A0A087YB06_POEFO Loading...

Protocadherin 10a

AlphaFold DB , UniProt , Accession A0A087YB06, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,022 aa.

						>A0A087YB06_POEFO|A0A087YB06
EMIWLILLLSILNGALCQLHYSVPEEQEPGTVVGNIAEDLGLDITKLSARRFQTVPSSRTPYLEVNLENGALVVKEKIDREEICKQTIPCLLHLEVFLENPLELFRVEIEVMDVNDNPPSFPEPDIFVEISESAIPGTRFPVENAFDPDVGTNALSTYAITNNNYFSLDVQTQSDGTKFAELVLEKPLDREQQAVHRYVLTAVDGGVPQRTGTALLVVKVLDSNDNAPTFDESVYTVNLRENSPVGTLVIQLNATDVDEGLNGEIIYSFSSHNTPRIKDLFNIDERTGRIEVAGEVDYEESNTHQINVQARDLGANAVPAHCKVLVKLVDVNDNTPEISFSTVTESVSEQHAPGTVIALFSVSDRDSGENGQMSCEIMGDVPFKLKSSFKNYYTIVTDGSLDRENTDSYTITVVATDKGQPSLATSKSIKVHVSDENDNAPRFTQAVYDVYVTENNVPGAFIHAVTALDPDIGQNSLITYSILECDIQGMSVDTYVSINQDTGYLYALRSFDYEQLKEFSFMVQAKDSGAVELFSNATVNVIIVDQNDNAPSVIAPIGKNGTAKEHLPRSAEPGYLVTRIVAMDADDGENARLSYSILRGNEMGMFRMDWRTGELRTARRISPKRDPQGFYDLLIEVRDHGQPPLSSSASVSVILVDSVVEGRSGDRGSASKAKETSLDLTLILIIALGSVSFIFLLAMIVLAVRCQKDKKLNLYTCLLAGDCCLCCGSCCSRQSRGRKQKKLSKSDIMLVQSTNVTTGVGPVGQVPVEESGVGSVGGGFGSHHHQNQNSYCYQVCLTPESAKTDLMFLKPCSPSRSNDADHTNPCGAIVTGYSDQQPDIISNGSILSSETKHQRAELSYLVDRPRRVNSSAFQEADIVSSKDSGHGDSEQGDSDHDATNRGHSAGADLFSNCTEECKALGHSDRCWMPSFVPSDGRQGPDYRSNLHVPGMDATLPDTEVPCSVNLSDQLTMTSSTASSNDRSFSTFGKQQQQYSSSTLERKEYDRGTLPYKPTFLSRKRIC
					

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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	E	42	Very low	46.6	Very low	201 Å²	201	151.4 Å²	151.4	94%	0.939	76%	0.762	S	S	*	*				0	65.1	0	-55.9	173.1	135.1	0	0	110.4	I3 W4	E1-I3 PolarHBondContact O-N 3.04Å; E1-W4 PolarHBondContact O-N 3.27Å
2	M	46.7	Very low	46.1	Very low	181 Å²	181	153.1 Å²	153.1	89%	0.892	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn		37.1	9.3	68.9	-136.7	-171.8	117.9	0	0	117.3
3	I	50.7	Low	45.4	Very low	128 Å²	128	155.1 Å²	155.1	66%	0.656	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.3	-38.5	172.4	-64.2	-178.4	0	0	0	109.2	E1 L5 I6	E1-I3 PolarHBondContact O-N 3.04Å; I3-L5 PolarHBondContact O-N 2.95Å; I3-I6 PolarHBondContact O-N 2.69Å
4	W	45.4	Very low	44.9	Very low	193 Å²	193	149.5 Å²	149.5	73%	0.731	79%	0.788	S	S	*	*	H	α-helix	trans	-62.8	-23.6	175.2	-105.7	82.8	0	0	0	114.6	E1 I6 L7 L8	E1-W4 PolarHBondContact O-N 3.27Å; W4-I6 PolarHBondContact O-N 3.01Å; W4-L7 PolarHBondContact O-N 3.09Å; W4-L8 HydrophobicContact CE3-CD1 4.41Å; W4-L8 HydrophobicContact CZ3-CD1 4.03Å
5	L	50.6	Low	44.4	Very low	149 Å²	149	145.9 Å²	145.9	78%	0.78	79%	0.788	S	S	*	*	H	α-helix	trans	-71.8	-14.1	-179.5	-149.7	76.8	0	0	0	113.7	I3	I3-L5 PolarHBondContact O-N 2.95Å
6	I	52.5	Low	44.4	Very low	135 Å²	135	147.9 Å²	147.9	69%	0.692	80%	0.797	S	S	*	*	H	α-helix	trans	-97.9	-19.3	-177.4	-63.4	174.7	0	0	0	111.5	I3 W4	I3-I6 PolarHBondContact O-N 2.69Å; W4-I6 PolarHBondContact O-N 3.01Å
7	L	47	Very low	44.9	Very low	136 Å²	136	143.5 Å²	143.5	71%	0.712	78%	0.779	S	S	*	*	H	α-helix	trans	-92.6	-9.4	-174	-138.1	83	0	0	0	115.1	W4	W4-L7 PolarHBondContact O-N 3.09Å
8	L	45.3	Very low	46.5	Very low	139 Å²	139	142.2 Å²	142.2	73%	0.728	77%	0.767	S	S	*	*	S	Bend	trans	-92.2	-5	179.1	-131.6	81.6	0	0	0	113.7	W4 S10	W4-L8 HydrophobicContact CE3-CD1 4.41Å; W4-L8 HydrophobicContact CZ3-CD1 4.03Å; L8-S10 VanDerWaalsContact C-N 3.33Å; L8-S10 PolarHBondContact O-N 2.94Å
9	L	44.5	Very low	48.5	Very low	156 Å²	156	135.6 Å²	135.6	82%	0.817	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	15.3	-170.8	-108.9	164.9	0	0	0	114.2
10	S	42.3	Very low	50.5	Low	93 Å²	93	133.7 Å²	133.7	65%	0.65	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.1	11.7	-166.8	62.1	0	0	0	0	116	L8	L8-S10 VanDerWaalsContact C-N 3.33Å; L8-S10 PolarHBondContact O-N 2.94Å
11	I	45.4	Very low	52.4	Low	154 Å²	154	128.4 Å²	128.4	79%	0.79	69%	0.688	S	S	*	*	S	Bend	trans	-136.5	66.5	177	-43.5	179.4	0	0	0	111.2
12	L	40.8	Very low	54.6	Low	172 Å²	172	121.6 Å²	121.6	90%	0.901	66%	0.662	S	S	*	*			trans	-158.1	82.2	164.8	-126.4	153.3	0	0	0	110
13	N	37.5	Very low	56.7	Low	179 Å²	179	113.2 Å²	113.2	96%	0.957	62%	0.621	S	S	*	*			trans	-143	106.8	172	-127.3	-2.4	0	0	0	108.5
14	G	37.8	Very low	58.6	Low	77 Å²	77	109.1 Å²	109.1	79%	0.794	60%	0.603	S	S	*	*			trans	163.4	30.1	-166.7	0	0	0	0	0	113.1
15	A	37.8	Very low	60.7	Low	95 Å²	95	100 Å²	100	79%	0.785	57%	0.568	S	S	*	*			trans	-83.3	124	172.6	0	0	0	0	0	109.1	C17	A15-C17 PolarHBondContact O-N 3.47Å
16	L	43.6	Very low	62.5	Low	178 Å²	178	95.5 Å²	95.5	93%	0.932	54%	0.544	S	S	*	.			trans	-68.4	110.9	160.3	-86.1	149.7	0	0	0	107	Q18	L16-Q18 PolarHBondContact O-N 2.87Å
17	C	53.9	Low	64.2	Low	73 Å²	73	91.9 Å²	91.9	49%	0.493	52%	0.524	S	S	.	.			trans	-80.5	104.8	-179.9	-161.2	0	0	0	0	109	A15	A15-C17 PolarHBondContact O-N 3.47Å
18	Q	72.9	Confident	66.2	Low	120 Å²	120	92.5 Å²	92.5	56%	0.561	52%	0.523	S	S	*	.			trans	-97.2	128	173.2	-178.8	164.5	-27.7	0	0	107.6	L16 E108	L16-Q18 PolarHBondContact O-N 2.87Å; Q18-E108 VanDerWaalsContact NE2-CD 3.25Å; Q18-E108 PolarHBondContact NE2-OE2 2.87Å
19	L	84.1	Confident	68.2	Low	18 Å²	18	89.7 Å²	89.7	9%	0.094	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.5	-172.2	-152.2	68.3	0	0	0	108.9	Y21 I36 D39 L40 R106 V107 E108	L19-Y21 HydrophobicContact CD2-CE2 3.79Å; L19-Y21 WeakPolarHBondContact CD2-OH 3.44Å; L19-Y21 HydrophobicContact CG-CE2 4.25Å; L19-I36 HydrophobicContact CD2-CB 4.24Å; L19-I36 HydrophobicContact CD2-CG1 4.12Å; L19-I36 HydrophobicContact CD2-CG2 3.95Å; L19-D39 HydrophobicContact CD1-CB 3.95Å; L19-L40 HydrophobicContact CD1-CD2 4.1Å; L19-L40 HydrophobicContact CD1-CG 4.47Å; L19-L40 HydrophobicContact CD2-CG 4.29Å; L19-R106 PolarHBondContact N-O 3.4Å; L19-V107 HydrophobicContact CB-CG1 4.48Å; L19-V107 HydrophobicContact CB-CG2 4.27Å; L19-V107 HydrophobicContact CD2-CG2 4.13Å; L19-V107 CarbonylContact O-C 3.41Å; L19-V107 WeakPolarHBondContact O-CA 3.39Å; L19-E108 PolarHBondContact O-N 3.45Å
20	H	88.4	Confident	70.1	Confident	96 Å²	96	84.7 Å²	84.7	44%	0.444	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.1	178.8	-165.8	80.9	0	0	0	109.5	E108 E110	H20-E108 WeakPolarHBondContact CA-O 3.24Å; H20-E110 IonicContact CD2-OE2 3.5Å; H20-E110 IonicContact CE1-OE2 2.7Å; H20-E110 IonicContact NE2-OE2 3.21Å; H20-E110 PolarHBondContact NE2-OE2 2.69Å
21	Y	90.4	Very high	72.3	Confident	23 Å²	23	82.5 Å²	82.5	9%	0.09	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	157.2	167.3	-64.2	-57.3	0	0	0	109.6	L19 V33 N35 I36 D39 L72 V107 E108 I109 E110	L19-Y21 HydrophobicContact CD2-CE2 3.79Å; L19-Y21 WeakPolarHBondContact CD2-OH 3.44Å; L19-Y21 HydrophobicContact CG-CE2 4.25Å; Y21-V33 HydrophobicContact CD2-CG1 4.49Å; Y21-V33 HydrophobicContact CG-CG1 4.25Å; Y21-N35 PolarHBondContact OH-N 2.78Å; Y21-N35 PolarHBondContact OH-O 3.29Å; Y21-I36 HydrophobicContact CE2-CG1 3.8Å; Y21-I36 WeakPolarHBondContact OH-CA 3.26Å; Y21-I36 PolarHBondContact OH-N 2.8Å; Y21-D39 VanDerWaalsContact CE1-OD2 3.28Å; Y21-D39 WeakPolarHBondContact CE1-OD2 3.48Å; Y21-D39 PolarHBondContact OH-OD2 3.3Å; Y21-L72 HydrophobicContact CD2-CD2 3.79Å; Y21-L72 HydrophobicContact CE2-CD2 4.19Å; Y21-V107 HydrophobicContact CD2-CG1 3.56Å; Y21-V107 HydrophobicContact CE2-CG1 3.77Å; Y21-E108 PolarHBondContact N-O 2.95Å; Y21-I109 WeakPolarHBondContact O-CA 3.48Å; Y21-E110 PolarHBondContact O-N 3.42Å
22	S	89.8	Confident	74.4	Confident	59 Å²	59	79.7 Å²	79.7	41%	0.413	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	143.7	162.7	64.4	0	0	0	0	110.1	E110 M112	S22-E110 CarbonylContact C-O 3.59Å; S22-E110 VanDerWaalsContact CA-O 3.26Å; S22-E110 WeakPolarHBondContact CA-O 3.28Å; S22-M112 PolarHBondContact OG-SD 2.9Å
23	V	90.8	Very high	76.7	Confident	4 Å²	4	72.5 Å²	72.5	2%	0.024	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133.9	174.1	71.4	0	0	0	0	106.9	Q27 V33 V74 I78 I109 E110 V111 M112	V23-Q27 HydrophobicContact CG2-CG 4.17Å; V23-V33 HydrophobicContact CB-CG1 4.07Å; V23-V33 HydrophobicContact CB-CG2 4.18Å; V23-V33 HydrophobicContact CG2-CG2 3.8Å; V23-V74 HydrophobicContact CG2-CG2 4.16Å; V23-I78 HydrophobicContact CG1-CD1 3.72Å; V23-I109 HydrophobicContact CB-CG2 4.36Å; V23-I109 HydrophobicContact CG1-CG2 3.78Å; V23-E110 PolarHBondContact N-O 3.13Å; V23-V111 CarbonylContact O-C 3.5Å; V23-V111 WeakPolarHBondContact O-CA 3.25Å; V23-M112 PolarHBondContact O-N 3.44Å
24	P	89.8	Confident	79	Confident	43 Å²	43	64.6 Å²	64.6	28%	0.279	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	156.4	163.8	-11.9	26	0	0	0	109.2	Q27 M112 V114	P24-Q27 HydrophobicContact CB-CG 4.27Å; P24-Q27 HydrophobicContact CG-CG 4.49Å; P24-Q27 VanDerWaalsContact O-CG 3.28Å; P24-Q27 WeakPolarHBondContact O-CG 3.49Å; P24-M112 WeakPolarHBondContact CA-O 3.35Å; P24-M112 HydrophobicContact CG-CE 3.89Å; P24-V114 HydrophobicContact CB-CG2 3.95Å
25	E	90.3	Very high	81.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	37%	0.365	C	S	.	.	S	Bend	trans	-72.9	-174.2	163.4	67.1	-173.8	116.1	0	0	112.2	Q27 I78 R80 V111 M112 D113 V114	E25-Q27 WeakPolarHBondContact O-CG 3.28Å; E25-Q27 PolarHBondContact O-N 3.25Å; E25-Q27 PolarHBondContact O-NE2 3.34Å; E25-I78 HydrophobicContact CB-CG2 4.12Å; E25-R80 HydrophobicContact CB-CB 4.31Å; E25-R80 HydrophobicContact CG-CB 4.48Å; E25-R80 VanDerWaalsContact OE1-CB 3.32Å; E25-R80 WeakPolarHBondContact OE1-CB 3.49Å; E25-R80 WeakPolarHBondContact OE1-CD 3.34Å; E25-R80 IonicContact OE1-NE 2.82Å; E25-R80 PolarHBondContact OE1-NE 3.48Å; E25-R80 WeakPolarHBondContact OE2-CB 3.44Å; E25-R80 PolarHBondContact OE2-N 2.71Å; E25-V111 HydrophobicContact CB-CG1 3.86Å; E25-M112 PolarHBondContact N-O 3.49Å; E25-D113 VanDerWaalsContact OE1-CA 3.28Å; E25-D113 WeakPolarHBondContact OE1-CA 3.29Å; E25-V114 HydrophobicContact CG-CB 3.78Å; E25-V114 HydrophobicContact CG-CG2 3.8Å; E25-V114 PolarHBondContact OE1-N 2.85Å; E25-V114 VanDerWaalsContact OE1-N 3.15Å
26	E	88.4	Confident	83.7	Confident	55 Å²	55	57.7 Å²	57.7	26%	0.257	33%	0.328	S	S	.	.	S	Bend	trans	60.7	5.6	176	-73.7	-71.8	92	0	0	115.7	K77 I78 D116	E26-K77 VanDerWaalsContact CD-CE 3.44Å; E26-K77 WeakPolarHBondContact OE1-CE 3.37Å; E26-K77 IonicContact OE1-NZ 2.93Å; E26-K77 PolarHBondContact OE1-NZ 2.74Å; E26-K77 VanDerWaalsContact OE2-CE 3.26Å; E26-K77 WeakPolarHBondContact OE2-CE 3.16Å; E26-K77 IonicContact OE2-NZ 3.74Å; E26-K77 PolarHBondContact OE2-NZ 2.91Å; E26-I78 PolarHBondContact N-O 2.81Å; E26-D116 HydrophobicContact CG-CB 4.28Å
27	Q	87.9	Confident	85.6	Confident	60 Å²	60	49.2 Å²	49.2	28%	0.28	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-70	142.3	-174.6	-60.5	-53.7	-78.6	0	0	113.3	V23 P24 E25 T31 V74	V23-Q27 HydrophobicContact CG2-CG 4.17Å; P24-Q27 HydrophobicContact CB-CG 4.27Å; P24-Q27 HydrophobicContact CG-CG 4.49Å; P24-Q27 VanDerWaalsContact O-CG 3.28Å; P24-Q27 WeakPolarHBondContact O-CG 3.49Å; E25-Q27 WeakPolarHBondContact O-CG 3.28Å; E25-Q27 PolarHBondContact O-N 3.25Å; E25-Q27 PolarHBondContact O-NE2 3.34Å; Q27-T31 HydrophobicContact CB-CG2 4.28Å; Q27-T31 HydrophobicContact CG-CG2 4.48Å; Q27-V74 HydrophobicContact CB-CG2 4.27Å
28	E	87.6	Confident	87	Confident	149 Å²	149	52 Å²	52	70%	0.696	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-62.4	137.2	177.7	-71	-74	-172	0	0	111.9	G30 T31	E28-G30 PolarHBondContact O-N 3.46Å; E28-T31 VanDerWaalsContact O-CB 3.28Å; E28-T31 WeakPolarHBondContact O-CB 3.28Å; E28-T31 PolarHBondContact O-N 2.88Å; E28-T31 VanDerWaalsContact O-N 3.09Å; E28-T31 PolarHBondContact O-OG1 3.44Å
29	P	88.4	Confident	87.5	Confident	79 Å²	79	50.6 Å²	50.6	51%	0.513	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	131.9	173.5	-30	37.4	0	0	0	113.2
30	G	84.5	Confident	87.4	Confident	52 Å²	52	51.2 Å²	51.2	54%	0.536	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.1	-6.3	-172.7	0	0	0	0	0	114.7	E28 V32 V74	E28-G30 PolarHBondContact O-N 3.46Å; G30-V32 PolarHBondContact O-N 3.01Å; G30-V74 PolarHBondContact N-O 2.73Å
31	T	89.1	Confident	86.9	Confident	47 Å²	47	49.9 Å²	49.9	29%	0.288	30%	0.301	S	S	.	.			trans	-60.7	129.7	173.9	-62.6	0	0	0	0	111	Q27 E28 V73 V74	Q27-T31 HydrophobicContact CB-CG2 4.28Å; Q27-T31 HydrophobicContact CG-CG2 4.48Å; E28-T31 VanDerWaalsContact O-CB 3.28Å; E28-T31 WeakPolarHBondContact O-CB 3.28Å; E28-T31 PolarHBondContact O-N 2.88Å; E28-T31 VanDerWaalsContact O-N 3.09Å; E28-T31 PolarHBondContact O-OG1 3.44Å; T31-V73 CarbonylContact O-C 3.58Å; T31-V73 VanDerWaalsContact O-CA 3.25Å; T31-V73 WeakPolarHBondContact O-CA 3.24Å; T31-V74 PolarHBondContact O-N 2.92Å
32	V	88.5	Confident	86.3	Confident	94 Å²	94	50.1 Å²	50.1	57%	0.57	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	123.1	179.8	-177.6	0	0	0	0	110	G30 A71 V73	G30-V32 PolarHBondContact O-N 3.01Å; V32-A71 HydrophobicContact CG1-CB 4.47Å; V32-V73 HydrophobicContact CG2-CG1 4.01Å
33	V	88.5	Confident	85.7	Confident	21 Å²	21	50.7 Å²	50.7	13%	0.127	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-38	179.1	179.3	0	0	0	0	111.6	Y21 V23 L63 L72 V74 I109	Y21-V33 HydrophobicContact CD2-CG1 4.49Å; Y21-V33 HydrophobicContact CG-CG1 4.25Å; V23-V33 HydrophobicContact CB-CG1 4.07Å; V23-V33 HydrophobicContact CB-CG2 4.18Å; V23-V33 HydrophobicContact CG2-CG2 3.8Å; V33-L63 HydrophobicContact CG2-CD2 4.02Å; V33-L72 HydrophobicContact CB-CB 4.3Å; V33-L72 HydrophobicContact CB-CD2 3.96Å; V33-L72 HydrophobicContact CB-CG 3.96Å; V33-L72 HydrophobicContact CG1-CD2 3.84Å; V33-L72 HydrophobicContact CG1-CG 4.39Å; V33-L72 HydrophobicContact CG2-CG 4.37Å; V33-L72 PolarHBondContact N-O 3.01Å; V33-V74 HydrophobicContact CG2-CG2 3.91Å; V33-I109 HydrophobicContact CG1-CG2 4.2Å
34	G	87.3	Confident	85	Confident	13 Å²	13	54.2 Å²	54.2	13%	0.134	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.4	174.7	-176.4	0	0	0	0	0	111.6	L72	G34-L72 PolarHBondContact O-N 3.23Å
35	N	88.1	Confident	84.3	Confident	28 Å²	28	57.4 Å²	57.4	15%	0.15	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	92.1	-180	-172.7	1.1	0	0	0	111.6	Y21 A37 E38 D39 N69 G70	Y21-N35 PolarHBondContact OH-N 2.78Å; Y21-N35 PolarHBondContact OH-O 3.29Å; N35-A37 PolarHBondContact O-N 2.84Å; N35-A37 VanDerWaalsContact O-N 3.1Å; N35-A37 PolarHBondContact OD1-N 3.42Å; N35-E38 HydrophobicContact CB-CB 3.94Å; N35-E38 VanDerWaalsContact ND2-CB 3.28Å; N35-E38 WeakPolarHBondContact ND2-CB 3.32Å; N35-E38 PolarHBondContact ND2-OE2 3.27Å; N35-E38 PolarHBondContact O-N 3.41Å; N35-D39 PolarHBondContact O-N 2.79Å; N35-D39 VanDerWaalsContact O-OD2 3.12Å; N35-N69 PolarHBondContact OD1-O 3.01Å; N35-G70 PolarHBondContact OD1-O 3.02Å
36	I	86	Confident	83.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-58	-32.1	-173.7	-60.8	161.4	0	0	0	111.7	L19 Y21 L40 F52 V65 G70 L72 V96 V107	L19-I36 HydrophobicContact CD2-CB 4.24Å; L19-I36 HydrophobicContact CD2-CG1 4.12Å; L19-I36 HydrophobicContact CD2-CG2 3.95Å; Y21-I36 HydrophobicContact CE2-CG1 3.8Å; Y21-I36 WeakPolarHBondContact OH-CA 3.26Å; Y21-I36 PolarHBondContact OH-N 2.8Å; I36-L40 HydrophobicContact CG2-CD1 3.74Å; I36-L40 HydrophobicContact CG2-CG 4.46Å; I36-L40 VanDerWaalsContact O-CB 3.26Å; I36-L40 WeakPolarHBondContact O-CB 3.43Å; I36-L40 WeakPolarHBondContact O-CD1 3.42Å; I36-L40 WeakPolarHBondContact O-CG 3.28Å; I36-L40 PolarHBondContact O-N 3.07Å; I36-F52 HydrophobicContact CB-CZ 4.25Å; I36-F52 HydrophobicContact CG2-CE2 4.34Å; I36-F52 HydrophobicContact CG2-CZ 3.92Å; I36-V65 HydrophobicContact CD1-CG1 4.11Å; I36-V65 HydrophobicContact CD1-CG2 3.69Å; I36-G70 PolarHBondContact N-O 2.86Å; I36-L72 HydrophobicContact CD1-CB 4.01Å; I36-L72 HydrophobicContact CD1-CD1 4.46Å; I36-L72 HydrophobicContact CG1-CB 4.38Å; I36-V96 HydrophobicContact CD1-CG1 4.39Å; I36-V96 HydrophobicContact CG2-CG2 4.01Å; I36-V107 HydrophobicContact CD1-CG2 4.12Å; I36-V107 HydrophobicContact CG1-CG2 4.22Å; I36-V107 HydrophobicContact CG2-CG2 4.36Å
37	A	82.8	Confident	83	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-71.9	-44.5	176.8	0	0	0	0	0	112.4	N35 G41 L42 I44 L47	N35-A37 PolarHBondContact O-N 2.84Å; N35-A37 VanDerWaalsContact O-N 3.1Å; N35-A37 PolarHBondContact OD1-N 3.42Å; A37-G41 PolarHBondContact O-N 3.28Å; A37-L42 HydrophobicContact CB-CB 4.32Å; A37-L42 WeakPolarHBondContact O-CA 3.29Å; A37-L42 WeakPolarHBondContact O-CB 3.28Å; A37-L42 PolarHBondContact O-N 3.47Å; A37-I44 HydrophobicContact CB-CG1 4.46Å; A37-L47 HydrophobicContact CB-CD1 3.57Å; A37-L47 HydrophobicContact CB-CD2 3.79Å; A37-L47 HydrophobicContact CB-CG 4.22Å
38	E	83.1	Confident	82.4	Confident	131 Å²	131	61.9 Å²	61.9	61%	0.612	37%	0.368	S	S	*	.	H	α-helix	trans	-70.3	-44.4	-176.8	-175.9	166	-165.2	0	0	111.5	N35 L40 G41	N35-E38 HydrophobicContact CB-CB 3.94Å; N35-E38 VanDerWaalsContact ND2-CB 3.28Å; N35-E38 WeakPolarHBondContact ND2-CB 3.32Å; N35-E38 PolarHBondContact ND2-OE2 3.27Å; N35-E38 PolarHBondContact O-N 3.41Å; E38-L40 VanDerWaalsContact C-N 3.33Å; E38-L40 PolarHBondContact O-N 3.44Å; E38-G41 PolarHBondContact O-N 3.26Å
39	D	84.6	Confident	81.9	Confident	90 Å²	90	58.6 Å²	58.6	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-69.7	-28.6	-179.7	-62.1	-47.1	0	0	0	112.9	L19 Y21 N35 G41	L19-D39 HydrophobicContact CD1-CB 3.95Å; Y21-D39 VanDerWaalsContact CE1-OD2 3.28Å; Y21-D39 WeakPolarHBondContact CE1-OD2 3.48Å; Y21-D39 PolarHBondContact OH-OD2 3.3Å; N35-D39 PolarHBondContact O-N 2.79Å; N35-D39 VanDerWaalsContact O-OD2 3.12Å; D39-G41 VanDerWaalsContact C-N 3.3Å
40	L	81	Confident	81.6	Confident	31 Å²	31	57 Å²	57	16%	0.162	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	2.4	170.5	-65.2	176.3	0	0	0	113.5	L19 I36 E38 L42 F105	L19-L40 HydrophobicContact CD1-CD2 4.1Å; L19-L40 HydrophobicContact CD1-CG 4.47Å; L19-L40 HydrophobicContact CD2-CG 4.29Å; I36-L40 HydrophobicContact CG2-CD1 3.74Å; I36-L40 HydrophobicContact CG2-CG 4.46Å; I36-L40 VanDerWaalsContact O-CB 3.26Å; I36-L40 WeakPolarHBondContact O-CB 3.43Å; I36-L40 WeakPolarHBondContact O-CD1 3.42Å; I36-L40 WeakPolarHBondContact O-CG 3.28Å; I36-L40 PolarHBondContact O-N 3.07Å; E38-L40 VanDerWaalsContact C-N 3.33Å; E38-L40 PolarHBondContact O-N 3.44Å; L40-L42 VanDerWaalsContact C-N 3.25Å; L40-L42 HydrophobicContact CB-CD1 3.93Å; L40-L42 HydrophobicContact CB-CG 3.95Å; L40-L42 HydrophobicContact CD1-CD1 4.14Å; L40-L42 PolarHBondContact O-N 2.87Å; L40-F105 HydrophobicContact CD1-CB 4.02Å; L40-F105 HydrophobicContact CD1-CD1 3.8Å; L40-F105 HydrophobicContact CD1-CD2 3.74Å; L40-F105 HydrophobicContact CD1-CE1 4.17Å; L40-F105 HydrophobicContact CD1-CE2 4.11Å; L40-F105 HydrophobicContact CD1-CG 3.56Å; L40-F105 HydrophobicContact CD1-CZ 4.31Å; L40-F105 HydrophobicContact CD2-CD1 3.65Å; L40-F105 HydrophobicContact CD2-CE1 3.85Å; L40-F105 HydrophobicContact CD2-CG 4.27Å; L40-F105 HydrophobicContact CG-CD1 4.39Å
41	G	78.1	Confident	81.4	Confident	69 Å²	69	61.2 Å²	61.2	71%	0.711	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	22.7	-179.5	0	0	0	0	0	114.5	A37 E38 D39	A37-G41 PolarHBondContact O-N 3.28Å; E38-G41 PolarHBondContact O-N 3.26Å; D39-G41 VanDerWaalsContact C-N 3.3Å
42	L	78.9	Confident	81.2	Confident	28 Å²	28	59.2 Å²	59.2	15%	0.147	34%	0.338	C	S	.	.			trans	-81.4	127.6	-179.1	-62.9	169	0	0	0	110.7	A37 L40 I44 L47 L98	A37-L42 HydrophobicContact CB-CB 4.32Å; A37-L42 WeakPolarHBondContact O-CA 3.29Å; A37-L42 WeakPolarHBondContact O-CB 3.28Å; A37-L42 PolarHBondContact O-N 3.47Å; L40-L42 VanDerWaalsContact C-N 3.25Å; L40-L42 HydrophobicContact CB-CD1 3.93Å; L40-L42 HydrophobicContact CB-CG 3.95Å; L40-L42 HydrophobicContact CD1-CD1 4.14Å; L40-L42 PolarHBondContact O-N 2.87Å; L42-I44 PolarHBondContact O-N 3.3Å; L42-L47 HydrophobicContact CB-CD2 3.99Å; L42-L47 HydrophobicContact CD1-CD2 4.19Å; L42-L98 HydrophobicContact CD1-CD1 3.93Å; L42-L98 HydrophobicContact CD1-CD2 3.93Å; L42-L98 HydrophobicContact CD2-CD2 4.03Å
43	D	75.6	Confident	80.9	Confident	71 Å²	71	58.9 Å²	58.9	38%	0.38	33%	0.33	S	S	.	.			trans	-63.5	111.1	173.4	-178	-20.2	0	0	0	110.3	T45 K46 L47	D43-T45 VanDerWaalsContact CG-OG1 3.31Å; D43-T45 PolarHBondContact O-N 3.49Å; D43-T45 VanDerWaalsContact O-N 3.12Å; D43-T45 WeakPolarHBondContact OD1-CB 3.28Å; D43-T45 PolarHBondContact OD1-N 2.89Å; D43-T45 PolarHBondContact OD1-OG1 2.88Å; D43-T45 PolarHBondContact OD2-OG1 3.26Å; D43-K46 HydrophobicContact CB-CB 4.37Å; D43-K46 HydrophobicContact CB-CD 4.22Å; D43-K46 HydrophobicContact CB-CG 4.12Å; D43-K46 WeakPolarHBondContact O-CA 3.34Å; D43-K46 WeakPolarHBondContact O-CB 3.49Å; D43-K46 PolarHBondContact O-N 2.84Å; D43-K46 IonicContact OD2-NZ 3.93Å; D43-K46 PolarHBondContact OD2-NZ 3.49Å; D43-L47 PolarHBondContact O-N 3.31Å
44	I	76.3	Confident	80.8	Confident	77 Å²	77	58.6 Å²	58.6	40%	0.395	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-51.5	-37.3	-178.4	-62.7	170.4	0	0	0	111.5	A37 L42 K46 L47	A37-I44 HydrophobicContact CB-CG1 4.46Å; L42-I44 PolarHBondContact O-N 3.3Å; I44-K46 PolarHBondContact O-N 3.49Å; I44-K46 VanDerWaalsContact O-N 3.09Å; I44-L47 HydrophobicContact CB-CD1 4.42Å; I44-L47 HydrophobicContact CG2-CD1 4.25Å; I44-L47 PolarHBondContact O-N 3.2Å
45	T	74.5	Confident	80.7	Confident	111 Å²	111	59.2 Å²	59.2	68%	0.681	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-67.7	-11.3	179.6	70.8	0	0	0	0	113.8	D43	D43-T45 VanDerWaalsContact CG-OG1 3.31Å; D43-T45 PolarHBondContact O-N 3.49Å; D43-T45 VanDerWaalsContact O-N 3.12Å; D43-T45 WeakPolarHBondContact OD1-CB 3.28Å; D43-T45 PolarHBondContact OD1-N 2.89Å; D43-T45 PolarHBondContact OD1-OG1 2.88Å; D43-T45 PolarHBondContact OD2-OG1 3.26Å
46	K	74.6	Confident	80.5	Confident	114 Å²	114	62.5 Å²	62.5	50%	0.496	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-110.7	-6	-178.4	-57.8	-170.1	178.2	91.1	0	114.1	D43 I44 S48 A49 R50	D43-K46 HydrophobicContact CB-CB 4.37Å; D43-K46 HydrophobicContact CB-CD 4.22Å; D43-K46 HydrophobicContact CB-CG 4.12Å; D43-K46 WeakPolarHBondContact O-CA 3.34Å; D43-K46 WeakPolarHBondContact O-CB 3.49Å; D43-K46 PolarHBondContact O-N 2.84Å; D43-K46 IonicContact OD2-NZ 3.93Å; D43-K46 PolarHBondContact OD2-NZ 3.49Å; I44-K46 PolarHBondContact O-N 3.49Å; I44-K46 VanDerWaalsContact O-N 3.09Å; K46-S48 PolarHBondContact O-N 3.5Å; K46-A49 PolarHBondContact O-N 3.1Å; K46-R50 WeakPolarHBondContact O-CB 3.28Å; K46-R50 PolarHBondContact O-N 3.3Å
47	L	77.7	Confident	80.2	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-47.7	-179.4	-66.1	171.3	0	0	0	112.4	A37 L42 D43 I44 R50 R51 F52	A37-L47 HydrophobicContact CB-CD1 3.57Å; A37-L47 HydrophobicContact CB-CD2 3.79Å; A37-L47 HydrophobicContact CB-CG 4.22Å; L42-L47 HydrophobicContact CB-CD2 3.99Å; L42-L47 HydrophobicContact CD1-CD2 4.19Å; D43-L47 PolarHBondContact O-N 3.31Å; I44-L47 HydrophobicContact CB-CD1 4.42Å; I44-L47 HydrophobicContact CG2-CD1 4.25Å; I44-L47 PolarHBondContact O-N 3.2Å; L47-R50 CarbonylContact O-C 3.28Å; L47-R50 PolarHBondContact O-N 2.88Å; L47-R51 PolarHBondContact O-N 3.39Å; L47-F52 HydrophobicContact CB-CB 4.17Å; L47-F52 HydrophobicContact CD2-CB 4.3Å; L47-F52 HydrophobicContact CD2-CD1 4.42Å; L47-F52 HydrophobicContact CD2-CG 4.27Å; L47-F52 PolarHBondContact O-N 2.83Å
48	S	76.3	Confident	80.2	Confident	93 Å²	93	68.7 Å²	68.7	65%	0.65	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-39.4	177.2	57.8	0	0	0	0	112.3	K46 R50 R51	K46-S48 PolarHBondContact O-N 3.5Å; S48-R50 VanDerWaalsContact C-N 3.3Å; S48-R50 PolarHBondContact O-N 2.93Å; S48-R51 PolarHBondContact O-N 3.09Å; S48-R51 VanDerWaalsContact O-N 3.13Å
49	A	76.4	Confident	80.2	Confident	81 Å²	81	69.1 Å²	69.1	67%	0.669	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-31	175.2	0	0	0	0	0	112.9	K46	K46-A49 PolarHBondContact O-N 3.1Å
50	R	81.4	Confident	80.1	Confident	44 Å²	44	66.4 Å²	66.4	17%	0.166	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	7.3	172.7	-69.6	-164.8	67.1	-161.8	-4.7	114	K46 L47 S48 F52 L98 E99 N100 P101 E103	K46-R50 WeakPolarHBondContact O-CB 3.28Å; K46-R50 PolarHBondContact O-N 3.3Å; L47-R50 CarbonylContact O-C 3.28Å; L47-R50 PolarHBondContact O-N 2.88Å; S48-R50 VanDerWaalsContact C-N 3.3Å; S48-R50 PolarHBondContact O-N 2.93Å; R50-F52 PolarHBondContact O-N 2.83Å; R50-L98 HydrophobicContact CB-CB 4.35Å; R50-L98 HydrophobicContact CB-CD2 3.91Å; R50-E99 PolarHBondContact NE-O 3.49Å; R50-E99 VanDerWaalsContact NE-O 3.13Å; R50-E99 PolarHBondContact O-N 2.85Å; R50-N100 PolarHBondContact NE-O 3.38Å; R50-P101 PolarHBondContact NH2-O 2.87Å; R50-E103 IonicContact CZ-OE2 2.65Å; R50-E103 IonicContact NH1-OE2 3.04Å; R50-E103 PolarHBondContact NH1-OE2 3.06Å; R50-E103 VanDerWaalsContact NH2-CD 3.33Å; R50-E103 IonicContact NH2-OE2 3.34Å; R50-E103 PolarHBondContact NH2-OE2 3.37Å
51	R	81.4	Confident	80.3	Confident	142 Å²	142	67.9 Å²	67.9	54%	0.536	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	50.3	179.6	-63.6	167.7	161.2	-170.2	-1.5	113.5	L47 S48 Q53 E99	L47-R51 PolarHBondContact O-N 3.39Å; S48-R51 PolarHBondContact O-N 3.09Å; S48-R51 VanDerWaalsContact O-N 3.13Å; R51-Q53 PolarHBondContact O-N 2.69Å; R51-E99 HydrophobicContact CB-CG 4.44Å; R51-E99 WeakPolarHBondContact CD-OE1 3.39Å; R51-E99 WeakPolarHBondContact CD-OE2 3.19Å; R51-E99 IonicContact CZ-OE1 3Å; R51-E99 IonicContact CZ-OE2 3.79Å; R51-E99 IonicContact NE-OE2 2.66Å; R51-E99 IonicContact NH1-OE1 2.7Å; R51-E99 PolarHBondContact NH1-OE1 2.84Å; R51-E99 IonicContact NH1-OE2 3.84Å; R51-E99 PolarHBondContact NH1-OE2 2.84Å
52	F	84.1	Confident	80.8	Confident	5 Å²	5	66.9 Å²	66.9	2%	0.022	37%	0.365	C	S	.	.			trans	-54.7	123.6	173.1	-178.9	-123.4	0	0	0	111.2	I36 L47 R50 V65 L67 V96 F97 L98	I36-F52 HydrophobicContact CB-CZ 4.25Å; I36-F52 HydrophobicContact CG2-CE2 4.34Å; I36-F52 HydrophobicContact CG2-CZ 3.92Å; L47-F52 HydrophobicContact CB-CB 4.17Å; L47-F52 HydrophobicContact CD2-CB 4.3Å; L47-F52 HydrophobicContact CD2-CD1 4.42Å; L47-F52 HydrophobicContact CD2-CG 4.27Å; L47-F52 PolarHBondContact O-N 2.83Å; R50-F52 PolarHBondContact O-N 2.83Å; F52-V65 HydrophobicContact CE1-CG1 3.51Å; F52-V65 HydrophobicContact CZ-CG1 3.95Å; F52-L67 HydrophobicContact CD1-CD2 4.36Å; F52-V96 HydrophobicContact CE2-CB 3.76Å; F52-V96 HydrophobicContact CE2-CG1 4.39Å; F52-V96 HydrophobicContact CE2-CG2 3.76Å; F52-V96 HydrophobicContact CZ-CB 4.2Å; F52-V96 HydrophobicContact CZ-CG1 4.34Å; F52-V96 HydrophobicContact CZ-CG2 4.26Å; F52-F97 WeakPolarHBondContact CA-O 3.31Å; F52-L98 HydrophobicContact CB-CG 4.33Å; F52-L98 HydrophobicContact CD2-CD1 3.6Å; F52-L98 HydrophobicContact CD2-CG 3.86Å; F52-L98 HydrophobicContact CE2-CD1 4.08Å
53	Q	82.8	Confident	81.2	Confident	86 Å²	86	66.2 Å²	66.2	40%	0.402	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	151.7	-177.1	-73	-168.3	5	0	0	113	R51 L67 V96 F97	R51-Q53 PolarHBondContact O-N 2.69Å; Q53-L67 HydrophobicContact CG-CD1 4.48Å; Q53-V96 WeakPolarHBondContact O-CA 3.15Å; Q53-F97 HydrophobicContact CB-CD1 4.33Å; Q53-F97 HydrophobicContact CB-CE1 3.66Å; Q53-F97 HydrophobicContact CB-CE2 4.41Å; Q53-F97 HydrophobicContact CB-CZ 3.71Å; Q53-F97 PolarHBondContact N-O 2.9Å; Q53-F97 WeakPolarHBondContact O-CD1 3.43Å; Q53-F97 PolarHBondContact O-N 2.95Å
54	T	85.8	Confident	81.9	Confident	16 Å²	16	67.3 Å²	67.3	10%	0.098	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	135.2	168	56	0	0	0	0	111	R59 V65 L94 V96	T54-R59 PolarHBondContact O-NH2 3.44Å; T54-R59 PolarHBondContact OG1-NE 2.7Å; T54-R59 PolarHBondContact OG1-NH2 2.87Å; T54-V65 HydrophobicContact CG2-CB 3.72Å; T54-V65 HydrophobicContact CG2-CG2 3.61Å; T54-L94 HydrophobicContact CG2-CD1 4.12Å; T54-V96 HydrophobicContact CG2-CG1 4.11Å
55	V	86.3	Confident	82.4	Confident	25 Å²	25	64 Å²	64	15%	0.152	35%	0.347	C	S	.	.			trans	-64	127.6	174.9	179.3	0	0	0	0	109.1	S57 S58 E95 F97 L104	V55-S57 VanDerWaalsContact C-N 3.26Å; V55-S57 PolarHBondContact O-N 3.38Å; V55-S57 VanDerWaalsContact O-N 3.15Å; V55-S58 PolarHBondContact O-N 2.94Å; V55-S58 PolarHBondContact O-OG 3.12Å; V55-E95 HydrophobicContact CB-CB 4.01Å; V55-E95 HydrophobicContact CG2-CB 3.7Å; V55-E95 PolarHBondContact N-O 3.12Å; V55-F97 HydrophobicContact CG2-CD1 3.77Å; V55-F97 HydrophobicContact CG2-CE1 4.36Å; V55-L104 HydrophobicContact CG2-CD1 3.94Å
56	P	82.3	Confident	83	Confident	97 Å²	97	61.6 Å²	61.6	63%	0.63	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-59.5	-29.2	-172.6	-28.5	36.2	0	0	0	115.8
57	S	81	Confident	83.4	Confident	113 Å²	113	59.6 Å²	59.6	79%	0.79	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-82.8	-9.8	-178.6	50	0	0	0	0	114.8	V55	V55-S57 VanDerWaalsContact C-N 3.26Å; V55-S57 PolarHBondContact O-N 3.38Å; V55-S57 VanDerWaalsContact O-N 3.15Å
58	S	82.5	Confident	83.6	Confident	18 Å²	18	67.3 Å²	67.3	13%	0.126	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-111.8	23.7	176.6	67.8	0	0	0	0	112	V55 L94 E95	V55-S58 PolarHBondContact O-N 2.94Å; V55-S58 PolarHBondContact O-OG 3.12Å; S58-L94 VanDerWaalsContact O-CD1 3.25Å; S58-L94 WeakPolarHBondContact O-CD1 3.4Å; S58-E95 PolarHBondContact OG-N 3.16Å; S58-E95 PolarHBondContact OG-O 3.16Å
59	R	81.8	Confident	83.9	Confident	139 Å²	139	65.8 Å²	65.8	53%	0.525	35%	0.345	S	S	.	.			trans	-87.9	119.7	175.8	-66.8	-178.6	-178.1	174.7	3.8	109.1	T54	T54-R59 PolarHBondContact O-NH2 3.44Å; T54-R59 PolarHBondContact OG1-NE 2.7Å; T54-R59 PolarHBondContact OG1-NH2 2.87Å
60	T	83.1	Confident	84.2	Confident	34 Å²	34	61.9 Å²	61.9	21%	0.209	31%	0.313	C	S	.	.			trans	-85.8	159.3	165.9	63.6	0	0	0	0	109.3	L63 L92	T60-L63 WeakPolarHBondContact OG1-CB 3.26Å; T60-L63 PolarHBondContact OG1-N 2.69Å; T60-L92 HydrophobicContact CG2-CD2 4.29Å
61	P	85.1	Confident	84.5	Confident	61 Å²	61	60.3 Å²	60.3	40%	0.396	31%	0.309	S	S	.	.	S	Bend	trans	-68.5	-29	166.4	28.6	-33.4	0	0	0	111.2	K75	P61-K75 WeakPolarHBondContact O-CD 3.44Å
62	Y	88.4	Confident	84.9	Confident	49 Å²	49	53.5 Å²	53.5	19%	0.192	28%	0.284	C	S	.	.	S	Bend	trans	-77	-22.6	-171.5	-42.6	-64.6	0	0	0	115.4	V74 K75 E76 K77 I78 I83 L92	Y62-V74 WeakPolarHBondContact O-CA 3.43Å; Y62-K75 PolarHBondContact O-N 3.44Å; Y62-E76 HydrophobicContact CD1-CB 4.41Å; Y62-K77 WeakPolarHBondContact CD1-O 3.39Å; Y62-I78 HydrophobicContact CG-CG1 4.31Å; Y62-I83 HydrophobicContact CD2-CD1 3.7Å; Y62-I83 HydrophobicContact CE1-CD1 4.18Å; Y62-I83 HydrophobicContact CE2-CD1 3.29Å; Y62-I83 HydrophobicContact CE2-CG1 3.68Å; Y62-I83 HydrophobicContact CG-CD1 4.29Å; Y62-L92 HydrophobicContact CD2-CD1 4.42Å
63	L	88.8	Confident	85.2	Confident	13 Å²	13	54.9 Å²	54.9	7%	0.068	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135.5	-172.5	-64.6	173.1	0	0	0	112.5	V33 T60 L72 V73 V74 I78 L92 I109	V33-L63 HydrophobicContact CG2-CD2 4.02Å; T60-L63 WeakPolarHBondContact OG1-CB 3.26Å; T60-L63 PolarHBondContact OG1-N 2.69Å; L63-L72 HydrophobicContact CB-CD1 4.15Å; L63-V73 WeakPolarHBondContact CA-O 3.4Å; L63-V74 HydrophobicContact CD2-CG2 4.44Å; L63-I78 HydrophobicContact CD2-CD1 4.35Å; L63-L92 HydrophobicContact CD1-CB 4.49Å; L63-L92 HydrophobicContact CD1-CD1 4Å; L63-I109 HydrophobicContact CD1-CB 4.11Å; L63-I109 HydrophobicContact CD1-CD1 3.84Å; L63-I109 HydrophobicContact CD1-CG1 3.82Å; L63-I109 HydrophobicContact CD1-CG2 4.23Å
64	E	89.3	Confident	85.5	Confident	95 Å²	95	50.8 Å²	50.8	44%	0.444	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.5	174.3	-173.8	162.2	165.2	0	0	111	V73 K75	E64-V73 HydrophobicContact CB-CG2 4.3Å; E64-V73 PolarHBondContact N-O 2.97Å; E64-V73 WeakPolarHBondContact O-CG2 3.31Å; E64-V73 PolarHBondContact O-N 3.44Å; E64-K75 HydrophobicContact CB-CB 4.04Å; E64-K75 HydrophobicContact CB-CG 4.25Å; E64-K75 IonicContact OE2-NZ 3.83Å; E64-K75 PolarHBondContact OE2-NZ 3.2Å
65	V	87.3	Confident	85.6	Confident	6 Å²	6	54.5 Å²	54.5	4%	0.036	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.2	173.7	-179.4	0	0	0	0	108.7	I36 F52 T54 L67 L72 L94 V96	I36-V65 HydrophobicContact CD1-CG1 4.11Å; I36-V65 HydrophobicContact CD1-CG2 3.69Å; F52-V65 HydrophobicContact CE1-CG1 3.51Å; F52-V65 HydrophobicContact CZ-CG1 3.95Å; T54-V65 HydrophobicContact CG2-CB 3.72Å; T54-V65 HydrophobicContact CG2-CG2 3.61Å; V65-L67 HydrophobicContact CB-CD2 4.41Å; V65-L67 HydrophobicContact CG1-CD2 4.29Å; V65-L67 WeakPolarHBondContact O-CD2 3.46Å; V65-L67 PolarHBondContact O-N 2.84Å; V65-L67 VanDerWaalsContact O-N 3.14Å; V65-L72 HydrophobicContact CG2-CD1 3.65Å; V65-L94 HydrophobicContact CG2-CD2 3.74Å; V65-V96 HydrophobicContact CG2-CG1 4.42Å
66	N	86.6	Confident	85.8	Confident	62 Å²	62	58 Å²	58	33%	0.332	30%	0.303	S	S	.	.			trans	-69.7	108.2	170.1	-178.9	-21.9	0	0	0	109.4	E68 N69 G70 A71	N66-E68 PolarHBondContact O-N 3.39Å; N66-E68 WeakPolarHBondContact OD1-CB 3.37Å; N66-E68 PolarHBondContact OD1-N 3.01Å; N66-N69 VanDerWaalsContact CB-OD1 3.26Å; N66-N69 WeakPolarHBondContact CB-OD1 3.4Å; N66-N69 PolarHBondContact ND2-OD1 3.47Å; N66-N69 PolarHBondContact O-N 2.97Å; N66-N69 PolarHBondContact O-OD1 3.37Å; N66-G70 WeakPolarHBondContact O-CA 3.33Å; N66-G70 PolarHBondContact O-N 3.38Å; N66-A71 PolarHBondContact N-O 2.96Å
67	L	83.7	Confident	86.1	Confident	72 Å²	72	58.6 Å²	58.6	38%	0.377	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-11.7	-173.9	-52.9	-176.5	0	0	0	113.9	F52 Q53 V65	F52-L67 HydrophobicContact CD1-CD2 4.36Å; Q53-L67 HydrophobicContact CG-CD1 4.48Å; V65-L67 HydrophobicContact CB-CD2 4.41Å; V65-L67 HydrophobicContact CG1-CD2 4.29Å; V65-L67 WeakPolarHBondContact O-CD2 3.46Å; V65-L67 PolarHBondContact O-N 2.84Å; V65-L67 VanDerWaalsContact O-N 3.14Å
68	E	81.8	Confident	86.5	Confident	162 Å²	162	53.2 Å²	53.2	76%	0.757	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-32.7	178.3	-59.5	-166.5	155.6	0	0	112.8	N66	N66-E68 PolarHBondContact O-N 3.39Å; N66-E68 WeakPolarHBondContact OD1-CB 3.37Å; N66-E68 PolarHBondContact OD1-N 3.01Å
69	N	82.4	Confident	86.9	Confident	61 Å²	61	55.6 Å²	55.6	33%	0.326	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-13.3	-173.4	70.9	-0.3	0	0	0	115.7	N35 N66 A71	N35-N69 PolarHBondContact OD1-O 3.01Å; N66-N69 VanDerWaalsContact CB-OD1 3.26Å; N66-N69 WeakPolarHBondContact CB-OD1 3.4Å; N66-N69 PolarHBondContact ND2-OD1 3.47Å; N66-N69 PolarHBondContact O-N 2.97Å; N66-N69 PolarHBondContact O-OD1 3.37Å; N69-A71 WeakPolarHBondContact OD1-CB 3.35Å; N69-A71 PolarHBondContact OD1-N 2.82Å
70	G	83.1	Confident	87.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.			trans	92	-4.4	-179	0	0	0	0	0	115.7	N35 I36 N66 L72	N35-G70 PolarHBondContact OD1-O 3.02Å; I36-G70 PolarHBondContact N-O 2.86Å; N66-G70 WeakPolarHBondContact O-CA 3.33Å; N66-G70 PolarHBondContact O-N 3.38Å; G70-L72 PolarHBondContact O-N 3.38Å
71	A	87.3	Confident	87.7	Confident	10 Å²	10	48.7 Å²	48.7	8%	0.083	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	127.1	-177.4	0	0	0	0	0	111.6	V32 N66 N69	V32-A71 HydrophobicContact CG1-CB 4.47Å; N66-A71 PolarHBondContact N-O 2.96Å; N69-A71 WeakPolarHBondContact OD1-CB 3.35Å; N69-A71 PolarHBondContact OD1-N 2.82Å
72	L	88.9	Confident	88	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.7	168.1	-179.3	65.2	0	0	0	108.5	Y21 V33 G34 I36 L63 V65 G70 L94 V107 I109	Y21-L72 HydrophobicContact CD2-CD2 3.79Å; Y21-L72 HydrophobicContact CE2-CD2 4.19Å; V33-L72 HydrophobicContact CB-CB 4.3Å; V33-L72 HydrophobicContact CB-CD2 3.96Å; V33-L72 HydrophobicContact CB-CG 3.96Å; V33-L72 HydrophobicContact CG1-CD2 3.84Å; V33-L72 HydrophobicContact CG1-CG 4.39Å; V33-L72 HydrophobicContact CG2-CG 4.37Å; V33-L72 PolarHBondContact N-O 3.01Å; G34-L72 PolarHBondContact O-N 3.23Å; I36-L72 HydrophobicContact CD1-CB 4.01Å; I36-L72 HydrophobicContact CD1-CD1 4.46Å; I36-L72 HydrophobicContact CG1-CB 4.38Å; L63-L72 HydrophobicContact CB-CD1 4.15Å; V65-L72 HydrophobicContact CG2-CD1 3.65Å; G70-L72 PolarHBondContact O-N 3.38Å; L72-L94 HydrophobicContact CD1-CD2 3.64Å; L72-V107 HydrophobicContact CD2-CG1 4.41Å; L72-I109 HydrophobicContact CD2-CD1 4.21Å; L72-I109 HydrophobicContact CD2-CG1 3.8Å
73	V	90.3	Very high	87.9	Confident	33 Å²	33	52.9 Å²	52.9	20%	0.2	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.4	-179.2	-64.9	0	0	0	0	112	T31 V32 L63 E64	T31-V73 CarbonylContact O-C 3.58Å; T31-V73 VanDerWaalsContact O-CA 3.25Å; T31-V73 WeakPolarHBondContact O-CA 3.24Å; V32-V73 HydrophobicContact CG2-CG1 4.01Å; L63-V73 WeakPolarHBondContact CA-O 3.4Å; E64-V73 HydrophobicContact CB-CG2 4.3Å; E64-V73 PolarHBondContact N-O 2.97Å; E64-V73 WeakPolarHBondContact O-CG2 3.31Å; E64-V73 PolarHBondContact O-N 3.44Å
74	V	90.1	Very high	87.9	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	131.2	166	-178.1	0	0	0	0	108.6	V23 Q27 G30 T31 V33 Y62 L63 E76 I78	V23-V74 HydrophobicContact CG2-CG2 4.16Å; Q27-V74 HydrophobicContact CB-CG2 4.27Å; G30-V74 PolarHBondContact N-O 2.73Å; T31-V74 PolarHBondContact O-N 2.92Å; V33-V74 HydrophobicContact CG2-CG2 3.91Å; Y62-V74 WeakPolarHBondContact O-CA 3.43Å; L63-V74 HydrophobicContact CD2-CG2 4.44Å; V74-E76 VanDerWaalsContact CG1-O 3.32Å; V74-E76 WeakPolarHBondContact CG1-O 3.48Å; V74-I78 HydrophobicContact CG2-CD1 4.33Å
75	K	88.2	Confident	87.8	Confident	94 Å²	94	54.9 Å²	54.9	41%	0.409	27%	0.267	S	S	.	.			trans	-109.8	-46.9	-176.8	-173.3	-146.1	179.9	84	0	111.6	P61 Y62 E64	P61-K75 WeakPolarHBondContact O-CD 3.44Å; Y62-K75 PolarHBondContact O-N 3.44Å; E64-K75 HydrophobicContact CB-CB 4.04Å; E64-K75 HydrophobicContact CB-CG 4.25Å; E64-K75 IonicContact OE2-NZ 3.83Å; E64-K75 PolarHBondContact OE2-NZ 3.2Å
76	E	89.5	Confident	87.6	Confident	98 Å²	98	59 Å²	59	46%	0.458	29%	0.286	S	S	.	.	S	Bend	trans	-124.5	148.5	172.7	-68.3	175.2	-160	0	0	107	Y62 V74 I78	Y62-E76 HydrophobicContact CD1-CB 4.41Å; V74-E76 VanDerWaalsContact CG1-O 3.32Å; V74-E76 WeakPolarHBondContact CG1-O 3.48Å; E76-I78 PolarHBondContact O-N 3.11Å
77	K	88.6	Confident	87.5	Confident	110 Å²	110	60.2 Å²	60.2	48%	0.478	30%	0.296	S	S	.	.			trans	-56.8	135.3	-176.2	-157.6	-170.6	-169.3	-144.6	0	109.6	E26 Y62	E26-K77 VanDerWaalsContact CD-CE 3.44Å; E26-K77 WeakPolarHBondContact OE1-CE 3.37Å; E26-K77 IonicContact OE1-NZ 2.93Å; E26-K77 PolarHBondContact OE1-NZ 2.74Å; E26-K77 VanDerWaalsContact OE2-CE 3.26Å; E26-K77 WeakPolarHBondContact OE2-CE 3.16Å; E26-K77 IonicContact OE2-NZ 3.74Å; E26-K77 PolarHBondContact OE2-NZ 2.91Å; Y62-K77 WeakPolarHBondContact CD1-O 3.39Å
78	I	89.8	Confident	87.5	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.306	C	S	.	.			trans	-90	122	177.2	-63.4	163.6	0	0	0	107.5	V23 E25 E26 Y62 L63 V74 E76 I83 V111	V23-I78 HydrophobicContact CG1-CD1 3.72Å; E25-I78 HydrophobicContact CB-CG2 4.12Å; E26-I78 PolarHBondContact N-O 2.81Å; Y62-I78 HydrophobicContact CG-CG1 4.31Å; L63-I78 HydrophobicContact CD2-CD1 4.35Å; V74-I78 HydrophobicContact CG2-CD1 4.33Å; E76-I78 PolarHBondContact O-N 3.11Å; I78-I83 HydrophobicContact CG2-CD1 4.08Å; I78-V111 HydrophobicContact CG2-CB 4.47Å; I78-V111 HydrophobicContact CG2-CG1 3.58Å; I78-V111 HydrophobicContact CG2-CG2 3.99Å
79	D	91	Very high	87.7	Confident	67 Å²	67	58 Å²	58	36%	0.358	29%	0.292	S	S	.	.			trans	-114	112.6	170.9	171.7	-41.5	0	0	0	105.8	E81 E82 I83	D79-E81 PolarHBondContact OD1-N 2.8Å; D79-E82 WeakPolarHBondContact OD1-CB 3.42Å; D79-E82 PolarHBondContact OD1-N 2.63Å; D79-I83 WeakPolarHBondContact O-CD1 3.32Å; D79-I83 WeakPolarHBondContact O-CG1 3.4Å; D79-I83 PolarHBondContact O-N 3.28Å
80	R	91.6	Very high	88.1	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.011	28%	0.278	C	S	.	.	H	α-helix	trans	-80.6	-26.6	-172	-168.6	-163.4	64.9	69.5	-1.3	111.2	E25 C84 K85 C90 V111 D113	E25-R80 HydrophobicContact CB-CB 4.31Å; E25-R80 HydrophobicContact CG-CB 4.48Å; E25-R80 VanDerWaalsContact OE1-CB 3.32Å; E25-R80 WeakPolarHBondContact OE1-CB 3.49Å; E25-R80 WeakPolarHBondContact OE1-CD 3.34Å; E25-R80 IonicContact OE1-NE 2.82Å; E25-R80 PolarHBondContact OE1-NE 3.48Å; E25-R80 WeakPolarHBondContact OE2-CB 3.44Å; E25-R80 PolarHBondContact OE2-N 2.71Å; R80-C84 HydrophobicContact CG-CB 4.39Å; R80-C84 WeakPolarHBondContact O-CA 3.45Å; R80-C84 WeakPolarHBondContact O-CB 3.33Å; R80-C84 PolarHBondContact O-N 3.13Å; R80-K85 PolarHBondContact NH1-O 2.82Å; R80-K85 PolarHBondContact O-N 2.84Å; R80-K85 VanDerWaalsContact O-N 3.14Å; R80-C90 HydrophobicContact CG-CB 4.03Å; R80-V111 HydrophobicContact CB-CG1 3.96Å; R80-V111 HydrophobicContact CG-CB 4.39Å; R80-V111 HydrophobicContact CG-CG1 3.81Å; R80-D113 IonicContact CZ-OD1 2.65Å; R80-D113 IonicContact NE-OD1 3.06Å; R80-D113 PolarHBondContact NE-OD1 2.91Å; R80-D113 IonicContact NH2-OD1 3.25Å; R80-D113 PolarHBondContact NH2-OD1 3.02Å
81	E	90.9	Very high	88.4	Confident	25 Å²	25	58 Å²	58	12%	0.117	29%	0.292	C	S	.	.	H	α-helix	trans	-68.2	-42.6	179.4	-73.1	53	-109.8	0	0	110.7	D79 K85 P148	D79-E81 PolarHBondContact OD1-N 2.8Å; E81-K85 WeakPolarHBondContact O-CA 3.41Å; E81-K85 WeakPolarHBondContact O-CG 3.47Å; E81-K85 PolarHBondContact O-N 3.21Å; E81-K85 VanDerWaalsContact O-N 3.11Å; E81-P148 HydrophobicContact CG-CB 3.57Å
82	E	89.6	Confident	88.4	Confident	145 Å²	145	58.3 Å²	58.3	68%	0.678	29%	0.292	S	S	*	.	H	α-helix	trans	-69	-44.1	174.9	-175.9	167.7	-141.3	0	0	111.3	D79	D79-E82 WeakPolarHBondContact OD1-CB 3.42Å; D79-E82 PolarHBondContact OD1-N 2.63Å
83	I	87.8	Confident	88.3	Confident	53 Å²	53	63.4 Å²	63.4	27%	0.272	32%	0.316	S	S	.	.	H	α-helix	trans	-73.2	-50.8	-175.5	-62.1	166.4	0	0	0	112.2	Y62 I78 D79 L92	Y62-I83 HydrophobicContact CD2-CD1 3.7Å; Y62-I83 HydrophobicContact CE1-CD1 4.18Å; Y62-I83 HydrophobicContact CE2-CD1 3.29Å; Y62-I83 HydrophobicContact CE2-CG1 3.68Å; Y62-I83 HydrophobicContact CG-CD1 4.29Å; I78-I83 HydrophobicContact CG2-CD1 4.08Å; D79-I83 WeakPolarHBondContact O-CD1 3.32Å; D79-I83 WeakPolarHBondContact O-CG1 3.4Å; D79-I83 PolarHBondContact O-N 3.28Å; I83-L92 HydrophobicContact CG2-CD2 4.16Å
84	C	88	Confident	88.2	Confident	21 Å²	21	62.3 Å²	62.3	14%	0.142	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-23.4	-166.5	-76.5	0	0	0	0	113.7	R80 T87 C90	R80-C84 HydrophobicContact CG-CB 4.39Å; R80-C84 WeakPolarHBondContact O-CA 3.45Å; R80-C84 WeakPolarHBondContact O-CB 3.33Å; R80-C84 PolarHBondContact O-N 3.13Å; C84-T87 WeakPolarHBondContact O-CB 3.18Å; C84-T87 PolarHBondContact O-N 2.81Å; C84-T87 PolarHBondContact O-OG1 2.84Å; C84-C90 HydrophobicContact CB-CB 3.67Å; C84-C90 WeakPolarHBondContact CB-SG 3.36Å; C84-C90 WeakPolarHBondContact SG-CA 3.35Å; C84-C90 WeakPolarHBondContact SG-CB 3.34Å; C84-C90 CovalentContact SG-SG 2.03Å; C84-C90 PolarHBondContact SG-SG 3.34Å
85	K	87.3	Confident	88.1	Confident	129 Å²	129	64.2 Å²	64.2	56%	0.561	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	-141.6	-171	-57.5	177.1	-177.7	-166.1	0	109.7	R80 E81 T87	R80-K85 PolarHBondContact NH1-O 2.82Å; R80-K85 PolarHBondContact O-N 2.84Å; R80-K85 VanDerWaalsContact O-N 3.14Å; E81-K85 WeakPolarHBondContact O-CA 3.41Å; E81-K85 WeakPolarHBondContact O-CG 3.47Å; E81-K85 PolarHBondContact O-N 3.21Å; E81-K85 VanDerWaalsContact O-N 3.11Å; K85-T87 PolarHBondContact O-N 2.84Å
86	Q	83.6	Confident	88	Confident	93 Å²	93	59.8 Å²	59.8	44%	0.435	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	20.4	-179.9	-62.8	66.4	47.5	0	0	113.7	P148 V150	Q86-P148 PolarHBondContact NE2-O 3.17Å; Q86-V150 HydrophobicContact CB-CG1 4.27Å; Q86-V150 HydrophobicContact CG-CG1 4.47Å
87	T	84.3	Confident	87.8	Confident	88 Å²	88	57 Å²	57	54%	0.54	29%	0.285	S	S	.	.			trans	-84.5	123.7	-179.2	-48.8	0	0	0	0	111.2	C84 K85	C84-T87 WeakPolarHBondContact O-CB 3.18Å; C84-T87 PolarHBondContact O-N 2.81Å; C84-T87 PolarHBondContact O-OG1 2.84Å; K85-T87 PolarHBondContact O-N 2.84Å
88	I	83	Confident	87.6	Confident	117 Å²	117	51.9 Å²	51.9	60%	0.6	26%	0.262	S	S	*	.	S	Bend	trans	-121.9	131.8	-179	-44.6	177.3	0	0	0	109.7	V150	I88-V150 HydrophobicContact CD1-CB 3.83Å; I88-V150 HydrophobicContact CD1-CG1 4.25Å; I88-V150 HydrophobicContact CD1-CG2 4.16Å; I88-V150 HydrophobicContact CG1-CB 4.12Å; I88-V150 HydrophobicContact CG1-CG1 4.2Å; I88-V150 HydrophobicContact CG1-CG2 4.12Å
89	P	86.8	Confident	87.3	Confident	70 Å²	70	54.3 Å²	54.3	46%	0.455	27%	0.274	S	S	.	.	S	Bend	cis	-75.7	153.7	-9.6	32.4	-35.2	0	0	0	112.3	L91	P89-L91 HydrophobicContact CB-CD2 4.25Å; P89-L91 HydrophobicContact CB-CG 4.17Å; P89-L91 HydrophobicContact CG-CD1 3.97Å; P89-L91 HydrophobicContact CG-CD2 4.39Å; P89-L91 HydrophobicContact CG-CG 3.97Å; P89-L91 PolarHBondContact O-N 2.87Å
90	C	89.9	Confident	86.5	Confident	6 Å²	6	57.1 Å²	57.1	4%	0.041	29%	0.289	C	S	.	.			trans	-87.9	104	171.6	-174.9	0	0	0	0	109.9	R80 C84 E110 V111	R80-C90 HydrophobicContact CG-CB 4.03Å; C84-C90 HydrophobicContact CB-CB 3.67Å; C84-C90 WeakPolarHBondContact CB-SG 3.36Å; C84-C90 WeakPolarHBondContact SG-CA 3.35Å; C84-C90 WeakPolarHBondContact SG-CB 3.34Å; C84-C90 CovalentContact SG-SG 2.03Å; C84-C90 PolarHBondContact SG-SG 3.34Å; C90-E110 WeakPolarHBondContact O-CA 3.45Å; C90-V111 HydrophobicContact CB-CB 4.19Å; C90-V111 PolarHBondContact O-N 2.64Å
91	L	89.2	Confident	85.9	Confident	56 Å²	56	60.8 Å²	60.8	29%	0.293	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.8	-174.7	-61.5	177.7	0	0	0	111.8	P89 E110	P89-L91 HydrophobicContact CB-CD2 4.25Å; P89-L91 HydrophobicContact CB-CG 4.17Å; P89-L91 HydrophobicContact CG-CD1 3.97Å; P89-L91 HydrophobicContact CG-CD2 4.39Å; P89-L91 HydrophobicContact CG-CG 3.97Å; P89-L91 PolarHBondContact O-N 2.87Å; L91-E110 HydrophobicContact CD2-CB 3.96Å; L91-E110 HydrophobicContact CD2-CG 4.24Å
92	L	87.1	Confident	85.4	Confident	15 Å²	15	66.1 Å²	66.1	8%	0.079	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	123.9	166.2	-61	178.5	0	0	0	109.2	T60 Y62 L63 I83 I109 V111	T60-L92 HydrophobicContact CG2-CD2 4.29Å; Y62-L92 HydrophobicContact CD2-CD1 4.42Å; L63-L92 HydrophobicContact CD1-CB 4.49Å; L63-L92 HydrophobicContact CD1-CD1 4Å; I83-L92 HydrophobicContact CG2-CD2 4.16Å; L92-I109 HydrophobicContact CB-CB 4.33Å; L92-I109 PolarHBondContact N-O 2.94Å; L92-I109 WeakPolarHBondContact O-CD1 3.34Å; L92-I109 PolarHBondContact O-N 3.37Å; L92-V111 HydrophobicContact CD1-CG2 3.89Å; L92-V111 HydrophobicContact CG-CG2 4.04Å
93	H	87.7	Confident	85	Confident	108 Å²	108	62.4 Å²	62.4	50%	0.5	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	122.9	179.6	-57.1	-79	0	0	0	111.4	E108	H93-E108 IonicContact CE1-OE1 3.07Å; H93-E108 PolarHBondContact CE1-OE1 2.69Å; H93-E108 IonicContact ND1-OE1 2.78Å; H93-E108 PolarHBondContact ND1-OE1 3.07Å
94	L	88.1	Confident	84.8	Confident	10 Å²	10	64.4 Å²	64.4	5%	0.052	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128	178.5	173.3	64.1	0	0	0	109.9	T54 S58 V65 L72 V96 V107 I109	T54-L94 HydrophobicContact CG2-CD1 4.12Å; S58-L94 VanDerWaalsContact O-CD1 3.25Å; S58-L94 WeakPolarHBondContact O-CD1 3.4Å; V65-L94 HydrophobicContact CG2-CD2 3.74Å; L72-L94 HydrophobicContact CD1-CD2 3.64Å; L94-V96 HydrophobicContact CG-CG1 4.32Å; L94-V107 HydrophobicContact CB-CB 4.31Å; L94-V107 PolarHBondContact N-O 3.03Å; L94-V107 PolarHBondContact O-N 2.82Å; L94-V107 VanDerWaalsContact O-O 3.09Å; L94-I109 HydrophobicContact CB-CD1 3.87Å; L94-I109 HydrophobicContact CD2-CD1 4.44Å
95	E	87.9	Confident	84.7	Confident	41 Å²	41	65 Å²	65	19%	0.192	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.4	173.1	-58.8	-165.4	142.2	0	0	110.7	V55 S58 L104 F105 R106	V55-E95 HydrophobicContact CB-CB 4.01Å; V55-E95 HydrophobicContact CG2-CB 3.7Å; V55-E95 PolarHBondContact N-O 3.12Å; S58-E95 PolarHBondContact OG-N 3.16Å; S58-E95 PolarHBondContact OG-O 3.16Å; E95-L104 HydrophobicContact CB-CD1 4.23Å; E95-F105 WeakPolarHBondContact CA-O 3.28Å; E95-R106 HydrophobicContact CG-CG 4.25Å; E95-R106 IonicContact OE1-CZ 2.88Å; E95-R106 IonicContact OE1-NE 2.7Å; E95-R106 PolarHBondContact OE1-NE 3.47Å; E95-R106 IonicContact OE1-NH2 3.7Å; E95-R106 PolarHBondContact OE1-NH2 3.16Å
96	V	86.1	Confident	84.6	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	147.2	175.6	-58.8	0	0	0	0	110.5	I36 F52 Q53 T54 V65 L94 F105 V107	I36-V96 HydrophobicContact CD1-CG1 4.39Å; I36-V96 HydrophobicContact CG2-CG2 4.01Å; F52-V96 HydrophobicContact CE2-CB 3.76Å; F52-V96 HydrophobicContact CE2-CG1 4.39Å; F52-V96 HydrophobicContact CE2-CG2 3.76Å; F52-V96 HydrophobicContact CZ-CB 4.2Å; F52-V96 HydrophobicContact CZ-CG1 4.34Å; F52-V96 HydrophobicContact CZ-CG2 4.26Å; Q53-V96 WeakPolarHBondContact O-CA 3.15Å; T54-V96 HydrophobicContact CG2-CG1 4.11Å; V65-V96 HydrophobicContact CG2-CG1 4.42Å; L94-V96 HydrophobicContact CG-CG1 4.32Å; V96-F105 HydrophobicContact CG2-CB 3.94Å; V96-F105 PolarHBondContact N-O 3.43Å; V96-F105 PolarHBondContact O-N 3.48Å; V96-V107 HydrophobicContact CG2-CG2 4.32Å
97	F	85.9	Confident	84.8	Confident	41 Å²	41	61.4 Å²	61.4	18%	0.18	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	156.9	-180	71.4	-81.9	0	0	0	112.9	F52 Q53 V55 E103 L104	F52-F97 WeakPolarHBondContact CA-O 3.31Å; Q53-F97 HydrophobicContact CB-CD1 4.33Å; Q53-F97 HydrophobicContact CB-CE1 3.66Å; Q53-F97 HydrophobicContact CB-CE2 4.41Å; Q53-F97 HydrophobicContact CB-CZ 3.71Å; Q53-F97 PolarHBondContact N-O 2.9Å; Q53-F97 WeakPolarHBondContact O-CD1 3.43Å; Q53-F97 PolarHBondContact O-N 2.95Å; V55-F97 HydrophobicContact CG2-CD1 3.77Å; V55-F97 HydrophobicContact CG2-CE1 4.36Å; F97-E103 CarbonylContact C-O 3.55Å; F97-E103 WeakPolarHBondContact CA-O 3.37Å; F97-E103 WeakPolarHBondContact CB-O 3.44Å; F97-L104 HydrophobicContact CB-CD1 4.01Å
98	L	84.5	Confident	85.1	Confident	1 Å²	1	59 Å²	59	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	152.2	170.1	-69.4	88.5	0	0	0	109	L42 R50 F52 L102 E103 F105	L42-L98 HydrophobicContact CD1-CD1 3.93Å; L42-L98 HydrophobicContact CD1-CD2 3.93Å; L42-L98 HydrophobicContact CD2-CD2 4.03Å; R50-L98 HydrophobicContact CB-CB 4.35Å; R50-L98 HydrophobicContact CB-CD2 3.91Å; F52-L98 HydrophobicContact CB-CG 4.33Å; F52-L98 HydrophobicContact CD2-CD1 3.6Å; F52-L98 HydrophobicContact CD2-CG 3.86Å; F52-L98 HydrophobicContact CE2-CD1 4.08Å; L98-L102 VanDerWaalsContact O-CA 3.31Å; L98-L102 WeakPolarHBondContact O-CA 3.4Å; L98-E103 PolarHBondContact N-O 2.87Å; L98-E103 PolarHBondContact O-N 2.84Å; L98-F105 HydrophobicContact CD1-CD2 4.16Å; L98-F105 HydrophobicContact CD1-CE2 4Å
99	E	82.4	Confident	85.4	Confident	51 Å²	51	53.4 Å²	53.4	24%	0.238	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	158	169.3	-65.8	-176.3	-157.2	0	0	111.7	R50 R51 P101	R50-E99 PolarHBondContact NE-O 3.49Å; R50-E99 VanDerWaalsContact NE-O 3.13Å; R50-E99 PolarHBondContact O-N 2.85Å; R51-E99 HydrophobicContact CB-CG 4.44Å; R51-E99 WeakPolarHBondContact CD-OE1 3.39Å; R51-E99 WeakPolarHBondContact CD-OE2 3.19Å; R51-E99 IonicContact CZ-OE1 3Å; R51-E99 IonicContact CZ-OE2 3.79Å; R51-E99 IonicContact NE-OE2 2.66Å; R51-E99 IonicContact NH1-OE1 2.7Å; R51-E99 PolarHBondContact NH1-OE1 2.84Å; R51-E99 IonicContact NH1-OE2 3.84Å; R51-E99 PolarHBondContact NH1-OE2 2.84Å; E99-P101 CarbonylContact C-O 2.99Å
100	N	75.4	Confident	85.6	Confident	127 Å²	127	53.3 Å²	53.3	68%	0.679	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	77.8	172.9	-53.7	-64.9	0	0	0	116.1	R50	R50-N100 PolarHBondContact NE-O 3.38Å
101	P	77.7	Confident	85.6	Confident	80 Å²	80	53.3 Å²	53.3	52%	0.519	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	cis	-69.4	162.1	-6	30.8	-36.7	0	0	0	112	R50 E99 E103	R50-P101 PolarHBondContact NH2-O 2.87Å; E99-P101 CarbonylContact C-O 2.99Å; P101-E103 HydrophobicContact CG-CG 4.19Å; P101-E103 WeakPolarHBondContact CG-OE1 3.44Å; P101-E103 PolarHBondContact O-N 3.03Å
102	L	80.7	Confident	85.6	Confident	136 Å²	136	54.3 Å²	54.3	71%	0.712	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	116.4	175.5	-167.6	148.3	0	0	0	109.6	L98	L98-L102 VanDerWaalsContact O-CA 3.31Å; L98-L102 WeakPolarHBondContact O-CA 3.4Å
103	E	82.5	Confident	85.8	Confident	67 Å²	67	55.2 Å²	55.2	31%	0.313	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	134.9	-177.1	-69.5	169.8	164.7	0	0	108.6	R50 F97 L98 P101 F105	R50-E103 IonicContact CZ-OE2 2.65Å; R50-E103 IonicContact NH1-OE2 3.04Å; R50-E103 PolarHBondContact NH1-OE2 3.06Å; R50-E103 VanDerWaalsContact NH2-CD 3.33Å; R50-E103 IonicContact NH2-OE2 3.34Å; R50-E103 PolarHBondContact NH2-OE2 3.37Å; F97-E103 CarbonylContact C-O 3.55Å; F97-E103 WeakPolarHBondContact CA-O 3.37Å; F97-E103 WeakPolarHBondContact CB-O 3.44Å; L98-E103 PolarHBondContact N-O 2.87Å; L98-E103 PolarHBondContact O-N 2.84Å; P101-E103 HydrophobicContact CG-CG 4.19Å; P101-E103 WeakPolarHBondContact CG-OE1 3.44Å; P101-E103 PolarHBondContact O-N 3.03Å; E103-F105 HydrophobicContact CB-CE2 3.72Å; E103-F105 HydrophobicContact CB-CZ 4.15Å
104	L	83.5	Confident	85.9	Confident	95 Å²	95	52.4 Å²	52.4	50%	0.497	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.8	-179.6	179.1	72.7	0	0	0	108.3	V55 E95 F97	V55-L104 HydrophobicContact CG2-CD1 3.94Å; E95-L104 HydrophobicContact CB-CD1 4.23Å; F97-L104 HydrophobicContact CB-CD1 4.01Å
105	F	85	Confident	86.1	Confident	35 Å²	35	52.9 Å²	52.9	15%	0.154	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.4	179.2	-61.1	-85	0	0	0	110.2	L40 E95 V96 L98 E103	L40-F105 HydrophobicContact CD1-CB 4.02Å; L40-F105 HydrophobicContact CD1-CD1 3.8Å; L40-F105 HydrophobicContact CD1-CD2 3.74Å; L40-F105 HydrophobicContact CD1-CE1 4.17Å; L40-F105 HydrophobicContact CD1-CE2 4.11Å; L40-F105 HydrophobicContact CD1-CG 3.56Å; L40-F105 HydrophobicContact CD1-CZ 4.31Å; L40-F105 HydrophobicContact CD2-CD1 3.65Å; L40-F105 HydrophobicContact CD2-CE1 3.85Å; L40-F105 HydrophobicContact CD2-CG 4.27Å; L40-F105 HydrophobicContact CG-CD1 4.39Å; E95-F105 WeakPolarHBondContact CA-O 3.28Å; V96-F105 HydrophobicContact CG2-CB 3.94Å; V96-F105 PolarHBondContact N-O 3.43Å; V96-F105 PolarHBondContact O-N 3.48Å; L98-F105 HydrophobicContact CD1-CD2 4.16Å; L98-F105 HydrophobicContact CD1-CE2 4Å; E103-F105 HydrophobicContact CB-CE2 3.72Å; E103-F105 HydrophobicContact CB-CZ 4.15Å
106	R	86.4	Confident	86.1	Confident	144 Å²	144	53.2 Å²	53.2	54%	0.543	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.4	171.4	-69.4	-171.8	164.9	169.4	-4.2	109	L19 E95	L19-R106 PolarHBondContact N-O 3.4Å; E95-R106 HydrophobicContact CG-CG 4.25Å; E95-R106 IonicContact OE1-CZ 2.88Å; E95-R106 IonicContact OE1-NE 2.7Å; E95-R106 PolarHBondContact OE1-NE 3.47Å; E95-R106 IonicContact OE1-NH2 3.7Å; E95-R106 PolarHBondContact OE1-NH2 3.16Å
107	V	87.4	Confident	86.3	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	118.5	172.1	-170.2	0	0	0	0	106.5	L19 Y21 I36 L72 L94 V96 I109	L19-V107 HydrophobicContact CB-CG1 4.48Å; L19-V107 HydrophobicContact CB-CG2 4.27Å; L19-V107 HydrophobicContact CD2-CG2 4.13Å; L19-V107 CarbonylContact O-C 3.41Å; L19-V107 WeakPolarHBondContact O-CA 3.39Å; Y21-V107 HydrophobicContact CD2-CG1 3.56Å; Y21-V107 HydrophobicContact CE2-CG1 3.77Å; I36-V107 HydrophobicContact CD1-CG2 4.12Å; I36-V107 HydrophobicContact CG1-CG2 4.22Å; I36-V107 HydrophobicContact CG2-CG2 4.36Å; L72-V107 HydrophobicContact CD2-CG1 4.41Å; L94-V107 HydrophobicContact CB-CB 4.31Å; L94-V107 PolarHBondContact N-O 3.03Å; L94-V107 PolarHBondContact O-N 2.82Å; L94-V107 VanDerWaalsContact O-O 3.09Å; V96-V107 HydrophobicContact CG2-CG2 4.32Å; V107-I109 HydrophobicContact CB-CD1 4.37Å; V107-I109 HydrophobicContact CG1-CD1 3.86Å; V107-I109 HydrophobicContact CG1-CG1 4.26Å
108	E	89.7	Confident	86.6	Confident	37 Å²	37	56.2 Å²	56.2	17%	0.173	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	130.5	171.1	-60.3	-170.8	140.8	0	0	107.6	Q18 L19 H20 Y21 H93	Q18-E108 VanDerWaalsContact NE2-CD 3.25Å; Q18-E108 PolarHBondContact NE2-OE2 2.87Å; L19-E108 PolarHBondContact O-N 3.45Å; H20-E108 WeakPolarHBondContact CA-O 3.24Å; Y21-E108 PolarHBondContact N-O 2.95Å; H93-E108 IonicContact CE1-OE1 3.07Å; H93-E108 PolarHBondContact CE1-OE1 2.69Å; H93-E108 IonicContact ND1-OE1 2.78Å; H93-E108 PolarHBondContact ND1-OE1 3.07Å
