A0A5K4F452_SCHMA Loading...

Staphylococcal nuclease domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F452, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,025 aa.

						>A0A5K4F452_SCHMA|A0A5K4F452
MSSLVNNREEARPVSTNTYFLGIVKQVLSGDTIMVRDRPINGPPPERTIILSNISCGRVARKPSTGVPTGTSEDPFAWEAREFVRTLLIGKEVCYSIETEQPSGRKYGCVYVGKNISGENVALSLVEQGLAEVRKLNPTVAAKNKVYQQLVTAQEQAKSLGKGRWSPNPPVTREILWSVENIRSFFESYKNRPLKAVVENVRDGCSVQVFILPESLNERPNTFVYLTVTMSGIKCPSIRYEDGKIVPDAWGLDALFFTESRLLQRDVTILLESVFNQTFVGSILHPNGNIAELLLRHGLAHCIDWNLNLVSVPGAAEAYKIAERFAKEKRLRVFENYQPTQTAEVHSDSLPTVVPGKIFSGVICEVGNGDNVSIKCSDGVHKFFLSSIRAPRPQSNNKEDDSSAQRGRIRPLYDIPYVFEAREVLRQFIGKQVTAHVDYIQPKTPNTVDERVCATVRADDVNLALALVSKGLASVVRYRNTNDSRSVFYGELLAAEENAQSKGLGMYSKQDAPIHRVADLTGNVAKSRQFLSFLQRAERLDGVVEFVFSASRFRIYIPRETCVITLLLGGIQCPRRGRIGPDGVALPDMPFSNEAYMFVKELCMQRNVEIKVEAMDRVGNFVGYLYMDIPNLSSNEPDINKSSGKKKKKKSTETNVKQKTNLSVLLISQGFGTVHRAPTTERSPHYHDMLKAEEDAKINRCGLWSSDQFVKEWEAEVQNNSDPTVSSGAEDGSLVPLAGLSEYLDDLSELQIDEDGDLKTVINDENIKQLSWKPVQITGISRPSGSQGLRFFAQHLSDACTLVKISQMLNSQSFPSFPSEYCPKKGSLCIACFSLDNCWYRARVIRSSPKSVTVQFIDFGNEEVIDAAEYSSRLSPLPPGSLMQLPPQVKEYRLAFVQLPPDTSDRMFAERAFCDLVENKELRLAVVYESVPCGNESLKPVPAVTLVLPVADHKTSGSSVCPNDIDISESLLSNGLVCVEPIQPQLLKRLPRNLLHKYLDAQALAKKERKNIWRYGDFRTDVEQL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	37.7	Very low	245 Å²	245	148.2 Å²	148.2	100%	1.207	78%	0.784	S	S	*	*				0	137.6	0	-76.9	-173	-167.6	0	0	108.6
2	S	35.7	Very low	38.9	Very low	117 Å²	117	152.8 Å²	152.8	82%	0.818	78%	0.783	S	S	*	*			trans	-54	134.4	175.3	52.1	0	0	0	0	113.6
3	S	37.4	Very low	39.9	Very low	107 Å²	107	149.8 Å²	149.8	75%	0.748	78%	0.779	S	S	*	*			trans	-144.1	84	141.9	59.5	0	0	0	0	108.9	V5	S3-V5 PolarHBondContact O-N 2.71Å
4	L	38.4	Very low	40.6	Very low	168 Å²	168	143.9 Å²	143.9	88%	0.88	75%	0.753	S	S	*	*			trans	-62.4	107.3	157.1	-79.8	162.3	0	0	0	106.2	N6	L4-N6 PolarHBondContact O-N 3.06Å
5	V	36.7	Very low	41.3	Very low	117 Å²	117	142.4 Å²	142.4	71%	0.709	76%	0.759	S	S	*	*			trans	-61.9	102.6	173.3	176.7	0	0	0	0	107.2	S3 N7	S3-V5 PolarHBondContact O-N 2.71Å; V5-N7 VanDerWaalsContact C-N 3.28Å; V5-N7 PolarHBondContact O-N 3.06Å
6	N	35.3	Very low	42.1	Very low	137 Å²	137	139.3 Å²	139.3	73%	0.733	75%	0.747	S	S	*	*			trans	-65.5	89	167.9	-93.9	-25.3	0	0	0	108.3	L4 R8	L4-N6 PolarHBondContact O-N 3.06Å; N6-R8 PolarHBondContact O-N 2.81Å
7	N	34.8	Very low	43.6	Very low	144 Å²	144	136.7 Å²	136.7	77%	0.77	73%	0.733	S	S	*	*			trans	-66.6	87.2	158.5	-80.6	-14.9	0	0	0	107.8	V5 E9	V5-N7 VanDerWaalsContact C-N 3.28Å; V5-N7 PolarHBondContact O-N 3.06Å; N7-E9 VanDerWaalsContact C-N 3.33Å; N7-E9 PolarHBondContact O-N 2.89Å; N7-E9 VanDerWaalsContact O-N 3.12Å
