSEFKVFEAKVIDGTLCGPETLAICVRGQCVKAGCDHVVDSPRKLDKCGVCGGKGNSCRKVSGSLTPTSYGYNDIVTIPAGATNIDVKQRSHPGVQNDGNYLALKTADGQYLLNGNLAISAIEQDILVKGTILKYSGSIATLERLQSFRPLPEPLTVQLLTVPGEVFPPKVKYTFFVPNDVDFSMQSSKERATTNIIQPLLHVQWVLGDWSECSSTCGPGWQRRTVECRDPSGQASATCNKALKPEDAKPCESQLCPL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	35.2	Very low	33.5	Very low	248 Å²	248	145.5 Å²	145.5	100%	1.222	83%	0.833	S	S	*	*				0	115.8	0	-83	170.2	166.4	0	0	107.7
2	L	32	Very low	34.5	Very low	160 Å²	160	142.3 Å²	142.3	84%	0.838	82%	0.821	S	S	*	*			trans	-53.6	163	167	-87.7	158.7	0	0	0	111.5
3	P	40.4	Very low	34.1	Very low	126 Å²	126	143.5 Å²	143.5	82%	0.818	82%	0.821	S	S	*	*				-149.6	165.1	52.6	36.9	-13.9	0	0	0	119.3
4	A	32.2	Very low	33.8	Very low	84 Å²	84	143.2 Å²	143.2	69%	0.694	82%	0.815	S	S	*	*			trans	-82.9	172.9	165.9	0	0	0	0	0	112
5	P	40.4	Very low	33.5	Very low	129 Å²	129	145 Å²	145	84%	0.838	82%	0.82	S	S	*	*			trans	-129.9	139.9	143	31.2	-15.2	0	0	0	115.2
6	A	30.1	Very low	33.2	Very low	100 Å²	100	145.1 Å²	145.1	83%	0.826	82%	0.817	S	S	*	*			trans	-28.9	151.4	165.9	0	0	0	0	0	121.5
7	A	29.6	Very low	33	Very low	92 Å²	92	144.5 Å²	144.5	76%	0.76	81%	0.81	S	S	*	*			trans	-76.2	171.2	159.6	0	0	0	0	0	113.6
8	P	34.5	Very low	32.7	Very low	133 Å²	133	144 Å²	144	86%	0.864	81%	0.805	S	S	*	*			trans	-107.7	162.8	157.3	32	-17.8	0	0	0	113.8
9	R	29.7	Very low	32.5	Very low	205 Å²	205	143.5 Å²	143.5	77%	0.774	80%	0.799	S	S	*	*			trans	-117.8	142.2	-161.3	-83.3	-175.6	168.8	178.5	-4.4	112.9
10	W	25.8	Very low	32.2	Very low	214 Å²	214	144 Å²	144	81%	0.811	80%	0.799	S	S	*	*				75.9	165.7	126.4	-69.8	34.4	0	0	0	121.6
11	P	38.6	Very low	32.4	Very low	110 Å²	110	142.7 Å²	142.7	71%	0.714	80%	0.798	S	S	*	*			cis	-143	-138.9	-16.1	33.1	-5	0	0	0	114.9
12	P	45.4	Very low	32.5	Very low	107 Å²	107	139.3 Å²	139.3	70%	0.695	78%	0.784	S	S	*	*				-134.1	-179.5	-102.8	44.2	-24.1	0	0	0	116.5
13	L	29.7	Very low	32.3	Very low	157 Å²	157	136.8 Å²	136.8	82%	0.822	79%	0.786	S	S	*	*			trans	177.3	107.9	143.1	-99	134.7	0	0	0	109
14	L	29.5	Very low	31.8	Very low	140 Å²	140	143 Å²	143	73%	0.733	79%	0.793	S	S	*	*				75.5	106.4	92.5	-104.8	145.5	0	0	0	115.1
15	L	30.1	Very low	31.6	Very low	170 Å²	170	142.5 Å²	142.5	89%	0.89	80%	0.796	S	S	*	*				-165.3	135.2	111.5	-126.6	86.1	0	0	0	111.4
16	L	27.9	Very low	31	Very low	147 Å²	147	141.2 Å²	141.2	77%	0.77	80%	0.796	S	S	*	*			trans	-103.6	172.5	178.1	-135.5	108.1	0	0	0	109.3
17	L	29.9	Very low	31.3	Very low	134 Å²	134	142.6 Å²	142.6	70%	0.702	80%	0.797	S	S	*	*			trans	100	103	150.8	-76.5	158.1	0	0	0	119
18	L	28.5	Very low	31.3	Very low	136 Å²	136	143 Å²	143	71%	0.712	80%	0.8	S	S	*	*				163.4	126.3	84.7	-84.7	139.5	0	0	0	114.9
19	L	28.9	Very low	31.1	Very low	135 Å²	135	148.1 Å²	148.1	71%	0.707	80%	0.802	S	S	*	*			trans	59.8	113.2	133.4	-56.9	171.8	0	0	0	124.9
20	L	26.4	Very low	31.2	Very low	153 Å²	153	144.3 Å²	144.3	80%	0.801	80%	0.804	S	S	*	*				54.4	162.7	125.6	-66.8	166.4	0	0	0	122
21	P	36.7	Very low	31.4	Very low	117 Å²	117	139.2 Å²	139.2	76%	0.76	81%	0.808	S	S	*	*			cis	-132.7	-178	-29.2	34.6	-14.2	0	0	0	114.5
22	L	35.6	Very low	31.1	Very low	177 Å²	177	138.5 Å²	138.5	93%	0.927	81%	0.811	S	S	*	*			trans	-60.9	139.8	171.2	-78.2	126.3	0	0	0	114.7
23	A	28.4	Very low	30.6	Very low	107 Å²	107	137.9 Å²	137.9	88%	0.884	82%	0.824	S	S	*	*			trans	-154.7	137.4	149	0	0	0	0	0	112.2
24	R	30.3	Very low	30.9	Very low	255 Å²	255	133.3 Å²	133.3	96%	0.962	82%	0.815	S	S	*	*			trans	-84	151.3	179.6	-72.2	171	161	175.1	-6.2	112.2
25	G	27.5	Very low	31.8	Very low	75 Å²	75	133 Å²	133	77%	0.773	81%	0.81	S	S	*	*			trans	123.5	88.5	136.7	0	0	0	0	0	120.6
26	A	29.1	Very low	33.4	Very low	101 Å²	101	126.5 Å²	126.5	84%	0.835	78%	0.78	S	S	*	*			trans	41.5	159.9	134.9	0	0	0	0	0	124
27	P	36.3	Very low	35.8	Very low	129 Å²	129	122.3 Å²	122.3	84%	0.838	76%	0.763	S	S	*	*			cis	-129	151.1	-0.7	37.1	-19.6	0	0	0	115.3
28	A	29.2	Very low	38.6	Very low	101 Å²	101	120 Å²	120	84%	0.835	75%	0.749	S	S	*	*			trans	-124.9	131.2	156.2	0	0	0	0	0	108.5
29	R	29.9	Very low	41.4	Very low	241 Å²	241	118.7 Å²	118.7	91%	0.909	74%	0.742	S	S	*	*			trans	-57.9	146.8	-174.4	-73.2	172.5	163.7	178.1	-6.1	112.5
30	P	31.9	Very low	44.3	Very low	124 Å²	124	112.4 Å²	112.4	81%	0.805	71%	0.709	S	S	*	*			trans	-81.2	133.8	173.5	33	-30	0	0	0	110.5
31	A	29.5	Very low	47.4	Very low	108 Å²	108	108.6 Å²	108.6	89%	0.893	69%	0.692	S	S	*	*			trans	-91.5	104.6	159	0	0	0	0	0	107.3
32	A	32.4	Very low	49.9	Very low	95 Å²	95	103.5 Å²	103.5	79%	0.785	66%	0.659	S	S	*	*			trans	-83.7	116.6	173.5	0	0	0	0	0	109.2	G34	A32-G34 PolarHBondContact O-N 3.37Å
33	G	35.3	Very low	52.4	Low	93 Å²	93	98.5 Å²	98.5	96%	0.959	64%	0.636	S	S	*	*			trans	-79	87.3	163.5	0	0	0	0	0	108.7
34	G	35.3	Very low	55.1	Low	61 Å²	61	102.6 Å²	102.6	63%	0.629	63%	0.629	S	S	*	*			trans	-101.9	136.2	-178.6	0	0	0	0	0	112.2	A32 A36	A32-G34 PolarHBondContact O-N 3.37Å; G34-A36 PolarHBondContact O-N 2.94Å
35	Q	47.9	Very low	57.7	Low	135 Å²	135	93.6 Å²	93.6	63%	0.631	60%	0.599	S	S	*	*			trans	-42.9	126.4	155.1	-88.3	167	-24.8	0	0	109.9	W152	Q35-W152 HydrophobicContact CG-CZ3 4.44Å
36	A	64.2	Low	59.7	Low	33 Å²	33	96.4 Å²	96.4	27%	0.273	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.5	116.9	171.4	0	0	0	0	0	108.5	G34 F59 R151	G34-A36 PolarHBondContact O-N 2.94Å; A36-F59 HydrophobicContact CB-CD1 4.04Å; A36-F59 HydrophobicContact CB-CE1 3.66Å; A36-F59 HydrophobicContact CB-CZ 4.49Å; A36-F59 WeakPolarHBondContact O-CE1 3.23Å; A36-F59 VanDerWaalsContact O-CZ 3.25Å; A36-F59 WeakPolarHBondContact O-CZ 3.32Å; A36-R151 PolarHBondContact O-N 2.91Å; A36-R151 VanDerWaalsContact O-N 3.07Å
37	S	79.3	Confident	61.1	Low	59 Å²	59	94.1 Å²	94.1	41%	0.413	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.1	131.2	172.7	71.1	0	0	0	0	110.1	L149	S37-L149 WeakPolarHBondContact CA-O 3.19Å
38	E	87	Confident	62.2	Low	85 Å²	85	91.8 Å²	91.8	40%	0.397	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.2	151.6	174	-78.8	-177.3	-165.7	0	0	110.4	A58 F59 L149	E38-A58 HydrophobicContact CB-CB 4.22Å; E38-A58 VanDerWaalsContact OE2-CA 3.26Å; E38-A58 WeakPolarHBondContact OE2-CA 3.37Å; E38-F59 HydrophobicContact CB-CD1 4.46Å; E38-F59 HydrophobicContact CB-CE1 3.95Å; E38-F59 HydrophobicContact CB-CZ 4.22Å; E38-F59 HydrophobicContact CG-CD1 3.96Å; E38-F59 HydrophobicContact CG-CE1 3.71Å; E38-F59 HydrophobicContact CG-CZ 4.47Å; E38-F59 PolarHBondContact OE2-N 2.77Å; E38-L149 PolarHBondContact N-O 3.03Å; E38-L149 PolarHBondContact O-N 2.94Å
39	L	88.9	Confident	63.3	Low	108 Å²	108	92.6 Å²	92.6	57%	0.565	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.7	125.9	171.7	-71.4	173.3	0	0	0	108.8	Q137 P146 H147 R148	L39-Q137 HydrophobicContact CD2-CB 4.32Å; L39-Q137 HydrophobicContact CD2-CG 4.25Å; L39-P146 HydrophobicContact CD2-CB 4.4Å; L39-H147 CarbonylContact C-O 3.55Å; L39-H147 WeakPolarHBondContact CA-O 3.25Å; L39-R148 HydrophobicContact CD2-CB 4.32Å
40	V	90.1	Very high	64.7	Low	3 Å²	3	84.3 Å²	84.3	2%	0.018	57%	0.573	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.9	149.5	179.7	-58.7	0	0	0	0	110.7	L56 S57 A58 I134 P146 H147 L149	V40-L56 HydrophobicContact CG2-CD2 4.16Å; V40-S57 WeakPolarHBondContact CG1-O 3.45Å; V40-A58 HydrophobicContact CG1-CB 3.4Å; V40-A58 VanDerWaalsContact CG1-CB 3.4Å; V40-I134 HydrophobicContact CG2-CD1 3.66Å; V40-P146 CarbonylContact O-C 3.06Å; V40-H147 HydrophobicContact CG2-CB 4.15Å; V40-H147 PolarHBondContact N-O 3.01Å; V40-H147 PolarHBondContact O-N 3.12Å; V40-L149 HydrophobicContact CG1-CB 3.92Å; V40-L149 HydrophobicContact CG1-CD2 4.12Å; V40-L149 HydrophobicContact CG2-CB 3.85Å
41	V	90.1	Very high	66.4	Low	74 Å²	74	83.6 Å²	83.6	45%	0.448	56%	0.559	S	S	.	*			trans	-115	110.1	169.7	-177.9	0	0	0	0	107.4	T43	V41-T43 PolarHBondContact O-N 2.75Å
42	P	88.8	Confident	68.9	Low	9 Å²	9	79 Å²	79	6%	0.058	52%	0.519	C	S	.	.			trans	-60.8	129.8	179.2	-21.5	31.6	0	0	0	111.8	L56 L121 I134 L143 H147	P42-L56 HydrophobicContact CB-CD2 3.69Å; P42-L56 HydrophobicContact CG-CD2 3.67Å; P42-L121 HydrophobicContact CB-CD2 3.89Å; P42-L121 HydrophobicContact CG-CB 4.11Å; P42-L121 HydrophobicContact CG-CD2 3.53Å; P42-L121 HydrophobicContact CG-CG 4.46Å; P42-I134 HydrophobicContact CG-CD1 4.49Å; P42-L143 HydrophobicContact CB-CD2 3.87Å; P42-L143 HydrophobicContact CG-CD2 4.38Å; P42-H147 WeakPolarHBondContact CD-ND1 3.27Å
43	T	88.7	Confident	71.5	Confident	72 Å²	72	75.2 Å²	75.2	44%	0.442	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129.9	177.2	39.6	0	0	0	0	110.3	V41 H55	V41-T43 PolarHBondContact O-N 2.75Å; T43-H55 PolarHBondContact N-O 2.95Å; T43-H55 PolarHBondContact O-N 3.09Å; T43-H55 PolarHBondContact OG1-O 3.19Å
44	R	86.3	Confident	74.1	Confident	194 Å²	194	70.8 Å²	70.8	73%	0.732	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	127.6	-179.9	-164.4	174.4	-175.1	171.6	5.3	109.9	L52 L54	R44-L52 HydrophobicContact CG-CD1 3.94Å; R44-L54 HydrophobicContact CB-CD2 4.32Å; R44-L54 HydrophobicContact CG-CD2 4.39Å
45	L	84.8	Confident	76.8	Confident	65 Å²	65	70.2 Å²	70.2	34%	0.34	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	150.6	176.1	-64.6	178.4	0	0	0	111.1	G47 A53 H55 V64	L45-G47 PolarHBondContact O-N 2.7Å; L45-A53 HydrophobicContact CB-CB 3.89Å; L45-A53 PolarHBondContact N-O 3.25Å; L45-H55 HydrophobicContact CD1-CB 3.96Å; L45-H55 HydrophobicContact CD2-CB 4.05Å; L45-H55 HydrophobicContact CG-CB 3.89Å; L45-V64 HydrophobicContact CD1-CG1 3.78Å; L45-V64 HydrophobicContact CD1-CG2 4.08Å
46	P	69.6	Low	79	Confident	134 Å²	134	63.8 Å²	63.8	87%	0.87	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-68.2	122.6	172.5	26.6	-30.8	0	0	0	110.1
47	G	58.2	Low	80.3	Confident	54 Å²	54	65.9 Å²	65.9	56%	0.557	41%	0.406	S	S	*	.			trans	-131.6	168.6	-176.4	0	0	0	0	0	113.6	L45	L45-G47 PolarHBondContact O-N 2.7Å
48	S	59.5	Low	80.7	Confident	80 Å²	80	63.2 Å²	63.2	56%	0.559	39%	0.388	S	S	*	.	S	Bend	trans	-60	151.1	172.4	24.4	0	0	0	0	111.9	G50 E51	S48-G50 PolarHBondContact O-N 3.32Å; S48-E51 PolarHBondContact O-N 2.99Å; S48-E51 PolarHBondContact OG-OE2 3.21Å
49	A	51.4	Low	80.7	Confident	117 Å²	117	61 Å²	61	97%	0.967	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	109.3	-177.3	0	0	0	0	0	111.5
50	G	58.9	Low	80.2	Confident	67 Å²	67	60.1 Å²	60.1	69%	0.691	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.2	-14.9	176.1	0	0	0	0	0	115.6	S48	S48-G50 PolarHBondContact O-N 3.32Å
51	E	68.6	Low	79.9	Confident	110 Å²	110	64.5 Å²	64.5	51%	0.514	41%	0.413	S	S	.	.			trans	-106.8	139.3	179.2	-72.1	178.8	159.8	0	0	111.7	S48	S48-E51 PolarHBondContact O-N 2.99Å; S48-E51 PolarHBondContact OG-OE2 3.21Å
52	L	81.4	Confident	79.8	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.052	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.6	172.8	177.2	67.9	0	0	0	109.7	R44 L54 L67 F101 L117	R44-L52 HydrophobicContact CG-CD1 3.94Å; L52-L54 HydrophobicContact CD1-CD2 4.14Å; L52-L54 HydrophobicContact CD1-CG 4.46Å; L52-L54 HydrophobicContact CD2-CD1 4.21Å; L52-L54 HydrophobicContact CD2-CG 4.24Å; L52-L54 HydrophobicContact CG-CD2 4.35Å; L52-L54 HydrophobicContact CG-CG 4.14Å; L52-L67 HydrophobicContact CB-CB 4.21Å; L52-L67 HydrophobicContact CD2-CD1 4.33Å; L52-L67 PolarHBondContact N-O 3.08Å; L52-L67 WeakPolarHBondContact O-CA 3.5Å; L52-L67 VanDerWaalsContact O-CB 3.29Å; L52-L67 WeakPolarHBondContact O-CB 3.48Å; L52-L67 PolarHBondContact O-N 2.9Å; L52-F101 HydrophobicContact CB-CD1 4.27Å; L52-F101 HydrophobicContact CB-CE1 3.95Å; L52-F101 HydrophobicContact CD2-CD1 4.18Å; L52-F101 HydrophobicContact CD2-CE1 3.9Å; L52-F101 HydrophobicContact CD2-CE2 4.34Å; L52-F101 HydrophobicContact CD2-CZ 4.01Å; L52-L117 HydrophobicContact CD2-CD1 3.15Å
53	A	87.5	Confident	79.9	Confident	16 Å²	16	62.2 Å²	62.2	13%	0.132	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.4	172.7	0	0	0	0	0	110.7	L45 L65	L45-A53 HydrophobicContact CB-CB 3.89Å; L45-A53 PolarHBondContact N-O 3.25Å; A53-L65 CarbonylContact C-O 3.56Å; A53-L65 VanDerWaalsContact CA-O 3.26Å; A53-L65 WeakPolarHBondContact CA-O 3.34Å
54	L	90.7	Very high	80.1	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.8	176.1	-62	176.6	0	0	0	110.4	R44 L52 V64 L65 L67 L117 L121 L143	R44-L54 HydrophobicContact CB-CD2 4.32Å; R44-L54 HydrophobicContact CG-CD2 4.39Å; L52-L54 HydrophobicContact CD1-CD2 4.14Å; L52-L54 HydrophobicContact CD1-CG 4.46Å; L52-L54 HydrophobicContact CD2-CD1 4.21Å; L52-L54 HydrophobicContact CD2-CG 4.24Å; L52-L54 HydrophobicContact CG-CD2 4.35Å; L52-L54 HydrophobicContact CG-CG 4.14Å; L54-V64 CarbonylContact O-C 3.58Å; L54-V64 WeakPolarHBondContact O-CA 3.46Å; L54-L65 HydrophobicContact CB-CB 4.26Å; L54-L65 HydrophobicContact CB-CD1 4.32Å; L54-L65 PolarHBondContact N-O 3.42Å; L54-L65 PolarHBondContact O-N 2.82Å; L54-L67 HydrophobicContact CD1-CD1 3.87Å; L54-L67 HydrophobicContact CG-CD1 4.29Å; L54-L117 HydrophobicContact CD1-CD2 4.1Å; L54-L121 HydrophobicContact CD1-CD1 3.88Å; L54-L121 HydrophobicContact CD1-CD2 4.07Å; L54-L143 HydrophobicContact CD1-CD2 3.93Å; L54-L143 HydrophobicContact CD2-CD2 3.94Å
55	H	92	Very high	80.2	Confident	49 Å²	49	51.3 Å²	51.3	23%	0.227	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.9	175	179.1	-112.1	0	0	0	110.9	T43 L45 S57 F63	T43-H55 PolarHBondContact N-O 2.95Å; T43-H55 PolarHBondContact O-N 3.09Å; T43-H55 PolarHBondContact OG1-O 3.19Å; L45-H55 HydrophobicContact CD1-CB 3.96Å; L45-H55 HydrophobicContact CD2-CB 4.05Å; L45-H55 HydrophobicContact CG-CB 3.89Å; H55-S57 PolarHBondContact CE1-OG 2.92Å; H55-F63 CarbonylContact C-O 3.55Å; H55-F63 VanDerWaalsContact CA-O 3.3Å; H55-F63 WeakPolarHBondContact CA-O 3.2Å
56	L	92.9	Very high	80.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136	173.1	-50.9	176.2	0	0	0	108.9	V40 P42 G62 F63 L65 L121 F125 I134 L149	V40-L56 HydrophobicContact CG2-CD2 4.16Å; P42-L56 HydrophobicContact CB-CD2 3.69Å; P42-L56 HydrophobicContact CG-CD2 3.67Å; L56-G62 WeakPolarHBondContact O-CA 3.5Å; L56-F63 HydrophobicContact CB-CB 4.24Å; L56-F63 HydrophobicContact CB-CD2 4.32Å; L56-F63 PolarHBondContact N-O 3.05Å; L56-F63 PolarHBondContact O-N 3.32Å; L56-L65 HydrophobicContact CD1-CD1 3.57Å; L56-L65 HydrophobicContact CG-CD1 3.98Å; L56-L121 HydrophobicContact CD2-CD2 3.93Å; L56-F125 HydrophobicContact CD1-CE1 3.67Å; L56-F125 HydrophobicContact CD1-CZ 4.02Å; L56-I134 HydrophobicContact CD1-CD1 3.72Å; L56-I134 HydrophobicContact CD2-CD1 3.86Å; L56-I134 HydrophobicContact CG-CD1 4.47Å; L56-L149 HydrophobicContact CD1-CD1 4.35Å
57	S	90.8	Very high	80.5	Confident	76 Å²	76	48.2 Å²	48.2	53%	0.531	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	112.2	172.4	-61.7	0	0	0	0	109.4	V40 H55	V40-S57 WeakPolarHBondContact CG1-O 3.45Å; H55-S57 PolarHBondContact CE1-OG 2.92Å
58	A	88.4	Confident	81.3	Confident	4 Å²	4	47.9 Å²	47.9	3%	0.033	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	154.8	178.9	0	0	0	0	0	111	E38 V40 G60 K61 F63 L149	E38-A58 HydrophobicContact CB-CB 4.22Å; E38-A58 VanDerWaalsContact OE2-CA 3.26Å; E38-A58 WeakPolarHBondContact OE2-CA 3.37Å; V40-A58 HydrophobicContact CG1-CB 3.4Å; V40-A58 VanDerWaalsContact CG1-CB 3.4Å; A58-G60 PolarHBondContact O-N 2.97Å; A58-G60 VanDerWaalsContact O-N 3.15Å; A58-K61 PolarHBondContact N-O 2.75Å; A58-K61 VanDerWaalsContact N-O 3.12Å; A58-K61 PolarHBondContact O-N 3.29Å; A58-F63 HydrophobicContact CB-CE2 4.49Å; A58-L149 HydrophobicContact CB-CD2 3.6Å
59	F	87.1	Confident	81.8	Confident	37 Å²	37	47.6 Å²	47.6	16%	0.162	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	29.8	177.9	-45	-63.1	0	0	0	113.3	A36 E38 K61 F132 L149 R151	A36-F59 HydrophobicContact CB-CD1 4.04Å; A36-F59 HydrophobicContact CB-CE1 3.66Å; A36-F59 HydrophobicContact CB-CZ 4.49Å; A36-F59 WeakPolarHBondContact O-CE1 3.23Å; A36-F59 VanDerWaalsContact O-CZ 3.25Å; A36-F59 WeakPolarHBondContact O-CZ 3.32Å; E38-F59 HydrophobicContact CB-CD1 4.46Å; E38-F59 HydrophobicContact CB-CE1 3.95Å; E38-F59 HydrophobicContact CB-CZ 4.22Å; E38-F59 HydrophobicContact CG-CD1 3.96Å; E38-F59 HydrophobicContact CG-CE1 3.71Å; E38-F59 HydrophobicContact CG-CZ 4.47Å; E38-F59 PolarHBondContact OE2-N 2.77Å; F59-K61 PolarHBondContact O-N 2.83Å; F59-F132 HydrophobicContact CD2-CD1 4.44Å; F59-F132 HydrophobicContact CD2-CE1 4.04Å; F59-F132 HydrophobicContact CE2-CD1 4.21Å; F59-F132 HydrophobicContact CE2-CE1 4.22Å; F59-L149 HydrophobicContact CD2-CD2 4.45Å; F59-L149 HydrophobicContact CE2-CD2 3.9Å; F59-L149 HydrophobicContact CE2-CG 4.11Å; F59-L149 WeakPolarHBondContact CZ-O 3.47Å; F59-R151 HydrophobicContact CD2-CB 4.05Å; F59-R151 HydrophobicContact CE1-CB 4.41Å; F59-R151 HydrophobicContact CE2-CB 3.56Å; F59-R151 HydrophobicContact CZ-CB 3.75Å
60	G	79.1	Confident	82	Confident	90 Å²	90	44.7 Å²	44.7	93%	0.928	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	8.8	-176.2	0	0	0	0	0	115.2	A58	A58-G60 PolarHBondContact O-N 2.97Å; A58-G60 VanDerWaalsContact O-N 3.15Å
61	K	83	Confident	81.8	Confident	95 Å²	95	44 Å²	44	41%	0.413	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	153.7	177.4	-63.4	-178.3	-177.7	178.6	0	111	A58 F59 F63 E130	A58-K61 PolarHBondContact N-O 2.75Å; A58-K61 VanDerWaalsContact N-O 3.12Å; A58-K61 PolarHBondContact O-N 3.29Å; F59-K61 PolarHBondContact O-N 2.83Å; K61-F63 HydrophobicContact CB-CE2 4.14Å; K61-F63 HydrophobicContact CB-CZ 3.98Å; K61-F63 HydrophobicContact CD-CZ 4.37Å; K61-E130 IonicContact NZ-OE2 3.38Å; K61-E130 PolarHBondContact NZ-OE2 3.33Å; K61-E130 VanDerWaalsContact NZ-OE2 3.15Å
62	G	87.7	Confident	80.9	Confident	35 Å²	35	40.4 Å²	40.4	36%	0.361	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.3	167.5	0	0	0	0	0	110	L56	L56-G62 WeakPolarHBondContact O-CA 3.5Å
63	F	91.6	Very high	79.5	Confident	1 Å²	1	43.2 Å²	43.2	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.6	175.1	-52	-88.4	0	0	0	108.9	H55 L56 A58 K61 V105 N106 F125 L127 F132 L149	H55-F63 CarbonylContact C-O 3.55Å; H55-F63 VanDerWaalsContact CA-O 3.3Å; H55-F63 WeakPolarHBondContact CA-O 3.2Å; L56-F63 HydrophobicContact CB-CB 4.24Å; L56-F63 HydrophobicContact CB-CD2 4.32Å; L56-F63 PolarHBondContact N-O 3.05Å; L56-F63 PolarHBondContact O-N 3.32Å; A58-F63 HydrophobicContact CB-CE2 4.49Å; K61-F63 HydrophobicContact CB-CE2 4.14Å; K61-F63 HydrophobicContact CB-CZ 3.98Å; K61-F63 HydrophobicContact CD-CZ 4.37Å; F63-V105 HydrophobicContact CB-CG1 4.28Å; F63-V105 HydrophobicContact CD1-CG1 4.3Å; F63-N106 WeakPolarHBondContact CA-OD1 3.42Å; F63-F125 HydrophobicContact CB-CE2 4.26Å; F63-F125 HydrophobicContact CB-CZ 4.21Å; F63-F125 AromaticContact CD1-CE2 3.61Å; F63-F125 HydrophobicContact CD1-CE2 3.61Å; F63-F125 HydrophobicContact CD1-CZ 4.07Å; F63-F125 HydrophobicContact CD2-CZ 4.41Å; F63-F125 HydrophobicContact CE1-CE2 4.09Å; F63-F125 AromaticContact CG-CE2 3.96Å; F63-F125 HydrophobicContact CG-CE2 3.96Å; F63-F125 AromaticContact CG-CZ 3.98Å; F63-F125 HydrophobicContact CG-CZ 3.98Å; F63-L127 HydrophobicContact CD1-CD2 3.85Å; F63-L127 HydrophobicContact CE1-CD2 3.99Å; F63-F132 HydrophobicContact CE1-CD1 4.37Å; F63-F132 HydrophobicContact CE1-CD2 4.44Å; F63-F132 AromaticContact CE1-CE1 3.83Å; F63-F132 HydrophobicContact CE1-CE1 3.83Å; F63-F132 AromaticContact CE1-CE2 3.93Å; F63-F132 HydrophobicContact CE1-CE2 3.93Å; F63-F132 AromaticContact CE1-CZ 3.61Å; F63-F132 HydrophobicContact CE1-CZ 3.61Å; F63-F132 HydrophobicContact CE2-CE1 4.34Å; F63-F132 HydrophobicContact CZ-CD1 4.08Å; F63-F132 AromaticContact CZ-CE1 3.44Å; F63-F132 HydrophobicContact CZ-CE1 3.44Å; F63-F132 VanDerWaalsContact CZ-CE1 3.44Å; F63-F132 HydrophobicContact CZ-CE2 4.4Å; F63-F132 AromaticContact CZ-CZ 3.66Å; F63-F132 HydrophobicContact CZ-CZ 3.66Å; F63-L149 HydrophobicContact CE2-CD2 4.32Å
64	V	92.7	Very high	77.8	Confident	36 Å²	36	43.6 Å²	43.6	22%	0.218	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	99.8	175.4	179.9	0	0	0	0	108.6	L45 L54 R66 V105 N106	L45-V64 HydrophobicContact CD1-CG1 3.78Å; L45-V64 HydrophobicContact CD1-CG2 4.08Å; L54-V64 CarbonylContact O-C 3.58Å; L54-V64 WeakPolarHBondContact O-CA 3.46Å; V64-R66 HydrophobicContact CG1-CG 4.32Å; V64-R66 PolarHBondContact O-N 3.44Å; V64-V105 CarbonylContact O-C 3.55Å; V64-V105 WeakPolarHBondContact O-CA 3.5Å; V64-N106 PolarHBondContact N-OD1 3.12Å; V64-N106 PolarHBondContact O-N 2.03Å
65	L	87.6	Confident	75.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	112.6	173.3	-66.7	150.8	0	0	0	108.6	A53 L54 L56 L67 V105 A113 L121 F125	A53-L65 CarbonylContact C-O 3.56Å; A53-L65 VanDerWaalsContact CA-O 3.26Å; A53-L65 WeakPolarHBondContact CA-O 3.34Å; L54-L65 HydrophobicContact CB-CB 4.26Å; L54-L65 HydrophobicContact CB-CD1 4.32Å; L54-L65 PolarHBondContact N-O 3.42Å; L54-L65 PolarHBondContact O-N 2.82Å; L56-L65 HydrophobicContact CD1-CD1 3.57Å; L56-L65 HydrophobicContact CG-CD1 3.98Å; L65-L67 HydrophobicContact CB-CD1 3.99Å; L65-L67 HydrophobicContact CB-CD2 4.27Å; L65-L67 HydrophobicContact CB-CG 3.94Å; L65-V105 HydrophobicContact CD2-CG2 4.13Å; L65-A113 HydrophobicContact CD2-CB 3.4Å; L65-A113 VanDerWaalsContact CD2-CB 3.4Å; L65-L121 HydrophobicContact CD1-CD2 4.41Å; L65-F125 HydrophobicContact CD2-CB 3.86Å; L65-F125 HydrophobicContact CD2-CD1 3.82Å; L65-F125 HydrophobicContact CD2-CD2 4.49Å; L65-F125 HydrophobicContact CD2-CE1 4.46Å; L65-F125 HydrophobicContact CD2-CG 3.82Å
66	R	84.4	Confident	74	Confident	134 Å²	134	44.7 Å²	44.7	51%	0.506	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	109.5	171.1	-65.6	-170.9	-179.5	-158.9	3.8	108.4	V64 G103 T104	V64-R66 HydrophobicContact CG1-CG 4.32Å; V64-R66 PolarHBondContact O-N 3.44Å; R66-G103 CarbonylContact O-C 3.49Å; R66-G103 VanDerWaalsContact O-CA 3.26Å; R66-G103 WeakPolarHBondContact O-CA 3.36Å; R66-T104 PolarHBondContact N-O 2.93Å; R66-T104 PolarHBondContact O-N 2.99Å
67	L	76.7	Confident	72.3	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.3	-162.6	-65	173.9	0	0	0	110.7	L52 L54 L65 F101 A113 V115	L52-L67 HydrophobicContact CB-CB 4.21Å; L52-L67 HydrophobicContact CD2-CD1 4.33Å; L52-L67 PolarHBondContact N-O 3.08Å; L52-L67 WeakPolarHBondContact O-CA 3.5Å; L52-L67 VanDerWaalsContact O-CB 3.29Å; L52-L67 WeakPolarHBondContact O-CB 3.48Å; L52-L67 PolarHBondContact O-N 2.9Å; L54-L67 HydrophobicContact CD1-CD1 3.87Å; L54-L67 HydrophobicContact CG-CD1 4.29Å; L65-L67 HydrophobicContact CB-CD1 3.99Å; L65-L67 HydrophobicContact CB-CD2 4.27Å; L65-L67 HydrophobicContact CB-CG 3.94Å; L67-F101 HydrophobicContact CB-CB 3.88Å; L67-F101 HydrophobicContact CB-CD1 3.96Å; L67-F101 HydrophobicContact CB-CG 4.24Å; L67-F101 HydrophobicContact CD1-CB 4.37Å; L67-F101 HydrophobicContact CD2-CB 4.29Å; L67-F101 HydrophobicContact CG-CB 4.4Å; L67-A113 HydrophobicContact CD2-CB 3.79Å; L67-V115 HydrophobicContact CD1-CG2 3.48Å; L67-V115 VanDerWaalsContact CD1-CG2 3.48Å; L67-V115 HydrophobicContact CD2-CG2 3.86Å; L67-V115 HydrophobicContact CG-CG2 4.31Å
68	A	76.1	Confident	70.9	Confident	46 Å²	46	47 Å²	47	38%	0.38	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	144.8	169.6	0	0	0	0	0	109.5	F101 S102	A68-F101 CarbonylContact O-C 3.58Å; A68-F101 WeakPolarHBondContact O-CA 3.36Å; A68-F101 WeakPolarHBondContact O-CB 3.29Å; A68-S102 PolarHBondContact N-O 3.46Å; A68-S102 PolarHBondContact O-N 3.1Å
69	P	68.5	Low	69.6	Low	75 Å²	75	50 Å²	50	49%	0.487	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	138.1	173.9	-21.7	32.2	0	0	0	111.9	F100 F101	P69-F100 CarbonylContact C-O 3.56Å; P69-F100 WeakPolarHBondContact CA-O 3.34Å; P69-F101 HydrophobicContact CB-CE1 4.36Å; P69-F101 HydrophobicContact CG-CD1 4.29Å; P69-F101 HydrophobicContact CG-CE1 3.82Å; P69-F101 HydrophobicContact CG-CZ 4.5Å
70	D	55.8	Low	68.7	Low	55 Å²	55	50.5 Å²	50.5	29%	0.294	29%	0.293	S	S	.	.			trans	-139.8	98.3	-176.1	-169.5	-7.7	0	0	0	111.5	S72 F100 S102	D70-S72 PolarHBondContact OD1-OG 2.94Å; D70-F100 PolarHBondContact N-O 3.42Å; D70-F100 WeakPolarHBondContact O-CB 3.4Å; D70-S102 WeakPolarHBondContact CB-OG 3.17Å; D70-S102 WeakPolarHBondContact OD2-CB 3.3Å; D70-S102 PolarHBondContact OD2-OG 2.89Å
71	D	55.1	Low	68.6	Low	53 Å²	53	50.1 Å²	50.1	28%	0.283	27%	0.267	S	S	.	.			trans	-116.7	22.4	-178.1	69.4	-21.1	0	0	0	113.4	F73 L74 R97	D71-F73 VanDerWaalsContact C-N 3.26Å; D71-F73 PolarHBondContact O-N 3.3Å; D71-F73 VanDerWaalsContact O-N 3.07Å; D71-L74 PolarHBondContact O-N 3.43Å; D71-R97 HydrophobicContact CB-CB 4.03Å; D71-R97 HydrophobicContact CB-CG 4.06Å; D71-R97 WeakPolarHBondContact OD2-CB 3.02Å; D71-R97 WeakPolarHBondContact OD2-CD 3.45Å; D71-R97 WeakPolarHBondContact OD2-CG 3.13Å; D71-R97 IonicContact OD2-CZ 2.98Å; D71-R97 IonicContact OD2-NE 3.68Å; D71-R97 IonicContact OD2-NH1 3.32Å; D71-R97 PolarHBondContact OD2-NH1 2.85Å
72	S	49.5	Very low	68.4	Low	35 Å²	35	51.1 Å²	51.1	25%	0.245	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.1	-164.4	73.2	0	0	0	0	116.2	D70 L432	D70-S72 PolarHBondContact OD1-OG 2.94Å; S72-L432 WeakPolarHBondContact O-CB 3.11Å
73	F	51.8	Low	68.2	Low	68 Å²	68	50.1 Å²	50.1	30%	0.298	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-0.4	-172	62.9	-82.3	0	0	0	114.1	D71 F100 L243	D71-F73 VanDerWaalsContact C-N 3.26Å; D71-F73 PolarHBondContact O-N 3.3Å; D71-F73 VanDerWaalsContact O-N 3.07Å; F73-F100 HydrophobicContact CE1-CD2 4.39Å; F73-F100 HydrophobicContact CZ-CD2 4.28Å; F73-F100 HydrophobicContact CZ-CE2 4.16Å; F73-F100 HydrophobicContact CZ-CZ 4.43Å; F73-L243 HydrophobicContact CE2-CD1 4.47Å
74	L	53.3	Low	67.2	Low	25 Å²	25	51.4 Å²	51.4	13%	0.131	27%	0.268	C	S	.	.	S	Bend	trans	-107.7	133.4	-176.7	-61.6	-176.7	0	0	0	109.5	D71 F78	D71-L74 PolarHBondContact O-N 3.43Å; L74-F78 HydrophobicContact CB-CB 3.73Å; L74-F78 HydrophobicContact CB-CD1 4.1Å; L74-F78 HydrophobicContact CB-CG 3.97Å; L74-F78 HydrophobicContact CD1-CD1 3.76Å; L74-F78 HydrophobicContact CD1-CE1 4.15Å; L74-F78 HydrophobicContact CD1-CG 4.48Å; L74-F78 HydrophobicContact CD2-CB 4.37Å; L74-F78 HydrophobicContact CD2-CD1 3.37Å; L74-F78 HydrophobicContact CD2-CD2 3.98Å; L74-F78 HydrophobicContact CD2-CE1 3.36Å; L74-F78 HydrophobicContact CD2-CE2 4.01Å; L74-F78 HydrophobicContact CD2-CG 3.65Å; L74-F78 HydrophobicContact CD2-CZ 3.71Å; L74-F78 HydrophobicContact CG-CB 4.49Å; L74-F78 HydrophobicContact CG-CD1 3.93Å; L74-F78 HydrophobicContact CG-CE1 4.3Å; L74-F78 HydrophobicContact CG-CG 4.23Å
75	A	50.3	Low	65.9	Low	12 Å²	12	51.3 Å²	51.3	10%	0.099	28%	0.275	C	S	.	.			trans	-47.6	147.5	168.7	0	0	0	0	0	110.1	E77 F78 R97	A75-E77 PolarHBondContact O-N 2.99Å; A75-F78 HydrophobicContact CB-CB 4.18Å; A75-F78 VanDerWaalsContact O-CB 3.32Å; A75-F78 WeakPolarHBondContact O-CB 3.02Å; A75-F78 PolarHBondContact O-N 3.26Å; A75-R97 PolarHBondContact O-NH2 2.79Å
76	P	51.2	Low	63.8	Low	60 Å²	60	58.1 Å²	58.1	39%	0.39	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-24.5	179.9	-30.6	37.3	0	0	0	114.3	R97 A429 A430	P76-R97 PolarHBondContact O-NH2 3.45Å; P76-A429 HydrophobicContact CG-CB 4.26Å; P76-A430 HydrophobicContact CG-CB 3.88Å
77	E	58.2	Low	61.9	Low	96 Å²	96	54.4 Å²	54.4	45%	0.449	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	28.6	174.5	-59.3	-170.6	-170.1	0	0	113.6	A75 K79 P307	A75-E77 PolarHBondContact O-N 2.99Å; E77-K79 WeakPolarHBondContact O-CG 3.29Å; E77-K79 PolarHBondContact O-N 2.87Å; E77-P307 HydrophobicContact CB-CB 3.96Å; E77-P307 HydrophobicContact CG-CB 3.95Å; E77-P307 HydrophobicContact CG-CG 4.41Å; E77-P307 WeakPolarHBondContact OE2-CB 3.32Å
78	F	61.1	Low	60.2	Low	30 Å²	30	65.4 Å²	65.4	13%	0.132	37%	0.367	C	S	.	.			trans	-53.2	133.2	-179.6	173.9	-101.5	0	0	0	113	L74 A75 I80 V266 V269	L74-F78 HydrophobicContact CB-CB 3.73Å; L74-F78 HydrophobicContact CB-CD1 4.1Å; L74-F78 HydrophobicContact CB-CG 3.97Å; L74-F78 HydrophobicContact CD1-CD1 3.76Å; L74-F78 HydrophobicContact CD1-CE1 4.15Å; L74-F78 HydrophobicContact CD1-CG 4.48Å; L74-F78 HydrophobicContact CD2-CB 4.37Å; L74-F78 HydrophobicContact CD2-CD1 3.37Å; L74-F78 HydrophobicContact CD2-CD2 3.98Å; L74-F78 HydrophobicContact CD2-CE1 3.36Å; L74-F78 HydrophobicContact CD2-CE2 4.01Å; L74-F78 HydrophobicContact CD2-CG 3.65Å; L74-F78 HydrophobicContact CD2-CZ 3.71Å; L74-F78 HydrophobicContact CG-CB 4.49Å; L74-F78 HydrophobicContact CG-CD1 3.93Å; L74-F78 HydrophobicContact CG-CE1 4.3Å; L74-F78 HydrophobicContact CG-CG 4.23Å; A75-F78 HydrophobicContact CB-CB 4.18Å; A75-F78 VanDerWaalsContact O-CB 3.32Å; A75-F78 WeakPolarHBondContact O-CB 3.02Å; A75-F78 PolarHBondContact O-N 3.26Å; F78-I80 HydrophobicContact CD1-CG1 4.38Å; F78-I80 HydrophobicContact CE1-CD1 3.6Å; F78-I80 HydrophobicContact CE1-CG1 3.35Å; F78-I80 HydrophobicContact CE2-CG1 4.49Å; F78-I80 HydrophobicContact CZ-CD1 3.8Å; F78-I80 HydrophobicContact CZ-CG1 3.41Å; F78-I80 VanDerWaalsContact CZ-CG1 3.41Å; F78-V266 HydrophobicContact CE2-CG1 4.13Å; F78-V269 HydrophobicContact CE2-CG2 3.91Å; F78-V269 HydrophobicContact CZ-CG2 4.01Å
79	K	61.7	Low	58.5	Low	66 Å²	66	67.9 Å²	67.9	29%	0.287	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.7	179.3	-70.5	178.2	-175.8	-179.3	0	111.2	E77 V269 E308	E77-K79 WeakPolarHBondContact O-CG 3.29Å; E77-K79 PolarHBondContact O-N 2.87Å; K79-V269 PolarHBondContact O-N 2.04Å; K79-V269 VanDerWaalsContact O-N 3.09Å; K79-E308 WeakPolarHBondContact CD-OE1 3.47Å; K79-E308 VanDerWaalsContact CE-OE1 3.26Å; K79-E308 WeakPolarHBondContact CE-OE1 3.07Å; K79-E308 IonicContact NZ-OE1 2.65Å; K79-E308 PolarHBondContact NZ-OE1 3.29Å
80	I	67.6	Low	57.1	Low	47 Å²	47	70.3 Å²	70.3	24%	0.241	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	121.7	163.4	-59.4	173	0	0	0	106.5	F78 Q239 V269 I271	F78-I80 HydrophobicContact CD1-CG1 4.38Å; F78-I80 HydrophobicContact CE1-CD1 3.6Å; F78-I80 HydrophobicContact CE1-CG1 3.35Å; F78-I80 HydrophobicContact CE2-CG1 4.49Å; F78-I80 HydrophobicContact CZ-CD1 3.8Å; F78-I80 HydrophobicContact CZ-CG1 3.41Å; F78-I80 VanDerWaalsContact CZ-CG1 3.41Å; I80-Q239 HydrophobicContact CD1-CG 4.04Å; I80-Q239 VanDerWaalsContact CD1-NE2 3.27Å; I80-V269 WeakPolarHBondContact CA-O 3.47Å; I80-V269 HydrophobicContact CG1-CB 4.31Å; I80-I271 HydrophobicContact CG2-CD1 4.37Å
81	E	76.2	Confident	56.4	Low	83 Å²	83	71.2 Å²	71.2	39%	0.388	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.1	177.9	-172	178.6	169.9	0	0	109.4	L83 V269 L270 I271	E81-L83 HydrophobicContact CG-CD2 4.1Å; E81-V269 PolarHBondContact N-O 3.25Å; E81-L270 HydrophobicContact CB-CD2 3.65Å; E81-L270 HydrophobicContact CG-CD2 4.4Å; E81-L270 WeakPolarHBondContact O-CA 3.27Å; E81-I271 PolarHBondContact O-N 3.32Å
82	R	79.1	Confident	55.9	Low	115 Å²	115	70.3 Å²	70.3	43%	0.434	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.9	176.4	-70.2	-178.2	173.7	-121.6	-3.2	109.2	I271 E273	R82-I271 CarbonylContact C-O 3.28Å; R82-I271 WeakPolarHBondContact CA-O 3.23Å; R82-I271 HydrophobicContact CG-CB 4.27Å; R82-E273 WeakPolarHBondContact CD-OE1 3.16Å; R82-E273 IonicContact CZ-OE1 2.8Å; R82-E273 IonicContact NE-OE1 3.69Å; R82-E273 IonicContact NH1-OE1 3.58Å; R82-E273 PolarHBondContact NH1-OE1 3.32Å
83	L	82.9	Confident	55.8	Low	15 Å²	15	75.3 Å²	75.3	8%	0.079	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.9	-177.3	-58.4	179.1	0	0	0	110.4	E81 I271 V272 E273 W277 W295 F299	E81-L83 HydrophobicContact CG-CD2 4.1Å; L83-I271 PolarHBondContact N-O 3.11Å; L83-V272 HydrophobicContact CD1-CG2 4.38Å; L83-E273 PolarHBondContact O-N 2.9Å; L83-W277 HydrophobicContact CB-CB 3.97Å; L83-W295 HydrophobicContact CD1-CH2 3.93Å; L83-W295 HydrophobicContact CD1-CZ2 3.71Å; L83-F299 HydrophobicContact CD1-CE1 4.37Å; L83-F299 HydrophobicContact CD1-CZ 4Å
84	G	71.4	Confident	55.3	Low	27 Å²	27	83.9 Å²	83.9	28%	0.278	47%	0.47	S	S	.	.	S	Bend	trans	93	-2	170.8	0	0	0	0	0	118
85	G	64.6	Low	55	Low	35 Å²	35	84.7 Å²	84.7	36%	0.361	49%	0.485	S	S	.	.			trans	-74.4	148	177.5	0	0	0	0	0	115.5	G87 E273	G85-G87 PolarHBondContact O-N 3Å; G85-E273 WeakPolarHBondContact CA-OE2 3.47Å; G85-E273 PolarHBondContact N-OE2 2.78Å
86	S	45.3	Very low	55.1	Low	142 Å²	142	87.3 Å²	87.3	99%	0.993	50%	0.496	S	S	*	.	S	Bend	trans	-77.1	57.9	173.7	56.4	0	0	0	0	112.1
87	G	42.5	Very low	55.4	Low	56 Å²	56	88.6 Å²	88.6	58%	0.577	49%	0.494	S	S	*	.			trans	-173.1	109.5	179.1	0	0	0	0	0	111.6	G85 S89	G85-G87 PolarHBondContact O-N 3Å; G87-S89 VanDerWaalsContact C-N 3.29Å; G87-S89 PolarHBondContact O-N 2.66Å
88	R	41.5	Very low	55.2	Low	233 Å²	233	86.1 Å²	86.1	88%	0.879	49%	0.494	S	S	*	.			trans	-66.5	91.2	166.4	-163.7	176.3	-179.7	-179.6	0.1	107.7	T90	R88-T90 HydrophobicContact CG-CG2 4.22Å; R88-T90 PolarHBondContact O-N 2.81Å
89	S	40	Very low	55.6	Low	97 Å²	97	86 Å²	86	68%	0.678	50%	0.497	S	S	*	.			trans	-93.8	68.5	170.3	69.2	0	0	0	0	110.2	G87 G91	G87-S89 VanDerWaalsContact C-N 3.29Å; G87-S89 PolarHBondContact O-N 2.66Å; S89-G91 PolarHBondContact O-N 3.15Å
90	T	40.3	Very low	55.7	Low	126 Å²	126	85.4 Å²	85.4	77%	0.773	49%	0.494	S	S	*	.			trans	-71.9	47.4	161	46.7	0	0	0	0	110.9	R88	R88-T90 HydrophobicContact CG-CG2 4.22Å; R88-T90 PolarHBondContact O-N 2.81Å
91	G	41.6	Very low	56	Low	74 Å²	74	84.3 Å²	84.3	76%	0.763	49%	0.488	S	S	*	.			trans	-153.9	23.8	-164.4	0	0	0	0	0	116.8	S89	S89-G91 PolarHBondContact O-N 3.15Å
92	G	43.3	Very low	56	Low	34 Å²	34	82.3 Å²	82.3	35%	0.351	48%	0.483	S	S	.	.	S	Bend	trans	-113.4	-19.1	174.8	0	0	0	0	0	115.4	R94 G95	G92-R94 PolarHBondContact O-N 2.84Å; G92-G95 PolarHBondContact O-N 3.31Å
93	E	47.6	Very low	56.1	Low	141 Å²	141	78 Å²	78	66%	0.659	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-24	-161.7	-70.8	-177.1	144.2	0	0	115.4
94	R	41.2	Very low	55.9	Low	248 Å²	248	79.2 Å²	79.2	94%	0.936	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-5.7	177.4	-73.7	-172.9	-175.4	-152.3	0.1	114.8	G92	G92-R94 PolarHBondContact O-N 2.84Å
95	G	47.9	Very low	56.4	Low	42 Å²	42	78 Å²	78	43%	0.433	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-28	-175.8	0	0	0	0	0	114.4	G92 C99	G92-G95 PolarHBondContact O-N 3.31Å; G95-C99 PolarHBondContact O-SG 2.96Å
96	L	52.8	Low	57.5	Low	66 Å²	66	79.3 Å²	79.3	35%	0.346	47%	0.468	S	S	.	.	S	Bend	trans	-76.4	-41.6	-169.5	-68.8	165.9	0	0	0	113.3	G98 C99 F100	L96-G98 VanDerWaalsContact C-N 3.31Å; L96-G98 PolarHBondContact O-N 3.43Å; L96-C99 PolarHBondContact O-N 3.44Å; L96-F100 HydrophobicContact CB-CE2 4.37Å; L96-F100 WeakPolarHBondContact O-CD2 3.44Å; L96-F100 WeakPolarHBondContact O-CE2 2.72Å
97	R	55.8	Low	58.7	Low	87 Å²	87	74.3 Å²	74.3	33%	0.328	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-60.1	-38	178.2	-69.5	179.5	175	-97.9	-4.6	113.2	D71 A75 P76 C99	D71-R97 HydrophobicContact CB-CB 4.03Å; D71-R97 HydrophobicContact CB-CG 4.06Å; D71-R97 WeakPolarHBondContact OD2-CB 3.02Å; D71-R97 WeakPolarHBondContact OD2-CD 3.45Å; D71-R97 WeakPolarHBondContact OD2-CG 3.13Å; D71-R97 IonicContact OD2-CZ 2.98Å; D71-R97 IonicContact OD2-NE 3.68Å; D71-R97 IonicContact OD2-NH1 3.32Å; D71-R97 PolarHBondContact OD2-NH1 2.85Å; A75-R97 PolarHBondContact O-NH2 2.79Å; P76-R97 PolarHBondContact O-NH2 3.45Å; R97-C99 VanDerWaalsContact C-N 3.27Å; R97-C99 PolarHBondContact O-N 2.81Å
98	G	54.6	Low	60	Low	45 Å²	45	76.6 Å²	76.6	46%	0.464	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-84.3	6.3	-179.4	0	0	0	0	0	114.8	L96 F101	L96-G98 VanDerWaalsContact C-N 3.31Å; L96-G98 PolarHBondContact O-N 3.43Å; G98-F101 WeakPolarHBondContact O-CE2 3.05Å; G98-F101 VanDerWaalsContact O-CZ 3.27Å; G98-F101 WeakPolarHBondContact O-CZ 3.3Å
99	C	68.8	Low	61.1	Low	27 Å²	27	70.5 Å²	70.5	18%	0.182	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-115.3	-10.8	-175.4	-73.9	0	0	0	0	114	G95 L96 R97 F101 S116 L117 C118	G95-C99 PolarHBondContact O-SG 2.96Å; L96-C99 PolarHBondContact O-N 3.44Å; R97-C99 VanDerWaalsContact C-N 3.27Å; R97-C99 PolarHBondContact O-N 2.81Å; C99-F101 WeakPolarHBondContact O-CD2 3.25Å; C99-S116 CarbonylContact O-C 3.59Å; C99-S116 VanDerWaalsContact O-CA 3.26Å; C99-S116 WeakPolarHBondContact O-CA 3.02Å; C99-L117 PolarHBondContact O-N 3.03Å; C99-C118 HydrophobicContact CB-CB 4.09Å; C99-C118 WeakPolarHBondContact CB-SG 3.34Å
100	F	64.1	Low	61.8	Low	53 Å²	53	74.1 Å²	74.1	23%	0.232	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	133.1	171.9	-62.4	-72.2	0	0	0	108.6	P69 D70 F73 L96	P69-F100 CarbonylContact C-O 3.56Å; P69-F100 WeakPolarHBondContact CA-O 3.34Å; D70-F100 PolarHBondContact N-O 3.42Å; D70-F100 WeakPolarHBondContact O-CB 3.4Å; F73-F100 HydrophobicContact CE1-CD2 4.39Å; F73-F100 HydrophobicContact CZ-CD2 4.28Å; F73-F100 HydrophobicContact CZ-CE2 4.16Å; F73-F100 HydrophobicContact CZ-CZ 4.43Å; L96-F100 HydrophobicContact CB-CE2 4.37Å; L96-F100 WeakPolarHBondContact O-CD2 3.44Å; L96-F100 WeakPolarHBondContact O-CE2 2.72Å
101	F	74.9	Confident	63.1	Low	24 Å²	24	68.3 Å²	68.3	11%	0.105	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138.5	-177.8	-66.3	-101.4	0	0	0	110.4	L52 L67 A68 P69 G98 C99 V115 L117	L52-F101 HydrophobicContact CB-CD1 4.27Å; L52-F101 HydrophobicContact CB-CE1 3.95Å; L52-F101 HydrophobicContact CD2-CD1 4.18Å; L52-F101 HydrophobicContact CD2-CE1 3.9Å; L52-F101 HydrophobicContact CD2-CE2 4.34Å; L52-F101 HydrophobicContact CD2-CZ 4.01Å; L67-F101 HydrophobicContact CB-CB 3.88Å; L67-F101 HydrophobicContact CB-CD1 3.96Å; L67-F101 HydrophobicContact CB-CG 4.24Å; L67-F101 HydrophobicContact CD1-CB 4.37Å; L67-F101 HydrophobicContact CD2-CB 4.29Å; L67-F101 HydrophobicContact CG-CB 4.4Å; A68-F101 CarbonylContact O-C 3.58Å; A68-F101 WeakPolarHBondContact O-CA 3.36Å; A68-F101 WeakPolarHBondContact O-CB 3.29Å; P69-F101 HydrophobicContact CB-CE1 4.36Å; P69-F101 HydrophobicContact CG-CD1 4.29Å; P69-F101 HydrophobicContact CG-CE1 3.82Å; P69-F101 HydrophobicContact CG-CZ 4.5Å; G98-F101 WeakPolarHBondContact O-CE2 3.05Å; G98-F101 VanDerWaalsContact O-CZ 3.27Å; G98-F101 WeakPolarHBondContact O-CZ 3.3Å; C99-F101 WeakPolarHBondContact O-CD2 3.25Å; F101-V115 HydrophobicContact CB-CG2 4.13Å; F101-V115 PolarHBondContact N-O 3.3Å; F101-V115 PolarHBondContact O-N 3.47Å; F101-L117 HydrophobicContact CD2-CD1 3.7Å; F101-L117 HydrophobicContact CD2-CG 3.95Å; F101-L117 HydrophobicContact CE2-CB 4.28Å; F101-L117 HydrophobicContact CE2-CD1 3.42Å; F101-L117 VanDerWaalsContact CE2-CD1 3.42Å; F101-L117 HydrophobicContact CE2-CG 3.97Å; F101-L117 HydrophobicContact CZ-CD1 4.06Å
102	S	75	Confident	63.9	Low	42 Å²	42	70.2 Å²	70.2	29%	0.294	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	159.7	166.9	62.1	0	0	0	0	110.5	A68 D70 A113	A68-S102 PolarHBondContact N-O 3.46Å; A68-S102 PolarHBondContact O-N 3.1Å; D70-S102 WeakPolarHBondContact CB-OG 3.17Å; D70-S102 WeakPolarHBondContact OD2-CB 3.3Å; D70-S102 PolarHBondContact OD2-OG 2.89Å; S102-A113 CarbonylContact C-O 2.92Å; S102-A113 WeakPolarHBondContact CA-O 3.46Å
103	G	81.4	Confident	65.3	Low	23 Å²	23	68.8 Å²	68.8	24%	0.237	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.3	-152.8	177.5	0	0	0	0	0	114	R66 L112 A113	R66-G103 CarbonylContact O-C 3.49Å; R66-G103 VanDerWaalsContact O-CA 3.26Å; R66-G103 WeakPolarHBondContact O-CA 3.36Å; G103-L112 CarbonylContact O-C 3.59Å; G103-L112 WeakPolarHBondContact O-CA 3.29Å; G103-A113 PolarHBondContact N-O 2.98Å; G103-A113 PolarHBondContact O-N 3.27Å
104	T	78.6	Confident	66.2	Low	42 Å²	42	64.9 Å²	64.9	26%	0.258	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	159.5	-172.1	56.3	0	0	0	0	111.5	R66	R66-T104 PolarHBondContact N-O 2.93Å; R66-T104 PolarHBondContact O-N 2.99Å
105	V	83.7	Confident	67.6	Low	0 Å²	0	53.3 Å²	53.3	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.8	177.2	-167.2	0	0	0	0	108.6	F63 V64 L65 G107 E108 S111 A113 F125 L127	F63-V105 HydrophobicContact CB-CG1 4.28Å; F63-V105 HydrophobicContact CD1-CG1 4.3Å; V64-V105 CarbonylContact O-C 3.55Å; V64-V105 WeakPolarHBondContact O-CA 3.5Å; L65-V105 HydrophobicContact CD2-CG2 4.13Å; V105-G107 PolarHBondContact O-N 2.83Å; V105-E108 PolarHBondContact O-N 2.94Å; V105-E108 VanDerWaalsContact O-N 3.13Å; V105-S111 WeakPolarHBondContact CA-OG 3.42Å; V105-S111 PolarHBondContact N-OG 3.02Å; V105-S111 PolarHBondContact O-OG 3.43Å; V105-A113 HydrophobicContact CG2-CB 4.14Å; V105-F125 HydrophobicContact CB-CD2 4.47Å; V105-F125 HydrophobicContact CG1-CD2 4Å; V105-F125 HydrophobicContact CG1-CE2 4.19Å; V105-F125 HydrophobicContact CG2-CB 3.7Å; V105-F125 HydrophobicContact CG2-CD2 3.65Å; V105-F125 HydrophobicContact CG2-CG 3.99Å; V105-L127 HydrophobicContact CB-CB 4.33Å; V105-L127 HydrophobicContact CB-CD1 4.21Å; V105-L127 HydrophobicContact CG1-CB 4.2Å; V105-L127 HydrophobicContact CG1-CD1 4.33Å; V105-L127 HydrophobicContact CG1-CD2 3.98Å; V105-L127 HydrophobicContact CG1-CG 4.4Å
106	N	87.4	Confident	68.8	Low	64 Å²	64	52.2 Å²	52.2	34%	0.342	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	10	-178.8	-62.7	-18.4	0	0	0	115.6	F63 V64 E108 L127	F63-N106 WeakPolarHBondContact CA-OD1 3.42Å; V64-N106 PolarHBondContact N-OD1 3.12Å; V64-N106 PolarHBondContact O-N 2.03Å; N106-E108 VanDerWaalsContact C-N 3.33Å; N106-L127 VanDerWaalsContact ND2-CD2 3.32Å; N106-L127 WeakPolarHBondContact ND2-CD2 3.33Å
107	G	70.7	Confident	69.6	Low	36 Å²	36	50.3 Å²	50.3	37%	0.371	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	11.6	-176.5	0	0	0	0	0	114.1	V105	V105-G107 PolarHBondContact O-N 2.83Å
108	E	69.8	Low	69.9	Low	105 Å²	105	48.4 Å²	48.4	49%	0.491	30%	0.296	S	S	.	.			trans	-79.6	124.4	177.2	-64.4	-64	161.2	0	0	110.3	V105 N106 E110 S111 L127	V105-E108 PolarHBondContact O-N 2.94Å; V105-E108 VanDerWaalsContact O-N 3.13Å; N106-E108 VanDerWaalsContact C-N 3.33Å; E108-E110 VanDerWaalsContact C-N 3.26Å; E108-E110 PolarHBondContact O-N 3.25Å; E108-S111 WeakPolarHBondContact O-CB 3.35Å; E108-S111 PolarHBondContact O-N 2.97Å; E108-S111 VanDerWaalsContact O-N 3.14Å; E108-S111 PolarHBondContact O-OG 2.8Å; E108-L127 HydrophobicContact CG-CD1 4.26Å
109	P	63.4	Low	70.3	Confident	104 Å²	104	55.4 Å²	55.4	68%	0.675	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.7	-176.4	-23.2	32.5	0	0	0	114.5	S111	P109-S111 VanDerWaalsContact C-N 3.31Å
110	E	55.5	Low	70.3	Confident	174 Å²	174	54.1 Å²	54.1	81%	0.813	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-1.8	-178.3	-58.4	-57.9	139.7	0	0	113	E108	E108-E110 VanDerWaalsContact C-N 3.26Å; E108-E110 PolarHBondContact O-N 3.25Å
111	S	66.7	Low	71	Confident	4 Å²	4	51.6 Å²	51.6	3%	0.028	29%	0.289	C	S	.	.			trans	-91.4	144.7	175.5	71.4	0	0	0	0	110.4	V105 E108 P109 L126	V105-S111 WeakPolarHBondContact CA-OG 3.42Å; V105-S111 PolarHBondContact N-OG 3.02Å; V105-S111 PolarHBondContact O-OG 3.43Å; E108-S111 WeakPolarHBondContact O-CB 3.35Å; E108-S111 PolarHBondContact O-N 2.97Å; E108-S111 VanDerWaalsContact O-N 3.14Å; E108-S111 PolarHBondContact O-OG 2.8Å; P109-S111 VanDerWaalsContact C-N 3.31Å; S111-L126 WeakPolarHBondContact CA-O 3.49Å; S111-L126 VanDerWaalsContact CB-O 3.28Å; S111-L126 WeakPolarHBondContact CB-O 3.46Å
112	L	58.3	Low	70.6	Confident	114 Å²	114	52.5 Å²	52.5	60%	0.597	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	139.3	-175.3	-72.3	166.6	0	0	0	109.7	G103 F125 L126	G103-L112 CarbonylContact O-C 3.59Å; G103-L112 WeakPolarHBondContact O-CA 3.29Å; L112-F125 CarbonylContact O-C 3.29Å; L112-F125 WeakPolarHBondContact O-CA 3.39Å; L112-F125 VanDerWaalsContact O-CB 3.25Å; L112-F125 WeakPolarHBondContact O-CB 3.44Å; L112-L126 PolarHBondContact N-O 3.32Å; L112-L126 VanDerWaalsContact N-O 3.17Å; L112-L126 PolarHBondContact O-N 3.3Å
113	A	72.2	Confident	70.1	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.033	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	130.7	172.5	0	0	0	0	0	108.9	L65 L67 S102 G103 V105 F125	L65-A113 HydrophobicContact CD2-CB 3.4Å; L65-A113 VanDerWaalsContact CD2-CB 3.4Å; L67-A113 HydrophobicContact CD2-CB 3.79Å; S102-A113 CarbonylContact C-O 2.92Å; S102-A113 WeakPolarHBondContact CA-O 3.46Å; G103-A113 PolarHBondContact N-O 2.98Å; G103-A113 PolarHBondContact O-N 3.27Å; V105-A113 HydrophobicContact CG2-CB 4.14Å; A113-F125 HydrophobicContact CB-CB 3.77Å
114	A	68.1	Low	69.1	Low	58 Å²	58	52.9 Å²	52.9	48%	0.479	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	108.6	174	0	0	0	0	0	108.2	G123 S124	A114-G123 WeakPolarHBondContact O-CA 3.21Å; A114-S124 PolarHBondContact N-O 2.89Å; A114-S124 PolarHBondContact O-N 2.89Å
115	V	69.3	Low	68.7	Low	6 Å²	6	51.1 Å²	51.1	4%	0.036	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	142	-171.2	-57.9	0	0	0	0	112.2	L67 F101 L121 S122	L67-V115 HydrophobicContact CD1-CG2 3.48Å; L67-V115 VanDerWaalsContact CD1-CG2 3.48Å; L67-V115 HydrophobicContact CD2-CG2 3.86Å; L67-V115 HydrophobicContact CG-CG2 4.31Å; F101-V115 HydrophobicContact CB-CG2 4.13Å; F101-V115 PolarHBondContact N-O 3.3Å; F101-V115 PolarHBondContact O-N 3.47Å; V115-L121 HydrophobicContact CB-CD1 3.65Å; V115-L121 HydrophobicContact CG1-CD1 3.98Å; V115-L121 HydrophobicContact CG2-CD1 3.73Å; V115-S122 CarbonylContact C-O 3.58Å; V115-S122 WeakPolarHBondContact CA-O 3.45Å
116	S	72.9	Confident	67.4	Low	19 Å²	19	53.6 Å²	53.6	13%	0.133	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.4	168	-173.4	0	0	0	0	110.1	C99 C118 S122	C99-S116 CarbonylContact O-C 3.59Å; C99-S116 VanDerWaalsContact O-CA 3.26Å; C99-S116 WeakPolarHBondContact O-CA 3.02Å; S116-C118 PolarHBondContact OG-N 3.31Å; S116-C118 PolarHBondContact OG-SG 2.65Å; S116-C118 VanDerWaalsContact OG-SG 3.33Å; S116-S122 PolarHBondContact N-O 2.91Å; S116-S122 PolarHBondContact O-N 3.08Å; S116-S122 PolarHBondContact O-OG 2.91Å
117	L	70.9	Confident	66.9	Low	25 Å²	25	51 Å²	51	13%	0.131	29%	0.29	C	S	.	.			trans	-109.7	4.6	174.2	-61.4	-178.5	0	0	0	112.7	L52 L54 C99 F101 R119 G120 L121 L143	L52-L117 HydrophobicContact CD2-CD1 3.15Å; L54-L117 HydrophobicContact CD1-CD2 4.1Å; C99-L117 PolarHBondContact O-N 3.03Å; F101-L117 HydrophobicContact CD2-CD1 3.7Å; F101-L117 HydrophobicContact CD2-CG 3.95Å; F101-L117 HydrophobicContact CE2-CB 4.28Å; F101-L117 HydrophobicContact CE2-CD1 3.42Å; F101-L117 VanDerWaalsContact CE2-CD1 3.42Å; F101-L117 HydrophobicContact CE2-CG 3.97Å; F101-L117 HydrophobicContact CZ-CD1 4.06Å; L117-R119 PolarHBondContact O-N 3.07Å; L117-R119 VanDerWaalsContact O-N 3.11Å; L117-G120 CarbonylContact C-O 3.59Å; L117-G120 VanDerWaalsContact CA-O 3.24Å; L117-G120 WeakPolarHBondContact CA-O 3.23Å; L117-L121 HydrophobicContact CD2-CB 4.01Å; L117-L121 HydrophobicContact CD2-CD1 3.47Å; L117-L121 VanDerWaalsContact CD2-CD1 3.47Å; L117-L121 HydrophobicContact CD2-CG 4.33Å; L117-L143 HydrophobicContact CD1-CD1 4.34Å; L117-L143 HydrophobicContact CD2-CD1 4.1Å; L117-L143 HydrophobicContact CD2-CD2 3.97Å; L117-L143 HydrophobicContact CD2-CG 4.2Å
118	C	61.6	Low	66.8	Low	47 Å²	47	55.8 Å²	55.8	32%	0.318	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-33.8	-173.9	-72.6	0	0	0	0	112.9	C99 S116	C99-C118 HydrophobicContact CB-CB 4.09Å; C99-C118 WeakPolarHBondContact CB-SG 3.34Å; S116-C118 PolarHBondContact OG-N 3.31Å; S116-C118 PolarHBondContact OG-SG 2.65Å; S116-C118 VanDerWaalsContact OG-SG 3.33Å
119	R	63.7	Low	66	Low	192 Å²	192	53.8 Å²	53.8	73%	0.725	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145.5	48.5	-176	-64.5	-172.2	176.6	-178.7	-0.4	110.7	L117 P136 G141	L117-R119 PolarHBondContact O-N 3.07Å; L117-R119 VanDerWaalsContact O-N 3.11Å; R119-P136 VanDerWaalsContact O-CG 3.27Å; R119-P136 WeakPolarHBondContact O-CG 3.47Å; R119-G141 CarbonylContact C-O 3.51Å; R119-G141 VanDerWaalsContact C-O 3.31Å
120	G	68.6	Low	65.6	Low	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.288	C	S	.	.	S	Bend	trans	91.6	178.9	-167.7	0	0	0	0	0	111	L117 S122 G141	L117-G120 CarbonylContact C-O 3.59Å; L117-G120 VanDerWaalsContact CA-O 3.24Å; L117-G120 WeakPolarHBondContact CA-O 3.23Å; G120-S122 PolarHBondContact O-N 2.8Å; G120-G141 PolarHBondContact N-O 3Å
121	L	77.8	Confident	65.9	Low	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	-82.9	103.6	-176.9	-179.8	64.6	0	0	0	110.4	P42 L54 L56 L65 V115 L117 I134 L143 H147	P42-L121 HydrophobicContact CB-CD2 3.89Å; P42-L121 HydrophobicContact CG-CB 4.11Å; P42-L121 HydrophobicContact CG-CD2 3.53Å; P42-L121 HydrophobicContact CG-CG 4.46Å; L54-L121 HydrophobicContact CD1-CD1 3.88Å; L54-L121 HydrophobicContact CD1-CD2 4.07Å; L56-L121 HydrophobicContact CD2-CD2 3.93Å; L65-L121 HydrophobicContact CD1-CD2 4.41Å; V115-L121 HydrophobicContact CB-CD1 3.65Å; V115-L121 HydrophobicContact CG1-CD1 3.98Å; V115-L121 HydrophobicContact CG2-CD1 3.73Å; L117-L121 HydrophobicContact CD2-CB 4.01Å; L117-L121 HydrophobicContact CD2-CD1 3.47Å; L117-L121 VanDerWaalsContact CD2-CD1 3.47Å; L117-L121 HydrophobicContact CD2-CG 4.33Å; L121-I134 HydrophobicContact CD2-CD1 3.53Å; L121-I134 HydrophobicContact CD2-CG1 4.34Å; L121-I134 HydrophobicContact CD2-CG2 4.35Å; L121-I134 HydrophobicContact CG-CD1 4.04Å; L121-I134 HydrophobicContact CG-CG1 4.32Å; L121-I134 HydrophobicContact CG-CG2 3.91Å; L121-L143 HydrophobicContact CB-CD2 4.2Å; L121-H147 PolarHBondContact N-CD2 3Å; L121-H147 PolarHBondContact N-NE2 3Å; L121-H147 PolarHBondContact O-CD2 2.85Å
122	S	67.1	Low	66.3	Low	44 Å²	44	43.3 Å²	43.3	31%	0.308	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.8	176.1	56.4	0	0	0	0	110.8	V115 S116 G120 I134	V115-S122 CarbonylContact C-O 3.58Å; V115-S122 WeakPolarHBondContact CA-O 3.45Å; S116-S122 PolarHBondContact N-O 2.91Å; S116-S122 PolarHBondContact O-N 3.08Å; S116-S122 PolarHBondContact O-OG 2.91Å; G120-S122 PolarHBondContact O-N 2.8Å; S122-I134 CarbonylContact C-O 3.59Å; S122-I134 VanDerWaalsContact CA-O 3.24Å; S122-I134 WeakPolarHBondContact CA-O 3.44Å
123	G	64.9	Low	66.8	Low	28 Å²	28	39.5 Å²	39.5	29%	0.289	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	159.2	-161.2	178.5	0	0	0	0	0	112.2	A114 I134	A114-G123 WeakPolarHBondContact O-CA 3.21Å; G123-I134 PolarHBondContact N-O 3.37Å; G123-I134 PolarHBondContact O-N 3.4Å
124	S	59.8	Low	67	Low	45 Å²	45	39.5 Å²	39.5	32%	0.315	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	155.5	179.6	56.6	0	0	0	0	111.3	A114 F132	A114-S124 PolarHBondContact N-O 2.89Å; A114-S124 PolarHBondContact O-N 2.89Å; S124-F132 CarbonylContact C-O 3.52Å; S124-F132 VanDerWaalsContact CA-O 3.23Å; S124-F132 WeakPolarHBondContact CA-O 3.35Å
125	F	69.9	Low	67.3	Low	4 Å²	4	41.1 Å²	41.1	2%	0.018	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	150	170.1	65.6	-92.7	0	0	0	111.1	L56 F63 L65 V105 L112 A113 F132 L149	L56-F125 HydrophobicContact CD1-CE1 3.67Å; L56-F125 HydrophobicContact CD1-CZ 4.02Å; F63-F125 HydrophobicContact CB-CE2 4.26Å; F63-F125 HydrophobicContact CB-CZ 4.21Å; F63-F125 AromaticContact CD1-CE2 3.61Å; F63-F125 HydrophobicContact CD1-CE2 3.61Å; F63-F125 HydrophobicContact CD1-CZ 4.07Å; F63-F125 HydrophobicContact CD2-CZ 4.41Å; F63-F125 HydrophobicContact CE1-CE2 4.09Å; F63-F125 AromaticContact CG-CE2 3.96Å; F63-F125 HydrophobicContact CG-CE2 3.96Å; F63-F125 AromaticContact CG-CZ 3.98Å; F63-F125 HydrophobicContact CG-CZ 3.98Å; L65-F125 HydrophobicContact CD2-CB 3.86Å; L65-F125 HydrophobicContact CD2-CD1 3.82Å; L65-F125 HydrophobicContact CD2-CD2 4.49Å; L65-F125 HydrophobicContact CD2-CE1 4.46Å; L65-F125 HydrophobicContact CD2-CG 3.82Å; V105-F125 HydrophobicContact CB-CD2 4.47Å; V105-F125 HydrophobicContact CG1-CD2 4Å; V105-F125 HydrophobicContact CG1-CE2 4.19Å; V105-F125 HydrophobicContact CG2-CB 3.7Å; V105-F125 HydrophobicContact CG2-CD2 3.65Å; V105-F125 HydrophobicContact CG2-CG 3.99Å; L112-F125 CarbonylContact O-C 3.29Å; L112-F125 WeakPolarHBondContact O-CA 3.39Å; L112-F125 VanDerWaalsContact O-CB 3.25Å; L112-F125 WeakPolarHBondContact O-CB 3.44Å; A113-F125 HydrophobicContact CB-CB 3.77Å; F125-F132 HydrophobicContact CD1-CB 3.99Å; F125-F132 HydrophobicContact CD2-CB 3.86Å; F125-F132 AromaticContact CD2-CD2 3.88Å; F125-F132 HydrophobicContact CD2-CD2 3.88Å; F125-F132 HydrophobicContact CD2-CG 4.14Å; F125-F132 HydrophobicContact CE1-CB 3.62Å; F125-F132 HydrophobicContact CE1-CG 4.45Å; F125-F132 HydrophobicContact CE2-CB 3.47Å; F125-F132 VanDerWaalsContact CE2-CB 3.47Å; F125-F132 HydrophobicContact CE2-CD1 4.31Å; F125-F132 AromaticContact CE2-CD2 3.5Å; F125-F132 HydrophobicContact CE2-CD2 3.5Å; F125-F132 HydrophobicContact CE2-CE2 4.32Å; F125-F132 AromaticContact CE2-CG 3.51Å; F125-F132 HydrophobicContact CE2-CG 3.51Å; F125-F132 HydrophobicContact CG-CB 4.12Å; F125-F132 HydrophobicContact CZ-CB 3.35Å; F125-F132 HydrophobicContact CZ-CD1 4.26Å; F125-F132 HydrophobicContact CZ-CD2 4.19Å; F125-F132 AromaticContact CZ-CG 3.7Å; F125-F132 HydrophobicContact CZ-CG 3.7Å; F125-F132 PolarHBondContact N-O 3.31Å; F125-F132 PolarHBondContact O-N 2.92Å; F125-L149 HydrophobicContact CE1-CD1 3.68Å; F125-L149 HydrophobicContact CZ-CD1 3.99Å; F125-L149 HydrophobicContact CZ-CD2 4.47Å
126	L	56.3	Low	67.7	Low	53 Å²	53	42.5 Å²	42.5	28%	0.277	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.2	-177.7	-170.2	77.5	0	0	0	108.6	S111 L112 E131	S111-L126 WeakPolarHBondContact CA-O 3.49Å; S111-L126 VanDerWaalsContact CB-O 3.28Å; S111-L126 WeakPolarHBondContact CB-O 3.46Å; L112-L126 PolarHBondContact N-O 3.32Å; L112-L126 VanDerWaalsContact N-O 3.17Å; L112-L126 PolarHBondContact O-N 3.3Å; L126-E131 HydrophobicContact CD1-CB 4.21Å
127	L	76.6	Confident	67.9	Low	10 Å²	10	45.6 Å²	45.6	5%	0.052	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	125.5	174.5	178.4	69.8	0	0	0	108.8	F63 V105 N106 E108 G129 E130 F132	F63-L127 HydrophobicContact CD1-CD2 3.85Å; F63-L127 HydrophobicContact CE1-CD2 3.99Å; V105-L127 HydrophobicContact CB-CB 4.33Å; V105-L127 HydrophobicContact CB-CD1 4.21Å; V105-L127 HydrophobicContact CG1-CB 4.2Å; V105-L127 HydrophobicContact CG1-CD1 4.33Å; V105-L127 HydrophobicContact CG1-CD2 3.98Å; V105-L127 HydrophobicContact CG1-CG 4.4Å; N106-L127 VanDerWaalsContact ND2-CD2 3.32Å; N106-L127 WeakPolarHBondContact ND2-CD2 3.33Å; E108-L127 HydrophobicContact CG-CD1 4.26Å; L127-G129 PolarHBondContact O-N 2.85Å; L127-E130 PolarHBondContact N-O 2.94Å; L127-E130 VanDerWaalsContact N-O 3.07Å; L127-E130 PolarHBondContact O-N 2.87Å; L127-F132 HydrophobicContact CB-CE2 4.41Å
128	D	69.9	Low	67.4	Low	135 Å²	135	47.1 Å²	47.1	72%	0.722	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	33.9	-179.7	-57	-35.8	0	0	0	114	E130	D128-E130 PolarHBondContact O-N 2.95Å
129	G	51.8	Low	66.9	Low	63 Å²	63	50.6 Å²	50.6	65%	0.649	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	4.2	-177.1	0	0	0	0	0	114.8	L127	L127-G129 PolarHBondContact O-N 2.85Å
130	E	55.4	Low	66.4	Low	27 Å²	27	43.2 Å²	43.2	13%	0.126	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128.3	167.9	-64.5	-171.3	114.6	0	0	109.1	K61 L127 D128 F132 R151	K61-E130 IonicContact NZ-OE2 3.38Å; K61-E130 PolarHBondContact NZ-OE2 3.33Å; K61-E130 VanDerWaalsContact NZ-OE2 3.15Å; L127-E130 PolarHBondContact N-O 2.94Å; L127-E130 VanDerWaalsContact N-O 3.07Å; L127-E130 PolarHBondContact O-N 2.87Å; D128-E130 PolarHBondContact O-N 2.95Å; E130-F132 HydrophobicContact CB-CD2 4.47Å; E130-F132 HydrophobicContact CB-CE2 3.55Å; E130-F132 HydrophobicContact CB-CZ 3.84Å; E130-F132 VanDerWaalsContact O-CD2 3.3Å; E130-F132 WeakPolarHBondContact O-CD2 3.22Å; E130-F132 VanDerWaalsContact O-CE2 3.31Å; E130-F132 WeakPolarHBondContact O-CE2 3.26Å; E130-R151 IonicContact OE1-CZ 3.82Å; E130-R151 IonicContact OE1-NH1 2.9Å; E130-R151 PolarHBondContact OE1-NH1 2.85Å
131	E	62.9	Low	66	Low	35 Å²	35	45.4 Å²	45.4	16%	0.164	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	137.9	175.8	177.8	178.9	-165.5	0	0	110.4	L126 T133 W152 R441	L126-E131 HydrophobicContact CD1-CB 4.21Å; E131-T133 HydrophobicContact CG-CG2 4.46Å; E131-W152 HydrophobicContact CB-CB 4.2Å; E131-W152 PolarHBondContact N-O 2.85Å; E131-W152 PolarHBondContact O-N 2.93Å; E131-R441 IonicContact OE2-CZ 3.77Å; E131-R441 IonicContact OE2-NH1 2.89Å; E131-R441 PolarHBondContact OE2-NH1 3.04Å
132	F	74.9	Confident	65.7	Low	1 Å²	1	48.5 Å²	48.5	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	120.5	177.5	-60.6	-95.3	0	0	0	109.5	F59 F63 S124 F125 L127 E130 L149 Q150 R151	F59-F132 HydrophobicContact CD2-CD1 4.44Å; F59-F132 HydrophobicContact CD2-CE1 4.04Å; F59-F132 HydrophobicContact CE2-CD1 4.21Å; F59-F132 HydrophobicContact CE2-CE1 4.22Å; F63-F132 HydrophobicContact CE1-CD1 4.37Å; F63-F132 HydrophobicContact CE1-CD2 4.44Å; F63-F132 AromaticContact CE1-CE1 3.83Å; F63-F132 HydrophobicContact CE1-CE1 3.83Å; F63-F132 AromaticContact CE1-CE2 3.93Å; F63-F132 HydrophobicContact CE1-CE2 3.93Å; F63-F132 AromaticContact CE1-CZ 3.61Å; F63-F132 HydrophobicContact CE1-CZ 3.61Å; F63-F132 HydrophobicContact CE2-CE1 4.34Å; F63-F132 HydrophobicContact CZ-CD1 4.08Å; F63-F132 AromaticContact CZ-CE1 3.44Å; F63-F132 HydrophobicContact CZ-CE1 3.44Å; F63-F132 VanDerWaalsContact CZ-CE1 3.44Å; F63-F132 HydrophobicContact CZ-CE2 4.4Å; F63-F132 AromaticContact CZ-CZ 3.66Å; F63-F132 HydrophobicContact CZ-CZ 3.66Å; S124-F132 CarbonylContact C-O 3.52Å; S124-F132 VanDerWaalsContact CA-O 3.23Å; S124-F132 WeakPolarHBondContact CA-O 3.35Å; F125-F132 HydrophobicContact CD1-CB 3.99Å; F125-F132 HydrophobicContact CD2-CB 3.86Å; F125-F132 AromaticContact CD2-CD2 3.88Å; F125-F132 HydrophobicContact CD2-CD2 3.88Å; F125-F132 HydrophobicContact CD2-CG 4.14Å; F125-F132 HydrophobicContact CE1-CB 3.62Å; F125-F132 HydrophobicContact CE1-CG 4.45Å; F125-F132 HydrophobicContact CE2-CB 3.47Å; F125-F132 VanDerWaalsContact CE2-CB 3.47Å; F125-F132 HydrophobicContact CE2-CD1 4.31Å; F125-F132 AromaticContact CE2-CD2 3.5Å; F125-F132 HydrophobicContact CE2-CD2 3.5Å; F125-F132 HydrophobicContact CE2-CE2 4.32Å; F125-F132 AromaticContact CE2-CG 3.51Å; F125-F132 HydrophobicContact CE2-CG 3.51Å; F125-F132 HydrophobicContact CG-CB 4.12Å; F125-F132 HydrophobicContact CZ-CB 3.35Å; F125-F132 HydrophobicContact CZ-CD1 4.26Å; F125-F132 HydrophobicContact CZ-CD2 4.19Å; F125-F132 AromaticContact CZ-CG 3.7Å; F125-F132 HydrophobicContact CZ-CG 3.7Å; F125-F132 PolarHBondContact N-O 3.31Å; F125-F132 PolarHBondContact O-N 2.92Å; L127-F132 HydrophobicContact CB-CE2 4.41Å; E130-F132 HydrophobicContact CB-CD2 4.47Å; E130-F132 HydrophobicContact CB-CE2 3.55Å; E130-F132 HydrophobicContact CB-CZ 3.84Å; E130-F132 VanDerWaalsContact O-CD2 3.3Å; E130-F132 WeakPolarHBondContact O-CD2 3.22Å; E130-F132 VanDerWaalsContact O-CE2 3.31Å; E130-F132 WeakPolarHBondContact O-CE2 3.26Å; F132-L149 HydrophobicContact CB-CD1 4.08Å; F132-L149 HydrophobicContact CD1-CD2 4.45Å; F132-Q150 CarbonylContact C-O 3.46Å; F132-Q150 VanDerWaalsContact CA-O 3.31Å; F132-Q150 WeakPolarHBondContact CA-O 3.48Å; F132-R151 HydrophobicContact CD1-CB 3.89Å; F132-R151 HydrophobicContact CD1-CG 4Å; F132-R151 HydrophobicContact CE1-CB 3.75Å; F132-R151 VanDerWaalsContact CE1-CD 3.5Å; F132-R151 HydrophobicContact CE1-CG 3.47Å; F132-R151 VanDerWaalsContact CE1-CG 3.47Å; F132-R151 HydrophobicContact CZ-CG 3.92Å
133	T	68.1	Low	66	Low	33 Å²	33	49.2 Å²	49.2	20%	0.202	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.3	173.3	62.1	0	0	0	0	109.9	E131 L149 Q150 W152	E131-T133 HydrophobicContact CG-CG2 4.46Å; T133-L149 CarbonylContact O-C 3.31Å; T133-L149 WeakPolarHBondContact O-CA 3.44Å; T133-Q150 PolarHBondContact N-O 3.28Å; T133-Q150 PolarHBondContact O-N 3.13Å; T133-W152 PolarHBondContact OG1-NE1 2.91Å
134	I	76.9	Confident	66.3	Low	4 Å²	4	50.8 Å²	50.8	2%	0.021	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.2	179.8	-170.4	156.3	0	0	0	110.1	V40 P42 L56 L121 S122 G123 H147 R148 L149	V40-I134 HydrophobicContact CG2-CD1 3.66Å; P42-I134 HydrophobicContact CG-CD1 4.49Å; L56-I134 HydrophobicContact CD1-CD1 3.72Å; L56-I134 HydrophobicContact CD2-CD1 3.86Å; L56-I134 HydrophobicContact CG-CD1 4.47Å; L121-I134 HydrophobicContact CD2-CD1 3.53Å; L121-I134 HydrophobicContact CD2-CG1 4.34Å; L121-I134 HydrophobicContact CD2-CG2 4.35Å; L121-I134 HydrophobicContact CG-CD1 4.04Å; L121-I134 HydrophobicContact CG-CG1 4.32Å; L121-I134 HydrophobicContact CG-CG2 3.91Å; S122-I134 CarbonylContact C-O 3.59Å; S122-I134 VanDerWaalsContact CA-O 3.24Å; S122-I134 WeakPolarHBondContact CA-O 3.44Å; G123-I134 PolarHBondContact N-O 3.37Å; G123-I134 PolarHBondContact O-N 3.4Å; I134-H147 HydrophobicContact CD1-CB 3.89Å; I134-H147 HydrophobicContact CG1-CB 3.69Å; I134-R148 WeakPolarHBondContact CA-O 3.26Å; I134-L149 HydrophobicContact CB-CD1 3.76Å; I134-L149 HydrophobicContact CD1-CD1 4.11Å; I134-L149 HydrophobicContact CG1-CD1 4.25Å