109	I	90.1	Very high	87	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	111	179.1	-54	86.6	0	0	0	107.4	Y21 V23 V33 L63 L72 L92 L94 V107	Y21-I109 WeakPolarHBondContact O-CA 3.48Å; V23-I109 HydrophobicContact CB-CG2 4.36Å; V23-I109 HydrophobicContact CG1-CG2 3.78Å; V33-I109 HydrophobicContact CG1-CG2 4.2Å; L63-I109 HydrophobicContact CD1-CB 4.11Å; L63-I109 HydrophobicContact CD1-CD1 3.84Å; L63-I109 HydrophobicContact CD1-CG1 3.82Å; L63-I109 HydrophobicContact CD1-CG2 4.23Å; L72-I109 HydrophobicContact CD2-CD1 4.21Å; L72-I109 HydrophobicContact CD2-CG1 3.8Å; L92-I109 HydrophobicContact CB-CB 4.33Å; L92-I109 PolarHBondContact N-O 2.94Å; L92-I109 WeakPolarHBondContact O-CD1 3.34Å; L92-I109 PolarHBondContact O-N 3.37Å; L94-I109 HydrophobicContact CB-CD1 3.87Å; L94-I109 HydrophobicContact CD2-CD1 4.44Å; V107-I109 HydrophobicContact CB-CD1 4.37Å; V107-I109 HydrophobicContact CG1-CD1 3.86Å; V107-I109 HydrophobicContact CG1-CG1 4.26Å
110	E	90.2	Very high	87.5	Confident	68 Å²	68	56.6 Å²	56.6	32%	0.318	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	115.6	173.4	-175	167.7	-156.9	0	0	109.4	H20 Y21 S22 V23 C90 L91 M112	H20-E110 IonicContact CD2-OE2 3.5Å; H20-E110 IonicContact CE1-OE2 2.7Å; H20-E110 IonicContact NE2-OE2 3.21Å; H20-E110 PolarHBondContact NE2-OE2 2.69Å; Y21-E110 PolarHBondContact O-N 3.42Å; S22-E110 CarbonylContact C-O 3.59Å; S22-E110 VanDerWaalsContact CA-O 3.26Å; S22-E110 WeakPolarHBondContact CA-O 3.28Å; V23-E110 PolarHBondContact N-O 3.13Å; C90-E110 WeakPolarHBondContact O-CA 3.45Å; L91-E110 HydrophobicContact CD2-CB 3.96Å; L91-E110 HydrophobicContact CD2-CG 4.24Å; E110-M112 PolarHBondContact O-N 2.93Å
111	V	90.6	Very high	88.3	Confident	6 Å²	6	51.9 Å²	51.9	4%	0.036	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	111.7	172.4	-178.6	0	0	0	0	107.4	V23 E25 I78 R80 C90 L92	V23-V111 CarbonylContact O-C 3.5Å; V23-V111 WeakPolarHBondContact O-CA 3.25Å; E25-V111 HydrophobicContact CB-CG1 3.86Å; I78-V111 HydrophobicContact CG2-CB 4.47Å; I78-V111 HydrophobicContact CG2-CG1 3.58Å; I78-V111 HydrophobicContact CG2-CG2 3.99Å; R80-V111 HydrophobicContact CB-CG1 3.96Å; R80-V111 HydrophobicContact CG-CB 4.39Å; R80-V111 HydrophobicContact CG-CG1 3.81Å; C90-V111 HydrophobicContact CB-CB 4.19Å; C90-V111 PolarHBondContact O-N 2.64Å; L92-V111 HydrophobicContact CD1-CG2 3.89Å; L92-V111 HydrophobicContact CG-CG2 4.04Å
112	M	89.6	Confident	88.9	Confident	78 Å²	78	52.5 Å²	52.5	38%	0.384	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128.6	178	-57.3	-175.3	-63.9	0	0	110	S22 V23 P24 E25 E110	S22-M112 PolarHBondContact OG-SD 2.9Å; V23-M112 PolarHBondContact O-N 3.44Å; P24-M112 WeakPolarHBondContact CA-O 3.35Å; P24-M112 HydrophobicContact CG-CE 3.89Å; E25-M112 PolarHBondContact N-O 3.49Å; E110-M112 PolarHBondContact O-N 2.93Å
113	D	90.8	Very high	89.3	Confident	33 Å²	33	51 Å²	51	18%	0.176	26%	0.263	C	S	.	.			trans	-62	138.2	179.5	176.1	104.5	0	0	0	113	E25 R80 V150 N153	E25-D113 VanDerWaalsContact OE1-CA 3.28Å; E25-D113 WeakPolarHBondContact OE1-CA 3.29Å; R80-D113 IonicContact CZ-OD1 2.65Å; R80-D113 IonicContact NE-OD1 3.06Å; R80-D113 PolarHBondContact NE-OD1 2.91Å; R80-D113 IonicContact NH2-OD1 3.25Å; R80-D113 PolarHBondContact NH2-OD1 3.02Å; D113-V150 HydrophobicContact CB-CG2 3.8Å; D113-V150 VanDerWaalsContact OD1-CG2 3.31Å; D113-V150 WeakPolarHBondContact OD1-CG2 3.43Å; D113-V150 PolarHBondContact OD1-N 2.74Å; D113-N153 PolarHBondContact O-ND2 2.71Å; D113-N153 VanDerWaalsContact OD2-CB 3.25Å; D113-N153 WeakPolarHBondContact OD2-CB 3.11Å; D113-N153 PolarHBondContact OD2-ND2 2.64Å
114	V	90.4	Very high	89.6	Confident	49 Å²	49	52.6 Å²	52.6	30%	0.297	28%	0.279	S	S	.	.			trans	-125.4	138.2	178.9	173.6	0	0	0	0	109.3	P24 E25 D116	P24-V114 HydrophobicContact CB-CG2 3.95Å; E25-V114 HydrophobicContact CG-CB 3.78Å; E25-V114 HydrophobicContact CG-CG2 3.8Å; E25-V114 PolarHBondContact OE1-N 2.85Å; E25-V114 VanDerWaalsContact OE1-N 3.15Å; V114-D116 VanDerWaalsContact C-N 3.32Å; V114-D116 HydrophobicContact CG1-CB 4.45Å; V114-D116 PolarHBondContact O-N 2.89Å
115	N	90.6	Very high	90	Very high	21 Å²	21	51.5 Å²	51.5	11%	0.112	27%	0.274	C	S	.	.	S	Bend	trans	-70.1	86.1	177.1	-172.6	0.1	0	0	0	111.7	N117 D149 N153 D204 P208 R210	N115-N117 PolarHBondContact OD1-O 2.84Å; N115-N117 VanDerWaalsContact OD1-O 3.12Å; N115-D149 WeakPolarHBondContact CA-OD2 3.35Å; N115-N153 HydrophobicContact CB-CB 3.92Å; N115-N153 PolarHBondContact N-ND2 3.03Å; N115-D204 PolarHBondContact ND2-OD1 2.87Å; N115-D204 PolarHBondContact ND2-OD2 2.81Å; N115-D204 PolarHBondContact OD1-OD2 2.98Å; N115-P208 PolarHBondContact ND2-O 2.93Å; N115-R210 VanDerWaalsContact CG-CD 3.45Å; N115-R210 WeakPolarHBondContact ND2-CD 3.46Å; N115-R210 WeakPolarHBondContact OD1-CD 3.3Å
116	D	88.9	Confident	90.3	Very high	47 Å²	47	50.2 Å²	50.2	25%	0.251	27%	0.268	S	S	.	.			trans	-121.6	-21.2	-171.4	135.4	-70.2	0	0	0	111.8	E26 V114 D149 R210	E26-D116 HydrophobicContact CG-CB 4.28Å; V114-D116 VanDerWaalsContact C-N 3.32Å; V114-D116 HydrophobicContact CG1-CB 4.45Å; V114-D116 PolarHBondContact O-N 2.89Å; D116-D149 PolarHBondContact N-OD2 3.45Å; D116-D149 VanDerWaalsContact N-OD2 3.1Å; D116-R210 PolarHBondContact O-NH1 2.95Å; D116-R210 PolarHBondContact O-NH2 2.96Å
117	N	90.3	Very high	90.6	Very high	44 Å²	44	50 Å²	50	24%	0.235	27%	0.271	C	S	.	.	S	Bend	trans	-104	147.2	168.3	-58.4	-82.3	0	0	0	111.8	N115 P148 D149 R210	N115-N117 PolarHBondContact OD1-O 2.84Å; N115-N117 VanDerWaalsContact OD1-O 3.12Å; N117-P148 HydrophobicContact CB-CB 4.07Å; N117-P148 HydrophobicContact CB-CG 3.64Å; N117-D149 VanDerWaalsContact CB-OD1 3.25Å; N117-D149 WeakPolarHBondContact CB-OD1 3.26Å; N117-D149 PolarHBondContact N-OD2 3.07Å; N117-D149 PolarHBondContact ND2-OD1 2.77Å; N117-R210 VanDerWaalsContact CA-NH1 3.3Å; N117-R210 PolarHBondContact O-NH1 2.9Å
118	P	91.2	Very high	90.9	Very high	61 Å²	61	50.7 Å²	50.7	40%	0.396	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-98.1	148.7	172.3	34.7	-29.5	0	0	0	110.1	S120 R210	P118-S120 PolarHBondContact O-N 2.9Å; P118-R210 HydrophobicContact CB-CB 4.13Å; P118-R210 VanDerWaalsContact N-NH1 3.15Å
119	P	93.3	Very high	91.1	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.006	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-59	140	171.3	22.4	-32	0	0	0	110.1	A145 F146 D147 L155 A202 D204 G212	P119-A145 HydrophobicContact CB-CB 4.41Å; P119-F146 WeakPolarHBondContact CA-O 3.17Å; P119-D147 HydrophobicContact CB-CB 4.16Å; P119-D147 WeakPolarHBondContact CB-OD2 3.48Å; P119-L155 HydrophobicContact CB-CD1 4.15Å; P119-A202 HydrophobicContact CB-CB 3.95Å; P119-A202 HydrophobicContact CG-CB 4.25Å; P119-D204 HydrophobicContact CG-CB 4.36Å; P119-G212 WeakPolarHBondContact O-CA 3.46Å; P119-G212 PolarHBondContact O-N 2.84Å; P119-G212 VanDerWaalsContact O-N 3.17Å
120	S	92.7	Very high	91.4	Very high	58 Å²	58	54.2 Å²	54.2	41%	0.406	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-138.2	140.9	-170.3	61.6	0	0	0	0	112.1	P118 A145 F146	P118-S120 PolarHBondContact O-N 2.9Å; S120-A145 CarbonylContact O-C 3.5Å; S120-A145 WeakPolarHBondContact O-CA 3.18Å; S120-F146 PolarHBondContact N-O 3.27Å; S120-F146 PolarHBondContact O-N 2.99Å; S120-F146 PolarHBondContact OG-O 3.31Å
121	F	92.4	Very high	91.6	Very high	28 Å²	28	53.1 Å²	53.1	12%	0.123	29%	0.292	C	S	.	.			trans	-90.3	146.9	176.1	-70.3	-81.1	0	0	0	111.1	I126 A145 Y158 L200 A202 A214	F121-I126 HydrophobicContact CD1-CD1 3.96Å; F121-I126 HydrophobicContact CE1-CD1 4.4Å; F121-I126 HydrophobicContact CG-CD1 4.46Å; F121-A145 HydrophobicContact CD1-CB 4.05Å; F121-A145 HydrophobicContact CE1-CB 3.84Å; F121-A145 HydrophobicContact CE2-CB 4.36Å; F121-A145 HydrophobicContact CG-CB 4.39Å; F121-A145 HydrophobicContact CZ-CB 4Å; F121-Y158 HydrophobicContact CE1-CD1 4.29Å; F121-Y158 AromaticContact CE1-CE1 3.89Å; F121-Y158 HydrophobicContact CE1-CE1 3.89Å; F121-Y158 HydrophobicContact CZ-CD1 4.05Å; F121-Y158 HydrophobicContact CZ-CE1 4.02Å; F121-L200 HydrophobicContact CD1-CD2 4.32Å; F121-L200 HydrophobicContact CE1-CD2 3.46Å; F121-L200 VanDerWaalsContact CE1-CD2 3.46Å; F121-L200 HydrophobicContact CE1-CG 4.12Å; F121-L200 HydrophobicContact CE2-CD2 4.49Å; F121-L200 HydrophobicContact CE2-CG 4.42Å; F121-L200 HydrophobicContact CZ-CD2 3.57Å; F121-L200 HydrophobicContact CZ-CG 3.68Å; F121-A202 HydrophobicContact CE2-CB 3.83Å; F121-A202 HydrophobicContact CZ-CB 3.75Å; F121-A214 HydrophobicContact CB-CB 4.03Å; F121-A214 HydrophobicContact CD1-CB 4.42Å; F121-A214 HydrophobicContact CD2-CB 3.7Å; F121-A214 HydrophobicContact CE2-CB 4.26Å; F121-A214 HydrophobicContact CG-CB 3.79Å
122	P	90.4	Very high	91.8	Very high	93 Å²	93	53.2 Å²	53.2	60%	0.604	29%	0.292	S	S	*	.	S	Bend	trans	-62.3	-47.1	176	-21.6	33.3	0	0	0	112.7	N144	P122-N144 WeakPolarHBondContact CD-O 3.43Å
123	E	89.9	Confident	92	Very high	106 Å²	106	53.2 Å²	53.2	50%	0.495	30%	0.3	S	S	.	.			trans	-110.9	143.1	174.1	-59.9	-156.7	162.5	0	0	112.1
124	P	88.5	Confident	92.2	Very high	99 Å²	99	52.5 Å²	52.5	64%	0.643	30%	0.299	S	S	*	.	S	Bend	trans	-79.2	-24.4	179.6	32.3	-35.6	0	0	0	113.3	A214 L215	P124-A214 CarbonylContact O-C 3.59Å; P124-A214 WeakPolarHBondContact O-CA 3.35Å; P124-L215 PolarHBondContact O-N 3.02Å
125	D	91.9	Very high	92.3	Very high	73 Å²	73	56.1 Å²	56.1	39%	0.39	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	107.1	176.9	-69.1	-41.1	0	0	0	107.8	F127 L215	D125-F127 HydrophobicContact CB-CE2 3.7Å; D125-F127 HydrophobicContact CB-CZ 4.08Å; D125-F127 WeakPolarHBondContact O-CD2 3.41Å; D125-F127 WeakPolarHBondContact O-CE2 3.13Å; D125-L215 CarbonylContact C-O 3.56Å; D125-L215 WeakPolarHBondContact CA-O 3.23Å; D125-L215 WeakPolarHBondContact OD1-CB 3.43Å; D125-L215 WeakPolarHBondContact OD1-CD2 3.47Å
126	I	91.9	Very high	92.5	Very high	7 Å²	7	58.2 Å²	58.2	4%	0.036	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	121.9	-178	-61.6	167.9	0	0	0	108.9	F121 V128 V142 E143 L200 A214 L215 L216 V217	F121-I126 HydrophobicContact CD1-CD1 3.96Å; F121-I126 HydrophobicContact CE1-CD1 4.4Å; F121-I126 HydrophobicContact CG-CD1 4.46Å; I126-V128 HydrophobicContact CG2-CG2 4.43Å; I126-V142 HydrophobicContact CD1-CG1 4.35Å; I126-V142 HydrophobicContact CG2-CG1 4.35Å; I126-E143 HydrophobicContact CD1-CB 4.12Å; I126-E143 HydrophobicContact CG2-CG 4.37Å; I126-L200 HydrophobicContact CD1-CD2 3.85Å; I126-A214 HydrophobicContact CD1-CB 3.69Å; I126-A214 HydrophobicContact CG1-CB 4.11Å; I126-L215 PolarHBondContact N-O 2.64Å; I126-L216 HydrophobicContact CB-CD1 4.49Å; I126-L216 HydrophobicContact CG2-CD1 4.18Å; I126-L216 WeakPolarHBondContact O-CA 3.08Å; I126-V217 PolarHBondContact O-N 2.7Å
127	F	92.5	Very high	92.7	Very high	139 Å²	139	58.4 Å²	58.4	61%	0.61	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	128.7	-178.7	-64.9	-90.7	0	0	0	111.7	D125 V217	D125-F127 HydrophobicContact CB-CE2 3.7Å; D125-F127 HydrophobicContact CB-CZ 4.08Å; D125-F127 WeakPolarHBondContact O-CD2 3.41Å; D125-F127 WeakPolarHBondContact O-CE2 3.13Å; F127-V217 HydrophobicContact CD1-CB 3.81Å; F127-V217 HydrophobicContact CD1-CG1 4.05Å; F127-V217 HydrophobicContact CD1-CG2 4.41Å; F127-V217 HydrophobicContact CE1-CB 3.91Å; F127-V217 HydrophobicContact CE1-CG1 4.02Å; F127-V217 HydrophobicContact CE1-CG2 4.06Å
128	V	93.1	Very high	92.8	Very high	17 Å²	17	58.8 Å²	58.8	10%	0.103	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.1	174.2	-172.4	0	0	0	0	109	I126 I130 F140 L216 V217 V218 K219	I126-V128 HydrophobicContact CG2-CG2 4.43Å; V128-I130 HydrophobicContact CG1-CD1 4.01Å; V128-I130 HydrophobicContact CG1-CG1 3.8Å; V128-F140 HydrophobicContact CG1-CB 4.25Å; V128-L216 HydrophobicContact CB-CD1 4.45Å; V128-L216 HydrophobicContact CG2-CD1 3.65Å; V128-V217 PolarHBondContact N-O 3.24Å; V128-V218 WeakPolarHBondContact O-CA 3.48Å; V128-K219 PolarHBondContact O-N 3.34Å
129	E	94.8	Very high	92.9	Very high	110 Å²	110	61.4 Å²	61.4	51%	0.514	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.8	174.7	-58.9	-162.5	130.2	0	0	109.9	K219 L221	E129-K219 WeakPolarHBondContact CA-O 3.31Å; E129-K219 HydrophobicContact CG-CB 4.48Å; E129-K219 HydrophobicContact CG-CD 4.43Å; E129-K219 WeakPolarHBondContact OE1-CD 3.02Å; E129-K219 WeakPolarHBondContact OE1-CE 3.49Å; E129-K219 IonicContact OE1-NZ 2.59Å; E129-K219 PolarHBondContact OE1-NZ 2.84Å; E129-L221 HydrophobicContact CB-CD1 3.84Å; E129-L221 HydrophobicContact CB-CD2 4.13Å; E129-L221 HydrophobicContact CB-CG 3.92Å; E129-L221 HydrophobicContact CG-CD2 4.44Å
130	I	95.7	Very high	92.9	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	120.7	-174.6	-57.8	-177.1	0	0	0	109.6	V128 A134 F140 F166 L182 L188 V218 K219 V220 L221	V128-I130 HydrophobicContact CG1-CD1 4.01Å; V128-I130 HydrophobicContact CG1-CG1 3.8Å; I130-A134 HydrophobicContact CG2-CB 3.91Å; I130-F140 HydrophobicContact CB-CE1 4.35Å; I130-F140 HydrophobicContact CB-CZ 4.35Å; I130-F140 HydrophobicContact CD1-CD1 4.12Å; I130-F140 HydrophobicContact CD1-CD2 3.7Å; I130-F140 HydrophobicContact CD1-CE1 4.23Å; I130-F140 HydrophobicContact CD1-CE2 3.84Å; I130-F140 HydrophobicContact CD1-CG 3.86Å; I130-F140 HydrophobicContact CD1-CZ 4.1Å; I130-F140 HydrophobicContact CG1-CD1 3.95Å; I130-F140 HydrophobicContact CG1-CD2 4.4Å; I130-F140 HydrophobicContact CG1-CE1 3.89Å; I130-F140 HydrophobicContact CG1-CE2 4.35Å; I130-F140 HydrophobicContact CG1-CG 4.21Å; I130-F140 HydrophobicContact CG1-CZ 4.1Å; I130-F140 HydrophobicContact CG2-CE1 3.9Å; I130-F140 HydrophobicContact CG2-CE2 4.02Å; I130-F140 HydrophobicContact CG2-CZ 3.48Å; I130-F140 VanDerWaalsContact CG2-CZ 3.48Å; I130-F166 HydrophobicContact CD1-CE1 3.64Å; I130-F166 HydrophobicContact CD1-CZ 4.15Å; I130-L182 HydrophobicContact CD1-CD2 4.2Å; I130-L188 HydrophobicContact CB-CD1 4.13Å; I130-L188 HydrophobicContact CG2-CD1 3.66Å; I130-V218 HydrophobicContact CB-CG1 4.27Å; I130-V218 HydrophobicContact CD1-CG1 3.72Å; I130-V218 HydrophobicContact CG1-CG1 3.99Å; I130-K219 PolarHBondContact N-O 3.14Å; I130-V220 CarbonylContact O-C 3.36Å; I130-V220 VanDerWaalsContact O-CA 3.29Å; I130-V220 WeakPolarHBondContact O-CA 3.3Å; I130-L221 PolarHBondContact O-N 3.27Å
131	S	94.5	Very high	92.8	Very high	44 Å²	44	65.3 Å²	65.3	31%	0.308	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	136.9	172.2	-164.3	0	0	0	0	111	S133 A134 L221 S223	S131-S133 VanDerWaalsContact C-N 3.26Å; S131-S133 PolarHBondContact O-N 2.83Å; S131-S133 PolarHBondContact OG-OG 3.33Å; S131-A134 WeakPolarHBondContact O-CB 3.21Å; S131-A134 PolarHBondContact O-N 2.9Å; S131-L221 WeakPolarHBondContact CA-O 3.22Å; S131-S223 PolarHBondContact OG-OG 2.91Å; S131-S223 VanDerWaalsContact OG-OG 3.06Å
132	E	94.9	Very high	92.6	Very high	9 Å²	9	64.6 Å²	64.6	4%	0.042	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-30.6	179.2	66.5	-147.7	117.5	0	0	114.1	A134 L188 R190 V220 L221 D222 S223	E132-A134 PolarHBondContact O-N 2.95Å; E132-L188 HydrophobicContact CB-CB 4.06Å; E132-R190 WeakPolarHBondContact OE2-CA 3.43Å; E132-R190 WeakPolarHBondContact OE2-CB 3.22Å; E132-R190 PolarHBondContact OE2-N 2.81Å; E132-V220 HydrophobicContact CB-CG1 3.68Å; E132-L221 PolarHBondContact N-O 2.58Å; E132-L221 VanDerWaalsContact N-O 3.14Å; E132-D222 VanDerWaalsContact OE1-CA 3.22Å; E132-D222 WeakPolarHBondContact OE1-CA 3.39Å; E132-S223 PolarHBondContact OE1-N 2.93Å
133	S	93.2	Very high	92.5	Very high	78 Å²	78	63.8 Å²	63.8	55%	0.545	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	4.3	167.3	51.9	0	0	0	0	114.5	S131 S223	S131-S133 VanDerWaalsContact C-N 3.26Å; S131-S133 PolarHBondContact O-N 2.83Å; S131-S133 PolarHBondContact OG-OG 3.33Å; S133-S223 PolarHBondContact OG-OG 2.86Å
134	A	94.3	Very high	92.4	Very high	18 Å²	18	62.3 Å²	62.3	15%	0.149	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-64.8	132.7	171	0	0	0	0	0	112	I130 S131 E132 F140 L184	I130-A134 HydrophobicContact CG2-CB 3.91Å; S131-A134 WeakPolarHBondContact O-CB 3.21Å; S131-A134 PolarHBondContact O-N 2.9Å; E132-A134 PolarHBondContact O-N 2.95Å; A134-F140 HydrophobicContact CB-CZ 4.09Å; A134-L184 HydrophobicContact CB-CD2 3.8Å; A134-L184 WeakPolarHBondContact O-CD2 3.21Å
135	I	94.2	Very high	92.4	Very high	125 Å²	125	58 Å²	58	64%	0.641	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-82	132.5	-174	-53.7	175.8	0	0	0	109.5	G137 T138	I135-G137 PolarHBondContact O-N 2.84Å; I135-T138 WeakPolarHBondContact O-CB 3.43Å; I135-T138 PolarHBondContact O-N 2.84Å; I135-T138 PolarHBondContact O-OG1 2.97Å
136	P	94.4	Very high	92.4	Very high	65 Å²	65	60 Å²	60	42%	0.422	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	135.2	171.4	-28.4	36.4	0	0	0	112.4	L184	P136-L184 CarbonylContact C-O 3.6Å; P136-L184 VanDerWaalsContact CA-O 3.31Å; P136-L184 WeakPolarHBondContact CA-O 3.32Å
137	G	91.7	Very high	92.3	Very high	50 Å²	50	60.3 Å²	60.3	52%	0.515	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.7	-7.7	-167.2	0	0	0	0	0	114.5	I135 L184	I135-G137 PolarHBondContact O-N 2.84Å; G137-L184 PolarHBondContact N-O 2.67Å
138	T	93.6	Very high	92.2	Very high	52 Å²	52	54.8 Å²	54.8	32%	0.319	31%	0.309	S	S	.	.			trans	-67.6	143.3	170.1	-62.5	0	0	0	0	110.7	I135 F140 L184	I135-T138 WeakPolarHBondContact O-CB 3.43Å; I135-T138 PolarHBondContact O-N 2.84Å; I135-T138 PolarHBondContact O-OG1 2.97Å; T138-F140 HydrophobicContact CG2-CE1 4.08Å; T138-F140 HydrophobicContact CG2-CE2 3.71Å; T138-F140 HydrophobicContact CG2-CZ 3.45Å; T138-F140 VanDerWaalsContact CG2-CZ 3.45Å; T138-L184 PolarHBondContact O-N 3.27Å
139	R	93.1	Very high	92.1	Very high	116 Å²	116	54.1 Å²	54.1	44%	0.438	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.7	-172.6	-62.1	172.5	165.9	-115.3	-11.5	109.6	D169 E181 L182 V183	R139-D169 IonicContact CZ-OD2 3.1Å; R139-D169 IonicContact NH1-OD2 2.59Å; R139-D169 PolarHBondContact NH1-OD2 2.99Å; R139-D169 IonicContact NH2-OD2 3.01Å; R139-D169 PolarHBondContact NH2-OD2 2.97Å; R139-E181 HydrophobicContact CB-CB 4.41Å; R139-E181 WeakPolarHBondContact CD-OE2 3.42Å; R139-E181 IonicContact CZ-OE2 2.77Å; R139-E181 IonicContact NE-OE2 3.22Å; R139-E181 IonicContact NH1-OE2 2.73Å; R139-E181 PolarHBondContact NH1-OE2 3.3Å; R139-L182 CarbonylContact C-O 3.55Å; R139-L182 WeakPolarHBondContact CA-O 3.09Å; R139-V183 HydrophobicContact CG-CG2 4.25Å
140	F	93.1	Very high	91.8	Very high	33 Å²	33	49.7 Å²	49.7	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.3	178.1	-55.6	-89.7	0	0	0	108.8	V128 I130 A134 T138 E181 L182 L184	V128-F140 HydrophobicContact CG1-CB 4.25Å; I130-F140 HydrophobicContact CB-CE1 4.35Å; I130-F140 HydrophobicContact CB-CZ 4.35Å; I130-F140 HydrophobicContact CD1-CD1 4.12Å; I130-F140 HydrophobicContact CD1-CD2 3.7Å; I130-F140 HydrophobicContact CD1-CE1 4.23Å; I130-F140 HydrophobicContact CD1-CE2 3.84Å; I130-F140 HydrophobicContact CD1-CG 3.86Å; I130-F140 HydrophobicContact CD1-CZ 4.1Å; I130-F140 HydrophobicContact CG1-CD1 3.95Å; I130-F140 HydrophobicContact CG1-CD2 4.4Å; I130-F140 HydrophobicContact CG1-CE1 3.89Å; I130-F140 HydrophobicContact CG1-CE2 4.35Å; I130-F140 HydrophobicContact CG1-CG 4.21Å; I130-F140 HydrophobicContact CG1-CZ 4.1Å; I130-F140 HydrophobicContact CG2-CE1 3.9Å; I130-F140 HydrophobicContact CG2-CE2 4.02Å; I130-F140 HydrophobicContact CG2-CZ 3.48Å; I130-F140 VanDerWaalsContact CG2-CZ 3.48Å; A134-F140 HydrophobicContact CB-CZ 4.09Å; T138-F140 HydrophobicContact CG2-CE1 4.08Å; T138-F140 HydrophobicContact CG2-CE2 3.71Å; T138-F140 HydrophobicContact CG2-CZ 3.45Å; T138-F140 VanDerWaalsContact CG2-CZ 3.45Å; F140-E181 CarbonylContact O-C 3.59Å; F140-E181 WeakPolarHBondContact O-CA 3.46Å; F140-L182 HydrophobicContact CB-CB 4.35Å; F140-L182 PolarHBondContact N-O 2.99Å; F140-L182 PolarHBondContact O-N 3.21Å; F140-L184 HydrophobicContact CE2-CB 4.23Å
141	P	90.3	Very high	91.3	Very high	108 Å²	108	52.8 Å²	52.8	70%	0.701	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	141.1	177.2	28.9	-34.4	0	0	0	110
142	V	89.4	Confident	90.9	Very high	14 Å²	14	56 Å²	56	9%	0.085	33%	0.334	C	S	.	.			trans	-115.5	154	174.5	-171.1	0	0	0	0	108.3	I126 N144 A180 L182 L200	I126-V142 HydrophobicContact CD1-CG1 4.35Å; I126-V142 HydrophobicContact CG2-CG1 4.35Å; V142-N144 PolarHBondContact O-N 3.33Å; V142-A180 PolarHBondContact N-O 3.3Å; V142-L182 HydrophobicContact CG2-CB 3.7Å; V142-L200 HydrophobicContact CG1-CD2 3.54Å
143	E	86.8	Confident	90.5	Very high	76 Å²	76	56.5 Å²	56.5	36%	0.355	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-62.9	134.1	173.6	-60.4	-152.5	145.7	0	0	111.3	I126	I126-E143 HydrophobicContact CD1-CB 4.12Å; I126-E143 HydrophobicContact CG2-CG 4.37Å
144	N	87.6	Confident	90.3	Very high	75 Å²	75	54.1 Å²	54.1	40%	0.401	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-77.3	139.7	179.6	-67.3	-28.6	0	0	0	110.7	P122 V142 Y158 F179	P122-N144 WeakPolarHBondContact CD-O 3.43Å; V142-N144 PolarHBondContact O-N 3.33Å; N144-Y158 WeakPolarHBondContact CA-OH 3.31Å; N144-F179 WeakPolarHBondContact OD1-CA 3.2Å; N144-F179 WeakPolarHBondContact OD1-CB 3.34Å
145	A	90.4	Very high	90.1	Very high	8 Å²	8	54.1 Å²	54.1	7%	0.066	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-71.7	140.5	162.7	0	0	0	0	0	109.4	P119 S120 F121 L155 Y158 A202	P119-A145 HydrophobicContact CB-CB 4.41Å; S120-A145 CarbonylContact O-C 3.5Å; S120-A145 WeakPolarHBondContact O-CA 3.18Å; F121-A145 HydrophobicContact CD1-CB 4.05Å; F121-A145 HydrophobicContact CE1-CB 3.84Å; F121-A145 HydrophobicContact CE2-CB 4.36Å; F121-A145 HydrophobicContact CG-CB 4.39Å; F121-A145 HydrophobicContact CZ-CB 4Å; A145-L155 HydrophobicContact CB-CD1 4.49Å; A145-Y158 HydrophobicContact CB-CE1 3.86Å; A145-Y158 PolarHBondContact N-OH 3.35Å; A145-A202 HydrophobicContact CB-CB 3.37Å
146	F	89.9	Confident	89.9	Confident	116 Å²	116	50.4 Å²	50.4	51%	0.509	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-102.4	137.8	169.6	-176.5	-102	0	0	0	110	P119 S120 P148	P119-F146 WeakPolarHBondContact CA-O 3.17Å; S120-F146 PolarHBondContact N-O 3.27Å; S120-F146 PolarHBondContact O-N 2.99Å; S120-F146 PolarHBondContact OG-O 3.31Å; F146-P148 HydrophobicContact CE1-CB 4.5Å; F146-P148 HydrophobicContact CE1-CG 4.18Å
147	D	91.6	Very high	89.7	Confident	12 Å²	12	50.1 Å²	50.1	6%	0.064	30%	0.302	C	S	.	.			trans	-129.5	119.4	-179.4	-154.8	-21.9	0	0	0	107.2	P119 D149 L155	P119-D147 HydrophobicContact CB-CB 4.16Å; P119-D147 WeakPolarHBondContact CB-OD2 3.48Å; D147-D149 VanDerWaalsContact C-N 3.31Å; D147-L155 HydrophobicContact CB-CB 3.96Å; D147-L155 WeakPolarHBondContact OD2-CA 3.46Å; D147-L155 PolarHBondContact OD2-N 3.25Å
148	P	89.6	Confident	89.7	Confident	24 Å²	24	48.2 Å²	48.2	16%	0.156	28%	0.28	C	S	.	.			trans	-64.8	-34.4	-178.9	-24.3	35.6	0	0	0	113.7	E81 Q86 N117 F146	E81-P148 HydrophobicContact CG-CB 3.57Å; Q86-P148 PolarHBondContact NE2-O 3.17Å; N117-P148 HydrophobicContact CB-CB 4.07Å; N117-P148 HydrophobicContact CB-CG 3.64Å; F146-P148 HydrophobicContact CE1-CB 4.5Å; F146-P148 HydrophobicContact CE1-CG 4.18Å
149	D	90.8	Very high	89.6	Confident	3 Å²	3	47.9 Å²	47.9	2%	0.016	28%	0.282	C	S	.	.			trans	-71.7	161.8	-170	-60.3	7.1	0	0	0	111.4	N115 D116 N117 D147 N153 A154	N115-D149 WeakPolarHBondContact CA-OD2 3.35Å; D116-D149 PolarHBondContact N-OD2 3.45Å; D116-D149 VanDerWaalsContact N-OD2 3.1Å; N117-D149 VanDerWaalsContact CB-OD1 3.25Å; N117-D149 WeakPolarHBondContact CB-OD1 3.26Å; N117-D149 PolarHBondContact N-OD2 3.07Å; N117-D149 PolarHBondContact ND2-OD1 2.77Å; D147-D149 VanDerWaalsContact C-N 3.31Å; D149-N153 HydrophobicContact CB-CB 4.01Å; D149-A154 VanDerWaalsContact O-CB 3.26Å; D149-A154 WeakPolarHBondContact O-CB 3.47Å
150	V	87.7	Confident	89.7	Confident	17 Å²	17	44 Å²	44	10%	0.103	27%	0.27	C	S	.	.			trans	-121.1	169.2	-172.7	-61.8	0	0	0	0	114.6	Q86 I88 D113 T152 N153 A154	Q86-V150 HydrophobicContact CB-CG1 4.27Å; Q86-V150 HydrophobicContact CG-CG1 4.47Å; I88-V150 HydrophobicContact CD1-CB 3.83Å; I88-V150 HydrophobicContact CD1-CG1 4.25Å; I88-V150 HydrophobicContact CD1-CG2 4.16Å; I88-V150 HydrophobicContact CG1-CB 4.12Å; I88-V150 HydrophobicContact CG1-CG1 4.2Å; I88-V150 HydrophobicContact CG1-CG2 4.12Å; D113-V150 HydrophobicContact CB-CG2 3.8Å; D113-V150 VanDerWaalsContact OD1-CG2 3.31Å; D113-V150 WeakPolarHBondContact OD1-CG2 3.43Å; D113-V150 PolarHBondContact OD1-N 2.74Å; V150-T152 PolarHBondContact O-N 3.03Å; V150-N153 PolarHBondContact O-N 3.26Å; V150-N153 VanDerWaalsContact O-N 3.08Å; V150-A154 PolarHBondContact O-N 2.71Å
151	G	85.2	Confident	89.7	Confident	65 Å²	65	45.5 Å²	45.5	67%	0.67	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	-108.3	171	0	0	0	0	0	112.9
152	T	86.4	Confident	89.8	Confident	111 Å²	111	48 Å²	48	68%	0.681	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-21.3	177.8	49.4	0	0	0	0	113.9	V150 G205 G206	V150-T152 PolarHBondContact O-N 3.03Å; T152-G205 CarbonylContact O-C 3.54Å; T152-G205 WeakPolarHBondContact O-CA 2.94Å; T152-G206 PolarHBondContact O-N 2.88Å
153	N	88.3	Confident	90	Very high	20 Å²	20	49 Å²	49	11%	0.107	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-20.4	-179.2	-59.5	-26.2	0	0	0	111.5	D113 N115 D149 V150 D204 G206	D113-N153 PolarHBondContact O-ND2 2.71Å; D113-N153 VanDerWaalsContact OD2-CB 3.25Å; D113-N153 WeakPolarHBondContact OD2-CB 3.11Å; D113-N153 PolarHBondContact OD2-ND2 2.64Å; N115-N153 HydrophobicContact CB-CB 3.92Å; N115-N153 PolarHBondContact N-ND2 3.03Å; D149-N153 HydrophobicContact CB-CB 4.01Å; V150-N153 PolarHBondContact O-N 3.26Å; V150-N153 VanDerWaalsContact O-N 3.08Å; N153-D204 WeakPolarHBondContact O-CB 3.48Å; N153-G206 WeakPolarHBondContact OD1-CA 3.26Å
154	A	87.8	Confident	90.2	Very high	28 Å²	28	50.5 Å²	50.5	23%	0.231	31%	0.305	C	S	.	.	S	Bend	trans	-55.2	158.7	168.2	0	0	0	0	0	114.1	D149 V150 S156 G205	D149-A154 VanDerWaalsContact O-CB 3.26Å; D149-A154 WeakPolarHBondContact O-CB 3.47Å; V150-A154 PolarHBondContact O-N 2.71Å; A154-S156 PolarHBondContact O-N 2.88Å; A154-G205 PolarHBondContact O-N 2.84Å
155	L	90.6	Very high	90.5	Very high	18 Å²	18	49.1 Å²	49.1	9%	0.094	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-32.7	113.6	172.7	-179.8	65	0	0	0	113.9	P119 A145 D147 Y158 K178 A202	P119-L155 HydrophobicContact CB-CD1 4.15Å; A145-L155 HydrophobicContact CB-CD1 4.49Å; D147-L155 HydrophobicContact CB-CB 3.96Å; D147-L155 WeakPolarHBondContact OD2-CA 3.46Å; D147-L155 PolarHBondContact OD2-N 3.25Å; L155-Y158 HydrophobicContact CD2-CE2 3.87Å; L155-Y158 WeakPolarHBondContact CD2-OH 3.32Å; L155-K178 HydrophobicContact CD2-CB 4.23Å; L155-K178 PolarHBondContact O-NZ 3Å; L155-A202 HydrophobicContact CD1-CB 3.88Å
156	S	89.1	Confident	90.7	Very high	48 Å²	48	49 Å²	49	34%	0.336	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-51	-178.2	-172.6	0	0	0	0	112.6	A154 K178 V203 D204	A154-S156 PolarHBondContact O-N 2.88Å; S156-K178 VanDerWaalsContact CA-NZ 3.33Å; S156-K178 WeakPolarHBondContact O-CD 3.47Å; S156-K178 WeakPolarHBondContact O-CE 3.47Å; S156-K178 PolarHBondContact O-NZ 2.92Å; S156-V203 WeakPolarHBondContact CA-O 3.13Å; S156-V203 WeakPolarHBondContact CB-O 3.2Å; S156-V203 PolarHBondContact N-O 2.86Å; S156-D204 WeakPolarHBondContact CB-O 3.02Å
157	T	90.4	Very high	90.9	Very high	58 Å²	58	45.1 Å²	45.1	36%	0.356	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	165.6	-174.5	-168.3	0	0	0	0	112.3	V203	T157-V203 HydrophobicContact CG2-CB 4.13Å; T157-V203 HydrophobicContact CG2-CG2 4.48Å; T157-V203 PolarHBondContact N-O 2.79Å; T157-V203 PolarHBondContact O-N 3.07Å
158	Y	92.5	Very high	91	Very high	10 Å²	10	46.1 Å²	46.1	4%	0.039	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	158	166.1	-60.4	-98.2	0	0	0	110.8	F121 N144 A145 L155 V170 K178 A180 T201 A202	F121-Y158 HydrophobicContact CE1-CD1 4.29Å; F121-Y158 AromaticContact CE1-CE1 3.89Å; F121-Y158 HydrophobicContact CE1-CE1 3.89Å; F121-Y158 HydrophobicContact CZ-CD1 4.05Å; F121-Y158 HydrophobicContact CZ-CE1 4.02Å; N144-Y158 WeakPolarHBondContact CA-OH 3.31Å; A145-Y158 HydrophobicContact CB-CE1 3.86Å; A145-Y158 PolarHBondContact N-OH 3.35Å; L155-Y158 HydrophobicContact CD2-CE2 3.87Å; L155-Y158 WeakPolarHBondContact CD2-OH 3.32Å; Y158-V170 HydrophobicContact CD2-CG1 4.04Å; Y158-V170 HydrophobicContact CD2-CG2 4.15Å; Y158-K178 HydrophobicContact CE2-CB 4.49Å; Y158-K178 WeakPolarHBondContact CE2-O 3.24Å; Y158-K178 PolarHBondContact OH-O 3.41Å; Y158-K178 VanDerWaalsContact OH-O 3.08Å; Y158-A180 HydrophobicContact CD1-CB 4.18Å; Y158-A180 HydrophobicContact CD2-CB 3.72Å; Y158-A180 HydrophobicContact CE2-CB 4.11Å; Y158-A180 HydrophobicContact CG-CB 3.75Å; Y158-T201 CarbonylContact C-O 3.6Å; Y158-T201 VanDerWaalsContact CA-O 3.3Å; Y158-T201 WeakPolarHBondContact CA-O 3.47Å; Y158-A202 HydrophobicContact CD1-CB 4.09Å; Y158-A202 HydrophobicContact CE1-CB 4.15Å
159	A	91.6	Very high	91.1	Very high	45 Å²	45	46.9 Å²	46.9	37%	0.372	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144	171.7	0	0	0	0	0	110.4	T201	A159-T201 PolarHBondContact N-O 2.89Å; A159-T201 PolarHBondContact O-N 2.8Å
160	I	94.4	Very high	91.1	Very high	35 Å²	35	48.8 Å²	48.8	18%	0.179	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	153.3	172.7	-169.4	166.6	0	0	0	109.9	N162 F166 L168 L182 Y198 L216	I160-N162 PolarHBondContact O-N 2.98Å; I160-F166 HydrophobicContact CD1-CB 4.43Å; I160-L168 HydrophobicContact CB-CD1 3.9Å; I160-L168 HydrophobicContact CB-CD2 4.45Å; I160-L168 HydrophobicContact CB-CG 3.9Å; I160-L168 HydrophobicContact CG2-CD1 4.32Å; I160-L168 HydrophobicContact CG2-CG 3.95Å; I160-L182 HydrophobicContact CD1-CD1 3.66Å; I160-Y198 HydrophobicContact CD1-CD2 4.22Å; I160-Y198 HydrophobicContact CD1-CG 4.19Å; I160-Y198 HydrophobicContact CG1-CG 4.42Å; I160-L216 HydrophobicContact CD1-CD2 3.89Å
161	T	94.1	Very high	91	Very high	64 Å²	64	51.5 Å²	51.5	39%	0.393	31%	0.31	S	S	.	.			trans	-54.4	129.6	169	-54.7	0	0	0	0	110.4	N163 V199	T161-N163 PolarHBondContact O-N 3.32Å; T161-N163 VanDerWaalsContact O-N 3.16Å; T161-N163 PolarHBondContact O-ND2 2.91Å; T161-V199 PolarHBondContact N-O 2.63Å; T161-V199 WeakPolarHBondContact OG1-CA 3.2Å; T161-V199 WeakPolarHBondContact OG1-CB 3.22Å; T161-V199 PolarHBondContact OG1-N 2.83Å; T161-V199 PolarHBondContact OG1-O 2.9Å
162	N	91.9	Very high	91.1	Very high	162 Å²	162	52.3 Å²	52.3	87%	0.866	30%	0.303	S	S	*	.			trans	-55.3	119.9	-178.3	-178.2	37.1	0	0	0	111.3	I160	I160-N162 PolarHBondContact O-N 2.98Å
163	N	92.6	Very high	90.9	Very high	34 Å²	34	51.5 Å²	51.5	18%	0.182	29%	0.291	C	S	.	.			trans	-148.8	179.7	-173.7	78.7	88.1	0	0	0	110.9	T161 Y165 F166 Y198	T161-N163 PolarHBondContact O-N 3.32Å; T161-N163 VanDerWaalsContact O-N 3.16Å; T161-N163 PolarHBondContact O-ND2 2.91Å; N163-Y165 PolarHBondContact OD1-N 2.79Å; N163-F166 PolarHBondContact ND2-O 2.97Å; N163-F166 PolarHBondContact OD1-N 3.05Å; N163-F166 PolarHBondContact OD1-O 2.95Å; N163-Y198 HydrophobicContact CB-CD1 3.92Å; N163-Y198 HydrophobicContact CB-CE1 3.35Å
164	N	91.6	Very high	90.3	Very high	108 Å²	108	56.8 Å²	56.8	58%	0.578	33%	0.329	S	S	*	.	S	Bend	trans	-106.8	-8.4	-170.9	-88.6	-54.1	0	0	0	115.3	K186	N164-K186 WeakPolarHBondContact O-CD 3.16Å; N164-K186 WeakPolarHBondContact O-CE 3.18Å; N164-K186 WeakPolarHBondContact O-CG 3.34Å; N164-K186 PolarHBondContact O-NZ 2.78Å; N164-K186 PolarHBondContact OD1-NZ 3.15Å
165	Y	93.8	Very high	89.6	Confident	45 Å²	45	60.1 Å²	60.1	18%	0.176	34%	0.343	C	S	.	.	S	Bend	trans	-118.4	-26	-168.3	-65.2	-89.5	0	0	0	113.2	N163 L184 E185 K186 L188 Q192 H196	N163-Y165 PolarHBondContact OD1-N 2.79Å; Y165-L184 CarbonylContact O-C 3.5Å; Y165-E185 PolarHBondContact O-N 3.45Å; Y165-K186 HydrophobicContact CD1-CB 4.07Å; Y165-L188 HydrophobicContact CD1-CD2 3.8Å; Y165-L188 HydrophobicContact CG-CD2 4.26Å; Y165-Q192 PolarHBondContact OH-OE1 3.32Å; Y165-H196 AromaticContact CD2-CE1 3.95Å; Y165-H196 AromaticContact CE2-CE1 3.92Å
166	F	95.2	Very high	88.8	Confident	7 Å²	7	61.5 Å²	61.5	3%	0.031	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	133.3	-174	-55.9	-83.6	0	0	0	112.7	I130 I160 N163 L182 V183 L184 L188 Y198 V218	I130-F166 HydrophobicContact CD1-CE1 3.64Å; I130-F166 HydrophobicContact CD1-CZ 4.15Å; I160-F166 HydrophobicContact CD1-CB 4.43Å; N163-F166 PolarHBondContact ND2-O 2.97Å; N163-F166 PolarHBondContact OD1-N 3.05Å; N163-F166 PolarHBondContact OD1-O 2.95Å; F166-L182 HydrophobicContact CB-CD1 3.69Å; F166-L182 HydrophobicContact CB-CG 4.07Å; F166-L182 HydrophobicContact CD1-CD1 4.25Å; F166-L182 HydrophobicContact CD1-CD2 3.62Å; F166-L182 HydrophobicContact CD1-CG 3.72Å; F166-L182 HydrophobicContact CE1-CD2 3.99Å; F166-L182 HydrophobicContact CG-CD1 4.17Å; F166-L182 HydrophobicContact CG-CD2 4.16Å; F166-L182 HydrophobicContact CG-CG 4.15Å; F166-V183 CarbonylContact C-O 3.46Å; F166-V183 VanDerWaalsContact CA-O 3.27Å; F166-V183 WeakPolarHBondContact CA-O 3.28Å; F166-L184 HydrophobicContact CD1-CD1 3.92Å; F166-L184 HydrophobicContact CE1-CD1 3.39Å; F166-L184 HydrophobicContact CZ-CD1 3.86Å; F166-L188 HydrophobicContact CE2-CD2 4.07Å; F166-L188 HydrophobicContact CZ-CD1 4.05Å; F166-L188 HydrophobicContact CZ-CD2 3.71Å; F166-L188 HydrophobicContact CZ-CG 4.46Å; F166-Y198 HydrophobicContact CD2-CD2 4.38Å; F166-Y198 AromaticContact CD2-CE2 3.42Å; F166-Y198 HydrophobicContact CD2-CE2 3.42Å; F166-Y198 VanDerWaalsContact CD2-CE2 3.42Å; F166-Y198 AromaticContact CD2-CZ 3.87Å; F166-Y198 AromaticContact CE2-CE2 3.78Å; F166-Y198 HydrophobicContact CE2-CE2 3.78Å; F166-Y198 HydrophobicContact CG-CE2 4.45Å; F166-V218 HydrophobicContact CE2-CG1 4.42Å; F166-V218 HydrophobicContact CE2-CG2 4.32Å; F166-V218 HydrophobicContact CZ-CB 4.42Å; F166-V218 HydrophobicContact CZ-CG1 3.85Å; F166-V218 HydrophobicContact CZ-CG2 4.27Å
167	S	94.1	Very high	88.4	Confident	34 Å²	34	62.9 Å²	62.9	24%	0.238	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	175.3	164.2	66.4	0	0	0	0	110.4	V183 E185	S167-V183 PolarHBondContact N-O 2.85Å; S167-V183 PolarHBondContact O-N 2.9Å; S167-E185 VanDerWaalsContact CB-OE1 3.24Å; S167-E185 WeakPolarHBondContact CB-OE1 3.11Å; S167-E185 PolarHBondContact OG-OE1 3.19Å
168	L	93.6	Very high	88.1	Confident	32 Å²	32	62.8 Å²	62.8	17%	0.168	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.7	168.7	-63.1	178.3	0	0	0	108.9	I160 A180 E181 L182 L200	I160-L168 HydrophobicContact CB-CD1 3.9Å; I160-L168 HydrophobicContact CB-CD2 4.45Å; I160-L168 HydrophobicContact CB-CG 3.9Å; I160-L168 HydrophobicContact CG2-CD1 4.32Å; I160-L168 HydrophobicContact CG2-CG 3.95Å; L168-A180 HydrophobicContact CD2-CB 4.47Å; L168-E181 WeakPolarHBondContact CA-O 3.33Å; L168-L182 HydrophobicContact CD2-CD1 3.86Å; L168-L200 HydrophobicContact CD1-CD1 3.64Å; L168-L200 HydrophobicContact CD2-CD1 4.21Å
169	D	91.6	Very high	87.9	Confident	41 Å²	41	65 Å²	65	22%	0.219	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	122.5	160.9	-172.2	17.3	0	0	0	108.7	R139 Q171 E181 V183	R139-D169 IonicContact CZ-OD2 3.1Å; R139-D169 IonicContact NH1-OD2 2.59Å; R139-D169 PolarHBondContact NH1-OD2 2.99Å; R139-D169 IonicContact NH2-OD2 3.01Å; R139-D169 PolarHBondContact NH2-OD2 2.97Å; D169-Q171 VanDerWaalsContact CG-NE2 3.33Å; D169-Q171 PolarHBondContact OD1-NE2 2.96Å; D169-Q171 PolarHBondContact OD2-NE2 2.56Å; D169-E181 PolarHBondContact N-O 3.05Å; D169-E181 PolarHBondContact O-N 3.4Å; D169-V183 HydrophobicContact CB-CG2 3.77Å
170	V	90.9	Very high	87.8	Confident	43 Å²	43	63 Å²	63	26%	0.261	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	104.3	-176.5	179.5	0	0	0	0	108.6	Y158 F179	Y158-V170 HydrophobicContact CD2-CG1 4.04Å; Y158-V170 HydrophobicContact CD2-CG2 4.15Å; V170-F179 WeakPolarHBondContact CA-O 3.32Å
171	Q	85.9	Confident	87.7	Confident	73 Å²	73	63.4 Å²	63.4	34%	0.341	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	143.6	-177.2	-69.3	-64.6	-28.1	0	0	110.6	D169 K178 F179	D169-Q171 VanDerWaalsContact CG-NE2 3.33Å; D169-Q171 PolarHBondContact OD1-NE2 2.96Å; D169-Q171 PolarHBondContact OD2-NE2 2.56Å; Q171-K178 WeakPolarHBondContact O-CA 3Å; Q171-F179 HydrophobicContact CB-CD1 4.25Å; Q171-F179 HydrophobicContact CB-CD2 4.15Å; Q171-F179 HydrophobicContact CB-CE1 3.77Å; Q171-F179 HydrophobicContact CB-CE2 3.67Å; Q171-F179 HydrophobicContact CB-CG 4.43Å; Q171-F179 HydrophobicContact CB-CZ 3.46Å; Q171-F179 VanDerWaalsContact CB-CZ 3.46Å; Q171-F179 HydrophobicContact CG-CE2 4.23Å; Q171-F179 HydrophobicContact CG-CZ 4.27Å; Q171-F179 PolarHBondContact N-O 2.93Å; Q171-F179 PolarHBondContact O-N 2.81Å
172	T	86.4	Confident	87.7	Confident	83 Å²	83	60.3 Å²	60.3	51%	0.509	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.1	176.6	-52	0	0	0	0	109.2	T177 K178	T172-T177 CarbonylContact C-O 3.57Å; T172-T177 WeakPolarHBondContact CA-O 3.47Å; T172-K178 HydrophobicContact CG2-CG 4.12Å
173	Q	81.9	Confident	87.8	Confident	94 Å²	94	53.3 Å²	53.3	44%	0.439	30%	0.302	S	S	.	.			trans	-78.3	164.2	-180	-174.7	165.4	-45.8	0	0	111.2	D175 G176 T177 F179	Q173-D175 WeakPolarHBondContact CB-OD1 3.38Å; Q173-D175 PolarHBondContact NE2-OD2 2.88Å; Q173-D175 PolarHBondContact O-N 2.76Å; Q173-G176 PolarHBondContact O-N 3.22Å; Q173-T177 PolarHBondContact N-O 3.22Å; Q173-F179 HydrophobicContact CB-CE1 4.34Å
174	S	76.5	Confident	88	Confident	130 Å²	130	51.7 Å²	51.7	91%	0.909	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-10.9	-176.1	52.5	0	0	0	0	115.6
175	D	72.6	Confident	88.1	Confident	98 Å²	98	51.7 Å²	51.7	52%	0.524	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-3.3	173.6	46.6	36.2	0	0	0	112.9	Q173 T177	Q173-D175 WeakPolarHBondContact CB-OD1 3.38Å; Q173-D175 PolarHBondContact NE2-OD2 2.88Å; Q173-D175 PolarHBondContact O-N 2.76Å; D175-T177 WeakPolarHBondContact OD1-CB 3.06Å; D175-T177 WeakPolarHBondContact OD1-CG2 3.29Å; D175-T177 PolarHBondContact OD1-N 2.84Å; D175-T177 PolarHBondContact OD1-OG1 3.4Å
176	G	74.1	Confident	88	Confident	47 Å²	47	53.9 Å²	53.9	49%	0.485	30%	0.3	S	S	.	.	S	Bend	trans	91	-6.3	-177.1	0	0	0	0	0	114.6	Q173	Q173-G176 PolarHBondContact O-N 3.22Å
177	T	79.7	Confident	88	Confident	77 Å²	77	57.5 Å²	57.5	47%	0.472	32%	0.324	S	S	.	.			trans	-67.7	150.4	175.8	63.5	0	0	0	0	111.3	T172 Q173 D175	T172-T177 CarbonylContact C-O 3.57Å; T172-T177 WeakPolarHBondContact CA-O 3.47Å; Q173-T177 PolarHBondContact N-O 3.22Å; D175-T177 WeakPolarHBondContact OD1-CB 3.06Å; D175-T177 WeakPolarHBondContact OD1-CG2 3.29Å; D175-T177 PolarHBondContact OD1-N 2.84Å; D175-T177 PolarHBondContact OD1-OG1 3.4Å
178	K	84.6	Confident	88	Confident	57 Å²	57	56.4 Å²	56.4	25%	0.248	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.9	-177.8	-64.5	179.5	-165.3	150.3	0	111.7	L155 S156 Y158 Q171 T172	L155-K178 HydrophobicContact CD2-CB 4.23Å; L155-K178 PolarHBondContact O-NZ 3Å; S156-K178 VanDerWaalsContact CA-NZ 3.33Å; S156-K178 WeakPolarHBondContact O-CD 3.47Å; S156-K178 WeakPolarHBondContact O-CE 3.47Å; S156-K178 PolarHBondContact O-NZ 2.92Å; Y158-K178 HydrophobicContact CE2-CB 4.49Å; Y158-K178 WeakPolarHBondContact CE2-O 3.24Å; Y158-K178 PolarHBondContact OH-O 3.41Å; Y158-K178 VanDerWaalsContact OH-O 3.08Å; Q171-K178 WeakPolarHBondContact O-CA 3Å; T172-K178 HydrophobicContact CG2-CG 4.12Å
179	F	88	Confident	88.1	Confident	57 Å²	57	57.9 Å²	57.9	25%	0.25	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	156.6	176.9	63.3	-87.8	0	0	0	111	N144 V170 Q171 Q173 E181	N144-F179 WeakPolarHBondContact OD1-CA 3.2Å; N144-F179 WeakPolarHBondContact OD1-CB 3.34Å; V170-F179 WeakPolarHBondContact CA-O 3.32Å; Q171-F179 HydrophobicContact CB-CD1 4.25Å; Q171-F179 HydrophobicContact CB-CD2 4.15Å; Q171-F179 HydrophobicContact CB-CE1 3.77Å; Q171-F179 HydrophobicContact CB-CE2 3.67Å; Q171-F179 HydrophobicContact CB-CG 4.43Å; Q171-F179 HydrophobicContact CB-CZ 3.46Å; Q171-F179 VanDerWaalsContact CB-CZ 3.46Å; Q171-F179 HydrophobicContact CG-CE2 4.23Å; Q171-F179 HydrophobicContact CG-CZ 4.27Å; Q171-F179 PolarHBondContact N-O 2.93Å; Q171-F179 PolarHBondContact O-N 2.81Å; Q173-F179 HydrophobicContact CB-CE1 4.34Å; F179-E181 HydrophobicContact CD2-CG 4.13Å; F179-E181 HydrophobicContact CE2-CG 4.03Å
180	A	89.7	Confident	88.3	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.5	177.3	0	0	0	0	0	110.8	V142 Y158 L168	V142-A180 PolarHBondContact N-O 3.3Å; Y158-A180 HydrophobicContact CD1-CB 4.18Å; Y158-A180 HydrophobicContact CD2-CB 3.72Å; Y158-A180 HydrophobicContact CE2-CB 4.11Å; Y158-A180 HydrophobicContact CG-CB 3.75Å; L168-A180 HydrophobicContact CD2-CB 4.47Å
181	E	92.4	Very high	88.5	Confident	44 Å²	44	58.8 Å²	58.8	21%	0.206	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.8	166.9	-62.2	-175.1	136	0	0	108.8	R139 F140 L168 D169 F179 V183	R139-E181 HydrophobicContact CB-CB 4.41Å; R139-E181 WeakPolarHBondContact CD-OE2 3.42Å; R139-E181 IonicContact CZ-OE2 2.77Å; R139-E181 IonicContact NE-OE2 3.22Å; R139-E181 IonicContact NH1-OE2 2.73Å; R139-E181 PolarHBondContact NH1-OE2 3.3Å; F140-E181 CarbonylContact O-C 3.59Å; F140-E181 WeakPolarHBondContact O-CA 3.46Å; L168-E181 WeakPolarHBondContact CA-O 3.33Å; D169-E181 PolarHBondContact N-O 3.05Å; D169-E181 PolarHBondContact O-N 3.4Å; F179-E181 HydrophobicContact CD2-CG 4.13Å; F179-E181 HydrophobicContact CE2-CG 4.03Å; E181-V183 PolarHBondContact O-N 3.44Å
182	L	94.4	Very high	88.8	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	119.1	172.1	-170.4	75.9	0	0	0	108.1	I130 R139 F140 V142 I160 F166 L168 L216 V218	I130-L182 HydrophobicContact CD1-CD2 4.2Å; R139-L182 CarbonylContact C-O 3.55Å; R139-L182 WeakPolarHBondContact CA-O 3.09Å; F140-L182 HydrophobicContact CB-CB 4.35Å; F140-L182 PolarHBondContact N-O 2.99Å; F140-L182 PolarHBondContact O-N 3.21Å; V142-L182 HydrophobicContact CG2-CB 3.7Å; I160-L182 HydrophobicContact CD1-CD1 3.66Å; F166-L182 HydrophobicContact CB-CD1 3.69Å; F166-L182 HydrophobicContact CB-CG 4.07Å; F166-L182 HydrophobicContact CD1-CD1 4.25Å; F166-L182 HydrophobicContact CD1-CD2 3.62Å; F166-L182 HydrophobicContact CD1-CG 3.72Å; F166-L182 HydrophobicContact CE1-CD2 3.99Å; F166-L182 HydrophobicContact CG-CD1 4.17Å; F166-L182 HydrophobicContact CG-CD2 4.16Å; F166-L182 HydrophobicContact CG-CG 4.15Å; L168-L182 HydrophobicContact CD2-CD1 3.86Å; L182-L216 HydrophobicContact CD1-CD2 3.7Å; L182-L216 HydrophobicContact CD2-CD2 4.03Å; L182-L216 HydrophobicContact CG-CD2 4.5Å; L182-V218 HydrophobicContact CD2-CG2 4.12Å
183	V	94.5	Very high	89.2	Confident	15 Å²	15	61.3 Å²	61.3	9%	0.091	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.9	-178.3	-170.2	0	0	0	0	109.7	R139 F166 S167 D169 E181 E185	R139-V183 HydrophobicContact CG-CG2 4.25Å; F166-V183 CarbonylContact C-O 3.46Å; F166-V183 VanDerWaalsContact CA-O 3.27Å; F166-V183 WeakPolarHBondContact CA-O 3.28Å; S167-V183 PolarHBondContact N-O 2.85Å; S167-V183 PolarHBondContact O-N 2.9Å; D169-V183 HydrophobicContact CB-CG2 3.77Å; E181-V183 PolarHBondContact O-N 3.44Å; V183-E185 PolarHBondContact O-N 2.98Å
184	L	95.8	Very high	89.8	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	114.4	178.4	-173.9	71.4	0	0	0	110.7	A134 P136 G137 T138 F140 Y165 F166 K186 L188	A134-L184 HydrophobicContact CB-CD2 3.8Å; A134-L184 WeakPolarHBondContact O-CD2 3.21Å; P136-L184 CarbonylContact C-O 3.6Å; P136-L184 VanDerWaalsContact CA-O 3.31Å; P136-L184 WeakPolarHBondContact CA-O 3.32Å; G137-L184 PolarHBondContact N-O 2.67Å; T138-L184 PolarHBondContact O-N 3.27Å; F140-L184 HydrophobicContact CE2-CB 4.23Å; Y165-L184 CarbonylContact O-C 3.5Å; F166-L184 HydrophobicContact CD1-CD1 3.92Å; F166-L184 HydrophobicContact CE1-CD1 3.39Å; F166-L184 HydrophobicContact CZ-CD1 3.86Å; L184-K186 WeakPolarHBondContact CD1-O 3.23Å; L184-K186 WeakPolarHBondContact CG-O 3.5Å; L184-L188 HydrophobicContact CD1-CD1 4.14Å; L184-L188 HydrophobicContact CD1-CD2 3.84Å; L184-L188 HydrophobicContact CD1-CG 3.83Å
185	E	93.8	Very high	90.7	Very high	108 Å²	108	55.4 Å²	55.4	51%	0.505	30%	0.297	S	S	.	.			trans	-90.3	-23.3	-178.1	-67.5	-69.8	173.1	0	0	113.3	Y165 S167 V183	Y165-E185 PolarHBondContact O-N 3.45Å; S167-E185 VanDerWaalsContact CB-OE1 3.24Å; S167-E185 WeakPolarHBondContact CB-OE1 3.11Å; S167-E185 PolarHBondContact OG-OE1 3.19Å; V183-E185 PolarHBondContact O-N 2.98Å
186	K	93.2	Very high	91.7	Very high	90 Å²	90	50.9 Å²	50.9	39%	0.391	27%	0.273	S	S	.	.	S	Bend	trans	-141.6	152	-179.1	-67.9	-172.8	-166.2	154.8	0	110.4	N164 Y165 L184	N164-K186 WeakPolarHBondContact O-CD 3.16Å; N164-K186 WeakPolarHBondContact O-CE 3.18Å; N164-K186 WeakPolarHBondContact O-CG 3.34Å; N164-K186 PolarHBondContact O-NZ 2.78Å; N164-K186 PolarHBondContact OD1-NZ 3.15Å; Y165-K186 HydrophobicContact CD1-CB 4.07Å; L184-K186 WeakPolarHBondContact CD1-O 3.23Å; L184-K186 WeakPolarHBondContact CG-O 3.5Å
187	P	94.2	Very high	92.7	Very high	83 Å²	83	56 Å²	56	54%	0.539	28%	0.277	S	S	.	.			trans	-57.4	150.3	171.1	27.6	-35.6	0	0	0	110.3
188	L	94.9	Very high	93.4	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.063	26%	0.259	C	S	.	.			trans	-92.7	170.6	169.9	-52.6	171.8	0	0	0	109.1	I130 E132 Y165 F166 L184 V220	I130-L188 HydrophobicContact CB-CD1 4.13Å; I130-L188 HydrophobicContact CG2-CD1 3.66Å; E132-L188 HydrophobicContact CB-CB 4.06Å; Y165-L188 HydrophobicContact CD1-CD2 3.8Å; Y165-L188 HydrophobicContact CG-CD2 4.26Å; F166-L188 HydrophobicContact CE2-CD2 4.07Å; F166-L188 HydrophobicContact CZ-CD1 4.05Å; F166-L188 HydrophobicContact CZ-CD2 3.71Å; F166-L188 HydrophobicContact CZ-CG 4.46Å; L184-L188 HydrophobicContact CD1-CD1 4.14Å; L184-L188 HydrophobicContact CD1-CD2 3.84Å; L184-L188 HydrophobicContact CD1-CG 3.83Å; L188-V220 HydrophobicContact CB-CG1 4.18Å; L188-V220 HydrophobicContact CD1-CG1 4.38Å; L188-V220 HydrophobicContact CD1-CG2 4.24Å
189	D	95.1	Very high	93.8	Very high	63 Å²	63	53.5 Å²	53.5	34%	0.337	26%	0.264	S	S	.	.			trans	-159.6	104.3	-173.2	167.5	-16.3	0	0	0	104.3	Q192 Q193	D189-Q192 HydrophobicContact CB-CB 4Å; D189-Q192 WeakPolarHBondContact OD1-CB 3.06Å; D189-Q192 PolarHBondContact OD1-N 2.79Å; D189-Q192 VanDerWaalsContact OD2-CB 3.28Å; D189-Q192 WeakPolarHBondContact OD2-CB 3.4Å; D189-Q192 PolarHBondContact OD2-NE2 2.91Å; D189-Q193 PolarHBondContact O-N 2.82Å
190	R	95.4	Very high	94.2	Very high	34 Å²	34	50.8 Å²	50.8	13%	0.128	25%	0.252	C	S	.	.	H	α-helix	trans	-74.1	-35.7	-171.7	-174.9	-146.6	65.5	112.2	-1.9	110.6	E132 Q192 Q193 A194 V220 D222 V257 E259	E132-R190 WeakPolarHBondContact OE2-CA 3.43Å; E132-R190 WeakPolarHBondContact OE2-CB 3.22Å; E132-R190 PolarHBondContact OE2-N 2.81Å; R190-Q192 PolarHBondContact O-N 2.97Å; R190-Q193 CarbonylContact O-C 3.59Å; R190-Q193 PolarHBondContact O-N 3.02Å; R190-A194 HydrophobicContact CG-CB 3.67Å; R190-A194 PolarHBondContact O-N 2.92Å; R190-V220 HydrophobicContact CB-CB 4.29Å; R190-V220 HydrophobicContact CB-CG1 3.86Å; R190-V220 HydrophobicContact CG-CB 4.28Å; R190-V220 HydrophobicContact CG-CG1 4.31Å; R190-D222 WeakPolarHBondContact CD-OD1 3.18Å; R190-D222 IonicContact CZ-OD1 2.62Å; R190-D222 IonicContact NE-OD1 3.6Å; R190-D222 PolarHBondContact NE-OD1 3.44Å; R190-D222 IonicContact NH1-OD1 2.76Å; R190-D222 IonicContact NH2-OD1 3.18Å; R190-V257 PolarHBondContact NH2-O 2.77Å; R190-E259 IonicContact CZ-OE2 3.53Å; R190-E259 IonicContact NH1-OE2 3.8Å; R190-E259 PolarHBondContact NH1-OE2 2.77Å
191	E	94.9	Very high	94.3	Very high	68 Å²	68	52.3 Å²	52.3	32%	0.318	26%	0.262	S	S	.	.	H	α-helix	trans	-61.3	-35.7	176.4	-66.7	56.4	-115	0	0	110.3	V257	E191-V257 HydrophobicContact CG-CB 4.07Å; E191-V257 HydrophobicContact CG-CG2 3.76Å
192	Q	93.8	Very high	94.4	Very high	127 Å²	127	50.2 Å²	50.2	59%	0.593	25%	0.252	S	S	*	.	H	α-helix	trans	-78.5	-48.5	170.9	-175.6	177.2	132.4	0	0	112.8	Y165 D189 R190	Y165-Q192 PolarHBondContact OH-OE1 3.32Å; D189-Q192 HydrophobicContact CB-CB 4Å; D189-Q192 WeakPolarHBondContact OD1-CB 3.06Å; D189-Q192 PolarHBondContact OD1-N 2.79Å; D189-Q192 VanDerWaalsContact OD2-CB 3.28Å; D189-Q192 WeakPolarHBondContact OD2-CB 3.4Å; D189-Q192 PolarHBondContact OD2-NE2 2.91Å; R190-Q192 PolarHBondContact O-N 2.97Å
193	Q	93.4	Very high	94.2	Very high	82 Å²	82	51.4 Å²	51.4	38%	0.383	26%	0.259	S	S	.	.	H	α-helix	trans	-154.9	84.6	-179.6	-168.3	172.7	-8.8	0	0	114.7	D189 R190 V195 H196 V220	D189-Q193 PolarHBondContact O-N 2.82Å; R190-Q193 CarbonylContact O-C 3.59Å; R190-Q193 PolarHBondContact O-N 3.02Å; Q193-V195 WeakPolarHBondContact CG-O 3.11Å; Q193-V195 PolarHBondContact NE2-O 3.37Å; Q193-V195 PolarHBondContact O-N 2.69Å; Q193-H196 VanDerWaalsContact CD-CE1 3.5Å; Q193-H196 VanDerWaalsContact CD-ND1 3.35Å; Q193-H196 PolarHBondContact NE2-ND1 3.39Å; Q193-H196 PolarHBondContact OE1-CE1 2.92Å; Q193-H196 PolarHBondContact OE1-ND1 2.83Å; Q193-V220 WeakPolarHBondContact O-CG2 3.3Å
194	A	94.1	Very high	94.1	Very high	37 Å²	37	50.7 Å²	50.7	31%	0.306	26%	0.255	S	S	.	.	S	Bend	trans	-56	-19.5	175.4	0	0	0	0	0	116.9	R190 V220	R190-A194 HydrophobicContact CG-CB 3.67Å; R190-A194 PolarHBondContact O-N 2.92Å; A194-V220 PolarHBondContact O-N 3.36Å
195	V	95.6	Very high	93.7	Very high	63 Å²	63	52 Å²	52	38%	0.382	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	126	-179	-176.4	0	0	0	0	111.9	Q193 R197 V217 V218	Q193-V195 WeakPolarHBondContact CG-O 3.11Å; Q193-V195 PolarHBondContact NE2-O 3.37Å; Q193-V195 PolarHBondContact O-N 2.69Å; V195-R197 HydrophobicContact CG1-CG 4.43Å; V195-V217 HydrophobicContact CG1-CG1 4.06Å; V195-V218 WeakPolarHBondContact CA-O 3.35Å
196	H	93.8	Very high	93.3	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.019	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	153	169.2	-54.4	-93.3	0	0	0	111.5	Y165 Q193 Y198 V218	Y165-H196 AromaticContact CD2-CE1 3.95Å; Y165-H196 AromaticContact CE2-CE1 3.92Å; Q193-H196 VanDerWaalsContact CD-CE1 3.5Å; Q193-H196 VanDerWaalsContact CD-ND1 3.35Å; Q193-H196 PolarHBondContact NE2-ND1 3.39Å; Q193-H196 PolarHBondContact OE1-CE1 2.92Å; Q193-H196 PolarHBondContact OE1-ND1 2.83Å; H196-Y198 HydrophobicContact CB-CD2 4.43Å; H196-Y198 HydrophobicContact CB-CE2 3.54Å; H196-Y198 PolarHBondContact ND1-OH 3Å; H196-V218 HydrophobicContact CB-CB 4.31Å; H196-V218 PolarHBondContact N-O 2.83Å; H196-V218 PolarHBondContact O-N 2.77Å
197	R	95	Very high	92.8	Very high	153 Å²	153	49.3 Å²	49.3	58%	0.577	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.8	124.7	179.5	-65	-178.2	-178.7	-89	-4.2	109.9	V195 L215 L216 V217	V195-R197 HydrophobicContact CG1-CG 4.43Å; R197-L215 HydrophobicContact CB-CD1 4.44Å; R197-L216 WeakPolarHBondContact CA-O 3.31Å; R197-V217 HydrophobicContact CG-CG1 4.47Å
198	Y	94.8	Very high	92.5	Very high	22 Å²	22	50.1 Å²	50.1	9%	0.086	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	148.1	-178.1	-53.2	-64.8	0	0	0	109.9	I160 N163 F166 H196 L216 V218	I160-Y198 HydrophobicContact CD1-CD2 4.22Å; I160-Y198 HydrophobicContact CD1-CG 4.19Å; I160-Y198 HydrophobicContact CG1-CG 4.42Å; N163-Y198 HydrophobicContact CB-CD1 3.92Å; N163-Y198 HydrophobicContact CB-CE1 3.35Å; F166-Y198 HydrophobicContact CD2-CD2 4.38Å; F166-Y198 AromaticContact CD2-CE2 3.42Å; F166-Y198 HydrophobicContact CD2-CE2 3.42Å; F166-Y198 VanDerWaalsContact CD2-CE2 3.42Å; F166-Y198 AromaticContact CD2-CZ 3.87Å; F166-Y198 AromaticContact CE2-CE2 3.78Å; F166-Y198 HydrophobicContact CE2-CE2 3.78Å; F166-Y198 HydrophobicContact CG-CE2 4.45Å; H196-Y198 HydrophobicContact CB-CD2 4.43Å; H196-Y198 HydrophobicContact CB-CE2 3.54Å; H196-Y198 PolarHBondContact ND1-OH 3Å; Y198-L216 HydrophobicContact CD2-CD2 4.38Å; Y198-L216 PolarHBondContact N-O 3.1Å; Y198-L216 PolarHBondContact O-N 3.42Å; Y198-V218 HydrophobicContact CD2-CG2 4.49Å; Y198-V218 HydrophobicContact CE2-CG2 4.44Å
199	V	93.9	Very high	92.2	Very high	61 Å²	61	55.8 Å²	55.8	37%	0.37	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.2	165.7	-173.7	0	0	0	0	108.3	T161 T213	T161-V199 PolarHBondContact N-O 2.63Å; T161-V199 WeakPolarHBondContact OG1-CA 3.2Å; T161-V199 WeakPolarHBondContact OG1-CB 3.22Å; T161-V199 PolarHBondContact OG1-N 2.83Å; T161-V199 PolarHBondContact OG1-O 2.9Å; V199-T213 HydrophobicContact CG1-CG2 4.18Å
200	L	94.6	Very high	92.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	135.8	167.5	-178.3	68	0	0	0	108.1	F121 I126 V142 L168 T213 A214	F121-L200 HydrophobicContact CD1-CD2 4.32Å; F121-L200 HydrophobicContact CE1-CD2 3.46Å; F121-L200 VanDerWaalsContact CE1-CD2 3.46Å; F121-L200 HydrophobicContact CE1-CG 4.12Å; F121-L200 HydrophobicContact CE2-CD2 4.49Å; F121-L200 HydrophobicContact CE2-CG 4.42Å; F121-L200 HydrophobicContact CZ-CD2 3.57Å; F121-L200 HydrophobicContact CZ-CG 3.68Å; I126-L200 HydrophobicContact CD1-CD2 3.85Å; V142-L200 HydrophobicContact CG1-CD2 3.54Å; L168-L200 HydrophobicContact CD1-CD1 3.64Å; L168-L200 HydrophobicContact CD2-CD1 4.21Å; L200-T213 CarbonylContact O-C 3Å; L200-T213 VanDerWaalsContact O-CA 3.25Å; L200-T213 WeakPolarHBondContact O-CA 3.19Å; L200-A214 PolarHBondContact N-O 3.3Å; L200-A214 PolarHBondContact O-N 3.18Å
201	T	93.3	Very high	92	Very high	33 Å²	33	58.9 Å²	58.9	20%	0.202	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.2	-179	-50.2	0	0	0	0	109.5	Y158 A159 V203 T211 G212 T213	Y158-T201 CarbonylContact C-O 3.6Å; Y158-T201 VanDerWaalsContact CA-O 3.3Å; Y158-T201 WeakPolarHBondContact CA-O 3.47Å; A159-T201 PolarHBondContact N-O 2.89Å; A159-T201 PolarHBondContact O-N 2.8Å; T201-V203 HydrophobicContact CG2-CG2 4.08Å; T201-T211 HydrophobicContact CG2-CG2 4.24Å; T201-G212 CarbonylContact C-O 3.56Å; T201-G212 VanDerWaalsContact CA-O 3.3Å; T201-G212 WeakPolarHBondContact CA-O 3.38Å; T201-T213 HydrophobicContact CG2-CG2 4.1Å
202	A	93.1	Very high	91.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	140.4	166.7	0	0	0	0	0	109	P119 F121 A145 L155 Y158 T211 G212	P119-A202 HydrophobicContact CB-CB 3.95Å; P119-A202 HydrophobicContact CG-CB 4.25Å; F121-A202 HydrophobicContact CE2-CB 3.83Å; F121-A202 HydrophobicContact CZ-CB 3.75Å; A145-A202 HydrophobicContact CB-CB 3.37Å; L155-A202 HydrophobicContact CD1-CB 3.88Å; Y158-A202 HydrophobicContact CD1-CB 4.09Å; Y158-A202 HydrophobicContact CE1-CB 4.15Å; A202-T211 WeakPolarHBondContact O-CA 3.2Å; A202-T211 WeakPolarHBondContact O-CB 3.28Å; A202-G212 PolarHBondContact N-O 2.88Å; A202-G212 PolarHBondContact O-N 2.89Å
203	V	92.1	Very high	91.9	Very high	24 Å²	24	54.3 Å²	54.3	15%	0.145	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	130	-174.5	-169.3	0	0	0	0	109.2	S156 T157 T201 T211	S156-V203 WeakPolarHBondContact CA-O 3.13Å; S156-V203 WeakPolarHBondContact CB-O 3.2Å; S156-V203 PolarHBondContact N-O 2.86Å; T157-V203 HydrophobicContact CG2-CB 4.13Å; T157-V203 HydrophobicContact CG2-CG2 4.48Å; T157-V203 PolarHBondContact N-O 2.79Å; T157-V203 PolarHBondContact O-N 3.07Å; T201-V203 HydrophobicContact CG2-CG2 4.08Å; V203-T211 HydrophobicContact CB-CG2 4.39Å; V203-T211 HydrophobicContact CG1-CG2 4.13Å; V203-T211 HydrophobicContact CG2-CG2 4.03Å
204	D	91.8	Very high	91.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	177.8	175.6	70.9	37.3	0	0	0	113.3	N115 P119 N153 S156 G206 Q209 R210	N115-D204 PolarHBondContact ND2-OD1 2.87Å; N115-D204 PolarHBondContact ND2-OD2 2.81Å; N115-D204 PolarHBondContact OD1-OD2 2.98Å; P119-D204 HydrophobicContact CG-CB 4.36Å; N153-D204 WeakPolarHBondContact O-CB 3.48Å; S156-D204 WeakPolarHBondContact CB-O 3.02Å; D204-G206 PolarHBondContact OD1-N 2.89Å; D204-Q209 VanDerWaalsContact OD1-CA 3.26Å; D204-Q209 WeakPolarHBondContact OD1-CA 3Å; D204-R210 VanDerWaalsContact CG-N 3.32Å; D204-R210 PolarHBondContact N-O 2.82Å; D204-R210 PolarHBondContact OD1-N 3.01Å; D204-R210 WeakPolarHBondContact OD2-CA 3.32Å; D204-R210 WeakPolarHBondContact OD2-CB 3.26Å; D204-R210 WeakPolarHBondContact OD2-CG 3.18Å; D204-R210 PolarHBondContact OD2-N 2.88Å
205	G	87.1	Confident	91.9	Very high	28 Å²	28	51.5 Å²	51.5	29%	0.289	28%	0.284	S	S	.	.	S	Bend	trans	-101.6	1.2	174.4	0	0	0	0	0	114.8	T152 A154	T152-G205 CarbonylContact O-C 3.54Å; T152-G205 WeakPolarHBondContact O-CA 2.94Å; A154-G205 PolarHBondContact O-N 2.84Å