8	R	37.2	Very low	45.8	Very low	218 Å²	218	132.7 Å²	132.7	82%	0.823	71%	0.714	S	S	*	*			trans	-72.9	92.4	163.2	-75.6	-178.6	172.3	178.3	-1.6	107	N6 E10	N6-R8 PolarHBondContact O-N 2.81Å; R8-E10 PolarHBondContact O-N 3.02Å; R8-E10 VanDerWaalsContact O-N 3.15Å
9	E	38.5	Very low	48.2	Very low	149 Å²	149	130.6 Å²	130.6	70%	0.696	70%	0.696	S	S	*	*			trans	-61.2	113.6	164.3	-77.8	-173	143.8	0	0	108.6	N7 P102	N7-E9 VanDerWaalsContact C-N 3.33Å; N7-E9 PolarHBondContact O-N 2.89Å; N7-E9 VanDerWaalsContact O-N 3.12Å; E9-P102 HydrophobicContact CB-CG 4.44Å; E9-P102 WeakPolarHBondContact O-CG 3.43Å
10	E	40.3	Very low	50.4	Low	178 Å²	178	127.4 Å²	127.4	83%	0.832	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-70.4	146.1	176.7	-70.8	-176.6	155.6	0	0	111.1	R8 R12	R8-E10 PolarHBondContact O-N 3.02Å; R8-E10 VanDerWaalsContact O-N 3.15Å; E10-R12 PolarHBondContact O-N 3.27Å
11	A	46	Very low	52.4	Low	50 Å²	50	126 Å²	126	41%	0.413	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-58.4	131.7	178.4	0	0	0	0	0	111.2	P13 T99	A11-P13 WeakPolarHBondContact O-CD 3.11Å; A11-T99 HydrophobicContact CB-CG2 3.99Å
12	R	51.9	Low	55.3	Low	204 Å²	204	114.8 Å²	114.8	77%	0.77	62%	0.615	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83	120.3	179.9	-67.8	-176.4	-174.1	-177.5	3.1	110.6	E10	E10-R12 PolarHBondContact O-N 3.27Å
13	P	52	Low	58.1	Low	113 Å²	113	110.3 Å²	110.3	73%	0.734	58%	0.582	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71	128.1	168.1	27.5	-30.8	0	0	0	109.9	A11 S15	A11-P13 WeakPolarHBondContact O-CD 3.11Å; P13-S15 PolarHBondContact O-N 2.89Å
14	V	49.9	Very low	60.9	Low	68 Å²	68	105.3 Å²	105.3	41%	0.412	55%	0.546	S	S	.	.			trans	-76	115.9	175.5	-172.8	0	0	0	0	107.9	T16	V14-T16 PolarHBondContact O-N 2.99Å; V14-T16 VanDerWaalsContact O-N 3.14Å
15	S	50.9	Low	63.7	Low	121 Å²	121	98.5 Å²	98.5	85%	0.846	51%	0.51	S	S	*	.	S	Bend	trans	-71.6	-5	-165.8	50.4	0	0	0	0	115.8	P13	P13-S15 PolarHBondContact O-N 2.89Å
16	T	54.4	Low	66.5	Low	92 Å²	92	94.7 Å²	94.7	56%	0.564	48%	0.484	S	S	*	.	S	Bend	trans	-142.1	132.6	172.4	47.9	0	0	0	0	109.9	V14 T18	V14-T16 PolarHBondContact O-N 2.99Å; V14-T16 VanDerWaalsContact O-N 3.14Å; T16-T18 PolarHBondContact O-N 2.77Å; T16-T18 PolarHBondContact O-OG1 3.48Å
17	N	66.9	Low	69.5	Low	96 Å²	96	88.1 Å²	88.1	51%	0.513	45%	0.449	S	S	.	.			trans	-67	83.9	174.3	-84.2	-2.3	0	0	0	109.5	Y19	N17-Y19 HydrophobicContact CB-CE2 4.03Å; N17-Y19 WeakPolarHBondContact O-CD2 3.46Å; N17-Y19 WeakPolarHBondContact O-CE2 3.46Å