135	Q	75	Confident	67.4	Low	92 Å²	92	49.9 Å²	49.9	43%	0.43	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	148.5	176.6	59.8	-178.4	-9.5	0	0	112.3	H147 R148	Q135-H147 CarbonylContact O-C 3.5Å; Q135-H147 WeakPolarHBondContact O-CA 3.29Å; Q135-H147 WeakPolarHBondContact O-CB 3.04Å; Q135-R148 HydrophobicContact CG-CB 4.19Å; Q135-R148 PolarHBondContact N-O 3.1Å; Q135-R148 VanDerWaalsContact N-O 3.08Å; Q135-R148 PolarHBondContact O-N 2.86Å
136	P	76.4	Confident	68.1	Low	35 Å²	35	52.5 Å²	52.5	23%	0.227	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	141	175.9	-22.4	32.2	0	0	0	113.3	R119	R119-P136 VanDerWaalsContact O-CG 3.27Å; R119-P136 WeakPolarHBondContact O-CG 3.47Å
137	Q	77.2	Confident	69.6	Low	84 Å²	84	50 Å²	50	39%	0.393	35%	0.349	S	S	.	.	S	Bend	trans	-96.5	104.5	173.5	-169.8	71.3	44.2	0	0	110.4	L39 P146	L39-Q137 HydrophobicContact CD2-CB 4.32Å; L39-Q137 HydrophobicContact CD2-CG 4.25Å; Q137-P146 VanDerWaalsContact CB-O 3.27Å; Q137-P146 WeakPolarHBondContact CB-O 2.98Å; Q137-P146 PolarHBondContact N-O 3.47Å
138	G	61.3	Low	70	Confident	58 Å²	58	53.3 Å²	53.3	60%	0.598	36%	0.361	S	S	*	.	S	Bend	trans	101.5	-176.3	176.2	0	0	0	0	0	114.8	G140	G138-G140 VanDerWaalsContact C-N 3.29Å; G138-G140 PolarHBondContact O-N 2.78Å
139	A	49.5	Very low	70.7	Confident	120 Å²	120	46.9 Å²	46.9	99%	0.992	33%	0.327	S	S	*	.	S	Bend	trans	-81.9	6.5	-171.8	0	0	0	0	0	115.4
140	G	54.2	Low	71.9	Confident	37 Å²	37	45.9 Å²	45.9	38%	0.381	31%	0.305	S	S	.	.			trans	-86.3	155	174.8	0	0	0	0	0	111.8	G138 Q145	G138-G140 VanDerWaalsContact C-N 3.29Å; G138-G140 PolarHBondContact O-N 2.78Å; G140-Q145 VanDerWaalsContact C-NE2 3.3Å; G140-Q145 PolarHBondContact O-NE2 3.27Å; G140-Q145 PolarHBondContact O-OE1 3.34Å; G140-Q145 VanDerWaalsContact O-OE1 3.09Å
141	G	59.4	Low	72.6	Confident	45 Å²	45	47.4 Å²	47.4	46%	0.464	31%	0.31	S	S	.	.			trans	-120.3	25.4	-174	0	0	0	0	0	115.5	R119 G120	R119-G141 CarbonylContact C-O 3.51Å; R119-G141 VanDerWaalsContact C-O 3.31Å; G120-G141 PolarHBondContact N-O 3Å
142	S	71.8	Confident	72.1	Confident	66 Å²	66	50 Å²	50	46%	0.462	32%	0.318	S	S	.	.			trans	-108.4	145.7	-174.9	83	0	0	0	0	113.1	G144 Q145	S142-G144 PolarHBondContact O-N 3.07Å; S142-Q145 VanDerWaalsContact O-CD 3.3Å; S142-Q145 WeakPolarHBondContact O-CG 3.33Å; S142-Q145 PolarHBondContact O-N 2.02Å; S142-Q145 PolarHBondContact O-NE2 3.45Å
143	L	73.1	Confident	70.9	Confident	59 Å²	59	52 Å²	52	31%	0.309	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.1	173.9	-93.5	139.8	0	0	0	113.9	P42 L54 L117 L121 Q145	P42-L143 HydrophobicContact CB-CD2 3.87Å; P42-L143 HydrophobicContact CG-CD2 4.38Å; L54-L143 HydrophobicContact CD1-CD2 3.93Å; L54-L143 HydrophobicContact CD2-CD2 3.94Å; L117-L143 HydrophobicContact CD1-CD1 4.34Å; L117-L143 HydrophobicContact CD2-CD1 4.1Å; L117-L143 HydrophobicContact CD2-CD2 3.97Å; L117-L143 HydrophobicContact CD2-CG 4.2Å; L121-L143 HydrophobicContact CB-CD2 4.2Å; L143-Q145 VanDerWaalsContact C-N 3.28Å; L143-Q145 PolarHBondContact O-N 2.82Å
144	G	72.1	Confident	69.8	Low	61 Å²	61	56.2 Å²	56.2	63%	0.629	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-3.3	-178.2	0	0	0	0	0	115.1	S142	S142-G144 PolarHBondContact O-N 3.07Å
145	Q	82.3	Confident	68	Low	26 Å²	26	60.4 Å²	60.4	12%	0.121	40%	0.402	C	S	.	.	S	Bend	trans	-87.8	162	176.2	80.2	-158.1	-18.9	0	0	111.6	G140 S142 L143 H147	G140-Q145 VanDerWaalsContact C-NE2 3.3Å; G140-Q145 PolarHBondContact O-NE2 3.27Å; G140-Q145 PolarHBondContact O-OE1 3.34Å; G140-Q145 VanDerWaalsContact O-OE1 3.09Å; S142-Q145 VanDerWaalsContact O-CD 3.3Å; S142-Q145 WeakPolarHBondContact O-CG 3.33Å; S142-Q145 PolarHBondContact O-N 2.02Å; S142-Q145 PolarHBondContact O-NE2 3.45Å; L143-Q145 VanDerWaalsContact C-N 3.28Å; L143-Q145 PolarHBondContact O-N 2.82Å; Q145-H147 PolarHBondContact O-CE1 2.92Å; Q145-H147 PolarHBondContact O-N 3.45Å; Q145-H147 PolarHBondContact O-ND1 3.32Å
146	P	85.3	Confident	66.7	Low	59 Å²	59	59.7 Å²	59.7	38%	0.383	42%	0.419	S	S	.	.			trans	-62.4	134.9	172.9	-21.1	33.5	0	0	0	111.7	L39 V40 Q137	L39-P146 HydrophobicContact CD2-CB 4.4Å; V40-P146 CarbonylContact O-C 3.06Å; Q137-P146 VanDerWaalsContact CB-O 3.27Å; Q137-P146 WeakPolarHBondContact CB-O 2.98Å; Q137-P146 PolarHBondContact N-O 3.47Å
147	H	88.6	Confident	64.6	Low	0 Å²	0	62.9 Å²	62.9	0%	0	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	141.1	172.1	-61.4	72	0	0	0	108.1	L39 V40 P42 L121 I134 Q135 Q145 L149	L39-H147 CarbonylContact C-O 3.55Å; L39-H147 WeakPolarHBondContact CA-O 3.25Å; V40-H147 HydrophobicContact CG2-CB 4.15Å; V40-H147 PolarHBondContact N-O 3.01Å; V40-H147 PolarHBondContact O-N 3.12Å; P42-H147 WeakPolarHBondContact CD-ND1 3.27Å; L121-H147 PolarHBondContact N-CD2 3Å; L121-H147 PolarHBondContact N-NE2 3Å; L121-H147 PolarHBondContact O-CD2 2.85Å; I134-H147 HydrophobicContact CD1-CB 3.89Å; I134-H147 HydrophobicContact CG1-CB 3.69Å; Q135-H147 CarbonylContact O-C 3.5Å; Q135-H147 WeakPolarHBondContact O-CA 3.29Å; Q135-H147 WeakPolarHBondContact O-CB 3.04Å; Q145-H147 PolarHBondContact O-CE1 2.92Å; Q145-H147 PolarHBondContact O-N 3.45Å; Q145-H147 PolarHBondContact O-ND1 3.32Å; H147-L149 PolarHBondContact O-N 3.3Å
148	R	84.5	Confident	62.4	Low	80 Å²	80	70.1 Å²	70.1	30%	0.302	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	113.1	173.1	-175.6	179.1	-63	-107.5	-3.5	108.1	L39 I134 Q135 Q150	L39-R148 HydrophobicContact CD2-CB 4.32Å; I134-R148 WeakPolarHBondContact CA-O 3.26Å; Q135-R148 HydrophobicContact CG-CB 4.19Å; Q135-R148 PolarHBondContact N-O 3.1Å; Q135-R148 VanDerWaalsContact N-O 3.08Å; Q135-R148 PolarHBondContact O-N 2.86Å; R148-Q150 HydrophobicContact CG-CG 3.97Å
149	L	84.6	Confident	60.9	Low	0 Å²	0	73.5 Å²	73.5	0%	0	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	121.5	170.7	-171.9	71.5	0	0	0	108.3	S37 E38 V40 L56 A58 F59 F63 F125 F132 T133 I134 H147	S37-L149 WeakPolarHBondContact CA-O 3.19Å; E38-L149 PolarHBondContact N-O 3.03Å; E38-L149 PolarHBondContact O-N 2.94Å; V40-L149 HydrophobicContact CG1-CB 3.92Å; V40-L149 HydrophobicContact CG1-CD2 4.12Å; V40-L149 HydrophobicContact CG2-CB 3.85Å; L56-L149 HydrophobicContact CD1-CD1 4.35Å; A58-L149 HydrophobicContact CB-CD2 3.6Å; F59-L149 HydrophobicContact CD2-CD2 4.45Å; F59-L149 HydrophobicContact CE2-CD2 3.9Å; F59-L149 HydrophobicContact CE2-CG 4.11Å; F59-L149 WeakPolarHBondContact CZ-O 3.47Å; F63-L149 HydrophobicContact CE2-CD2 4.32Å; F125-L149 HydrophobicContact CE1-CD1 3.68Å; F125-L149 HydrophobicContact CZ-CD1 3.99Å; F125-L149 HydrophobicContact CZ-CD2 4.47Å; F132-L149 HydrophobicContact CB-CD1 4.08Å; F132-L149 HydrophobicContact CD1-CD2 4.45Å; T133-L149 CarbonylContact O-C 3.31Å; T133-L149 WeakPolarHBondContact O-CA 3.44Å; I134-L149 HydrophobicContact CB-CD1 3.76Å; I134-L149 HydrophobicContact CD1-CD1 4.11Å; I134-L149 HydrophobicContact CG1-CD1 4.25Å; H147-L149 PolarHBondContact O-N 3.3Å
150	Q	75.9	Confident	60	Low	42 Å²	42	75.7 Å²	75.7	20%	0.196	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.7	178.2	-57	-178.7	-68.6	0	0	108.2	F132 T133 R148 W152	F132-Q150 CarbonylContact C-O 3.46Å; F132-Q150 VanDerWaalsContact CA-O 3.31Å; F132-Q150 WeakPolarHBondContact CA-O 3.48Å; T133-Q150 PolarHBondContact N-O 3.28Å; T133-Q150 PolarHBondContact O-N 3.13Å; R148-Q150 HydrophobicContact CG-CG 3.97Å; Q150-W152 HydrophobicContact CB-CZ2 4.45Å; Q150-W152 VanDerWaalsContact O-CD1 3.28Å
151	R	71.1	Confident	58.8	Low	59 Å²	59	79.7 Å²	79.7	22%	0.223	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133.3	174.6	179.8	174.6	65.4	140.9	-3.7	109.8	A36 F59 E130 F132	A36-R151 PolarHBondContact O-N 2.91Å; A36-R151 VanDerWaalsContact O-N 3.07Å; F59-R151 HydrophobicContact CD2-CB 4.05Å; F59-R151 HydrophobicContact CE1-CB 4.41Å; F59-R151 HydrophobicContact CE2-CB 3.56Å; F59-R151 HydrophobicContact CZ-CB 3.75Å; E130-R151 IonicContact OE1-CZ 3.82Å; E130-R151 IonicContact OE1-NH1 2.9Å; E130-R151 PolarHBondContact OE1-NH1 2.85Å; F132-R151 HydrophobicContact CD1-CB 3.89Å; F132-R151 HydrophobicContact CD1-CG 4Å; F132-R151 HydrophobicContact CE1-CB 3.75Å; F132-R151 VanDerWaalsContact CE1-CD 3.5Å; F132-R151 HydrophobicContact CE1-CG 3.47Å; F132-R151 VanDerWaalsContact CE1-CG 3.47Å; F132-R151 HydrophobicContact CZ-CG 3.92Å
152	W	51.9	Low	57.5	Low	89 Å²	89	89.8 Å²	89.8	34%	0.337	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	113.2	-179.3	-55.9	86.8	0	0	0	107.6	Q35 E131 T133 Q150	Q35-W152 HydrophobicContact CG-CZ3 4.44Å; E131-W152 HydrophobicContact CB-CB 4.2Å; E131-W152 PolarHBondContact N-O 2.85Å; E131-W152 PolarHBondContact O-N 2.93Å; T133-W152 PolarHBondContact OG1-NE1 2.91Å; Q150-W152 HydrophobicContact CB-CZ2 4.45Å; Q150-W152 VanDerWaalsContact O-CD1 3.28Å
153	G	50.3	Low	55.3	Low	43 Å²	43	89.9 Å²	89.9	44%	0.443	53%	0.532	S	S	.	.	S	Bend	trans	155.8	155.2	-178.6	0	0	0	0	0	113.8
154	P	45.4	Very low	53.2	Low	122 Å²	122	92.7 Å²	92.7	79%	0.792	55%	0.554	S	S	*	*			trans	-71.5	131	-177.6	27.2	-31.3	0	0	0	111.9	G156	P154-G156 PolarHBondContact O-N 3.23Å
155	A	37.8	Very low	50.9	Low	91 Å²	91	98.1 Å²	98.1	75%	0.752	56%	0.563	S	S	*	*	S	Bend	trans	-67.6	100.1	179	0	0	0	0	0	111.8
156	G	48.7	Very low	48.1	Very low	77 Å²	77	108.6 Å²	108.6	79%	0.794	60%	0.602	S	S	*	*			trans	99.2	86.4	158.5	0	0	0	0	0	115.8	P154	P154-G156 PolarHBondContact O-N 3.23Å
157	A	32.5	Very low	45.1	Very low	103 Å²	103	113.6 Å²	113.6	85%	0.851	62%	0.62	S	S	*	*			trans	-104.7	123.3	154.3	0	0	0	0	0	109.1
158	R	29.8	Very low	42.1	Very low	236 Å²	236	119.3 Å²	119.3	89%	0.891	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-74.1	150.1	171.7	-92.6	174.1	149.8	178.3	-7	109.8	L160	R158-L160 PolarHBondContact O-N 2.9Å
159	P	30.7	Very low	39.1	Very low	129 Å²	129	124 Å²	124	84%	0.838	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-68.7	131.4	174.8	-6.2	21.1	0	0	0	110.7
160	L	29.4	Very low	36.3	Very low	166 Å²	166	131 Å²	131	87%	0.869	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-84.2	153.9	167.9	-79.8	167.7	0	0	0	110.7	R158	R158-L160 PolarHBondContact O-N 2.9Å
161	P	28.8	Very low	33.8	Very low	120 Å²	120	132.9 Å²	132.9	78%	0.779	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-81.6	150.3	-161.7	31.4	-32.1	0	0	0	114
162	R	32.4	Very low	31.5	Very low	258 Å²	258	139.8 Å²	139.8	97%	0.974	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-60.4	128.6	173.8	-72.1	-177.1	-170.1	-170.9	1.1	111.6
163	G	26.2	Very low	30.1	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-98.4	162.6	161.7	0	0	0	0	0	111.5
164	P	28.6	Very low	28.8	Very low	119 Å²	119	146.5 Å²	146.5	77%	0.773	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-88.5	151.4	-142.6	33.9	-35	0	0	0	115.5
165	E	25.2	Very low	27.9	Very low	175 Å²	175	152.3 Å²	152.3	82%	0.818	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-63.3	143.3	170.7	-74.2	163.8	149.9	0	0	112.5
166	W	23.4	Very low	27.2	Very low	245 Å²	245	157.3 Å²	157.3	93%	0.928	85%	0.846	S	S	*	*			trans	-125.5	110.4	154.7	-77.7	94.4	0	0	0	108.1
167	E	21.7	Very low	26	Very low	165 Å²	165	162.8 Å²	162.8	77%	0.771	85%	0.851	S	S	*	*			trans	-84.6	175.3	168.3	-73.2	-176.6	139.2	0	0	111.4
168	V	24.2	Very low	25.6	Very low	120 Å²	120	169.9 Å²	169.9	73%	0.727	86%	0.856	S	S	*	*			trans	108.9	129.4	155.8	-178.2	0	0	0	0	114
169	E	22.6	Very low	25.2	Very low	179 Å²	179	161.7 Å²	161.7	84%	0.836	85%	0.845	S	S	*	*			cis	-164.2	153.9	-13.3	-110.1	174.7	162.7	0	0	106.3
170	T	26.8	Very low	25	Very low	145 Å²	145	162.9 Å²	162.9	89%	0.89	84%	0.844	S	S	*	*			trans	-75	145.3	167.3	34.3	0	0	0	0	111.9
171	G	23.2	Very low	24.7	Very low	82 Å²	82	160.9 Å²	160.9	85%	0.845	83%	0.834	S	S	*	*			trans	-138.8	113.9	169.3	0	0	0	0	0	111.8
172	E	22.4	Very low	24.6	Very low	204 Å²	204	163 Å²	163	95%	0.953	83%	0.833	S	S	*	*			trans	-88.9	158.6	172.7	-73.6	-177.5	120.1	0	0	113.1
173	G	23.1	Very low	24.3	Very low	75 Å²	75	158.3 Å²	158.3	77%	0.773	82%	0.823	S	S	*	*			trans	112.2	135.6	158	0	0	0	0	0	114.1
174	Q	22.4	Very low	24.2	Very low	199 Å²	199	162.2 Å²	162.2	93%	0.93	83%	0.828	S	S	*	*			cis	-161.5	157.3	19.1	-95.9	175.3	-19.8	0	0	110.8
175	R	26.5	Very low	24	Very low	244 Å²	244	162.4 Å²	162.4	92%	0.921	83%	0.832	S	S	*	*			trans	-71.1	151.5	171.6	-67.6	171.5	171.8	174.6	-3.9	112.8
176	Q	22.3	Very low	24	Very low	196 Å²	196	163 Å²	163	92%	0.916	84%	0.835	S	S	*	*			trans	-156.6	123.5	141.4	-145.4	159.7	-5.1	0	0	113.2
177	E	24.2	Very low	24	Very low	192 Å²	192	159.9 Å²	159.9	90%	0.897	83%	0.83	S	S	*	*			trans	-83.1	151.2	170.1	-67.9	172.4	149.2	0	0	111.4
178	R	22.8	Very low	24.2	Very low	252 Å²	252	161.2 Å²	161.2	95%	0.951	84%	0.837	S	S	*	*			trans	-158.3	132.6	151.3	-158.8	171	-173	175.4	1.1	110.6
179	G	22.7	Very low	24.2	Very low	64 Å²	64	160.9 Å²	160.9	66%	0.66	84%	0.84	S	S	*	*			trans	-109.8	-172.9	-175	0	0	0	0	0	117
180	D	26	Very low	24.2	Very low	153 Å²	153	161.7 Å²	161.7	82%	0.818	84%	0.844	S	S	*	*			trans	102.5	126.7	149.3	-64.6	-5.8	0	0	0	122.6
181	N	24	Very low	24.1	Very low	125 Å²	125	164.1 Å²	164.1	67%	0.668	85%	0.845	S	S	*	*			trans	88	111.9	145.5	-66.3	5.9	0	0	0	121
182	E	25.6	Very low	24.2	Very low	163 Å²	163	169.4 Å²	169.4	76%	0.762	85%	0.848	S	S	*	*				72.4	131.3	93.2	-75.5	177.6	170.6	0	0	112.1
183	E	25.5	Very low	24.5	Very low	160 Å²	160	168.7 Å²	168.7	75%	0.748	84%	0.844	S	S	*	*			cis	-167.5	157.5	23.5	-110.5	171.3	175.1	0	0	109.7
184	D	24.5	Very low	24.5	Very low	150 Å²	150	170 Å²	170	80%	0.802	85%	0.848	S	S	*	*			trans	51.3	117.3	151.4	-69.8	-10.3	0	0	0	125.1
185	S	25.1	Very low	24.8	Very low	123 Å²	123	170 Å²	170	86%	0.86	85%	0.848	S	S	*	*				178.6	143.1	109	61.2	0	0	0	0	112.5
186	E	25	Very low	24.8	Very low	186 Å²	186	162.1 Å²	162.1	87%	0.869	84%	0.843	S	S	*	*			trans	-78.2	166.4	-168.5	-59.4	174.7	139.7	0	0	116.2
187	E	24.3	Very low	24.9	Very low	180 Å²	180	157.4 Å²	157.4	84%	0.841	84%	0.837	S	S	*	*			trans	86.2	98.2	160.2	-56.9	-168.8	161.9	0	0	119.8
188	E	24.1	Very low	25.6	Very low	193 Å²	193	154.2 Å²	154.2	90%	0.902	84%	0.836	S	S	*	*				179.1	141.1	98.2	-97.9	-173.9	163.3	0	0	111.2
189	S	24.2	Very low	25.7	Very low	114 Å²	114	151.3 Å²	151.3	80%	0.797	83%	0.833	S	S	*	*			trans	-75.8	130.8	-172.4	51.3	0	0	0	0	114.5
190	Q	24.1	Very low	26	Very low	196 Å²	196	155.8 Å²	155.8	92%	0.916	84%	0.841	S	S	*	*			trans	-139.7	129.4	150.5	-73.6	-171	-12.3	0	0	110.7
191	E	24.5	Very low	26.2	Very low	195 Å²	195	154 Å²	154	91%	0.911	84%	0.838	S	S	*	*			trans	-68.2	131.6	170.1	-64.2	168.9	145.7	0	0	109.9
192	E	24.8	Very low	26.5	Very low	194 Å²	194	153.3 Å²	153.3	91%	0.907	84%	0.841	S	S	*	*			trans	-163.3	159	136.2	-111.6	179.2	-164.7	0	0	111.3
193	E	28	Very low	26.6	Very low	188 Å²	188	151.2 Å²	151.2	88%	0.879	84%	0.841	S	S	*	*			trans	-69.6	156.5	-149.3	-59.1	-179.9	141	0	0	117.3
194	A	23.6	Very low	27.2	Very low	103 Å²	103	152.7 Å²	152.7	85%	0.851	85%	0.853	S	S	*	*			trans	-148.9	126.4	142.8	0	0	0	0	0	111.7
195	E	28.3	Very low	27.6	Very low	199 Å²	199	149.4 Å²	149.4	93%	0.93	86%	0.855	S	S	*	*			trans	-58.8	153	165.8	-63.7	-175.3	132.4	0	0	112.6
196	G	26.2	Very low	27.7	Very low	79 Å²	79	147.7 Å²	147.7	81%	0.814	85%	0.848	S	S	*	*			trans	121.6	88.6	147.7	0	0	0	0	0	116
197	A	24.6	Very low	28	Very low	97 Å²	97	145.3 Å²	145.3	80%	0.802	85%	0.846	S	S	*	*			trans	-161.7	136.7	140.6	0	0	0	0	0	111.7
198	S	38.6	Very low	28.4	Very low	125 Å²	125	142 Å²	142	87%	0.874	84%	0.843	S	S	*	*			trans	-35.2	128.3	168.9	-173.4	0	0	0	0	114.4
199	E	26.4	Very low	29.4	Very low	191 Å²	191	143.7 Å²	143.7	89%	0.893	84%	0.841	S	S	*	*			trans	-130.5	129.7	163.5	-80.7	-165.8	140.5	0	0	112.3
200	L	29.3	Very low	30.5	Very low	157 Å²	157	142.1 Å²	142.1	82%	0.822	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-52.5	160.2	167.8	-76.4	136.6	0	0	0	112.5
201	P	30	Very low	32	Very low	116 Å²	116	140.3 Å²	140.3	75%	0.753	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-67.9	140.4	-175.8	26.7	-31.5	0	0	0	111.7
202	P	29.6	Very low	33.9	Very low	111 Å²	111	135.3 Å²	135.3	72%	0.721	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-74.5	155.8	-179.6	30.4	-33.7	0	0	0	111.7
203	P	28.7	Very low	36.2	Very low	119 Å²	119	126.6 Å²	126.6	77%	0.773	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-72.1	152.2	-179.4	30.3	-32.4	0	0	0	111.8	G205	P203-G205 PolarHBondContact O-N 2.68Å
204	L	36.8	Very low	38.6	Very low	190 Å²	190	118.5 Å²	118.5	100%	0.995	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.5	117.8	177.9	-73.1	145.3	0	0	0	112.6
205	G	34.2	Very low	41.6	Very low	82 Å²	82	113.6 Å²	113.6	85%	0.845	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	143.2	-2.8	166.3	0	0	0	0	0	117.6	P203	P203-G205 PolarHBondContact O-N 2.68Å
206	A	25.4	Very low	44.4	Very low	86 Å²	86	106.7 Å²	106.7	71%	0.711	64%	0.638	S	S	*	*			trans	-85	119	175.3	0	0	0	0	0	110.7	S208	A206-S208 PolarHBondContact O-N 2.86Å
207	T	32.2	Very low	47.2	Very low	137 Å²	137	104.2 Å²	104.2	84%	0.84	61%	0.61	S	S	*	*			trans	-61.2	108.4	165.9	41.8	0	0	0	0	108.4	R209	T207-R209 PolarHBondContact O-N 2.96Å; T207-R209 VanDerWaalsContact O-N 3.07Å
208	S	32.2	Very low	50.3	Low	110 Å²	110	100.2 Å²	100.2	77%	0.769	57%	0.574	S	S	*	*			trans	-53.6	116.5	175.3	-176.4	0	0	0	0	109.1	A206 T210	A206-S208 PolarHBondContact O-N 2.86Å; S208-T210 PolarHBondContact O-N 3.39Å; S208-T210 VanDerWaalsContact O-N 3.15Å
209	R	44.5	Very low	52.7	Low	229 Å²	229	95.4 Å²	95.4	86%	0.864	54%	0.538	S	S	*	.			trans	-65.6	112	169.5	-83.8	-179.4	166.7	-171.7	-3	106.9	T207 K211	T207-R209 PolarHBondContact O-N 2.96Å; T207-R209 VanDerWaalsContact O-N 3.07Å; R209-K211 PolarHBondContact O-N 3.24Å; R209-K211 VanDerWaalsContact O-N 3.14Å
210	T	48.2	Very low	55.8	Low	80 Å²	80	86.3 Å²	86.3	49%	0.491	50%	0.495	S	S	.	.			trans	-57.1	118.1	173.6	40.8	0	0	0	0	109.6	S208 R212	S208-T210 PolarHBondContact O-N 3.39Å; S208-T210 VanDerWaalsContact O-N 3.15Å; T210-R212 PolarHBondContact O-N 2.84Å
211	K	56.2	Low	58.7	Low	159 Å²	159	79.4 Å²	79.4	69%	0.691	46%	0.459	S	S	*	.			trans	-77.8	105.5	175.4	-70.3	-178	178.7	176	0	107.5	R209 V214	R209-K211 PolarHBondContact O-N 3.24Å; R209-K211 VanDerWaalsContact O-N 3.14Å; K211-V214 HydrophobicContact CB-CG2 3.83Å
212	R	62.9	Low	61.7	Low	90 Å²	90	73.9 Å²	73.9	34%	0.34	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	157.7	-173.1	-63.7	173.6	-171.3	177.5	0.1	112.6	T210 V214	T210-R212 PolarHBondContact O-N 2.84Å; R212-V214 WeakPolarHBondContact O-CG2 3.3Å; R212-V214 PolarHBondContact O-N 2.85Å
213	F	73.2	Confident	64.7	Low	10 Å²	10	68.6 Å²	68.6	4%	0.044	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	27.6	-172.9	-48.8	-80	0	0	0	112.3	F547 R567 R568 A569 Y571 V656 R657	F213-F547 HydrophobicContact CE1-CE1 4.04Å; F213-F547 HydrophobicContact CZ-CE1 4.13Å; F213-R567 CarbonylContact O-C 3.48Å; F213-R567 VanDerWaalsContact O-CA 3.29Å; F213-R567 WeakPolarHBondContact O-CA 3.21Å; F213-R568 VanDerWaalsContact O-CG 3.26Å; F213-R568 WeakPolarHBondContact O-CG 3.45Å; F213-R568 PolarHBondContact O-N 3.26Å; F213-A569 HydrophobicContact CB-CB 3.95Å; F213-A569 WeakPolarHBondContact CB-O 3.4Å; F213-A569 HydrophobicContact CD1-CB 3.97Å; F213-A569 HydrophobicContact CG-CB 4.2Å; F213-Y571 AromaticContact CD2-CD1 3.88Å; F213-Y571 HydrophobicContact CD2-CD1 3.88Å; F213-Y571 AromaticContact CD2-CE1 3.59Å; F213-Y571 HydrophobicContact CD2-CE1 3.59Å; F213-Y571 AromaticContact CE2-CD1 3.58Å; F213-Y571 HydrophobicContact CE2-CD1 3.58Å; F213-Y571 AromaticContact CE2-CE1 3.24Å; F213-Y571 HydrophobicContact CE2-CE1 3.24Å; F213-Y571 HydrophobicContact CZ-CD1 4.16Å; F213-Y571 HydrophobicContact CZ-CE1 4.17Å; F213-V656 HydrophobicContact CZ-CG1 4.29Å; F213-R657 HydrophobicContact CE1-CB 3.96Å; F213-R657 HydrophobicContact CE1-CG 3.59Å; F213-R657 HydrophobicContact CZ-CB 3.97Å; F213-R657 HydrophobicContact CZ-CG 3.93Å
214	V	80.4	Confident	67.9	Low	18 Å²	18	63 Å²	63	11%	0.109	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.4	179.1	-176.3	0	0	0	0	106	K211 R212 E216 G566 R567	K211-V214 HydrophobicContact CB-CG2 3.83Å; R212-V214 WeakPolarHBondContact O-CG2 3.3Å; R212-V214 PolarHBondContact O-N 2.85Å; V214-E216 HydrophobicContact CB-CG 4.13Å; V214-E216 HydrophobicContact CG1-CG 3.66Å; V214-E216 PolarHBondContact O-N 3.4Å; V214-G566 CarbonylContact C-O 3.6Å; V214-G566 WeakPolarHBondContact CA-O 3.22Å; V214-R567 HydrophobicContact CG2-CG 3.9Å
215	S	86.2	Confident	70.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	115.4	162.2	-165.9	0	0	0	0	107.1	C564 L565 G566	S215-C564 VanDerWaalsContact CB-O 3.25Å; S215-C564 WeakPolarHBondContact CB-O 3.38Å; S215-C564 PolarHBondContact OG-O 3.28Å; S215-C564 VanDerWaalsContact OG-O 3.1Å; S215-L565 CarbonylContact O-C 3.44Å; S215-L565 VanDerWaalsContact O-CA 3.27Å; S215-L565 WeakPolarHBondContact O-CA 3.19Å; S215-G566 PolarHBondContact N-O 3Å; S215-G566 PolarHBondContact O-N 2.99Å
216	E	86.3	Confident	73.7	Confident	55 Å²	55	50 Å²	50	26%	0.257	26%	0.264	S	S	.	.			trans	-121.4	155.1	178.3	-73.6	177.8	165.5	0	0	107.7	V214 R218 L425	V214-E216 HydrophobicContact CB-CG 4.13Å; V214-E216 HydrophobicContact CG1-CG 3.66Å; V214-E216 PolarHBondContact O-N 3.4Å; E216-R218 PolarHBondContact O-N 2.85Å; E216-R218 IonicContact OE2-CZ 2.78Å; E216-R218 IonicContact OE2-NH1 2.67Å; E216-R218 PolarHBondContact OE2-NH1 3.47Å; E216-R218 IonicContact OE2-NH2 3.96Å; E216-R218 PolarHBondContact OE2-NH2 2.89Å; E216-L425 WeakPolarHBondContact OE2-CD2 3.03Å
217	A	86.1	Confident	77	Confident	27 Å²	27	46.6 Å²	46.6	22%	0.223	23%	0.234	C	C	.	.			trans	-64.2	132.2	170.5	0	0	0	0	0	108.7	F219 L565	A217-F219 HydrophobicContact CB-CE2 3.89Å; A217-F219 HydrophobicContact CB-CZ 3.9Å; A217-L565 HydrophobicContact CB-CD2 4.5Å
218	R	89.6	Confident	80	Confident	12 Å²	12	40.7 Å²	40.7	5%	0.045	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.6	172.9	-62.1	-74.8	176.6	-100.2	7.4	108.3	E216 S261 I262 N263 L416 L424	E216-R218 PolarHBondContact O-N 2.85Å; E216-R218 IonicContact OE2-CZ 2.78Å; E216-R218 IonicContact OE2-NH1 2.67Å; E216-R218 PolarHBondContact OE2-NH1 3.47Å; E216-R218 IonicContact OE2-NH2 3.96Å; E216-R218 PolarHBondContact OE2-NH2 2.89Å; R218-S261 PolarHBondContact N-O 3.2Å; R218-I262 HydrophobicContact CB-CD1 3.77Å; R218-I262 HydrophobicContact CG-CD1 4.16Å; R218-N263 WeakPolarHBondContact O-CB 3.41Å; R218-N263 PolarHBondContact O-N 3.49Å; R218-N263 PolarHBondContact O-ND2 3.04Å; R218-L416 HydrophobicContact CG-CD1 4.01Å; R218-L416 HydrophobicContact CG-CD2 4.04Å; R218-L424 CarbonylContact C-O 3.39Å; R218-L424 VanDerWaalsContact CA-O 3.26Å; R218-L424 WeakPolarHBondContact CA-O 3.48Å; R218-L424 HydrophobicContact CB-CB 4.04Å
219	F	87.9	Confident	82.9	Confident	25 Å²	25	37.1 Å²	37.1	11%	0.11	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.1	179.6	-56.6	-88.3	0	0	0	107.4	A217 N263 M265 L424 D426 A427 P428 A431	A217-F219 HydrophobicContact CB-CE2 3.89Å; A217-F219 HydrophobicContact CB-CZ 3.9Å; F219-N263 CarbonylContact C-O 3.59Å; F219-N263 WeakPolarHBondContact CA-O 3.37Å; F219-N263 HydrophobicContact CD1-CB 3.73Å; F219-N263 HydrophobicContact CE1-CB 4.09Å; F219-M265 HydrophobicContact CD1-CG 4.48Å; F219-L424 PolarHBondContact N-O 3.42Å; F219-L424 WeakPolarHBondContact O-CA 3.25Å; F219-L424 WeakPolarHBondContact O-CB 3.47Å; F219-L424 WeakPolarHBondContact O-CD2 3.35Å; F219-D426 WeakPolarHBondContact CD2-O 3.15Å; F219-A427 HydrophobicContact CD2-CB 3.92Å; F219-A427 HydrophobicContact CE1-CB 4.34Å; F219-A427 HydrophobicContact CE2-CB 3.46Å; F219-A427 VanDerWaalsContact CE2-CB 3.46Å; F219-A427 HydrophobicContact CZ-CB 3.7Å; F219-P428 HydrophobicContact CD1-CG 4.45Å; F219-A431 HydrophobicContact CE1-CB 4.12Å
220	V	92.6	Very high	85.2	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	94.9	179.5	-178.6	0	0	0	0	107.1	T222 I262 N263 L264 M265 T312 I339 L364 L424	V220-T222 PolarHBondContact O-N 2.96Å; V220-T222 PolarHBondContact O-OG1 2.87Å; V220-I262 HydrophobicContact CG2-CG2 3.93Å; V220-N263 PolarHBondContact N-O 2.95Å; V220-L264 HydrophobicContact CB-CD2 3.76Å; V220-L264 HydrophobicContact CG1-CD2 4.25Å; V220-L264 HydrophobicContact CG2-CD2 3.92Å; V220-M265 PolarHBondContact O-N 3.31Å; V220-T312 HydrophobicContact CG1-CG2 3.75Å; V220-I339 HydrophobicContact CG1-CD1 4.26Å; V220-L364 HydrophobicContact CG1-CD1 4.24Å; V220-L424 HydrophobicContact CG2-CD1 4.3Å; V220-L424 HydrophobicContact CG2-CD2 4.16Å
221	E	90.3	Very high	87.2	Confident	12 Å²	12	23.3 Å²	23.3	6%	0.056	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	120.3	177.9	-64.8	-170.7	137.7	0	0	109.9	V267 H309 Y310 D311 T312	E221-V267 HydrophobicContact CB-CG2 3.67Å; E221-V267 HydrophobicContact CG-CG2 4.08Å; E221-H309 IonicContact OE2-CD2 2.7Å; E221-Y310 CarbonylContact O-C 3.52Å; E221-Y310 WeakPolarHBondContact O-CB 2.93Å; E221-D311 WeakPolarHBondContact CB-OD2 3.28Å; E221-D311 PolarHBondContact N-OD2 2.52Å; E221-D311 PolarHBondContact O-N 3.03Å; E221-T312 PolarHBondContact O-N 2.79Å; E221-T312 VanDerWaalsContact O-N 3.11Å
222	T	91.6	Very high	88.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.9	-166.2	-54.4	0	0	0	0	111.5	V220 L224 M265 V267 T312 I314	V220-T222 PolarHBondContact O-N 2.96Å; V220-T222 PolarHBondContact O-OG1 2.87Å; T222-L224 HydrophobicContact CG2-CD2 4.2Å; T222-L224 HydrophobicContact CG2-CG 4.26Å; T222-M265 WeakPolarHBondContact CA-O 3.17Å; T222-M265 VanDerWaalsContact CB-O 3.31Å; T222-M265 WeakPolarHBondContact CB-O 3.41Å; T222-M265 PolarHBondContact N-O 3.49Å; T222-M265 PolarHBondContact OG1-O 3.15Å; T222-V267 PolarHBondContact O-N 3.03Å; T222-T312 WeakPolarHBondContact CA-O 3.22Å; T222-T312 HydrophobicContact CG2-CG2 4.25Å; T222-I314 HydrophobicContact CG2-CD1 3.78Å; T222-I314 HydrophobicContact CG2-CG1 4.19Å
223	L	93.9	Very high	89.9	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.2	160.6	171.2	63.2	0	0	0	109.6	V225 K268 L270 Q296 Y310 T312 A313 I314	L223-V225 HydrophobicContact CD1-CG2 4.21Å; L223-V225 HydrophobicContact CD2-CG2 3.85Å; L223-V225 HydrophobicContact CG-CG2 3.76Å; L223-K268 HydrophobicContact CD1-CB 3.85Å; L223-K268 HydrophobicContact CD1-CD 4.1Å; L223-K268 HydrophobicContact CD1-CG 3.84Å; L223-K268 VanDerWaalsContact CD1-O 3.32Å; L223-K268 WeakPolarHBondContact CD1-O 3.41Å; L223-L270 HydrophobicContact CD1-CD1 3.98Å; L223-L270 HydrophobicContact CD1-CG 3.77Å; L223-L270 HydrophobicContact CD2-CD1 4.12Å; L223-Q296 HydrophobicContact CD2-CB 4.31Å; L223-Y310 HydrophobicContact CB-CD1 3.85Å; L223-Y310 HydrophobicContact CB-CD2 3.66Å; L223-Y310 HydrophobicContact CB-CE1 3.93Å; L223-Y310 HydrophobicContact CB-CE2 3.74Å; L223-Y310 HydrophobicContact CB-CG 3.71Å; L223-Y310 HydrophobicContact CD2-CE1 3.88Å; L223-Y310 HydrophobicContact CD2-CE2 3.84Å; L223-Y310 VanDerWaalsContact CD2-CZ 3.42Å; L223-Y310 WeakPolarHBondContact CD2-OH 3.43Å; L223-Y310 HydrophobicContact CG-CE1 4.36Å; L223-Y310 HydrophobicContact CG-CE2 4.43Å; L223-T312 PolarHBondContact N-O 2.81Å; L223-A313 HydrophobicContact CB-CB 4.05Å; L223-A313 HydrophobicContact CD2-CB 4.11Å; L223-A313 HydrophobicContact CG-CB 4.36Å; L223-A313 CarbonylContact O-C 3.53Å; L223-A313 WeakPolarHBondContact O-CA 3.36Å; L223-I314 PolarHBondContact O-N 2.84Å
224	L	94.9	Very high	90.3	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.3	171.4	-67.2	166.5	0	0	0	109.8	T222 I242 M246 V266 K268 V269 L270 I314 L360	T222-L224 HydrophobicContact CG2-CD2 4.2Å; T222-L224 HydrophobicContact CG2-CG 4.26Å; L224-I242 HydrophobicContact CB-CG2 3.96Å; L224-I242 HydrophobicContact CD1-CG2 3.6Å; L224-I242 HydrophobicContact CD2-CG2 4.5Å; L224-I242 HydrophobicContact CG-CG2 4.23Å; L224-M246 HydrophobicContact CD1-CB 4.22Å; L224-M246 HydrophobicContact CD1-CG 4.23Å; L224-M246 HydrophobicContact CD1-SD 4.38Å; L224-M246 HydrophobicContact CD2-SD 4.35Å; L224-V266 HydrophobicContact CD1-CB 4.37Å; L224-V266 HydrophobicContact CD1-CG1 3.75Å; L224-V266 HydrophobicContact CD1-CG2 3.62Å; L224-V266 HydrophobicContact CG-CG1 4.34Å; L224-K268 PolarHBondContact N-O 3.37Å; L224-V269 HydrophobicContact CB-CG2 4.3Å; L224-V269 CarbonylContact O-C 3.52Å; L224-V269 VanDerWaalsContact O-CA 3.27Å; L224-V269 WeakPolarHBondContact O-CA 3.21Å; L224-L270 PolarHBondContact O-N 3Å; L224-I314 HydrophobicContact CD2-CB 4Å; L224-I314 HydrophobicContact CD2-CD1 4.35Å; L224-I314 HydrophobicContact CD2-CG2 4.2Å; L224-L360 HydrophobicContact CD2-CD1 4.47Å
225	V	96.6	Very high	90.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.8	179.2	-173.1	0	0	0	0	108.9	L223 L270 V272 F292 W295 I314 L315 L316	L223-V225 HydrophobicContact CD1-CG2 4.21Å; L223-V225 HydrophobicContact CD2-CG2 3.85Å; L223-V225 HydrophobicContact CG-CG2 3.76Å; V225-L270 CarbonylContact C-O 3.52Å; V225-L270 WeakPolarHBondContact CA-O 3.3Å; V225-L270 HydrophobicContact CG1-CB 4.26Å; V225-L270 HydrophobicContact CG2-CB 4.18Å; V225-L270 HydrophobicContact CG2-CD1 4.32Å; V225-V272 HydrophobicContact CG1-CG2 4.36Å; V225-F292 HydrophobicContact CB-CE2 3.94Å; V225-F292 HydrophobicContact CB-CZ 4.21Å; V225-F292 HydrophobicContact CG1-CE2 4.3Å; V225-F292 HydrophobicContact CG2-CE2 3.74Å; V225-F292 HydrophobicContact CG2-CZ 3.91Å; V225-W295 HydrophobicContact CG1-CH2 4.26Å; V225-W295 HydrophobicContact CG1-CZ3 4.08Å; V225-W295 HydrophobicContact CG2-CZ3 4.19Å; V225-I314 PolarHBondContact N-O 3.35Å; V225-L315 HydrophobicContact CB-CD1 4.03Å; V225-L315 HydrophobicContact CG1-CD1 3.8Å; V225-L315 CarbonylContact O-C 3.46Å; V225-L315 WeakPolarHBondContact O-CA 3.48Å; V225-L316 PolarHBondContact O-N 3.36Å
226	A	96.5	Very high	90	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.3	170.8	0	0	0	0	0	109.3	M230 L238 I242 L270 V272	A226-M230 HydrophobicContact CB-CB 3.88Å; A226-M230 HydrophobicContact CB-CG 4.32Å; A226-L238 HydrophobicContact CB-CD1 4.15Å; A226-L238 HydrophobicContact CB-CD2 3.86Å; A226-L238 HydrophobicContact CB-CG 4.37Å; A226-I242 HydrophobicContact CB-CD1 3.55Å; A226-L270 PolarHBondContact N-O 2.87Å; A226-V272 PolarHBondContact O-N 3.49Å
227	D	95.8	Very high	89.4	Confident	15 Å²	15	25.7 Å²	25.7	8%	0.08	17%	0.174	C	C	.	.			trans	-78.7	-179.4	-179.1	78.2	-2.5	0	0	0	113.2	S229 M230 A231 V272 L315 L316 T317	D227-S229 VanDerWaalsContact CG-OG 3.28Å; D227-S229 PolarHBondContact O-N 2.98Å; D227-S229 WeakPolarHBondContact OD1-CB 3.39Å; D227-S229 PolarHBondContact OD1-N 2.94Å; D227-S229 PolarHBondContact OD1-OG 3.47Å; D227-S229 PolarHBondContact OD2-OG 2.79Å; D227-M230 WeakPolarHBondContact O-CB 3.45Å; D227-M230 PolarHBondContact O-N 2.89Å; D227-M230 PolarHBondContact OD1-N 2.91Å; D227-A231 PolarHBondContact O-N 2.92Å; D227-V272 CarbonylContact C-O 3.51Å; D227-V272 VanDerWaalsContact C-O 3.28Å; D227-L315 HydrophobicContact CB-CD1 4.33Å; D227-L316 PolarHBondContact N-O 2.64Å; D227-T317 WeakPolarHBondContact OD2-CB 3.16Å; D227-T317 PolarHBondContact OD2-OG1 2.8Å
228	A	93.6	Very high	89.1	Confident	13 Å²	13	24.5 Å²	24.5	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-31.4	-179.7	0	0	0	0	0	112.9	A231 A232 V272 E275	A228-A231 PolarHBondContact O-N 3.1Å; A228-A232 WeakPolarHBondContact O-CB 3.39Å; A228-A232 PolarHBondContact O-N 3.14Å; A228-V272 WeakPolarHBondContact CA-O 3.35Å; A228-V272 PolarHBondContact N-O 2.7Å; A228-E275 HydrophobicContact CB-CG 3.6Å
229	S	93.7	Very high	88.4	Confident	35 Å²	35	26.3 Å²	26.3	25%	0.245	17%	0.173	C	C	.	.	H	α-helix	trans	-67.6	-40.7	178.1	78.1	0	0	0	0	111.6	D227 A232 F233 R318	D227-S229 VanDerWaalsContact CG-OG 3.28Å; D227-S229 PolarHBondContact O-N 2.98Å; D227-S229 WeakPolarHBondContact OD1-CB 3.39Å; D227-S229 PolarHBondContact OD1-N 2.94Å; D227-S229 PolarHBondContact OD1-OG 3.47Å; D227-S229 PolarHBondContact OD2-OG 2.79Å; S229-A232 PolarHBondContact O-N 2.88Å; S229-F233 WeakPolarHBondContact O-CB 3.19Å; S229-F233 PolarHBondContact O-N 2.9Å; S229-F233 VanDerWaalsContact O-N 3.08Å; S229-R318 WeakPolarHBondContact OG-CB 3.25Å; S229-R318 PolarHBondContact OG-N 3.49Å
230	M	93.5	Very high	87.7	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-44.7	172.8	-71.3	-67.7	-71.6	0	0	111.7	A226 D227 A232 F233 Y234 L238 L316 R318 D351	A226-M230 HydrophobicContact CB-CB 3.88Å; A226-M230 HydrophobicContact CB-CG 4.32Å; D227-M230 WeakPolarHBondContact O-CB 3.45Å; D227-M230 PolarHBondContact O-N 2.89Å; D227-M230 PolarHBondContact OD1-N 2.91Å; M230-A232 VanDerWaalsContact C-N 3.34Å; M230-A232 PolarHBondContact O-N 3.44Å; M230-F233 PolarHBondContact O-N 2.82Å; M230-Y234 HydrophobicContact CE-CD2 3.9Å; M230-Y234 HydrophobicContact CE-CE2 3.66Å; M230-Y234 PolarHBondContact O-N 2.97Å; M230-Y234 HydrophobicContact SD-CD2 4.32Å; M230-Y234 HydrophobicContact SD-CE2 4.01Å; M230-L238 HydrophobicContact CB-CD1 3.9Å; M230-L238 HydrophobicContact CB-CD2 4.36Å; M230-L238 HydrophobicContact CE-CD1 3.8Å; M230-L316 HydrophobicContact CE-CB 4Å; M230-L316 HydrophobicContact CG-CB 4.27Å; M230-L316 VanDerWaalsContact CG-O 3.3Å; M230-L316 WeakPolarHBondContact CG-O 3.42Å; M230-L316 HydrophobicContact SD-CB 4.44Å; M230-R318 HydrophobicContact CG-CG 4.5Å; M230-R318 HydrophobicContact SD-CG 3.72Å; M230-D351 HydrophobicContact CE-CB 3.85Å; M230-D351 HydrophobicContact SD-CB 3.37Å; M230-D351 WeakPolarHBondContact SD-CB 3.45Å
231	A	89.9	Confident	87.1	Confident	19 Å²	19	28.8 Å²	28.8	16%	0.157	19%	0.187	C	C	.	.	H	α-helix	trans	-62.1	-41.3	178.3	0	0	0	0	0	112.2	D227 A228 G235 L238 I271	D227-A231 PolarHBondContact O-N 2.92Å; A228-A231 PolarHBondContact O-N 3.1Å; A231-G235 WeakPolarHBondContact O-CA 3.15Å; A231-G235 PolarHBondContact O-N 3.37Å; A231-L238 HydrophobicContact CB-CD2 4.12Å; A231-I271 HydrophobicContact CB-CG2 4.13Å
232	A	89.4	Confident	86.8	Confident	87 Å²	87	28.3 Å²	28.3	72%	0.719	19%	0.185	S	C	*	.	H	α-helix	trans	-65.9	-39.2	176.6	0	0	0	0	0	112.5	A228 S229 M230	A228-A232 WeakPolarHBondContact O-CB 3.39Å; A228-A232 PolarHBondContact O-N 3.14Å; S229-A232 PolarHBondContact O-N 2.88Å; M230-A232 VanDerWaalsContact C-N 3.34Å; M230-A232 PolarHBondContact O-N 3.44Å
233	F	86.4	Confident	86.1	Confident	77 Å²	77	30 Å²	30	34%	0.338	19%	0.194	S	C	.	.	H	α-helix	trans	-76.2	-52.1	-175.9	-173.4	-94.5	0	0	0	113.2	S229 M230 R318 Q453	S229-F233 WeakPolarHBondContact O-CB 3.19Å; S229-F233 PolarHBondContact O-N 2.9Å; S229-F233 VanDerWaalsContact O-N 3.08Å; M230-F233 PolarHBondContact O-N 2.82Å; F233-R318 HydrophobicContact CB-CG 4.49Å; F233-Q453 HydrophobicContact CE1-CG 4.34Å
234	Y	81.7	Confident	85.1	Confident	16 Å²	16	30.7 Å²	30.7	6%	0.063	20%	0.198	C	C	.	.	H	α-helix	trans	-89.9	-18.2	-174.2	-70.7	-78.5	0	0	0	113.7	M230 A236 D237 L238 H241 D351 L444 Q453	M230-Y234 HydrophobicContact CE-CD2 3.9Å; M230-Y234 HydrophobicContact CE-CE2 3.66Å; M230-Y234 PolarHBondContact O-N 2.97Å; M230-Y234 HydrophobicContact SD-CD2 4.32Å; M230-Y234 HydrophobicContact SD-CE2 4.01Å; Y234-A236 PolarHBondContact O-N 2.01Å; Y234-A236 VanDerWaalsContact O-N 3.12Å; Y234-D237 PolarHBondContact O-N 3.21Å; Y234-L238 HydrophobicContact CD2-CD1 3.91Å; Y234-L238 HydrophobicContact CG-CD1 4.28Å; Y234-H241 HydrophobicContact CD1-CB 4.15Å; Y234-H241 HydrophobicContact CE1-CB 4.25Å; Y234-H241 AromaticContact CE1-CD2 3.85Å; Y234-H241 AromaticContact CE1-CE1 3.91Å; Y234-H241 AromaticContact CE1-CG 3.67Å; Y234-H241 AromaticContact CE1-ND1 3.74Å; Y234-H241 AromaticContact CE1-NE2 3.99Å; Y234-H241 AromaticContact CE2-CD2 3.57Å; Y234-H241 AromaticContact CE2-NE2 3.75Å; Y234-H241 HydrophobicContact CG-CB 4.46Å; Y234-H241 AromaticContact CZ-CD2 3.45Å; Y234-H241 VanDerWaalsContact CZ-CD2 3.45Å; Y234-H241 AromaticContact CZ-CE1 3.64Å; Y234-H241 AromaticContact CZ-CG 3.77Å; Y234-H241 AromaticContact CZ-ND1 3.91Å; Y234-H241 AromaticContact CZ-NE2 3.35Å; Y234-H241 PolarHBondContact OH-CE1 2.94Å; Y234-H241 VanDerWaalsContact OH-CE1 3.29Å; Y234-H241 PolarHBondContact OH-NE2 3.07Å; Y234-H241 VanDerWaalsContact OH-NE2 3.15Å; Y234-D351 VanDerWaalsContact CE2-OD2 3.25Å; Y234-D351 WeakPolarHBondContact CE2-OD2 3.32Å; Y234-D351 PolarHBondContact OH-OD2 3.14Å; Y234-L444 HydrophobicContact CD1-CD1 4.41Å; Y234-Q453 HydrophobicContact CE1-CG 4.08Å
235	G	84.1	Confident	84.5	Confident	37 Å²	37	30.7 Å²	30.7	38%	0.381	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	53.8	-117.7	177.9	0	0	0	0	0	113.1	A231 D237	A231-G235 WeakPolarHBondContact O-CA 3.15Å; A231-G235 PolarHBondContact O-N 3.37Å; G235-D237 VanDerWaalsContact C-N 3.31Å; G235-D237 PolarHBondContact O-N 3.32Å
236	A	74.8	Confident	83.8	Confident	85 Å²	85	30.9 Å²	30.9	70%	0.702	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-70.4	-25.2	-179.1	0	0	0	0	0	113.5	Y234	Y234-A236 PolarHBondContact O-N 2.01Å; Y234-A236 VanDerWaalsContact O-N 3.12Å
237	D	74.4	Confident	82.7	Confident	80 Å²	80	31.4 Å²	31.4	43%	0.428	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-87.6	-6.2	-176	-66.7	-46.9	0	0	0	113.4	Y234 G235 Q239 N240 H241 L444	Y234-D237 PolarHBondContact O-N 3.21Å; G235-D237 VanDerWaalsContact C-N 3.31Å; G235-D237 PolarHBondContact O-N 3.32Å; D237-Q239 VanDerWaalsContact C-N 3.26Å; D237-Q239 PolarHBondContact O-N 2.84Å; D237-N240 PolarHBondContact O-N 2.96Å; D237-H241 PolarHBondContact O-N 3.23Å; D237-L444 HydrophobicContact CB-CD1 3.88Å
238	L	80.1	Confident	81.8	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-53	-44.5	-176.7	176.5	58.4	0	0	0	112.4	A226 M230 A231 Y234 N240 H241 I242 I271	A226-L238 HydrophobicContact CB-CD1 4.15Å; A226-L238 HydrophobicContact CB-CD2 3.86Å; A226-L238 HydrophobicContact CB-CG 4.37Å; M230-L238 HydrophobicContact CB-CD1 3.9Å; M230-L238 HydrophobicContact CB-CD2 4.36Å; M230-L238 HydrophobicContact CE-CD1 3.8Å; A231-L238 HydrophobicContact CB-CD2 4.12Å; Y234-L238 HydrophobicContact CD2-CD1 3.91Å; Y234-L238 HydrophobicContact CG-CD1 4.28Å; L238-N240 VanDerWaalsContact C-N 3.33Å; L238-N240 PolarHBondContact O-N 3.16Å; L238-H241 WeakPolarHBondContact O-CB 3.31Å; L238-H241 PolarHBondContact O-N 3.33Å; L238-I242 HydrophobicContact CD1-CD1 3.77Å; L238-I242 HydrophobicContact CD1-CG1 3.93Å; L238-I242 HydrophobicContact CD2-CD1 4.43Å; L238-I242 HydrophobicContact CG-CD1 3.79Å; L238-I242 HydrophobicContact CG-CG1 4.38Å; L238-I242 VanDerWaalsContact O-CG1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.46Å; L238-I242 PolarHBondContact O-N 2.8Å; L238-I271 HydrophobicContact CD2-CD1 4.22Å; L238-I271 HydrophobicContact CD2-CG1 4.25Å; L238-I271 HydrophobicContact CD2-CG2 3.73Å
239	Q	75.3	Confident	81.3	Confident	49 Å²	49	31.2 Å²	31.2	23%	0.229	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-43.4	-179.1	-177.5	-175.8	-35.3	0	0	111.5	I80 D237 H241 L243	I80-Q239 HydrophobicContact CD1-CG 4.04Å; I80-Q239 VanDerWaalsContact CD1-NE2 3.27Å; D237-Q239 VanDerWaalsContact C-N 3.26Å; D237-Q239 PolarHBondContact O-N 2.84Å; Q239-H241 VanDerWaalsContact C-N 3.33Å; Q239-L243 HydrophobicContact CG-CD1 4.25Å; Q239-L243 VanDerWaalsContact O-CG 3.29Å; Q239-L243 WeakPolarHBondContact O-CG 3.46Å; Q239-L243 PolarHBondContact O-N 3.27Å
240	N	72.8	Confident	80.7	Confident	78 Å²	78	29.7 Å²	29.7	42%	0.417	19%	0.19	S	C	.	.	H	α-helix	trans	-68	-37.3	179	-67.3	-19.3	0	0	0	111.1	D237 L238 T244 L444	D237-N240 PolarHBondContact O-N 2.96Å; L238-N240 VanDerWaalsContact C-N 3.33Å; L238-N240 PolarHBondContact O-N 3.16Å; N240-T244 WeakPolarHBondContact O-CB 3.49Å; N240-T244 PolarHBondContact O-N 3.05Å; N240-T244 PolarHBondContact O-OG1 3.44Å; N240-L444 HydrophobicContact CB-CD2 4.49Å
241	H	79.9	Confident	79.9	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.7	-55.6	175.6	-174.4	61.8	0	0	0	111.5	Y234 D237 L238 Q239 L243 T244 L245 D351 L444 Y445	Y234-H241 HydrophobicContact CD1-CB 4.15Å; Y234-H241 HydrophobicContact CE1-CB 4.25Å; Y234-H241 AromaticContact CE1-CD2 3.85Å; Y234-H241 AromaticContact CE1-CE1 3.91Å; Y234-H241 AromaticContact CE1-CG 3.67Å; Y234-H241 AromaticContact CE1-ND1 3.74Å; Y234-H241 AromaticContact CE1-NE2 3.99Å; Y234-H241 AromaticContact CE2-CD2 3.57Å; Y234-H241 AromaticContact CE2-NE2 3.75Å; Y234-H241 HydrophobicContact CG-CB 4.46Å; Y234-H241 AromaticContact CZ-CD2 3.45Å; Y234-H241 VanDerWaalsContact CZ-CD2 3.45Å; Y234-H241 AromaticContact CZ-CE1 3.64Å; Y234-H241 AromaticContact CZ-CG 3.77Å; Y234-H241 AromaticContact CZ-ND1 3.91Å; Y234-H241 AromaticContact CZ-NE2 3.35Å; Y234-H241 PolarHBondContact OH-CE1 2.94Å; Y234-H241 VanDerWaalsContact OH-CE1 3.29Å; Y234-H241 PolarHBondContact OH-NE2 3.07Å; Y234-H241 VanDerWaalsContact OH-NE2 3.15Å; D237-H241 PolarHBondContact O-N 3.23Å; L238-H241 WeakPolarHBondContact O-CB 3.31Å; L238-H241 PolarHBondContact O-N 3.33Å; Q239-H241 VanDerWaalsContact C-N 3.33Å; H241-L243 VanDerWaalsContact C-N 3.31Å; H241-L243 PolarHBondContact O-N 3.03Å; H241-T244 WeakPolarHBondContact O-CB 3.17Å; H241-T244 PolarHBondContact O-N 3.45Å; H241-L245 WeakPolarHBondContact O-CG 3.4Å; H241-L245 PolarHBondContact O-N 2.93Å; H241-D351 IonicContact CD2-OD1 3.75Å; H241-D351 IonicContact CE1-OD1 3.9Å; H241-D351 IonicContact NE2-OD1 3.15Å; H241-D351 PolarHBondContact NE2-OD1 3.32Å; H241-D351 IonicContact NE2-OD2 2.73Å; H241-L444 HydrophobicContact CB-CD2 3.79Å; H241-Y445 AromaticContact ND1-CE1 3.69Å; H241-Y445 AromaticContact ND1-CZ 3.6Å; H241-Y445 PolarHBondContact ND1-OH 2.66Å
242	I	83.7	Confident	79.5	Confident	2 Å²	2	35 Å²	35	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-56	-45.6	-179	-65.7	168.1	0	0	0	111.3	L224 A226 L238 T244 L245 M246 V269 L316	L224-I242 HydrophobicContact CB-CG2 3.96Å; L224-I242 HydrophobicContact CD1-CG2 3.6Å; L224-I242 HydrophobicContact CD2-CG2 4.5Å; L224-I242 HydrophobicContact CG-CG2 4.23Å; A226-I242 HydrophobicContact CB-CD1 3.55Å; L238-I242 HydrophobicContact CD1-CD1 3.77Å; L238-I242 HydrophobicContact CD1-CG1 3.93Å; L238-I242 HydrophobicContact CD2-CD1 4.43Å; L238-I242 HydrophobicContact CG-CD1 3.79Å; L238-I242 HydrophobicContact CG-CG1 4.38Å; L238-I242 VanDerWaalsContact O-CG1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.46Å; L238-I242 PolarHBondContact O-N 2.8Å; I242-T244 VanDerWaalsContact C-N 3.32Å; I242-T244 PolarHBondContact O-N 2.78Å; I242-L245 PolarHBondContact O-N 3.38Å; I242-M246 PolarHBondContact O-N 2.88Å; I242-M246 VanDerWaalsContact O-N 3.13Å; I242-V269 HydrophobicContact CD1-CG1 4.32Å; I242-L316 HydrophobicContact CB-CD1 4.38Å; I242-L316 HydrophobicContact CG1-CD1 3.82Å; I242-L316 HydrophobicContact CG2-CD1 4.12Å
243	L	76.8	Confident	79.5	Confident	35 Å²	35	30.9 Å²	30.9	18%	0.183	17%	0.173	C	C	.	.	H	α-helix	trans	-67.7	-32.7	179.9	-66.4	175.8	0	0	0	112.3	F73 Q239 H241 M246 S247	F73-L243 HydrophobicContact CE2-CD1 4.47Å; Q239-L243 HydrophobicContact CG-CD1 4.25Å; Q239-L243 VanDerWaalsContact O-CG 3.29Å; Q239-L243 WeakPolarHBondContact O-CG 3.46Å; Q239-L243 PolarHBondContact O-N 3.27Å; H241-L243 VanDerWaalsContact C-N 3.31Å; H241-L243 PolarHBondContact O-N 3.03Å; L243-M246 PolarHBondContact O-N 2.88Å; L243-S247 PolarHBondContact O-N 3.06Å
244	T	73.4	Confident	79.2	Confident	15 Å²	15	31.4 Å²	31.4	9%	0.092	18%	0.175	C	C	.	.	H	α-helix	trans	-69.6	-43.9	176.2	-54.6	0	0	0	0	111.3	N240 H241 I242 M246 S247 V248 L354 P439 M442 Y445	N240-T244 WeakPolarHBondContact O-CB 3.49Å; N240-T244 PolarHBondContact O-N 3.05Å; N240-T244 PolarHBondContact O-OG1 3.44Å; H241-T244 WeakPolarHBondContact O-CB 3.17Å; H241-T244 PolarHBondContact O-N 3.45Å; I242-T244 VanDerWaalsContact C-N 3.32Å; I242-T244 PolarHBondContact O-N 2.78Å; T244-M246 VanDerWaalsContact C-N 3.26Å; T244-M246 PolarHBondContact O-N 2.92Å; T244-S247 PolarHBondContact O-N 3Å; T244-V248 PolarHBondContact O-N 2.95Å; T244-L354 HydrophobicContact CG2-CD1 3.9Å; T244-P439 HydrophobicContact CG2-CB 4.13Å; T244-P439 HydrophobicContact CG2-CG 4.41Å; T244-M442 HydrophobicContact CG2-SD 4.39Å; T244-Y445 WeakPolarHBondContact CB-OH 2.94Å; T244-Y445 HydrophobicContact CG2-CD2 4.32Å; T244-Y445 HydrophobicContact CG2-CE2 3.41Å; T244-Y445 VanDerWaalsContact CG2-CE2 3.41Å
245	L	81.6	Confident	79.4	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-55.1	-46	174	-62.9	-176.7	0	0	0	111.1	H241 I242 S247 V248 A249 L316 G353 L354 A356 A357	H241-L245 WeakPolarHBondContact O-CG 3.4Å; H241-L245 PolarHBondContact O-N 2.93Å; I242-L245 PolarHBondContact O-N 3.38Å; L245-S247 PolarHBondContact O-N 2.89Å; L245-V248 PolarHBondContact O-N 2.87Å; L245-A249 PolarHBondContact O-N 3.29Å; L245-L316 HydrophobicContact CD1-CD1 4.22Å; L245-L316 HydrophobicContact CD1-CD2 4.27Å; L245-G353 WeakPolarHBondContact CD2-O 3.39Å; L245-L354 HydrophobicContact CD2-CD1 4.28Å; L245-A356 HydrophobicContact CD1-CB 3.88Å; L245-A356 HydrophobicContact CD2-CB 4.13Å; L245-A357 HydrophobicContact CB-CB 4.33Å; L245-A357 HydrophobicContact CD2-CB 4.11Å; L245-A357 WeakPolarHBondContact O-CB 2.93Å
246	M	82.5	Confident	79.6	Confident	4 Å²	4	32.6 Å²	32.6	2%	0.02	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-38.9	179.9	-166	66.3	-164	0	0	112.6	L224 I242 L243 T244 A249 A250 L264 V266 L360	L224-M246 HydrophobicContact CD1-CB 4.22Å; L224-M246 HydrophobicContact CD1-CG 4.23Å; L224-M246 HydrophobicContact CD1-SD 4.38Å; L224-M246 HydrophobicContact CD2-SD 4.35Å; I242-M246 PolarHBondContact O-N 2.88Å; I242-M246 VanDerWaalsContact O-N 3.13Å; L243-M246 PolarHBondContact O-N 2.88Å; T244-M246 VanDerWaalsContact C-N 3.26Å; T244-M246 PolarHBondContact O-N 2.92Å; M246-A249 PolarHBondContact O-N 2.78Å; M246-A250 VanDerWaalsContact O-CB 3.28Å; M246-A250 WeakPolarHBondContact O-CB 3.26Å; M246-A250 PolarHBondContact O-N 2.99Å; M246-L264 HydrophobicContact CE-CB 3.27Å; M246-L264 HydrophobicContact CE-CD1 3.48Å; M246-L264 VanDerWaalsContact CE-CD1 3.48Å; M246-L264 HydrophobicContact CE-CG 3.98Å; M246-V266 HydrophobicContact CB-CG2 4.38Å; M246-V266 HydrophobicContact CG-CG2 3.58Å; M246-V266 HydrophobicContact SD-CG2 4.47Å; M246-L360 HydrophobicContact SD-CD1 4.4Å; M246-L360 HydrophobicContact SD-CD2 4.17Å
247	S	74.3	Confident	80.5	Confident	10 Å²	10	29.2 Å²	29.2	7%	0.07	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-45.3	175.8	-174	0	0	0	0	111.7	L243 T244 L245 A250 R251 P435	L243-S247 PolarHBondContact O-N 3.06Å; T244-S247 PolarHBondContact O-N 3Å; L245-S247 PolarHBondContact O-N 2.89Å; S247-A250 PolarHBondContact O-N 3.4Å; S247-R251 WeakPolarHBondContact O-CG 3.48Å; S247-R251 PolarHBondContact O-N 2.9Å; S247-P435 PolarHBondContact OG-O 3.3Å
248	V	75.8	Confident	81.4	Confident	24 Å²	24	25.4 Å²	25.4	15%	0.145	12%	0.124	C	C	.	.	H	α-helix	trans	-62.4	-48.7	176.8	173.3	0	0	0	0	110.7	T244 L245 A250 R251 I252 L354 A357 P439	T244-V248 PolarHBondContact O-N 2.95Å; L245-V248 PolarHBondContact O-N 2.87Å; V248-A250 VanDerWaalsContact C-N 3.32Å; V248-A250 PolarHBondContact O-N 2.93Å; V248-R251 WeakPolarHBondContact O-CB 2.98Å; V248-R251 PolarHBondContact O-N 3.47Å; V248-R251 VanDerWaalsContact O-N 3.16Å; V248-I252 HydrophobicContact CG1-CD1 4.33Å; V248-I252 WeakPolarHBondContact O-CG1 3.47Å; V248-I252 PolarHBondContact O-N 3.12Å; V248-I252 VanDerWaalsContact O-N 3.13Å; V248-L354 HydrophobicContact CG2-CD1 4.13Å; V248-A357 HydrophobicContact CB-CB 3.67Å; V248-A357 HydrophobicContact CG1-CB 3.59Å; V248-P439 HydrophobicContact CG2-CG 4.17Å
249	A	84.1	Confident	82	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.6	-44.1	177.9	0	0	0	0	0	112	L245 M246 R251 I252 Y253 L264 L360 A361	L245-A249 PolarHBondContact O-N 3.29Å; M246-A249 PolarHBondContact O-N 2.78Å; A249-R251 VanDerWaalsContact C-N 3.33Å; A249-R251 PolarHBondContact O-N 3.19Å; A249-I252 WeakPolarHBondContact O-CB 3.12Å; A249-I252 PolarHBondContact O-N 3.24Å; A249-I252 VanDerWaalsContact O-N 3.09Å; A249-Y253 WeakPolarHBondContact O-CD2 3.34Å; A249-Y253 PolarHBondContact O-N 2.8Å; A249-L264 HydrophobicContact CB-CD1 4.45Å; A249-L360 HydrophobicContact CB-CD2 3.64Å; A249-A361 HydrophobicContact CB-CB 4.24Å
250	A	80.6	Confident	82.9	Confident	3 Å²	3	27.4 Å²	27.4	3%	0.025	13%	0.133	C	C	.	.	H	α-helix	trans	-64.8	-34.7	178.2	0	0	0	0	0	113.1	M246 S247 V248 I252 Y253 K254 L264 L434	M246-A250 VanDerWaalsContact O-CB 3.28Å; M246-A250 WeakPolarHBondContact O-CB 3.26Å; M246-A250 PolarHBondContact O-N 2.99Å; S247-A250 PolarHBondContact O-N 3.4Å; V248-A250 VanDerWaalsContact C-N 3.32Å; V248-A250 PolarHBondContact O-N 2.93Å; A250-I252 VanDerWaalsContact C-N 3.32Å; A250-I252 PolarHBondContact O-N 3.46Å; A250-Y253 PolarHBondContact O-N 3.23Å; A250-K254 VanDerWaalsContact O-CG 3.29Å; A250-K254 WeakPolarHBondContact O-CG 3.35Å; A250-K254 PolarHBondContact O-N 3.04Å; A250-L264 HydrophobicContact CB-CB 4.09Å; A250-L264 HydrophobicContact CB-CD1 3.99Å; A250-L264 HydrophobicContact CB-CG 4.14Å; A250-L434 HydrophobicContact CB-CD1 3.06Å
251	R	76.2	Confident	83.7	Confident	113 Å²	113	24.4 Å²	24.4	43%	0.426	12%	0.118	S	C	.	.	H	α-helix	trans	-61.3	-40.3	170.8	-73.8	172.8	61.2	170.2	-5	111.6	S247 V248 A249 Y253 K254 H255	S247-R251 WeakPolarHBondContact O-CG 3.48Å; S247-R251 PolarHBondContact O-N 2.9Å; V248-R251 WeakPolarHBondContact O-CB 2.98Å; V248-R251 PolarHBondContact O-N 3.47Å; V248-R251 VanDerWaalsContact O-N 3.16Å; A249-R251 VanDerWaalsContact C-N 3.33Å; A249-R251 PolarHBondContact O-N 3.19Å; R251-Y253 VanDerWaalsContact C-N 3.34Å; R251-Y253 PolarHBondContact O-N 2.73Å; R251-K254 WeakPolarHBondContact O-CB 3.21Å; R251-K254 PolarHBondContact O-N 3.03Å; R251-H255 PolarHBondContact O-N 3.27Å
252	I	81.8	Confident	84.2	Confident	17 Å²	17	24.4 Å²	24.4	9%	0.087	12%	0.118	C	C	.	.	H	α-helix	trans	-61.6	-43.4	175.5	-62.5	166.8	0	0	0	110.5	V248 A249 A250 K254 H255 A361 M390 W404	V248-I252 HydrophobicContact CG1-CD1 4.33Å; V248-I252 WeakPolarHBondContact O-CG1 3.47Å; V248-I252 PolarHBondContact O-N 3.12Å; V248-I252 VanDerWaalsContact O-N 3.13Å; A249-I252 WeakPolarHBondContact O-CB 3.12Å; A249-I252 PolarHBondContact O-N 3.24Å; A249-I252 VanDerWaalsContact O-N 3.09Å; A250-I252 VanDerWaalsContact C-N 3.32Å; A250-I252 PolarHBondContact O-N 3.46Å; I252-K254 VanDerWaalsContact C-N 3.26Å; I252-K254 PolarHBondContact O-N 3.01Å; I252-H255 WeakPolarHBondContact O-CB 3.34Å; I252-H255 PolarHBondContact O-N 2.97Å; I252-A361 HydrophobicContact CD1-CB 4.21Å; I252-A361 HydrophobicContact CG2-CB 4.46Å; I252-M390 HydrophobicContact CD1-SD 4.3Å; I252-M390 HydrophobicContact CG2-CG 4.45Å; I252-M390 HydrophobicContact CG2-SD 4.18Å; I252-W404 HydrophobicContact CG2-CZ2 3.8Å; I252-W404 PolarHBondContact O-NE1 2.74Å
253	Y	88.6	Confident	84.2	Confident	1 Å²	1	25.7 Å²	25.7	0%	0.004	13%	0.125	C	C	.	.	H	α-helix	trans	-69.8	-18.4	176.7	-86.6	-84.7	0	0	0	114.7	A249 A250 R251 H255 I258 I262 L264 A361 L364 G365 L368 M370 W404	A249-Y253 WeakPolarHBondContact O-CD2 3.34Å; A249-Y253 PolarHBondContact O-N 2.8Å; A250-Y253 PolarHBondContact O-N 3.23Å; R251-Y253 VanDerWaalsContact C-N 3.34Å; R251-Y253 PolarHBondContact O-N 2.73Å; Y253-H255 VanDerWaalsContact C-N 3.32Å; Y253-I258 HydrophobicContact CD1-CD1 3.4Å; Y253-I258 HydrophobicContact CE1-CD1 3.71Å; Y253-I258 HydrophobicContact CG-CD1 4.37Å; Y253-I262 HydrophobicContact CD1-CB 4.14Å; Y253-I262 HydrophobicContact CD1-CG1 4.4Å; Y253-I262 HydrophobicContact CD1-CG2 3.83Å; Y253-I262 HydrophobicContact CG-CG2 4.35Å; Y253-L264 HydrophobicContact CD2-CD1 3.73Å; Y253-L264 HydrophobicContact CD2-CD2 4.38Å; Y253-L264 HydrophobicContact CD2-CG 4.36Å; Y253-L264 HydrophobicContact CE2-CD1 4.29Å; Y253-L264 HydrophobicContact CG-CD1 4.28Å; Y253-L264 HydrophobicContact CG-CD2 4.3Å; Y253-L264 HydrophobicContact CG-CG 4.44Å; Y253-A361 HydrophobicContact CE2-CB 3.99Å; Y253-A361 PolarHBondContact OH-O 2.68Å; Y253-L364 HydrophobicContact CD2-CD2 4.48Å; Y253-L364 HydrophobicContact CE2-CB 4.31Å; Y253-L364 HydrophobicContact CE2-CD2 3.78Å; Y253-L364 HydrophobicContact CE2-CG 4.24Å; Y253-L364 WeakPolarHBondContact OH-CB 3.24Å; Y253-L364 WeakPolarHBondContact OH-CG 3.43Å; Y253-G365 WeakPolarHBondContact OH-CA 3.03Å; Y253-G365 PolarHBondContact OH-N 3.21Å; Y253-L368 HydrophobicContact CE1-CD1 3.58Å; Y253-M370 HydrophobicContact CE1-CE 4.28Å; Y253-W404 HydrophobicContact CD1-CH2 4.43Å; Y253-W404 AromaticContact CD1-CZ2 3.94Å; Y253-W404 HydrophobicContact CD1-CZ2 3.94Å; Y253-W404 HydrophobicContact CD2-CZ2 4.04Å; Y253-W404 AromaticContact CE1-CH2 3.78Å; Y253-W404 HydrophobicContact CE1-CH2 3.78Å; Y253-W404 AromaticContact CE1-CZ2 3.76Å; Y253-W404 HydrophobicContact CE1-CZ2 3.76Å; Y253-W404 AromaticContact CE2-CH2 3.98Å; Y253-W404 HydrophobicContact CE2-CH2 3.98Å; Y253-W404 AromaticContact CE2-CZ2 3.89Å; Y253-W404 HydrophobicContact CE2-CZ2 3.89Å; Y253-W404 HydrophobicContact CG-CZ2 4.08Å; Y253-W404 AromaticContact CZ-CH2 3.54Å; Y253-W404 AromaticContact CZ-CZ2 3.74Å
254	K	81.5	Confident	84.7	Confident	89 Å²	89	24.5 Å²	24.5	39%	0.387	12%	0.118	S	C	.	.	H	α-helix	trans	-79.8	-14.1	173.1	-73.6	-72.2	-179.9	179.2	0	113.4	A250 R251 I252 N263	A250-K254 VanDerWaalsContact O-CG 3.29Å; A250-K254 WeakPolarHBondContact O-CG 3.35Å; A250-K254 PolarHBondContact O-N 3.04Å; R251-K254 WeakPolarHBondContact O-CB 3.21Å; R251-K254 PolarHBondContact O-N 3.03Å; I252-K254 VanDerWaalsContact C-N 3.26Å; I252-K254 PolarHBondContact O-N 3.01Å; K254-N263 PolarHBondContact NZ-OD1 2.02Å
255	H	85.9	Confident	85	Confident	49 Å²	49	25.1 Å²	25.1	23%	0.227	12%	0.12	C	C	.	.	S	Bend	trans	-65.8	132.8	-176.8	-166.5	-83.6	0	0	0	111.6	R251 I252 Y253 S257 I258 T401 P403	R251-H255 PolarHBondContact O-N 3.27Å; I252-H255 WeakPolarHBondContact O-CB 3.34Å; I252-H255 PolarHBondContact O-N 2.97Å; Y253-H255 VanDerWaalsContact C-N 3.32Å; H255-S257 VanDerWaalsContact ND1-CB 3.33Å; H255-S257 WeakPolarHBondContact ND1-CB 3.37Å; H255-S257 PolarHBondContact ND1-N 3.2Å; H255-S257 PolarHBondContact ND1-OG 3.15Å; H255-S257 PolarHBondContact O-N 3.19Å; H255-I258 WeakPolarHBondContact O-CG2 3.28Å; H255-I258 PolarHBondContact O-N 3.33Å; H255-T401 PolarHBondContact CE1-O 3Å; H255-T401 PolarHBondContact NE2-O 3.38Å; H255-P403 HydrophobicContact CB-CG 3.75Å; H255-P403 VanDerWaalsContact CE1-CD 3.48Å; H255-P403 WeakPolarHBondContact CE1-CD 3.48Å; H255-P403 VanDerWaalsContact CG-CG 3.46Å; H255-P403 VanDerWaalsContact ND1-CD 3.32Å; H255-P403 WeakPolarHBondContact ND1-CD 3.25Å
256	P	88.5	Confident	85.1	Confident	29 Å²	29	25.9 Å²	25.9	19%	0.188	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-61.6	-20.7	-173.5	24.2	-36.5	0	0	0	114.4	I258 K259 P557 Y563	P256-I258 PolarHBondContact O-N 3.28Å; P256-I258 VanDerWaalsContact O-N 3.13Å; P256-K259 PolarHBondContact O-N 3.07Å; P256-P557 HydrophobicContact CB-CB 4.41Å; P256-P557 HydrophobicContact CB-CG 4.08Å; P256-Y563 HydrophobicContact CB-CD2 4.37Å; P256-Y563 HydrophobicContact CB-CE2 4.41Å
257	S	92	Very high	85.1	Confident	13 Å²	13	26 Å²	26	9%	0.091	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-59.3	-22.3	176.9	67.6	0	0	0	0	113.9	H255 K259 P403 W404 A409	H255-S257 VanDerWaalsContact ND1-CB 3.33Å; H255-S257 WeakPolarHBondContact ND1-CB 3.37Å; H255-S257 PolarHBondContact ND1-N 3.2Å; H255-S257 PolarHBondContact ND1-OG 3.15Å; H255-S257 PolarHBondContact O-N 3.19Å; S257-K259 PolarHBondContact O-N 2.76Å; S257-P403 WeakPolarHBondContact OG-CD 3.36Å; S257-W404 WeakPolarHBondContact OG-CB 3.45Å; S257-W404 PolarHBondContact OG-N 2.82Å; S257-A409 WeakPolarHBondContact O-CB 2.98Å
258	I	93.6	Very high	85.4	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-74.8	-11.3	175.8	-147.8	178.7	0	0	0	113	Y253 H255 P256 N260 M370 W404 L412	Y253-I258 HydrophobicContact CD1-CD1 3.4Å; Y253-I258 HydrophobicContact CE1-CD1 3.71Å; Y253-I258 HydrophobicContact CG-CD1 4.37Å; H255-I258 WeakPolarHBondContact O-CG2 3.28Å; H255-I258 PolarHBondContact O-N 3.33Å; P256-I258 PolarHBondContact O-N 3.28Å; P256-I258 VanDerWaalsContact O-N 3.13Å; I258-N260 HydrophobicContact CG2-CB 4.46Å; I258-N260 WeakPolarHBondContact CG2-O 3.38Å; I258-N260 PolarHBondContact O-N 3.4Å; I258-N260 VanDerWaalsContact O-N 3.1Å; I258-N260 PolarHBondContact O-ND2 3.49Å; I258-M370 HydrophobicContact CD1-CE 4.1Å; I258-M370 HydrophobicContact CG1-CE 4.46Å; I258-W404 HydrophobicContact CB-CB 4.29Å; I258-W404 HydrophobicContact CB-CD2 4.3Å; I258-W404 HydrophobicContact CB-CG 3.78Å; I258-W404 HydrophobicContact CD1-CD2 3.86Å; I258-W404 HydrophobicContact CD1-CE3 4.39Å; I258-W404 HydrophobicContact CD1-CG 4.27Å; I258-W404 HydrophobicContact CD1-CH2 4.32Å; I258-W404 HydrophobicContact CD1-CZ2 3.77Å; I258-W404 HydrophobicContact CG1-CB 4.34Å; I258-W404 HydrophobicContact CG1-CD2 3.75Å; I258-W404 HydrophobicContact CG1-CE3 4.34Å; I258-W404 HydrophobicContact CG1-CG 3.73Å; I258-L412 HydrophobicContact CD1-CD2 3.77Å; I258-L412 HydrophobicContact CG1-CD2 3.76Å
259	K	93.8	Very high	85.9	Confident	89 Å²	89	24.8 Å²	24.8	39%	0.387	12%	0.118	S	C	.	.			trans	56.2	20.6	178	-57	-165.6	174.7	-165	0	115.9	P256 S257 A409 E551 Y563 R568	P256-K259 PolarHBondContact O-N 3.07Å; S257-K259 PolarHBondContact O-N 2.76Å; K259-A409 HydrophobicContact CB-CB 4.17Å; K259-A409 HydrophobicContact CD-CB 4.37Å; K259-A409 HydrophobicContact CG-CB 4.03Å; K259-E551 IonicContact NZ-OE1 3.73Å; K259-E551 PolarHBondContact NZ-OE1 3.27Å; K259-Y563 VanDerWaalsContact CA-OH 3.27Å; K259-Y563 WeakPolarHBondContact CA-OH 3.44Å; K259-Y563 WeakPolarHBondContact O-CE1 3.34Å; K259-Y563 PolarHBondContact O-OH 3.01Å; K259-R568 PolarHBondContact O-NH1 3.14Å
260	N	92.9	Very high	86.2	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.027	12%	0.118	C	C	.	.	S	Bend	trans	-143.4	151.6	-177.3	-72.2	-84.6	0	0	0	111.2	I258 I262 L412 T413 L416 R568	I258-N260 HydrophobicContact CG2-CB 4.46Å; I258-N260 WeakPolarHBondContact CG2-O 3.38Å; I258-N260 PolarHBondContact O-N 3.4Å; I258-N260 VanDerWaalsContact O-N 3.1Å; I258-N260 PolarHBondContact O-ND2 3.49Å; N260-I262 HydrophobicContact CB-CD1 4.16Å; N260-I262 HydrophobicContact CB-CG1 4.19Å; N260-I262 PolarHBondContact O-N 2.94Å; N260-L412 HydrophobicContact CB-CD2 3.73Å; N260-L412 HydrophobicContact CB-CG 4.38Å; N260-T413 PolarHBondContact ND2-OG1 2.8Å; N260-L416 HydrophobicContact CB-CD1 4.29Å; N260-L416 WeakPolarHBondContact OD1-CD1 3.18Å; N260-R568 PolarHBondContact OD1-NH1 2.9Å; N260-R568 PolarHBondContact OD1-NH2 2.76Å
261	S	90.4	Very high	86.7	Confident	14 Å²	14	24.7 Å²	24.7	10%	0.098	12%	0.117	C	C	.	.			trans	-89.4	91.9	174.1	-173.6	0	0	0	0	110	R218	R218-S261 PolarHBondContact N-O 3.2Å
262	I	90.1	Very high	87.5	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.7	176.9	-53.1	-55.1	0	0	0	109.6	R218 V220 Y253 N260 L264 L412 L416	R218-I262 HydrophobicContact CB-CD1 3.77Å; R218-I262 HydrophobicContact CG-CD1 4.16Å; V220-I262 HydrophobicContact CG2-CG2 3.93Å; Y253-I262 HydrophobicContact CD1-CB 4.14Å; Y253-I262 HydrophobicContact CD1-CG1 4.4Å; Y253-I262 HydrophobicContact CD1-CG2 3.83Å; Y253-I262 HydrophobicContact CG-CG2 4.35Å; N260-I262 HydrophobicContact CB-CD1 4.16Å; N260-I262 HydrophobicContact CB-CG1 4.19Å; N260-I262 PolarHBondContact O-N 2.94Å; I262-L264 HydrophobicContact CG2-CD2 3.84Å; I262-L412 HydrophobicContact CD1-CD1 4.46Å; I262-L412 HydrophobicContact CD1-CD2 4.13Å; I262-L412 HydrophobicContact CG1-CD2 3.96Å; I262-L416 HydrophobicContact CD1-CD1 4.09Å
263	N	84.8	Confident	87.7	Confident	29 Å²	29	22.2 Å²	22.2	16%	0.155	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	117.3	177.2	-55.7	-89.4	0	0	0	107.5	R218 F219 V220 K254	R218-N263 WeakPolarHBondContact O-CB 3.41Å; R218-N263 PolarHBondContact O-N 3.49Å; R218-N263 PolarHBondContact O-ND2 3.04Å; F219-N263 CarbonylContact C-O 3.59Å; F219-N263 WeakPolarHBondContact CA-O 3.37Å; F219-N263 HydrophobicContact CD1-CB 3.73Å; F219-N263 HydrophobicContact CE1-CB 4.09Å; V220-N263 PolarHBondContact N-O 2.95Å; K254-N263 PolarHBondContact NZ-OD1 2.02Å
264	L	85.6	Confident	87.5	Confident	9 Å²	9	24.8 Å²	24.8	5%	0.047	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	135	175.5	-49.2	-173	0	0	0	110	V220 M246 A249 A250 Y253 I262 L364	V220-L264 HydrophobicContact CB-CD2 3.76Å; V220-L264 HydrophobicContact CG1-CD2 4.25Å; V220-L264 HydrophobicContact CG2-CD2 3.92Å; M246-L264 HydrophobicContact CE-CB 3.27Å; M246-L264 HydrophobicContact CE-CD1 3.48Å; M246-L264 VanDerWaalsContact CE-CD1 3.48Å; M246-L264 HydrophobicContact CE-CG 3.98Å; A249-L264 HydrophobicContact CB-CD1 4.45Å; A250-L264 HydrophobicContact CB-CB 4.09Å; A250-L264 HydrophobicContact CB-CD1 3.99Å; A250-L264 HydrophobicContact CB-CG 4.14Å; Y253-L264 HydrophobicContact CD2-CD1 3.73Å; Y253-L264 HydrophobicContact CD2-CD2 4.38Å; Y253-L264 HydrophobicContact CD2-CG 4.36Å; Y253-L264 HydrophobicContact CE2-CD1 4.29Å; Y253-L264 HydrophobicContact CG-CD1 4.28Å; Y253-L264 HydrophobicContact CG-CD2 4.3Å; Y253-L264 HydrophobicContact CG-CG 4.44Å; I262-L264 HydrophobicContact CG2-CD2 3.84Å; L264-L364 HydrophobicContact CD1-CD2 3.9Å; L264-L364 HydrophobicContact CD2-CD2 3.62Å; L264-L364 HydrophobicContact CG-CD2 4.44Å