206	G	86.1	Confident	91.8	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.01	27%	0.266	C	S	.	.	S	Bend	trans	-78.9	179.2	-169.3	0	0	0	0	0	114.4	T152 N153 D204 P208 Q209	T152-G206 PolarHBondContact O-N 2.88Å; N153-G206 WeakPolarHBondContact OD1-CA 3.26Å; D204-G206 PolarHBondContact OD1-N 2.89Å; G206-P208 CarbonylContact C-O 3.6Å; G206-P208 CarbonylContact O-C 3.6Å; G206-Q209 WeakPolarHBondContact O-CG 3.47Å
207	V	82.6	Confident	91.9	Very high	140 Å²	140	48.6 Å²	48.6	85%	0.848	27%	0.267	S	S	*	.	S	Bend	trans	-136.6	107.6	177.8	-176.4	0	0	0	0	109.5
208	P	86.4	Confident	91.9	Very high	100 Å²	100	41.3 Å²	41.3	65%	0.649	24%	0.239	S	C	*	.	S	Bend	cis	-66.4	160	1.1	31.4	-37.4	0	0	0	113.1	N115 G206	N115-P208 PolarHBondContact ND2-O 2.93Å; G206-P208 CarbonylContact C-O 3.6Å; G206-P208 CarbonylContact O-C 3.6Å
209	Q	89.6	Confident	91.9	Very high	131 Å²	131	44.8 Å²	44.8	61%	0.612	26%	0.255	S	S	*	.			trans	-81.2	145.6	171.9	-69.9	179.9	-30.5	0	0	111.5	D204 G206	D204-Q209 VanDerWaalsContact OD1-CA 3.26Å; D204-Q209 WeakPolarHBondContact OD1-CA 3Å; G206-Q209 WeakPolarHBondContact O-CG 3.47Å
210	R	92.1	Very high	92	Very high	83 Å²	83	42.2 Å²	42.2	31%	0.313	24%	0.239	S	C	.	.			trans	-132.4	158.9	-179	-43.6	163.4	105.2	-136.9	21.6	108.1	N115 D116 N117 P118 D204	N115-R210 VanDerWaalsContact CG-CD 3.45Å; N115-R210 WeakPolarHBondContact ND2-CD 3.46Å; N115-R210 WeakPolarHBondContact OD1-CD 3.3Å; D116-R210 PolarHBondContact O-NH1 2.95Å; D116-R210 PolarHBondContact O-NH2 2.96Å; N117-R210 VanDerWaalsContact CA-NH1 3.3Å; N117-R210 PolarHBondContact O-NH1 2.9Å; P118-R210 HydrophobicContact CB-CB 4.13Å; P118-R210 VanDerWaalsContact N-NH1 3.15Å; D204-R210 VanDerWaalsContact CG-N 3.32Å; D204-R210 PolarHBondContact N-O 2.82Å; D204-R210 PolarHBondContact OD1-N 3.01Å; D204-R210 WeakPolarHBondContact OD2-CA 3.32Å; D204-R210 WeakPolarHBondContact OD2-CB 3.26Å; D204-R210 WeakPolarHBondContact OD2-CG 3.18Å; D204-R210 PolarHBondContact OD2-N 2.88Å
211	T	93	Very high	92	Very high	79 Å²	79	44.9 Å²	44.9	49%	0.485	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	137.3	-164.6	59	0	0	0	0	113.4	T201 A202 V203	T201-T211 HydrophobicContact CG2-CG2 4.24Å; A202-T211 WeakPolarHBondContact O-CA 3.2Å; A202-T211 WeakPolarHBondContact O-CB 3.28Å; V203-T211 HydrophobicContact CB-CG2 4.39Å; V203-T211 HydrophobicContact CG1-CG2 4.13Å; V203-T211 HydrophobicContact CG2-CG2 4.03Å
212	G	92.8	Very high	92.1	Very high	10 Å²	10	45.1 Å²	45.1	10%	0.103	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	152.1	165	0	0	0	0	0	111.6	P119 T201 A202	P119-G212 WeakPolarHBondContact O-CA 3.46Å; P119-G212 PolarHBondContact O-N 2.84Å; P119-G212 VanDerWaalsContact O-N 3.17Å; T201-G212 CarbonylContact C-O 3.56Å; T201-G212 VanDerWaalsContact CA-O 3.3Å; T201-G212 WeakPolarHBondContact CA-O 3.38Å; A202-G212 PolarHBondContact N-O 2.88Å; A202-G212 PolarHBondContact O-N 2.89Å
213	T	93.8	Very high	92.1	Very high	90 Å²	90	45.9 Å²	45.9	55%	0.552	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.5	178.7	56.2	0	0	0	0	112.4	V199 L200 T201	V199-T213 HydrophobicContact CG1-CG2 4.18Å; L200-T213 CarbonylContact O-C 3Å; L200-T213 VanDerWaalsContact O-CA 3.25Å; L200-T213 WeakPolarHBondContact O-CA 3.19Å; T201-T213 HydrophobicContact CG2-CG2 4.1Å
214	A	94	Very high	92.2	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.033	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	154.7	170.9	0	0	0	0	0	110.9	F121 P124 I126 L200	F121-A214 HydrophobicContact CB-CB 4.03Å; F121-A214 HydrophobicContact CD1-CB 4.42Å; F121-A214 HydrophobicContact CD2-CB 3.7Å; F121-A214 HydrophobicContact CE2-CB 4.26Å; F121-A214 HydrophobicContact CG-CB 3.79Å; P124-A214 CarbonylContact O-C 3.59Å; P124-A214 WeakPolarHBondContact O-CA 3.35Å; I126-A214 HydrophobicContact CD1-CB 3.69Å; I126-A214 HydrophobicContact CG1-CB 4.11Å; L200-A214 PolarHBondContact N-O 3.3Å; L200-A214 PolarHBondContact O-N 3.18Å
215	L	94.6	Very high	92.3	Very high	55 Å²	55	51.9 Å²	51.9	29%	0.288	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	105.5	174.6	-178.7	69.1	0	0	0	109.7	P124 D125 I126 R197 V217	P124-L215 PolarHBondContact O-N 3.02Å; D125-L215 CarbonylContact C-O 3.56Å; D125-L215 WeakPolarHBondContact CA-O 3.23Å; D125-L215 WeakPolarHBondContact OD1-CB 3.43Å; D125-L215 WeakPolarHBondContact OD1-CD2 3.47Å; I126-L215 PolarHBondContact N-O 2.64Å; R197-L215 HydrophobicContact CB-CD1 4.44Å; L215-V217 HydrophobicContact CD2-CG2 4.02Å; L215-V217 HydrophobicContact CG-CG2 3.99Å; L215-V217 PolarHBondContact O-N 2.98Å
216	L	94.4	Very high	92.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	114.3	170.5	176.7	63.9	0	0	0	109.7	I126 V128 I160 L182 R197 Y198 V218	I126-L216 HydrophobicContact CB-CD1 4.49Å; I126-L216 HydrophobicContact CG2-CD1 4.18Å; I126-L216 WeakPolarHBondContact O-CA 3.08Å; V128-L216 HydrophobicContact CB-CD1 4.45Å; V128-L216 HydrophobicContact CG2-CD1 3.65Å; I160-L216 HydrophobicContact CD1-CD2 3.89Å; L182-L216 HydrophobicContact CD1-CD2 3.7Å; L182-L216 HydrophobicContact CD2-CD2 4.03Å; L182-L216 HydrophobicContact CG-CD2 4.5Å; R197-L216 WeakPolarHBondContact CA-O 3.31Å; Y198-L216 HydrophobicContact CD2-CD2 4.38Å; Y198-L216 PolarHBondContact N-O 3.1Å; Y198-L216 PolarHBondContact O-N 3.42Å; L216-V218 HydrophobicContact CD1-CG2 4.39Å; L216-V218 HydrophobicContact CD2-CG2 4.33Å; L216-V218 HydrophobicContact CG-CG2 4.1Å
217	V	94.7	Very high	93	Very high	7 Å²	7	55.2 Å²	55.2	4%	0.042	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	106	174.1	-174.3	0	0	0	0	108.4	I126 F127 V128 V195 R197 L215	I126-V217 PolarHBondContact O-N 2.7Å; F127-V217 HydrophobicContact CD1-CB 3.81Å; F127-V217 HydrophobicContact CD1-CG1 4.05Å; F127-V217 HydrophobicContact CD1-CG2 4.41Å; F127-V217 HydrophobicContact CE1-CB 3.91Å; F127-V217 HydrophobicContact CE1-CG1 4.02Å; F127-V217 HydrophobicContact CE1-CG2 4.06Å; V128-V217 PolarHBondContact N-O 3.24Å; V195-V217 HydrophobicContact CG1-CG1 4.06Å; R197-V217 HydrophobicContact CG-CG1 4.47Å; L215-V217 HydrophobicContact CD2-CG2 4.02Å; L215-V217 HydrophobicContact CG-CG2 3.99Å; L215-V217 PolarHBondContact O-N 2.98Å
218	V	94.9	Very high	93.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	117.8	172.8	-175.9	0	0	0	0	108.3	V128 I130 F166 L182 V195 H196 Y198 L216	V128-V218 WeakPolarHBondContact O-CA 3.48Å; I130-V218 HydrophobicContact CB-CG1 4.27Å; I130-V218 HydrophobicContact CD1-CG1 3.72Å; I130-V218 HydrophobicContact CG1-CG1 3.99Å; F166-V218 HydrophobicContact CE2-CG1 4.42Å; F166-V218 HydrophobicContact CE2-CG2 4.32Å; F166-V218 HydrophobicContact CZ-CB 4.42Å; F166-V218 HydrophobicContact CZ-CG1 3.85Å; F166-V218 HydrophobicContact CZ-CG2 4.27Å; L182-V218 HydrophobicContact CD2-CG2 4.12Å; V195-V218 WeakPolarHBondContact CA-O 3.35Å; H196-V218 HydrophobicContact CB-CB 4.31Å; H196-V218 PolarHBondContact N-O 2.83Å; H196-V218 PolarHBondContact O-N 2.77Å; Y198-V218 HydrophobicContact CD2-CG2 4.49Å; Y198-V218 HydrophobicContact CE2-CG2 4.44Å; L216-V218 HydrophobicContact CD1-CG2 4.39Å; L216-V218 HydrophobicContact CD2-CG2 4.33Å; L216-V218 HydrophobicContact CG-CG2 4.1Å
219	K	95.3	Very high	94.1	Very high	95 Å²	95	47.8 Å²	47.8	41%	0.413	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.8	170.2	175.6	-175.9	159	-150.9	0	108.2	V128 E129 I130 L221	V128-K219 PolarHBondContact O-N 3.34Å; E129-K219 WeakPolarHBondContact CA-O 3.31Å; E129-K219 HydrophobicContact CG-CB 4.48Å; E129-K219 HydrophobicContact CG-CD 4.43Å; E129-K219 WeakPolarHBondContact OE1-CD 3.02Å; E129-K219 WeakPolarHBondContact OE1-CE 3.49Å; E129-K219 IonicContact OE1-NZ 2.59Å; E129-K219 PolarHBondContact OE1-NZ 2.84Å; I130-K219 PolarHBondContact N-O 3.14Å; K219-L221 HydrophobicContact CD-CD2 4.48Å
220	V	96	Very high	94.4	Very high	6 Å²	6	43 Å²	43	4%	0.036	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	133.4	173.9	-169	0	0	0	0	108.3	I130 E132 L188 R190 Q193 A194	I130-V220 CarbonylContact O-C 3.36Å; I130-V220 VanDerWaalsContact O-CA 3.29Å; I130-V220 WeakPolarHBondContact O-CA 3.3Å; E132-V220 HydrophobicContact CB-CG1 3.68Å; L188-V220 HydrophobicContact CB-CG1 4.18Å; L188-V220 HydrophobicContact CD1-CG1 4.38Å; L188-V220 HydrophobicContact CD1-CG2 4.24Å; R190-V220 HydrophobicContact CB-CB 4.29Å; R190-V220 HydrophobicContact CB-CG1 3.86Å; R190-V220 HydrophobicContact CG-CB 4.28Å; R190-V220 HydrophobicContact CG-CG1 4.31Å; Q193-V220 WeakPolarHBondContact O-CG2 3.3Å; A194-V220 PolarHBondContact O-N 3.36Å
221	L	94.7	Very high	94.4	Very high	56 Å²	56	44.3 Å²	44.3	29%	0.293	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	129.8	174.1	-63.1	-177.3	0	0	0	110.1	E129 I130 S131 E132 K219	E129-L221 HydrophobicContact CB-CD1 3.84Å; E129-L221 HydrophobicContact CB-CD2 4.13Å; E129-L221 HydrophobicContact CB-CG 3.92Å; E129-L221 HydrophobicContact CG-CD2 4.44Å; I130-L221 PolarHBondContact O-N 3.27Å; S131-L221 WeakPolarHBondContact CA-O 3.22Å; E132-L221 PolarHBondContact N-O 2.58Å; E132-L221 VanDerWaalsContact N-O 3.14Å; K219-L221 HydrophobicContact CD-CD2 4.48Å
222	D	94.8	Very high	94.4	Very high	39 Å²	39	45.8 Å²	45.8	21%	0.209	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-56.8	133.1	-178.9	-166.8	87.3	0	0	0	113.2	E132 R190 E259 N262	E132-D222 VanDerWaalsContact OE1-CA 3.22Å; E132-D222 WeakPolarHBondContact OE1-CA 3.39Å; R190-D222 WeakPolarHBondContact CD-OD1 3.18Å; R190-D222 IonicContact CZ-OD1 2.62Å; R190-D222 IonicContact NE-OD1 3.6Å; R190-D222 PolarHBondContact NE-OD1 3.44Å; R190-D222 IonicContact NH1-OD1 2.76Å; R190-D222 IonicContact NH2-OD1 3.18Å; D222-E259 HydrophobicContact CB-CB 4Å; D222-E259 VanDerWaalsContact CG-N 3.31Å; D222-E259 WeakPolarHBondContact OD1-CA 3.39Å; D222-E259 WeakPolarHBondContact OD1-CB 3.24Å; D222-E259 PolarHBondContact OD1-N 3.01Å; D222-E259 PolarHBondContact OD2-N 2.87Å; D222-N262 PolarHBondContact OD2-ND2 2.87Å
223	S	93.7	Very high	94.4	Very high	16 Å²	16	49.7 Å²	49.7	11%	0.112	28%	0.276	C	S	.	.			trans	-125.4	135.7	173.4	-63	0	0	0	0	109.7	S131 E132 S133 D225	S131-S223 PolarHBondContact OG-OG 2.91Å; S131-S223 VanDerWaalsContact OG-OG 3.06Å; E132-S223 PolarHBondContact OE1-N 2.93Å; S133-S223 PolarHBondContact OG-OG 2.86Å; S223-D225 VanDerWaalsContact C-N 3.28Å; S223-D225 PolarHBondContact O-N 2.86Å
224	N	94.6	Very high	94.5	Very high	35 Å²	35	48.9 Å²	48.9	19%	0.187	27%	0.271	C	S	.	.	S	Bend	trans	-71.2	81.3	177.6	-159.1	52.6	0	0	0	110.6	D258 N262 D312 A315 A317	N224-D258 WeakPolarHBondContact CA-OD2 3.41Å; N224-N262 HydrophobicContact CB-CB 4.13Å; N224-N262 PolarHBondContact N-ND2 2.93Å; N224-N262 WeakPolarHBondContact OD1-CA 3.38Å; N224-N262 WeakPolarHBondContact OD1-CB 3.5Å; N224-D312 PolarHBondContact ND2-OD1 2.84Å; N224-D312 PolarHBondContact OD1-OD1 2.9Å; N224-A315 WeakPolarHBondContact CB-O 3.12Å; N224-A315 PolarHBondContact ND2-O 3.09Å; N224-A317 WeakPolarHBondContact ND2-CA 3.47Å; N224-A317 PolarHBondContact ND2-N 2.87Å
225	D	92.9	Very high	94.6	Very high	114 Å²	114	49.8 Å²	49.8	61%	0.61	27%	0.274	S	S	*	.			trans	-123.5	-20.5	-170	117.8	-44.3	0	0	0	113	S223 D258	S223-D225 VanDerWaalsContact C-N 3.28Å; S223-D225 PolarHBondContact O-N 2.86Å; D225-D258 PolarHBondContact N-OD2 3.1Å; D225-D258 VanDerWaalsContact N-OD2 3.14Å
226	N	93.5	Very high	94.8	Very high	64 Å²	64	50.8 Å²	50.8	34%	0.342	28%	0.282	S	S	.	.	S	Bend	trans	-82.5	179.2	159.2	-62.5	-80.8	0	0	0	110.5	V257 D258	N226-V257 HydrophobicContact CB-CG2 3.76Å; N226-V257 VanDerWaalsContact CG-CG2 3.42Å; N226-V257 WeakPolarHBondContact ND2-CG2 2.95Å; N226-D258 VanDerWaalsContact CB-OD1 3.3Å; N226-D258 WeakPolarHBondContact CB-OD1 3.25Å; N226-D258 PolarHBondContact N-OD2 3.33Å; N226-D258 PolarHBondContact ND2-OD1 2.57Å
227	A	94.2	Very high	94.9	Very high	35 Å²	35	52 Å²	52	29%	0.289	29%	0.289	S	S	.	.			trans	-151.4	153.6	176.7	0	0	0	0	0	109.7	T229 D256 V318	A227-T229 PolarHBondContact O-N 2.91Å; A227-D256 WeakPolarHBondContact CA-OD2 3.23Å; A227-V318 HydrophobicContact CB-CB 4.14Å; A227-V318 HydrophobicContact CB-CG1 4.5Å
228	P	96.3	Very high	95	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.013	32%	0.318	C	S	.	.			trans	-61.2	137.2	-170.1	-27.9	35.6	0	0	0	112.7	A254 D256 I265 A310 D312 A320	P228-A254 HydrophobicContact CB-CB 4.47Å; P228-D256 WeakPolarHBondContact CA-OD2 3.48Å; P228-D256 WeakPolarHBondContact CD-OD2 3.35Å; P228-D256 WeakPolarHBondContact CG-OD2 3.42Å; P228-I265 HydrophobicContact CB-CD1 4.05Å; P228-I265 HydrophobicContact CB-CG1 4.14Å; P228-I265 HydrophobicContact CG-CD1 4.49Å; P228-I265 HydrophobicContact CG-CG1 4.06Å; P228-A310 HydrophobicContact CB-CB 4Å; P228-D312 HydrophobicContact CG-CB 4.36Å; P228-A320 WeakPolarHBondContact O-CB 3.32Å
229	T	95.3	Very high	95.1	Very high	82 Å²	82	57.8 Å²	57.8	50%	0.503	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.7	-178.3	48.9	0	0	0	0	111.4	A227 A254 T255	A227-T229 PolarHBondContact O-N 2.91Å; T229-A254 CarbonylContact O-C 3.5Å; T229-A254 WeakPolarHBondContact O-CA 3.31Å; T229-T255 PolarHBondContact N-O 3.48Å; T229-T255 PolarHBondContact O-N 3.13Å; T229-T255 PolarHBondContact O-OG1 2.8Å; T229-T255 PolarHBondContact OG1-O 2.62Å; T229-T255 PolarHBondContact OG1-OG1 2.88Å
230	F	96	Very high	95.1	Very high	32 Å²	32	61.6 Å²	61.6	14%	0.14	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	143.8	174	-72.1	-79.8	0	0	0	111.1	E232 L252 N253 A254 Y267 V308 A310 A320 C322	F230-E232 VanDerWaalsContact C-N 3.32Å; F230-E232 PolarHBondContact O-N 2.94Å; F230-L252 HydrophobicContact CE1-CB 4.45Å; F230-L252 HydrophobicContact CE1-CD1 4.31Å; F230-N253 WeakPolarHBondContact CD1-O 3.13Å; F230-A254 HydrophobicContact CD1-CB 3.87Å; F230-A254 HydrophobicContact CE1-CB 4Å; F230-A254 HydrophobicContact CG-CB 4.27Å; F230-Y267 HydrophobicContact CE1-CD1 4.26Å; F230-Y267 HydrophobicContact CE1-CE1 4.04Å; F230-V308 HydrophobicContact CZ-CG1 4.39Å; F230-A310 HydrophobicContact CE1-CB 4.09Å; F230-A310 HydrophobicContact CE2-CB 3.68Å; F230-A310 HydrophobicContact CZ-CB 3.37Å; F230-A320 HydrophobicContact CD2-CB 4.48Å; F230-A320 HydrophobicContact CE2-CB 4.44Å; F230-C322 HydrophobicContact CB-CB 4.17Å; F230-C322 HydrophobicContact CD1-CB 4.15Å; F230-C322 VanDerWaalsContact CD1-SG 3.59Å; F230-C322 HydrophobicContact CD2-CB 3.67Å; F230-C322 HydrophobicContact CE1-CB 4.44Å; F230-C322 WeakPolarHBondContact CE1-SG 3.47Å; F230-C322 HydrophobicContact CE2-CB 3.99Å; F230-C322 HydrophobicContact CG-CB 3.75Å; F230-C322 HydrophobicContact CZ-CB 4.36Å; F230-C322 WeakPolarHBondContact CZ-SG 3.22Å
231	D	92.9	Very high	95	Very high	110 Å²	110	61.5 Å²	61.5	59%	0.588	33%	0.331	S	S	*	.	S	Bend	trans	-57.5	-41.5	176.4	-67.1	-53.5	0	0	0	112.8	Y235 N253	D231-Y235 PolarHBondContact N-OH 2.74Å; D231-N253 WeakPolarHBondContact OD2-CB 3.36Å; D231-N253 PolarHBondContact OD2-ND2 2.91Å
232	E	93.1	Very high	94.9	Very high	110 Å²	110	63.2 Å²	63.2	51%	0.514	34%	0.341	S	S	.	.			trans	-128.1	150	173.2	-58.4	-174	-179.9	0	0	112.2	F230 Y235	F230-E232 VanDerWaalsContact C-N 3.32Å; F230-E232 PolarHBondContact O-N 2.94Å; E232-Y235 HydrophobicContact CB-CD1 4.04Å; E232-Y235 HydrophobicContact CB-CE1 3.68Å; E232-Y235 HydrophobicContact CB-CE2 4.29Å; E232-Y235 HydrophobicContact CG-CD1 4.4Å; E232-Y235 HydrophobicContact CG-CE1 4.03Å; E232-Y235 PolarHBondContact N-OH 3.05Å; E232-Y235 WeakPolarHBondContact O-CE2 3.4Å; E232-Y235 PolarHBondContact O-OH 3.04Å
233	S	92.7	Very high	95	Very high	91 Å²	91	62.2 Å²	62.2	64%	0.636	34%	0.337	S	S	*	.	S	Bend	trans	-82.1	-24.1	174.3	57.9	0	0	0	0	113.7	C322 K323	S233-C322 WeakPolarHBondContact O-CA 3.46Å; S233-K323 PolarHBondContact O-N 2.94Å
234	V	96.4	Very high	95	Very high	73 Å²	73	66 Å²	66	44%	0.442	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	95.8	179.6	-172.3	0	0	0	0	111.1	K323	V234-K323 CarbonylContact C-O 3.52Å; V234-K323 WeakPolarHBondContact CA-O 3.46Å; V234-K323 HydrophobicContact CG1-CB 4.3Å; V234-K323 HydrophobicContact CG2-CB 4.33Å
235	Y	96.6	Very high	95.1	Very high	23 Å²	23	69.2 Å²	69.2	9%	0.09	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	145.8	171	-54.7	-87.5	0	0	0	110.2	D231 E232 I250 L252 C322 K323 V324 L325	D231-Y235 PolarHBondContact N-OH 2.74Å; E232-Y235 HydrophobicContact CB-CD1 4.04Å; E232-Y235 HydrophobicContact CB-CE1 3.68Å; E232-Y235 HydrophobicContact CB-CE2 4.29Å; E232-Y235 HydrophobicContact CG-CD1 4.4Å; E232-Y235 HydrophobicContact CG-CE1 4.03Å; E232-Y235 PolarHBondContact N-OH 3.05Å; E232-Y235 WeakPolarHBondContact O-CE2 3.4Å; E232-Y235 PolarHBondContact O-OH 3.04Å; Y235-I250 HydrophobicContact CD1-CD1 3.88Å; Y235-I250 HydrophobicContact CG-CD1 3.92Å; Y235-L252 HydrophobicContact CD2-CD2 3.58Å; Y235-L252 HydrophobicContact CE1-CD2 4.47Å; Y235-L252 HydrophobicContact CE2-CD2 3.53Å; Y235-L252 HydrophobicContact CG-CD2 4.12Å; Y235-C322 HydrophobicContact CD2-CB 4.5Å; Y235-C322 HydrophobicContact CE2-CB 4.02Å; Y235-K323 PolarHBondContact N-O 3.36Å; Y235-V324 HydrophobicContact CD2-CG2 4.23Å; Y235-L325 PolarHBondContact O-N 2.84Å
236	T	97.2	Very high	95.2	Very high	76 Å²	76	65.9 Å²	65.9	47%	0.466	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.3	171.1	-60.8	0	0	0	0	110.3	L325 K327	T236-L325 WeakPolarHBondContact CA-O 3.47Å; T236-L325 HydrophobicContact CG2-CD2 4.49Å; T236-K327 HydrophobicContact CG2-CD 4.02Å
237	V	96.9	Very high	95.3	Very high	25 Å²	25	64.7 Å²	64.7	15%	0.152	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.3	-178.1	-178.5	0	0	0	0	109.1	V249 I250 V324 L325 K327	V237-V249 HydrophobicContact CB-CG1 4.27Å; V237-V249 HydrophobicContact CG1-CG1 3.89Å; V237-V249 WeakPolarHBondContact CG1-O 3.47Å; V237-V249 HydrophobicContact CG2-CG1 4.43Å; V237-I250 HydrophobicContact CG2-CB 4.05Å; V237-I250 HydrophobicContact CG2-CD1 4.08Å; V237-I250 HydrophobicContact CG2-CG2 4.49Å; V237-V324 HydrophobicContact CG2-CG1 4.05Å; V237-L325 PolarHBondContact N-O 2.77Å; V237-K327 PolarHBondContact O-N 2.9Å
238	N	97.1	Very high	95.5	Very high	119 Å²	119	66.8 Å²	66.8	64%	0.636	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.4	166.8	-65.5	-9.8	0	0	0	108.2	K327 V329	N238-K327 WeakPolarHBondContact CA-O 3.48Å; N238-V329 HydrophobicContact CB-CG2 4.02Å
239	L	96.8	Very high	95.5	Very high	10 Å²	10	67.3 Å²	67.3	5%	0.052	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	142.6	177	-179	66.8	0	0	0	107.7	T247 V249 F281 V292 V296 V326 K327 L328 V329	L239-T247 HydrophobicContact CD1-CG2 4.06Å; L239-V249 HydrophobicContact CD1-CG2 4.45Å; L239-V249 HydrophobicContact CD2-CG2 4.11Å; L239-F281 HydrophobicContact CD2-CE1 3.97Å; L239-F281 HydrophobicContact CD2-CZ 4.42Å; L239-V292 HydrophobicContact CD1-CG2 4.31Å; L239-V292 HydrophobicContact CD2-CG2 3.81Å; L239-V296 HydrophobicContact CD2-CG2 4.29Å; L239-V326 HydrophobicContact CB-CG1 3.65Å; L239-V326 HydrophobicContact CD2-CG1 3.84Å; L239-V326 HydrophobicContact CG-CG1 4.41Å; L239-K327 PolarHBondContact N-O 3.28Å; L239-L328 HydrophobicContact CB-CD2 4.19Å; L239-L328 HydrophobicContact CD2-CD2 4.08Å; L239-L328 HydrophobicContact CG-CD2 4.33Å; L239-L328 CarbonylContact O-C 3.55Å; L239-L328 VanDerWaalsContact O-CA 3.27Å; L239-L328 WeakPolarHBondContact O-CA 3.26Å; L239-V329 PolarHBondContact O-N 3.31Å
240	R	95.3	Very high	95.6	Very high	175 Å²	175	65 Å²	65	66%	0.66	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	142.3	168.2	-73.5	-177.9	177.2	-174.2	-5	109.3	S243 V329 V331	R240-S243 WeakPolarHBondContact O-CB 3.22Å; R240-S243 PolarHBondContact O-OG 2.67Å; R240-V329 HydrophobicContact CG-CB 4.31Å; R240-V331 HydrophobicContact CB-CG2 4.1Å; R240-V331 HydrophobicContact CG-CG2 4.26Å
241	E	94.4	Very high	95.6	Very high	5 Å²	5	68.2 Å²	68.2	2%	0.023	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	169.8	162.5	76.6	-170.6	120.9	0	0	111	S243 V296 Y298 L328 V329 D330 V331	E241-S243 PolarHBondContact O-N 2.96Å; E241-V296 WeakPolarHBondContact CB-O 3.32Å; E241-Y298 VanDerWaalsContact OE1-CB 3.29Å; E241-Y298 WeakPolarHBondContact OE1-CB 3.32Å; E241-Y298 WeakPolarHBondContact OE2-CB 3.38Å; E241-Y298 PolarHBondContact OE2-N 2.86Å; E241-L328 HydrophobicContact CB-CD1 4.49Å; E241-V329 PolarHBondContact N-O 2.91Å; E241-D330 WeakPolarHBondContact OE1-CA 3.21Å; E241-V331 HydrophobicContact CG-CB 3.87Å; E241-V331 HydrophobicContact CG-CG2 4.06Å; E241-V331 PolarHBondContact OE1-N 2.77Å
242	N	93.3	Very high	95.8	Very high	91 Å²	91	63.1 Å²	63.1	49%	0.487	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	17.5	-172.3	-73.4	-65	0	0	0	114	V296 D333	N242-V296 PolarHBondContact N-O 3.4Å; N242-D333 PolarHBondContact ND2-OD2 2.73Å
243	S	95.1	Very high	95.8	Very high	19 Å²	19	61.4 Å²	61.4	13%	0.133	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-64	127.3	172.5	-75.3	0	0	0	0	109.4	R240 E241	R240-S243 WeakPolarHBondContact O-CB 3.22Å; R240-S243 PolarHBondContact O-OG 2.67Å; E241-S243 PolarHBondContact O-N 2.96Å
244	P	95.4	Very high	95.9	Very high	95 Å²	95	57.4 Å²	57.4	62%	0.617	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-65.9	150.1	-174.8	25.8	-34	0	0	0	112	G246 T247	P244-G246 PolarHBondContact O-N 3.29Å; P244-T247 WeakPolarHBondContact CD-OG1 3.28Å; P244-T247 VanDerWaalsContact O-CB 3.23Å; P244-T247 WeakPolarHBondContact O-CB 3.43Å; P244-T247 PolarHBondContact O-N 3.4Å; P244-T247 PolarHBondContact O-OG1 2.91Å
245	V	95.3	Very high	95.9	Very high	103 Å²	103	57.1 Å²	57.1	62%	0.624	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	133.1	173.6	177.2	0	0	0	0	110.4	V292	V245-V292 CarbonylContact C-O 3.55Å; V245-V292 WeakPolarHBondContact CA-O 3.47Å
246	G	94.8	Very high	95.8	Very high	44 Å²	44	57.4 Å²	57.4	45%	0.454	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	3.4	-169.2	0	0	0	0	0	114.9	P244 L248 V292	P244-G246 PolarHBondContact O-N 3.29Å; G246-L248 PolarHBondContact O-N 2.93Å; G246-V292 PolarHBondContact N-O 2.93Å
247	T	97	Very high	95.8	Very high	38 Å²	38	57.7 Å²	57.7	23%	0.233	32%	0.321	C	S	.	.			trans	-69	121.9	170.9	-63.5	0	0	0	0	110.3	L239 P244 V249 E291 V292	L239-T247 HydrophobicContact CD1-CG2 4.06Å; P244-T247 WeakPolarHBondContact CD-OG1 3.28Å; P244-T247 VanDerWaalsContact O-CB 3.23Å; P244-T247 WeakPolarHBondContact O-CB 3.43Å; P244-T247 PolarHBondContact O-N 3.4Å; P244-T247 PolarHBondContact O-OG1 2.91Å; T247-V249 PolarHBondContact O-N 2.78Å; T247-E291 CarbonylContact O-C 3.56Å; T247-E291 VanDerWaalsContact O-CA 3.3Å; T247-E291 WeakPolarHBondContact O-CA 3.29Å; T247-V292 PolarHBondContact O-N 2.95Å
248	L	97.3	Very high	95.7	Very high	79 Å²	79	57 Å²	57	41%	0.414	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	120.5	174.2	-178.1	68.1	0	0	0	110.8	G246 R289 E291	G246-L248 PolarHBondContact O-N 2.93Å; L248-R289 HydrophobicContact CD1-CB 3.99Å; L248-R289 HydrophobicContact CD1-CG 3.98Å; L248-E291 HydrophobicContact CD1-CG 4.05Å
249	V	97.3	Very high	95.5	Very high	14 Å²	14	56.9 Å²	56.9	9%	0.085	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-53.4	175	-175.7	0	0	0	0	109.7	V237 L239 T247 F281 I290 V292 V326	V237-V249 HydrophobicContact CB-CG1 4.27Å; V237-V249 HydrophobicContact CG1-CG1 3.89Å; V237-V249 WeakPolarHBondContact CG1-O 3.47Å; V237-V249 HydrophobicContact CG2-CG1 4.43Å; L239-V249 HydrophobicContact CD1-CG2 4.45Å; L239-V249 HydrophobicContact CD2-CG2 4.11Å; T247-V249 PolarHBondContact O-N 2.78Å; V249-F281 HydrophobicContact CG2-CD1 3.97Å; V249-F281 HydrophobicContact CG2-CE1 3.91Å; V249-I290 HydrophobicContact CB-CB 4.47Å; V249-I290 HydrophobicContact CB-CG2 4.22Å; V249-I290 WeakPolarHBondContact CB-O 3.36Å; V249-I290 HydrophobicContact CG2-CG2 4.39Å; V249-I290 PolarHBondContact N-O 3.08Å; V249-V292 HydrophobicContact CG2-CG2 3.85Å; V249-V326 HydrophobicContact CG1-CG1 4.27Å; V249-V326 HydrophobicContact CG1-CG2 3.73Å
250	I	97.1	Very high	95.3	Very high	33 Å²	33	59.1 Å²	59.1	17%	0.169	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	148.2	176.1	-172.2	164	0	0	0	109.4	Y235 V237 L252 I290 V324	Y235-I250 HydrophobicContact CD1-CD1 3.88Å; Y235-I250 HydrophobicContact CG-CD1 3.92Å; V237-I250 HydrophobicContact CG2-CB 4.05Å; V237-I250 HydrophobicContact CG2-CD1 4.08Å; V237-I250 HydrophobicContact CG2-CG2 4.49Å; I250-L252 HydrophobicContact CD1-CD2 4.11Å; I250-L252 HydrophobicContact CG1-CD2 4.36Å; I250-L252 HydrophobicContact CG2-CD2 4.23Å; I250-L252 HydrophobicContact CG2-CG 4.34Å; I250-I290 HydrophobicContact CG2-CB 4.14Å; I250-I290 HydrophobicContact CG2-CD1 4.01Å; I250-I290 HydrophobicContact CG2-CG1 4.32Å; I250-I290 PolarHBondContact N-O 3.36Å; I250-I290 PolarHBondContact O-N 3.44Å; I250-V324 HydrophobicContact CG2-CG1 3.94Å; I250-V324 HydrophobicContact CG2-CG2 4.21Å
251	Q	96.6	Very high	95.3	Very high	99 Å²	99	55.6 Å²	55.6	46%	0.463	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115	160.8	-175.9	164.8	-10.8	0	0	107.9	T287 R289	Q251-T287 WeakPolarHBondContact CG-O 3.4Å; Q251-T287 PolarHBondContact NE2-O 3.19Å; Q251-R289 HydrophobicContact CB-CG 3.99Å; Q251-R289 HydrophobicContact CG-CG 3.7Å; Q251-R289 VanDerWaalsContact OE1-NH2 3.16Å
252	L	96	Very high	95.2	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.021	34%	0.336	C	S	.	.			trans	-77.3	154	175.1	-65.3	177.1	0	0	0	110.8	F230 Y235 I250 Y267 G288 I290 V308 V324	F230-L252 HydrophobicContact CE1-CB 4.45Å; F230-L252 HydrophobicContact CE1-CD1 4.31Å; Y235-L252 HydrophobicContact CD2-CD2 3.58Å; Y235-L252 HydrophobicContact CE1-CD2 4.47Å; Y235-L252 HydrophobicContact CE2-CD2 3.53Å; Y235-L252 HydrophobicContact CG-CD2 4.12Å; I250-L252 HydrophobicContact CD1-CD2 4.11Å; I250-L252 HydrophobicContact CG1-CD2 4.36Å; I250-L252 HydrophobicContact CG2-CD2 4.23Å; I250-L252 HydrophobicContact CG2-CG 4.34Å; L252-Y267 HydrophobicContact CB-CE1 4.43Å; L252-G288 WeakPolarHBondContact CB-O 3.38Å; L252-G288 PolarHBondContact N-O 2.9Å; L252-I290 HydrophobicContact CD1-CD1 3.88Å; L252-I290 HydrophobicContact CD1-CG1 4.47Å; L252-I290 HydrophobicContact CG-CD1 4.37Å; L252-V308 HydrophobicContact CD1-CB 4.07Å; L252-V308 HydrophobicContact CD1-CG1 3.7Å; L252-V308 HydrophobicContact CD1-CG2 3.99Å; L252-V324 HydrophobicContact CD1-CG2 4.25Å; L252-V324 HydrophobicContact CD2-CG2 3.93Å
253	N	93.9	Very high	95.2	Very high	74 Å²	74	53.4 Å²	53.4	40%	0.396	33%	0.326	S	S	.	.			trans	-130.8	130.5	173.5	-179.2	60.5	0	0	0	108.2	F230 D231	F230-N253 WeakPolarHBondContact CD1-O 3.13Å; D231-N253 WeakPolarHBondContact OD2-CB 3.36Å; D231-N253 PolarHBondContact OD2-ND2 2.91Å
254	A	95	Very high	95.2	Very high	7 Å²	7	55.4 Å²	55.4	6%	0.058	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	146.8	166.8	0	0	0	0	0	108.3	P228 T229 F230 I265 Y267 A310	P228-A254 HydrophobicContact CB-CB 4.47Å; T229-A254 CarbonylContact O-C 3.5Å; T229-A254 WeakPolarHBondContact O-CA 3.31Å; F230-A254 HydrophobicContact CD1-CB 3.87Å; F230-A254 HydrophobicContact CE1-CB 4Å; F230-A254 HydrophobicContact CG-CB 4.27Å; A254-I265 HydrophobicContact CB-CD1 4.05Å; A254-I265 WeakPolarHBondContact O-CD1 3.21Å; A254-Y267 HydrophobicContact CB-CE1 3.9Å; A254-Y267 PolarHBondContact N-OH 3.02Å; A254-A310 HydrophobicContact CB-CB 3.9Å
255	T	95.1	Very high	95.2	Very high	67 Å²	67	52 Å²	52	41%	0.411	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.7	-179	48	0	0	0	0	111	T229	T229-T255 PolarHBondContact N-O 3.48Å; T229-T255 PolarHBondContact O-N 3.13Å; T229-T255 PolarHBondContact O-OG1 2.8Å; T229-T255 PolarHBondContact OG1-O 2.62Å; T229-T255 PolarHBondContact OG1-OG1 2.88Å
256	D	96.1	Very high	95.3	Very high	28 Å²	28	49.3 Å²	49.3	15%	0.15	29%	0.291	C	S	.	.			trans	-124	159.8	168.3	-148.1	-51.7	0	0	0	108	A227 P228 D258 I265	A227-D256 WeakPolarHBondContact CA-OD2 3.23Å; P228-D256 WeakPolarHBondContact CA-OD2 3.48Å; P228-D256 WeakPolarHBondContact CD-OD2 3.35Å; P228-D256 WeakPolarHBondContact CG-OD2 3.42Å; D256-D258 PolarHBondContact OD1-N 2.73Å; D256-I265 HydrophobicContact CB-CD1 4.05Å; D256-I265 HydrophobicContact CB-CG1 4.14Å
257	V	95.3	Very high	95.4	Very high	83 Å²	83	48 Å²	48	50%	0.503	27%	0.272	S	S	.	.			trans	-115.6	-18.1	-172.2	-66.8	0	0	0	0	113.3	R190 E191 N226	R190-V257 PolarHBondContact NH2-O 2.77Å; E191-V257 HydrophobicContact CG-CB 4.07Å; E191-V257 HydrophobicContact CG-CG2 3.76Å; N226-V257 HydrophobicContact CB-CG2 3.76Å; N226-V257 VanDerWaalsContact CG-CG2 3.42Å; N226-V257 WeakPolarHBondContact ND2-CG2 2.95Å
258	D	95.7	Very high	95.4	Very high	10 Å²	10	47.6 Å²	47.6	5%	0.053	27%	0.271	C	S	.	.	S	Bend	trans	-68.4	165.1	-178.6	-62.4	2.7	0	0	0	112	N224 D225 N226 D256 N262 G263	N224-D258 WeakPolarHBondContact CA-OD2 3.41Å; D225-D258 PolarHBondContact N-OD2 3.1Å; D225-D258 VanDerWaalsContact N-OD2 3.14Å; N226-D258 VanDerWaalsContact CB-OD1 3.3Å; N226-D258 WeakPolarHBondContact CB-OD1 3.25Å; N226-D258 PolarHBondContact N-OD2 3.33Å; N226-D258 PolarHBondContact ND2-OD1 2.57Å; D256-D258 PolarHBondContact OD1-N 2.73Å; D258-N262 HydrophobicContact CB-CB 3.52Å; D258-G263 VanDerWaalsContact O-CA 3.24Å; D258-G263 WeakPolarHBondContact O-CA 3.35Å; D258-G263 PolarHBondContact O-N 3.2Å
259	E	93.2	Very high	95.4	Very high	117 Å²	117	45.2 Å²	45.2	55%	0.547	26%	0.258	S	S	.	.	S	Bend	trans	-89.1	143.5	-172.1	-149.5	170.6	133.4	0	0	114	R190 D222 L261 N262	R190-E259 IonicContact CZ-OE2 3.53Å; R190-E259 IonicContact NH1-OE2 3.8Å; R190-E259 PolarHBondContact NH1-OE2 2.77Å; D222-E259 HydrophobicContact CB-CB 4Å; D222-E259 VanDerWaalsContact CG-N 3.31Å; D222-E259 WeakPolarHBondContact OD1-CA 3.39Å; D222-E259 WeakPolarHBondContact OD1-CB 3.24Å; D222-E259 PolarHBondContact OD1-N 3.01Å; D222-E259 PolarHBondContact OD2-N 2.87Å; E259-L261 PolarHBondContact O-N 2.84Å; E259-L261 VanDerWaalsContact O-N 3.1Å; E259-N262 PolarHBondContact O-N 3.35Å
260	G	92.9	Very high	95.2	Very high	57 Å²	57	44.7 Å²	44.7	59%	0.588	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	-114.4	169.4	0	0	0	0	0	112.9	E264	G260-E264 WeakPolarHBondContact O-CB 3.4Å; G260-E264 PolarHBondContact O-N 3.16Å
261	L	93.6	Very high	94.9	Very high	101 Å²	101	47.9 Å²	47.9	53%	0.529	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-25.8	-177.6	-68.3	175.8	0	0	0	113.3	E259 E264 L313 G314	E259-L261 PolarHBondContact O-N 2.84Å; E259-L261 VanDerWaalsContact O-N 3.1Å; L261-E264 PolarHBondContact O-N 3.31Å; L261-L313 HydrophobicContact CB-CB 4.4Å; L261-L313 HydrophobicContact CD2-CB 4.39Å; L261-L313 HydrophobicContact CD2-CD1 4.36Å; L261-L313 CarbonylContact O-C 3.36Å; L261-L313 WeakPolarHBondContact O-CA 3.44Å; L261-L313 WeakPolarHBondContact O-CB 3.35Å; L261-L313 PolarHBondContact O-N 2.93Å; L261-L313 VanDerWaalsContact O-N 3.17Å; L261-G314 PolarHBondContact O-N 3.35Å
262	N	93.6	Very high	94.6	Very high	25 Å²	25	50.3 Å²	50.3	13%	0.134	29%	0.291	C	S	.	.	S	Bend	trans	-70.5	-39.6	175.7	-63.8	-13.6	0	0	0	109.1	D222 N224 D258 E259 E264 D312 G314	D222-N262 PolarHBondContact OD2-ND2 2.87Å; N224-N262 HydrophobicContact CB-CB 4.13Å; N224-N262 PolarHBondContact N-ND2 2.93Å; N224-N262 WeakPolarHBondContact OD1-CA 3.38Å; N224-N262 WeakPolarHBondContact OD1-CB 3.5Å; D258-N262 HydrophobicContact CB-CB 3.52Å; E259-N262 PolarHBondContact O-N 3.35Å; N262-E264 PolarHBondContact O-N 2.8Å; N262-D312 WeakPolarHBondContact O-CB 3.23Å; N262-G314 WeakPolarHBondContact OD1-CA 3.42Å
263	G	92.9	Very high	94.5	Very high	25 Å²	25	50.7 Å²	50.7	26%	0.258	29%	0.293	S	S	.	.	S	Bend	trans	-77	-5.7	169.6	0	0	0	0	0	116.7	D258 I265	D258-G263 VanDerWaalsContact O-CA 3.24Å; D258-G263 WeakPolarHBondContact O-CA 3.35Å; D258-G263 PolarHBondContact O-N 3.2Å; G263-I265 PolarHBondContact O-N 3.39Å
264	E	95.2	Very high	94.4	Very high	61 Å²	61	51.1 Å²	51.1	29%	0.285	30%	0.298	S	S	.	.			trans	-89.5	101.1	-174.3	-168.3	175.5	157.2	0	0	111.7	G260 L261 N262 R286 D312 L313	G260-E264 WeakPolarHBondContact O-CB 3.4Å; G260-E264 PolarHBondContact O-N 3.16Å; L261-E264 PolarHBondContact O-N 3.31Å; N262-E264 PolarHBondContact O-N 2.8Å; E264-R286 IonicContact OE1-CZ 2.73Å; E264-R286 IonicContact OE1-NH1 2.67Å; E264-R286 PolarHBondContact OE1-NH1 2.98Å; E264-R286 IonicContact OE1-NH2 4Å; E264-R286 PolarHBondContact OE1-NH2 3.36Å; E264-D312 CarbonylContact O-C 3.55Å; E264-D312 WeakPolarHBondContact O-CA 3.46Å; E264-L313 HydrophobicContact CB-CD1 4.15Å; E264-L313 HydrophobicContact CB-CG 4.49Å; E264-L313 HydrophobicContact CG-CD1 3.86Å; E264-L313 WeakPolarHBondContact O-CG 3.45Å; E264-L313 PolarHBondContact O-N 3.17Å; E264-L313 VanDerWaalsContact O-N 3.08Å
265	I	95.8	Very high	94.3	Very high	23 Å²	23	55.6 Å²	55.6	12%	0.118	33%	0.327	C	S	.	.			trans	-82.2	137	-175.6	-57.5	167	0	0	0	112.5	P228 A254 D256 G263 Y267 A310	P228-I265 HydrophobicContact CB-CD1 4.05Å; P228-I265 HydrophobicContact CB-CG1 4.14Å; P228-I265 HydrophobicContact CG-CD1 4.49Å; P228-I265 HydrophobicContact CG-CG1 4.06Å; A254-I265 HydrophobicContact CB-CD1 4.05Å; A254-I265 WeakPolarHBondContact O-CD1 3.21Å; D256-I265 HydrophobicContact CB-CD1 4.05Å; D256-I265 HydrophobicContact CB-CG1 4.14Å; G263-I265 PolarHBondContact O-N 3.39Å; I265-Y267 HydrophobicContact CG2-CD2 4.4Å; I265-Y267 HydrophobicContact CG2-CE1 4.34Å; I265-Y267 HydrophobicContact CG2-CE2 4Å; I265-A310 HydrophobicContact CG2-CB 3.88Å
266	I	96.4	Very high	94.2	Very high	47 Å²	47	56.7 Å²	56.7	24%	0.241	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	144.5	160.5	55.7	165	0	0	0	112.1	E285 A310 R311 L313	I266-E285 CarbonylContact C-O 3.34Å; I266-E285 VanDerWaalsContact CA-O 3.29Å; I266-E285 WeakPolarHBondContact CA-O 3.41Å; I266-A310 WeakPolarHBondContact O-CA 3.31Å; I266-R311 VanDerWaalsContact CG1-O 3.26Å; I266-R311 WeakPolarHBondContact CG1-O 3.44Å; I266-R311 PolarHBondContact N-O 2.88Å; I266-R311 PolarHBondContact O-N 3.09Å; I266-L313 HydrophobicContact CD1-CD2 3.82Å; I266-L313 HydrophobicContact CG1-CD2 4Å; I266-L313 HydrophobicContact CG2-CD2 3.97Å; I266-L313 HydrophobicContact CG2-CG 4.34Å
267	Y	97.4	Very high	94.1	Very high	15 Å²	15	55.9 Å²	55.9	6%	0.059	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	143.6	179.7	-59.1	-93.6	0	0	0	111	F230 L252 A254 I265 E285 A310	F230-Y267 HydrophobicContact CE1-CD1 4.26Å; F230-Y267 HydrophobicContact CE1-CE1 4.04Å; L252-Y267 HydrophobicContact CB-CE1 4.43Å; A254-Y267 HydrophobicContact CB-CE1 3.9Å; A254-Y267 PolarHBondContact N-OH 3.02Å; I265-Y267 HydrophobicContact CG2-CD2 4.4Å; I265-Y267 HydrophobicContact CG2-CE1 4.34Å; I265-Y267 HydrophobicContact CG2-CE2 4Å; Y267-E285 PolarHBondContact N-O 3.38Å; Y267-E285 WeakPolarHBondContact O-CA 3.44Å; Y267-A310 HydrophobicContact CD1-CB 4.2Å; Y267-A310 HydrophobicContact CE1-CB 4.25Å
268	S	96.6	Very high	94	Very high	31 Å²	31	57 Å²	57	22%	0.217	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	163.4	173.3	52.8	0	0	0	0	112.7	V308 Q309	S268-V308 WeakPolarHBondContact O-CG1 3.38Å; S268-Q309 PolarHBondContact N-O 3.29Å; S268-Q309 WeakPolarHBondContact O-CG 3.44Å; S268-Q309 PolarHBondContact O-N 2.92Å; S268-Q309 WeakPolarHBondContact OG-CG 3.45Å; S268-Q309 PolarHBondContact OG-NE2 2.85Å
269	F	96.8	Very high	94	Very high	29 Å²	29	61.1 Å²	61.1	13%	0.127	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	132.5	169.7	-66.7	-44.2	0	0	0	111.3	K278 F281 N282 I283 I306	F269-K278 HydrophobicContact CD2-CG 4.15Å; F269-F281 WeakPolarHBondContact CE2-O 3.43Å; F269-F281 HydrophobicContact CZ-CB 4.06Å; F269-F281 WeakPolarHBondContact CZ-O 3.19Å; F269-N282 VanDerWaalsContact CZ-C 3.5Å; F269-I283 HydrophobicContact CD1-CB 4.37Å; F269-I283 HydrophobicContact CD1-CG2 3.9Å; F269-I283 HydrophobicContact CD2-CG2 3.94Å; F269-I283 HydrophobicContact CE1-CB 3.8Å; F269-I283 HydrophobicContact CE1-CG2 3.8Å; F269-I283 HydrophobicContact CE2-CB 4.3Å; F269-I283 HydrophobicContact CE2-CG2 3.85Å; F269-I283 HydrophobicContact CG-CG2 3.97Å; F269-I283 HydrophobicContact CZ-CB 3.78Å; F269-I283 HydrophobicContact CZ-CG2 3.79Å; F269-I306 HydrophobicContact CD1-CG2 3.69Å; F269-I306 HydrophobicContact CE1-CG2 3.53Å
270	S	94.3	Very high	94.1	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.021	31%	0.313	C	S	.	.			trans	-61.1	152	173.5	-178.8	0	0	0	0	111.6	H272 N273 N307	S270-H272 PolarHBondContact O-N 3.28Å; S270-H272 VanDerWaalsContact O-N 3.13Å; S270-H272 PolarHBondContact OG-CD2 3.42Å; S270-H272 PolarHBondContact OG-N 2.91Å; S270-N273 PolarHBondContact O-N 2.82Å; S270-N307 WeakPolarHBondContact CB-O 3.49Å; S270-N307 PolarHBondContact N-O 3.28Å
271	S	90.6	Very high	94.4	Very high	100 Å²	100	52.8 Å²	52.8	70%	0.699	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-15.8	172.8	56.2	0	0	0	0	113.7	N273	S271-N273 VanDerWaalsContact C-N 3.31Å; S271-N273 PolarHBondContact O-N 3.17Å
272	H	90.1	Very high	94.5	Very high	149 Å²	149	52.4 Å²	52.4	69%	0.69	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.5	175.9	-61.5	-53.3	0	0	0	114.8	S270	S270-H272 PolarHBondContact O-N 3.28Å; S270-H272 VanDerWaalsContact O-N 3.13Å; S270-H272 PolarHBondContact OG-CD2 3.42Å; S270-H272 PolarHBondContact OG-N 2.91Å
273	N	93.9	Very high	94.7	Very high	13 Å²	13	51.7 Å²	51.7	7%	0.07	28%	0.279	C	S	.	.	S	Bend	trans	-77.8	138.3	176.7	-67.4	-8.2	0	0	0	111.3	S270 S271 I277 N307	S270-N273 PolarHBondContact O-N 2.82Å; S271-N273 VanDerWaalsContact C-N 3.31Å; S271-N273 PolarHBondContact O-N 3.17Å; N273-I277 HydrophobicContact CB-CB 4.27Å; N273-I277 HydrophobicContact CB-CG2 4.06Å; N273-N307 PolarHBondContact ND2-O 3.12Å; N273-N307 WeakPolarHBondContact OD1-CA 3.12Å; N273-N307 VanDerWaalsContact OD1-CB 3.25Å; N273-N307 WeakPolarHBondContact OD1-CB 3.26Å; N273-N307 PolarHBondContact OD1-N 2.71Å; N273-N307 PolarHBondContact OD1-ND2 3.45Å; N273-N307 PolarHBondContact OD1-O 2.88Å
274	T	92.8	Very high	94.9	Very high	82 Å²	82	53.8 Å²	53.8	50%	0.503	28%	0.284	S	S	.	.			trans	-66	159.7	173.5	60.9	0	0	0	0	111.1	R276 I277	T274-R276 VanDerWaalsContact C-N 3.34Å; T274-R276 PolarHBondContact O-N 3.26Å; T274-I277 PolarHBondContact O-N 3.13Å; T274-I277 WeakPolarHBondContact OG1-CG1 3.28Å
275	P	92.7	Very high	95	Very high	102 Å²	102	57.1 Å²	57.1	66%	0.662	30%	0.3	S	S	*	.	H	α-helix	trans	-53.8	-47.8	174.4	-27.5	36.2	0	0	0	112.6	I277 K278 D279	P275-I277 PolarHBondContact O-N 2.75Å; P275-K278 WeakPolarHBondContact O-CA 3.12Å; P275-K278 WeakPolarHBondContact O-CB 3.41Å; P275-K278 PolarHBondContact O-N 3.31Å; P275-D279 VanDerWaalsContact C-OD2 3.28Å; P275-D279 PolarHBondContact O-N 2.79Å; P275-D279 VanDerWaalsContact O-N 3.09Å
276	R	92.8	Very high	94.9	Very high	90 Å²	90	63.5 Å²	63.5	34%	0.34	32%	0.323	S	S	.	.	H	α-helix	trans	-51.8	-35.5	179	-168.5	74.2	176.6	118.4	1.2	113.1	T274 K278 D279 L280 E300	T274-R276 VanDerWaalsContact C-N 3.34Å; T274-R276 PolarHBondContact O-N 3.26Å; R276-K278 VanDerWaalsContact C-N 3.32Å; R276-K278 PolarHBondContact O-N 3.34Å; R276-D279 WeakPolarHBondContact CA-OD2 3.25Å; R276-D279 PolarHBondContact N-OD2 2.82Å; R276-D279 PolarHBondContact O-N 3.22Å; R276-L280 HydrophobicContact CG-CD1 3.84Å; R276-L280 HydrophobicContact CG-CG 4.21Å; R276-L280 VanDerWaalsContact NH1-CD2 3.34Å; R276-L280 VanDerWaalsContact O-CB 3.3Å; R276-L280 WeakPolarHBondContact O-CB 3.18Å; R276-L280 VanDerWaalsContact O-CG 3.22Å; R276-L280 WeakPolarHBondContact O-CG 3.34Å; R276-L280 PolarHBondContact O-N 3.22Å; R276-E300 IonicContact CZ-OE2 2.69Å; R276-E300 VanDerWaalsContact CZ-OE2 3.25Å; R276-E300 IonicContact NE-OE1 2.83Å; R276-E300 PolarHBondContact NE-OE1 3.24Å; R276-E300 IonicContact NE-OE2 3.05Å; R276-E300 PolarHBondContact NE-OE2 2.87Å; R276-E300 IonicContact NH2-OE2 3.11Å; R276-E300 PolarHBondContact NH2-OE2 2.57Å
277	I	94.7	Very high	94.8	Very high	10 Å²	10	64 Å²	64	5%	0.051	33%	0.328	C	S	.	.	H	α-helix	trans	-65.9	-33.2	176	-67.4	-67.4	0	0	0	112.5	N273 T274 P275 F281 H304 I306	N273-I277 HydrophobicContact CB-CB 4.27Å; N273-I277 HydrophobicContact CB-CG2 4.06Å; T274-I277 PolarHBondContact O-N 3.13Å; T274-I277 WeakPolarHBondContact OG1-CG1 3.28Å; P275-I277 PolarHBondContact O-N 2.75Å; I277-F281 HydrophobicContact CD1-CD2 4.46Å; I277-F281 HydrophobicContact CD1-CE2 4.44Å; I277-F281 HydrophobicContact CG2-CD2 4.49Å; I277-F281 WeakPolarHBondContact O-CB 3.19Å; I277-F281 PolarHBondContact O-N 3.02Å; I277-H304 HydrophobicContact CD1-CB 3.77Å; I277-I306 HydrophobicContact CD1-CG1 4.45Å; I277-I306 HydrophobicContact CG2-CB 4.43Å; I277-I306 HydrophobicContact CG2-CG1 4.05Å; I277-I306 HydrophobicContact CG2-CG2 4.11Å
278	K	93.1	Very high	94.7	Very high	107 Å²	107	63.2 Å²	63.2	47%	0.465	33%	0.325	S	S	.	.	H	α-helix	trans	-81.5	-20.6	176.3	-55.1	-173	-179.6	-171.1	0	112.8	F269 P275 R276	F269-K278 HydrophobicContact CD2-CG 4.15Å; P275-K278 WeakPolarHBondContact O-CA 3.12Å; P275-K278 WeakPolarHBondContact O-CB 3.41Å; P275-K278 PolarHBondContact O-N 3.31Å; R276-K278 VanDerWaalsContact C-N 3.32Å; R276-K278 PolarHBondContact O-N 3.34Å
279	D	94.6	Very high	94.7	Very high	96 Å²	96	66.3 Å²	66.3	51%	0.513	33%	0.332	S	S	.	.	H	α-helix	trans	-80.7	-34.6	171.6	-50.4	-42.6	0	0	0	111	P275 R276 G294	P275-D279 VanDerWaalsContact C-OD2 3.28Å; P275-D279 PolarHBondContact O-N 2.79Å; P275-D279 VanDerWaalsContact O-N 3.09Å; R276-D279 WeakPolarHBondContact CA-OD2 3.25Å; R276-D279 PolarHBondContact N-OD2 2.82Å; R276-D279 PolarHBondContact O-N 3.22Å; D279-G294 PolarHBondContact O-N 3.02Å
280	L	96.1	Very high	94.8	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-86.1	-32	-178.5	-72.8	177.3	0	0	0	114.5	R276 A293 G294 E295 V296	R276-L280 HydrophobicContact CG-CD1 3.84Å; R276-L280 HydrophobicContact CG-CG 4.21Å; R276-L280 VanDerWaalsContact NH1-CD2 3.34Å; R276-L280 VanDerWaalsContact O-CB 3.3Å; R276-L280 WeakPolarHBondContact O-CB 3.18Å; R276-L280 VanDerWaalsContact O-CG 3.22Å; R276-L280 WeakPolarHBondContact O-CG 3.34Å; R276-L280 PolarHBondContact O-N 3.22Å; L280-A293 PolarHBondContact O-N 2.91Å; L280-G294 PolarHBondContact O-N 2.81Å; L280-E295 WeakPolarHBondContact CD2-O 3.03Å; L280-V296 HydrophobicContact CB-CG1 4.43Å; L280-V296 HydrophobicContact CD2-CG1 4.01Å
281	F	97.6	Very high	94.9	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142.8	-175	-58.2	-78.7	0	0	0	111.4	L239 V249 F269 I277 I290 E291 V292 V296 H304 I306 V326	L239-F281 HydrophobicContact CD2-CE1 3.97Å; L239-F281 HydrophobicContact CD2-CZ 4.42Å; V249-F281 HydrophobicContact CG2-CD1 3.97Å; V249-F281 HydrophobicContact CG2-CE1 3.91Å; F269-F281 WeakPolarHBondContact CE2-O 3.43Å; F269-F281 HydrophobicContact CZ-CB 4.06Å; F269-F281 WeakPolarHBondContact CZ-O 3.19Å; I277-F281 HydrophobicContact CD1-CD2 4.46Å; I277-F281 HydrophobicContact CD1-CE2 4.44Å; I277-F281 HydrophobicContact CG2-CD2 4.49Å; I277-F281 WeakPolarHBondContact O-CB 3.19Å; I277-F281 PolarHBondContact O-N 3.02Å; F281-I290 HydrophobicContact CB-CG2 4.24Å; F281-I290 HydrophobicContact CD1-CG2 4.36Å; F281-E291 WeakPolarHBondContact CA-O 3.5Å; F281-V292 HydrophobicContact CE1-CG2 4.33Å; F281-V296 HydrophobicContact CE1-CG1 4.19Å; F281-V296 HydrophobicContact CE2-CG1 4.43Å; F281-V296 HydrophobicContact CZ-CG1 3.77Å; F281-H304 HydrophobicContact CE2-CB 4.14Å; F281-H304 AromaticContact CE2-CD2 3.58Å; F281-H304 AromaticContact CE2-CG 4Å; F281-H304 AromaticContact CZ-CD2 3.65Å; F281-I306 HydrophobicContact CB-CD1 4.13Å; F281-I306 HydrophobicContact CD1-CD1 4.11Å; F281-I306 HydrophobicContact CD2-CD1 3.67Å; F281-I306 HydrophobicContact CD2-CG1 4.27Å; F281-I306 HydrophobicContact CE1-CD1 4.49Å; F281-I306 HydrophobicContact CE2-CD1 4.1Å; F281-I306 HydrophobicContact CG-CD1 3.68Å; F281-I306 HydrophobicContact CZ-CD1 4.5Å; F281-V326 HydrophobicContact CZ-CG1 4.3Å; F281-V326 HydrophobicContact CZ-CG2 4.47Å
282	N	97	Very high	95.3	Very high	92 Å²	92	63 Å²	63	49%	0.492	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	157.5	168.1	-174.2	37.9	0	0	0	110.1	F269 I290 E291 A293	F269-N282 VanDerWaalsContact CZ-C 3.5Å; N282-I290 VanDerWaalsContact O-CA 3.32Å; N282-I290 WeakPolarHBondContact O-CA 3.26Å; N282-E291 PolarHBondContact N-O 3.09Å; N282-E291 PolarHBondContact O-N 3.47Å; N282-A293 HydrophobicContact CB-CB 4.05Å
283	I	97.6	Very high	95.6	Very high	11 Å²	11	57.8 Å²	57.8	6%	0.056	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.1	168.7	-171.3	170.1	0	0	0	110.1	F269 E285 R289 I290 V308	F269-I283 HydrophobicContact CD1-CB 4.37Å; F269-I283 HydrophobicContact CD1-CG2 3.9Å; F269-I283 HydrophobicContact CD2-CG2 3.94Å; F269-I283 HydrophobicContact CE1-CB 3.8Å; F269-I283 HydrophobicContact CE1-CG2 3.8Å; F269-I283 HydrophobicContact CE2-CB 4.3Å; F269-I283 HydrophobicContact CE2-CG2 3.85Å; F269-I283 HydrophobicContact CG-CG2 3.97Å; F269-I283 HydrophobicContact CZ-CB 3.78Å; F269-I283 HydrophobicContact CZ-CG2 3.79Å; I283-E285 PolarHBondContact O-N 3.31Å; I283-R289 CarbonylContact C-O 3.52Å; I283-R289 VanDerWaalsContact CA-O 3.28Å; I283-R289 WeakPolarHBondContact CA-O 3.23Å; I283-I290 HydrophobicContact CB-CG1 4.26Å; I283-I290 HydrophobicContact CD1-CD1 4.36Å; I283-I290 HydrophobicContact CD1-CG1 3.92Å; I283-I290 HydrophobicContact CG1-CG1 3.95Å; I283-V308 HydrophobicContact CD1-CG1 3.62Å
284	D	97.1	Very high	95.6	Very high	68 Å²	68	57.9 Å²	57.9	36%	0.364	29%	0.292	S	S	.	.			trans	-76.1	119.8	173.3	178	-88.5	0	0	0	110.2	R286 T287 G288 R289	D284-R286 PolarHBondContact O-N 2.73Å; D284-R286 VanDerWaalsContact O-N 3.1Å; D284-R286 PolarHBondContact OD1-N 3.45Å; D284-R286 VanDerWaalsContact OD1-N 3.11Å; D284-T287 WeakPolarHBondContact CB-OG1 3.19Å; D284-T287 WeakPolarHBondContact OD1-CB 3.5Å; D284-T287 WeakPolarHBondContact OD1-CG2 3.48Å; D284-T287 PolarHBondContact OD1-N 2.84Å; D284-T287 PolarHBondContact OD1-OG1 2.93Å; D284-G288 PolarHBondContact O-N 2.86Å; D284-R289 HydrophobicContact CB-CB 4.27Å; D284-R289 PolarHBondContact N-O 3.22Å
285	E	96.1	Very high	95.6	Very high	131 Å²	131	61.7 Å²	61.7	61%	0.612	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.7	-171.1	-59.8	-174.5	154.8	0	0	113.7	I266 Y267 I283	I266-E285 CarbonylContact C-O 3.34Å; I266-E285 VanDerWaalsContact CA-O 3.29Å; I266-E285 WeakPolarHBondContact CA-O 3.41Å; Y267-E285 PolarHBondContact N-O 3.38Å; Y267-E285 WeakPolarHBondContact O-CA 3.44Å; I283-E285 PolarHBondContact O-N 3.31Å
286	R	93.8	Very high	95.7	Very high	158 Å²	158	57 Å²	57	60%	0.596	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-30.4	-174	-73.7	-62.3	-168.6	139.1	-24.5	114.3	E264 D284	E264-R286 IonicContact OE1-CZ 2.73Å; E264-R286 IonicContact OE1-NH1 2.67Å; E264-R286 PolarHBondContact OE1-NH1 2.98Å; E264-R286 IonicContact OE1-NH2 4Å; E264-R286 PolarHBondContact OE1-NH2 3.36Å; D284-R286 PolarHBondContact O-N 2.73Å; D284-R286 VanDerWaalsContact O-N 3.1Å; D284-R286 PolarHBondContact OD1-N 3.45Å; D284-R286 VanDerWaalsContact OD1-N 3.11Å
287	T	95.2	Very high	95.8	Very high	56 Å²	56	55.8 Å²	55.8	34%	0.344	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-6.7	-172.5	62.6	0	0	0	0	113.8	Q251 D284 R289	Q251-T287 WeakPolarHBondContact CG-O 3.4Å; Q251-T287 PolarHBondContact NE2-O 3.19Å; D284-T287 WeakPolarHBondContact CB-OG1 3.19Å; D284-T287 WeakPolarHBondContact OD1-CB 3.5Å; D284-T287 WeakPolarHBondContact OD1-CG2 3.48Å; D284-T287 PolarHBondContact OD1-N 2.84Å; D284-T287 PolarHBondContact OD1-OG1 2.93Å; T287-R289 PolarHBondContact O-N 2.99Å; T287-R289 WeakPolarHBondContact OG1-CG 3.14Å
288	G	94.9	Very high	95.9	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.281	C	S	.	.			trans	69.2	11.9	-178.7	0	0	0	0	0	113.8	L252 D284 I290	L252-G288 WeakPolarHBondContact CB-O 3.38Å; L252-G288 PolarHBondContact N-O 2.9Å; D284-G288 PolarHBondContact O-N 2.86Å; G288-I290 PolarHBondContact O-N 3.5Å
289	R	97.6	Very high	96	Very high	96 Å²	96	55.5 Å²	55.5	36%	0.362	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	123.4	-179.9	-72.9	-178.7	166.2	-148.5	-6.1	111.2	L248 Q251 I283 D284 T287 E291	L248-R289 HydrophobicContact CD1-CB 3.99Å; L248-R289 HydrophobicContact CD1-CG 3.98Å; Q251-R289 HydrophobicContact CB-CG 3.99Å; Q251-R289 HydrophobicContact CG-CG 3.7Å; Q251-R289 VanDerWaalsContact OE1-NH2 3.16Å; I283-R289 CarbonylContact C-O 3.52Å; I283-R289 VanDerWaalsContact CA-O 3.28Å; I283-R289 WeakPolarHBondContact CA-O 3.23Å; D284-R289 HydrophobicContact CB-CB 4.27Å; D284-R289 PolarHBondContact N-O 3.22Å; T287-R289 PolarHBondContact O-N 2.99Å; T287-R289 WeakPolarHBondContact OG1-CG 3.14Å; R289-E291 HydrophobicContact CB-CG 4.41Å
290	I	98	Very high	95.9	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.4	168.9	-58.6	178.3	0	0	0	107.9	V249 I250 L252 F281 N282 I283 G288 I306 V308 V324	V249-I290 HydrophobicContact CB-CB 4.47Å; V249-I290 HydrophobicContact CB-CG2 4.22Å; V249-I290 WeakPolarHBondContact CB-O 3.36Å; V249-I290 HydrophobicContact CG2-CG2 4.39Å; V249-I290 PolarHBondContact N-O 3.08Å; I250-I290 HydrophobicContact CG2-CB 4.14Å; I250-I290 HydrophobicContact CG2-CD1 4.01Å; I250-I290 HydrophobicContact CG2-CG1 4.32Å; I250-I290 PolarHBondContact N-O 3.36Å; I250-I290 PolarHBondContact O-N 3.44Å; L252-I290 HydrophobicContact CD1-CD1 3.88Å; L252-I290 HydrophobicContact CD1-CG1 4.47Å; L252-I290 HydrophobicContact CG-CD1 4.37Å; F281-I290 HydrophobicContact CB-CG2 4.24Å; F281-I290 HydrophobicContact CD1-CG2 4.36Å; N282-I290 VanDerWaalsContact O-CA 3.32Å; N282-I290 WeakPolarHBondContact O-CA 3.26Å; I283-I290 HydrophobicContact CB-CG1 4.26Å; I283-I290 HydrophobicContact CD1-CD1 4.36Å; I283-I290 HydrophobicContact CD1-CG1 3.92Å; I283-I290 HydrophobicContact CG1-CG1 3.95Å; G288-I290 PolarHBondContact O-N 3.5Å; I290-I306 HydrophobicContact CG2-CD1 4.08Å; I290-V308 HydrophobicContact CD1-CG2 3.89Å; I290-V324 HydrophobicContact CD1-CB 4.47Å; I290-V324 HydrophobicContact CD1-CG2 3.88Å
291	E	97.6	Very high	95.8	Very high	58 Å²	58	58 Å²	58	27%	0.271	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149.6	-176.9	-57.2	-172.4	166.8	0	0	110	T247 L248 F281 N282 R289 A293	T247-E291 CarbonylContact O-C 3.56Å; T247-E291 VanDerWaalsContact O-CA 3.3Å; T247-E291 WeakPolarHBondContact O-CA 3.29Å; L248-E291 HydrophobicContact CD1-CG 4.05Å; F281-E291 WeakPolarHBondContact CA-O 3.5Å; N282-E291 PolarHBondContact N-O 3.09Å; N282-E291 PolarHBondContact O-N 3.47Å; R289-E291 HydrophobicContact CB-CG 4.41Å; E291-A293 PolarHBondContact O-N 3.16Å
292	V	97.6	Very high	95.6	Very high	3 Å²	3	61.7 Å²	61.7	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	127.1	176.2	178.8	0	0	0	0	109.5	L239 V245 G246 T247 V249 F281 G294 V296	L239-V292 HydrophobicContact CD1-CG2 4.31Å; L239-V292 HydrophobicContact CD2-CG2 3.81Å; V245-V292 CarbonylContact C-O 3.55Å; V245-V292 WeakPolarHBondContact CA-O 3.47Å; G246-V292 PolarHBondContact N-O 2.93Å; T247-V292 PolarHBondContact O-N 2.95Å; V249-V292 HydrophobicContact CG2-CG2 3.85Å; F281-V292 HydrophobicContact CE1-CG2 4.33Å; V292-G294 WeakPolarHBondContact CG1-O 3.47Å; V292-V296 HydrophobicContact CG1-CG2 4.37Å
293	A	96.1	Very high	95.5	Very high	40 Å²	40	60 Å²	60	33%	0.331	30%	0.299	S	S	.	.			trans	-110.6	-23.5	-178.4	0	0	0	0	0	113.6	L280 N282 E291	L280-A293 PolarHBondContact O-N 2.91Å; N282-A293 HydrophobicContact CB-CB 4.05Å; E291-A293 PolarHBondContact O-N 3.16Å
294	G	94.1	Very high	95.4	Very high	15 Å²	15	60.1 Å²	60.1	16%	0.155	30%	0.299	C	S	.	.	S	Bend	trans	-143.4	177.8	178.7	0	0	0	0	0	112.2	D279 L280 V292 V296	D279-G294 PolarHBondContact O-N 3.02Å; L280-G294 PolarHBondContact O-N 2.81Å; V292-G294 WeakPolarHBondContact CG1-O 3.47Å; G294-V296 PolarHBondContact O-N 3.06Å
295	E	93.8	Very high	95.3	Very high	163 Å²	163	61.3 Å²	61.3	76%	0.762	30%	0.303	S	S	*	.			trans	-69.6	112.8	-176.9	-68.8	165.7	167.6	0	0	110.9	L280	L280-E295 WeakPolarHBondContact CD2-O 3.03Å
296	V	95.1	Very high	95.4	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.012	27%	0.274	C	S	.	.			trans	-91.3	128.9	175.3	-76.2	0	0	0	0	110.2	L239 E241 N242 L280 F281 V292 G294 L328	L239-V296 HydrophobicContact CD2-CG2 4.29Å; E241-V296 WeakPolarHBondContact CB-O 3.32Å; N242-V296 PolarHBondContact N-O 3.4Å; L280-V296 HydrophobicContact CB-CG1 4.43Å; L280-V296 HydrophobicContact CD2-CG1 4.01Å; F281-V296 HydrophobicContact CE1-CG1 4.19Å; F281-V296 HydrophobicContact CE2-CG1 4.43Å; F281-V296 HydrophobicContact CZ-CG1 3.77Å; V292-V296 HydrophobicContact CG1-CG2 4.37Å; G294-V296 PolarHBondContact O-N 3.06Å; V296-L328 HydrophobicContact CB-CD1 4.23Å; V296-L328 HydrophobicContact CB-CD2 4.18Å
297	D	95.3	Very high	95.5	Very high	66 Å²	66	48.8 Å²	48.8	35%	0.353	25%	0.252	S	S	.	.			trans	-135.6	121.4	-161.7	169.9	-25.2	0	0	0	108.3	E299 E300 S301 L328	D297-E299 WeakPolarHBondContact OD1-CA 3.24Å; D297-E299 WeakPolarHBondContact OD1-CB 2.99Å; D297-E299 PolarHBondContact OD1-N 3.02Å; D297-E300 HydrophobicContact CB-CB 4.2Å; D297-E300 PolarHBondContact OD1-N 3.48Å; D297-S301 PolarHBondContact O-N 2.86Å; D297-S301 VanDerWaalsContact O-N 3.1Å; D297-L328 WeakPolarHBondContact O-CD1 3.49Å
298	Y	95.9	Very high	95.6	Very high	48 Å²	48	46.1 Å²	46.1	19%	0.188	24%	0.236	C	C	.	.	H	α-helix	trans	-74.3	-37.5	-175.7	-179	-82.9	0	0	0	112.1	E241 S301 N302 L328 D330	E241-Y298 VanDerWaalsContact OE1-CB 3.29Å; E241-Y298 WeakPolarHBondContact OE1-CB 3.32Å; E241-Y298 WeakPolarHBondContact OE2-CB 3.38Å; E241-Y298 PolarHBondContact OE2-N 2.86Å; Y298-S301 CarbonylContact O-C 3.59Å; Y298-S301 PolarHBondContact O-N 3.26Å; Y298-N302 HydrophobicContact CD1-CB 4.23Å; Y298-N302 HydrophobicContact CD2-CB 3.53Å; Y298-N302 HydrophobicContact CE1-CB 4.09Å; Y298-N302 HydrophobicContact CE2-CB 3.38Å; Y298-N302 HydrophobicContact CG-CB 3.95Å; Y298-N302 PolarHBondContact O-N 3.32Å; Y298-L328 HydrophobicContact CD2-CB 3.87Å; Y298-L328 WeakPolarHBondContact CE2-O 3.25Å; Y298-D330 HydrophobicContact CD2-CB 4.19Å; Y298-D330 HydrophobicContact CE1-CB 4.48Å; Y298-D330 HydrophobicContact CE2-CB 4.02Å; Y298-D330 HydrophobicContact CG-CB 4.49Å
299	E	95.2	Very high	95.7	Very high	63 Å²	63	48.3 Å²	48.3	29%	0.294	25%	0.246	S	C	.	.	H	α-helix	trans	-65.4	-34.6	177	-82	49.3	-120.8	0	0	112.5	D297 R365	D297-E299 WeakPolarHBondContact OD1-CA 3.24Å; D297-E299 WeakPolarHBondContact OD1-CB 2.99Å; D297-E299 PolarHBondContact OD1-N 3.02Å; E299-R365 HydrophobicContact CG-CB 3.85Å
300	E	93.2	Very high	95.6	Very high	101 Å²	101	43.7 Å²	43.7	47%	0.472	23%	0.228	S	C	.	.	H	α-helix	trans	-70.4	-53.1	166.4	-171.5	-167.7	170.6	0	0	110.2	R276 D297	R276-E300 IonicContact CZ-OE2 2.69Å; R276-E300 VanDerWaalsContact CZ-OE2 3.25Å; R276-E300 IonicContact NE-OE1 2.83Å; R276-E300 PolarHBondContact NE-OE1 3.24Å; R276-E300 IonicContact NE-OE2 3.05Å; R276-E300 PolarHBondContact NE-OE2 2.87Å; R276-E300 IonicContact NH2-OE2 3.11Å; R276-E300 PolarHBondContact NH2-OE2 2.57Å; D297-E300 HydrophobicContact CB-CB 4.2Å; D297-E300 PolarHBondContact OD1-N 3.48Å
301	S	93.2	Very high	95.5	Very high	48 Å²	48	48.9 Å²	48.9	34%	0.336	25%	0.248	S	C	.	.	H	α-helix	trans	-162.7	95.8	-177.6	-145.8	0	0	0	0	115.8	D297 Y298 T303 L328	D297-S301 PolarHBondContact O-N 2.86Å; D297-S301 VanDerWaalsContact O-N 3.1Å; Y298-S301 CarbonylContact O-C 3.59Å; Y298-S301 PolarHBondContact O-N 3.26Å; S301-T303 PolarHBondContact O-N 2.83Å; S301-L328 WeakPolarHBondContact O-CD1 3.35Å
302	N	93.4	Very high	95.4	Very high	77 Å²	77	46.2 Å²	46.2	41%	0.412	24%	0.235	S	C	.	.	S	Bend	trans	-55.6	-9.5	175.4	70.7	34.3	0	0	0	117.4	Y298 L328	Y298-N302 HydrophobicContact CD1-CB 4.23Å; Y298-N302 HydrophobicContact CD2-CB 3.53Å; Y298-N302 HydrophobicContact CE1-CB 4.09Å; Y298-N302 HydrophobicContact CE2-CB 3.38Å; Y298-N302 HydrophobicContact CG-CB 3.95Å; Y298-N302 PolarHBondContact O-N 3.32Å; N302-L328 PolarHBondContact O-N 2.89Å
303	T	94.8	Very high	95.3	Very high	56 Å²	56	49.3 Å²	49.3	34%	0.344	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	120.8	-179.3	-54.8	0	0	0	0	112.3	S301 L325 V326 K327	S301-T303 PolarHBondContact O-N 2.83Å; T303-L325 HydrophobicContact CG2-CD1 3.49Å; T303-L325 VanDerWaalsContact CG2-CD1 3.49Å; T303-L325 HydrophobicContact CG2-CG 4.13Å; T303-V326 CarbonylContact C-O 3.52Å; T303-V326 WeakPolarHBondContact CA-O 3.37Å; T303-K327 HydrophobicContact CG2-CG 4.4Å