18	T	84.3	Confident	72.4	Confident	64 Å²	64	84.6 Å²	84.6	39%	0.393	43%	0.43	S	S	.	.			trans	-79	122.5	172.7	-55.2	0	0	0	0	107.7	T16 F20	T16-T18 PolarHBondContact O-N 2.77Å; T16-T18 PolarHBondContact O-OG1 3.48Å; T18-F20 HydrophobicContact CG2-CE1 3.98Å; T18-F20 HydrophobicContact CG2-CE2 4.15Å; T18-F20 HydrophobicContact CG2-CZ 3.68Å; T18-F20 WeakPolarHBondContact O-CE2 3.23Å
19	Y	90	Very high	75.1	Confident	93 Å²	93	75 Å²	75	37%	0.365	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	138.6	176.8	-63.5	-82	0	0	0	110.2	N17 Y95 Y111 I116	N17-Y19 HydrophobicContact CB-CE2 4.03Å; N17-Y19 WeakPolarHBondContact O-CD2 3.46Å; N17-Y19 WeakPolarHBondContact O-CE2 3.46Å; Y19-Y95 CarbonylContact C-O 3.56Å; Y19-Y95 WeakPolarHBondContact CA-O 3.44Å; Y19-Y111 HydrophobicContact CE1-CE2 4.24Å; Y19-I116 HydrophobicContact CD1-CG2 3.53Å; Y19-I116 HydrophobicContact CD2-CG2 4.34Å; Y19-I116 HydrophobicContact CE1-CG2 3.37Å; Y19-I116 HydrophobicContact CE2-CG2 4.2Å; Y19-I116 HydrophobicContact CG-CG2 4.03Å
20	F	92.5	Very high	77.8	Confident	67 Å²	67	67.9 Å²	67.9	29%	0.294	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	153.4	-179.7	-56.9	-81.9	0	0	0	109.7	T18 C94 Y95 I97	T18-F20 HydrophobicContact CG2-CE1 3.98Å; T18-F20 HydrophobicContact CG2-CE2 4.15Å; T18-F20 HydrophobicContact CG2-CZ 3.68Å; T18-F20 WeakPolarHBondContact O-CE2 3.23Å; F20-C94 CarbonylContact O-C 3.15Å; F20-C94 WeakPolarHBondContact O-CA 3.37Å; F20-Y95 HydrophobicContact CB-CD1 4.04Å; F20-Y95 HydrophobicContact CB-CD2 4.18Å; F20-Y95 HydrophobicContact CB-CE1 3.54Å; F20-Y95 HydrophobicContact CB-CE2 3.71Å; F20-Y95 HydrophobicContact CB-CG 4.34Å; F20-Y95 HydrophobicContact CD2-CD2 4.29Å; F20-Y95 AromaticContact CD2-CE2 3.94Å; F20-Y95 HydrophobicContact CD2-CE2 3.94Å; F20-Y95 HydrophobicContact CG-CE2 4.08Å; F20-Y95 PolarHBondContact N-O 3.3Å; F20-Y95 WeakPolarHBondContact O-CD1 3.47Å; F20-Y95 PolarHBondContact O-N 2.92Å; F20-I97 HydrophobicContact CD2-CD1 4.5Å; F20-I97 HydrophobicContact CE2-CD1 4.06Å; F20-I97 HydrophobicContact CE2-CG1 4.37Å
21	L	93.5	Very high	80.5	Confident	99 Å²	99	59.9 Å²	59.9	52%	0.518	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	141.1	171.4	-76.8	170.1	0	0	0	108.8	C94 K114	L21-C94 HydrophobicContact CD2-CB 4.4Å; L21-K114 HydrophobicContact CD2-CB 4.04Å; L21-K114 HydrophobicContact CD2-CG 4.36Å; L21-K114 WeakPolarHBondContact CD2-O 3.49Å
22	G	93.8	Very high	83	Confident	8 Å²	8	58.7 Å²	58.7	8%	0.082	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	173.4	172.6	0	0	0	0	0	112.5	E92 V93	G22-E92 CarbonylContact O-C 3.57Å; G22-E92 WeakPolarHBondContact O-CA 3.34Å; G22-V93 PolarHBondContact N-O 3.38Å; G22-V93 VanDerWaalsContact N-O 3.08Å; G22-V93 PolarHBondContact O-N 2.75Å