265	M	81.1	Confident	87.8	Confident	28 Å²	28	27.7 Å²	27.7	14%	0.138	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	128	-175.6	-63.7	-56.4	-39.5	0	0	110.6	F219 V220 T222 P428	F219-M265 HydrophobicContact CD1-CG 4.48Å; V220-M265 PolarHBondContact O-N 3.31Å; T222-M265 WeakPolarHBondContact CA-O 3.17Å; T222-M265 VanDerWaalsContact CB-O 3.31Å; T222-M265 WeakPolarHBondContact CB-O 3.41Å; T222-M265 PolarHBondContact N-O 3.49Å; T222-M265 PolarHBondContact OG1-O 3.15Å; M265-P428 HydrophobicContact CE-CG 4.46Å; M265-P428 HydrophobicContact CG-CG 4.16Å; M265-P428 HydrophobicContact SD-CG 4.4Å
266	V	83.8	Confident	87.9	Confident	17 Å²	17	32.4 Å²	32.4	10%	0.103	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	113.7	173.4	-175.3	0	0	0	0	109.1	F78 L224 M246 V269	F78-V266 HydrophobicContact CE2-CG1 4.13Å; L224-V266 HydrophobicContact CD1-CB 4.37Å; L224-V266 HydrophobicContact CD1-CG1 3.75Å; L224-V266 HydrophobicContact CD1-CG2 3.62Å; L224-V266 HydrophobicContact CG-CG1 4.34Å; M246-V266 HydrophobicContact CB-CG2 4.38Å; M246-V266 HydrophobicContact CG-CG2 3.58Å; M246-V266 HydrophobicContact SD-CG2 4.47Å; V266-V269 HydrophobicContact CG1-CG2 3.84Å
267	V	81.1	Confident	87.9	Confident	6 Å²	6	37.8 Å²	37.8	4%	0.036	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-41.6	179.7	-178.8	0	0	0	0	111	E221 T222 P307 H309	E221-V267 HydrophobicContact CB-CG2 3.67Å; E221-V267 HydrophobicContact CG-CG2 4.08Å; T222-V267 PolarHBondContact O-N 3.03Å; V267-P307 WeakPolarHBondContact CG1-O 3.27Å; V267-H309 WeakPolarHBondContact CG1-O 3.35Å
268	K	82.1	Confident	87.7	Confident	7 Å²	7	37.9 Å²	37.9	3%	0.03	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	143.9	-173	179.8	-178.5	-66	177.5	0	110.8	L223 L224 L270 E308	L223-K268 HydrophobicContact CD1-CB 3.85Å; L223-K268 HydrophobicContact CD1-CD 4.1Å; L223-K268 HydrophobicContact CD1-CG 3.84Å; L223-K268 VanDerWaalsContact CD1-O 3.32Å; L223-K268 WeakPolarHBondContact CD1-O 3.41Å; L224-K268 PolarHBondContact N-O 3.37Å; K268-L270 HydrophobicContact CD-CD2 4.06Å; K268-L270 HydrophobicContact CD-CG 4.48Å; K268-L270 HydrophobicContact CG-CD2 4.17Å; K268-L270 HydrophobicContact CG-CG 4.49Å; K268-E308 WeakPolarHBondContact CE-OE2 3.46Å; K268-E308 IonicContact NZ-OE2 2.74Å; K268-E308 PolarHBondContact NZ-OE2 3.44Å
269	V	86.6	Confident	87.7	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.1	172.6	-177.4	0	0	0	0	109.4	F78 K79 I80 E81 L224 I242 V266 I271	F78-V269 HydrophobicContact CE2-CG2 3.91Å; F78-V269 HydrophobicContact CZ-CG2 4.01Å; K79-V269 PolarHBondContact O-N 2.04Å; K79-V269 VanDerWaalsContact O-N 3.09Å; I80-V269 WeakPolarHBondContact CA-O 3.47Å; I80-V269 HydrophobicContact CG1-CB 4.31Å; E81-V269 PolarHBondContact N-O 3.25Å; L224-V269 HydrophobicContact CB-CG2 4.3Å; L224-V269 CarbonylContact O-C 3.52Å; L224-V269 VanDerWaalsContact O-CA 3.27Å; L224-V269 WeakPolarHBondContact O-CA 3.21Å; I242-V269 HydrophobicContact CD1-CG1 4.32Å; V266-V269 HydrophobicContact CG1-CG2 3.84Å; V269-I271 HydrophobicContact CG1-CG1 4.22Å
270	L	89.6	Confident	87.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.3	173.7	-59	-179.8	0	0	0	109.5	E81 L223 L224 V225 A226 K268 W295 F299	E81-L270 HydrophobicContact CB-CD2 3.65Å; E81-L270 HydrophobicContact CG-CD2 4.4Å; E81-L270 WeakPolarHBondContact O-CA 3.27Å; L223-L270 HydrophobicContact CD1-CD1 3.98Å; L223-L270 HydrophobicContact CD1-CG 3.77Å; L223-L270 HydrophobicContact CD2-CD1 4.12Å; L224-L270 PolarHBondContact O-N 3Å; V225-L270 CarbonylContact C-O 3.52Å; V225-L270 WeakPolarHBondContact CA-O 3.3Å; V225-L270 HydrophobicContact CG1-CB 4.26Å; V225-L270 HydrophobicContact CG2-CB 4.18Å; V225-L270 HydrophobicContact CG2-CD1 4.32Å; A226-L270 PolarHBondContact N-O 2.87Å; K268-L270 HydrophobicContact CD-CD2 4.06Å; K268-L270 HydrophobicContact CD-CG 4.48Å; K268-L270 HydrophobicContact CG-CD2 4.17Å; K268-L270 HydrophobicContact CG-CG 4.49Å; L270-W295 HydrophobicContact CD1-CH2 3.76Å; L270-W295 HydrophobicContact CD1-CZ3 3.99Å; L270-F299 HydrophobicContact CD1-CB 4.36Å; L270-F299 HydrophobicContact CD1-CD1 4.05Å; L270-F299 HydrophobicContact CD1-CD2 4.1Å; L270-F299 HydrophobicContact CD1-CE1 4.35Å; L270-F299 HydrophobicContact CD1-CE2 4.42Å; L270-F299 HydrophobicContact CD1-CG 3.91Å
271	I	91.3	Very high	87.8	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	113.9	174.1	-59.8	175	0	0	0	107.7	I80 E81 R82 L83 A231 L238 V269 E273	I80-I271 HydrophobicContact CG2-CD1 4.37Å; E81-I271 PolarHBondContact O-N 3.32Å; R82-I271 CarbonylContact C-O 3.28Å; R82-I271 WeakPolarHBondContact CA-O 3.23Å; R82-I271 HydrophobicContact CG-CB 4.27Å; L83-I271 PolarHBondContact N-O 3.11Å; A231-I271 HydrophobicContact CB-CG2 4.13Å; L238-I271 HydrophobicContact CD2-CD1 4.22Å; L238-I271 HydrophobicContact CD2-CG1 4.25Å; L238-I271 HydrophobicContact CD2-CG2 3.73Å; V269-I271 HydrophobicContact CG1-CG1 4.22Å; I271-E273 HydrophobicContact CG2-CG 4.4Å
272	V	91.7	Very high	87.9	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	115.2	175.2	-178.7	0	0	0	0	107.8	L83 V225 A226 D227 A228 D274	L83-V272 HydrophobicContact CD1-CG2 4.38Å; V225-V272 HydrophobicContact CG1-CG2 4.36Å; A226-V272 PolarHBondContact O-N 3.49Å; D227-V272 CarbonylContact C-O 3.51Å; D227-V272 VanDerWaalsContact C-O 3.28Å; A228-V272 WeakPolarHBondContact CA-O 3.35Å; A228-V272 PolarHBondContact N-O 2.7Å; V272-D274 WeakPolarHBondContact CG1-O 3.34Å
273	E	86.4	Confident	87.8	Confident	77 Å²	77	48.2 Å²	48.2	36%	0.36	24%	0.236	S	C	.	.	S	Bend	trans	-92.1	-23.1	178.4	-63.5	-175.6	148.4	0	0	112.3	R82 L83 G85 I271	R82-E273 WeakPolarHBondContact CD-OE1 3.16Å; R82-E273 IonicContact CZ-OE1 2.8Å; R82-E273 IonicContact NE-OE1 3.69Å; R82-E273 IonicContact NH1-OE1 3.58Å; R82-E273 PolarHBondContact NH1-OE1 3.32Å; L83-E273 PolarHBondContact O-N 2.9Å; G85-E273 WeakPolarHBondContact CA-OE2 3.47Å; G85-E273 PolarHBondContact N-OE2 2.78Å; I271-E273 HydrophobicContact CG2-CG 4.4Å
274	D	84.6	Confident	88.1	Confident	54 Å²	54	50.7 Å²	50.7	29%	0.289	25%	0.25	S	C	.	.	S	Bend	trans	-130.7	122.8	179	-178	-27.2	0	0	0	109.3	V272 K276 W277	V272-D274 WeakPolarHBondContact CG1-O 3.34Å; D274-K276 PolarHBondContact O-N 2.67Å; D274-K276 WeakPolarHBondContact OD1-CD 3.23Å; D274-K276 VanDerWaalsContact OD1-CG 3.24Å; D274-K276 WeakPolarHBondContact OD1-CG 3.04Å; D274-K276 PolarHBondContact OD1-N 3.28Å; D274-K276 VanDerWaalsContact OD1-N 3.09Å; D274-K276 VanDerWaalsContact OD2-CD 3.3Å; D274-K276 WeakPolarHBondContact OD2-CD 3.27Å; D274-K276 WeakPolarHBondContact OD2-CE 3.31Å; D274-K276 IonicContact OD2-NZ 2.72Å; D274-K276 PolarHBondContact OD2-NZ 3.49Å; D274-W277 PolarHBondContact O-N 3.44Å
275	E	87.6	Confident	88.3	Confident	151 Å²	151	50.6 Å²	50.6	71%	0.706	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-49.1	-33.1	-176.1	-67.7	178.9	-179.9	0	0	113.1	A228 W277 G278	A228-E275 HydrophobicContact CB-CG 3.6Å; E275-W277 PolarHBondContact O-N 3.45Å; E275-W277 VanDerWaalsContact O-N 3.08Å; E275-G278 PolarHBondContact O-N 2.75Å
276	K	88.7	Confident	88.8	Confident	148 Å²	148	51.2 Å²	51.2	64%	0.643	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-62.1	-20.8	-179	79.1	-163.9	178.1	-150.7	0	114.2	D274	D274-K276 PolarHBondContact O-N 2.67Å; D274-K276 WeakPolarHBondContact OD1-CD 3.23Å; D274-K276 VanDerWaalsContact OD1-CG 3.24Å; D274-K276 WeakPolarHBondContact OD1-CG 3.04Å; D274-K276 PolarHBondContact OD1-N 3.28Å; D274-K276 VanDerWaalsContact OD1-N 3.09Å; D274-K276 VanDerWaalsContact OD2-CD 3.3Å; D274-K276 WeakPolarHBondContact OD2-CD 3.27Å; D274-K276 WeakPolarHBondContact OD2-CE 3.31Å; D274-K276 IonicContact OD2-NZ 2.72Å; D274-K276 PolarHBondContact OD2-NZ 3.49Å
277	W	87.7	Confident	89.2	Confident	141 Å²	141	53.1 Å²	53.1	53%	0.534	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-97.2	-15.4	178.3	-67.2	93.3	0	0	0	112.9	L83 D274 E275 W295	L83-W277 HydrophobicContact CB-CB 3.97Å; D274-W277 PolarHBondContact O-N 3.44Å; E275-W277 PolarHBondContact O-N 3.45Å; E275-W277 VanDerWaalsContact O-N 3.08Å; W277-W295 WeakPolarHBondContact O-CZ2 3.17Å; W277-W295 PolarHBondContact O-NE1 3.48Å; W277-W295 VanDerWaalsContact O-NE1 3.11Å
278	G	89.5	Confident	89.9	Confident	15 Å²	15	52.9 Å²	52.9	16%	0.155	27%	0.272	C	S	.	.	S	Bend	trans	-85.5	177.1	-179.1	0	0	0	0	0	113.9	E275	E275-G278 PolarHBondContact O-N 2.75Å
279	P	92.9	Very high	90.5	Very high	12 Å²	12	53 Å²	53	8%	0.078	27%	0.273	C	S	.	.			trans	-65.9	152	164.9	32	-36.3	0	0	0	110.5	V281 F292 W295 L315	P279-V281 HydrophobicContact CG-CG2 4.4Å; P279-V281 PolarHBondContact O-N 3.2Å; P279-F292 HydrophobicContact CB-CB 4.28Å; P279-F292 HydrophobicContact CB-CD2 4.26Å; P279-F292 HydrophobicContact CG-CD2 3.99Å; P279-W295 HydrophobicContact CB-CB 4.06Å; P279-W295 HydrophobicContact CB-CD2 4.34Å; P279-W295 HydrophobicContact CB-CG 4.05Å; P279-L315 HydrophobicContact CG-CD1 4.15Å; P279-L315 HydrophobicContact CG-CD2 3.96Å
280	E	93.7	Very high	90.9	Very high	148 Å²	148	60.1 Å²	60.1	69%	0.692	30%	0.3	S	S	*	.			trans	-69.5	115.9	170.3	-74.8	177.5	-171.7	0	0	110.1	N291	E280-N291 HydrophobicContact CB-CB 4.38Å; E280-N291 WeakPolarHBondContact CB-ND2 3Å; E280-N291 WeakPolarHBondContact O-CB 3.41Å; E280-N291 PolarHBondContact O-ND2 3.2Å
281	V	94.4	Very high	91.2	Very high	44 Å²	44	61.6 Å²	61.6	27%	0.267	31%	0.308	S	S	.	.			trans	-106.8	132.2	178.5	-176	0	0	0	0	109.4	P279 T288 L315 T317 Q319	P279-V281 HydrophobicContact CG-CG2 4.4Å; P279-V281 PolarHBondContact O-N 3.2Å; V281-T288 HydrophobicContact CB-CG2 4.28Å; V281-T288 HydrophobicContact CG1-CG2 3.91Å; V281-T288 HydrophobicContact CG2-CG2 4.23Å; V281-L315 HydrophobicContact CG2-CD2 4.06Å; V281-T317 HydrophobicContact CG1-CG2 4.31Å; V281-Q319 HydrophobicContact CG1-CB 3.7Å; V281-Q319 HydrophobicContact CG1-CG 3.9Å
282	S	91.9	Very high	91.5	Very high	35 Å²	35	61.5 Å²	61.5	25%	0.245	31%	0.307	C	S	.	.			trans	-137.9	174.6	173.2	97.7	0	0	0	0	111.3	N284 T288	S282-N284 PolarHBondContact O-N 2.83Å; S282-N284 VanDerWaalsContact O-N 3.17Å; S282-N284 PolarHBondContact OG-N 2.86Å; S282-T288 PolarHBondContact N-OG1 3.24Å; S282-T288 PolarHBondContact O-OG1 2.79Å
283	D	89.1	Confident	91.7	Very high	87 Å²	87	61.8 Å²	61.8	47%	0.465	31%	0.309	S	S	.	.	S	Bend	trans	-60	-14.9	170.7	61.9	-9.7	0	0	0	114.2	G285 N320 F321 C322	D283-G285 PolarHBondContact O-N 3.07Å; D283-N320 WeakPolarHBondContact CA-O 3.46Å; D283-F321 CarbonylContact O-C 3.57Å; D283-F321 VanDerWaalsContact O-CA 3.27Å; D283-F321 WeakPolarHBondContact O-CA 3.33Å; D283-C322 HydrophobicContact CB-CB 4.36Å; D283-C322 PolarHBondContact O-N 2.8Å
284	N	90.4	Very high	92.2	Very high	81 Å²	81	61.5 Å²	61.5	43%	0.433	31%	0.31	S	S	.	.			trans	-91.5	96	176.6	-175.2	-36.9	0	0	0	109.3	S282 G286 L287 T288	S282-N284 PolarHBondContact O-N 2.83Å; S282-N284 VanDerWaalsContact O-N 3.17Å; S282-N284 PolarHBondContact OG-N 2.86Å; N284-G286 PolarHBondContact O-N 3.14Å; N284-G286 VanDerWaalsContact O-N 3.16Å; N284-G286 PolarHBondContact OD1-N 2.48Å; N284-L287 HydrophobicContact CB-CB 3.9Å; N284-L287 WeakPolarHBondContact O-CB 3.26Å; N284-L287 PolarHBondContact O-N 2.9Å; N284-L287 PolarHBondContact OD1-N 3.38Å; N284-T288 PolarHBondContact O-N 3.07Å; N284-T288 PolarHBondContact O-OG1 3.12Å
285	G	90.2	Very high	92.7	Very high	7 Å²	7	59.7 Å²	59.7	7%	0.072	30%	0.299	C	S	.	.	H	α-helix	trans	-54.3	-35.8	-178.3	0	0	0	0	0	114	D283 T288 L289	D283-G285 PolarHBondContact O-N 3.07Å; G285-T288 PolarHBondContact O-N 2.98Å; G285-L289 WeakPolarHBondContact O-CB 3.07Å; G285-L289 PolarHBondContact O-N 2.99Å
286	G	90.6	Very high	93	Very high	41 Å²	41	52.6 Å²	52.6	42%	0.423	27%	0.266	S	S	.	.	H	α-helix	trans	-69.3	-36.4	176.3	0	0	0	0	0	113.7	N284 R290	N284-G286 PolarHBondContact O-N 3.14Å; N284-G286 VanDerWaalsContact O-N 3.16Å; N284-G286 PolarHBondContact OD1-N 2.48Å; G286-R290 PolarHBondContact O-N 2.96Å; G286-R290 VanDerWaalsContact O-N 3.15Å
287	L	92.7	Very high	93.2	Very high	58 Å²	58	50.3 Å²	50.3	30%	0.304	25%	0.253	S	S	.	.	H	α-helix	trans	-68.5	-45.9	173.1	178.2	58.5	0	0	0	111	N284 L289 R290 N291	N284-L287 HydrophobicContact CB-CB 3.9Å; N284-L287 WeakPolarHBondContact O-CB 3.26Å; N284-L287 PolarHBondContact O-N 2.9Å; N284-L287 PolarHBondContact OD1-N 3.38Å; L287-L289 VanDerWaalsContact C-N 3.34Å; L287-L289 PolarHBondContact O-N 3.12Å; L287-R290 PolarHBondContact O-N 3Å; L287-N291 WeakPolarHBondContact O-CB 3.49Å; L287-N291 VanDerWaalsContact O-CG 3.26Å; L287-N291 PolarHBondContact O-N 3.5Å
288	T	95.6	Very high	93.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-56.8	-47.1	175.5	-61.3	0	0	0	0	110.9	V281 S282 N284 G285 R290 N291 F292 L315 F321 V348	V281-T288 HydrophobicContact CB-CG2 4.28Å; V281-T288 HydrophobicContact CG1-CG2 3.91Å; V281-T288 HydrophobicContact CG2-CG2 4.23Å; S282-T288 PolarHBondContact N-OG1 3.24Å; S282-T288 PolarHBondContact O-OG1 2.79Å; N284-T288 PolarHBondContact O-N 3.07Å; N284-T288 PolarHBondContact O-OG1 3.12Å; G285-T288 PolarHBondContact O-N 2.98Å; T288-R290 PolarHBondContact O-N 3.43Å; T288-N291 PolarHBondContact O-N 3.28Å; T288-F292 WeakPolarHBondContact O-CB 3.31Å; T288-F292 PolarHBondContact O-N 3.2Å; T288-L315 HydrophobicContact CG2-CD2 4.11Å; T288-F321 HydrophobicContact CG2-CE1 4.09Å; T288-F321 HydrophobicContact CG2-CZ 4.36Å; T288-V348 HydrophobicContact CG2-CB 4.42Å; T288-V348 HydrophobicContact CG2-CG1 4.12Å
289	L	95.7	Very high	93.4	Very high	9 Å²	9	54.1 Å²	54.1	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-54.7	-55.1	175	178.6	64	0	0	0	110.8	G285 L287 N291 F292 C293 V333 C346 V348	G285-L289 WeakPolarHBondContact O-CB 3.07Å; G285-L289 PolarHBondContact O-N 2.99Å; L287-L289 VanDerWaalsContact C-N 3.34Å; L287-L289 PolarHBondContact O-N 3.12Å; L289-N291 VanDerWaalsContact C-N 3.29Å; L289-N291 PolarHBondContact O-N 2.89Å; L289-F292 PolarHBondContact O-N 3.24Å; L289-C293 VanDerWaalsContact CD1-SG 3.6Å; L289-C293 WeakPolarHBondContact O-CB 3.38Å; L289-C293 PolarHBondContact O-N 3.43Å; L289-C293 PolarHBondContact O-SG 2.94Å; L289-V333 HydrophobicContact CD2-CG1 3.93Å; L289-C346 HydrophobicContact CD1-CB 4.23Å; L289-C346 WeakPolarHBondContact CD1-O 3.33Å; L289-V348 HydrophobicContact CB-CG1 4.23Å; L289-V348 HydrophobicContact CB-CG2 4.18Å; L289-V348 HydrophobicContact CD1-CG1 4.07Å
290	R	94.8	Very high	93.3	Very high	153 Å²	153	54.9 Å²	54.9	58%	0.577	27%	0.268	S	S	*	.	H	α-helix	trans	-56.7	-42.8	179.7	-173.4	-172.9	71.8	-176.7	3.8	112.4	G286 L287 T288 N294	G286-R290 PolarHBondContact O-N 2.96Å; G286-R290 VanDerWaalsContact O-N 3.15Å; L287-R290 PolarHBondContact O-N 3Å; T288-R290 PolarHBondContact O-N 3.43Å; R290-N294 WeakPolarHBondContact O-CB 3.2Å; R290-N294 PolarHBondContact O-N 3.46Å; R290-N294 PolarHBondContact O-ND2 2.86Å
291	N	95.9	Very high	93.1	Very high	30 Å²	30	51.1 Å²	51.1	16%	0.16	25%	0.25	C	S	.	.	H	α-helix	trans	-65.8	-45.1	179.7	-71.9	-10.3	0	0	0	111	E280 L287 T288 L289 N294 W295	E280-N291 HydrophobicContact CB-CB 4.38Å; E280-N291 WeakPolarHBondContact CB-ND2 3Å; E280-N291 WeakPolarHBondContact O-CB 3.41Å; E280-N291 PolarHBondContact O-ND2 3.2Å; L287-N291 WeakPolarHBondContact O-CB 3.49Å; L287-N291 VanDerWaalsContact O-CG 3.26Å; L287-N291 PolarHBondContact O-N 3.5Å; T288-N291 PolarHBondContact O-N 3.28Å; L289-N291 VanDerWaalsContact C-N 3.29Å; L289-N291 PolarHBondContact O-N 2.89Å; N291-N294 PolarHBondContact O-N 3.3Å; N291-W295 WeakPolarHBondContact O-CB 3.22Å; N291-W295 PolarHBondContact O-N 2.86Å
292	F	97.6	Very high	92.6	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.8	-48.1	177.7	176.2	-122.1	0	0	0	112.8	V225 P279 T288 L289 N294 W295 Q296 A313 L315 C346 S347 V348	V225-F292 HydrophobicContact CB-CE2 3.94Å; V225-F292 HydrophobicContact CB-CZ 4.21Å; V225-F292 HydrophobicContact CG1-CE2 4.3Å; V225-F292 HydrophobicContact CG2-CE2 3.74Å; V225-F292 HydrophobicContact CG2-CZ 3.91Å; P279-F292 HydrophobicContact CB-CB 4.28Å; P279-F292 HydrophobicContact CB-CD2 4.26Å; P279-F292 HydrophobicContact CG-CD2 3.99Å; T288-F292 WeakPolarHBondContact O-CB 3.31Å; T288-F292 PolarHBondContact O-N 3.2Å; L289-F292 PolarHBondContact O-N 3.24Å; F292-N294 PolarHBondContact O-N 2.93Å; F292-W295 HydrophobicContact CD2-CE3 4.23Å; F292-W295 HydrophobicContact CE2-CE3 4.19Å; F292-W295 HydrophobicContact CE2-CZ3 4.36Å; F292-W295 PolarHBondContact O-N 3.49Å; F292-Q296 HydrophobicContact CE2-CB 4.1Å; F292-Q296 HydrophobicContact CZ-CB 4.32Å; F292-Q296 WeakPolarHBondContact O-CG 3.39Å; F292-Q296 PolarHBondContact O-N 3.33Å; F292-A313 HydrophobicContact CE1-CB 4Å; F292-A313 WeakPolarHBondContact CE1-O 3.37Å; F292-A313 HydrophobicContact CZ-CB 3.78Å; F292-L315 HydrophobicContact CB-CD2 4.09Å; F292-L315 HydrophobicContact CD1-CB 3.7Å; F292-L315 HydrophobicContact CD2-CB 3.89Å; F292-L315 HydrophobicContact CD2-CD1 4.38Å; F292-L315 HydrophobicContact CD2-CD2 4.11Å; F292-L315 HydrophobicContact CD2-CG 4.36Å; F292-L315 HydrophobicContact CE1-CB 3.64Å; F292-L315 HydrophobicContact CE2-CB 3.83Å; F292-L315 HydrophobicContact CE2-CD1 4.35Å; F292-L315 HydrophobicContact CG-CB 3.82Å; F292-L315 HydrophobicContact CG-CD2 4.02Å; F292-L315 HydrophobicContact CG-CG 4.47Å; F292-L315 HydrophobicContact CZ-CB 3.7Å; F292-C346 HydrophobicContact CD1-CB 4.13Å; F292-C346 HydrophobicContact CE1-CB 4.22Å; F292-S347 WeakPolarHBondContact CE1-O 3.37Å; F292-V348 HydrophobicContact CB-CG1 4.15Å; F292-V348 HydrophobicContact CD1-CG1 3.97Å; F292-V348 HydrophobicContact CG-CG1 4.36Å
293	C	96.4	Very high	92.2	Very high	7 Å²	7	56.4 Å²	56.4	5%	0.047	29%	0.286	C	S	.	.	H	α-helix	trans	-56.3	-38.9	176.2	-58	0	0	0	0	111.8	L289 R297 C346	L289-C293 VanDerWaalsContact CD1-SG 3.6Å; L289-C293 WeakPolarHBondContact O-CB 3.38Å; L289-C293 PolarHBondContact O-N 3.43Å; L289-C293 PolarHBondContact O-SG 2.94Å; C293-R297 WeakPolarHBondContact O-CG 3.13Å; C293-C346 HydrophobicContact CB-CB 4.02Å; C293-C346 WeakPolarHBondContact CB-SG 3.49Å; C293-C346 WeakPolarHBondContact SG-CB 3.32Å; C293-C346 CovalentContact SG-SG 1.99Å; C293-C346 PolarHBondContact SG-SG 3.19Å
294	N	95.7	Very high	91.8	Very high	71 Å²	71	55.7 Å²	55.7	38%	0.38	28%	0.282	S	S	.	.	H	α-helix	trans	-70.6	-38.8	176.2	-78.7	-52	0	0	0	112.7	R290 N291 F292 R297	R290-N294 WeakPolarHBondContact O-CB 3.2Å; R290-N294 PolarHBondContact O-N 3.46Å; R290-N294 PolarHBondContact O-ND2 2.86Å; N291-N294 PolarHBondContact O-N 3.3Å; F292-N294 PolarHBondContact O-N 2.93Å; N294-R297 PolarHBondContact OD1-NH2 2.88Å
295	W	95.9	Very high	91.1	Very high	16 Å²	16	62.6 Å²	62.6	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-71	-47	-177.4	178.9	98.3	0	0	0	112.2	L83 V225 L270 W277 P279 N291 F292 R297 R298 F299	L83-W295 HydrophobicContact CD1-CH2 3.93Å; L83-W295 HydrophobicContact CD1-CZ2 3.71Å; V225-W295 HydrophobicContact CG1-CH2 4.26Å; V225-W295 HydrophobicContact CG1-CZ3 4.08Å; V225-W295 HydrophobicContact CG2-CZ3 4.19Å; L270-W295 HydrophobicContact CD1-CH2 3.76Å; L270-W295 HydrophobicContact CD1-CZ3 3.99Å; W277-W295 WeakPolarHBondContact O-CZ2 3.17Å; W277-W295 PolarHBondContact O-NE1 3.48Å; W277-W295 VanDerWaalsContact O-NE1 3.11Å; P279-W295 HydrophobicContact CB-CB 4.06Å; P279-W295 HydrophobicContact CB-CD2 4.34Å; P279-W295 HydrophobicContact CB-CG 4.05Å; N291-W295 WeakPolarHBondContact O-CB 3.22Å; N291-W295 PolarHBondContact O-N 2.86Å; F292-W295 HydrophobicContact CD2-CE3 4.23Å; F292-W295 HydrophobicContact CE2-CE3 4.19Å; F292-W295 HydrophobicContact CE2-CZ3 4.36Å; F292-W295 PolarHBondContact O-N 3.49Å; W295-R297 PolarHBondContact O-N 2.74Å; W295-R297 VanDerWaalsContact O-N 3.16Å; W295-R298 WeakPolarHBondContact O-CB 3.39Å; W295-R298 WeakPolarHBondContact O-CG 3.01Å; W295-R298 PolarHBondContact O-N 2.81Å; W295-F299 AromaticContact CD2-CE2 3.98Å; W295-F299 HydrophobicContact CD2-CE2 3.98Å; W295-F299 AromaticContact CE2-CE2 3.66Å; W295-F299 HydrophobicContact CE3-CD2 4.3Å; W295-F299 HydrophobicContact CE3-CE2 4.03Å; W295-F299 HydrophobicContact CH2-CD2 4.07Å; W295-F299 AromaticContact CH2-CE2 3.45Å; W295-F299 HydrophobicContact CH2-CE2 3.45Å; W295-F299 VanDerWaalsContact CH2-CE2 3.45Å; W295-F299 AromaticContact CH2-CZ 3.92Å; W295-F299 HydrophobicContact CH2-CZ 3.92Å; W295-F299 HydrophobicContact CZ2-CD2 4.42Å; W295-F299 AromaticContact CZ2-CE2 3.41Å; W295-F299 HydrophobicContact CZ2-CE2 3.41Å; W295-F299 VanDerWaalsContact CZ2-CE2 3.41Å; W295-F299 AromaticContact CZ2-CZ 3.73Å; W295-F299 HydrophobicContact CZ2-CZ 3.73Å; W295-F299 HydrophobicContact CZ3-CD2 4Å; W295-F299 AromaticContact CZ3-CE2 3.76Å; W295-F299 HydrophobicContact CZ3-CE2 3.76Å
296	Q	94.5	Very high	90.7	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.009	31%	0.313	C	S	.	.	H	α-helix	trans	-59.8	-33.2	-173.9	69.9	76.6	7.8	0	0	112.2	L223 F292 R298 F299 Y310 A313 P342	L223-Q296 HydrophobicContact CD2-CB 4.31Å; F292-Q296 HydrophobicContact CE2-CB 4.1Å; F292-Q296 HydrophobicContact CZ-CB 4.32Å; F292-Q296 WeakPolarHBondContact O-CG 3.39Å; F292-Q296 PolarHBondContact O-N 3.33Å; Q296-R298 PolarHBondContact O-N 3.45Å; Q296-F299 WeakPolarHBondContact O-CB 3.46Å; Q296-F299 PolarHBondContact O-N 2.02Å; Q296-Y310 PolarHBondContact O-OH 2.84Å; Q296-Y310 PolarHBondContact OE1-OH 3.29Å; Q296-A313 HydrophobicContact CB-CB 4.04Å; Q296-A313 HydrophobicContact CG-CB 3.84Å; Q296-P342 PolarHBondContact NE2-O 2.8Å
297	R	92.6	Very high	89.9	Confident	99 Å²	99	66.1 Å²	66.1	37%	0.374	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.3	-178.3	-70.6	-177	-55.1	-171.7	-2	114.2	C293 N294 W295 F299 N300 N343	C293-R297 WeakPolarHBondContact O-CG 3.13Å; N294-R297 PolarHBondContact OD1-NH2 2.88Å; W295-R297 PolarHBondContact O-N 2.74Å; W295-R297 VanDerWaalsContact O-N 3.16Å; R297-F299 PolarHBondContact O-N 3.47Å; R297-N300 PolarHBondContact O-N 2.85Å; R297-N343 PolarHBondContact NH1-OD1 3.3Å
298	R	90.6	Very high	89.3	Confident	194 Å²	194	64.6 Å²	64.6	73%	0.732	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.7	177.1	-60.9	174.9	-173.8	172	2.7	112.4	W295 Q296	W295-R298 WeakPolarHBondContact O-CB 3.39Å; W295-R298 WeakPolarHBondContact O-CG 3.01Å; W295-R298 PolarHBondContact O-N 2.81Å; Q296-R298 PolarHBondContact O-N 3.45Å
299	F	90	Very high	88.9	Confident	42 Å²	42	65.2 Å²	65.2	18%	0.184	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-9	-177.5	-56.1	-87.4	0	0	0	113.1	L83 L270 W295 Q296 R297	L83-F299 HydrophobicContact CD1-CE1 4.37Å; L83-F299 HydrophobicContact CD1-CZ 4Å; L270-F299 HydrophobicContact CD1-CB 4.36Å; L270-F299 HydrophobicContact CD1-CD1 4.05Å; L270-F299 HydrophobicContact CD1-CD2 4.1Å; L270-F299 HydrophobicContact CD1-CE1 4.35Å; L270-F299 HydrophobicContact CD1-CE2 4.42Å; L270-F299 HydrophobicContact CD1-CG 3.91Å; W295-F299 AromaticContact CD2-CE2 3.98Å; W295-F299 HydrophobicContact CD2-CE2 3.98Å; W295-F299 AromaticContact CE2-CE2 3.66Å; W295-F299 HydrophobicContact CE3-CD2 4.3Å; W295-F299 HydrophobicContact CE3-CE2 4.03Å; W295-F299 HydrophobicContact CH2-CD2 4.07Å; W295-F299 AromaticContact CH2-CE2 3.45Å; W295-F299 HydrophobicContact CH2-CE2 3.45Å; W295-F299 VanDerWaalsContact CH2-CE2 3.45Å; W295-F299 AromaticContact CH2-CZ 3.92Å; W295-F299 HydrophobicContact CH2-CZ 3.92Å; W295-F299 HydrophobicContact CZ2-CD2 4.42Å; W295-F299 AromaticContact CZ2-CE2 3.41Å; W295-F299 HydrophobicContact CZ2-CE2 3.41Å; W295-F299 VanDerWaalsContact CZ2-CE2 3.41Å; W295-F299 AromaticContact CZ2-CZ 3.73Å; W295-F299 HydrophobicContact CZ2-CZ 3.73Å; W295-F299 HydrophobicContact CZ3-CD2 4Å; W295-F299 AromaticContact CZ3-CE2 3.76Å; W295-F299 HydrophobicContact CZ3-CE2 3.76Å; Q296-F299 WeakPolarHBondContact O-CB 3.46Å; Q296-F299 PolarHBondContact O-N 2.02Å; R297-F299 PolarHBondContact O-N 3.47Å
300	N	91.7	Very high	88.7	Confident	29 Å²	29	64.8 Å²	64.8	16%	0.155	30%	0.303	C	S	.	.			trans	-87	135.5	180	-155	-7.7	0	0	0	111	R297 H309 Y310	R297-N300 PolarHBondContact O-N 2.85Å; N300-H309 PolarHBondContact OD1-ND1 2.86Å; N300-Y310 WeakPolarHBondContact CA-OH 3.25Å; N300-Y310 HydrophobicContact CB-CE1 3.87Å; N300-Y310 HydrophobicContact CB-CE2 3.8Å; N300-Y310 VanDerWaalsContact CB-OH 3.31Å; N300-Y310 WeakPolarHBondContact CB-OH 3.38Å; N300-Y310 PolarHBondContact N-OH 3.18Å; N300-Y310 VanDerWaalsContact N-OH 3.1Å; N300-Y310 WeakPolarHBondContact ND2-CE2 3.43Å; N300-Y310 PolarHBondContact ND2-O 2.64Å; N300-Y310 PolarHBondContact OD1-N 2.72Å
301	Q	88.6	Confident	88.7	Confident	68 Å²	68	58 Å²	58	32%	0.318	28%	0.278	S	S	.	.			trans	-83.6	139	178.3	-62.7	-67.6	-13	0	0	109.9	S303 H306 E308 H309	Q301-S303 PolarHBondContact O-N 3.49Å; Q301-H306 HydrophobicContact CB-CB 3.86Å; Q301-H306 HydrophobicContact CG-CB 4.4Å; Q301-H306 WeakPolarHBondContact CG-ND1 3.36Å; Q301-E308 HydrophobicContact CG-CB 4.1Å; Q301-H309 HydrophobicContact CB-CB 4.41Å; Q301-H309 PolarHBondContact O-ND1 3.24Å
302	P	84.4	Confident	88.7	Confident	127 Å²	127	56.6 Å²	56.6	83%	0.825	27%	0.27	S	S	*	.	S	Bend	trans	-69.7	-15.2	-174.3	-21.5	32.6	0	0	0	115.7
303	S	83.5	Confident	88.7	Confident	63 Å²	63	56.6 Å²	56.6	44%	0.441	27%	0.27	S	S	.	.			trans	-108.7	121.8	-176.5	170.4	0	0	0	0	109.4	Q301 R305 H306 H309	Q301-S303 PolarHBondContact O-N 3.49Å; S303-R305 PolarHBondContact O-N 3.13Å; S303-R305 VanDerWaalsContact O-N 3.13Å; S303-R305 PolarHBondContact OG-N 2.84Å; S303-H306 WeakPolarHBondContact O-CB 3.46Å; S303-H306 PolarHBondContact O-N 3.35Å; S303-H309 WeakPolarHBondContact O-CB 3.46Å
304	D	79.5	Confident	88.8	Confident	72 Å²	72	56.3 Å²	56.3	39%	0.385	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-36	177.1	-54.4	-4.1	0	0	0	111.9	H306 H309	D304-H306 PolarHBondContact O-N 3.28Å; D304-H309 IonicContact OD1-CE1 2.97Å; D304-H309 PolarHBondContact OD1-CE1 3.09Å; D304-H309 VanDerWaalsContact OD1-CE1 3.28Å; D304-H309 IonicContact OD1-ND1 2.69Å; D304-H309 IonicContact OD1-NE2 2.73Å; D304-H309 PolarHBondContact OD1-NE2 3Å
305	R	77.1	Confident	88.9	Confident	227 Å²	227	52.9 Å²	52.9	86%	0.857	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-8.3	176.3	-59.2	-176.7	179.5	-170.9	-2	115.8	S303	S303-R305 PolarHBondContact O-N 3.13Å; S303-R305 VanDerWaalsContact O-N 3.13Å; S303-R305 PolarHBondContact OG-N 2.84Å
306	H	80.6	Confident	89	Confident	65 Å²	65	52.1 Å²	52.1	30%	0.301	25%	0.247	S	C	.	.	S	Bend	trans	-80	132.4	-177.2	-169.8	-75.6	0	0	0	109.5	Q301 S303 D304 E308 H309	Q301-H306 HydrophobicContact CB-CB 3.86Å; Q301-H306 HydrophobicContact CG-CB 4.4Å; Q301-H306 WeakPolarHBondContact CG-ND1 3.36Å; S303-H306 WeakPolarHBondContact O-CB 3.46Å; S303-H306 PolarHBondContact O-N 3.35Å; D304-H306 PolarHBondContact O-N 3.28Å; H306-E308 PolarHBondContact ND1-N 3.15Å; H306-E308 PolarHBondContact O-N 3.41Å; H306-H309 HydrophobicContact CB-CB 4.33Å; H306-H309 WeakPolarHBondContact O-CB 2.92Å; H306-H309 PolarHBondContact O-N 3.09Å
307	P	75.5	Confident	89.1	Confident	56 Å²	56	52 Å²	52	36%	0.364	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.2	-176	-26.6	35.6	0	0	0	116.3	E77 V267	E77-P307 HydrophobicContact CB-CB 3.96Å; E77-P307 HydrophobicContact CG-CB 3.95Å; E77-P307 HydrophobicContact CG-CG 4.41Å; E77-P307 WeakPolarHBondContact OE2-CB 3.32Å; V267-P307 WeakPolarHBondContact CG1-O 3.27Å
308	E	78.6	Confident	89	Confident	26 Å²	26	50.3 Å²	50.3	12%	0.121	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	5.6	173.6	-60.1	-174.9	-160.3	0	0	114.3	K79 K268 Q301 H306 Y310	K79-E308 WeakPolarHBondContact CD-OE1 3.47Å; K79-E308 VanDerWaalsContact CE-OE1 3.26Å; K79-E308 WeakPolarHBondContact CE-OE1 3.07Å; K79-E308 IonicContact NZ-OE1 2.65Å; K79-E308 PolarHBondContact NZ-OE1 3.29Å; K268-E308 WeakPolarHBondContact CE-OE2 3.46Å; K268-E308 IonicContact NZ-OE2 2.74Å; K268-E308 PolarHBondContact NZ-OE2 3.44Å; Q301-E308 HydrophobicContact CG-CB 4.1Å; H306-E308 PolarHBondContact ND1-N 3.15Å; H306-E308 PolarHBondContact O-N 3.41Å; E308-Y310 WeakPolarHBondContact O-CD1 3.15Å
309	H	88.1	Confident	89	Confident	14 Å²	14	44.8 Å²	44.8	7%	0.065	22%	0.223	C	C	.	.			trans	-65.7	155.1	167.5	-179.8	78.9	0	0	0	109.7	E221 V267 N300 Q301 S303 D304 H306	E221-H309 IonicContact OE2-CD2 2.7Å; V267-H309 WeakPolarHBondContact CG1-O 3.35Å; N300-H309 PolarHBondContact OD1-ND1 2.86Å; Q301-H309 HydrophobicContact CB-CB 4.41Å; Q301-H309 PolarHBondContact O-ND1 3.24Å; S303-H309 WeakPolarHBondContact O-CB 3.46Å; D304-H309 IonicContact OD1-CE1 2.97Å; D304-H309 PolarHBondContact OD1-CE1 3.09Å; D304-H309 VanDerWaalsContact OD1-CE1 3.28Å; D304-H309 IonicContact OD1-ND1 2.69Å; D304-H309 IonicContact OD1-NE2 2.73Å; D304-H309 PolarHBondContact OD1-NE2 3Å; H306-H309 HydrophobicContact CB-CB 4.33Å; H306-H309 WeakPolarHBondContact O-CB 2.92Å; H306-H309 PolarHBondContact O-N 3.09Å
310	Y	91.1	Very high	88.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.235	C	C	.	.			trans	-149.6	142.1	171	48.9	-94.4	0	0	0	110.1	E221 L223 Q296 N300 E308 T312 A313	E221-Y310 CarbonylContact O-C 3.52Å; E221-Y310 WeakPolarHBondContact O-CB 2.93Å; L223-Y310 HydrophobicContact CB-CD1 3.85Å; L223-Y310 HydrophobicContact CB-CD2 3.66Å; L223-Y310 HydrophobicContact CB-CE1 3.93Å; L223-Y310 HydrophobicContact CB-CE2 3.74Å; L223-Y310 HydrophobicContact CB-CG 3.71Å; L223-Y310 HydrophobicContact CD2-CE1 3.88Å; L223-Y310 HydrophobicContact CD2-CE2 3.84Å; L223-Y310 VanDerWaalsContact CD2-CZ 3.42Å; L223-Y310 WeakPolarHBondContact CD2-OH 3.43Å; L223-Y310 HydrophobicContact CG-CE1 4.36Å; L223-Y310 HydrophobicContact CG-CE2 4.43Å; Q296-Y310 PolarHBondContact O-OH 2.84Å; Q296-Y310 PolarHBondContact OE1-OH 3.29Å; N300-Y310 WeakPolarHBondContact CA-OH 3.25Å; N300-Y310 HydrophobicContact CB-CE1 3.87Å; N300-Y310 HydrophobicContact CB-CE2 3.8Å; N300-Y310 VanDerWaalsContact CB-OH 3.31Å; N300-Y310 WeakPolarHBondContact CB-OH 3.38Å; N300-Y310 PolarHBondContact N-OH 3.18Å; N300-Y310 VanDerWaalsContact N-OH 3.1Å; N300-Y310 WeakPolarHBondContact ND2-CE2 3.43Å; N300-Y310 PolarHBondContact ND2-O 2.64Å; N300-Y310 PolarHBondContact OD1-N 2.72Å; E308-Y310 WeakPolarHBondContact O-CD1 3.15Å; Y310-T312 WeakPolarHBondContact CD2-O 3.29Å; Y310-A313 HydrophobicContact CD2-CB 4.48Å; Y310-A313 HydrophobicContact CE2-CB 4.07Å
311	D	94.3	Very high	88.6	Confident	10 Å²	10	45.4 Å²	45.4	5%	0.053	23%	0.228	C	C	.	.	S	Bend	trans	-68.8	-39.8	178.2	-61.3	-58	0	0	0	111.7	E221 I339 S345 L424	E221-D311 WeakPolarHBondContact CB-OD2 3.28Å; E221-D311 PolarHBondContact N-OD2 2.52Å; E221-D311 PolarHBondContact O-N 3.03Å; D311-I339 HydrophobicContact CB-CD1 4.23Å; D311-S345 WeakPolarHBondContact O-CB 3.46Å; D311-S345 PolarHBondContact O-OG 3.18Å; D311-L424 HydrophobicContact CB-CD2 3.91Å; D311-L424 VanDerWaalsContact CG-CD2 3.47Å; D311-L424 WeakPolarHBondContact OD2-CD2 3.3Å
312	T	96.8	Very high	88.3	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	154.6	-173.5	-170.6	0	0	0	0	112.4	V220 E221 T222 L223 Y310 I339 S345 L364	V220-T312 HydrophobicContact CG1-CG2 3.75Å; E221-T312 PolarHBondContact O-N 2.79Å; E221-T312 VanDerWaalsContact O-N 3.11Å; T222-T312 WeakPolarHBondContact CA-O 3.22Å; T222-T312 HydrophobicContact CG2-CG2 4.25Å; L223-T312 PolarHBondContact N-O 2.81Å; Y310-T312 WeakPolarHBondContact CD2-O 3.29Å; T312-I339 HydrophobicContact CG2-CD1 4.21Å; T312-S345 WeakPolarHBondContact CA-OG 3.3Å; T312-S345 VanDerWaalsContact CB-OG 3.3Å; T312-S345 WeakPolarHBondContact CB-OG 3.49Å; T312-S345 PolarHBondContact OG1-OG 2.94Å; T312-L364 HydrophobicContact CG2-CD1 4.09Å
313	A	97.2	Very high	87.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.4	176.9	0	0	0	0	0	111.2	L223 F292 Q296 Y310 S345 C346 S347	L223-A313 HydrophobicContact CB-CB 4.05Å; L223-A313 HydrophobicContact CD2-CB 4.11Å; L223-A313 HydrophobicContact CG-CB 4.36Å; L223-A313 CarbonylContact O-C 3.53Å; L223-A313 WeakPolarHBondContact O-CA 3.36Å; F292-A313 HydrophobicContact CE1-CB 4Å; F292-A313 WeakPolarHBondContact CE1-O 3.37Å; F292-A313 HydrophobicContact CZ-CB 3.78Å; Q296-A313 HydrophobicContact CB-CB 4.04Å; Q296-A313 HydrophobicContact CG-CB 3.84Å; Y310-A313 HydrophobicContact CD2-CB 4.48Å; Y310-A313 HydrophobicContact CE2-CB 4.07Å; A313-S345 PolarHBondContact N-O 2.64Å; A313-C346 CarbonylContact O-C 3.54Å; A313-C346 WeakPolarHBondContact O-CA 3.26Å; A313-S347 PolarHBondContact O-N 3.15Å
314	I	98.3	Very high	86.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.1	-178.4	-66.8	171.4	0	0	0	109.1	T222 L223 L224 V225 L316 S347 I349 L360	T222-I314 HydrophobicContact CG2-CD1 3.78Å; T222-I314 HydrophobicContact CG2-CG1 4.19Å; L223-I314 PolarHBondContact O-N 2.84Å; L224-I314 HydrophobicContact CD2-CB 4Å; L224-I314 HydrophobicContact CD2-CD1 4.35Å; L224-I314 HydrophobicContact CD2-CG2 4.2Å; V225-I314 PolarHBondContact N-O 3.35Å; I314-L316 HydrophobicContact CG2-CD2 4.49Å; I314-S347 WeakPolarHBondContact CG1-OG 3.1Å; I314-I349 HydrophobicContact CG2-CD1 3.41Å; I314-I349 VanDerWaalsContact CG2-CD1 3.41Å; I314-L360 HydrophobicContact CD1-CD1 4.11Å; I314-L360 HydrophobicContact CD1-CD2 3.82Å; I314-L360 HydrophobicContact CD1-CG 3.82Å; I314-L360 HydrophobicContact CG2-CD1 4.18Å; I314-L360 HydrophobicContact CG2-CG 4.4Å
315	L	98.3	Very high	85.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.3	171.5	178.9	64.7	0	0	0	110.3	V225 D227 P279 V281 T288 F292 S347 V348 I349	V225-L315 HydrophobicContact CB-CD1 4.03Å; V225-L315 HydrophobicContact CG1-CD1 3.8Å; V225-L315 CarbonylContact O-C 3.46Å; V225-L315 WeakPolarHBondContact O-CA 3.48Å; D227-L315 HydrophobicContact CB-CD1 4.33Å; P279-L315 HydrophobicContact CG-CD1 4.15Å; P279-L315 HydrophobicContact CG-CD2 3.96Å; V281-L315 HydrophobicContact CG2-CD2 4.06Å; T288-L315 HydrophobicContact CG2-CD2 4.11Å; F292-L315 HydrophobicContact CB-CD2 4.09Å; F292-L315 HydrophobicContact CD1-CB 3.7Å; F292-L315 HydrophobicContact CD2-CB 3.89Å; F292-L315 HydrophobicContact CD2-CD1 4.38Å; F292-L315 HydrophobicContact CD2-CD2 4.11Å; F292-L315 HydrophobicContact CD2-CG 4.36Å; F292-L315 HydrophobicContact CE1-CB 3.64Å; F292-L315 HydrophobicContact CE2-CB 3.83Å; F292-L315 HydrophobicContact CE2-CD1 4.35Å; F292-L315 HydrophobicContact CG-CB 3.82Å; F292-L315 HydrophobicContact CG-CD2 4.02Å; F292-L315 HydrophobicContact CG-CG 4.47Å; F292-L315 HydrophobicContact CZ-CB 3.7Å; L315-S347 PolarHBondContact N-O 2.99Å; L315-V348 HydrophobicContact CB-CB 4.47Å; L315-V348 HydrophobicContact CB-CG1 4.07Å; L315-V348 HydrophobicContact CD2-CG1 4.09Å; L315-I349 PolarHBondContact O-N 3.38Å
316	L	97.6	Very high	85.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.4	170.3	-61.5	167.6	0	0	0	109.1	V225 D227 M230 I242 L245 I314 I349	V225-L316 PolarHBondContact O-N 3.36Å; D227-L316 PolarHBondContact N-O 2.64Å; M230-L316 HydrophobicContact CE-CB 4Å; M230-L316 HydrophobicContact CG-CB 4.27Å; M230-L316 VanDerWaalsContact CG-O 3.3Å; M230-L316 WeakPolarHBondContact CG-O 3.42Å; M230-L316 HydrophobicContact SD-CB 4.44Å; I242-L316 HydrophobicContact CB-CD1 4.38Å; I242-L316 HydrophobicContact CG1-CD1 3.82Å; I242-L316 HydrophobicContact CG2-CD1 4.12Å; L245-L316 HydrophobicContact CD1-CD1 4.22Å; L245-L316 HydrophobicContact CD1-CD2 4.27Å; I314-L316 HydrophobicContact CG2-CD2 4.49Å; L316-I349 HydrophobicContact CD2-CB 4.05Å; L316-I349 HydrophobicContact CD2-CG2 4.09Å
317	T	95.9	Very high	84.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	151.4	180	-177.4	0	0	0	0	111.1	D227 V281 Q319 F321 I349 E350 D351	D227-T317 WeakPolarHBondContact OD2-CB 3.16Å; D227-T317 PolarHBondContact OD2-OG1 2.8Å; V281-T317 HydrophobicContact CG1-CG2 4.31Å; T317-Q319 VanDerWaalsContact C-N 3.31Å; T317-Q319 HydrophobicContact CG2-CB 4.2Å; T317-Q319 VanDerWaalsContact OG1-CB 3.32Å; T317-Q319 WeakPolarHBondContact OG1-CB 3.43Å; T317-Q319 PolarHBondContact OG1-N 2.7Å; T317-F321 HydrophobicContact CG2-CE1 4.22Å; T317-F321 HydrophobicContact CG2-CE2 4.43Å; T317-F321 HydrophobicContact CG2-CZ 3.65Å; T317-I349 PolarHBondContact N-O 2.98Å; T317-E350 CarbonylContact O-C 3.56Å; T317-E350 WeakPolarHBondContact O-CA 3.47Å; T317-D351 PolarHBondContact O-N 3.46Å
318	R	91.3	Very high	84.8	Confident	62 Å²	62	44.8 Å²	44.8	23%	0.234	25%	0.247	C	C	.	.	S	Bend	trans	-92.3	9.2	168.1	-68.2	-71.7	-64.5	-178.1	-5.5	112.3	S229 M230 F233 D351 Q453	S229-R318 WeakPolarHBondContact OG-CB 3.25Å; S229-R318 PolarHBondContact OG-N 3.49Å; M230-R318 HydrophobicContact CG-CG 4.5Å; M230-R318 HydrophobicContact SD-CG 3.72Å; F233-R318 HydrophobicContact CB-CG 4.49Å; R318-D351 WeakPolarHBondContact CD-O 3.4Å; R318-D351 PolarHBondContact NH1-O 2.95Å; R318-D351 IonicContact NH1-OD2 3.62Å; R318-Q453 PolarHBondContact NH1-O 2.93Å; R318-Q453 PolarHBondContact NH2-O 2.84Å
319	Q	90.9	Very high	84.7	Confident	79 Å²	79	49.7 Å²	49.7	37%	0.369	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-78.8	124	174	179.8	58.7	48	0	0	110.4	V281 T317	V281-Q319 HydrophobicContact CG1-CB 3.7Å; V281-Q319 HydrophobicContact CG1-CG 3.9Å; T317-Q319 VanDerWaalsContact C-N 3.31Å; T317-Q319 HydrophobicContact CG2-CB 4.2Å; T317-Q319 VanDerWaalsContact OG1-CB 3.32Å; T317-Q319 WeakPolarHBondContact OG1-CB 3.43Å; T317-Q319 PolarHBondContact OG1-N 2.7Å
320	N	85.8	Confident	84.4	Confident	81 Å²	81	52 Å²	52	43%	0.433	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-70.5	137.2	175.4	-57.1	1	0	0	0	110.6	D283 E350	D283-N320 WeakPolarHBondContact CA-O 3.46Å; N320-E350 WeakPolarHBondContact CA-OE2 3.31Å; N320-E350 PolarHBondContact OD1-OE1 3.41Å
321	F	87.1	Confident	84.2	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.009	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-96.3	127.8	173.2	-54.2	-51.6	0	0	0	111.8	D283 T288 T317 C328 T330 V348 E350	D283-F321 CarbonylContact O-C 3.57Å; D283-F321 VanDerWaalsContact O-CA 3.27Å; D283-F321 WeakPolarHBondContact O-CA 3.33Å; T288-F321 HydrophobicContact CG2-CE1 4.09Å; T288-F321 HydrophobicContact CG2-CZ 4.36Å; T317-F321 HydrophobicContact CG2-CE1 4.22Å; T317-F321 HydrophobicContact CG2-CE2 4.43Å; T317-F321 HydrophobicContact CG2-CZ 3.65Å; F321-C328 CarbonylContact O-C 3.51Å; F321-C328 WeakPolarHBondContact O-CA 3.45Å; F321-C328 WeakPolarHBondContact O-CB 3.43Å; F321-T330 HydrophobicContact CB-CG2 4.47Å; F321-V348 HydrophobicContact CE2-CB 4.5Å; F321-V348 HydrophobicContact CE2-CG2 4.03Å; F321-V348 HydrophobicContact CZ-CB 4.16Å; F321-V348 HydrophobicContact CZ-CG2 3.89Å; F321-E350 HydrophobicContact CD2-CB 4.41Å; F321-E350 HydrophobicContact CE2-CB 4.33Å
322	C	83.4	Confident	84	Confident	34 Å²	34	54.6 Å²	54.6	23%	0.23	31%	0.305	C	S	.	.			trans	-121.5	134.9	-175.2	-53.8	0	0	0	0	111.6	D283 C328	D283-C322 HydrophobicContact CB-CB 4.36Å; D283-C322 PolarHBondContact O-N 2.8Å; C322-C328 HydrophobicContact CB-CB 4.05Å; C322-C328 WeakPolarHBondContact CB-SG 3.37Å; C322-C328 WeakPolarHBondContact SG-CB 3.47Å; C322-C328 CovalentContact SG-SG 2.04Å; C322-C328 PolarHBondContact SG-SG 3.26Å
323	G	71.1	Confident	83.9	Confident	42 Å²	42	56.1 Å²	56.1	43%	0.433	31%	0.314	S	S	.	.			trans	-77.5	176.6	174.1	0	0	0	0	0	113.2	E325 G326 L327	G323-E325 PolarHBondContact O-N 2.85Å; G323-E325 VanDerWaalsContact O-N 3.07Å; G323-G326 PolarHBondContact O-N 3.39Å; G323-L327 PolarHBondContact N-O 3.25Å
324	Q	61	Low	83.8	Confident	212 Å²	212	56.9 Å²	56.9	99%	0.991	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-17.7	-179.2	-71.2	-151.4	-26.5	0	0	114.8
325	E	63.5	Low	83.6	Confident	175 Å²	175	60.1 Å²	60.1	82%	0.818	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	4.6	177.5	-63	-174.2	171	0	0	113.2	G323 L327	G323-E325 PolarHBondContact O-N 2.85Å; G323-E325 VanDerWaalsContact O-N 3.07Å; E325-L327 HydrophobicContact CB-CD1 3.8Å; E325-L327 PolarHBondContact O-N 3.28Å
326	G	62.8	Low	83.4	Confident	56 Å²	56	64.7 Å²	64.7	58%	0.577	36%	0.361	S	S	*	.	S	Bend	trans	76.5	4	-178.8	0	0	0	0	0	114.9	G323	G323-G326 PolarHBondContact O-N 3.39Å
327	L	70.3	Confident	83.2	Confident	97 Å²	97	66.2 Å²	66.2	51%	0.508	38%	0.377	S	S	.	.			trans	-74.1	125.2	166.7	-73	105	0	0	0	109.6	G323 E325	G323-L327 PolarHBondContact N-O 3.25Å; E325-L327 HydrophobicContact CB-CD1 3.8Å; E325-L327 PolarHBondContact O-N 3.28Å
328	C	77.5	Confident	83.2	Confident	50 Å²	50	66.9 Å²	66.9	34%	0.338	38%	0.381	S	S	.	.			trans	-110.1	49	-177.8	-47.5	0	0	0	0	111.4	F321 C322 T330	F321-C328 CarbonylContact O-C 3.51Å; F321-C328 WeakPolarHBondContact O-CA 3.45Å; F321-C328 WeakPolarHBondContact O-CB 3.43Å; C322-C328 HydrophobicContact CB-CB 4.05Å; C322-C328 WeakPolarHBondContact CB-SG 3.37Å; C322-C328 WeakPolarHBondContact SG-CB 3.47Å; C322-C328 CovalentContact SG-SG 2.04Å; C322-C328 PolarHBondContact SG-SG 3.26Å; C328-T330 VanDerWaalsContact C-N 3.35Å
329	D	76.9	Confident	83.4	Confident	129 Å²	129	64 Å²	64	69%	0.69	37%	0.371	S	S	*	.			trans	-91.7	1.9	-177.8	-60	-29.9	0	0	0	112.6
330	T	81.8	Confident	83.5	Confident	62 Å²	62	62.9 Å²	62.9	38%	0.38	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-89	110.1	-176.2	-56.9	0	0	0	0	110.2	F321 C328 G332 V333	F321-T330 HydrophobicContact CB-CG2 4.47Å; C328-T330 VanDerWaalsContact C-N 3.35Å; T330-G332 WeakPolarHBondContact CG2-O 3.47Å; T330-V333 HydrophobicContact CG2-CG2 3.88Å
331	L	86.4	Confident	83.8	Confident	54 Å²	54	61.5 Å²	61.5	28%	0.283	36%	0.363	S	S	.	.			trans	-88.8	-16.4	-178.6	-59.2	179.2	0	0	0	113.8	E350 E352 T359	L331-E350 WeakPolarHBondContact O-CB 3.49Å; L331-E350 PolarHBondContact O-N 2.92Å; L331-E352 HydrophobicContact CD2-CG 4.09Å; L331-E352 WeakPolarHBondContact CD2-OE1 3.39Å; L331-T359 HydrophobicContact CB-CG2 3.78Å; L331-T359 WeakPolarHBondContact O-CG2 3.49Å
332	G	91	Very high	83.8	Confident	10 Å²	10	65 Å²	65	10%	0.103	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	157.8	-177.4	0	0	0	0	0	112.5	T330 V348 E363	T330-G332 WeakPolarHBondContact CG2-O 3.47Å; G332-V348 CarbonylContact C-O 3.46Å; G332-V348 WeakPolarHBondContact CA-O 3.3Å; G332-E363 VanDerWaalsContact C-CD 3.4Å; G332-E363 VanDerWaalsContact C-OE1 3.3Å; G332-E363 WeakPolarHBondContact CA-OE1 3.44Å
333	V	93.6	Very high	84.1	Confident	33 Å²	33	67 Å²	67	20%	0.2	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	134.1	175.8	-166.7	0	0	0	0	110.6	L289 T330 S347 V348 E363	L289-V333 HydrophobicContact CD2-CG1 3.93Å; T330-V333 HydrophobicContact CG2-CG2 3.88Å; V333-S347 WeakPolarHBondContact O-CA 3.16Å; V333-V348 HydrophobicContact CB-CG2 3.9Å; V333-V348 HydrophobicContact CG2-CG2 4.35Å; V333-V348 PolarHBondContact N-O 2.96Å; V333-V348 PolarHBondContact O-N 3.48Å; V333-E363 VanDerWaalsContact C-OE2 3.25Å; V333-E363 WeakPolarHBondContact CA-OE2 3.09Å; V333-E363 PolarHBondContact N-OE2 3.15Å
334	A	96	Very high	85.2	Confident	17 Å²	17	69.8 Å²	69.8	14%	0.14	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	159	172.2	0	0	0	0	0	112	E363 H366 V367	A334-E363 HydrophobicContact CB-CB 4.15Å; A334-E363 WeakPolarHBondContact CB-OE2 3.45Å; A334-E363 PolarHBondContact N-OE2 3.18Å; A334-E363 VanDerWaalsContact N-OE2 3.1Å; A334-H366 HydrophobicContact CB-CB 4Å; A334-V367 HydrophobicContact CB-CG2 3.89Å
335	D	93.9	Very high	86.9	Confident	67 Å²	67	59.7 Å²	59.7	36%	0.358	35%	0.348	S	S	.	.			trans	-81.8	148.3	167.5	-83.9	-26.7	0	0	0	110.5	T338 H366 V367	D335-T338 HydrophobicContact CB-CG2 3.63Å; D335-T338 PolarHBondContact O-OG1 3.29Å; D335-H366 CarbonylContact O-C 3.38Å; D335-V367 PolarHBondContact O-N 2.88Å
336	I	93.1	Very high	88.5	Confident	97 Å²	97	51.4 Å²	51.4	50%	0.497	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	126.7	-178.3	-58	177.7	0	0	0	111.3	H366	I336-H366 CarbonylContact C-O 3.5Å; I336-H366 WeakPolarHBondContact CA-O 3.29Å; I336-H366 HydrophobicContact CG1-CB 4.13Å
337	G	93.3	Very high	90.2	Very high	32 Å²	32	48.7 Å²	48.7	33%	0.33	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	33.8	169.6	0	0	0	0	0	114.3	H366 V367	G337-H366 PolarHBondContact N-O 2.7Å; G337-V367 CarbonylContact C-O 3.52Å; G337-V367 WeakPolarHBondContact CA-O 3.47Å; G337-V367 PolarHBondContact N-O 3.26Å
338	T	95.5	Very high	91.5	Very high	14 Å²	14	44.1 Å²	44.1	9%	0.086	26%	0.257	C	S	.	.			trans	-106.7	10	-175	54.1	0	0	0	0	113.9	D335 C340 D341 K344 S345 V367	D335-T338 HydrophobicContact CB-CG2 3.63Å; D335-T338 PolarHBondContact O-OG1 3.29Å; T338-C340 VanDerWaalsContact C-N 3.28Å; T338-C340 PolarHBondContact O-N 3.37Å; T338-C340 VanDerWaalsContact O-N 3.12Å; T338-D341 PolarHBondContact O-N 3.48Å; T338-K344 WeakPolarHBondContact CB-O 3.37Å; T338-K344 HydrophobicContact CG2-CB 3.71Å; T338-K344 HydrophobicContact CG2-CD 4.24Å; T338-K344 PolarHBondContact OG1-O 2.94Å; T338-S345 VanDerWaalsContact O-CB 3.27Å; T338-S345 WeakPolarHBondContact O-CB 3.41Å; T338-V367 PolarHBondContact N-O 2.86Å; T338-V367 VanDerWaalsContact N-O 3.12Å
339	I	95.9	Very high	92.3	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-40.5	-173.5	-170.8	62.4	0	0	0	114.9	V220 D311 T312 S345 V367 L368 L415 L424	V220-I339 HydrophobicContact CG1-CD1 4.26Å; D311-I339 HydrophobicContact CB-CD1 4.23Å; T312-I339 HydrophobicContact CG2-CD1 4.21Å; I339-S345 WeakPolarHBondContact CA-OG 3.39Å; I339-S345 WeakPolarHBondContact O-CB 3.49Å; I339-S345 PolarHBondContact O-OG 2.98Å; I339-V367 HydrophobicContact CB-CG1 3.86Å; I339-V367 HydrophobicContact CD1-CG1 3.69Å; I339-V367 HydrophobicContact CG1-CG1 4.36Å; I339-V367 PolarHBondContact N-O 3.1Å; I339-V367 VanDerWaalsContact N-O 3.16Å; I339-L368 HydrophobicContact CB-CD2 4.17Å; I339-L368 HydrophobicContact CD1-CD2 4.29Å; I339-L368 HydrophobicContact CG1-CD2 3.89Å; I339-L368 HydrophobicContact CG2-CD2 4.33Å; I339-L415 HydrophobicContact CG2-CD2 4.03Å; I339-L424 HydrophobicContact CD1-CD2 4.28Å; I339-L424 HydrophobicContact CG1-CD1 4.12Å; I339-L424 HydrophobicContact CG1-CD2 3.76Å; I339-L424 HydrophobicContact CG1-CG 4.29Å
340	C	93.3	Very high	93.1	Very high	54 Å²	54	36.1 Å²	36.1	37%	0.365	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	18.5	177.1	-56.8	0	0	0	0	113.3	T338 H420 C423	T338-C340 VanDerWaalsContact C-N 3.28Å; T338-C340 PolarHBondContact O-N 3.37Å; T338-C340 VanDerWaalsContact O-N 3.12Å; C340-H420 PolarHBondContact SG-O 2.67Å; C340-H420 VanDerWaalsContact SG-O 3.35Å; C340-C423 WeakPolarHBondContact CA-SG 3.26Å; C340-C423 HydrophobicContact CB-CB 3.9Å; C340-C423 WeakPolarHBondContact CB-SG 3.4Å; C340-C423 WeakPolarHBondContact SG-CB 3.41Å; C340-C423 PolarHBondContact SG-N 3.09Å; C340-C423 VanDerWaalsContact SG-N 3.37Å; C340-C423 CovalentContact SG-SG 2.04Å; C340-C423 PolarHBondContact SG-SG 2.92Å
341	D	92.3	Very high	93.4	Very high	53 Å²	53	33.2 Å²	33.2	28%	0.283	19%	0.193	S	C	.	.			trans	-100.8	104.2	168.5	-176	-13.7	0	0	0	109.3	T338 N343 K344 S345	T338-D341 PolarHBondContact O-N 3.48Å; D341-N343 PolarHBondContact O-N 3.28Å; D341-N343 WeakPolarHBondContact OD1-CB 3.23Å; D341-N343 PolarHBondContact OD1-N 2.89Å; D341-N343 PolarHBondContact OD1-ND2 2.92Å; D341-K344 HydrophobicContact CB-CB 4.36Å; D341-K344 PolarHBondContact O-N 3.35Å; D341-S345 VanDerWaalsContact O-CB 3.32Å; D341-S345 WeakPolarHBondContact O-CB 3.34Å; D341-S345 PolarHBondContact O-N 3.39Å
342	P	88	Confident	93.2	Very high	76 Å²	76	31.7 Å²	31.7	49%	0.494	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.8	-176.1	26.1	-35.4	0	0	0	113.8	Q296	Q296-P342 PolarHBondContact NE2-O 2.8Å
343	N	89.6	Confident	92.8	Very high	76 Å²	76	31.2 Å²	31.2	41%	0.406	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-16.7	176.8	-57.1	-66.8	0	0	0	114	R297 D341	R297-N343 PolarHBondContact NH1-OD1 3.3Å; D341-N343 PolarHBondContact O-N 3.28Å; D341-N343 WeakPolarHBondContact OD1-CB 3.23Å; D341-N343 PolarHBondContact OD1-N 2.89Å; D341-N343 PolarHBondContact OD1-ND2 2.92Å
344	K	92.9	Very high	92.1	Very high	99 Å²	99	30.5 Å²	30.5	43%	0.43	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.4	-0.9	-169.3	-60.7	-173.1	176.5	-169.2	0	114.1	T338 D341 C346	T338-K344 WeakPolarHBondContact CB-O 3.37Å; T338-K344 HydrophobicContact CG2-CB 3.71Å; T338-K344 HydrophobicContact CG2-CD 4.24Å; T338-K344 PolarHBondContact OG1-O 2.94Å; D341-K344 HydrophobicContact CB-CB 4.36Å; D341-K344 PolarHBondContact O-N 3.35Å; K344-C346 VanDerWaalsContact C-N 3.3Å; K344-C346 PolarHBondContact O-N 3.36Å; K344-C346 PolarHBondContact O-SG 2.75Å
345	S	96.8	Very high	91.3	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	17%	0.171	C	C	.	.			trans	-77.7	81.4	172.9	-166.3	0	0	0	0	110.1	D311 T312 A313 T338 I339 D341	D311-S345 WeakPolarHBondContact O-CB 3.46Å; D311-S345 PolarHBondContact O-OG 3.18Å; T312-S345 WeakPolarHBondContact CA-OG 3.3Å; T312-S345 VanDerWaalsContact CB-OG 3.3Å; T312-S345 WeakPolarHBondContact CB-OG 3.49Å; T312-S345 PolarHBondContact OG1-OG 2.94Å; A313-S345 PolarHBondContact N-O 2.64Å; T338-S345 VanDerWaalsContact O-CB 3.27Å; T338-S345 WeakPolarHBondContact O-CB 3.41Å; I339-S345 WeakPolarHBondContact CA-OG 3.39Å; I339-S345 WeakPolarHBondContact O-CB 3.49Å; I339-S345 PolarHBondContact O-OG 2.98Å; D341-S345 VanDerWaalsContact O-CB 3.32Å; D341-S345 WeakPolarHBondContact O-CB 3.34Å; D341-S345 PolarHBondContact O-N 3.39Å
346	C	97.1	Very high	90.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	149.6	-172.4	34	0	0	0	0	110.2	L289 F292 C293 A313 K344	L289-C346 HydrophobicContact CD1-CB 4.23Å; L289-C346 WeakPolarHBondContact CD1-O 3.33Å; F292-C346 HydrophobicContact CD1-CB 4.13Å; F292-C346 HydrophobicContact CE1-CB 4.22Å; C293-C346 HydrophobicContact CB-CB 4.02Å; C293-C346 WeakPolarHBondContact CB-SG 3.49Å; C293-C346 WeakPolarHBondContact SG-CB 3.32Å; C293-C346 CovalentContact SG-SG 1.99Å; C293-C346 PolarHBondContact SG-SG 3.19Å; A313-C346 CarbonylContact O-C 3.54Å; A313-C346 WeakPolarHBondContact O-CA 3.26Å; K344-C346 VanDerWaalsContact C-N 3.3Å; K344-C346 PolarHBondContact O-N 3.36Å; K344-C346 PolarHBondContact O-SG 2.75Å
347	S	98	Very high	90.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	156.9	169.3	60.3	0	0	0	0	111.5	F292 A313 I314 L315 V333	F292-S347 WeakPolarHBondContact CE1-O 3.37Å; A313-S347 PolarHBondContact O-N 3.15Å; I314-S347 WeakPolarHBondContact CG1-OG 3.1Å; L315-S347 PolarHBondContact N-O 2.99Å; V333-S347 WeakPolarHBondContact O-CA 3.16Å
348	V	97.6	Very high	90	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.3	176.5	-56.9	0	0	0	0	108.2	T288 L289 F292 L315 F321 G332 V333	T288-V348 HydrophobicContact CG2-CB 4.42Å; T288-V348 HydrophobicContact CG2-CG1 4.12Å; L289-V348 HydrophobicContact CB-CG1 4.23Å; L289-V348 HydrophobicContact CB-CG2 4.18Å; L289-V348 HydrophobicContact CD1-CG1 4.07Å; F292-V348 HydrophobicContact CB-CG1 4.15Å; F292-V348 HydrophobicContact CD1-CG1 3.97Å; F292-V348 HydrophobicContact CG-CG1 4.36Å; L315-V348 HydrophobicContact CB-CB 4.47Å; L315-V348 HydrophobicContact CB-CG1 4.07Å; L315-V348 HydrophobicContact CD2-CG1 4.09Å; F321-V348 HydrophobicContact CE2-CB 4.5Å; F321-V348 HydrophobicContact CE2-CG2 4.03Å; F321-V348 HydrophobicContact CZ-CB 4.16Å; F321-V348 HydrophobicContact CZ-CG2 3.89Å; G332-V348 CarbonylContact C-O 3.46Å; G332-V348 WeakPolarHBondContact CA-O 3.3Å; V333-V348 HydrophobicContact CB-CG2 3.9Å; V333-V348 HydrophobicContact CG2-CG2 4.35Å; V333-V348 PolarHBondContact N-O 2.96Å; V333-V348 PolarHBondContact O-N 3.48Å
349	I	95.8	Very high	89.6	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.4	-175.3	-67.2	102.5	0	0	0	109.2	I314 L315 L316 T317 A356 T359 L360 E363	I314-I349 HydrophobicContact CG2-CD1 3.41Å; I314-I349 VanDerWaalsContact CG2-CD1 3.41Å; L315-I349 PolarHBondContact O-N 3.38Å; L316-I349 HydrophobicContact CD2-CB 4.05Å; L316-I349 HydrophobicContact CD2-CG2 4.09Å; T317-I349 PolarHBondContact N-O 2.98Å; I349-A356 HydrophobicContact CG2-CB 4.25Å; I349-T359 HydrophobicContact CG1-CG2 4.23Å; I349-T359 HydrophobicContact CG2-CG2 3.88Å; I349-L360 HydrophobicContact CD1-CB 4.46Å; I349-L360 HydrophobicContact CD1-CG 4.47Å; I349-E363 HydrophobicContact CD1-CB 4.34Å; I349-E363 HydrophobicContact CD1-CG 4.38Å; I349-E363 HydrophobicContact CG1-CB 4.4Å; I349-E363 HydrophobicContact CG1-CG 3.94Å
350	E	92.3	Very high	89.5	Confident	12 Å²	12	23 Å²	23	6%	0.056	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	122.9	164.8	-174.9	-179.7	155.1	0	0	108.9	T317 N320 F321 L331 E352	T317-E350 CarbonylContact O-C 3.56Å; T317-E350 WeakPolarHBondContact O-CA 3.47Å; N320-E350 WeakPolarHBondContact CA-OE2 3.31Å; N320-E350 PolarHBondContact OD1-OE1 3.41Å; F321-E350 HydrophobicContact CD2-CB 4.41Å; F321-E350 HydrophobicContact CE2-CB 4.33Å; L331-E350 WeakPolarHBondContact O-CB 3.49Å; L331-E350 PolarHBondContact O-N 2.92Å; E350-E352 HydrophobicContact CG-CG 4.44Å; E350-E352 PolarHBondContact O-N 2.84Å
351	D	89.6	Confident	89.4	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.106	C	C	.	.			trans	-79.1	115	176.8	179.8	79.6	0	0	0	110.6	M230 Y234 H241 T317 R318 G353	M230-D351 HydrophobicContact CE-CB 3.85Å; M230-D351 HydrophobicContact SD-CB 3.37Å; M230-D351 WeakPolarHBondContact SD-CB 3.45Å; Y234-D351 VanDerWaalsContact CE2-OD2 3.25Å; Y234-D351 WeakPolarHBondContact CE2-OD2 3.32Å; Y234-D351 PolarHBondContact OH-OD2 3.14Å; H241-D351 IonicContact CD2-OD1 3.75Å; H241-D351 IonicContact CE1-OD1 3.9Å; H241-D351 IonicContact NE2-OD1 3.15Å; H241-D351 PolarHBondContact NE2-OD1 3.32Å; H241-D351 IonicContact NE2-OD2 2.73Å; T317-D351 PolarHBondContact O-N 3.46Å; R318-D351 WeakPolarHBondContact CD-O 3.4Å; R318-D351 PolarHBondContact NH1-O 2.95Å; R318-D351 IonicContact NH1-OD2 3.62Å; D351-G353 PolarHBondContact OD2-N 3.33Å
352	E	81.4	Confident	89.4	Confident	22 Å²	22	18.8 Å²	18.8	10%	0.103	10%	0.097	C	C	.	.			trans	-115.6	42.9	171.5	-60.6	-165.3	133.6	0	0	111.1	L331 E350 I454 K488	L331-E352 HydrophobicContact CD2-CG 4.09Å; L331-E352 WeakPolarHBondContact CD2-OE1 3.39Å; E350-E352 HydrophobicContact CG-CG 4.44Å; E350-E352 PolarHBondContact O-N 2.84Å; E352-I454 VanDerWaalsContact O-CG1 3.31Å; E352-I454 WeakPolarHBondContact O-CG1 3.34Å; E352-K488 VanDerWaalsContact CD-NZ 3.32Å; E352-K488 IonicContact OE1-NZ 2.57Å; E352-K488 PolarHBondContact OE1-NZ 2.86Å; E352-K488 IonicContact OE2-NZ 3.93Å
353	G	82.9	Confident	89.8	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	72.5	-147.2	-173.1	0	0	0	0	0	112.3	L245 D351 Q355 A356	L245-G353 WeakPolarHBondContact CD2-O 3.39Å; D351-G353 PolarHBondContact OD2-N 3.33Å; G353-Q355 PolarHBondContact O-N 3.46Å; G353-A356 VanDerWaalsContact O-CB 3.29Å; G353-A356 WeakPolarHBondContact O-CB 3.32Å; G353-A356 PolarHBondContact O-N 3.43Å; G353-A356 VanDerWaalsContact O-N 3.08Å
354	L	79.1	Confident	90.2	Very high	19 Å²	19	12.1 Å²	12.1	10%	0.099	6%	0.057	C	C	.	.	G	3₁₀ helix	trans	-58.9	-25.3	-174.5	-169.4	62.9	0	0	0	113.7	T244 L245 V248 A356 A357 P439 Y445 A495	T244-L354 HydrophobicContact CG2-CD1 3.9Å; L245-L354 HydrophobicContact CD2-CD1 4.28Å; V248-L354 HydrophobicContact CG2-CD1 4.13Å; L354-A356 PolarHBondContact O-N 3.21Å; L354-A357 VanDerWaalsContact O-CB 3.26Å; L354-A357 WeakPolarHBondContact O-CB 3.33Å; L354-A357 PolarHBondContact O-N 3.42Å; L354-A357 VanDerWaalsContact O-N 3.11Å; L354-P439 HydrophobicContact CD1-CB 4.43Å; L354-P439 HydrophobicContact CD2-CB 4Å; L354-Y445 HydrophobicContact CB-CD1 4.17Å; L354-Y445 HydrophobicContact CB-CE1 4.02Å; L354-Y445 HydrophobicContact CD1-CE1 4.06Å; L354-Y445 HydrophobicContact CD1-CE2 4.39Å; L354-A495 HydrophobicContact CD2-CB 3.35Å
355	Q	78.2	Confident	90.4	Very high	15 Å²	15	7.4 Å²	7.4	7%	0.07	4%	0.037	C	C	.	.	G	3₁₀ helix	trans	-67.9	-21.7	-179.2	-61.7	-62.9	-18.5	0	0	113.1	G353 A357 H358 T359 L492 P493	G353-Q355 PolarHBondContact O-N 3.46Å; Q355-A357 PolarHBondContact O-N 3.35Å; Q355-H358 WeakPolarHBondContact O-CB 3.02Å; Q355-H358 PolarHBondContact O-N 2.88Å; Q355-H358 PolarHBondContact OE1-CE1 2.74Å; Q355-H358 PolarHBondContact OE1-ND1 2.04Å; Q355-T359 PolarHBondContact O-N 3.17Å; Q355-L492 HydrophobicContact CB-CD2 4.35Å; Q355-L492 VanDerWaalsContact CD-CD2 3.44Å; Q355-L492 HydrophobicContact CG-CB 4.33Å; Q355-L492 HydrophobicContact CG-CD1 4.09Å; Q355-L492 HydrophobicContact CG-CD2 3.74Å; Q355-L492 HydrophobicContact CG-CG 4.24Å; Q355-P493 PolarHBondContact NE2-O 3.14Å
356	A	85.7	Confident	90.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-56.8	-20.5	171.3	0	0	0	0	0	112.6	L245 I349 G353 L354 H358 T359 L360	L245-A356 HydrophobicContact CD1-CB 3.88Å; L245-A356 HydrophobicContact CD2-CB 4.13Å; I349-A356 HydrophobicContact CG2-CB 4.25Å; G353-A356 VanDerWaalsContact O-CB 3.29Å; G353-A356 WeakPolarHBondContact O-CB 3.32Å; G353-A356 PolarHBondContact O-N 3.43Å; G353-A356 VanDerWaalsContact O-N 3.08Å; L354-A356 PolarHBondContact O-N 3.21Å; A356-H358 VanDerWaalsContact C-N 3.35Å; A356-T359 PolarHBondContact O-N 3.32Å; A356-L360 VanDerWaalsContact O-CB 3.22Å; A356-L360 WeakPolarHBondContact O-CB 2.99Å; A356-L360 PolarHBondContact O-N 3.39Å
357	A	83.4	Confident	90.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-64.5	-37.5	173.4	0	0	0	0	0	112.9	L245 V248 L354 Q355 A361	L245-A357 HydrophobicContact CB-CB 4.33Å; L245-A357 HydrophobicContact CD2-CB 4.11Å; L245-A357 WeakPolarHBondContact O-CB 2.93Å; V248-A357 HydrophobicContact CB-CB 3.67Å; V248-A357 HydrophobicContact CG1-CB 3.59Å; L354-A357 VanDerWaalsContact O-CB 3.26Å; L354-A357 WeakPolarHBondContact O-CB 3.33Å; L354-A357 PolarHBondContact O-N 3.42Å; L354-A357 VanDerWaalsContact O-N 3.11Å; Q355-A357 PolarHBondContact O-N 3.35Å; A357-A361 WeakPolarHBondContact O-CB 3.47Å; A357-A361 PolarHBondContact O-N 3.2Å
358	H	84.4	Confident	90.5	Very high	35 Å²	35	8 Å²	8	16%	0.162	4%	0.039	C	C	.	.	H	α-helix	trans	-69.3	-44.1	175.8	-66.7	112.4	0	0	0	110.5	Q355 A356 A361 H362 M390 F395	Q355-H358 WeakPolarHBondContact O-CB 3.02Å; Q355-H358 PolarHBondContact O-N 2.88Å; Q355-H358 PolarHBondContact OE1-CE1 2.74Å; Q355-H358 PolarHBondContact OE1-ND1 2.04Å; A356-H358 VanDerWaalsContact C-N 3.35Å; H358-A361 PolarHBondContact O-N 2.04Å; H358-H362 WeakPolarHBondContact O-CB 3.41Å; H358-H362 PolarHBondContact O-N 3.35Å; H358-M390 HydrophobicContact CB-CE 3.94Å; H358-M390 VanDerWaalsContact O-CE 3.27Å; H358-M390 WeakPolarHBondContact O-CE 3.29Å; H358-F395 HydrophobicContact CB-CE2 4.4Å; H358-F395 HydrophobicContact CB-CZ 4.35Å
359	T	87.9	Confident	90.4	Very high	19 Å²	19	9.4 Å²	9.4	12%	0.117	5%	0.049	C	C	.	.	H	α-helix	trans	-61.6	-44.2	174.2	-48.4	0	0	0	0	111.2	L331 I349 Q355 A356 A361 H362 E363	L331-T359 HydrophobicContact CB-CG2 3.78Å; L331-T359 WeakPolarHBondContact O-CG2 3.49Å; I349-T359 HydrophobicContact CG1-CG2 4.23Å; I349-T359 HydrophobicContact CG2-CG2 3.88Å; Q355-T359 PolarHBondContact O-N 3.17Å; A356-T359 PolarHBondContact O-N 3.32Å; T359-A361 VanDerWaalsContact C-N 3.32Å; T359-A361 PolarHBondContact O-N 3.37Å; T359-H362 WeakPolarHBondContact O-CB 3.26Å; T359-H362 PolarHBondContact O-N 2.96Å; T359-H362 VanDerWaalsContact O-N 3.13Å; T359-E363 HydrophobicContact CG2-CG 4.39Å; T359-E363 WeakPolarHBondContact O-CG 3.4Å; T359-E363 PolarHBondContact O-N 3.08Å
360	L	92.6	Very high	90.4	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-57.9	-45.9	174.8	-173.1	159.7	0	0	0	111.1	L224 M246 A249 I314 I349 A356 H362 E363 L364	L224-L360 HydrophobicContact CD2-CD1 4.47Å; M246-L360 HydrophobicContact SD-CD1 4.4Å; M246-L360 HydrophobicContact SD-CD2 4.17Å; A249-L360 HydrophobicContact CB-CD2 3.64Å; I314-L360 HydrophobicContact CD1-CD1 4.11Å; I314-L360 HydrophobicContact CD1-CD2 3.82Å; I314-L360 HydrophobicContact CD1-CG 3.82Å; I314-L360 HydrophobicContact CG2-CD1 4.18Å; I314-L360 HydrophobicContact CG2-CG 4.4Å; I349-L360 HydrophobicContact CD1-CB 4.46Å; I349-L360 HydrophobicContact CD1-CG 4.47Å; A356-L360 VanDerWaalsContact O-CB 3.22Å; A356-L360 WeakPolarHBondContact O-CB 2.99Å; A356-L360 PolarHBondContact O-N 3.39Å; L360-H362 VanDerWaalsContact C-N 3.33Å; L360-H362 PolarHBondContact O-N 2.86Å; L360-E363 PolarHBondContact O-N 3.12Å; L360-L364 VanDerWaalsContact O-CB 3.31Å; L360-L364 WeakPolarHBondContact O-CB 3.11Å; L360-L364 PolarHBondContact O-N 3.27Å