304	H	95.4	Very high	95	Very high	14 Å²	14	48.1 Å²	48.1	7%	0.065	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.3	173.7	-55.9	-54.6	0	0	0	111.8	I277 F281 V326	I277-H304 HydrophobicContact CD1-CB 3.77Å; F281-H304 HydrophobicContact CE2-CB 4.14Å; F281-H304 AromaticContact CE2-CD2 3.58Å; F281-H304 AromaticContact CE2-CG 4Å; F281-H304 AromaticContact CZ-CD2 3.65Å; H304-V326 HydrophobicContact CB-CB 4.37Å; H304-V326 PolarHBondContact N-O 2.9Å; H304-V326 PolarHBondContact O-N 2.77Å
305	Q	95.9	Very high	94.7	Very high	93 Å²	93	50.6 Å²	50.6	44%	0.435	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	106.8	170.9	-174.7	-168.6	-57.3	0	0	109.9	N307 K323 L325	Q305-N307 PolarHBondContact NE2-OD1 3.2Å; Q305-K323 HydrophobicContact CG-CD 4.43Å; Q305-L325 HydrophobicContact CB-CD1 4.43Å
306	I	97	Very high	94.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	117.2	175.1	-48.6	177.5	0	0	0	108	F269 I277 F281 I290 V308 K323 V324 V326	F269-I306 HydrophobicContact CD1-CG2 3.69Å; F269-I306 HydrophobicContact CE1-CG2 3.53Å; I277-I306 HydrophobicContact CD1-CG1 4.45Å; I277-I306 HydrophobicContact CG2-CB 4.43Å; I277-I306 HydrophobicContact CG2-CG1 4.05Å; I277-I306 HydrophobicContact CG2-CG2 4.11Å; F281-I306 HydrophobicContact CB-CD1 4.13Å; F281-I306 HydrophobicContact CD1-CD1 4.11Å; F281-I306 HydrophobicContact CD2-CD1 3.67Å; F281-I306 HydrophobicContact CD2-CG1 4.27Å; F281-I306 HydrophobicContact CE1-CD1 4.49Å; F281-I306 HydrophobicContact CE2-CD1 4.1Å; F281-I306 HydrophobicContact CG-CD1 3.68Å; F281-I306 HydrophobicContact CZ-CD1 4.5Å; I290-I306 HydrophobicContact CG2-CD1 4.08Å; I306-V308 HydrophobicContact CG2-CG2 3.88Å; I306-K323 CarbonylContact O-C 3.55Å; I306-K323 WeakPolarHBondContact O-CA 3.14Å; I306-V324 HydrophobicContact CB-CB 4.32Å; I306-V324 PolarHBondContact N-O 3.04Å; I306-V324 PolarHBondContact O-N 3.09Å; I306-V326 HydrophobicContact CD1-CG2 3.84Å; I306-V326 HydrophobicContact CG1-CG2 4.39Å
307	N	97.1	Very high	94.4	Very high	26 Å²	26	50.4 Å²	50.4	14%	0.139	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.9	172.1	-45.4	-88	0	0	0	108.1	S270 N273 Q305 K323	S270-N307 WeakPolarHBondContact CB-O 3.49Å; S270-N307 PolarHBondContact N-O 3.28Å; N273-N307 PolarHBondContact ND2-O 3.12Å; N273-N307 WeakPolarHBondContact OD1-CA 3.12Å; N273-N307 VanDerWaalsContact OD1-CB 3.25Å; N273-N307 WeakPolarHBondContact OD1-CB 3.26Å; N273-N307 PolarHBondContact OD1-N 2.71Å; N273-N307 PolarHBondContact OD1-ND2 3.45Å; N273-N307 PolarHBondContact OD1-O 2.88Å; Q305-N307 PolarHBondContact NE2-OD1 3.2Å; N307-K323 WeakPolarHBondContact OD1-CE 3.43Å
308	V	97.3	Very high	94.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	149.6	-174.8	-176.6	0	0	0	0	109	F230 L252 S268 I283 I290 I306 H321 C322 V324	F230-V308 HydrophobicContact CZ-CG1 4.39Å; L252-V308 HydrophobicContact CD1-CB 4.07Å; L252-V308 HydrophobicContact CD1-CG1 3.7Å; L252-V308 HydrophobicContact CD1-CG2 3.99Å; S268-V308 WeakPolarHBondContact O-CG1 3.38Å; I283-V308 HydrophobicContact CD1-CG1 3.62Å; I290-V308 HydrophobicContact CD1-CG2 3.89Å; I306-V308 HydrophobicContact CG2-CG2 3.88Å; V308-H321 WeakPolarHBondContact O-CA 3.46Å; V308-C322 PolarHBondContact N-O 3.17Å; V308-C322 PolarHBondContact O-N 2.85Å; V308-C322 VanDerWaalsContact O-N 3.13Å; V308-V324 HydrophobicContact CG2-CG2 4.39Å
309	Q	95.8	Very high	94.1	Very high	45 Å²	45	51.7 Å²	51.7	21%	0.21	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.1	171	70.4	-168.6	20.2	0	0	110.7	S268 A320 H321	S268-Q309 PolarHBondContact N-O 3.29Å; S268-Q309 WeakPolarHBondContact O-CG 3.44Å; S268-Q309 PolarHBondContact O-N 2.92Å; S268-Q309 WeakPolarHBondContact OG-CG 3.45Å; S268-Q309 PolarHBondContact OG-NE2 2.85Å; Q309-A320 CarbonylContact C-O 3.36Å; Q309-A320 WeakPolarHBondContact CA-O 3.12Å; Q309-A320 WeakPolarHBondContact CB-O 3.3Å; Q309-H321 VanDerWaalsContact CB-ND1 3.3Å; Q309-H321 WeakPolarHBondContact CB-ND1 3.03Å
310	A	96.7	Very high	94.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	142.8	165.1	0	0	0	0	0	107.6	P228 F230 A254 I265 I266 Y267 P319 A320	P228-A310 HydrophobicContact CB-CB 4Å; F230-A310 HydrophobicContact CE1-CB 4.09Å; F230-A310 HydrophobicContact CE2-CB 3.68Å; F230-A310 HydrophobicContact CZ-CB 3.37Å; A254-A310 HydrophobicContact CB-CB 3.9Å; I265-A310 HydrophobicContact CG2-CB 3.88Å; I266-A310 WeakPolarHBondContact O-CA 3.31Å; Y267-A310 HydrophobicContact CD1-CB 4.2Å; Y267-A310 HydrophobicContact CE1-CB 4.25Å; A310-P319 CarbonylContact O-C 3.53Å; A310-P319 WeakPolarHBondContact O-CA 3.23Å; A310-A320 PolarHBondContact N-O 2.92Å; A310-A320 PolarHBondContact O-N 2.92Å
311	R	95.4	Very high	94.2	Very high	108 Å²	108	50.1 Å²	50.1	41%	0.408	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	138.6	178.3	-163.6	-172.2	-168.9	-145.9	-0.2	109.1	I266 A317 P319	I266-R311 VanDerWaalsContact CG1-O 3.26Å; I266-R311 WeakPolarHBondContact CG1-O 3.44Å; I266-R311 PolarHBondContact N-O 2.88Å; I266-R311 PolarHBondContact O-N 3.09Å; R311-A317 HydrophobicContact CG-CB 4.01Å; R311-A317 VanDerWaalsContact CZ-CB 3.47Å; R311-A317 VanDerWaalsContact CZ-O 3.26Å; R311-A317 PolarHBondContact NE-O 2.86Å; R311-A317 PolarHBondContact NH2-O 3.19Å; R311-P319 HydrophobicContact CB-CB 4.34Å; R311-P319 HydrophobicContact CG-CB 4.24Å
312	D	96.1	Very high	94.4	Very high	2 Å²	2	48 Å²	48	1%	0.011	26%	0.264	C	S	.	.			trans	-63.9	169.5	167.7	60.9	101.8	0	0	0	112.7	N224 P228 N262 E264 G314 A317 V318	N224-D312 PolarHBondContact ND2-OD1 2.84Å; N224-D312 PolarHBondContact OD1-OD1 2.9Å; P228-D312 HydrophobicContact CG-CB 4.36Å; N262-D312 WeakPolarHBondContact O-CB 3.23Å; E264-D312 CarbonylContact O-C 3.55Å; E264-D312 WeakPolarHBondContact O-CA 3.46Å; D312-G314 VanDerWaalsContact OD1-CA 3.29Å; D312-G314 WeakPolarHBondContact OD1-CA 3.47Å; D312-G314 PolarHBondContact OD1-N 2.9Å; D312-A317 VanDerWaalsContact CG-CB 3.42Å; D312-A317 WeakPolarHBondContact OD1-CA 3.35Å; D312-A317 WeakPolarHBondContact OD1-CB 3.43Å; D312-A317 WeakPolarHBondContact OD2-CA 3.42Å; D312-A317 VanDerWaalsContact OD2-CB 3.26Å; D312-A317 WeakPolarHBondContact OD2-CB 3.24Å; D312-V318 PolarHBondContact OD2-N 2.96Å
313	L	94.3	Very high	94.5	Very high	68 Å²	68	48.4 Å²	48.4	36%	0.356	26%	0.263	S	S	.	.	S	Bend	trans	-98.2	11	171.1	-65.7	179.5	0	0	0	112.7	L261 E264 I266	L261-L313 HydrophobicContact CB-CB 4.4Å; L261-L313 HydrophobicContact CD2-CB 4.39Å; L261-L313 HydrophobicContact CD2-CD1 4.36Å; L261-L313 CarbonylContact O-C 3.36Å; L261-L313 WeakPolarHBondContact O-CA 3.44Å; L261-L313 WeakPolarHBondContact O-CB 3.35Å; L261-L313 PolarHBondContact O-N 2.93Å; L261-L313 VanDerWaalsContact O-N 3.17Å; E264-L313 HydrophobicContact CB-CD1 4.15Å; E264-L313 HydrophobicContact CB-CG 4.49Å; E264-L313 HydrophobicContact CG-CD1 3.86Å; E264-L313 WeakPolarHBondContact O-CG 3.45Å; E264-L313 PolarHBondContact O-N 3.17Å; E264-L313 VanDerWaalsContact O-N 3.08Å; I266-L313 HydrophobicContact CD1-CD2 3.82Å; I266-L313 HydrophobicContact CG1-CD2 4Å; I266-L313 HydrophobicContact CG2-CD2 3.97Å; I266-L313 HydrophobicContact CG2-CG 4.34Å
314	G	91.1	Very high	94.7	Very high	15 Å²	15	45.8 Å²	45.8	16%	0.155	25%	0.246	C	C	.	.	S	Bend	trans	-76.1	176.4	-175.3	0	0	0	0	0	115.1	L261 N262 D312 A317	L261-G314 PolarHBondContact O-N 3.35Å; N262-G314 WeakPolarHBondContact OD1-CA 3.42Å; D312-G314 VanDerWaalsContact OD1-CA 3.29Å; D312-G314 WeakPolarHBondContact OD1-CA 3.47Å; D312-G314 PolarHBondContact OD1-N 2.9Å; G314-A317 WeakPolarHBondContact O-CB 3.09Å
315	A	86.9	Confident	94.7	Very high	68 Å²	68	47.1 Å²	47.1	56%	0.562	25%	0.254	S	S	*	.	S	Bend	trans	-75.2	135.5	171.7	0	0	0	0	0	110.1	N224 A317	N224-A315 WeakPolarHBondContact CB-O 3.12Å; N224-A315 PolarHBondContact ND2-O 3.09Å; A315-A317 PolarHBondContact O-N 3.01Å; A315-A317 VanDerWaalsContact O-N 3.09Å
316	N	89.4	Confident	94.8	Very high	156 Å²	156	42.7 Å²	42.7	83%	0.834	23%	0.233	S	C	*	.	S	Bend	trans	65.3	-2	-176.7	-48.1	-56.3	0	0	0	116.7	V318	N316-V318 PolarHBondContact O-N 3.06Å
317	A	92.2	Very high	94.8	Very high	5 Å²	5	46.9 Å²	46.9	4%	0.041	25%	0.251	C	S	.	.			trans	-3.3	108.7	167.3	0	0	0	0	0	117.7	N224 R311 D312 G314 A315	N224-A317 WeakPolarHBondContact ND2-CA 3.47Å; N224-A317 PolarHBondContact ND2-N 2.87Å; R311-A317 HydrophobicContact CG-CB 4.01Å; R311-A317 VanDerWaalsContact CZ-CB 3.47Å; R311-A317 VanDerWaalsContact CZ-O 3.26Å; R311-A317 PolarHBondContact NE-O 2.86Å; R311-A317 PolarHBondContact NH2-O 3.19Å; D312-A317 VanDerWaalsContact CG-CB 3.42Å; D312-A317 WeakPolarHBondContact OD1-CA 3.35Å; D312-A317 WeakPolarHBondContact OD1-CB 3.43Å; D312-A317 WeakPolarHBondContact OD2-CA 3.42Å; D312-A317 VanDerWaalsContact OD2-CB 3.26Å; D312-A317 WeakPolarHBondContact OD2-CB 3.24Å; G314-A317 WeakPolarHBondContact O-CB 3.09Å; A315-A317 PolarHBondContact O-N 3.01Å; A315-A317 VanDerWaalsContact O-N 3.09Å
318	V	92.6	Very high	94.8	Very high	89 Å²	89	46.1 Å²	46.1	54%	0.539	25%	0.247	S	C	.	.			trans	-99.3	113.6	-174.6	-180	0	0	0	0	110.1	A227 D312 N316 A320	A227-V318 HydrophobicContact CB-CB 4.14Å; A227-V318 HydrophobicContact CB-CG1 4.5Å; D312-V318 PolarHBondContact OD2-N 2.96Å; N316-V318 PolarHBondContact O-N 3.06Å; V318-A320 PolarHBondContact O-N 2.91Å
319	P	93.6	Very high	94.7	Very high	52 Å²	52	49 Å²	49	34%	0.338	27%	0.265	S	S	.	.			trans	-73.5	130.8	-177.3	30.2	-34.3	0	0	0	111.7	A310 R311	A310-P319 CarbonylContact O-C 3.53Å; A310-P319 WeakPolarHBondContact O-CA 3.23Å; R311-P319 HydrophobicContact CB-CB 4.34Å; R311-P319 HydrophobicContact CG-CB 4.24Å
320	A	95.1	Very high	94.7	Very high	22 Å²	22	48.5 Å²	48.5	18%	0.182	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	160.8	168.1	0	0	0	0	0	111.5	P228 F230 Q309 A310 V318	P228-A320 WeakPolarHBondContact O-CB 3.32Å; F230-A320 HydrophobicContact CD2-CB 4.48Å; F230-A320 HydrophobicContact CE2-CB 4.44Å; Q309-A320 CarbonylContact C-O 3.36Å; Q309-A320 WeakPolarHBondContact CA-O 3.12Å; Q309-A320 WeakPolarHBondContact CB-O 3.3Å; A310-A320 PolarHBondContact N-O 2.92Å; A310-A320 PolarHBondContact O-N 2.92Å; V318-A320 PolarHBondContact O-N 2.91Å
321	H	95.3	Very high	94.6	Very high	108 Å²	108	50.8 Å²	50.8	50%	0.5	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.4	-171.2	-63.7	-51.1	0	0	0	113.1	V308 Q309	V308-H321 WeakPolarHBondContact O-CA 3.46Å; Q309-H321 VanDerWaalsContact CB-ND1 3.3Å; Q309-H321 WeakPolarHBondContact CB-ND1 3.03Å
322	C	96.3	Very high	94.6	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.02	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	173	166.5	69.6	0	0	0	0	110.7	F230 S233 Y235 V308	F230-C322 HydrophobicContact CB-CB 4.17Å; F230-C322 HydrophobicContact CD1-CB 4.15Å; F230-C322 VanDerWaalsContact CD1-SG 3.59Å; F230-C322 HydrophobicContact CD2-CB 3.67Å; F230-C322 HydrophobicContact CE1-CB 4.44Å; F230-C322 WeakPolarHBondContact CE1-SG 3.47Å; F230-C322 HydrophobicContact CE2-CB 3.99Å; F230-C322 HydrophobicContact CG-CB 3.75Å; F230-C322 HydrophobicContact CZ-CB 4.36Å; F230-C322 WeakPolarHBondContact CZ-SG 3.22Å; S233-C322 WeakPolarHBondContact O-CA 3.46Å; Y235-C322 HydrophobicContact CD2-CB 4.5Å; Y235-C322 HydrophobicContact CE2-CB 4.02Å; V308-C322 PolarHBondContact N-O 3.17Å; V308-C322 PolarHBondContact O-N 2.85Å; V308-C322 VanDerWaalsContact O-N 3.13Å
323	K	96.9	Very high	94.5	Very high	87 Å²	87	49.9 Å²	49.9	38%	0.378	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.4	175.3	-62.5	-179.3	176.8	-175.4	0	110.4	S233 V234 Y235 Q305 I306 N307	S233-K323 PolarHBondContact O-N 2.94Å; V234-K323 CarbonylContact C-O 3.52Å; V234-K323 WeakPolarHBondContact CA-O 3.46Å; V234-K323 HydrophobicContact CG1-CB 4.3Å; V234-K323 HydrophobicContact CG2-CB 4.33Å; Y235-K323 PolarHBondContact N-O 3.36Å; Q305-K323 HydrophobicContact CG-CD 4.43Å; I306-K323 CarbonylContact O-C 3.55Å; I306-K323 WeakPolarHBondContact O-CA 3.14Å; N307-K323 WeakPolarHBondContact OD1-CE 3.43Å
324	V	97.5	Very high	94.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	115.3	167.8	-174.6	0	0	0	0	107.7	Y235 V237 I250 L252 I290 I306 V308 V326	Y235-V324 HydrophobicContact CD2-CG2 4.23Å; V237-V324 HydrophobicContact CG2-CG1 4.05Å; I250-V324 HydrophobicContact CG2-CG1 3.94Å; I250-V324 HydrophobicContact CG2-CG2 4.21Å; L252-V324 HydrophobicContact CD1-CG2 4.25Å; L252-V324 HydrophobicContact CD2-CG2 3.93Å; I290-V324 HydrophobicContact CD1-CB 4.47Å; I290-V324 HydrophobicContact CD1-CG2 3.88Å; I306-V324 HydrophobicContact CB-CB 4.32Å; I306-V324 PolarHBondContact N-O 3.04Å; I306-V324 PolarHBondContact O-N 3.09Å; V308-V324 HydrophobicContact CG2-CG2 4.39Å; V324-V326 HydrophobicContact CG1-CG2 4.01Å
325	L	97.3	Very high	94.7	Very high	43 Å²	43	51.4 Å²	51.4	23%	0.225	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	96.6	175.3	-172.5	69.4	0	0	0	108.5	Y235 T236 V237 T303 Q305	Y235-L325 PolarHBondContact O-N 2.84Å; T236-L325 WeakPolarHBondContact CA-O 3.47Å; T236-L325 HydrophobicContact CG2-CD2 4.49Å; V237-L325 PolarHBondContact N-O 2.77Å; T303-L325 HydrophobicContact CG2-CD1 3.49Å; T303-L325 VanDerWaalsContact CG2-CD1 3.49Å; T303-L325 HydrophobicContact CG2-CG 4.13Å; Q305-L325 HydrophobicContact CB-CD1 4.43Å
326	V	97.5	Very high	95.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	113.6	175.4	-172.7	0	0	0	0	107.7	L239 V249 F281 T303 H304 I306 V324 L328	L239-V326 HydrophobicContact CB-CG1 3.65Å; L239-V326 HydrophobicContact CD2-CG1 3.84Å; L239-V326 HydrophobicContact CG-CG1 4.41Å; V249-V326 HydrophobicContact CG1-CG1 4.27Å; V249-V326 HydrophobicContact CG1-CG2 3.73Å; F281-V326 HydrophobicContact CZ-CG1 4.3Å; F281-V326 HydrophobicContact CZ-CG2 4.47Å; T303-V326 CarbonylContact C-O 3.52Å; T303-V326 WeakPolarHBondContact CA-O 3.37Å; H304-V326 HydrophobicContact CB-CB 4.37Å; H304-V326 PolarHBondContact N-O 2.9Å; H304-V326 PolarHBondContact O-N 2.77Å; I306-V326 HydrophobicContact CD1-CG2 3.84Å; I306-V326 HydrophobicContact CG1-CG2 4.39Å; V324-V326 HydrophobicContact CG1-CG2 4.01Å; V326-L328 HydrophobicContact CG1-CD2 4.31Å
327	K	96.8	Very high	95.4	Very high	87 Å²	87	45.7 Å²	45.7	38%	0.378	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124.3	171.2	-64.8	176.5	-177.9	174.8	0	107.7	T236 V237 N238 L239 T303	T236-K327 HydrophobicContact CG2-CD 4.02Å; V237-K327 PolarHBondContact O-N 2.9Å; N238-K327 WeakPolarHBondContact CA-O 3.48Å; L239-K327 PolarHBondContact N-O 3.28Å; T303-K327 HydrophobicContact CG2-CG 4.4Å
328	L	96.5	Very high	95.5	Very high	10 Å²	10	45.5 Å²	45.5	5%	0.052	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	143.3	173.1	-60	-173.6	0	0	0	109.7	L239 E241 V296 D297 Y298 S301 N302 V326	L239-L328 HydrophobicContact CB-CD2 4.19Å; L239-L328 HydrophobicContact CD2-CD2 4.08Å; L239-L328 HydrophobicContact CG-CD2 4.33Å; L239-L328 CarbonylContact O-C 3.55Å; L239-L328 VanDerWaalsContact O-CA 3.27Å; L239-L328 WeakPolarHBondContact O-CA 3.26Å; E241-L328 HydrophobicContact CB-CD1 4.49Å; V296-L328 HydrophobicContact CB-CD1 4.23Å; V296-L328 HydrophobicContact CB-CD2 4.18Å; D297-L328 WeakPolarHBondContact O-CD1 3.49Å; Y298-L328 HydrophobicContact CD2-CB 3.87Å; Y298-L328 WeakPolarHBondContact CE2-O 3.25Å; S301-L328 WeakPolarHBondContact O-CD1 3.35Å; N302-L328 PolarHBondContact O-N 2.89Å; V326-L328 HydrophobicContact CG1-CD2 4.31Å
329	V	95	Very high	95.6	Very high	61 Å²	61	43 Å²	43	37%	0.37	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	109.9	172.8	179.8	0	0	0	0	106.7	N238 L239 R240 E241	N238-V329 HydrophobicContact CB-CG2 4.02Å; L239-V329 PolarHBondContact O-N 3.31Å; R240-V329 HydrophobicContact CG-CB 4.31Å; E241-V329 PolarHBondContact N-O 2.91Å
330	D	95.4	Very high	95.6	Very high	34 Å²	34	42.9 Å²	42.9	18%	0.182	22%	0.224	C	C	.	.			trans	-30.2	124.7	165.2	-176.4	-26.4	0	0	0	113	E241 Y298 S367 N370	E241-D330 WeakPolarHBondContact OE1-CA 3.21Å; Y298-D330 HydrophobicContact CD2-CB 4.19Å; Y298-D330 HydrophobicContact CE1-CB 4.48Å; Y298-D330 HydrophobicContact CE2-CB 4.02Å; Y298-D330 HydrophobicContact CG-CB 4.49Å; D330-S367 WeakPolarHBondContact OD2-CA 3.39Å; D330-S367 WeakPolarHBondContact OD2-CB 3.49Å; D330-S367 PolarHBondContact OD2-N 2.96Å; D330-S367 VanDerWaalsContact OD2-N 3.08Å; D330-N370 PolarHBondContact OD1-ND2 2.64Å
331	V	94.8	Very high	95.4	Very high	48 Å²	48	45.1 Å²	45.1	29%	0.291	24%	0.238	S	C	.	.			trans	-131.3	126.7	176.2	175.2	0	0	0	0	109.1	R240 E241 D333	R240-V331 HydrophobicContact CB-CG2 4.1Å; R240-V331 HydrophobicContact CG-CG2 4.26Å; E241-V331 HydrophobicContact CG-CB 3.87Å; E241-V331 HydrophobicContact CG-CG2 4.06Å; E241-V331 PolarHBondContact OE1-N 2.77Å; V331-D333 PolarHBondContact O-N 3.48Å
332	N	95.2	Very high	95.1	Very high	17 Å²	17	44.1 Å²	44.1	9%	0.091	24%	0.24	C	C	.	.	S	Bend	trans	-64.5	92.1	-172.2	-160.4	112.5	0	0	0	113.3	D366 N370 D417 G419 L423	N332-D366 WeakPolarHBondContact CA-OD2 3.38Å; N332-N370 WeakPolarHBondContact CA-ND2 2.94Å; N332-N370 HydrophobicContact CB-CB 3.98Å; N332-N370 WeakPolarHBondContact CB-ND2 3.22Å; N332-N370 PolarHBondContact N-ND2 2.85Å; N332-N370 WeakPolarHBondContact OD1-CA 3.49Å; N332-N370 WeakPolarHBondContact OD1-CB 3.4Å; N332-D417 PolarHBondContact ND2-OD2 3.43Å; N332-D417 PolarHBondContact OD1-OD2 2.93Å; N332-G419 WeakPolarHBondContact OD1-CA 3.4Å; N332-G419 PolarHBondContact OD1-N 2.84Å; N332-L423 WeakPolarHBondContact ND2-CD1 3.36Å; N332-L423 WeakPolarHBondContact ND2-CG 3.08Å
333	D	94.3	Very high	94.9	Very high	74 Å²	74	46.7 Å²	46.7	40%	0.396	26%	0.256	S	S	.	.			trans	-125.9	-21.2	-174.9	92.3	-20.2	0	0	0	114.4	N242 V331 D366	N242-D333 PolarHBondContact ND2-OD2 2.73Å; V331-D333 PolarHBondContact O-N 3.48Å; D333-D366 PolarHBondContact N-OD2 2.92Å
334	N	94.3	Very high	94.6	Very high	38 Å²	38	45.7 Å²	45.7	20%	0.203	26%	0.257	C	S	.	.	S	Bend	trans	-82.5	145.4	168.6	-61.5	-90.9	0	0	0	110.7	R365 D366 L423	N334-R365 HydrophobicContact CB-CB 4.06Å; N334-R365 WeakPolarHBondContact OD1-CD 3.42Å; N334-D366 WeakPolarHBondContact CB-OD1 3.5Å; N334-D366 PolarHBondContact N-OD1 2.85Å; N334-D366 PolarHBondContact ND2-OD1 3.41Å; N334-L423 WeakPolarHBondContact O-CD1 3.15Å
335	T	94.9	Very high	94.2	Very high	77 Å²	77	53.3 Å²	53.3	47%	0.472	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-97.6	141	174.3	61	0	0	0	0	110.4	E337 L423	T335-E337 PolarHBondContact O-N 3.01Å; T335-L423 HydrophobicContact CG2-CB 4.13Å; T335-L423 HydrophobicContact CG2-CD1 4.08Å
336	P	96.1	Very high	93.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-51.5	120.3	177.1	-24.3	26.2	0	0	0	113.4	V362 D364 M373 A415 D417 T425	P336-V362 HydrophobicContact CB-CG1 3.92Å; P336-D364 WeakPolarHBondContact CA-OD2 3.39Å; P336-D364 WeakPolarHBondContact CD-OD2 3.24Å; P336-D364 VanDerWaalsContact CG-OD2 3.22Å; P336-D364 WeakPolarHBondContact CG-OD2 3.27Å; P336-M373 HydrophobicContact CB-CB 4.4Å; P336-M373 HydrophobicContact CB-SD 4.2Å; P336-M373 HydrophobicContact CG-CB 4.25Å; P336-A415 HydrophobicContact CB-CB 3.88Å; P336-D417 HydrophobicContact CG-CB 4.07Å; P336-T425 WeakPolarHBondContact O-CB 3.45Å; P336-T425 WeakPolarHBondContact O-CG2 3.33Å; P336-T425 PolarHBondContact O-OG1 3.43Å
337	E	95	Very high	93.7	Very high	104 Å²	104	54.6 Å²	54.6	49%	0.486	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121.8	180	-169.7	-175.4	167.3	0	0	111.6	T335 V362 S363	T335-E337 PolarHBondContact O-N 3.01Å; E337-V362 CarbonylContact O-C 3.58Å; E337-V362 VanDerWaalsContact O-CA 3.26Å; E337-V362 WeakPolarHBondContact O-CA 3.38Å; E337-V362 WeakPolarHBondContact O-CG1 3.26Å; E337-S363 WeakPolarHBondContact CB-O 3.07Å; E337-S363 PolarHBondContact N-O 3.47Å; E337-S363 PolarHBondContact O-N 2.78Å
338	I	95.8	Very high	93.5	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.8	178.5	-56.2	-179.2	0	0	0	111	F340 F360 V362 V413 A415 T425 K427	I338-F340 HydrophobicContact CG2-CD2 4.47Å; I338-F340 HydrophobicContact CG2-CE2 4.11Å; I338-F360 HydrophobicContact CG2-CD2 3.84Å; I338-F360 HydrophobicContact CG2-CE2 4.25Å; I338-V362 HydrophobicContact CG1-CG1 4.09Å; I338-V362 HydrophobicContact CG1-CG2 4.15Å; I338-V413 HydrophobicContact CD1-CG2 4.04Å; I338-V413 HydrophobicContact CG2-CG2 3.99Å; I338-A415 HydrophobicContact CD1-CB 3.84Å; I338-A415 HydrophobicContact CG1-CB 3.96Å; I338-T425 HydrophobicContact CD1-CG2 4.33Å; I338-T425 WeakPolarHBondContact CD1-O 3.48Å; I338-T425 HydrophobicContact CG1-CG2 4.29Å; I338-K427 HydrophobicContact CB-CB 4.17Å; I338-K427 HydrophobicContact CB-CD 3.96Å; I338-K427 HydrophobicContact CD1-CB 4.15Å; I338-K427 HydrophobicContact CG2-CB 4.13Å; I338-K427 HydrophobicContact CG2-CD 4.06Å; I338-K427 VanDerWaalsContact O-CD 3.26Å; I338-K427 WeakPolarHBondContact O-CD 3.26Å; I338-K427 PolarHBondContact O-NZ 2.89Å
339	S	94.4	Very high	93.3	Very high	37 Å²	37	51.2 Å²	51.2	26%	0.259	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	105.1	-178.7	46.4	0	0	0	0	112	S341 F360 S361	S339-S341 PolarHBondContact O-N 2.83Å; S339-F360 CarbonylContact O-C 3.59Å; S339-F360 VanDerWaalsContact O-CA 3.3Å; S339-F360 WeakPolarHBondContact O-CA 3.23Å; S339-F360 WeakPolarHBondContact O-CB 3.18Å; S339-S361 PolarHBondContact N-O 3.26Å; S339-S361 PolarHBondContact O-N 2.93Å; S339-S361 PolarHBondContact O-OG 3.25Å; S339-S361 PolarHBondContact OG-O 2.89Å; S339-S361 PolarHBondContact OG-OG 3.24Å
340	F	93.4	Very high	93	Very high	49 Å²	49	55.6 Å²	55.6	22%	0.215	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	124.3	171.9	-73.9	-83.7	0	0	0	110.4	I338 V343 A358 F360 I395 V413 K427 I429	I338-F340 HydrophobicContact CG2-CD2 4.47Å; I338-F340 HydrophobicContact CG2-CE2 4.11Å; F340-V343 HydrophobicContact CB-CG2 3.9Å; F340-V343 HydrophobicContact CD1-CG2 3.68Å; F340-V343 HydrophobicContact CE1-CG2 4.47Å; F340-V343 HydrophobicContact CG-CG2 3.95Å; F340-A358 HydrophobicContact CD1-CB 4.16Å; F340-A358 HydrophobicContact CE1-CB 4.17Å; F340-F360 HydrophobicContact CD1-CB 3.7Å; F340-F360 HydrophobicContact CD1-CD1 4.49Å; F340-F360 HydrophobicContact CD1-CG 4.38Å; F340-F360 HydrophobicContact CE1-CB 4.04Å; F340-F360 HydrophobicContact CE1-CD1 4.07Å; F340-F360 HydrophobicContact CE1-CG 4.22Å; F340-F360 HydrophobicContact CG-CB 4.11Å; F340-I395 HydrophobicContact CE1-CD1 4.14Å; F340-V413 HydrophobicContact CE2-CG2 4.24Å; F340-V413 HydrophobicContact CZ-CG2 3.73Å; F340-K427 HydrophobicContact CD2-CD 4.16Å; F340-K427 HydrophobicContact CD2-CG 4.48Å; F340-K427 HydrophobicContact CE2-CB 4.21Å; F340-K427 HydrophobicContact CE2-CD 4.06Å; F340-K427 HydrophobicContact CE2-CG 3.97Å; F340-I429 HydrophobicContact CD1-CG2 4.16Å; F340-I429 HydrophobicContact CD2-CG2 4.16Å; F340-I429 HydrophobicContact CE1-CD1 4.08Å; F340-I429 HydrophobicContact CE1-CG1 4.47Å; F340-I429 HydrophobicContact CE1-CG2 3.78Å; F340-I429 HydrophobicContact CE2-CG2 3.78Å; F340-I429 HydrophobicContact CG-CG2 4.34Å; F340-I429 HydrophobicContact CZ-CG1 4.43Å; F340-I429 HydrophobicContact CZ-CG2 3.57Å
341	S	90.1	Very high	92.6	Very high	68 Å²	68	58.3 Å²	58.3	48%	0.476	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-40.6	177.5	-42.5	0	0	0	0	111.6	S339 L359	S339-S341 PolarHBondContact O-N 2.83Å; S341-L359 PolarHBondContact N-O 3.17Å
342	T	90.1	Very high	92.4	Very high	88 Å²	88	59.1 Å²	59.1	54%	0.54	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	143.9	172.5	57.4	0	0	0	0	109.9	A358 L359	T342-A358 CarbonylContact O-C 3.41Å; T342-A358 VanDerWaalsContact O-CA 3.27Å; T342-A358 WeakPolarHBondContact O-CA 3.34Å; T342-A358 WeakPolarHBondContact O-CB 3.13Å; T342-L359 PolarHBondContact N-O 2.75Å; T342-L359 PolarHBondContact O-N 2.82Å
343	V	91.9	Very high	92.2	Very high	57 Å²	57	62.2 Å²	62.2	35%	0.345	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131.1	173.5	-177.2	0	0	0	0	107.3	F340 A358 I429	F340-V343 HydrophobicContact CB-CG2 3.9Å; F340-V343 HydrophobicContact CD1-CG2 3.68Å; F340-V343 HydrophobicContact CE1-CG2 4.47Å; F340-V343 HydrophobicContact CG-CG2 3.95Å; V343-A358 HydrophobicContact CG2-CB 4.2Å; V343-I429 HydrophobicContact CG1-CB 4.26Å; V343-I429 HydrophobicContact CG1-CD1 3.93Å; V343-I429 HydrophobicContact CG1-CG2 4.22Å; V343-I429 HydrophobicContact CG2-CG2 4.05Å
344	T	90.1	Very high	92	Very high	66 Å²	66	59.9 Å²	59.9	41%	0.405	35%	0.345	S	S	.	.			trans	-86.7	121	172.1	-43.7	0	0	0	0	108.4	S346 I357	T344-S346 WeakPolarHBondContact CG2-O 3.26Å; T344-I357 WeakPolarHBondContact CB-O 3.47Å; T344-I357 PolarHBondContact N-O 3.22Å; T344-I357 PolarHBondContact OG1-O 2.96Å
345	E	88.5	Confident	91.9	Very high	160 Å²	160	60 Å²	60	75%	0.748	35%	0.347	S	S	*	.	S	Bend	trans	-68	-35	-176.1	-61.9	-177.6	163.9	0	0	112.7	H432	E345-H432 PolarHBondContact O-N 2.93Å
346	S	91.3	Very high	91.8	Very high	61 Å²	61	60.1 Å²	60.1	43%	0.427	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.7	177.2	58.8	0	0	0	0	113.1	T344 H432	T344-S346 WeakPolarHBondContact CG2-O 3.26Å; S346-H432 CarbonylContact C-O 3.6Å; S346-H432 WeakPolarHBondContact CA-O 3.31Å
347	V	93.6	Very high	91.6	Very high	9 Å²	9	60.1 Å²	60.1	6%	0.055	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	133.8	174.4	55.6	0	0	0	0	109.1	H351 T355 I357 L401 V431 H432 V433 S434	V347-H351 HydrophobicContact CG2-CB 4.14Å; V347-T355 HydrophobicContact CG2-CG2 4.42Å; V347-I357 HydrophobicContact CB-CD1 3.82Å; V347-I357 HydrophobicContact CG1-CD1 3.87Å; V347-I357 HydrophobicContact CG2-CD1 3.82Å; V347-L401 HydrophobicContact CG1-CD1 3.5Å; V347-L401 HydrophobicContact CG2-CD1 4.28Å; V347-V431 HydrophobicContact CG1-CG1 3.91Å; V347-H432 PolarHBondContact N-O 2.93Å; V347-V433 CarbonylContact O-C 3.54Å; V347-V433 WeakPolarHBondContact O-CA 3.46Å; V347-S434 PolarHBondContact O-N 2.94Å
348	S	92.1	Very high	91.6	Very high	9 Å²	9	55.2 Å²	55.2	6%	0.063	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	144.9	179.4	88.4	0	0	0	0	112.2	Q350 H351 S434 E436	S348-Q350 VanDerWaalsContact C-N 3.26Å; S348-Q350 PolarHBondContact O-N 2.74Å; S348-H351 VanDerWaalsContact O-CB 3.24Å; S348-H351 WeakPolarHBondContact O-CB 3.48Å; S348-H351 PolarHBondContact O-N 3.09Å; S348-H351 PolarHBondContact O-ND1 2.9Å; S348-H351 PolarHBondContact OG-CE1 3.35Å; S348-H351 PolarHBondContact OG-ND1 2.05Å; S348-S434 VanDerWaalsContact CA-O 3.26Å; S348-S434 WeakPolarHBondContact CA-O 3.16Å; S348-S434 WeakPolarHBondContact CA-OG 3.37Å; S348-S434 WeakPolarHBondContact CB-O 3.44Å; S348-S434 VanDerWaalsContact CB-OG 3.23Å; S348-S434 WeakPolarHBondContact CB-OG 3.19Å; S348-S434 PolarHBondContact N-OG 3.39Å; S348-E436 WeakPolarHBondContact CB-OE1 3.31Å; S348-E436 PolarHBondContact OG-OE1 3.42Å
349	E	93.3	Very high	91.5	Very high	16 Å²	16	57.9 Å²	57.9	8%	0.075	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-27.3	-172.8	57.4	-136.5	118.8	0	0	114.9	H351 L401 R403 V433 D435 E436	E349-H351 PolarHBondContact O-N 2.82Å; E349-H351 VanDerWaalsContact O-N 3.09Å; E349-L401 HydrophobicContact CB-CB 4.26Å; E349-R403 WeakPolarHBondContact OE2-CB 3.38Å; E349-R403 PolarHBondContact OE2-N 3.25Å; E349-V433 HydrophobicContact CB-CG1 3.91Å; E349-D435 VanDerWaalsContact OE1-CA 3.24Å; E349-D435 WeakPolarHBondContact OE1-CA 3.37Å; E349-E436 HydrophobicContact CG-CB 4.21Å; E349-E436 HydrophobicContact CG-CG 4.22Å; E349-E436 PolarHBondContact OE1-N 3.3Å
350	Q	88.4	Confident	91.5	Very high	154 Å²	154	56.1 Å²	56.1	72%	0.72	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-14.5	172.2	-161.6	-178.3	116.1	0	0	113.1	S348 A352 E436	S348-Q350 VanDerWaalsContact C-N 3.26Å; S348-Q350 PolarHBondContact O-N 2.74Å; Q350-A352 PolarHBondContact O-N 3.4Å; Q350-E436 HydrophobicContact CB-CG 3.98Å; Q350-E436 PolarHBondContact NE2-OE2 3.12Å
351	H	87.9	Confident	91.5	Very high	90 Å²	90	54.6 Å²	54.6	42%	0.417	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-67.7	124.7	-179.3	-81	72.5	0	0	0	113.2	V347 S348 E349 T355	V347-H351 HydrophobicContact CG2-CB 4.14Å; S348-H351 VanDerWaalsContact O-CB 3.24Å; S348-H351 WeakPolarHBondContact O-CB 3.48Å; S348-H351 PolarHBondContact O-N 3.09Å; S348-H351 PolarHBondContact O-ND1 2.9Å; S348-H351 PolarHBondContact OG-CE1 3.35Å; S348-H351 PolarHBondContact OG-ND1 2.05Å; E349-H351 PolarHBondContact O-N 2.82Å; E349-H351 VanDerWaalsContact O-N 3.09Å; H351-T355 HydrophobicContact CB-CG2 4.23Å
352	A	89.1	Confident	91.8	Very high	66 Å²	66	51.4 Å²	51.4	55%	0.545	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-62	152	-178.7	0	0	0	0	0	113.5	Q350 G354 T355 T397	Q350-A352 PolarHBondContact O-N 3.4Å; A352-G354 PolarHBondContact O-N 3.44Å; A352-T355 PolarHBondContact O-N 2.72Å; A352-T355 PolarHBondContact O-OG1 2.83Å; A352-T397 PolarHBondContact O-OG1 3.07Å
353	P	91.3	Very high	92	Very high	82 Å²	82	49.7 Å²	49.7	53%	0.532	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	130.8	173.9	-28.4	34.7	0	0	0	113.7	T397	P353-T397 WeakPolarHBondContact CA-OG1 3.39Å
354	G	89.9	Confident	92.1	Very high	25 Å²	25	48.2 Å²	48.2	26%	0.258	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.8	2.6	-177.4	0	0	0	0	0	114.8	A352 T397	A352-G354 PolarHBondContact O-N 3.44Å; G354-T397 WeakPolarHBondContact CA-O 3.35Å; G354-T397 PolarHBondContact N-O 2.62Å; G354-T397 PolarHBondContact N-OG1 2.81Å
355	T	92.1	Very high	92.4	Very high	39 Å²	39	53.1 Å²	53.1	24%	0.239	29%	0.292	C	S	.	.			trans	-61.6	138.1	170.5	-64.8	0	0	0	0	110.5	V347 H351 A352 V396 T397	V347-T355 HydrophobicContact CG2-CG2 4.42Å; H351-T355 HydrophobicContact CB-CG2 4.23Å; A352-T355 PolarHBondContact O-N 2.72Å; A352-T355 PolarHBondContact O-OG1 2.83Å; T355-V396 CarbonylContact O-C 3.58Å; T355-V396 WeakPolarHBondContact O-CA 3.36Å; T355-V396 WeakPolarHBondContact O-CB 3.41Å; T355-T397 PolarHBondContact N-OG1 2.84Å; T355-T397 VanDerWaalsContact N-OG1 3.16Å; T355-T397 PolarHBondContact O-N 3.26Å
356	V	92.7	Very high	92.7	Very high	80 Å²	80	45.9 Å²	45.9	49%	0.485	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	126.8	-175.1	-176.2	0	0	0	0	110.9	T394 V396	V356-T394 HydrophobicContact CG1-CG2 4.43Å; V356-V396 HydrophobicContact CG2-CG1 4.01Å
357	I	93.8	Very high	92.8	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-37.5	-177	-55.4	-58.5	0	0	0	111.7	T344 V347 F383 I395 T397 I411 V431	T344-I357 WeakPolarHBondContact CB-O 3.47Å; T344-I357 PolarHBondContact N-O 3.22Å; T344-I357 PolarHBondContact OG1-O 2.96Å; V347-I357 HydrophobicContact CB-CD1 3.82Å; V347-I357 HydrophobicContact CG1-CD1 3.87Å; V347-I357 HydrophobicContact CG2-CD1 3.82Å; I357-F383 HydrophobicContact CD1-CE1 4.29Å; I357-F383 HydrophobicContact CG1-CD1 3.93Å; I357-F383 HydrophobicContact CG1-CE1 3.88Å; I357-I395 HydrophobicContact CB-CG2 4.37Å; I357-I395 PolarHBondContact N-O 2.81Å; I357-T397 HydrophobicContact CD1-CG2 4.16Å; I357-T397 HydrophobicContact CG1-CG2 4.35Å; I357-I411 HydrophobicContact CG2-CD1 4.39Å; I357-V431 HydrophobicContact CG2-CB 4.35Å; I357-V431 HydrophobicContact CG2-CG1 3.83Å; I357-V431 HydrophobicContact CG2-CG2 3.61Å
358	A	93.6	Very high	92.7	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.008	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	151.8	177.8	0	0	0	0	0	111.8	F340 T342 V343 T394 I395 I429	F340-A358 HydrophobicContact CD1-CB 4.16Å; F340-A358 HydrophobicContact CE1-CB 4.17Å; T342-A358 CarbonylContact O-C 3.41Å; T342-A358 VanDerWaalsContact O-CA 3.27Å; T342-A358 WeakPolarHBondContact O-CA 3.34Å; T342-A358 WeakPolarHBondContact O-CB 3.13Å; V343-A358 HydrophobicContact CG2-CB 4.2Å; A358-T394 CarbonylContact O-C 3.5Å; A358-T394 WeakPolarHBondContact O-CA 3.25Å; A358-I395 HydrophobicContact CB-CB 4.29Å; A358-I395 HydrophobicContact CB-CD1 4.18Å; A358-I395 HydrophobicContact CB-CG1 4.35Å; A358-I395 PolarHBondContact N-O 2.86Å; A358-I395 PolarHBondContact O-N 2.85Å; A358-I429 HydrophobicContact CB-CD1 3.88Å
359	L	93.9	Very high	92.6	Very high	57 Å²	57	54.2 Å²	54.2	30%	0.298	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.2	166.8	174.3	66.9	0	0	0	108.2	S341 T342 T394	S341-L359 PolarHBondContact N-O 3.17Å; T342-L359 PolarHBondContact N-O 2.75Å; T342-L359 PolarHBondContact O-N 2.82Å; L359-T394 HydrophobicContact CD1-CG2 3.7Å
360	F	94.6	Very high	92.6	Very high	1 Å²	1	54.9 Å²	54.9	0%	0.004	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	149.6	174.1	72	-84.4	0	0	0	112.3	I338 S339 F340 V362 L385 Y393 I395 V413	I338-F360 HydrophobicContact CG2-CD2 3.84Å; I338-F360 HydrophobicContact CG2-CE2 4.25Å; S339-F360 CarbonylContact O-C 3.59Å; S339-F360 VanDerWaalsContact O-CA 3.3Å; S339-F360 WeakPolarHBondContact O-CA 3.23Å; S339-F360 WeakPolarHBondContact O-CB 3.18Å; F340-F360 HydrophobicContact CD1-CB 3.7Å; F340-F360 HydrophobicContact CD1-CD1 4.49Å; F340-F360 HydrophobicContact CD1-CG 4.38Å; F340-F360 HydrophobicContact CE1-CB 4.04Å; F340-F360 HydrophobicContact CE1-CD1 4.07Å; F340-F360 HydrophobicContact CE1-CG 4.22Å; F340-F360 HydrophobicContact CG-CB 4.11Å; F360-V362 HydrophobicContact CD2-CG2 3.77Å; F360-V362 HydrophobicContact CE2-CG2 3.56Å; F360-L385 HydrophobicContact CE1-CD1 4.19Å; F360-L385 HydrophobicContact CZ-CD1 3.69Å; F360-Y393 HydrophobicContact CD2-CD2 4.42Å; F360-Y393 AromaticContact CE2-CD2 3.92Å; F360-Y393 HydrophobicContact CE2-CD2 3.92Å; F360-Y393 HydrophobicContact CE2-CG 4.27Å; F360-Y393 HydrophobicContact CZ-CD2 4.23Å; F360-Y393 HydrophobicContact CZ-CG 4.12Å; F360-Y393 PolarHBondContact N-O 2.95Å; F360-Y393 PolarHBondContact O-N 2.94Å; F360-I395 HydrophobicContact CD1-CD1 4.29Å; F360-I395 HydrophobicContact CD1-CG1 4.12Å; F360-I395 HydrophobicContact CE1-CD1 4.03Å; F360-I395 HydrophobicContact CE1-CG1 3.73Å; F360-V413 HydrophobicContact CE1-CG1 3.85Å; F360-V413 HydrophobicContact CE2-CB 4.48Å; F360-V413 HydrophobicContact CE2-CG2 4.38Å; F360-V413 HydrophobicContact CZ-CB 4.06Å; F360-V413 HydrophobicContact CZ-CG1 3.69Å; F360-V413 HydrophobicContact CZ-CG2 4.29Å
361	S	94.4	Very high	92.6	Very high	16 Å²	16	48.3 Å²	48.3	11%	0.112	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	153.4	162.8	27.5	0	0	0	0	109.9	S339 N391	S339-S361 PolarHBondContact N-O 3.26Å; S339-S361 PolarHBondContact O-N 2.93Å; S339-S361 PolarHBondContact O-OG 3.25Å; S339-S361 PolarHBondContact OG-O 2.89Å; S339-S361 PolarHBondContact OG-OG 3.24Å; S361-N391 WeakPolarHBondContact CA-O 3.43Å
362	V	94.8	Very high	92.8	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	140.4	157.9	-165.2	0	0	0	0	107.8	P336 E337 I338 F360 M373 N391 Y393 A415	P336-V362 HydrophobicContact CB-CG1 3.92Å; E337-V362 CarbonylContact O-C 3.58Å; E337-V362 VanDerWaalsContact O-CA 3.26Å; E337-V362 WeakPolarHBondContact O-CA 3.38Å; E337-V362 WeakPolarHBondContact O-CG1 3.26Å; I338-V362 HydrophobicContact CG1-CG1 4.09Å; I338-V362 HydrophobicContact CG1-CG2 4.15Å; F360-V362 HydrophobicContact CD2-CG2 3.77Å; F360-V362 HydrophobicContact CE2-CG2 3.56Å; V362-M373 HydrophobicContact CB-CE 4Å; V362-M373 HydrophobicContact CB-SD 3.75Å; V362-M373 HydrophobicContact CG1-CE 4.23Å; V362-M373 HydrophobicContact CG1-CG 4.33Å; V362-M373 HydrophobicContact CG1-SD 3.35Å; V362-M373 WeakPolarHBondContact CG1-SD 3.33Å; V362-M373 WeakPolarHBondContact O-CE 3.45Å; V362-N391 PolarHBondContact N-O 2.76Å; V362-N391 WeakPolarHBondContact O-CB 3.37Å; V362-Y393 HydrophobicContact CG2-CD2 4.12Å; V362-Y393 HydrophobicContact CG2-CE2 4.12Å; V362-A415 HydrophobicContact CG1-CB 3.66Å; V362-A415 HydrophobicContact CG2-CB 4.24Å
363	S	94	Very high	92.9	Very high	52 Å²	52	45.9 Å²	45.9	36%	0.364	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	126.3	177.5	45.4	0	0	0	0	109.6	E337	E337-S363 WeakPolarHBondContact CB-O 3.07Å; E337-S363 PolarHBondContact N-O 3.47Å; E337-S363 PolarHBondContact O-N 2.78Å
364	D	95.9	Very high	93	Very high	26 Å²	26	44.9 Å²	44.9	14%	0.139	26%	0.262	C	S	.	.			trans	-99.7	160	163.5	-136.4	-50.5	0	0	0	110	P336 M373	P336-D364 WeakPolarHBondContact CA-OD2 3.39Å; P336-D364 WeakPolarHBondContact CD-OD2 3.24Å; P336-D364 VanDerWaalsContact CG-OD2 3.22Å; P336-D364 WeakPolarHBondContact CG-OD2 3.27Å; D364-M373 HydrophobicContact CB-SD 4.22Å
365	R	95.1	Very high	93.1	Very high	168 Å²	168	44.7 Å²	44.7	63%	0.634	26%	0.257	S	S	*	.			trans	-100.1	-39.8	177.6	-63.7	-171.6	179.4	-174	2.2	111.7	E299 N334	E299-R365 HydrophobicContact CG-CB 3.85Å; N334-R365 HydrophobicContact CB-CB 4.06Å; N334-R365 WeakPolarHBondContact OD1-CD 3.42Å
366	D	95.9	Very high	93.3	Very high	9 Å²	9	48.7 Å²	48.7	5%	0.048	27%	0.273	C	S	.	.	S	Bend	trans	-51.7	162.8	176.1	-59.7	3.6	0	0	0	112.1	N332 D333 N334 N370 G371	N332-D366 WeakPolarHBondContact CA-OD2 3.38Å; D333-D366 PolarHBondContact N-OD2 2.92Å; N334-D366 WeakPolarHBondContact CB-OD1 3.5Å; N334-D366 PolarHBondContact N-OD1 2.85Å; N334-D366 PolarHBondContact ND2-OD1 3.41Å; D366-N370 HydrophobicContact CB-CB 3.63Å; D366-G371 VanDerWaalsContact O-CA 3.25Å; D366-G371 WeakPolarHBondContact O-CA 3.33Å
367	S	92.6	Very high	93.4	Very high	46 Å²	46	46.4 Å²	46.4	32%	0.322	26%	0.258	S	S	.	.			trans	-110.5	-177.5	-177.8	-78.8	0	0	0	0	113	D330 E369 N370 G371	D330-S367 WeakPolarHBondContact OD2-CA 3.39Å; D330-S367 WeakPolarHBondContact OD2-CB 3.49Å; D330-S367 PolarHBondContact OD2-N 2.96Å; D330-S367 VanDerWaalsContact OD2-N 3.08Å; S367-E369 PolarHBondContact O-N 3.35Å; S367-N370 WeakPolarHBondContact O-CB 3.47Å; S367-N370 PolarHBondContact O-N 3.46Å; S367-N370 VanDerWaalsContact O-N 3.09Å; S367-G371 PolarHBondContact O-N 3.2Å
368	G	90.6	Very high	93.4	Very high	66 Å²	66	51.7 Å²	51.7	68%	0.68	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	-119.3	172	0	0	0	0	0	115.6
369	E	91.4	Very high	93	Very high	142 Å²	142	54.4 Å²	54.4	66%	0.664	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-29.9	174.2	-62.9	-164.6	135.7	0	0	111.9	S367 Q372 K418	S367-E369 PolarHBondContact O-N 3.35Å; E369-Q372 WeakPolarHBondContact O-CB 3.31Å; E369-Q372 PolarHBondContact O-N 2.88Å; E369-Q372 VanDerWaalsContact O-N 3.09Å; E369-K418 WeakPolarHBondContact O-CB 3.26Å
370	N	92.3	Very high	92.7	Very high	30 Å²	30	60 Å²	60	16%	0.16	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-58	177.2	-62.2	6.1	0	0	0	109.3	D330 N332 D366 S367 Q372 D417	D330-N370 PolarHBondContact OD1-ND2 2.64Å; N332-N370 WeakPolarHBondContact CA-ND2 2.94Å; N332-N370 HydrophobicContact CB-CB 3.98Å; N332-N370 WeakPolarHBondContact CB-ND2 3.22Å; N332-N370 PolarHBondContact N-ND2 2.85Å; N332-N370 WeakPolarHBondContact OD1-CA 3.49Å; N332-N370 WeakPolarHBondContact OD1-CB 3.4Å; D366-N370 HydrophobicContact CB-CB 3.63Å; S367-N370 WeakPolarHBondContact O-CB 3.47Å; S367-N370 PolarHBondContact O-N 3.46Å; S367-N370 VanDerWaalsContact O-N 3.09Å; N370-Q372 PolarHBondContact O-N 2.96Å; N370-D417 WeakPolarHBondContact O-CB 3.31Å
371	G	89.9	Confident	92.6	Very high	16 Å²	16	61.7 Å²	61.7	17%	0.165	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	15.6	174.3	0	0	0	0	0	117	D366 S367	D366-G371 VanDerWaalsContact O-CA 3.25Å; D366-G371 WeakPolarHBondContact O-CA 3.33Å; S367-G371 PolarHBondContact O-N 3.2Å
372	Q	91.4	Very high	92.5	Very high	92 Å²	92	62.3 Å²	62.3	43%	0.43	36%	0.356	S	S	.	.			trans	-106.8	72.2	179.4	-164.8	-178.2	111.7	0	0	113.5	E369 N370 K418	E369-Q372 WeakPolarHBondContact O-CB 3.31Å; E369-Q372 PolarHBondContact O-N 2.88Å; E369-Q372 VanDerWaalsContact O-N 3.09Å; N370-Q372 PolarHBondContact O-N 2.96Å; Q372-K418 HydrophobicContact CB-CD 4.35Å; Q372-K418 HydrophobicContact CG-CD 4.34Å; Q372-K418 WeakPolarHBondContact O-CD 3.42Å; Q372-K418 WeakPolarHBondContact O-CE 3.11Å; Q372-K418 VanDerWaalsContact O-CG 3.27Å; Q372-K418 WeakPolarHBondContact O-CG 3.23Å
373	M	91	Very high	92.5	Very high	13 Å²	13	62.7 Å²	62.7	6%	0.064	36%	0.358	C	S	.	.			trans	-66.4	157.4	175.6	70.9	-140.5	151.9	0	0	116.5	P336 V362 D364 N391 T416	P336-M373 HydrophobicContact CB-CB 4.4Å; P336-M373 HydrophobicContact CB-SD 4.2Å; P336-M373 HydrophobicContact CG-CB 4.25Å; V362-M373 HydrophobicContact CB-CE 4Å; V362-M373 HydrophobicContact CB-SD 3.75Å; V362-M373 HydrophobicContact CG1-CE 4.23Å; V362-M373 HydrophobicContact CG1-CG 4.33Å; V362-M373 HydrophobicContact CG1-SD 3.35Å; V362-M373 WeakPolarHBondContact CG1-SD 3.33Å; V362-M373 WeakPolarHBondContact O-CE 3.45Å; D364-M373 HydrophobicContact CB-SD 4.22Å; M373-N391 HydrophobicContact CE-CB 3.81Å; M373-N391 WeakPolarHBondContact CE-ND2 3.34Å; M373-T416 CarbonylContact C-O 3.56Å; M373-T416 VanDerWaalsContact CA-O 3.23Å; M373-T416 WeakPolarHBondContact CA-O 3.03Å
374	S	92.3	Very high	92.5	Very high	60 Å²	60	63.7 Å²	63.7	42%	0.42	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.4	167.8	61.2	0	0	0	0	109	A415 T416	S374-A415 WeakPolarHBondContact O-CA 3.27Å; S374-T416 PolarHBondContact N-O 2.79Å; S374-T416 PolarHBondContact O-N 2.8Å; S374-T416 PolarHBondContact OG-O 3.31Å
375	C	94	Very high	92.4	Very high	21 Å²	21	64.8 Å²	64.8	14%	0.142	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	136	-175.3	-53.7	0	0	0	0	112	L385 Y393 V414	C375-L385 HydrophobicContact CB-CD1 4.06Å; C375-Y393 HydrophobicContact CB-CD2 4.43Å; C375-Y393 HydrophobicContact CB-CE1 4.3Å; C375-Y393 HydrophobicContact CB-CE2 4Å; C375-Y393 WeakPolarHBondContact SG-CE2 3.12Å; C375-V414 CarbonylContact C-O 3.58Å; C375-V414 VanDerWaalsContact CA-O 3.31Å; C375-V414 WeakPolarHBondContact CA-O 3.5Å
376	E	94.3	Very high	92.3	Very high	124 Å²	124	61.2 Å²	61.2	58%	0.579	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.2	168.5	178.9	61.5	-178.4	-164.1	0	0	112.2	V413 V414	E376-V413 WeakPolarHBondContact O-CA 3.49Å; E376-V414 HydrophobicContact CG-CB 4.32Å; E376-V414 PolarHBondContact N-O 3.27Å; E376-V414 PolarHBondContact O-N 3.08Å
377	I	95.1	Very high	92	Very high	31 Å²	31	64.1 Å²	64.1	16%	0.159	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.2	170.5	-66.1	171	0	0	0	107	V381 F383 L385 I395 I411 T412 V413	I377-V381 HydrophobicContact CG2-CG2 3.71Å; I377-F383 HydrophobicContact CD1-CB 4.48Å; I377-L385 HydrophobicContact CD1-CB 4.05Å; I377-L385 HydrophobicContact CG1-CB 4.25Å; I377-I395 HydrophobicContact CD1-CG2 4.28Å; I377-I411 HydrophobicContact CD1-CG2 4.34Å; I377-I411 HydrophobicContact CG1-CG2 4.44Å; I377-I411 HydrophobicContact CG2-CG2 3.83Å; I377-T412 WeakPolarHBondContact CA-O 3.35Å; I377-V413 HydrophobicContact CG1-CG1 4.04Å
378	M	93.5	Very high	91.3	Very high	112 Å²	112	65.3 Å²	65.3	55%	0.552	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	126	-179.2	-174.5	-177.6	73.6	0	0	110.9	T412 V414	M378-T412 HydrophobicContact CE-CG2 3.95Å; M378-T412 PolarHBondContact N-O 2.76Å; M378-V414 HydrophobicContact CB-CG2 4.02Å
379	G	86.6	Confident	90.8	Very high	58 Å²	58	70 Å²	70	60%	0.598	38%	0.381	S	S	*	.	S	Bend	trans	101.6	161.5	179.1	0	0	0	0	0	113.6	V381	G379-V381 PolarHBondContact O-N 3.38Å
380	D	88	Confident	90.4	Very high	175 Å²	175	71.2 Å²	71.2	94%	0.936	38%	0.384	S	S	*	.	S	Bend	trans	-86	96.2	175.4	-166.9	16.8	0	0	0	108.8
381	V	91.6	Very high	90.2	Very high	37 Å²	37	71.9 Å²	71.9	22%	0.224	39%	0.388	C	S	.	.			trans	-133.9	151	-175.9	-64	0	0	0	0	109.9	I377 G379 F383	I377-V381 HydrophobicContact CG2-CG2 3.71Å; G379-V381 PolarHBondContact O-N 3.38Å; V381-F383 HydrophobicContact CB-CD2 4.1Å; V381-F383 HydrophobicContact CG2-CB 4.48Å; V381-F383 HydrophobicContact CG2-CD2 4.12Å; V381-F383 PolarHBondContact O-N 2.89Å
382	P	93.3	Very high	90.3	Very high	28 Å²	28	76.8 Å²	76.8	18%	0.182	40%	0.402	C	S	.	.	S	Bend	trans	-75.3	32.5	-174.1	31.9	-37.1	0	0	0	114.3	D398 L401 Y409	P382-D398 PolarHBondContact O-N 3.05Å; P382-L401 HydrophobicContact CB-CD2 4.12Å; P382-L401 HydrophobicContact CG-CD2 3.6Å; P382-Y409 VanDerWaalsContact CD-CE1 3.46Å; P382-Y409 HydrophobicContact CG-CD1 4.32Å; P382-Y409 HydrophobicContact CG-CE1 3.73Å; P382-Y409 HydrophobicContact CG-CE2 4.24Å
383	F	94.2	Very high	90.4	Very high	11 Å²	11	73.5 Å²	73.5	5%	0.048	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142.7	-178.5	-52.3	-87	0	0	0	111	I357 I377 V381 I395 V396 T397 L401 Y409 I411	I357-F383 HydrophobicContact CD1-CE1 4.29Å; I357-F383 HydrophobicContact CG1-CD1 3.93Å; I357-F383 HydrophobicContact CG1-CE1 3.88Å; I377-F383 HydrophobicContact CD1-CB 4.48Å; V381-F383 HydrophobicContact CB-CD2 4.1Å; V381-F383 HydrophobicContact CG2-CB 4.48Å; V381-F383 HydrophobicContact CG2-CD2 4.12Å; V381-F383 PolarHBondContact O-N 2.89Å; F383-I395 HydrophobicContact CB-CG2 4.01Å; F383-V396 CarbonylContact C-O 3.51Å; F383-V396 VanDerWaalsContact CA-O 3.27Å; F383-V396 WeakPolarHBondContact CA-O 3.34Å; F383-T397 HydrophobicContact CD1-CG2 4.09Å; F383-T397 HydrophobicContact CE1-CG2 3.87Å; F383-L401 HydrophobicContact CE1-CD1 4.39Å; F383-L401 HydrophobicContact CE1-CD2 4.37Å; F383-L401 HydrophobicContact CZ-CD1 4.35Å; F383-L401 HydrophobicContact CZ-CD2 3.94Å; F383-Y409 HydrophobicContact CE2-CD1 4.01Å; F383-Y409 AromaticContact CE2-CD2 3.83Å; F383-Y409 HydrophobicContact CE2-CD2 3.83Å; F383-Y409 HydrophobicContact CE2-CE2 4.47Å; F383-Y409 AromaticContact CE2-CG 3.55Å; F383-Y409 HydrophobicContact CE2-CG 3.55Å; F383-Y409 AromaticContact CZ-CD2 3.92Å; F383-Y409 HydrophobicContact CZ-CD2 3.92Å; F383-Y409 HydrophobicContact CZ-CG 4.1Å; F383-I411 HydrophobicContact CB-CD1 4.19Å; F383-I411 HydrophobicContact CD1-CD1 3.81Å; F383-I411 HydrophobicContact CD2-CD1 3.56Å; F383-I411 HydrophobicContact CD2-CG1 3.85Å; F383-I411 HydrophobicContact CE1-CD1 4.04Å; F383-I411 HydrophobicContact CE2-CD1 3.82Å; F383-I411 HydrophobicContact CE2-CG1 4.09Å; F383-I411 HydrophobicContact CG-CD1 3.56Å; F383-I411 HydrophobicContact CG-CG1 4.31Å; F383-I411 HydrophobicContact CZ-CD1 4.05Å
384	K	93.9	Very high	90.6	Very high	73 Å²	73	73.8 Å²	73.8	32%	0.317	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	150.6	178	63.1	-174.8	158.7	-161.8	0	111.9	V396 T397 D398	K384-V396 HydrophobicContact CD-CG2 4.34Å; K384-V396 HydrophobicContact CG-CG2 3.6Å; K384-V396 PolarHBondContact N-O 2.99Å; K384-V396 PolarHBondContact O-N 3.44Å; K384-T397 WeakPolarHBondContact CE-O 3.43Å; K384-D398 HydrophobicContact CB-CB 4.25Å; K384-D398 HydrophobicContact CD-CB 3.9Å; K384-D398 WeakPolarHBondContact CD-OD1 3.27Å; K384-D398 VanDerWaalsContact CE-OD1 3.26Å; K384-D398 WeakPolarHBondContact CE-OD1 3.41Å; K384-D398 HydrophobicContact CG-CB 4.01Å; K384-D398 IonicContact NZ-OD1 3.69Å; K384-D398 PolarHBondContact NZ-OD1 3.27Å
385	L	94.5	Very high	90.7	Very high	48 Å²	48	71 Å²	71	25%	0.251	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.8	177.3	177.9	138.4	0	0	0	110.2	F360 C375 I377 Y393	F360-L385 HydrophobicContact CE1-CD1 4.19Å; F360-L385 HydrophobicContact CZ-CD1 3.69Å; C375-L385 HydrophobicContact CB-CD1 4.06Å; I377-L385 HydrophobicContact CD1-CB 4.05Å; I377-L385 HydrophobicContact CG1-CB 4.25Å; L385-Y393 HydrophobicContact CD1-CD1 4.08Å; L385-Y393 HydrophobicContact CD1-CG 4.2Å; L385-Y393 HydrophobicContact CD2-CD1 3.56Å; L385-Y393 HydrophobicContact CD2-CE1 3.91Å; L385-Y393 HydrophobicContact CD2-CG 4.46Å; L385-Y393 HydrophobicContact CG-CD1 3.91Å; L385-Y393 HydrophobicContact CG-CG 4.39Å
386	K	91.9	Very high	90.7	Very high	93 Å²	93	70 Å²	70	40%	0.404	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116	171.1	-76.7	178.5	-179.8	165.9	0	109.4	T394 V396	K386-T394 WeakPolarHBondContact CB-OG1 3.47Å; K386-T394 PolarHBondContact N-O 2.82Å; K386-T394 PolarHBondContact O-N 3.02Å; K386-T394 PolarHBondContact O-OG1 2.91Å; K386-T394 VanDerWaalsContact O-OG1 3.06Å; K386-V396 HydrophobicContact CD-CG1 4.09Å; K386-V396 HydrophobicContact CD-CG2 3.8Å; K386-V396 HydrophobicContact CG-CG2 4.11Å
387	S	89.8	Confident	90.7	Very high	70 Å²	70	64.1 Å²	64.1	49%	0.49	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	128.2	166.1	-178.2	0	0	0	0	109.7	F389 Y392	S387-F389 PolarHBondContact OG-O 3.16Å; S387-F389 VanDerWaalsContact OG-O 3.06Å; S387-Y392 WeakPolarHBondContact CA-O 3.23Å
388	S	76.9	Confident	90.6	Very high	71 Å²	71	66.8 Å²	66.8	50%	0.497	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-35.4	177.5	-63.1	0	0	0	0	111.7	Y392	S388-Y392 PolarHBondContact N-O 3.01Å
389	F	80.8	Confident	90.3	Very high	166 Å²	166	62.8 Å²	62.8	73%	0.728	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.1	167.1	173.4	-86	-88.7	0	0	0	108.7	S387 N391 Y392	S387-F389 PolarHBondContact OG-O 3.16Å; S387-F389 VanDerWaalsContact OG-O 3.06Å; F389-N391 PolarHBondContact O-N 3.3Å; F389-Y392 PolarHBondContact O-N 2.92Å; F389-Y392 VanDerWaalsContact O-O 3.13Å
390	K	83.5	Confident	90.4	Very high	167 Å²	167	64.4 Å²	64.4	73%	0.726	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	126.9	172.9	177.8	-179.7	178.9	-164.4	0	108.9	Y392	K390-Y392 WeakPolarHBondContact O-CD2 3.42Å; K390-Y392 PolarHBondContact O-N 2.74Å
391	N	87	Confident	90.6	Very high	44 Å²	44	56.7 Å²	56.7	24%	0.235	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	3.5	178.6	-57.9	8	0	0	0	116.4	S361 V362 M373 F389	S361-N391 WeakPolarHBondContact CA-O 3.43Å; V362-N391 PolarHBondContact N-O 2.76Å; V362-N391 WeakPolarHBondContact O-CB 3.37Å; M373-N391 HydrophobicContact CE-CB 3.81Å; M373-N391 WeakPolarHBondContact CE-ND2 3.34Å; F389-N391 PolarHBondContact O-N 3.3Å
392	Y	92.4	Very high	90.7	Very high	118 Å²	118	58 Å²	58	46%	0.463	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.5	176.7	-75.5	-88	0	0	0	112	S387 S388 F389 K390	S387-Y392 WeakPolarHBondContact CA-O 3.23Å; S388-Y392 PolarHBondContact N-O 3.01Å; F389-Y392 PolarHBondContact O-N 2.92Å; F389-Y392 VanDerWaalsContact O-O 3.13Å; K390-Y392 WeakPolarHBondContact O-CD2 3.42Å; K390-Y392 PolarHBondContact O-N 2.74Å
393	Y	93.8	Very high	90.8	Very high	24 Å²	24	58.3 Å²	58.3	9%	0.094	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	140.7	-169	-59.4	-78.2	0	0	0	111.9	F360 V362 C375 L385	F360-Y393 HydrophobicContact CD2-CD2 4.42Å; F360-Y393 AromaticContact CE2-CD2 3.92Å; F360-Y393 HydrophobicContact CE2-CD2 3.92Å; F360-Y393 HydrophobicContact CE2-CG 4.27Å; F360-Y393 HydrophobicContact CZ-CD2 4.23Å; F360-Y393 HydrophobicContact CZ-CG 4.12Å; F360-Y393 PolarHBondContact N-O 2.95Å; F360-Y393 PolarHBondContact O-N 2.94Å; V362-Y393 HydrophobicContact CG2-CD2 4.12Å; V362-Y393 HydrophobicContact CG2-CE2 4.12Å; C375-Y393 HydrophobicContact CB-CD2 4.43Å; C375-Y393 HydrophobicContact CB-CE1 4.3Å; C375-Y393 HydrophobicContact CB-CE2 4Å; C375-Y393 WeakPolarHBondContact SG-CE2 3.12Å; L385-Y393 HydrophobicContact CD1-CD1 4.08Å; L385-Y393 HydrophobicContact CD1-CG 4.2Å; L385-Y393 HydrophobicContact CD2-CD1 3.56Å; L385-Y393 HydrophobicContact CD2-CE1 3.91Å; L385-Y393 HydrophobicContact CD2-CG 4.46Å; L385-Y393 HydrophobicContact CG-CD1 3.91Å; L385-Y393 HydrophobicContact CG-CG 4.39Å
394	T	94.4	Very high	90.8	Very high	19 Å²	19	60.9 Å²	60.9	12%	0.117	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.3	172.2	49.5	0	0	0	0	109.7	V356 A358 L359 K386	V356-T394 HydrophobicContact CG1-CG2 4.43Å; A358-T394 CarbonylContact O-C 3.5Å; A358-T394 WeakPolarHBondContact O-CA 3.25Å; L359-T394 HydrophobicContact CD1-CG2 3.7Å; K386-T394 WeakPolarHBondContact CB-OG1 3.47Å; K386-T394 PolarHBondContact N-O 2.82Å; K386-T394 PolarHBondContact O-N 3.02Å; K386-T394 PolarHBondContact O-OG1 2.91Å; K386-T394 VanDerWaalsContact O-OG1 3.06Å
395	I	94.9	Very high	90.7	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.4	169.5	-55.8	-178.5	0	0	0	106.7	F340 I357 A358 F360 I377 F383 I411 V413 I429	F340-I395 HydrophobicContact CE1-CD1 4.14Å; I357-I395 HydrophobicContact CB-CG2 4.37Å; I357-I395 PolarHBondContact N-O 2.81Å; A358-I395 HydrophobicContact CB-CB 4.29Å; A358-I395 HydrophobicContact CB-CD1 4.18Å; A358-I395 HydrophobicContact CB-CG1 4.35Å; A358-I395 PolarHBondContact N-O 2.86Å; A358-I395 PolarHBondContact O-N 2.85Å; F360-I395 HydrophobicContact CD1-CD1 4.29Å; F360-I395 HydrophobicContact CD1-CG1 4.12Å; F360-I395 HydrophobicContact CE1-CD1 4.03Å; F360-I395 HydrophobicContact CE1-CG1 3.73Å; I377-I395 HydrophobicContact CD1-CG2 4.28Å; F383-I395 HydrophobicContact CB-CG2 4.01Å; I395-I411 HydrophobicContact CD1-CG2 4.22Å; I395-I411 HydrophobicContact CG2-CD1 4.01Å; I395-I411 HydrophobicContact CG2-CG2 4.4Å; I395-V413 HydrophobicContact CD1-CG1 3.81Å; I395-V413 HydrophobicContact CG1-CG1 4.5Å; I395-I429 HydrophobicContact CD1-CD1 3.98Å
396	V	94.3	Very high	90.6	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	154.5	179.2	-52.7	0	0	0	0	111.6	T355 V356 F383 K384 K386	T355-V396 CarbonylContact O-C 3.58Å; T355-V396 WeakPolarHBondContact O-CA 3.36Å; T355-V396 WeakPolarHBondContact O-CB 3.41Å; V356-V396 HydrophobicContact CG2-CG1 4.01Å; F383-V396 CarbonylContact C-O 3.51Å; F383-V396 VanDerWaalsContact CA-O 3.27Å; F383-V396 WeakPolarHBondContact CA-O 3.34Å; K384-V396 HydrophobicContact CD-CG2 4.34Å; K384-V396 HydrophobicContact CG-CG2 3.6Å; K384-V396 PolarHBondContact N-O 2.99Å; K384-V396 PolarHBondContact O-N 3.44Å; K386-V396 HydrophobicContact CD-CG1 4.09Å; K386-V396 HydrophobicContact CD-CG2 3.8Å; K386-V396 HydrophobicContact CG-CG2 4.11Å
397	T	94.4	Very high	90.6	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	143.7	170.7	53.2	0	0	0	0	111.5	A352 P353 G354 T355 I357 F383 K384 L401	A352-T397 PolarHBondContact O-OG1 3.07Å; P353-T397 WeakPolarHBondContact CA-OG1 3.39Å; G354-T397 WeakPolarHBondContact CA-O 3.35Å; G354-T397 PolarHBondContact N-O 2.62Å; G354-T397 PolarHBondContact N-OG1 2.81Å; T355-T397 PolarHBondContact N-OG1 2.84Å; T355-T397 VanDerWaalsContact N-OG1 3.16Å; T355-T397 PolarHBondContact O-N 3.26Å; I357-T397 HydrophobicContact CD1-CG2 4.16Å; I357-T397 HydrophobicContact CG1-CG2 4.35Å; F383-T397 HydrophobicContact CD1-CG2 4.09Å; F383-T397 HydrophobicContact CE1-CG2 3.87Å; K384-T397 WeakPolarHBondContact CE-O 3.43Å; T397-L401 HydrophobicContact CG2-CD1 4.03Å; T397-L401 HydrophobicContact CG2-CG 4.33Å
398	D	92.1	Very high	90.9	Very high	88 Å²	88	60.6 Å²	60.6	47%	0.471	32%	0.317	S	S	.	.	S	Bend	trans	-111.5	-41.3	173.5	-162.1	13.6	0	0	0	111.9	P382 K384	P382-D398 PolarHBondContact O-N 3.05Å; K384-D398 HydrophobicContact CB-CB 4.25Å; K384-D398 HydrophobicContact CD-CB 3.9Å; K384-D398 WeakPolarHBondContact CD-OD1 3.27Å; K384-D398 VanDerWaalsContact CE-OD1 3.26Å; K384-D398 WeakPolarHBondContact CE-OD1 3.41Å; K384-D398 HydrophobicContact CG-CB 4.01Å; K384-D398 IonicContact NZ-OD1 3.69Å; K384-D398 PolarHBondContact NZ-OD1 3.27Å
399	G	87.3	Confident	91.7	Very high	28 Å²	28	59.1 Å²	59.1	29%	0.289	30%	0.301	S	S	.	.	S	Bend	trans	-97.6	-177.9	169.5	0	0	0	0	0	113.2
400	S	89.1	Confident	92.3	Very high	92 Å²	92	55.2 Å²	55.2	64%	0.643	29%	0.291	S	S	*	.			trans	-68.5	157.6	154	48	0	0	0	0	109.8
401	L	92.9	Very high	92.8	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.063	26%	0.257	C	S	.	.			trans	-104.5	168.2	167.3	-56.1	176.5	0	0	0	109	V347 E349 P382 F383 T397 Y409 V433	V347-L401 HydrophobicContact CG1-CD1 3.5Å; V347-L401 HydrophobicContact CG2-CD1 4.28Å; E349-L401 HydrophobicContact CB-CB 4.26Å; P382-L401 HydrophobicContact CB-CD2 4.12Å; P382-L401 HydrophobicContact CG-CD2 3.6Å; F383-L401 HydrophobicContact CE1-CD1 4.39Å; F383-L401 HydrophobicContact CE1-CD2 4.37Å; F383-L401 HydrophobicContact CZ-CD1 4.35Å; F383-L401 HydrophobicContact CZ-CD2 3.94Å; T397-L401 HydrophobicContact CG2-CD1 4.03Å; T397-L401 HydrophobicContact CG2-CG 4.33Å; L401-Y409 HydrophobicContact CD2-CE2 4Å; L401-V433 HydrophobicContact CB-CG1 4.28Å
402	D	93.3	Very high	93.3	Very high	65 Å²	65	45.9 Å²	45.9	35%	0.348	25%	0.25	S	C	.	.			trans	-166.2	109.2	-169.3	163.2	-8.2	0	0	0	105.7	N405 T406	D402-N405 HydrophobicContact CB-CB 4.26Å; D402-N405 WeakPolarHBondContact OD1-CB 3.12Å; D402-N405 PolarHBondContact OD1-N 3.37Å; D402-N405 VanDerWaalsContact OD2-CB 3.24Å; D402-N405 WeakPolarHBondContact OD2-CB 3.41Å; D402-N405 PolarHBondContact OD2-ND2 3.06Å; D402-T406 PolarHBondContact O-N 2.85Å