23	I	95.2	Very high	85.1	Confident	24 Å²	24	49 Å²	49	12%	0.123	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.3	179	-61.7	165.1	0	0	0	107.9	K25 V35 R36 R38 K91 E92	I23-K25 PolarHBondContact O-N 3.49Å; I23-K25 VanDerWaalsContact O-N 3.12Å; I23-V35 WeakPolarHBondContact O-CA 3.47Å; I23-R36 HydrophobicContact CB-CG 4.4Å; I23-R36 PolarHBondContact N-O 3.45Å; I23-R36 PolarHBondContact O-N 3Å; I23-R38 HydrophobicContact CD1-CG 4.18Å; I23-K91 WeakPolarHBondContact CA-O 3.33Å; I23-E92 HydrophobicContact CG1-CG 3.89Å
24	V	97.3	Very high	87.3	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	114.1	176.4	175	0	0	0	0	109.4	V27 I33 V35 L88 I89 G90 K91 V93	V24-V27 HydrophobicContact CG1-CG2 4.17Å; V24-I33 HydrophobicContact CB-CG2 4.36Å; V24-I33 HydrophobicContact CG1-CG2 3.62Å; V24-I33 HydrophobicContact CG2-CG2 3.94Å; V24-V35 HydrophobicContact CG2-CG2 4.46Å; V24-L88 HydrophobicContact CB-CB 4.23Å; V24-L88 WeakPolarHBondContact CB-O 3.41Å; V24-L88 HydrophobicContact CG1-CB 4.1Å; V24-L88 HydrophobicContact CG2-CB 3.99Å; V24-L88 HydrophobicContact CG2-CD1 4.44Å; V24-I89 HydrophobicContact CG1-CD1 4.46Å; V24-G90 VanDerWaalsContact O-CA 3.22Å; V24-G90 WeakPolarHBondContact O-CA 3.37Å; V24-G90 PolarHBondContact O-N 2.89Å; V24-K91 PolarHBondContact N-O 3.26Å; V24-V93 HydrophobicContact CG2-CB 4.29Å; V24-V93 HydrophobicContact CG2-CG1 3.64Å; V24-V93 HydrophobicContact CG2-CG2 3.62Å
25	K	95.4	Very high	89.5	Confident	26 Å²	26	41.7 Å²	41.7	11%	0.113	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-46.1	-179.8	178	-175.5	171.5	-179.5	0	111.2	I23 M34 R36 E46 I89 E259 L263	I23-K25 PolarHBondContact O-N 3.49Å; I23-K25 VanDerWaalsContact O-N 3.12Å; K25-M34 HydrophobicContact CD-CG 4.49Å; K25-M34 HydrophobicContact CD-SD 3.91Å; K25-M34 PolarHBondContact N-O 2.78Å; K25-R36 HydrophobicContact CB-CB 4.37Å; K25-R36 HydrophobicContact CB-CG 4.07Å; K25-E46 WeakPolarHBondContact CD-OE1 3.09Å; K25-E46 WeakPolarHBondContact CE-OE1 3.41Å; K25-E46 IonicContact NZ-OE1 2.72Å; K25-E46 PolarHBondContact NZ-OE1 3.3Å; K25-E46 IonicContact NZ-OE2 3.15Å; K25-E46 PolarHBondContact NZ-OE2 3.38Å; K25-I89 WeakPolarHBondContact O-CD1 3.47Å; K25-E259 WeakPolarHBondContact CE-OE1 3.34Å; K25-E259 IonicContact NZ-OE1 3.3Å; K25-E259 PolarHBondContact NZ-OE1 3.48Å; K25-E259 IonicContact NZ-OE2 3.17Å; K25-L263 HydrophobicContact CG-CD2 4.11Å