361	A	91.3	Very high	90.6	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-64.5	-36.6	176.8	0	0	0	0	0	112.7	A249 I252 Y253 A357 H358 T359 G365 M390	A249-A361 HydrophobicContact CB-CB 4.24Å; I252-A361 HydrophobicContact CD1-CB 4.21Å; I252-A361 HydrophobicContact CG2-CB 4.46Å; Y253-A361 HydrophobicContact CE2-CB 3.99Å; Y253-A361 PolarHBondContact OH-O 2.68Å; A357-A361 WeakPolarHBondContact O-CB 3.47Å; A357-A361 PolarHBondContact O-N 3.2Å; H358-A361 PolarHBondContact O-N 2.04Å; T359-A361 VanDerWaalsContact C-N 3.32Å; T359-A361 PolarHBondContact O-N 3.37Å; A361-G365 PolarHBondContact O-N 2.74Å; A361-M390 HydrophobicContact CB-CG 4.34Å; A361-M390 HydrophobicContact CB-SD 4.04Å
362	H	93.3	Very high	90.8	Very high	19 Å²	19	12.7 Å²	12.7	9%	0.088	7%	0.066	C	C	.	.	H	α-helix	trans	-63.6	-52.3	174.5	-174.6	102.8	0	0	0	111.8	H358 T359 L360 L364 G365 H366 H372 M390 M391 A392	H358-H362 WeakPolarHBondContact O-CB 3.41Å; H358-H362 PolarHBondContact O-N 3.35Å; T359-H362 WeakPolarHBondContact O-CB 3.26Å; T359-H362 PolarHBondContact O-N 2.96Å; T359-H362 VanDerWaalsContact O-N 3.13Å; L360-H362 VanDerWaalsContact C-N 3.33Å; L360-H362 PolarHBondContact O-N 2.86Å; H362-L364 VanDerWaalsContact C-N 3.35Å; H362-L364 PolarHBondContact O-N 2.98Å; H362-G365 VanDerWaalsContact O-CA 3.27Å; H362-G365 WeakPolarHBondContact O-CA 3.49Å; H362-G365 PolarHBondContact O-N 3.46Å; H362-H366 AromaticContact CD2-CD2 3.63Å; H362-H366 AromaticContact CD2-NE2 3.44Å; H362-H366 PolarHBondContact CD2-NE2 3.18Å; H362-H366 AromaticContact NE2-CD2 3.71Å; H362-H366 AromaticContact NE2-CE1 3.96Å; H362-H366 AromaticContact NE2-NE2 3Å; H362-H366 PolarHBondContact NE2-NE2 2.95Å; H362-H366 PolarHBondContact O-N 2.97Å; H362-H366 VanDerWaalsContact O-N 3.15Å; H362-H372 AromaticContact CE1-CD2 3.64Å; H362-H372 AromaticContact CE1-NE2 3.68Å; H362-H372 AromaticContact NE2-CD2 3.49Å; H362-H372 PolarHBondContact NE2-CD2 3.05Å; H362-H372 AromaticContact NE2-NE2 3.15Å; H362-H372 PolarHBondContact NE2-NE2 3.4Å; H362-H372 VanDerWaalsContact NE2-NE2 3.15Å; H362-M390 HydrophobicContact CB-CE 4.25Å; H362-M390 PolarHBondContact ND1-O 3.4Å; H362-M391 WeakPolarHBondContact O-CE 3.45Å; H362-A392 PolarHBondContact CE1-O 2.67Å
363	E	96.8	Very high	91.3	Very high	13 Å²	13	11.7 Å²	11.7	6%	0.061	6%	0.061	C	C	.	.	H	α-helix	trans	-66	-37.8	-178.3	-63.4	-44.6	136.5	0	0	112.1	G332 V333 A334 I349 T359 L360 G365 H366 V367	G332-E363 VanDerWaalsContact C-CD 3.4Å; G332-E363 VanDerWaalsContact C-OE1 3.3Å; G332-E363 WeakPolarHBondContact CA-OE1 3.44Å; V333-E363 VanDerWaalsContact C-OE2 3.25Å; V333-E363 WeakPolarHBondContact CA-OE2 3.09Å; V333-E363 PolarHBondContact N-OE2 3.15Å; A334-E363 HydrophobicContact CB-CB 4.15Å; A334-E363 WeakPolarHBondContact CB-OE2 3.45Å; A334-E363 PolarHBondContact N-OE2 3.18Å; A334-E363 VanDerWaalsContact N-OE2 3.1Å; I349-E363 HydrophobicContact CD1-CB 4.34Å; I349-E363 HydrophobicContact CD1-CG 4.38Å; I349-E363 HydrophobicContact CG1-CB 4.4Å; I349-E363 HydrophobicContact CG1-CG 3.94Å; T359-E363 HydrophobicContact CG2-CG 4.39Å; T359-E363 WeakPolarHBondContact O-CG 3.4Å; T359-E363 PolarHBondContact O-N 3.08Å; L360-E363 PolarHBondContact O-N 3.12Å; E363-G365 PolarHBondContact O-N 2.88Å; E363-H366 WeakPolarHBondContact O-CB 3.49Å; E363-H366 PolarHBondContact O-N 2.83Å; E363-H366 IonicContact OE2-CD2 3.73Å; E363-V367 PolarHBondContact O-N 3.38Å; E363-V367 VanDerWaalsContact O-N 3.09Å
364	L	97.7	Very high	91.7	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.7	-30.3	171.4	-176.2	60	0	0	0	111.5	V220 Y253 L264 T312 L360 H362 V367 L368	V220-L364 HydrophobicContact CG1-CD1 4.24Å; Y253-L364 HydrophobicContact CD2-CD2 4.48Å; Y253-L364 HydrophobicContact CE2-CB 4.31Å; Y253-L364 HydrophobicContact CE2-CD2 3.78Å; Y253-L364 HydrophobicContact CE2-CG 4.24Å; Y253-L364 WeakPolarHBondContact OH-CB 3.24Å; Y253-L364 WeakPolarHBondContact OH-CG 3.43Å; L264-L364 HydrophobicContact CD1-CD2 3.9Å; L264-L364 HydrophobicContact CD2-CD2 3.62Å; L264-L364 HydrophobicContact CG-CD2 4.44Å; T312-L364 HydrophobicContact CG2-CD1 4.09Å; L360-L364 VanDerWaalsContact O-CB 3.31Å; L360-L364 WeakPolarHBondContact O-CB 3.11Å; L360-L364 PolarHBondContact O-N 3.27Å; H362-L364 VanDerWaalsContact C-N 3.35Å; H362-L364 PolarHBondContact O-N 2.98Å; L364-V367 HydrophobicContact CD1-CB 4.38Å; L364-V367 PolarHBondContact O-N 3.22Å; L364-L368 HydrophobicContact CD1-CD1 4.45Å; L364-L368 HydrophobicContact CD1-CG 4.49Å; L364-L368 HydrophobicContact CG-CD1 4.06Å; L364-L368 WeakPolarHBondContact O-CB 3.2Å; L364-L368 VanDerWaalsContact O-CG 3.32Å; L364-L368 WeakPolarHBondContact O-CG 3.48Å; L364-L368 PolarHBondContact O-N 2.86Å
365	G	97.6	Very high	92.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.2	-45.9	171.4	0	0	0	0	0	112	Y253 A361 H362 E363 L368 S369 M370	Y253-G365 WeakPolarHBondContact OH-CA 3.03Å; Y253-G365 PolarHBondContact OH-N 3.21Å; A361-G365 PolarHBondContact O-N 2.74Å; H362-G365 VanDerWaalsContact O-CA 3.27Å; H362-G365 WeakPolarHBondContact O-CA 3.49Å; H362-G365 PolarHBondContact O-N 3.46Å; E363-G365 PolarHBondContact O-N 2.88Å; G365-L368 CarbonylContact O-C 3.4Å; G365-L368 VanDerWaalsContact O-C 3.23Å; G365-L368 WeakPolarHBondContact O-CA 3.41Å; G365-L368 PolarHBondContact O-N 3.38Å; G365-S369 PolarHBondContact O-N 2.95Å; G365-M370 VanDerWaalsContact O-CB 3.28Å; G365-M370 WeakPolarHBondContact O-CB 3.18Å; G365-M370 WeakPolarHBondContact O-CG 3.21Å; G365-M370 PolarHBondContact O-N 2.88Å
366	H	97.1	Very high	92.8	Very high	13 Å²	13	24.6 Å²	24.6	6%	0.06	12%	0.124	C	C	.	.	H	α-helix	trans	-59.4	-50.5	172.9	-74.1	-54.1	0	0	0	111.5	A334 D335 I336 G337 H362 E363 L368 S369 M370 H372	A334-H366 HydrophobicContact CB-CB 4Å; D335-H366 CarbonylContact O-C 3.38Å; I336-H366 CarbonylContact C-O 3.5Å; I336-H366 WeakPolarHBondContact CA-O 3.29Å; I336-H366 HydrophobicContact CG1-CB 4.13Å; G337-H366 PolarHBondContact N-O 2.7Å; H362-H366 AromaticContact CD2-CD2 3.63Å; H362-H366 AromaticContact CD2-NE2 3.44Å; H362-H366 PolarHBondContact CD2-NE2 3.18Å; H362-H366 AromaticContact NE2-CD2 3.71Å; H362-H366 AromaticContact NE2-CE1 3.96Å; H362-H366 AromaticContact NE2-NE2 3Å; H362-H366 PolarHBondContact NE2-NE2 2.95Å; H362-H366 PolarHBondContact O-N 2.97Å; H362-H366 VanDerWaalsContact O-N 3.15Å; E363-H366 WeakPolarHBondContact O-CB 3.49Å; E363-H366 PolarHBondContact O-N 2.83Å; E363-H366 IonicContact OE2-CD2 3.73Å; H366-L368 PolarHBondContact O-N 3.16Å; H366-L368 VanDerWaalsContact O-N 3.14Å; H366-S369 WeakPolarHBondContact O-CA 3.49Å; H366-S369 PolarHBondContact O-N 3.4Å; H366-M370 PolarHBondContact ND1-O 3.32Å; H366-H372 AromaticContact CE1-CD2 3.27Å; H366-H372 PolarHBondContact CE1-CD2 3.16Å; H366-H372 AromaticContact CE1-NE2 3.29Å; H366-H372 PolarHBondContact CE1-NE2 2.89Å; H366-H372 VanDerWaalsContact CE1-NE2 3.29Å; H366-H372 AromaticContact NE2-CD2 3.45Å; H366-H372 PolarHBondContact NE2-CD2 3.28Å; H366-H372 AromaticContact NE2-NE2 3.08Å; H366-H372 PolarHBondContact NE2-NE2 2.8Å
367	V	97.9	Very high	93	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-55.4	-36	177.2	178.5	0	0	0	0	111.1	A334 D335 G337 T338 I339 E363 L364 S369	A334-V367 HydrophobicContact CB-CG2 3.89Å; D335-V367 PolarHBondContact O-N 2.88Å; G337-V367 CarbonylContact C-O 3.52Å; G337-V367 WeakPolarHBondContact CA-O 3.47Å; G337-V367 PolarHBondContact N-O 3.26Å; T338-V367 PolarHBondContact N-O 2.86Å; T338-V367 VanDerWaalsContact N-O 3.12Å; I339-V367 HydrophobicContact CB-CG1 3.86Å; I339-V367 HydrophobicContact CD1-CG1 3.69Å; I339-V367 HydrophobicContact CG1-CG1 4.36Å; I339-V367 PolarHBondContact N-O 3.1Å; I339-V367 VanDerWaalsContact N-O 3.16Å; E363-V367 PolarHBondContact O-N 3.38Å; E363-V367 VanDerWaalsContact O-N 3.09Å; L364-V367 HydrophobicContact CD1-CB 4.38Å; L364-V367 PolarHBondContact O-N 3.22Å; V367-S369 PolarHBondContact O-N 2.85Å
368	L	97.6	Very high	93.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	23.2	173.2	-68.5	170.7	0	0	0	114.6	Y253 I339 L364 G365 H366 M370 L412 L415 L424	Y253-L368 HydrophobicContact CE1-CD1 3.58Å; I339-L368 HydrophobicContact CB-CD2 4.17Å; I339-L368 HydrophobicContact CD1-CD2 4.29Å; I339-L368 HydrophobicContact CG1-CD2 3.89Å; I339-L368 HydrophobicContact CG2-CD2 4.33Å; L364-L368 HydrophobicContact CD1-CD1 4.45Å; L364-L368 HydrophobicContact CD1-CG 4.49Å; L364-L368 HydrophobicContact CG-CD1 4.06Å; L364-L368 WeakPolarHBondContact O-CB 3.2Å; L364-L368 VanDerWaalsContact O-CG 3.32Å; L364-L368 WeakPolarHBondContact O-CG 3.48Å; L364-L368 PolarHBondContact O-N 2.86Å; G365-L368 CarbonylContact O-C 3.4Å; G365-L368 VanDerWaalsContact O-C 3.23Å; G365-L368 WeakPolarHBondContact O-CA 3.41Å; G365-L368 PolarHBondContact O-N 3.38Å; H366-L368 PolarHBondContact O-N 3.16Å; H366-L368 VanDerWaalsContact O-N 3.14Å; L368-M370 VanDerWaalsContact C-N 3.32Å; L368-M370 HydrophobicContact CB-CE 4.07Å; L368-M370 HydrophobicContact CD1-CE 4.4Å; L368-M370 PolarHBondContact O-N 2.95Å; L368-L412 HydrophobicContact CB-CD1 4.11Å; L368-L412 HydrophobicContact CD2-CD1 4.32Å; L368-L415 HydrophobicContact CD2-CD2 4.43Å; L368-L415 WeakPolarHBondContact O-CD2 3.22Å; L368-L424 HydrophobicContact CD2-CD1 3.98Å
369	S	96.2	Very high	93.7	Very high	29 Å²	29	27.7 Å²	27.7	20%	0.203	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	15.6	172.9	-167.5	0	0	0	0	116.4	G365 H366 V367 P371	G365-S369 PolarHBondContact O-N 2.95Å; H366-S369 WeakPolarHBondContact O-CA 3.49Å; H366-S369 PolarHBondContact O-N 3.4Å; V367-S369 PolarHBondContact O-N 2.85Å; S369-P371 WeakPolarHBondContact O-CD 3.31Å
370	M	96.6	Very high	93.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-84.8	116.9	177.1	-51.1	-172.6	-148.4	0	0	109.8	Y253 I258 G365 H366 L368 M391 W404 L412	Y253-M370 HydrophobicContact CE1-CE 4.28Å; I258-M370 HydrophobicContact CD1-CE 4.1Å; I258-M370 HydrophobicContact CG1-CE 4.46Å; G365-M370 VanDerWaalsContact O-CB 3.28Å; G365-M370 WeakPolarHBondContact O-CB 3.18Å; G365-M370 WeakPolarHBondContact O-CG 3.21Å; G365-M370 PolarHBondContact O-N 2.88Å; H366-M370 PolarHBondContact ND1-O 3.32Å; L368-M370 VanDerWaalsContact C-N 3.32Å; L368-M370 HydrophobicContact CB-CE 4.07Å; L368-M370 HydrophobicContact CD1-CE 4.4Å; L368-M370 PolarHBondContact O-N 2.95Å; M370-M391 HydrophobicContact CB-CE 4.2Å; M370-M391 HydrophobicContact CB-CG 4.06Å; M370-M391 HydrophobicContact CB-SD 4.32Å; M370-M391 WeakPolarHBondContact O-CE 3.48Å; M370-M391 HydrophobicContact SD-CG 4.43Å; M370-W404 HydrophobicContact CE-CH2 4.45Å; M370-W404 HydrophobicContact CE-CZ3 4.08Å; M370-W404 HydrophobicContact SD-CE3 3.82Å; M370-W404 HydrophobicContact SD-CH2 4.42Å; M370-W404 HydrophobicContact SD-CZ3 3.53Å; M370-W404 VanDerWaalsContact SD-CZ3 3.53Å; M370-L412 HydrophobicContact CE-CB 3.84Å; M370-L412 HydrophobicContact CE-CD1 4.11Å; M370-L412 HydrophobicContact CE-CD2 3.82Å; M370-L412 HydrophobicContact CE-CG 4.13Å
371	P	94.7	Very high	93.5	Very high	18 Å²	18	40.1 Å²	40.1	12%	0.117	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-77.8	169.8	171.5	34.4	-35.5	0	0	0	110.7	S369 Y411	S369-P371 WeakPolarHBondContact O-CD 3.31Å; P371-Y411 HydrophobicContact CG-CD2 3.76Å; P371-Y411 HydrophobicContact CG-CE2 3.65Å; P371-Y411 HydrophobicContact CG-CG 4.27Å
372	H	94.3	Very high	93.5	Very high	63 Å²	63	44.1 Å²	44.1	29%	0.292	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-58.9	146	169.7	-65.5	159.4	0	0	0	112.2	H362 H366 D374 S375 C378 M391	H362-H372 AromaticContact CE1-CD2 3.64Å; H362-H372 AromaticContact CE1-NE2 3.68Å; H362-H372 AromaticContact NE2-CD2 3.49Å; H362-H372 PolarHBondContact NE2-CD2 3.05Å; H362-H372 AromaticContact NE2-NE2 3.15Å; H362-H372 PolarHBondContact NE2-NE2 3.4Å; H362-H372 VanDerWaalsContact NE2-NE2 3.15Å; H366-H372 AromaticContact CE1-CD2 3.27Å; H366-H372 PolarHBondContact CE1-CD2 3.16Å; H366-H372 AromaticContact CE1-NE2 3.29Å; H366-H372 PolarHBondContact CE1-NE2 2.89Å; H366-H372 VanDerWaalsContact CE1-NE2 3.29Å; H366-H372 AromaticContact NE2-CD2 3.45Å; H366-H372 PolarHBondContact NE2-CD2 3.28Å; H366-H372 AromaticContact NE2-NE2 3.08Å; H366-H372 PolarHBondContact NE2-NE2 2.8Å; H372-D374 VanDerWaalsContact C-N 3.25Å; H372-D374 WeakPolarHBondContact CB-OD1 3.21Å; H372-D374 PolarHBondContact O-N 2.82Å; H372-S375 WeakPolarHBondContact O-CB 3.48Å; H372-S375 PolarHBondContact O-N 3.2Å; H372-S375 PolarHBondContact O-OG 2.8Å; H372-C378 PolarHBondContact O-SG 2.79Å; H372-M391 VanDerWaalsContact CA-O 3.26Å; H372-M391 WeakPolarHBondContact CA-O 3.42Å
373	D	92.8	Very high	93.4	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.011	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-26.9	-177.3	-71.1	-41.5	0	0	0	113.4	S375 C378 M385 H389 M391 A392 S405 S408	D373-S375 VanDerWaalsContact C-N 3.29Å; D373-C378 VanDerWaalsContact O-CB 3.3Å; D373-C378 WeakPolarHBondContact O-CB 3.49Å; D373-M385 HydrophobicContact CB-CB 4.33Å; D373-M385 HydrophobicContact CB-CE 4.12Å; D373-M385 WeakPolarHBondContact O-CE 3.48Å; D373-H389 VanDerWaalsContact OD2-CB 3.24Å; D373-H389 WeakPolarHBondContact OD2-CB 3.35Å; D373-M391 PolarHBondContact N-O 2.81Å; D373-A392 PolarHBondContact OD2-N 2.88Å; D373-S405 WeakPolarHBondContact OD1-CB 3.46Å; D373-S405 PolarHBondContact OD1-OG 2.96Å; D373-S408 PolarHBondContact OD1-OG 3.05Å
374	D	91.4	Very high	93	Very high	95 Å²	95	49.9 Å²	49.9	51%	0.508	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	1.3	176.1	73	-23.4	0	0	0	113.6	H372 P393	H372-D374 VanDerWaalsContact C-N 3.25Å; H372-D374 WeakPolarHBondContact CB-OD1 3.21Å; H372-D374 PolarHBondContact O-N 2.82Å; D374-P393 WeakPolarHBondContact OD2-CG 3.48Å
375	S	91.3	Very high	92.3	Very high	26 Å²	26	51.5 Å²	51.5	18%	0.182	27%	0.267	C	S	.	.	S	Bend	trans	-61.5	150.7	178.7	70.7	0	0	0	0	111.8	H372 D373 P377 C378 T379	H372-S375 WeakPolarHBondContact O-CB 3.48Å; H372-S375 PolarHBondContact O-N 3.2Å; H372-S375 PolarHBondContact O-OG 2.8Å; D373-S375 VanDerWaalsContact C-N 3.29Å; S375-P377 VanDerWaalsContact C-CD 3.46Å; S375-P377 VanDerWaalsContact C-N 3.34Å; S375-C378 PolarHBondContact O-N 2.77Å; S375-C378 VanDerWaalsContact O-N 3.16Å; S375-C378 WeakPolarHBondContact OG-CB 3.5Å; S375-C378 PolarHBondContact OG-SG 2.82Å; S375-T379 WeakPolarHBondContact O-CG2 3.45Å; S375-T379 PolarHBondContact O-N 2.79Å; S375-T379 PolarHBondContact O-OG1 2.84Å
376	K	89.4	Confident	91.3	Very high	183 Å²	183	53.3 Å²	53.3	80%	0.796	29%	0.286	S	S	*	.	H	α-helix	trans	-53.6	-42.4	178.1	-66.3	-178.7	-178.8	176.2	0	113.4	T379 R380	K376-T379 WeakPolarHBondContact CA-OG1 3.4Å; K376-T379 PolarHBondContact O-OG1 3.39Å; K376-R380 WeakPolarHBondContact O-CB 3.33Å; K376-R380 PolarHBondContact O-N 3.1Å
377	P	88	Confident	90.4	Very high	49 Å²	49	58.4 Å²	58.4	32%	0.318	31%	0.308	S	S	.	.	H	α-helix	trans	-62.9	-44.9	176.8	-23.3	35.5	0	0	0	112.9	S375 L381 Y411	S375-P377 VanDerWaalsContact C-CD 3.46Å; S375-P377 VanDerWaalsContact C-N 3.34Å; P377-L381 WeakPolarHBondContact O-CG 3.43Å; P377-L381 PolarHBondContact O-N 2.75Å; P377-Y411 WeakPolarHBondContact CB-OH 3.01Å
378	C	91.7	Very high	89.6	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-51.2	178.2	-80.2	0	0	0	0	112	H372 D373 S375 R380 L381 F382 M385 C407	H372-C378 PolarHBondContact O-SG 2.79Å; D373-C378 VanDerWaalsContact O-CB 3.3Å; D373-C378 WeakPolarHBondContact O-CB 3.49Å; S375-C378 PolarHBondContact O-N 2.77Å; S375-C378 VanDerWaalsContact O-N 3.16Å; S375-C378 WeakPolarHBondContact OG-CB 3.5Å; S375-C378 PolarHBondContact OG-SG 2.82Å; C378-R380 VanDerWaalsContact C-N 3.28Å; C378-R380 PolarHBondContact O-N 3.25Å; C378-L381 PolarHBondContact O-N 2.71Å; C378-L381 VanDerWaalsContact O-N 3.12Å; C378-F382 PolarHBondContact O-N 2.87Å; C378-M385 HydrophobicContact CB-CE 3.49Å; C378-M385 VanDerWaalsContact CB-CE 3.49Å; C378-C407 WeakPolarHBondContact CA-SG 3.42Å; C378-C407 HydrophobicContact CB-CB 3.92Å; C378-C407 WeakPolarHBondContact CB-SG 3.26Å; C378-C407 WeakPolarHBondContact SG-CB 3.36Å; C378-C407 CovalentContact SG-SG 2.04Å; C378-C407 PolarHBondContact SG-SG 2.81Å
379	T	92.5	Very high	89.3	Confident	52 Å²	52	63.7 Å²	63.7	32%	0.319	33%	0.333	S	S	.	.	H	α-helix	trans	-63.1	-32.7	-179.8	50.4	0	0	0	0	113.2	S375 K376 G383	S375-T379 WeakPolarHBondContact O-CG2 3.45Å; S375-T379 PolarHBondContact O-N 2.79Å; S375-T379 PolarHBondContact O-OG1 2.84Å; K376-T379 WeakPolarHBondContact CA-OG1 3.4Å; K376-T379 PolarHBondContact O-OG1 3.39Å; T379-G383 WeakPolarHBondContact CA-O 3.43Å; T379-G383 WeakPolarHBondContact O-CA 3.27Å; T379-G383 PolarHBondContact O-N 2.89Å
380	R	88.4	Confident	88.9	Confident	189 Å²	189	62.4 Å²	62.4	71%	0.713	32%	0.323	S	S	*	.	H	α-helix	trans	-67	-36.5	174.5	-177.8	-176.1	65.8	165	0.8	112.9	K376 C378	K376-R380 WeakPolarHBondContact O-CB 3.33Å; K376-R380 PolarHBondContact O-N 3.1Å; C378-R380 VanDerWaalsContact C-N 3.28Å; C378-R380 PolarHBondContact O-N 3.25Å
381	L	86.5	Confident	88.8	Confident	92 Å²	92	62.4 Å²	62.4	48%	0.482	32%	0.323	S	S	.	.	H	α-helix	trans	-90.6	-37.6	-174	-70.2	172.8	0	0	0	112.9	P377 C378 M410	P377-L381 WeakPolarHBondContact O-CG 3.43Å; P377-L381 PolarHBondContact O-N 2.75Å; C378-L381 PolarHBondContact O-N 2.71Å; C378-L381 VanDerWaalsContact O-N 3.12Å; L381-M410 HydrophobicContact CD1-CE 3.82Å; L381-M410 HydrophobicContact CD1-SD 4.18Å
382	F	91.3	Very high	88.5	Confident	84 Å²	84	61.7 Å²	61.7	37%	0.368	32%	0.319	S	S	.	.	H	α-helix	trans	-118.9	-3.9	-171.4	-61	-79.1	0	0	0	113.7	C378 M385 P406 C407 M410	C378-F382 PolarHBondContact O-N 2.87Å; F382-M385 HydrophobicContact CB-CE 4.16Å; F382-M385 HydrophobicContact CB-CG 4.43Å; F382-M385 HydrophobicContact CB-SD 3.89Å; F382-M385 HydrophobicContact CG-SD 4.48Å; F382-P406 HydrophobicContact CD1-CB 3.83Å; F382-P406 HydrophobicContact CE1-CB 3.85Å; F382-P406 HydrophobicContact CG-CB 4.49Å; F382-C407 HydrophobicContact CD2-CB 3.73Å; F382-C407 HydrophobicContact CE2-CB 3.95Å; F382-M410 HydrophobicContact CE2-CB 4.42Å; F382-M410 HydrophobicContact CE2-CE 3.93Å; F382-M410 HydrophobicContact CE2-SD 3.67Å; F382-M410 HydrophobicContact CZ-CB 4.01Å; F382-M410 HydrophobicContact CZ-CE 4.38Å; F382-M410 HydrophobicContact CZ-CG 4.29Å; F382-M410 HydrophobicContact CZ-SD 3.55Å; F382-M410 VanDerWaalsContact CZ-SD 3.55Å
383	G	91	Very high	88	Confident	24 Å²	24	61.9 Å²	61.9	25%	0.247	33%	0.326	C	S	.	.			trans	76.3	-176.1	-171.3	0	0	0	0	0	112.6	T379 M385	T379-G383 WeakPolarHBondContact CA-O 3.43Å; T379-G383 WeakPolarHBondContact O-CA 3.27Å; T379-G383 PolarHBondContact O-N 2.89Å; G383-M385 PolarHBondContact O-N 2.84Å
384	P	88.4	Confident	87.2	Confident	129 Å²	129	66 Å²	66	84%	0.838	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-65	118.9	175.9	27.4	-32.7	0	0	0	110
385	M	83.5	Confident	85.8	Confident	33 Å²	33	63.8 Å²	63.8	16%	0.163	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-96.3	139.6	173.2	-65.5	171.6	-75	0	0	108.5	D373 C378 F382 G383 C407	D373-M385 HydrophobicContact CB-CB 4.33Å; D373-M385 HydrophobicContact CB-CE 4.12Å; D373-M385 WeakPolarHBondContact O-CE 3.48Å; C378-M385 HydrophobicContact CB-CE 3.49Å; C378-M385 VanDerWaalsContact CB-CE 3.49Å; F382-M385 HydrophobicContact CB-CE 4.16Å; F382-M385 HydrophobicContact CB-CG 4.43Å; F382-M385 HydrophobicContact CB-SD 3.89Å; F382-M385 HydrophobicContact CG-SD 4.48Å; G383-M385 PolarHBondContact O-N 2.84Å; M385-C407 HydrophobicContact CE-CB 3.52Å; M385-C407 HydrophobicContact SD-CB 3.85Å
386	G	76	Confident	84.4	Confident	38 Å²	38	65.4 Å²	65.4	39%	0.392	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-62.9	170.2	-177	0	0	0	0	0	112.8	H388	G386-H388 PolarHBondContact O-N 2.95Å; G386-H388 VanDerWaalsContact O-N 3.08Å
387	K	79.9	Confident	83.4	Confident	120 Å²	120	60.5 Å²	60.5	52%	0.522	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	34.3	-179.4	-58.5	-175.7	179.4	-174.7	0	113	V396	K387-V396 HydrophobicContact CB-CG2 4.28Å; K387-V396 HydrophobicContact CD-CG2 4.33Å
388	H	81.1	Confident	82.6	Confident	88 Å²	88	58.9 Å²	58.9	41%	0.407	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	5.8	-169.5	-51.4	-62	0	0	0	114.2	G386 H397 N399	G386-H388 PolarHBondContact O-N 2.95Å; G386-H388 VanDerWaalsContact O-N 3.08Å; H388-H397 WeakPolarHBondContact CA-O 3.46Å; H388-H397 WeakPolarHBondContact CB-O 3.36Å; H388-H397 PolarHBondContact ND1-O 3.48Å; H388-N399 HydrophobicContact CB-CB 4.14Å; H388-N399 PolarHBondContact O-N 3.02Å
389	H	89.5	Confident	81.9	Confident	23 Å²	23	61.5 Å²	61.5	11%	0.106	32%	0.324	C	S	.	.	S	Bend	trans	-104.4	162.3	176.8	-59.2	-58.9	0	0	0	110.1	D373 M391 A392 L402 P403	D373-H389 VanDerWaalsContact OD2-CB 3.24Å; D373-H389 WeakPolarHBondContact OD2-CB 3.35Å; H389-M391 PolarHBondContact O-N 3.4Å; H389-A392 VanDerWaalsContact O-CB 3.29Å; H389-A392 WeakPolarHBondContact O-CB 3.26Å; H389-A392 PolarHBondContact O-N 2.61Å; H389-A392 VanDerWaalsContact O-N 3.09Å; H389-L402 PolarHBondContact ND1-O 2.86Å; H389-P403 CarbonylContact C-O 3.54Å; H389-P403 VanDerWaalsContact CA-O 3.27Å; H389-P403 WeakPolarHBondContact CA-O 3.32Å
390	M	88.8	Confident	80.9	Confident	2 Å²	2	62 Å²	62	1%	0.01	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-37.6	-173.6	-165.6	66.5	-88.6	0	0	112	I252 H358 A361 H362 A392 F395 L398 P403 W404	I252-M390 HydrophobicContact CD1-SD 4.3Å; I252-M390 HydrophobicContact CG2-CG 4.45Å; I252-M390 HydrophobicContact CG2-SD 4.18Å; H358-M390 HydrophobicContact CB-CE 3.94Å; H358-M390 VanDerWaalsContact O-CE 3.27Å; H358-M390 WeakPolarHBondContact O-CE 3.29Å; A361-M390 HydrophobicContact CB-CG 4.34Å; A361-M390 HydrophobicContact CB-SD 4.04Å; H362-M390 HydrophobicContact CB-CE 4.25Å; H362-M390 PolarHBondContact ND1-O 3.4Å; M390-A392 VanDerWaalsContact C-N 3.31Å; M390-A392 PolarHBondContact O-N 3.26Å; M390-F395 HydrophobicContact CE-CD2 4.07Å; M390-F395 HydrophobicContact CE-CE2 3.76Å; M390-L398 HydrophobicContact CB-CD1 4.38Å; M390-L398 HydrophobicContact SD-CD1 4.36Å; M390-P403 PolarHBondContact N-O 3.16Å; M390-W404 HydrophobicContact CB-CD2 4.3Å; M390-W404 HydrophobicContact CB-CE3 3.95Å; M390-W404 HydrophobicContact CB-CH2 4.3Å; M390-W404 HydrophobicContact CB-CZ3 3.95Å; M390-W404 HydrophobicContact CG-CE3 4.44Å; M390-W404 HydrophobicContact CG-CH2 3.88Å; M390-W404 HydrophobicContact CG-CZ2 4.26Å; M390-W404 HydrophobicContact CG-CZ3 3.98Å
391	M	93.6	Very high	80.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	18.3	-179.1	-58.4	-51.8	-58.6	0	0	113.7	H362 M370 H372 D373 H389 W404 S408	H362-M391 WeakPolarHBondContact O-CE 3.45Å; M370-M391 HydrophobicContact CB-CE 4.2Å; M370-M391 HydrophobicContact CB-CG 4.06Å; M370-M391 HydrophobicContact CB-SD 4.32Å; M370-M391 WeakPolarHBondContact O-CE 3.48Å; M370-M391 HydrophobicContact SD-CG 4.43Å; H372-M391 VanDerWaalsContact CA-O 3.26Å; H372-M391 WeakPolarHBondContact CA-O 3.42Å; D373-M391 PolarHBondContact N-O 2.81Å; H389-M391 PolarHBondContact O-N 3.4Å; M391-W404 HydrophobicContact CG-CE3 4.39Å; M391-W404 HydrophobicContact CG-CZ3 4.07Å; M391-W404 HydrophobicContact SD-CZ3 4.02Å; M391-S408 WeakPolarHBondContact CG-OG 3.24Å
392	A	89.3	Confident	80.4	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.033	31%	0.314	C	S	.	.			trans	-69.4	134.9	168.8	0	0	0	0	0	110	H362 D373 H389 M390 L394	H362-A392 PolarHBondContact CE1-O 2.67Å; D373-A392 PolarHBondContact OD2-N 2.88Å; H389-A392 VanDerWaalsContact O-CB 3.29Å; H389-A392 WeakPolarHBondContact O-CB 3.26Å; H389-A392 PolarHBondContact O-N 2.61Å; H389-A392 VanDerWaalsContact O-N 3.09Å; M390-A392 VanDerWaalsContact C-N 3.31Å; M390-A392 PolarHBondContact O-N 3.26Å; A392-L394 PolarHBondContact O-N 3.19Å
393	P	83.8	Confident	80.2	Confident	66 Å²	66	53.1 Å²	53.1	43%	0.429	30%	0.298	S	S	.	.	S	Bend	trans	-71.1	-21.1	-178.5	29.2	-36.9	0	0	0	113.5	D374	D374-P393 WeakPolarHBondContact OD2-CG 3.48Å
394	L	74.9	Confident	80.3	Confident	90 Å²	90	52 Å²	52	47%	0.471	29%	0.286	S	S	.	.	S	Bend	trans	-124.7	115.2	171.7	-177.5	72.2	0	0	0	107.8	A392 V396	A392-L394 PolarHBondContact O-N 3.19Å; L394-V396 HydrophobicContact CD2-CG2 4.31Å; L394-V396 HydrophobicContact CG-CG2 4.4Å; L394-V396 PolarHBondContact O-N 3.08Å
395	F	63.4	Low	80.7	Confident	48 Å²	48	45.9 Å²	45.9	21%	0.211	25%	0.247	C	C	.	.			trans	-82.1	104.3	-178.2	-168.4	-93.1	0	0	0	110.1	H358 M390 L398 L492	H358-F395 HydrophobicContact CB-CE2 4.4Å; H358-F395 HydrophobicContact CB-CZ 4.35Å; M390-F395 HydrophobicContact CE-CD2 4.07Å; M390-F395 HydrophobicContact CE-CE2 3.76Å; F395-L398 HydrophobicContact CE2-CB 3.76Å; F395-L398 HydrophobicContact CE2-CD1 4.31Å; F395-L398 HydrophobicContact CZ-CB 3.57Å; F395-L492 HydrophobicContact CD1-CD2 4.43Å; F395-L492 HydrophobicContact CE1-CD2 4.28Å
396	V	62	Low	81.2	Confident	60 Å²	60	47.4 Å²	47.4	36%	0.364	26%	0.259	S	S	.	.	S	Bend	trans	-96.3	-47	177.3	-177.1	0	0	0	0	111	K387 L394 G490 S491	K387-V396 HydrophobicContact CB-CG2 4.28Å; K387-V396 HydrophobicContact CD-CG2 4.33Å; L394-V396 HydrophobicContact CD2-CG2 4.31Å; L394-V396 HydrophobicContact CG-CG2 4.4Å; L394-V396 PolarHBondContact O-N 3.08Å; V396-G490 CarbonylContact O-C 3.57Å; V396-S491 PolarHBondContact O-N 2.9Å; V396-S491 PolarHBondContact O-OG 2.8Å
397	H	67.8	Low	82.1	Confident	80 Å²	80	45.6 Å²	45.6	37%	0.37	24%	0.24	S	C	.	.			trans	-163.8	125.6	177.8	173.9	-82.3	0	0	0	108.4	H388 S491	H388-H397 WeakPolarHBondContact CA-O 3.46Å; H388-H397 WeakPolarHBondContact CB-O 3.36Å; H388-H397 PolarHBondContact ND1-O 3.48Å; H397-S491 WeakPolarHBondContact CA-OG 3.27Å; H397-S491 WeakPolarHBondContact CB-OG 3.25Å; H397-S491 PolarHBondContact CD2-OG 2Å
398	L	71.9	Confident	82.9	Confident	15 Å²	15	39.9 Å²	39.9	8%	0.079	22%	0.215	C	C	.	.			trans	-76.2	125	174.3	-175.5	66.6	0	0	0	111	M390 F395 Q400 P403	M390-L398 HydrophobicContact CB-CD1 4.38Å; M390-L398 HydrophobicContact SD-CD1 4.36Å; F395-L398 HydrophobicContact CE2-CB 3.76Å; F395-L398 HydrophobicContact CE2-CD1 4.31Å; F395-L398 HydrophobicContact CZ-CB 3.57Å; L398-Q400 PolarHBondContact O-N 3.03Å; L398-Q400 VanDerWaalsContact O-N 3.09Å; L398-P403 HydrophobicContact CD1-CB 3.89Å; L398-P403 HydrophobicContact CD2-CB 4.22Å; L398-P403 HydrophobicContact CG-CB 4.21Å
399	N	75.9	Confident	83.6	Confident	54 Å²	54	35.8 Å²	35.8	29%	0.289	20%	0.197	S	C	.	.			trans	-72.9	101.9	167.6	-176.4	-6.6	0	0	0	109.5	H388 T401 L402 P403	H388-N399 HydrophobicContact CB-CB 4.14Å; H388-N399 PolarHBondContact O-N 3.02Å; N399-T401 PolarHBondContact O-N 2.97Å; N399-T401 PolarHBondContact OD1-N 3.28Å; N399-T401 VanDerWaalsContact OD1-N 3.11Å; N399-T401 PolarHBondContact OD1-OG1 2.85Å; N399-L402 CarbonylContact O-C 3.54Å; N399-L402 PolarHBondContact O-N 2.82Å; N399-L402 VanDerWaalsContact O-N 3.07Å; N399-L402 PolarHBondContact OD1-N 3.21Å; N399-P403 VanDerWaalsContact O-CA 3.23Å; N399-P403 WeakPolarHBondContact O-CA 3.29Å; N399-P403 WeakPolarHBondContact O-CD 3.27Å
400	Q	72.2	Confident	83.7	Confident	62 Å²	62	36.7 Å²	36.7	29%	0.29	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-23.3	-176.3	-55.5	-171.3	16.4	0	0	113.6	L398 E508	L398-Q400 PolarHBondContact O-N 3.03Å; L398-Q400 VanDerWaalsContact O-N 3.09Å; Q400-E508 VanDerWaalsContact OE1-CG 3.24Å
401	T	79.6	Confident	84	Confident	102 Å²	102	38.8 Å²	38.8	63%	0.626	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-22.4	174.7	67.5	0	0	0	0	113	H255 N399	H255-T401 PolarHBondContact CE1-O 3Å; H255-T401 PolarHBondContact NE2-O 3.38Å; N399-T401 PolarHBondContact O-N 2.97Å; N399-T401 PolarHBondContact OD1-N 3.28Å; N399-T401 VanDerWaalsContact OD1-N 3.11Å; N399-T401 PolarHBondContact OD1-OG1 2.85Å
402	L	84.8	Confident	84	Confident	73 Å²	73	38.8 Å²	38.8	38%	0.382	21%	0.21	S	C	.	.	S	Bend	trans	-147.1	65.3	-179.7	-166	73.2	0	0	0	110.5	H389 N399 W404	H389-L402 PolarHBondContact ND1-O 2.86Å; N399-L402 CarbonylContact O-C 3.54Å; N399-L402 PolarHBondContact O-N 2.82Å; N399-L402 VanDerWaalsContact O-N 3.07Å; N399-L402 PolarHBondContact OD1-N 3.21Å; L402-W404 VanDerWaalsContact C-N 3.31Å; L402-W404 PolarHBondContact O-N 2.99Å
403	P	86.7	Confident	84.2	Confident	4 Å²	4	39.6 Å²	39.6	3%	0.026	21%	0.214	C	C	.	.			trans	-67.1	-33.6	-173.3	24.8	-33.7	0	0	0	111.8	H255 S257 H389 M390 L398 N399	H255-P403 HydrophobicContact CB-CG 3.75Å; H255-P403 VanDerWaalsContact CE1-CD 3.48Å; H255-P403 WeakPolarHBondContact CE1-CD 3.48Å; H255-P403 VanDerWaalsContact CG-CG 3.46Å; H255-P403 VanDerWaalsContact ND1-CD 3.32Å; H255-P403 WeakPolarHBondContact ND1-CD 3.25Å; S257-P403 WeakPolarHBondContact OG-CD 3.36Å; H389-P403 CarbonylContact C-O 3.54Å; H389-P403 VanDerWaalsContact CA-O 3.27Å; H389-P403 WeakPolarHBondContact CA-O 3.32Å; M390-P403 PolarHBondContact N-O 3.16Å; L398-P403 HydrophobicContact CD1-CB 3.89Å; L398-P403 HydrophobicContact CD2-CB 4.22Å; L398-P403 HydrophobicContact CG-CB 4.21Å; N399-P403 VanDerWaalsContact O-CA 3.23Å; N399-P403 WeakPolarHBondContact O-CA 3.29Å; N399-P403 WeakPolarHBondContact O-CD 3.27Å
404	W	93.8	Very high	84.3	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	22%	0.215	C	C	.	.	S	Bend	trans	-98.9	134.1	177.9	-58.6	96.6	0	0	0	111.5	I252 Y253 S257 I258 M370 M390 M391 L402	I252-W404 HydrophobicContact CG2-CZ2 3.8Å; I252-W404 PolarHBondContact O-NE1 2.74Å; Y253-W404 HydrophobicContact CD1-CH2 4.43Å; Y253-W404 AromaticContact CD1-CZ2 3.94Å; Y253-W404 HydrophobicContact CD1-CZ2 3.94Å; Y253-W404 HydrophobicContact CD2-CZ2 4.04Å; Y253-W404 AromaticContact CE1-CH2 3.78Å; Y253-W404 HydrophobicContact CE1-CH2 3.78Å; Y253-W404 AromaticContact CE1-CZ2 3.76Å; Y253-W404 HydrophobicContact CE1-CZ2 3.76Å; Y253-W404 AromaticContact CE2-CH2 3.98Å; Y253-W404 HydrophobicContact CE2-CH2 3.98Å; Y253-W404 AromaticContact CE2-CZ2 3.89Å; Y253-W404 HydrophobicContact CE2-CZ2 3.89Å; Y253-W404 HydrophobicContact CG-CZ2 4.08Å; Y253-W404 AromaticContact CZ-CH2 3.54Å; Y253-W404 AromaticContact CZ-CZ2 3.74Å; S257-W404 WeakPolarHBondContact OG-CB 3.45Å; S257-W404 PolarHBondContact OG-N 2.82Å; I258-W404 HydrophobicContact CB-CB 4.29Å; I258-W404 HydrophobicContact CB-CD2 4.3Å; I258-W404 HydrophobicContact CB-CG 3.78Å; I258-W404 HydrophobicContact CD1-CD2 3.86Å; I258-W404 HydrophobicContact CD1-CE3 4.39Å; I258-W404 HydrophobicContact CD1-CG 4.27Å; I258-W404 HydrophobicContact CD1-CH2 4.32Å; I258-W404 HydrophobicContact CD1-CZ2 3.77Å; I258-W404 HydrophobicContact CG1-CB 4.34Å; I258-W404 HydrophobicContact CG1-CD2 3.75Å; I258-W404 HydrophobicContact CG1-CE3 4.34Å; I258-W404 HydrophobicContact CG1-CG 3.73Å; M370-W404 HydrophobicContact CE-CH2 4.45Å; M370-W404 HydrophobicContact CE-CZ3 4.08Å; M370-W404 HydrophobicContact SD-CE3 3.82Å; M370-W404 HydrophobicContact SD-CH2 4.42Å; M370-W404 HydrophobicContact SD-CZ3 3.53Å; M370-W404 VanDerWaalsContact SD-CZ3 3.53Å; M390-W404 HydrophobicContact CB-CD2 4.3Å; M390-W404 HydrophobicContact CB-CE3 3.95Å; M390-W404 HydrophobicContact CB-CH2 4.3Å; M390-W404 HydrophobicContact CB-CZ3 3.95Å; M390-W404 HydrophobicContact CG-CE3 4.44Å; M390-W404 HydrophobicContact CG-CH2 3.88Å; M390-W404 HydrophobicContact CG-CZ2 4.26Å; M390-W404 HydrophobicContact CG-CZ3 3.98Å; M391-W404 HydrophobicContact CG-CE3 4.39Å; M391-W404 HydrophobicContact CG-CZ3 4.07Å; M391-W404 HydrophobicContact SD-CZ3 4.02Å; L402-W404 VanDerWaalsContact C-N 3.31Å; L402-W404 PolarHBondContact O-N 2.99Å
405	S	95.2	Very high	85	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.007	20%	0.196	C	C	.	.			trans	-73.9	160	175.6	79.6	0	0	0	0	111.8	D373 C407 S408 A409	D373-S405 WeakPolarHBondContact OD1-CB 3.46Å; D373-S405 PolarHBondContact OD1-OG 2.96Å; S405-C407 PolarHBondContact O-N 3.18Å; S405-C407 PolarHBondContact OG-N 2.87Å; S405-S408 PolarHBondContact O-N 3.5Å; S405-S408 PolarHBondContact OG-N 3.36Å; S405-S408 PolarHBondContact OG-OG 2.86Å; S405-S408 VanDerWaalsContact OG-OG 3.1Å; S405-A409 PolarHBondContact O-N 3.07Å; S405-A409 VanDerWaalsContact O-N 3.07Å
406	P	94.7	Very high	86.3	Confident	64 Å²	64	35.4 Å²	35.4	42%	0.416	19%	0.188	S	C	.	.	H	α-helix	trans	-56.8	-32.7	169.5	-25.5	35.3	0	0	0	113.3	F382 M410	F382-P406 HydrophobicContact CD1-CB 3.83Å; F382-P406 HydrophobicContact CE1-CB 3.85Å; F382-P406 HydrophobicContact CG-CB 4.49Å; P406-M410 WeakPolarHBondContact O-CB 3.15Å; P406-M410 PolarHBondContact O-N 2.73Å
407	C	95.3	Very high	87.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67	-48.5	177.5	-164.8	0	0	0	0	111.4	C378 F382 M385 S405 A409 M410 Y411	C378-C407 WeakPolarHBondContact CA-SG 3.42Å; C378-C407 HydrophobicContact CB-CB 3.92Å; C378-C407 WeakPolarHBondContact CB-SG 3.26Å; C378-C407 WeakPolarHBondContact SG-CB 3.36Å; C378-C407 CovalentContact SG-SG 2.04Å; C378-C407 PolarHBondContact SG-SG 2.81Å; F382-C407 HydrophobicContact CD2-CB 3.73Å; F382-C407 HydrophobicContact CE2-CB 3.95Å; M385-C407 HydrophobicContact CE-CB 3.52Å; M385-C407 HydrophobicContact SD-CB 3.85Å; S405-C407 PolarHBondContact O-N 3.18Å; S405-C407 PolarHBondContact OG-N 2.87Å; C407-A409 PolarHBondContact O-N 3.49Å; C407-M410 PolarHBondContact O-N 2.86Å; C407-Y411 WeakPolarHBondContact O-CD2 2.91Å; C407-Y411 PolarHBondContact O-N 2.89Å; C407-Y411 VanDerWaalsContact SG-CD2 3.58Å; C407-Y411 VanDerWaalsContact SG-CE2 3.5Å
408	S	96.1	Very high	87.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-56.3	-50.7	177.2	-65.3	0	0	0	0	111.5	D373 M391 S405 M410 Y411 L412	D373-S408 PolarHBondContact OD1-OG 3.05Å; M391-S408 WeakPolarHBondContact CG-OG 3.24Å; S405-S408 PolarHBondContact O-N 3.5Å; S405-S408 PolarHBondContact OG-N 3.36Å; S405-S408 PolarHBondContact OG-OG 2.86Å; S405-S408 VanDerWaalsContact OG-OG 3.1Å; S408-M410 VanDerWaalsContact C-N 3.32Å; S408-M410 PolarHBondContact O-N 2.62Å; S408-Y411 PolarHBondContact O-N 2.75Å; S408-L412 PolarHBondContact O-N 3.32Å
409	A	95.4	Very high	88.3	Confident	2 Å²	2	31 Å²	31	2%	0.017	18%	0.175	C	C	.	.	H	α-helix	trans	-61.6	-37.4	178.9	0	0	0	0	0	112.9	S257 K259 S405 C407 T413	S257-A409 WeakPolarHBondContact O-CB 2.98Å; K259-A409 HydrophobicContact CB-CB 4.17Å; K259-A409 HydrophobicContact CD-CB 4.37Å; K259-A409 HydrophobicContact CG-CB 4.03Å; S405-A409 PolarHBondContact O-N 3.07Å; S405-A409 VanDerWaalsContact O-N 3.07Å; C407-A409 PolarHBondContact O-N 3.49Å; A409-T413 WeakPolarHBondContact O-CB 3.43Å; A409-T413 PolarHBondContact O-N 2.73Å; A409-T413 VanDerWaalsContact O-N 3.07Å; A409-T413 PolarHBondContact O-OG1 2.81Å
410	M	93.1	Very high	88.7	Confident	43 Å²	43	33.9 Å²	33.9	21%	0.212	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-51.9	176.2	-178.6	-161.3	72.6	0	0	111.3	L381 F382 P406 C407 S408 L412 T413 E414	L381-M410 HydrophobicContact CD1-CE 3.82Å; L381-M410 HydrophobicContact CD1-SD 4.18Å; F382-M410 HydrophobicContact CE2-CB 4.42Å; F382-M410 HydrophobicContact CE2-CE 3.93Å; F382-M410 HydrophobicContact CE2-SD 3.67Å; F382-M410 HydrophobicContact CZ-CB 4.01Å; F382-M410 HydrophobicContact CZ-CE 4.38Å; F382-M410 HydrophobicContact CZ-CG 4.29Å; F382-M410 HydrophobicContact CZ-SD 3.55Å; F382-M410 VanDerWaalsContact CZ-SD 3.55Å; P406-M410 WeakPolarHBondContact O-CB 3.15Å; P406-M410 PolarHBondContact O-N 2.73Å; C407-M410 PolarHBondContact O-N 2.86Å; S408-M410 VanDerWaalsContact C-N 3.32Å; S408-M410 PolarHBondContact O-N 2.62Å; M410-L412 VanDerWaalsContact C-N 3.35Å; M410-L412 PolarHBondContact O-N 2.04Å; M410-T413 WeakPolarHBondContact O-CB 3.38Å; M410-T413 PolarHBondContact O-N 3.33Å; M410-T413 VanDerWaalsContact O-N 3.09Å; M410-E414 WeakPolarHBondContact O-CG 3.29Å; M410-E414 PolarHBondContact O-N 3.15Å
411	Y	93.8	Very high	89.6	Confident	46 Å²	46	31 Å²	31	18%	0.18	17%	0.173	C	C	.	.	H	α-helix	trans	-61.3	-41.9	-178	-89.8	-76.4	0	0	0	112.3	P371 P377 C407 S408 T413 E414 L415	P371-Y411 HydrophobicContact CG-CD2 3.76Å; P371-Y411 HydrophobicContact CG-CE2 3.65Å; P371-Y411 HydrophobicContact CG-CG 4.27Å; P377-Y411 WeakPolarHBondContact CB-OH 3.01Å; C407-Y411 WeakPolarHBondContact O-CD2 2.91Å; C407-Y411 PolarHBondContact O-N 2.89Å; C407-Y411 VanDerWaalsContact SG-CD2 3.58Å; C407-Y411 VanDerWaalsContact SG-CE2 3.5Å; S408-Y411 PolarHBondContact O-N 2.75Å; Y411-T413 VanDerWaalsContact C-N 3.34Å; Y411-T413 PolarHBondContact O-N 3.49Å; Y411-E414 PolarHBondContact O-N 3.28Å; Y411-L415 PolarHBondContact O-N 3.46Å
412	L	95.2	Very high	90	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-46.6	172.4	179.3	61.5	0	0	0	111.4	I258 N260 I262 L368 M370 S408 M410 E414 L415 L416	I258-L412 HydrophobicContact CD1-CD2 3.77Å; I258-L412 HydrophobicContact CG1-CD2 3.76Å; N260-L412 HydrophobicContact CB-CD2 3.73Å; N260-L412 HydrophobicContact CB-CG 4.38Å; I262-L412 HydrophobicContact CD1-CD1 4.46Å; I262-L412 HydrophobicContact CD1-CD2 4.13Å; I262-L412 HydrophobicContact CG1-CD2 3.96Å; L368-L412 HydrophobicContact CB-CD1 4.11Å; L368-L412 HydrophobicContact CD2-CD1 4.32Å; M370-L412 HydrophobicContact CE-CB 3.84Å; M370-L412 HydrophobicContact CE-CD1 4.11Å; M370-L412 HydrophobicContact CE-CD2 3.82Å; M370-L412 HydrophobicContact CE-CG 4.13Å; S408-L412 PolarHBondContact O-N 3.32Å; M410-L412 VanDerWaalsContact C-N 3.35Å; M410-L412 PolarHBondContact O-N 2.04Å; L412-E414 VanDerWaalsContact C-N 3.29Å; L412-E414 PolarHBondContact O-N 3.11Å; L412-L415 WeakPolarHBondContact O-CB 3.46Å; L412-L415 PolarHBondContact O-N 3.37Å; L412-L416 HydrophobicContact CD1-CD1 3.99Å; L412-L416 HydrophobicContact CD1-CG 4.11Å; L412-L416 HydrophobicContact CG-CD1 4.03Å; L412-L416 HydrophobicContact CG-CG 4.47Å; L412-L416 VanDerWaalsContact O-CG 3.29Å; L412-L416 WeakPolarHBondContact O-CG 3.36Å; L412-L416 PolarHBondContact O-N 3.49Å
413	T	91.8	Very high	90.3	Very high	21 Å²	21	26.9 Å²	26.9	13%	0.129	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-40.5	179.3	-60.7	0	0	0	0	111.6	N260 A409 M410 Y411 L416 D417	N260-T413 PolarHBondContact ND2-OG1 2.8Å; A409-T413 WeakPolarHBondContact O-CB 3.43Å; A409-T413 PolarHBondContact O-N 2.73Å; A409-T413 VanDerWaalsContact O-N 3.07Å; A409-T413 PolarHBondContact O-OG1 2.81Å; M410-T413 WeakPolarHBondContact O-CB 3.38Å; M410-T413 PolarHBondContact O-N 3.33Å; M410-T413 VanDerWaalsContact O-N 3.09Å; Y411-T413 VanDerWaalsContact C-N 3.34Å; Y411-T413 PolarHBondContact O-N 3.49Å; T413-L416 PolarHBondContact O-N 2.74Å; T413-D417 VanDerWaalsContact O-CB 3.25Å; T413-D417 WeakPolarHBondContact O-CB 3.26Å; T413-D417 PolarHBondContact O-N 2.87Å
414	E	87.6	Confident	90.5	Very high	97 Å²	97	26.7 Å²	26.7	45%	0.453	15%	0.147	S	C	.	.	H	α-helix	trans	-68.4	-40.1	177.5	-71.7	-168.7	157.8	0	0	112.8	M410 Y411 L412 L416 G418	M410-E414 WeakPolarHBondContact O-CG 3.29Å; M410-E414 PolarHBondContact O-N 3.15Å; Y411-E414 PolarHBondContact O-N 3.28Å; L412-E414 VanDerWaalsContact C-N 3.29Å; L412-E414 PolarHBondContact O-N 3.11Å; E414-L416 VanDerWaalsContact C-N 3.34Å; E414-L416 PolarHBondContact O-N 3.01Å; E414-G418 WeakPolarHBondContact O-CA 3.05Å; E414-G418 PolarHBondContact O-N 3.4Å
415	L	89.4	Confident	90.3	Very high	12 Å²	12	29.9 Å²	29.9	6%	0.063	16%	0.164	C	C	.	.	H	α-helix	trans	-56.3	-50.6	173.1	179.6	79.1	0	0	0	110.6	I339 L368 Y411 L412 G419 H420	I339-L415 HydrophobicContact CG2-CD2 4.03Å; L368-L415 HydrophobicContact CD2-CD2 4.43Å; L368-L415 WeakPolarHBondContact O-CD2 3.22Å; Y411-L415 PolarHBondContact O-N 3.46Å; L412-L415 WeakPolarHBondContact O-CB 3.46Å; L412-L415 PolarHBondContact O-N 3.37Å; L415-G419 PolarHBondContact O-N 2.61Å; L415-H420 HydrophobicContact CD1-CB 3.38Å; L415-H420 HydrophobicContact CG-CB 4.08Å; L415-H420 WeakPolarHBondContact O-CB 3.29Å; L415-H420 PolarHBondContact O-N 3.04Å
416	L	90	Very high	89.6	Confident	7 Å²	7	32.3 Å²	32.3	4%	0.037	18%	0.177	C	C	.	.	H	α-helix	trans	-71.6	-46.9	-176	-61.4	178	0	0	0	112.3	R218 N260 I262 L412 T413 E414 G418 G419 L424	R218-L416 HydrophobicContact CG-CD1 4.01Å; R218-L416 HydrophobicContact CG-CD2 4.04Å; N260-L416 HydrophobicContact CB-CD1 4.29Å; N260-L416 WeakPolarHBondContact OD1-CD1 3.18Å; I262-L416 HydrophobicContact CD1-CD1 4.09Å; L412-L416 HydrophobicContact CD1-CD1 3.99Å; L412-L416 HydrophobicContact CD1-CG 4.11Å; L412-L416 HydrophobicContact CG-CD1 4.03Å; L412-L416 HydrophobicContact CG-CG 4.47Å; L412-L416 VanDerWaalsContact O-CG 3.29Å; L412-L416 WeakPolarHBondContact O-CG 3.36Å; L412-L416 PolarHBondContact O-N 3.49Å; T413-L416 PolarHBondContact O-N 2.74Å; E414-L416 VanDerWaalsContact C-N 3.34Å; E414-L416 PolarHBondContact O-N 3.01Å; L416-G418 PolarHBondContact O-N 2.86Å; L416-G419 PolarHBondContact O-N 2.89Å; L416-L424 HydrophobicContact CD2-CD1 4.2Å
417	D	84.3	Confident	88.2	Confident	18 Å²	18	32.1 Å²	32.1	10%	0.096	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-28.2	177.7	-76.8	-3.3	0	0	0	111.6	T413 G419 R568 R657 Q659	T413-D417 VanDerWaalsContact O-CB 3.25Å; T413-D417 WeakPolarHBondContact O-CB 3.26Å; T413-D417 PolarHBondContact O-N 2.87Å; D417-G419 PolarHBondContact O-N 2.7Å; D417-R568 IonicContact OD1-CZ 3.6Å; D417-R568 IonicContact OD1-NE 3.45Å; D417-R568 PolarHBondContact OD1-NE 2.79Å; D417-R568 IonicContact OD1-NH2 3.35Å; D417-R568 PolarHBondContact OD1-NH2 3.17Å; D417-R568 IonicContact OD2-NE 3.59Å; D417-R657 IonicContact OD2-NH1 2.69Å; D417-R657 PolarHBondContact OD2-NH1 2.97Å; D417-Q659 PolarHBondContact O-NE2 3.29Å
418	G	78.6	Confident	86.5	Confident	20 Å²	20	33.1 Å²	33.1	21%	0.206	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.3	176.3	0	0	0	0	0	114.4	E414 L416 H420 Q659	E414-G418 WeakPolarHBondContact O-CA 3.05Å; E414-G418 PolarHBondContact O-N 3.4Å; L416-G418 PolarHBondContact O-N 2.86Å; G418-H420 VanDerWaalsContact C-N 3.32Å; G418-Q659 PolarHBondContact O-NE2 3.2Å
419	G	81.3	Confident	84.3	Confident	23 Å²	23	38.2 Å²	38.2	24%	0.237	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	15.6	-176.7	0	0	0	0	0	113.8	L415 L416 D417 G421 D422	L415-G419 PolarHBondContact O-N 2.61Å; L416-G419 PolarHBondContact O-N 2.89Å; D417-G419 PolarHBondContact O-N 2.7Å; G419-G421 VanDerWaalsContact C-N 3.32Å; G419-D422 WeakPolarHBondContact CA-OD1 3.07Å
420	H	84.2	Confident	81.7	Confident	116 Å²	116	40.1 Å²	40.1	54%	0.537	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-8.8	178	-66.1	-57.8	0	0	0	112.8	C340 L415 G418	C340-H420 PolarHBondContact SG-O 2.67Å; C340-H420 VanDerWaalsContact SG-O 3.35Å; L415-H420 HydrophobicContact CD1-CB 3.38Å; L415-H420 HydrophobicContact CG-CB 4.08Å; L415-H420 WeakPolarHBondContact O-CB 3.29Å; L415-H420 PolarHBondContact O-N 3.04Å; G418-H420 VanDerWaalsContact C-N 3.32Å
421	G	89.8	Confident	79.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	27.4	173.8	0	0	0	0	0	113.4	G419 C423 L424	G419-G421 VanDerWaalsContact C-N 3.32Å; G421-C423 PolarHBondContact O-N 2.98Å; G421-L424 WeakPolarHBondContact O-CB 3.24Å; G421-L424 PolarHBondContact O-N 3.11Å; G421-L424 VanDerWaalsContact O-N 3.14Å
422	D	89.4	Confident	76.8	Confident	73 Å²	73	42.9 Å²	42.9	39%	0.39	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-68.4	-18.5	-175.9	-78.5	-2.6	0	0	0	113.2	G419 L424 L425	G419-D422 WeakPolarHBondContact CA-OD1 3.07Å; D422-L424 PolarHBondContact O-N 2.82Å; D422-L425 HydrophobicContact CB-CD1 4.03Å; D422-L425 WeakPolarHBondContact O-CB 3.43Å; D422-L425 WeakPolarHBondContact O-CD1 3.09Å; D422-L425 PolarHBondContact O-N 3.21Å
423	C	90.6	Very high	74.2	Confident	16 Å²	16	47.2 Å²	47.2	11%	0.108	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-66	-17.5	171.1	60.8	0	0	0	0	112.9	C340 G421 L425	C340-C423 WeakPolarHBondContact CA-SG 3.26Å; C340-C423 HydrophobicContact CB-CB 3.9Å; C340-C423 WeakPolarHBondContact CB-SG 3.4Å; C340-C423 WeakPolarHBondContact SG-CB 3.41Å; C340-C423 PolarHBondContact SG-N 3.09Å; C340-C423 VanDerWaalsContact SG-N 3.37Å; C340-C423 CovalentContact SG-SG 2.04Å; C340-C423 PolarHBondContact SG-SG 2.92Å; G421-C423 PolarHBondContact O-N 2.98Å; C423-L425 VanDerWaalsContact C-N 3.28Å; C423-L425 PolarHBondContact O-N 2.94Å
424	L	92.1	Very high	72	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-90.6	9.2	-177.4	-50.1	178.4	0	0	0	112.9	R218 F219 V220 D311 I339 L368 L416 G421 D422	R218-L424 CarbonylContact C-O 3.39Å; R218-L424 VanDerWaalsContact CA-O 3.26Å; R218-L424 WeakPolarHBondContact CA-O 3.48Å; R218-L424 HydrophobicContact CB-CB 4.04Å; F219-L424 PolarHBondContact N-O 3.42Å; F219-L424 WeakPolarHBondContact O-CA 3.25Å; F219-L424 WeakPolarHBondContact O-CB 3.47Å; F219-L424 WeakPolarHBondContact O-CD2 3.35Å; V220-L424 HydrophobicContact CG2-CD1 4.3Å; V220-L424 HydrophobicContact CG2-CD2 4.16Å; D311-L424 HydrophobicContact CB-CD2 3.91Å; D311-L424 VanDerWaalsContact CG-CD2 3.47Å; D311-L424 WeakPolarHBondContact OD2-CD2 3.3Å; I339-L424 HydrophobicContact CD1-CD2 4.28Å; I339-L424 HydrophobicContact CG1-CD1 4.12Å; I339-L424 HydrophobicContact CG1-CD2 3.76Å; I339-L424 HydrophobicContact CG1-CG 4.29Å; L368-L424 HydrophobicContact CD2-CD1 3.98Å; L416-L424 HydrophobicContact CD2-CD1 4.2Å; G421-L424 WeakPolarHBondContact O-CB 3.24Å; G421-L424 PolarHBondContact O-N 3.11Å; G421-L424 VanDerWaalsContact O-N 3.14Å; D422-L424 PolarHBondContact O-N 2.82Å
425	L	87.8	Confident	70	Confident	69 Å²	69	48.2 Å²	48.2	36%	0.361	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-84.8	-30.1	-171.2	-87.4	165.8	0	0	0	112.9	E216 D422 C423 A427	E216-L425 WeakPolarHBondContact OE2-CD2 3.03Å; D422-L425 HydrophobicContact CB-CD1 4.03Å; D422-L425 WeakPolarHBondContact O-CB 3.43Å; D422-L425 WeakPolarHBondContact O-CD1 3.09Å; D422-L425 PolarHBondContact O-N 3.21Å; C423-L425 VanDerWaalsContact C-N 3.28Å; C423-L425 PolarHBondContact O-N 2.94Å; L425-A427 PolarHBondContact O-N 3.14Å
426	D	80.6	Confident	68.1	Low	51 Å²	51	53.6 Å²	53.6	27%	0.273	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-74.3	123.1	178.8	44.6	-52.6	0	0	0	110.5	F219	F219-D426 WeakPolarHBondContact CD2-O 3.15Å
427	A	65.9	Low	66.6	Low	61 Å²	61	55.7 Å²	55.7	50%	0.504	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-78.8	138.1	171	0	0	0	0	0	108.5	F219 L425	F219-A427 HydrophobicContact CD2-CB 3.92Å; F219-A427 HydrophobicContact CE1-CB 4.34Å; F219-A427 HydrophobicContact CE2-CB 3.46Å; F219-A427 VanDerWaalsContact CE2-CB 3.46Å; F219-A427 HydrophobicContact CZ-CB 3.7Å; L425-A427 PolarHBondContact O-N 3.14Å
428	P	58.9	Low	65.9	Low	21 Å²	21	56.6 Å²	56.6	14%	0.136	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-61.4	153.1	169.8	27.7	-34.8	0	0	0	109.7	F219 M265 A430 A431	F219-P428 HydrophobicContact CD1-CG 4.45Å; M265-P428 HydrophobicContact CE-CG 4.46Å; M265-P428 HydrophobicContact CG-CG 4.16Å; M265-P428 HydrophobicContact SD-CG 4.4Å; P428-A430 PolarHBondContact O-N 3.36Å; P428-A431 HydrophobicContact CG-CB 4.13Å
429	A	50.1	Low	65.3	Low	107 Å²	107	56.1 Å²	56.1	88%	0.884	37%	0.366	S	S	*	.	S	Bend	trans	-57	-19.2	-177.2	0	0	0	0	0	114.1	P76	P76-A429 HydrophobicContact CG-CB 4.26Å
430	A	41.3	Very low	65	Low	41 Å²	41	55.1 Å²	55.1	34%	0.339	36%	0.355	S	S	.	.			trans	-143.5	132.2	161.5	0	0	0	0	0	109.5	P76 P428	P76-A430 HydrophobicContact CG-CB 3.88Å; P428-A430 PolarHBondContact O-N 3.36Å
431	A	41.1	Very low	64.6	Low	52 Å²	52	52.7 Å²	52.7	43%	0.43	34%	0.341	S	S	.	.			trans	-117.6	122.1	171.4	0	0	0	0	0	108.4	F219 P428	F219-A431 HydrophobicContact CE1-CB 4.12Å; P428-A431 HydrophobicContact CG-CB 4.13Å
432	L	43.6	Very low	63.7	Low	96 Å²	96	56.2 Å²	56.2	50%	0.503	36%	0.359	S	S	.	.			trans	-147.6	152.2	-168.1	-79.5	174.6	0	0	0	111.6	S72	S72-L432 WeakPolarHBondContact O-CB 3.11Å
433	P	40.1	Very low	62.8	Low	90 Å²	90	56.4 Å²	56.4	58%	0.584	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-71.2	148.5	-153	27.6	-34.7	0	0	0	113.5
434	L	44.5	Very low	61.9	Low	61 Å²	61	56.3 Å²	56.3	32%	0.319	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-78.3	157	176.7	-66.4	164.9	0	0	0	111.3	A250 T436	A250-L434 HydrophobicContact CB-CD1 3.06Å; L434-T436 PolarHBondContact O-N 3.3Å
435	P	45.5	Very low	61.2	Low	78 Å²	78	56.3 Å²	56.3	51%	0.506	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-55.2	121.5	177.2	-22.5	31.8	0	0	0	111.6	S247	S247-P435 PolarHBondContact OG-O 3.3Å
436	T	50	Low	60.8	Low	125 Å²	125	58 Å²	58	77%	0.767	37%	0.374	S	S	*	.			trans	-90.4	-5.7	178.8	50.8	0	0	0	0	113.4	L434	L434-T436 PolarHBondContact O-N 3.3Å
437	G	59.3	Low	60.8	Low	52 Å²	52	57.6 Å²	57.6	54%	0.536	37%	0.372	S	S	.	.	S	Bend	trans	-60.4	154.4	-179.4	0	0	0	0	0	113.1	P439	G437-P439 WeakPolarHBondContact O-CD 3.33Å
438	L	70	Confident	61.7	Low	36 Å²	36	57.5 Å²	57.5	19%	0.188	36%	0.363	C	S	.	.			trans	-76.8	116.3	178.1	-59.6	169.9	0	0	0	109.4	G440 R441 D496 L505 V517	L438-G440 VanDerWaalsContact C-N 3.25Å; L438-G440 PolarHBondContact O-N 2.92Å; L438-G440 VanDerWaalsContact O-N 3.17Å; L438-R441 HydrophobicContact CB-CG 4.2Å; L438-R441 WeakPolarHBondContact O-CB 3.31Å; L438-R441 PolarHBondContact O-N 3.14Å; L438-R441 VanDerWaalsContact O-N 3.09Å; L438-D496 CarbonylContact C-O 3.58Å; L438-D496 WeakPolarHBondContact CB-O 3.33Å; L438-D496 HydrophobicContact CD2-CB 4.04Å; L438-L505 HydrophobicContact CD1-CD1 4.25Å; L438-V517 HydrophobicContact CD1-CG1 3.66Å; L438-V517 HydrophobicContact CD2-CG1 4.34Å
439	P	66.1	Low	63	Low	11 Å²	11	59 Å²	59	7%	0.071	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-56.3	-36.3	-173.6	-26.4	34.8	0	0	0	113.8	T244 V248 L354 G437 R441 M442 Y445 A495	T244-P439 HydrophobicContact CG2-CB 4.13Å; T244-P439 HydrophobicContact CG2-CG 4.41Å; V248-P439 HydrophobicContact CG2-CG 4.17Å; L354-P439 HydrophobicContact CD1-CB 4.43Å; L354-P439 HydrophobicContact CD2-CB 4Å; G437-P439 WeakPolarHBondContact O-CD 3.33Å; P439-R441 PolarHBondContact O-N 3.04Å; P439-M442 VanDerWaalsContact O-CB 3.27Å; P439-M442 WeakPolarHBondContact O-CB 3.48Å; P439-M442 WeakPolarHBondContact O-CG 3.29Å; P439-M442 PolarHBondContact O-N 2.84Å; P439-Y445 HydrophobicContact CB-CD2 4.21Å; P439-Y445 WeakPolarHBondContact O-CB 3.36Å; P439-Y445 WeakPolarHBondContact O-CD2 3.39Å; P439-A495 HydrophobicContact CB-CB 4.35Å
440	G	74.6	Confident	64.6	Low	2 Å²	2	54.1 Å²	54.1	2%	0.021	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-67.4	-12.4	-179.5	0	0	0	0	0	115.5	L438 M442 D496 G497	L438-G440 VanDerWaalsContact C-N 3.25Å; L438-G440 PolarHBondContact O-N 2.92Å; L438-G440 VanDerWaalsContact O-N 3.17Å; G440-M442 VanDerWaalsContact C-N 3.35Å; G440-D496 WeakPolarHBondContact CA-O 3Å; G440-D496 PolarHBondContact N-O 3.45Å; G440-G497 CarbonylContact C-O 3.5Å
441	R	76.3	Confident	66.7	Low	65 Å²	65	52.2 Å²	52.2	25%	0.245	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-78.3	-21.3	169.7	-73.6	-99	-175	-178.7	-4.8	112.5	E131 L438 P439 E514 E518	E131-R441 IonicContact OE2-CZ 3.77Å; E131-R441 IonicContact OE2-NH1 2.89Å; E131-R441 PolarHBondContact OE2-NH1 3.04Å; L438-R441 HydrophobicContact CB-CG 4.2Å; L438-R441 WeakPolarHBondContact O-CB 3.31Å; L438-R441 PolarHBondContact O-N 3.14Å; L438-R441 VanDerWaalsContact O-N 3.09Å; P439-R441 PolarHBondContact O-N 3.04Å; R441-E514 IonicContact CZ-OE1 3.34Å; R441-E514 IonicContact NH1-OE1 3.1Å; R441-E514 PolarHBondContact NH1-OE1 2.95Å; R441-E514 VanDerWaalsContact NH1-OE1 3.1Å; R441-E514 IonicContact NH2-OE1 2.66Å; R441-E514 PolarHBondContact NH2-OE1 3.48Å; R441-E518 IonicContact CZ-OE1 2.62Å; R441-E518 IonicContact NE-OE1 3.65Å; R441-E518 PolarHBondContact NE-OE1 2.92Å; R441-E518 IonicContact NH1-OE1 2.75Å; R441-E518 IonicContact NH2-OE1 3.31Å; R441-E518 PolarHBondContact NH2-OE1 3.19Å; R441-E518 IonicContact NH2-OE2 2.98Å
442	M	70	Confident	68.9	Low	74 Å²	74	53.4 Å²	53.4	37%	0.365	31%	0.305	S	S	.	.	S	Bend	trans	-73	141.4	-178.1	-57.1	174.9	67	0	0	110	T244 P439 G440 L444 Y445 Q446	T244-M442 HydrophobicContact CG2-SD 4.39Å; P439-M442 VanDerWaalsContact O-CB 3.27Å; P439-M442 WeakPolarHBondContact O-CB 3.48Å; P439-M442 WeakPolarHBondContact O-CG 3.29Å; P439-M442 PolarHBondContact O-N 2.84Å; G440-M442 VanDerWaalsContact C-N 3.35Å; M442-L444 PolarHBondContact O-N 2.83Å; M442-Y445 HydrophobicContact CB-CD2 4.18Å; M442-Y445 CarbonylContact O-C 3.29Å; M442-Y445 PolarHBondContact O-N 3.3Å; M442-Y445 HydrophobicContact SD-CD2 4.33Å; M442-Y445 HydrophobicContact SD-CE2 4.33Å; M442-Q446 PolarHBondContact O-N 2.98Å
443	A	70.1	Confident	70.9	Confident	77 Å²	77	48.9 Å²	48.9	64%	0.636	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-54.4	-29.7	177.3	0	0	0	0	0	113	Y445	A443-Y445 VanDerWaalsContact C-N 3.29Å; A443-Y445 PolarHBondContact O-N 2.98Å
444	L	71.1	Confident	72.8	Confident	14 Å²	14	45.2 Å²	45.2	7%	0.073	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-68.9	-22	178.1	-173.8	60.9	0	0	0	113.8	Y234 D237 N240 H241 M442 Q449 Q453	Y234-L444 HydrophobicContact CD1-CD1 4.41Å; D237-L444 HydrophobicContact CB-CD1 3.88Å; N240-L444 HydrophobicContact CB-CD2 4.49Å; H241-L444 HydrophobicContact CB-CD2 3.79Å; M442-L444 PolarHBondContact O-N 2.83Å; L444-Q449 WeakPolarHBondContact O-CG 3.36Å; L444-Q453 PolarHBondContact O-NE2 2.86Å
445	Y	79.2	Confident	74.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-125.2	32.3	-177.2	-54.1	-69.2	0	0	0	112.1	H241 T244 L354 P439 M442 A443 Q450	H241-Y445 AromaticContact ND1-CE1 3.69Å; H241-Y445 AromaticContact ND1-CZ 3.6Å; H241-Y445 PolarHBondContact ND1-OH 2.66Å; T244-Y445 WeakPolarHBondContact CB-OH 2.94Å; T244-Y445 HydrophobicContact CG2-CD2 4.32Å; T244-Y445 HydrophobicContact CG2-CE2 3.41Å; T244-Y445 VanDerWaalsContact CG2-CE2 3.41Å; L354-Y445 HydrophobicContact CB-CD1 4.17Å; L354-Y445 HydrophobicContact CB-CE1 4.02Å; L354-Y445 HydrophobicContact CD1-CE1 4.06Å; L354-Y445 HydrophobicContact CD1-CE2 4.39Å; P439-Y445 HydrophobicContact CB-CD2 4.21Å; P439-Y445 WeakPolarHBondContact O-CB 3.36Å; P439-Y445 WeakPolarHBondContact O-CD2 3.39Å; M442-Y445 HydrophobicContact CB-CD2 4.18Å; M442-Y445 CarbonylContact O-C 3.29Å; M442-Y445 PolarHBondContact O-N 3.3Å; M442-Y445 HydrophobicContact SD-CD2 4.33Å; M442-Y445 HydrophobicContact SD-CE2 4.33Å; A443-Y445 VanDerWaalsContact C-N 3.29Å; A443-Y445 PolarHBondContact O-N 2.98Å; Y445-Q450 PolarHBondContact O-NE2 3.41Å
446	Q	78.8	Confident	76.4	Confident	103 Å²	103	41.3 Å²	41.3	48%	0.481	23%	0.233	S	C	.	.	S	Bend	trans	-64.2	165.3	167.5	-68.8	-173.2	-5	0	0	111.6	M442 D448 Q449 Q450	M442-Q446 PolarHBondContact O-N 2.98Å; Q446-D448 PolarHBondContact O-N 2.96Å; Q446-Q449 WeakPolarHBondContact O-CA 3.49Å; Q446-Q449 WeakPolarHBondContact O-CB 3.48Å; Q446-Q449 PolarHBondContact O-N 2.83Å; Q446-Q450 PolarHBondContact O-N 2.93Å
447	L	80.4	Confident	77.9	Confident	44 Å²	44	39.6 Å²	39.6	23%	0.23	22%	0.224	C	C	.	.	H	α-helix	trans	-45.7	-59.3	-174.8	-112.8	138.7	0	0	0	113.8	Q449 H461 W494 T498 P499	L447-Q449 VanDerWaalsContact C-N 3.27Å; L447-Q449 PolarHBondContact O-N 2.04Å; L447-H461 HydrophobicContact CD2-CB 3.49Å; L447-H461 VanDerWaalsContact CD2-CB 3.49Å; L447-H461 WeakPolarHBondContact CD2-CD2 3.38Å; L447-W494 VanDerWaalsContact CA-CZ3 3.49Å; L447-W494 HydrophobicContact CB-CZ3 4.21Å; L447-W494 HydrophobicContact CD2-CE3 4.4Å; L447-W494 HydrophobicContact CD2-CH2 3.6Å; L447-W494 HydrophobicContact CD2-CZ2 3.98Å; L447-W494 HydrophobicContact CD2-CZ3 3.86Å; L447-W494 HydrophobicContact CG-CE3 4.27Å; L447-W494 HydrophobicContact CG-CH2 4.16Å; L447-W494 HydrophobicContact CG-CZ3 3.9Å; L447-W494 VanDerWaalsContact O-CH2 3.28Å; L447-W494 WeakPolarHBondContact O-CH2 3.32Å; L447-W494 WeakPolarHBondContact O-CZ3 3.49Å; L447-T498 HydrophobicContact CD1-CG2 4.15Å; L447-T498 HydrophobicContact CG-CG2 3.99Å; L447-P499 WeakPolarHBondContact CD1-O 3.41Å
448	D	84.6	Confident	79.2	Confident	59 Å²	59	42.8 Å²	42.8	32%	0.316	23%	0.228	S	C	.	.	H	α-helix	trans	-68.8	-29.1	179.1	-76.2	-8.5	0	0	0	112.8	Q446 C451 R452 H460 H461	Q446-D448 PolarHBondContact O-N 2.96Å; D448-C451 WeakPolarHBondContact O-CB 2.8Å; D448-C451 PolarHBondContact O-N 3.12Å; D448-R452 WeakPolarHBondContact O-CG 3.4Å; D448-R452 PolarHBondContact O-N 2.96Å; D448-H460 IonicContact OD1-ND1 3.96Å; D448-H460 IonicContact OD2-CE1 4Å; D448-H460 IonicContact OD2-ND1 3.04Å; D448-H460 PolarHBondContact OD2-ND1 3.01Å; D448-H461 PolarHBondContact OD1-N 3.24Å
449	Q	85.4	Confident	80	Confident	52 Å²	52	43 Å²	43	24%	0.243	23%	0.228	C	C	.	.	H	α-helix	trans	-71.6	-35.3	-174.7	-162	64	10.1	0	0	112	L444 Q446 L447 C451 R452 Q453	L444-Q449 WeakPolarHBondContact O-CG 3.36Å; Q446-Q449 WeakPolarHBondContact O-CA 3.49Å; Q446-Q449 WeakPolarHBondContact O-CB 3.48Å; Q446-Q449 PolarHBondContact O-N 2.83Å; L447-Q449 VanDerWaalsContact C-N 3.27Å; L447-Q449 PolarHBondContact O-N 2.04Å; Q449-C451 VanDerWaalsContact C-N 3.32Å; Q449-C451 PolarHBondContact O-N 3.11Å; Q449-R452 PolarHBondContact O-N 2.9Å; Q449-R452 VanDerWaalsContact OE1-NH1 3.11Å; Q449-Q453 VanDerWaalsContact O-CG 3.27Å; Q449-Q453 WeakPolarHBondContact O-CG 3.27Å; Q449-Q453 PolarHBondContact O-N 2.69Å
450	Q	84.9	Confident	81.1	Confident	5 Å²	5	44.4 Å²	44.4	2%	0.023	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-39.5	172.4	-64.5	179.7	58.8	0	0	111.1	Y445 Q446 Q453 I454 L474 W494 T498	Y445-Q450 PolarHBondContact O-NE2 3.41Å; Q446-Q450 PolarHBondContact O-N 2.93Å; Q450-Q453 PolarHBondContact O-N 2.74Å; Q450-I454 WeakPolarHBondContact O-CG1 3.47Å; Q450-I454 PolarHBondContact O-N 2.88Å; Q450-L474 HydrophobicContact CB-CD1 3.75Å; Q450-W494 HydrophobicContact CB-CE3 4.3Å; Q450-W494 HydrophobicContact CB-CZ3 3.92Å; Q450-W494 HydrophobicContact CG-CE3 4.47Å; Q450-W494 HydrophobicContact CG-CZ3 4.43Å; Q450-T498 PolarHBondContact NE2-OG1 3.23Å
451	C	85.8	Confident	81.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.6	-45.3	172.3	-77.7	0	0	0	0	112.2	D448 Q449 Q453 I454 F455 F459 C476	D448-C451 WeakPolarHBondContact O-CB 2.8Å; D448-C451 PolarHBondContact O-N 3.12Å; Q449-C451 VanDerWaalsContact C-N 3.32Å; Q449-C451 PolarHBondContact O-N 3.11Å; C451-Q453 VanDerWaalsContact C-N 3.33Å; C451-Q453 PolarHBondContact O-N 3.25Å; C451-I454 PolarHBondContact O-N 2.83Å; C451-F455 PolarHBondContact O-N 2.93Å; C451-F459 HydrophobicContact CB-CB 4.23Å; C451-C476 WeakPolarHBondContact CA-SG 3.45Å; C451-C476 HydrophobicContact CB-CB 3.72Å; C451-C476 WeakPolarHBondContact CB-SG 3.4Å; C451-C476 WeakPolarHBondContact SG-CB 3.49Å; C451-C476 CovalentContact SG-SG 2.03Å; C451-C476 PolarHBondContact SG-SG 2.86Å
452	R	87.4	Confident	82.1	Confident	77 Å²	77	44.2 Å²	44.2	29%	0.291	24%	0.236	S	C	.	.	H	α-helix	trans	-63.8	-37.3	-179.4	-68.8	178.9	-165.5	152.7	3.1	113.7	D448 Q449 G456 F459 H460	D448-R452 WeakPolarHBondContact O-CG 3.4Å; D448-R452 PolarHBondContact O-N 2.96Å; Q449-R452 PolarHBondContact O-N 2.9Å; Q449-R452 VanDerWaalsContact OE1-NH1 3.11Å; R452-G456 VanDerWaalsContact CA-O 3.24Å; R452-G456 WeakPolarHBondContact CA-O 3.32Å; R452-G456 CarbonylContact O-C 3.57Å; R452-G456 VanDerWaalsContact O-C 3.31Å; R452-G456 WeakPolarHBondContact O-CA 3.49Å; R452-G456 PolarHBondContact O-N 2.93Å; R452-F459 VanDerWaalsContact CG-O 3.26Å; R452-F459 WeakPolarHBondContact CG-O 3.47Å; R452-H460 PolarHBondContact NH2-CE1 1.99Å; R452-H460 VanDerWaalsContact NH2-CE1 3.35Å
453	Q	85.2	Confident	82.6	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-66.6	-39.6	178.3	-71.8	166.7	1.2	0	0	112.1	F233 Y234 R318 L444 Q449 Q450 C451	F233-Q453 HydrophobicContact CE1-CG 4.34Å; Y234-Q453 HydrophobicContact CE1-CG 4.08Å; R318-Q453 PolarHBondContact NH1-O 2.93Å; R318-Q453 PolarHBondContact NH2-O 2.84Å; L444-Q453 PolarHBondContact O-NE2 2.86Å; Q449-Q453 VanDerWaalsContact O-CG 3.27Å; Q449-Q453 WeakPolarHBondContact O-CG 3.27Å; Q449-Q453 PolarHBondContact O-N 2.69Å; Q450-Q453 PolarHBondContact O-N 2.74Å; C451-Q453 VanDerWaalsContact C-N 3.33Å; C451-Q453 PolarHBondContact O-N 3.25Å
454	I	80	Confident	82.8	Confident	13 Å²	13	48.1 Å²	48.1	7%	0.067	25%	0.251	C	S	.	.	H	α-helix	trans	-82.7	-43.4	-174.9	-65.4	166.4	0	0	0	112	E352 Q450 C451 L474 K488	E352-I454 VanDerWaalsContact O-CG1 3.31Å; E352-I454 WeakPolarHBondContact O-CG1 3.34Å; Q450-I454 WeakPolarHBondContact O-CG1 3.47Å; Q450-I454 PolarHBondContact O-N 2.88Å; C451-I454 PolarHBondContact O-N 2.83Å; I454-L474 HydrophobicContact CD1-CD1 3.62Å; I454-L474 HydrophobicContact CD1-CD2 3.67Å; I454-L474 HydrophobicContact CD1-CG 4.27Å; I454-K488 HydrophobicContact CG2-CD 3.85Å; I454-K488 HydrophobicContact CG2-CG 4.25Å; I454-K488 PolarHBondContact O-NZ 2.82Å