403	R	94.9	Very high	93.4	Very high	34 Å²	34	40.3 Å²	40.3	13%	0.128	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-33.9	-170.2	-176.7	-138.3	61.6	106.8	-6	111.6	E349 N405 T406 D407 V433 D435 P470	E349-R403 WeakPolarHBondContact OE2-CB 3.38Å; E349-R403 PolarHBondContact OE2-N 3.25Å; R403-N405 PolarHBondContact O-N 2.75Å; R403-T406 CarbonylContact O-C 3.58Å; R403-T406 PolarHBondContact O-N 2.84Å; R403-D407 PolarHBondContact O-N 3.1Å; R403-V433 HydrophobicContact CB-CB 4.01Å; R403-V433 HydrophobicContact CB-CG1 3.75Å; R403-V433 HydrophobicContact CG-CB 4.13Å; R403-V433 HydrophobicContact CG-CG1 4.33Å; R403-D435 VanDerWaalsContact CD-OD1 3.26Å; R403-D435 WeakPolarHBondContact CD-OD1 3.4Å; R403-D435 IonicContact CZ-OD1 3.93Å; R403-D435 IonicContact NE-OD1 3.19Å; R403-D435 PolarHBondContact NE-OD1 2.83Å; R403-D435 IonicContact NH1-OD1 2.6Å; R403-D435 IonicContact NH2-OD1 2.59Å; R403-P470 PolarHBondContact NH2-O 3.43Å
404	E	94.1	Very high	93.5	Very high	66 Å²	66	40.2 Å²	40.2	31%	0.308	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.5	175.7	-65.5	58.7	-119	0	0	110.4	P470	E404-P470 HydrophobicContact CG-CB 3.62Å
405	N	92.9	Very high	93.6	Very high	119 Å²	119	39.3 Å²	39.3	64%	0.636	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-37.2	173.5	-172.2	13.5	0	0	0	113	D402 R403	D402-N405 HydrophobicContact CB-CB 4.26Å; D402-N405 WeakPolarHBondContact OD1-CB 3.12Å; D402-N405 PolarHBondContact OD1-N 3.37Å; D402-N405 VanDerWaalsContact OD2-CB 3.24Å; D402-N405 WeakPolarHBondContact OD2-CB 3.41Å; D402-N405 PolarHBondContact OD2-ND2 3.06Å; R403-N405 PolarHBondContact O-N 2.75Å
406	T	92.6	Very high	93.6	Very high	44 Å²	44	41 Å²	41	27%	0.27	24%	0.235	S	C	.	.			trans	-151.9	107.5	178	-61.3	0	0	0	0	113.5	D402 R403 S408 Y409 V433	D402-T406 PolarHBondContact O-N 2.85Å; R403-T406 CarbonylContact O-C 3.58Å; R403-T406 PolarHBondContact O-N 2.84Å; T406-S408 VanDerWaalsContact C-N 3.28Å; T406-S408 WeakPolarHBondContact CG2-O 3.45Å; T406-S408 PolarHBondContact O-N 2.88Å; T406-Y409 HydrophobicContact CG2-CD1 4.16Å; T406-Y409 HydrophobicContact CG2-CD2 4.21Å; T406-Y409 HydrophobicContact CG2-CE1 3.69Å; T406-Y409 HydrophobicContact CG2-CE2 3.77Å; T406-Y409 HydrophobicContact CG2-CG 4.4Å; T406-Y409 VanDerWaalsContact CG2-CZ 3.48Å; T406-V433 WeakPolarHBondContact O-CG2 3.13Å
407	D	92.3	Very high	93.7	Very high	97 Å²	97	41.2 Å²	41.2	52%	0.519	24%	0.236	S	C	.	.	S	Bend	trans	-63.1	-26.8	-176.6	83	-25.6	0	0	0	115	R403 V433	R403-D407 PolarHBondContact O-N 3.1Å; D407-V433 PolarHBondContact O-N 3.13Å
408	S	94.8	Very high	93.6	Very high	18 Å²	18	46.1 Å²	46.1	13%	0.126	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	146.8	-170.3	60.5	0	0	0	0	113.2	T406 K430 V431	T406-S408 VanDerWaalsContact C-N 3.28Å; T406-S408 WeakPolarHBondContact CG2-O 3.45Å; T406-S408 PolarHBondContact O-N 2.88Å; S408-K430 WeakPolarHBondContact OG-CE 3.3Å; S408-K430 PolarHBondContact OG-NZ 2.82Å; S408-V431 CarbonylContact C-O 3.46Å; S408-V431 VanDerWaalsContact CA-O 3.31Å; S408-V431 WeakPolarHBondContact CA-O 3.42Å
409	Y	93.4	Very high	93.6	Very high	39 Å²	39	42.1 Å²	42.1	15%	0.153	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.2	-179.4	-66.6	-89.1	0	0	0	111.1	P382 F383 L401 T406 K430 V431 V433	P382-Y409 VanDerWaalsContact CD-CE1 3.46Å; P382-Y409 HydrophobicContact CG-CD1 4.32Å; P382-Y409 HydrophobicContact CG-CE1 3.73Å; P382-Y409 HydrophobicContact CG-CE2 4.24Å; F383-Y409 HydrophobicContact CE2-CD1 4.01Å; F383-Y409 AromaticContact CE2-CD2 3.83Å; F383-Y409 HydrophobicContact CE2-CD2 3.83Å; F383-Y409 HydrophobicContact CE2-CE2 4.47Å; F383-Y409 AromaticContact CE2-CG 3.55Å; F383-Y409 HydrophobicContact CE2-CG 3.55Å; F383-Y409 AromaticContact CZ-CD2 3.92Å; F383-Y409 HydrophobicContact CZ-CD2 3.92Å; F383-Y409 HydrophobicContact CZ-CG 4.1Å; L401-Y409 HydrophobicContact CD2-CE2 4Å; T406-Y409 HydrophobicContact CG2-CD1 4.16Å; T406-Y409 HydrophobicContact CG2-CD2 4.21Å; T406-Y409 HydrophobicContact CG2-CE1 3.69Å; T406-Y409 HydrophobicContact CG2-CE2 3.77Å; T406-Y409 HydrophobicContact CG2-CG 4.4Å; T406-Y409 VanDerWaalsContact CG2-CZ 3.48Å; Y409-K430 WeakPolarHBondContact O-CA 3.44Å; Y409-V431 PolarHBondContact N-O 2.88Å; Y409-V431 PolarHBondContact O-N 2.65Å; Y409-V433 HydrophobicContact CD2-CG2 4.05Å; Y409-V433 HydrophobicContact CE2-CG2 3.85Å
410	T	94.7	Very high	93.7	Very high	85 Å²	85	49.7 Å²	49.7	52%	0.521	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	95.4	170.7	-57.9	0	0	0	0	108.8	T412 I429	T410-T412 PolarHBondContact O-N 3.13Å; T410-I429 CarbonylContact C-O 3.59Å; T410-I429 WeakPolarHBondContact CA-O 3.37Å
411	I	94.3	Very high	93.9	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	114.1	-177.6	-48	174.9	0	0	0	108.1	I357 I377 F383 I395 S428 I429 V431	I357-I411 HydrophobicContact CG2-CD1 4.39Å; I377-I411 HydrophobicContact CD1-CG2 4.34Å; I377-I411 HydrophobicContact CG1-CG2 4.44Å; I377-I411 HydrophobicContact CG2-CG2 3.83Å; F383-I411 HydrophobicContact CB-CD1 4.19Å; F383-I411 HydrophobicContact CD1-CD1 3.81Å; F383-I411 HydrophobicContact CD2-CD1 3.56Å; F383-I411 HydrophobicContact CD2-CG1 3.85Å; F383-I411 HydrophobicContact CE1-CD1 4.04Å; F383-I411 HydrophobicContact CE2-CD1 3.82Å; F383-I411 HydrophobicContact CE2-CG1 4.09Å; F383-I411 HydrophobicContact CG-CD1 3.56Å; F383-I411 HydrophobicContact CG-CG1 4.31Å; F383-I411 HydrophobicContact CZ-CD1 4.05Å; I395-I411 HydrophobicContact CD1-CG2 4.22Å; I395-I411 HydrophobicContact CG2-CD1 4.01Å; I395-I411 HydrophobicContact CG2-CG2 4.4Å; I411-S428 WeakPolarHBondContact O-CA 3.14Å; I411-I429 HydrophobicContact CB-CG1 4.02Å; I411-I429 PolarHBondContact N-O 3.06Å; I411-I429 PolarHBondContact O-N 2.74Å; I411-V431 HydrophobicContact CD1-CG2 3.93Å; I411-V431 HydrophobicContact CG1-CG2 4.49Å
412	T	95.6	Very high	93.9	Very high	14 Å²	14	53.1 Å²	53.1	9%	0.086	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	117.8	175.2	-57.1	0	0	0	0	109.6	I377 M378 T410 S428	I377-T412 WeakPolarHBondContact CA-O 3.35Å; M378-T412 HydrophobicContact CE-CG2 3.95Å; M378-T412 PolarHBondContact N-O 2.76Å; T410-T412 PolarHBondContact O-N 3.13Å; T412-S428 WeakPolarHBondContact CG2-OG 3.15Å; T412-S428 PolarHBondContact OG1-OG 3.36Å
413	V	95.8	Very high	94	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	139.7	169.2	-71.3	0	0	0	0	109.6	I338 F340 F360 E376 I377 I395 S426 K427	I338-V413 HydrophobicContact CD1-CG2 4.04Å; I338-V413 HydrophobicContact CG2-CG2 3.99Å; F340-V413 HydrophobicContact CE2-CG2 4.24Å; F340-V413 HydrophobicContact CZ-CG2 3.73Å; F360-V413 HydrophobicContact CE1-CG1 3.85Å; F360-V413 HydrophobicContact CE2-CB 4.48Å; F360-V413 HydrophobicContact CE2-CG2 4.38Å; F360-V413 HydrophobicContact CZ-CB 4.06Å; F360-V413 HydrophobicContact CZ-CG1 3.69Å; F360-V413 HydrophobicContact CZ-CG2 4.29Å; E376-V413 WeakPolarHBondContact O-CA 3.49Å; I377-V413 HydrophobicContact CG1-CG1 4.04Å; I395-V413 HydrophobicContact CD1-CG1 3.81Å; I395-V413 HydrophobicContact CG1-CG1 4.5Å; V413-S426 CarbonylContact O-C 3.56Å; V413-S426 WeakPolarHBondContact O-CA 3.5Å; V413-K427 HydrophobicContact CG2-CB 4.41Å; V413-K427 VanDerWaalsContact CG2-O 3.25Å; V413-K427 WeakPolarHBondContact CG2-O 3.26Å; V413-K427 PolarHBondContact N-O 2.65Å; V413-K427 PolarHBondContact O-N 2.96Å
414	V	95.8	Very high	94	Very high	21 Å²	21	53.6 Å²	53.6	13%	0.127	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131.2	173	-177	0	0	0	0	107.7	C375 E376 M378 T425	C375-V414 CarbonylContact C-O 3.58Å; C375-V414 VanDerWaalsContact CA-O 3.31Å; C375-V414 WeakPolarHBondContact CA-O 3.5Å; E376-V414 HydrophobicContact CG-CB 4.32Å; E376-V414 PolarHBondContact N-O 3.27Å; E376-V414 PolarHBondContact O-N 3.08Å; M378-V414 HydrophobicContact CB-CG2 4.02Å; V414-T425 WeakPolarHBondContact CA-O 3.17Å
415	A	95.9	Very high	94.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	130.6	168.3	0	0	0	0	0	108.7	P336 I338 V362 S374 A424 T425	P336-A415 HydrophobicContact CB-CB 3.88Å; I338-A415 HydrophobicContact CD1-CB 3.84Å; I338-A415 HydrophobicContact CG1-CB 3.96Å; V362-A415 HydrophobicContact CG1-CB 3.66Å; V362-A415 HydrophobicContact CG2-CB 4.24Å; S374-A415 WeakPolarHBondContact O-CA 3.27Å; A415-A424 CarbonylContact O-C 3.53Å; A415-A424 VanDerWaalsContact O-CA 3.23Å; A415-A424 WeakPolarHBondContact O-CA 3.25Å; A415-T425 PolarHBondContact N-O 3.41Å; A415-T425 PolarHBondContact O-N 3.37Å
416	T	95.2	Very high	94.2	Very high	36 Å²	36	50.4 Å²	50.4	22%	0.221	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	130.7	-178	-54.6	0	0	0	0	108.2	M373 S374 L423 A424	M373-T416 CarbonylContact C-O 3.56Å; M373-T416 VanDerWaalsContact CA-O 3.23Å; M373-T416 WeakPolarHBondContact CA-O 3.03Å; S374-T416 PolarHBondContact N-O 2.79Å; S374-T416 PolarHBondContact O-N 2.8Å; S374-T416 PolarHBondContact OG-O 3.31Å; T416-L423 WeakPolarHBondContact CA-O 3.46Å; T416-A424 HydrophobicContact CG2-CB 4.12Å; T416-A424 WeakPolarHBondContact OG1-CB 3.06Å
417	D	95.5	Very high	94.3	Very high	5 Å²	5	52.8 Å²	52.8	3%	0.027	30%	0.3	C	S	.	.			trans	-69.1	-164.9	177.7	68.6	36.3	0	0	0	112.9	N332 P336 N370 G419 S422 L423	N332-D417 PolarHBondContact ND2-OD2 3.43Å; N332-D417 PolarHBondContact OD1-OD2 2.93Å; P336-D417 HydrophobicContact CG-CB 4.07Å; N370-D417 WeakPolarHBondContact O-CB 3.31Å; D417-G419 PolarHBondContact OD1-N 2.85Å; D417-S422 WeakPolarHBondContact OD1-CA 3.14Å; D417-S422 WeakPolarHBondContact OD1-CB 3.22Å; D417-L423 PolarHBondContact N-O 2.88Å; D417-L423 PolarHBondContact OD1-N 3.34Å; D417-L423 VanDerWaalsContact OD1-N 3.12Å; D417-L423 VanDerWaalsContact OD2-CA 3.26Å; D417-L423 WeakPolarHBondContact OD2-CA 3.38Å; D417-L423 WeakPolarHBondContact OD2-CB 3.02Å; D417-L423 PolarHBondContact OD2-N 3.23Å
418	K	93.6	Very high	94.4	Very high	103 Å²	103	51.4 Å²	51.4	45%	0.448	30%	0.298	S	S	.	.			trans	-125.3	21.6	167.2	-69.6	175.4	-171.6	-175.4	0	113.3	E369 Q372	E369-K418 WeakPolarHBondContact O-CB 3.26Å; Q372-K418 HydrophobicContact CB-CD 4.35Å; Q372-K418 HydrophobicContact CG-CD 4.34Å; Q372-K418 WeakPolarHBondContact O-CD 3.42Å; Q372-K418 WeakPolarHBondContact O-CE 3.11Å; Q372-K418 VanDerWaalsContact O-CG 3.27Å; Q372-K418 WeakPolarHBondContact O-CG 3.23Å
419	G	91.6	Very high	94.4	Very high	5 Å²	5	51.4 Å²	51.4	5%	0.052	30%	0.296	C	S	.	.			trans	-62.7	172.7	174.4	0	0	0	0	0	113.8	N332 D417 P421 S422	N332-G419 WeakPolarHBondContact OD1-CA 3.4Å; N332-G419 PolarHBondContact OD1-N 2.84Å; D417-G419 PolarHBondContact OD1-N 2.85Å; G419-P421 VanDerWaalsContact C-C 3.43Å; G419-P421 CarbonylContact C-O 3.57Å; G419-P421 VanDerWaalsContact C-O 3.28Å; G419-P421 CarbonylContact O-C 3.48Å; G419-S422 WeakPolarHBondContact O-CA 3.35Å; G419-S422 WeakPolarHBondContact O-CB 3.45Å; G419-S422 PolarHBondContact O-N 2.9Å
420	Q	89.3	Confident	94.5	Very high	186 Å²	186	54.5 Å²	54.5	87%	0.869	31%	0.31	S	S	*	.	S	Bend	trans	-136.2	99.2	171.2	-65.1	-172.2	26.8	0	0	109.9
421	P	92.6	Very high	94.4	Very high	104 Å²	104	50.5 Å²	50.5	68%	0.675	29%	0.286	S	S	*	.	S	Bend	cis	-67.5	153.6	2.2	32	-37	0	0	0	112.7	G419	G419-P421 VanDerWaalsContact C-C 3.43Å; G419-P421 CarbonylContact C-O 3.57Å; G419-P421 VanDerWaalsContact C-O 3.28Å; G419-P421 CarbonylContact O-C 3.48Å
422	S	94.3	Very high	94.4	Very high	72 Å²	72	54.4 Å²	54.4	50%	0.503	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-86.7	130.1	174.9	59.3	0	0	0	0	111.3	D417 G419	D417-S422 WeakPolarHBondContact OD1-CA 3.14Å; D417-S422 WeakPolarHBondContact OD1-CB 3.22Å; G419-S422 WeakPolarHBondContact O-CA 3.35Å; G419-S422 WeakPolarHBondContact O-CB 3.45Å; G419-S422 PolarHBondContact O-N 2.9Å
423	L	94.6	Very high	94.4	Very high	50 Å²	50	54.2 Å²	54.2	26%	0.262	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-97.1	155.7	176.3	-49.5	174.8	0	0	0	110.8	N332 N334 T335 T416 D417	N332-L423 WeakPolarHBondContact ND2-CD1 3.36Å; N332-L423 WeakPolarHBondContact ND2-CG 3.08Å; N334-L423 WeakPolarHBondContact O-CD1 3.15Å; T335-L423 HydrophobicContact CG2-CB 4.13Å; T335-L423 HydrophobicContact CG2-CD1 4.08Å; T416-L423 WeakPolarHBondContact CA-O 3.46Å; D417-L423 PolarHBondContact N-O 2.88Å; D417-L423 PolarHBondContact OD1-N 3.34Å; D417-L423 VanDerWaalsContact OD1-N 3.12Å; D417-L423 VanDerWaalsContact OD2-CA 3.26Å; D417-L423 WeakPolarHBondContact OD2-CA 3.38Å; D417-L423 WeakPolarHBondContact OD2-CB 3.02Å; D417-L423 PolarHBondContact OD2-N 3.23Å
424	A	95.1	Very high	94.2	Very high	60 Å²	60	56.2 Å²	56.2	50%	0.496	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	142.2	-175.8	0	0	0	0	0	112.6	A415 T416	A415-A424 CarbonylContact O-C 3.53Å; A415-A424 VanDerWaalsContact O-CA 3.23Å; A415-A424 WeakPolarHBondContact O-CA 3.25Å; T416-A424 HydrophobicContact CG2-CB 4.12Å; T416-A424 WeakPolarHBondContact OG1-CB 3.06Å
425	T	96.4	Very high	94.1	Very high	34 Å²	34	56.7 Å²	56.7	21%	0.209	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.7	178.3	-60.8	0	0	0	0	109.7	P336 I338 V414 A415	P336-T425 WeakPolarHBondContact O-CB 3.45Å; P336-T425 WeakPolarHBondContact O-CG2 3.33Å; P336-T425 PolarHBondContact O-OG1 3.43Å; I338-T425 HydrophobicContact CD1-CG2 4.33Å; I338-T425 WeakPolarHBondContact CD1-O 3.48Å; I338-T425 HydrophobicContact CG1-CG2 4.29Å; V414-T425 WeakPolarHBondContact CA-O 3.17Å; A415-T425 PolarHBondContact N-O 3.41Å; A415-T425 PolarHBondContact O-N 3.37Å
426	S	95.6	Very high	94	Very high	83 Å²	83	59.5 Å²	59.5	58%	0.58	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.6	173.4	62.4	0	0	0	0	111.4	V413	V413-S426 CarbonylContact O-C 3.56Å; V413-S426 WeakPolarHBondContact O-CA 3.5Å
427	K	94.9	Very high	93.9	Very high	94 Å²	94	59.1 Å²	59.1	41%	0.409	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	133.9	176.2	-156.6	166.6	-176.3	163	0	110.6	I338 F340 V413	I338-K427 HydrophobicContact CB-CB 4.17Å; I338-K427 HydrophobicContact CB-CD 3.96Å; I338-K427 HydrophobicContact CD1-CB 4.15Å; I338-K427 HydrophobicContact CG2-CB 4.13Å; I338-K427 HydrophobicContact CG2-CD 4.06Å; I338-K427 VanDerWaalsContact O-CD 3.26Å; I338-K427 WeakPolarHBondContact O-CD 3.26Å; I338-K427 PolarHBondContact O-NZ 2.89Å; F340-K427 HydrophobicContact CD2-CD 4.16Å; F340-K427 HydrophobicContact CD2-CG 4.48Å; F340-K427 HydrophobicContact CE2-CB 4.21Å; F340-K427 HydrophobicContact CE2-CD 4.06Å; F340-K427 HydrophobicContact CE2-CG 3.97Å; V413-K427 HydrophobicContact CG2-CB 4.41Å; V413-K427 VanDerWaalsContact CG2-O 3.25Å; V413-K427 WeakPolarHBondContact CG2-O 3.26Å; V413-K427 PolarHBondContact N-O 2.65Å; V413-K427 PolarHBondContact O-N 2.96Å
428	S	94.5	Very high	93.8	Very high	68 Å²	68	64.2 Å²	64.2	48%	0.476	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	142.7	-174	-48.8	0	0	0	0	111.9	I411 T412	I411-S428 WeakPolarHBondContact O-CA 3.14Å; T412-S428 WeakPolarHBondContact CG2-OG 3.15Å; T412-S428 PolarHBondContact OG1-OG 3.36Å
429	I	94.4	Very high	93.7	Very high	18 Å²	18	61.6 Å²	61.6	9%	0.092	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144	165.6	56	169.7	0	0	0	109	F340 V343 A358 I395 T410 I411 V431	F340-I429 HydrophobicContact CD1-CG2 4.16Å; F340-I429 HydrophobicContact CD2-CG2 4.16Å; F340-I429 HydrophobicContact CE1-CD1 4.08Å; F340-I429 HydrophobicContact CE1-CG1 4.47Å; F340-I429 HydrophobicContact CE1-CG2 3.78Å; F340-I429 HydrophobicContact CE2-CG2 3.78Å; F340-I429 HydrophobicContact CG-CG2 4.34Å; F340-I429 HydrophobicContact CZ-CG1 4.43Å; F340-I429 HydrophobicContact CZ-CG2 3.57Å; V343-I429 HydrophobicContact CG1-CB 4.26Å; V343-I429 HydrophobicContact CG1-CD1 3.93Å; V343-I429 HydrophobicContact CG1-CG2 4.22Å; V343-I429 HydrophobicContact CG2-CG2 4.05Å; A358-I429 HydrophobicContact CB-CD1 3.88Å; I395-I429 HydrophobicContact CD1-CD1 3.98Å; T410-I429 CarbonylContact C-O 3.59Å; T410-I429 WeakPolarHBondContact CA-O 3.37Å; I411-I429 HydrophobicContact CB-CG1 4.02Å; I411-I429 PolarHBondContact N-O 3.06Å; I411-I429 PolarHBondContact O-N 2.74Å; I429-V431 HydrophobicContact CD1-CG2 3.98Å; I429-V431 HydrophobicContact CG1-CG2 4.28Å
430	K	94	Very high	93.8	Very high	104 Å²	104	63.3 Å²	63.3	45%	0.452	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	132.2	167.3	-173.1	173.7	-179.4	177.3	0	108.8	S408 Y409 H432	S408-K430 WeakPolarHBondContact OG-CE 3.3Å; S408-K430 PolarHBondContact OG-NZ 2.82Å; Y409-K430 WeakPolarHBondContact O-CA 3.44Å; K430-H432 VanDerWaalsContact CE-NE2 3.34Å; K430-H432 WeakPolarHBondContact CE-NE2 3.42Å
431	V	93.8	Very high	94.2	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.4	179.9	-177	0	0	0	0	107.3	V347 I357 S408 Y409 I411 I429	V347-V431 HydrophobicContact CG1-CG1 3.91Å; I357-V431 HydrophobicContact CG2-CB 4.35Å; I357-V431 HydrophobicContact CG2-CG1 3.83Å; I357-V431 HydrophobicContact CG2-CG2 3.61Å; S408-V431 CarbonylContact C-O 3.46Å; S408-V431 VanDerWaalsContact CA-O 3.31Å; S408-V431 WeakPolarHBondContact CA-O 3.42Å; Y409-V431 PolarHBondContact N-O 2.88Å; Y409-V431 PolarHBondContact O-N 2.65Å; I411-V431 HydrophobicContact CD1-CG2 3.93Å; I411-V431 HydrophobicContact CG1-CG2 4.49Å; I429-V431 HydrophobicContact CD1-CG2 3.98Å; I429-V431 HydrophobicContact CG1-CG2 4.28Å
432	H	94.1	Very high	94.3	Very high	83 Å²	83	58.6 Å²	58.6	38%	0.384	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	144.2	176.9	-75.5	-96.8	0	0	0	110.8	E345 S346 V347 K430	E345-H432 PolarHBondContact O-N 2.93Å; S346-H432 CarbonylContact C-O 3.6Å; S346-H432 WeakPolarHBondContact CA-O 3.31Å; V347-H432 PolarHBondContact N-O 2.93Å; K430-H432 VanDerWaalsContact CE-NE2 3.34Å; K430-H432 WeakPolarHBondContact CE-NE2 3.42Å
433	V	94.6	Very high	94.4	Very high	11 Å²	11	55.9 Å²	55.9	7%	0.067	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.2	165.1	-167.6	0	0	0	0	107.2	V347 E349 L401 R403 T406 D407 Y409	V347-V433 CarbonylContact O-C 3.54Å; V347-V433 WeakPolarHBondContact O-CA 3.46Å; E349-V433 HydrophobicContact CB-CG1 3.91Å; L401-V433 HydrophobicContact CB-CG1 4.28Å; R403-V433 HydrophobicContact CB-CB 4.01Å; R403-V433 HydrophobicContact CB-CG1 3.75Å; R403-V433 HydrophobicContact CG-CB 4.13Å; R403-V433 HydrophobicContact CG-CG1 4.33Å; T406-V433 WeakPolarHBondContact O-CG2 3.13Å; D407-V433 PolarHBondContact O-N 3.13Å; Y409-V433 HydrophobicContact CD2-CG2 4.05Å; Y409-V433 HydrophobicContact CE2-CG2 3.85Å
434	S	93.5	Very high	94.4	Very high	42 Å²	42	57.4 Å²	57.4	29%	0.294	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.6	176.9	64.4	0	0	0	0	111.2	V347 S348	V347-S434 PolarHBondContact O-N 2.94Å; S348-S434 VanDerWaalsContact CA-O 3.26Å; S348-S434 WeakPolarHBondContact CA-O 3.16Å; S348-S434 WeakPolarHBondContact CA-OG 3.37Å; S348-S434 WeakPolarHBondContact CB-O 3.44Å; S348-S434 VanDerWaalsContact CB-OG 3.23Å; S348-S434 WeakPolarHBondContact CB-OG 3.19Å; S348-S434 PolarHBondContact N-OG 3.39Å
435	D	93.3	Very high	94.3	Very high	31 Å²	31	59.4 Å²	59.4	17%	0.166	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-47.2	131.5	179.7	-155.9	93.9	0	0	0	114.5	E349 R403 I472 N475	E349-D435 VanDerWaalsContact OE1-CA 3.24Å; E349-D435 WeakPolarHBondContact OE1-CA 3.37Å; R403-D435 VanDerWaalsContact CD-OD1 3.26Å; R403-D435 WeakPolarHBondContact CD-OD1 3.4Å; R403-D435 IonicContact CZ-OD1 3.93Å; R403-D435 IonicContact NE-OD1 3.19Å; R403-D435 PolarHBondContact NE-OD1 2.83Å; R403-D435 IonicContact NH1-OD1 2.6Å; R403-D435 IonicContact NH2-OD1 2.59Å; D435-I472 HydrophobicContact CB-CG2 3.75Å; D435-I472 WeakPolarHBondContact OD1-CB 3.48Å; D435-I472 VanDerWaalsContact OD1-CG2 3.31Å; D435-I472 WeakPolarHBondContact OD1-CG2 3.49Å; D435-I472 PolarHBondContact OD1-N 2.84Å; D435-I472 PolarHBondContact OD2-N 3.31Å; D435-N475 WeakPolarHBondContact OD2-CB 3.16Å; D435-N475 PolarHBondContact OD2-ND2 3.07Å
436	E	92.9	Very high	94.2	Very high	59 Å²	59	61.5 Å²	61.5	28%	0.276	33%	0.332	S	S	.	.			trans	-122.4	143.3	168.2	-65.3	-89.5	-175.1	0	0	108.7	S348 E349 Q350 D438	S348-E436 WeakPolarHBondContact CB-OE1 3.31Å; S348-E436 PolarHBondContact OG-OE1 3.42Å; E349-E436 HydrophobicContact CG-CB 4.21Å; E349-E436 HydrophobicContact CG-CG 4.22Å; E349-E436 PolarHBondContact OE1-N 3.3Å; Q350-E436 HydrophobicContact CB-CG 3.98Å; Q350-E436 PolarHBondContact NE2-OE2 3.12Å; E436-D438 VanDerWaalsContact C-N 3.29Å; E436-D438 PolarHBondContact O-N 3.05Å
437	N	94.1	Very high	94.2	Very high	29 Å²	29	60.8 Å²	60.8	16%	0.155	32%	0.324	C	S	.	.	S	Bend	trans	-75.5	79.3	-176.2	-159.1	103.6	0	0	0	111.2	D471 N475 D527 G529 L533	N437-D471 WeakPolarHBondContact CA-OD2 3.22Å; N437-N475 HydrophobicContact CB-CB 4.13Å; N437-N475 PolarHBondContact N-ND2 2.81Å; N437-N475 WeakPolarHBondContact OD1-CA 3.17Å; N437-N475 WeakPolarHBondContact OD1-CB 3.43Å; N437-N475 VanDerWaalsContact OD1-CG 3.26Å; N437-N475 PolarHBondContact OD1-OD1 3.24Å; N437-D527 PolarHBondContact ND2-OD2 2.84Å; N437-G529 VanDerWaalsContact OD1-CA 3.3Å; N437-G529 WeakPolarHBondContact OD1-CA 3.27Å; N437-L533 WeakPolarHBondContact ND2-CD1 3.33Å; N437-L533 WeakPolarHBondContact ND2-CG 3.49Å
438	D	92	Very high	94.3	Very high	111 Å²	111	56.5 Å²	56.5	59%	0.594	31%	0.305	S	S	*	.			trans	-107.8	-30.2	-167.1	157.9	-74.4	0	0	0	111.6	E436 D471	E436-D438 VanDerWaalsContact C-N 3.29Å; E436-D438 PolarHBondContact O-N 3.05Å; D438-D471 PolarHBondContact N-OD2 3.02Å
439	N	92.8	Very high	94.4	Very high	48 Å²	48	57.1 Å²	57.1	26%	0.257	30%	0.303	S	S	.	.	S	Bend	trans	-94.2	162.1	172.1	-62	-85.2	0	0	0	111.5	P470 D471 L533	N439-P470 HydrophobicContact CB-CB 4.36Å; N439-P470 HydrophobicContact CB-CG 3.84Å; N439-D471 VanDerWaalsContact CB-OD1 3.28Å; N439-D471 WeakPolarHBondContact CB-OD1 3.41Å; N439-D471 PolarHBondContact N-OD2 2.83Å; N439-D471 PolarHBondContact ND2-OD1 2.88Å; N439-L533 VanDerWaalsContact O-CD1 3.25Å; N439-L533 WeakPolarHBondContact O-CD1 3.27Å
440	A	94.1	Very high	94.5	Very high	41 Å²	41	56.3 Å²	56.3	34%	0.339	30%	0.299	S	S	.	.			trans	-120.3	143.6	177.6	0	0	0	0	0	110.4	R442 L533	A440-R442 PolarHBondContact O-N 3.27Å; A440-R442 VanDerWaalsContact O-N 3.09Å; A440-L533 HydrophobicContact CB-CB 3.81Å; A440-L533 HydrophobicContact CB-CD1 4.49Å
441	P	96.4	Very high	94.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.			trans	-57.6	117.7	-175.7	-26.3	30.5	0	0	0	111.7	A467 D469 I478 A525 D527 S535	P441-A467 HydrophobicContact CB-CB 4.32Å; P441-D469 WeakPolarHBondContact CA-OD2 3.42Å; P441-D469 WeakPolarHBondContact CD-OD2 3.43Å; P441-D469 VanDerWaalsContact CG-OD2 3.23Å; P441-D469 WeakPolarHBondContact CG-OD2 3.44Å; P441-I478 HydrophobicContact CB-CD1 4.13Å; P441-I478 HydrophobicContact CB-CG1 4.05Å; P441-I478 HydrophobicContact CB-CG2 4.2Å; P441-I478 HydrophobicContact CG-CG1 4.32Å; P441-A525 HydrophobicContact CB-CB 4.01Å; P441-D527 HydrophobicContact CG-CB 3.9Å; P441-S535 WeakPolarHBondContact O-CB 3.01Å; P441-S535 PolarHBondContact O-OG 2.7Å
442	R	95.2	Very high	94.6	Very high	192 Å²	192	59 Å²	59	73%	0.725	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.9	-170.9	-179.1	-179.8	165.5	-150.3	-7.6	112	A440 A467 L468	A440-R442 PolarHBondContact O-N 3.27Å; A440-R442 VanDerWaalsContact O-N 3.09Å; R442-A467 CarbonylContact O-C 3.57Å; R442-A467 VanDerWaalsContact O-CA 3.24Å; R442-A467 WeakPolarHBondContact O-CA 3.07Å; R442-L468 PolarHBondContact N-O 2.98Å; R442-L468 PolarHBondContact O-N 3.49Å
443	F	96.5	Very high	94.6	Very high	14 Å²	14	58.3 Å²	58.3	6%	0.061	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	142.7	171.8	-75.2	-76.5	0	0	0	113.3	Q445 Y448 V465 T466 A467 Y480 V523 A525 S535 A537	F443-Q445 WeakPolarHBondContact CB-O 3.42Å; F443-Q445 PolarHBondContact O-N 2.88Å; F443-Y448 HydrophobicContact CB-CE2 4.41Å; F443-Y448 HydrophobicContact CD1-CE2 4.04Å; F443-Y448 HydrophobicContact CG-CE2 4.46Å; F443-V465 HydrophobicContact CD1-CB 4.37Å; F443-V465 HydrophobicContact CE1-CB 4Å; F443-V465 HydrophobicContact CE1-CG2 3.96Å; F443-T466 WeakPolarHBondContact CA-O 3.3Å; F443-A467 HydrophobicContact CD1-CB 4.08Å; F443-A467 HydrophobicContact CE1-CB 4.36Å; F443-A467 HydrophobicContact CG-CB 4.25Å; F443-Y480 HydrophobicContact CE1-CD1 4.13Å; F443-Y480 AromaticContact CE1-CE1 3.91Å; F443-Y480 HydrophobicContact CE1-CE1 3.91Å; F443-Y480 HydrophobicContact CZ-CD1 4.33Å; F443-Y480 HydrophobicContact CZ-CE1 4.43Å; F443-V523 HydrophobicContact CE1-CG2 3.79Å; F443-V523 HydrophobicContact CE2-CG2 4.19Å; F443-V523 HydrophobicContact CZ-CB 4.12Å; F443-V523 HydrophobicContact CZ-CG2 3.53Å; F443-A525 HydrophobicContact CD2-CB 4.25Å; F443-A525 HydrophobicContact CE1-CB 4.04Å; F443-A525 HydrophobicContact CE2-CB 3.55Å; F443-A525 HydrophobicContact CZ-CB 3.43Å; F443-A525 VanDerWaalsContact CZ-CB 3.43Å; F443-S535 WeakPolarHBondContact CD2-OG 3.29Å; F443-S535 WeakPolarHBondContact CE2-O 3.49Å; F443-A537 HydrophobicContact CB-CB 3.93Å; F443-A537 HydrophobicContact CD1-CB 4.12Å; F443-A537 HydrophobicContact CD2-CB 3.5Å; F443-A537 VanDerWaalsContact CD2-CB 3.5Å; F443-A537 HydrophobicContact CE2-CB 3.95Å; F443-A537 HydrophobicContact CG-CB 3.59Å; F443-A537 HydrophobicContact CZ-CB 4.44Å
444	T	94.6	Very high	94.5	Very high	83 Å²	83	57.9 Å²	57.9	51%	0.509	31%	0.307	S	S	.	.	S	Bend	trans	-65.9	-25.6	176.1	54.3	0	0	0	0	112.8	Y448 T466	T444-Y448 PolarHBondContact N-OH 2.79Å; T444-Y448 PolarHBondContact OG1-OH 3.44Å; T444-T466 HydrophobicContact CG2-CG2 4.38Å; T444-T466 WeakPolarHBondContact CG2-O 3.5Å; T444-T466 PolarHBondContact N-O 3.18Å; T444-T466 PolarHBondContact OG1-O 3.25Å
445	Q	93.4	Very high	94.5	Very high	101 Å²	101	60.2 Å²	60.2	47%	0.472	32%	0.316	S	S	.	.			trans	-135.8	142.9	173.8	-57.1	-178.1	-27.4	0	0	109.4	F443 V447 Y448	F443-Q445 WeakPolarHBondContact CB-O 3.42Å; F443-Q445 PolarHBondContact O-N 2.88Å; Q445-V447 VanDerWaalsContact C-N 3.32Å; Q445-Y448 HydrophobicContact CB-CD1 4.17Å; Q445-Y448 HydrophobicContact CB-CD2 4.38Å; Q445-Y448 HydrophobicContact CB-CE1 3.83Å; Q445-Y448 HydrophobicContact CB-CE2 4.07Å; Q445-Y448 HydrophobicContact CB-CG 4.42Å; Q445-Y448 HydrophobicContact CG-CD1 4.43Å; Q445-Y448 HydrophobicContact CG-CE1 4.01Å; Q445-Y448 PolarHBondContact N-OH 3.21Å; Q445-Y448 WeakPolarHBondContact O-CE2 3.37Å
446	A	93.1	Very high	94.5	Very high	79 Å²	79	59.5 Å²	59.5	65%	0.653	31%	0.312	S	S	*	.	S	Bend	trans	-77.2	-23.1	174.5	0	0	0	0	0	112.6	T538	A446-T538 PolarHBondContact O-N 2.89Å
447	V	96.4	Very high	94.6	Very high	68 Å²	68	61.8 Å²	61.8	41%	0.412	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	131.1	177.4	-175.8	0	0	0	0	108	Q445 T538 N540	Q445-V447 VanDerWaalsContact C-N 3.32Å; V447-T538 CarbonylContact C-O 3.53Å; V447-T538 VanDerWaalsContact CA-O 3.28Å; V447-T538 WeakPolarHBondContact CA-O 3.39Å; V447-N540 WeakPolarHBondContact CG1-ND2 3.34Å
448	Y	96.4	Very high	94.6	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.016	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.4	174.7	-64.3	-94.4	0	0	0	109.2	F443 T444 Q445 V465 T466 A537 T538 V539 N540	F443-Y448 HydrophobicContact CB-CE2 4.41Å; F443-Y448 HydrophobicContact CD1-CE2 4.04Å; F443-Y448 HydrophobicContact CG-CE2 4.46Å; T444-Y448 PolarHBondContact N-OH 2.79Å; T444-Y448 PolarHBondContact OG1-OH 3.44Å; Q445-Y448 HydrophobicContact CB-CD1 4.17Å; Q445-Y448 HydrophobicContact CB-CD2 4.38Å; Q445-Y448 HydrophobicContact CB-CE1 3.83Å; Q445-Y448 HydrophobicContact CB-CE2 4.07Å; Q445-Y448 HydrophobicContact CB-CG 4.42Å; Q445-Y448 HydrophobicContact CG-CD1 4.43Å; Q445-Y448 HydrophobicContact CG-CE1 4.01Å; Q445-Y448 PolarHBondContact N-OH 3.21Å; Q445-Y448 WeakPolarHBondContact O-CE2 3.37Å; Y448-V465 HydrophobicContact CD1-CG1 4.22Å; Y448-V465 HydrophobicContact CD2-CG1 3.79Å; Y448-V465 HydrophobicContact CE1-CG1 4.31Å; Y448-V465 HydrophobicContact CE2-CB 4.16Å; Y448-V465 HydrophobicContact CE2-CG1 3.87Å; Y448-V465 HydrophobicContact CG-CG1 3.98Å; Y448-T466 PolarHBondContact OH-O 3.16Å; Y448-A537 HydrophobicContact CD2-CB 4.2Å; Y448-A537 HydrophobicContact CE2-CB 3.86Å; Y448-T538 PolarHBondContact N-O 3.41Å; Y448-V539 WeakPolarHBondContact O-CA 3.45Å; Y448-N540 PolarHBondContact O-N 3.04Å
449	D	96.5	Very high	94.6	Very high	81 Å²	81	61.1 Å²	61.1	43%	0.433	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	112.6	174.2	-64.3	-36.3	0	0	0	109.9	Y451 N540 I542	D449-Y451 HydrophobicContact CB-CE2 4.27Å; D449-N540 WeakPolarHBondContact OD1-CB 3.4Å; D449-N540 PolarHBondContact OD1-ND2 2.87Å; D449-I542 HydrophobicContact CB-CD1 4.34Å
450	V	95.8	Very high	94.6	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	105	-170.8	-178.1	0	0	0	0	109.8	V452 I462 H463 V539 N540 V541 I542	V450-V452 HydrophobicContact CG1-CG2 3.89Å; V450-I462 HydrophobicContact CG1-CB 4.23Å; V450-I462 HydrophobicContact CG1-CD1 4.46Å; V450-I462 HydrophobicContact CG1-CG1 4.48Å; V450-H463 HydrophobicContact CB-CB 4.44Å; V450-H463 HydrophobicContact CG1-CB 3.8Å; V450-H463 HydrophobicContact CG2-CB 3.72Å; V450-V539 HydrophobicContact CB-CG1 4.41Å; V450-V539 HydrophobicContact CG2-CG1 3.61Å; V450-N540 PolarHBondContact N-O 2.89Å; V450-V541 HydrophobicContact CB-CG2 4.35Å; V450-V541 WeakPolarHBondContact O-CA 3.29Å; V450-I542 PolarHBondContact O-N 3.19Å
451	Y	95.4	Very high	94.7	Very high	153 Å²	153	63.6 Å²	63.6	60%	0.6	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	115.9	176.4	-61.6	-85.4	0	0	0	110.4	D449 I542 V544	D449-Y451 HydrophobicContact CB-CE2 4.27Å; Y451-I542 WeakPolarHBondContact CA-O 3.39Å; Y451-I542 HydrophobicContact CD1-CB 3.95Å; Y451-I542 HydrophobicContact CD1-CD1 4.38Å; Y451-I542 HydrophobicContact CD1-CG2 3.94Å; Y451-I542 HydrophobicContact CE1-CB 4.04Å; Y451-I542 HydrophobicContact CE1-CD1 3.68Å; Y451-I542 HydrophobicContact CE1-CG1 4.47Å; Y451-I542 HydrophobicContact CE1-CG2 3.89Å; Y451-V544 HydrophobicContact CD1-CG2 4.06Å
452	V	96	Very high	94.7	Very high	9 Å²	9	64.7 Å²	64.7	6%	0.055	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.4	177.2	-170.9	0	0	0	0	107.7	V450 N456 I462 F511 V541 I542 I543 V544	V450-V452 HydrophobicContact CG1-CG2 3.89Å; V452-N456 HydrophobicContact CG1-CB 4.31Å; V452-I462 HydrophobicContact CB-CG2 4.45Å; V452-I462 HydrophobicContact CG1-CG2 3.81Å; V452-I462 HydrophobicContact CG2-CB 3.83Å; V452-I462 HydrophobicContact CG2-CD1 4.27Å; V452-I462 HydrophobicContact CG2-CG2 3.69Å; V452-F511 HydrophobicContact CB-CD2 4.4Å; V452-F511 HydrophobicContact CB-CE2 4.48Å; V452-F511 HydrophobicContact CG1-CD2 3.88Å; V452-F511 HydrophobicContact CG1-CE2 3.99Å; V452-V541 HydrophobicContact CB-CG1 4.37Å; V452-V541 HydrophobicContact CG2-CG1 3.84Å; V452-I542 PolarHBondContact N-O 3.1Å; V452-I543 CarbonylContact O-C 3.45Å; V452-I543 VanDerWaalsContact O-CA 3.29Å; V452-I543 WeakPolarHBondContact O-CA 2.91Å; V452-V544 PolarHBondContact O-N 3.34Å
453	T	93.4	Very high	94.7	Very high	69 Å²	69	58.4 Å²	58.4	42%	0.423	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	144.6	170.7	56.7	0	0	0	0	110.2	N456 V544	T453-N456 WeakPolarHBondContact O-CB 3.47Å; T453-V544 WeakPolarHBondContact CA-O 3.45Å
454	E	93.6	Very high	94.7	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	172.8	162	60.8	158.1	-103.5	0	0	112.5	N456 I543 V544 D545 Q546	E454-N456 PolarHBondContact O-N 2.82Å; E454-I543 HydrophobicContact CB-CG2 3.97Å; E454-V544 WeakPolarHBondContact CG-O 3.15Å; E454-V544 PolarHBondContact N-O 3.33Å; E454-D545 WeakPolarHBondContact OE2-CA 3.14Å; E454-Q546 HydrophobicContact CG-CB 3.83Å; E454-Q546 HydrophobicContact CG-CG 3.77Å; E454-Q546 PolarHBondContact OE2-N 2.85Å
455	N	92.7	Very high	94.8	Very high	92 Å²	92	55.3 Å²	55.3	49%	0.492	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	21.9	176.9	-87.5	-60.7	0	0	0	113.2	F511 D548	N455-F511 PolarHBondContact N-O 3.48Å; N455-D548 PolarHBondContact ND2-OD2 2.85Å
456	N	93.8	Very high	94.9	Very high	15 Å²	15	53.3 Å²	53.3	8%	0.08	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-66.9	155	-177.2	65.5	-76.4	0	0	0	112.5	V452 T453 E454 P458 A507 R509 S510 F511	V452-N456 HydrophobicContact CG1-CB 4.31Å; T453-N456 WeakPolarHBondContact O-CB 3.47Å; E454-N456 PolarHBondContact O-N 2.82Å; N456-P458 WeakPolarHBondContact O-CD 3.48Å; N456-A507 WeakPolarHBondContact ND2-CB 3.15Å; N456-R509 PolarHBondContact ND2-O 3.38Å; N456-S510 VanDerWaalsContact O-CA 3.31Å; N456-S510 WeakPolarHBondContact O-CA 3.34Å; N456-S510 VanDerWaalsContact O-CB 3.23Å; N456-S510 WeakPolarHBondContact O-CB 3.43Å; N456-S510 WeakPolarHBondContact OD1-CA 3.41Å; N456-F511 WeakPolarHBondContact OD1-CD2 3.44Å; N456-F511 PolarHBondContact OD1-N 3.28Å
457	V	94.1	Very high	95	Very high	107 Å²	107	49.7 Å²	49.7	65%	0.648	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-68.9	127.5	176.7	-176.9	0	0	0	0	110.2	G459 A460	V457-G459 PolarHBondContact O-N 2.83Å; V457-A460 HydrophobicContact CB-CB 4.42Å; V457-A460 WeakPolarHBondContact O-CB 3.34Å; V457-A460 PolarHBondContact O-N 2.99Å; V457-A460 VanDerWaalsContact O-N 3.13Å
458	P	93.9	Very high	94.9	Very high	79 Å²	79	52 Å²	52	51%	0.513	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	133.4	169.6	-24.3	34.7	0	0	0	111.8	N456	N456-P458 WeakPolarHBondContact O-CD 3.48Å
459	G	92.3	Very high	94.9	Very high	48 Å²	48	53 Å²	53	50%	0.495	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	4	-171.8	0	0	0	0	0	114.7	V457 A507	V457-G459 PolarHBondContact O-N 2.83Å; G459-A507 WeakPolarHBondContact CA-O 3.47Å; G459-A507 PolarHBondContact N-O 3.48Å
460	A	93.9	Very high	94.8	Very high	33 Å²	33	52.3 Å²	52.3	27%	0.273	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	140.3	176.4	0	0	0	0	0	112.3	V457 Y506 A507	V457-A460 HydrophobicContact CB-CB 4.42Å; V457-A460 WeakPolarHBondContact O-CB 3.34Å; V457-A460 PolarHBondContact O-N 2.99Å; V457-A460 VanDerWaalsContact O-N 3.13Å; A460-Y506 CarbonylContact O-C 3.58Å; A460-Y506 VanDerWaalsContact O-CA 3.25Å; A460-Y506 WeakPolarHBondContact O-CA 2.83Å; A460-A507 PolarHBondContact O-N 2.65Å
461	F	96.1	Very high	94.8	Very high	107 Å²	107	52.7 Å²	52.7	47%	0.469	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	134.6	167.1	169.7	-93.2	0	0	0	110.2	H463 A464 Y504 Y506	F461-H463 VanDerWaalsContact CE2-C 3.44Å; F461-H463 WeakPolarHBondContact CE2-O 3.23Å; F461-H463 WeakPolarHBondContact CZ-O 3.4Å; F461-A464 HydrophobicContact CE2-CB 4.24Å; F461-A464 HydrophobicContact CZ-CB 4.15Å; F461-Y504 HydrophobicContact CD2-CD2 4.18Å; F461-Y504 HydrophobicContact CD2-CG 4.18Å; F461-Y504 HydrophobicContact CE2-CD1 4.09Å; F461-Y504 AromaticContact CE2-CD2 3.96Å; F461-Y504 HydrophobicContact CE2-CD2 3.96Å; F461-Y504 AromaticContact CE2-CG 3.72Å; F461-Y504 HydrophobicContact CE2-CG 3.72Å; F461-Y506 HydrophobicContact CB-CD1 4.07Å; F461-Y506 HydrophobicContact CB-CE1 3.93Å; F461-Y506 HydrophobicContact CD2-CE1 4.47Å
462	I	95.5	Very high	94.7	Very high	23 Å²	23	50.2 Å²	50.2	12%	0.118	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	-34.1	-179.3	55.5	170.4	0	0	0	113.6	V450 V452 V496 L505 A507 V541	V450-I462 HydrophobicContact CG1-CB 4.23Å; V450-I462 HydrophobicContact CG1-CD1 4.46Å; V450-I462 HydrophobicContact CG1-CG1 4.48Å; V452-I462 HydrophobicContact CB-CG2 4.45Å; V452-I462 HydrophobicContact CG1-CG2 3.81Å; V452-I462 HydrophobicContact CG2-CB 3.83Å; V452-I462 HydrophobicContact CG2-CD1 4.27Å; V452-I462 HydrophobicContact CG2-CG2 3.69Å; I462-V496 HydrophobicContact CD1-CG1 3.97Å; I462-L505 HydrophobicContact CD1-CB 4.35Å; I462-L505 HydrophobicContact CG1-CB 3.91Å; I462-L505 WeakPolarHBondContact CG1-O 3.41Å; I462-L505 PolarHBondContact N-O 2.78Å; I462-A507 HydrophobicContact CD1-CB 4.45Å; I462-A507 HydrophobicContact CG2-CB 3.78Å; I462-V541 HydrophobicContact CD1-CG2 4.35Å
463	H	95.9	Very high	94.5	Very high	61 Å²	61	52.2 Å²	52.2	28%	0.282	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	169.2	177.7	-142.8	69.9	0	0	0	112	V450 F461 L505	V450-H463 HydrophobicContact CB-CB 4.44Å; V450-H463 HydrophobicContact CG1-CB 3.8Å; V450-H463 HydrophobicContact CG2-CB 3.72Å; F461-H463 VanDerWaalsContact CE2-C 3.44Å; F461-H463 WeakPolarHBondContact CE2-O 3.23Å; F461-H463 WeakPolarHBondContact CZ-O 3.4Å; H463-L505 HydrophobicContact CB-CD1 4.37Å; H463-L505 PolarHBondContact O-N 2.87Å
464	A	95.5	Very high	94.4	Very high	31 Å²	31	55.7 Å²	55.7	26%	0.256	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127.8	164.5	0	0	0	0	0	109.1	F461 Y504	F461-A464 HydrophobicContact CE2-CB 4.24Å; F461-A464 HydrophobicContact CZ-CB 4.15Å; A464-Y504 HydrophobicContact CB-CD1 3.55Å; A464-Y504 HydrophobicContact CB-CE1 3.78Å
465	V	96.3	Very high	94.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	34%	0.337	C	S	.	.			trans	-92.1	156	165.4	-63.7	0	0	0	0	109	F443 Y448 Y480 I498 G503 L505 V523 V539	F443-V465 HydrophobicContact CD1-CB 4.37Å; F443-V465 HydrophobicContact CE1-CB 4Å; F443-V465 HydrophobicContact CE1-CG2 3.96Å; Y448-V465 HydrophobicContact CD1-CG1 4.22Å; Y448-V465 HydrophobicContact CD2-CG1 3.79Å; Y448-V465 HydrophobicContact CE1-CG1 4.31Å; Y448-V465 HydrophobicContact CE2-CB 4.16Å; Y448-V465 HydrophobicContact CE2-CG1 3.87Å; Y448-V465 HydrophobicContact CG-CG1 3.98Å; V465-Y480 HydrophobicContact CG2-CD1 4.21Å; V465-Y480 HydrophobicContact CG2-CE1 4.44Å; V465-I498 HydrophobicContact CG2-CD1 3.72Å; V465-G503 WeakPolarHBondContact CG2-O 3.4Å; V465-G503 PolarHBondContact N-O 2.89Å; V465-L505 HydrophobicContact CG1-CD1 3.95Å; V465-V523 HydrophobicContact CB-CG2 4.49Å; V465-V523 HydrophobicContact CG1-CG2 4.22Å; V465-V523 HydrophobicContact CG2-CG1 4.49Å; V465-V523 HydrophobicContact CG2-CG2 4.26Å; V465-V539 HydrophobicContact CG1-CG2 4.03Å
466	T	95.5	Very high	94.4	Very high	59 Å²	59	54.3 Å²	54.3	36%	0.362	33%	0.327	S	S	.	.			trans	-147.3	126.6	-178.9	-52.8	0	0	0	0	109.6	F443 T444 Y448	F443-T466 WeakPolarHBondContact CA-O 3.3Å; T444-T466 HydrophobicContact CG2-CG2 4.38Å; T444-T466 WeakPolarHBondContact CG2-O 3.5Å; T444-T466 PolarHBondContact N-O 3.18Å; T444-T466 PolarHBondContact OG1-O 3.25Å; Y448-T466 PolarHBondContact OH-O 3.16Å
467	A	95.6	Very high	94.5	Very high	3 Å²	3	58 Å²	58	3%	0.025	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	158.1	164.3	0	0	0	0	0	110.2	P441 R442 F443 I478 Y480 A525	P441-A467 HydrophobicContact CB-CB 4.32Å; R442-A467 CarbonylContact O-C 3.57Å; R442-A467 VanDerWaalsContact O-CA 3.24Å; R442-A467 WeakPolarHBondContact O-CA 3.07Å; F443-A467 HydrophobicContact CD1-CB 4.08Å; F443-A467 HydrophobicContact CE1-CB 4.36Å; F443-A467 HydrophobicContact CG-CB 4.25Å; A467-I478 HydrophobicContact CB-CD1 3.93Å; A467-I478 HydrophobicContact CB-CG2 4.37Å; A467-I478 WeakPolarHBondContact O-CD1 3.13Å; A467-Y480 HydrophobicContact CB-CE1 4.1Å; A467-Y480 PolarHBondContact N-OH 3.41Å; A467-Y480 PolarHBondContact O-OH 3.44Å; A467-A525 HydrophobicContact CB-CB 3.49Å; A467-A525 VanDerWaalsContact CB-CB 3.49Å
468	L	94.9	Very high	94.5	Very high	116 Å²	116	54.2 Å²	54.2	61%	0.607	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.9	174.5	-64.1	174.2	0	0	0	108.2	R442	R442-L468 PolarHBondContact N-O 2.98Å; R442-L468 PolarHBondContact O-N 3.49Å
469	D	96.1	Very high	94.6	Very high	27 Å²	27	52.9 Å²	52.9	14%	0.144	31%	0.312	C	S	.	.			trans	-122.4	131	177.3	-154.6	-67.3	0	0	0	109.4	P441 D471 I478	P441-D469 WeakPolarHBondContact CA-OD2 3.42Å; P441-D469 WeakPolarHBondContact CD-OD2 3.43Å; P441-D469 VanDerWaalsContact CG-OD2 3.23Å; P441-D469 WeakPolarHBondContact CG-OD2 3.44Å; D469-D471 WeakPolarHBondContact OD1-CB 3.19Å; D469-D471 PolarHBondContact OD1-N 3.02Å; D469-D471 VanDerWaalsContact OD1-N 3.1Å; D469-I478 HydrophobicContact CB-CD1 4.1Å; D469-I478 HydrophobicContact CB-CG1 4.14Å
470	P	94.3	Very high	94.9	Very high	66 Å²	66	51.4 Å²	51.4	43%	0.429	29%	0.292	S	S	.	.	S	Bend	trans	-68.5	-27.6	177.4	-22.1	35.3	0	0	0	115.6	R403 E404 N439	R403-P470 PolarHBondContact NH2-O 3.43Å; E404-P470 HydrophobicContact CG-CB 3.62Å; N439-P470 HydrophobicContact CB-CB 4.36Å; N439-P470 HydrophobicContact CB-CG 3.84Å
471	D	95.6	Very high	95	Very high	8 Å²	8	51.5 Å²	51.5	4%	0.043	29%	0.291	C	S	.	.	S	Bend	trans	-71.7	-160.6	-164.8	-64.1	6.4	0	0	0	111.6	N437 D438 N439 D469 N475 S476	N437-D471 WeakPolarHBondContact CA-OD2 3.22Å; D438-D471 PolarHBondContact N-OD2 3.02Å; N439-D471 VanDerWaalsContact CB-OD1 3.28Å; N439-D471 WeakPolarHBondContact CB-OD1 3.41Å; N439-D471 PolarHBondContact N-OD2 2.83Å; N439-D471 PolarHBondContact ND2-OD1 2.88Å; D469-D471 WeakPolarHBondContact OD1-CB 3.19Å; D469-D471 PolarHBondContact OD1-N 3.02Å; D469-D471 VanDerWaalsContact OD1-N 3.1Å; D471-N475 HydrophobicContact CB-CB 3.72Å; D471-S476 WeakPolarHBondContact O-CB 3Å
472	I	93.4	Very high	95	Very high	101 Å²	101	47.5 Å²	47.5	52%	0.518	27%	0.274	S	S	.	.			trans	-137.6	148.7	179.2	-140.5	175.2	0	0	0	116	D435 Q474 N475	D435-I472 HydrophobicContact CB-CG2 3.75Å; D435-I472 WeakPolarHBondContact OD1-CB 3.48Å; D435-I472 VanDerWaalsContact OD1-CG2 3.31Å; D435-I472 WeakPolarHBondContact OD1-CG2 3.49Å; D435-I472 PolarHBondContact OD1-N 2.84Å; D435-I472 PolarHBondContact OD2-N 3.31Å; I472-Q474 PolarHBondContact O-N 2.85Å; I472-Q474 VanDerWaalsContact O-N 3.12Å; I472-N475 PolarHBondContact O-N 3.26Å
473	G	92	Very high	95	Very high	51 Å²	51	48.6 Å²	48.6	53%	0.526	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	-105	169.8	0	0	0	0	0	112.6	S476	G473-S476 PolarHBondContact N-OG 2.79Å; G473-S476 VanDerWaalsContact N-OG 3.09Å; G473-S476 PolarHBondContact O-OG 3.07Å
474	Q	91.8	Very high	94.9	Very high	141 Å²	141	51.8 Å²	51.8	66%	0.659	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-31.6	177.2	-68.8	-171.6	-45.4	0	0	112	I472 S476 L477 S528	I472-Q474 PolarHBondContact O-N 2.85Å; I472-Q474 VanDerWaalsContact O-N 3.12Å; Q474-S476 VanDerWaalsContact C-N 3.32Å; Q474-S476 PolarHBondContact O-N 3.09Å; Q474-L477 WeakPolarHBondContact O-CB 3.39Å; Q474-L477 PolarHBondContact O-N 3.22Å; Q474-L477 VanDerWaalsContact O-N 3.08Å; Q474-S528 CarbonylContact O-C 3.52Å; Q474-S528 WeakPolarHBondContact O-CA 3.33Å; Q474-S528 WeakPolarHBondContact O-CB 3.16Å; Q474-S528 PolarHBondContact O-N 2.77Å
475	N	92.9	Very high	94.7	Very high	26 Å²	26	52.2 Å²	52.2	14%	0.139	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-37.4	177.3	-62.1	-9.2	0	0	0	110.3	D435 N437 D471 I472 L477 D527 G529	D435-N475 WeakPolarHBondContact OD2-CB 3.16Å; D435-N475 PolarHBondContact OD2-ND2 3.07Å; N437-N475 HydrophobicContact CB-CB 4.13Å; N437-N475 PolarHBondContact N-ND2 2.81Å; N437-N475 WeakPolarHBondContact OD1-CA 3.17Å; N437-N475 WeakPolarHBondContact OD1-CB 3.43Å; N437-N475 VanDerWaalsContact OD1-CG 3.26Å; N437-N475 PolarHBondContact OD1-OD1 3.24Å; D471-N475 HydrophobicContact CB-CB 3.72Å; I472-N475 PolarHBondContact O-N 3.26Å; N475-L477 VanDerWaalsContact C-N 3.31Å; N475-L477 PolarHBondContact O-N 3.4Å; N475-D527 WeakPolarHBondContact O-CB 3.45Å; N475-G529 WeakPolarHBondContact OD1-CA 3.3Å
476	S	94.1	Very high	94.5	Very high	39 Å²	39	58.5 Å²	58.5	27%	0.273	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	3.8	171.1	68.2	0	0	0	0	115.7	D471 G473 Q474 I478	D471-S476 WeakPolarHBondContact O-CB 3Å; G473-S476 PolarHBondContact N-OG 2.79Å; G473-S476 VanDerWaalsContact N-OG 3.09Å; G473-S476 PolarHBondContact O-OG 3.07Å; Q474-S476 VanDerWaalsContact C-N 3.32Å; Q474-S476 PolarHBondContact O-N 3.09Å; S476-I478 PolarHBondContact O-N 3.44Å; S476-I478 VanDerWaalsContact O-N 3.16Å
477	L	94.6	Very high	94.3	Very high	93 Å²	93	56.3 Å²	56.3	49%	0.487	32%	0.315	S	S	.	.			trans	-87.9	88.3	-172.8	-176.6	59.8	0	0	0	111.4	Q474 N475 D527 S528	Q474-L477 WeakPolarHBondContact O-CB 3.39Å; Q474-L477 PolarHBondContact O-N 3.22Å; Q474-L477 VanDerWaalsContact O-N 3.08Å; N475-L477 VanDerWaalsContact C-N 3.31Å; N475-L477 PolarHBondContact O-N 3.4Å; L477-D527 CarbonylContact O-C 3.46Å; L477-S528 PolarHBondContact O-N 2.9Å; L477-S528 VanDerWaalsContact O-N 3.17Å; L477-S528 PolarHBondContact O-OG 2.88Å
478	I	95.4	Very high	93.9	Very high	26 Å²	26	61.5 Å²	61.5	13%	0.133	34%	0.339	C	S	.	.			trans	-71.5	129	-178	-49.3	177.9	0	0	0	111.4	P441 A467 D469 S476 Y480 A525 K526	P441-I478 HydrophobicContact CB-CD1 4.13Å; P441-I478 HydrophobicContact CB-CG1 4.05Å; P441-I478 HydrophobicContact CB-CG2 4.2Å; P441-I478 HydrophobicContact CG-CG1 4.32Å; A467-I478 HydrophobicContact CB-CD1 3.93Å; A467-I478 HydrophobicContact CB-CG2 4.37Å; A467-I478 WeakPolarHBondContact O-CD1 3.13Å; D469-I478 HydrophobicContact CB-CD1 4.1Å; D469-I478 HydrophobicContact CB-CG1 4.14Å; S476-I478 PolarHBondContact O-N 3.44Å; S476-I478 VanDerWaalsContact O-N 3.16Å; I478-Y480 HydrophobicContact CG2-CD2 4.4Å; I478-Y480 HydrophobicContact CG2-CE1 4.11Å; I478-Y480 HydrophobicContact CG2-CE2 3.95Å; I478-A525 HydrophobicContact CG2-CB 3.81Å; I478-K526 CarbonylContact C-O 3.56Å; I478-K526 WeakPolarHBondContact CA-O 3.49Å
479	T	96.1	Very high	93.5	Very high	52 Å²	52	59 Å²	59	32%	0.319	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	138.3	165.5	60.7	0	0	0	0	110.2	Q500 K526	T479-Q500 WeakPolarHBondContact CA-O 3.16Å; T479-K526 PolarHBondContact N-O 2.75Å; T479-K526 PolarHBondContact O-N 2.92Å; T479-K526 PolarHBondContact OG1-O 3.14Å; T479-K526 VanDerWaalsContact OG1-O 3.13Å
480	Y	97.1	Very high	93.2	Very high	16 Å²	16	61.3 Å²	61.3	6%	0.063	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	140.2	-179.2	-62.8	-86.1	0	0	0	112	F443 V465 A467 I478 Q500 Q524 A525	F443-Y480 HydrophobicContact CE1-CD1 4.13Å; F443-Y480 AromaticContact CE1-CE1 3.91Å; F443-Y480 HydrophobicContact CE1-CE1 3.91Å; F443-Y480 HydrophobicContact CZ-CD1 4.33Å; F443-Y480 HydrophobicContact CZ-CE1 4.43Å; V465-Y480 HydrophobicContact CG2-CD1 4.21Å; V465-Y480 HydrophobicContact CG2-CE1 4.44Å; A467-Y480 HydrophobicContact CB-CE1 4.1Å; A467-Y480 PolarHBondContact N-OH 3.41Å; A467-Y480 PolarHBondContact O-OH 3.44Å; I478-Y480 HydrophobicContact CG2-CD2 4.4Å; I478-Y480 HydrophobicContact CG2-CE1 4.11Å; I478-Y480 HydrophobicContact CG2-CE2 3.95Å; Y480-Q500 WeakPolarHBondContact CD2-O 3.43Å; Y480-Q500 PolarHBondContact N-O 2.82Å; Y480-Q500 WeakPolarHBondContact O-CA 3.42Å; Y480-Q524 WeakPolarHBondContact CA-O 3.48Å; Y480-A525 HydrophobicContact CD1-CB 4.12Å; Y480-A525 HydrophobicContact CE1-CB 4.01Å
481	S	96.6	Very high	93.1	Very high	36 Å²	36	59.5 Å²	59.5	25%	0.252	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	161.4	175.1	57.2	0	0	0	0	111.8	V523 Q524	S481-V523 CarbonylContact O-C 3.57Å; S481-V523 WeakPolarHBondContact O-CA 3.41Å; S481-Q524 PolarHBondContact N-O 3.16Å; S481-Q524 PolarHBondContact O-N 2.78Å
482	I	96.6	Very high	93	Very high	23 Å²	23	59.1 Å²	59.1	12%	0.118	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	137.1	168.2	-65.2	169.2	0	0	0	107.4	V492 V496 I498 L505 F521 V523	I482-V492 HydrophobicContact CG2-CB 4.41Å; I482-V492 HydrophobicContact CG2-CG1 3.59Å; I482-V492 HydrophobicContact CG2-CG2 3.86Å; I482-V496 HydrophobicContact CD1-CG2 3.96Å; I482-I498 HydrophobicContact CD1-CB 4.1Å; I482-I498 HydrophobicContact CD1-CG2 4.26Å; I482-I498 HydrophobicContact CG1-CB 4.02Å; I482-I498 HydrophobicContact CG1-CG2 3.86Å; I482-L505 HydrophobicContact CD1-CD2 4.26Å; I482-F521 HydrophobicContact CD1-CE2 4.29Å; I482-F521 HydrophobicContact CG1-CD2 4.38Å; I482-F521 HydrophobicContact CG1-CE2 4.25Å; I482-F521 HydrophobicContact CG2-CD2 4Å; I482-V523 HydrophobicContact CG1-CG1 4.38Å
483	L	95.1	Very high	93	Very high	45 Å²	45	59 Å²	59	24%	0.236	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	122.2	172.6	-63.3	-179.3	0	0	0	109.4	C485 M522 Q524 N536	L483-C485 PolarHBondContact O-N 3.18Å; L483-M522 HydrophobicContact CB-CB 4.23Å; L483-M522 HydrophobicContact CD1-CB 4.01Å; L483-M522 HydrophobicContact CD1-CE 4.21Å; L483-M522 HydrophobicContact CG-CB 4.43Å; L483-M522 PolarHBondContact N-O 3.17Å; L483-Q524 HydrophobicContact CD1-CB 4.35Å; L483-Q524 HydrophobicContact CD2-CB 4Å; L483-Q524 HydrophobicContact CG-CB 4.05Å; L483-N536 WeakPolarHBondContact CD1-ND2 3.17Å
484	E	93.2	Very high	93.1	Very high	128 Å²	128	59.2 Å²	59.2	60%	0.598	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-54.3	128.4	-176	172.9	67	148.8	0	0	112.5	S491	E484-S491 VanDerWaalsContact CD-OG 3.25Å; E484-S491 VanDerWaalsContact OE1-CB 3.25Å; E484-S491 WeakPolarHBondContact OE1-CB 3.48Å; E484-S491 PolarHBondContact OE1-OG 3.13Å; E484-S491 VanDerWaalsContact OE1-OG 3.1Å; E484-S491 WeakPolarHBondContact OE2-CB 3.42Å; E484-S491 PolarHBondContact OE2-OG 3.4Å
485	C	92.6	Very high	93.2	Very high	40 Å²	40	52.8 Å²	52.8	27%	0.27	30%	0.3	S	S	.	.			trans	-154.1	149.9	177.1	62.4	0	0	0	0	111.8	L483 V492	L483-C485 PolarHBondContact O-N 3.18Å; C485-V492 PolarHBondContact O-N 3.5Å
486	D	92.1	Very high	93.3	Very high	133 Å²	133	51.5 Å²	51.5	71%	0.711	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	120	178.8	-70.7	-49	0	0	0	112.1
487	I	90.3	Very high	93.4	Very high	12 Å²	12	51.6 Å²	51.6	6%	0.062	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.7	168.7	-62.2	164.7	0	0	0	107.6	G489 M490 V492 Y495 L516 F519	I487-G489 PolarHBondContact O-N 2.75Å; I487-M490 PolarHBondContact N-O 2.65Å; I487-M490 PolarHBondContact O-N 3.11Å; I487-M490 VanDerWaalsContact O-O 3.06Å; I487-V492 HydrophobicContact CD1-CB 3.95Å; I487-V492 HydrophobicContact CD1-CG2 3.84Å; I487-Y495 HydrophobicContact CB-CD2 3.97Å; I487-Y495 HydrophobicContact CB-CE2 3.62Å; I487-Y495 HydrophobicContact CD1-CD2 4.26Å; I487-Y495 HydrophobicContact CG2-CD2 4.11Å; I487-Y495 HydrophobicContact CG2-CE1 4.25Å; I487-Y495 HydrophobicContact CG2-CE2 3.63Å; I487-Y495 WeakPolarHBondContact O-CE2 3.42Å; I487-Y495 PolarHBondContact O-OH 3.42Å; I487-L516 HydrophobicContact CG2-CD2 4.22Å; I487-F519 HydrophobicContact CD1-CB 4.32Å; I487-F519 HydrophobicContact CD1-CD2 3.44Å; I487-F519 VanDerWaalsContact CD1-CD2 3.44Å; I487-F519 HydrophobicContact CD1-CE2 3.97Å; I487-F519 HydrophobicContact CD1-CG 4.12Å; I487-F519 HydrophobicContact CG1-CB 4.47Å; I487-F519 HydrophobicContact CG1-CD2 4.44Å; I487-F519 HydrophobicContact CG2-CB 4.03Å; I487-F519 HydrophobicContact CG2-CG 4.35Å
488	Q	88	Confident	93.6	Very high	113 Å²	113	48.4 Å²	48.4	53%	0.528	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	19.8	-174.8	-54.1	179.5	-51.8	0	0	115.4	Y495 Q515 L516	Q488-Y495 PolarHBondContact OE1-OH 2.93Å; Q488-Q515 PolarHBondContact NE2-O 2.74Å; Q488-L516 HydrophobicContact CG-CD1 4.24Å
489	G	85.4	Confident	93.6	Very high	64 Å²	64	49.6 Å²	49.6	66%	0.66	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	18.7	-176.2	0	0	0	0	0	115.1	I487	I487-G489 PolarHBondContact O-N 2.75Å
490	M	89.3	Confident	93.6	Very high	75 Å²	75	53.2 Å²	53.2	37%	0.369	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152	167.6	-64.9	175.7	-65.3	0	0	109.7	I487 Y495	I487-M490 PolarHBondContact N-O 2.65Å; I487-M490 PolarHBondContact O-N 3.11Å; I487-M490 VanDerWaalsContact O-O 3.06Å; M490-Y495 HydrophobicContact CB-CE2 4.15Å; M490-Y495 HydrophobicContact CE-CE2 4.01Å; M490-Y495 WeakPolarHBondContact CE-OH 3.25Å
491	S	93.1	Very high	93.4	Very high	28 Å²	28	58.8 Å²	58.8	20%	0.196	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	144.8	175.1	163.5	0	0	0	0	112.1	E484 D493 T494	E484-S491 VanDerWaalsContact CD-OG 3.25Å; E484-S491 VanDerWaalsContact OE1-CB 3.25Å; E484-S491 WeakPolarHBondContact OE1-CB 3.48Å; E484-S491 PolarHBondContact OE1-OG 3.13Å; E484-S491 VanDerWaalsContact OE1-OG 3.1Å; E484-S491 WeakPolarHBondContact OE2-CB 3.42Å; E484-S491 PolarHBondContact OE2-OG 3.4Å; S491-D493 PolarHBondContact O-N 2.9Å; S491-D493 PolarHBondContact OG-N 3.47Å; S491-T494 WeakPolarHBondContact O-CB 3.45Å; S491-T494 PolarHBondContact O-N 3.37Å; S491-T494 PolarHBondContact O-OG1 2.8Å
492	V	94.3	Very high	93.4	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-55.4	-33.6	173.1	59.6	0	0	0	0	113.2	I482 C485 I487 T494 Y495 V496 F521	I482-V492 HydrophobicContact CG2-CB 4.41Å; I482-V492 HydrophobicContact CG2-CG1 3.59Å; I482-V492 HydrophobicContact CG2-CG2 3.86Å; C485-V492 PolarHBondContact O-N 3.5Å; I487-V492 HydrophobicContact CD1-CB 3.95Å; I487-V492 HydrophobicContact CD1-CG2 3.84Å; V492-T494 PolarHBondContact O-N 3.1Å; V492-Y495 PolarHBondContact O-N 2.83Å; V492-V496 HydrophobicContact CG2-CG2 3.53Å; V492-V496 PolarHBondContact O-N 2.9Å; V492-F521 HydrophobicContact CG2-CB 3.75Å; V492-F521 HydrophobicContact CG2-CD1 4.16Å; V492-F521 HydrophobicContact CG2-CD2 4.4Å; V492-F521 HydrophobicContact CG2-CG 3.87Å
493	D	93	Very high	93.3	Very high	97 Å²	97	58.7 Å²	58.7	52%	0.519	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-65.5	-5.9	175.4	-76.6	-2.5	0	0	0	113.1	S491 L508	S491-D493 PolarHBondContact O-N 2.9Å; S491-D493 PolarHBondContact OG-N 3.47Å; D493-L508 WeakPolarHBondContact O-CD1 3.38Å
494	T	93.1	Very high	93.4	Very high	56 Å²	56	61.6 Å²	61.6	34%	0.344	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-90.6	-15.9	169.6	73	0	0	0	0	113.5	S491 V492 R509	S491-T494 WeakPolarHBondContact O-CB 3.45Å; S491-T494 PolarHBondContact O-N 3.37Å; S491-T494 PolarHBondContact O-OG1 2.8Å; V492-T494 PolarHBondContact O-N 3.1Å; T494-R509 WeakPolarHBondContact O-CD 3.4Å; T494-R509 WeakPolarHBondContact O-CG 3.4Å
495	Y	94.3	Very high	93.6	Very high	6 Å²	6	55.5 Å²	55.5	2%	0.024	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-38.5	-178.3	-70.7	-90	0	0	0	112.4	I487 Q488 M490 V492 L508 F511 L516	I487-Y495 HydrophobicContact CB-CD2 3.97Å; I487-Y495 HydrophobicContact CB-CE2 3.62Å; I487-Y495 HydrophobicContact CD1-CD2 4.26Å; I487-Y495 HydrophobicContact CG2-CD2 4.11Å; I487-Y495 HydrophobicContact CG2-CE1 4.25Å; I487-Y495 HydrophobicContact CG2-CE2 3.63Å; I487-Y495 WeakPolarHBondContact O-CE2 3.42Å; I487-Y495 PolarHBondContact O-OH 3.42Å; Q488-Y495 PolarHBondContact OE1-OH 2.93Å; M490-Y495 HydrophobicContact CB-CE2 4.15Å; M490-Y495 HydrophobicContact CE-CE2 4.01Å; M490-Y495 WeakPolarHBondContact CE-OH 3.25Å; V492-Y495 PolarHBondContact O-N 2.83Å; Y495-L508 PolarHBondContact O-N 3.46Å; Y495-F511 HydrophobicContact CD1-CD1 4.47Å; Y495-F511 HydrophobicContact CD1-CE1 4Å; Y495-L516 HydrophobicContact CE1-CD2 3.95Å
496	V	96	Very high	93.8	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	159.7	-175	-72.2	0	0	0	0	111.7	I462 I482 V492 Y506 L508 F511 F519 F521	I462-V496 HydrophobicContact CD1-CG1 3.97Å; I482-V496 HydrophobicContact CD1-CG2 3.96Å; V492-V496 HydrophobicContact CG2-CG2 3.53Å; V492-V496 PolarHBondContact O-N 2.9Å; V496-Y506 CarbonylContact C-O 3.51Å; V496-Y506 WeakPolarHBondContact CA-O 3.5Å; V496-L508 WeakPolarHBondContact O-CD1 3.39Å; V496-F511 HydrophobicContact CG1-CZ 4.39Å; V496-F519 HydrophobicContact CG1-CE2 4.27Å; V496-F519 HydrophobicContact CG1-CZ 4.18Å; V496-F521 HydrophobicContact CB-CZ 4.43Å; V496-F521 HydrophobicContact CG1-CE1 4.26Å; V496-F521 HydrophobicContact CG1-CZ 4.44Å; V496-F521 HydrophobicContact CG2-CD1 4.22Å; V496-F521 HydrophobicContact CG2-CE1 3.82Å; V496-F521 HydrophobicContact CG2-CE2 4.3Å; V496-F521 HydrophobicContact CG2-CZ 3.87Å
497	S	96	Very high	94	Very high	40 Å²	40	50.7 Å²	50.7	28%	0.28	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	160	165.8	62.6	0	0	0	0	111.3	L505 Y506	S497-L505 WeakPolarHBondContact O-CA 3.5Å; S497-Y506 PolarHBondContact N-O 3.22Å; S497-Y506 PolarHBondContact O-N 3.38Å
498	I	97.3	Very high	94.2	Very high	26 Å²	26	53.5 Å²	53.5	13%	0.133	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	141.4	174.7	-162.7	161.2	0	0	0	110.9	V465 I482 Y504 L505 V523	V465-I498 HydrophobicContact CG2-CD1 3.72Å; I482-I498 HydrophobicContact CD1-CB 4.1Å; I482-I498 HydrophobicContact CD1-CG2 4.26Å; I482-I498 HydrophobicContact CG1-CB 4.02Å; I482-I498 HydrophobicContact CG1-CG2 3.86Å; I498-Y504 CarbonylContact C-O 3.39Å; I498-Y504 WeakPolarHBondContact CA-O 3.14Å; I498-L505 HydrophobicContact CB-CD2 3.89Å; I498-L505 HydrophobicContact CD1-CD2 3.95Å; I498-L505 HydrophobicContact CD1-CG 4.41Å; I498-L505 HydrophobicContact CG1-CD2 3.97Å; I498-L505 HydrophobicContact CG1-CG 4.45Å; I498-V523 HydrophobicContact CD1-CB 4.43Å; I498-V523 HydrophobicContact CD1-CG1 3.9Å
499	N	96.7	Very high	94.4	Very high	52 Å²	52	53 Å²	53	28%	0.278	28%	0.282	S	S	.	.			trans	-76.4	123	165.1	-178.4	-55.4	0	0	0	109.1	D501 T502 G503 Y504 Y506	N499-D501 VanDerWaalsContact C-N 3.29Å; N499-D501 PolarHBondContact O-N 3.24Å; N499-D501 PolarHBondContact OD1-N 2.75Å; N499-T502 WeakPolarHBondContact CB-OG1 3.28Å; N499-T502 VanDerWaalsContact CG-OG1 3.3Å; N499-T502 PolarHBondContact OD1-N 3.29Å; N499-T502 PolarHBondContact OD1-OG1 2.89Å; N499-G503 PolarHBondContact O-N 2.97Å; N499-Y504 PolarHBondContact N-O 3.46Å; N499-Y506 HydrophobicContact CB-CE2 4.33Å