26	Q	96.9	Very high	91.5	Very high	36 Å²	36	37.2 Å²	37.2	17%	0.168	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	142.6	-171.4	-164.6	-179.5	7.5	0	0	110.3	L28 M34 L263 Q264	Q26-L28 HydrophobicContact CG-CD2 4.09Å; Q26-M34 HydrophobicContact CB-CB 4.12Å; Q26-M34 PolarHBondContact N-O 2.76Å; Q26-M34 PolarHBondContact O-N 3.46Å; Q26-L263 HydrophobicContact CB-CD2 4.22Å; Q26-L263 HydrophobicContact CG-CD2 4.36Å; Q26-Q264 HydrophobicContact CG-CG 4.39Å
27	V	97.6	Very high	93.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	113.1	171	-175.7	0	0	0	0	108.2	V24 S29 R81 V84 R85 Q264	V24-V27 HydrophobicContact CG1-CG2 4.17Å; V27-S29 VanDerWaalsContact CG1-O 3.29Å; V27-S29 WeakPolarHBondContact CG1-O 3.42Å; V27-R81 HydrophobicContact CG1-CG 3.98Å; V27-R81 PolarHBondContact O-NE 3.43Å; V27-R81 VanDerWaalsContact O-NE 3.09Å; V27-V84 HydrophobicContact CG1-CB 3.92Å; V27-V84 HydrophobicContact CG1-CG1 3.71Å; V27-V84 HydrophobicContact CG2-CG1 3.96Å; V27-R85 HydrophobicContact CB-CB 4.49Å; V27-R85 HydrophobicContact CG2-CB 4.39Å; V27-Q264 PolarHBondContact O-NE2 3.35Å
28	L	95.3	Very high	93.9	Very high	70 Å²	70	37.7 Å²	37.7	37%	0.366	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-37.8	-176.1	-60.5	-179.9	0	0	0	111.6	Q26 T32 M34 T48	Q26-L28 HydrophobicContact CG-CD2 4.09Å; L28-T32 HydrophobicContact CB-CG2 4.11Å; L28-T32 HydrophobicContact CD1-CG2 3.93Å; L28-T32 HydrophobicContact CG-CG2 4.48Å; L28-T32 PolarHBondContact N-O 2.98Å; L28-M34 HydrophobicContact CD1-CE 4.43Å; L28-T48 HydrophobicContact CD1-CG2 4.09Å
29	S	95.4	Very high	93.6	Very high	15 Å²	15	37.7 Å²	37.7	11%	0.105	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	172.9	172.3	57	0	0	0	0	108.5	V27 D31 T32	V27-S29 VanDerWaalsContact CG1-O 3.29Å; V27-S29 WeakPolarHBondContact CG1-O 3.42Å; S29-D31 PolarHBondContact O-N 3.32Å; S29-D31 VanDerWaalsContact O-N 3.07Å; S29-D31 PolarHBondContact OG-OD1 3.34Å; S29-T32 PolarHBondContact N-O 3.25Å; S29-T32 PolarHBondContact O-N 3.17Å; S29-T32 VanDerWaalsContact O-N 3.15Å; S29-T32 WeakPolarHBondContact OG-CB 3.25Å; S29-T32 PolarHBondContact OG-N 2.88Å; S29-T32 PolarHBondContact OG-OG1 3.46Å; S29-T32 VanDerWaalsContact OG-OG1 3.06Å
30	G	95.3	Very high	93	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.8	176.3	0	0	0	0	0	114.1	V84 L125	G30-V84 WeakPolarHBondContact O-CG2 3.46Å; G30-L125 WeakPolarHBondContact O-CD1 3.47Å
31	D	96.5	Very high	91.8	Very high	11 Å²	11	45 Å²	45	6%	0.059	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	2.7	179.2	59.2	-3.5	0	0	0	114	S29 I50 L51 I54 C56 R134	S29-D31 PolarHBondContact O-N 3.32Å; S29-D31 VanDerWaalsContact O-N 3.07Å; S29-D31 PolarHBondContact OG-OD1 3.34Å; D31-I50 CarbonylContact O-C 3.59Å; D31-I50 VanDerWaalsContact O-CA 3.3Å; D31-I50 WeakPolarHBondContact O-CA 3.28Å; D31-L51 HydrophobicContact CB-CB 4.41Å; D31-L51 PolarHBondContact O-N 2.9Å; D31-I54 HydrophobicContact CB-CD1 4.47Å; D31-I54 HydrophobicContact CB-CG1 4.44Å; D31-C56 HydrophobicContact CB-CB 4.17Å; D31-C56 PolarHBondContact OD2-N 3.36Å; D31-R134 IonicContact OD2-NH2 3.54Å