455	F	81.8	Confident	82.9	Confident	46 Å²	46	49.2 Å²	49.2	20%	0.202	26%	0.258	C	S	.	.	H	α-helix	trans	-111.7	-18	-170.3	-62.9	-78.1	0	0	0	114.5	C451 F459 L474 C476 H486 K488	C451-F455 PolarHBondContact O-N 2.93Å; F455-F459 HydrophobicContact CB-CB 3.84Å; F455-F459 HydrophobicContact CB-CD1 3.47Å; F455-F459 VanDerWaalsContact CB-CD1 3.47Å; F455-F459 HydrophobicContact CB-CD2 3.42Å; F455-F459 VanDerWaalsContact CB-CD2 3.42Å; F455-F459 HydrophobicContact CB-CE1 3.75Å; F455-F459 HydrophobicContact CB-CE2 3.71Å; F455-F459 HydrophobicContact CB-CG 3.29Å; F455-F459 HydrophobicContact CB-CZ 3.86Å; F455-F459 HydrophobicContact CD1-CE1 4.3Å; F455-F459 HydrophobicContact CD2-CD1 4.34Å; F455-F459 AromaticContact CG-CD1 3.91Å; F455-F459 HydrophobicContact CG-CD1 3.91Å; F455-F459 HydrophobicContact CG-CE1 4.08Å; F455-F459 HydrophobicContact CG-CG 4.19Å; F455-F459 WeakPolarHBondContact O-CD2 3.29Å; F455-F459 VanDerWaalsContact O-CE2 3.31Å; F455-F459 WeakPolarHBondContact O-CE2 3.44Å; F455-L474 HydrophobicContact CD2-CD2 4.42Å; F455-L474 HydrophobicContact CE2-CD2 3.62Å; F455-C476 HydrophobicContact CD2-CB 3.71Å; F455-C476 VanDerWaalsContact CD2-SG 3.58Å; F455-C476 HydrophobicContact CE2-CB 3.87Å; F455-C476 VanDerWaalsContact CE2-SG 3.53Å; F455-H486 HydrophobicContact CE1-CB 4.46Å; F455-K488 HydrophobicContact CE1-CG 3.69Å; F455-K488 HydrophobicContact CZ-CG 3.93Å
456	G	82.8	Confident	82.9	Confident	12 Å²	12	51.8 Å²	51.8	12%	0.124	28%	0.276	C	S	.	.			trans	117.4	168.6	-179.2	0	0	0	0	0	113.6	R452 D458 F459	R452-G456 VanDerWaalsContact CA-O 3.24Å; R452-G456 WeakPolarHBondContact CA-O 3.32Å; R452-G456 CarbonylContact O-C 3.57Å; R452-G456 VanDerWaalsContact O-C 3.31Å; R452-G456 WeakPolarHBondContact O-CA 3.49Å; R452-G456 PolarHBondContact O-N 2.93Å; G456-D458 PolarHBondContact O-N 2.88Å; G456-F459 PolarHBondContact O-N 3.03Å; G456-F459 VanDerWaalsContact O-N 3.12Å
457	P	82.9	Confident	82.6	Confident	89 Å²	89	49.1 Å²	49.1	58%	0.578	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.7	-165.1	24.6	-35.3	0	0	0	115.4	F459	P457-F459 VanDerWaalsContact C-N 3.32Å
458	D	86.3	Confident	82.4	Confident	119 Å²	119	51.5 Å²	51.5	64%	0.636	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	1.6	-177.5	-56.1	-41.8	0	0	0	113.8	G456 H460	G456-D458 PolarHBondContact O-N 2.88Å; D458-H460 PolarHBondContact O-CD2 2.85Å
459	F	87.3	Confident	82	Confident	39 Å²	39	52.9 Å²	52.9	17%	0.171	29%	0.289	C	S	.	.			trans	-95.7	138.2	-178	-75.9	-102.4	0	0	0	112.5	C451 R452 F455 G456 P457 C476 H477 T478 H486	C451-F459 HydrophobicContact CB-CB 4.23Å; R452-F459 VanDerWaalsContact CG-O 3.26Å; R452-F459 WeakPolarHBondContact CG-O 3.47Å; F455-F459 HydrophobicContact CB-CB 3.84Å; F455-F459 HydrophobicContact CB-CD1 3.47Å; F455-F459 VanDerWaalsContact CB-CD1 3.47Å; F455-F459 HydrophobicContact CB-CD2 3.42Å; F455-F459 VanDerWaalsContact CB-CD2 3.42Å; F455-F459 HydrophobicContact CB-CE1 3.75Å; F455-F459 HydrophobicContact CB-CE2 3.71Å; F455-F459 HydrophobicContact CB-CG 3.29Å; F455-F459 HydrophobicContact CB-CZ 3.86Å; F455-F459 HydrophobicContact CD1-CE1 4.3Å; F455-F459 HydrophobicContact CD2-CD1 4.34Å; F455-F459 AromaticContact CG-CD1 3.91Å; F455-F459 HydrophobicContact CG-CD1 3.91Å; F455-F459 HydrophobicContact CG-CE1 4.08Å; F455-F459 HydrophobicContact CG-CG 4.19Å; F455-F459 WeakPolarHBondContact O-CD2 3.29Å; F455-F459 VanDerWaalsContact O-CE2 3.31Å; F455-F459 WeakPolarHBondContact O-CE2 3.44Å; G456-F459 PolarHBondContact O-N 3.03Å; G456-F459 VanDerWaalsContact O-N 3.12Å; P457-F459 VanDerWaalsContact C-N 3.32Å; F459-C476 HydrophobicContact CB-CB 4.3Å; F459-C476 HydrophobicContact CD1-CB 3.99Å; F459-H477 WeakPolarHBondContact CA-O 3.38Å; F459-T478 HydrophobicContact CD1-CG2 3.77Å; F459-T478 HydrophobicContact CD2-CG2 3.8Å; F459-T478 HydrophobicContact CE1-CG2 3.61Å; F459-T478 HydrophobicContact CE2-CG2 3.63Å; F459-T478 HydrophobicContact CG-CG2 3.87Å; F459-T478 HydrophobicContact CZ-CG2 3.54Å; F459-H486 HydrophobicContact CE1-CB 4.33Å
460	H	88.4	Confident	81.8	Confident	42 Å²	42	50.8 Å²	50.8	19%	0.194	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	166.1	-179.7	-63.4	-93.1	0	0	0	110.9	D448 R452 D458 C462 C476 H477	D448-H460 IonicContact OD1-ND1 3.96Å; D448-H460 IonicContact OD2-CE1 4Å; D448-H460 IonicContact OD2-ND1 3.04Å; D448-H460 PolarHBondContact OD2-ND1 3.01Å; R452-H460 PolarHBondContact NH2-CE1 1.99Å; R452-H460 VanDerWaalsContact NH2-CE1 3.35Å; D458-H460 PolarHBondContact O-CD2 2.85Å; H460-C462 PolarHBondContact O-N 2.87Å; H460-C476 CarbonylContact O-C 3.56Å; H460-C476 WeakPolarHBondContact O-CA 3.47Å; H460-C476 WeakPolarHBondContact O-CB 3.27Å; H460-H477 PolarHBondContact N-O 3.11Å; H460-H477 PolarHBondContact O-CD2 2.97Å; H460-H477 PolarHBondContact O-N 3.03Å
461	H	86.4	Confident	81.8	Confident	48 Å²	48	50.5 Å²	50.5	22%	0.222	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	133.1	177.3	158.4	-91.7	0	0	0	113	L447 D448 H477 W494	L447-H461 HydrophobicContact CD2-CB 3.49Å; L447-H461 VanDerWaalsContact CD2-CB 3.49Å; L447-H461 WeakPolarHBondContact CD2-CD2 3.38Å; D448-H461 PolarHBondContact OD1-N 3.24Å; H461-H477 PolarHBondContact O-CD2 2.92Å; H461-H477 PolarHBondContact O-NE2 2.98Å; H461-W494 HydrophobicContact CB-CH2 4.25Å; H461-W494 AromaticContact CD2-CZ2 3.82Å
462	C	86.3	Confident	81.5	Confident	15 Å²	15	52.6 Å²	52.6	10%	0.101	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-57.7	127.8	178.8	-176.5	0	0	0	0	112.9	H460 T465 W475 C485	H460-C462 PolarHBondContact O-N 2.87Å; C462-T465 PolarHBondContact O-OG1 3.19Å; C462-W475 HydrophobicContact CB-CB 3.81Å; C462-W475 WeakPolarHBondContact CB-O 3.27Å; C462-W475 PolarHBondContact N-O 3.34Å; C462-C485 HydrophobicContact CB-CB 3.83Å; C462-C485 WeakPolarHBondContact CB-SG 3.32Å; C462-C485 WeakPolarHBondContact SG-CB 3.05Å; C462-C485 CovalentContact SG-SG 2.02Å; C462-C485 PolarHBondContact SG-SG 3.18Å
463	P	79.4	Confident	81.1	Confident	62 Å²	62	51.4 Å²	51.4	40%	0.403	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	154.2	176.8	28.3	-34.3	0	0	0	112.5	T465	P463-T465 VanDerWaalsContact C-N 3.34Å; P463-T465 PolarHBondContact O-N 2.84Å
464	N	74.3	Confident	80.9	Confident	171 Å²	171	51.5 Å²	51.5	91%	0.914	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	21.6	176.1	-58.7	-36.5	0	0	0	116.8
465	T	74	Confident	81.1	Confident	37 Å²	37	54.8 Å²	54.8	23%	0.227	31%	0.306	C	S	.	.			trans	-72.2	136.9	170.1	-27.8	0	0	0	0	110	C462 P463 D469 V470	C462-T465 PolarHBondContact O-OG1 3.19Å; P463-T465 VanDerWaalsContact C-N 3.34Å; P463-T465 PolarHBondContact O-N 2.84Å; T465-D469 HydrophobicContact CG2-CB 3.77Å; T465-V470 HydrophobicContact CG2-CG2 4.32Å
466	S	79.2	Confident	81.4	Confident	54 Å²	54	52.6 Å²	52.6	38%	0.378	30%	0.296	S	S	.	.			trans	-69	153.8	175.6	86.4	0	0	0	0	110.4	Q468 D469 V470	S466-Q468 PolarHBondContact O-N 2.65Å; S466-Q468 VanDerWaalsContact O-N 3.17Å; S466-D469 WeakPolarHBondContact CB-OD2 3.33Å; S466-D469 PolarHBondContact O-N 3.08Å; S466-D469 WeakPolarHBondContact OG-CB 3.3Å; S466-D469 PolarHBondContact OG-N 2.98Å; S466-D469 PolarHBondContact OG-OD2 2.76Å; S466-V470 WeakPolarHBondContact O-CG2 3.41Å; S466-V470 PolarHBondContact O-N 2.99Å
467	A	72.8	Confident	81.6	Confident	47 Å²	47	53.2 Å²	53.2	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-56	-35.9	-178	0	0	0	0	0	113.1	C500 C511	A467-C500 WeakPolarHBondContact CB-O 3.38Å; A467-C511 VanDerWaalsContact O-CB 3.25Å; A467-C511 WeakPolarHBondContact O-CB 3.47Å
468	Q	75.2	Confident	81.9	Confident	94 Å²	94	51.3 Å²	51.3	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-73.3	-38.4	176.5	-171.7	64.3	19.5	0	0	112	S466 V470 C471 A472	S466-Q468 PolarHBondContact O-N 2.65Å; S466-Q468 VanDerWaalsContact O-N 3.17Å; Q468-V470 VanDerWaalsContact C-N 3.3Å; Q468-V470 PolarHBondContact O-N 3.4Å; Q468-C471 PolarHBondContact O-N 2.96Å; Q468-A472 PolarHBondContact O-N 2.77Å
469	D	76.2	Confident	81.3	Confident	87 Å²	87	52.1 Å²	52.1	47%	0.465	29%	0.287	S	S	.	.	H	α-helix	trans	-71.7	-26.2	179.4	-63.7	-35.7	0	0	0	112.2	T465 S466 Q473	T465-D469 HydrophobicContact CG2-CB 3.77Å; S466-D469 WeakPolarHBondContact CB-OD2 3.33Å; S466-D469 PolarHBondContact O-N 3.08Å; S466-D469 WeakPolarHBondContact OG-CB 3.3Å; S466-D469 PolarHBondContact OG-N 2.98Å; S466-D469 PolarHBondContact OG-OD2 2.76Å; D469-Q473 PolarHBondContact O-N 2.86Å
470	V	81.6	Confident	80.4	Confident	8 Å²	8	52.5 Å²	52.5	5%	0.048	30%	0.302	C	S	.	.	H	α-helix	trans	-54.4	-66.7	169.3	174.1	0	0	0	0	107.4	T465 S466 Q468 A472 Q473 W494 C500	T465-V470 HydrophobicContact CG2-CG2 4.32Å; S466-V470 WeakPolarHBondContact O-CG2 3.41Å; S466-V470 PolarHBondContact O-N 2.99Å; Q468-V470 VanDerWaalsContact C-N 3.3Å; Q468-V470 PolarHBondContact O-N 3.4Å; V470-A472 VanDerWaalsContact C-N 3.26Å; V470-A472 PolarHBondContact O-N 2.86Å; V470-A472 VanDerWaalsContact O-N 3.1Å; V470-Q473 PolarHBondContact O-N 3.43Å; V470-W494 HydrophobicContact CG1-CD2 4.4Å; V470-W494 HydrophobicContact CG1-CG 4.31Å; V470-W494 PolarHBondContact O-NE1 3.06Å; V470-C500 HydrophobicContact CB-CB 4.26Å; V470-C500 HydrophobicContact CG1-CB 4.13Å
471	C	83.9	Confident	79.1	Confident	0 Å²	0	56 Å²	56	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.7	-27.6	-172.7	-57.1	0	0	0	0	115.4	Q468 P493 W494 C500 C506 G509 C511	Q468-C471 PolarHBondContact O-N 2.96Å; C471-P493 VanDerWaalsContact O-CA 3.29Å; C471-P493 WeakPolarHBondContact O-CA 3.12Å; C471-P493 WeakPolarHBondContact O-CB 3.32Å; C471-W494 PolarHBondContact O-N 2.8Å; C471-C500 WeakPolarHBondContact SG-CB 3.44Å; C471-C506 WeakPolarHBondContact CA-SG 3.3Å; C471-C506 HydrophobicContact CB-CB 3.7Å; C471-C506 WeakPolarHBondContact CB-SG 3.42Å; C471-C506 WeakPolarHBondContact SG-CA 3.5Å; C471-C506 WeakPolarHBondContact SG-CB 3.19Å; C471-C506 CovalentContact SG-SG 2.04Å; C471-C506 PolarHBondContact SG-SG 3.36Å; C471-G509 CarbonylContact C-O 3.53Å; C471-G509 VanDerWaalsContact C-O 3.29Å; C471-G509 WeakPolarHBondContact CB-O 3.24Å; C471-G509 WeakPolarHBondContact O-CA 3.15Å; C471-C511 VanDerWaalsContact SG-CA 3.58Å
472	A	79.6	Confident	78.1	Confident	43 Å²	43	61.8 Å²	61.8	36%	0.355	37%	0.365	S	S	.	.	H	α-helix	trans	-71.6	-35.7	-177.2	0	0	0	0	0	113.3	Q468 V470 G509	Q468-A472 PolarHBondContact O-N 2.77Å; V470-A472 VanDerWaalsContact C-N 3.26Å; V470-A472 PolarHBondContact O-N 2.86Å; V470-A472 VanDerWaalsContact O-N 3.1Å; A472-G509 PolarHBondContact N-O 3.09Å
473	Q	80.6	Confident	77.2	Confident	52 Å²	52	65.4 Å²	65.4	24%	0.243	39%	0.388	C	S	.	.			trans	-154.9	135.3	-174.8	-171.1	170.4	-9.9	0	0	113.3	D469 V470 W475 T487 L492 W494	D469-Q473 PolarHBondContact O-N 2.86Å; V470-Q473 PolarHBondContact O-N 3.43Å; Q473-W475 PolarHBondContact O-N 3.34Å; Q473-T487 PolarHBondContact NE2-OG1 2.89Å; Q473-L492 CarbonylContact C-O 3.55Å; Q473-L492 WeakPolarHBondContact CA-O 3.12Å; Q473-W494 PolarHBondContact O-NE1 2.82Å; Q473-W494 VanDerWaalsContact O-NE1 3.14Å
474	L	79.4	Confident	77.3	Confident	3 Å²	3	68 Å²	68	2%	0.016	40%	0.398	C	S	.	.			trans	-79.3	109.6	176.7	-172.1	146.4	0	0	0	111.8	Q450 I454 F455 C476 T487 L492 W494	Q450-L474 HydrophobicContact CB-CD1 3.75Å; I454-L474 HydrophobicContact CD1-CD1 3.62Å; I454-L474 HydrophobicContact CD1-CD2 3.67Å; I454-L474 HydrophobicContact CD1-CG 4.27Å; F455-L474 HydrophobicContact CD2-CD2 4.42Å; F455-L474 HydrophobicContact CE2-CD2 3.62Å; L474-C476 WeakPolarHBondContact CD2-SG 3.36Å; L474-T487 PolarHBondContact O-OG1 2.8Å; L474-L492 WeakPolarHBondContact CB-O 3.46Å; L474-L492 PolarHBondContact N-O 2.02Å; L474-W494 HydrophobicContact CB-CZ2 4.46Å; L474-W494 HydrophobicContact CD1-CD2 4.23Å; L474-W494 HydrophobicContact CD1-CE3 4.15Å; L474-W494 HydrophobicContact CD1-CH2 4.23Å; L474-W494 HydrophobicContact CD1-CZ2 4.35Å; L474-W494 HydrophobicContact CD1-CZ3 4.09Å; L474-W494 HydrophobicContact CG-CD2 4.44Å; L474-W494 HydrophobicContact CG-CH2 4.17Å; L474-W494 HydrophobicContact CG-CZ2 3.92Å
475	W	85.1	Confident	77.8	Confident	82 Å²	82	61.4 Å²	61.4	31%	0.311	37%	0.366	S	S	.	.			trans	-115.6	125.8	176.7	-70.3	94.6	0	0	0	110.8	C462 Q473 C485 H486 T487	C462-W475 HydrophobicContact CB-CB 3.81Å; C462-W475 WeakPolarHBondContact CB-O 3.27Å; C462-W475 PolarHBondContact N-O 3.34Å; Q473-W475 PolarHBondContact O-N 3.34Å; W475-C485 HydrophobicContact CE3-CB 4.07Å; W475-H486 WeakPolarHBondContact CA-O 3.42Å; W475-T487 HydrophobicContact CD2-CG2 4.36Å; W475-T487 HydrophobicContact CE3-CG2 3.9Å; W475-T487 HydrophobicContact CH2-CG2 3.39Å; W475-T487 HydrophobicContact CZ2-CG2 3.87Å; W475-T487 HydrophobicContact CZ3-CG2 3.4Å
476	C	87.1	Confident	78.2	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	147.4	-175.8	-54.7	0	0	0	0	111.7	C451 F455 F459 H460 L474 C485 H486	C451-C476 WeakPolarHBondContact CA-SG 3.45Å; C451-C476 HydrophobicContact CB-CB 3.72Å; C451-C476 WeakPolarHBondContact CB-SG 3.4Å; C451-C476 WeakPolarHBondContact SG-CB 3.49Å; C451-C476 CovalentContact SG-SG 2.03Å; C451-C476 PolarHBondContact SG-SG 2.86Å; F455-C476 HydrophobicContact CD2-CB 3.71Å; F455-C476 VanDerWaalsContact CD2-SG 3.58Å; F455-C476 HydrophobicContact CE2-CB 3.87Å; F455-C476 VanDerWaalsContact CE2-SG 3.53Å; F459-C476 HydrophobicContact CB-CB 4.3Å; F459-C476 HydrophobicContact CD1-CB 3.99Å; H460-C476 CarbonylContact O-C 3.56Å; H460-C476 WeakPolarHBondContact O-CA 3.47Å; H460-C476 WeakPolarHBondContact O-CB 3.27Å; L474-C476 WeakPolarHBondContact CD2-SG 3.36Å; C476-C485 CarbonylContact O-C 3.44Å; C476-C485 WeakPolarHBondContact O-CA 3.46Å; C476-H486 PolarHBondContact N-O 3.41Å; C476-H486 PolarHBondContact O-N 2.78Å
477	H	88.1	Confident	78.3	Confident	25 Å²	25	62.7 Å²	62.7	12%	0.116	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	164.2	175.4	79.4	95.1	0	0	0	111	F459 H460 H461 D479	F459-H477 WeakPolarHBondContact CA-O 3.38Å; H460-H477 PolarHBondContact N-O 3.11Å; H460-H477 PolarHBondContact O-CD2 2.97Å; H460-H477 PolarHBondContact O-N 3.03Å; H461-H477 PolarHBondContact O-CD2 2.92Å; H461-H477 PolarHBondContact O-NE2 2.98Å; H477-D479 IonicContact CE1-OD1 3.5Å
478	T	88.2	Confident	78.2	Confident	49 Å²	49	63.5 Å²	63.5	30%	0.301	36%	0.361	S	S	.	.			trans	-107.2	160.3	166	54.8	0	0	0	0	109.6	F459 G480	F459-T478 HydrophobicContact CD1-CG2 3.77Å; F459-T478 HydrophobicContact CD2-CG2 3.8Å; F459-T478 HydrophobicContact CE1-CG2 3.61Å; F459-T478 HydrophobicContact CE2-CG2 3.63Å; F459-T478 HydrophobicContact CG-CG2 3.87Å; F459-T478 HydrophobicContact CZ-CG2 3.54Å; T478-G480 VanDerWaalsContact C-N 3.29Å; T478-G480 PolarHBondContact O-N 3.43Å
479	D	73.8	Confident	77.2	Confident	137 Å²	137	66.7 Å²	66.7	73%	0.733	38%	0.381	S	S	*	.	S	Bend	trans	-76	80.9	176.3	-72	-27.1	0	0	0	110.5	H477	H477-D479 IonicContact CE1-OD1 3.5Å
480	G	69.6	Low	76.4	Confident	47 Å²	47	63.1 Å²	63.1	49%	0.485	36%	0.364	S	S	.	.			trans	-114.5	171	177.8	0	0	0	0	0	113.8	T478 E482	T478-G480 VanDerWaalsContact C-N 3.29Å; T478-G480 PolarHBondContact O-N 3.43Å; G480-E482 PolarHBondContact O-N 3.31Å
481	A	60.7	Low	75.1	Confident	116 Å²	116	63.9 Å²	63.9	96%	0.959	37%	0.37	S	S	*	.	S	Bend	trans	-64.2	-21.7	179	0	0	0	0	0	113.8
482	E	64.3	Low	74.3	Confident	168 Å²	168	64.8 Å²	64.8	79%	0.785	38%	0.375	S	S	*	.	S	Bend	trans	-125.7	133.2	164.5	-63.1	-144.7	160.8	0	0	109.4	G480 L484	G480-E482 PolarHBondContact O-N 3.31Å; E482-L484 VanDerWaalsContact C-N 3.26Å; E482-L484 PolarHBondContact O-N 2.66Å
483	P	67.3	Low	74.1	Confident	91 Å²	91	63.9 Å²	63.9	59%	0.591	37%	0.365	S	S	*	.			trans	-77.6	77.1	178.8	32.2	-33.8	0	0	0	109.8
484	L	82.7	Confident	74.1	Confident	116 Å²	116	61.6 Å²	61.6	61%	0.607	36%	0.355	S	S	*	.			trans	-77.4	122.4	171.7	-170.7	69.8	0	0	0	108.9	E482 H486	E482-L484 VanDerWaalsContact C-N 3.26Å; E482-L484 PolarHBondContact O-N 2.66Å; L484-H486 PolarHBondContact O-CD2 2.82Å; L484-H486 VanDerWaalsContact O-CD2 3.24Å
485	C	85.6	Confident	74.2	Confident	34 Å²	34	61.8 Å²	61.8	23%	0.23	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	130.4	175.8	-61.5	0	0	0	0	110.7	C462 W475 C476	C462-C485 HydrophobicContact CB-CB 3.83Å; C462-C485 WeakPolarHBondContact CB-SG 3.32Å; C462-C485 WeakPolarHBondContact SG-CB 3.05Å; C462-C485 CovalentContact SG-SG 2.02Å; C462-C485 PolarHBondContact SG-SG 3.18Å; W475-C485 HydrophobicContact CE3-CB 4.07Å; C476-C485 CarbonylContact O-C 3.44Å; C476-C485 WeakPolarHBondContact O-CA 3.46Å
486	H	82.4	Confident	73.9	Confident	72 Å²	72	59.4 Å²	59.4	33%	0.333	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	145.7	-178.7	-59.4	-93.5	0	0	0	109.7	F455 F459 W475 C476 L484	F455-H486 HydrophobicContact CE1-CB 4.46Å; F459-H486 HydrophobicContact CE1-CB 4.33Å; W475-H486 WeakPolarHBondContact CA-O 3.42Å; C476-H486 PolarHBondContact N-O 3.41Å; C476-H486 PolarHBondContact O-N 2.78Å; L484-H486 PolarHBondContact O-CD2 2.82Å; L484-H486 VanDerWaalsContact O-CD2 3.24Å
487	T	79.8	Confident	73.7	Confident	45 Å²	45	59.4 Å²	59.4	28%	0.276	35%	0.35	S	S	.	.			trans	-139.1	153.3	170.9	-178.9	0	0	0	0	107.3	Q473 L474 W475	Q473-T487 PolarHBondContact NE2-OG1 2.89Å; L474-T487 PolarHBondContact O-OG1 2.8Å; W475-T487 HydrophobicContact CD2-CG2 4.36Å; W475-T487 HydrophobicContact CE3-CG2 3.9Å; W475-T487 HydrophobicContact CH2-CG2 3.39Å; W475-T487 HydrophobicContact CZ2-CG2 3.87Å; W475-T487 HydrophobicContact CZ3-CG2 3.4Å
488	K	70.4	Confident	73.7	Confident	64 Å²	64	58.2 Å²	58.2	28%	0.278	34%	0.344	S	S	.	.			trans	-79.3	156.6	164.2	-73.8	-168.3	174.3	177.7	0	109.4	E352 I454 F455 G490 L492	E352-K488 VanDerWaalsContact CD-NZ 3.32Å; E352-K488 IonicContact OE1-NZ 2.57Å; E352-K488 PolarHBondContact OE1-NZ 2.86Å; E352-K488 IonicContact OE2-NZ 3.93Å; I454-K488 HydrophobicContact CG2-CD 3.85Å; I454-K488 HydrophobicContact CG2-CG 4.25Å; I454-K488 PolarHBondContact O-NZ 2.82Å; F455-K488 HydrophobicContact CE1-CG 3.69Å; F455-K488 HydrophobicContact CZ-CG 3.93Å; K488-G490 PolarHBondContact O-N 2.96Å; K488-L492 HydrophobicContact CB-CD1 4.31Å
489	N	55.6	Low	73.6	Confident	161 Å²	161	59.2 Å²	59.2	86%	0.861	35%	0.352	S	S	*	.	S	Bend	trans	-72.5	107.4	-178	-163.1	17.7	0	0	0	109.1
490	G	58.2	Low	74.3	Confident	12 Å²	12	53.3 Å²	53.3	12%	0.124	32%	0.321	C	S	.	.	S	Bend	trans	132.9	138.8	-170.9	0	0	0	0	0	110.2	V396 K488 L492	V396-G490 CarbonylContact O-C 3.57Å; K488-G490 PolarHBondContact O-N 2.96Å; G490-L492 PolarHBondContact O-N 2.67Å
491	S	55.8	Low	75.1	Confident	25 Å²	25	52.3 Å²	52.3	18%	0.175	31%	0.31	C	S	.	.			trans	-73.8	98.5	174.2	68.1	0	0	0	0	108.3	V396 H397 P493	V396-S491 PolarHBondContact O-N 2.9Å; V396-S491 PolarHBondContact O-OG 2.8Å; H397-S491 WeakPolarHBondContact CA-OG 3.27Å; H397-S491 WeakPolarHBondContact CB-OG 3.25Å; H397-S491 PolarHBondContact CD2-OG 2Å; S491-P493 WeakPolarHBondContact O-CD 3.44Å
492	L	65.9	Low	76.3	Confident	18 Å²	18	53 Å²	53	9%	0.094	31%	0.306	C	S	.	.			trans	-93.3	102.1	169.6	-59.3	170.4	0	0	0	106.1	Q355 F395 Q473 L474 K488 G490	Q355-L492 HydrophobicContact CB-CD2 4.35Å; Q355-L492 VanDerWaalsContact CD-CD2 3.44Å; Q355-L492 HydrophobicContact CG-CB 4.33Å; Q355-L492 HydrophobicContact CG-CD1 4.09Å; Q355-L492 HydrophobicContact CG-CD2 3.74Å; Q355-L492 HydrophobicContact CG-CG 4.24Å; F395-L492 HydrophobicContact CD1-CD2 4.43Å; F395-L492 HydrophobicContact CE1-CD2 4.28Å; Q473-L492 CarbonylContact C-O 3.55Å; Q473-L492 WeakPolarHBondContact CA-O 3.12Å; L474-L492 WeakPolarHBondContact CB-O 3.46Å; L474-L492 PolarHBondContact N-O 2.02Å; K488-L492 HydrophobicContact CB-CD1 4.31Å; G490-L492 PolarHBondContact O-N 2.67Å
493	P	75.9	Confident	77.4	Confident	24 Å²	24	47.1 Å²	47.1	16%	0.156	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-65	155.7	173.4	30	-34.6	0	0	0	108.7	Q355 C471 S491	Q355-P493 PolarHBondContact NE2-O 3.14Å; C471-P493 VanDerWaalsContact O-CA 3.29Å; C471-P493 WeakPolarHBondContact O-CA 3.12Å; C471-P493 WeakPolarHBondContact O-CB 3.32Å; S491-P493 WeakPolarHBondContact O-CD 3.44Å
494	W	79.8	Confident	78.5	Confident	5 Å²	5	46.3 Å²	46.3	2%	0.019	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-65.4	152.1	171	-69.7	65.3	0	0	0	109.9	L447 Q450 H461 V470 C471 Q473 L474 D496 T498	L447-W494 VanDerWaalsContact CA-CZ3 3.49Å; L447-W494 HydrophobicContact CB-CZ3 4.21Å; L447-W494 HydrophobicContact CD2-CE3 4.4Å; L447-W494 HydrophobicContact CD2-CH2 3.6Å; L447-W494 HydrophobicContact CD2-CZ2 3.98Å; L447-W494 HydrophobicContact CD2-CZ3 3.86Å; L447-W494 HydrophobicContact CG-CE3 4.27Å; L447-W494 HydrophobicContact CG-CH2 4.16Å; L447-W494 HydrophobicContact CG-CZ3 3.9Å; L447-W494 VanDerWaalsContact O-CH2 3.28Å; L447-W494 WeakPolarHBondContact O-CH2 3.32Å; L447-W494 WeakPolarHBondContact O-CZ3 3.49Å; Q450-W494 HydrophobicContact CB-CE3 4.3Å; Q450-W494 HydrophobicContact CB-CZ3 3.92Å; Q450-W494 HydrophobicContact CG-CE3 4.47Å; Q450-W494 HydrophobicContact CG-CZ3 4.43Å; H461-W494 HydrophobicContact CB-CH2 4.25Å; H461-W494 AromaticContact CD2-CZ2 3.82Å; V470-W494 HydrophobicContact CG1-CD2 4.4Å; V470-W494 HydrophobicContact CG1-CG 4.31Å; V470-W494 PolarHBondContact O-NE1 3.06Å; C471-W494 PolarHBondContact O-N 2.8Å; Q473-W494 PolarHBondContact O-NE1 2.82Å; Q473-W494 VanDerWaalsContact O-NE1 3.14Å; L474-W494 HydrophobicContact CB-CZ2 4.46Å; L474-W494 HydrophobicContact CD1-CD2 4.23Å; L474-W494 HydrophobicContact CD1-CE3 4.15Å; L474-W494 HydrophobicContact CD1-CH2 4.23Å; L474-W494 HydrophobicContact CD1-CZ2 4.35Å; L474-W494 HydrophobicContact CD1-CZ3 4.09Å; L474-W494 HydrophobicContact CG-CD2 4.44Å; L474-W494 HydrophobicContact CG-CH2 4.17Å; L474-W494 HydrophobicContact CG-CZ2 3.92Å; W494-D496 PolarHBondContact O-N 3.38Å; W494-T498 HydrophobicContact CB-CG2 4.23Å; W494-T498 HydrophobicContact CD2-CG2 4.32Å; W494-T498 HydrophobicContact CE3-CG2 3.81Å
495	A	82.2	Confident	78.8	Confident	6 Å²	6	41.1 Å²	41.1	5%	0.05	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-51.4	137	176.4	0	0	0	0	0	111.7	L354 P439 G497 T498	L354-A495 HydrophobicContact CD2-CB 3.35Å; P439-A495 HydrophobicContact CB-CB 4.35Å; A495-G497 PolarHBondContact O-N 3.39Å; A495-T498 VanDerWaalsContact O-CB 3.23Å; A495-T498 WeakPolarHBondContact O-CB 3.25Å; A495-T498 PolarHBondContact O-N 2.88Å; A495-T498 PolarHBondContact O-OG1 3.46Å
496	D	79.5	Confident	78.8	Confident	33 Å²	33	39.5 Å²	39.5	18%	0.176	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	136	172.6	-69.8	-22.3	0	0	0	109.9	L438 G440 W494 C506 S507 E508	L438-D496 CarbonylContact C-O 3.58Å; L438-D496 WeakPolarHBondContact CB-O 3.33Å; L438-D496 HydrophobicContact CD2-CB 4.04Å; G440-D496 WeakPolarHBondContact CA-O 3Å; G440-D496 PolarHBondContact N-O 3.45Å; W494-D496 PolarHBondContact O-N 3.38Å; D496-C506 CarbonylContact C-O 3.53Å; D496-C506 WeakPolarHBondContact CA-O 2.99Å; D496-S507 WeakPolarHBondContact OD1-CA 3.24Å; D496-E508 PolarHBondContact OD1-N 2.7Å
497	G	83.1	Confident	78.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	-3	-171.3	0	0	0	0	0	115.1	G440 A495 P499 C506	G440-G497 CarbonylContact C-O 3.5Å; A495-G497 PolarHBondContact O-N 3.39Å; G497-P499 WeakPolarHBondContact O-CD 3.4Å; G497-C506 PolarHBondContact N-O 2.73Å
498	T	86.3	Confident	78.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.24	C	C	.	.			trans	-65.4	128.9	174.2	-57.5	0	0	0	0	109.3	L447 Q450 W494 A495 C500 L505 C506	L447-T498 HydrophobicContact CD1-CG2 4.15Å; L447-T498 HydrophobicContact CG-CG2 3.99Å; Q450-T498 PolarHBondContact NE2-OG1 3.23Å; W494-T498 HydrophobicContact CB-CG2 4.23Å; W494-T498 HydrophobicContact CD2-CG2 4.32Å; W494-T498 HydrophobicContact CE3-CG2 3.81Å; A495-T498 VanDerWaalsContact O-CB 3.23Å; A495-T498 WeakPolarHBondContact O-CB 3.25Å; A495-T498 PolarHBondContact O-N 2.88Å; A495-T498 PolarHBondContact O-OG1 3.46Å; T498-C500 PolarHBondContact O-N 2.85Å; T498-L505 CarbonylContact O-C 3.6Å; T498-L505 WeakPolarHBondContact O-CA 3.37Å; T498-C506 PolarHBondContact O-N 3.48Å; T498-C506 PolarHBondContact O-SG 3.18Å
499	P	87.2	Confident	79.2	Confident	70 Å²	70	37.4 Å²	37.4	46%	0.455	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	124.5	175.2	-22.4	33.7	0	0	0	111.4	L447 G497	L447-P499 WeakPolarHBondContact CD1-O 3.41Å; G497-P499 WeakPolarHBondContact O-CD 3.4Å
500	C	88.4	Confident	80.7	Confident	12 Å²	12	31.8 Å²	31.8	8%	0.081	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-8.7	178.7	55.5	0	0	0	0	113.4	A467 V470 C471 T498 H504 C511	A467-C500 WeakPolarHBondContact CB-O 3.38Å; V470-C500 HydrophobicContact CB-CB 4.26Å; V470-C500 HydrophobicContact CG1-CB 4.13Å; C471-C500 WeakPolarHBondContact SG-CB 3.44Å; T498-C500 PolarHBondContact O-N 2.85Å; C500-H504 PolarHBondContact N-O 2.91Å; C500-H504 VanDerWaalsContact N-O 3.1Å; C500-H504 VanDerWaalsContact SG-C 3.54Å; C500-C511 HydrophobicContact CB-CB 3.85Å; C500-C511 WeakPolarHBondContact CB-SG 3.3Å; C500-C511 WeakPolarHBondContact SG-CA 3.42Å; C500-C511 WeakPolarHBondContact SG-CB 3.4Å; C500-C511 CovalentContact SG-SG 2.03Å; C500-C511 PolarHBondContact SG-SG 3.26Å
501	G	85.4	Confident	82.2	Confident	26 Å²	26	32 Å²	32	27%	0.268	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	176.7	175.5	0	0	0	0	0	110.9	G503 H504	G501-G503 PolarHBondContact O-N 3.17Å; G501-G503 VanDerWaalsContact O-N 3.12Å; G501-H504 PolarHBondContact O-N 3.41Å; G501-H504 VanDerWaalsContact O-N 3.14Å
502	P	87.1	Confident	83.9	Confident	132 Å²	132	33.2 Å²	33.2	86%	0.857	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	117.3	175.8	-22.7	33.8	0	0	0	111.4	H504	P502-H504 VanDerWaalsContact C-N 3.26Å; P502-H504 PolarHBondContact O-N 3.17Å; P502-H504 PolarHBondContact O-ND1 3.44Å
503	G	86.9	Confident	85.2	Confident	44 Å²	44	34.9 Å²	34.9	45%	0.454	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.4	21.3	-179	0	0	0	0	0	114.9	G501 E514	G501-G503 PolarHBondContact O-N 3.17Å; G501-G503 VanDerWaalsContact O-N 3.12Å; G503-E514 WeakPolarHBondContact O-CB 3.3Å; G503-E514 PolarHBondContact O-N 3.4Å
504	H	90.1	Very high	85.7	Confident	74 Å²	74	36.6 Å²	36.6	34%	0.343	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.1	179.4	-66.6	66.6	0	0	0	111.1	C500 G501 P502 C511 L512	C500-H504 PolarHBondContact N-O 2.91Å; C500-H504 VanDerWaalsContact N-O 3.1Å; C500-H504 VanDerWaalsContact SG-C 3.54Å; G501-H504 PolarHBondContact O-N 3.41Å; G501-H504 VanDerWaalsContact O-N 3.14Å; P502-H504 VanDerWaalsContact C-N 3.26Å; P502-H504 PolarHBondContact O-N 3.17Å; P502-H504 PolarHBondContact O-ND1 3.44Å; H504-C511 VanDerWaalsContact CB-SG 3.59Å; H504-L512 CarbonylContact C-O 3.57Å; H504-L512 WeakPolarHBondContact CA-O 3.46Å; H504-L512 WeakPolarHBondContact CB-O 3.46Å
505	L	89.8	Confident	85.9	Confident	6 Å²	6	44.5 Å²	44.5	3%	0.031	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.4	179.7	-53.9	175.8	0	0	0	111.1	L438 T498 L512 E514 V517 E518	L438-L505 HydrophobicContact CD1-CD1 4.25Å; T498-L505 CarbonylContact O-C 3.6Å; T498-L505 WeakPolarHBondContact O-CA 3.37Å; L505-L512 PolarHBondContact N-O 3.03Å; L505-L512 PolarHBondContact O-N 2.89Å; L505-E514 HydrophobicContact CD1-CB 4.35Å; L505-E514 HydrophobicContact CD1-CG 4.14Å; L505-E514 HydrophobicContact CG-CB 4.18Å; L505-E514 HydrophobicContact CG-CG 4.36Å; L505-V517 HydrophobicContact CB-CB 4.47Å; L505-V517 HydrophobicContact CB-CG1 4.39Å; L505-V517 HydrophobicContact CB-CG2 4.26Å; L505-V517 HydrophobicContact CD1-CB 4.19Å; L505-V517 HydrophobicContact CD1-CG1 4.09Å; L505-E518 HydrophobicContact CD1-CG 4.3Å
506	C	85.6	Confident	86	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131.4	167.3	-62.2	0	0	0	0	110.8	C471 D496 G497 T498 S510	C471-C506 WeakPolarHBondContact CA-SG 3.3Å; C471-C506 HydrophobicContact CB-CB 3.7Å; C471-C506 WeakPolarHBondContact CB-SG 3.42Å; C471-C506 WeakPolarHBondContact SG-CA 3.5Å; C471-C506 WeakPolarHBondContact SG-CB 3.19Å; C471-C506 CovalentContact SG-SG 2.04Å; C471-C506 PolarHBondContact SG-SG 3.36Å; D496-C506 CarbonylContact C-O 3.53Å; D496-C506 WeakPolarHBondContact CA-O 2.99Å; G497-C506 PolarHBondContact N-O 2.73Å; T498-C506 PolarHBondContact O-N 3.48Å; T498-C506 PolarHBondContact O-SG 3.18Å; C506-S510 CarbonylContact C-O 3.4Å; C506-S510 WeakPolarHBondContact CA-O 3.46Å
507	S	84.7	Confident	85.9	Confident	18 Å²	18	48.4 Å²	48.4	13%	0.126	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	125.4	169	-176.8	0	0	0	0	107.9	D496 G509 S510	D496-S507 WeakPolarHBondContact OD1-CA 3.24Å; S507-G509 PolarHBondContact O-N 2.69Å; S507-S510 PolarHBondContact N-O 3.1Å; S507-S510 PolarHBondContact O-N 2.95Å
508	E	76.4	Confident	85.5	Confident	107 Å²	107	52.3 Å²	52.3	50%	0.5	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	37.2	178.7	-50.6	-173.9	-178.1	0	0	112.8	Q400 D496 S510	Q400-E508 VanDerWaalsContact OE1-CG 3.24Å; D496-E508 PolarHBondContact OD1-N 2.7Å; E508-S510 PolarHBondContact O-N 2.95Å
509	G	80	Confident	85	Confident	12 Å²	12	60.1 Å²	60.1	12%	0.124	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	5.8	-178.8	0	0	0	0	0	115.3	C471 A472 S507	C471-G509 CarbonylContact C-O 3.53Å; C471-G509 VanDerWaalsContact C-O 3.29Å; C471-G509 WeakPolarHBondContact CB-O 3.24Å; C471-G509 WeakPolarHBondContact O-CA 3.15Å; A472-G509 PolarHBondContact N-O 3.09Å; S507-G509 PolarHBondContact O-N 2.69Å
510	S	86.8	Confident	84	Confident	44 Å²	44	62.4 Å²	62.4	31%	0.308	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	147.9	177.3	-64.4	0	0	0	0	111.8	C506 S507 E508 L512	C506-S510 CarbonylContact C-O 3.4Å; C506-S510 WeakPolarHBondContact CA-O 3.46Å; S507-S510 PolarHBondContact N-O 3.1Å; S507-S510 PolarHBondContact O-N 2.95Å; E508-S510 PolarHBondContact O-N 2.95Å; S510-L512 PolarHBondContact O-N 3.25Å
511	C	90.4	Very high	83.4	Confident	16 Å²	16	67.3 Å²	67.3	11%	0.108	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	104.6	174.9	-173.9	0	0	0	0	109.5	A467 C471 C500 H504	A467-C511 VanDerWaalsContact O-CB 3.25Å; A467-C511 WeakPolarHBondContact O-CB 3.47Å; C471-C511 VanDerWaalsContact SG-CA 3.58Å; C500-C511 HydrophobicContact CB-CB 3.85Å; C500-C511 WeakPolarHBondContact CB-SG 3.3Å; C500-C511 WeakPolarHBondContact SG-CA 3.42Å; C500-C511 WeakPolarHBondContact SG-CB 3.4Å; C500-C511 CovalentContact SG-SG 2.03Å; C500-C511 PolarHBondContact SG-SG 3.26Å; H504-C511 VanDerWaalsContact CB-SG 3.59Å
512	L	91.3	Very high	82.9	Confident	50 Å²	50	70.9 Å²	70.9	26%	0.262	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	155.6	-174.8	-62.8	-178.1	0	0	0	111	H504 L505 S510 E514 V517	H504-L512 CarbonylContact C-O 3.57Å; H504-L512 WeakPolarHBondContact CA-O 3.46Å; H504-L512 WeakPolarHBondContact CB-O 3.46Å; L505-L512 PolarHBondContact N-O 3.03Å; L505-L512 PolarHBondContact O-N 2.89Å; S510-L512 PolarHBondContact O-N 3.25Å; L512-E514 PolarHBondContact O-N 3.29Å; L512-V517 HydrophobicContact CB-CG2 3.61Å; L512-V517 HydrophobicContact CD1-CG2 4.43Å
513	P	91.9	Very high	82.5	Confident	53 Å²	53	69.3 Å²	69.3	34%	0.344	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	137.1	173.1	-23	34	0	0	0	111.3	E515 E516 V517	P513-E515 PolarHBondContact O-N 3.09Å; P513-E516 HydrophobicContact CB-CB 4.44Å; P513-E516 WeakPolarHBondContact O-CB 3.26Å; P513-E516 PolarHBondContact O-N 3.37Å; P513-V517 PolarHBondContact O-N 3.42Å
514	E	87	Confident	82.4	Confident	60 Å²	60	69.2 Å²	69.2	28%	0.28	36%	0.362	S	S	.	.	H	α-helix	trans	-51.6	-43.6	-179.2	173.2	165.4	-165.8	0	0	112.3	R441 G503 L505 L512 E516 V517 E518	R441-E514 IonicContact CZ-OE1 3.34Å; R441-E514 IonicContact NH1-OE1 3.1Å; R441-E514 PolarHBondContact NH1-OE1 2.95Å; R441-E514 VanDerWaalsContact NH1-OE1 3.1Å; R441-E514 IonicContact NH2-OE1 2.66Å; R441-E514 PolarHBondContact NH2-OE1 3.48Å; G503-E514 WeakPolarHBondContact O-CB 3.3Å; G503-E514 PolarHBondContact O-N 3.4Å; L505-E514 HydrophobicContact CD1-CB 4.35Å; L505-E514 HydrophobicContact CD1-CG 4.14Å; L505-E514 HydrophobicContact CG-CB 4.18Å; L505-E514 HydrophobicContact CG-CG 4.36Å; L512-E514 PolarHBondContact O-N 3.29Å; E514-E516 VanDerWaalsContact C-N 3.27Å; E514-E516 PolarHBondContact O-N 3.06Å; E514-V517 PolarHBondContact O-N 3.31Å; E514-E518 HydrophobicContact CG-CG 4.47Å; E514-E518 WeakPolarHBondContact O-CB 3.16Å; E514-E518 WeakPolarHBondContact O-CG 3.49Å; E514-E518 PolarHBondContact O-N 2.88Å
515	E	83.3	Confident	82.2	Confident	172 Å²	172	69.6 Å²	69.6	80%	0.804	37%	0.367	S	S	*	.	H	α-helix	trans	-59	-33.3	176.3	-62.7	176.7	-171.4	0	0	113.5	P513 R519	P513-E515 PolarHBondContact O-N 3.09Å; E515-R519 VanDerWaalsContact O-CB 3.31Å; E515-R519 WeakPolarHBondContact O-CB 3.38Å; E515-R519 PolarHBondContact O-N 3.14Å
516	E	86	Confident	82.4	Confident	97 Å²	97	70.2 Å²	70.2	45%	0.453	37%	0.374	S	S	.	.	H	α-helix	trans	-75.8	-40.1	178.8	-176.8	177.4	173.8	0	0	111.6	P513 E514	P513-E516 HydrophobicContact CB-CB 4.44Å; P513-E516 WeakPolarHBondContact O-CB 3.26Å; P513-E516 PolarHBondContact O-N 3.37Å; E514-E516 VanDerWaalsContact C-N 3.27Å; E514-E516 PolarHBondContact O-N 3.06Å
517	V	77.3	Confident	82.8	Confident	23 Å²	23	71 Å²	71	14%	0.139	38%	0.383	C	S	.	.	H	α-helix	trans	-70.9	-39.1	-178.4	179.6	0	0	0	0	111.2	L438 L505 L512 P513 E514	L438-V517 HydrophobicContact CD1-CG1 3.66Å; L438-V517 HydrophobicContact CD2-CG1 4.34Å; L505-V517 HydrophobicContact CB-CB 4.47Å; L505-V517 HydrophobicContact CB-CG1 4.39Å; L505-V517 HydrophobicContact CB-CG2 4.26Å; L505-V517 HydrophobicContact CD1-CB 4.19Å; L505-V517 HydrophobicContact CD1-CG1 4.09Å; L512-V517 HydrophobicContact CB-CG2 3.61Å; L512-V517 HydrophobicContact CD1-CG2 4.43Å; P513-V517 PolarHBondContact O-N 3.42Å; E514-V517 PolarHBondContact O-N 3.31Å
518	E	74.4	Confident	83.4	Confident	83 Å²	83	72.4 Å²	72.4	39%	0.388	39%	0.385	S	S	.	.	H	α-helix	trans	-85.6	-14.2	-177.4	-64.4	-165.2	143.8	0	0	113.9	R441 L505 E514 P520	R441-E518 IonicContact CZ-OE1 2.62Å; R441-E518 IonicContact NE-OE1 3.65Å; R441-E518 PolarHBondContact NE-OE1 2.92Å; R441-E518 IonicContact NH1-OE1 2.75Å; R441-E518 IonicContact NH2-OE1 3.31Å; R441-E518 PolarHBondContact NH2-OE1 3.19Å; R441-E518 IonicContact NH2-OE2 2.98Å; L505-E518 HydrophobicContact CD1-CG 4.3Å; E514-E518 HydrophobicContact CG-CG 4.47Å; E514-E518 WeakPolarHBondContact O-CB 3.16Å; E514-E518 WeakPolarHBondContact O-CG 3.49Å; E514-E518 PolarHBondContact O-N 2.88Å; E518-P520 WeakPolarHBondContact O-CD 2.97Å; E518-P520 VanDerWaalsContact O-N 3.16Å
519	R	75.8	Confident	84.3	Confident	164 Å²	164	67.8 Å²	67.8	62%	0.619	37%	0.365	S	S	*	.	S	Bend	trans	-61.7	119.8	-179.9	-175	176.6	65.2	-174	-2.9	110.1	E515 K521	E515-R519 VanDerWaalsContact O-CB 3.31Å; E515-R519 WeakPolarHBondContact O-CB 3.38Å; E515-R519 PolarHBondContact O-N 3.14Å; R519-K521 PolarHBondContact O-N 3.16Å
520	P	66.5	Low	85.1	Confident	118 Å²	118	72.1 Å²	72.1	77%	0.766	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-62.8	122.9	178.8	23.6	-31.4	0	0	0	110	E518	E518-P520 WeakPolarHBondContact O-CD 2.97Å; E518-P520 VanDerWaalsContact O-N 3.16Å
521	K	73.9	Confident	85.5	Confident	115 Å²	115	73.9 Å²	73.9	50%	0.5	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-84.6	139.8	173.8	-61.3	178.6	-177.2	173.4	0	109	R519 V523 N559	R519-K521 PolarHBondContact O-N 3.16Å; K521-V523 PolarHBondContact O-N 3.47Å; K521-N559 HydrophobicContact CB-CB 4.04Å; K521-N559 VanDerWaalsContact CB-CG 3.41Å; K521-N559 VanDerWaalsContact CD-OD1 3.31Å; K521-N559 WeakPolarHBondContact CD-OD1 3.32Å
522	P	76.1	Confident	85.7	Confident	101 Å²	101	74.5 Å²	74.5	66%	0.656	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-63.9	133.3	179.1	26.6	-33.8	0	0	0	110.5	V524 N559	P522-V524 PolarHBondContact O-N 3.29Å; P522-N559 WeakPolarHBondContact O-CB 3.42Å; P522-N559 PolarHBondContact O-ND2 3.12Å
523	V	78.9	Confident	86	Confident	98 Å²	98	77.9 Å²	77.9	59%	0.594	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-68.1	127.3	174.1	-177.6	0	0	0	0	108.7	K521	K521-V523 PolarHBondContact O-N 3.47Å
524	V	85.1	Confident	86.2	Confident	42 Å²	42	79.7 Å²	79.7	26%	0.255	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-118.7	109.1	177.2	-177.2	0	0	0	0	108.4	P522 P555 P557 Q558 G561	P522-V524 PolarHBondContact O-N 3.29Å; V524-P555 HydrophobicContact CG1-CB 4.12Å; V524-P555 HydrophobicContact CG1-CG 3.7Å; V524-P557 CarbonylContact O-C 3.56Å; V524-P557 VanDerWaalsContact O-CA 3.28Å; V524-P557 WeakPolarHBondContact O-CA 3.03Å; V524-Q558 HydrophobicContact CB-CB 4.05Å; V524-Q558 HydrophobicContact CG2-CB 4.34Å; V524-Q558 PolarHBondContact N-O 3.35Å; V524-Q558 VanDerWaalsContact N-O 3.12Å; V524-Q558 PolarHBondContact O-N 3.27Å; V524-G561 WeakPolarHBondContact O-CA 3.49Å
525	D	86.1	Confident	86.6	Confident	83 Å²	83	78.8 Å²	78.8	44%	0.444	43%	0.431	S	S	.	.			trans	-71.8	145.6	172.8	-72.7	-23.7	0	0	0	110.8	G561 R562	D525-G561 WeakPolarHBondContact OD1-CA 3.41Å; D525-R562 PolarHBondContact OD1-N 2.79Å
526	G	92.5	Very high	87.2	Confident	18 Å²	18	79.6 Å²	79.6	19%	0.186	44%	0.435	C	S	.	.			trans	-74	142.8	-179.8	0	0	0	0	0	113.5	P555 R562 C564	G526-P555 CarbonylContact C-O 3.56Å; G526-P555 VanDerWaalsContact CA-O 3.3Å; G526-P555 WeakPolarHBondContact CA-O 3.38Å; G526-R562 PolarHBondContact N-O 3.35Å; G526-C564 PolarHBondContact O-SG 3.3Å; G526-C564 VanDerWaalsContact O-SG 3.34Å
527	G	95.3	Very high	87.7	Confident	18 Å²	18	76.3 Å²	76.3	19%	0.186	42%	0.423	C	S	.	.			trans	-116.2	144.2	171.1	0	0	0	0	0	112.9	A529 C552 K553 D554 P555 C564	G527-A529 PolarHBondContact O-N 3.09Å; G527-C552 CarbonylContact O-C 3.58Å; G527-C552 WeakPolarHBondContact O-CA 3.49Å; G527-K553 PolarHBondContact O-N 3Å; G527-D554 CarbonylContact C-O 3.59Å; G527-D554 VanDerWaalsContact CA-O 3.24Å; G527-D554 WeakPolarHBondContact CA-O 3.48Å; G527-D554 PolarHBondContact O-N 3.02Å; G527-P555 PolarHBondContact N-O 3.38Å; G527-C564 PolarHBondContact N-SG 2.8Å; G527-C564 VanDerWaalsContact N-SG 3.43Å; G527-C564 PolarHBondContact O-SG 3.47Å
528	W	95.8	Very high	88.6	Confident	47 Å²	47	77 Å²	77	18%	0.178	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-71	124.1	176	-77.6	117.9	0	0	0	110.3	R550 C552 C564 L565 R568	W528-R550 VanDerWaalsContact CD1-CZ 3.48Å; W528-R550 VanDerWaalsContact CD1-NH2 3.27Å; W528-R550 HydrophobicContact CD2-CG 4.17Å; W528-R550 HydrophobicContact CE3-CB 4.42Å; W528-R550 HydrophobicContact CE3-CG 3.65Å; W528-R550 HydrophobicContact CZ3-CG 4.17Å; W528-R550 WeakPolarHBondContact CZ3-O 3.2Å; W528-C552 HydrophobicContact CE3-CB 4.35Å; W528-C552 HydrophobicContact CZ3-CB 4.15Å; W528-C564 HydrophobicContact CD2-CB 3.66Å; W528-C564 HydrophobicContact CE3-CB 4.13Å; W528-C564 HydrophobicContact CG-CB 4.1Å; W528-C564 HydrophobicContact CH2-CB 3.99Å; W528-C564 HydrophobicContact CZ2-CB 3.53Å; W528-C564 WeakPolarHBondContact CZ2-O 3.32Å; W528-C564 HydrophobicContact CZ3-CB 4.29Å; W528-L565 PolarHBondContact NE1-O 3.08Å; W528-R568 HydrophobicContact CH2-CB 3.57Å; W528-R568 HydrophobicContact CZ2-CB 4.25Å; W528-R568 HydrophobicContact CZ3-CB 4.04Å
529	A	96.3	Very high	89.5	Confident	9 Å²	9	74.4 Å²	74.4	7%	0.074	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-63.4	163.8	166.1	0	0	0	0	0	111.4	G527 R550 E551 K553 D554	G527-A529 PolarHBondContact O-N 3.09Å; A529-R550 WeakPolarHBondContact O-CB 3.27Å; A529-E551 WeakPolarHBondContact CB-O 3.41Å; A529-E551 PolarHBondContact N-O 2.84Å; A529-K553 HydrophobicContact CB-CG 3.82Å; A529-D554 HydrophobicContact CB-CB 4.22Å
530	P	96.3	Very high	90.4	Very high	104 Å²	104	72.2 Å²	72.2	68%	0.675	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-53.6	154.1	169.5	-25.8	34.9	0	0	0	112.4	G532	P530-G532 PolarHBondContact O-N 3.43Å
531	W	95.4	Very high	91.7	Very high	81 Å²	81	67.7 Å²	67.7	31%	0.307	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-59.9	128.4	173.5	-71.8	102.2	0	0	0	110.7	S548 R550 R567 K570	W531-S548 WeakPolarHBondContact CZ3-O 3.46Å; W531-R550 HydrophobicContact CD2-CB 4.41Å; W531-R550 HydrophobicContact CD2-CG 4.25Å; W531-R550 HydrophobicContact CE3-CB 4.07Å; W531-R550 HydrophobicContact CE3-CG 3.92Å; W531-R550 HydrophobicContact CH2-CG 4.04Å; W531-R550 HydrophobicContact CZ2-CG 4.36Å; W531-R550 HydrophobicContact CZ3-CB 4.37Å; W531-R550 HydrophobicContact CZ3-CG 3.8Å; W531-R567 HydrophobicContact CH2-CB 4.09Å; W531-R567 HydrophobicContact CZ2-CB 4.23Å; W531-K570 HydrophobicContact CD2-CD 3.79Å; W531-K570 HydrophobicContact CD2-CG 4.17Å; W531-K570 HydrophobicContact CE3-CD 3.98Å; W531-K570 HydrophobicContact CE3-CG 3.82Å; W531-K570 HydrophobicContact CG-CD 4.22Å; W531-K570 HydrophobicContact CH2-CB 4.09Å; W531-K570 HydrophobicContact CH2-CD 4.49Å; W531-K570 HydrophobicContact CH2-CG 4.17Å; W531-K570 HydrophobicContact CZ2-CB 4.49Å; W531-K570 HydrophobicContact CZ2-CD 4.32Å; W531-K570 HydrophobicContact CZ2-CG 4.48Å; W531-K570 HydrophobicContact CZ3-CB 4.15Å; W531-K570 HydrophobicContact CZ3-CD 4.33Å; W531-K570 HydrophobicContact CZ3-CG 3.83Å
532	G	95.6	Very high	92.5	Very high	28 Å²	28	62.3 Å²	62.3	29%	0.289	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-64.7	168.1	170.3	0	0	0	0	0	112.1	P530 S548 H549	P530-G532 PolarHBondContact O-N 3.43Å; G532-S548 PolarHBondContact O-OG 2.57Å; G532-H549 WeakPolarHBondContact CA-O 3.24Å; G532-H549 PolarHBondContact N-O 2.84Å
533	P	96.8	Very high	93.4	Very high	122 Å²	122	57.6 Å²	57.6	79%	0.792	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-59.3	159.2	175.4	28.3	-35.3	0	0	0	111.1	G535	P533-G535 PolarHBondContact O-N 2.99Å
534	W	96.1	Very high	94.2	Very high	91 Å²	91	53 Å²	53	35%	0.345	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-65.1	128.3	168.9	-66.4	107	0	0	0	109.5	Q546 K570 Q572	W534-Q546 HydrophobicContact CB-CG 4.49Å; W534-Q546 HydrophobicContact CD2-CG 4.41Å; W534-Q546 HydrophobicContact CE3-CG 3.93Å; W534-K570 HydrophobicContact CH2-CB 4.42Å; W534-K570 HydrophobicContact CH2-CD 3.96Å; W534-K570 HydrophobicContact CH2-CG 3.66Å; W534-K570 HydrophobicContact CZ2-CD 4.17Å; W534-K570 HydrophobicContact CZ2-CG 4.34Å; W534-K570 HydrophobicContact CZ3-CG 4.08Å; W534-Q572 HydrophobicContact CD2-CG 4.21Å; W534-Q572 VanDerWaalsContact CE2-CD 3.41Å; W534-Q572 HydrophobicContact CE3-CG 3.97Å; W534-Q572 HydrophobicContact CH2-CB 3.91Å; W534-Q572 HydrophobicContact CH2-CG 3.61Å; W534-Q572 HydrophobicContact CZ2-CB 4.41Å; W534-Q572 HydrophobicContact CZ2-CG 3.88Å; W534-Q572 VanDerWaalsContact CZ2-OE1 3.29Å; W534-Q572 HydrophobicContact CZ3-CB 4.24Å; W534-Q572 HydrophobicContact CZ3-CG 3.68Å
535	G	94.6	Very high	94.7	Very high	40 Å²	40	51 Å²	51	41%	0.412	30%	0.298	S	S	.	.			trans	-71.5	-177.1	172.3	0	0	0	0	0	112.1	P533 Q546 F547	P533-G535 PolarHBondContact O-N 2.99Å; G535-Q546 PolarHBondContact O-OE1 2.86Å; G535-F547 PolarHBondContact N-O 3.17Å
536	E	96	Very high	95.1	Very high	189 Å²	189	48.8 Å²	48.8	88%	0.883	29%	0.285	S	S	*	.			trans	-62.9	146.2	179.3	-61.6	-170.3	150.8	0	0	112.1
537	C	96.4	Very high	95.2	Very high	29 Å²	29	49.1 Å²	49.1	20%	0.196	28%	0.282	C	S	.	.			trans	-71.7	133.1	173.7	-168.6	0	0	0	0	110.2	R539 C574 H575	C537-R539 PolarHBondContact O-N 3.01Å; C537-R539 VanDerWaalsContact O-N 3.09Å; C537-R539 PolarHBondContact SG-O 3.21Å; C537-C574 VanDerWaalsContact CA-SG 3.55Å; C537-C574 HydrophobicContact CB-CB 3.8Å; C537-C574 WeakPolarHBondContact CB-SG 3.09Å; C537-C574 WeakPolarHBondContact SG-CB 3.47Å; C537-C574 CovalentContact SG-SG 2Å; C537-C574 PolarHBondContact SG-SG 3.42Å; C537-H575 VanDerWaalsContact CB-ND1 3.29Å; C537-H575 WeakPolarHBondContact CB-ND1 3.46Å; C537-H575 PolarHBondContact SG-ND1 2.98Å
538	S	96.4	Very high	95.1	Very high	37 Å²	37	48.3 Å²	48.3	26%	0.259	27%	0.273	S	S	.	.	S	Bend	trans	-62.4	-17.6	178.6	66.2	0	0	0	0	114.5	G544 V545 I642 D643	S538-G544 WeakPolarHBondContact OG-CA 3.41Å; S538-V545 WeakPolarHBondContact CB-O 3.47Å; S538-V545 PolarHBondContact N-O 2.83Å; S538-V545 PolarHBondContact OG-N 3.28Å; S538-V545 PolarHBondContact OG-O 3.17Å; S538-I642 WeakPolarHBondContact O-CG2 3.35Å; S538-D643 WeakPolarHBondContact CB-O 3.35Å; S538-D643 PolarHBondContact OG-O 3.06Å
539	R	94.5	Very high	95	Very high	29 Å²	29	50.1 Å²	50.1	11%	0.109	28%	0.284	C	S	.	.			trans	-141.7	154	-179.6	-60.1	176.8	58.2	-160.2	-7.2	110.3	C537 C541 G542 G543 H575 F586 G644	C537-R539 PolarHBondContact O-N 3.01Å; C537-R539 VanDerWaalsContact O-N 3.09Å; C537-R539 PolarHBondContact SG-O 3.21Å; R539-C541 VanDerWaalsContact CZ-O 3.29Å; R539-C541 PolarHBondContact NE-O 3.47Å; R539-C541 PolarHBondContact NH2-O 2.94Å; R539-G542 VanDerWaalsContact CZ-O 3.23Å; R539-G542 PolarHBondContact NH1-O 2.91Å; R539-G542 PolarHBondContact NH2-O 2.79Å; R539-G543 VanDerWaalsContact CD-O 3.31Å; R539-G543 WeakPolarHBondContact CD-O 3.32Å; R539-G543 PolarHBondContact NH1-O 2.96Å; R539-H575 PolarHBondContact O-ND1 2.85Å; R539-F586 HydrophobicContact CG-CD1 4.49Å; R539-F586 HydrophobicContact CG-CE1 3.78Å; R539-F586 HydrophobicContact CG-CZ 3.83Å; R539-G644 PolarHBondContact NH1-O 3.47Å
540	T	94.6	Very high	94.8	Very high	117 Å²	117	52.4 Å²	52.4	72%	0.718	29%	0.29	S	S	*	.	S	Bend	trans	-97.4	-5.8	177.3	51.5	0	0	0	0	113.4
541	C	93.6	Very high	94.6	Very high	23 Å²	23	51.3 Å²	51.3	16%	0.155	28%	0.276	C	S	.	.	S	Bend	trans	-164.9	167.1	175.2	60.4	0	0	0	0	110.2	R539 G543 H575 C579	R539-C541 VanDerWaalsContact CZ-O 3.29Å; R539-C541 PolarHBondContact NE-O 3.47Å; R539-C541 PolarHBondContact NH2-O 2.94Å; C541-G543 VanDerWaalsContact C-N 3.26Å; C541-G543 PolarHBondContact O-N 2.93Å; C541-H575 CarbonylContact C-O 3.56Å; C541-H575 VanDerWaalsContact C-O 3.29Å; C541-H575 WeakPolarHBondContact CA-O 3.34Å; C541-C579 HydrophobicContact CB-CB 4Å; C541-C579 WeakPolarHBondContact CB-SG 3.46Å; C541-C579 PolarHBondContact O-SG 2.69Å; C541-C579 WeakPolarHBondContact SG-CA 3.41Å; C541-C579 WeakPolarHBondContact SG-CB 3.49Å; C541-C579 CovalentContact SG-SG 2.04Å; C541-C579 PolarHBondContact SG-SG 2.77Å
542	G	91.1	Very high	94.6	Very high	3 Å²	3	47.9 Å²	47.9	3%	0.031	26%	0.264	C	S	.	.	S	Bend	trans	67.3	23.7	171.4	0	0	0	0	0	113.7	R539 H575 E577 C579 H667	R539-G542 VanDerWaalsContact CZ-O 3.23Å; R539-G542 PolarHBondContact NH1-O 2.91Å; R539-G542 PolarHBondContact NH2-O 2.79Å; G542-H575 PolarHBondContact N-O 3.46Å; G542-H575 VanDerWaalsContact N-O 3.16Å; G542-E577 VanDerWaalsContact CA-O 3.3Å; G542-E577 WeakPolarHBondContact CA-O 3.48Å; G542-E577 PolarHBondContact N-O 3.2Å; G542-C579 PolarHBondContact N-SG 2.86Å; G542-H667 PolarHBondContact O-ND1 3.23Å
543	G	93.3	Very high	94.5	Very high	2 Å²	2	51.5 Å²	51.5	2%	0.021	27%	0.272	C	S	.	.			trans	86.4	92.5	179.5	0	0	0	0	0	114.6	R539 C541 H575 G644	R539-G543 VanDerWaalsContact CD-O 3.31Å; R539-G543 WeakPolarHBondContact CD-O 3.32Å; R539-G543 PolarHBondContact NH1-O 2.96Å; C541-G543 VanDerWaalsContact C-N 3.26Å; C541-G543 PolarHBondContact O-N 2.93Å; G543-H575 PolarHBondContact N-O 3.12Å; G543-G644 WeakPolarHBondContact O-CA 3.46Å
544	G	95.8	Very high	94.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	178.8	163.8	0	0	0	0	0	112.6	S538 S573 C574	S538-G544 WeakPolarHBondContact OG-CA 3.41Å; G544-S573 WeakPolarHBondContact O-CA 3.46Å; G544-C574 PolarHBondContact N-O 2.81Å; G544-C574 PolarHBondContact O-N 3.41Å
545	V	95.9	Very high	94.3	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.5	174.8	-176.6	0	0	0	0	108.6	S538 F547 Y571 Q572 C574 D643 I654 V656	S538-V545 WeakPolarHBondContact CB-O 3.47Å; S538-V545 PolarHBondContact N-O 2.83Å; S538-V545 PolarHBondContact OG-N 3.28Å; S538-V545 PolarHBondContact OG-O 3.17Å; V545-F547 HydrophobicContact CB-CE2 4.43Å; V545-F547 HydrophobicContact CG1-CD2 4.37Å; V545-F547 HydrophobicContact CG1-CE2 3.81Å; V545-F547 HydrophobicContact CG1-CZ 3.95Å; V545-Y571 HydrophobicContact CG1-CD2 4.1Å; V545-Y571 HydrophobicContact CG1-CG 4.36Å; V545-Q572 WeakPolarHBondContact CA-O 3.45Å; V545-C574 VanDerWaalsContact C-SG 3.51Å; V545-D643 HydrophobicContact CB-CB 4.05Å; V545-D643 HydrophobicContact CG2-CB 4.37Å; V545-I654 HydrophobicContact CG2-CD1 3.82Å; V545-V656 HydrophobicContact CG1-CG1 4.18Å; V545-V656 HydrophobicContact CG2-CG2 4.09Å
546	Q	95.4	Very high	94.1	Very high	36 Å²	36	52.6 Å²	52.6	17%	0.168	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	150.3	171	57.6	-174.6	-22.8	0	0	109.4	W534 G535 Y571 Q572 C574	W534-Q546 HydrophobicContact CB-CG 4.49Å; W534-Q546 HydrophobicContact CD2-CG 4.41Å; W534-Q546 HydrophobicContact CE3-CG 3.93Å; G535-Q546 PolarHBondContact O-OE1 2.86Å; Q546-Y571 VanDerWaalsContact O-CA 3.24Å; Q546-Y571 WeakPolarHBondContact O-CA 3.44Å; Q546-Q572 HydrophobicContact CG-CG 3.64Å; Q546-Q572 PolarHBondContact N-O 3.12Å; Q546-Q572 PolarHBondContact O-N 3.45Å; Q546-Q572 VanDerWaalsContact O-N 3.08Å; Q546-C574 HydrophobicContact CG-CB 4.17Å; Q546-C574 PolarHBondContact N-SG 2.9Å
547	F	93.7	Very high	93.7	Very high	25 Å²	25	44 Å²	44	11%	0.11	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	146.3	-176.8	-66.1	-97.2	0	0	0	110.5	F213 G535 V545 H549 K570 Y571 D643 V656 R657	F213-F547 HydrophobicContact CE1-CE1 4.04Å; F213-F547 HydrophobicContact CZ-CE1 4.13Å; G535-F547 PolarHBondContact N-O 3.17Å; V545-F547 HydrophobicContact CB-CE2 4.43Å; V545-F547 HydrophobicContact CG1-CD2 4.37Å; V545-F547 HydrophobicContact CG1-CE2 3.81Å; V545-F547 HydrophobicContact CG1-CZ 3.95Å; F547-H549 VanDerWaalsContact CB-CE1 3.46Å; F547-H549 WeakPolarHBondContact CB-CE1 3.27Å; F547-K570 CarbonylContact C-O 3.6Å; F547-K570 WeakPolarHBondContact CA-O 3.3Å; F547-Y571 HydrophobicContact CE1-CD1 4.42Å; F547-Y571 HydrophobicContact CE1-CG 4.23Å; F547-D643 HydrophobicContact CE2-CB 4.49Å; F547-D643 VanDerWaalsContact CE2-OD2 3.24Å; F547-D643 WeakPolarHBondContact CE2-OD2 3.19Å; F547-D643 WeakPolarHBondContact CZ-OD2 3.36Å; F547-V656 HydrophobicContact CE1-CG1 4.04Å; F547-V656 HydrophobicContact CZ-CG1 3.64Å; F547-R657 HydrophobicContact CE1-CG 3.95Å; F547-R657 HydrophobicContact CZ-CG 3.81Å
548	S	94.6	Very high	93	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.7	166	160.6	0	0	0	0	107	W531 G532 A569 K570	W531-S548 WeakPolarHBondContact CZ3-O 3.46Å; G532-S548 PolarHBondContact O-OG 2.57Å; S548-A569 WeakPolarHBondContact O-CA 3.16Å; S548-K570 PolarHBondContact N-O 3.14Å; S548-K570 PolarHBondContact O-N 2.63Å; S548-K570 WeakPolarHBondContact OG-CE 3.11Å
549	H	92.1	Very high	92	Very high	86 Å²	86	49 Å²	49	40%	0.398	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	156.7	-176.6	-59.3	86.4	0	0	0	110.2	G532 F547 R568 R657	G532-H549 WeakPolarHBondContact CA-O 3.24Å; G532-H549 PolarHBondContact N-O 2.84Å; F547-H549 VanDerWaalsContact CB-CE1 3.46Å; F547-H549 WeakPolarHBondContact CB-CE1 3.27Å; H549-R568 WeakPolarHBondContact CA-O 3.39Å; H549-R657 PolarHBondContact NE2-NH2 3.25Å; H549-R657 VanDerWaalsContact NE2-NH2 3.17Å
550	R	93.3	Very high	90.8	Very high	57 Å²	57	51 Å²	51	22%	0.215	28%	0.278	C	S	.	.			trans	-133.3	154.5	166.8	59.8	179.7	-174	170.5	1.5	110	W528 A529 W531 R567 R568	W528-R550 VanDerWaalsContact CD1-CZ 3.48Å; W528-R550 VanDerWaalsContact CD1-NH2 3.27Å; W528-R550 HydrophobicContact CD2-CG 4.17Å; W528-R550 HydrophobicContact CE3-CB 4.42Å; W528-R550 HydrophobicContact CE3-CG 3.65Å; W528-R550 HydrophobicContact CZ3-CG 4.17Å; W528-R550 WeakPolarHBondContact CZ3-O 3.2Å; A529-R550 WeakPolarHBondContact O-CB 3.27Å; W531-R550 HydrophobicContact CD2-CB 4.41Å; W531-R550 HydrophobicContact CD2-CG 4.25Å; W531-R550 HydrophobicContact CE3-CB 4.07Å; W531-R550 HydrophobicContact CE3-CG 3.92Å; W531-R550 HydrophobicContact CH2-CG 4.04Å; W531-R550 HydrophobicContact CZ2-CG 4.36Å; W531-R550 HydrophobicContact CZ3-CB 4.37Å; W531-R550 HydrophobicContact CZ3-CG 3.8Å; R550-R567 PolarHBondContact NE-O 3.13Å; R550-R567 PolarHBondContact NH2-O 3.47Å; R550-R568 PolarHBondContact N-O 2.83Å
551	E	92	Very high	89.8	Confident	81 Å²	81	45.8 Å²	45.8	38%	0.379	25%	0.247	S	C	.	.			trans	-112.1	150.7	-177.3	-62.6	-171.6	132	0	0	110.4	K259 A529 K553	K259-E551 IonicContact NZ-OE1 3.73Å; K259-E551 PolarHBondContact NZ-OE1 3.27Å; A529-E551 WeakPolarHBondContact CB-O 3.41Å; A529-E551 PolarHBondContact N-O 2.84Å; E551-K553 VanDerWaalsContact C-N 3.34Å; E551-K553 HydrophobicContact CB-CD 3.99Å; E551-K553 HydrophobicContact CB-CG 4.06Å; E551-K553 PolarHBondContact O-N 3.15Å; E551-K553 VanDerWaalsContact O-N 3.12Å; E551-K553 WeakPolarHBondContact OE2-CE 3.29Å; E551-K553 IonicContact OE2-NZ 3.74Å; E551-K553 PolarHBondContact OE2-NZ 2.93Å
552	C	94.4	Very high	89.2	Confident	8 Å²	8	53.8 Å²	53.8	5%	0.054	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-83.8	79.6	175.8	-174	0	0	0	0	109.3	G527 W528 Y563 C564	G527-C552 CarbonylContact O-C 3.58Å; G527-C552 WeakPolarHBondContact O-CA 3.49Å; W528-C552 HydrophobicContact CE3-CB 4.35Å; W528-C552 HydrophobicContact CZ3-CB 4.15Å; C552-Y563 HydrophobicContact CB-CD2 4.29Å; C552-Y563 HydrophobicContact CB-CE1 4.05Å; C552-Y563 HydrophobicContact CB-CE2 3.65Å; C552-Y563 VanDerWaalsContact CB-CZ 3.5Å; C552-C564 WeakPolarHBondContact CA-SG 3.45Å; C552-C564 HydrophobicContact CB-CB 3.63Å; C552-C564 WeakPolarHBondContact CB-SG 3.46Å; C552-C564 WeakPolarHBondContact SG-CB 3.35Å; C552-C564 PolarHBondContact SG-N 3.26Å; C552-C564 CovalentContact SG-SG 2.02Å; C552-C564 PolarHBondContact SG-SG 2.81Å
553	K	93.9	Very high	89.2	Confident	104 Å²	104	55.1 Å²	55.1	45%	0.452	28%	0.278	S	S	.	.			trans	-143.8	8.5	-171.5	69.9	177.7	178.9	-165.1	0	115.9	G527 A529 E551 P555 E556	G527-K553 PolarHBondContact O-N 3Å; A529-K553 HydrophobicContact CB-CG 3.82Å; E551-K553 VanDerWaalsContact C-N 3.34Å; E551-K553 HydrophobicContact CB-CD 3.99Å; E551-K553 HydrophobicContact CB-CG 4.06Å; E551-K553 PolarHBondContact O-N 3.15Å; E551-K553 VanDerWaalsContact O-N 3.12Å; E551-K553 WeakPolarHBondContact OE2-CE 3.29Å; E551-K553 IonicContact OE2-NZ 3.74Å; E551-K553 PolarHBondContact OE2-NZ 2.93Å; K553-P555 VanDerWaalsContact C-CA 3.48Å; K553-P555 CarbonylContact C-O 3.53Å; K553-P555 CarbonylContact O-C 3.56Å; K553-E556 HydrophobicContact CB-CG 3.57Å; K553-E556 PolarHBondContact O-N 3.25Å
554	D	94.2	Very high	89.2	Confident	104 Å²	104	55.3 Å²	55.3	56%	0.556	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.7	68.8	-178.3	-164.2	15.8	0	0	0	111.3	G527 A529	G527-D554 CarbonylContact C-O 3.59Å; G527-D554 VanDerWaalsContact CA-O 3.24Å; G527-D554 WeakPolarHBondContact CA-O 3.48Å; G527-D554 PolarHBondContact O-N 3.02Å; A529-D554 HydrophobicContact CB-CB 4.22Å
555	P	94.6	Very high	88.9	Confident	65 Å²	65	60 Å²	60	42%	0.422	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.9	170.5	-0.1	35.1	-35.1	0	0	0	113.6	V524 G526 G527 K553	V524-P555 HydrophobicContact CG1-CB 4.12Å; V524-P555 HydrophobicContact CG1-CG 3.7Å; G526-P555 CarbonylContact C-O 3.56Å; G526-P555 VanDerWaalsContact CA-O 3.3Å; G526-P555 WeakPolarHBondContact CA-O 3.38Å; G527-P555 PolarHBondContact N-O 3.38Å; K553-P555 VanDerWaalsContact C-CA 3.48Å; K553-P555 CarbonylContact C-O 3.53Å; K553-P555 CarbonylContact O-C 3.56Å
556	E	90.7	Very high	88.7	Confident	107 Å²	107	61 Å²	61	50%	0.5	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-71.7	142	169	-75.7	-175	160	0	0	110.8	K553 Q558	K553-E556 HydrophobicContact CB-CG 3.57Å; K553-E556 PolarHBondContact O-N 3.25Å; E556-Q558 PolarHBondContact O-N 2.91Å
557	P	88	Confident	88.4	Confident	8 Å²	8	65.4 Å²	65.4	5%	0.052	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-60	131.2	173.7	-17.1	24.9	0	0	0	112.1	P256 V524 Y563	P256-P557 HydrophobicContact CB-CB 4.41Å; P256-P557 HydrophobicContact CB-CG 4.08Å; V524-P557 CarbonylContact O-C 3.56Å; V524-P557 VanDerWaalsContact O-CA 3.28Å; V524-P557 WeakPolarHBondContact O-CA 3.03Å; P557-Y563 HydrophobicContact CG-CD2 3.98Å
558	Q	81.9	Confident	88.3	Confident	103 Å²	103	65.2 Å²	65.2	48%	0.481	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-136.6	156.4	177.4	-58.4	177.5	15.7	0	0	111.8	V524 E556 G560 G561	V524-Q558 HydrophobicContact CB-CB 4.05Å; V524-Q558 HydrophobicContact CG2-CB 4.34Å; V524-Q558 PolarHBondContact N-O 3.35Å; V524-Q558 VanDerWaalsContact N-O 3.12Å; V524-Q558 PolarHBondContact O-N 3.27Å; E556-Q558 PolarHBondContact O-N 2.91Å; Q558-G560 VanDerWaalsContact C-N 3.27Å; Q558-G560 PolarHBondContact O-N 3.37Å; Q558-G561 PolarHBondContact O-N 3.09Å
559	N	73.6	Confident	88.1	Confident	70 Å²	70	65.2 Å²	65.2	37%	0.374	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	40.6	171.5	-48.5	-49.1	0	0	0	113.6	K521 P522	K521-N559 HydrophobicContact CB-CB 4.04Å; K521-N559 VanDerWaalsContact CB-CG 3.41Å; K521-N559 VanDerWaalsContact CD-OD1 3.31Å; K521-N559 WeakPolarHBondContact CD-OD1 3.32Å; P522-N559 WeakPolarHBondContact O-CB 3.42Å; P522-N559 PolarHBondContact O-ND2 3.12Å
560	G	69.5	Low	88	Confident	71 Å²	71	63.8 Å²	63.8	73%	0.732	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	9.2	-178.6	0	0	0	0	0	115.2	Q558	Q558-G560 VanDerWaalsContact C-N 3.27Å; Q558-G560 PolarHBondContact O-N 3.37Å
561	G	74.4	Confident	88	Confident	7 Å²	7	63.1 Å²	63.1	7%	0.072	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-62.8	156.6	174.7	0	0	0	0	0	113.8	V524 D525 Q558	V524-G561 WeakPolarHBondContact O-CA 3.49Å; D525-G561 WeakPolarHBondContact OD1-CA 3.41Å; Q558-G561 PolarHBondContact O-N 3.09Å
562	R	81.4	Confident	88.1	Confident	191 Å²	191	62.7 Å²	62.7	72%	0.721	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-73.8	136.8	-176.2	-63.6	176.2	179.4	175.8	1.2	110.9	D525 G526	D525-R562 PolarHBondContact OD1-N 2.79Å; G526-R562 PolarHBondContact N-O 3.35Å
563	Y	89.9	Confident	88.2	Confident	30 Å²	30	63.4 Å²	63.4	12%	0.118	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-70.2	149.8	168.8	-165.2	-94	0	0	0	110.7	P256 K259 C552 P557 L565	P256-Y563 HydrophobicContact CB-CD2 4.37Å; P256-Y563 HydrophobicContact CB-CE2 4.41Å; K259-Y563 VanDerWaalsContact CA-OH 3.27Å; K259-Y563 WeakPolarHBondContact CA-OH 3.44Å; K259-Y563 WeakPolarHBondContact O-CE1 3.34Å; K259-Y563 PolarHBondContact O-OH 3.01Å; C552-Y563 HydrophobicContact CB-CD2 4.29Å; C552-Y563 HydrophobicContact CB-CE1 4.05Å; C552-Y563 HydrophobicContact CB-CE2 3.65Å; C552-Y563 VanDerWaalsContact CB-CZ 3.5Å; P557-Y563 HydrophobicContact CG-CD2 3.98Å; Y563-L565 PolarHBondContact O-N 2.82Å
564	C	92.9	Very high	88.3	Confident	6 Å²	6	59 Å²	59	4%	0.041	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-62.1	129.9	-175.8	-57.8	0	0	0	0	112	S215 G526 G527 W528 C552	S215-C564 VanDerWaalsContact CB-O 3.25Å; S215-C564 WeakPolarHBondContact CB-O 3.38Å; S215-C564 PolarHBondContact OG-O 3.28Å; S215-C564 VanDerWaalsContact OG-O 3.1Å; G526-C564 PolarHBondContact O-SG 3.3Å; G526-C564 VanDerWaalsContact O-SG 3.34Å; G527-C564 PolarHBondContact N-SG 2.8Å; G527-C564 VanDerWaalsContact N-SG 3.43Å; G527-C564 PolarHBondContact O-SG 3.47Å; W528-C564 HydrophobicContact CD2-CB 3.66Å; W528-C564 HydrophobicContact CE3-CB 4.13Å; W528-C564 HydrophobicContact CG-CB 4.1Å; W528-C564 HydrophobicContact CH2-CB 3.99Å; W528-C564 HydrophobicContact CZ2-CB 3.53Å; W528-C564 WeakPolarHBondContact CZ2-O 3.32Å; W528-C564 HydrophobicContact CZ3-CB 4.29Å; C552-C564 WeakPolarHBondContact CA-SG 3.45Å; C552-C564 HydrophobicContact CB-CB 3.63Å; C552-C564 WeakPolarHBondContact CB-SG 3.46Å; C552-C564 WeakPolarHBondContact SG-CB 3.35Å; C552-C564 PolarHBondContact SG-N 3.26Å; C552-C564 CovalentContact SG-SG 2.02Å; C552-C564 PolarHBondContact SG-SG 2.81Å
565	L	91.3	Very high	88.4	Confident	100 Å²	100	58.3 Å²	58.3	52%	0.524	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-100.4	147.7	171.7	-56.6	-178.1	0	0	0	110.3	S215 A217 W528 Y563	S215-L565 CarbonylContact O-C 3.44Å; S215-L565 VanDerWaalsContact O-CA 3.27Å; S215-L565 WeakPolarHBondContact O-CA 3.19Å; A217-L565 HydrophobicContact CB-CD2 4.5Å; W528-L565 PolarHBondContact NE1-O 3.08Å; Y563-L565 PolarHBondContact O-N 2.82Å
566	G	90.2	Very high	88.4	Confident	22 Å²	22	58 Å²	58	23%	0.227	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.8	-178.2	-179.6	0	0	0	0	0	114.1	V214 S215 R568	V214-G566 CarbonylContact C-O 3.6Å; V214-G566 WeakPolarHBondContact CA-O 3.22Å; S215-G566 PolarHBondContact N-O 3Å; S215-G566 PolarHBondContact O-N 2.99Å; G566-R568 PolarHBondContact O-N 3.13Å
567	R	90.1	Very high	88.6	Confident	128 Å²	128	57.6 Å²	57.6	48%	0.483	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	124.8	-176.7	-65	179.2	79.1	178	6.2	110.7	F213 V214 W531 R550	F213-R567 CarbonylContact O-C 3.48Å; F213-R567 VanDerWaalsContact O-CA 3.29Å; F213-R567 WeakPolarHBondContact O-CA 3.21Å; V214-R567 HydrophobicContact CG2-CG 3.9Å; W531-R567 HydrophobicContact CH2-CB 4.09Å; W531-R567 HydrophobicContact CZ2-CB 4.23Å; R550-R567 PolarHBondContact NE-O 3.13Å; R550-R567 PolarHBondContact NH2-O 3.47Å