500	Q	95.7	Very high	94.8	Very high	128 Å²	128	53 Å²	53	60%	0.598	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-25.2	-173.1	-59.6	-171.5	-47.4	0	0	113.8	T479 Y480	T479-Q500 WeakPolarHBondContact CA-O 3.16Å; Y480-Q500 WeakPolarHBondContact CD2-O 3.43Å; Y480-Q500 PolarHBondContact N-O 2.82Å; Y480-Q500 WeakPolarHBondContact O-CA 3.42Å
501	D	93.9	Very high	95	Very high	132 Å²	132	49.8 Å²	49.8	71%	0.706	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-36.4	-179.1	-48.7	-52.1	0	0	0	112	N499	N499-D501 VanDerWaalsContact C-N 3.29Å; N499-D501 PolarHBondContact O-N 3.24Å; N499-D501 PolarHBondContact OD1-N 2.75Å
502	T	94.8	Very high	95.1	Very high	58 Å²	58	51.2 Å²	51.2	36%	0.356	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-7	-169.6	77.1	0	0	0	0	115.2	N499 Y504	N499-T502 WeakPolarHBondContact CB-OG1 3.28Å; N499-T502 VanDerWaalsContact CG-OG1 3.3Å; N499-T502 PolarHBondContact OD1-N 3.29Å; N499-T502 PolarHBondContact OD1-OG1 2.89Å; T502-Y504 WeakPolarHBondContact O-CD1 3.32Å; T502-Y504 PolarHBondContact O-N 3.21Å; T502-Y504 WeakPolarHBondContact OG1-CB 3.47Å; T502-Y504 WeakPolarHBondContact OG1-CD1 3.17Å; T502-Y504 PolarHBondContact OG1-N 3.19Å
503	G	95	Very high	95.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.268	C	S	.	.			trans	65.9	14.4	-176	0	0	0	0	0	114.3	V465 N499	V465-G503 WeakPolarHBondContact CG2-O 3.4Å; V465-G503 PolarHBondContact N-O 2.89Å; N499-G503 PolarHBondContact O-N 2.97Å
504	Y	97.3	Very high	95.1	Very high	106 Å²	106	51.3 Å²	51.3	42%	0.416	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	125.4	-178.6	-73.1	8.3	0	0	0	110.9	F461 A464 I498 N499 T502 Y506	F461-Y504 HydrophobicContact CD2-CD2 4.18Å; F461-Y504 HydrophobicContact CD2-CG 4.18Å; F461-Y504 HydrophobicContact CE2-CD1 4.09Å; F461-Y504 AromaticContact CE2-CD2 3.96Å; F461-Y504 HydrophobicContact CE2-CD2 3.96Å; F461-Y504 AromaticContact CE2-CG 3.72Å; F461-Y504 HydrophobicContact CE2-CG 3.72Å; A464-Y504 HydrophobicContact CB-CD1 3.55Å; A464-Y504 HydrophobicContact CB-CE1 3.78Å; I498-Y504 CarbonylContact C-O 3.39Å; I498-Y504 WeakPolarHBondContact CA-O 3.14Å; N499-Y504 PolarHBondContact N-O 3.46Å; T502-Y504 WeakPolarHBondContact O-CD1 3.32Å; T502-Y504 PolarHBondContact O-N 3.21Å; T502-Y504 WeakPolarHBondContact OG1-CB 3.47Å; T502-Y504 WeakPolarHBondContact OG1-CD1 3.17Å; T502-Y504 PolarHBondContact OG1-N 3.19Å; Y504-Y506 WeakPolarHBondContact O-CD2 3.43Å; Y504-Y506 WeakPolarHBondContact O-CE2 3.41Å
505	L	96.9	Very high	95	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.3	177.4	-71	167.2	0	0	0	111.1	I462 H463 V465 I482 S497 I498 F521 V523 V539	I462-L505 HydrophobicContact CD1-CB 4.35Å; I462-L505 HydrophobicContact CG1-CB 3.91Å; I462-L505 WeakPolarHBondContact CG1-O 3.41Å; I462-L505 PolarHBondContact N-O 2.78Å; H463-L505 HydrophobicContact CB-CD1 4.37Å; H463-L505 PolarHBondContact O-N 2.87Å; V465-L505 HydrophobicContact CG1-CD1 3.95Å; I482-L505 HydrophobicContact CD1-CD2 4.26Å; S497-L505 WeakPolarHBondContact O-CA 3.5Å; I498-L505 HydrophobicContact CB-CD2 3.89Å; I498-L505 HydrophobicContact CD1-CD2 3.95Å; I498-L505 HydrophobicContact CD1-CG 4.41Å; I498-L505 HydrophobicContact CG1-CD2 3.97Å; I498-L505 HydrophobicContact CG1-CG 4.45Å; L505-F521 HydrophobicContact CD1-CE2 4.44Å; L505-F521 HydrophobicContact CD1-CZ 4.18Å; L505-F521 HydrophobicContact CD2-CE2 3.94Å; L505-F521 HydrophobicContact CD2-CZ 4.02Å; L505-V523 HydrophobicContact CD2-CG1 4.36Å; L505-V539 HydrophobicContact CD1-CG1 3.99Å; L505-V539 HydrophobicContact CD1-CG2 4.1Å
506	Y	96.6	Very high	94.8	Very high	71 Å²	71	56 Å²	56	28%	0.278	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	138.9	178.6	-60.5	-95.5	0	0	0	110.3	A460 F461 V496 S497 N499 Y504	A460-Y506 CarbonylContact O-C 3.58Å; A460-Y506 VanDerWaalsContact O-CA 3.25Å; A460-Y506 WeakPolarHBondContact O-CA 2.83Å; F461-Y506 HydrophobicContact CB-CD1 4.07Å; F461-Y506 HydrophobicContact CB-CE1 3.93Å; F461-Y506 HydrophobicContact CD2-CE1 4.47Å; V496-Y506 CarbonylContact C-O 3.51Å; V496-Y506 WeakPolarHBondContact CA-O 3.5Å; S497-Y506 PolarHBondContact N-O 3.22Å; S497-Y506 PolarHBondContact O-N 3.38Å; N499-Y506 HydrophobicContact CB-CE2 4.33Å; Y504-Y506 WeakPolarHBondContact O-CD2 3.43Å; Y504-Y506 WeakPolarHBondContact O-CE2 3.41Å
507	A	96.4	Very high	94.7	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119.8	170.2	0	0	0	0	0	109.8	N456 G459 A460 I462 R509 F511	N456-A507 WeakPolarHBondContact ND2-CB 3.15Å; G459-A507 WeakPolarHBondContact CA-O 3.47Å; G459-A507 PolarHBondContact N-O 3.48Å; A460-A507 PolarHBondContact O-N 2.65Å; I462-A507 HydrophobicContact CD1-CB 4.45Å; I462-A507 HydrophobicContact CG2-CB 3.78Å; A507-R509 VanDerWaalsContact C-N 3.33Å; A507-F511 HydrophobicContact CB-CE2 3.54Å; A507-F511 HydrophobicContact CB-CZ 3.85Å
508	L	94.7	Very high	94.6	Very high	72 Å²	72	64.7 Å²	64.7	38%	0.377	31%	0.311	S	S	.	.	S	Bend	trans	-83.3	-10.1	-179.3	-65.9	178.1	0	0	0	113.6	D493 Y495 V496	D493-L508 WeakPolarHBondContact O-CD1 3.38Å; Y495-L508 PolarHBondContact O-N 3.46Å; V496-L508 WeakPolarHBondContact O-CD1 3.39Å
509	R	92	Very high	94.5	Very high	102 Å²	102	64.2 Å²	64.2	39%	0.385	31%	0.308	S	S	.	.	S	Bend	trans	-135.9	159.9	-178.8	-67.8	173.9	65.4	165.5	-0.9	110.3	N456 T494 A507	N456-R509 PolarHBondContact ND2-O 3.38Å; T494-R509 WeakPolarHBondContact O-CD 3.4Å; T494-R509 WeakPolarHBondContact O-CG 3.4Å; A507-R509 VanDerWaalsContact C-N 3.33Å
510	S	94.5	Very high	94.5	Very high	64 Å²	64	65.1 Å²	65.1	45%	0.448	32%	0.318	S	S	.	.			trans	-72.1	127.5	158.9	52.7	0	0	0	0	108.7	N456	N456-S510 VanDerWaalsContact O-CA 3.31Å; N456-S510 WeakPolarHBondContact O-CA 3.34Å; N456-S510 VanDerWaalsContact O-CB 3.23Å; N456-S510 WeakPolarHBondContact O-CB 3.43Å; N456-S510 WeakPolarHBondContact OD1-CA 3.41Å
511	F	94.6	Very high	94.5	Very high	7 Å²	7	59.1 Å²	59.1	3%	0.031	29%	0.29	C	S	.	.			trans	-84.1	154.9	171	-56	-63.4	0	0	0	110.8	V452 N455 N456 Y495 V496 A507 F519 I543	V452-F511 HydrophobicContact CB-CD2 4.4Å; V452-F511 HydrophobicContact CB-CE2 4.48Å; V452-F511 HydrophobicContact CG1-CD2 3.88Å; V452-F511 HydrophobicContact CG1-CE2 3.99Å; N455-F511 PolarHBondContact N-O 3.48Å; N456-F511 WeakPolarHBondContact OD1-CD2 3.44Å; N456-F511 PolarHBondContact OD1-N 3.28Å; Y495-F511 HydrophobicContact CD1-CD1 4.47Å; Y495-F511 HydrophobicContact CD1-CE1 4Å; V496-F511 HydrophobicContact CG1-CZ 4.39Å; A507-F511 HydrophobicContact CB-CE2 3.54Å; A507-F511 HydrophobicContact CB-CZ 3.85Å; F511-F519 AromaticContact CD1-CE1 3.97Å; F511-F519 HydrophobicContact CD1-CE1 3.97Å; F511-F519 AromaticContact CE1-CE1 3.48Å; F511-F519 HydrophobicContact CE1-CE1 3.48Å; F511-F519 VanDerWaalsContact CE1-CE1 3.48Å; F511-F519 AromaticContact CE1-CZ 3.59Å; F511-F519 HydrophobicContact CE1-CZ 3.59Å; F511-F519 AromaticContact CZ-CE1 3.86Å; F511-F519 HydrophobicContact CZ-CE1 3.86Å; F511-F519 AromaticContact CZ-CZ 3.65Å; F511-F519 HydrophobicContact CZ-CZ 3.65Å; F511-I543 HydrophobicContact CB-CD1 3.67Å; F511-I543 HydrophobicContact CB-CG1 3.9Å; F511-I543 HydrophobicContact CB-CG2 4.14Å; F511-I543 HydrophobicContact CD1-CD1 4Å; F511-I543 HydrophobicContact CD2-CD1 4.5Å; F511-I543 HydrophobicContact CD2-CG1 4.31Å; F511-I543 HydrophobicContact CG-CD1 3.82Å; F511-I543 HydrophobicContact CG-CG1 4.06Å
512	D	93.8	Very high	94.6	Very high	58 Å²	58	57 Å²	57	31%	0.31	28%	0.277	S	S	.	.			trans	-135.1	120.3	-175.7	165.4	-48.8	0	0	0	104.8	E514 Q515 L516	D512-E514 PolarHBondContact OD1-N 2.87Å; D512-Q515 HydrophobicContact CB-CB 4.37Å; D512-Q515 VanDerWaalsContact CG-NE2 3.3Å; D512-Q515 VanDerWaalsContact OD1-CB 3.22Å; D512-Q515 WeakPolarHBondContact OD1-CB 3.33Å; D512-Q515 VanDerWaalsContact OD1-CG 3.22Å; D512-Q515 WeakPolarHBondContact OD1-CG 3.42Å; D512-Q515 PolarHBondContact OD1-N 3Å; D512-Q515 PolarHBondContact OD2-NE2 3.35Å; D512-L516 PolarHBondContact O-N 3.38Å
513	Y	94.2	Very high	94.7	Very high	35 Å²	35	54.2 Å²	54.2	14%	0.137	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-32.6	-166.9	179.6	-115.4	0	0	0	111.6	Q515 L516 K517 I543 D545 D587	Y513-Q515 VanDerWaalsContact C-N 3.28Å; Y513-Q515 PolarHBondContact O-N 2.89Å; Y513-L516 CarbonylContact O-C 3.58Å; Y513-L516 PolarHBondContact O-N 3.27Å; Y513-K517 HydrophobicContact CD2-CB 4.09Å; Y513-K517 HydrophobicContact CD2-CD 4.31Å; Y513-K517 HydrophobicContact CD2-CG 3.73Å; Y513-K517 HydrophobicContact CE1-CD 4.08Å; Y513-K517 HydrophobicContact CE1-CG 4.48Å; Y513-K517 HydrophobicContact CE2-CB 3.78Å; Y513-K517 HydrophobicContact CE2-CD 3.71Å; Y513-K517 HydrophobicContact CE2-CG 3.53Å; Y513-K517 HydrophobicContact CG-CG 4.27Å; Y513-K517 WeakPolarHBondContact O-CG 3.41Å; Y513-K517 PolarHBondContact OH-NZ 3.43Å; Y513-I543 HydrophobicContact CD2-CB 4.26Å; Y513-I543 HydrophobicContact CD2-CG2 4.02Å; Y513-I543 VanDerWaalsContact CD2-O 3.3Å; Y513-I543 WeakPolarHBondContact CD2-O 3.48Å; Y513-I543 WeakPolarHBondContact CE2-O 3.26Å; Y513-D545 HydrophobicContact CD1-CB 3.61Å; Y513-D545 HydrophobicContact CE1-CB 3.47Å; Y513-D545 VanDerWaalsContact CE1-CB 3.47Å; Y513-D545 VanDerWaalsContact CE1-OD2 3.28Å; Y513-D545 WeakPolarHBondContact CE1-OD2 3.11Å; Y513-D545 HydrophobicContact CE2-CB 4.42Å; Y513-D545 HydrophobicContact CG-CB 4.15Å; Y513-D587 HydrophobicContact CE1-CB 3.75Å
514	E	92.7	Very high	94.8	Very high	64 Å²	64	55.7 Å²	55.7	30%	0.299	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-32.9	178.2	-70.4	49	-107.5	0	0	110.7	D512 A585	D512-E514 PolarHBondContact OD1-N 2.87Å; E514-A585 HydrophobicContact CG-CB 3.89Å
515	Q	91.3	Very high	94.8	Very high	138 Å²	138	50.6 Å²	50.6	65%	0.645	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-35.2	174.4	-68.2	-178	64.6	0	0	113.6	Q488 D512 Y513	Q488-Q515 PolarHBondContact NE2-O 2.74Å; D512-Q515 HydrophobicContact CB-CB 4.37Å; D512-Q515 VanDerWaalsContact CG-NE2 3.3Å; D512-Q515 VanDerWaalsContact OD1-CB 3.22Å; D512-Q515 WeakPolarHBondContact OD1-CB 3.33Å; D512-Q515 VanDerWaalsContact OD1-CG 3.22Å; D512-Q515 WeakPolarHBondContact OD1-CG 3.42Å; D512-Q515 PolarHBondContact OD1-N 3Å; D512-Q515 PolarHBondContact OD2-NE2 3.35Å; Y513-Q515 VanDerWaalsContact C-N 3.28Å; Y513-Q515 PolarHBondContact O-N 2.89Å
516	L	91.7	Very high	94.7	Very high	23 Å²	23	53 Å²	53	12%	0.12	26%	0.257	C	S	.	.			trans	-150.3	107.2	-174.6	-173.5	59.2	0	0	0	111.7	I487 Q488 Y495 D512 Y513 E518 F519 I543	I487-L516 HydrophobicContact CG2-CD2 4.22Å; Q488-L516 HydrophobicContact CG-CD1 4.24Å; Y495-L516 HydrophobicContact CE1-CD2 3.95Å; D512-L516 PolarHBondContact O-N 3.38Å; Y513-L516 CarbonylContact O-C 3.58Å; Y513-L516 PolarHBondContact O-N 3.27Å; L516-E518 VanDerWaalsContact CD1-O 3.31Å; L516-E518 WeakPolarHBondContact CD1-O 3.28Å; L516-F519 HydrophobicContact CD1-CB 4.46Å; L516-F519 HydrophobicContact CD2-CD1 3.65Å; L516-F519 HydrophobicContact CD2-CE1 4.22Å; L516-F519 HydrophobicContact CD2-CG 4.39Å; L516-F519 HydrophobicContact CG-CD1 4.17Å; L516-I543 HydrophobicContact CB-CD1 4.28Å; L516-I543 HydrophobicContact CD2-CD1 4.31Å; L516-I543 HydrophobicContact CG-CD1 4.01Å; L516-I543 WeakPolarHBondContact O-CD1 3.29Å
517	K	92.8	Very high	94.7	Very high	77 Å²	77	49.6 Å²	49.6	34%	0.335	24%	0.244	S	C	.	.	S	Bend	trans	-86.1	-33.4	179.2	-61.7	-163.8	171.8	-139.2	0	114	Y513 I543 D587	Y513-K517 HydrophobicContact CD2-CB 4.09Å; Y513-K517 HydrophobicContact CD2-CD 4.31Å; Y513-K517 HydrophobicContact CD2-CG 3.73Å; Y513-K517 HydrophobicContact CE1-CD 4.08Å; Y513-K517 HydrophobicContact CE1-CG 4.48Å; Y513-K517 HydrophobicContact CE2-CB 3.78Å; Y513-K517 HydrophobicContact CE2-CD 3.71Å; Y513-K517 HydrophobicContact CE2-CG 3.53Å; Y513-K517 HydrophobicContact CG-CG 4.27Å; Y513-K517 WeakPolarHBondContact O-CG 3.41Å; Y513-K517 PolarHBondContact OH-NZ 3.43Å; K517-I543 PolarHBondContact O-N 2.68Å; K517-D587 IonicContact NZ-OD2 3.64Å; K517-D587 PolarHBondContact NZ-OD2 2.85Å
518	E	94.9	Very high	94.5	Very high	145 Å²	145	51.5 Å²	51.5	68%	0.678	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152	150.8	179.6	62.5	-177.8	-171.2	0	0	111.3	L516 V541	L516-E518 VanDerWaalsContact CD1-O 3.31Å; L516-E518 WeakPolarHBondContact CD1-O 3.28Å; E518-V541 VanDerWaalsContact CA-O 3.31Å; E518-V541 WeakPolarHBondContact CA-O 3.1Å
519	F	94.9	Very high	94.2	Very high	16 Å²	16	48.4 Å²	48.4	7%	0.07	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	150.3	166.3	64	-89.3	0	0	0	111.4	I487 V496 F511 L516 F521 V541 I543	I487-F519 HydrophobicContact CD1-CB 4.32Å; I487-F519 HydrophobicContact CD1-CD2 3.44Å; I487-F519 VanDerWaalsContact CD1-CD2 3.44Å; I487-F519 HydrophobicContact CD1-CE2 3.97Å; I487-F519 HydrophobicContact CD1-CG 4.12Å; I487-F519 HydrophobicContact CG1-CB 4.47Å; I487-F519 HydrophobicContact CG1-CD2 4.44Å; I487-F519 HydrophobicContact CG2-CB 4.03Å; I487-F519 HydrophobicContact CG2-CG 4.35Å; V496-F519 HydrophobicContact CG1-CE2 4.27Å; V496-F519 HydrophobicContact CG1-CZ 4.18Å; F511-F519 AromaticContact CD1-CE1 3.97Å; F511-F519 HydrophobicContact CD1-CE1 3.97Å; F511-F519 AromaticContact CE1-CE1 3.48Å; F511-F519 HydrophobicContact CE1-CE1 3.48Å; F511-F519 VanDerWaalsContact CE1-CE1 3.48Å; F511-F519 AromaticContact CE1-CZ 3.59Å; F511-F519 HydrophobicContact CE1-CZ 3.59Å; F511-F519 AromaticContact CZ-CE1 3.86Å; F511-F519 HydrophobicContact CZ-CE1 3.86Å; F511-F519 AromaticContact CZ-CZ 3.65Å; F511-F519 HydrophobicContact CZ-CZ 3.65Å; L516-F519 HydrophobicContact CD1-CB 4.46Å; L516-F519 HydrophobicContact CD2-CD1 3.65Å; L516-F519 HydrophobicContact CD2-CE1 4.22Å; L516-F519 HydrophobicContact CD2-CG 4.39Å; L516-F519 HydrophobicContact CG-CD1 4.17Å; F519-F521 AromaticContact CD2-CD1 4Å; F519-F521 HydrophobicContact CD2-CD1 4Å; F519-F521 HydrophobicContact CD2-CE1 4.38Å; F519-F521 AromaticContact CE2-CD1 3.83Å; F519-F521 HydrophobicContact CE2-CD1 3.83Å; F519-F521 AromaticContact CE2-CE1 3.82Å; F519-F521 HydrophobicContact CE2-CE1 3.82Å; F519-V541 HydrophobicContact CD1-CB 4.04Å; F519-V541 HydrophobicContact CD1-CG1 4.16Å; F519-V541 HydrophobicContact CD2-CB 4.16Å; F519-V541 HydrophobicContact CE1-CB 3.65Å; F519-V541 HydrophobicContact CE1-CG1 3.45Å; F519-V541 VanDerWaalsContact CE1-CG1 3.45Å; F519-V541 HydrophobicContact CE1-CG2 4.41Å; F519-V541 HydrophobicContact CE2-CB 3.8Å; F519-V541 HydrophobicContact CE2-CG1 4.37Å; F519-V541 HydrophobicContact CE2-CG2 3.84Å; F519-V541 HydrophobicContact CG-CB 4.3Å; F519-V541 HydrophobicContact CZ-CB 3.53Å; F519-V541 HydrophobicContact CZ-CG1 3.59Å; F519-V541 HydrophobicContact CZ-CG2 3.79Å; F519-V541 PolarHBondContact N-O 2.89Å; F519-V541 PolarHBondContact O-N 2.8Å; F519-I543 HydrophobicContact CD1-CD1 4.15Å; F519-I543 HydrophobicContact CE1-CD1 4.04Å
520	S	95.6	Very high	93.8	Very high	71 Å²	71	48.6 Å²	48.6	50%	0.497	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.9	-179.4	64.1	0	0	0	0	111.6	V539 N540	S520-V539 VanDerWaalsContact CA-O 3.3Å; S520-V539 WeakPolarHBondContact CA-O 3.05Å; S520-N540 WeakPolarHBondContact CB-OD1 3.36Å
521	F	95.9	Very high	93.5	Very high	3 Å²	3	51 Å²	51	1%	0.013	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	167.2	171.3	58.6	-87.3	0	0	0	110.8	I482 V492 V496 L505 F519 V523 T538 V539 V541	I482-F521 HydrophobicContact CD1-CE2 4.29Å; I482-F521 HydrophobicContact CG1-CD2 4.38Å; I482-F521 HydrophobicContact CG1-CE2 4.25Å; I482-F521 HydrophobicContact CG2-CD2 4Å; V492-F521 HydrophobicContact CG2-CB 3.75Å; V492-F521 HydrophobicContact CG2-CD1 4.16Å; V492-F521 HydrophobicContact CG2-CD2 4.4Å; V492-F521 HydrophobicContact CG2-CG 3.87Å; V496-F521 HydrophobicContact CB-CZ 4.43Å; V496-F521 HydrophobicContact CG1-CE1 4.26Å; V496-F521 HydrophobicContact CG1-CZ 4.44Å; V496-F521 HydrophobicContact CG2-CD1 4.22Å; V496-F521 HydrophobicContact CG2-CE1 3.82Å; V496-F521 HydrophobicContact CG2-CE2 4.3Å; V496-F521 HydrophobicContact CG2-CZ 3.87Å; L505-F521 HydrophobicContact CD1-CE2 4.44Å; L505-F521 HydrophobicContact CD1-CZ 4.18Å; L505-F521 HydrophobicContact CD2-CE2 3.94Å; L505-F521 HydrophobicContact CD2-CZ 4.02Å; F519-F521 AromaticContact CD2-CD1 4Å; F519-F521 HydrophobicContact CD2-CD1 4Å; F519-F521 HydrophobicContact CD2-CE1 4.38Å; F519-F521 AromaticContact CE2-CD1 3.83Å; F519-F521 HydrophobicContact CE2-CD1 3.83Å; F519-F521 AromaticContact CE2-CE1 3.82Å; F519-F521 HydrophobicContact CE2-CE1 3.82Å; F521-V523 HydrophobicContact CD2-CG1 4.21Å; F521-V523 HydrophobicContact CE2-CG1 3.81Å; F521-T538 WeakPolarHBondContact O-CA 3.26Å; F521-V539 HydrophobicContact CD1-CB 4.49Å; F521-V539 HydrophobicContact CD2-CB 4.22Å; F521-V539 HydrophobicContact CE1-CB 4.09Å; F521-V539 HydrophobicContact CE1-CG1 4.04Å; F521-V539 HydrophobicContact CE2-CB 3.8Å; F521-V539 HydrophobicContact CE2-CG1 4.25Å; F521-V539 HydrophobicContact CE2-CG2 3.98Å; F521-V539 HydrophobicContact CZ-CB 3.72Å; F521-V539 HydrophobicContact CZ-CG1 3.7Å; F521-V539 HydrophobicContact CZ-CG2 4.27Å; F521-V539 PolarHBondContact N-O 3.31Å; F521-V539 PolarHBondContact O-N 3.08Å; F521-V541 HydrophobicContact CE1-CG2 3.75Å; F521-V541 HydrophobicContact CZ-CG2 4.48Å
522	M	96.5	Very high	93.4	Very high	87 Å²	87	55.9 Å²	55.9	43%	0.429	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.5	173.5	-70.3	-178.7	-67.4	0	0	110.3	L483 A537	L483-M522 HydrophobicContact CB-CB 4.23Å; L483-M522 HydrophobicContact CD1-CB 4.01Å; L483-M522 HydrophobicContact CD1-CE 4.21Å; L483-M522 HydrophobicContact CG-CB 4.43Å; L483-M522 PolarHBondContact N-O 3.17Å; M522-A537 CarbonylContact C-O 3.43Å; M522-A537 WeakPolarHBondContact CA-O 3.38Å
523	V	96.9	Very high	93.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	145.2	163	-67.7	0	0	0	0	109.2	F443 V465 S481 I482 I498 L505 F521 N536 A537 V539	F443-V523 HydrophobicContact CE1-CG2 3.79Å; F443-V523 HydrophobicContact CE2-CG2 4.19Å; F443-V523 HydrophobicContact CZ-CB 4.12Å; F443-V523 HydrophobicContact CZ-CG2 3.53Å; V465-V523 HydrophobicContact CB-CG2 4.49Å; V465-V523 HydrophobicContact CG1-CG2 4.22Å; V465-V523 HydrophobicContact CG2-CG1 4.49Å; V465-V523 HydrophobicContact CG2-CG2 4.26Å; S481-V523 CarbonylContact O-C 3.57Å; S481-V523 WeakPolarHBondContact O-CA 3.41Å; I482-V523 HydrophobicContact CG1-CG1 4.38Å; I498-V523 HydrophobicContact CD1-CB 4.43Å; I498-V523 HydrophobicContact CD1-CG1 3.9Å; L505-V523 HydrophobicContact CD2-CG1 4.36Å; F521-V523 HydrophobicContact CD2-CG1 4.21Å; F521-V523 HydrophobicContact CE2-CG1 3.81Å; V523-N536 CarbonylContact O-C 3.57Å; V523-N536 VanDerWaalsContact O-CA 3.23Å; V523-N536 WeakPolarHBondContact O-CA 3.13Å; V523-A537 HydrophobicContact CG2-CB 4.06Å; V523-A537 WeakPolarHBondContact CG2-O 3.48Å; V523-A537 PolarHBondContact N-O 2.94Å; V523-A537 PolarHBondContact O-N 2.9Å; V523-V539 HydrophobicContact CB-CG2 4.49Å; V523-V539 HydrophobicContact CG1-CG2 3.79Å; V523-V539 HydrophobicContact CG2-CG2 3.92Å
524	Q	96.7	Very high	93.5	Very high	30 Å²	30	59.6 Å²	59.6	14%	0.14	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.4	172.3	171.4	163.6	103.7	0	0	109.3	Y480 S481 L483 K526 F534 S535 N536	Y480-Q524 WeakPolarHBondContact CA-O 3.48Å; S481-Q524 PolarHBondContact N-O 3.16Å; S481-Q524 PolarHBondContact O-N 2.78Å; L483-Q524 HydrophobicContact CD1-CB 4.35Å; L483-Q524 HydrophobicContact CD2-CB 4Å; L483-Q524 HydrophobicContact CG-CB 4.05Å; Q524-K526 HydrophobicContact CG-CB 4.4Å; Q524-F534 HydrophobicContact CG-CB 4.09Å; Q524-S535 WeakPolarHBondContact CA-O 3.24Å; Q524-N536 PolarHBondContact NE2-OD1 2.94Å
525	A	96.9	Very high	93.7	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128.8	166.3	0	0	0	0	0	107.4	P441 F443 A467 I478 Y480 F534 S535	P441-A525 HydrophobicContact CB-CB 4.01Å; F443-A525 HydrophobicContact CD2-CB 4.25Å; F443-A525 HydrophobicContact CE1-CB 4.04Å; F443-A525 HydrophobicContact CE2-CB 3.55Å; F443-A525 HydrophobicContact CZ-CB 3.43Å; F443-A525 VanDerWaalsContact CZ-CB 3.43Å; A467-A525 HydrophobicContact CB-CB 3.49Å; A467-A525 VanDerWaalsContact CB-CB 3.49Å; I478-A525 HydrophobicContact CG2-CB 3.81Å; Y480-A525 HydrophobicContact CD1-CB 4.12Å; Y480-A525 HydrophobicContact CE1-CB 4.01Å; A525-F534 CarbonylContact O-C 3.58Å; A525-F534 WeakPolarHBondContact O-CA 3.3Å; A525-F534 WeakPolarHBondContact O-CB 3.11Å; A525-S535 PolarHBondContact N-O 3.03Å; A525-S535 PolarHBondContact O-N 2.98Å
526	K	95.4	Very high	93.9	Very high	49 Å²	49	54.8 Å²	54.8	21%	0.213	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	135.9	-170.4	-177	-164.4	-179.8	-162.3	0	109.3	I478 T479 Q524 E532 L533 F534	I478-K526 CarbonylContact C-O 3.56Å; I478-K526 WeakPolarHBondContact CA-O 3.49Å; T479-K526 PolarHBondContact N-O 2.75Å; T479-K526 PolarHBondContact O-N 2.92Å; T479-K526 PolarHBondContact OG1-O 3.14Å; T479-K526 VanDerWaalsContact OG1-O 3.13Å; Q524-K526 HydrophobicContact CG-CB 4.4Å; K526-E532 VanDerWaalsContact CE-CB 3.43Å; K526-E532 WeakPolarHBondContact CE-OE1 3.38Å; K526-E532 VanDerWaalsContact CE-OE2 3.26Å; K526-E532 WeakPolarHBondContact CE-OE2 3.3Å; K526-E532 HydrophobicContact CG-CB 4.47Å; K526-E532 IonicContact NZ-OE1 2.71Å; K526-E532 PolarHBondContact NZ-OE1 2.83Å; K526-E532 IonicContact NZ-OE2 2.68Å; K526-E532 PolarHBondContact NZ-OE2 3.3Å; K526-L533 WeakPolarHBondContact CA-O 3.37Å; K526-F534 HydrophobicContact CB-CB 4.07Å; K526-F534 HydrophobicContact CG-CB 4.16Å
527	D	95.8	Very high	94.2	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	30%	0.296	C	S	.	.			trans	-73.4	-176	178	63.1	50.4	0	0	0	112.5	N437 P441 N475 L477 G529 E532 L533	N437-D527 PolarHBondContact ND2-OD2 2.84Å; P441-D527 HydrophobicContact CG-CB 3.9Å; N475-D527 WeakPolarHBondContact O-CB 3.45Å; L477-D527 CarbonylContact O-C 3.46Å; D527-G529 PolarHBondContact OD1-N 3.23Å; D527-E532 WeakPolarHBondContact OD1-CA 3.33Å; D527-L533 VanDerWaalsContact CG-N 3.34Å; D527-L533 PolarHBondContact N-O 2.88Å; D527-L533 PolarHBondContact OD1-N 3.09Å; D527-L533 VanDerWaalsContact OD2-CA 3.23Å; D527-L533 WeakPolarHBondContact OD2-CA 3.4Å; D527-L533 WeakPolarHBondContact OD2-CB 3.43Å; D527-L533 PolarHBondContact OD2-N 3.47Å
528	S	93.1	Very high	94.4	Very high	39 Å²	39	52.3 Å²	52.3	27%	0.273	29%	0.294	S	S	.	.			trans	-116.4	27.8	170.4	-51	0	0	0	0	111.9	Q474 L477	Q474-S528 CarbonylContact O-C 3.52Å; Q474-S528 WeakPolarHBondContact O-CA 3.33Å; Q474-S528 WeakPolarHBondContact O-CB 3.16Å; Q474-S528 PolarHBondContact O-N 2.77Å; L477-S528 PolarHBondContact O-N 2.9Å; L477-S528 VanDerWaalsContact O-N 3.17Å; L477-S528 PolarHBondContact O-OG 2.88Å
529	G	88.8	Confident	94.5	Very high	8 Å²	8	45.4 Å²	45.4	8%	0.082	26%	0.261	C	S	.	.	S	Bend	trans	-72.4	166.8	-178.2	0	0	0	0	0	114.1	N437 N475 D527 V531 E532	N437-G529 VanDerWaalsContact OD1-CA 3.3Å; N437-G529 WeakPolarHBondContact OD1-CA 3.27Å; N475-G529 WeakPolarHBondContact OD1-CA 3.3Å; D527-G529 PolarHBondContact OD1-N 3.23Å; G529-V531 PolarHBondContact O-N 3.3Å; G529-E532 WeakPolarHBondContact O-CG 3.5Å
530	A	83.6	Confident	94.6	Very high	106 Å²	106	46.9 Å²	46.9	88%	0.876	27%	0.27	S	S	*	.	S	Bend	trans	-67.7	-23.3	-179.4	0	0	0	0	0	113.8
531	V	87.8	Confident	94.6	Very high	115 Å²	115	43.5 Å²	43.5	70%	0.697	25%	0.247	S	C	*	.	S	Bend	trans	-128.1	98	165.5	176.7	0	0	0	0	106.1	G529 L533	G529-V531 PolarHBondContact O-N 3.3Å; V531-L533 PolarHBondContact O-N 2.81Å
532	E	92.5	Very high	94.6	Very high	109 Å²	109	45.4 Å²	45.4	51%	0.509	26%	0.256	S	S	.	.			trans	-68.6	120.9	-164.4	-47.9	164	117.1	0	0	112.3	K526 D527 G529	K526-E532 VanDerWaalsContact CE-CB 3.43Å; K526-E532 WeakPolarHBondContact CE-OE1 3.38Å; K526-E532 VanDerWaalsContact CE-OE2 3.26Å; K526-E532 WeakPolarHBondContact CE-OE2 3.3Å; K526-E532 HydrophobicContact CG-CB 4.47Å; K526-E532 IonicContact NZ-OE1 2.71Å; K526-E532 PolarHBondContact NZ-OE1 2.83Å; K526-E532 IonicContact NZ-OE2 2.68Å; K526-E532 PolarHBondContact NZ-OE2 3.3Å; D527-E532 WeakPolarHBondContact OD1-CA 3.33Å; G529-E532 WeakPolarHBondContact O-CG 3.5Å
533	L	94.7	Very high	94.6	Very high	56 Å²	56	41.5 Å²	41.5	29%	0.293	24%	0.237	S	C	.	.			trans	-99.3	160.6	174.3	-54.9	177.6	0	0	0	110.8	N437 N439 A440 K526 D527 V531	N437-L533 WeakPolarHBondContact ND2-CD1 3.33Å; N437-L533 WeakPolarHBondContact ND2-CG 3.49Å; N439-L533 VanDerWaalsContact O-CD1 3.25Å; N439-L533 WeakPolarHBondContact O-CD1 3.27Å; A440-L533 HydrophobicContact CB-CB 3.81Å; A440-L533 HydrophobicContact CB-CD1 4.49Å; K526-L533 WeakPolarHBondContact CA-O 3.37Å; D527-L533 VanDerWaalsContact CG-N 3.34Å; D527-L533 PolarHBondContact N-O 2.88Å; D527-L533 PolarHBondContact OD1-N 3.09Å; D527-L533 VanDerWaalsContact OD2-CA 3.23Å; D527-L533 WeakPolarHBondContact OD2-CA 3.4Å; D527-L533 WeakPolarHBondContact OD2-CB 3.43Å; D527-L533 PolarHBondContact OD2-N 3.47Å; V531-L533 PolarHBondContact O-N 2.81Å
534	F	95.6	Very high	94.4	Very high	115 Å²	115	44.3 Å²	44.3	50%	0.504	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	156.5	-174.8	61.2	-90.8	0	0	0	112.6	Q524 A525 K526	Q524-F534 HydrophobicContact CG-CB 4.09Å; A525-F534 CarbonylContact O-C 3.58Å; A525-F534 WeakPolarHBondContact O-CA 3.3Å; A525-F534 WeakPolarHBondContact O-CB 3.11Å; K526-F534 HydrophobicContact CB-CB 4.07Å; K526-F534 HydrophobicContact CG-CB 4.16Å
535	S	96.4	Very high	94.3	Very high	32 Å²	32	44.3 Å²	44.3	22%	0.224	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	164.7	159.2	82.5	0	0	0	0	111.4	P441 F443 Q524 A525	P441-S535 WeakPolarHBondContact O-CB 3.01Å; P441-S535 PolarHBondContact O-OG 2.7Å; F443-S535 WeakPolarHBondContact CD2-OG 3.29Å; F443-S535 WeakPolarHBondContact CE2-O 3.49Å; Q524-S535 WeakPolarHBondContact CA-O 3.24Å; A525-S535 PolarHBondContact N-O 3.03Å; A525-S535 PolarHBondContact O-N 2.98Å
536	N	96.4	Very high	94.1	Very high	68 Å²	68	48.5 Å²	48.5	36%	0.364	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	146.2	178.2	-57.1	-11.6	0	0	0	109.6	L483 V523 Q524	L483-N536 WeakPolarHBondContact CD1-ND2 3.17Å; V523-N536 CarbonylContact O-C 3.57Å; V523-N536 VanDerWaalsContact O-CA 3.23Å; V523-N536 WeakPolarHBondContact O-CA 3.13Å; Q524-N536 PolarHBondContact NE2-OD1 2.94Å
537	A	96.3	Very high	94	Very high	2 Å²	2	46.6 Å²	46.6	2%	0.017	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	151	167.6	0	0	0	0	0	110.3	F443 Y448 M522 V523	F443-A537 HydrophobicContact CB-CB 3.93Å; F443-A537 HydrophobicContact CD1-CB 4.12Å; F443-A537 HydrophobicContact CD2-CB 3.5Å; F443-A537 VanDerWaalsContact CD2-CB 3.5Å; F443-A537 HydrophobicContact CE2-CB 3.95Å; F443-A537 HydrophobicContact CG-CB 3.59Å; F443-A537 HydrophobicContact CZ-CB 4.44Å; Y448-A537 HydrophobicContact CD2-CB 4.2Å; Y448-A537 HydrophobicContact CE2-CB 3.86Å; M522-A537 CarbonylContact C-O 3.43Å; M522-A537 WeakPolarHBondContact CA-O 3.38Å; V523-A537 HydrophobicContact CG2-CB 4.06Å; V523-A537 WeakPolarHBondContact CG2-O 3.48Å; V523-A537 PolarHBondContact N-O 2.94Å; V523-A537 PolarHBondContact O-N 2.9Å
538	T	96.9	Very high	93.9	Very high	46 Å²	46	50.3 Å²	50.3	28%	0.282	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	138.3	176.1	-54.3	0	0	0	0	110	A446 V447 Y448 F521	A446-T538 PolarHBondContact O-N 2.89Å; V447-T538 CarbonylContact C-O 3.53Å; V447-T538 VanDerWaalsContact CA-O 3.28Å; V447-T538 WeakPolarHBondContact CA-O 3.39Å; Y448-T538 PolarHBondContact N-O 3.41Å; F521-T538 WeakPolarHBondContact O-CA 3.26Å
539	V	97.3	Very high	93.8	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	117.4	169.6	-175.1	0	0	0	0	107.9	Y448 V450 V465 L505 S520 F521 V523 V541	Y448-V539 WeakPolarHBondContact O-CA 3.45Å; V450-V539 HydrophobicContact CB-CG1 4.41Å; V450-V539 HydrophobicContact CG2-CG1 3.61Å; V465-V539 HydrophobicContact CG1-CG2 4.03Å; L505-V539 HydrophobicContact CD1-CG1 3.99Å; L505-V539 HydrophobicContact CD1-CG2 4.1Å; S520-V539 VanDerWaalsContact CA-O 3.3Å; S520-V539 WeakPolarHBondContact CA-O 3.05Å; F521-V539 HydrophobicContact CD1-CB 4.49Å; F521-V539 HydrophobicContact CD2-CB 4.22Å; F521-V539 HydrophobicContact CE1-CB 4.09Å; F521-V539 HydrophobicContact CE1-CG1 4.04Å; F521-V539 HydrophobicContact CE2-CB 3.8Å; F521-V539 HydrophobicContact CE2-CG1 4.25Å; F521-V539 HydrophobicContact CE2-CG2 3.98Å; F521-V539 HydrophobicContact CZ-CB 3.72Å; F521-V539 HydrophobicContact CZ-CG1 3.7Å; F521-V539 HydrophobicContact CZ-CG2 4.27Å; F521-V539 PolarHBondContact N-O 3.31Å; F521-V539 PolarHBondContact O-N 3.08Å; V523-V539 HydrophobicContact CB-CG2 4.49Å; V523-V539 HydrophobicContact CG1-CG2 3.79Å; V523-V539 HydrophobicContact CG2-CG2 3.92Å; V539-V541 HydrophobicContact CG1-CG2 4.36Å
540	N	96.8	Very high	93.9	Very high	48 Å²	48	53 Å²	53	26%	0.257	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	110.2	173	-58.9	-32.7	0	0	0	107.8	V447 Y448 D449 V450 S520	V447-N540 WeakPolarHBondContact CG1-ND2 3.34Å; Y448-N540 PolarHBondContact O-N 3.04Å; D449-N540 WeakPolarHBondContact OD1-CB 3.4Å; D449-N540 PolarHBondContact OD1-ND2 2.87Å; V450-N540 PolarHBondContact N-O 2.89Å; S520-N540 WeakPolarHBondContact CB-OD1 3.36Å
541	V	96.1	Very high	94.4	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	114.5	170.1	175.6	0	0	0	0	108.1	V450 V452 I462 E518 F519 F521 V539 I543	V450-V541 HydrophobicContact CB-CG2 4.35Å; V450-V541 WeakPolarHBondContact O-CA 3.29Å; V452-V541 HydrophobicContact CB-CG1 4.37Å; V452-V541 HydrophobicContact CG2-CG1 3.84Å; I462-V541 HydrophobicContact CD1-CG2 4.35Å; E518-V541 VanDerWaalsContact CA-O 3.31Å; E518-V541 WeakPolarHBondContact CA-O 3.1Å; F519-V541 HydrophobicContact CD1-CB 4.04Å; F519-V541 HydrophobicContact CD1-CG1 4.16Å; F519-V541 HydrophobicContact CD2-CB 4.16Å; F519-V541 HydrophobicContact CE1-CB 3.65Å; F519-V541 HydrophobicContact CE1-CG1 3.45Å; F519-V541 VanDerWaalsContact CE1-CG1 3.45Å; F519-V541 HydrophobicContact CE1-CG2 4.41Å; F519-V541 HydrophobicContact CE2-CB 3.8Å; F519-V541 HydrophobicContact CE2-CG1 4.37Å; F519-V541 HydrophobicContact CE2-CG2 3.84Å; F519-V541 HydrophobicContact CG-CB 4.3Å; F519-V541 HydrophobicContact CZ-CB 3.53Å; F519-V541 HydrophobicContact CZ-CG1 3.59Å; F519-V541 HydrophobicContact CZ-CG2 3.79Å; F519-V541 PolarHBondContact N-O 2.89Å; F519-V541 PolarHBondContact O-N 2.8Å; F521-V541 HydrophobicContact CE1-CG2 3.75Å; F521-V541 HydrophobicContact CZ-CG2 4.48Å; V539-V541 HydrophobicContact CG1-CG2 4.36Å; V541-I543 HydrophobicContact CG1-CG1 4.31Å
542	I	96.1	Very high	94.5	Very high	43 Å²	43	46.2 Å²	46.2	22%	0.221	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.8	178.3	-58.5	169	0	0	0	106.6	D449 V450 Y451 V452	D449-I542 HydrophobicContact CB-CD1 4.34Å; V450-I542 PolarHBondContact O-N 3.19Å; Y451-I542 WeakPolarHBondContact CA-O 3.39Å; Y451-I542 HydrophobicContact CD1-CB 3.95Å; Y451-I542 HydrophobicContact CD1-CD1 4.38Å; Y451-I542 HydrophobicContact CD1-CG2 3.94Å; Y451-I542 HydrophobicContact CE1-CB 4.04Å; Y451-I542 HydrophobicContact CE1-CD1 3.68Å; Y451-I542 HydrophobicContact CE1-CG1 4.47Å; Y451-I542 HydrophobicContact CE1-CG2 3.89Å; V452-I542 PolarHBondContact N-O 3.1Å
543	I	95.7	Very high	94.3	Very high	4 Å²	4	43 Å²	43	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132	-177.3	-66.2	152.8	0	0	0	108.6	V452 E454 F511 Y513 L516 K517 F519 V541	V452-I543 CarbonylContact O-C 3.45Å; V452-I543 VanDerWaalsContact O-CA 3.29Å; V452-I543 WeakPolarHBondContact O-CA 2.91Å; E454-I543 HydrophobicContact CB-CG2 3.97Å; F511-I543 HydrophobicContact CB-CD1 3.67Å; F511-I543 HydrophobicContact CB-CG1 3.9Å; F511-I543 HydrophobicContact CB-CG2 4.14Å; F511-I543 HydrophobicContact CD1-CD1 4Å; F511-I543 HydrophobicContact CD2-CD1 4.5Å; F511-I543 HydrophobicContact CD2-CG1 4.31Å; F511-I543 HydrophobicContact CG-CD1 3.82Å; F511-I543 HydrophobicContact CG-CG1 4.06Å; Y513-I543 HydrophobicContact CD2-CB 4.26Å; Y513-I543 HydrophobicContact CD2-CG2 4.02Å; Y513-I543 VanDerWaalsContact CD2-O 3.3Å; Y513-I543 WeakPolarHBondContact CD2-O 3.48Å; Y513-I543 WeakPolarHBondContact CE2-O 3.26Å; L516-I543 HydrophobicContact CB-CD1 4.28Å; L516-I543 HydrophobicContact CD2-CD1 4.31Å; L516-I543 HydrophobicContact CG-CD1 4.01Å; L516-I543 WeakPolarHBondContact O-CD1 3.29Å; K517-I543 PolarHBondContact O-N 2.68Å; F519-I543 HydrophobicContact CD1-CD1 4.15Å; F519-I543 HydrophobicContact CE1-CD1 4.04Å; V541-I543 HydrophobicContact CG1-CG1 4.31Å
544	V	94.3	Very high	93.9	Very high	60 Å²	60	44.5 Å²	44.5	36%	0.364	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	104.9	-175.4	-176.4	0	0	0	0	109.5	Y451 V452 T453 E454	Y451-V544 HydrophobicContact CD1-CG2 4.06Å; V452-V544 PolarHBondContact O-N 3.34Å; T453-V544 WeakPolarHBondContact CA-O 3.45Å; E454-V544 WeakPolarHBondContact CG-O 3.15Å; E454-V544 PolarHBondContact N-O 3.33Å
545	D	94.3	Very high	93.4	Very high	29 Å²	29	40.6 Å²	40.6	16%	0.155	24%	0.239	C	C	.	.			trans	-24.7	130.3	162.7	-167.4	-28.6	0	0	0	115	E454 Y513 D587 N590	E454-D545 WeakPolarHBondContact OE2-CA 3.14Å; Y513-D545 HydrophobicContact CD1-CB 3.61Å; Y513-D545 HydrophobicContact CE1-CB 3.47Å; Y513-D545 VanDerWaalsContact CE1-CB 3.47Å; Y513-D545 VanDerWaalsContact CE1-OD2 3.28Å; Y513-D545 WeakPolarHBondContact CE1-OD2 3.11Å; Y513-D545 HydrophobicContact CE2-CB 4.42Å; Y513-D545 HydrophobicContact CG-CB 4.15Å; D545-D587 WeakPolarHBondContact OD2-CA 3.39Å; D545-D587 VanDerWaalsContact OD2-CB 3.3Å; D545-D587 WeakPolarHBondContact OD2-CB 3.25Å; D545-D587 PolarHBondContact OD2-N 2.99Å; D545-N590 PolarHBondContact OD1-ND2 3.26Å
546	Q	92.8	Very high	92.6	Very high	88 Å²	88	40.4 Å²	40.4	41%	0.411	24%	0.237	S	C	.	.			trans	-125.2	155.1	162.9	-63.4	-171.7	30.4	0	0	110.1	E454 D548 N590	E454-Q546 HydrophobicContact CG-CB 3.83Å; E454-Q546 HydrophobicContact CG-CG 3.77Å; E454-Q546 PolarHBondContact OE2-N 2.85Å; Q546-D548 PolarHBondContact O-N 3.36Å; Q546-N590 VanDerWaalsContact C-ND2 3.32Å
547	N	93.6	Very high	91.6	Very high	9 Å²	9	44.6 Å²	44.6	5%	0.048	26%	0.257	C	S	.	.	S	Bend	trans	-77.2	67	-177.2	-159.3	119.6	0	0	0	111.3	D586 N590 D639 G641 L645	N547-D586 WeakPolarHBondContact CA-OD2 3.43Å; N547-N590 HydrophobicContact CB-CB 4.1Å; N547-N590 PolarHBondContact N-ND2 2.7Å; N547-N590 WeakPolarHBondContact OD1-CA 3.36Å; N547-N590 WeakPolarHBondContact OD1-CB 3.45Å; N547-D639 PolarHBondContact ND2-OD2 3.09Å; N547-D639 PolarHBondContact OD1-OD2 3.43Å; N547-G641 WeakPolarHBondContact OD1-CA 3.48Å; N547-G641 PolarHBondContact OD1-N 3.45Å; N547-L645 WeakPolarHBondContact ND2-CG 3.42Å; N547-L645 VanDerWaalsContact O-CD1 3.26Å; N547-L645 WeakPolarHBondContact O-CD1 3.32Å
548	D	92	Very high	90.3	Very high	80 Å²	80	45.5 Å²	45.5	43%	0.428	27%	0.267	S	S	.	.			trans	-88.7	-36.5	-174.5	149.7	-65.5	0	0	0	111.6	N455 Q546	N455-D548 PolarHBondContact ND2-OD2 2.85Å; Q546-D548 PolarHBondContact O-N 3.36Å
549	N	92.1	Very high	88.6	Confident	52 Å²	52	52.7 Å²	52.7	28%	0.278	29%	0.294	S	S	.	.	S	Bend	trans	-87.9	152.2	175.5	-58.9	-89.2	0	0	0	111.8	A585 D586 L645	N549-A585 HydrophobicContact CB-CB 3.93Å; N549-D586 WeakPolarHBondContact CB-OD1 3.43Å; N549-D586 PolarHBondContact N-OD1 2.59Å; N549-D586 PolarHBondContact ND2-OD1 2.91Å; N549-L645 WeakPolarHBondContact O-CD1 3.18Å
550	A	91.4	Very high	87.2	Confident	52 Å²	52	60.7 Å²	60.7	43%	0.43	34%	0.337	S	S	.	.			trans	-110.4	139.4	177.9	0	0	0	0	0	111.1	S552 D584 L645	A550-S552 PolarHBondContact O-N 2.84Å; A550-D584 VanDerWaalsContact C-OD1 3.23Å; A550-L645 HydrophobicContact CB-CB 3.99Å; A550-L645 HydrophobicContact CB-CD1 4.24Å
551	P	93.3	Very high	86	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	35%	0.353	C	S	.	.			trans	-56	120.9	-172	13.7	-29.4	0	0	0	113.4	D584 L593 V637 S647	P551-D584 WeakPolarHBondContact CA-OD1 3.21Å; P551-D584 WeakPolarHBondContact CA-OD2 3.35Å; P551-D584 WeakPolarHBondContact CB-OD2 3.35Å; P551-D584 WeakPolarHBondContact CD-OD2 3.4Å; P551-L593 HydrophobicContact CB-CD2 3.62Å; P551-V637 HydrophobicContact CB-CB 4.31Å; P551-V637 HydrophobicContact CB-CG1 3.85Å; P551-V637 HydrophobicContact CG-CG1 4.36Å; P551-V637 WeakPolarHBondContact CG-O 3.36Å; P551-S647 WeakPolarHBondContact O-CB 3.42Å; P551-S647 PolarHBondContact O-OG 3Å
552	S	90.4	Very high	85.3	Confident	77 Å²	77	63.4 Å²	63.4	54%	0.538	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124.4	-175.4	-169.9	0	0	0	0	112.4	A550 I554 A582 M583	A550-S552 PolarHBondContact O-N 2.84Å; S552-I554 PolarHBondContact O-N 3.14Å; S552-A582 CarbonylContact O-C 3.56Å; S552-A582 WeakPolarHBondContact O-CA 3.44Å; S552-A582 VanDerWaalsContact O-CB 3.28Å; S552-A582 WeakPolarHBondContact O-CB 3.46Å; S552-M583 PolarHBondContact N-O 2.91Å; S552-M583 PolarHBondContact O-N 2.83Å
553	V	88.1	Confident	84.8	Confident	41 Å²	41	61.6 Å²	61.6	25%	0.248	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	107.8	-178.5	-173.3	0	0	0	0	111.3	I580 A582 V637 A649	V553-I580 HydrophobicContact CG1-CG2 3.91Å; V553-A582 HydrophobicContact CG2-CB 4.26Å; V553-V637 HydrophobicContact CG2-CG2 3.82Å; V553-A649 HydrophobicContact CB-CB 4.49Å; V553-A649 HydrophobicContact CG1-CB 4.1Å; V553-A649 HydrophobicContact CG2-CB 4.23Å
554	I	87	Confident	84.3	Confident	89 Å²	89	68 Å²	68	46%	0.456	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-33.4	-179.2	-61.8	179.2	0	0	0	111.9	S552 I557 V581 M583	S552-I554 PolarHBondContact O-N 3.14Å; I554-I557 WeakPolarHBondContact O-CG1 3.45Å; I554-V581 PolarHBondContact N-O 3.03Å; I554-M583 HydrophobicContact CD1-CB 3.58Å; I554-M583 HydrophobicContact CD1-SD 4.31Å; I554-M583 HydrophobicContact CG1-CB 4.43Å
555	A	83.9	Confident	84	Confident	33 Å²	33	67.1 Å²	67.1	27%	0.273	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	151.6	178.4	0	0	0	0	0	112.9	I580 V581	A555-I580 WeakPolarHBondContact O-CA 3.39Å; A555-V581 HydrophobicContact CB-CB 4.22Å; A555-V581 PolarHBondContact N-O 2.96Å; A555-V581 PolarHBondContact O-N 2.93Å
556	P	80.5	Confident	83.5	Confident	28 Å²	28	70.7 Å²	70.7	18%	0.182	39%	0.394	C	S	.	.	S	Bend	cis	-75.2	138.3	-5.3	29.6	-34.9	0	0	0	113.4	G558 A563 E565 T578 I580	P556-G558 PolarHBondContact O-N 2.96Å; P556-A563 HydrophobicContact CB-CB 3.93Å; P556-A563 HydrophobicContact CG-CB 3.58Å; P556-E565 VanDerWaalsContact CB-OE1 3.28Å; P556-E565 WeakPolarHBondContact CB-OE1 3.29Å; P556-E565 WeakPolarHBondContact CG-OE1 3.22Å; P556-T578 HydrophobicContact CG-CG2 4.28Å; P556-I580 HydrophobicContact CG-CD1 4.27Å
557	I	74.4	Confident	83.2	Confident	155 Å²	155	66.6 Å²	66.6	80%	0.795	37%	0.374	S	S	*	.			trans	-80.5	113.9	-176.6	-56.5	177.9	0	0	0	110.8	I554	I554-I557 WeakPolarHBondContact O-CG1 3.45Å
558	G	68.5	Low	82.6	Confident	21 Å²	21	66.8 Å²	66.8	22%	0.216	38%	0.376	C	S	.	.			trans	-90.7	135.9	178.1	0	0	0	0	0	114.6	P556 N560 G561 T562	P556-G558 PolarHBondContact O-N 2.96Å; G558-N560 PolarHBondContact O-N 3.37Å; G558-G561 PolarHBondContact O-N 3.06Å; G558-T562 VanDerWaalsContact CA-C 3.44Å; G558-T562 WeakPolarHBondContact CA-O 3.17Å
559	K	61.8	Low	82	Confident	197 Å²	197	66 Å²	66	86%	0.857	37%	0.367	S	S	*	.	B	Isolated β-bridge	trans	-65.5	127.1	162.4	-72.4	-173	177.7	-178.2	0	108.4	G561	K559-G561 VanDerWaalsContact C-N 3.3Å; K559-G561 PolarHBondContact O-N 2.81Å
560	N	67.8	Low	81.3	Confident	168 Å²	168	68 Å²	68	90%	0.898	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	36.3	-173.7	-52.3	7.7	0	0	0	113.3	G558 T562	G558-N560 PolarHBondContact O-N 3.37Å; N560-T562 PolarHBondContact O-N 2.79Å
561	G	71.2	Confident	80.9	Confident	57 Å²	57	66 Å²	66	59%	0.588	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	2.8	173.7	0	0	0	0	0	115.8	G558 K559	G558-G561 PolarHBondContact O-N 3.06Å; K559-G561 VanDerWaalsContact C-N 3.3Å; K559-G561 PolarHBondContact O-N 2.81Å
562	T	81.9	Confident	80.5	Confident	48 Å²	48	71.3 Å²	71.3	29%	0.294	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	112.9	173.6	-55.5	0	0	0	0	110.3	G558 N560 S650	G558-T562 VanDerWaalsContact CA-C 3.44Å; G558-T562 WeakPolarHBondContact CA-O 3.17Å; N560-T562 PolarHBondContact O-N 2.79Å; T562-S650 CarbonylContact C-O 3.45Å; T562-S650 WeakPolarHBondContact CA-O 3.31Å
563	A	85.4	Confident	80.2	Confident	5 Å²	5	70.8 Å²	70.8	4%	0.041	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	148.2	170.8	0	0	0	0	0	110.2	P556 S650 V651 S652	P556-A563 HydrophobicContact CB-CB 3.93Å; P556-A563 HydrophobicContact CG-CB 3.58Å; A563-S650 PolarHBondContact N-O 2.79Å; A563-V651 HydrophobicContact CB-CG2 4.35Å; A563-S652 PolarHBondContact O-N 2.78Å
564	K	84.8	Confident	80.2	Confident	140 Å²	140	69.6 Å²	69.6	61%	0.609	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	114.1	179	-70.9	-171.1	170	-166.3	0	109.3	S652 I654	K564-S652 WeakPolarHBondContact CA-O 3.28Å; K564-I654 HydrophobicContact CB-CD1 4.2Å; K564-I654 HydrophobicContact CD-CD1 4.05Å; K564-I654 HydrophobicContact CG-CD1 4.29Å
565	E	87.8	Confident	80.2	Confident	41 Å²	41	69.4 Å²	69.4	19%	0.192	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.8	-173.5	-65	-70.5	-166.7	0	0	110.4	P556 V577 T578 V651 S652 V653 I654	P556-E565 VanDerWaalsContact CB-OE1 3.28Å; P556-E565 WeakPolarHBondContact CB-OE1 3.29Å; P556-E565 WeakPolarHBondContact CG-OE1 3.22Å; E565-V577 HydrophobicContact CB-CG1 4.07Å; E565-T578 HydrophobicContact CG-CG2 3.97Å; E565-T578 WeakPolarHBondContact OE1-CB 3.17Å; E565-T578 PolarHBondContact OE1-OG1 2.66Å; E565-V651 HydrophobicContact CB-CG1 4.36Å; E565-V651 HydrophobicContact CG-CG1 3.84Å; E565-S652 PolarHBondContact N-O 3.44Å; E565-V653 CarbonylContact O-C 3.59Å; E565-V653 WeakPolarHBondContact O-CA 3.41Å; E565-I654 PolarHBondContact O-N 3.4Å
566	H	84.5	Confident	80.5	Confident	104 Å²	104	71.1 Å²	71.1	48%	0.481	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118.5	-173	-71	-69.3	0	0	0	111.9	V656	H566-V656 HydrophobicContact CB-CG2 4.04Å; H566-V656 WeakPolarHBondContact ND1-CG2 3.43Å
567	L	86.4	Confident	80.9	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.005	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111.6	-179.9	178	57.2	0	0	0	110.7	R569 A571 Y575 V577 F606 T617 I621 V653 I654 L655 V656	L567-R569 PolarHBondContact O-N 3.43Å; L567-A571 HydrophobicContact CD1-CB 3.61Å; L567-Y575 HydrophobicContact CD1-CD1 3.51Å; L567-Y575 HydrophobicContact CD1-CE1 3.62Å; L567-Y575 HydrophobicContact CD1-CG 4.43Å; L567-V577 HydrophobicContact CD1-CG2 4.38Å; L567-F606 HydrophobicContact CD2-CE1 3.9Å; L567-F606 HydrophobicContact CD2-CZ 4.13Å; L567-T617 HydrophobicContact CD1-CG2 3.85Å; L567-T617 HydrophobicContact CD2-CG2 4.11Å; L567-I621 HydrophobicContact CD2-CD1 3.92Å; L567-I621 HydrophobicContact CG-CD1 3.98Å; L567-V653 HydrophobicContact CB-CG1 3.54Å; L567-V653 HydrophobicContact CD2-CG1 3.83Å; L567-V653 HydrophobicContact CG-CG1 4.34Å; L567-I654 PolarHBondContact N-O 2.94Å; L567-L655 HydrophobicContact CB-CD2 4.2Å; L567-L655 HydrophobicContact CD2-CD2 4.01Å; L567-L655 HydrophobicContact CG-CD2 4.11Å; L567-L655 WeakPolarHBondContact O-CA 3.14Å; L567-V656 PolarHBondContact O-N 2.8Å
568	P	81.8	Confident	81.6	Confident	13 Å²	13	64 Å²	64	8%	0.084	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	134.1	173.4	20.9	-30.6	0	0	0	111.5	S570 A571 Y575 V656 V659	P568-S570 PolarHBondContact O-N 2.77Å; P568-S570 VanDerWaalsContact O-N 3.12Å; P568-A571 HydrophobicContact CG-CB 4.41Å; P568-A571 WeakPolarHBondContact O-CB 3.03Å; P568-A571 PolarHBondContact O-N 3.4Å; P568-Y575 WeakPolarHBondContact CD-OH 3.27Å; P568-Y575 HydrophobicContact CG-CE1 4.41Å; P568-Y575 HydrophobicContact CG-CE2 3.97Å; P568-V656 CarbonylContact C-O 3.43Å; P568-V656 VanDerWaalsContact CA-O 3.32Å; P568-V656 WeakPolarHBondContact CA-O 3.44Å; P568-V659 HydrophobicContact CB-CG2 4.19Å; P568-V659 HydrophobicContact CG-CG2 4.22Å
569	R	78.5	Confident	82.6	Confident	65 Å²	65	69.6 Å²	69.6	25%	0.245	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.8	179	-68.8	172	80.3	-142.6	8.9	113.6	L567 A571 R625 L655 V656 D657	L567-R569 PolarHBondContact O-N 3.43Å; R569-A571 VanDerWaalsContact C-N 3.33Å; R569-R625 PolarHBondContact NH2-O 3.07Å; R569-L655 HydrophobicContact CG-CB 3.96Å; R569-L655 HydrophobicContact CG-CD1 4.47Å; R569-L655 HydrophobicContact CG-CD2 4.45Å; R569-V656 PolarHBondContact N-O 2.98Å; R569-D657 WeakPolarHBondContact CD-OD1 3.45Å; R569-D657 IonicContact CZ-OD1 2.73Å; R569-D657 IonicContact NE-OD1 3.67Å; R569-D657 IonicContact NH1-OD1 2.7Å; R569-D657 PolarHBondContact NH1-OD1 2.75Å
570	S	78.6	Confident	84	Confident	94 Å²	94	60.2 Å²	60.2	66%	0.657	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-2	171.1	52.8	0	0	0	0	114.7	P568 E572	P568-S570 PolarHBondContact O-N 2.77Å; P568-S570 VanDerWaalsContact O-N 3.12Å; S570-E572 PolarHBondContact O-N 2.93Å
571	A	82.5	Confident	85.1	Confident	8 Å²	8	54.6 Å²	54.6	7%	0.066	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-58	129	-177.3	0	0	0	0	0	113.3	L567 P568 R569 Y575 T617	L567-A571 HydrophobicContact CD1-CB 3.61Å; P568-A571 HydrophobicContact CG-CB 4.41Å; P568-A571 WeakPolarHBondContact O-CB 3.03Å; P568-A571 PolarHBondContact O-N 3.4Å; R569-A571 VanDerWaalsContact C-N 3.33Å; A571-Y575 HydrophobicContact CB-CD1 4.14Å; A571-Y575 HydrophobicContact CB-CD2 4.14Å; A571-Y575 HydrophobicContact CB-CG 3.82Å; A571-T617 HydrophobicContact CB-CG2 4.42Å
572	E	84.1	Confident	86	Confident	113 Å²	113	52.5 Å²	52.5	53%	0.528	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-79.9	162.9	172.7	-56.3	-137.9	128.3	0	0	111.4	S570 G574 Y575 T617 R620	S570-E572 PolarHBondContact O-N 2.93Å; E572-G574 PolarHBondContact O-N 2.83Å; E572-Y575 WeakPolarHBondContact O-CB 3.45Å; E572-Y575 PolarHBondContact O-N 2.81Å; E572-T617 PolarHBondContact O-OG1 2.88Å; E572-R620 VanDerWaalsContact CD-NH2 3.29Å; E572-R620 IonicContact OE1-CZ 3.13Å; E572-R620 IonicContact OE1-NH1 3.14Å; E572-R620 PolarHBondContact OE1-NH1 2.78Å; E572-R620 IonicContact OE1-NH2 2.69Å; E572-R620 PolarHBondContact OE1-NH2 2.85Å; E572-R620 IonicContact OE2-NH2 3.69Å
573	P	85.6	Confident	86.5	Confident	66 Å²	66	56 Å²	56	43%	0.429	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	129.4	174.8	-19.9	34.1	0	0	0	111.1	T617 R620	P573-T617 WeakPolarHBondContact CA-OG1 3.41Å; P573-R620 HydrophobicContact CG-CG 3.9Å
574	G	86.2	Confident	86.9	Confident	15 Å²	15	56.4 Å²	56.4	16%	0.155	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	100	-6.8	-176.9	0	0	0	0	0	115.2	E572 L576 R616 T617	E572-G574 PolarHBondContact O-N 2.83Å; G574-L576 PolarHBondContact O-N 3.38Å; G574-R616 PolarHBondContact O-NH1 3.21Å; G574-T617 WeakPolarHBondContact CA-O 3.07Å; G574-T617 PolarHBondContact N-O 2.85Å; G574-T617 PolarHBondContact N-OG1 2.78Å
575	Y	88.1	Confident	87.3	Confident	86 Å²	86	52.1 Å²	52.1	34%	0.337	27%	0.274	S	S	.	.			trans	-52.4	131.1	170.9	179.1	-86.6	0	0	0	110.9	L567 P568 A571 E572 V577 R616 T617	L567-Y575 HydrophobicContact CD1-CD1 3.51Å; L567-Y575 HydrophobicContact CD1-CE1 3.62Å; L567-Y575 HydrophobicContact CD1-CG 4.43Å; P568-Y575 WeakPolarHBondContact CD-OH 3.27Å; P568-Y575 HydrophobicContact CG-CE1 4.41Å; P568-Y575 HydrophobicContact CG-CE2 3.97Å; A571-Y575 HydrophobicContact CB-CD1 4.14Å; A571-Y575 HydrophobicContact CB-CD2 4.14Å; A571-Y575 HydrophobicContact CB-CG 3.82Å; E572-Y575 WeakPolarHBondContact O-CB 3.45Å; E572-Y575 PolarHBondContact O-N 2.81Å; Y575-V577 HydrophobicContact CD1-CG2 4.49Å; Y575-R616 CarbonylContact O-C 3.54Å; Y575-R616 WeakPolarHBondContact O-CA 3.24Å; Y575-T617 HydrophobicContact CD1-CG2 4.44Å; Y575-T617 PolarHBondContact N-OG1 3.39Å; Y575-T617 VanDerWaalsContact N-OG1 3.11Å; Y575-T617 PolarHBondContact O-N 3.12Å
576	L	89.8	Confident	87.6	Confident	68 Å²	68	50.6 Å²	50.6	36%	0.356	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	118.1	177.7	-176.5	66.8	0	0	0	109.6	G574 T578 E614 R616	G574-L576 PolarHBondContact O-N 3.38Å; L576-T578 WeakPolarHBondContact CD1-O 3.35Å; L576-E614 HydrophobicContact CD1-CB 3.85Å; L576-E614 HydrophobicContact CD1-CG 3.97Å; L576-R616 HydrophobicContact CB-CG 4.47Å; L576-R616 HydrophobicContact CD1-CG 3.89Å
577	V	88.9	Confident	88	Confident	14 Å²	14	49.4 Å²	49.4	9%	0.085	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-53.4	178.5	-174.1	0	0	0	0	109.4	E565 L567 Y575 F606 L615 T617 V653	E565-V577 HydrophobicContact CB-CG1 4.07Å; L567-V577 HydrophobicContact CD1-CG2 4.38Å; Y575-V577 HydrophobicContact CD1-CG2 4.49Å; V577-F606 HydrophobicContact CG2-CD1 4.08Å; V577-F606 HydrophobicContact CG2-CE1 3.92Å; V577-L615 HydrophobicContact CB-CD2 4.03Å; V577-L615 HydrophobicContact CB-CG 4.19Å; V577-L615 WeakPolarHBondContact CB-O 3.31Å; V577-L615 HydrophobicContact CG1-CD2 4.08Å; V577-L615 HydrophobicContact CG2-CG 4.41Å; V577-L615 PolarHBondContact N-O 2.83Å; V577-T617 HydrophobicContact CG2-CG2 4.31Å; V577-V653 HydrophobicContact CG1-CG1 3.78Å; V577-V653 HydrophobicContact CG1-CG2 3.98Å
578	T	89.4	Confident	88.2	Confident	19 Å²	19	52.1 Å²	52.1	12%	0.117	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	175.7	175.6	-166.8	0	0	0	0	109	P556 E565 L576 I580 L615 V651	P556-T578 HydrophobicContact CG-CG2 4.28Å; E565-T578 HydrophobicContact CG-CG2 3.97Å; E565-T578 WeakPolarHBondContact OE1-CB 3.17Å; E565-T578 PolarHBondContact OE1-OG1 2.66Å; L576-T578 WeakPolarHBondContact CD1-O 3.35Å; T578-I580 HydrophobicContact CG2-CD1 3.96Å; T578-L615 HydrophobicContact CG2-CB 4.18Å; T578-L615 HydrophobicContact CG2-CD2 4.18Å; T578-L615 PolarHBondContact O-N 2.94Å; T578-V651 HydrophobicContact CG2-CG1 4.38Å
579	R	90.3	Very high	88.7	Confident	139 Å²	139	56 Å²	56	53%	0.525	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.7	168.9	-175.2	-179	65.8	178.5	1.6	109.1	V581 T612 G613 E614	R579-V581 HydrophobicContact CG-CG2 4.39Å; R579-V581 PolarHBondContact O-N 2.79Å; R579-T612 VanDerWaalsContact CD-O 3.31Å; R579-T612 WeakPolarHBondContact CD-O 3.4Å; R579-T612 WeakPolarHBondContact CG-O 3.48Å; R579-G613 WeakPolarHBondContact CA-O 3.2Å; R579-E614 HydrophobicContact CB-CG 4.46Å; R579-E614 HydrophobicContact CG-CG 4.06Å
580	I	90.3	Very high	89.3	Confident	1 Å²	1	54 Å²	54	1%	0.005	30%	0.304	C	S	.	.			trans	-73.2	125.6	172.4	-45.6	-53.7	0	0	0	107.6	V553 A555 P556 T578 Y595 M608 G613 I635 V637 V651	V553-I580 HydrophobicContact CG1-CG2 3.91Å; A555-I580 WeakPolarHBondContact O-CA 3.39Å; P556-I580 HydrophobicContact CG-CD1 4.27Å; T578-I580 HydrophobicContact CG2-CD1 3.96Å; I580-Y595 HydrophobicContact CB-CD1 4.04Å; I580-Y595 HydrophobicContact CB-CE1 4.08Å; I580-Y595 HydrophobicContact CG2-CD1 4.07Å; I580-Y595 HydrophobicContact CG2-CE1 3.93Å; I580-M608 HydrophobicContact CG1-SD 4.08Å; I580-G613 PolarHBondContact N-O 3.43Å; I580-I635 HydrophobicContact CD1-CD1 3.72Å; I580-I635 HydrophobicContact CG1-CD1 3.75Å; I580-I635 HydrophobicContact CG1-CG2 4.16Å; I580-I635 HydrophobicContact CG2-CG2 4.49Å; I580-V637 HydrophobicContact CG2-CG2 4.14Å; I580-V651 HydrophobicContact CD1-CG2 3.94Å
581	V	90.8	Very high	89.9	Confident	50 Å²	50	51 Å²	51	30%	0.303	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	120.1	175.6	-177.7	0	0	0	0	106.8	I554 A555 R579	I554-V581 PolarHBondContact N-O 3.03Å; A555-V581 HydrophobicContact CB-CB 4.22Å; A555-V581 PolarHBondContact N-O 2.96Å; A555-V581 PolarHBondContact O-N 2.93Å; R579-V581 HydrophobicContact CG-CG2 4.39Å; R579-V581 PolarHBondContact O-N 2.79Å
582	A	90.8	Very high	90.4	Very high	12 Å²	12	55.6 Å²	55.6	10%	0.099	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	169.2	172.4	0	0	0	0	0	110.1	S552 V553 L593 Y595 V637	S552-A582 CarbonylContact O-C 3.56Å; S552-A582 WeakPolarHBondContact O-CA 3.44Å; S552-A582 VanDerWaalsContact O-CB 3.28Å; S552-A582 WeakPolarHBondContact O-CB 3.46Å; V553-A582 HydrophobicContact CG2-CB 4.26Å; A582-L593 HydrophobicContact CB-CD1 3.82Å; A582-L593 WeakPolarHBondContact O-CD1 3.19Å; A582-Y595 HydrophobicContact CB-CE1 4.32Å; A582-Y595 PolarHBondContact N-OH 2.83Å; A582-V637 HydrophobicContact CB-CB 4.32Å; A582-V637 HydrophobicContact CB-CG1 3.78Å; A582-V637 HydrophobicContact CB-CG2 4.05Å
583	M	91.8	Very high	90.9	Very high	121 Å²	121	51.9 Å²	51.9	60%	0.596	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.2	141.6	177.3	177.1	168.6	175.2	0	0	108.3	S552 I554	S552-M583 PolarHBondContact N-O 2.91Å; S552-M583 PolarHBondContact O-N 2.83Å; I554-M583 HydrophobicContact CD1-CB 3.58Å; I554-M583 HydrophobicContact CD1-SD 4.31Å; I554-M583 HydrophobicContact CG1-CB 4.43Å
584	D	93.9	Very high	91.3	Very high	15 Å²	15	49.6 Å²	49.6	8%	0.08	27%	0.27	C	S	.	.			trans	-102.9	166.6	164.2	-106.5	-49.8	0	0	0	111.5	A550 P551 A591 L593	A550-D584 VanDerWaalsContact C-OD1 3.23Å; P551-D584 WeakPolarHBondContact CA-OD1 3.21Å; P551-D584 WeakPolarHBondContact CA-OD2 3.35Å; P551-D584 WeakPolarHBondContact CB-OD2 3.35Å; P551-D584 WeakPolarHBondContact CD-OD2 3.4Å; D584-A591 HydrophobicContact CB-CB 3.87Å; D584-L593 HydrophobicContact CB-CD2 4.26Å; D584-L593 VanDerWaalsContact OD2-CD2 3.23Å; D584-L593 WeakPolarHBondContact OD2-CD2 3.3Å
585	A	92.8	Very high	91.6	Very high	50 Å²	50	50 Å²	50	41%	0.413	27%	0.267	S	S	.	.	S	Bend	trans	-92	-35.7	176.4	0	0	0	0	0	112.7	E514 N549	E514-A585 HydrophobicContact CG-CB 3.89Å; N549-A585 HydrophobicContact CB-CB 3.93Å
586	D	94.4	Very high	91.8	Very high	9 Å²	9	47.8 Å²	47.8	5%	0.048	26%	0.264	C	S	.	.	S	Bend	trans	-59.7	-169.6	179	-47.6	-2.7	0	0	0	113.2	N547 N549 N590 A591	N547-D586 WeakPolarHBondContact CA-OD2 3.43Å; N549-D586 WeakPolarHBondContact CB-OD1 3.43Å; N549-D586 PolarHBondContact N-OD1 2.59Å; N549-D586 PolarHBondContact ND2-OD1 2.91Å; D586-N590 HydrophobicContact CB-CB 3.64Å; D586-A591 HydrophobicContact CB-CB 4.49Å; D586-A591 WeakPolarHBondContact O-CB 3.41Å
587	D	92.6	Very high	91.9	Very high	78 Å²	78	46.4 Å²	46.4	42%	0.417	26%	0.257	S	S	.	.			trans	-131	-178.4	178.9	-147.4	-39.6	0	0	0	112.4	Y513 K517 D545 E589 N590 A591	Y513-D587 HydrophobicContact CE1-CB 3.75Å; K517-D587 IonicContact NZ-OD2 3.64Å; K517-D587 PolarHBondContact NZ-OD2 2.85Å; D545-D587 WeakPolarHBondContact OD2-CA 3.39Å; D545-D587 VanDerWaalsContact OD2-CB 3.3Å; D545-D587 WeakPolarHBondContact OD2-CB 3.25Å; D545-D587 PolarHBondContact OD2-N 2.99Å; D587-E589 PolarHBondContact O-N 3.17Å; D587-N590 WeakPolarHBondContact O-CB 3.05Å; D587-N590 PolarHBondContact O-N 3.46Å; D587-A591 PolarHBondContact O-N 3.38Å
588	G	91.6	Very high	91.9	Very high	58 Å²	58	49.8 Å²	49.8	60%	0.598	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	-116.9	170.3	0	0	0	0	0	115.8
589	E	91.3	Very high	91.9	Very high	94 Å²	94	57.9 Å²	57.9	44%	0.439	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-17.6	176.6	-68.9	-77	147.3	0	0	112.5	D587 R592 H640 G641	D587-E589 PolarHBondContact O-N 3.17Å; E589-R592 VanDerWaalsContact O-CB 3.24Å; E589-R592 WeakPolarHBondContact O-CB 3.2Å; E589-R592 PolarHBondContact O-N 3.06Å; E589-R592 IonicContact OE1-CZ 3.86Å; E589-R592 VanDerWaalsContact OE1-CZ 3.32Å; E589-R592 IonicContact OE1-NE 2.64Å; E589-R592 IonicContact OE1-NH1 3.5Å; E589-R592 PolarHBondContact OE1-NH1 2.81Å; E589-R592 WeakPolarHBondContact OE2-CD 3.43Å; E589-R592 IonicContact OE2-CZ 3.29Å; E589-R592 IonicContact OE2-NE 3.32Å; E589-R592 IonicContact OE2-NH1 2.71Å; E589-R592 PolarHBondContact OE2-NH1 2.89Å; E589-H640 CarbonylContact O-C 3.42Å; E589-H640 WeakPolarHBondContact O-CA 3.26Å; E589-H640 PolarHBondContact O-N 2.95Å; E589-G641 PolarHBondContact O-N 3.11Å
590	N	91.8	Very high	91.6	Very high	24 Å²	24	52.7 Å²	52.7	13%	0.128	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-45.1	176.4	-62.1	-7.4	0	0	0	109.2	D545 Q546 N547 D586 D587 R592 D639 G641	D545-N590 PolarHBondContact OD1-ND2 3.26Å; Q546-N590 VanDerWaalsContact C-ND2 3.32Å; N547-N590 HydrophobicContact CB-CB 4.1Å; N547-N590 PolarHBondContact N-ND2 2.7Å; N547-N590 WeakPolarHBondContact OD1-CA 3.36Å; N547-N590 WeakPolarHBondContact OD1-CB 3.45Å; D586-N590 HydrophobicContact CB-CB 3.64Å; D587-N590 WeakPolarHBondContact O-CB 3.05Å; D587-N590 PolarHBondContact O-N 3.46Å; N590-R592 PolarHBondContact O-N 2.87Å; N590-D639 WeakPolarHBondContact O-CB 3.45Å; N590-G641 WeakPolarHBondContact OD1-CA 3.45Å