32	T	97.2	Very high	90.6	Very high	24 Å²	24	42.1 Å²	42.1	15%	0.147	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	115.3	-176.2	-53.6	0	0	0	0	111.1	L28 S29 T48 I50	L28-T32 HydrophobicContact CB-CG2 4.11Å; L28-T32 HydrophobicContact CD1-CG2 3.93Å; L28-T32 HydrophobicContact CG-CG2 4.48Å; L28-T32 PolarHBondContact N-O 2.98Å; S29-T32 PolarHBondContact N-O 3.25Å; S29-T32 PolarHBondContact O-N 3.17Å; S29-T32 VanDerWaalsContact O-N 3.15Å; S29-T32 WeakPolarHBondContact OG-CB 3.25Å; S29-T32 PolarHBondContact OG-N 2.88Å; S29-T32 PolarHBondContact OG-OG1 3.46Å; S29-T32 VanDerWaalsContact OG-OG1 3.06Å; T32-T48 HydrophobicContact CG2-CG2 3.46Å; T32-T48 VanDerWaalsContact CG2-CG2 3.46Å; T32-I50 HydrophobicContact CG2-CG1 4.1Å
33	I	97.4	Very high	89.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.3	-172.5	-57.8	160.7	0	0	0	109.3	V24 V35 I49 L51 V84 L88 V110 V121	V24-I33 HydrophobicContact CB-CG2 4.36Å; V24-I33 HydrophobicContact CG1-CG2 3.62Å; V24-I33 HydrophobicContact CG2-CG2 3.94Å; I33-V35 HydrophobicContact CG2-CG2 4.12Å; I33-I49 PolarHBondContact N-O 2.89Å; I33-I49 PolarHBondContact O-N 3.4Å; I33-L51 HydrophobicContact CD1-CD1 4.38Å; I33-L51 HydrophobicContact CD1-CD2 4.29Å; I33-L51 HydrophobicContact CD1-CG 4.45Å; I33-V84 HydrophobicContact CD1-CG1 3.85Å; I33-V84 HydrophobicContact CG1-CG1 3.96Å; I33-L88 HydrophobicContact CD1-CD1 3.63Å; I33-V110 HydrophobicContact CD1-CG1 4.49Å; I33-V110 HydrophobicContact CD1-CG2 4.34Å; I33-V121 HydrophobicContact CD1-CG1 4.49Å
34	M	96.7	Very high	89.2	Confident	28 Å²	28	46.3 Å²	46.3	14%	0.138	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.6	170.9	-170.2	178.5	-70.5	0	0	109.8	K25 Q26 L28 E46 R47	K25-M34 HydrophobicContact CD-CG 4.49Å; K25-M34 HydrophobicContact CD-SD 3.91Å; K25-M34 PolarHBondContact N-O 2.78Å; Q26-M34 HydrophobicContact CB-CB 4.12Å; Q26-M34 PolarHBondContact N-O 2.76Å; Q26-M34 PolarHBondContact O-N 3.46Å; L28-M34 HydrophobicContact CD1-CE 4.43Å; M34-E46 HydrophobicContact CG-CB 4.48Å; M34-E46 VanDerWaalsContact SD-OE2 3.33Å; M34-R47 WeakPolarHBondContact CA-O 2.89Å