568	R	90.4	Very high	88.7	Confident	21 Å²	21	63.2 Å²	63.2	8%	0.079	32%	0.317	C	S	.	.			trans	-104.3	-21.3	175.1	57.4	171.8	152.7	-149.8	-6.5	113.5	F213 K259 N260 D417 W528 H549 R550 G566	F213-R568 VanDerWaalsContact O-CG 3.26Å; F213-R568 WeakPolarHBondContact O-CG 3.45Å; F213-R568 PolarHBondContact O-N 3.26Å; K259-R568 PolarHBondContact O-NH1 3.14Å; N260-R568 PolarHBondContact OD1-NH1 2.9Å; N260-R568 PolarHBondContact OD1-NH2 2.76Å; D417-R568 IonicContact OD1-CZ 3.6Å; D417-R568 IonicContact OD1-NE 3.45Å; D417-R568 PolarHBondContact OD1-NE 2.79Å; D417-R568 IonicContact OD1-NH2 3.35Å; D417-R568 PolarHBondContact OD1-NH2 3.17Å; D417-R568 IonicContact OD2-NE 3.59Å; W528-R568 HydrophobicContact CH2-CB 3.57Å; W528-R568 HydrophobicContact CZ2-CB 4.25Å; W528-R568 HydrophobicContact CZ3-CB 4.04Å; H549-R568 WeakPolarHBondContact CA-O 3.39Å; R550-R568 PolarHBondContact N-O 2.83Å; G566-R568 PolarHBondContact O-N 3.13Å
569	A	90.9	Very high	89.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	143	172	0	0	0	0	0	109.8	F213 S548	F213-A569 HydrophobicContact CB-CB 3.95Å; F213-A569 WeakPolarHBondContact CB-O 3.4Å; F213-A569 HydrophobicContact CD1-CB 3.97Å; F213-A569 HydrophobicContact CG-CB 4.2Å; S548-A569 WeakPolarHBondContact O-CA 3.16Å
570	K	91.4	Very high	89.9	Confident	56 Å²	56	62.1 Å²	62.1	24%	0.243	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	152.6	163.6	64	-178.8	-178.5	-173.2	0	108.3	W531 W534 F547 S548	W531-K570 HydrophobicContact CD2-CD 3.79Å; W531-K570 HydrophobicContact CD2-CG 4.17Å; W531-K570 HydrophobicContact CE3-CD 3.98Å; W531-K570 HydrophobicContact CE3-CG 3.82Å; W531-K570 HydrophobicContact CG-CD 4.22Å; W531-K570 HydrophobicContact CH2-CB 4.09Å; W531-K570 HydrophobicContact CH2-CD 4.49Å; W531-K570 HydrophobicContact CH2-CG 4.17Å; W531-K570 HydrophobicContact CZ2-CB 4.49Å; W531-K570 HydrophobicContact CZ2-CD 4.32Å; W531-K570 HydrophobicContact CZ2-CG 4.48Å; W531-K570 HydrophobicContact CZ3-CB 4.15Å; W531-K570 HydrophobicContact CZ3-CD 4.33Å; W531-K570 HydrophobicContact CZ3-CG 3.83Å; W534-K570 HydrophobicContact CH2-CB 4.42Å; W534-K570 HydrophobicContact CH2-CD 3.96Å; W534-K570 HydrophobicContact CH2-CG 3.66Å; W534-K570 HydrophobicContact CZ2-CD 4.17Å; W534-K570 HydrophobicContact CZ2-CG 4.34Å; W534-K570 HydrophobicContact CZ3-CG 4.08Å; F547-K570 CarbonylContact C-O 3.6Å; F547-K570 WeakPolarHBondContact CA-O 3.3Å; S548-K570 PolarHBondContact N-O 3.14Å; S548-K570 PolarHBondContact O-N 2.63Å; S548-K570 WeakPolarHBondContact OG-CE 3.11Å
571	Y	92.9	Very high	90.4	Very high	43 Å²	43	65.1 Å²	65.1	17%	0.169	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.4	-178.1	61.2	-84.6	0	0	0	109.6	F213 V545 Q546 F547 V656 V661 V669	F213-Y571 AromaticContact CD2-CD1 3.88Å; F213-Y571 HydrophobicContact CD2-CD1 3.88Å; F213-Y571 AromaticContact CD2-CE1 3.59Å; F213-Y571 HydrophobicContact CD2-CE1 3.59Å; F213-Y571 AromaticContact CE2-CD1 3.58Å; F213-Y571 HydrophobicContact CE2-CD1 3.58Å; F213-Y571 AromaticContact CE2-CE1 3.24Å; F213-Y571 HydrophobicContact CE2-CE1 3.24Å; F213-Y571 HydrophobicContact CZ-CD1 4.16Å; F213-Y571 HydrophobicContact CZ-CE1 4.17Å; V545-Y571 HydrophobicContact CG1-CD2 4.1Å; V545-Y571 HydrophobicContact CG1-CG 4.36Å; Q546-Y571 VanDerWaalsContact O-CA 3.24Å; Q546-Y571 WeakPolarHBondContact O-CA 3.44Å; F547-Y571 HydrophobicContact CE1-CD1 4.42Å; F547-Y571 HydrophobicContact CE1-CG 4.23Å; Y571-V656 HydrophobicContact CD2-CG1 3.9Å; Y571-V656 HydrophobicContact CE2-CG1 4.07Å; Y571-V656 HydrophobicContact CE2-CG2 4.42Å; Y571-V656 HydrophobicContact CG-CG1 4.15Å; Y571-V661 HydrophobicContact CE2-CG1 4.44Å; Y571-V669 HydrophobicContact CD2-CG1 4.22Å; Y571-V669 HydrophobicContact CD2-CG2 4.38Å; Y571-V669 HydrophobicContact CE2-CG1 3.55Å; Y571-V669 HydrophobicContact CE2-CG2 4.28Å
572	Q	93.5	Very high	90.6	Very high	72 Å²	72	68.8 Å²	68.8	34%	0.336	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	158.8	175.7	67.7	-177.7	3.9	0	0	110.4	W534 V545 Q546	W534-Q572 HydrophobicContact CD2-CG 4.21Å; W534-Q572 VanDerWaalsContact CE2-CD 3.41Å; W534-Q572 HydrophobicContact CE3-CG 3.97Å; W534-Q572 HydrophobicContact CH2-CB 3.91Å; W534-Q572 HydrophobicContact CH2-CG 3.61Å; W534-Q572 HydrophobicContact CZ2-CB 4.41Å; W534-Q572 HydrophobicContact CZ2-CG 3.88Å; W534-Q572 VanDerWaalsContact CZ2-OE1 3.29Å; W534-Q572 HydrophobicContact CZ3-CB 4.24Å; W534-Q572 HydrophobicContact CZ3-CG 3.68Å; V545-Q572 WeakPolarHBondContact CA-O 3.45Å; Q546-Q572 HydrophobicContact CG-CG 3.64Å; Q546-Q572 PolarHBondContact N-O 3.12Å; Q546-Q572 PolarHBondContact O-N 3.45Å; Q546-Q572 VanDerWaalsContact O-N 3.08Å
573	S	95.9	Very high	90.4	Very high	23 Å²	23	61.4 Å²	61.4	16%	0.161	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	152.5	172.3	-71.1	0	0	0	0	111.8	G544 H667 V668 V669	G544-S573 WeakPolarHBondContact O-CA 3.46Å; S573-H667 PolarHBondContact OG-O 2.98Å; S573-V668 WeakPolarHBondContact OG-CA 3.39Å; S573-V669 WeakPolarHBondContact OG-CG2 3.45Å; S573-V669 PolarHBondContact OG-N 3.21Å
574	C	96.6	Very high	90.3	Very high	13 Å²	13	63.4 Å²	63.4	9%	0.088	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158.2	174.6	43.8	0	0	0	0	109.7	C537 G544 V545 Q546 T576	C537-C574 VanDerWaalsContact CA-SG 3.55Å; C537-C574 HydrophobicContact CB-CB 3.8Å; C537-C574 WeakPolarHBondContact CB-SG 3.09Å; C537-C574 WeakPolarHBondContact SG-CB 3.47Å; C537-C574 CovalentContact SG-SG 2Å; C537-C574 PolarHBondContact SG-SG 3.42Å; G544-C574 PolarHBondContact N-O 2.81Å; G544-C574 PolarHBondContact O-N 3.41Å; V545-C574 VanDerWaalsContact C-SG 3.51Å; Q546-C574 HydrophobicContact CG-CB 4.17Å; Q546-C574 PolarHBondContact N-SG 2.9Å; C574-T576 PolarHBondContact O-N 2.96Å
575	H	96.3	Very high	90.1	Very high	88 Å²	88	64.3 Å²	64.3	41%	0.407	35%	0.347	S	S	.	.			trans	47.1	56.4	-179.1	-56.8	116.6	0	0	0	113.1	C537 R539 C541 G542 G543 E577	C537-H575 VanDerWaalsContact CB-ND1 3.29Å; C537-H575 WeakPolarHBondContact CB-ND1 3.46Å; C537-H575 PolarHBondContact SG-ND1 2.98Å; R539-H575 PolarHBondContact O-ND1 2.85Å; C541-H575 CarbonylContact C-O 3.56Å; C541-H575 VanDerWaalsContact C-O 3.29Å; C541-H575 WeakPolarHBondContact CA-O 3.34Å; G542-H575 PolarHBondContact N-O 3.46Å; G542-H575 VanDerWaalsContact N-O 3.16Å; G543-H575 PolarHBondContact N-O 3.12Å; H575-E577 VanDerWaalsContact C-N 3.29Å; H575-E577 WeakPolarHBondContact CA-OE1 3.41Å; H575-E577 VanDerWaalsContact CA-OE2 3.22Å; H575-E577 WeakPolarHBondContact CA-OE2 3.16Å; H575-E577 VanDerWaalsContact CB-OE1 3.29Å; H575-E577 WeakPolarHBondContact CB-OE1 3.16Å; H575-E577 IonicContact CD2-OE1 2.74Å; H575-E577 IonicContact CG-OE1 3.79Å; H575-E577 PolarHBondContact O-N 2.95Å
576	T	95.1	Very high	90.1	Very high	58 Å²	58	61.9 Å²	61.9	36%	0.356	33%	0.332	S	S	.	.			trans	-79.5	-8.7	-173.2	52.3	0	0	0	0	113.8	C574 H667 V668	C574-T576 PolarHBondContact O-N 2.96Å; T576-H667 HydrophobicContact CG2-CB 4.32Å; T576-H667 PolarHBondContact O-CD2 2.74Å; T576-H667 VanDerWaalsContact O-CD2 3.28Å; T576-V668 HydrophobicContact CG2-CG2 4.02Å
577	E	94.1	Very high	90.3	Very high	100 Å²	100	61.3 Å²	61.3	47%	0.467	32%	0.323	S	S	.	.	S	Bend	trans	-59.7	141	172.7	63.3	-74.4	173.3	0	0	111.8	G542 H575	G542-E577 VanDerWaalsContact CA-O 3.3Å; G542-E577 WeakPolarHBondContact CA-O 3.48Å; G542-E577 PolarHBondContact N-O 3.2Å; H575-E577 VanDerWaalsContact C-N 3.29Å; H575-E577 WeakPolarHBondContact CA-OE1 3.41Å; H575-E577 VanDerWaalsContact CA-OE2 3.22Å; H575-E577 WeakPolarHBondContact CA-OE2 3.16Å; H575-E577 VanDerWaalsContact CB-OE1 3.29Å; H575-E577 WeakPolarHBondContact CB-OE1 3.16Å; H575-E577 IonicContact CD2-OE1 2.74Å; H575-E577 IonicContact CG-OE1 3.79Å; H575-E577 PolarHBondContact O-N 2.95Å
578	E	90.6	Very high	90.4	Very high	125 Å²	125	55.9 Å²	55.9	58%	0.584	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-60.8	142.3	179.9	-73.9	-68.2	174.5	0	0	112.1	H667	E578-H667 IonicContact OE1-CD2 3.13Å; E578-H667 IonicContact OE1-CE1 2.98Å; E578-H667 IonicContact OE1-NE2 2.84Å; E578-H667 PolarHBondContact OE1-NE2 2.85Å; E578-H667 IonicContact OE2-NE2 2.94Å; E578-H667 PolarHBondContact OE2-NE2 3.47Å
579	C	89.8	Confident	90.5	Very high	47 Å²	47	58.5 Å²	58.5	32%	0.318	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-70.1	151	175.3	-69.8	0	0	0	0	111.5	C541 G542	C541-C579 HydrophobicContact CB-CB 4Å; C541-C579 WeakPolarHBondContact CB-SG 3.46Å; C541-C579 PolarHBondContact O-SG 2.69Å; C541-C579 WeakPolarHBondContact SG-CA 3.41Å; C541-C579 WeakPolarHBondContact SG-CB 3.49Å; C541-C579 CovalentContact SG-SG 2.04Å; C541-C579 PolarHBondContact SG-SG 2.77Å; G542-C579 PolarHBondContact N-SG 2.86Å
580	P	89.9	Confident	90.6	Very high	103 Å²	103	59.3 Å²	59.3	67%	0.669	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-54.3	142.1	169	-23.9	33.8	0	0	0	111.3	D582	P580-D582 PolarHBondContact O-N 2.97Å
581	P	80.4	Confident	90.7	Very high	135 Å²	135	56.7 Å²	56.7	88%	0.877	31%	0.309	S	S	*	.			trans	-69.3	101.4	-179.3	27.1	-33.2	0	0	0	110.7
582	D	78.3	Confident	90.6	Very high	84 Å²	84	58 Å²	58	45%	0.449	32%	0.316	S	S	.	.			trans	-96.4	-4	173.6	82.3	-22.4	0	0	0	113	P580 K584 Q589	P580-D582 PolarHBondContact O-N 2.97Å; D582-K584 VanDerWaalsContact C-N 3.29Å; D582-K584 PolarHBondContact O-N 2.97Å; D582-K584 WeakPolarHBondContact OD1-CA 3.49Å; D582-K584 PolarHBondContact OD1-N 2.88Å; D582-Q589 PolarHBondContact OD2-NE2 2.91Å
583	G	78.4	Confident	90.5	Very high	35 Å²	35	62.1 Å²	62.1	36%	0.361	33%	0.334	S	S	.	.	S	Bend	trans	73.3	13.8	-177.2	0	0	0	0	0	114.8	K759 G760	G583-K759 CarbonylContact O-C 3.57Å; G583-K759 WeakPolarHBondContact O-CA 3.13Å; G583-G760 PolarHBondContact O-N 3.01Å
584	K	86.6	Confident	90.2	Very high	72 Å²	72	62.8 Å²	62.8	31%	0.313	33%	0.333	S	S	.	.	S	Bend	trans	-131.5	153.9	178.6	-63.8	177.8	177.5	173.5	0	110.8	D582 E588 Q589 E592	D582-K584 VanDerWaalsContact C-N 3.29Å; D582-K584 PolarHBondContact O-N 2.97Å; D582-K584 WeakPolarHBondContact OD1-CA 3.49Å; D582-K584 PolarHBondContact OD1-N 2.88Å; K584-E588 WeakPolarHBondContact CA-OE2 3.46Å; K584-E588 HydrophobicContact CB-CB 4.49Å; K584-E588 HydrophobicContact CB-CG 4.38Å; K584-Q589 HydrophobicContact CB-CG 4.36Å; K584-E592 IonicContact NZ-OE1 3.95Å; K584-E592 PolarHBondContact NZ-OE1 3.2Å; K584-E592 IonicContact NZ-OE2 3.28Å; K584-E592 PolarHBondContact NZ-OE2 3.46Å
585	S	89.1	Confident	89.7	Confident	25 Å²	25	64.3 Å²	64.3	18%	0.175	34%	0.34	C	S	.	.			trans	-83.4	153.8	170.7	70.4	0	0	0	0	110.9	R587 E588 Q589	S585-R587 PolarHBondContact O-N 3.04Å; S585-R587 VanDerWaalsContact O-N 3.15Å; S585-E588 PolarHBondContact N-OE2 2.95Å; S585-E588 WeakPolarHBondContact O-CA 3.46Å; S585-E588 VanDerWaalsContact O-CB 3.29Å; S585-E588 WeakPolarHBondContact O-CB 3.4Å; S585-E588 PolarHBondContact O-N 3.11Å; S585-E588 VanDerWaalsContact OG-CB 3.29Å; S585-E588 WeakPolarHBondContact OG-CB 3.24Å; S585-E588 PolarHBondContact OG-N 3.13Å; S585-Q589 PolarHBondContact O-N 3.47Å
586	F	92.1	Very high	88.8	Confident	49 Å²	49	62 Å²	62	22%	0.215	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-30	176.7	-173.4	-122.4	0	0	0	113.2	R539 Q590 I642 T645	R539-F586 HydrophobicContact CG-CD1 4.49Å; R539-F586 HydrophobicContact CG-CE1 3.78Å; R539-F586 HydrophobicContact CG-CZ 3.83Å; F586-Q590 WeakPolarHBondContact O-CG 3.44Å; F586-Q590 PolarHBondContact O-N 3.35Å; F586-Q590 PolarHBondContact O-NE2 3.03Å; F586-Q590 VanDerWaalsContact O-NE2 3.14Å; F586-I642 HydrophobicContact CE1-CB 3.84Å; F586-I642 HydrophobicContact CE1-CG2 3.89Å; F586-I642 HydrophobicContact CZ-CB 4.06Å; F586-I642 HydrophobicContact CZ-CD1 3.98Å; F586-I642 HydrophobicContact CZ-CG2 3.91Å; F586-T645 HydrophobicContact CD1-CG2 4.42Å; F586-T645 VanDerWaalsContact CD1-OG1 3.27Å; F586-T645 WeakPolarHBondContact CD1-OG1 3.43Å; F586-T645 WeakPolarHBondContact CE1-OG1 3.3Å
587	R	93.4	Very high	87	Confident	10 Å²	10	67.9 Å²	67.9	4%	0.038	35%	0.353	C	S	.	.	H	α-helix	trans	-73.3	-32.1	173.8	-174.1	165.4	-99.5	173.8	-5.2	112.6	S585 Q590 C591 P611 Y613 R621 L624 V641 T645 L646 C647	S585-R587 PolarHBondContact O-N 3.04Å; S585-R587 VanDerWaalsContact O-N 3.15Å; R587-Q590 PolarHBondContact O-N 3Å; R587-C591 PolarHBondContact O-N 3.18Å; R587-C591 VanDerWaalsContact O-N 3.14Å; R587-P611 HydrophobicContact CB-CG 4.25Å; R587-P611 HydrophobicContact CG-CB 4.02Å; R587-P611 HydrophobicContact CG-CG 3.94Å; R587-Y613 WeakPolarHBondContact CD-OH 3.48Å; R587-R621 VanDerWaalsContact CZ-O 3.26Å; R587-R621 PolarHBondContact NH1-O 3.34Å; R587-R621 VanDerWaalsContact NH1-O 3.08Å; R587-R621 PolarHBondContact NH2-O 3.13Å; R587-L624 HydrophobicContact CG-CD1 4.24Å; R587-V641 VanDerWaalsContact NH2-CG1 3.35Å; R587-T645 HydrophobicContact CB-CG2 3.74Å; R587-T645 HydrophobicContact CG-CG2 4.27Å; R587-L646 PolarHBondContact NH1-O 3.17Å; R587-L646 VanDerWaalsContact NH1-O 3.12Å; R587-C647 PolarHBondContact NH1-O 3.06Å; R587-C647 VanDerWaalsContact NH1-O 3.09Å
588	E	92.1	Very high	85.7	Confident	15 Å²	15	68.2 Å²	68.2	7%	0.07	36%	0.358	C	S	.	.	H	α-helix	trans	-67.1	-43.1	174.5	-178	179.3	178.8	0	0	111.3	K584 S585 Q590 C591 E592 P611 L757	K584-E588 WeakPolarHBondContact CA-OE2 3.46Å; K584-E588 HydrophobicContact CB-CB 4.49Å; K584-E588 HydrophobicContact CB-CG 4.38Å; S585-E588 PolarHBondContact N-OE2 2.95Å; S585-E588 WeakPolarHBondContact O-CA 3.46Å; S585-E588 VanDerWaalsContact O-CB 3.29Å; S585-E588 WeakPolarHBondContact O-CB 3.4Å; S585-E588 PolarHBondContact O-N 3.11Å; S585-E588 VanDerWaalsContact OG-CB 3.29Å; S585-E588 WeakPolarHBondContact OG-CB 3.24Å; S585-E588 PolarHBondContact OG-N 3.13Å; E588-Q590 PolarHBondContact O-N 3.39Å; E588-C591 PolarHBondContact O-N 3.49Å; E588-C591 VanDerWaalsContact O-N 3.11Å; E588-E592 WeakPolarHBondContact O-CB 3.32Å; E588-E592 PolarHBondContact O-N 2.78Å; E588-P611 HydrophobicContact CB-CG 3.93Å; E588-L757 WeakPolarHBondContact OE1-CD2 3.27Å
589	Q	92.5	Very high	84.7	Confident	75 Å²	75	65.4 Å²	65.4	35%	0.35	34%	0.343	S	S	.	.	H	α-helix	trans	-56.5	-39.3	172.4	-63.5	170.1	12	0	0	111.8	D582 K584 S585 E592 K593	D582-Q589 PolarHBondContact OD2-NE2 2.91Å; K584-Q589 HydrophobicContact CB-CG 4.36Å; S585-Q589 PolarHBondContact O-N 3.47Å; Q589-E592 PolarHBondContact O-N 2.75Å; Q589-K593 PolarHBondContact O-N 3.08Å
590	Q	94.5	Very high	84	Confident	18 Å²	18	66.3 Å²	66.3	8%	0.084	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-39.9	176	-73.6	171.1	74	0	0	113	F586 R587 E588 K593 Y594 L624 I642 T645	F586-Q590 WeakPolarHBondContact O-CG 3.44Å; F586-Q590 PolarHBondContact O-N 3.35Å; F586-Q590 PolarHBondContact O-NE2 3.03Å; F586-Q590 VanDerWaalsContact O-NE2 3.14Å; R587-Q590 PolarHBondContact O-N 3Å; E588-Q590 PolarHBondContact O-N 3.39Å; Q590-K593 WeakPolarHBondContact O-CB 3.28Å; Q590-Y594 WeakPolarHBondContact O-CD2 3.47Å; Q590-Y594 WeakPolarHBondContact O-CE2 3.28Å; Q590-L624 HydrophobicContact CB-CD1 3.83Å; Q590-L624 HydrophobicContact CB-CD2 4.09Å; Q590-I642 HydrophobicContact CG-CD1 4.06Å; Q590-I642 HydrophobicContact CG-CG1 4.48Å; Q590-T645 PolarHBondContact NE2-OG1 3.15Å
591	C	92.7	Very high	83.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.3	-40	173.5	-73.5	0	0	0	0	111.8	R587 E588 K593 Y594 W609 C626	R587-C591 PolarHBondContact O-N 3.18Å; R587-C591 VanDerWaalsContact O-N 3.14Å; E588-C591 PolarHBondContact O-N 3.49Å; E588-C591 VanDerWaalsContact O-N 3.11Å; C591-K593 PolarHBondContact O-N 3.09Å; C591-Y594 PolarHBondContact O-N 3.18Å; C591-W609 HydrophobicContact CB-CB 4.16Å; C591-C626 VanDerWaalsContact CA-SG 3.5Å; C591-C626 HydrophobicContact CB-CB 3.91Å; C591-C626 WeakPolarHBondContact CB-SG 3.38Å; C591-C626 WeakPolarHBondContact SG-CB 3.48Å; C591-C626 CovalentContact SG-SG 2.04Å; C591-C626 PolarHBondContact SG-SG 2.99Å
592	E	91.9	Very high	82.6	Confident	70 Å²	70	65 Å²	65	33%	0.327	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-26.2	-178.4	178.6	167.7	-135.9	0	0	113.1	K584 E588 Q589 Y594 N595	K584-E592 IonicContact NZ-OE1 3.95Å; K584-E592 PolarHBondContact NZ-OE1 3.2Å; K584-E592 IonicContact NZ-OE2 3.28Å; K584-E592 PolarHBondContact NZ-OE2 3.46Å; E588-E592 WeakPolarHBondContact O-CB 3.32Å; E588-E592 PolarHBondContact O-N 2.78Å; Q589-E592 PolarHBondContact O-N 2.75Å; E592-Y594 PolarHBondContact O-N 3.48Å; E592-N595 VanDerWaalsContact O-CB 3.3Å; E592-N595 WeakPolarHBondContact O-CB 3.5Å; E592-N595 PolarHBondContact O-N 3.13Å
593	K	90.6	Very high	82.4	Confident	160 Å²	160	67 Å²	67	70%	0.696	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-25.4	170.5	-173.6	-179.3	174.8	-172.5	0	113.2	Q589 Q590 C591	Q589-K593 PolarHBondContact O-N 3.08Å; Q590-K593 WeakPolarHBondContact O-CB 3.28Å; C591-K593 PolarHBondContact O-N 3.09Å
594	Y	88.7	Confident	82.1	Confident	36 Å²	36	67.6 Å²	67.6	14%	0.141	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	8.5	-179.7	-56	-86.9	0	0	0	113.8	Q590 C591 E592 A596 Y599 L624 F637 E638	Q590-Y594 WeakPolarHBondContact O-CD2 3.47Å; Q590-Y594 WeakPolarHBondContact O-CE2 3.28Å; C591-Y594 PolarHBondContact O-N 3.18Å; E592-Y594 PolarHBondContact O-N 3.48Å; Y594-A596 PolarHBondContact O-N 3.16Å; Y594-Y599 WeakPolarHBondContact O-CD2 3.38Å; Y594-L624 HydrophobicContact CD2-CD2 4.45Å; Y594-L624 HydrophobicContact CE2-CD2 3.75Å; Y594-F637 HydrophobicContact CD1-CB 4.25Å; Y594-F637 AromaticContact CD1-CD1 3.38Å; Y594-F637 HydrophobicContact CD1-CD1 3.38Å; Y594-F637 AromaticContact CD1-CE1 3.77Å; Y594-F637 HydrophobicContact CD1-CE1 3.77Å; Y594-F637 AromaticContact CD1-CG 3.85Å; Y594-F637 HydrophobicContact CD1-CG 3.85Å; Y594-F637 HydrophobicContact CD2-CB 3.91Å; Y594-F637 HydrophobicContact CD2-CD1 4.11Å; Y594-F637 AromaticContact CD2-CD2 3.91Å; Y594-F637 HydrophobicContact CD2-CD2 3.91Å; Y594-F637 HydrophobicContact CD2-CE2 4.43Å; Y594-F637 AromaticContact CD2-CG 3.72Å; Y594-F637 HydrophobicContact CD2-CG 3.72Å; Y594-F637 HydrophobicContact CE1-CB 4.02Å; Y594-F637 AromaticContact CE1-CD1 3.84Å; Y594-F637 HydrophobicContact CE1-CD1 3.84Å; Y594-F637 HydrophobicContact CE1-CG 4.13Å; Y594-F637 HydrophobicContact CE2-CB 3.7Å; Y594-F637 HydrophobicContact CE2-CG 4.04Å; Y594-F637 HydrophobicContact CG-CB 4.2Å; Y594-F637 AromaticContact CG-CD1 3.54Å; Y594-F637 HydrophobicContact CG-CD1 3.54Å; Y594-F637 AromaticContact CG-CD2 3.97Å; Y594-F637 HydrophobicContact CG-CD2 3.97Å; Y594-F637 AromaticContact CG-CE1 3.77Å; Y594-F637 HydrophobicContact CG-CE1 3.77Å; Y594-F637 HydrophobicContact CG-CE2 4.18Å; Y594-F637 AromaticContact CG-CG 3.64Å; Y594-F637 HydrophobicContact CG-CG 3.64Å; Y594-F637 HydrophobicContact CG-CZ 4.09Å; Y594-E638 VanDerWaalsContact OH-CD 3.3Å; Y594-E638 WeakPolarHBondContact OH-CG 3.31Å; Y594-E638 PolarHBondContact OH-OE1 2.99Å
595	N	86.8	Confident	81.7	Confident	46 Å²	46	68.7 Å²	68.7	25%	0.246	35%	0.349	C	S	.	.			trans	-74.4	62.7	169.9	-64.8	-6.3	0	0	0	110.2	E592 L607 W609	E592-N595 VanDerWaalsContact O-CB 3.3Å; E592-N595 WeakPolarHBondContact O-CB 3.5Å; E592-N595 PolarHBondContact O-N 3.13Å; N595-L607 PolarHBondContact OD1-O 3.39Å; N595-W609 WeakPolarHBondContact OD1-CB 3.4Å; N595-W609 VanDerWaalsContact OD1-CD1 3.28Å; N595-W609 PolarHBondContact OD1-N 2.72Å
596	A	76.8	Confident	81.3	Confident	39 Å²	39	72.5 Å²	72.5	32%	0.322	37%	0.367	S	S	.	.	S	Bend	trans	-117.5	162.2	-175.8	0	0	0	0	0	111.7	Y594 N598 Y599	Y594-A596 PolarHBondContact O-N 3.16Å; A596-N598 PolarHBondContact O-N 3.03Å; A596-Y599 PolarHBondContact O-N 3.27Å
597	Y	57.9	Low	80.9	Confident	181 Å²	181	71 Å²	71	71%	0.71	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-18.4	-174.6	75.7	-85.9	0	0	0	115.8	Y599	Y597-Y599 PolarHBondContact O-N 2.9Å
598	N	67	Low	80.7	Confident	107 Å²	107	74 Å²	74	57%	0.572	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.3	175.7	-71.8	-25.3	0	0	0	113.8	A596	A596-N598 PolarHBondContact O-N 3.03Å
599	Y	69.6	Low	80.7	Confident	67 Å²	67	74 Å²	74	26%	0.263	38%	0.375	S	S	.	.	S	Bend	trans	-129.1	82.8	-178.7	-58.5	-67.3	0	0	0	110	Y594 A596 Y597 L607 W609 K635 F637	Y594-Y599 WeakPolarHBondContact O-CD2 3.38Å; A596-Y599 PolarHBondContact O-N 3.27Å; Y597-Y599 PolarHBondContact O-N 2.9Å; Y599-L607 WeakPolarHBondContact O-CB 3.33Å; Y599-L607 PolarHBondContact O-N 3.36Å; Y599-W609 HydrophobicContact CD1-CZ2 4.29Å; Y599-W609 HydrophobicContact CG-CZ2 4.31Å; Y599-W609 AromaticContact CG-NE1 3.95Å; Y599-K635 HydrophobicContact CE1-CD 4.45Å; Y599-K635 PolarHBondContact OH-NZ 3.05Å; Y599-F637 HydrophobicContact CE1-CE1 4.39Å; Y599-F637 AromaticContact CE2-CE1 3.87Å; Y599-F637 HydrophobicContact CE2-CE1 3.87Å; Y599-F637 HydrophobicContact CE2-CZ 4.4Å; Y599-F637 AromaticContact CZ-CE1 3.78Å
600	T	74.1	Confident	80.6	Confident	66 Å²	66	70.6 Å²	70.6	41%	0.405	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-106.5	153.8	175.2	56.7	0	0	0	0	111.3	G604 N605 L606	T600-G604 WeakPolarHBondContact CG2-O 3.48Å; T600-N605 CarbonylContact C-O 3.48Å; T600-N605 WeakPolarHBondContact CA-O 3.39Å; T600-N605 WeakPolarHBondContact CB-O 3.07Å; T600-L606 HydrophobicContact CG2-CD2 4.32Å
601	D	70.8	Confident	80.6	Confident	26 Å²	26	70 Å²	70	14%	0.139	36%	0.357	C	S	.	.			trans	-72.8	179.5	165.9	65	17.6	0	0	0	112.1	D603 G604 N605 L607 R631	D601-D603 PolarHBondContact O-N 3.36Å; D601-D603 VanDerWaalsContact O-N 3.13Å; D601-D603 WeakPolarHBondContact OD1-CA 3.37Å; D601-D603 WeakPolarHBondContact OD1-CB 3.48Å; D601-D603 PolarHBondContact OD1-N 3.05Å; D601-G604 PolarHBondContact O-N 3.22Å; D601-G604 PolarHBondContact OD1-N 3.07Å; D601-G604 VanDerWaalsContact OD1-N 3.08Å; D601-N605 PolarHBondContact N-O 3.39Å; D601-N605 WeakPolarHBondContact OD1-CB 3.25Å; D601-N605 PolarHBondContact OD1-N 2.98Å; D601-L607 HydrophobicContact CB-CD2 3.81Å; D601-R631 IonicContact OD2-CZ 2.64Å; D601-R631 IonicContact OD2-NH2 2.7Å; D601-R631 PolarHBondContact OD2-NH2 3.21Å
602	M	69.8	Low	80.5	Confident	185 Å²	185	72.4 Å²	72.4	91%	0.911	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.2	177.5	-65.8	-63.3	-139.5	0	0	113.5
603	D	75	Confident	80.4	Confident	126 Å²	126	69.9 Å²	69.9	67%	0.674	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	3.3	179.9	-56.1	-56.3	0	0	0	112	D601 N605	D601-D603 PolarHBondContact O-N 3.36Å; D601-D603 VanDerWaalsContact O-N 3.13Å; D601-D603 WeakPolarHBondContact OD1-CA 3.37Å; D601-D603 WeakPolarHBondContact OD1-CB 3.48Å; D601-D603 PolarHBondContact OD1-N 3.05Å; D603-N605 VanDerWaalsContact C-N 3.34Å
604	G	72.4	Confident	80.2	Confident	47 Å²	47	62.8 Å²	62.8	49%	0.485	33%	0.326	S	S	.	.	S	Bend	trans	80.7	7.4	-179.6	0	0	0	0	0	114.7	T600 D601	T600-G604 WeakPolarHBondContact CG2-O 3.48Å; D601-G604 PolarHBondContact O-N 3.22Å; D601-G604 PolarHBondContact OD1-N 3.07Å; D601-G604 VanDerWaalsContact OD1-N 3.08Å
605	N	78.9	Confident	80	Confident	94 Å²	94	64.8 Å²	64.8	50%	0.503	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-82	143.4	177.3	-56.8	-62.2	0	0	0	110.9	T600 D601 D603 L607	T600-N605 CarbonylContact C-O 3.48Å; T600-N605 WeakPolarHBondContact CA-O 3.39Å; T600-N605 WeakPolarHBondContact CB-O 3.07Å; D601-N605 PolarHBondContact N-O 3.39Å; D601-N605 WeakPolarHBondContact OD1-CB 3.25Å; D601-N605 PolarHBondContact OD1-N 2.98Å; D603-N605 VanDerWaalsContact C-N 3.34Å; N605-L607 PolarHBondContact O-N 3.09Å
606	L	80.8	Confident	80	Confident	106 Å²	106	63.7 Å²	63.7	56%	0.555	35%	0.353	S	S	*	.	B	Isolated β-bridge	trans	-60.9	130.2	177.2	-65.3	173.6	0	0	0	111.5	T600	T600-L606 HydrophobicContact CG2-CD2 4.32Å
607	L	83.4	Confident	80.5	Confident	16 Å²	16	64.1 Å²	64.1	8%	0.084	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-71.4	130.2	172.6	-65.7	177	0	0	0	110.2	N595 Y599 D601 N605 W609 A628 E633	N595-L607 PolarHBondContact OD1-O 3.39Å; Y599-L607 WeakPolarHBondContact O-CB 3.33Å; Y599-L607 PolarHBondContact O-N 3.36Å; D601-L607 HydrophobicContact CB-CD2 3.81Å; N605-L607 PolarHBondContact O-N 3.09Å; L607-W609 HydrophobicContact CB-CZ2 4.45Å; L607-W609 HydrophobicContact CD1-CH2 4.47Å; L607-W609 HydrophobicContact CD1-CZ2 3.88Å; L607-A628 HydrophobicContact CD2-CB 4.2Å; L607-E633 WeakPolarHBondContact CD1-OE1 3.29Å; L607-E633 VanDerWaalsContact CD2-OE1 3.24Å; L607-E633 WeakPolarHBondContact CD2-OE1 3.46Å
608	Q	88.7	Confident	81.7	Confident	75 Å²	75	60.8 Å²	60.8	35%	0.35	35%	0.354	S	S	.	.			trans	-89.5	104.9	171	-172.2	176.5	24.9	0	0	109.7	R629	Q608-R629 HydrophobicContact CB-CB 4.18Å; Q608-R629 HydrophobicContact CG-CB 4.48Å; Q608-R629 WeakPolarHBondContact O-CB 3.47Å; Q608-R629 PolarHBondContact O-N 2.75Å
609	W	90.9	Very high	82.4	Confident	14 Å²	14	66.8 Å²	66.8	5%	0.053	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	128.5	178.3	-64.9	101.6	0	0	0	111.6	C591 N595 Y599 L607 C626 K635 F637	C591-W609 HydrophobicContact CB-CB 4.16Å; N595-W609 WeakPolarHBondContact OD1-CB 3.4Å; N595-W609 VanDerWaalsContact OD1-CD1 3.28Å; N595-W609 PolarHBondContact OD1-N 2.72Å; Y599-W609 HydrophobicContact CD1-CZ2 4.29Å; Y599-W609 HydrophobicContact CG-CZ2 4.31Å; Y599-W609 AromaticContact CG-NE1 3.95Å; L607-W609 HydrophobicContact CB-CZ2 4.45Å; L607-W609 HydrophobicContact CD1-CH2 4.47Å; L607-W609 HydrophobicContact CD1-CZ2 3.88Å; W609-C626 HydrophobicContact CB-CB 4.15Å; W609-C626 HydrophobicContact CE3-CB 3.95Å; W609-K635 HydrophobicContact CH2-CB 4.17Å; W609-K635 HydrophobicContact CZ3-CB 4.19Å; W609-F637 HydrophobicContact CB-CE2 4.47Å; W609-F637 AromaticContact CD2-CE2 3.57Å; W609-F637 HydrophobicContact CD2-CE2 3.57Å; W609-F637 AromaticContact CD2-CZ 3.77Å; W609-F637 HydrophobicContact CD2-CZ 3.77Å; W609-F637 AromaticContact CE2-CE2 3.9Å; W609-F637 AromaticContact CE2-CZ 3.56Å; W609-F637 AromaticContact CE3-CE2 3.77Å; W609-F637 HydrophobicContact CE3-CE2 3.77Å; W609-F637 HydrophobicContact CE3-CZ 4.23Å; W609-F637 AromaticContact CG-CE2 3.87Å; W609-F637 HydrophobicContact CG-CE2 3.87Å; W609-F637 HydrophobicContact CG-CZ 4.17Å; W609-F637 HydrophobicContact CH2-CZ 4.32Å; W609-F637 HydrophobicContact CZ2-CE2 4.39Å; W609-F637 AromaticContact CZ2-CZ 3.87Å; W609-F637 HydrophobicContact CZ2-CZ 3.87Å; W609-F637 HydrophobicContact CZ3-CE2 4.27Å; W609-F637 HydrophobicContact CZ3-CZ 4.48Å; W609-F637 AromaticContact NE1-CZ 3.82Å
610	V	91.8	Very high	83.2	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.024	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	155.9	176.3	-63.5	0	0	0	0	110.7	C626 R627 R629 L757	V610-C626 CarbonylContact O-C 3.44Å; V610-C626 VanDerWaalsContact O-CA 3.27Å; V610-C626 WeakPolarHBondContact O-CA 3.19Å; V610-R627 HydrophobicContact CG2-CG 3.74Å; V610-R627 WeakPolarHBondContact CG2-O 3.41Å; V610-R627 PolarHBondContact N-O 3.26Å; V610-R627 PolarHBondContact O-N 3.31Å; V610-R629 HydrophobicContact CG1-CB 4.25Å; V610-R629 HydrophobicContact CG1-CG 4.49Å; V610-R629 HydrophobicContact CG2-CB 4.45Å; V610-L757 HydrophobicContact CB-CD2 4.3Å; V610-L757 HydrophobicContact CG1-CD2 3.98Å
611	P	93.4	Very high	84	Confident	5 Å²	5	64.9 Å²	64.9	3%	0.032	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	141	179.7	-26.5	37	0	0	0	112.8	R587 E588 Y613	R587-P611 HydrophobicContact CB-CG 4.25Å; R587-P611 HydrophobicContact CG-CB 4.02Å; R587-P611 HydrophobicContact CG-CG 3.94Å; E588-P611 HydrophobicContact CB-CG 3.93Å; P611-Y613 HydrophobicContact CB-CD2 4.31Å; P611-Y613 HydrophobicContact CB-CE2 3.54Å
612	K	91.6	Very high	85.1	Confident	50 Å²	50	63.7 Å²	63.7	22%	0.217	35%	0.35	C	S	.	.			trans	-114.5	121.5	172.9	175.8	177	171.3	57.9	0	109.7	A614 V616 F625 R627 F634	K612-A614 WeakPolarHBondContact CE-O 3.44Å; K612-A614 PolarHBondContact NZ-O 2.98Å; K612-V616 HydrophobicContact CG-CG2 4.32Å; K612-F625 HydrophobicContact CB-CB 4.18Å; K612-F625 PolarHBondContact N-O 3.46Å; K612-R627 HydrophobicContact CB-CB 4.16Å; K612-R627 HydrophobicContact CB-CG 4.14Å; K612-R627 HydrophobicContact CD-CB 4.31Å; K612-F634 HydrophobicContact CD-CB 3.68Å; K612-F634 HydrophobicContact CD-CD1 4.46Å; K612-F634 HydrophobicContact CD-CD2 4.15Å; K612-F634 HydrophobicContact CD-CG 3.85Å
613	Y	89.4	Confident	86.2	Confident	18 Å²	18	58 Å²	58	7%	0.071	32%	0.321	C	S	.	.			trans	-115.2	-35.8	173.5	-56.8	-92.9	0	0	0	111.9	R587 P611 G615 V616 P649 D755 I762	R587-Y613 WeakPolarHBondContact CD-OH 3.48Å; P611-Y613 HydrophobicContact CB-CD2 4.31Å; P611-Y613 HydrophobicContact CB-CE2 3.54Å; Y613-G615 PolarHBondContact O-N 3.04Å; Y613-V616 PolarHBondContact O-N 3Å; Y613-V616 VanDerWaalsContact O-N 3.15Å; Y613-P649 HydrophobicContact CD2-CG 4.5Å; Y613-D755 WeakPolarHBondContact CA-OD2 3.24Å; Y613-D755 WeakPolarHBondContact CB-OD2 3.43Å; Y613-D755 PolarHBondContact N-OD2 3.46Å; Y613-I762 HydrophobicContact CD2-CD1 3.87Å; Y613-I762 HydrophobicContact CE2-CD1 3.29Å
614	A	85.8	Confident	87.2	Confident	11 Å²	11	52.1 Å²	52.1	9%	0.091	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	127.2	175.8	0	0	0	0	0	111.5	K612 V616 E753 D755	K612-A614 WeakPolarHBondContact CE-O 3.44Å; K612-A614 PolarHBondContact NZ-O 2.98Å; A614-V616 VanDerWaalsContact C-N 3.32Å; A614-V616 PolarHBondContact O-N 3.48Å; A614-E753 HydrophobicContact CB-CB 4.46Å; A614-E753 HydrophobicContact CB-CG 4.09Å; A614-D755 PolarHBondContact N-OD2 2.77Å
615	G	84	Confident	88.2	Confident	78 Å²	78	51.3 Å²	51.3	80%	0.804	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	6.1	-178	0	0	0	0	0	116	Y613	Y613-G615 PolarHBondContact O-N 3.04Å
616	V	88.4	Confident	88.9	Confident	23 Å²	23	46.9 Å²	46.9	14%	0.139	25%	0.248	C	C	.	.			trans	-90.2	129.9	175.4	-179.1	0	0	0	0	109.9	K612 Y613 A614 D620 F625	K612-V616 HydrophobicContact CG-CG2 4.32Å; Y613-V616 PolarHBondContact O-N 3Å; Y613-V616 VanDerWaalsContact O-N 3.15Å; A614-V616 VanDerWaalsContact C-N 3.32Å; A614-V616 PolarHBondContact O-N 3.48Å; V616-D620 HydrophobicContact CG1-CB 3.96Å; V616-F625 HydrophobicContact CG1-CD2 3.8Å; V616-F625 HydrophobicContact CG1-CE2 3.74Å; V616-F625 HydrophobicContact CG1-CG 4.37Å; V616-F625 HydrophobicContact CG1-CZ 4.26Å; V616-F625 HydrophobicContact CG2-CB 4.12Å; V616-F625 HydrophobicContact CG2-CD1 4.04Å; V616-F625 HydrophobicContact CG2-CD2 4.12Å; V616-F625 HydrophobicContact CG2-CE1 4.5Å; V616-F625 HydrophobicContact CG2-CG 3.84Å
617	S	86.3	Confident	89.4	Confident	48 Å²	48	43.6 Å²	43.6	34%	0.336	23%	0.229	S	C	.	.			trans	-61.6	149	179.5	93	0	0	0	0	111.3	R619 D620 R621	S617-R619 PolarHBondContact O-N 3.04Å; S617-R619 VanDerWaalsContact O-N 3.15Å; S617-R619 PolarHBondContact OG-N 3.49Å; S617-D620 PolarHBondContact O-N 3.17Å; S617-D620 WeakPolarHBondContact OG-CB 3.28Å; S617-D620 VanDerWaalsContact OG-CG 3.28Å; S617-D620 PolarHBondContact OG-N 2.91Å; S617-D620 PolarHBondContact OG-OD2 3.36Å; S617-R621 VanDerWaalsContact O-CG 3.25Å; S617-R621 WeakPolarHBondContact O-CG 3.4Å; S617-R621 PolarHBondContact O-N 3.43Å
618	P	84.4	Confident	89.6	Confident	111 Å²	111	42.9 Å²	42.9	72%	0.721	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.2	175.3	-30.1	37.2	0	0	0	115	R621	P618-R621 WeakPolarHBondContact O-CG 3.49Å
619	R	79.8	Confident	89.5	Confident	233 Å²	233	45.8 Å²	45.8	88%	0.879	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-31.8	177.9	-70.3	-175.5	172.5	-174.4	-4.4	112.2	S617	S617-R619 PolarHBondContact O-N 3.04Å; S617-R619 VanDerWaalsContact O-N 3.15Å; S617-R619 PolarHBondContact OG-N 3.49Å
620	D	87.7	Confident	88.8	Confident	46 Å²	46	48.8 Å²	48.8	25%	0.246	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	1	-176.1	-65.2	-55	0	0	0	113.8	V616 S617 C622 K623 F625	V616-D620 HydrophobicContact CG1-CB 3.96Å; S617-D620 PolarHBondContact O-N 3.17Å; S617-D620 WeakPolarHBondContact OG-CB 3.28Å; S617-D620 VanDerWaalsContact OG-CG 3.28Å; S617-D620 PolarHBondContact OG-N 2.91Å; S617-D620 PolarHBondContact OG-OD2 3.36Å; D620-C622 PolarHBondContact O-N 3.43Å; D620-K623 HydrophobicContact CB-CD 4.2Å; D620-K623 PolarHBondContact O-N 2.98Å; D620-K623 WeakPolarHBondContact OD1-CE 3.27Å; D620-K623 IonicContact OD1-NZ 3.51Å; D620-K623 PolarHBondContact OD1-NZ 2.92Å; D620-F625 HydrophobicContact CB-CE2 3.8Å; D620-F625 HydrophobicContact CB-CZ 4.11Å; D620-F625 WeakPolarHBondContact O-CE2 3.35Å
621	R	91.4	Very high	88.1	Confident	47 Å²	47	53 Å²	53	18%	0.177	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-13.9	-175.1	-61.8	-168.3	92.7	173.6	6.6	114.8	R587 S617 P618 E650	R587-R621 VanDerWaalsContact CZ-O 3.26Å; R587-R621 PolarHBondContact NH1-O 3.34Å; R587-R621 VanDerWaalsContact NH1-O 3.08Å; R587-R621 PolarHBondContact NH2-O 3.13Å; S617-R621 VanDerWaalsContact O-CG 3.25Å; S617-R621 WeakPolarHBondContact O-CG 3.4Å; S617-R621 PolarHBondContact O-N 3.43Å; P618-R621 WeakPolarHBondContact O-CG 3.49Å; R621-E650 IonicContact CZ-OE1 2.9Å; R621-E650 IonicContact NH1-OE1 2.68Å; R621-E650 PolarHBondContact NH1-OE1 2.99Å; R621-E650 IonicContact NH2-OE1 2.75Å; R621-E650 PolarHBondContact NH2-OE1 3.12Å; R621-E650 IonicContact NH2-OE2 3.83Å; R621-E650 PolarHBondContact NH2-OE2 3.46Å
622	C	93.6	Very high	87.3	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.007	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	9.1	177.3	-71.7	0	0	0	0	114	D620 K640 V641 C655 G658 C660	D620-C622 PolarHBondContact O-N 3.43Å; C622-K640 CarbonylContact O-C 3.59Å; C622-K640 WeakPolarHBondContact O-CA 3.27Å; C622-V641 HydrophobicContact CB-CG2 4.48Å; C622-V641 WeakPolarHBondContact O-CG2 3.36Å; C622-V641 PolarHBondContact O-N 3.26Å; C622-C655 WeakPolarHBondContact CA-SG 3.47Å; C622-C655 HydrophobicContact CB-CB 3.75Å; C622-C655 WeakPolarHBondContact CB-SG 3.42Å; C622-C655 WeakPolarHBondContact SG-CA 3.34Å; C622-C655 WeakPolarHBondContact SG-CB 3.32Å; C622-C655 CovalentContact SG-SG 2.04Å; C622-C655 PolarHBondContact SG-SG 3.03Å; C622-G658 WeakPolarHBondContact CB-O 3.26Å; C622-C660 PolarHBondContact SG-SG 3.06Å
623	K	93.3	Very high	87	Confident	65 Å²	65	59.5 Å²	59.5	28%	0.283	33%	0.328	S	S	.	.	S	Bend	trans	-84	159.2	160.8	-48.8	-176.7	166.6	161.3	0	109.8	D620 F625 V636 A639	D620-K623 HydrophobicContact CB-CD 4.2Å; D620-K623 PolarHBondContact O-N 2.98Å; D620-K623 WeakPolarHBondContact OD1-CE 3.27Å; D620-K623 IonicContact OD1-NZ 3.51Å; D620-K623 PolarHBondContact OD1-NZ 2.92Å; K623-F625 HydrophobicContact CB-CD2 3.93Å; K623-F625 HydrophobicContact CB-CE2 3.65Å; K623-F625 HydrophobicContact CD-CE2 4.07Å; K623-F625 HydrophobicContact CD-CZ 4.46Å; K623-F625 HydrophobicContact CG-CE2 4.24Å; K623-F625 PolarHBondContact O-N 3.37Å; K623-V636 HydrophobicContact CB-CG1 4.16Å; K623-A639 WeakPolarHBondContact CG-O 3.43Å
624	L	94.4	Very high	87	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.01	35%	0.349	C	S	.	.			trans	-89	79.3	179.4	-170.4	62.6	0	0	0	111	R587 Q590 Y594 V636 F637 E638 V641	R587-L624 HydrophobicContact CG-CD1 4.24Å; Q590-L624 HydrophobicContact CB-CD1 3.83Å; Q590-L624 HydrophobicContact CB-CD2 4.09Å; Y594-L624 HydrophobicContact CD2-CD2 4.45Å; Y594-L624 HydrophobicContact CE2-CD2 3.75Å; L624-V636 WeakPolarHBondContact O-CA 3.38Å; L624-F637 HydrophobicContact CD2-CB 4.09Å; L624-F637 HydrophobicContact CG-CB 4.48Å; L624-F637 PolarHBondContact O-N 2.99Å; L624-E638 HydrophobicContact CB-CB 3.83Å; L624-E638 HydrophobicContact CD2-CB 4.22Å; L624-E638 HydrophobicContact CD2-CG 3.99Å; L624-E638 PolarHBondContact N-O 3.3Å; L624-V641 HydrophobicContact CB-CG1 3.91Å; L624-V641 HydrophobicContact CD1-CG1 3.85Å; L624-V641 HydrophobicContact CG-CG1 4.47Å
625	F	94.3	Very high	87.1	Confident	31 Å²	31	67.7 Å²	67.7	14%	0.136	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	118.7	169.9	-72.4	-97.9	0	0	0	110.3	K612 V616 D620 K623 F634 V636	K612-F625 HydrophobicContact CB-CB 4.18Å; K612-F625 PolarHBondContact N-O 3.46Å; V616-F625 HydrophobicContact CG1-CD2 3.8Å; V616-F625 HydrophobicContact CG1-CE2 3.74Å; V616-F625 HydrophobicContact CG1-CG 4.37Å; V616-F625 HydrophobicContact CG1-CZ 4.26Å; V616-F625 HydrophobicContact CG2-CB 4.12Å; V616-F625 HydrophobicContact CG2-CD1 4.04Å; V616-F625 HydrophobicContact CG2-CD2 4.12Å; V616-F625 HydrophobicContact CG2-CE1 4.5Å; V616-F625 HydrophobicContact CG2-CG 3.84Å; D620-F625 HydrophobicContact CB-CE2 3.8Å; D620-F625 HydrophobicContact CB-CZ 4.11Å; D620-F625 WeakPolarHBondContact O-CE2 3.35Å; K623-F625 HydrophobicContact CB-CD2 3.93Å; K623-F625 HydrophobicContact CB-CE2 3.65Å; K623-F625 HydrophobicContact CD-CE2 4.07Å; K623-F625 HydrophobicContact CD-CZ 4.46Å; K623-F625 HydrophobicContact CG-CE2 4.24Å; K623-F625 PolarHBondContact O-N 3.37Å; F625-F634 HydrophobicContact CD1-CD2 4.28Å; F625-F634 HydrophobicContact CD1-CE2 4.37Å; F625-F634 HydrophobicContact CE1-CE2 4.44Å; F625-V636 HydrophobicContact CD1-CG2 3.54Å; F625-V636 HydrophobicContact CD2-CG2 4.44Å; F625-V636 HydrophobicContact CE1-CG2 3.29Å; F625-V636 HydrophobicContact CE2-CG2 4.23Å; F625-V636 HydrophobicContact CG-CG2 4.11Å; F625-V636 HydrophobicContact CZ-CG2 3.67Å
626	C	92.8	Very high	87.4	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.7	175.2	-53.6	0	0	0	0	110	C591 W609 V610 F634 K635 F637	C591-C626 VanDerWaalsContact CA-SG 3.5Å; C591-C626 HydrophobicContact CB-CB 3.91Å; C591-C626 WeakPolarHBondContact CB-SG 3.38Å; C591-C626 WeakPolarHBondContact SG-CB 3.48Å; C591-C626 CovalentContact SG-SG 2.04Å; C591-C626 PolarHBondContact SG-SG 2.99Å; W609-C626 HydrophobicContact CB-CB 4.15Å; W609-C626 HydrophobicContact CE3-CB 3.95Å; V610-C626 CarbonylContact O-C 3.44Å; V610-C626 VanDerWaalsContact O-CA 3.27Å; V610-C626 WeakPolarHBondContact O-CA 3.19Å; C626-F634 CarbonylContact O-C 3.59Å; C626-F634 VanDerWaalsContact O-CA 3.25Å; C626-F634 WeakPolarHBondContact O-CA 3.39Å; C626-F634 WeakPolarHBondContact O-CB 3.42Å; C626-K635 PolarHBondContact N-O 3.02Å; C626-K635 PolarHBondContact O-N 3.34Å; C626-F637 HydrophobicContact CB-CD2 3.76Å; C626-F637 HydrophobicContact CB-CE2 3.81Å
627	R	91.6	Very high	87.4	Confident	37 Å²	37	67 Å²	67	14%	0.14	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	150.9	173.7	66	-177.7	-175.5	90.6	-5.4	110.1	V610 K612 E633 F634 D755	V610-R627 HydrophobicContact CG2-CG 3.74Å; V610-R627 WeakPolarHBondContact CG2-O 3.41Å; V610-R627 PolarHBondContact N-O 3.26Å; V610-R627 PolarHBondContact O-N 3.31Å; K612-R627 HydrophobicContact CB-CB 4.16Å; K612-R627 HydrophobicContact CB-CG 4.14Å; K612-R627 HydrophobicContact CD-CB 4.31Å; R627-E633 WeakPolarHBondContact CA-O 3.43Å; R627-F634 HydrophobicContact CB-CB 4.05Å; R627-D755 PolarHBondContact NH2-O 3.15Å
628	A	88.3	Confident	87.4	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.008	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	136.8	171.7	0	0	0	0	0	110	L607 G630 R631 E633	L607-A628 HydrophobicContact CD2-CB 4.2Å; A628-G630 PolarHBondContact O-N 2.97Å; A628-R631 HydrophobicContact CB-CB 4.09Å; A628-R631 PolarHBondContact O-N 3.42Å; A628-R631 VanDerWaalsContact O-N 3.16Å; A628-E633 HydrophobicContact CB-CG 3.51Å; A628-E633 WeakPolarHBondContact CB-OE1 3.28Å; A628-E633 PolarHBondContact N-O 3.2Å
629	R	85.5	Confident	87.3	Confident	137 Å²	137	66.9 Å²	66.9	52%	0.517	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	125.7	-178.5	-169.2	178.2	-174.5	169	2.4	110	Q608 V610 R631	Q608-R629 HydrophobicContact CB-CB 4.18Å; Q608-R629 HydrophobicContact CG-CB 4.48Å; Q608-R629 WeakPolarHBondContact O-CB 3.47Å; Q608-R629 PolarHBondContact O-N 2.75Å; V610-R629 HydrophobicContact CG1-CB 4.25Å; V610-R629 HydrophobicContact CG1-CG 4.49Å; V610-R629 HydrophobicContact CG2-CB 4.45Å; R629-R631 VanDerWaalsContact C-N 3.27Å; R629-R631 PolarHBondContact O-N 3.04Å
630	G	75.9	Confident	87.7	Confident	77 Å²	77	59.4 Å²	59.4	79%	0.794	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	3.5	-179.5	0	0	0	0	0	115.5	A628	A628-G630 PolarHBondContact O-N 2.97Å
631	R	78.8	Confident	88.1	Confident	93 Å²	93	57.2 Å²	57.2	35%	0.351	30%	0.3	S	S	.	.	S	Bend	trans	-125.4	166	-179.2	-60	176.5	178.3	-125.2	-0.4	111.3	D601 A628 R629 E633	D601-R631 IonicContact OD2-CZ 2.64Å; D601-R631 IonicContact OD2-NH2 2.7Å; D601-R631 PolarHBondContact OD2-NH2 3.21Å; A628-R631 HydrophobicContact CB-CB 4.09Å; A628-R631 PolarHBondContact O-N 3.42Å; A628-R631 VanDerWaalsContact O-N 3.16Å; R629-R631 VanDerWaalsContact C-N 3.27Å; R629-R631 PolarHBondContact O-N 3.04Å; R631-E633 HydrophobicContact CB-CG 4Å; R631-E633 WeakPolarHBondContact CD-OE1 3.22Å
632	S	76.4	Confident	88.2	Confident	119 Å²	119	58.7 Å²	58.7	83%	0.832	31%	0.311	S	S	*	.	S	Bend	trans	-89.6	-16.2	179.6	54.1	0	0	0	0	113.9
633	E	84.1	Confident	88.3	Confident	72 Å²	72	59.3 Å²	59.3	34%	0.336	31%	0.314	S	S	.	.			trans	-62.6	135.2	177.3	64.9	-151.4	-158.1	0	0	112.2	L607 R627 A628 R631	L607-E633 WeakPolarHBondContact CD1-OE1 3.29Å; L607-E633 VanDerWaalsContact CD2-OE1 3.24Å; L607-E633 WeakPolarHBondContact CD2-OE1 3.46Å; R627-E633 WeakPolarHBondContact CA-O 3.43Å; A628-E633 HydrophobicContact CB-CG 3.51Å; A628-E633 WeakPolarHBondContact CB-OE1 3.28Å; A628-E633 PolarHBondContact N-O 3.2Å; R631-E633 HydrophobicContact CB-CG 4Å; R631-E633 WeakPolarHBondContact CD-OE1 3.22Å
634	F	89.5	Confident	88.4	Confident	117 Å²	117	56.2 Å²	56.2	51%	0.513	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.2	178.9	76.2	-86.3	0	0	0	111.6	K612 F625 C626 R627	K612-F634 HydrophobicContact CD-CB 3.68Å; K612-F634 HydrophobicContact CD-CD1 4.46Å; K612-F634 HydrophobicContact CD-CD2 4.15Å; K612-F634 HydrophobicContact CD-CG 3.85Å; F625-F634 HydrophobicContact CD1-CD2 4.28Å; F625-F634 HydrophobicContact CD1-CE2 4.37Å; F625-F634 HydrophobicContact CE1-CE2 4.44Å; C626-F634 CarbonylContact O-C 3.59Å; C626-F634 VanDerWaalsContact O-CA 3.25Å; C626-F634 WeakPolarHBondContact O-CA 3.39Å; C626-F634 WeakPolarHBondContact O-CB 3.42Å; R627-F634 HydrophobicContact CB-CB 4.05Å
635	K	88.1	Confident	88.4	Confident	83 Å²	83	56.1 Å²	56.1	36%	0.361	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	151	179.5	-171.1	166.9	177.5	177.2	0	110.7	Y599 W609 C626 F637	Y599-K635 HydrophobicContact CE1-CD 4.45Å; Y599-K635 PolarHBondContact OH-NZ 3.05Å; W609-K635 HydrophobicContact CH2-CB 4.17Å; W609-K635 HydrophobicContact CZ3-CB 4.19Å; C626-K635 PolarHBondContact N-O 3.02Å; C626-K635 PolarHBondContact O-N 3.34Å; K635-F637 HydrophobicContact CB-CE2 4.26Å; K635-F637 HydrophobicContact CB-CZ 4.27Å; K635-F637 HydrophobicContact CD-CD1 4.16Å; K635-F637 HydrophobicContact CD-CE1 3.67Å; K635-F637 HydrophobicContact CD-CZ 3.98Å; K635-F637 HydrophobicContact CG-CD1 4.42Å; K635-F637 HydrophobicContact CG-CE1 4.27Å; K635-F637 HydrophobicContact CG-CZ 4.4Å
636	V	90.6	Very high	88.4	Confident	62 Å²	62	57 Å²	57	38%	0.376	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	110.2	167.2	-174	0	0	0	0	107.2	K623 L624 F625	K623-V636 HydrophobicContact CB-CG1 4.16Å; L624-V636 WeakPolarHBondContact O-CA 3.38Å; F625-V636 HydrophobicContact CD1-CG2 3.54Å; F625-V636 HydrophobicContact CD2-CG2 4.44Å; F625-V636 HydrophobicContact CE1-CG2 3.29Å; F625-V636 HydrophobicContact CE2-CG2 4.23Å; F625-V636 HydrophobicContact CG-CG2 4.11Å; F625-V636 HydrophobicContact CZ-CG2 3.67Å
637	F	88.9	Confident	88.4	Confident	25 Å²	25	57 Å²	57	11%	0.11	31%	0.306	C	S	.	.			trans	-87.8	-33.6	-176.3	-78.8	-67.2	0	0	0	113.4	Y594 Y599 W609 L624 C626 K635	Y594-F637 HydrophobicContact CD1-CB 4.25Å; Y594-F637 AromaticContact CD1-CD1 3.38Å; Y594-F637 HydrophobicContact CD1-CD1 3.38Å; Y594-F637 AromaticContact CD1-CE1 3.77Å; Y594-F637 HydrophobicContact CD1-CE1 3.77Å; Y594-F637 AromaticContact CD1-CG 3.85Å; Y594-F637 HydrophobicContact CD1-CG 3.85Å; Y594-F637 HydrophobicContact CD2-CB 3.91Å; Y594-F637 HydrophobicContact CD2-CD1 4.11Å; Y594-F637 AromaticContact CD2-CD2 3.91Å; Y594-F637 HydrophobicContact CD2-CD2 3.91Å; Y594-F637 HydrophobicContact CD2-CE2 4.43Å; Y594-F637 AromaticContact CD2-CG 3.72Å; Y594-F637 HydrophobicContact CD2-CG 3.72Å; Y594-F637 HydrophobicContact CE1-CB 4.02Å; Y594-F637 AromaticContact CE1-CD1 3.84Å; Y594-F637 HydrophobicContact CE1-CD1 3.84Å; Y594-F637 HydrophobicContact CE1-CG 4.13Å; Y594-F637 HydrophobicContact CE2-CB 3.7Å; Y594-F637 HydrophobicContact CE2-CG 4.04Å; Y594-F637 HydrophobicContact CG-CB 4.2Å; Y594-F637 AromaticContact CG-CD1 3.54Å; Y594-F637 HydrophobicContact CG-CD1 3.54Å; Y594-F637 AromaticContact CG-CD2 3.97Å; Y594-F637 HydrophobicContact CG-CD2 3.97Å; Y594-F637 AromaticContact CG-CE1 3.77Å; Y594-F637 HydrophobicContact CG-CE1 3.77Å; Y594-F637 HydrophobicContact CG-CE2 4.18Å; Y594-F637 AromaticContact CG-CG 3.64Å; Y594-F637 HydrophobicContact CG-CG 3.64Å; Y594-F637 HydrophobicContact CG-CZ 4.09Å; Y599-F637 HydrophobicContact CE1-CE1 4.39Å; Y599-F637 AromaticContact CE2-CE1 3.87Å; Y599-F637 HydrophobicContact CE2-CE1 3.87Å; Y599-F637 HydrophobicContact CE2-CZ 4.4Å; Y599-F637 AromaticContact CZ-CE1 3.78Å; W609-F637 HydrophobicContact CB-CE2 4.47Å; W609-F637 AromaticContact CD2-CE2 3.57Å; W609-F637 HydrophobicContact CD2-CE2 3.57Å; W609-F637 AromaticContact CD2-CZ 3.77Å; W609-F637 HydrophobicContact CD2-CZ 3.77Å; W609-F637 AromaticContact CE2-CE2 3.9Å; W609-F637 AromaticContact CE2-CZ 3.56Å; W609-F637 AromaticContact CE3-CE2 3.77Å; W609-F637 HydrophobicContact CE3-CE2 3.77Å; W609-F637 HydrophobicContact CE3-CZ 4.23Å; W609-F637 AromaticContact CG-CE2 3.87Å; W609-F637 HydrophobicContact CG-CE2 3.87Å; W609-F637 HydrophobicContact CG-CZ 4.17Å; W609-F637 HydrophobicContact CH2-CZ 4.32Å; W609-F637 HydrophobicContact CZ2-CE2 4.39Å; W609-F637 AromaticContact CZ2-CZ 3.87Å; W609-F637 HydrophobicContact CZ2-CZ 3.87Å; W609-F637 HydrophobicContact CZ3-CE2 4.27Å; W609-F637 HydrophobicContact CZ3-CZ 4.48Å; W609-F637 AromaticContact NE1-CZ 3.82Å; L624-F637 HydrophobicContact CD2-CB 4.09Å; L624-F637 HydrophobicContact CG-CB 4.48Å; L624-F637 PolarHBondContact O-N 2.99Å; C626-F637 HydrophobicContact CB-CD2 3.76Å; C626-F637 HydrophobicContact CB-CE2 3.81Å; K635-F637 HydrophobicContact CB-CE2 4.26Å; K635-F637 HydrophobicContact CB-CZ 4.27Å; K635-F637 HydrophobicContact CD-CD1 4.16Å; K635-F637 HydrophobicContact CD-CE1 3.67Å; K635-F637 HydrophobicContact CD-CZ 3.98Å; K635-F637 HydrophobicContact CG-CD1 4.42Å; K635-F637 HydrophobicContact CG-CE1 4.27Å; K635-F637 HydrophobicContact CG-CZ 4.4Å
638	E	86.4	Confident	88.3	Confident	78 Å²	78	55.2 Å²	55.2	36%	0.364	30%	0.299	S	S	.	.			trans	-136.4	139.8	-179.5	-65	-65.9	163.3	0	0	109.5	Y594 L624 K640	Y594-E638 VanDerWaalsContact OH-CD 3.3Å; Y594-E638 WeakPolarHBondContact OH-CG 3.31Å; Y594-E638 PolarHBondContact OH-OE1 2.99Å; L624-E638 HydrophobicContact CB-CB 3.83Å; L624-E638 HydrophobicContact CD2-CB 4.22Å; L624-E638 HydrophobicContact CD2-CG 3.99Å; L624-E638 PolarHBondContact N-O 3.3Å; E638-K640 WeakPolarHBondContact CB-O 3.35Å; E638-K640 PolarHBondContact O-N 3.4Å
639	A	81.3	Confident	88.1	Confident	79 Å²	79	56.4 Å²	56.4	65%	0.653	31%	0.306	S	S	*	.	S	Bend	trans	-64.4	-18.8	175.6	0	0	0	0	0	112.3	K623	K623-A639 WeakPolarHBondContact CG-O 3.43Å
640	K	89.3	Confident	88	Confident	75 Å²	75	52.9 Å²	52.9	33%	0.326	30%	0.296	S	S	.	.	S	Bend	trans	-149.7	135.9	179	167.9	-177.8	170.5	-160.5	0	110.2	C622 E638 D643	C622-K640 CarbonylContact O-C 3.59Å; C622-K640 WeakPolarHBondContact O-CA 3.27Å; E638-K640 WeakPolarHBondContact CB-O 3.35Å; E638-K640 PolarHBondContact O-N 3.4Å; K640-D643 VanDerWaalsContact CE-CG 3.47Å; K640-D643 WeakPolarHBondContact CE-OD1 3.47Å; K640-D643 IonicContact NZ-OD1 2.97Å; K640-D643 PolarHBondContact NZ-OD1 3.35Å; K640-D643 IonicContact NZ-OD2 2.77Å; K640-D643 PolarHBondContact NZ-OD2 3.44Å
641	V	94.6	Very high	88.6	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-75.3	157.2	167.2	-59.6	0	0	0	0	111.3	R587 C622 L624 D643 T645 C655	R587-V641 VanDerWaalsContact NH2-CG1 3.35Å; C622-V641 HydrophobicContact CB-CG2 4.48Å; C622-V641 WeakPolarHBondContact O-CG2 3.36Å; C622-V641 PolarHBondContact O-N 3.26Å; L624-V641 HydrophobicContact CB-CG1 3.91Å; L624-V641 HydrophobicContact CD1-CG1 3.85Å; L624-V641 HydrophobicContact CG-CG1 4.47Å; V641-D643 PolarHBondContact O-N 2.95Å; V641-T645 HydrophobicContact CB-CG2 4.3Å; V641-T645 HydrophobicContact CG2-CG2 4.04Å; V641-C655 HydrophobicContact CG2-CB 3.49Å; V641-C655 VanDerWaalsContact CG2-CB 3.49Å; V641-C655 WeakPolarHBondContact CG2-SG 3.46Å
642	I	95.4	Very high	89.1	Confident	78 Å²	78	48.8 Å²	48.8	40%	0.4	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-56.2	135.8	176.7	-61.2	171.9	0	0	0	109.9	S538 F586 Q590 T645	S538-I642 WeakPolarHBondContact O-CG2 3.35Å; F586-I642 HydrophobicContact CE1-CB 3.84Å; F586-I642 HydrophobicContact CE1-CG2 3.89Å; F586-I642 HydrophobicContact CZ-CB 4.06Å; F586-I642 HydrophobicContact CZ-CD1 3.98Å; F586-I642 HydrophobicContact CZ-CG2 3.91Å; Q590-I642 HydrophobicContact CG-CD1 4.06Å; Q590-I642 HydrophobicContact CG-CG1 4.48Å; I642-T645 VanDerWaalsContact O-CB 3.26Å; I642-T645 WeakPolarHBondContact O-CB 3.45Å; I642-T645 PolarHBondContact O-N 2.87Å; I642-T645 VanDerWaalsContact O-N 3.17Å; I642-T645 PolarHBondContact O-OG1 3.48Å
643	D	95.3	Very high	89.9	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.07	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	143.7	-177.5	-69.9	-34.4	0	0	0	111.5	S538 V545 F547 K640 V641 T645 C655 V656 R657	S538-D643 WeakPolarHBondContact CB-O 3.35Å; S538-D643 PolarHBondContact OG-O 3.06Å; V545-D643 HydrophobicContact CB-CB 4.05Å; V545-D643 HydrophobicContact CG2-CB 4.37Å; F547-D643 HydrophobicContact CE2-CB 4.49Å; F547-D643 VanDerWaalsContact CE2-OD2 3.24Å; F547-D643 WeakPolarHBondContact CE2-OD2 3.19Å; F547-D643 WeakPolarHBondContact CZ-OD2 3.36Å; K640-D643 VanDerWaalsContact CE-CG 3.47Å; K640-D643 WeakPolarHBondContact CE-OD1 3.47Å; K640-D643 IonicContact NZ-OD1 2.97Å; K640-D643 PolarHBondContact NZ-OD1 3.35Å; K640-D643 IonicContact NZ-OD2 2.77Å; K640-D643 PolarHBondContact NZ-OD2 3.44Å; V641-D643 PolarHBondContact O-N 2.95Å; D643-T645 VanDerWaalsContact C-N 3.33Å; D643-C655 CarbonylContact C-O 3.52Å; D643-C655 VanDerWaalsContact CA-O 3.3Å; D643-C655 WeakPolarHBondContact CA-O 3.28Å; D643-V656 VanDerWaalsContact OD1-CA 3.3Å; D643-V656 WeakPolarHBondContact OD1-CA 3.33Å; D643-R657 PolarHBondContact OD1-N 3.23Å
644	G	94.8	Very high	90.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-7.2	-170.9	0	0	0	0	0	114.4	R539 G543 C655	R539-G644 PolarHBondContact NH1-O 3.47Å; G543-G644 WeakPolarHBondContact O-CA 3.46Å; G644-C655 PolarHBondContact N-O 2.95Å
645	T	95.6	Very high	90.7	Very high	1 Å²	1	35 Å²	35	1%	0.006	19%	0.191	C	C	.	.			trans	-68.3	134.5	173	-57.1	0	0	0	0	110.8	F586 R587 Q590 V641 I642 D643 C647 I654 C655	F586-T645 HydrophobicContact CD1-CG2 4.42Å; F586-T645 VanDerWaalsContact CD1-OG1 3.27Å; F586-T645 WeakPolarHBondContact CD1-OG1 3.43Å; F586-T645 WeakPolarHBondContact CE1-OG1 3.3Å; R587-T645 HydrophobicContact CB-CG2 3.74Å; R587-T645 HydrophobicContact CG-CG2 4.27Å; Q590-T645 PolarHBondContact NE2-OG1 3.15Å; V641-T645 HydrophobicContact CB-CG2 4.3Å; V641-T645 HydrophobicContact CG2-CG2 4.04Å; I642-T645 VanDerWaalsContact O-CB 3.26Å; I642-T645 WeakPolarHBondContact O-CB 3.45Å; I642-T645 PolarHBondContact O-N 2.87Å; I642-T645 VanDerWaalsContact O-N 3.17Å; I642-T645 PolarHBondContact O-OG1 3.48Å; D643-T645 VanDerWaalsContact C-N 3.33Å; T645-C647 PolarHBondContact O-N 2.88Å; T645-I654 CarbonylContact O-C 3.43Å; T645-I654 WeakPolarHBondContact O-CA 3.2Å; T645-C655 WeakPolarHBondContact O-CB 3.33Å; T645-C655 PolarHBondContact O-N 3.05Å
646	L	92.9	Very high	90.8	Very high	48 Å²	48	31.1 Å²	31.1	25%	0.251	17%	0.174	S	C	.	.	B	Isolated β-bridge	trans	-59.8	137.8	174.9	-69.8	172.6	0	0	0	112.2	R587 G648 I654	R587-L646 PolarHBondContact NH1-O 3.17Å; R587-L646 VanDerWaalsContact NH1-O 3.12Å; L646-G648 VanDerWaalsContact C-N 3.31Å; L646-G648 PolarHBondContact O-N 3.47Å; L646-I654 HydrophobicContact CD2-CG2 3.96Å
647	C	92.9	Very high	90.6	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	17%	0.167	C	C	.	.	S	Bend	trans	-65.2	-34	177.5	-79.4	0	0	0	0	113.8	R587 T645 T651 A653 C660	R587-C647 PolarHBondContact NH1-O 3.06Å; R587-C647 VanDerWaalsContact NH1-O 3.09Å; T645-C647 PolarHBondContact O-N 2.88Å; C647-T651 HydrophobicContact CB-CG2 3.83Å; C647-A653 HydrophobicContact CB-CB 4.24Å; C647-A653 WeakPolarHBondContact CB-O 3.46Å; C647-A653 PolarHBondContact N-O 2.9Å; C647-C660 HydrophobicContact CB-CB 4.13Å; C647-C660 WeakPolarHBondContact CB-SG 3.34Å; C647-C660 WeakPolarHBondContact SG-CA 3.3Å; C647-C660 WeakPolarHBondContact SG-CB 3.31Å; C647-C660 CovalentContact SG-SG 2.02Å; C647-C660 PolarHBondContact SG-SG 2.84Å
648	G	89.6	Confident	90.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.			trans	-163.9	158	-175.6	0	0	0	0	0	110.5	L646 E650 T651	L646-G648 VanDerWaalsContact C-N 3.31Å; L646-G648 PolarHBondContact O-N 3.47Å; G648-E650 PolarHBondContact O-N 2.99Å; G648-T651 PolarHBondContact O-N 3.49Å
649	P	84.9	Confident	90.4	Very high	25 Å²	25	28.9 Å²	28.9	16%	0.162	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-19.6	179.1	28.3	-36.4	0	0	0	113.7	Y613 I762	Y613-P649 HydrophobicContact CD2-CG 4.5Å; P649-I762 HydrophobicContact CB-CB 3.75Å; P649-I762 HydrophobicContact CB-CD1 4.21Å; P649-I762 HydrophobicContact CB-CG1 4.42Å; P649-I762 HydrophobicContact CB-CG2 4.25Å; P649-I762 HydrophobicContact CG-CB 4.09Å; P649-I762 HydrophobicContact CG-CD1 4.34Å; P649-I762 HydrophobicContact CG-CG2 4.03Å
650	E	82.8	Confident	90.9	Very high	64 Å²	64	27.4 Å²	27.4	30%	0.299	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	0.7	-179.2	77.5	-71.8	176.1	0	0	114.8	R621 G648 K764 F778	R621-E650 IonicContact CZ-OE1 2.9Å; R621-E650 IonicContact NH1-OE1 2.68Å; R621-E650 PolarHBondContact NH1-OE1 2.99Å; R621-E650 IonicContact NH2-OE1 2.75Å; R621-E650 PolarHBondContact NH2-OE1 3.12Å; R621-E650 IonicContact NH2-OE2 3.83Å; R621-E650 PolarHBondContact NH2-OE2 3.46Å; G648-E650 PolarHBondContact O-N 2.99Å; E650-K764 VanDerWaalsContact CD-NZ 3.26Å; E650-K764 IonicContact OE1-NZ 3.05Å; E650-K764 VanDerWaalsContact OE2-CE 3.22Å; E650-K764 WeakPolarHBondContact OE2-CE 3.4Å; E650-K764 IonicContact OE2-NZ 3.36Å; E650-K764 PolarHBondContact OE2-NZ 3.1Å; E650-F778 HydrophobicContact CB-CD2 3.77Å; E650-F778 HydrophobicContact CB-CE2 3.67Å
651	T	88.1	Confident	91	Very high	45 Å²	45	24.4 Å²	24.4	28%	0.276	14%	0.135	S	C	.	.			trans	-130.4	152	-174.9	-176.8	0	0	0	0	111.1	C647 G648 A653	C647-T651 HydrophobicContact CB-CG2 3.83Å; G648-T651 PolarHBondContact O-N 3.49Å; T651-A653 VanDerWaalsContact C-N 3.33Å; T651-A653 HydrophobicContact CG2-CB 4.16Å; T651-A653 VanDerWaalsContact OG1-CB 3.31Å; T651-A653 WeakPolarHBondContact OG1-CB 3.18Å; T651-A653 PolarHBondContact OG1-N 3.47Å
652	L	90.5	Very high	90.9	Very high	38 Å²	38	30.2 Å²	30.2	20%	0.199	16%	0.16	C	C	.	.			trans	-90.8	-4.4	169.9	-60.8	170.9	0	0	0	111.6	I654 A663 C665 L675	L652-I654 PolarHBondContact O-N 3.38Å; L652-A663 WeakPolarHBondContact CB-O 3.32Å; L652-A663 WeakPolarHBondContact O-CB 3.48Å; L652-C665 HydrophobicContact CD1-CB 3.77Å; L652-C665 HydrophobicContact CD2-CB 4.5Å; L652-L675 HydrophobicContact CD1-CG 4.31Å; L652-L675 HydrophobicContact CD2-CD1 4.1Å; L652-L675 HydrophobicContact CD2-CG 4.49Å
653	A	93.2	Very high	90.9	Very high	14 Å²	14	26.8 Å²	26.8	12%	0.116	14%	0.144	C	C	.	.			trans	-60.9	137.6	174.6	0	0	0	0	0	110.6	C647 T651 V661	C647-A653 HydrophobicContact CB-CB 4.24Å; C647-A653 WeakPolarHBondContact CB-O 3.46Å; C647-A653 PolarHBondContact N-O 2.9Å; T651-A653 VanDerWaalsContact C-N 3.33Å; T651-A653 HydrophobicContact CG2-CB 4.16Å; T651-A653 VanDerWaalsContact OG1-CB 3.31Å; T651-A653 WeakPolarHBondContact OG1-CB 3.18Å; T651-A653 PolarHBondContact OG1-N 3.47Å; A653-V661 CarbonylContact C-O 3.53Å; A653-V661 WeakPolarHBondContact CA-O 3.23Å; A653-V661 VanDerWaalsContact CB-O 3.27Å; A653-V661 WeakPolarHBondContact CB-O 3.31Å
654	I	94.8	Very high	90.8	Very high	6 Å²	6	26.3 Å²	26.3	3%	0.031	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	154.9	178.9	58.4	167.1	0	0	0	110.6	V545 T645 L646 L652 V656 V661 A663 V669	V545-I654 HydrophobicContact CG2-CD1 3.82Å; T645-I654 CarbonylContact O-C 3.43Å; T645-I654 WeakPolarHBondContact O-CA 3.2Å; L646-I654 HydrophobicContact CD2-CG2 3.96Å; L652-I654 PolarHBondContact O-N 3.38Å; I654-V656 HydrophobicContact CD1-CG2 4.17Å; I654-V656 HydrophobicContact CG1-CG2 4.13Å; I654-V661 PolarHBondContact N-O 2.89Å; I654-V661 PolarHBondContact O-N 2.95Å; I654-A663 HydrophobicContact CD1-CB 4.35Å; I654-A663 HydrophobicContact CG1-CB 3.98Å; I654-A663 HydrophobicContact CG2-CB 4.38Å; I654-V669 HydrophobicContact CD1-CG2 3.76Å
655	C	94.1	Very high	90.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	125.8	173.4	-67.5	0	0	0	0	109.8	C622 V641 D643 G644 T645 Q659	C622-C655 WeakPolarHBondContact CA-SG 3.47Å; C622-C655 HydrophobicContact CB-CB 3.75Å; C622-C655 WeakPolarHBondContact CB-SG 3.42Å; C622-C655 WeakPolarHBondContact SG-CA 3.34Å; C622-C655 WeakPolarHBondContact SG-CB 3.32Å; C622-C655 CovalentContact SG-SG 2.04Å; C622-C655 PolarHBondContact SG-SG 3.03Å; V641-C655 HydrophobicContact CG2-CB 3.49Å; V641-C655 VanDerWaalsContact CG2-CB 3.49Å; V641-C655 WeakPolarHBondContact CG2-SG 3.46Å; D643-C655 CarbonylContact C-O 3.52Å; D643-C655 VanDerWaalsContact CA-O 3.3Å; D643-C655 WeakPolarHBondContact CA-O 3.28Å; G644-C655 PolarHBondContact N-O 2.95Å; T645-C655 WeakPolarHBondContact O-CB 3.33Å; T645-C655 PolarHBondContact O-N 3.05Å; C655-Q659 CarbonylContact C-O 3.56Å; C655-Q659 WeakPolarHBondContact CA-O 3.44Å
656	V	91.3	Very high	90.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	116.1	172.6	-171.6	0	0	0	0	107	F213 V545 F547 Y571 D643 I654 G658 Q659 V661	F213-V656 HydrophobicContact CZ-CG1 4.29Å; V545-V656 HydrophobicContact CG1-CG1 4.18Å; V545-V656 HydrophobicContact CG2-CG2 4.09Å; F547-V656 HydrophobicContact CE1-CG1 4.04Å; F547-V656 HydrophobicContact CZ-CG1 3.64Å; Y571-V656 HydrophobicContact CD2-CG1 3.9Å; Y571-V656 HydrophobicContact CE2-CG1 4.07Å; Y571-V656 HydrophobicContact CE2-CG2 4.42Å; Y571-V656 HydrophobicContact CG-CG1 4.15Å; D643-V656 VanDerWaalsContact OD1-CA 3.3Å; D643-V656 WeakPolarHBondContact OD1-CA 3.33Å; I654-V656 HydrophobicContact CD1-CG2 4.17Å; I654-V656 HydrophobicContact CG1-CG2 4.13Å; V656-G658 VanDerWaalsContact C-N 3.29Å; V656-G658 PolarHBondContact O-N 3.31Å; V656-Q659 PolarHBondContact N-O 3.03Å; V656-Q659 PolarHBondContact O-N 3Å; V656-V661 HydrophobicContact CB-CB 4.46Å; V656-V661 HydrophobicContact CB-CG2 3.82Å; V656-V661 HydrophobicContact CG2-CB 3.98Å; V656-V661 HydrophobicContact CG2-CG2 3.91Å
657	R	85.1	Confident	90.6	Very high	62 Å²	62	27.2 Å²	27.2	23%	0.234	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	45.1	-174	-71.6	-132.4	-174	153.5	-22.1	114.1	F213 D417 F547 H549 D643 Q659	F213-R657 HydrophobicContact CE1-CB 3.96Å; F213-R657 HydrophobicContact CE1-CG 3.59Å; F213-R657 HydrophobicContact CZ-CB 3.97Å; F213-R657 HydrophobicContact CZ-CG 3.93Å; D417-R657 IonicContact OD2-NH1 2.69Å; D417-R657 PolarHBondContact OD2-NH1 2.97Å; F547-R657 HydrophobicContact CE1-CG 3.95Å; F547-R657 HydrophobicContact CZ-CG 3.81Å; H549-R657 PolarHBondContact NE2-NH2 3.25Å; H549-R657 VanDerWaalsContact NE2-NH2 3.17Å; D643-R657 PolarHBondContact OD1-N 3.23Å; R657-Q659 PolarHBondContact O-N 2.57Å
658	G	86.6	Confident	90.7	Very high	20 Å²	20	29.9 Å²	29.9	21%	0.206	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	10.4	174.1	0	0	0	0	0	113.8	C622 V656	C622-G658 WeakPolarHBondContact CB-O 3.26Å; V656-G658 VanDerWaalsContact C-N 3.29Å; V656-G658 PolarHBondContact O-N 3.31Å
659	Q	86.1	Confident	90.8	Very high	36 Å²	36	30.8 Å²	30.8	17%	0.168	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151	177.4	-64.9	-177.1	-6.2	0	0	112	D417 G418 C655 V656 R657 V661	D417-Q659 PolarHBondContact O-NE2 3.29Å; G418-Q659 PolarHBondContact O-NE2 3.2Å; C655-Q659 CarbonylContact C-O 3.56Å; C655-Q659 WeakPolarHBondContact CA-O 3.44Å; V656-Q659 PolarHBondContact N-O 3.03Å; V656-Q659 PolarHBondContact O-N 3Å; R657-Q659 PolarHBondContact O-N 2.57Å; Q659-V661 PolarHBondContact O-N 3.02Å
660	C	91	Very high	91.1	Very high	47 Å²	47	34.5 Å²	34.5	32%	0.318	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	118.9	175.6	-74.2	0	0	0	0	111.8	C622 C647	C622-C660 PolarHBondContact SG-SG 3.06Å; C647-C660 HydrophobicContact CB-CB 4.13Å; C647-C660 WeakPolarHBondContact CB-SG 3.34Å; C647-C660 WeakPolarHBondContact SG-CA 3.3Å; C647-C660 WeakPolarHBondContact SG-CB 3.31Å; C647-C660 CovalentContact SG-SG 2.02Å; C647-C660 PolarHBondContact SG-SG 2.84Å