591	A	92.1	Very high	91.5	Very high	32 Å²	32	55 Å²	55	26%	0.264	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	8.7	169.1	0	0	0	0	0	115.9	D584 D586 D587 L593	D584-A591 HydrophobicContact CB-CB 3.87Å; D586-A591 HydrophobicContact CB-CB 4.49Å; D586-A591 WeakPolarHBondContact O-CB 3.41Å; D587-A591 PolarHBondContact O-N 3.38Å; A591-L593 PolarHBondContact O-N 3.34Å
592	R	93.1	Very high	91.1	Very high	104 Å²	104	57.1 Å²	57.1	39%	0.392	31%	0.311	S	S	.	.			trans	-84.9	87.6	-171.6	-171.6	-171.6	-169.1	169.1	18	112.7	E589 N590 D639 H640	E589-R592 VanDerWaalsContact O-CB 3.24Å; E589-R592 WeakPolarHBondContact O-CB 3.2Å; E589-R592 PolarHBondContact O-N 3.06Å; E589-R592 IonicContact OE1-CZ 3.86Å; E589-R592 VanDerWaalsContact OE1-CZ 3.32Å; E589-R592 IonicContact OE1-NE 2.64Å; E589-R592 IonicContact OE1-NH1 3.5Å; E589-R592 PolarHBondContact OE1-NH1 2.81Å; E589-R592 WeakPolarHBondContact OE2-CD 3.43Å; E589-R592 IonicContact OE2-CZ 3.29Å; E589-R592 IonicContact OE2-NE 3.32Å; E589-R592 IonicContact OE2-NH1 2.71Å; E589-R592 PolarHBondContact OE2-NH1 2.89Å; N590-R592 PolarHBondContact O-N 2.87Å; R592-D639 CarbonylContact O-C 3.51Å; R592-D639 WeakPolarHBondContact O-CA 3.26Å; R592-H640 HydrophobicContact CB-CB 4.22Å; R592-H640 PolarHBondContact O-CD2 2.83Å
593	L	93.3	Very high	90.5	Very high	34 Å²	34	63.6 Å²	63.6	18%	0.178	34%	0.341	C	S	.	.			trans	-65.9	135.7	-177	-51.9	-173.4	0	0	0	114.6	P551 A582 D584 A591 Y595 V637	P551-L593 HydrophobicContact CB-CD2 3.62Å; A582-L593 HydrophobicContact CB-CD1 3.82Å; A582-L593 WeakPolarHBondContact O-CD1 3.19Å; D584-L593 HydrophobicContact CB-CD2 4.26Å; D584-L593 VanDerWaalsContact OD2-CD2 3.23Å; D584-L593 WeakPolarHBondContact OD2-CD2 3.3Å; A591-L593 PolarHBondContact O-N 3.34Å; L593-Y595 HydrophobicContact CB-CE2 4.02Å; L593-V637 HydrophobicContact CB-CG1 4.23Å; L593-V637 HydrophobicContact CD1-CG1 4.48Å; L593-V637 HydrophobicContact CD2-CG1 4.11Å
594	S	93.4	Very high	90.1	Very high	19 Å²	19	59.2 Å²	59.2	13%	0.133	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	144.8	168.3	65.3	0	0	0	0	112.3	W610 V637 R638 H640	S594-W610 WeakPolarHBondContact CA-O 3.07Å; S594-V637 WeakPolarHBondContact O-CA 3.21Å; S594-R638 PolarHBondContact N-O 2.83Å; S594-R638 PolarHBondContact O-N 2.81Å; S594-R638 PolarHBondContact OG-O 2.91Å; S594-H640 VanDerWaalsContact CB-NE2 3.32Å; S594-H640 WeakPolarHBondContact CB-NE2 2.97Å; S594-H640 PolarHBondContact OG-NE2 3.24Å
595	Y	93.6	Very high	89.8	Confident	23 Å²	23	59.1 Å²	59.1	9%	0.09	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.1	-165.7	-62.5	-93	0	0	0	112	I580 A582 L593 M608 W610 V637	I580-Y595 HydrophobicContact CB-CD1 4.04Å; I580-Y595 HydrophobicContact CB-CE1 4.08Å; I580-Y595 HydrophobicContact CG2-CD1 4.07Å; I580-Y595 HydrophobicContact CG2-CE1 3.93Å; A582-Y595 HydrophobicContact CB-CE1 4.32Å; A582-Y595 PolarHBondContact N-OH 2.83Å; L593-Y595 HydrophobicContact CB-CE2 4.02Å; Y595-M608 VanDerWaalsContact C-CE 3.45Å; Y595-W610 PolarHBondContact N-O 2.81Å; Y595-V637 HydrophobicContact CD1-CG1 4.31Å; Y595-V637 HydrophobicContact CD1-CG2 3.73Å; Y595-V637 HydrophobicContact CE1-CB 4.47Å; Y595-V637 HydrophobicContact CE1-CG1 3.96Å; Y595-V637 HydrophobicContact CE1-CG2 3.68Å
596	S	93	Very high	89.7	Confident	39 Å²	39	57 Å²	57	27%	0.273	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.2	-171	158.1	0	0	0	0	111.6	M608 I635 E636	S596-M608 VanDerWaalsContact N-CE 3.26Å; S596-M608 WeakPolarHBondContact O-CE 3.43Å; S596-I635 CarbonylContact O-C 3.59Å; S596-I635 WeakPolarHBondContact O-CA 3.19Å; S596-E636 WeakPolarHBondContact CB-OE2 3.3Å; S596-E636 PolarHBondContact N-O 2.79Å; S596-E636 PolarHBondContact O-N 3.27Å; S596-E636 PolarHBondContact OG-OE2 2.71Å
597	I	91.6	Very high	89.5	Confident	40 Å²	40	63.2 Å²	63.2	21%	0.205	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	103.2	170.4	-48.9	173.9	0	0	0	108.5	N601 F606 M608 L615	I597-N601 HydrophobicContact CG2-CB 4.14Å; I597-F606 HydrophobicContact CD1-CB 4.32Å; I597-M608 HydrophobicContact CD1-CB 3.89Å; I597-M608 HydrophobicContact CG1-CB 3.84Å; I597-M608 HydrophobicContact CG1-CE 3.77Å; I597-L615 HydrophobicContact CD1-CD1 3.93Å
598	L	89.4	Confident	89.5	Confident	84 Å²	84	61 Å²	61	44%	0.44	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	-48.7	179.9	-71.3	177.6	0	0	0	112.6	L634 E636	L598-L634 HydrophobicContact CB-CD2 4.39Å; L598-L634 HydrophobicContact CB-CG 4.48Å; L598-L634 HydrophobicContact CD1-CD2 4.15Å; L598-L634 HydrophobicContact CD1-CG 4.45Å; L598-L634 PolarHBondContact N-O 2.71Å; L598-E636 HydrophobicContact CD1-CB 3.75Å; L598-E636 HydrophobicContact CD1-CG 4.44Å; L598-E636 HydrophobicContact CD2-CB 4.31Å; L598-E636 WeakPolarHBondContact CD2-OE2 3.49Å; L598-E636 HydrophobicContact CG-CB 3.67Å; L598-E636 HydrophobicContact CG-CG 4.49Å
599	R	88.1	Confident	89.5	Confident	189 Å²	189	61.4 Å²	61.4	71%	0.713	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.4	165.2	-170.4	-59.6	-173.5	-175.8	-176.7	3.2	112.2	L633 L634	R599-L633 WeakPolarHBondContact O-CA 3.47Å; R599-L634 HydrophobicContact CB-CB 4.15Å; R599-L634 PolarHBondContact N-O 2.68Å; R599-L634 PolarHBondContact O-N 2.82Å
600	G	84.6	Confident	89.5	Confident	31 Å²	31	63 Å²	63	32%	0.32	31%	0.308	S	S	.	.			trans	90	-13.2	175.8	0	0	0	0	0	116.3	E602 D632 L633	G600-E602 PolarHBondContact O-N 3.03Å; G600-D632 VanDerWaalsContact CA-O 3.29Å; G600-D632 WeakPolarHBondContact CA-O 3.46Å; G600-L633 VanDerWaalsContact C-CD2 3.43Å; G600-L633 WeakPolarHBondContact O-CD2 3.4Å
601	N	87.7	Confident	89.4	Confident	50 Å²	50	69.5 Å²	69.5	27%	0.267	33%	0.331	S	S	.	.			trans	-77.8	64.9	-177.1	-166.5	5.7	0	0	0	113.1	I597 M603 G604 M605 F606 L633	I597-N601 HydrophobicContact CG2-CB 4.14Å; N601-M603 PolarHBondContact O-N 2.93Å; N601-G604 PolarHBondContact O-N 2.78Å; N601-G604 VanDerWaalsContact O-N 3.13Å; N601-G604 WeakPolarHBondContact OD1-CA 3.39Å; N601-M605 PolarHBondContact OD1-N 2.7Å; N601-F606 PolarHBondContact ND2-O 2.79Å; N601-F606 PolarHBondContact OD1-N 2.95Å; N601-F606 PolarHBondContact OD1-O 2.84Å; N601-L633 HydrophobicContact CB-CD2 4.4Å
602	E	82	Confident	89.3	Confident	94 Å²	94	71.2 Å²	71.2	44%	0.439	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-47.4	126	178.5	-60	-178	160.7	0	0	111.3	G600 G604 M605 R625 Y631	G600-E602 PolarHBondContact O-N 3.03Å; E602-G604 PolarHBondContact O-N 3.5Å; E602-M605 WeakPolarHBondContact O-CB 3Å; E602-M605 VanDerWaalsContact O-CG 3.24Å; E602-M605 WeakPolarHBondContact O-CG 3.48Å; E602-M605 PolarHBondContact O-N 3.44Å; E602-R625 IonicContact OE1-NH2 2.77Å; E602-R625 IonicContact OE2-CZ 3.13Å; E602-R625 IonicContact OE2-NE 3.56Å; E602-R625 IonicContact OE2-NH2 2.64Å; E602-R625 PolarHBondContact OE2-NH2 2.6Å; E602-Y631 HydrophobicContact CB-CD1 4.35Å; E602-Y631 HydrophobicContact CB-CE1 4.04Å; E602-Y631 HydrophobicContact CG-CD1 4.17Å; E602-Y631 HydrophobicContact CG-CE1 4.21Å; E602-Y631 WeakPolarHBondContact OE2-CE1 3.05Å
603	M	79.1	Confident	89.2	Confident	147 Å²	147	66.2 Å²	66.2	72%	0.724	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	53.2	16.3	177.7	-60.2	-177.2	-76.6	0	0	115.9	N601 R619	N601-M603 PolarHBondContact O-N 2.93Å; M603-R619 PolarHBondContact O-NH1 3.08Å
604	G	83.9	Confident	89.1	Confident	29 Å²	29	67 Å²	67	30%	0.299	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	65.4	43.6	-173.5	0	0	0	0	0	112.7	N601 E602 F606 R619	N601-G604 PolarHBondContact O-N 2.78Å; N601-G604 VanDerWaalsContact O-N 3.13Å; N601-G604 WeakPolarHBondContact OD1-CA 3.39Å; E602-G604 PolarHBondContact O-N 3.5Å; G604-F606 VanDerWaalsContact C-N 3.29Å; G604-R619 PolarHBondContact O-NE 3.46Å
605	M	85.7	Confident	89.1	Confident	13 Å²	13	66.1 Å²	66.1	6%	0.064	32%	0.316	C	S	.	.			trans	-66.7	-28.4	175.3	-81.7	-61.2	-52.3	0	0	113.4	N601 E602 A618 R619 I621 Y631	N601-M605 PolarHBondContact OD1-N 2.7Å; E602-M605 WeakPolarHBondContact O-CB 3Å; E602-M605 VanDerWaalsContact O-CG 3.24Å; E602-M605 WeakPolarHBondContact O-CG 3.48Å; E602-M605 PolarHBondContact O-N 3.44Å; M605-A618 PolarHBondContact O-N 2.67Å; M605-R619 HydrophobicContact CE-CB 4.29Å; M605-R619 HydrophobicContact SD-CB 3.9Å; M605-I621 HydrophobicContact CE-CB 4.5Å; M605-I621 HydrophobicContact CE-CG1 3.9Å; M605-Y631 HydrophobicContact CB-CE1 4.36Å; M605-Y631 HydrophobicContact CG-CE1 4.14Å
606	F	90.8	Very high	88.9	Confident	7 Å²	7	68.3 Å²	68.3	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	155.1	179	-56.5	-86	0	0	0	111.8	L567 V577 I597 N601 G604 L615 R616 Y631 L633 V653	L567-F606 HydrophobicContact CD2-CE1 3.9Å; L567-F606 HydrophobicContact CD2-CZ 4.13Å; V577-F606 HydrophobicContact CG2-CD1 4.08Å; V577-F606 HydrophobicContact CG2-CE1 3.92Å; I597-F606 HydrophobicContact CD1-CB 4.32Å; N601-F606 PolarHBondContact ND2-O 2.79Å; N601-F606 PolarHBondContact OD1-N 2.95Å; N601-F606 PolarHBondContact OD1-O 2.84Å; G604-F606 VanDerWaalsContact C-N 3.29Å; F606-L615 HydrophobicContact CB-CD1 3.91Å; F606-L615 HydrophobicContact CD1-CD1 4.32Å; F606-L615 HydrophobicContact CD1-CG 4.34Å; F606-L615 HydrophobicContact CG-CD1 4.32Å; F606-R616 CarbonylContact C-O 3.51Å; F606-R616 WeakPolarHBondContact CA-O 3.5Å; F606-Y631 AromaticContact CE2-CD1 3.93Å; F606-Y631 HydrophobicContact CE2-CD1 3.93Å; F606-Y631 AromaticContact CE2-CD2 3.81Å; F606-Y631 HydrophobicContact CE2-CD2 3.81Å; F606-Y631 HydrophobicContact CE2-CE1 4.4Å; F606-Y631 HydrophobicContact CE2-CE2 4.3Å; F606-Y631 AromaticContact CE2-CG 3.61Å; F606-Y631 HydrophobicContact CE2-CG 3.61Å; F606-Y631 AromaticContact CZ-CD2 3.75Å; F606-Y631 HydrophobicContact CZ-CD2 3.75Å; F606-Y631 HydrophobicContact CZ-CE2 4.24Å; F606-Y631 AromaticContact CZ-CG 4Å; F606-Y631 HydrophobicContact CZ-CG 4Å; F606-L633 HydrophobicContact CD1-CD1 4.37Å; F606-L633 HydrophobicContact CD2-CD1 3.91Å; F606-L633 HydrophobicContact CD2-CD2 3.87Å; F606-L633 HydrophobicContact CD2-CG 4.45Å; F606-L633 HydrophobicContact CE2-CD1 4.18Å; F606-L633 HydrophobicContact CE2-CD2 4.11Å; F606-L633 HydrophobicContact CG-CD1 4.01Å; F606-V653 HydrophobicContact CE1-CB 4.44Å; F606-V653 HydrophobicContact CE1-CG1 4.05Å; F606-V653 HydrophobicContact CE1-CG2 4.23Å; F606-V653 HydrophobicContact CZ-CB 4.04Å; F606-V653 HydrophobicContact CZ-CG1 3.92Å; F606-V653 HydrophobicContact CZ-CG2 4.12Å
607	R	90.9	Very high	88.8	Confident	138 Å²	138	66.5 Å²	66.5	52%	0.521	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145	164.6	59.6	-179	-178.6	155.6	6.2	107.9	R616 A618	R607-R616 HydrophobicContact CG-CB 4.05Å; R607-R616 PolarHBondContact N-O 3.45Å; R607-R616 PolarHBondContact O-N 3Å; R607-R616 VanDerWaalsContact O-O 3.05Å; R607-A618 HydrophobicContact CB-CB 4.16Å; R607-A618 HydrophobicContact CG-CB 4.21Å
608	M	92	Very high	88.6	Confident	32 Å²	32	66.4 Å²	66.4	16%	0.158	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	141.2	168.8	-172.3	156.3	63.4	0	0	109.1	I580 Y595 S596 I597 E614 L615 I635	I580-M608 HydrophobicContact CG1-SD 4.08Å; Y595-M608 VanDerWaalsContact C-CE 3.45Å; S596-M608 VanDerWaalsContact N-CE 3.26Å; S596-M608 WeakPolarHBondContact O-CE 3.43Å; I597-M608 HydrophobicContact CD1-CB 3.89Å; I597-M608 HydrophobicContact CG1-CB 3.84Å; I597-M608 HydrophobicContact CG1-CE 3.77Å; M608-E614 WeakPolarHBondContact CA-O 3.35Å; M608-L615 HydrophobicContact CB-CD1 4.5Å; M608-I635 HydrophobicContact CE-CB 4.37Å; M608-I635 HydrophobicContact CE-CD1 4.43Å; M608-I635 HydrophobicContact CE-CG1 4.15Å; M608-I635 HydrophobicContact CE-CG2 3.5Å; M608-I635 HydrophobicContact SD-CD1 4Å; M608-I635 HydrophobicContact SD-CG1 4.38Å; M608-I635 HydrophobicContact SD-CG2 4.04Å
609	D	93.1	Very high	88.3	Confident	67 Å²	67	69.1 Å²	69.1	36%	0.358	32%	0.321	S	S	.	.			trans	-81	126.6	169.8	179.9	-87.9	0	0	0	110.1	R611 T612 G613 E614	D609-R611 VanDerWaalsContact C-N 3.27Å; D609-R611 PolarHBondContact O-N 3.17Å; D609-R611 PolarHBondContact OD1-N 3.28Å; D609-T612 VanDerWaalsContact CB-OG1 3.28Å; D609-T612 WeakPolarHBondContact CB-OG1 3.5Å; D609-T612 WeakPolarHBondContact OD1-CB 3.36Å; D609-T612 PolarHBondContact OD1-N 2.87Å; D609-T612 PolarHBondContact OD1-OG1 3.06Å; D609-G613 PolarHBondContact O-N 3.08Å; D609-G613 VanDerWaalsContact O-N 3.12Å; D609-E614 HydrophobicContact CB-CB 4.4Å; D609-E614 PolarHBondContact N-O 3.47Å; D609-E614 VanDerWaalsContact N-O 3.16Å
610	W	90.5	Very high	88	Confident	126 Å²	126	67 Å²	67	48%	0.477	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-14.3	-168.7	71	-90.7	0	0	0	114.6	S594 Y595	S594-W610 WeakPolarHBondContact CA-O 3.07Å; Y595-W610 PolarHBondContact N-O 2.81Å
611	R	90.4	Very high	87.6	Confident	162 Å²	162	66.3 Å²	66.3	61%	0.611	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-33.7	178.5	-66.2	-173.5	175.1	-172.8	-3.8	113.1	D609	D609-R611 VanDerWaalsContact C-N 3.27Å; D609-R611 PolarHBondContact O-N 3.17Å; D609-R611 PolarHBondContact OD1-N 3.28Å
612	T	89.8	Confident	86.8	Confident	67 Å²	67	66.8 Å²	66.8	41%	0.411	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	-6.5	-169.1	59.9	0	0	0	0	114	R579 D609 E614	R579-T612 VanDerWaalsContact CD-O 3.31Å; R579-T612 WeakPolarHBondContact CD-O 3.4Å; R579-T612 WeakPolarHBondContact CG-O 3.48Å; D609-T612 VanDerWaalsContact CB-OG1 3.28Å; D609-T612 WeakPolarHBondContact CB-OG1 3.5Å; D609-T612 WeakPolarHBondContact OD1-CB 3.36Å; D609-T612 PolarHBondContact OD1-N 2.87Å; D609-T612 PolarHBondContact OD1-OG1 3.06Å; T612-E614 PolarHBondContact O-N 2.85Å; T612-E614 VanDerWaalsContact O-N 3.16Å
613	G	89.7	Confident	85.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.326	C	S	.	.			trans	66.2	11.5	-179.1	0	0	0	0	0	114.1	R579 I580 D609 L615	R579-G613 WeakPolarHBondContact CA-O 3.2Å; I580-G613 PolarHBondContact N-O 3.43Å; D609-G613 PolarHBondContact O-N 3.08Å; D609-G613 VanDerWaalsContact O-N 3.12Å; G613-L615 PolarHBondContact O-N 3.02Å; G613-L615 VanDerWaalsContact O-N 3.16Å
614	E	92.7	Very high	85.1	Confident	50 Å²	50	70.5 Å²	70.5	23%	0.234	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	108.9	-179.2	-74.5	-163.4	151.8	0	0	111.4	L576 R579 M608 D609 T612 R616	L576-E614 HydrophobicContact CD1-CB 3.85Å; L576-E614 HydrophobicContact CD1-CG 3.97Å; R579-E614 HydrophobicContact CB-CG 4.46Å; R579-E614 HydrophobicContact CG-CG 4.06Å; M608-E614 WeakPolarHBondContact CA-O 3.35Å; D609-E614 HydrophobicContact CB-CB 4.4Å; D609-E614 PolarHBondContact N-O 3.47Å; D609-E614 VanDerWaalsContact N-O 3.16Å; T612-E614 PolarHBondContact O-N 2.85Å; T612-E614 VanDerWaalsContact O-N 3.16Å; E614-R616 VanDerWaalsContact CD-NH2 3.25Å; E614-R616 PolarHBondContact O-N 3.21Å; E614-R616 IonicContact OE1-NH2 2.71Å; E614-R616 PolarHBondContact OE1-NH2 2.84Å; E614-R616 VanDerWaalsContact OE1-NH2 3.13Å; E614-R616 IonicContact OE2-CZ 2.69Å; E614-R616 IonicContact OE2-NE 3.13Å; E614-R616 PolarHBondContact OE2-NE 3.18Å; E614-R616 IonicContact OE2-NH2 3.91Å; E614-R616 PolarHBondContact OE2-NH2 3.1Å
615	L	91.7	Very high	84.2	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	112.5	172.6	-177.7	71.3	0	0	0	109.3	V577 T578 I597 F606 M608 G613 L633 I635 V651 V653	V577-L615 HydrophobicContact CB-CD2 4.03Å; V577-L615 HydrophobicContact CB-CG 4.19Å; V577-L615 WeakPolarHBondContact CB-O 3.31Å; V577-L615 HydrophobicContact CG1-CD2 4.08Å; V577-L615 HydrophobicContact CG2-CG 4.41Å; V577-L615 PolarHBondContact N-O 2.83Å; T578-L615 HydrophobicContact CG2-CB 4.18Å; T578-L615 HydrophobicContact CG2-CD2 4.18Å; T578-L615 PolarHBondContact O-N 2.94Å; I597-L615 HydrophobicContact CD1-CD1 3.93Å; F606-L615 HydrophobicContact CB-CD1 3.91Å; F606-L615 HydrophobicContact CD1-CD1 4.32Å; F606-L615 HydrophobicContact CD1-CG 4.34Å; F606-L615 HydrophobicContact CG-CD1 4.32Å; M608-L615 HydrophobicContact CB-CD1 4.5Å; G613-L615 PolarHBondContact O-N 3.02Å; G613-L615 VanDerWaalsContact O-N 3.16Å; L615-L633 HydrophobicContact CD1-CD1 3.82Å; L615-L633 HydrophobicContact CD2-CD1 3.57Å; L615-L633 HydrophobicContact CG-CD1 4.31Å; L615-I635 HydrophobicContact CD2-CD1 4.48Å; L615-V651 HydrophobicContact CD2-CG1 4.44Å; L615-V653 HydrophobicContact CD2-CG2 4.22Å
616	R	91.3	Very high	83.1	Confident	70 Å²	70	75.9 Å²	75.9	26%	0.264	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	152.2	-179.2	-67.2	178.6	176.7	-89.5	-1.4	111.8	G574 Y575 L576 F606 R607 E614	G574-R616 PolarHBondContact O-NH1 3.21Å; Y575-R616 CarbonylContact O-C 3.54Å; Y575-R616 WeakPolarHBondContact O-CA 3.24Å; L576-R616 HydrophobicContact CB-CG 4.47Å; L576-R616 HydrophobicContact CD1-CG 3.89Å; F606-R616 CarbonylContact C-O 3.51Å; F606-R616 WeakPolarHBondContact CA-O 3.5Å; R607-R616 HydrophobicContact CG-CB 4.05Å; R607-R616 PolarHBondContact N-O 3.45Å; R607-R616 PolarHBondContact O-N 3Å; R607-R616 VanDerWaalsContact O-O 3.05Å; E614-R616 VanDerWaalsContact CD-NH2 3.25Å; E614-R616 PolarHBondContact O-N 3.21Å; E614-R616 IonicContact OE1-NH2 2.71Å; E614-R616 PolarHBondContact OE1-NH2 2.84Å; E614-R616 VanDerWaalsContact OE1-NH2 3.13Å; E614-R616 IonicContact OE2-CZ 2.69Å; E614-R616 IonicContact OE2-NE 3.13Å; E614-R616 PolarHBondContact OE2-NE 3.18Å; E614-R616 IonicContact OE2-NH2 3.91Å; E614-R616 PolarHBondContact OE2-NH2 3.1Å
617	T	89.8	Confident	81.6	Confident	1 Å²	1	78.4 Å²	78.4	1%	0.006	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	139.6	166.8	59.9	0	0	0	0	109.8	L567 A571 E572 P573 G574 Y575 V577	L567-T617 HydrophobicContact CD1-CG2 3.85Å; L567-T617 HydrophobicContact CD2-CG2 4.11Å; A571-T617 HydrophobicContact CB-CG2 4.42Å; E572-T617 PolarHBondContact O-OG1 2.88Å; P573-T617 WeakPolarHBondContact CA-OG1 3.41Å; G574-T617 WeakPolarHBondContact CA-O 3.07Å; G574-T617 PolarHBondContact N-O 2.85Å; G574-T617 PolarHBondContact N-OG1 2.78Å; Y575-T617 HydrophobicContact CD1-CG2 4.44Å; Y575-T617 PolarHBondContact N-OG1 3.39Å; Y575-T617 VanDerWaalsContact N-OG1 3.11Å; Y575-T617 PolarHBondContact O-N 3.12Å; V577-T617 HydrophobicContact CG2-CG2 4.31Å
618	A	87.4	Confident	80.2	Confident	37 Å²	37	79.9 Å²	79.9	31%	0.306	38%	0.38	S	S	.	.	S	Bend	trans	-102.7	-21.5	171.1	0	0	0	0	0	112	M605 R607	M605-A618 PolarHBondContact O-N 2.67Å; R607-A618 HydrophobicContact CB-CB 4.16Å; R607-A618 HydrophobicContact CG-CB 4.21Å
619	R	82.9	Confident	79.2	Confident	141 Å²	141	79.1 Å²	79.1	53%	0.532	38%	0.381	S	S	.	.	S	Bend	trans	-142.4	156.8	-174.7	-59.4	-179.9	-178.1	-164.5	-2.6	110.4	M603 G604 M605	M603-R619 PolarHBondContact O-NH1 3.08Å; G604-R619 PolarHBondContact O-NE 3.46Å; M605-R619 HydrophobicContact CE-CB 4.29Å; M605-R619 HydrophobicContact SD-CB 3.9Å
620	R	81.5	Confident	78.7	Confident	145 Å²	145	81.1 Å²	81.1	55%	0.547	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-69.6	143	169.2	-66.1	-177	-171.5	-102.9	-3.9	109.5	E572 P573	E572-R620 VanDerWaalsContact CD-NH2 3.29Å; E572-R620 IonicContact OE1-CZ 3.13Å; E572-R620 IonicContact OE1-NH1 3.14Å; E572-R620 PolarHBondContact OE1-NH1 2.78Å; E572-R620 IonicContact OE1-NH2 2.69Å; E572-R620 PolarHBondContact OE1-NH2 2.85Å; E572-R620 IonicContact OE2-NH2 3.69Å; P573-R620 HydrophobicContact CG-CG 3.9Å
621	I	77.2	Confident	78.5	Confident	17 Å²	17	75.4 Å²	75.4	9%	0.087	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-66.8	136.2	176.6	-65	151.9	0	0	0	109.4	L567 M605 L655	L567-I621 HydrophobicContact CD2-CD1 3.92Å; L567-I621 HydrophobicContact CG-CD1 3.98Å; M605-I621 HydrophobicContact CE-CB 4.5Å; M605-I621 HydrophobicContact CE-CG1 3.9Å; I621-L655 HydrophobicContact CD1-CD2 3.54Å; I621-L655 HydrophobicContact CG1-CD2 4.26Å; I621-L655 HydrophobicContact CG2-CD1 4.08Å
622	S	69.9	Low	78.4	Confident	59 Å²	59	72 Å²	72	41%	0.413	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-67.1	127.7	178.1	178.9	0	0	0	0	110.5	K624 R625	S622-K624 PolarHBondContact O-N 2.64Å; S622-K624 PolarHBondContact OG-N 2.92Å; S622-R625 PolarHBondContact O-N 2.97Å
623	P	64.1	Low	78.4	Confident	124 Å²	124	68.9 Å²	68.9	81%	0.805	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-6.5	178	28.2	-35.5	0	0	0	113.4
624	K	60.8	Low	78.4	Confident	196 Å²	196	71.1 Å²	71.1	85%	0.852	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-5.8	171.8	-62.9	-174.3	177.9	-177	0	114	S622	S622-K624 PolarHBondContact O-N 2.64Å; S622-K624 PolarHBondContact OG-N 2.92Å
625	R	65.6	Low	78.4	Confident	52 Å²	52	68.7 Å²	68.7	20%	0.196	34%	0.34	C	S	.	.	S	Bend	trans	-82.6	134.7	178.2	-158	176.4	-163.7	-103.6	8.7	109.9	R569 E602 S622 G629 F630 Y631	R569-R625 PolarHBondContact NH2-O 3.07Å; E602-R625 IonicContact OE1-NH2 2.77Å; E602-R625 IonicContact OE2-CZ 3.13Å; E602-R625 IonicContact OE2-NE 3.56Å; E602-R625 IonicContact OE2-NH2 2.64Å; E602-R625 PolarHBondContact OE2-NH2 2.6Å; S622-R625 PolarHBondContact O-N 2.97Å; R625-G629 VanDerWaalsContact NH1-C 3.33Å; R625-G629 PolarHBondContact NH1-O 2.8Å; R625-F630 PolarHBondContact NH1-O 2.59Å; R625-F630 PolarHBondContact NH2-O 2.88Å; R625-Y631 WeakPolarHBondContact CD-OH 3.06Å; R625-Y631 PolarHBondContact NE-OH 3.03Å; R625-Y631 VanDerWaalsContact NH2-CE1 3.31Å
626	D	63.5	Low	78.4	Confident	103 Å²	103	70.4 Å²	70.4	55%	0.551	35%	0.348	S	S	*	.			trans	-59.9	141.4	-173.6	-169.1	47.3	0	0	0	112.8	Q628 G629	D626-Q628 PolarHBondContact O-N 2.88Å; D626-G629 PolarHBondContact O-N 2.88Å
627	P	59.7	Low	78.5	Confident	59 Å²	59	67 Å²	67	38%	0.383	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.4	-177.5	-23.1	35	0	0	0	114.9
628	Q	61.2	Low	78.7	Confident	169 Å²	169	72.1 Å²	72.1	79%	0.79	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-0.8	174.7	-64	-169.9	-6	0	0	113.6	D626 F630	D626-Q628 PolarHBondContact O-N 2.88Å; Q628-F630 PolarHBondContact O-N 3.15Å
629	G	70.9	Confident	79	Confident	17 Å²	17	70.4 Å²	70.4	18%	0.175	34%	0.34	C	S	.	.			trans	-71.4	127.9	-178.5	0	0	0	0	0	113.1	R625 D626 L655	R625-G629 VanDerWaalsContact NH1-C 3.33Å; R625-G629 PolarHBondContact NH1-O 2.8Å; D626-G629 PolarHBondContact O-N 2.88Å; G629-L655 WeakPolarHBondContact O-CB 3.16Å; G629-L655 WeakPolarHBondContact O-CD1 3.32Å; G629-L655 WeakPolarHBondContact O-CG 3.01Å
630	F	82.1	Confident	79.5	Confident	108 Å²	108	67.4 Å²	67.4	47%	0.474	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	179.9	173.3	52.3	-86.6	0	0	0	111.5	R625 Q628 D632 V653 I654	R625-F630 PolarHBondContact NH1-O 2.59Å; R625-F630 PolarHBondContact NH2-O 2.88Å; Q628-F630 PolarHBondContact O-N 3.15Å; F630-D632 WeakPolarHBondContact CD2-OD1 3.4Å; F630-D632 VanDerWaalsContact CE2-OD2 3.31Å; F630-D632 WeakPolarHBondContact CE2-OD2 3.42Å; F630-V653 CarbonylContact C-O 3.55Å; F630-V653 VanDerWaalsContact CA-O 3.26Å; F630-V653 WeakPolarHBondContact CA-O 3.35Å; F630-I654 HydrophobicContact CB-CG1 4.44Å
631	Y	85.9	Confident	79.9	Confident	7 Å²	7	60.8 Å²	60.8	3%	0.027	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	112.4	167.1	-63	-92	0	0	0	108.8	E602 M605 F606 R625 L633 S652 V653 L655	E602-Y631 HydrophobicContact CB-CD1 4.35Å; E602-Y631 HydrophobicContact CB-CE1 4.04Å; E602-Y631 HydrophobicContact CG-CD1 4.17Å; E602-Y631 HydrophobicContact CG-CE1 4.21Å; E602-Y631 WeakPolarHBondContact OE2-CE1 3.05Å; M605-Y631 HydrophobicContact CB-CE1 4.36Å; M605-Y631 HydrophobicContact CG-CE1 4.14Å; F606-Y631 AromaticContact CE2-CD1 3.93Å; F606-Y631 HydrophobicContact CE2-CD1 3.93Å; F606-Y631 AromaticContact CE2-CD2 3.81Å; F606-Y631 HydrophobicContact CE2-CD2 3.81Å; F606-Y631 HydrophobicContact CE2-CE1 4.4Å; F606-Y631 HydrophobicContact CE2-CE2 4.3Å; F606-Y631 AromaticContact CE2-CG 3.61Å; F606-Y631 HydrophobicContact CE2-CG 3.61Å; F606-Y631 AromaticContact CZ-CD2 3.75Å; F606-Y631 HydrophobicContact CZ-CD2 3.75Å; F606-Y631 HydrophobicContact CZ-CE2 4.24Å; F606-Y631 AromaticContact CZ-CG 4Å; F606-Y631 HydrophobicContact CZ-CG 4Å; R625-Y631 WeakPolarHBondContact CD-OH 3.06Å; R625-Y631 PolarHBondContact NE-OH 3.03Å; R625-Y631 VanDerWaalsContact NH2-CE1 3.31Å; Y631-L633 PolarHBondContact O-N 3.19Å; Y631-S652 WeakPolarHBondContact O-CA 3.39Å; Y631-V653 PolarHBondContact N-O 3.44Å; Y631-V653 PolarHBondContact O-N 2.83Å; Y631-L655 HydrophobicContact CE2-CD1 4.35Å; Y631-L655 HydrophobicContact CE2-CD2 4.28Å; Y631-L655 HydrophobicContact CE2-CG 4.45Å
632	D	87.9	Confident	80.4	Confident	89 Å²	89	68.5 Å²	68.5	48%	0.476	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	97.5	174.5	-70.9	-15.4	0	0	0	109.3	G600 F630 S652	G600-D632 VanDerWaalsContact CA-O 3.29Å; G600-D632 WeakPolarHBondContact CA-O 3.46Å; F630-D632 WeakPolarHBondContact CD2-OD1 3.4Å; F630-D632 VanDerWaalsContact CE2-OD2 3.31Å; F630-D632 WeakPolarHBondContact CE2-OD2 3.42Å; D632-S652 WeakPolarHBondContact OD1-CA 3.42Å; D632-S652 WeakPolarHBondContact OD1-CB 3.28Å; D632-S652 PolarHBondContact OD1-OG 3.39Å
633	L	90.4	Very high	81.5	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.01	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	131.8	177.3	-55.5	-179.7	0	0	0	109.8	R599 G600 N601 F606 L615 Y631 S650 V651 V653	R599-L633 WeakPolarHBondContact O-CA 3.47Å; G600-L633 VanDerWaalsContact C-CD2 3.43Å; G600-L633 WeakPolarHBondContact O-CD2 3.4Å; N601-L633 HydrophobicContact CB-CD2 4.4Å; F606-L633 HydrophobicContact CD1-CD1 4.37Å; F606-L633 HydrophobicContact CD2-CD1 3.91Å; F606-L633 HydrophobicContact CD2-CD2 3.87Å; F606-L633 HydrophobicContact CD2-CG 4.45Å; F606-L633 HydrophobicContact CE2-CD1 4.18Å; F606-L633 HydrophobicContact CE2-CD2 4.11Å; F606-L633 HydrophobicContact CG-CD1 4.01Å; L615-L633 HydrophobicContact CD1-CD1 3.82Å; L615-L633 HydrophobicContact CD2-CD1 3.57Å; L615-L633 HydrophobicContact CG-CD1 4.31Å; Y631-L633 PolarHBondContact O-N 3.19Å; L633-S650 CarbonylContact O-C 3.6Å; L633-S650 WeakPolarHBondContact O-CA 3.48Å; L633-V651 PolarHBondContact N-O 2.95Å; L633-V651 PolarHBondContact O-N 3.14Å; L633-V653 HydrophobicContact CD1-CG2 3.95Å; L633-V653 HydrophobicContact CG-CG2 4.39Å
634	L	90.4	Very high	82.8	Confident	47 Å²	47	66.9 Å²	66.9	25%	0.246	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.3	164.2	-172.7	65.8	0	0	0	107.9	L598 R599	L598-L634 HydrophobicContact CB-CD2 4.39Å; L598-L634 HydrophobicContact CB-CG 4.48Å; L598-L634 HydrophobicContact CD1-CD2 4.15Å; L598-L634 HydrophobicContact CD1-CG 4.45Å; L598-L634 PolarHBondContact N-O 2.71Å; R599-L634 HydrophobicContact CB-CB 4.15Å; R599-L634 PolarHBondContact N-O 2.68Å; R599-L634 PolarHBondContact O-N 2.82Å
635	I	91.4	Very high	84.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	139.1	176.7	-68.7	171.9	0	0	0	108.6	I580 S596 M608 L615 S648 A649 V651	I580-I635 HydrophobicContact CD1-CD1 3.72Å; I580-I635 HydrophobicContact CG1-CD1 3.75Å; I580-I635 HydrophobicContact CG1-CG2 4.16Å; I580-I635 HydrophobicContact CG2-CG2 4.49Å; S596-I635 CarbonylContact O-C 3.59Å; S596-I635 WeakPolarHBondContact O-CA 3.19Å; M608-I635 HydrophobicContact CE-CB 4.37Å; M608-I635 HydrophobicContact CE-CD1 4.43Å; M608-I635 HydrophobicContact CE-CG1 4.15Å; M608-I635 HydrophobicContact CE-CG2 3.5Å; M608-I635 HydrophobicContact SD-CD1 4Å; M608-I635 HydrophobicContact SD-CG1 4.38Å; M608-I635 HydrophobicContact SD-CG2 4.04Å; L615-I635 HydrophobicContact CD2-CD1 4.48Å; I635-S648 CarbonylContact O-C 3.52Å; I635-S648 WeakPolarHBondContact O-CA 3.38Å; I635-S648 VanDerWaalsContact O-CB 3.32Å; I635-S648 WeakPolarHBondContact O-CB 3.01Å; I635-A649 PolarHBondContact N-O 3.05Å; I635-A649 PolarHBondContact O-N 2.69Å; I635-V651 HydrophobicContact CD1-CB 4.41Å; I635-V651 HydrophobicContact CD1-CG2 3.91Å
636	E	92.4	Very high	85.7	Confident	35 Å²	35	60.8 Å²	60.8	16%	0.164	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	135.8	173.4	165.9	-175.4	-116.7	0	0	108.8	S596 L598 R638 S647	S596-E636 WeakPolarHBondContact CB-OE2 3.3Å; S596-E636 PolarHBondContact N-O 2.79Å; S596-E636 PolarHBondContact O-N 3.27Å; S596-E636 PolarHBondContact OG-OE2 2.71Å; L598-E636 HydrophobicContact CD1-CB 3.75Å; L598-E636 HydrophobicContact CD1-CG 4.44Å; L598-E636 HydrophobicContact CD2-CB 4.31Å; L598-E636 WeakPolarHBondContact CD2-OE2 3.49Å; L598-E636 HydrophobicContact CG-CB 3.67Å; L598-E636 HydrophobicContact CG-CG 4.49Å; E636-R638 HydrophobicContact CG-CB 4.23Å; E636-S647 WeakPolarHBondContact CA-O 3.2Å
637	V	93.5	Very high	87	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	130.5	161.9	-171.8	0	0	0	0	106.7	P551 V553 I580 A582 L593 S594 Y595 S646 S647	P551-V637 HydrophobicContact CB-CB 4.31Å; P551-V637 HydrophobicContact CB-CG1 3.85Å; P551-V637 HydrophobicContact CG-CG1 4.36Å; P551-V637 WeakPolarHBondContact CG-O 3.36Å; V553-V637 HydrophobicContact CG2-CG2 3.82Å; I580-V637 HydrophobicContact CG2-CG2 4.14Å; A582-V637 HydrophobicContact CB-CB 4.32Å; A582-V637 HydrophobicContact CB-CG1 3.78Å; A582-V637 HydrophobicContact CB-CG2 4.05Å; L593-V637 HydrophobicContact CB-CG1 4.23Å; L593-V637 HydrophobicContact CD1-CG1 4.48Å; L593-V637 HydrophobicContact CD2-CG1 4.11Å; S594-V637 WeakPolarHBondContact O-CA 3.21Å; Y595-V637 HydrophobicContact CD1-CG1 4.31Å; Y595-V637 HydrophobicContact CD1-CG2 3.73Å; Y595-V637 HydrophobicContact CE1-CB 4.47Å; Y595-V637 HydrophobicContact CE1-CG1 3.96Å; Y595-V637 HydrophobicContact CE1-CG2 3.68Å; V637-S646 CarbonylContact O-C 3.58Å; V637-S646 WeakPolarHBondContact O-CA 3.25Å; V637-S646 WeakPolarHBondContact O-CB 3.34Å; V637-S647 PolarHBondContact N-O 2.86Å; V637-S647 PolarHBondContact O-N 3.05Å
638	R	92.9	Very high	88.4	Confident	107 Å²	107	58.2 Å²	58.2	40%	0.404	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	134.3	-174.2	-173.7	-171.4	172.4	164.3	-2.8	110.4	S594 E636 L645	S594-R638 PolarHBondContact N-O 2.83Å; S594-R638 PolarHBondContact O-N 2.81Å; S594-R638 PolarHBondContact OG-O 2.91Å; E636-R638 HydrophobicContact CG-CB 4.23Å; R638-L645 VanDerWaalsContact CG-O 3.26Å; R638-L645 WeakPolarHBondContact CG-O 3.42Å
639	D	94.6	Very high	89.6	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.011	28%	0.277	C	S	.	.			trans	-69.2	-175.9	171	54.8	48.6	0	0	0	113.2	N547 N590 R592 P644 L645	N547-D639 PolarHBondContact ND2-OD2 3.09Å; N547-D639 PolarHBondContact OD1-OD2 3.43Å; N590-D639 WeakPolarHBondContact O-CB 3.45Å; R592-D639 CarbonylContact O-C 3.51Å; R592-D639 WeakPolarHBondContact O-CA 3.26Å; D639-P644 VanDerWaalsContact OD1-C 3.3Å; D639-P644 WeakPolarHBondContact OD1-CA 3.25Å; D639-P644 WeakPolarHBondContact OD1-CB 3.26Å; D639-L645 VanDerWaalsContact CG-N 3.25Å; D639-L645 PolarHBondContact N-O 3.39Å; D639-L645 PolarHBondContact OD1-N 2.68Å; D639-L645 VanDerWaalsContact OD2-C 3.23Å; D639-L645 WeakPolarHBondContact OD2-CA 3.41Å; D639-L645 VanDerWaalsContact OD2-CB 3.26Å; D639-L645 WeakPolarHBondContact OD2-CB 3.34Å; D639-L645 PolarHBondContact OD2-N 2.75Å
640	H	92.6	Very high	90.5	Very high	78 Å²	78	52.1 Å²	52.1	36%	0.361	28%	0.283	S	S	.	.	S	Bend	trans	-121.1	10.9	173.3	-74.6	-120.5	0	0	0	112.9	E589 R592 S594	E589-H640 CarbonylContact O-C 3.42Å; E589-H640 WeakPolarHBondContact O-CA 3.26Å; E589-H640 PolarHBondContact O-N 2.95Å; R592-H640 HydrophobicContact CB-CB 4.22Å; R592-H640 PolarHBondContact O-CD2 2.83Å; S594-H640 VanDerWaalsContact CB-NE2 3.32Å; S594-H640 WeakPolarHBondContact CB-NE2 2.97Å; S594-H640 PolarHBondContact OG-NE2 3.24Å
641	G	90.3	Very high	90.8	Very high	5 Å²	5	47 Å²	47	5%	0.052	26%	0.261	C	S	.	.	S	Bend	trans	-75.6	-170.4	177.2	0	0	0	0	0	114.1	N547 E589 N590 P644	N547-G641 WeakPolarHBondContact OD1-CA 3.48Å; N547-G641 PolarHBondContact OD1-N 3.45Å; E589-G641 PolarHBondContact O-N 3.11Å; N590-G641 WeakPolarHBondContact OD1-CA 3.45Å; G641-P644 WeakPolarHBondContact O-CA 2.93Å; G641-P644 VanDerWaalsContact O-CB 3.31Å; G641-P644 WeakPolarHBondContact O-CB 3.28Å; G641-P644 VanDerWaalsContact O-CD 3.32Å; G641-P644 WeakPolarHBondContact O-CD 3.36Å
642	Q	88.6	Confident	90.9	Very high	180 Å²	180	47.1 Å²	47.1	84%	0.841	26%	0.263	S	S	*	.	S	Bend	trans	-141.3	116.7	-177.4	-64.8	-170.5	39.4	0	0	112
643	P	92.2	Very high	90.9	Very high	98 Å²	98	42.9 Å²	42.9	64%	0.636	24%	0.24	S	C	*	.	S	Bend	cis	-70.3	135.9	-2.9	31.1	-34.5	0	0	0	111.5	L645	P643-L645 PolarHBondContact O-N 2.8Å
644	P	92.8	Very high	90.6	Very high	50 Å²	50	45.1 Å²	45.1	33%	0.325	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-73.9	127.1	-177.4	26.8	-32.5	0	0	0	111.8	D639 G641	D639-P644 VanDerWaalsContact OD1-C 3.3Å; D639-P644 WeakPolarHBondContact OD1-CA 3.25Å; D639-P644 WeakPolarHBondContact OD1-CB 3.26Å; G641-P644 WeakPolarHBondContact O-CA 2.93Å; G641-P644 VanDerWaalsContact O-CB 3.31Å; G641-P644 WeakPolarHBondContact O-CB 3.28Å; G641-P644 VanDerWaalsContact O-CD 3.32Å; G641-P644 WeakPolarHBondContact O-CD 3.36Å
645	L	93.3	Very high	90.3	Very high	56 Å²	56	43.3 Å²	43.3	29%	0.293	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-95.3	168.7	179	-58.9	179	0	0	0	111.1	N547 N549 A550 R638 D639 P643	N547-L645 WeakPolarHBondContact ND2-CG 3.42Å; N547-L645 VanDerWaalsContact O-CD1 3.26Å; N547-L645 WeakPolarHBondContact O-CD1 3.32Å; N549-L645 WeakPolarHBondContact O-CD1 3.18Å; A550-L645 HydrophobicContact CB-CB 3.99Å; A550-L645 HydrophobicContact CB-CD1 4.24Å; R638-L645 VanDerWaalsContact CG-O 3.26Å; R638-L645 WeakPolarHBondContact CG-O 3.42Å; D639-L645 VanDerWaalsContact CG-N 3.25Å; D639-L645 PolarHBondContact N-O 3.39Å; D639-L645 PolarHBondContact OD1-N 2.68Å; D639-L645 VanDerWaalsContact OD2-C 3.23Å; D639-L645 WeakPolarHBondContact OD2-CA 3.41Å; D639-L645 VanDerWaalsContact OD2-CB 3.26Å; D639-L645 WeakPolarHBondContact OD2-CB 3.34Å; D639-L645 PolarHBondContact OD2-N 2.75Å; P643-L645 PolarHBondContact O-N 2.8Å
646	S	92.5	Very high	89.7	Confident	64 Å²	64	45.3 Å²	45.3	45%	0.448	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	154.5	-179.8	54.9	0	0	0	0	112.2	V637	V637-S646 CarbonylContact O-C 3.58Å; V637-S646 WeakPolarHBondContact O-CA 3.25Å; V637-S646 WeakPolarHBondContact O-CB 3.34Å
647	S	91.2	Very high	88.6	Confident	34 Å²	34	48.5 Å²	48.5	24%	0.238	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	170.2	164.3	75.8	0	0	0	0	110.5	P551 E636 V637	P551-S647 WeakPolarHBondContact O-CB 3.42Å; P551-S647 PolarHBondContact O-OG 3Å; E636-S647 WeakPolarHBondContact CA-O 3.2Å; V637-S647 PolarHBondContact N-O 2.86Å; V637-S647 PolarHBondContact O-N 3.05Å
648	S	88.9	Confident	86.9	Confident	74 Å²	74	52.1 Å²	52.1	52%	0.517	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.4	178.2	68.9	0	0	0	0	112.9	I635	I635-S648 CarbonylContact O-C 3.52Å; I635-S648 WeakPolarHBondContact O-CA 3.38Å; I635-S648 VanDerWaalsContact O-CB 3.32Å; I635-S648 WeakPolarHBondContact O-CB 3.01Å
649	A	87.7	Confident	84.8	Confident	14 Å²	14	51.2 Å²	51.2	12%	0.116	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130.7	173.7	0	0	0	0	0	110.3	V553 I635	V553-A649 HydrophobicContact CB-CB 4.49Å; V553-A649 HydrophobicContact CG1-CB 4.1Å; V553-A649 HydrophobicContact CG2-CB 4.23Å; I635-A649 PolarHBondContact N-O 3.05Å; I635-A649 PolarHBondContact O-N 2.69Å
650	S	88.1	Confident	82.3	Confident	44 Å²	44	56.5 Å²	56.5	31%	0.308	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	124.1	170.7	-66.2	0	0	0	0	109.7	T562 A563 L633	T562-S650 CarbonylContact C-O 3.45Å; T562-S650 WeakPolarHBondContact CA-O 3.31Å; A563-S650 PolarHBondContact N-O 2.79Å; L633-S650 CarbonylContact O-C 3.6Å; L633-S650 WeakPolarHBondContact O-CA 3.48Å
651	V	88.7	Confident	80.2	Confident	1 Å²	1	62 Å²	62	1%	0.006	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	105.1	180	-176.1	0	0	0	0	109.3	A563 E565 T578 I580 L615 L633 I635 V653	A563-V651 HydrophobicContact CB-CG2 4.35Å; E565-V651 HydrophobicContact CB-CG1 4.36Å; E565-V651 HydrophobicContact CG-CG1 3.84Å; T578-V651 HydrophobicContact CG2-CG1 4.38Å; I580-V651 HydrophobicContact CD1-CG2 3.94Å; L615-V651 HydrophobicContact CD2-CG1 4.44Å; L633-V651 PolarHBondContact N-O 2.95Å; L633-V651 PolarHBondContact O-N 3.14Å; I635-V651 HydrophobicContact CD1-CB 4.41Å; I635-V651 HydrophobicContact CD1-CG2 3.91Å; V651-V653 HydrophobicContact CG1-CG2 4.12Å; V651-V653 PolarHBondContact O-N 2.79Å
652	S	88.4	Confident	77.5	Confident	10 Å²	10	64.3 Å²	64.3	7%	0.07	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	102.6	176.3	-167.5	0	0	0	0	109.5	A563 K564 E565 Y631 D632 I654	A563-S652 PolarHBondContact O-N 2.78Å; K564-S652 WeakPolarHBondContact CA-O 3.28Å; E565-S652 PolarHBondContact N-O 3.44Å; Y631-S652 WeakPolarHBondContact O-CA 3.39Å; D632-S652 WeakPolarHBondContact OD1-CA 3.42Å; D632-S652 WeakPolarHBondContact OD1-CB 3.28Å; D632-S652 PolarHBondContact OD1-OG 3.39Å; S652-I654 PolarHBondContact O-N 2.95Å
653	V	87.2	Confident	75.4	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	106.4	179.8	-173.4	0	0	0	0	109.2	E565 L567 V577 F606 L615 F630 Y631 L633 V651	E565-V653 CarbonylContact O-C 3.59Å; E565-V653 WeakPolarHBondContact O-CA 3.41Å; L567-V653 HydrophobicContact CB-CG1 3.54Å; L567-V653 HydrophobicContact CD2-CG1 3.83Å; L567-V653 HydrophobicContact CG-CG1 4.34Å; V577-V653 HydrophobicContact CG1-CG1 3.78Å; V577-V653 HydrophobicContact CG1-CG2 3.98Å; F606-V653 HydrophobicContact CE1-CB 4.44Å; F606-V653 HydrophobicContact CE1-CG1 4.05Å; F606-V653 HydrophobicContact CE1-CG2 4.23Å; F606-V653 HydrophobicContact CZ-CB 4.04Å; F606-V653 HydrophobicContact CZ-CG1 3.92Å; F606-V653 HydrophobicContact CZ-CG2 4.12Å; L615-V653 HydrophobicContact CD2-CG2 4.22Å; F630-V653 CarbonylContact C-O 3.55Å; F630-V653 VanDerWaalsContact CA-O 3.26Å; F630-V653 WeakPolarHBondContact CA-O 3.35Å; Y631-V653 PolarHBondContact N-O 3.44Å; Y631-V653 PolarHBondContact O-N 2.83Å; L633-V653 HydrophobicContact CD1-CG2 3.95Å; L633-V653 HydrophobicContact CG-CG2 4.39Å; V651-V653 HydrophobicContact CG1-CG2 4.12Å; V651-V653 PolarHBondContact O-N 2.79Å
654	I	84.8	Confident	72.7	Confident	49 Å²	49	68.5 Å²	68.5	25%	0.251	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.9	-175	-59.3	173.8	0	0	0	109.2	K564 E565 L567 F630 S652	K564-I654 HydrophobicContact CB-CD1 4.2Å; K564-I654 HydrophobicContact CD-CD1 4.05Å; K564-I654 HydrophobicContact CG-CD1 4.29Å; E565-I654 PolarHBondContact O-N 3.4Å; L567-I654 PolarHBondContact N-O 2.94Å; F630-I654 HydrophobicContact CB-CG1 4.44Å; S652-I654 PolarHBondContact O-N 2.95Å
655	L	83.6	Confident	70	Confident	8 Å²	8	70.1 Å²	70.1	4%	0.042	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.1	175.8	-64.9	-176.1	0	0	0	111.3	L567 R569 I621 G629 Y631	L567-L655 HydrophobicContact CB-CD2 4.2Å; L567-L655 HydrophobicContact CD2-CD2 4.01Å; L567-L655 HydrophobicContact CG-CD2 4.11Å; L567-L655 WeakPolarHBondContact O-CA 3.14Å; R569-L655 HydrophobicContact CG-CB 3.96Å; R569-L655 HydrophobicContact CG-CD1 4.47Å; R569-L655 HydrophobicContact CG-CD2 4.45Å; I621-L655 HydrophobicContact CD1-CD2 3.54Å; I621-L655 HydrophobicContact CG1-CD2 4.26Å; I621-L655 HydrophobicContact CG2-CD1 4.08Å; G629-L655 WeakPolarHBondContact O-CB 3.16Å; G629-L655 WeakPolarHBondContact O-CD1 3.32Å; G629-L655 WeakPolarHBondContact O-CG 3.01Å; Y631-L655 HydrophobicContact CE2-CD1 4.35Å; Y631-L655 HydrophobicContact CE2-CD2 4.28Å; Y631-L655 HydrophobicContact CE2-CG 4.45Å
656	V	79.6	Confident	67.1	Low	43 Å²	43	75.3 Å²	75.3	26%	0.261	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.4	178.5	-165	0	0	0	0	110	H566 L567 P568 R569 S658	H566-V656 HydrophobicContact CB-CG2 4.04Å; H566-V656 WeakPolarHBondContact ND1-CG2 3.43Å; L567-V656 PolarHBondContact O-N 2.8Å; P568-V656 CarbonylContact C-O 3.43Å; P568-V656 VanDerWaalsContact CA-O 3.32Å; P568-V656 WeakPolarHBondContact CA-O 3.44Å; R569-V656 PolarHBondContact N-O 2.98Å; V656-S658 VanDerWaalsContact CG1-O 3.28Å; V656-S658 WeakPolarHBondContact CG1-O 3.4Å
657	D	70	Confident	64.3	Low	102 Å²	102	84.1 Å²	84.1	55%	0.545	48%	0.476	S	S	.	.	S	Bend	trans	-71.6	-29.6	179.6	-72.7	-54.2	0	0	0	113.5	R569	R569-D657 WeakPolarHBondContact CD-OD1 3.45Å; R569-D657 IonicContact CZ-OD1 2.73Å; R569-D657 IonicContact NE-OD1 3.67Å; R569-D657 IonicContact NH1-OD1 2.7Å; R569-D657 PolarHBondContact NH1-OD1 2.75Å
658	S	57.7	Low	61.4	Low	75 Å²	75	86 Å²	86	52%	0.524	50%	0.501	S	S	.	.			trans	-155.7	139.5	168.5	58.2	0	0	0	0	111	V656 V660	V656-S658 VanDerWaalsContact CG1-O 3.28Å; V656-S658 WeakPolarHBondContact CG1-O 3.4Å; S658-V660 PolarHBondContact O-N 2.87Å
659	V	48.2	Very low	58.7	Low	89 Å²	89	88.7 Å²	88.7	54%	0.539	52%	0.52	S	S	.	.			trans	-83.1	97	171.2	-178.7	0	0	0	0	107.7	P568	P568-V659 HydrophobicContact CB-CG2 4.19Å; P568-V659 HydrophobicContact CG-CG2 4.22Å
660	V	41.2	Very low	56.1	Low	112 Å²	112	93 Å²	93	68%	0.679	56%	0.556	S	S	*	*			trans	-85.1	121.4	173.4	179.8	0	0	0	0	108.6	S658 G662	S658-V660 PolarHBondContact O-N 2.87Å; V660-G662 PolarHBondContact O-N 2.83Å
661	E	48.5	Very low	53.5	Low	193 Å²	193	96.7 Å²	96.7	90%	0.902	58%	0.582	S	S	*	*			trans	-70	71.9	168.2	-69.1	-168.6	119.6	0	0	110.6	R663	E661-R663 PolarHBondContact O-N 2.9Å
662	G	35.1	Very low	51.2	Low	55 Å²	55	107 Å²	107	57%	0.567	63%	0.626	S	S	*	*			trans	-85.9	90	-171.2	0	0	0	0	0	113.7	V660 S664	V660-G662 PolarHBondContact O-N 2.83Å; G662-S664 PolarHBondContact O-N 3.27Å
663	R	44.3	Very low	48.5	Very low	253 Å²	253	111.4 Å²	111.4	96%	0.955	66%	0.663	S	S	*	*			trans	-68	89	168	-80.3	-179.8	166.9	174.6	-3.8	112.1	E661	E661-R663 PolarHBondContact O-N 2.9Å
664	S	35.9	Very low	45.9	Very low	113 Å²	113	121 Å²	121	79%	0.79	71%	0.705	S	S	*	*			trans	-158.3	129.9	160	54.9	0	0	0	0	110.5	G662	G662-S664 PolarHBondContact O-N 3.27Å
665	G	35.1	Very low	43.8	Very low	84 Å²	84	127.2 Å²	127.2	87%	0.866	73%	0.733	S	S	*	*			cis	122.7	64	3.1	0	0	0	0	0	112.2
666	D	31.7	Very low	41.9	Very low	165 Å²	165	132.2 Å²	132.2	88%	0.882	76%	0.764	S	S	*	*			trans	-116.6	155.9	171.4	-162.6	6.8	0	0	0	110.8
667	R	35.1	Very low	40.5	Very low	248 Å²	248	135.5 Å²	135.5	94%	0.936	79%	0.789	S	S	*	*			trans	-112	111.5	-162.9	-80.2	174.9	157.1	171.1	-6.5	112.9
668	G	30.1	Very low	39.8	Very low	75 Å²	75	137.8 Å²	137.8	77%	0.773	80%	0.8	S	S	*	*			trans	-136.4	61.5	179	0	0	0	0	0	115.1
669	S	32.1	Very low	39.9	Very low	130 Å²	130	138 Å²	138	91%	0.909	80%	0.796	S	S	*	*			trans	42.7	92.7	162.6	-176.9	0	0	0	0	118.6
670	A	32	Very low	40.4	Very low	105 Å²	105	140.5 Å²	140.5	87%	0.868	81%	0.805	S	S	*	*			trans	-123.1	144.9	159.5	0	0	0	0	0	110.8
671	S	35.1	Very low	41.4	Very low	121 Å²	121	139.9 Å²	139.9	85%	0.846	80%	0.802	S	S	*	*			trans	-87.6	164.3	-174.9	50.2	0	0	0	0	113.4	A673	S671-A673 PolarHBondContact O-N 2.86Å
672	K	38.8	Very low	42.2	Very low	216 Å²	216	135.2 Å²	135.2	94%	0.939	78%	0.783	S	S	*	*			trans	-53.3	127.7	-173.1	-60.9	169.8	-179.7	171.9	0	113.9
673	A	32	Very low	43.7	Very low	103 Å²	103	136.7 Å²	136.7	85%	0.851	78%	0.777	S	S	*	*			trans	-128.9	149.5	144.6	0	0	0	0	0	108.4	S671	S671-A673 PolarHBondContact O-N 2.86Å
674	K	34.1	Very low	45	Very low	202 Å²	202	129.8 Å²	129.8	88%	0.878	76%	0.758	S	S	*	*			trans	-94.6	159	-178.5	-95	-171.2	172.4	-172	0	111.8
675	E	40	Very low	46.9	Very low	180 Å²	180	130 Å²	130	84%	0.841	75%	0.749	S	S	*	*			trans	-64.1	131.3	168.7	-58.2	162.5	121.7	0	0	111.6
676	T	43.4	Very low	48.8	Very low	113 Å²	113	130.8 Å²	130.8	69%	0.693	73%	0.732	S	S	*	*			trans	-141.8	34.4	164.7	45.3	0	0	0	0	111.7	L678 D679	T676-L678 PolarHBondContact O-N 2.03Å; T676-D679 PolarHBondContact O-N 2.7Å
677	S	49.8	Very low	50.9	Low	111 Å²	111	125.1 Å²	125.1	78%	0.776	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	16	-176.8	49.6	0	0	0	0	115.7
678	L	55.7	Low	53	Low	150 Å²	150	118.5 Å²	118.5	79%	0.785	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	1.6	175	-76.5	172.8	0	0	0	113.8	T676	T676-L678 PolarHBondContact O-N 2.03Å
679	D	60	Low	55.5	Low	81 Å²	81	116.8 Å²	116.8	43%	0.433	67%	0.673	S	S	.	*	S	Bend	trans	-89.5	-36.3	-177.7	-137.1	-13.8	0	0	0	112.5	T676 T681 L682 I683	T676-D679 PolarHBondContact O-N 2.7Å; D679-T681 PolarHBondContact O-N 3.17Å; D679-L682 WeakPolarHBondContact O-CB 3.26Å; D679-L682 PolarHBondContact O-N 2.87Å; D679-I683 HydrophobicContact CB-CD1 4.02Å; D679-I683 WeakPolarHBondContact O-CB 3.32Å; D679-I683 VanDerWaalsContact O-CG1 3.29Å; D679-I683 WeakPolarHBondContact O-CG1 3.41Å; D679-I683 PolarHBondContact O-N 2.93Å
680	L	58.4	Low	57.8	Low	140 Å²	140	113.2 Å²	113.2	73%	0.733	65%	0.648	S	S	*	*	H	α-helix	trans	-62.3	-40	-169.1	-156.1	79.2	0	0	0	113.8	L684	L680-L684 WeakPolarHBondContact O-CB 3.49Å; L680-L684 PolarHBondContact O-N 2.86Å
681	T	61.9	Low	60.4	Low	99 Å²	99	112.7 Å²	112.7	61%	0.607	63%	0.634	S	S	*	*	H	α-helix	trans	-73.2	-32.8	176	46.9	0	0	0	0	112.3	D679 I685	D679-T681 PolarHBondContact O-N 3.17Å; T681-I685 WeakPolarHBondContact O-CD1 3.03Å; T681-I685 VanDerWaalsContact O-CG1 3.28Å; T681-I685 WeakPolarHBondContact O-CG1 3.25Å; T681-I685 PolarHBondContact O-N 2.9Å; T681-I685 VanDerWaalsContact O-N 3.09Å
682	L	64.9	Low	62.7	Low	96 Å²	96	110.5 Å²	110.5	50%	0.503	62%	0.619	S	S	.	*	H	α-helix	trans	-67.5	-47.6	174.3	-166.9	77.2	0	0	0	110.6	D679 L684 I685 I686	D679-L682 WeakPolarHBondContact O-CB 3.26Å; D679-L682 PolarHBondContact O-N 2.87Å; L682-L684 VanDerWaalsContact C-N 3.32Å; L682-L684 PolarHBondContact O-N 3.48Å; L682-I685 PolarHBondContact O-N 2.59Å; L682-I686 HydrophobicContact CD2-CD1 4.26Å; L682-I686 HydrophobicContact CG-CD1 3.91Å; L682-I686 WeakPolarHBondContact O-CB 3.05Å; L682-I686 VanDerWaalsContact O-CG1 3.26Å; L682-I686 WeakPolarHBondContact O-CG1 3.13Å; L682-I686 PolarHBondContact O-N 3.48Å
683	I	68	Low	64.9	Low	86 Å²	86	106.3 Å²	106.3	44%	0.441	60%	0.601	S	S	.	*	H	α-helix	trans	-57.7	-43	174.9	-70.1	165.9	0	0	0	110.7	D679 I686 A687	D679-I683 HydrophobicContact CB-CD1 4.02Å; D679-I683 WeakPolarHBondContact O-CB 3.32Å; D679-I683 VanDerWaalsContact O-CG1 3.29Å; D679-I683 WeakPolarHBondContact O-CG1 3.41Å; D679-I683 PolarHBondContact O-N 2.93Å; I683-I686 PolarHBondContact O-N 2.98Å; I683-A687 VanDerWaalsContact O-CB 3.28Å; I683-A687 WeakPolarHBondContact O-CB 3.48Å; I683-A687 PolarHBondContact O-N 2.84Å
684	L	72.1	Confident	67.4	Low	107 Å²	107	106.6 Å²	106.6	56%	0.56	59%	0.587	S	S	*	*	H	α-helix	trans	-69.9	-34.2	-179.3	-159.6	142.4	0	0	0	112.5	L680 L682 L688	L680-L684 WeakPolarHBondContact O-CB 3.49Å; L680-L684 PolarHBondContact O-N 2.86Å; L682-L684 VanDerWaalsContact C-N 3.32Å; L682-L684 PolarHBondContact O-N 3.48Å; L684-L688 HydrophobicContact CD2-CD1 3.84Å; L684-L688 WeakPolarHBondContact O-CG 3.5Å; L684-L688 PolarHBondContact O-N 3.49Å
685	I	75.4	Confident	69.7	Low	117 Å²	117	103.8 Å²	103.8	60%	0.6	58%	0.575	S	S	*	*	H	α-helix	trans	-68.8	-41.8	170.5	-69.3	166.2	0	0	0	111.1	T681 L682 A687 G689	T681-I685 WeakPolarHBondContact O-CD1 3.03Å; T681-I685 VanDerWaalsContact O-CG1 3.28Å; T681-I685 WeakPolarHBondContact O-CG1 3.25Å; T681-I685 PolarHBondContact O-N 2.9Å; T681-I685 VanDerWaalsContact O-N 3.09Å; L682-I685 PolarHBondContact O-N 2.59Å; I685-A687 VanDerWaalsContact C-N 3.33Å; I685-G689 PolarHBondContact O-N 3.4Å
686	I	75.4	Confident	71.8	Confident	102 Å²	102	99.9 Å²	99.9	52%	0.523	56%	0.559	S	S	.	*	H	α-helix	trans	-64.8	-37.7	176.2	-70.9	167.1	0	0	0	110.9	L682 I683 G689 S690	L682-I686 HydrophobicContact CD2-CD1 4.26Å; L682-I686 HydrophobicContact CG-CD1 3.91Å; L682-I686 WeakPolarHBondContact O-CB 3.05Å; L682-I686 VanDerWaalsContact O-CG1 3.26Å; L682-I686 WeakPolarHBondContact O-CG1 3.13Å; L682-I686 PolarHBondContact O-N 3.48Å; I683-I686 PolarHBondContact O-N 2.98Å; I686-G689 PolarHBondContact O-N 3.38Å; I686-S690 WeakPolarHBondContact O-CB 3.48Å; I686-S690 PolarHBondContact O-N 2.94Å; I686-S690 PolarHBondContact O-OG 2.84Å
687	A	74.6	Confident	73.8	Confident	45 Å²	45	98.2 Å²	98.2	37%	0.372	55%	0.546	S	S	.	.	H	α-helix	trans	-69.2	-45.8	176.8	0	0	0	0	0	112.2	I683 I685 G689 S690 V691	I683-A687 VanDerWaalsContact O-CB 3.28Å; I683-A687 WeakPolarHBondContact O-CB 3.48Å; I683-A687 PolarHBondContact O-N 2.84Å; I685-A687 VanDerWaalsContact C-N 3.33Å; A687-G689 VanDerWaalsContact C-N 3.29Å; A687-G689 PolarHBondContact O-N 2.8Å; A687-S690 PolarHBondContact O-N 2.96Å; A687-S690 PolarHBondContact O-OG 3.18Å; A687-S690 VanDerWaalsContact O-OG 3.09Å; A687-V691 WeakPolarHBondContact O-CB 3.38Å; A687-V691 VanDerWaalsContact O-CG2 3.31Å; A687-V691 WeakPolarHBondContact O-CG2 3.2Å; A687-V691 PolarHBondContact O-N 2.99Å
688	L	80.4	Confident	75.2	Confident	109 Å²	109	95.1 Å²	95.1	57%	0.571	53%	0.527	S	S	*	.	H	α-helix	trans	-62.1	-39.2	172.8	-77.9	167.9	0	0	0	111.6	L684 S692	L684-L688 HydrophobicContact CD2-CD1 3.84Å; L684-L688 WeakPolarHBondContact O-CG 3.5Å; L684-L688 PolarHBondContact O-N 3.49Å; L688-S692 VanDerWaalsContact O-CB 3.25Å; L688-S692 WeakPolarHBondContact O-CB 3.33Å; L688-S692 PolarHBondContact O-N 3.25Å; L688-S692 PolarHBondContact O-OG 2.57Å
689	G	81.9	Confident	76.4	Confident	40 Å²	40	92.9 Å²	92.9	41%	0.412	51%	0.514	S	S	.	.	H	α-helix	trans	-64.5	-43.7	174.5	0	0	0	0	0	113.2	I685 I686 A687 S692 F693	I685-G689 PolarHBondContact O-N 3.4Å; I686-G689 PolarHBondContact O-N 3.38Å; A687-G689 VanDerWaalsContact C-N 3.29Å; A687-G689 PolarHBondContact O-N 2.8Å; G689-S692 PolarHBondContact O-N 3.42Å; G689-F693 VanDerWaalsContact O-CB 3.28Å; G689-F693 WeakPolarHBondContact O-CB 3.26Å; G689-F693 PolarHBondContact O-N 3.18Å
690	S	80.3	Confident	77.4	Confident	54 Å²	54	93.2 Å²	93.2	38%	0.378	51%	0.514	S	S	.	.	H	α-helix	trans	-71.9	-41.5	-179.4	68.6	0	0	0	0	112.2	I686 A687 S692 F693 I694	I686-S690 WeakPolarHBondContact O-CB 3.48Å; I686-S690 PolarHBondContact O-N 2.94Å; I686-S690 PolarHBondContact O-OG 2.84Å; A687-S690 PolarHBondContact O-N 2.96Å; A687-S690 PolarHBondContact O-OG 3.18Å; A687-S690 VanDerWaalsContact O-OG 3.09Å; S690-S692 VanDerWaalsContact C-N 3.35Å; S690-S692 PolarHBondContact O-N 3.42Å; S690-F693 PolarHBondContact O-N 3.44Å; S690-I694 WeakPolarHBondContact O-CB 3.28Å; S690-I694 VanDerWaalsContact O-CG1 3.24Å; S690-I694 WeakPolarHBondContact O-CG1 3.48Å; S690-I694 PolarHBondContact O-N 2.87Å
691	V	85.6	Confident	78.5	Confident	95 Å²	95	90.7 Å²	90.7	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-61.1	-44.4	172.5	172	0	0	0	0	110.6	A687 F693 I694 F695	A687-V691 WeakPolarHBondContact O-CB 3.38Å; A687-V691 VanDerWaalsContact O-CG2 3.31Å; A687-V691 WeakPolarHBondContact O-CG2 3.2Å; A687-V691 PolarHBondContact O-N 2.99Å; V691-F693 VanDerWaalsContact C-N 3.34Å; V691-F693 PolarHBondContact O-N 3.1Å; V691-I694 PolarHBondContact O-N 3.1Å; V691-F695 WeakPolarHBondContact O-CB 3.28Å; V691-F695 PolarHBondContact O-N 3.01Å
692	S	83.7	Confident	79	Confident	75 Å²	75	90.7 Å²	90.7	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-39.3	175.9	-59.2	0	0	0	0	112.4	L688 G689 S690 L696	L688-S692 VanDerWaalsContact O-CB 3.25Å; L688-S692 WeakPolarHBondContact O-CB 3.33Å; L688-S692 PolarHBondContact O-N 3.25Å; L688-S692 PolarHBondContact O-OG 2.57Å; G689-S692 PolarHBondContact O-N 3.42Å; S690-S692 VanDerWaalsContact C-N 3.35Å; S690-S692 PolarHBondContact O-N 3.42Å; S692-L696 VanDerWaalsContact O-CB 3.29Å; S692-L696 WeakPolarHBondContact O-CB 3.49Å; S692-L696 PolarHBondContact O-N 3.01Å
693	F	85.7	Confident	79.3	Confident	127 Å²	127	88.4 Å²	88.4	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-71	-39	178	-175.7	-108.5	0	0	0	112.6	G689 S690 V691 L696 L697	G689-F693 VanDerWaalsContact O-CB 3.28Å; G689-F693 WeakPolarHBondContact O-CB 3.26Å; G689-F693 PolarHBondContact O-N 3.18Å; S690-F693 PolarHBondContact O-N 3.44Å; V691-F693 VanDerWaalsContact C-N 3.34Å; V691-F693 PolarHBondContact O-N 3.1Å; F693-L696 PolarHBondContact O-N 2.89Å; F693-L697 HydrophobicContact CD1-CD1 3.87Å; F693-L697 HydrophobicContact CE1-CD1 3.47Å; F693-L697 VanDerWaalsContact CE1-CD1 3.47Å; F693-L697 HydrophobicContact CE1-CG 4.28Å; F693-L697 HydrophobicContact CZ-CD1 3.94Å; F693-L697 HydrophobicContact CZ-CG 4.35Å; F693-L697 WeakPolarHBondContact O-CB 3.34Å; F693-L697 WeakPolarHBondContact O-CG 3.5Å; F693-L697 PolarHBondContact O-N 2.85Å
694	I	84.6	Confident	79.7	Confident	109 Å²	109	87.6 Å²	87.6	56%	0.559	50%	0.495	S	S	*	.	H	α-helix	trans	-65.9	-43	174	-70.3	164.8	0	0	0	110.4	S690 V691 L696 L697 A698	S690-I694 WeakPolarHBondContact O-CB 3.28Å; S690-I694 VanDerWaalsContact O-CG1 3.24Å; S690-I694 WeakPolarHBondContact O-CG1 3.48Å; S690-I694 PolarHBondContact O-N 2.87Å; V691-I694 PolarHBondContact O-N 3.1Å; I694-L696 PolarHBondContact O-N 2.7Å; I694-L697 PolarHBondContact O-N 3.26Å; I694-A698 WeakPolarHBondContact O-CB 3.4Å; I694-A698 PolarHBondContact O-N 3.14Å
695	F	81.8	Confident	79.3	Confident	144 Å²	144	90.8 Å²	90.8	63%	0.632	50%	0.499	S	S	*	.	H	α-helix	trans	-62	-42.3	174.6	-172.1	-96.1	0	0	0	111.7	V691 A698 M699	V691-F695 WeakPolarHBondContact O-CB 3.28Å; V691-F695 PolarHBondContact O-N 3.01Å; F695-A698 PolarHBondContact O-N 2.97Å; F695-M699 HydrophobicContact CD1-CG 4.16Å; F695-M699 HydrophobicContact CE1-CG 3.87Å; F695-M699 HydrophobicContact CZ-CG 4.28Å; F695-M699 WeakPolarHBondContact O-CB 3.44Å; F695-M699 WeakPolarHBondContact O-CG 3.47Å; F695-M699 PolarHBondContact O-N 3.12Å
696	L	85.2	Confident	78.4	Confident	97 Å²	97	88.6 Å²	88.6	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-66.3	-38.2	176.1	-171.6	146.6	0	0	0	112.1	S692 F693 I694 M699 I700	S692-L696 VanDerWaalsContact O-CB 3.29Å; S692-L696 WeakPolarHBondContact O-CB 3.49Å; S692-L696 PolarHBondContact O-N 3.01Å; F693-L696 PolarHBondContact O-N 2.89Å; I694-L696 PolarHBondContact O-N 2.7Å; L696-M699 PolarHBondContact O-N 3.47Å; L696-I700 HydrophobicContact CD2-CD1 3.62Å; L696-I700 HydrophobicContact CD2-CG1 4.43Å; L696-I700 WeakPolarHBondContact O-CG1 3.47Å; L696-I700 PolarHBondContact O-N 3Å
697	L	85.5	Confident	77.7	Confident	79 Å²	79	91 Å²	91	41%	0.414	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-42.7	171.2	-82.5	171.6	0	0	0	112.3	F693 I694 M699 I700 V701	F693-L697 HydrophobicContact CD1-CD1 3.87Å; F693-L697 HydrophobicContact CE1-CD1 3.47Å; F693-L697 VanDerWaalsContact CE1-CD1 3.47Å; F693-L697 HydrophobicContact CE1-CG 4.28Å; F693-L697 HydrophobicContact CZ-CD1 3.94Å; F693-L697 HydrophobicContact CZ-CG 4.35Å; F693-L697 WeakPolarHBondContact O-CB 3.34Å; F693-L697 WeakPolarHBondContact O-CG 3.5Å; F693-L697 PolarHBondContact O-N 2.85Å; I694-L697 PolarHBondContact O-N 3.26Å; L697-M699 VanDerWaalsContact C-N 3.34Å; L697-M699 PolarHBondContact O-N 3.32Å; L697-I700 PolarHBondContact O-N 3.09Å; L697-V701 WeakPolarHBondContact O-CG2 3.49Å; L697-V701 PolarHBondContact O-N 2.62Å
698	A	78.8	Confident	76.7	Confident	46 Å²	46	96 Å²	96	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-61.4	-43	175.5	0	0	0	0	0	111.3	I694 F695 I700 V701 L702	I694-A698 WeakPolarHBondContact O-CB 3.4Å; I694-A698 PolarHBondContact O-N 3.14Å; F695-A698 PolarHBondContact O-N 2.97Å; A698-I700 PolarHBondContact O-N 3.07Å; A698-V701 PolarHBondContact O-N 2.91Å; A698-L702 WeakPolarHBondContact O-CB 3.46Å; A698-L702 WeakPolarHBondContact O-CG 3.36Å; A698-L702 PolarHBondContact O-N 2.93Å
699	M	80.8	Confident	75.3	Confident	102 Å²	102	95.5 Å²	95.5	50%	0.502	51%	0.513	S	S	.	.	H	α-helix	trans	-64	-36.7	173.8	-73.3	-65	-71.4	0	0	112.7	F695 L696 L697 L702 A703	F695-M699 HydrophobicContact CD1-CG 4.16Å; F695-M699 HydrophobicContact CE1-CG 3.87Å; F695-M699 HydrophobicContact CZ-CG 4.28Å; F695-M699 WeakPolarHBondContact O-CB 3.44Å; F695-M699 WeakPolarHBondContact O-CG 3.47Å; F695-M699 PolarHBondContact O-N 3.12Å; L696-M699 PolarHBondContact O-N 3.47Å; L697-M699 VanDerWaalsContact C-N 3.34Å; L697-M699 PolarHBondContact O-N 3.32Å; M699-L702 HydrophobicContact SD-CD1 4.39Å; M699-A703 VanDerWaalsContact O-CB 3.26Å; M699-A703 WeakPolarHBondContact O-CB 3.38Å; M699-A703 PolarHBondContact O-N 3.28Å