661	V	91.1	Very high	91.6	Very high	12 Å²	12	32 Å²	32	7%	0.073	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	142.2	175.4	-177.5	0	0	0	0	109	Y571 A653 I654 V656 Q659 V669	Y571-V661 HydrophobicContact CE2-CG1 4.44Å; A653-V661 CarbonylContact C-O 3.53Å; A653-V661 WeakPolarHBondContact CA-O 3.23Å; A653-V661 VanDerWaalsContact CB-O 3.27Å; A653-V661 WeakPolarHBondContact CB-O 3.31Å; I654-V661 PolarHBondContact N-O 2.89Å; I654-V661 PolarHBondContact O-N 2.95Å; V656-V661 HydrophobicContact CB-CB 4.46Å; V656-V661 HydrophobicContact CB-CG2 3.82Å; V656-V661 HydrophobicContact CG2-CB 3.98Å; V656-V661 HydrophobicContact CG2-CG2 3.91Å; Q659-V661 PolarHBondContact O-N 3.02Å; V661-V669 HydrophobicContact CG1-CG1 4.19Å
662	K	93.3	Very high	91.8	Very high	123 Å²	123	34.8 Å²	34.8	54%	0.535	20%	0.195	S	C	.	.			trans	-65.7	135.8	179	-173.7	-177	172.2	-164.5	0	109.5	D670	K662-D670 PolarHBondContact O-N 3.16Å
663	A	94.6	Very high	91.9	Very high	7 Å²	7	39.4 Å²	39.4	6%	0.058	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-138.9	157.3	169.7	0	0	0	0	0	109.9	L652 I654 V668	L652-A663 WeakPolarHBondContact CB-O 3.32Å; L652-A663 WeakPolarHBondContact O-CB 3.48Å; I654-A663 HydrophobicContact CD1-CB 4.35Å; I654-A663 HydrophobicContact CG1-CB 3.98Å; I654-A663 HydrophobicContact CG2-CB 4.38Å; A663-V668 WeakPolarHBondContact CA-O 3.42Å; A663-V668 WeakPolarHBondContact CB-O 3.38Å
664	G	93.1	Very high	91.8	Very high	2 Å²	2	46 Å²	46	2%	0.021	24%	0.236	C	C	.	.			trans	-81	172.4	175.5	0	0	0	0	0	112.3	D666 H667 V668 S671 R673	G664-D666 VanDerWaalsContact C-OD1 3.32Å; G664-D666 VanDerWaalsContact CA-OD1 3.31Å; G664-D666 WeakPolarHBondContact CA-OD1 3.33Å; G664-D666 PolarHBondContact O-N 3.25Å; G664-H667 PolarHBondContact O-N 3Å; G664-V668 PolarHBondContact N-O 2.58Å; G664-S671 PolarHBondContact N-O 3.04Å; G664-R673 CarbonylContact C-O 3.4Å; G664-R673 WeakPolarHBondContact CA-O 3.33Å
665	C	92.3	Very high	91.6	Very high	10 Å²	10	48.5 Å²	48.5	7%	0.068	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-8.7	174.9	55	0	0	0	0	113.9	L652 H667 R673 K674 L675 C681	L652-C665 HydrophobicContact CD1-CB 3.77Å; L652-C665 HydrophobicContact CD2-CB 4.5Å; C665-H667 VanDerWaalsContact C-N 3.27Å; C665-R673 PolarHBondContact N-O 3.12Å; C665-R673 VanDerWaalsContact SG-C 3.53Å; C665-K674 PolarHBondContact SG-O 2.82Å; C665-L675 HydrophobicContact CB-CD2 3.64Å; C665-L675 HydrophobicContact CB-CG 3.77Å; C665-C681 HydrophobicContact CB-CB 3.61Å; C665-C681 WeakPolarHBondContact CB-SG 3.14Å; C665-C681 PolarHBondContact O-SG 3.17Å; C665-C681 WeakPolarHBondContact SG-CA 3.41Å; C665-C681 WeakPolarHBondContact SG-CB 3.18Å; C665-C681 CovalentContact SG-SG 2.02Å; C665-C681 PolarHBondContact SG-SG 3.05Å
666	D	93.9	Very high	91.5	Very high	35 Å²	35	49.5 Å²	49.5	19%	0.187	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	8.7	175.1	53.8	-2.9	0	0	0	112.1	G664 V668 S671 R673 C681	G664-D666 VanDerWaalsContact C-OD1 3.32Å; G664-D666 VanDerWaalsContact CA-OD1 3.31Å; G664-D666 WeakPolarHBondContact CA-OD1 3.33Å; G664-D666 PolarHBondContact O-N 3.25Å; D666-V668 HydrophobicContact CB-CG2 4.45Å; D666-V668 PolarHBondContact O-N 3.46Å; D666-V668 PolarHBondContact OD1-N 2.93Å; D666-S671 VanDerWaalsContact CG-OG 3.31Å; D666-S671 VanDerWaalsContact OD1-CB 3.27Å; D666-S671 WeakPolarHBondContact OD1-CB 3.47Å; D666-S671 PolarHBondContact OD1-OG 3.02Å; D666-S671 VanDerWaalsContact OD1-OG 3.07Å; D666-S671 PolarHBondContact OD2-OG 3Å; D666-R673 WeakPolarHBondContact OD2-CD 3.34Å; D666-C681 PolarHBondContact N-SG 3.09Å
667	H	93.6	Very high	91.5	Very high	24 Å²	24	54.3 Å²	54.3	11%	0.111	28%	0.275	C	S	.	.	S	Bend	trans	62.7	17.7	-177.4	-52.5	-68	0	0	0	114.7	G542 S573 T576 E578 G664 C665	G542-H667 PolarHBondContact O-ND1 3.23Å; S573-H667 PolarHBondContact OG-O 2.98Å; T576-H667 HydrophobicContact CG2-CB 4.32Å; T576-H667 PolarHBondContact O-CD2 2.74Å; T576-H667 VanDerWaalsContact O-CD2 3.28Å; E578-H667 IonicContact OE1-CD2 3.13Å; E578-H667 IonicContact OE1-CE1 2.98Å; E578-H667 IonicContact OE1-NE2 2.84Å; E578-H667 PolarHBondContact OE1-NE2 2.85Å; E578-H667 IonicContact OE2-NE2 2.94Å; E578-H667 PolarHBondContact OE2-NE2 3.47Å; G664-H667 PolarHBondContact O-N 3Å; C665-H667 VanDerWaalsContact C-N 3.27Å
668	V	94.4	Very high	91.7	Very high	56 Å²	56	52 Å²	52	34%	0.339	27%	0.268	S	S	.	.			trans	-94.9	125.4	177.6	179	0	0	0	0	110.1	S573 T576 A663 G664 D666 D670 S671	S573-V668 WeakPolarHBondContact OG-CA 3.39Å; T576-V668 HydrophobicContact CG2-CG2 4.02Å; A663-V668 WeakPolarHBondContact CA-O 3.42Å; A663-V668 WeakPolarHBondContact CB-O 3.38Å; G664-V668 PolarHBondContact N-O 2.58Å; D666-V668 HydrophobicContact CB-CG2 4.45Å; D666-V668 PolarHBondContact O-N 3.46Å; D666-V668 PolarHBondContact OD1-N 2.93Å; V668-D670 PolarHBondContact O-N 3.34Å; V668-S671 VanDerWaalsContact O-CB 3.23Å; V668-S671 WeakPolarHBondContact O-CB 3.44Å; V668-S671 PolarHBondContact O-N 2.98Å
669	V	92.5	Very high	91.8	Very high	20 Å²	20	51.9 Å²	51.9	12%	0.121	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-54.1	136	173	167.3	0	0	0	0	109.8	Y571 S573 I654 V661 S671	Y571-V669 HydrophobicContact CD2-CG1 4.22Å; Y571-V669 HydrophobicContact CD2-CG2 4.38Å; Y571-V669 HydrophobicContact CE2-CG1 3.55Å; Y571-V669 HydrophobicContact CE2-CG2 4.28Å; S573-V669 WeakPolarHBondContact OG-CG2 3.45Å; S573-V669 PolarHBondContact OG-N 3.21Å; I654-V669 HydrophobicContact CD1-CG2 3.76Å; V661-V669 HydrophobicContact CG1-CG1 4.19Å; V669-S671 PolarHBondContact O-N 2.95Å
670	D	90.3	Very high	92.1	Very high	102 Å²	102	53.3 Å²	53.3	55%	0.545	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	8.1	-179.8	-65.8	-45.6	0	0	0	115.5	K662 V668	K662-D670 PolarHBondContact O-N 3.16Å; V668-D670 PolarHBondContact O-N 3.34Å
671	S	93.4	Very high	92.1	Very high	12 Å²	12	53 Å²	53	8%	0.084	28%	0.276	C	S	.	.			trans	-62.7	134.4	173.3	173.2	0	0	0	0	111	G664 D666 V668 V669 R673	G664-S671 PolarHBondContact N-O 3.04Å; D666-S671 VanDerWaalsContact CG-OG 3.31Å; D666-S671 VanDerWaalsContact OD1-CB 3.27Å; D666-S671 WeakPolarHBondContact OD1-CB 3.47Å; D666-S671 PolarHBondContact OD1-OG 3.02Å; D666-S671 VanDerWaalsContact OD1-OG 3.07Å; D666-S671 PolarHBondContact OD2-OG 3Å; V668-S671 VanDerWaalsContact O-CB 3.23Å; V668-S671 WeakPolarHBondContact O-CB 3.44Å; V668-S671 PolarHBondContact O-N 2.98Å; V669-S671 PolarHBondContact O-N 2.95Å; S671-R673 PolarHBondContact O-N 3.18Å; S671-R673 WeakPolarHBondContact OG-CG 3.43Å; S671-R673 PolarHBondContact OG-N 3.07Å
672	P	92.5	Very high	92.2	Very high	103 Å²	103	54.6 Å²	54.6	67%	0.669	29%	0.294	S	S	*	.			trans	-78.4	-5.3	177.1	32.6	-35.3	0	0	0	112.9
673	R	93.7	Very high	92	Very high	135 Å²	135	50 Å²	50	51%	0.509	28%	0.283	S	S	.	.			trans	-67.7	133.7	-175.1	-62.4	-171.3	106.4	-170.7	4	111.3	G664 C665 D666 S671	G664-R673 CarbonylContact C-O 3.4Å; G664-R673 WeakPolarHBondContact CA-O 3.33Å; C665-R673 PolarHBondContact N-O 3.12Å; C665-R673 VanDerWaalsContact SG-C 3.53Å; D666-R673 WeakPolarHBondContact OD2-CD 3.34Å; S671-R673 PolarHBondContact O-N 3.18Å; S671-R673 WeakPolarHBondContact OG-CG 3.43Å; S671-R673 PolarHBondContact OG-N 3.07Å
674	K	91.2	Very high	91.9	Very high	153 Å²	153	58.9 Å²	58.9	67%	0.665	32%	0.32	S	S	*	.			trans	-121.6	155.4	-178.9	-64	177.5	-175.8	175.8	0	110.7	C665 G682	C665-K674 PolarHBondContact SG-O 2.82Å; K674-G682 PolarHBondContact O-N 2.92Å
675	L	90.2	Very high	91.7	Very high	58 Å²	58	59.1 Å²	59.1	30%	0.304	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-65.9	136.7	165.1	-64.4	172.8	0	0	0	108.9	L652 C665 G679 C681	L652-L675 HydrophobicContact CD1-CG 4.31Å; L652-L675 HydrophobicContact CD2-CD1 4.1Å; L652-L675 HydrophobicContact CD2-CG 4.49Å; C665-L675 HydrophobicContact CB-CD2 3.64Å; C665-L675 HydrophobicContact CB-CG 3.77Å; L675-G679 WeakPolarHBondContact CD2-O 3.41Å; L675-C681 HydrophobicContact CD2-CB 4.28Å
676	D	91.7	Very high	91.8	Very high	21 Å²	21	64.3 Å²	64.3	11%	0.112	35%	0.349	C	S	.	.			trans	-77.2	-179.3	168.5	76.8	0.9	0	0	0	111.3	C678 G679 V680 G683 K684 G685	D676-C678 PolarHBondContact O-N 3.14Å; D676-C678 VanDerWaalsContact O-N 3.07Å; D676-C678 VanDerWaalsContact OD1-CA 3.26Å; D676-C678 WeakPolarHBondContact OD1-CA 3.39Å; D676-C678 VanDerWaalsContact OD1-CB 3.26Å; D676-C678 WeakPolarHBondContact OD1-CB 3.21Å; D676-C678 PolarHBondContact OD1-N 2.89Å; D676-G679 PolarHBondContact O-N 2.9Å; D676-G679 PolarHBondContact OD1-N 3.08Å; D676-V680 PolarHBondContact N-O 2.86Å; D676-V680 PolarHBondContact OD1-N 2.76Å; D676-G683 WeakPolarHBondContact CB-O 3.43Å; D676-G683 VanDerWaalsContact OD2-CA 3.22Å; D676-G683 WeakPolarHBondContact OD2-CA 3.49Å; D676-K684 PolarHBondContact OD2-N 3.07Å; D676-G685 VanDerWaalsContact OD2-CA 3.26Å; D676-G685 WeakPolarHBondContact OD2-CA 3.43Å; D676-G685 PolarHBondContact OD2-N 2.87Å
677	K	90.4	Very high	91.7	Very high	102 Å²	102	65 Å²	65	44%	0.443	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.9	179.1	70.2	-171	-177.6	-176.5	0	114.1	G685 T713 N714 F806	K677-G685 WeakPolarHBondContact CE-O 3.26Å; K677-G685 PolarHBondContact NZ-O 3.26Å; K677-G685 VanDerWaalsContact NZ-O 3.11Å; K677-T713 PolarHBondContact O-OG1 3.5Å; K677-N714 VanDerWaalsContact C-ND2 3.3Å; K677-N714 VanDerWaalsContact CA-ND2 3.33Å; K677-N714 WeakPolarHBondContact CA-ND2 3.46Å; K677-N714 PolarHBondContact O-ND2 3.05Å; K677-F806 HydrophobicContact CB-CD1 4.37Å; K677-F806 HydrophobicContact CB-CE1 4.03Å; K677-F806 HydrophobicContact CB-CE2 4.24Å; K677-F806 HydrophobicContact CB-CZ 3.94Å; K677-F806 HydrophobicContact CD-CD1 4.23Å; K677-F806 HydrophobicContact CD-CE1 3.54Å; K677-F806 HydrophobicContact CD-CZ 3.98Å; K677-F806 HydrophobicContact CG-CD1 4.07Å; K677-F806 HydrophobicContact CG-CE1 3.8Å; K677-F806 HydrophobicContact CG-CZ 4.21Å; K677-F806 WeakPolarHBondContact O-CB 3.45Å; K677-F806 WeakPolarHBondContact O-CD2 3.17Å; K677-F806 VanDerWaalsContact O-CG 3.3Å; K677-F806 WeakPolarHBondContact O-CG 3.27Å
678	C	90.9	Very high	91.7	Very high	13 Å²	13	64.4 Å²	64.4	9%	0.088	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-0	178.3	-53.7	0	0	0	0	112.7	D676 V680 S687 C688 T713	D676-C678 PolarHBondContact O-N 3.14Å; D676-C678 VanDerWaalsContact O-N 3.07Å; D676-C678 VanDerWaalsContact OD1-CA 3.26Å; D676-C678 WeakPolarHBondContact OD1-CA 3.39Å; D676-C678 VanDerWaalsContact OD1-CB 3.26Å; D676-C678 WeakPolarHBondContact OD1-CB 3.21Å; D676-C678 PolarHBondContact OD1-N 2.89Å; C678-V680 VanDerWaalsContact C-N 3.34Å; C678-V680 HydrophobicContact CB-CG2 4.3Å; C678-S687 VanDerWaalsContact CB-OG 3.27Å; C678-S687 WeakPolarHBondContact CB-OG 3.08Å; C678-S687 PolarHBondContact SG-OG 2.81Å; C678-C688 WeakPolarHBondContact CA-SG 3.36Å; C678-C688 HydrophobicContact CB-CB 3.58Å; C678-C688 WeakPolarHBondContact CB-SG 3.46Å; C678-C688 WeakPolarHBondContact SG-CB 3.29Å; C678-C688 PolarHBondContact SG-N 3.46Å; C678-C688 CovalentContact SG-SG 2.02Å; C678-C688 PolarHBondContact SG-SG 3.46Å; C678-T713 PolarHBondContact O-OG1 3.22Å
679	G	88.4	Confident	91.6	Very high	18 Å²	18	65.9 Å²	65.9	19%	0.186	36%	0.355	C	S	.	.	S	Bend	trans	75.8	19.5	-175.3	0	0	0	0	0	113.9	L675 D676	L675-G679 WeakPolarHBondContact CD2-O 3.41Å; D676-G679 PolarHBondContact O-N 2.9Å; D676-G679 PolarHBondContact OD1-N 3.08Å
680	V	90.9	Very high	91.7	Very high	66 Å²	66	71.2 Å²	71.2	40%	0.4	38%	0.376	S	S	.	.			trans	-97	129	176.1	-178	0	0	0	0	109.7	D676 C678 G682 G683	D676-V680 PolarHBondContact N-O 2.86Å; D676-V680 PolarHBondContact OD1-N 2.76Å; C678-V680 VanDerWaalsContact C-N 3.34Å; C678-V680 HydrophobicContact CB-CG2 4.3Å; V680-G682 PolarHBondContact O-N 3.18Å; V680-G683 PolarHBondContact O-N 3.4Å; V680-G683 VanDerWaalsContact O-N 3.16Å
681	C	92.1	Very high	91.8	Very high	42 Å²	42	66.7 Å²	66.7	28%	0.284	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-68.8	121.7	179.9	-176	0	0	0	0	111.8	C665 D666 L675 G683	C665-C681 HydrophobicContact CB-CB 3.61Å; C665-C681 WeakPolarHBondContact CB-SG 3.14Å; C665-C681 PolarHBondContact O-SG 3.17Å; C665-C681 WeakPolarHBondContact SG-CA 3.41Å; C665-C681 WeakPolarHBondContact SG-CB 3.18Å; C665-C681 CovalentContact SG-SG 2.02Å; C665-C681 PolarHBondContact SG-SG 3.05Å; D666-C681 PolarHBondContact N-SG 3.09Å; L675-C681 HydrophobicContact CD2-CB 4.28Å; C681-G683 PolarHBondContact O-N 3.26Å
682	G	91.8	Very high	91.9	Very high	44 Å²	44	69.3 Å²	69.3	45%	0.454	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	17.4	-174.5	0	0	0	0	0	113.7	K674 V680	K674-G682 PolarHBondContact O-N 2.92Å; V680-G682 PolarHBondContact O-N 3.18Å
683	G	91.1	Very high	91.8	Very high	28 Å²	28	65.5 Å²	65.5	29%	0.289	35%	0.35	S	S	.	.			trans	-71.8	162.4	-180	0	0	0	0	0	113.1	D676 V680 C681	D676-G683 WeakPolarHBondContact CB-O 3.43Å; D676-G683 VanDerWaalsContact OD2-CA 3.22Å; D676-G683 WeakPolarHBondContact OD2-CA 3.49Å; V680-G683 PolarHBondContact O-N 3.4Å; V680-G683 VanDerWaalsContact O-N 3.16Å; C681-G683 PolarHBondContact O-N 3.26Å
684	K	91.5	Very high	91.5	Very high	193 Å²	193	63 Å²	63	84%	0.839	35%	0.353	S	S	*	.			trans	-93.5	-3.3	179.7	-63.4	-178.6	179.9	178.6	0	113	D676	D676-K684 PolarHBondContact OD2-N 3.07Å
685	G	89.7	Confident	91.1	Very high	7 Å²	7	57.5 Å²	57.5	7%	0.072	33%	0.331	C	S	.	.	S	Bend	trans	75.7	25.3	-178.4	0	0	0	0	0	114.7	D676 K677	D676-G685 VanDerWaalsContact OD2-CA 3.26Å; D676-G685 WeakPolarHBondContact OD2-CA 3.43Å; D676-G685 PolarHBondContact OD2-N 2.87Å; K677-G685 WeakPolarHBondContact CE-O 3.26Å; K677-G685 PolarHBondContact NZ-O 3.26Å; K677-G685 VanDerWaalsContact NZ-O 3.11Å
686	N	92.8	Very high	90	Very high	118 Å²	118	59 Å²	59	63%	0.631	34%	0.343	S	S	*	.			trans	-108	-6.3	179.9	62	-9.7	0	0	0	113.9	C688 N809	N686-C688 VanDerWaalsContact C-N 3.28Å; N686-C688 PolarHBondContact O-N 2.74Å; N686-N809 PolarHBondContact O-ND2 3.1Å
687	S	92.9	Very high	88.7	Confident	50 Å²	50	63.1 Å²	63.1	35%	0.35	37%	0.371	S	S	.	.	S	Bend	trans	-81.1	-3	179.5	53.9	0	0	0	0	114.4	C678 N809	C678-S687 VanDerWaalsContact CB-OG 3.27Å; C678-S687 WeakPolarHBondContact CB-OG 3.08Å; C678-S687 PolarHBondContact SG-OG 2.81Å; S687-N809 PolarHBondContact O-N 2.96Å; S687-N809 PolarHBondContact O-ND2 2.82Å
688	C	93	Very high	87.4	Confident	12 Å²	12	60 Å²	60	8%	0.081	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.6	-177.5	69.7	0	0	0	0	111.9	C678 N686 F806 V807 N809	C678-C688 WeakPolarHBondContact CA-SG 3.36Å; C678-C688 HydrophobicContact CB-CB 3.58Å; C678-C688 WeakPolarHBondContact CB-SG 3.46Å; C678-C688 WeakPolarHBondContact SG-CB 3.29Å; C678-C688 PolarHBondContact SG-N 3.46Å; C678-C688 CovalentContact SG-SG 2.02Å; C678-C688 PolarHBondContact SG-SG 3.46Å; N686-C688 VanDerWaalsContact C-N 3.28Å; N686-C688 PolarHBondContact O-N 2.74Å; C688-F806 HydrophobicContact CB-CB 4.27Å; C688-V807 CarbonylContact C-O 3.52Å; C688-V807 WeakPolarHBondContact CA-O 3.42Å; C688-V807 VanDerWaalsContact CB-O 3.25Å; C688-V807 WeakPolarHBondContact CB-O 3.27Å; C688-N809 VanDerWaalsContact C-OD1 3.28Å; C688-N809 WeakPolarHBondContact CA-OD1 3.38Å
689	R	93.1	Very high	86.7	Confident	86 Å²	86	63.2 Å²	63.2	33%	0.325	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.1	173.4	62.1	179.9	-179	-104	8.7	111.5	F806 V807 N809 V811 F813	R689-F806 WeakPolarHBondContact O-CA 3.4Å; R689-V807 HydrophobicContact CG-CB 4.49Å; R689-V807 PolarHBondContact N-O 3.47Å; R689-V807 PolarHBondContact O-N 3Å; R689-N809 PolarHBondContact N-OD1 3.03Å; R689-V811 PolarHBondContact NH2-O 3.35Å; R689-V811 VanDerWaalsContact NH2-O 3.1Å; R689-F813 VanDerWaalsContact NH2-N 3.13Å; R689-F813 PolarHBondContact NH2-O 2.5Å
690	K	93.1	Very high	86.4	Confident	132 Å²	132	69.8 Å²	69.8	57%	0.574	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	130.6	176	-172.7	179	178.2	-178.7	0	109.7	F806	K690-F806 HydrophobicContact CB-CD1 3.99Å; K690-F806 HydrophobicContact CB-CE1 3.61Å; K690-F806 HydrophobicContact CB-CZ 4.19Å; K690-F806 HydrophobicContact CD-CE1 4.37Å; K690-F806 HydrophobicContact CD-CZ 4.15Å; K690-F806 HydrophobicContact CG-CD1 4.48Å; K690-F806 HydrophobicContact CG-CE1 3.95Å; K690-F806 HydrophobicContact CG-CZ 4Å
691	V	94	Very high	86.2	Confident	8 Å²	8	67.2 Å²	67.2	5%	0.048	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.5	169.3	-179.9	0	0	0	0	108.1	Y803 T804 F805 V807 F813 M815	V691-Y803 HydrophobicContact CG1-CE2 4.3Å; V691-T804 VanDerWaalsContact O-CA 3.29Å; V691-T804 WeakPolarHBondContact O-CA 3.47Å; V691-F805 HydrophobicContact CB-CD1 4.41Å; V691-F805 HydrophobicContact CB-CD2 4.06Å; V691-F805 HydrophobicContact CB-CE1 4.09Å; V691-F805 HydrophobicContact CB-CE2 3.73Å; V691-F805 HydrophobicContact CB-CG 4.4Å; V691-F805 HydrophobicContact CB-CZ 3.74Å; V691-F805 HydrophobicContact CG1-CE1 3.77Å; V691-F805 HydrophobicContact CG1-CE2 3.97Å; V691-F805 HydrophobicContact CG1-CZ 3.47Å; V691-F805 VanDerWaalsContact CG1-CZ 3.47Å; V691-F805 HydrophobicContact CG2-CD2 4.43Å; V691-F805 HydrophobicContact CG2-CE2 3.95Å; V691-F805 HydrophobicContact CG2-CZ 4.3Å; V691-F805 PolarHBondContact N-O 3.26Å; V691-F805 PolarHBondContact O-N 2.04Å; V691-V807 HydrophobicContact CG2-CB 4.46Å; V691-V807 HydrophobicContact CG2-CG2 3.7Å; V691-F813 HydrophobicContact CB-CE1 4.39Å; V691-F813 HydrophobicContact CG1-CE1 3.69Å; V691-F813 HydrophobicContact CG1-CZ 4.31Å; V691-F813 HydrophobicContact CG2-CD1 3.86Å; V691-F813 HydrophobicContact CG2-CE1 3.83Å; V691-M815 HydrophobicContact CG1-CE 4.43Å; V691-M815 HydrophobicContact CG1-CG 4.29Å; V691-M815 HydrophobicContact CG1-SD 4.23Å
692	S	94.1	Very high	86.1	Confident	66 Å²	66	68 Å²	68	46%	0.462	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	145.8	176.6	58.2	0	0	0	0	111.3	Y803	S692-Y803 VanDerWaalsContact CA-O 3.25Å; S692-Y803 WeakPolarHBondContact CA-O 3.09Å
693	G	90.6	Very high	85.9	Confident	23 Å²	23	66.9 Å²	66.9	24%	0.237	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	178.8	176.4	0	0	0	0	0	112.7	Y803	G693-Y803 VanDerWaalsContact CA-CZ 3.5Å; G693-Y803 PolarHBondContact N-O 2.88Å; G693-Y803 VanDerWaalsContact N-O 3.12Å; G693-Y803 PolarHBondContact O-N 3.12Å
694	S	88.3	Confident	85.9	Confident	82 Å²	82	69.9 Å²	69.9	57%	0.573	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	150.5	176.6	56.6	0	0	0	0	110.5	V801	S694-V801 WeakPolarHBondContact CA-O 3.41Å; S694-V801 WeakPolarHBondContact CB-O 3.17Å
695	L	81.5	Confident	85.8	Confident	38 Å²	38	61.6 Å²	61.6	20%	0.199	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.5	174.6	-173.6	71.3	0	0	0	108.8	T698 I705 V801	L695-T698 HydrophobicContact CD2-CG2 3.8Å; L695-T698 HydrophobicContact CG-CG2 4.29Å; L695-I705 HydrophobicContact CD2-CG1 3.79Å; L695-V801 HydrophobicContact CB-CB 4.3Å; L695-V801 PolarHBondContact N-O 2.86Å
696	T	68.3	Low	85.9	Confident	90 Å²	90	62 Å²	62	55%	0.552	35%	0.346	S	S	*	.			trans	-125.7	-39.2	-174.9	26.5	0	0	0	0	114.9	P799	T696-P799 WeakPolarHBondContact O-CD 3.26Å
697	P	63.2	Low	86	Confident	107 Å²	107	59.5 Å²	59.5	70%	0.695	34%	0.336	S	S	*	.			trans	-101.5	132.4	170.3	28.8	-17.1	0	0	0	111.4
698	T	64.9	Low	86.1	Confident	36 Å²	36	57.3 Å²	57.3	22%	0.221	32%	0.32	C	S	.	.			trans	-127.6	143.6	175.7	48.8	0	0	0	0	111.3	L695 N703 L789 T791 P799	L695-T698 HydrophobicContact CD2-CG2 3.8Å; L695-T698 HydrophobicContact CG-CG2 4.29Å; T698-N703 HydrophobicContact CG2-CB 3.97Å; T698-L789 HydrophobicContact CG2-CD2 3.74Å; T698-T791 PolarHBondContact OG1-OG1 3.2Å; T698-T791 VanDerWaalsContact OG1-OG1 3.12Å; T698-P799 HydrophobicContact CG2-CG 3.88Å
699	S	75.2	Confident	86.1	Confident	81 Å²	81	57.6 Å²	57.6	57%	0.566	32%	0.321	S	S	*	.			trans	-78.3	159.2	162.9	46	0	0	0	0	110.1	G701 N703	S699-G701 PolarHBondContact O-N 3.28Å; S699-N703 PolarHBondContact N-OD1 3.29Å; S699-N703 PolarHBondContact O-ND2 3.29Å; S699-N703 PolarHBondContact O-OD1 3.08Å; S699-N703 PolarHBondContact OG-OD1 3.05Å
700	Y	83	Confident	86.1	Confident	156 Å²	156	55.3 Å²	55.3	61%	0.612	32%	0.321	S	S	*	.	S	Bend	trans	-54.2	137.5	169.8	173.2	-105.2	0	0	0	111.4	P793	Y700-P793 HydrophobicContact CD2-CB 4.23Å; Y700-P793 HydrophobicContact CD2-CG 4.39Å; Y700-P793 HydrophobicContact CE2-CB 3.74Å; Y700-P793 VanDerWaalsContact CE2-CD 3.44Å; Y700-P793 HydrophobicContact CE2-CG 3.45Å; Y700-P793 VanDerWaalsContact CE2-CG 3.45Å
701	G	86.5	Confident	86	Confident	13 Å²	13	50.2 Å²	50.2	13%	0.134	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	97	-152.4	-179.8	0	0	0	0	0	114.2	S699 N703 T791	S699-G701 PolarHBondContact O-N 3.28Å; G701-N703 PolarHBondContact O-ND2 3.11Å; G701-T791 PolarHBondContact N-O 3.21Å; G701-T791 PolarHBondContact O-N 3.1Å
702	Y	88.9	Confident	86.1	Confident	58 Å²	58	49.9 Å²	49.9	23%	0.227	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	124.5	-177.8	-71	-85	0	0	0	111.4	A733 Y741 N744 G745 N746 L747 Q788 L790	Y702-A733 HydrophobicContact CD1-CB 4.04Å; Y702-A733 HydrophobicContact CE1-CB 3.72Å; Y702-Y741 AromaticContact CD1-CE1 3.89Å; Y702-Y741 HydrophobicContact CD1-CE1 3.89Å; Y702-Y741 HydrophobicContact CE1-CD1 4.47Å; Y702-Y741 AromaticContact CE1-CE1 3.62Å; Y702-Y741 HydrophobicContact CE1-CE1 3.62Å; Y702-N744 VanDerWaalsContact CE1-O 3.27Å; Y702-N744 WeakPolarHBondContact CE1-O 3.44Å; Y702-N744 PolarHBondContact OH-O 3.17Å; Y702-G745 VanDerWaalsContact OH-C 3.24Å; Y702-G745 WeakPolarHBondContact OH-CA 3.42Å; Y702-N746 PolarHBondContact OH-N 3.32Å; Y702-L747 HydrophobicContact CE2-CD2 4.03Å; Y702-L747 PolarHBondContact OH-N 2.77Å; Y702-Q788 HydrophobicContact CD1-CB 4.42Å; Y702-L790 HydrophobicContact CD1-CB 4.06Å; Y702-L790 HydrophobicContact CD1-CD1 4.26Å; Y702-L790 HydrophobicContact CD2-CD1 4.12Å; Y702-L790 HydrophobicContact CE1-CB 3.88Å; Y702-L790 HydrophobicContact CE1-CD1 4.08Å; Y702-L790 HydrophobicContact CE1-CD2 4.25Å; Y702-L790 HydrophobicContact CE1-CG 4.28Å; Y702-L790 HydrophobicContact CE2-CD1 3.94Å; Y702-L790 HydrophobicContact CG-CD1 4.28Å
703	N	88.8	Confident	86.1	Confident	20 Å²	20	46.8 Å²	46.8	11%	0.107	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.8	-179.7	-58.3	-96.3	0	0	0	109.9	T698 S699 G701 I705 Q788 L789	T698-N703 HydrophobicContact CG2-CB 3.97Å; S699-N703 PolarHBondContact N-OD1 3.29Å; S699-N703 PolarHBondContact O-ND2 3.29Å; S699-N703 PolarHBondContact O-OD1 3.08Å; S699-N703 PolarHBondContact OG-OD1 3.05Å; G701-N703 PolarHBondContact O-ND2 3.11Å; N703-I705 PolarHBondContact O-N 2.95Å; N703-Q788 CarbonylContact O-C 3.23Å; N703-Q788 WeakPolarHBondContact O-CA 3.48Å; N703-Q788 WeakPolarHBondContact O-CB 3.02Å; N703-L789 PolarHBondContact N-O 2.66Å; N703-L789 PolarHBondContact ND2-O 3.02Å; N703-L789 PolarHBondContact O-N 3.22Å
704	D	89.7	Confident	86.1	Confident	91 Å²	91	47.7 Å²	47.7	49%	0.487	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	122.1	178.7	-72.3	18	0	0	0	110.4	K735 T786 Q788	D704-K735 IonicContact OD1-NZ 3.64Å; D704-K735 PolarHBondContact OD1-NZ 2.8Å; D704-K735 IonicContact OD2-NZ 3.19Å; D704-K735 PolarHBondContact OD2-NZ 3.44Å; D704-T786 HydrophobicContact CB-CG2 4.43Å; D704-Q788 VanDerWaalsContact OD1-CG 3.31Å; D704-Q788 WeakPolarHBondContact OD1-CG 3.23Å; D704-Q788 PolarHBondContact OD1-NE2 3.42Å
705	I	90.8	Very high	86.5	Confident	19 Å²	19	44 Å²	44	10%	0.097	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-56.8	176.7	-61.2	158.7	0	0	0	109.5	L695 N703 L732 V787 Q788 L789 V801 Y803	L695-I705 HydrophobicContact CD2-CG1 3.79Å; N703-I705 PolarHBondContact O-N 2.95Å; I705-L732 HydrophobicContact CD1-CD2 3.91Å; I705-V787 WeakPolarHBondContact CB-O 3.3Å; I705-V787 HydrophobicContact CD1-CG1 3.92Å; I705-V787 PolarHBondContact N-O 3.46Å; I705-Q788 VanDerWaalsContact CD1-C 3.47Å; I705-L789 HydrophobicContact CD1-CB 4Å; I705-L789 HydrophobicContact CG1-CB 4.18Å; I705-V801 HydrophobicContact CD1-CG1 3.93Å; I705-V801 HydrophobicContact CG1-CG1 4.46Å; I705-V801 HydrophobicContact CG2-CG1 4.2Å; I705-Y803 HydrophobicContact CG2-CD1 3.5Å; I705-Y803 HydrophobicContact CG2-CE1 3.66Å; I705-Y803 HydrophobicContact CG2-CG 4.46Å
706	V	92.2	Very high	87.1	Confident	15 Å²	15	43.3 Å²	43.3	9%	0.091	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	141.7	-177.5	63.1	0	0	0	0	110.5	I708 V787 Y803 F805 F813	V706-I708 HydrophobicContact CG1-CG1 4.02Å; V706-V787 HydrophobicContact CG1-CB 4.41Å; V706-V787 HydrophobicContact CG1-CG2 4.36Å; V706-V787 PolarHBondContact N-O 2.96Å; V706-V787 PolarHBondContact O-N 3.13Å; V706-Y803 HydrophobicContact CB-CE1 4.46Å; V706-Y803 HydrophobicContact CB-CE2 4.21Å; V706-Y803 HydrophobicContact CG1-CD1 4.41Å; V706-Y803 HydrophobicContact CG1-CD2 4.12Å; V706-Y803 HydrophobicContact CG1-CE2 4.26Å; V706-Y803 HydrophobicContact CG1-CG 4.19Å; V706-Y803 HydrophobicContact CG2-CE2 4.2Å; V706-F805 HydrophobicContact CG1-CE1 4.26Å; V706-F805 HydrophobicContact CG2-CE1 3.88Å; V706-F805 HydrophobicContact CG2-CZ 3.85Å; V706-F813 HydrophobicContact CG2-CZ 4.16Å
707	T	93.7	Very high	88.5	Confident	67 Å²	67	39 Å²	39	41%	0.411	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	109.3	164.9	-55.9	0	0	0	0	108.8	P784 L785 T786 F813	T707-P784 HydrophobicContact CG2-CB 4.36Å; T707-L785 CarbonylContact C-O 3.31Å; T707-L785 WeakPolarHBondContact CA-O 3.2Å; T707-T786 PolarHBondContact OG1-OG1 3.07Å; T707-F813 WeakPolarHBondContact O-CE2 3.25Å
708	I	94.9	Very high	90	Very high	4 Å²	4	37 Å²	37	2%	0.021	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	121.7	178.4	-57.2	177.6	0	0	0	107.7	V706 A712 I715 L781 P784 L785 V787 F805	V706-I708 HydrophobicContact CG1-CG1 4.02Å; I708-A712 HydrophobicContact CG2-CB 3.43Å; I708-A712 VanDerWaalsContact CG2-CB 3.43Å; I708-I715 HydrophobicContact CD1-CD1 4.35Å; I708-I715 HydrophobicContact CD1-CG1 4.33Å; I708-I715 HydrophobicContact CD1-CG2 3.55Å; I708-I715 HydrophobicContact CG2-CD1 3.86Å; I708-I715 HydrophobicContact CG2-CG1 4.15Å; I708-L781 HydrophobicContact CB-CD2 4.31Å; I708-L781 HydrophobicContact CG2-CD2 3.99Å; I708-P784 CarbonylContact O-C 3.52Å; I708-P784 WeakPolarHBondContact O-CA 3.37Å; I708-L785 PolarHBondContact N-O 2.74Å; I708-L785 PolarHBondContact O-N 2.57Å; I708-V787 HydrophobicContact CD1-CG2 3.78Å; I708-V787 HydrophobicContact CG1-CG2 4.25Å; I708-F805 HydrophobicContact CD1-CD1 4.35Å; I708-F805 HydrophobicContact CG1-CD1 4.22Å; I708-F805 HydrophobicContact CG1-CE1 4.04Å; I708-F805 HydrophobicContact CG1-CZ 4.28Å; I708-F805 HydrophobicContact CG2-CD2 4.13Å; I708-F805 HydrophobicContact CG2-CE2 4.28Å; I708-F805 HydrophobicContact CG2-CG 4.36Å
709	P	94.4	Very high	91.2	Very high	17 Å²	17	35.3 Å²	35.3	11%	0.11	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-72.4	160	-177.5	30.7	-35.1	0	0	0	111.9	A712 V807 V811 F813	P709-A712 HydrophobicContact CG-CB 4.41Å; P709-A712 VanDerWaalsContact O-CB 3.24Å; P709-A712 WeakPolarHBondContact O-CB 3.41Å; P709-A712 PolarHBondContact O-N 2.88Å; P709-V807 HydrophobicContact CG-CG1 3.92Å; P709-V807 HydrophobicContact CG-CG2 3.95Å; P709-V811 HydrophobicContact CB-CG1 4.08Å; P709-V811 HydrophobicContact CG-CG1 4.3Å; P709-F813 HydrophobicContact CG-CD2 3.87Å; P709-F813 HydrophobicContact CG-CE2 4.46Å; P709-F813 HydrophobicContact CG-CG 4.46Å
710	A	92.5	Very high	91.9	Very high	39 Å²	39	38.8 Å²	38.8	32%	0.322	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	148.5	166.6	0	0	0	0	0	110.7	A712 L781	A710-A712 PolarHBondContact O-N 2.75Å; A710-L781 CarbonylContact C-O 3.57Å; A710-L781 WeakPolarHBondContact CA-O 3.33Å
711	G	91.6	Very high	91.8	Very high	25 Å²	25	32 Å²	32	26%	0.258	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	-10.3	-174.1	0	0	0	0	0	114.7	L781 P808	G711-L781 PolarHBondContact N-O 2.69Å; G711-P808 WeakPolarHBondContact O-CG 3.37Å
712	A	94.4	Very high	91.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.			trans	-65.9	141	178.6	0	0	0	0	0	112.1	I708 P709 A710 P780 L781 F805 F806	I708-A712 HydrophobicContact CG2-CB 3.43Å; I708-A712 VanDerWaalsContact CG2-CB 3.43Å; P709-A712 HydrophobicContact CG-CB 4.41Å; P709-A712 VanDerWaalsContact O-CB 3.24Å; P709-A712 WeakPolarHBondContact O-CB 3.41Å; P709-A712 PolarHBondContact O-N 2.88Å; A710-A712 PolarHBondContact O-N 2.75Å; A712-P780 WeakPolarHBondContact O-CA 3.42Å; A712-L781 PolarHBondContact O-N 3.41Å; A712-F805 HydrophobicContact CB-CD2 4.08Å; A712-F806 CarbonylContact C-O 3.57Å; A712-F806 WeakPolarHBondContact CA-O 3.27Å
713	T	93.9	Very high	90.6	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	165.1	-176.2	52.6	0	0	0	0	112	K677 C678 I715 P780 F806	K677-T713 PolarHBondContact O-OG1 3.5Å; C678-T713 PolarHBondContact O-OG1 3.22Å; T713-I715 VanDerWaalsContact C-N 3.25Å; T713-I715 PolarHBondContact O-N 3.43Å; T713-P780 HydrophobicContact CG2-CB 3.92Å; T713-P780 HydrophobicContact CG2-CG 3.65Å; T713-F806 PolarHBondContact N-O 2.91Å; T713-F806 PolarHBondContact O-N 2.61Å
714	N	92.4	Very high	89.8	Confident	43 Å²	43	39.4 Å²	39.4	23%	0.23	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	48.4	48.6	178.6	-66.2	-46.3	0	0	0	112.6	K677 S777 F778 F806	K677-N714 VanDerWaalsContact C-ND2 3.3Å; K677-N714 VanDerWaalsContact CA-ND2 3.33Å; K677-N714 WeakPolarHBondContact CA-ND2 3.46Å; K677-N714 PolarHBondContact O-ND2 3.05Å; N714-S777 CarbonylContact C-O 3.59Å; N714-S777 VanDerWaalsContact CA-O 3.28Å; N714-S777 WeakPolarHBondContact CA-O 3.48Å; N714-S777 PolarHBondContact N-O 2.82Å; N714-F778 WeakPolarHBondContact OD1-CD1 3.32Å; N714-F806 HydrophobicContact CB-CD2 3.85Å; N714-F806 HydrophobicContact CB-CE2 4.21Å
715	I	94.8	Very high	89	Confident	4 Å²	4	37 Å²	37	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	127.6	177.8	-61.2	166.1	0	0	0	108.4	I708 T713 V717 Q776 S777 L781 F805	I708-I715 HydrophobicContact CD1-CD1 4.35Å; I708-I715 HydrophobicContact CD1-CG1 4.33Å; I708-I715 HydrophobicContact CD1-CG2 3.55Å; I708-I715 HydrophobicContact CG2-CD1 3.86Å; I708-I715 HydrophobicContact CG2-CG1 4.15Å; T713-I715 VanDerWaalsContact C-N 3.25Å; T713-I715 PolarHBondContact O-N 3.43Å; I715-V717 HydrophobicContact CG2-CG2 4.41Å; I715-Q776 CarbonylContact O-C 3.55Å; I715-Q776 VanDerWaalsContact O-CA 3.22Å; I715-Q776 WeakPolarHBondContact O-CA 3.46Å; I715-S777 PolarHBondContact N-O 3.34Å; I715-S777 PolarHBondContact O-N 3.28Å; I715-L781 HydrophobicContact CD1-CB 4.22Å; I715-L781 HydrophobicContact CD1-CD1 4.27Å; I715-L781 HydrophobicContact CD1-CD2 4.31Å; I715-F805 HydrophobicContact CB-CB 4.46Å; I715-F805 HydrophobicContact CG1-CB 3.98Å
716	D	95.5	Very high	87.6	Confident	24 Å²	24	44.2 Å²	44.2	13%	0.128	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	106	177.9	-172.6	31	0	0	0	109.1	K718 R774 Y803 T804	D716-K718 VanDerWaalsContact OD1-CE 3.3Å; D716-K718 WeakPolarHBondContact OD1-CE 3.42Å; D716-K718 IonicContact OD1-NZ 3.82Å; D716-K718 WeakPolarHBondContact OD2-CE 3.39Å; D716-K718 IonicContact OD2-NZ 2.66Å; D716-K718 PolarHBondContact OD2-NZ 3.47Å; D716-R774 VanDerWaalsContact CG-NH2 3.25Å; D716-R774 IonicContact OD1-CZ 3.95Å; D716-R774 IonicContact OD1-NE 3.21Å; D716-R774 PolarHBondContact OD1-NE 2.91Å; D716-R774 IonicContact OD1-NH2 3.15Å; D716-R774 PolarHBondContact OD1-NH2 3.09Å; D716-R774 IonicContact OD2-CZ 2.92Å; D716-R774 IonicContact OD2-NH2 2.7Å; D716-R774 PolarHBondContact OD2-NH2 3.03Å; D716-R774 VanDerWaalsContact OD2-NH2 3.15Å; D716-Y803 CarbonylContact O-C 3.56Å; D716-Y803 VanDerWaalsContact O-CA 3.3Å; D716-Y803 WeakPolarHBondContact O-CA 3.15Å; D716-T804 PolarHBondContact N-O 3.33Å; D716-T804 PolarHBondContact O-N 2.88Å
717	V	96.3	Very high	86.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.6	174.2	-172.7	0	0	0	0	108.3	I715 L732 R774 L775 V787 V801	I715-V717 HydrophobicContact CG2-CG2 4.41Å; V717-L732 HydrophobicContact CG1-CD1 4.16Å; V717-L732 HydrophobicContact CG1-CD2 3.9Å; V717-R774 CarbonylContact O-C 3.45Å; V717-R774 VanDerWaalsContact O-CA 3.3Å; V717-R774 WeakPolarHBondContact O-CA 3.17Å; V717-L775 HydrophobicContact CB-CB 4.24Å; V717-L775 PolarHBondContact N-O 3.5Å; V717-L775 PolarHBondContact O-N 3.26Å; V717-V787 HydrophobicContact CG1-CG1 4.17Å; V717-V787 HydrophobicContact CG2-CG1 4.37Å; V717-V787 HydrophobicContact CG2-CG2 4.32Å; V717-V801 HydrophobicContact CG1-CG1 4.15Å
718	K	94.7	Very high	86.1	Confident	64 Å²	64	45.1 Å²	45.1	28%	0.278	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	127	-176.4	-72.6	170	-178	152.4	0	109.3	D716 L772 E773 R774 V801 K802	D716-K718 VanDerWaalsContact OD1-CE 3.3Å; D716-K718 WeakPolarHBondContact OD1-CE 3.42Å; D716-K718 IonicContact OD1-NZ 3.82Å; D716-K718 WeakPolarHBondContact OD2-CE 3.39Å; D716-K718 IonicContact OD2-NZ 2.66Å; D716-K718 PolarHBondContact OD2-NZ 3.47Å; K718-L772 HydrophobicContact CB-CD1 3.87Å; K718-L772 HydrophobicContact CD-CD1 4.42Å; K718-L772 HydrophobicContact CD-CD2 4.3Å; K718-L772 HydrophobicContact CG-CD1 4.11Å; K718-L772 HydrophobicContact CG-CD2 4.38Å; K718-L772 HydrophobicContact CG-CG 4.46Å; K718-E773 CarbonylContact C-O 3.44Å; K718-E773 WeakPolarHBondContact CA-O 3.36Å; K718-R774 HydrophobicContact CG-CG 3.99Å; K718-V801 CarbonylContact O-C 3.54Å; K718-V801 VanDerWaalsContact O-CA 3.29Å; K718-V801 WeakPolarHBondContact O-CA 3.21Å; K718-K802 PolarHBondContact N-O 3.19Å; K718-K802 PolarHBondContact O-N 2.98Å
719	Q	91.4	Very high	85.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.9	162.5	166.9	55	-29.5	0	0	108.1	L732 E773 L789 K800 V801	Q719-L732 HydrophobicContact CB-CD1 4.33Å; Q719-L732 HydrophobicContact CB-CD2 4.14Å; Q719-L732 HydrophobicContact CB-CG 4Å; Q719-E773 HydrophobicContact CB-CB 4.19Å; Q719-E773 PolarHBondContact N-O 2.74Å; Q719-E773 PolarHBondContact O-N 3.43Å; Q719-E773 VanDerWaalsContact O-O 3.12Å; Q719-L789 HydrophobicContact CG-CD1 4.46Å; Q719-K800 PolarHBondContact OE1-O 2.76Å; Q719-V801 HydrophobicContact CB-CG2 4.26Å
720	R	88.6	Confident	85.3	Confident	154 Å²	154	44.9 Å²	44.9	58%	0.581	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.8	-178.8	179.7	173.6	-74.1	-149	-4.1	109.5	L772 K800	R720-L772 HydrophobicContact CB-CD1 4.1Å; R720-K800 HydrophobicContact CB-CB 4.44Å
721	S	81.3	Confident	85.2	Confident	14 Å²	14	43.8 Å²	43.8	10%	0.098	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-66	157.5	174.7	-49.6	0	0	0	0	111.6	D728 T771	S721-D728 WeakPolarHBondContact CA-OD2 3.38Å; S721-T771 PolarHBondContact N-O 3.42Å
722	H	78.3	Confident	85.3	Confident	36 Å²	36	42.6 Å²	42.6	17%	0.167	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-67	137.6	175.9	-84.8	68.5	0	0	0	111.1	G724 V725 F797 P798 K800	H722-G724 PolarHBondContact O-N 3.05Å; H722-V725 HydrophobicContact CB-CB 4.18Å; H722-V725 HydrophobicContact CB-CG2 3.97Å; H722-V725 PolarHBondContact O-N 3.16Å; H722-F797 HydrophobicContact CB-CD1 4.02Å; H722-F797 HydrophobicContact CB-CE1 4.48Å; H722-F797 HydrophobicContact CB-CG 4.37Å; H722-F797 AromaticContact CD2-CD1 3.91Å; H722-F797 AromaticContact CG-CD1 3.68Å; H722-F797 AromaticContact ND1-CD1 3.99Å; H722-P798 PolarHBondContact CE1-O 3.16Å; H722-P798 VanDerWaalsContact CE1-O 3.32Å; H722-K800 VanDerWaalsContact CE1-CE 3.5Å; H722-K800 WeakPolarHBondContact CE1-CE 3.47Å; H722-K800 PolarHBondContact CE1-NZ 2.8Å; H722-K800 WeakPolarHBondContact NE2-CE 3.02Å; H722-K800 PolarHBondContact NE2-NZ 2.89Å
723	P	72.8	Confident	85.3	Confident	121 Å²	121	42.7 Å²	42.7	79%	0.786	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	126.6	177.7	-24.2	33.2	0	0	0	111.2	V725	P723-V725 VanDerWaalsContact C-N 3.34Å
724	G	70.9	Confident	85.4	Confident	90 Å²	90	42.7 Å²	42.7	93%	0.928	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.3	-1.3	-179	0	0	0	0	0	115.6	H722	H722-G724 PolarHBondContact O-N 3.05Å
725	V	73.3	Confident	85.5	Confident	40 Å²	40	42.4 Å²	42.4	24%	0.242	24%	0.236	C	C	.	.			trans	-111.4	113.9	178.2	-176.1	0	0	0	0	109	H722 P723 D728 F797	H722-V725 HydrophobicContact CB-CB 4.18Å; H722-V725 HydrophobicContact CB-CG2 3.97Å; H722-V725 PolarHBondContact O-N 3.16Å; P723-V725 VanDerWaalsContact C-N 3.34Å; V725-D728 HydrophobicContact CG1-CB 4.06Å; V725-F797 HydrophobicContact CB-CE2 4.46Å; V725-F797 HydrophobicContact CG1-CD2 4.1Å; V725-F797 HydrophobicContact CG1-CE2 3.72Å; V725-F797 HydrophobicContact CG1-CZ 4.26Å; V725-F797 HydrophobicContact CG2-CE1 4.05Å; V725-F797 HydrophobicContact CG2-CE2 4Å; V725-F797 HydrophobicContact CG2-CZ 3.67Å
726	Q	62.4	Low	85.4	Confident	170 Å²	170	42.6 Å²	42.6	79%	0.794	24%	0.238	S	C	*	.	S	Bend	trans	-72.6	-33.6	179.6	-79.7	-163.5	-18.6	0	0	113.2
727	N	74.2	Confident	85	Confident	100 Å²	100	45.4 Å²	45.4	54%	0.535	26%	0.264	S	S	.	.			trans	-130.4	91.7	-179.1	-67.7	-30.9	0	0	0	108.7	G729	N727-G729 PolarHBondContact O-N 3.07Å
728	D	79.5	Confident	84.7	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.011	30%	0.296	C	S	.	.			trans	-83.9	9.2	-177.4	77.3	-22.9	0	0	0	113.3	S721 V725 N730 F797	S721-D728 WeakPolarHBondContact CA-OD2 3.38Å; V725-D728 HydrophobicContact CG1-CB 4.06Å; D728-N730 VanDerWaalsContact C-N 3.3Å; D728-N730 PolarHBondContact O-N 2.73Å; D728-N730 PolarHBondContact O-ND2 3.15Å; D728-N730 PolarHBondContact OD1-N 2.62Å; D728-F797 HydrophobicContact CB-CB 4.08Å; D728-F797 HydrophobicContact CB-CD2 4.07Å; D728-F797 HydrophobicContact CB-CG 4.3Å
729	G	84.6	Confident	84.4	Confident	13 Å²	13	50.2 Å²	50.2	13%	0.134	30%	0.303	C	S	.	.	S	Bend	trans	77.6	8.1	176.4	0	0	0	0	0	114.9	N727 T791 V792	N727-G729 PolarHBondContact O-N 3.07Å; G729-T791 WeakPolarHBondContact O-CA 3.33Å; G729-V792 WeakPolarHBondContact O-CG2 3.27Å; G729-V792 PolarHBondContact O-N 3.41Å
730	N	87.9	Confident	84.4	Confident	2 Å²	2	56 Å²	56	1%	0.011	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.7	-175.4	-65	-72.4	0	0	0	111.3	D728 L789 L790 T791 F797 P799	D728-N730 VanDerWaalsContact C-N 3.3Å; D728-N730 PolarHBondContact O-N 2.73Å; D728-N730 PolarHBondContact O-ND2 3.15Å; D728-N730 PolarHBondContact OD1-N 2.62Å; N730-L789 HydrophobicContact CB-CD1 4.25Å; N730-L789 HydrophobicContact CB-CD2 4.4Å; N730-L789 HydrophobicContact CB-CG 4.5Å; N730-L790 WeakPolarHBondContact CA-O 3.31Å; N730-T791 PolarHBondContact OD1-OG1 3.41Å; N730-F797 PolarHBondContact ND2-O 3.33Å; N730-P799 HydrophobicContact CB-CB 4.47Å
731	Y	90.7	Very high	84.5	Confident	17 Å²	17	52 Å²	52	7%	0.067	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136.2	-173.5	-52.6	-74.8	0	0	0	111.9	I749 E773 L790 V792	Y731-I749 HydrophobicContact CD1-CG2 3.81Å; Y731-I749 HydrophobicContact CD2-CD1 3.44Å; Y731-I749 VanDerWaalsContact CD2-CD1 3.44Å; Y731-I749 HydrophobicContact CD2-CG1 4Å; Y731-I749 HydrophobicContact CE1-CD1 4.48Å; Y731-I749 HydrophobicContact CE1-CG2 4.15Å; Y731-I749 HydrophobicContact CE2-CD1 3.38Å; Y731-I749 HydrophobicContact CE2-CG1 4.39Å; Y731-I749 HydrophobicContact CG-CD1 4.04Å; Y731-I749 HydrophobicContact CG-CG1 4.18Å; Y731-I749 HydrophobicContact CG-CG2 3.97Å; Y731-E773 WeakPolarHBondContact CA-OE2 3.47Å; Y731-L790 PolarHBondContact N-O 3.08Å; Y731-L790 PolarHBondContact O-N 3.29Å; Y731-V792 HydrophobicContact CE2-CG1 4.47Å; Y731-V792 HydrophobicContact CE2-CG2 3.9Å
732	L	94.1	Very high	85	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.8	175.2	-66.9	177.3	0	0	0	110.6	I705 V717 Q719 N744 Y765 E773 L775 L789	I705-L732 HydrophobicContact CD1-CD2 3.91Å; V717-L732 HydrophobicContact CG1-CD1 4.16Å; V717-L732 HydrophobicContact CG1-CD2 3.9Å; Q719-L732 HydrophobicContact CB-CD1 4.33Å; Q719-L732 HydrophobicContact CB-CD2 4.14Å; Q719-L732 HydrophobicContact CB-CG 4Å; L732-N744 WeakPolarHBondContact O-CB 3.31Å; L732-N744 PolarHBondContact O-ND2 3.15Å; L732-Y765 HydrophobicContact CB-CE2 4.4Å; L732-E773 HydrophobicContact CB-CG 4.44Å; L732-E773 HydrophobicContact CD1-CG 4.05Å; L732-E773 HydrophobicContact CG-CG 4.19Å; L732-E773 PolarHBondContact N-OE1 3.44Å; L732-E773 PolarHBondContact N-OE2 2.92Å; L732-L775 HydrophobicContact CD1-CB 4.34Å; L732-L789 HydrophobicContact CD2-CD1 4.25Å
733	A	94.4	Very high	85.7	Confident	1 Å²	1	52 Å²	52	1%	0.008	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	156.1	173	0	0	0	0	0	110.2	Y702 Y741 L743 N744 Q788	Y702-A733 HydrophobicContact CD1-CB 4.04Å; Y702-A733 HydrophobicContact CE1-CB 3.72Å; A733-Y741 HydrophobicContact CB-CE1 4.38Å; A733-L743 WeakPolarHBondContact CA-O 3.42Å; A733-N744 HydrophobicContact CB-CB 4.04Å; A733-Q788 HydrophobicContact CB-CB 4.19Å; A733-Q788 PolarHBondContact N-O 3.26Å; A733-Q788 PolarHBondContact O-N 2.9Å
734	L	95.3	Very high	86.5	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	127	-176.3	-167.9	66.8	0	0	0	109.6	Y741 L742 L743 I756 L763 L775 L785 V787	L734-Y741 CarbonylContact O-C 3.59Å; L734-Y741 WeakPolarHBondContact O-CA 3.48Å; L734-L742 HydrophobicContact CB-CB 4.48Å; L734-L742 HydrophobicContact CD2-CB 4.31Å; L734-L742 HydrophobicContact CD2-CD1 4.31Å; L734-L742 HydrophobicContact CG-CB 4.48Å; L734-L742 PolarHBondContact O-N 2.89Å; L734-L743 HydrophobicContact CB-CB 3.74Å; L734-L743 PolarHBondContact N-O 3.45Å; L734-L743 PolarHBondContact O-N 2.8Å; L734-I756 HydrophobicContact CD2-CD1 4.18Å; L734-I756 HydrophobicContact CD2-CG2 4.2Å; L734-L763 HydrophobicContact CD2-CD2 4.18Å; L734-L775 HydrophobicContact CD1-CD2 3.97Å; L734-L775 HydrophobicContact CD2-CD2 4.26Å; L734-L785 HydrophobicContact CD1-CB 4.02Å; L734-L785 HydrophobicContact CD1-CD1 4.36Å; L734-L785 HydrophobicContact CD2-CD1 4.15Å; L734-L785 HydrophobicContact CG-CD1 4.48Å; L734-V787 HydrophobicContact CD1-CG2 3.93Å
735	K	93.7	Very high	87.3	Confident	37 Å²	37	43.1 Å²	43.1	16%	0.161	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.7	176	69.1	179.5	177.4	-165.8	0	111.6	D704 Q740 Y741 T786 Q788	D704-K735 IonicContact OD1-NZ 3.64Å; D704-K735 PolarHBondContact OD1-NZ 2.8Å; D704-K735 IonicContact OD2-NZ 3.19Å; D704-K735 PolarHBondContact OD2-NZ 3.44Å; K735-Q740 CarbonylContact C-O 3.48Å; K735-Q740 VanDerWaalsContact CA-O 3.25Å; K735-Q740 WeakPolarHBondContact CA-O 3.43Å; K735-Y741 HydrophobicContact CB-CD1 4.19Å; K735-Y741 HydrophobicContact CB-CE1 4.31Å; K735-T786 VanDerWaalsContact CE-CB 3.45Å; K735-T786 HydrophobicContact CG-CG2 4.38Å; K735-T786 PolarHBondContact N-O 3.01Å; K735-T786 PolarHBondContact O-N 2.92Å; K735-Q788 HydrophobicContact CD-CG 4.4Å
736	T	92.7	Very high	87.9	Confident	9 Å²	9	48.4 Å²	48.4	6%	0.055	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	172	171.2	52.9	0	0	0	0	111.5	D738 G739 Q740 L742 L785	T736-D738 VanDerWaalsContact C-N 3.27Å; T736-D738 WeakPolarHBondContact CB-OD1 3.38Å; T736-D738 PolarHBondContact O-N 2.79Å; T736-D738 PolarHBondContact OG1-OD1 3Å; T736-G739 PolarHBondContact O-N 3.49Å; T736-Q740 PolarHBondContact N-O 3.27Å; T736-Q740 WeakPolarHBondContact OG1-CB 3.5Å; T736-Q740 PolarHBondContact OG1-N 3.44Å; T736-Q740 VanDerWaalsContact OG1-N 3.14Å; T736-Q740 PolarHBondContact OG1-O 3.08Å; T736-Q740 VanDerWaalsContact OG1-O 3.07Å; T736-L742 HydrophobicContact CG2-CD1 3.69Å; T736-L742 HydrophobicContact CG2-CD2 3.9Å; T736-L742 HydrophobicContact CG2-CG 3.77Å; T736-L785 HydrophobicContact CG2-CD2 4.15Å
737	A	88.8	Confident	88.9	Confident	83 Å²	83	45 Å²	45	69%	0.686	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-27.7	179.5	0	0	0	0	0	114.1	G739 P784	A737-G739 VanDerWaalsContact C-N 3.27Å; A737-P784 HydrophobicContact CB-CG 4.23Å
738	D	89.7	Confident	89.4	Confident	124 Å²	124	43.4 Å²	43.4	66%	0.663	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-0.6	173.5	61.2	-42	0	0	0	113.4	T736	T736-D738 VanDerWaalsContact C-N 3.27Å; T736-D738 WeakPolarHBondContact CB-OD1 3.38Å; T736-D738 PolarHBondContact O-N 2.79Å; T736-D738 PolarHBondContact OG1-OD1 3Å
739	G	87.6	Confident	89.8	Confident	41 Å²	41	46.3 Å²	46.3	42%	0.423	27%	0.272	S	S	.	.	S	Bend	trans	89.6	4.6	174.2	0	0	0	0	0	115.2	T736 A737	T736-G739 PolarHBondContact O-N 3.49Å; A737-G739 VanDerWaalsContact C-N 3.27Å
740	Q	91.1	Very high	89.9	Confident	120 Å²	120	46.8 Å²	46.8	56%	0.561	27%	0.273	S	S	*	.			trans	-73.2	130.9	174.6	-173.8	-179.3	-0	0	0	110.8	K735 T736	K735-Q740 CarbonylContact C-O 3.48Å; K735-Q740 VanDerWaalsContact CA-O 3.25Å; K735-Q740 WeakPolarHBondContact CA-O 3.43Å; T736-Q740 PolarHBondContact N-O 3.27Å; T736-Q740 WeakPolarHBondContact OG1-CB 3.5Å; T736-Q740 PolarHBondContact OG1-N 3.44Å; T736-Q740 VanDerWaalsContact OG1-N 3.14Å; T736-Q740 PolarHBondContact OG1-O 3.08Å; T736-Q740 VanDerWaalsContact OG1-O 3.07Å
741	Y	91.5	Very high	89.8	Confident	72 Å²	72	48.8 Å²	48.8	28%	0.282	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	126.9	175.7	-76	-87.1	0	0	0	111.7	Y702 A733 L734 K735 Q788	Y702-Y741 AromaticContact CD1-CE1 3.89Å; Y702-Y741 HydrophobicContact CD1-CE1 3.89Å; Y702-Y741 HydrophobicContact CE1-CD1 4.47Å; Y702-Y741 AromaticContact CE1-CE1 3.62Å; Y702-Y741 HydrophobicContact CE1-CE1 3.62Å; A733-Y741 HydrophobicContact CB-CE1 4.38Å; L734-Y741 CarbonylContact O-C 3.59Å; L734-Y741 WeakPolarHBondContact O-CA 3.48Å; K735-Y741 HydrophobicContact CB-CD1 4.19Å; K735-Y741 HydrophobicContact CB-CE1 4.31Å; Y741-Q788 PolarHBondContact OH-OE1 2.91Å; Y741-Q788 VanDerWaalsContact OH-OE1 3.12Å
742	L	91.1	Very high	89.6	Confident	45 Å²	45	53.6 Å²	53.6	24%	0.236	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-25	172	-58.4	-179.6	0	0	0	112.4	L734 T736 I756 V758 L785	L734-L742 HydrophobicContact CB-CB 4.48Å; L734-L742 HydrophobicContact CD2-CB 4.31Å; L734-L742 HydrophobicContact CD2-CD1 4.31Å; L734-L742 HydrophobicContact CG-CB 4.48Å; L734-L742 PolarHBondContact O-N 2.89Å; T736-L742 HydrophobicContact CG2-CD1 3.69Å; T736-L742 HydrophobicContact CG2-CD2 3.9Å; T736-L742 HydrophobicContact CG2-CG 3.77Å; L742-I756 HydrophobicContact CB-CG2 3.93Å; L742-I756 HydrophobicContact CD1-CG2 4.35Å; L742-V758 HydrophobicContact CD1-CG2 3.75Å; L742-L785 HydrophobicContact CD1-CD2 3.84Å
743	L	92.6	Very high	89.3	Confident	5 Å²	5	58 Å²	58	3%	0.026	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	136.2	178.3	177.3	69.2	0	0	0	109.8	A733 L734 G745 I756 Y765	A733-L743 WeakPolarHBondContact CA-O 3.42Å; L734-L743 HydrophobicContact CB-CB 3.74Å; L734-L743 PolarHBondContact N-O 3.45Å; L734-L743 PolarHBondContact O-N 2.8Å; L743-G745 VanDerWaalsContact C-N 3.33Å; L743-G745 PolarHBondContact O-N 3.35Å; L743-I756 HydrophobicContact CB-CD1 3.87Å; L743-I756 HydrophobicContact CD1-CD1 4.27Å; L743-I756 HydrophobicContact CD2-CD1 3.98Å; L743-I756 HydrophobicContact CG-CD1 4.24Å; L743-Y765 HydrophobicContact CD1-CD1 3.64Å; L743-Y765 HydrophobicContact CD1-CD2 4.47Å; L743-Y765 HydrophobicContact CD1-CE1 3.72Å; L743-Y765 HydrophobicContact CD1-CG 4.01Å; L743-Y765 HydrophobicContact CD2-CD1 4.27Å; L743-Y765 HydrophobicContact CD2-CD2 3.58Å; L743-Y765 HydrophobicContact CD2-CE1 4.4Å; L743-Y765 HydrophobicContact CD2-CE2 3.74Å; L743-Y765 HydrophobicContact CD2-CG 3.83Å
744	N	91	Very high	88.9	Confident	9 Å²	9	60.6 Å²	60.6	5%	0.048	35%	0.348	C	S	.	.	S	Bend	trans	50.7	43.1	171.3	-62.3	-12.4	0	0	0	115.2	Y702 L732 A733 A748 S750 Y765	Y702-N744 VanDerWaalsContact CE1-O 3.27Å; Y702-N744 WeakPolarHBondContact CE1-O 3.44Å; Y702-N744 PolarHBondContact OH-O 3.17Å; L732-N744 WeakPolarHBondContact O-CB 3.31Å; L732-N744 PolarHBondContact O-ND2 3.15Å; A733-N744 HydrophobicContact CB-CB 4.04Å; N744-A748 CarbonylContact C-O 3.56Å; N744-A748 WeakPolarHBondContact CA-O 3.25Å; N744-S750 WeakPolarHBondContact OD1-CB 3.49Å; N744-S750 PolarHBondContact OD1-N 2.98Å; N744-Y765 PolarHBondContact ND2-OH 3.26Å
745	G	87.6	Confident	88.5	Confident	14 Å²	14	60.9 Å²	60.9	14%	0.144	35%	0.349	C	S	.	.			trans	-84.4	164.8	172.7	0	0	0	0	0	113.4	Y702 L743 L747 A748	Y702-G745 VanDerWaalsContact OH-C 3.24Å; Y702-G745 WeakPolarHBondContact OH-CA 3.42Å; L743-G745 VanDerWaalsContact C-N 3.33Å; L743-G745 PolarHBondContact O-N 3.35Å; G745-L747 PolarHBondContact O-N 3.3Å; G745-L747 VanDerWaalsContact O-N 3.12Å; G745-A748 PolarHBondContact O-N 2.97Å
746	N	85.5	Confident	88.4	Confident	151 Å²	151	59.4 Å²	59.4	81%	0.807	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	32.3	177.3	-59.6	-25.6	0	0	0	114.4	Y702 A748	Y702-N746 PolarHBondContact OH-N 3.32Å; N746-A748 PolarHBondContact O-N 3.15Å; N746-A748 VanDerWaalsContact O-N 3.12Å
747	L	83.6	Confident	88.1	Confident	100 Å²	100	60.5 Å²	60.5	52%	0.524	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	11.4	-175.2	-50.4	174.9	0	0	0	115	Y702 G745 L790	Y702-L747 HydrophobicContact CE2-CD2 4.03Å; Y702-L747 PolarHBondContact OH-N 2.77Å; G745-L747 PolarHBondContact O-N 3.3Å; G745-L747 VanDerWaalsContact O-N 3.12Å; L747-L790 HydrophobicContact CD2-CD1 3.55Å; L747-L790 HydrophobicContact CD2-CD2 4.15Å; L747-L790 HydrophobicContact CD2-CG 4.48Å
748	A	85	Confident	88.1	Confident	65 Å²	65	56.7 Å²	56.7	54%	0.537	32%	0.317	S	S	.	.			trans	-87.1	121.2	174.8	0	0	0	0	0	109.8	N744 G745 N746	N744-A748 CarbonylContact C-O 3.56Å; N744-A748 WeakPolarHBondContact CA-O 3.25Å; G745-A748 PolarHBondContact O-N 2.97Å; N746-A748 PolarHBondContact O-N 3.15Å; N746-A748 VanDerWaalsContact O-N 3.12Å
749	I	87.4	Confident	87.9	Confident	64 Å²	64	56.7 Å²	56.7	33%	0.328	31%	0.311	S	S	.	.			trans	-105.3	129.1	-173.6	-60.1	156.3	0	0	0	110.3	Y731 A751 S768 L790	Y731-I749 HydrophobicContact CD1-CG2 3.81Å; Y731-I749 HydrophobicContact CD2-CD1 3.44Å; Y731-I749 VanDerWaalsContact CD2-CD1 3.44Å; Y731-I749 HydrophobicContact CD2-CG1 4Å; Y731-I749 HydrophobicContact CE1-CD1 4.48Å; Y731-I749 HydrophobicContact CE1-CG2 4.15Å; Y731-I749 HydrophobicContact CE2-CD1 3.38Å; Y731-I749 HydrophobicContact CE2-CG1 4.39Å; Y731-I749 HydrophobicContact CG-CD1 4.04Å; Y731-I749 HydrophobicContact CG-CG1 4.18Å; Y731-I749 HydrophobicContact CG-CG2 3.97Å; I749-A751 PolarHBondContact O-N 3.21Å; I749-S768 WeakPolarHBondContact CG2-OG 3.49Å; I749-L790 HydrophobicContact CG1-CD2 4.31Å
750	S	86.6	Confident	87.6	Confident	23 Å²	23	55.8 Å²	55.8	16%	0.161	30%	0.302	C	S	.	.			trans	-83.9	109.5	175.5	-170.2	0	0	0	0	110.8	N744 Q754 Y765 S768	N744-S750 WeakPolarHBondContact OD1-CB 3.49Å; N744-S750 PolarHBondContact OD1-N 2.98Å; S750-Q754 PolarHBondContact OG-OE1 3.3Å; S750-Y765 WeakPolarHBondContact O-CE1 3.16Å; S750-Y765 PolarHBondContact O-OH 3.11Å; S750-S768 PolarHBondContact O-N 3.48Å; S750-S768 PolarHBondContact O-OG 2.68Å
751	A	85.9	Confident	87.3	Confident	44 Å²	44	50.9 Å²	50.9	36%	0.364	28%	0.28	S	S	.	.			trans	-73.3	-25.5	-178.6	0	0	0	0	0	113.7	I749 S768 I769	I749-A751 PolarHBondContact O-N 3.21Å; A751-S768 WeakPolarHBondContact CA-OG 3.35Å; A751-I769 HydrophobicContact CB-CG2 3.84Å; A751-I769 WeakPolarHBondContact O-CD1 3.4Å; A751-I769 WeakPolarHBondContact O-CG1 3.31Å; A751-I769 PolarHBondContact O-N 2.99Å
752	I	85.8	Confident	87.2	Confident	118 Å²	118	48.2 Å²	48.2	61%	0.605	27%	0.271	S	S	*	.	S	Bend	trans	-111.9	164.6	-167.4	58.8	169	0	0	0	112.5	Q754 G767	I752-Q754 PolarHBondContact O-N 3.26Å; I752-G767 VanDerWaalsContact O-CA 3.25Å; I752-G767 WeakPolarHBondContact O-CA 3.4Å
753	E	88.1	Confident	87.2	Confident	91 Å²	91	46.2 Å²	46.2	43%	0.425	26%	0.26	S	S	.	.			trans	-58.4	132.9	173.3	-171.2	-175.3	-168.5	0	0	111	A614 Y765	A614-E753 HydrophobicContact CB-CB 4.46Å; A614-E753 HydrophobicContact CB-CG 4.09Å; E753-Y765 CarbonylContact C-O 3.51Å; E753-Y765 VanDerWaalsContact CA-O 3.28Å; E753-Y765 WeakPolarHBondContact CA-O 3.09Å; E753-Y765 WeakPolarHBondContact CG-O 3.45Å
754	Q	86.4	Confident	87.2	Confident	57 Å²	57	47.2 Å²	47.2	27%	0.266	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.3	-176	-171.4	172	-8.3	0	0	112	S750 I752 Y765	S750-Q754 PolarHBondContact OG-OE1 3.3Å; I752-Q754 PolarHBondContact O-N 3.26Å; Q754-Y765 HydrophobicContact CB-CD1 4.29Å; Q754-Y765 PolarHBondContact N-O 3.03Å; Q754-Y765 PolarHBondContact O-N 2.82Å
755	D	87.8	Confident	87.2	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.032	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	115.9	169.2	-64.5	-44	0	0	0	109.4	Y613 A614 R627 I762	Y613-D755 WeakPolarHBondContact CA-OD2 3.24Å; Y613-D755 WeakPolarHBondContact CB-OD2 3.43Å; Y613-D755 PolarHBondContact N-OD2 3.46Å; A614-D755 PolarHBondContact N-OD2 2.77Å; R627-D755 PolarHBondContact NH2-O 3.15Å; D755-I762 HydrophobicContact CB-CG2 3.8Å
756	I	89.6	Confident	87.4	Confident	7 Å²	7	48 Å²	48	4%	0.036	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	112.9	178.7	-56.5	162.1	0	0	0	108.7	L734 L742 L743 V758 I762 L763 L775	L734-I756 HydrophobicContact CD2-CD1 4.18Å; L734-I756 HydrophobicContact CD2-CG2 4.2Å; L742-I756 HydrophobicContact CB-CG2 3.93Å; L742-I756 HydrophobicContact CD1-CG2 4.35Å; L743-I756 HydrophobicContact CB-CD1 3.87Å; L743-I756 HydrophobicContact CD1-CD1 4.27Å; L743-I756 HydrophobicContact CD2-CD1 3.98Å; L743-I756 HydrophobicContact CG-CD1 4.24Å; I756-V758 HydrophobicContact CG2-CG2 4.21Å; I756-I762 CarbonylContact O-C 3.5Å; I756-I762 WeakPolarHBondContact O-CA 3.29Å; I756-L763 HydrophobicContact CB-CB 4.29Å; I756-L763 PolarHBondContact N-O 3.07Å; I756-L763 PolarHBondContact O-N 2.99Å; I756-L775 HydrophobicContact CD1-CD1 3.76Å
757	L	87.9	Confident	87.6	Confident	31 Å²	31	40.8 Å²	40.8	16%	0.162	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.4	-176.5	-176.8	66.8	0	0	0	111.1	E588 V610 I762	E588-L757 WeakPolarHBondContact OE1-CD2 3.27Å; V610-L757 HydrophobicContact CB-CD2 4.3Å; V610-L757 HydrophobicContact CG1-CD2 3.98Å; L757-I762 HydrophobicContact CD1-CD1 4.43Å; L757-I762 HydrophobicContact CD1-CG1 3.8Å
758	V	88.7	Confident	87.8	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.024	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	100.8	-179	-173	0	0	0	0	108.5	L742 I756 G760 T761 L763 P782 E783 L785	L742-V758 HydrophobicContact CD1-CG2 3.75Å; I756-V758 HydrophobicContact CG2-CG2 4.21Å; V758-G760 PolarHBondContact O-N 2.78Å; V758-T761 PolarHBondContact N-O 2.96Å; V758-T761 WeakPolarHBondContact O-CA 3.42Å; V758-T761 WeakPolarHBondContact O-CB 3.23Å; V758-T761 PolarHBondContact O-N 2.62Å; V758-L763 HydrophobicContact CB-CD1 4.19Å; V758-L763 HydrophobicContact CG2-CD1 3.65Å; V758-P782 HydrophobicContact CG1-CG 4.09Å; V758-P782 WeakPolarHBondContact O-CG 3.43Å; V758-E783 HydrophobicContact CG1-CG 3.9Å; V758-E783 WeakPolarHBondContact CG1-OE1 3.42Å; V758-L785 HydrophobicContact CG1-CD1 4.34Å; V758-L785 HydrophobicContact CG1-CD2 4.37Å; V758-L785 HydrophobicContact CG2-CD1 4.13Å
759	K	85.4	Confident	87.8	Confident	123 Å²	123	38.9 Å²	38.9	54%	0.535	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	38.1	60.2	179.4	-67.4	177.6	174.5	163.6	0	113.7	G583 T761 P782 E783	G583-K759 CarbonylContact O-C 3.57Å; G583-K759 WeakPolarHBondContact O-CA 3.13Å; K759-T761 PolarHBondContact O-N 3.31Å; K759-P782 HydrophobicContact CB-CB 4.01Å; K759-P782 HydrophobicContact CB-CG 3.76Å; K759-E783 VanDerWaalsContact CE-OE2 3.23Å; K759-E783 WeakPolarHBondContact CE-OE2 3.39Å; K759-E783 IonicContact NZ-OE2 3.91Å; K759-E783 PolarHBondContact NZ-OE2 3.3Å
760	G	79.9	Confident	87.6	Confident	23 Å²	23	37.2 Å²	37.2	24%	0.237	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-11	178.6	0	0	0	0	0	115.7	G583 V758	G583-G760 PolarHBondContact O-N 3.01Å; V758-G760 PolarHBondContact O-N 2.78Å
761	T	86.8	Confident	87.3	Confident	17 Å²	17	42 Å²	42	10%	0.104	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	142.1	172.1	-63.5	0	0	0	0	110.7	V758 K759 R779 P780	V758-T761 PolarHBondContact N-O 2.96Å; V758-T761 WeakPolarHBondContact O-CA 3.42Å; V758-T761 WeakPolarHBondContact O-CB 3.23Å; V758-T761 PolarHBondContact O-N 2.62Å; K759-T761 PolarHBondContact O-N 3.31Å; T761-R779 HydrophobicContact CG2-CB 4.18Å; T761-P780 PolarHBondContact OG1-O 2.85Å
762	I	89	Confident	87.5	Confident	16 Å²	16	42.1 Å²	42.1	8%	0.082	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.9	178.7	-62	174.7	0	0	0	109.4	Y613 P649 D755 I756 L757	Y613-I762 HydrophobicContact CD2-CD1 3.87Å; Y613-I762 HydrophobicContact CE2-CD1 3.29Å; P649-I762 HydrophobicContact CB-CB 3.75Å; P649-I762 HydrophobicContact CB-CD1 4.21Å; P649-I762 HydrophobicContact CB-CG1 4.42Å; P649-I762 HydrophobicContact CB-CG2 4.25Å; P649-I762 HydrophobicContact CG-CB 4.09Å; P649-I762 HydrophobicContact CG-CD1 4.34Å; P649-I762 HydrophobicContact CG-CG2 4.03Å; D755-I762 HydrophobicContact CB-CG2 3.8Å; I756-I762 CarbonylContact O-C 3.5Å; I756-I762 WeakPolarHBondContact O-CA 3.29Å; L757-I762 HydrophobicContact CD1-CD1 4.43Å; L757-I762 HydrophobicContact CD1-CG1 3.8Å
763	L	91.6	Very high	87.8	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.5	166.7	-64.3	84.5	0	0	0	108.4	L734 I756 V758 L775 Q776 L781 L785	L734-L763 HydrophobicContact CD2-CD2 4.18Å; I756-L763 HydrophobicContact CB-CB 4.29Å; I756-L763 PolarHBondContact N-O 3.07Å; I756-L763 PolarHBondContact O-N 2.99Å; V758-L763 HydrophobicContact CB-CD1 4.19Å; V758-L763 HydrophobicContact CG2-CD1 3.65Å; L763-L775 HydrophobicContact CB-CD1 3.92Å; L763-L775 HydrophobicContact CD2-CD1 4.19Å; L763-L775 HydrophobicContact CD2-CD2 4.11Å; L763-L775 HydrophobicContact CD2-CG 4.16Å; L763-Q776 WeakPolarHBondContact CA-O 3.41Å; L763-L781 HydrophobicContact CD1-CD1 4.16Å; L763-L785 HydrophobicContact CD1-CD1 4.08Å; L763-L785 HydrophobicContact CD2-CD1 4.09Å
764	K	91	Very high	88.1	Confident	26 Å²	26	35.9 Å²	35.9	11%	0.113	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	128.6	174.8	-72.2	-164.2	179	-177.6	0	110.4	E650 L775 Q776	E650-K764 VanDerWaalsContact CD-NZ 3.26Å; E650-K764 IonicContact OE1-NZ 3.05Å; E650-K764 VanDerWaalsContact OE2-CE 3.22Å; E650-K764 WeakPolarHBondContact OE2-CE 3.4Å; E650-K764 IonicContact OE2-NZ 3.36Å; E650-K764 PolarHBondContact OE2-NZ 3.1Å; K764-L775 WeakPolarHBondContact O-CA 3.24Å; K764-Q776 HydrophobicContact CB-CG 3.94Å; K764-Q776 PolarHBondContact N-O 2.99Å; K764-Q776 PolarHBondContact O-N 3.22Å
765	Y	92.6	Very high	88.5	Confident	1 Å²	1	33.2 Å²	33.2	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	130	172.8	173.7	-113.5	0	0	0	110	L732 L743 N744 S750 E753 Q754 G767 S768 E773 R774	L732-Y765 HydrophobicContact CB-CE2 4.4Å; L743-Y765 HydrophobicContact CD1-CD1 3.64Å; L743-Y765 HydrophobicContact CD1-CD2 4.47Å; L743-Y765 HydrophobicContact CD1-CE1 3.72Å; L743-Y765 HydrophobicContact CD1-CG 4.01Å; L743-Y765 HydrophobicContact CD2-CD1 4.27Å; L743-Y765 HydrophobicContact CD2-CD2 3.58Å; L743-Y765 HydrophobicContact CD2-CE1 4.4Å; L743-Y765 HydrophobicContact CD2-CE2 3.74Å; L743-Y765 HydrophobicContact CD2-CG 3.83Å; N744-Y765 PolarHBondContact ND2-OH 3.26Å; S750-Y765 WeakPolarHBondContact O-CE1 3.16Å; S750-Y765 PolarHBondContact O-OH 3.11Å; E753-Y765 CarbonylContact C-O 3.51Å; E753-Y765 VanDerWaalsContact CA-O 3.28Å; E753-Y765 WeakPolarHBondContact CA-O 3.09Å; E753-Y765 WeakPolarHBondContact CG-O 3.45Å; Q754-Y765 HydrophobicContact CB-CD1 4.29Å; Q754-Y765 PolarHBondContact N-O 3.03Å; Q754-Y765 PolarHBondContact O-N 2.82Å; Y765-G767 VanDerWaalsContact C-N 3.31Å; Y765-G767 PolarHBondContact O-N 2.75Å; Y765-S768 PolarHBondContact OH-N 3.07Å; Y765-E773 HydrophobicContact CE2-CG 3.49Å; Y765-E773 VanDerWaalsContact CE2-CG 3.49Å; Y765-E773 WeakPolarHBondContact CE2-OE1 3.5Å; Y765-E773 VanDerWaalsContact CZ-OE1 3.25Å; Y765-E773 PolarHBondContact OH-OE1 2.74Å; Y765-R774 WeakPolarHBondContact CA-O 3.43Å
766	S	90.8	Very high	88.8	Confident	38 Å²	38	35.2 Å²	35.2	27%	0.266	19%	0.19	S	C	.	.			trans	-77.3	-9.3	-174.7	63.1	0	0	0	0	115.5	L772 E773 R774	S766-L772 PolarHBondContact OG-O 2.96Å; S766-E773 WeakPolarHBondContact OG-CA 3.08Å; S766-R774 PolarHBondContact N-O 3.44Å; S766-R774 PolarHBondContact OG-N 3.04Å
767	G	90	Very high	88.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.19	C	C	.	.			trans	87.4	151.7	-169.3	0	0	0	0	0	112.8	I752 Y765 A770	I752-G767 VanDerWaalsContact O-CA 3.25Å; I752-G767 WeakPolarHBondContact O-CA 3.4Å; Y765-G767 VanDerWaalsContact C-N 3.31Å; Y765-G767 PolarHBondContact O-N 2.75Å; G767-A770 WeakPolarHBondContact O-CB 3.37Å; G767-A770 PolarHBondContact O-N 3.19Å
768	S	87.6	Confident	88.8	Confident	9 Å²	9	37.7 Å²	37.7	6%	0.063	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-20.9	-179.6	64.8	0	0	0	0	114.5	I749 S750 A751 Y765 A770	I749-S768 WeakPolarHBondContact CG2-OG 3.49Å; S750-S768 PolarHBondContact O-N 3.48Å; S750-S768 PolarHBondContact O-OG 2.68Å; A751-S768 WeakPolarHBondContact CA-OG 3.35Å; Y765-S768 PolarHBondContact OH-N 3.07Å; S768-A770 PolarHBondContact O-N 3.36Å
769	I	84.1	Confident	88.7	Confident	117 Å²	117	41.6 Å²	41.6	60%	0.6	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-12.9	177	72.3	-171.1	0	0	0	112.5	A751	A751-I769 HydrophobicContact CB-CG2 3.84Å; A751-I769 WeakPolarHBondContact O-CD1 3.4Å; A751-I769 WeakPolarHBondContact O-CG1 3.31Å; A751-I769 PolarHBondContact O-N 2.99Å
770	A	83.4	Confident	88.9	Confident	29 Å²	29	38.4 Å²	38.4	24%	0.24	21%	0.207	C	C	.	.	S	Bend	trans	-69.9	133	177.2	0	0	0	0	0	109.5	G767 S768 L772 E773	G767-A770 WeakPolarHBondContact O-CB 3.37Å; G767-A770 PolarHBondContact O-N 3.19Å; S768-A770 PolarHBondContact O-N 3.36Å; A770-L772 PolarHBondContact O-N 3.09Å; A770-E773 PolarHBondContact O-N 2.78Å
771	T	81.8	Confident	89.5	Confident	123 Å²	123	37.5 Å²	37.5	76%	0.755	20%	0.196	S	C	*	.	S	Bend	trans	-55.3	-27	176.1	55.1	0	0	0	0	113.5	S721	S721-T771 PolarHBondContact N-O 3.42Å
772	L	88.8	Confident	89.7	Confident	47 Å²	47	39.3 Å²	39.3	25%	0.246	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	97.5	168.6	-179.5	67.4	0	0	0	108.1	K718 R720 S766 A770 R774	K718-L772 HydrophobicContact CB-CD1 3.87Å; K718-L772 HydrophobicContact CD-CD1 4.42Å; K718-L772 HydrophobicContact CD-CD2 4.3Å; K718-L772 HydrophobicContact CG-CD1 4.11Å; K718-L772 HydrophobicContact CG-CD2 4.38Å; K718-L772 HydrophobicContact CG-CG 4.46Å; R720-L772 HydrophobicContact CB-CD1 4.1Å; S766-L772 PolarHBondContact OG-O 2.96Å; A770-L772 PolarHBondContact O-N 3.09Å; L772-R774 PolarHBondContact O-N 3.42Å
773	E	92.4	Very high	89.8	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.009	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	122	169.8	-171.3	-172.2	-163.4	0	0	108.7	K718 Q719 Y731 L732 Y765 S766 A770	K718-E773 CarbonylContact C-O 3.44Å; K718-E773 WeakPolarHBondContact CA-O 3.36Å; Q719-E773 HydrophobicContact CB-CB 4.19Å; Q719-E773 PolarHBondContact N-O 2.74Å; Q719-E773 PolarHBondContact O-N 3.43Å; Q719-E773 VanDerWaalsContact O-O 3.12Å; Y731-E773 WeakPolarHBondContact CA-OE2 3.47Å; L732-E773 HydrophobicContact CB-CG 4.44Å; L732-E773 HydrophobicContact CD1-CG 4.05Å; L732-E773 HydrophobicContact CG-CG 4.19Å; L732-E773 PolarHBondContact N-OE1 3.44Å; L732-E773 PolarHBondContact N-OE2 2.92Å; Y765-E773 HydrophobicContact CE2-CG 3.49Å; Y765-E773 VanDerWaalsContact CE2-CG 3.49Å; Y765-E773 WeakPolarHBondContact CE2-OE1 3.5Å; Y765-E773 VanDerWaalsContact CZ-OE1 3.25Å; Y765-E773 PolarHBondContact OH-OE1 2.74Å; S766-E773 WeakPolarHBondContact OG-CA 3.08Å; A770-E773 PolarHBondContact O-N 2.78Å
774	R	94	Very high	89.9	Confident	76 Å²	76	43 Å²	43	29%	0.287	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	131.4	-169.3	-170.7	176.4	-173.2	-171.9	-3.9	111.5	D716 V717 K718 Y765 S766 L772	D716-R774 VanDerWaalsContact CG-NH2 3.25Å; D716-R774 IonicContact OD1-CZ 3.95Å; D716-R774 IonicContact OD1-NE 3.21Å; D716-R774 PolarHBondContact OD1-NE 2.91Å; D716-R774 IonicContact OD1-NH2 3.15Å; D716-R774 PolarHBondContact OD1-NH2 3.09Å; D716-R774 IonicContact OD2-CZ 2.92Å; D716-R774 IonicContact OD2-NH2 2.7Å; D716-R774 PolarHBondContact OD2-NH2 3.03Å; D716-R774 VanDerWaalsContact OD2-NH2 3.15Å; V717-R774 CarbonylContact O-C 3.45Å; V717-R774 VanDerWaalsContact O-CA 3.3Å; V717-R774 WeakPolarHBondContact O-CA 3.17Å; K718-R774 HydrophobicContact CG-CG 3.99Å; Y765-R774 WeakPolarHBondContact CA-O 3.43Å; S766-R774 PolarHBondContact N-O 3.44Å; S766-R774 PolarHBondContact OG-N 3.04Å; L772-R774 PolarHBondContact O-N 3.42Å
775	L	94.9	Very high	90.1	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.6	168.8	-176	71.9	0	0	0	108.8	V717 L732 L734 I756 L763 K764 V787	V717-L775 HydrophobicContact CB-CB 4.24Å; V717-L775 PolarHBondContact N-O 3.5Å; V717-L775 PolarHBondContact O-N 3.26Å; L732-L775 HydrophobicContact CD1-CB 4.34Å; L734-L775 HydrophobicContact CD1-CD2 3.97Å; L734-L775 HydrophobicContact CD2-CD2 4.26Å; I756-L775 HydrophobicContact CD1-CD1 3.76Å; L763-L775 HydrophobicContact CB-CD1 3.92Å; L763-L775 HydrophobicContact CD2-CD1 4.19Å; L763-L775 HydrophobicContact CD2-CD2 4.11Å; L763-L775 HydrophobicContact CD2-CG 4.16Å; K764-L775 WeakPolarHBondContact O-CA 3.24Å; L775-V787 HydrophobicContact CD2-CG2 4.46Å
776	Q	93.6	Very high	90.2	Very high	47 Å²	47	42.4 Å²	42.4	22%	0.22	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	145.3	-176.2	65.6	-177.6	-10.1	0	0	114.2	I715 L763 K764	I715-Q776 CarbonylContact O-C 3.55Å; I715-Q776 VanDerWaalsContact O-CA 3.22Å; I715-Q776 WeakPolarHBondContact O-CA 3.46Å; L763-Q776 WeakPolarHBondContact CA-O 3.41Å; K764-Q776 HydrophobicContact CB-CG 3.94Å; K764-Q776 PolarHBondContact N-O 2.99Å; K764-Q776 PolarHBondContact O-N 3.22Å
777	S	91.4	Very high	90.4	Very high	5 Å²	5	40.7 Å²	40.7	4%	0.035	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	140.5	169.1	175.2	0	0	0	0	111.1	N714 I715 R779	N714-S777 CarbonylContact C-O 3.59Å; N714-S777 VanDerWaalsContact CA-O 3.28Å; N714-S777 WeakPolarHBondContact CA-O 3.48Å; N714-S777 PolarHBondContact N-O 2.82Å; I715-S777 PolarHBondContact N-O 3.34Å; I715-S777 PolarHBondContact O-N 3.28Å; S777-R779 PolarHBondContact OG-N 2.89Å; S777-R779 PolarHBondContact OG-O 2.87Å
778	F	86.3	Confident	90.6	Very high	86 Å²	86	41 Å²	41	38%	0.377	22%	0.218	S	C	.	.			trans	-99.8	-21.7	178.6	-60.4	-84.9	0	0	0	113	E650 N714	E650-F778 HydrophobicContact CB-CD2 3.77Å; E650-F778 HydrophobicContact CB-CE2 3.67Å; N714-F778 WeakPolarHBondContact OD1-CD1 3.32Å
779	R	87.2	Confident	90.8	Very high	85 Å²	85	40.6 Å²	40.6	32%	0.321	22%	0.215	S	C	.	.	S	Bend	trans	-86.3	155.1	-176.3	-63.7	-70.7	-73	-133.3	2.8	111	T761 S777 L781	T761-R779 HydrophobicContact CG2-CB 4.18Å; S777-R779 PolarHBondContact OG-N 2.89Å; S777-R779 PolarHBondContact OG-O 2.87Å; R779-L781 PolarHBondContact O-N 3.35Å
780	P	89.9	Confident	91.1	Very high	56 Å²	56	35 Å²	35	36%	0.364	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-58.1	133.4	173.4	-21.1	31.1	0	0	0	111.2	A712 T713 T761	A712-P780 WeakPolarHBondContact O-CA 3.42Å; T713-P780 HydrophobicContact CG2-CB 3.92Å; T713-P780 HydrophobicContact CG2-CG 3.65Å; T761-P780 PolarHBondContact OG1-O 2.85Å
781	L	91.9	Very high	91.3	Very high	4 Å²	4	34 Å²	34	2%	0.021	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-73.5	129.8	-180	-166.2	70	0	0	0	110.9	I708 A710 G711 A712 I715 L763 R779 E783 L785	I708-L781 HydrophobicContact CB-CD2 4.31Å; I708-L781 HydrophobicContact CG2-CD2 3.99Å; A710-L781 CarbonylContact C-O 3.57Å; A710-L781 WeakPolarHBondContact CA-O 3.33Å; G711-L781 PolarHBondContact N-O 2.69Å; A712-L781 PolarHBondContact O-N 3.41Å; I715-L781 HydrophobicContact CD1-CB 4.22Å; I715-L781 HydrophobicContact CD1-CD1 4.27Å; I715-L781 HydrophobicContact CD1-CD2 4.31Å; L763-L781 HydrophobicContact CD1-CD1 4.16Å; R779-L781 PolarHBondContact O-N 3.35Å; L781-E783 WeakPolarHBondContact CD2-O 3.35Å; L781-E783 WeakPolarHBondContact CG-O 3.23Å; L781-L785 HydrophobicContact CD1-CD1 3.59Å; L781-L785 HydrophobicContact CD1-CG 4.22Å; L781-L785 HydrophobicContact CD2-CB 4.13Å; L781-L785 HydrophobicContact CD2-CD1 4.1Å; L781-L785 HydrophobicContact CD2-CG 3.94Å; L781-L785 HydrophobicContact CG-CD1 4.35Å; L781-L785 HydrophobicContact CG-CG 4.47Å
782	P	90.6	Very high	91.4	Very high	55 Å²	55	30 Å²	30	36%	0.357	15%	0.152	S	C	.	.	S	Bend	trans	-78.4	-23.1	-175.3	28.7	-33.3	0	0	0	113.6	V758 K759	V758-P782 HydrophobicContact CG1-CG 4.09Å; V758-P782 WeakPolarHBondContact O-CG 3.43Å; K759-P782 HydrophobicContact CB-CB 4.01Å; K759-P782 HydrophobicContact CB-CG 3.76Å
783	E	91.7	Very high	90.5	Very high	46 Å²	46	32.4 Å²	32.4	22%	0.215	17%	0.171	C	C	.	.	S	Bend	trans	-148.6	154.4	-179.5	68.4	-170.7	168.9	0	0	110.5	V758 K759 L781	V758-E783 HydrophobicContact CG1-CG 3.9Å; V758-E783 WeakPolarHBondContact CG1-OE1 3.42Å; K759-E783 VanDerWaalsContact CE-OE2 3.23Å; K759-E783 WeakPolarHBondContact CE-OE2 3.39Å; K759-E783 IonicContact NZ-OE2 3.91Å; K759-E783 PolarHBondContact NZ-OE2 3.3Å; L781-E783 WeakPolarHBondContact CD2-O 3.35Å; L781-E783 WeakPolarHBondContact CG-O 3.23Å
784	P	93.6	Very high	89.1	Confident	51 Å²	51	35 Å²	35	33%	0.331	20%	0.198	S	C	.	.			trans	-66.2	137.5	-178.4	26.6	-33.7	0	0	0	112	T707 I708 A737	T707-P784 HydrophobicContact CG2-CB 4.36Å; I708-P784 CarbonylContact O-C 3.52Å; I708-P784 WeakPolarHBondContact O-CA 3.37Å; A737-P784 HydrophobicContact CB-CG 4.23Å
785	L	95.7	Very high	87.4	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.6	178.2	-65	178.8	0	0	0	110.7	T707 I708 L734 T736 L742 V758 L763 L781	T707-L785 CarbonylContact C-O 3.31Å; T707-L785 WeakPolarHBondContact CA-O 3.2Å; I708-L785 PolarHBondContact N-O 2.74Å; I708-L785 PolarHBondContact O-N 2.57Å; L734-L785 HydrophobicContact CD1-CB 4.02Å; L734-L785 HydrophobicContact CD1-CD1 4.36Å; L734-L785 HydrophobicContact CD2-CD1 4.15Å; L734-L785 HydrophobicContact CG-CD1 4.48Å; T736-L785 HydrophobicContact CG2-CD2 4.15Å; L742-L785 HydrophobicContact CD1-CD2 3.84Å; V758-L785 HydrophobicContact CG1-CD1 4.34Å; V758-L785 HydrophobicContact CG1-CD2 4.37Å; V758-L785 HydrophobicContact CG2-CD1 4.13Å; L763-L785 HydrophobicContact CD1-CD1 4.08Å; L763-L785 HydrophobicContact CD2-CD1 4.09Å; L781-L785 HydrophobicContact CD1-CD1 3.59Å; L781-L785 HydrophobicContact CD1-CG 4.22Å; L781-L785 HydrophobicContact CD2-CB 4.13Å; L781-L785 HydrophobicContact CD2-CD1 4.1Å; L781-L785 HydrophobicContact CD2-CG 3.94Å; L781-L785 HydrophobicContact CG-CD1 4.35Å; L781-L785 HydrophobicContact CG-CG 4.47Å
786	T	95.1	Very high	85.7	Confident	12 Å²	12	44.2 Å²	44.2	7%	0.074	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.6	175.3	-55.2	0	0	0	0	110.3	D704 T707 K735 Q788	D704-T786 HydrophobicContact CB-CG2 4.43Å; T707-T786 PolarHBondContact OG1-OG1 3.07Å; K735-T786 VanDerWaalsContact CE-CB 3.45Å; K735-T786 HydrophobicContact CG-CG2 4.38Å; K735-T786 PolarHBondContact N-O 3.01Å; K735-T786 PolarHBondContact O-N 2.92Å; T786-Q788 HydrophobicContact CG2-CG 4.31Å
787	V	95.3	Very high	84.7	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.2	174.5	-165.4	0	0	0	0	108.1	I705 V706 I708 V717 L734 L775	I705-V787 WeakPolarHBondContact CB-O 3.3Å; I705-V787 HydrophobicContact CD1-CG1 3.92Å; I705-V787 PolarHBondContact N-O 3.46Å; V706-V787 HydrophobicContact CG1-CB 4.41Å; V706-V787 HydrophobicContact CG1-CG2 4.36Å; V706-V787 PolarHBondContact N-O 2.96Å; V706-V787 PolarHBondContact O-N 3.13Å; I708-V787 HydrophobicContact CD1-CG2 3.78Å; I708-V787 HydrophobicContact CG1-CG2 4.25Å; V717-V787 HydrophobicContact CG1-CG1 4.17Å; V717-V787 HydrophobicContact CG2-CG1 4.37Å; V717-V787 HydrophobicContact CG2-CG2 4.32Å; L734-V787 HydrophobicContact CD1-CG2 3.93Å; L775-V787 HydrophobicContact CD2-CG2 4.46Å
788	Q	93.3	Very high	84.1	Confident	7 Å²	7	47.7 Å²	47.7	3%	0.033	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	158.9	179.1	-64.2	-177.8	-63.4	0	0	110.9	Y702 N703 D704 I705 A733 K735 Y741 T786	Y702-Q788 HydrophobicContact CD1-CB 4.42Å; N703-Q788 CarbonylContact O-C 3.23Å; N703-Q788 WeakPolarHBondContact O-CA 3.48Å; N703-Q788 WeakPolarHBondContact O-CB 3.02Å; D704-Q788 VanDerWaalsContact OD1-CG 3.31Å; D704-Q788 WeakPolarHBondContact OD1-CG 3.23Å; D704-Q788 PolarHBondContact OD1-NE2 3.42Å; I705-Q788 VanDerWaalsContact CD1-C 3.47Å; A733-Q788 HydrophobicContact CB-CB 4.19Å; A733-Q788 PolarHBondContact N-O 3.26Å; A733-Q788 PolarHBondContact O-N 2.9Å; K735-Q788 HydrophobicContact CD-CG 4.4Å; Y741-Q788 PolarHBondContact OH-OE1 2.91Å; Y741-Q788 VanDerWaalsContact OH-OE1 3.12Å; T786-Q788 HydrophobicContact CG2-CG 4.31Å
789	L	91.8	Very high	83.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.2	166.8	-167	68.2	0	0	0	109.2	T698 N703 I705 Q719 N730 L732 P799 V801	T698-L789 HydrophobicContact CG2-CD2 3.74Å; N703-L789 PolarHBondContact N-O 2.66Å; N703-L789 PolarHBondContact ND2-O 3.02Å; N703-L789 PolarHBondContact O-N 3.22Å; I705-L789 HydrophobicContact CD1-CB 4Å; I705-L789 HydrophobicContact CG1-CB 4.18Å; Q719-L789 HydrophobicContact CG-CD1 4.46Å; N730-L789 HydrophobicContact CB-CD1 4.25Å; N730-L789 HydrophobicContact CB-CD2 4.4Å; N730-L789 HydrophobicContact CB-CG 4.5Å; L732-L789 HydrophobicContact CD2-CD1 4.25Å; L789-P799 HydrophobicContact CD2-CB 3.3Å; L789-P799 HydrophobicContact CD2-CG 3.76Å; L789-V801 HydrophobicContact CD1-CG2 3.84Å; L789-V801 HydrophobicContact CD2-CG2 3.85Å; L789-V801 HydrophobicContact CG-CG2 4.39Å
790	L	90.1	Very high	83.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	114.7	169.1	173.8	59.5	0	0	0	109.1	Y702 N730 Y731 L747 I749 V792	Y702-L790 HydrophobicContact CD1-CB 4.06Å; Y702-L790 HydrophobicContact CD1-CD1 4.26Å; Y702-L790 HydrophobicContact CD2-CD1 4.12Å; Y702-L790 HydrophobicContact CE1-CB 3.88Å; Y702-L790 HydrophobicContact CE1-CD1 4.08Å; Y702-L790 HydrophobicContact CE1-CD2 4.25Å; Y702-L790 HydrophobicContact CE1-CG 4.28Å; Y702-L790 HydrophobicContact CE2-CD1 3.94Å; Y702-L790 HydrophobicContact CG-CD1 4.28Å; N730-L790 WeakPolarHBondContact CA-O 3.31Å; Y731-L790 PolarHBondContact N-O 3.08Å; Y731-L790 PolarHBondContact O-N 3.29Å; L747-L790 HydrophobicContact CD2-CD1 3.55Å; L747-L790 HydrophobicContact CD2-CD2 4.15Å; L747-L790 HydrophobicContact CD2-CG 4.48Å; I749-L790 HydrophobicContact CG1-CD2 4.31Å; L790-V792 HydrophobicContact CD1-CG1 4.38Å; L790-V792 HydrophobicContact CD2-CG1 4.26Å; L790-V792 HydrophobicContact CG-CG1 4.07Å
791	T	87.9	Confident	84	Confident	8 Å²	8	41.7 Å²	41.7	5%	0.049	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	114.5	172	-60.4	0	0	0	0	109.1	T698 G701 G729 N730	T698-T791 PolarHBondContact OG1-OG1 3.2Å; T698-T791 VanDerWaalsContact OG1-OG1 3.12Å; G701-T791 PolarHBondContact N-O 3.21Å; G701-T791 PolarHBondContact O-N 3.1Å; G729-T791 WeakPolarHBondContact O-CA 3.33Å; N730-T791 PolarHBondContact OD1-OG1 3.41Å
792	V	84.3	Confident	84.1	Confident	39 Å²	39	48.4 Å²	48.4	24%	0.236	27%	0.273	C	S	.	.			trans	-92	159.1	179.9	-62.8	0	0	0	0	111.5	G729 Y731 L790	G729-V792 WeakPolarHBondContact O-CG2 3.27Å; G729-V792 PolarHBondContact O-N 3.41Å; Y731-V792 HydrophobicContact CE2-CG1 4.47Å; Y731-V792 HydrophobicContact CE2-CG2 3.9Å; L790-V792 HydrophobicContact CD1-CG1 4.38Å; L790-V792 HydrophobicContact CD2-CG1 4.26Å; L790-V792 HydrophobicContact CG-CG1 4.07Å
793	P	69.3	Low	84.3	Confident	98 Å²	98	46.9 Å²	46.9	64%	0.636	26%	0.26	S	S	*	.	S	Bend	trans	-78.7	129.3	-174.8	22.4	-8.3	0	0	0	110	Y700	Y700-P793 HydrophobicContact CD2-CB 4.23Å; Y700-P793 HydrophobicContact CD2-CG 4.39Å; Y700-P793 HydrophobicContact CE2-CB 3.74Å; Y700-P793 VanDerWaalsContact CE2-CD 3.44Å; Y700-P793 HydrophobicContact CE2-CG 3.45Å; Y700-P793 VanDerWaalsContact CE2-CG 3.45Å
794	G	63.5	Low	84.5	Confident	56 Å²	56	46.7 Å²	46.7	58%	0.577	26%	0.262	S	S	*	.	S	Bend	trans	169.6	-165	-175.9	0	0	0	0	0	112	V796	G794-V796 VanDerWaalsContact O-CG2 3.23Å; G794-V796 WeakPolarHBondContact O-CG2 3.45Å; G794-V796 PolarHBondContact O-N 3.46Å
795	E	57.2	Low	84.7	Confident	165 Å²	165	44.2 Å²	44.2	77%	0.771	25%	0.246	S	C	*	.	S	Bend	trans	-59.8	103.4	168.4	-73.2	-174.6	171.3	0	0	109.2	F797	E795-F797 HydrophobicContact CB-CE2 4.22Å; E795-F797 WeakPolarHBondContact O-CD2 3.48Å; E795-F797 PolarHBondContact O-N 2.94Å; E795-F797 VanDerWaalsContact O-N 3.09Å
796	V	60.3	Low	84.6	Confident	105 Å²	105	45.5 Å²	45.5	64%	0.636	25%	0.251	S	S	*	.			trans	-79.2	98.7	-170.2	-173.5	0	0	0	0	109.6	G794	G794-V796 VanDerWaalsContact O-CG2 3.23Å; G794-V796 WeakPolarHBondContact O-CG2 3.45Å; G794-V796 PolarHBondContact O-N 3.46Å
797	F	73	Confident	84.6	Confident	51 Å²	51	44.9 Å²	44.9	22%	0.224	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-78.1	135	164.9	-66.3	-81	0	0	0	109.4	H722 V725 D728 N730 E795	H722-F797 HydrophobicContact CB-CD1 4.02Å; H722-F797 HydrophobicContact CB-CE1 4.48Å; H722-F797 HydrophobicContact CB-CG 4.37Å; H722-F797 AromaticContact CD2-CD1 3.91Å; H722-F797 AromaticContact CG-CD1 3.68Å; H722-F797 AromaticContact ND1-CD1 3.99Å; V725-F797 HydrophobicContact CB-CE2 4.46Å; V725-F797 HydrophobicContact CG1-CD2 4.1Å; V725-F797 HydrophobicContact CG1-CE2 3.72Å; V725-F797 HydrophobicContact CG1-CZ 4.26Å; V725-F797 HydrophobicContact CG2-CE1 4.05Å; V725-F797 HydrophobicContact CG2-CE2 4Å; V725-F797 HydrophobicContact CG2-CZ 3.67Å; D728-F797 HydrophobicContact CB-CB 4.08Å; D728-F797 HydrophobicContact CB-CD2 4.07Å; D728-F797 HydrophobicContact CB-CG 4.3Å; N730-F797 PolarHBondContact ND2-O 3.33Å; E795-F797 HydrophobicContact CB-CE2 4.22Å; E795-F797 WeakPolarHBondContact O-CD2 3.48Å; E795-F797 PolarHBondContact O-N 2.94Å; E795-F797 VanDerWaalsContact O-N 3.09Å
798	P	77.8	Confident	84.5	Confident	75 Å²	75	46.1 Å²	46.1	49%	0.487	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-64.8	130.4	-179.8	24.6	-32.5	0	0	0	110.2	H722	H722-P798 PolarHBondContact CE1-O 3.16Å; H722-P798 VanDerWaalsContact CE1-O 3.32Å
799	P	82.7	Confident	84.3	Confident	4 Å²	4	49.7 Å²	49.7	3%	0.026	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-64.7	147.5	-178.5	25.7	-34.1	0	0	0	112	T696 T698 N730 L789 V801	T696-P799 WeakPolarHBondContact O-CD 3.26Å; T698-P799 HydrophobicContact CG2-CG 3.88Å; N730-P799 HydrophobicContact CB-CB 4.47Å; L789-P799 HydrophobicContact CD2-CB 3.3Å; L789-P799 HydrophobicContact CD2-CG 3.76Å; P799-V801 HydrophobicContact CB-CG2 4.36Å
800	K	87.9	Confident	84	Confident	95 Å²	95	56.4 Å²	56.4	41%	0.413	31%	0.311	S	S	.	.			trans	-123.5	58.5	-179.5	-68.8	178	-175.7	161.9	0	109.8	Q719 R720 H722	Q719-K800 PolarHBondContact OE1-O 2.76Å; R720-K800 HydrophobicContact CB-CB 4.44Å; H722-K800 VanDerWaalsContact CE1-CE 3.5Å; H722-K800 WeakPolarHBondContact CE1-CE 3.47Å; H722-K800 PolarHBondContact CE1-NZ 2.8Å; H722-K800 WeakPolarHBondContact NE2-CE 3.02Å; H722-K800 PolarHBondContact NE2-NZ 2.89Å
801	V	91.2	Very high	83.8	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	131.2	-178.6	-176	0	0	0	0	110.3	S694 L695 I705 V717 K718 Q719 L789 P799	S694-V801 WeakPolarHBondContact CA-O 3.41Å; S694-V801 WeakPolarHBondContact CB-O 3.17Å; L695-V801 HydrophobicContact CB-CB 4.3Å; L695-V801 PolarHBondContact N-O 2.86Å; I705-V801 HydrophobicContact CD1-CG1 3.93Å; I705-V801 HydrophobicContact CG1-CG1 4.46Å; I705-V801 HydrophobicContact CG2-CG1 4.2Å; V717-V801 HydrophobicContact CG1-CG1 4.15Å; K718-V801 CarbonylContact O-C 3.54Å; K718-V801 VanDerWaalsContact O-CA 3.29Å; K718-V801 WeakPolarHBondContact O-CA 3.21Å; Q719-V801 HydrophobicContact CB-CG2 4.26Å; L789-V801 HydrophobicContact CD1-CG2 3.84Å; L789-V801 HydrophobicContact CD2-CG2 3.85Å; L789-V801 HydrophobicContact CG-CG2 4.39Å; P799-V801 HydrophobicContact CB-CG2 4.36Å
802	K	94.1	Very high	83.3	Confident	146 Å²	146	65.3 Å²	65.3	64%	0.635	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.6	169.3	-66.1	-175.1	179.7	-177.2	0	109.2	K718	K718-K802 PolarHBondContact N-O 3.19Å; K718-K802 PolarHBondContact O-N 2.98Å
803	Y	95.1	Very high	83.1	Confident	22 Å²	22	65.1 Å²	65.1	9%	0.086	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.7	175.4	62.6	-94.3	0	0	0	111.6	V691 S692 G693 I705 V706 D716 F805 M815	V691-Y803 HydrophobicContact CG1-CE2 4.3Å; S692-Y803 VanDerWaalsContact CA-O 3.25Å; S692-Y803 WeakPolarHBondContact CA-O 3.09Å; G693-Y803 VanDerWaalsContact CA-CZ 3.5Å; G693-Y803 PolarHBondContact N-O 2.88Å; G693-Y803 VanDerWaalsContact N-O 3.12Å; G693-Y803 PolarHBondContact O-N 3.12Å; I705-Y803 HydrophobicContact CG2-CD1 3.5Å; I705-Y803 HydrophobicContact CG2-CE1 3.66Å; I705-Y803 HydrophobicContact CG2-CG 4.46Å; V706-Y803 HydrophobicContact CB-CE1 4.46Å; V706-Y803 HydrophobicContact CB-CE2 4.21Å; V706-Y803 HydrophobicContact CG1-CD1 4.41Å; V706-Y803 HydrophobicContact CG1-CD2 4.12Å; V706-Y803 HydrophobicContact CG1-CE2 4.26Å; V706-Y803 HydrophobicContact CG1-CG 4.19Å; V706-Y803 HydrophobicContact CG2-CE2 4.2Å; D716-Y803 CarbonylContact O-C 3.56Å; D716-Y803 VanDerWaalsContact O-CA 3.3Å; D716-Y803 WeakPolarHBondContact O-CA 3.15Å; Y803-F805 HydrophobicContact CD2-CD1 4.12Å; Y803-F805 AromaticContact CD2-CE1 3.74Å; Y803-F805 HydrophobicContact CD2-CE1 3.74Å; Y803-F805 AromaticContact CE2-CE1 3.99Å; Y803-F805 HydrophobicContact CE2-CE1 3.99Å; Y803-M815 HydrophobicContact CE2-CE 4.37Å; Y803-M815 WeakPolarHBondContact OH-CE 3.4Å
804	T	96.5	Very high	83.1	Confident	42 Å²	42	64.6 Å²	64.6	26%	0.258	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	139.9	171.4	59.9	0	0	0	0	110.5	V691 D716	V691-T804 VanDerWaalsContact O-CA 3.29Å; V691-T804 WeakPolarHBondContact O-CA 3.47Å; D716-T804 PolarHBondContact N-O 3.33Å; D716-T804 PolarHBondContact O-N 2.88Å
805	F	95.8	Very high	82.8	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	171.8	171.5	56	-86.6	0	0	0	109.8	V691 V706 I708 A712 I715 Y803 V807 F813	V691-F805 HydrophobicContact CB-CD1 4.41Å; V691-F805 HydrophobicContact CB-CD2 4.06Å; V691-F805 HydrophobicContact CB-CE1 4.09Å; V691-F805 HydrophobicContact CB-CE2 3.73Å; V691-F805 HydrophobicContact CB-CG 4.4Å; V691-F805 HydrophobicContact CB-CZ 3.74Å; V691-F805 HydrophobicContact CG1-CE1 3.77Å; V691-F805 HydrophobicContact CG1-CE2 3.97Å; V691-F805 HydrophobicContact CG1-CZ 3.47Å; V691-F805 VanDerWaalsContact CG1-CZ 3.47Å; V691-F805 HydrophobicContact CG2-CD2 4.43Å; V691-F805 HydrophobicContact CG2-CE2 3.95Å; V691-F805 HydrophobicContact CG2-CZ 4.3Å; V691-F805 PolarHBondContact N-O 3.26Å; V691-F805 PolarHBondContact O-N 2.04Å; V706-F805 HydrophobicContact CG1-CE1 4.26Å; V706-F805 HydrophobicContact CG2-CE1 3.88Å; V706-F805 HydrophobicContact CG2-CZ 3.85Å; I708-F805 HydrophobicContact CD1-CD1 4.35Å; I708-F805 HydrophobicContact CG1-CD1 4.22Å; I708-F805 HydrophobicContact CG1-CE1 4.04Å; I708-F805 HydrophobicContact CG1-CZ 4.28Å; I708-F805 HydrophobicContact CG2-CD2 4.13Å; I708-F805 HydrophobicContact CG2-CE2 4.28Å; I708-F805 HydrophobicContact CG2-CG 4.36Å; A712-F805 HydrophobicContact CB-CD2 4.08Å; I715-F805 HydrophobicContact CB-CB 4.46Å; I715-F805 HydrophobicContact CG1-CB 3.98Å; Y803-F805 HydrophobicContact CD2-CD1 4.12Å; Y803-F805 AromaticContact CD2-CE1 3.74Å; Y803-F805 HydrophobicContact CD2-CE1 3.74Å; Y803-F805 AromaticContact CE2-CE1 3.99Å; Y803-F805 HydrophobicContact CE2-CE1 3.99Å; F805-V807 HydrophobicContact CD2-CG2 3.55Å; F805-V807 HydrophobicContact CE2-CG2 3.32Å; F805-F813 HydrophobicContact CE2-CE1 4.5Å; F805-F813 HydrophobicContact CE2-CZ 4.33Å; F805-F813 HydrophobicContact CZ-CE1 4.23Å; F805-F813 HydrophobicContact CZ-CE2 4.42Å; F805-F813 AromaticContact CZ-CZ 3.86Å; F805-F813 HydrophobicContact CZ-CZ 3.86Å
806	F	94.7	Very high	82.4	Confident	28 Å²	28	64.2 Å²	64.2	12%	0.123	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.9	177.3	-69	-97	0	0	0	110.3	K677 C688 R689 K690 A712 T713 N714	K677-F806 HydrophobicContact CB-CD1 4.37Å; K677-F806 HydrophobicContact CB-CE1 4.03Å; K677-F806 HydrophobicContact CB-CE2 4.24Å; K677-F806 HydrophobicContact CB-CZ 3.94Å; K677-F806 HydrophobicContact CD-CD1 4.23Å; K677-F806 HydrophobicContact CD-CE1 3.54Å; K677-F806 HydrophobicContact CD-CZ 3.98Å; K677-F806 HydrophobicContact CG-CD1 4.07Å; K677-F806 HydrophobicContact CG-CE1 3.8Å; K677-F806 HydrophobicContact CG-CZ 4.21Å; K677-F806 WeakPolarHBondContact O-CB 3.45Å; K677-F806 WeakPolarHBondContact O-CD2 3.17Å; K677-F806 VanDerWaalsContact O-CG 3.3Å; K677-F806 WeakPolarHBondContact O-CG 3.27Å; C688-F806 HydrophobicContact CB-CB 4.27Å; R689-F806 WeakPolarHBondContact O-CA 3.4Å; K690-F806 HydrophobicContact CB-CD1 3.99Å; K690-F806 HydrophobicContact CB-CE1 3.61Å; K690-F806 HydrophobicContact CB-CZ 4.19Å; K690-F806 HydrophobicContact CD-CE1 4.37Å; K690-F806 HydrophobicContact CD-CZ 4.15Å; K690-F806 HydrophobicContact CG-CD1 4.48Å; K690-F806 HydrophobicContact CG-CE1 3.95Å; K690-F806 HydrophobicContact CG-CZ 4Å; A712-F806 CarbonylContact C-O 3.57Å; A712-F806 WeakPolarHBondContact CA-O 3.27Å; T713-F806 PolarHBondContact N-O 2.91Å; T713-F806 PolarHBondContact O-N 2.61Å; N714-F806 HydrophobicContact CB-CD2 3.85Å; N714-F806 HydrophobicContact CB-CE2 4.21Å
807	V	94.3	Very high	81.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.2	-178.7	-177.2	0	0	0	0	109.2	C688 R689 V691 P709 F805 V811 F813	C688-V807 CarbonylContact C-O 3.52Å; C688-V807 WeakPolarHBondContact CA-O 3.42Å; C688-V807 VanDerWaalsContact CB-O 3.25Å; C688-V807 WeakPolarHBondContact CB-O 3.27Å; R689-V807 HydrophobicContact CG-CB 4.49Å; R689-V807 PolarHBondContact N-O 3.47Å; R689-V807 PolarHBondContact O-N 3Å; V691-V807 HydrophobicContact CG2-CB 4.46Å; V691-V807 HydrophobicContact CG2-CG2 3.7Å; P709-V807 HydrophobicContact CG-CG1 3.92Å; P709-V807 HydrophobicContact CG-CG2 3.95Å; F805-V807 HydrophobicContact CD2-CG2 3.55Å; F805-V807 HydrophobicContact CE2-CG2 3.32Å; V807-V811 HydrophobicContact CG1-CB 3.81Å; V807-V811 HydrophobicContact CG1-CG1 3.89Å; V807-F813 HydrophobicContact CG1-CB 3.93Å; V807-F813 HydrophobicContact CG2-CD1 4.42Å; V807-F813 HydrophobicContact CG2-CG 4.36Å
808	P	93	Very high	79.6	Confident	27 Å²	27	67 Å²	67	18%	0.175	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	142.5	172.7	-25.9	35.5	0	0	0	112.2	G711 D810 V811	G711-P808 WeakPolarHBondContact O-CG 3.37Å; P808-D810 WeakPolarHBondContact CB-OD1 3.37Å; P808-D810 PolarHBondContact O-N 2.93Å; P808-V811 HydrophobicContact CB-CG2 4.07Å; P808-V811 HydrophobicContact CG-CG2 4.34Å; P808-V811 PolarHBondContact O-N 3.29Å; P808-V811 VanDerWaalsContact O-N 3.13Å
809	N	89.1	Confident	77.5	Confident	81 Å²	81	72.4 Å²	72.4	43%	0.433	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-26.8	-173.1	-71.7	-23.1	0	0	0	113.7	N686 S687 C688 R689 V811	N686-N809 PolarHBondContact O-ND2 3.1Å; S687-N809 PolarHBondContact O-N 2.96Å; S687-N809 PolarHBondContact O-ND2 2.82Å; C688-N809 VanDerWaalsContact C-OD1 3.28Å; C688-N809 WeakPolarHBondContact CA-OD1 3.38Å; R689-N809 PolarHBondContact N-OD1 3.03Å; N809-V811 VanDerWaalsContact C-N 3.26Å
810	D	86	Confident	75.3	Confident	142 Å²	142	80.6 Å²	80.6	76%	0.759	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-12.8	176.2	59.9	-45.6	0	0	0	113.4	P808	P808-D810 WeakPolarHBondContact CB-OD1 3.37Å; P808-D810 PolarHBondContact O-N 2.93Å
811	V	85.8	Confident	72.6	Confident	39 Å²	39	85.4 Å²	85.4	24%	0.236	44%	0.438	C	S	.	.	S	Bend	trans	-88.3	121	174.9	177.1	0	0	0	0	109.7	R689 P709 V807 P808 N809 F813	R689-V811 PolarHBondContact NH2-O 3.35Å; R689-V811 VanDerWaalsContact NH2-O 3.1Å; P709-V811 HydrophobicContact CB-CG1 4.08Å; P709-V811 HydrophobicContact CG-CG1 4.3Å; V807-V811 HydrophobicContact CG1-CB 3.81Å; V807-V811 HydrophobicContact CG1-CG1 3.89Å; P808-V811 HydrophobicContact CB-CG2 4.07Å; P808-V811 HydrophobicContact CG-CG2 4.34Å; P808-V811 PolarHBondContact O-N 3.29Å; P808-V811 VanDerWaalsContact O-N 3.13Å; N809-V811 VanDerWaalsContact C-N 3.26Å; V811-F813 VanDerWaalsContact C-N 3.34Å; V811-F813 PolarHBondContact O-N 3.43Å
812	D	78.5	Confident	69.8	Low	156 Å²	156	90 Å²	90	83%	0.834	48%	0.476	S	S	*	.			trans	-75.1	87.8	173.7	-166.1	8.6	0	0	0	110.6
813	F	79.9	Confident	66.8	Low	35 Å²	35	88.5 Å²	88.5	15%	0.154	48%	0.479	C	S	.	.			trans	-107.3	107	173.1	-176.5	-95.6	0	0	0	110.3	R689 V691 V706 T707 P709 F805 V807 V811 M815	R689-F813 VanDerWaalsContact NH2-N 3.13Å; R689-F813 PolarHBondContact NH2-O 2.5Å; V691-F813 HydrophobicContact CB-CE1 4.39Å; V691-F813 HydrophobicContact CG1-CE1 3.69Å; V691-F813 HydrophobicContact CG1-CZ 4.31Å; V691-F813 HydrophobicContact CG2-CD1 3.86Å; V691-F813 HydrophobicContact CG2-CE1 3.83Å; V706-F813 HydrophobicContact CG2-CZ 4.16Å; T707-F813 WeakPolarHBondContact O-CE2 3.25Å; P709-F813 HydrophobicContact CG-CD2 3.87Å; P709-F813 HydrophobicContact CG-CE2 4.46Å; P709-F813 HydrophobicContact CG-CG 4.46Å; F805-F813 HydrophobicContact CE2-CE1 4.5Å; F805-F813 HydrophobicContact CE2-CZ 4.33Å; F805-F813 HydrophobicContact CZ-CE1 4.23Å; F805-F813 HydrophobicContact CZ-CE2 4.42Å; F805-F813 AromaticContact CZ-CZ 3.86Å; F805-F813 HydrophobicContact CZ-CZ 3.86Å; V807-F813 HydrophobicContact CG1-CB 3.93Å; V807-F813 HydrophobicContact CG2-CD1 4.42Å; V807-F813 HydrophobicContact CG2-CG 4.36Å; V811-F813 VanDerWaalsContact C-N 3.34Å; V811-F813 PolarHBondContact O-N 3.43Å; F813-M815 HydrophobicContact CE1-CG 3.82Å
814	S	69.4	Low	64	Low	86 Å²	86	93.4 Å²	93.4	60%	0.601	51%	0.512	S	S	*	.			trans	-94.6	122.6	166.1	173.2	0	0	0	0	109	Q816	S814-Q816 VanDerWaalsContact C-N 3.34Å; S814-Q816 PolarHBondContact O-N 3.13Å
815	M	56.6	Low	60.9	Low	94 Å²	94	98.5 Å²	98.5	46%	0.463	54%	0.537	S	S	.	.			trans	-63.1	104.2	161.1	-75.6	-173.8	94.1	0	0	105.5	V691 Y803 F813 S817	V691-M815 HydrophobicContact CG1-CE 4.43Å; V691-M815 HydrophobicContact CG1-CG 4.29Å; V691-M815 HydrophobicContact CG1-SD 4.23Å; Y803-M815 HydrophobicContact CE2-CE 4.37Å; Y803-M815 WeakPolarHBondContact OH-CE 3.4Å; F813-M815 HydrophobicContact CE1-CG 3.82Å; M815-S817 PolarHBondContact O-N 3.08Å
816	Q	49	Very low	58.2	Low	120 Å²	120	106.6 Å²	106.6	56%	0.561	58%	0.579	S	S	*	*			trans	-59.7	98.7	169.9	-74.4	173.3	21	0	0	106.8	S814 S818	S814-Q816 VanDerWaalsContact C-N 3.34Å; S814-Q816 PolarHBondContact O-N 3.13Å; Q816-S818 PolarHBondContact O-N 3.29Å
817	S	34.8	Very low	55.2	Low	87 Å²	87	111.3 Å²	111.3	61%	0.608	60%	0.604	S	S	*	*			trans	-54.9	132.2	158.6	90.3	0	0	0	0	105	M815 K819	M815-S817 PolarHBondContact O-N 3.08Å; S817-K819 PolarHBondContact O-N 3.24Å
818	S	39	Very low	52.1	Low	126 Å²	126	120 Å²	120	88%	0.881	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	37	-176.4	53	0	0	0	0	113.6	Q816	Q816-S818 PolarHBondContact O-N 3.29Å
819	K	33.2	Very low	49.3	Very low	189 Å²	189	122.8 Å²	122.8	82%	0.822	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	-13.1	-178.7	-83.8	-168.2	172.7	-177.8	0	117.3	S817	S817-K819 PolarHBondContact O-N 3.24Å
820	E	37.6	Very low	46.9	Very low	177 Å²	177	126.3 Å²	126.3	83%	0.827	68%	0.681	S	S	*	*			trans	-142.4	98.3	177.7	-81.3	-179.1	164.7	0	0	112.8
821	R	32.1	Very low	45	Very low	195 Å²	195	125.6 Å²	125.6	74%	0.736	68%	0.677	S	S	*	*			trans	-134.3	96.4	145.7	-116.9	179.6	179.9	-175.5	-0.6	108.3	T823	R821-T823 PolarHBondContact O-N 3.03Å
822	A	31.8	Very low	43.6	Very low	98 Å²	98	131.3 Å²	131.3	81%	0.81	70%	0.7	S	S	*	*			trans	-58.5	127.7	157.4	0	0	0	0	0	108.2	T824	A822-T824 PolarHBondContact O-N 3.5Å
823	T	31	Very low	43	Very low	114 Å²	114	125.7 Å²	125.7	70%	0.699	67%	0.672	S	S	*	*			trans	-71.8	115.8	-179.8	46.6	0	0	0	0	110.7	R821 I827	R821-T823 PolarHBondContact O-N 3.03Å; T823-I827 HydrophobicContact CG2-CD1 4.33Å
824	T	35.6	Very low	42.8	Very low	125 Å²	125	130 Å²	130	77%	0.767	69%	0.692	S	S	*	*			trans	-121.9	92.3	152.3	39.7	0	0	0	0	107.9	A822	A822-T824 PolarHBondContact O-N 3.5Å
825	N	32.7	Very low	43.4	Very low	149 Å²	149	129 Å²	129	80%	0.797	68%	0.675	S	S	*	*	S	Bend	trans	164.4	99.3	136.4	-77.2	-27.1	0	0	0	108.9
826	I	37.5	Very low	44.5	Very low	170 Å²	170	127.2 Å²	127.2	87%	0.872	67%	0.67	S	S	*	*			trans	38.5	87.7	153	-48.3	177.6	0	0	0	115.2
827	I	31.4	Very low	46.3	Very low	127 Å²	127	125 Å²	125	65%	0.651	66%	0.662	S	S	*	*			trans	-86.6	114.3	158.2	-64.3	171.6	0	0	0	107.2	T823 P829	T823-I827 HydrophobicContact CG2-CD1 4.33Å; I827-P829 HydrophobicContact CG2-CB 4.12Å
828	Q	30.7	Very low	48.4	Very low	182 Å²	182	122 Å²	122	85%	0.85	64%	0.644	S	S	*	*			trans	-82.6	113.5	147.1	-155.2	170.9	7.8	0	0	105.5	L830	Q828-L830 PolarHBondContact O-N 3.32Å
829	P	34.1	Very low	50.8	Low	86 Å²	86	123.5 Å²	123.5	56%	0.558	64%	0.642	S	S	*	*			trans	-74.9	117.2	-174.7	27.9	-30.6	0	0	0	108.9	I827 L831	I827-P829 HydrophobicContact CG2-CB 4.12Å; P829-L831 VanDerWaalsContact C-N 3.25Å; P829-L831 PolarHBondContact O-N 2.99Å
830	L	39.2	Very low	53.4	Low	156 Å²	156	118 Å²	118	82%	0.817	62%	0.616	S	S	*	*			trans	-70.2	94.4	157.7	-87.8	157.3	0	0	0	107.2	Q828 H832	Q828-L830 PolarHBondContact O-N 3.32Å; L830-H832 PolarHBondContact O-N 3.26Å; L830-H832 VanDerWaalsContact O-N 3.1Å; L830-H832 PolarHBondContact O-ND1 3.27Å
831	L	44.9	Very low	55.7	Low	127 Å²	127	112 Å²	112	67%	0.665	59%	0.594	S	S	*	*			trans	-48	107.6	168.3	-74	150.6	0	0	0	109.6	P829 V833 P861	P829-L831 VanDerWaalsContact C-N 3.25Å; P829-L831 PolarHBondContact O-N 2.99Å; L831-V833 PolarHBondContact O-N 3.46Å; L831-V833 VanDerWaalsContact O-N 3.14Å; L831-P861 HydrophobicContact CD2-CG 4.2Å
832	H	57.5	Low	58.3	Low	159 Å²	159	111.1 Å²	111.1	74%	0.736	60%	0.598	S	S	*	*			trans	-79.2	96.6	173.7	-76.7	66.9	0	0	0	109.2	L830 P861	L830-H832 PolarHBondContact O-N 3.26Å; L830-H832 VanDerWaalsContact O-N 3.1Å; L830-H832 PolarHBondContact O-ND1 3.27Å; H832-P861 WeakPolarHBondContact O-CG 3.29Å
833	V	64.6	Low	60.9	Low	38 Å²	38	108 Å²	108	23%	0.23	57%	0.57	C	S	.	*			trans	-78.2	133.2	165.4	-92.3	0	0	0	0	109.6	L831 R859 D860 S866 T868	L831-V833 PolarHBondContact O-N 3.46Å; L831-V833 VanDerWaalsContact O-N 3.14Å; V833-R859 WeakPolarHBondContact CA-O 3.18Å; V833-D860 HydrophobicContact CG1-CB 3.8Å; V833-S866 WeakPolarHBondContact CG1-OG 3.26Å; V833-T868 WeakPolarHBondContact CG1-OG1 3.18Å; V833-T868 WeakPolarHBondContact CG2-OG1 3.24Å
834	Q	75.6	Confident	63.5	Low	126 Å²	126	106.8 Å²	106.8	59%	0.589	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-127.9	148	-175.2	62.6	-179.9	-8.4	0	0	112.1	V836 R859 C869	Q834-V836 HydrophobicContact CG-CG2 4.21Å; Q834-V836 PolarHBondContact O-N 3.05Å; Q834-R859 PolarHBondContact N-O 3.31Å; Q834-R859 PolarHBondContact O-N 3.32Å; Q834-C869 VanDerWaalsContact C-SG 3.56Å
835	W	81.7	Confident	65.6	Low	63 Å²	63	102.6 Å²	102.6	24%	0.239	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	118	171.2	-69.6	114	0	0	0	109.6	V856 C858 C869 N870 K874 P875	W835-V856 HydrophobicContact CD2-CG1 4.39Å; W835-V856 HydrophobicContact CE3-CG1 3.81Å; W835-V856 HydrophobicContact CZ3-CG1 4.39Å; W835-C858 HydrophobicContact CD2-CB 4.23Å; W835-C858 HydrophobicContact CE3-CB 3.67Å; W835-C858 HydrophobicContact CH2-CB 3.88Å; W835-C858 HydrophobicContact CZ2-CB 4.42Å; W835-C858 HydrophobicContact CZ3-CB 3.49Å; W835-C858 VanDerWaalsContact CZ3-CB 3.49Å; W835-C869 HydrophobicContact CD2-CB 3.87Å; W835-C869 HydrophobicContact CE3-CB 4.49Å; W835-C869 HydrophobicContact CG-CB 4.33Å; W835-C869 HydrophobicContact CH2-CB 4.15Å; W835-C869 HydrophobicContact CZ2-CB 3.48Å; W835-C869 VanDerWaalsContact CZ2-CB 3.48Å; W835-N870 PolarHBondContact NE1-O 2.79Å; W835-K874 HydrophobicContact CD2-CG 4.27Å; W835-K874 HydrophobicContact CE3-CG 4.29Å; W835-K874 HydrophobicContact CH2-CB 4.43Å; W835-K874 HydrophobicContact CH2-CD 4.31Å; W835-K874 HydrophobicContact CH2-CG 4.01Å; W835-K874 HydrophobicContact CZ2-CB 3.89Å; W835-K874 HydrophobicContact CZ2-CG 3.95Å; W835-K874 HydrophobicContact CZ3-CG 4.16Å; W835-P875 HydrophobicContact CB-CG 4.25Å
836	V	81.1	Confident	67.7	Low	57 Å²	57	102.1 Å²	102.1	35%	0.345	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	131.5	175.3	-177.4	0	0	0	0	108.6	Q834 E857 R859	Q834-V836 HydrophobicContact CG-CG2 4.21Å; Q834-V836 PolarHBondContact O-N 3.05Å; V836-E857 PolarHBondContact N-O 3.35Å; V836-E857 PolarHBondContact O-N 2.97Å; V836-R859 HydrophobicContact CG2-CB 4.02Å; V836-R859 HydrophobicContact CG2-CG 4.24Å
837	L	85.3	Confident	69.6	Low	75 Å²	75	95.8 Å²	95.8	39%	0.393	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.6	-174.8	-53	172.9	0	0	0	109.1	V856 P875	L837-V856 HydrophobicContact CD2-CB 4.13Å; L837-V856 HydrophobicContact CD2-CG1 3.75Å; L837-V856 HydrophobicContact CD2-CG2 3.61Å; L837-P875 HydrophobicContact CD1-CB 4.31Å; L837-P875 HydrophobicContact CD1-CG 4.42Å; L837-P875 HydrophobicContact CD2-CB 3.74Å; L837-P875 HydrophobicContact CD2-CG 3.87Å
838	G	80.9	Confident	71.7	Confident	23 Å²	23	90.4 Å²	90.4	24%	0.237	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-81	172.1	167.6	0	0	0	0	0	112.1	R854 T855	G838-R854 WeakPolarHBondContact O-CB 3.31Å; G838-R854 WeakPolarHBondContact O-CD 3.45Å; G838-T855 WeakPolarHBondContact CA-OG1 3.04Å; G838-T855 PolarHBondContact N-O 2.94Å
839	D	88.4	Confident	74.1	Confident	157 Å²	157	87.1 Å²	87.1	84%	0.84	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-66.3	152.8	174.8	-64.8	-41.3	0	0	0	111.6	R854	D839-R854 WeakPolarHBondContact O-CB 3.09Å
840	W	87.9	Confident	76.4	Confident	74 Å²	74	83.1 Å²	83.1	28%	0.28	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-72.3	137	174	-70.6	106.1	0	0	0	110.7	Q852 R853 R854 K879	W840-Q852 HydrophobicContact CB-CB 4.34Å; W840-Q852 HydrophobicContact CE3-CB 3.96Å; W840-Q852 WeakPolarHBondContact CZ3-O 3.12Å; W840-R853 CarbonylContact C-O 3.6Å; W840-R853 VanDerWaalsContact CE3-C 3.42Å; W840-R854 HydrophobicContact CD2-CB 3.97Å; W840-R854 HydrophobicContact CD2-CG 4.09Å; W840-R854 HydrophobicContact CE3-CB 3.72Å; W840-R854 HydrophobicContact CE3-CG 3.83Å; W840-R854 HydrophobicContact CG-CB 4.49Å; W840-R854 HydrophobicContact CH2-CG 3.77Å; W840-R854 HydrophobicContact CZ2-CG 4.04Å; W840-R854 VanDerWaalsContact CZ2-CZ 3.44Å; W840-R854 VanDerWaalsContact CZ2-NE 3.31Å; W840-R854 HydrophobicContact CZ3-CB 4.03Å; W840-R854 HydrophobicContact CZ3-CG 3.65Å; W840-K879 HydrophobicContact CD2-CD 4.06Å; W840-K879 HydrophobicContact CD2-CG 4.24Å; W840-K879 HydrophobicContact CE3-CD 4.4Å; W840-K879 HydrophobicContact CE3-CG 4.07Å; W840-K879 HydrophobicContact CH2-CB 4.01Å; W840-K879 HydrophobicContact CH2-CD 4.18Å; W840-K879 HydrophobicContact CH2-CG 3.88Å; W840-K879 HydrophobicContact CZ2-CB 4.36Å; W840-K879 HydrophobicContact CZ2-CD 3.79Å; W840-K879 HydrophobicContact CZ2-CG 4.03Å; W840-K879 HydrophobicContact CZ3-CB 4.33Å; W840-K879 HydrophobicContact CZ3-CD 4.47Å; W840-K879 HydrophobicContact CZ3-CG 3.9Å
841	S	85.9	Confident	78.6	Confident	52 Å²	52	82.3 Å²	82.3	36%	0.364	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-64.2	164.2	171.3	73.4	0	0	0	0	111.4	Q852 R853	S841-Q852 VanDerWaalsContact O-CG 3.29Å; S841-Q852 WeakPolarHBondContact O-CG 3.44Å; S841-Q852 PolarHBondContact O-NE2 3.36Å; S841-R853 WeakPolarHBondContact CB-O 3.2Å; S841-R853 PolarHBondContact N-O 2.85Å; S841-R853 PolarHBondContact OG-N 3.45Å; S841-R853 PolarHBondContact OG-O 3.2Å
842	E	85.7	Confident	80.6	Confident	175 Å²	175	78.5 Å²	78.5	82%	0.818	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-57.1	154.8	163.7	-63.7	-164.7	163.1	0	0	111	S844	E842-S844 PolarHBondContact O-N 3.32Å
843	C	86.6	Confident	82.1	Confident	34 Å²	34	79.5 Å²	79.5	23%	0.23	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-62.6	132.6	178.6	-167.5	0	0	0	0	109	S845 Q852 C881	C843-S845 PolarHBondContact O-N 3.42Å; C843-S845 PolarHBondContact SG-O 3.06Å; C843-Q852 HydrophobicContact CB-CG 4.33Å; C843-C881 WeakPolarHBondContact CA-SG 3.42Å; C843-C881 HydrophobicContact CB-CB 3.95Å; C843-C881 WeakPolarHBondContact CB-SG 3.07Å; C843-C881 WeakPolarHBondContact SG-CB 3.43Å; C843-C881 CovalentContact SG-SG 2.03Å; C843-C881 PolarHBondContact SG-SG 3.49Å
844	S	86.1	Confident	83.2	Confident	87 Å²	87	80.3 Å²	80.3	61%	0.608	42%	0.421	S	S	*	.	S	Bend	trans	-59.1	-17.4	-179.5	66.2	0	0	0	0	114	E842 G850 W851	E842-S844 PolarHBondContact O-N 3.32Å; S844-G850 WeakPolarHBondContact OG-CA 3.04Å; S844-W851 WeakPolarHBondContact CB-O 3.25Å; S844-W851 PolarHBondContact N-O 3.12Å; S844-W851 PolarHBondContact OG-N 2.85Å
845	S	78.9	Confident	83.7	Confident	38 Å²	38	78.5 Å²	78.5	27%	0.266	42%	0.419	S	S	.	.			trans	-128.6	129.2	-178	-49.7	0	0	0	0	109.4	C843 C847 P849 S883	C843-S845 PolarHBondContact O-N 3.42Å; C843-S845 PolarHBondContact SG-O 3.06Å; S845-C847 VanDerWaalsContact C-N 3.28Å; S845-C847 WeakPolarHBondContact CB-O 3.43Å; S845-P849 PolarHBondContact OG-O 3.36Å; S845-S883 PolarHBondContact O-OG 3.12Å
846	T	77.8	Confident	84	Confident	138 Å²	138	76.5 Å²	76.5	85%	0.847	41%	0.413	S	S	*	.	S	Bend	trans	-77.6	-15.7	176.6	50.5	0	0	0	0	113.1	S883	T846-S883 VanDerWaalsContact C-OG 3.24Å; T846-S883 WeakPolarHBondContact O-CB 3.38Å; T846-S883 PolarHBondContact O-OG 3.04Å
847	C	77.9	Confident	84.1	Confident	37 Å²	37	77.7 Å²	77.7	25%	0.25	42%	0.415	C	S	.	.	S	Bend	trans	-145.7	151.6	170.4	66.4	0	0	0	0	110.4	S845 S883 Q884 C886	S845-C847 VanDerWaalsContact C-N 3.28Å; S845-C847 WeakPolarHBondContact CB-O 3.43Å; C847-S883 WeakPolarHBondContact CA-OG 3.5Å; C847-S883 PolarHBondContact N-OG 2.93Å; C847-S883 VanDerWaalsContact N-OG 3.1Å; C847-Q884 CarbonylContact C-O 3.46Å; C847-Q884 WeakPolarHBondContact CA-O 3.04Å; C847-Q884 VanDerWaalsContact CB-O 3.23Å; C847-Q884 WeakPolarHBondContact CB-O 3.47Å; C847-C886 HydrophobicContact CB-CB 3.8Å; C847-C886 WeakPolarHBondContact CB-SG 3.34Å; C847-C886 PolarHBondContact O-SG 2.02Å; C847-C886 WeakPolarHBondContact SG-CA 3.21Å; C847-C886 WeakPolarHBondContact SG-CB 3.07Å; C847-C886 CovalentContact SG-SG 2.04Å; C847-C886 PolarHBondContact SG-SG 2.9Å
848	G	75.6	Confident	84.1	Confident	14 Å²	14	74.4 Å²	74.4	14%	0.144	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.5	-171.1	-177.1	0	0	0	0	0	114.7	G850 S883 Q884	G848-G850 PolarHBondContact O-N 2.04Å; G848-S883 PolarHBondContact N-OG 2.71Å; G848-S883 PolarHBondContact O-N 3.32Å; G848-S883 PolarHBondContact O-OG 3.24Å; G848-S883 VanDerWaalsContact O-OG 3.08Å; G848-Q884 PolarHBondContact N-O 2.59Å
849	P	79.9	Confident	84	Confident	114 Å²	114	77.8 Å²	77.8	74%	0.74	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	129.5	179.8	26.4	-31.8	0	0	0	111.2	S845	S845-P849 PolarHBondContact OG-O 3.36Å
850	G	83.3	Confident	83.4	Confident	2 Å²	2	72 Å²	72	2%	0.021	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	-177	176.3	0	0	0	0	0	111.8	S844 G848 P880 C881	S844-G850 WeakPolarHBondContact OG-CA 3.04Å; G848-G850 PolarHBondContact O-N 2.04Å; G850-P880 WeakPolarHBondContact O-CA 3.39Å; G850-C881 CarbonylContact C-O 3.54Å; G850-C881 PolarHBondContact N-O 3.17Å; G850-C881 PolarHBondContact O-N 3Å; G850-C881 VanDerWaalsContact O-O 3.08Å; G850-C881 PolarHBondContact O-SG 3.22Å
851	W	85.9	Confident	82.2	Confident	139 Å²	139	72.6 Å²	72.6	53%	0.527	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	139.6	178.1	-69.6	81.7	0	0	0	111.1	S844 A878 K879 P880 C881	S844-W851 WeakPolarHBondContact CB-O 3.25Å; S844-W851 PolarHBondContact N-O 3.12Å; S844-W851 PolarHBondContact OG-N 2.85Å; W851-A878 HydrophobicContact CE3-CB 4.18Å; W851-K879 WeakPolarHBondContact CA-O 3.35Å; W851-P880 HydrophobicContact CE3-CB 4.47Å; W851-P880 HydrophobicContact CH2-CB 4.33Å; W851-P880 HydrophobicContact CH2-CG 4.5Å; W851-P880 HydrophobicContact CZ2-CB 4.43Å; W851-P880 HydrophobicContact CZ3-CB 4.35Å; W851-P880 HydrophobicContact CZ3-CG 4.46Å; W851-C881 PolarHBondContact N-SG 2.89Å
852	Q	86.6	Confident	81.4	Confident	47 Å²	47	74.6 Å²	74.6	22%	0.22	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.8	164.8	-64.4	-175.2	-63.5	0	0	108.9	W840 S841 C843 A878 K879 C881	W840-Q852 HydrophobicContact CB-CB 4.34Å; W840-Q852 HydrophobicContact CE3-CB 3.96Å; W840-Q852 WeakPolarHBondContact CZ3-O 3.12Å; S841-Q852 VanDerWaalsContact O-CG 3.29Å; S841-Q852 WeakPolarHBondContact O-CG 3.44Å; S841-Q852 PolarHBondContact O-NE2 3.36Å; C843-Q852 HydrophobicContact CB-CG 4.33Å; Q852-A878 CarbonylContact O-C 3.5Å; Q852-A878 WeakPolarHBondContact O-CA 3.06Å; Q852-K879 HydrophobicContact CB-CG 4.24Å; Q852-K879 PolarHBondContact N-O 2.9Å; Q852-K879 PolarHBondContact O-N 3.12Å; Q852-C881 HydrophobicContact CG-CB 3.9Å
853	R	88.6	Confident	80.5	Confident	180 Å²	180	67.9 Å²	67.9	68%	0.679	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	152.3	176.4	-67.1	-171.4	179.2	-161.8	-0.3	111.1	W840 S841 D877 A878	W840-R853 CarbonylContact C-O 3.6Å; W840-R853 VanDerWaalsContact CE3-C 3.42Å; S841-R853 WeakPolarHBondContact CB-O 3.2Å; S841-R853 PolarHBondContact N-O 2.85Å; S841-R853 PolarHBondContact OG-N 3.45Å; S841-R853 PolarHBondContact OG-O 3.2Å; R853-D877 CarbonylContact C-O 3.52Å; R853-D877 VanDerWaalsContact CA-O 3.23Å; R853-D877 WeakPolarHBondContact CA-O 3.27Å; R853-A878 HydrophobicContact CG-CB 4.06Å
854	R	87.6	Confident	80	Confident	54 Å²	54	72.8 Å²	72.8	20%	0.204	40%	0.398	C	S	.	.			trans	-135.8	159.7	173.6	67.3	177	172.8	-170.9	-2.6	110.8	G838 D839 W840 V856 E876 D877	G838-R854 WeakPolarHBondContact O-CB 3.31Å; G838-R854 WeakPolarHBondContact O-CD 3.45Å; D839-R854 WeakPolarHBondContact O-CB 3.09Å; W840-R854 HydrophobicContact CD2-CB 3.97Å; W840-R854 HydrophobicContact CD2-CG 4.09Å; W840-R854 HydrophobicContact CE3-CB 3.72Å; W840-R854 HydrophobicContact CE3-CG 3.83Å; W840-R854 HydrophobicContact CG-CB 4.49Å; W840-R854 HydrophobicContact CH2-CG 3.77Å; W840-R854 HydrophobicContact CZ2-CG 4.04Å; W840-R854 VanDerWaalsContact CZ2-CZ 3.44Å; W840-R854 VanDerWaalsContact CZ2-NE 3.31Å; W840-R854 HydrophobicContact CZ3-CB 4.03Å; W840-R854 HydrophobicContact CZ3-CG 3.65Å; R854-V856 HydrophobicContact CG-CG2 4.08Å; R854-E876 VanDerWaalsContact CZ-O 3.31Å; R854-E876 PolarHBondContact NE-O 3.1Å; R854-E876 PolarHBondContact NH2-O 3.14Å; R854-D877 PolarHBondContact N-O 3.5Å
855	T	85.2	Confident	79.5	Confident	89 Å²	89	72.6 Å²	72.6	55%	0.546	40%	0.402	S	S	.	.			trans	-77.5	137.5	170.6	50.6	0	0	0	0	110.2	G838	G838-T855 WeakPolarHBondContact CA-OG1 3.04Å; G838-T855 PolarHBondContact N-O 2.94Å
856	V	88.7	Confident	79.4	Confident	20 Å²	20	72.4 Å²	72.4	12%	0.121	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	99.1	176	179.6	0	0	0	0	107.2	W835 L837 R854 K874 D877	W835-V856 HydrophobicContact CD2-CG1 4.39Å; W835-V856 HydrophobicContact CE3-CG1 3.81Å; W835-V856 HydrophobicContact CZ3-CG1 4.39Å; L837-V856 HydrophobicContact CD2-CB 4.13Å; L837-V856 HydrophobicContact CD2-CG1 3.75Å; L837-V856 HydrophobicContact CD2-CG2 3.61Å; R854-V856 HydrophobicContact CG-CG2 4.08Å; V856-K874 HydrophobicContact CG1-CG 3.96Å; V856-D877 HydrophobicContact CB-CB 4.4Å; V856-D877 HydrophobicContact CG2-CB 3.74Å
857	E	84.1	Confident	79.2	Confident	82 Å²	82	70.4 Å²	70.4	38%	0.383	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.1	-174.4	-70.9	-177.4	172.1	0	0	110.4	V836 R859	V836-E857 PolarHBondContact N-O 3.35Å; V836-E857 PolarHBondContact O-N 2.97Å; E857-R859 IonicContact OE2-CZ 3.46Å; E857-R859 IonicContact OE2-NE 3.29Å; E857-R859 PolarHBondContact OE2-NE 3.31Å; E857-R859 IonicContact OE2-NH2 2.77Å; E857-R859 PolarHBondContact OE2-NH2 3.38Å
858	C	83.6	Confident	78.9	Confident	7 Å²	7	73.6 Å²	73.6	5%	0.047	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	126	171.2	171.5	0	0	0	0	108.3	W835 A865 S866 C869	W835-C858 HydrophobicContact CD2-CB 4.23Å; W835-C858 HydrophobicContact CE3-CB 3.67Å; W835-C858 HydrophobicContact CH2-CB 3.88Å; W835-C858 HydrophobicContact CZ2-CB 4.42Å; W835-C858 HydrophobicContact CZ3-CB 3.49Å; W835-C858 VanDerWaalsContact CZ3-CB 3.49Å; C858-A865 CarbonylContact O-C 3.54Å; C858-A865 WeakPolarHBondContact O-CA 3.46Å; C858-S866 WeakPolarHBondContact CB-O 3.35Å; C858-S866 PolarHBondContact O-N 3.47Å; C858-S866 PolarHBondContact SG-O 2.03Å; C858-C869 VanDerWaalsContact CA-SG 3.54Å; C858-C869 HydrophobicContact CB-CB 3.55Å; C858-C869 WeakPolarHBondContact CB-SG 3.41Å; C858-C869 VanDerWaalsContact SG-CA 3.6Å; C858-C869 WeakPolarHBondContact SG-CB 3.32Å; C858-C869 PolarHBondContact SG-N 2.04Å; C858-C869 CovalentContact SG-SG 2.01Å; C858-C869 PolarHBondContact SG-SG 3.5Å
859	R	80.5	Confident	78.9	Confident	93 Å²	93	73.4 Å²	73.4	35%	0.351	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.6	178.6	-65.4	-174	175.3	-138.9	6.6	111.5	V833 Q834 V836 E857 G863 Q864	V833-R859 WeakPolarHBondContact CA-O 3.18Å; Q834-R859 PolarHBondContact N-O 3.31Å; Q834-R859 PolarHBondContact O-N 3.32Å; V836-R859 HydrophobicContact CG2-CB 4.02Å; V836-R859 HydrophobicContact CG2-CG 4.24Å; E857-R859 IonicContact OE2-CZ 3.46Å; E857-R859 IonicContact OE2-NE 3.29Å; E857-R859 PolarHBondContact OE2-NE 3.31Å; E857-R859 IonicContact OE2-NH2 2.77Å; E857-R859 PolarHBondContact OE2-NH2 3.38Å; R859-G863 PolarHBondContact NH1-O 3.1Å; R859-Q864 WeakPolarHBondContact CA-O 3.39Å
860	D	74.8	Confident	78.5	Confident	36 Å²	36	72.8 Å²	72.8	19%	0.193	40%	0.403	C	S	.	.			trans	-80.7	174	174.1	70.5	20.4	0	0	0	111.9	V833 S862 G863 Q864	V833-D860 HydrophobicContact CG1-CB 3.8Å; D860-S862 PolarHBondContact O-N 3.14Å; D860-S862 VanDerWaalsContact O-N 3.08Å; D860-S862 VanDerWaalsContact OD1-CA 3.32Å; D860-S862 WeakPolarHBondContact OD1-CA 3.05Å; D860-S862 WeakPolarHBondContact OD1-CB 3.28Å; D860-S862 PolarHBondContact OD1-N 2.89Å; D860-S862 PolarHBondContact OD1-OG 2.86Å; D860-S862 PolarHBondContact OD2-OG 3.34Å; D860-G863 PolarHBondContact O-N 3.32Å; D860-G863 PolarHBondContact OD1-N 3.33Å; D860-Q864 PolarHBondContact N-O 3.47Å; D860-Q864 PolarHBondContact OD1-N 2.95Å; D860-Q864 VanDerWaalsContact OD1-N 3.07Å
861	P	62.9	Low	78.2	Confident	87 Å²	87	81.1 Å²	81.1	57%	0.565	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.3	178.8	-25.3	35.3	0	0	0	115	L831 H832	L831-P861 HydrophobicContact CD2-CG 4.2Å; H832-P861 WeakPolarHBondContact O-CG 3.29Å
862	S	69.6	Low	77.4	Confident	93 Å²	93	78.8 Å²	78.8	65%	0.65	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	1	173.8	42.3	0	0	0	0	113.9	D860 Q864	D860-S862 PolarHBondContact O-N 3.14Å; D860-S862 VanDerWaalsContact O-N 3.08Å; D860-S862 VanDerWaalsContact OD1-CA 3.32Å; D860-S862 WeakPolarHBondContact OD1-CA 3.05Å; D860-S862 WeakPolarHBondContact OD1-CB 3.28Å; D860-S862 PolarHBondContact OD1-N 2.89Å; D860-S862 PolarHBondContact OD1-OG 2.86Å; D860-S862 PolarHBondContact OD2-OG 3.34Å; S862-Q864 VanDerWaalsContact C-N 3.33Å
863	G	67.3	Low	76.6	Confident	34 Å²	34	82.6 Å²	82.6	35%	0.351	47%	0.47	S	S	.	.	S	Bend	trans	80.6	9	177	0	0	0	0	0	114.5	R859 D860	R859-G863 PolarHBondContact NH1-O 3.1Å; D860-G863 PolarHBondContact O-N 3.32Å; D860-G863 PolarHBondContact OD1-N 3.33Å
864	Q	75.9	Confident	76.3	Confident	137 Å²	137	78.3 Å²	78.3	64%	0.64	46%	0.457	S	S	*	.			trans	-85.1	149.9	174.4	-76	-170.2	-6.9	0	0	111.2	R859 D860 S862 S866	R859-Q864 WeakPolarHBondContact CA-O 3.39Å; D860-Q864 PolarHBondContact N-O 3.47Å; D860-Q864 PolarHBondContact OD1-N 2.95Å; D860-Q864 VanDerWaalsContact OD1-N 3.07Å; S862-Q864 VanDerWaalsContact C-N 3.33Å; Q864-S866 PolarHBondContact O-N 3.04Å
865	A	75.3	Confident	76	Confident	84 Å²	84	77.7 Å²	77.7	69%	0.694	46%	0.46	S	S	*	.	B	Isolated β-bridge	trans	-65	127	178.3	0	0	0	0	0	110.4	C858	C858-A865 CarbonylContact O-C 3.54Å; C858-A865 WeakPolarHBondContact O-CA 3.46Å
866	S	75.7	Confident	75.8	Confident	34 Å²	34	80.4 Å²	80.4	24%	0.238	47%	0.466	C	S	.	.			trans	-124.8	155.4	-178.4	-179.4	0	0	0	0	110.9	V833 C858 Q864 T868	V833-S866 WeakPolarHBondContact CG1-OG 3.26Å; C858-S866 WeakPolarHBondContact CB-O 3.35Å; C858-S866 PolarHBondContact O-N 3.47Å; C858-S866 PolarHBondContact SG-O 2.03Å; Q864-S866 PolarHBondContact O-N 3.04Å; S866-T868 PolarHBondContact OG-N 2.97Å; S866-T868 PolarHBondContact OG-OG1 3.48Å
867	A	73.6	Confident	75.8	Confident	96 Å²	96	82.9 Å²	82.9	79%	0.793	48%	0.479	S	S	*	.	S	Bend	trans	-104.2	1.5	177.5	0	0	0	0	0	113.3
868	T	71.3	Confident	76	Confident	103 Å²	103	80.2 Å²	80.2	63%	0.632	47%	0.471	S	S	*	.			trans	-93.7	3	-169	50.8	0	0	0	0	114.9	V833 S866	V833-T868 WeakPolarHBondContact CG1-OG1 3.18Å; V833-T868 WeakPolarHBondContact CG2-OG1 3.24Å; S866-T868 PolarHBondContact OG-N 2.97Å; S866-T868 PolarHBondContact OG-OG1 3.48Å
869	C	76.3	Confident	75.9	Confident	10 Å²	10	83.4 Å²	83.4	7%	0.068	48%	0.484	C	S	.	.	S	Bend	trans	-67.2	144.1	172.1	-63.6	0	0	0	0	111.3	Q834 W835 C858 K871	Q834-C869 VanDerWaalsContact C-SG 3.56Å; W835-C869 HydrophobicContact CD2-CB 3.87Å; W835-C869 HydrophobicContact CE3-CB 4.49Å; W835-C869 HydrophobicContact CG-CB 4.33Å; W835-C869 HydrophobicContact CH2-CB 4.15Å; W835-C869 HydrophobicContact CZ2-CB 3.48Å; W835-C869 VanDerWaalsContact CZ2-CB 3.48Å; C858-C869 VanDerWaalsContact CA-SG 3.54Å; C858-C869 HydrophobicContact CB-CB 3.55Å; C858-C869 WeakPolarHBondContact CB-SG 3.41Å; C858-C869 VanDerWaalsContact SG-CA 3.6Å; C858-C869 WeakPolarHBondContact SG-CB 3.32Å; C858-C869 PolarHBondContact SG-N 2.04Å; C858-C869 CovalentContact SG-SG 2.01Å; C858-C869 PolarHBondContact SG-SG 3.5Å; C869-K871 PolarHBondContact O-N 2.88Å; C869-K871 VanDerWaalsContact O-N 3.15Å
870	N	72.4	Confident	76	Confident	101 Å²	101	83.3 Å²	83.3	54%	0.54	50%	0.496	S	S	.	.			trans	-64.1	117.3	176.7	-172.6	-17	0	0	0	110.5	W835 A872 L873	W835-N870 PolarHBondContact NE1-O 2.79Å; N870-A872 VanDerWaalsContact C-N 3.28Å; N870-A872 PolarHBondContact O-N 2.03Å; N870-A872 WeakPolarHBondContact OD1-CB 3.47Å; N870-A872 PolarHBondContact OD1-N 3.36Å; N870-L873 HydrophobicContact CB-CD1 4.38Å; N870-L873 PolarHBondContact O-N 2.92Å
871	K	76.6	Confident	76.3	Confident	177 Å²	177	82.4 Å²	82.4	77%	0.77	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-65.7	-27.5	-179.4	-67	-175.9	179.8	178.9	0	113.3	C869 L873 K874	C869-K871 PolarHBondContact O-N 2.88Å; C869-K871 VanDerWaalsContact O-N 3.15Å; K871-L873 PolarHBondContact O-N 2.77Å; K871-K874 WeakPolarHBondContact O-CB 3.12Å; K871-K874 PolarHBondContact O-N 3.19Å
872	A	68.6	Low	76.6	Confident	91 Å²	91	87 Å²	87	75%	0.752	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-68.7	-20.4	177.2	0	0	0	0	0	112.8	N870	N870-A872 VanDerWaalsContact C-N 3.28Å; N870-A872 PolarHBondContact O-N 2.03Å; N870-A872 WeakPolarHBondContact OD1-CB 3.47Å; N870-A872 PolarHBondContact OD1-N 3.36Å
873	L	69.1	Low	76.3	Confident	126 Å²	126	84.2 Å²	84.2	66%	0.66	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-103.3	11.7	176.5	-60.6	175	0	0	0	112.2	N870 K871 P875	N870-L873 HydrophobicContact CB-CD1 4.38Å; N870-L873 PolarHBondContact O-N 2.92Å; K871-L873 PolarHBondContact O-N 2.77Å; L873-P875 WeakPolarHBondContact O-CD 2.96Å
874	K	82.4	Confident	76.3	Confident	91 Å²	91	90.7 Å²	90.7	40%	0.396	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-65.3	118.7	178.6	-172	-167.4	174.7	-154.9	0	108.9	W835 V856 K871 D877	W835-K874 HydrophobicContact CD2-CG 4.27Å; W835-K874 HydrophobicContact CE3-CG 4.29Å; W835-K874 HydrophobicContact CH2-CB 4.43Å; W835-K874 HydrophobicContact CH2-CD 4.31Å; W835-K874 HydrophobicContact CH2-CG 4.01Å; W835-K874 HydrophobicContact CZ2-CB 3.89Å; W835-K874 HydrophobicContact CZ2-CG 3.95Å; W835-K874 HydrophobicContact CZ3-CG 4.16Å; V856-K874 HydrophobicContact CG1-CG 3.96Å; K871-K874 WeakPolarHBondContact O-CB 3.12Å; K871-K874 PolarHBondContact O-N 3.19Å; K874-D877 IonicContact NZ-OD2 3.62Å; K874-D877 PolarHBondContact NZ-OD2 2.89Å
875	P	81.8	Confident	75.8	Confident	41 Å²	41	92 Å²	92	27%	0.266	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-67.7	156.2	177.3	-22.6	37.2	0	0	0	112	W835 L837 L873	W835-P875 HydrophobicContact CB-CG 4.25Å; L837-P875 HydrophobicContact CD1-CB 4.31Å; L837-P875 HydrophobicContact CD1-CG 4.42Å; L837-P875 HydrophobicContact CD2-CB 3.74Å; L837-P875 HydrophobicContact CD2-CG 3.87Å; L873-P875 WeakPolarHBondContact O-CD 2.96Å
876	E	82.3	Confident	75.5	Confident	145 Å²	145	91 Å²	91	68%	0.678	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-62.5	136.9	-180	-62.8	-176	165.5	0	0	111.8	R854	R854-E876 VanDerWaalsContact CZ-O 3.31Å; R854-E876 PolarHBondContact NE-O 3.1Å; R854-E876 PolarHBondContact NH2-O 3.14Å
877	D	88	Confident	75.5	Confident	72 Å²	72	95 Å²	95	39%	0.385	53%	0.53	S	S	.	.	S	Bend	trans	-103	-1.5	178.8	50.7	9.6	0	0	0	113.2	R853 R854 V856 K874	R853-D877 CarbonylContact C-O 3.52Å; R853-D877 VanDerWaalsContact CA-O 3.23Å; R853-D877 WeakPolarHBondContact CA-O 3.27Å; R854-D877 PolarHBondContact N-O 3.5Å; V856-D877 HydrophobicContact CB-CB 4.4Å; V856-D877 HydrophobicContact CG2-CB 3.74Å; K874-D877 IonicContact NZ-OD2 3.62Å; K874-D877 PolarHBondContact NZ-OD2 2.89Å
878	A	87.4	Confident	74.9	Confident	27 Å²	27	102.1 Å²	102.1	22%	0.223	55%	0.554	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-141.7	139.5	174.7	0	0	0	0	0	111.2	W851 Q852 R853	W851-A878 HydrophobicContact CE3-CB 4.18Å; Q852-A878 CarbonylContact O-C 3.5Å; Q852-A878 WeakPolarHBondContact O-CA 3.06Å; R853-A878 HydrophobicContact CG-CB 4.06Å
879	K	83.2	Confident	75	Confident	73 Å²	73	102.1 Å²	102.1	32%	0.317	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150	171.4	69.7	175.9	-176.6	175.8	0	111.2	W840 W851 Q852	W840-K879 HydrophobicContact CD2-CD 4.06Å; W840-K879 HydrophobicContact CD2-CG 4.24Å; W840-K879 HydrophobicContact CE3-CD 4.4Å; W840-K879 HydrophobicContact CE3-CG 4.07Å; W840-K879 HydrophobicContact CH2-CB 4.01Å; W840-K879 HydrophobicContact CH2-CD 4.18Å; W840-K879 HydrophobicContact CH2-CG 3.88Å; W840-K879 HydrophobicContact CZ2-CB 4.36Å; W840-K879 HydrophobicContact CZ2-CD 3.79Å; W840-K879 HydrophobicContact CZ2-CG 4.03Å; W840-K879 HydrophobicContact CZ3-CB 4.33Å; W840-K879 HydrophobicContact CZ3-CD 4.47Å; W840-K879 HydrophobicContact CZ3-CG 3.9Å; W851-K879 WeakPolarHBondContact CA-O 3.35Å; Q852-K879 HydrophobicContact CB-CG 4.24Å; Q852-K879 PolarHBondContact N-O 2.9Å; Q852-K879 PolarHBondContact O-N 3.12Å
880	P	82.6	Confident	75	Confident	92 Å²	92	106.9 Å²	106.9	60%	0.597	58%	0.575	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69.3	145.3	174.4	28.2	-32.4	0	0	0	110.7	G850 W851	G850-P880 WeakPolarHBondContact O-CA 3.39Å; W851-P880 HydrophobicContact CE3-CB 4.47Å; W851-P880 HydrophobicContact CH2-CB 4.33Å; W851-P880 HydrophobicContact CH2-CG 4.5Å; W851-P880 HydrophobicContact CZ2-CB 4.43Å; W851-P880 HydrophobicContact CZ3-CB 4.35Å; W851-P880 HydrophobicContact CZ3-CG 4.46Å
881	C	79.9	Confident	75.1	Confident	17 Å²	17	107.2 Å²	107.2	12%	0.115	58%	0.577	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.9	136.6	169.4	48.1	0	0	0	0	108.7	C843 G850 W851 Q852	C843-C881 WeakPolarHBondContact CA-SG 3.42Å; C843-C881 HydrophobicContact CB-CB 3.95Å; C843-C881 WeakPolarHBondContact CB-SG 3.07Å; C843-C881 WeakPolarHBondContact SG-CB 3.43Å; C843-C881 CovalentContact SG-SG 2.03Å; C843-C881 PolarHBondContact SG-SG 3.49Å; G850-C881 CarbonylContact C-O 3.54Å; G850-C881 PolarHBondContact N-O 3.17Å; G850-C881 PolarHBondContact O-N 3Å; G850-C881 VanDerWaalsContact O-O 3.08Å; G850-C881 PolarHBondContact O-SG 3.22Å; W851-C881 PolarHBondContact N-SG 2.89Å; Q852-C881 HydrophobicContact CG-CB 3.9Å
882	E	69.8	Low	75	Confident	182 Å²	182	103.1 Å²	103.1	85%	0.85	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.6	115.7	173	-69.7	-177.7	173	0	0	108
883	S	62.6	Low	75.4	Confident	35 Å²	35	103.9 Å²	103.9	25%	0.245	55%	0.554	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.9	168.9	165.2	51.4	0	0	0	0	109.5	S845 T846 C847 G848	S845-S883 PolarHBondContact O-OG 3.12Å; T846-S883 VanDerWaalsContact C-OG 3.24Å; T846-S883 WeakPolarHBondContact O-CB 3.38Å; T846-S883 PolarHBondContact O-OG 3.04Å; C847-S883 WeakPolarHBondContact CA-OG 3.5Å; C847-S883 PolarHBondContact N-OG 2.93Å; C847-S883 VanDerWaalsContact N-OG 3.1Å; G848-S883 PolarHBondContact N-OG 2.71Å; G848-S883 PolarHBondContact O-N 3.32Å; G848-S883 PolarHBondContact O-OG 3.24Å; G848-S883 VanDerWaalsContact O-OG 3.08Å
884	Q	68.3	Low	75.9	Confident	170 Å²	170	102.4 Å²	102.4	79%	0.794	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-50.9	149.5	-176.5	-66.7	179.3	-1.5	0	0	111.6	C847 G848 C886	C847-Q884 CarbonylContact C-O 3.46Å; C847-Q884 WeakPolarHBondContact CA-O 3.04Å; C847-Q884 VanDerWaalsContact CB-O 3.23Å; C847-Q884 WeakPolarHBondContact CB-O 3.47Å; G848-Q884 PolarHBondContact N-O 2.59Å; Q884-C886 PolarHBondContact O-N 3.41Å
885	L	64.5	Low	75.4	Confident	164 Å²	164	103.2 Å²	103.2	86%	0.859	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-51.8	129.2	175.1	-79.4	159.2	0	0	0	109.8
886	C	69.8	Low	74.9	Confident	64 Å²	64	108 Å²	108	43%	0.432	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-57.4	129.7	179.2	-69.7	0	0	0	0	110	C847 Q884 L888	C847-C886 HydrophobicContact CB-CB 3.8Å; C847-C886 WeakPolarHBondContact CB-SG 3.34Å; C847-C886 PolarHBondContact O-SG 2.02Å; C847-C886 WeakPolarHBondContact SG-CA 3.21Å; C847-C886 WeakPolarHBondContact SG-CB 3.07Å; C847-C886 CovalentContact SG-SG 2.04Å; C847-C886 PolarHBondContact SG-SG 2.9Å; Q884-C886 PolarHBondContact O-N 3.41Å; C886-L888 PolarHBondContact O-N 3.24Å
887	P	74.8	Confident	74.3	Confident	117 Å²	117	104.9 Å²	104.9	76%	0.76	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-59.4	131.5	170	21.2	-25.5	0	0	0	108.3
888	L	60.5	Low	73	Confident	246 Å²	246	107.9 Å²	107.9	100%	1.288	59%	0.589	S	S	*	*			trans	-66.9	0	176.9	-75.8	167.9	0	0	0	111.7	C886	C886-L888 PolarHBondContact O-N 3.24Å

Retrieved 888 of 888 residues in 1123.1 ms (Link to these results)

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