700	I	81.7	Confident	73.7	Confident	88 Å²	88	102.5 Å²	102.5	45%	0.451	53%	0.533	S	S	.	.	H	α-helix	trans	-67.4	-42.4	172.3	-72.6	172.4	0	0	0	111.1	L696 L697 A698 A703 V704	L696-I700 HydrophobicContact CD2-CD1 3.62Å; L696-I700 HydrophobicContact CD2-CG1 4.43Å; L696-I700 WeakPolarHBondContact O-CG1 3.47Å; L696-I700 PolarHBondContact O-N 3Å; L697-I700 PolarHBondContact O-N 3.09Å; A698-I700 PolarHBondContact O-N 3.07Å; I700-A703 PolarHBondContact O-N 3.33Å; I700-V704 HydrophobicContact CG2-CG2 4.36Å; I700-V704 WeakPolarHBondContact O-CB 3.36Å; I700-V704 VanDerWaalsContact O-CG2 3.28Å; I700-V704 WeakPolarHBondContact O-CG2 3.39Å; I700-V704 PolarHBondContact O-N 3.25Å
701	V	80.1	Confident	72.1	Confident	87 Å²	87	109 Å²	109	53%	0.527	55%	0.554	S	S	.	*	H	α-helix	trans	-64.6	-41.2	176.9	170	0	0	0	0	111.3	L697 A698 V704 R705	L697-V701 WeakPolarHBondContact O-CG2 3.49Å; L697-V701 PolarHBondContact O-N 2.62Å; A698-V701 PolarHBondContact O-N 2.91Å; V701-V704 PolarHBondContact O-N 3.4Å; V701-R705 PolarHBondContact O-N 3.49Å
702	L	73	Confident	70.2	Confident	99 Å²	99	111.5 Å²	111.5	52%	0.518	56%	0.564	S	S	.	*	H	α-helix	trans	-63.4	-43.8	172.6	-76.9	166.3	0	0	0	111.7	A698 M699 V704 R705 C706	A698-L702 WeakPolarHBondContact O-CB 3.46Å; A698-L702 WeakPolarHBondContact O-CG 3.36Å; A698-L702 PolarHBondContact O-N 2.93Å; M699-L702 HydrophobicContact SD-CD1 4.39Å; L702-V704 VanDerWaalsContact C-N 3.34Å; L702-V704 PolarHBondContact O-N 2.93Å; L702-R705 PolarHBondContact O-N 2.79Å; L702-C706 WeakPolarHBondContact O-CB 3.19Å; L702-C706 PolarHBondContact O-N 3.34Å; L702-C706 PolarHBondContact O-SG 3.29Å
703	A	71.6	Confident	68	Low	49 Å²	49	114.8 Å²	114.8	41%	0.405	58%	0.575	S	S	.	*	H	α-helix	trans	-63.4	-38.2	175.3	0	0	0	0	0	112.4	M699 I700 C706 Q707	M699-A703 VanDerWaalsContact O-CB 3.26Å; M699-A703 WeakPolarHBondContact O-CB 3.38Å; M699-A703 PolarHBondContact O-N 3.28Å; I700-A703 PolarHBondContact O-N 3.33Å; A703-C706 PolarHBondContact O-N 2.82Å; A703-Q707 WeakPolarHBondContact O-CB 3.25Å; A703-Q707 WeakPolarHBondContact O-CG 3.49Å; A703-Q707 PolarHBondContact O-N 3.26Å
704	V	75	Confident	65.6	Low	69 Å²	69	115.6 Å²	115.6	42%	0.418	59%	0.585	S	S	.	*	H	α-helix	trans	-72.6	-35.6	177.1	169.3	0	0	0	0	112.1	I700 V701 L702 K708	I700-V704 HydrophobicContact CG2-CG2 4.36Å; I700-V704 WeakPolarHBondContact O-CB 3.36Å; I700-V704 VanDerWaalsContact O-CG2 3.28Å; I700-V704 WeakPolarHBondContact O-CG2 3.39Å; I700-V704 PolarHBondContact O-N 3.25Å; V701-V704 PolarHBondContact O-N 3.4Å; L702-V704 VanDerWaalsContact C-N 3.34Å; L702-V704 PolarHBondContact O-N 2.93Å; V704-K708 WeakPolarHBondContact O-CG 3.47Å; V704-K708 PolarHBondContact O-N 3.41Å; V704-K708 VanDerWaalsContact O-N 3.1Å
705	R	63.9	Low	63.2	Low	174 Å²	174	120.4 Å²	120.4	66%	0.657	60%	0.597	S	S	*	*	H	α-helix	trans	-62.1	-54.5	166.6	-86.7	-166.8	171.2	-170.6	-2.5	110.4	V701 L702 Q707 K708 D709	V701-R705 PolarHBondContact O-N 3.49Å; L702-R705 PolarHBondContact O-N 2.79Å; R705-Q707 PolarHBondContact O-N 3.23Å; R705-K708 CarbonylContact O-C 3.52Å; R705-K708 WeakPolarHBondContact O-CA 3.46Å; R705-K708 PolarHBondContact O-N 3Å; R705-D709 VanDerWaalsContact C-OD2 3.31Å; R705-D709 VanDerWaalsContact O-CG 3.23Å; R705-D709 PolarHBondContact O-N 3.44Å; R705-D709 VanDerWaalsContact O-OD2 3.05Å
706	C	57.7	Low	60.7	Low	70 Å²	70	119.5 Å²	119.5	47%	0.473	60%	0.603	S	S	.	*	H	α-helix	trans	-56.6	-28.2	177.7	-69.6	0	0	0	0	114.2	L702 A703 K710	L702-C706 WeakPolarHBondContact O-CB 3.19Å; L702-C706 PolarHBondContact O-N 3.34Å; L702-C706 PolarHBondContact O-SG 3.29Å; A703-C706 PolarHBondContact O-N 2.82Å; C706-K710 VanDerWaalsContact O-CB 3.28Å; C706-K710 WeakPolarHBondContact O-CB 3.46Å; C706-K710 WeakPolarHBondContact O-CD 3.43Å; C706-K710 WeakPolarHBondContact O-CG 3.26Å; C706-K710 PolarHBondContact O-N 3.29Å
707	Q	60	Low	58	Low	154 Å²	154	121.2 Å²	121.2	72%	0.72	62%	0.622	S	S	*	*	H	α-helix	trans	-80.5	-28.2	172.4	-78.5	-171.1	-1.1	0	0	114	A703 R705	A703-Q707 WeakPolarHBondContact O-CB 3.25Å; A703-Q707 WeakPolarHBondContact O-CG 3.49Å; A703-Q707 PolarHBondContact O-N 3.26Å; R705-Q707 PolarHBondContact O-N 3.23Å
708	K	53.2	Low	55.6	Low	149 Å²	149	125.7 Å²	125.7	65%	0.648	65%	0.646	S	S	*	*	H	α-helix	trans	-75.4	-45.6	171.3	-76.2	-176.5	174	-175.2	0	111.5	V704 R705 K710 K711	V704-K708 WeakPolarHBondContact O-CG 3.47Å; V704-K708 PolarHBondContact O-N 3.41Å; V704-K708 VanDerWaalsContact O-N 3.1Å; R705-K708 CarbonylContact O-C 3.52Å; R705-K708 WeakPolarHBondContact O-CA 3.46Å; R705-K708 PolarHBondContact O-N 3Å; K708-K710 VanDerWaalsContact C-N 3.29Å; K708-K710 PolarHBondContact O-N 3.26Å; K708-K711 PolarHBondContact O-N 2.98Å
709	D	50.4	Low	53.3	Low	98 Å²	98	131.5 Å²	131.5	52%	0.524	67%	0.67	S	S	.	*	H	α-helix	trans	-67.6	-31.5	-176.8	-56.5	-32.9	0	0	0	111.4	R705 K711 L712 N713	R705-D709 VanDerWaalsContact C-OD2 3.31Å; R705-D709 VanDerWaalsContact O-CG 3.23Å; R705-D709 PolarHBondContact O-N 3.44Å; R705-D709 VanDerWaalsContact O-OD2 3.05Å; D709-K711 PolarHBondContact O-N 2.95Å; D709-L712 PolarHBondContact O-N 3.17Å; D709-N713 PolarHBondContact O-N 3.17Å
710	K	48.3	Very low	50.9	Low	188 Å²	188	131.4 Å²	131.4	82%	0.817	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	1	169.3	-83.4	-179.6	178.3	-177.7	0	115.5	C706 K708	C706-K710 VanDerWaalsContact O-CB 3.28Å; C706-K710 WeakPolarHBondContact O-CB 3.46Å; C706-K710 WeakPolarHBondContact O-CD 3.43Å; C706-K710 WeakPolarHBondContact O-CG 3.26Å; C706-K710 PolarHBondContact O-N 3.29Å; K708-K710 VanDerWaalsContact C-N 3.29Å; K708-K710 PolarHBondContact O-N 3.26Å
711	K	47.5	Very low	48.4	Very low	191 Å²	191	130.2 Å²	130.2	83%	0.83	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	1.4	170.3	-142.6	-179.8	-176.4	-177.8	0	114.1	K708 D709	K708-K711 PolarHBondContact O-N 2.98Å; D709-K711 PolarHBondContact O-N 2.95Å
712	L	46.1	Very low	46.1	Very low	147 Å²	147	133.8 Å²	133.8	77%	0.77	71%	0.71	S	S	*	*	S	Bend	trans	-149.9	43.8	-177.7	-151.9	85.7	0	0	0	114.3	D709	D709-L712 PolarHBondContact O-N 3.17Å
713	N	36.6	Very low	44	Very low	143 Å²	143	134.5 Å²	134.5	77%	0.765	72%	0.722	S	S	*	*			trans	-162.8	99	153	-100.9	-28.2	0	0	0	111.7	D709	D709-N713 PolarHBondContact O-N 3.17Å
714	L	36	Very low	41.9	Very low	145 Å²	145	138.4 Å²	138.4	76%	0.759	75%	0.745	S	S	*	*	S	Bend	trans	-141.1	124.1	159.2	-164.2	73.6	0	0	0	107.3
715	Y	34.6	Very low	39.8	Very low	209 Å²	209	142.4 Å²	142.4	82%	0.82	76%	0.763	S	S	*	*	S	Bend	trans	74.7	59.8	-177.4	-51.9	-68.1	0	0	0	118.6
716	T	28.7	Very low	38.1	Very low	125 Å²	125	139.8 Å²	139.8	77%	0.767	77%	0.77	S	S	*	*				-160.7	104.5	123.6	23.8	0	0	0	0	111.1
717	C	29.3	Very low	36.8	Very low	133 Å²	133	143.3 Å²	143.3	90%	0.899	79%	0.794	S	S	*	*			trans	177.3	129.6	131.4	-100.1	0	0	0	0	109.1
718	L	34	Very low	35.4	Very low	173 Å²	173	139.4 Å²	139.4	91%	0.906	80%	0.796	S	S	*	*			trans	-146	89.5	172.9	-130.4	178	0	0	0	106.2
719	L	30.7	Very low	34.4	Very low	169 Å²	169	138 Å²	138	89%	0.885	80%	0.804	S	S	*	*			trans	-169	142.4	176.8	-107	161.8	0	0	0	107.9
720	A	30.8	Very low	33.4	Very low	99 Å²	99	139.4 Å²	139.4	82%	0.818	82%	0.82	S	S	*	*			trans	58.8	145.2	-157.7	0	0	0	0	0	113.1
721	G	30.1	Very low	32.5	Very low	63 Å²	63	136.4 Å²	136.4	65%	0.649	82%	0.822	S	S	*	*			cis	122.3	122.7	19.1	0	0	0	0	0	106.7
722	D	30.7	Very low	31.7	Very low	162 Å²	162	132.9 Å²	132.9	87%	0.866	82%	0.821	S	S	*	*			cis	-143.8	172.2	26.8	-75.1	-42.9	0	0	0	116.3
723	C	28.6	Very low	31	Very low	115 Å²	115	136.2 Å²	136.2	78%	0.777	82%	0.824	S	S	*	*			trans	-5.5	127.5	161.8	-65	0	0	0	0	121
724	C	28.5	Very low	30.7	Very low	130 Å²	130	137.3 Å²	137.3	88%	0.878	82%	0.824	S	S	*	*				-149.3	139.6	126.5	-151.5	0	0	0	0	110.7
725	L	30.5	Very low	30.4	Very low	153 Å²	153	134.5 Å²	134.5	80%	0.801	82%	0.816	S	S	*	*			trans	-85	130.2	179.1	-81.7	74.4	0	0	0	111.4
726	C	28.8	Very low	30.3	Very low	119 Å²	119	136.1 Å²	136.1	80%	0.804	82%	0.821	S	S	*	*				170.2	142.4	119.1	-90.3	0	0	0	0	113.3
727	C	30.1	Very low	30.3	Very low	144 Å²	144	133.8 Å²	133.8	97%	0.973	82%	0.822	S	S	*	*			trans	62.3	142.9	176.8	-66.5	0	0	0	0	116.5
728	G	30.3	Very low	30.4	Very low	73 Å²	73	138.6 Å²	138.6	75%	0.753	82%	0.821	S	S	*	*			trans	-139	-157	-170.4	0	0	0	0	0	115.2
729	S	31.7	Very low	30.3	Very low	119 Å²	119	138.5 Å²	138.5	83%	0.832	81%	0.814	S	S	*	*			trans	74.5	62.4	-178.5	-61.7	0	0	0	0	117.4
730	C	29.1	Very low	30.3	Very low	127 Å²	127	137.9 Å²	137.9	86%	0.858	81%	0.806	S	S	*	*				33.1	132.8	112.4	-58.9	0	0	0	0	121.2
731	C	29.6	Very low	30.3	Very low	126 Å²	126	141.6 Å²	141.6	85%	0.851	80%	0.804	S	S	*	*			trans	-70.6	-170.5	150.6	-60.3	0	0	0	0	110.2
732	S	31.9	Very low	30.2	Very low	116 Å²	116	146.7 Å²	146.7	81%	0.811	81%	0.808	S	S	*	*			cis	-165.2	-169.1	22.1	70.3	0	0	0	0	112
733	R	30	Very low	30.1	Very low	218 Å²	218	146 Å²	146	82%	0.823	80%	0.804	S	S	*	*			trans	-140.5	116.7	175.1	-153.7	-176.6	-166.3	-170.1	6.2	112.5
734	Q	30.7	Very low	30.2	Very low	165 Å²	165	145.2 Å²	145.2	77%	0.771	80%	0.799	S	S	*	*			trans	63.3	129.8	145.1	-77	-177.5	-25	0	0	123.5
735	S	30.4	Very low	30.3	Very low	86 Å²	86	148.3 Å²	148.3	60%	0.601	80%	0.798	S	S	*	*				105.6	113.2	113.3	169.1	0	0	0	0	123.6
736	R	32	Very low	30.5	Very low	244 Å²	244	144.6 Å²	144.6	92%	0.921	79%	0.785	S	S	*	*			trans	68.6	143.3	137.1	-64.1	172.3	175.4	168.6	-3.1	120.9
737	G	27.8	Very low	30.5	Very low	76 Å²	76	146.1 Å²	146.1	78%	0.784	79%	0.785	S	S	*	*			trans	-159.2	-28.7	174	0	0	0	0	0	126
738	R	32.4	Very low	30.7	Very low	233 Å²	233	144.5 Å²	144.5	88%	0.879	77%	0.765	S	S	*	*			trans	49	133.5	168.4	-104.6	-178.3	174.6	175.1	-0.5	122.4
739	K	32.1	Very low	30.7	Very low	172 Å²	172	148.8 Å²	148.8	75%	0.748	77%	0.768	S	S	*	*			trans	94.4	106.1	140.9	-72.7	179.8	172.3	-177.1	0	124
740	Q	29.7	Very low	30.6	Very low	156 Å²	156	150 Å²	150	73%	0.729	76%	0.764	S	S	*	*				71.2	146.1	111.4	-120.1	-176.1	29.7	0	0	124.1
741	K	30.9	Very low	30.7	Very low	177 Å²	177	149.8 Å²	149.8	77%	0.77	76%	0.758	S	S	*	*			trans	80.6	148.9	157.4	-70.9	176.9	-174.9	178.2	0	118.5
742	K	28.8	Very low	30.8	Very low	170 Å²	170	151.3 Å²	151.3	74%	0.739	75%	0.753	S	S	*	*			cis	-174.6	144.1	-22.9	-142.4	-172.4	172.4	-167.7	0	110.4
743	L	28.3	Very low	30.9	Very low	148 Å²	148	150.2 Å²	150.2	78%	0.775	75%	0.746	S	S	*	*			trans	66	157.9	157.6	-72.9	162.4	0	0	0	117.8
744	S	30.1	Very low	31.1	Very low	98 Å²	98	145.4 Å²	145.4	69%	0.685	74%	0.74	S	S	*	*			cis	-166	151.8	-4.4	163.9	0	0	0	0	112.6
745	K	30.7	Very low	31.2	Very low	195 Å²	195	144 Å²	144	85%	0.848	74%	0.739	S	S	*	*			trans	9.7	157.5	148.9	-92.4	-178.7	178.1	-176.9	0	122
746	S	35.2	Very low	31.1	Very low	75 Å²	75	145 Å²	145	52%	0.524	74%	0.741	S	S	.	*			cis	-170.2	161.9	12.7	39.9	0	0	0	0	113.1
747	D	28.3	Very low	31.1	Very low	150 Å²	150	138.5 Å²	138.5	80%	0.802	73%	0.728	S	S	*	*				-159.5	123.5	127.5	-86.6	-31.4	0	0	0	106.5
748	I	34.3	Very low	31.2	Very low	110 Å²	110	141.8 Å²	141.8	56%	0.564	73%	0.733	S	S	*	*			cis	80.2	112	46.7	-58.4	167.5	0	0	0	110
749	M	30.1	Very low	31.1	Very low	164 Å²	164	133.9 Å²	133.9	81%	0.808	72%	0.724	S	S	*	*				-118	-119.5	81	-75.1	-70.8	170.3	0	0	117.2
750	L	30.4	Very low	31	Very low	145 Å²	145	133.1 Å²	133.1	76%	0.759	73%	0.733	S	S	*	*			trans	-154.9	170.8	-138.6	-64.8	178.4	0	0	0	109.7
751	V	31.6	Very low	31.1	Very low	121 Å²	121	128.6 Å²	128.6	73%	0.733	73%	0.728	S	S	*	*			cis	-156.6	156.5	8.5	95	0	0	0	0	107.1
752	Q	31	Very low	31.9	Very low	158 Å²	158	126.4 Å²	126.4	74%	0.738	73%	0.732	S	S	*	*			cis	-146.4	-51.8	1.4	-169.3	-172.7	99	0	0	114.9
753	S	34.1	Very low	32	Very low	94 Å²	94	125.7 Å²	125.7	66%	0.657	74%	0.742	S	S	*	*				-132.9	159.9	-123.8	35.9	0	0	0	0	115.1
754	T	35	Very low	32.1	Very low	116 Å²	116	122.1 Å²	122.1	71%	0.712	74%	0.741	S	S	*	*			cis	-167.6	166.2	-18.4	30.9	0	0	0	0	106.5
755	N	31.4	Very low	31.9	Very low	137 Å²	137	126.2 Å²	126.2	73%	0.733	75%	0.749	S	S	*	*			cis	-153.6	-171.8	12	-146.6	-6.5	0	0	0	112.4
756	V	29.8	Very low	31.7	Very low	107 Å²	107	123.1 Å²	123.1	65%	0.648	75%	0.746	S	S	*	*			trans	13.4	141.6	143.7	167.4	0	0	0	0	120
757	T	31.4	Very low	32.9	Very low	107 Å²	107	124.7 Å²	124.7	66%	0.656	76%	0.755	S	S	*	*			cis	167.8	161	-45.6	39	0	0	0	0	109.4
758	T	30.5	Very low	32.8	Very low	145 Å²	145	123 Å²	123	89%	0.89	75%	0.749	S	S	*	*			trans	77.1	144.4	171	76.9	0	0	0	0	116.3
759	G	28.5	Very low	32.5	Very low	66 Å²	66	126 Å²	126	68%	0.68	76%	0.761	S	S	*	*			cis	167.5	148.1	-13.1	0	0	0	0	0	115.8
760	V	32	Very low	32.3	Very low	156 Å²	156	126.5 Å²	126.5	95%	0.945	76%	0.762	S	S	*	*			trans	69.1	141.8	164.9	-168.7	0	0	0	0	116.7
761	G	30.8	Very low	32.3	Very low	61 Å²	61	125.2 Å²	125.2	63%	0.629	76%	0.764	S	S	*	*			trans	-137.1	-176.9	167.3	0	0	0	0	0	110.6
762	P	48	Very low	32.2	Very low	131 Å²	131	122.5 Å²	122.5	85%	0.851	76%	0.761	S	S	*	*			trans	-124.4	164.8	-179.4	39.4	-27	0	0	0	115.7
763	V	30.8	Very low	32.2	Very low	155 Å²	155	122.6 Å²	122.6	94%	0.939	77%	0.772	S	S	*	*			trans	-125.5	132.7	156.8	175	0	0	0	0	106.2
764	G	29.6	Very low	31.9	Very low	73 Å²	73	121.2 Å²	121.2	75%	0.753	77%	0.772	S	S	*	*			trans	-171.4	148.3	-177.3	0	0	0	0	0	113.1
765	Q	26.9	Very low	31.6	Very low	185 Å²	185	121.4 Å²	121.4	86%	0.864	78%	0.779	S	S	*	*			trans	-107.1	141.3	-163.2	-63.7	161.8	-63.2	0	0	113.5
766	V	26.2	Very low	31.6	Very low	130 Å²	130	122.1 Å²	122.1	79%	0.788	79%	0.788	S	S	*	*				36.7	140.9	120.9	-167.4	0	0	0	0	118.7
767	P	59.8	Low	31.6	Very low	108 Å²	108	120.8 Å²	120.8	70%	0.701	80%	0.796	S	S	*	*			cis	-133.1	-151.6	-40.5	42	-22	0	0	0	110.7
768	V	26.1	Very low	31.5	Very low	113 Å²	113	119.8 Å²	119.8	69%	0.685	81%	0.807	S	S	*	*			trans	153.7	129.7	134.8	158	0	0	0	0	114.6
769	E	28.3	Very low	31.3	Very low	175 Å²	175	116.6 Å²	116.6	82%	0.818	80%	0.803	S	S	*	*			trans	54.9	163	155.5	-74.1	163.5	177.1	0	0	120.7
770	E	26.9	Very low	31.3	Very low	174 Å²	174	124.4 Å²	124.4	81%	0.813	82%	0.818	S	S	*	*			cis	-142.6	170.5	15.8	-151	178.2	172.1	0	0	115
771	S	29.8	Very low	31	Very low	117 Å²	117	120.8 Å²	120.8	82%	0.818	81%	0.812	S	S	*	*			trans	-52.9	167.9	175.6	-49.7	0	0	0	0	116.6
772	G	28.7	Very low	30.9	Very low	64 Å²	64	123 Å²	123	66%	0.66	82%	0.818	S	S	*	*			cis	156.6	179.2	-1.5	0	0	0	0	0	112.5
773	V	31	Very low	30	Very low	161 Å²	161	124.3 Å²	124.3	98%	0.976	81%	0.812	S	S	*	*			trans	69.9	143.2	176.2	-166.3	0	0	0	0	115.2
774	G	29	Very low	30	Very low	64 Å²	64	124.2 Å²	124.2	66%	0.66	80%	0.801	S	S	*	*			cis	167.2	162.3	-10.3	0	0	0	0	0	113.5
775	S	29.1	Very low	30	Very low	121 Å²	121	129.1 Å²	129.1	85%	0.846	80%	0.804	S	S	*	*			trans	78.3	109.3	169	-64.6	0	0	0	0	122.3
776	V	31.4	Very low	30.3	Very low	152 Å²	152	127 Å²	127	92%	0.921	79%	0.794	S	S	*	*			trans	39.1	117.4	131	-168.2	0	0	0	0	120.7
777	G	29.6	Very low	30.5	Very low	79 Å²	79	126.8 Å²	126.8	81%	0.814	79%	0.789	S	S	*	*			trans	175.5	126	157.1	0	0	0	0	0	111.5
778	G	28	Very low	29.3	Very low	86 Å²	86	131 Å²	131	89%	0.887	80%	0.799	S	S	*	*			trans	-107.8	146.2	-177.8	0	0	0	0	0	113.3
779	G	27.8	Very low	29.6	Very low	78 Å²	78	131.8 Å²	131.8	80%	0.804	80%	0.8	S	S	*	*			trans	178.5	145.9	175.4	0	0	0	0	0	112.6
780	F	27.5	Very low	29.7	Very low	230 Å²	230	128.4 Å²	128.4	100%	1.009	80%	0.795	S	S	*	*			trans	-69.9	142.7	175.3	-83.8	-116.1	0	0	0	111.3
781	G	26.1	Very low	30.1	Very low	79 Å²	79	128.6 Å²	128.6	81%	0.814	79%	0.79	S	S	*	*			trans	178.1	118.3	170.2	0	0	0	0	0	113.2
782	S	28.6	Very low	30.2	Very low	108 Å²	108	128.9 Å²	128.9	76%	0.755	79%	0.79	S	S	*	*			trans	-76.4	141.4	175.4	-179.7	0	0	0	0	111.7
783	H	28.1	Very low	30.7	Very low	159 Å²	159	135.2 Å²	135.2	74%	0.736	80%	0.796	S	S	*	*				-179.7	143.7	124.1	-101.9	-76.6	0	0	0	114
784	H	30.7	Very low	31.2	Very low	152 Å²	152	135.7 Å²	135.7	70%	0.704	79%	0.787	S	S	*	*			trans	38.8	124.1	154.3	-72.7	-28	0	0	0	123.6
785	H	30.1	Very low	32.1	Very low	176 Å²	176	136.2 Å²	136.2	82%	0.815	78%	0.778	S	S	*	*				-124.8	130.6	103.4	-87.1	-78.9	0	0	0	107.1
786	Q	32.6	Very low	33.5	Very low	140 Å²	140	133.3 Å²	133.3	65%	0.654	76%	0.756	S	S	*	*				91.8	123	53.5	-102.3	-172.7	-12.3	0	0	115.1
787	N	31.4	Very low	35.1	Very low	127 Å²	127	131 Å²	131	68%	0.679	74%	0.738	S	S	*	*			trans	66.9	91.8	157.4	-60.4	2.8	0	0	0	120
788	Q	33.9	Very low	37.1	Very low	196 Å²	196	128.6 Å²	128.6	92%	0.916	71%	0.708	S	S	*	*				-126.4	145.5	117.2	-69.8	-167	-3.5	0	0	109
789	N	33.5	Very low	38.9	Very low	130 Å²	130	130 Å²	130	70%	0.695	70%	0.701	S	S	*	*			trans	-89.4	125.1	-174.8	-68.2	-7.3	0	0	0	111.2
790	S	30.4	Very low	40.6	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	69%	0.69	S	S	*	*			trans	-104	128.3	164.1	57.5	0	0	0	0	110.7
791	Y	35.4	Very low	42.6	Very low	179 Å²	179	122.2 Å²	122.2	70%	0.702	65%	0.65	S	S	*	*			trans	-91.1	106.1	172.1	-68.6	-87	0	0	0	109.8	Y793	Y791-Y793 PolarHBondContact O-N 3.15Å
792	C	31.6	Very low	44.3	Very low	123 Å²	123	122.9 Å²	122.9	83%	0.831	65%	0.647	S	S	*	*			trans	-79.9	114.5	172.1	-66.8	0	0	0	0	110.3
793	Y	38	Very low	45.5	Very low	197 Å²	197	126.7 Å²	126.7	77%	0.773	65%	0.65	S	S	*	*			trans	-95.3	113.1	168.4	-69.6	-84.4	0	0	0	109.6	Y791	Y791-Y793 PolarHBondContact O-N 3.15Å
794	Q	41.5	Very low	47.2	Very low	171 Å²	171	122.3 Å²	122.3	80%	0.799	64%	0.635	S	S	*	*			trans	-87.9	128.9	170.5	-168	170.7	2.7	0	0	109.2	C812	Q794-C812 PolarHBondContact O-SG 3.42Å; Q794-C812 VanDerWaalsContact O-SG 3.39Å
795	V	48.2	Very low	48.4	Very low	75 Å²	75	123.7 Å²	123.7	46%	0.455	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.1	138.8	-173.1	-161.6	0	0	0	0	109.3	L809 K810 C812	V795-L809 HydrophobicContact CB-CD2 4.47Å; V795-L809 HydrophobicContact CG1-CB 3.8Å; V795-L809 HydrophobicContact CG1-CD2 3.98Å; V795-L809 HydrophobicContact CG1-CG 4.34Å; V795-K810 WeakPolarHBondContact CG1-O 3.38Å; V795-C812 VanDerWaalsContact C-SG 3.53Å
796	C	59.6	Low	49.3	Very low	59 Å²	59	120.8 Å²	120.8	40%	0.399	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.3	133.1	-172.4	-68.8	0	0	0	0	109.7	K810 C812	C796-K810 PolarHBondContact N-O 3.48Å; C796-K810 PolarHBondContact O-N 2.73Å; C796-C812 HydrophobicContact CB-CB 4.38Å; C796-C812 WeakPolarHBondContact CB-SG 3.48Å; C796-C812 PolarHBondContact N-SG 2.88Å; C796-C812 WeakPolarHBondContact SG-CB 3.31Å; C796-C812 CovalentContact SG-SG 2.05Å; C796-C812 PolarHBondContact SG-SG 3.13Å
797	L	64.1	Low	50.5	Low	104 Å²	104	121.6 Å²	121.6	55%	0.545	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.6	143.7	169.5	-74.6	166.7	0	0	0	110.4	M807 F808 L809	L797-M807 HydrophobicContact CD2-CB 3.89Å; L797-M807 HydrophobicContact CD2-CG 3.92Å; L797-M807 HydrophobicContact CD2-SD 4.26Å; L797-F808 WeakPolarHBondContact CA-O 3.4Å; L797-L809 HydrophobicContact CD2-CD2 3.73Å; L797-L809 HydrophobicContact CD2-CG 4.39Å; L797-L809 HydrophobicContact CG-CD2 4.12Å
798	T	72.6	Confident	52	Low	29 Å²	29	120.2 Å²	120.2	18%	0.178	63%	0.631	C	S	.	*			trans	-80.4	155.6	174.2	78.6	0	0	0	0	111.9	E800 S801 F808	T798-E800 VanDerWaalsContact CB-OE2 3.31Å; T798-E800 WeakPolarHBondContact CB-OE2 3.34Å; T798-E800 PolarHBondContact O-N 2.84Å; T798-E800 VanDerWaalsContact O-N 3.16Å; T798-E800 PolarHBondContact OG1-N 3.02Å; T798-E800 PolarHBondContact OG1-OE2 3.27Å; T798-S801 VanDerWaalsContact O-CB 3.27Å; T798-S801 WeakPolarHBondContact O-CB 3.49Å; T798-S801 PolarHBondContact O-N 3.36Å; T798-S801 PolarHBondContact O-OG 2.89Å; T798-S801 PolarHBondContact OG1-OG 3.03Å; T798-F808 HydrophobicContact CG2-CB 4.04Å; T798-F808 PolarHBondContact N-O 3Å
799	P	64.6	Low	53.4	Low	114 Å²	114	116.3 Å²	116.3	74%	0.74	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-60.7	-18.6	172.7	-23.9	35.2	0	0	0	114.7	S801	P799-S801 VanDerWaalsContact C-N 3.34Å
800	E	64.8	Low	54.3	Low	123 Å²	123	116.4 Å²	116.4	58%	0.575	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-72.3	-28.1	173.3	-62.9	117.6	162.1	0	0	112.4	T798 A802 K803 T804	T798-E800 VanDerWaalsContact CB-OE2 3.31Å; T798-E800 WeakPolarHBondContact CB-OE2 3.34Å; T798-E800 PolarHBondContact O-N 2.84Å; T798-E800 VanDerWaalsContact O-N 3.16Å; T798-E800 PolarHBondContact OG1-N 3.02Å; T798-E800 PolarHBondContact OG1-OE2 3.27Å; E800-A802 PolarHBondContact O-N 3.01Å; E800-K803 PolarHBondContact O-N 3.24Å; E800-T804 PolarHBondContact O-OG1 3.43Å
801	S	69.7	Low	55	Low	23 Å²	23	116.3 Å²	116.3	16%	0.161	61%	0.607	C	S	.	*	G	3₁₀ helix	trans	-63.3	-10.2	176.2	-50	0	0	0	0	113.4	T798 P799 F808	T798-S801 VanDerWaalsContact O-CB 3.27Å; T798-S801 WeakPolarHBondContact O-CB 3.49Å; T798-S801 PolarHBondContact O-N 3.36Å; T798-S801 PolarHBondContact O-OG 2.89Å; T798-S801 PolarHBondContact OG1-OG 3.03Å; P799-S801 VanDerWaalsContact C-N 3.34Å; S801-F808 PolarHBondContact OG-N 2.77Å; S801-F808 PolarHBondContact OG-O 2.85Å
802	A	60.1	Low	55.7	Low	92 Å²	92	110.3 Å²	110.3	76%	0.76	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-92	7.8	172.8	0	0	0	0	0	113.4	E800	E800-A802 PolarHBondContact O-N 3.01Å
803	K	55.5	Low	56.2	Low	188 Å²	188	109.4 Å²	109.4	82%	0.817	59%	0.586	S	S	*	*	S	Bend	trans	-131.9	2.2	-177.4	-63.1	-175.5	178.3	179.9	0	114.2	E800	E800-K803 PolarHBondContact O-N 3.24Å
804	T	63.5	Low	56.2	Low	68 Å²	68	106 Å²	106	42%	0.417	59%	0.588	S	S	.	*	S	Bend	trans	-149.1	148.6	-176.9	53.2	0	0	0	0	109.7	E800 L806	E800-T804 PolarHBondContact O-OG1 3.43Å; T804-L806 PolarHBondContact O-N 2.9Å; T804-L806 PolarHBondContact OG1-O 2.59Å
805	D	55.9	Low	55.8	Low	181 Å²	181	103.5 Å²	103.5	97%	0.968	59%	0.589	S	S	*	*	S	Bend	trans	-71.5	18	175.3	-51.9	-55.2	0	0	0	114
806	L	47.9	Very low	55	Low	114 Å²	114	111.3 Å²	111.3	60%	0.597	61%	0.611	S	S	*	*	S	Bend	trans	-117	128.3	179.5	-64.3	176.1	0	0	0	109.8	T804 F808	T804-L806 PolarHBondContact O-N 2.9Å; T804-L806 PolarHBondContact OG1-O 2.59Å; L806-F808 HydrophobicContact CB-CD2 4.45Å; L806-F808 HydrophobicContact CB-CE2 3.68Å; L806-F808 HydrophobicContact CB-CZ 3.87Å; L806-F808 HydrophobicContact CD1-CZ 4.11Å; L806-F808 WeakPolarHBondContact O-CD2 3.18Å
807	M	58.1	Low	53.7	Low	158 Å²	158	113.4 Å²	113.4	78%	0.778	63%	0.626	S	S	*	*			trans	-87.2	115.6	176.1	-77	-174.8	-89.8	0	0	111.2	L797	L797-M807 HydrophobicContact CD2-CB 3.89Å; L797-M807 HydrophobicContact CD2-CG 3.92Å; L797-M807 HydrophobicContact CD2-SD 4.26Å
808	F	63.3	Low	52.1	Low	97 Å²	97	115.9 Å²	115.9	43%	0.425	64%	0.64	S	S	.	*			trans	-102.5	128.9	174.5	-61.4	-82	0	0	0	110.2	L797 T798 S801 L806	L797-F808 WeakPolarHBondContact CA-O 3.4Å; T798-F808 HydrophobicContact CG2-CB 4.04Å; T798-F808 PolarHBondContact N-O 3Å; S801-F808 PolarHBondContact OG-N 2.77Å; S801-F808 PolarHBondContact OG-O 2.85Å; L806-F808 HydrophobicContact CB-CD2 4.45Å; L806-F808 HydrophobicContact CB-CE2 3.68Å; L806-F808 HydrophobicContact CB-CZ 3.87Å; L806-F808 HydrophobicContact CD1-CZ 4.11Å; L806-F808 WeakPolarHBondContact O-CD2 3.18Å
809	L	62.8	Low	50.2	Low	115 Å²	115	122.3 Å²	122.3	60%	0.602	67%	0.673	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119	138.8	-170.4	-74.2	172.4	0	0	0	111.9	V795 L797	V795-L809 HydrophobicContact CB-CD2 4.47Å; V795-L809 HydrophobicContact CG1-CB 3.8Å; V795-L809 HydrophobicContact CG1-CD2 3.98Å; V795-L809 HydrophobicContact CG1-CG 4.34Å; L797-L809 HydrophobicContact CD2-CD2 3.73Å; L797-L809 HydrophobicContact CD2-CG 4.39Å; L797-L809 HydrophobicContact CG-CD2 4.12Å
810	K	53.5	Low	48.6	Very low	131 Å²	131	120.7 Å²	120.7	57%	0.57	67%	0.669	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-132.2	138.2	176.8	-175.4	-179.3	175.2	175.9	0	111.2	V795 C796 C812	V795-K810 WeakPolarHBondContact CG1-O 3.38Å; C796-K810 PolarHBondContact N-O 3.48Å; C796-K810 PolarHBondContact O-N 2.73Å; K810-C812 PolarHBondContact O-N 3.23Å
811	P	45.5	Very low	47	Very low	102 Å²	102	121.8 Å²	121.8	66%	0.662	68%	0.679	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-61	128.1	170	25.3	-34.4	0	0	0	110.9	S813	P811-S813 PolarHBondContact O-N 2.82Å
812	C	48.5	Very low	45.2	Very low	52 Å²	52	128.4 Å²	128.4	35%	0.351	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-76.5	118.3	-178.8	-39.8	0	0	0	0	109.8	Q794 V795 C796 K810	Q794-C812 PolarHBondContact O-SG 3.42Å; Q794-C812 VanDerWaalsContact O-SG 3.39Å; V795-C812 VanDerWaalsContact C-SG 3.53Å; C796-C812 HydrophobicContact CB-CB 4.38Å; C796-C812 WeakPolarHBondContact CB-SG 3.48Å; C796-C812 PolarHBondContact N-SG 2.88Å; C796-C812 WeakPolarHBondContact SG-CB 3.31Å; C796-C812 CovalentContact SG-SG 2.05Å; C796-C812 PolarHBondContact SG-SG 3.13Å; K810-C812 PolarHBondContact O-N 3.23Å
813	S	42.3	Very low	43.7	Very low	104 Å²	104	130 Å²	130	73%	0.727	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-70.6	136.6	177.5	-56	0	0	0	0	111.4	P811 S815	P811-S813 PolarHBondContact O-N 2.82Å; S813-S815 PolarHBondContact O-N 3.44Å
814	P	37.8	Very low	42.5	Very low	127 Å²	127	128.4 Å²	128.4	83%	0.825	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-69.9	121.2	-178.1	27.5	-34.1	0	0	0	111.7
815	S	33	Very low	41.7	Very low	118 Å²	118	130.1 Å²	130.1	83%	0.825	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-72.5	129	171.2	39.9	0	0	0	0	110.7	S813 S817	S813-S815 PolarHBondContact O-N 3.44Å; S815-S817 PolarHBondContact O-N 2.8Å
816	R	31.8	Very low	40.2	Very low	239 Å²	239	127.7 Å²	127.7	90%	0.902	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-72.7	117.2	169.9	-99.8	-180	165.1	169.1	-5.6	109.8
817	S	32.5	Very low	39.3	Very low	102 Å²	102	126.2 Å²	126.2	71%	0.713	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-67.2	132.1	156.9	54	0	0	0	0	109.8	S815	S815-S817 PolarHBondContact O-N 2.8Å
818	N	31.6	Very low	38	Very low	157 Å²	157	123.2 Å²	123.2	84%	0.84	73%	0.729	S	S	*	*			trans	-147.6	112.1	159.9	-104.5	10.3	0	0	0	107.2
819	D	31.5	Very low	36.4	Very low	164 Å²	164	126.8 Å²	126.8	88%	0.877	75%	0.75	S	S	*	*			trans	-82.8	175.1	166.3	-83.7	-57.7	0	0	0	111
820	A	31.2	Very low	34.8	Very low	80 Å²	80	126.9 Å²	126.9	66%	0.661	76%	0.755	S	S	*	*			trans	74.5	99.2	166.7	0	0	0	0	0	118.4
821	D	30.5	Very low	33.8	Very low	145 Å²	145	127 Å²	127	78%	0.775	77%	0.768	S	S	*	*				87.2	142.4	122.6	-66.2	-31.2	0	0	0	123.9
822	H	32.3	Very low	33.1	Very low	163 Å²	163	125 Å²	125	76%	0.755	76%	0.764	S	S	*	*			trans	70.3	104.8	158.2	-71.5	-58.4	0	0	0	122
823	T	30	Very low	32.3	Very low	125 Å²	125	133 Å²	133	77%	0.767	79%	0.789	S	S	*	*			trans	73.2	108.8	131.9	54.1	0	0	0	0	121.2
824	N	28.9	Very low	32	Very low	154 Å²	154	132.3 Å²	132.3	82%	0.824	78%	0.784	S	S	*	*			trans	-25.1	160.7	133.3	-105.1	-16.7	0	0	0	115.9
825	P	47.2	Very low	31.8	Very low	104 Å²	104	132.4 Å²	132.4	68%	0.675	78%	0.778	S	S	*	*			cis	-141.8	176.5	14.6	41	-22.2	0	0	0	117.6
826	C	24.3	Very low	31.8	Very low	131 Å²	131	135.6 Å²	135.6	89%	0.885	78%	0.779	S	S	*	*			trans	50.8	127.6	146.4	-68.5	0	0	0	0	122.1
827	G	28.6	Very low	31.7	Very low	83 Å²	83	131.2 Å²	131.2	86%	0.856	77%	0.769	S	S	*	*			trans	-175.6	66.2	167.4	0	0	0	0	0	114.6
828	A	30.2	Very low	32.6	Very low	95 Å²	95	132.3 Å²	132.3	79%	0.785	77%	0.774	S	S	*	*			trans	-89.1	138.5	179.1	0	0	0	0	0	112.7
829	I	29.9	Very low	32.7	Very low	172 Å²	172	130.2 Å²	130.2	88%	0.882	76%	0.763	S	S	*	*			trans	-132.4	148.3	162.7	-64.3	-175.8	0	0	0	108.1
830	V	29.3	Very low	32.7	Very low	116 Å²	116	129.9 Å²	129.9	70%	0.703	76%	0.759	S	S	*	*			trans	-133.6	169.4	-162.5	-171.9	0	0	0	0	110.1
831	T	32.4	Very low	32.8	Very low	135 Å²	135	133.1 Å²	133.1	83%	0.828	76%	0.764	S	S	*	*			trans	85.2	143.5	169	73.9	0	0	0	0	117
832	G	31.8	Very low	33.1	Very low	58 Å²	58	130.4 Å²	130.4	60%	0.598	76%	0.757	S	S	*	*			cis	172.3	-172.6	-5.6	0	0	0	0	0	114.9
833	Y	32.1	Very low	33	Very low	222 Å²	222	129.9 Å²	129.9	87%	0.871	76%	0.759	S	S	*	*			trans	70.3	118.9	179.5	-57.6	-87.5	0	0	0	114.1
834	S	35.5	Very low	33.1	Very low	88 Å²	88	127.4 Å²	127.4	62%	0.615	76%	0.758	S	S	*	*			cis	83.8	146.8	45.9	92.6	0	0	0	0	112.9
835	D	33.8	Very low	33.3	Very low	130 Å²	130	125 Å²	125	70%	0.695	75%	0.754	S	S	*	*			cis	-157.2	171.8	31.5	-127.5	-58.1	0	0	0	116.2
836	Q	32.5	Very low	32.6	Very low	184 Å²	184	126.8 Å²	126.8	86%	0.86	76%	0.756	S	S	*	*			trans	81.1	159.5	157	-72.2	170.1	26.6	0	0	123.3
837	Q	29.6	Very low	33	Very low	147 Å²	147	128.3 Å²	128.3	69%	0.687	76%	0.755	S	S	*	*			trans	-146.7	178.1	-151	-139	176.5	-26.6	0	0	108.2	D839	Q837-D839 VanDerWaalsContact NE2-CG 3.26Å; Q837-D839 PolarHBondContact NE2-OD1 3.13Å; Q837-D839 PolarHBondContact NE2-OD2 3.48Å; Q837-D839 VanDerWaalsContact NE2-OD2 3.13Å
838	P	52	Low	33	Very low	126 Å²	126	129.6 Å²	129.6	82%	0.818	75%	0.75	S	S	*	*				-145.3	175.8	62.1	36.7	-14.6	0	0	0	117
839	D	32.8	Very low	33.1	Very low	112 Å²	112	129.7 Å²	129.7	60%	0.599	75%	0.745	S	S	*	*			trans	-84	179.2	-168.4	-47.5	-70.9	0	0	0	116.8	Q837	Q837-D839 VanDerWaalsContact NE2-CG 3.26Å; Q837-D839 PolarHBondContact NE2-OD1 3.13Å; Q837-D839 PolarHBondContact NE2-OD2 3.48Å; Q837-D839 VanDerWaalsContact NE2-OD2 3.13Å
840	I	32.2	Very low	33.2	Very low	157 Å²	157	129.2 Å²	129.2	81%	0.805	74%	0.74	S	S	*	*				-159.6	112.4	117.4	-99.6	153.4	0	0	0	112.9
841	I	32.7	Very low	33.3	Very low	148 Å²	148	129.2 Å²	129.2	76%	0.759	74%	0.74	S	S	*	*			trans	41.7	142.9	132.2	-52.6	173.1	0	0	0	120.5
842	S	36.2	Very low	33.2	Very low	89 Å²	89	131 Å²	131	62%	0.622	74%	0.736	S	S	*	*			cis	175.8	173.2	-22.3	-171.1	0	0	0	0	110.2
843	N	30.9	Very low	33.4	Very low	151 Å²	151	135.7 Å²	135.7	81%	0.807	74%	0.742	S	S	*	*			trans	80	144.4	162.5	-45.3	-27	0	0	0	116.4
844	G	32.2	Very low	33.4	Very low	73 Å²	73	131.7 Å²	131.7	75%	0.753	73%	0.732	S	S	*	*			cis	111.2	142.7	2.8	0	0	0	0	0	112.8
845	S	33.9	Very low	33.2	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	74%	0.741	S	S	*	*			cis	-174.9	-168.8	-0.1	54.2	0	0	0	0	110.4
846	I	32.3	Very low	33.1	Very low	143 Å²	143	136 Å²	136	73%	0.733	75%	0.745	S	S	*	*			trans	77.4	104.6	162.6	-61.9	160.5	0	0	0	115
847	L	31	Very low	33.3	Very low	162 Å²	162	136.1 Å²	136.1	85%	0.848	75%	0.745	S	S	*	*				69.8	138.7	86.7	-65.8	161.7	0	0	0	113.7
848	S	30.2	Very low	33.4	Very low	110 Å²	110	136.8 Å²	136.8	77%	0.769	75%	0.752	S	S	*	*			cis	-150.7	-176.9	45.6	61.4	0	0	0	0	116.4
849	S	30.9	Very low	32.4	Very low	97 Å²	97	134.9 Å²	134.9	68%	0.678	74%	0.742	S	S	*	*			trans	-70.9	-179.7	171.3	56.7	0	0	0	0	113
850	E	32.2	Very low	32.3	Very low	163 Å²	163	139.3 Å²	139.3	76%	0.762	75%	0.752	S	S	*	*			cis	-168.2	140.9	18.3	-148.1	177	169.7	0	0	108.4
851	T	32	Very low	32.4	Very low	116 Å²	116	138.8 Å²	138.8	71%	0.712	75%	0.75	S	S	*	*				168	147.8	84.6	27.6	0	0	0	0	113
852	K	31.1	Very low	32.4	Very low	172 Å²	172	137.8 Å²	137.8	75%	0.748	75%	0.75	S	S	*	*			trans	32	128.2	146	-68.5	-174.1	177.6	178.9	0	125.4
853	H	34.5	Very low	32.1	Very low	157 Å²	157	140.5 Å²	140.5	73%	0.727	76%	0.758	S	S	*	*			trans	75.7	155	132.4	-67.1	6	0	0	0	120.3
854	Q	32.8	Very low	32.1	Very low	138 Å²	138	144.1 Å²	144.1	65%	0.645	76%	0.76	S	S	*	*			cis	-172.7	153.6	-34.8	-156.7	-172	51.9	0	0	108.7
855	R	31.2	Very low	33	Very low	216 Å²	216	145.9 Å²	145.9	82%	0.815	76%	0.758	S	S	*	*			trans	68.2	160	169.2	-74.1	-179	154.5	87.4	-3.3	116.3
856	A	32.6	Very low	32.8	Very low	93 Å²	93	151.6 Å²	151.6	77%	0.769	76%	0.764	S	S	*	*			cis	-164	174.9	-23.9	0	0	0	0	0	109.7
857	E	35.2	Very low	32.7	Very low	185 Å²	185	155.5 Å²	155.5	86%	0.864	77%	0.77	S	S	*	*			trans	-86.3	-169.6	-174.6	-52.3	177.1	116.5	0	0	115.1
858	L	32	Very low	32.6	Very low	162 Å²	162	153.5 Å²	153.5	85%	0.848	76%	0.764	S	S	*	*			trans	96.1	140.6	170.7	-56.9	160	0	0	0	115.7
859	S	30.9	Very low	32.5	Very low	85 Å²	85	155 Å²	155	59%	0.594	76%	0.763	S	S	*	*			cis	-177.1	163.5	-12.9	51.4	0	0	0	0	113.3
860	Y	32.1	Very low	32.5	Very low	205 Å²	205	155.1 Å²	155.1	80%	0.804	76%	0.764	S	S	*	*			trans	76.1	115.1	152	-71.3	-61.6	0	0	0	124.1
861	L	33	Very low	32.5	Very low	146 Å²	146	152.6 Å²	152.6	76%	0.764	76%	0.764	S	S	*	*				52.3	139.9	125.9	-73.8	175	0	0	0	125.4
862	V	33.1	Very low	32.7	Very low	128 Å²	128	151.2 Å²	151.2	78%	0.776	77%	0.765	S	S	*	*			trans	73.7	140.7	147.3	168.6	0	0	0	0	116.4
863	D	29.6	Very low	32.7	Very low	146 Å²	146	152.1 Å²	152.1	78%	0.781	77%	0.769	S	S	*	*			cis	-144.4	-176.5	6.5	-147.5	-24.6	0	0	0	113.4
864	R	31.6	Very low	32.8	Very low	226 Å²	226	151.4 Å²	151.4	85%	0.853	77%	0.766	S	S	*	*			trans	-79.7	-177.4	162.5	-76.6	-177.7	166.8	-173.3	-2.1	111
865	P	50.3	Low	33	Very low	110 Å²	110	152.2 Å²	152.2	71%	0.714	77%	0.77	S	S	*	*			cis	-146	-167.8	13.4	44.6	-23.8	0	0	0	118.3
866	R	30.5	Very low	33	Very low	223 Å²	223	146.2 Å²	146.2	84%	0.842	77%	0.767	S	S	*	*			trans	92.1	110	149.7	-79.6	176.8	179.2	178	1.4	123
867	R	29.5	Very low	33	Very low	225 Å²	225	148.3 Å²	148.3	85%	0.849	77%	0.765	S	S	*	*				82.2	108.4	121.5	-85.7	-163.5	173.9	-175	-0.8	123.6
868	V	29.8	Very low	32.9	Very low	120 Å²	120	145.9 Å²	145.9	73%	0.727	76%	0.757	S	S	*	*			trans	63.9	133.7	136.7	-98.5	0	0	0	0	125.1
869	N	27.5	Very low	33	Very low	141 Å²	141	144.7 Å²	144.7	75%	0.754	76%	0.756	S	S	*	*			trans	95.6	116.6	134.4	-88.7	9.5	0	0	0	123.6
870	S	32	Very low	33	Very low	100 Å²	100	145 Å²	145	70%	0.699	76%	0.758	S	S	*	*				78.4	145.3	129.9	63.3	0	0	0	0	122.4
871	S	32	Very low	33.2	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	75%	0.752	S	S	*	*			trans	61.6	124.9	171.7	38.4	0	0	0	0	116.9
872	A	34.9	Very low	33.2	Very low	88 Å²	88	142 Å²	142	73%	0.727	76%	0.755	S	S	*	*			cis	97.2	158.5	36.2	0	0	0	0	0	113.7
873	F	32.6	Very low	33.2	Very low	190 Å²	190	143.1 Å²	143.1	83%	0.833	76%	0.757	S	S	*	*			trans	73.4	153.2	-173.1	-61.2	-55.1	0	0	0	115.3
874	Q	35.7	Very low	33.5	Very low	142 Å²	142	141.3 Å²	141.3	66%	0.664	76%	0.755	S	S	*	*			cis	-161.1	167.9	0.7	-121.6	167.4	-42.9	0	0	107.5
875	E	36.6	Very low	33.6	Very low	156 Å²	156	133.7 Å²	133.7	73%	0.729	75%	0.748	S	S	*	*			cis	-160.9	-164.3	-3.1	-162.2	141.4	-109.5	0	0	108.7
876	A	32.4	Very low	32.9	Very low	90 Å²	90	138.1 Å²	138.1	74%	0.744	76%	0.758	S	S	*	*			trans	69.7	99.8	163.2	0	0	0	0	0	117.9
877	D	31.5	Very low	33	Very low	137 Å²	137	130.9 Å²	130.9	73%	0.733	75%	0.753	S	S	*	*			cis	81.2	135.5	4.8	-153.2	22.7	0	0	0	118.9
878	I	33.9	Very low	33.3	Very low	134 Å²	134	127.8 Å²	127.8	69%	0.687	75%	0.753	S	S	*	*			trans	59.9	131.9	171.8	-20.2	-176.8	0	0	0	116.3
879	V	33.4	Very low	33.7	Very low	137 Å²	137	126.6 Å²	126.6	83%	0.83	75%	0.75	S	S	*	*				176.6	157.4	74.4	169.4	0	0	0	0	108.1
880	S	31.2	Very low	34.3	Very low	92 Å²	92	127.4 Å²	127.4	64%	0.643	75%	0.749	S	S	*	*			cis	174.3	145.5	-34.3	-169.9	0	0	0	0	110.3
881	S	35.7	Very low	34.7	Very low	97 Å²	97	131 Å²	131	68%	0.678	76%	0.755	S	S	*	*			trans	73.9	138.8	145.3	74.1	0	0	0	0	125
882	K	33.7	Very low	34.8	Very low	191 Å²	191	129.3 Å²	129.3	83%	0.83	76%	0.756	S	S	*	*			trans	72.9	115.1	141.7	-76.6	174.5	175.7	-178.1	0	123.4
883	D	32.7	Very low	34.8	Very low	151 Å²	151	132.4 Å²	132.4	81%	0.807	76%	0.76	S	S	*	*				178.3	174.3	109.2	-108.6	-4.2	0	0	0	109.6
884	S	36.3	Very low	35.3	Very low	107 Å²	107	128.1 Å²	128.1	75%	0.748	75%	0.754	S	S	*	*			cis	-171.1	152.3	-46.3	-96.6	0	0	0	0	110
885	G	33.3	Very low	35.5	Very low	67 Å²	67	128.1 Å²	128.1	69%	0.691	76%	0.758	S	S	*	*			trans	106.6	124.8	178.5	0	0	0	0	0	113.8
886	H	36	Very low	35.6	Very low	203 Å²	203	128.1 Å²	128.1	94%	0.94	76%	0.758	S	S	*	*				61.4	117.7	76.8	-73.6	43.9	0	0	0	113.2
887	G	33.3	Very low	35.7	Very low	70 Å²	70	130.2 Å²	130.2	72%	0.722	76%	0.756	S	S	*	*			cis	127.4	129.5	-7.1	0	0	0	0	0	113.2
888	D	35.6	Very low	35.9	Very low	161 Å²	161	127.6 Å²	127.6	86%	0.861	75%	0.754	S	S	*	*			trans	-171.3	155.3	161.1	-108.5	-19.7	0	0	0	112.6
889	S	38.1	Very low	36	Very low	95 Å²	95	127.1 Å²	127.1	66%	0.664	76%	0.757	S	S	*	*			trans	59.2	106.2	150.9	-63	0	0	0	0	123.6
890	E	39.5	Very low	35.9	Very low	157 Å²	157	126.6 Å²	126.6	73%	0.734	75%	0.75	S	S	*	*				113.6	107.9	121.4	-73.7	-175.3	151.9	0	0	122.1
891	Q	40.4	Very low	36	Very low	175 Å²	175	133.5 Å²	133.5	82%	0.818	76%	0.762	S	S	*	*			trans	64.9	136	134.2	-62.7	165.2	17.5	0	0	120.7
892	G	34.4	Very low	35.8	Very low	76 Å²	76	132.5 Å²	132.5	78%	0.784	77%	0.767	S	S	*	*			trans	157.5	17	159.4	0	0	0	0	0	121.3
893	D	35.5	Very low	35.8	Very low	152 Å²	152	132.4 Å²	132.4	81%	0.813	77%	0.769	S	S	*	*			trans	0.8	147	172.5	-61.1	-7.1	0	0	0	122.6
894	S	41.6	Very low	35.8	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	77%	0.766	S	S	*	*			trans	87.9	85.1	146.8	66.6	0	0	0	0	121.3
895	D	41.1	Very low	35.7	Very low	141 Å²	141	129.9 Å²	129.9	75%	0.754	77%	0.769	S	S	*	*				70	128.5	102.9	-64.9	4	0	0	0	124.5
896	H	37.3	Very low	35.7	Very low	157 Å²	157	130.1 Å²	130.1	73%	0.727	77%	0.772	S	S	*	*			trans	87.1	121.8	135.3	-83.3	-61.2	0	0	0	123.5
897	D	35.6	Very low	35.6	Very low	133 Å²	133	124.5 Å²	124.5	71%	0.711	76%	0.76	S	S	*	*			trans	76.4	84.1	132.6	-66.8	8.8	0	0	0	123.3
898	A	34.7	Very low	35.6	Very low	82 Å²	82	128.2 Å²	128.2	68%	0.678	76%	0.764	S	S	*	*				74.1	145	101.4	0	0	0	0	0	123
899	T	35.6	Very low	35.6	Very low	124 Å²	124	127.1 Å²	127.1	76%	0.761	76%	0.757	S	S	*	*			trans	85.1	116.2	158.5	67.6	0	0	0	0	121.6
900	N	33.2	Very low	35.3	Very low	127 Å²	127	131.2 Å²	131.2	68%	0.679	76%	0.763	S	S	*	*			trans	77.3	120.4	131.4	-78.8	-44.7	0	0	0	122.8
901	R	32.5	Very low	34.9	Very low	237 Å²	237	129.3 Å²	129.3	89%	0.894	77%	0.767	S	S	*	*			trans	68.7	126.5	136.5	-62.6	171.7	176.7	168	-3.2	119.2
902	G	30.8	Very low	34.9	Very low	76 Å²	76	127.8 Å²	127.8	78%	0.784	77%	0.765	S	S	*	*			trans	172.8	112.1	159.8	0	0	0	0	0	111.7
903	H	35	Very low	34.6	Very low	189 Å²	189	130 Å²	130	88%	0.875	77%	0.767	S	S	*	*			trans	-71.4	129.8	-176.7	-76	-78.5	0	0	0	113.3
904	S	32.5	Very low	35	Very low	105 Å²	105	128.4 Å²	128.4	73%	0.734	76%	0.763	S	S	*	*			trans	7.7	114.9	143.4	54.9	0	0	0	0	118.9
905	A	34.3	Very low	34.8	Very low	100 Å²	100	131 Å²	131	83%	0.826	76%	0.764	S	S	*	*			trans	-71.2	172	142.1	0	0	0	0	0	110.1
906	G	31.8	Very low	34.5	Very low	72 Å²	72	134.2 Å²	134.2	74%	0.742	77%	0.774	S	S	*	*			cis	131.7	120.7	-4.9	0	0	0	0	0	113.2
907	A	35.2	Very low	34.2	Very low	85 Å²	85	131.1 Å²	131.1	70%	0.702	77%	0.769	S	S	*	*			trans	68.5	123.1	168.9	0	0	0	0	0	119.6
908	D	33.6	Very low	34.1	Very low	148 Å²	148	133.7 Å²	133.7	79%	0.791	77%	0.774	S	S	*	*				50.5	154.9	123.3	-49.7	-18.2	0	0	0	121.5
909	L	34.7	Very low	34.4	Very low	137 Å²	137	134.9 Å²	134.9	72%	0.717	78%	0.784	S	S	*	*			cis	165.5	138.3	-32.9	-110.9	163	0	0	0	105.8
910	F	31.5	Very low	34.4	Very low	181 Å²	181	136.5 Å²	136.5	79%	0.794	79%	0.787	S	S	*	*			trans	66.7	107.4	172.3	-70.9	-70.6	0	0	0	121.2
911	S	31.9	Very low	34.3	Very low	117 Å²	117	133.5 Å²	133.5	82%	0.818	79%	0.786	S	S	*	*				-148.3	147.7	117.4	64.2	0	0	0	0	110.3
912	N	39.2	Very low	34.3	Very low	143 Å²	143	131.6 Å²	131.6	77%	0.765	79%	0.787	S	S	*	*			trans	-103.4	135	174.6	-84.7	-6.7	0	0	0	109.8
913	C	28.9	Very low	34.5	Very low	123 Å²	123	132.5 Å²	132.5	83%	0.831	78%	0.781	S	S	*	*				-175.7	134.1	125.5	-94.7	0	0	0	0	113.8
914	T	43.6	Very low	34.5	Very low	118 Å²	118	129.3 Å²	129.3	72%	0.724	77%	0.771	S	S	*	*			trans	-42	149	154.8	41.2	0	0	0	0	115.3
915	E	37.3	Very low	34.6	Very low	156 Å²	156	135.2 Å²	135.2	73%	0.729	78%	0.777	S	S	*	*			cis	-147.2	155.1	-3.6	-62.5	-156.2	145.8	0	0	111.8	C917	E915-C917 VanDerWaalsContact C-N 3.34Å; E915-C917 HydrophobicContact CB-CB 4.32Å; E915-C917 PolarHBondContact O-N 2.7Å
916	E	35.1	Very low	34.4	Very low	208 Å²	208	135.9 Å²	135.9	97%	0.972	77%	0.774	S	S	*	*			trans	-85.7	70.4	159	-77.4	-161.4	127.7	0	0	111.8
917	C	30.5	Very low	34.4	Very low	92 Å²	92	144.3 Å²	144.3	62%	0.622	78%	0.784	S	S	*	*			trans	-110.9	72.6	170.9	-164.4	0	0	0	0	111.8	E915	E915-C917 VanDerWaalsContact C-N 3.34Å; E915-C917 HydrophobicContact CB-CB 4.32Å; E915-C917 PolarHBondContact O-N 2.7Å
918	K	35.3	Very low	34	Very low	187 Å²	187	147.1 Å²	147.1	81%	0.813	78%	0.784	S	S	*	*			trans	-178.2	114.8	150.4	-102.8	149.6	-169.9	171.2	0	114.2	L920	K918-L920 VanDerWaalsContact C-N 3.29Å; K918-L920 PolarHBondContact O-N 2.73Å
919	A	39.2	Very low	34.2	Very low	107 Å²	107	145.8 Å²	145.8	88%	0.884	78%	0.784	S	S	*	*			trans	-88.9	55.1	165.7	0	0	0	0	0	112
920	L	36	Very low	34.1	Very low	159 Å²	159	143.7 Å²	143.7	83%	0.832	78%	0.78	S	S	*	*			trans	-140.7	130	172	-70.1	176.4	0	0	0	108.6	K918	K918-L920 VanDerWaalsContact C-N 3.29Å; K918-L920 PolarHBondContact O-N 2.73Å
921	G	31.7	Very low	33.9	Very low	63 Å²	63	145 Å²	145	65%	0.649	79%	0.786	S	S	*	*			trans	-108.9	174.6	-159.5	0	0	0	0	0	117.6
922	H	33	Very low	34	Very low	197 Å²	197	145.4 Å²	145.4	91%	0.912	78%	0.783	S	S	*	*			trans	74.3	133.8	175.3	-50.7	-81	0	0	0	116.6
923	S	34.5	Very low	34.8	Very low	95 Å²	95	144.5 Å²	144.5	66%	0.664	79%	0.785	S	S	*	*			cis	-159.3	171.7	-15	60.4	0	0	0	0	112.6
924	D	34.8	Very low	34.9	Very low	123 Å²	123	144.3 Å²	144.3	66%	0.658	79%	0.785	S	S	*	*			trans	72.2	99.2	155.8	-58.2	-56.3	0	0	0	122.4
925	R	35.3	Very low	34.3	Very low	228 Å²	228	147 Å²	147	86%	0.86	80%	0.795	S	S	*	*				47.9	138.4	122.2	-61.9	177.9	-175.1	-158.1	0.5	120.1
926	C	29.5	Very low	33.9	Very low	115 Å²	115	143.2 Å²	143.2	78%	0.777	80%	0.799	S	S	*	*			cis	-178	176.6	-8.2	-114.7	0	0	0	0	110
927	W	31	Very low	33.6	Very low	248 Å²	248	144.1 Å²	144.1	94%	0.939	79%	0.793	S	S	*	*			trans	94.3	113.6	150.3	-108.1	36.8	0	0	0	121.2
928	M	27.4	Very low	33.5	Very low	144 Å²	144	148.8 Å²	148.8	71%	0.709	81%	0.806	S	S	*	*			trans	-93	172.6	149.5	-64.9	167.4	61.1	0	0	109.4	S930	M928-S930 WeakPolarHBondContact CE-OG 3.17Å
929	P	37.8	Very low	33.2	Very low	121 Å²	121	143 Å²	143	79%	0.786	80%	0.8	S	S	*	*				-142.3	158.8	105.1	38.2	-26.5	0	0	0	115.2
930	S	31.5	Very low	34	Very low	92 Å²	92	143.4 Å²	143.4	64%	0.643	79%	0.793	S	S	*	*			trans	-104.4	149.2	172	-48.9	0	0	0	0	110.8	M928	M928-S930 WeakPolarHBondContact CE-OG 3.17Å
931	F	28.8	Very low	33.9	Very low	208 Å²	208	142.3 Å²	142.3	91%	0.912	79%	0.788	S	S	*	*			trans	-147.5	168.1	164.4	-112.8	-81.4	0	0	0	113.8
932	V	34.3	Very low	33.7	Very low	127 Å²	127	148 Å²	148	77%	0.77	79%	0.791	S	S	*	*			trans	-91.1	152.5	-158.7	169.1	0	0	0	0	112.4
933	P	54.9	Low	33.5	Very low	123 Å²	123	148.8 Å²	148.8	80%	0.799	79%	0.786	S	S	*	*			trans	-88	175.2	-164.1	36.2	-39	0	0	0	115.4
934	S	30.9	Very low	33.4	Very low	119 Å²	119	148.7 Å²	148.7	83%	0.832	79%	0.786	S	S	*	*			trans	-148.5	154.8	173.5	46.6	0	0	0	0	113.1
935	D	30.6	Very low	33.2	Very low	174 Å²	174	149.9 Å²	149.9	93%	0.93	79%	0.792	S	S	*	*			trans	-63.4	152.6	176.4	-66.5	-82.3	0	0	0	113.8
936	G	29	Very low	33.1	Very low	78 Å²	78	146.8 Å²	146.8	80%	0.804	79%	0.791	S	S	*	*			trans	-175.3	86	173.7	0	0	0	0	0	116.5
937	R	29.8	Very low	33.2	Very low	226 Å²	226	148.9 Å²	148.9	85%	0.853	79%	0.789	S	S	*	*			trans	-54.6	154	168.8	-61.5	169.9	173.9	168.4	-2.4	113.6
938	Q	28.6	Very low	33.2	Very low	190 Å²	190	142.4 Å²	142.4	89%	0.888	78%	0.777	S	S	*	*			trans	62.5	138.8	156.4	-65.4	160.3	-24.5	0	0	114.5
939	G	27.6	Very low	34.2	Very low	67 Å²	67	140.9 Å²	140.9	69%	0.691	78%	0.778	S	S	*	*			cis	169.5	-170.4	22.2	0	0	0	0	0	106.6
940	P	57.8	Low	34.1	Very low	115 Å²	115	138.8 Å²	138.8	75%	0.747	78%	0.778	S	S	*	*			trans	-85.4	163.3	-171.7	36.1	-36.8	0	0	0	113.2
941	D	32.9	Very low	34.2	Very low	136 Å²	136	142.5 Å²	142.5	73%	0.727	79%	0.788	S	S	*	*				-174.9	149.8	110.7	-100.4	-22.3	0	0	0	117.3
942	Y	28.4	Very low	34.5	Very low	182 Å²	182	139.5 Å²	139.5	71%	0.714	78%	0.781	S	S	*	*			trans	62	116	148.4	-83	-122.7	0	0	0	123.9
943	R	28.5	Very low	34.5	Very low	214 Å²	214	137.5 Å²	137.5	81%	0.808	78%	0.778	S	S	*	*				27.6	137.7	117.5	-72.4	178.4	157.1	139.2	-5.4	118.4
944	S	32.2	Very low	33.3	Very low	93 Å²	93	138 Å²	138	65%	0.65	78%	0.779	S	S	*	*				-176.8	154.2	58.9	53.5	0	0	0	0	115.3
945	N	30.6	Very low	33.5	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	77%	0.774	S	S	*	*			trans	68.1	152	159	-52.2	-24.9	0	0	0	117.3
946	L	33.6	Very low	34.4	Very low	162 Å²	162	136.4 Å²	136.4	85%	0.848	77%	0.767	S	S	*	*			cis	-145.9	157.3	13.8	-163.9	71.3	0	0	0	113
947	H	30.7	Very low	34.5	Very low	159 Å²	159	137.7 Å²	137.7	74%	0.736	76%	0.755	S	S	*	*			trans	-24.9	155.3	164.2	-139.4	35.1	0	0	0	117.8
948	V	31.2	Very low	34.7	Very low	112 Å²	112	132.8 Å²	132.8	68%	0.679	75%	0.75	S	S	*	*			cis	-163.3	176.3	41.7	-144.8	0	0	0	0	110.4
949	P	49.3	Very low	34.8	Very low	113 Å²	113	132.1 Å²	132.1	73%	0.734	75%	0.747	S	S	*	*				-123.4	169.9	-83.4	43.2	-28.1	0	0	0	117.8
950	G	35.8	Very low	34.9	Very low	76 Å²	76	135.4 Å²	135.4	78%	0.784	75%	0.754	S	S	*	*			trans	95.5	137.8	145.9	0	0	0	0	0	118.2
951	M	33.6	Very low	34.6	Very low	171 Å²	171	135.2 Å²	135.2	84%	0.842	75%	0.752	S	S	*	*			cis	-158.7	131.5	-3.4	-156.6	165.8	-176	0	0	111.8
952	D	33.3	Very low	34.4	Very low	144 Å²	144	134.6 Å²	134.6	77%	0.77	76%	0.757	S	S	*	*			trans	17.6	153	150.1	-49.4	-23.7	0	0	0	122.2
953	A	34.6	Very low	34.5	Very low	85 Å²	85	130.5 Å²	130.5	70%	0.702	76%	0.755	S	S	*	*			cis	-174.7	175	-17.8	0	0	0	0	0	106.2
954	T	30.9	Very low	34.6	Very low	134 Å²	134	126.3 Å²	126.3	82%	0.822	75%	0.753	S	S	*	*			cis	-160.5	143.6	34.5	47	0	0	0	0	112.5
955	L	33.7	Very low	34.6	Very low	142 Å²	142	128.3 Å²	128.3	74%	0.743	76%	0.756	S	S	*	*			trans	-84.7	178.8	155.5	-89.4	171.8	0	0	0	109.9
956	P	49.7	Very low	34.6	Very low	118 Å²	118	128.5 Å²	128.5	77%	0.766	76%	0.757	S	S	*	*			cis	-146.3	-159.1	37.5	33.6	-7.1	0	0	0	115.5
957	D	32.7	Very low	34.5	Very low	105 Å²	105	126 Å²	126	56%	0.561	75%	0.753	S	S	*	*				-171.9	-174.5	-55.1	-83	-47.4	0	0	0	108
958	T	34.1	Very low	34.5	Very low	122 Å²	122	125.3 Å²	125.3	75%	0.748	75%	0.754	S	S	*	*			trans	75	145.8	158.8	69.8	0	0	0	0	118.6
959	E	30	Very low	34.5	Very low	177 Å²	177	127.4 Å²	127.4	83%	0.827	76%	0.757	S	S	*	*			cis	-155.7	168.1	-8.4	-121.2	166.7	-143.3	0	0	112
960	V	30.1	Very low	33.6	Very low	136 Å²	136	128.6 Å²	128.6	82%	0.824	76%	0.756	S	S	*	*			trans	-148.7	126.7	-170.8	169.9	0	0	0	0	112.6
961	P	51.9	Low	33.3	Very low	111 Å²	111	130.7 Å²	130.7	72%	0.721	75%	0.754	S	S	*	*			trans	-154.3	172	133.2	40.8	-24.2	0	0	0	117.7
962	C	26.9	Very low	33.1	Very low	122 Å²	122	130.8 Å²	130.8	82%	0.824	75%	0.754	S	S	*	*			trans	74.8	146.1	150.5	-71.9	0	0	0	0	121.9
963	S	30.8	Very low	32.9	Very low	97 Å²	97	130 Å²	130	68%	0.678	76%	0.755	S	S	*	*			cis	-174.2	139.2	-14.2	51.6	0	0	0	0	115.8
964	V	31.6	Very low	32.6	Very low	126 Å²	126	130.7 Å²	130.7	76%	0.764	76%	0.755	S	S	*	*				86.4	131.8	129.7	165.1	0	0	0	0	124.1
965	N	31	Very low	32.6	Very low	134 Å²	134	129.3 Å²	129.3	72%	0.717	75%	0.751	S	S	*	*			trans	92	117.2	150.1	-81.8	-0.5	0	0	0	126.4
966	L	31.1	Very low	32.3	Very low	153 Å²	153	129.3 Å²	129.3	80%	0.801	76%	0.757	S	S	*	*			trans	22.4	134.7	134	-77.5	74.2	0	0	0	122.3
967	S	31.2	Very low	31.4	Very low	109 Å²	109	128.8 Å²	128.8	76%	0.762	76%	0.763	S	S	*	*				179.7	131.9	89.8	64.1	0	0	0	0	116.2
968	D	31.6	Very low	31.4	Very low	144 Å²	144	129.1 Å²	129.1	77%	0.77	77%	0.773	S	S	*	*			trans	45.9	133.3	144.2	-76.4	-45.7	0	0	0	127.3
969	Q	30.9	Very low	31.2	Very low	156 Å²	156	128.2 Å²	128.2	73%	0.729	77%	0.771	S	S	*	*			trans	73.3	110.8	136.5	-68.9	-171.5	28	0	0	125.5
970	L	31.3	Very low	31.3	Very low	138 Å²	138	126.4 Å²	126.4	72%	0.723	77%	0.767	S	S	*	*				76.9	132.2	122.5	-71.2	169.2	0	0	0	124.1
971	T	29.5	Very low	31.5	Very low	120 Å²	120	124.8 Å²	124.8	74%	0.736	75%	0.754	S	S	*	*			trans	70.1	108.3	148.2	43.7	0	0	0	0	122
972	M	28.3	Very low	30.6	Very low	173 Å²	173	129.5 Å²	129.5	85%	0.852	76%	0.758	S	S	*	*			trans	47	123.2	133.5	-58.2	-167.4	164.9	0	0	119.2
973	T	29.6	Very low	30.8	Very low	127 Å²	127	127.6 Å²	127.6	78%	0.779	75%	0.746	S	S	*	*				-168.2	151.5	67.4	25.7	0	0	0	0	113.7
974	S	28.6	Very low	30.8	Very low	100 Å²	100	132.4 Å²	132.4	70%	0.699	76%	0.755	S	S	*	*			trans	44.7	134.9	147.8	62.5	0	0	0	0	124.4
975	S	29.7	Very low	30.8	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	75%	0.748	S	S	*	*			trans	63.6	86.4	141	60.8	0	0	0	0	120.1
976	T	28.9	Very low	30.8	Very low	143 Å²	143	129.5 Å²	129.5	88%	0.877	75%	0.746	S	S	*	*			trans	-11.7	130.2	137.3	50.9	0	0	0	0	118.3
977	A	30	Very low	30.8	Very low	107 Å²	107	132.4 Å²	132.4	88%	0.884	75%	0.753	S	S	*	*			trans	-140	166.3	150.8	0	0	0	0	0	109.4
978	S	32.1	Very low	30.7	Very low	112 Å²	112	130.8 Å²	130.8	78%	0.783	75%	0.753	S	S	*	*			trans	-91.4	-177	-163.8	60.7	0	0	0	0	115.4
979	S	31	Very low	30.8	Very low	102 Å²	102	133.7 Å²	133.7	71%	0.713	76%	0.759	S	S	*	*			trans	84.2	158.2	165.6	92.1	0	0	0	0	116
980	N	32.3	Very low	30.8	Very low	139 Å²	139	134.4 Å²	134.4	74%	0.743	76%	0.762	S	S	*	*			cis	-161.2	151.2	-1.2	-133.3	-3	0	0	0	113.4
981	D	33.1	Very low	30.8	Very low	103 Å²	103	134.4 Å²	134.4	55%	0.551	76%	0.758	S	S	*	*				54.9	152.8	129.5	-148.7	6.9	0	0	0	123.5
982	R	33	Very low	30.9	Very low	209 Å²	209	135 Å²	135	79%	0.789	75%	0.753	S	S	*	*			trans	73.5	150.8	159.9	-72.5	157.1	-144.2	-152.5	3.8	121.5
983	S	32	Very low	31	Very low	82 Å²	82	135.4 Å²	135.4	57%	0.573	75%	0.753	S	S	*	*			cis	-177.6	162.9	-20.3	52.4	0	0	0	0	113.6
984	F	30.1	Very low	31.1	Very low	199 Å²	199	138 Å²	138	87%	0.873	75%	0.75	S	S	*	*			trans	70.9	158.4	169.4	-64.8	-76.8	0	0	0	116.1
985	S	30.7	Very low	31.1	Very low	88 Å²	88	138.1 Å²	138.1	62%	0.615	75%	0.75	S	S	*	*			cis	-156.7	145.1	21.7	-160.5	0	0	0	0	117.1
986	T	32	Very low	31.3	Very low	111 Å²	111	137 Å²	137	68%	0.681	74%	0.742	S	S	*	*			trans	59.1	135	140.2	46.9	0	0	0	0	126.7
987	F	30.6	Very low	31.6	Very low	213 Å²	213	134.6 Å²	134.6	93%	0.934	73%	0.732	S	S	*	*			trans	75.5	142.3	142.3	-94.3	-92.4	0	0	0	122.2
988	G	30.3	Very low	31.9	Very low	75 Å²	75	135.2 Å²	135.2	77%	0.773	72%	0.724	S	S	*	*			trans	121.1	115.1	170.9	0	0	0	0	0	114.3
989	K	32.2	Very low	32	Very low	205 Å²	205	136.9 Å²	136.9	89%	0.891	72%	0.724	S	S	*	*			trans	-160.3	116.6	-175.6	-165.3	-176.8	-169.1	-179.7	0	114.3
990	Q	31.3	Very low	32.1	Very low	171 Å²	171	138.9 Å²	138.9	80%	0.799	72%	0.722	S	S	*	*			trans	174.3	147.6	158.8	-102.3	169	-20.7	0	0	108.1
991	Q	30.8	Very low	32	Very low	138 Å²	138	140.3 Å²	140.3	65%	0.645	72%	0.717	S	S	*	*			cis	-155.1	134.5	-13.7	-131.2	172.6	-36.4	0	0	108.4
992	Q	31.7	Very low	31.9	Very low	133 Å²	133	143 Å²	143	62%	0.621	72%	0.724	S	S	*	*				39.2	131.9	112	-52.3	177.1	-44	0	0	115.7	Y994	Q992-Y994 HydrophobicContact CB-CD2 4.42Å; Q992-Y994 HydrophobicContact CG-CE2 4.47Å
993	Q	30.3	Very low	31.9	Very low	181 Å²	181	139.2 Å²	139.2	85%	0.846	72%	0.715	S	S	*	*				-139.9	146.9	57.8	-81.1	173.9	-30	0	0	112.8
994	Y	32.6	Very low	31.8	Very low	182 Å²	182	146.4 Å²	146.4	71%	0.714	73%	0.731	S	S	*	*				64.1	141.9	69.9	-80.1	-87.9	0	0	0	114	Q992	Q992-Y994 HydrophobicContact CB-CD2 4.42Å; Q992-Y994 HydrophobicContact CG-CE2 4.47Å
995	S	28.1	Very low	32	Very low	102 Å²	102	142.4 Å²	142.4	71%	0.713	72%	0.719	S	S	*	*			cis	-126.4	166	19.7	59.7	0	0	0	0	113
996	S	34.2	Very low	32	Very low	81 Å²	81	148.6 Å²	148.6	57%	0.566	73%	0.729	S	S	*	*			cis	65.7	158.8	33.6	86.3	0	0	0	0	114.2
997	S	36.2	Very low	32	Very low	94 Å²	94	146.7 Å²	146.7	66%	0.657	73%	0.731	S	S	*	*			cis	-167.6	169.3	13.5	-5.7	0	0	0	0	109.6
998	T	35.6	Very low	32	Very low	119 Å²	119	143.1 Å²	143.1	73%	0.73	73%	0.727	S	S	*	*			cis	178.4	165.2	-19.5	30.9	0	0	0	0	110
999	L	34.9	Very low	32.2	Very low	148 Å²	148	147.2 Å²	147.2	78%	0.775	73%	0.73	S	S	*	*			trans	77.1	165.6	156.7	-68.4	152.5	0	0	0	119.4
1000	E	31.7	Very low	33.2	Very low	143 Å²	143	142.5 Å²	142.5	67%	0.668	72%	0.721	S	S	*	*			cis	-128.6	174.5	1.2	-69.5	-174.5	123.3	0	0	110.6	K1002	E1000-K1002 WeakPolarHBondContact OE1-CE 3.35Å; E1000-K1002 IonicContact OE1-NZ 3.59Å; E1000-K1002 PolarHBondContact OE1-NZ 3.06Å; E1000-K1002 IonicContact OE2-NZ 2.69Å; E1000-K1002 PolarHBondContact OE2-NZ 2.7Å
1001	R	29.9	Very low	33.1	Very low	170 Å²	170	145.8 Å²	145.8	64%	0.642	73%	0.727	S	S	*	*			cis	88.1	95.3	6.9	-163.2	-176.9	174.3	-169.2	-5.8	121.1	E1003	R1001-E1003 IonicContact CZ-OE1 3.71Å; R1001-E1003 VanDerWaalsContact CZ-OE1 3.29Å; R1001-E1003 IonicContact CZ-OE2 3.03Å; R1001-E1003 IonicContact NE-OE1 2.71Å; R1001-E1003 PolarHBondContact NE-OE1 2.88Å; R1001-E1003 IonicContact NE-OE2 2.71Å; R1001-E1003 VanDerWaalsContact NH2-CD 3.3Å; R1001-E1003 IonicContact NH2-OE1 2.74Å; R1001-E1003 PolarHBondContact NH2-OE1 2.92Å; R1001-E1003 IonicContact NH2-OE2 3.5Å; R1001-E1003 PolarHBondContact NH2-OE2 3.4Å
1002	K	32.3	Very low	33.2	Very low	160 Å²	160	148 Å²	148	70%	0.696	74%	0.735	S	S	*	*			trans	-166.9	144.1	146.5	-87.5	119.4	-154.5	179.5	0	110.9	E1000	E1000-K1002 WeakPolarHBondContact OE1-CE 3.35Å; E1000-K1002 IonicContact OE1-NZ 3.59Å; E1000-K1002 PolarHBondContact OE1-NZ 3.06Å; E1000-K1002 IonicContact OE2-NZ 2.69Å; E1000-K1002 PolarHBondContact OE2-NZ 2.7Å
1003	E	31.9	Very low	33.8	Very low	128 Å²	128	147 Å²	147	60%	0.598	74%	0.74	S	S	*	*			cis	108.2	97.6	-11.5	-150.9	170.7	-43	0	0	118.2	R1001	R1001-E1003 IonicContact CZ-OE1 3.71Å; R1001-E1003 VanDerWaalsContact CZ-OE1 3.29Å; R1001-E1003 IonicContact CZ-OE2 3.03Å; R1001-E1003 IonicContact NE-OE1 2.71Å; R1001-E1003 PolarHBondContact NE-OE1 2.88Å; R1001-E1003 IonicContact NE-OE2 2.71Å; R1001-E1003 VanDerWaalsContact NH2-CD 3.3Å; R1001-E1003 IonicContact NH2-OE1 2.74Å; R1001-E1003 PolarHBondContact NH2-OE1 2.92Å; R1001-E1003 IonicContact NH2-OE2 3.5Å; R1001-E1003 PolarHBondContact NH2-OE2 3.4Å
1004	Y	31.1	Very low	33.8	Very low	234 Å²	234	144.3 Å²	144.3	92%	0.918	74%	0.736	S	S	*	*			trans	-171.7	169.4	163.6	-116.7	-75.6	0	0	0	112.6
1005	D	33	Very low	33.7	Very low	114 Å²	114	145.2 Å²	145.2	61%	0.61	74%	0.744	S	S	*	*				-148.9	161.6	-97.5	-179.4	34.2	0	0	0	112.9
1006	R	30.9	Very low	33.9	Very low	219 Å²	219	147.9 Å²	147.9	83%	0.826	75%	0.749	S	S	*	*			trans	71.5	146.1	170.6	-42.2	-174.2	-177.5	-177.3	-2.6	118.1
1007	G	31.4	Very low	34.1	Very low	71 Å²	71	148.6 Å²	148.6	73%	0.732	75%	0.754	S	S	*	*			cis	120.5	124.7	0.9	0	0	0	0	0	112.2
1008	T	31.8	Very low	33.9	Very low	138 Å²	138	155.9 Å²	155.9	85%	0.847	77%	0.767	S	S	*	*			cis	-133.4	-142.4	2.9	-29.3	0	0	0	0	109.5
1009	L	34.1	Very low	33.9	Very low	161 Å²	161	160 Å²	160	84%	0.843	78%	0.775	S	S	*	*			cis	-143.8	173.2	14.8	-88.9	176.5	0	0	0	110.1
1010	P	54.3	Low	34.3	Very low	106 Å²	106	163.5 Å²	163.5	69%	0.688	78%	0.778	S	S	*	*			trans	-114.7	157.9	-162.3	40.7	-33.3	0	0	0	117.8
1011	Y	28.7	Very low	34.5	Very low	239 Å²	239	163 Å²	163	94%	0.937	78%	0.779	S	S	*	*			trans	-149.8	177.7	136.4	-136.8	-107.1	0	0	0	112
1012	K	32.1	Very low	34.6	Very low	186 Å²	186	164.3 Å²	164.3	81%	0.809	81%	0.812	S	S	*	*			trans	-121.3	178.8	-155.5	-124.3	-170.6	179.4	177.7	0	113.8
1013	P	44.2	Very low	34.7	Very low	112 Å²	112	164.6 Å²	164.6	73%	0.727	82%	0.818	S	S	*	*				-123.2	-174	-114	43.2	-27.3	0	0	0	114.8
1014	T	31.9	Very low	34.9	Very low	124 Å²	124	166.5 Å²	166.5	76%	0.761	83%	0.829	S	S	*	*			trans	-126.1	166.5	168.4	45.5	0	0	0	0	112.6
1015	F	30.6	Very low	35.1	Very low	200 Å²	200	162.7 Å²	162.7	88%	0.877	82%	0.824	S	S	*	*			trans	78.8	98.4	-178	-68.2	-80.6	0	0	0	118.8
1016	L	31.8	Very low	35.2	Very low	158 Å²	158	165.6 Å²	165.6	83%	0.827	84%	0.837	S	S	*	*			trans	-90.7	142.6	150.4	-64.7	160.5	0	0	0	106.8
1017	S	37.9	Very low	35.5	Very low	96 Å²	96	162.3 Å²	162.3	67%	0.671	84%	0.837	S	S	*	*			cis	85.3	119.3	27.9	92.5	0	0	0	0	116.2
1018	R	32.7	Very low	35.8	Very low	247 Å²	247	168.3 Å²	168.3	93%	0.932	84%	0.844	S	S	*	*			trans	-160	159.8	151.8	-93.5	-167.2	178	-163.3	0.3	109
1019	K	34	Very low	36.1	Very low	207 Å²	207	170.5 Å²	170.5	90%	0.9	84%	0.844	S	S	*	*				-152.1	169.2	-61.7	-142.6	-174.9	177.9	-172.9	0	108.1
1020	R	44	Very low	36.2	Very low	221 Å²	221	171.2 Å²	171.2	83%	0.834	84%	0.844	S	S	*	*			trans	-88.3	149.1	-175	-92.9	-178	174.1	-169.4	-0.4	114.4
1021	I	35.4	Very low	34.7	Very low	133 Å²	133	176.7 Å²	176.7	68%	0.682	86%	0.857	S	S	*	*			trans	62.6	116.9	139.4	-61.7	167.9	0	0	0	117.8
1022	C	33.2	Very low	35.3	Very low	197 Å²	197	171 Å²	171	100%	1.331	85%	0.85	S	S	*	*				-104	0	106.9	-74.3	0	0	0	0	107.8

Retrieved 1,022 of 1,022 residues in 702 ms (Link to these results)

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