35	V	96.2	Very high	88.7	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.9	179.4	-172.3	0	0	0	0	108.4	I23 V24 I33 E46 R47 I49 V93 Y95	I23-V35 WeakPolarHBondContact O-CA 3.47Å; V24-V35 HydrophobicContact CG2-CG2 4.46Å; I33-V35 HydrophobicContact CG2-CG2 4.12Å; V35-E46 CarbonylContact O-C 3.54Å; V35-E46 WeakPolarHBondContact O-CA 3.49Å; V35-R47 PolarHBondContact N-O 3.21Å; V35-R47 PolarHBondContact O-N 2.99Å; V35-I49 HydrophobicContact CG2-CG1 4.41Å; V35-V93 HydrophobicContact CG1-CG2 4.23Å; V35-V93 HydrophobicContact CG2-CG2 4.22Å; V35-Y95 HydrophobicContact CB-CE1 4.32Å; V35-Y95 HydrophobicContact CG1-CD1 4.22Å; V35-Y95 HydrophobicContact CG1-CE1 3.73Å
36	R	93.8	Very high	88.6	Confident	26 Å²	26	52.6 Å²	52.6	10%	0.098	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.1	173.9	67.7	174.2	-178.4	74.3	-1	111	I23 K25 P44 P45 E46	I23-R36 HydrophobicContact CB-CG 4.4Å; I23-R36 PolarHBondContact N-O 3.45Å; I23-R36 PolarHBondContact O-N 3Å; K25-R36 HydrophobicContact CB-CB 4.37Å; K25-R36 HydrophobicContact CB-CG 4.07Å; R36-P44 HydrophobicContact CB-CB 4.46Å; R36-P44 HydrophobicContact CB-CG 4.25Å; R36-P44 HydrophobicContact CG-CG 4.45Å; R36-P45 WeakPolarHBondContact CA-O 3.4Å; R36-E46 HydrophobicContact CB-CG 4.1Å
37	D	88.8	Confident	88.4	Confident	41 Å²	41	53.8 Å²	53.8	22%	0.219	29%	0.29	C	S	.	.			trans	-77.5	177	171.2	-65.6	-16.2	0	0	0	110.5	P44 P45 R47	D37-P44 WeakPolarHBondContact O-CB 3.35Å; D37-P45 HydrophobicContact CB-CG 4Å; D37-P45 PolarHBondContact N-O 3.05Å; D37-P45 VanDerWaalsContact N-O 3.1Å; D37-P45 WeakPolarHBondContact OD2-CG 3.48Å; D37-R47 IonicContact OD1-NH1 2.79Å; D37-R47 PolarHBondContact OD1-NH1 2.96Å; D37-R47 IonicContact OD2-NH1 2.66Å; D37-R47 PolarHBondContact OD2-NH1 3.36Å; D37-R47 IonicContact OD2-NH2 3.33Å
38	R	83.5	Confident	88.3	Confident	158 Å²	158	56.4 Å²	56.4	60%	0.596	31%	0.305	S	S	*	.			trans	-71.7	137	171.6	-71	179.7	172.8	-128.5	2.3	108.9	I23 I40 E92	I23-R38 HydrophobicContact CD1-CG 4.18Å; R38-I40 PolarHBondContact O-N 2.95Å; R38-E92 IonicContact CZ-OE1 2.74Å; R38-E92 IonicContact NE-OE1 3.06Å; R38-E92 PolarHBondContact NE-OE1 3.34Å; R38-E92 IonicContact NH2-OE1 2.67Å; R38-E92 PolarHBondContact NH2-OE1 3.01Å; R38-E92 IonicContact NH2-OE2 3.86Å
39	P	76.9	Confident	88.4	Confident	64 Å²	64	53 Å²	53	42%	0.416	29%	0.288	S	S	.	.			trans	-65.4	124	178.8	28.6	-35.6	0	0	0	110.1	P44 F256	P39-P44 HydrophobicContact CB-CG 4.43Å; P39-F256 HydrophobicContact CB-CE1 4Å; P39-F256 HydrophobicContact CB-CZ 3.78Å; P39-F256 HydrophobicContact CG-CE1 3.88Å; P39-F256 HydrophobicContact CG-CZ 3.69Å
40	I	77.1	Confident	88.5	Confident	139 Å²	139	53.1 Å²	53.1	71%	0.713	29%	0.287	S	S	*	.	S	Bend	trans	-129.4	111.6	173.1	-58.9	173.2	0	0	0	106.5	R38 G42	R38-I40 PolarHBondContact O-N 2.95Å; I40-G42 PolarHBondContact O-N 3.37Å
41	N	67.8	Low	88.6	Confident	174 Å²	174	53.1 Å²	53.1	93%	0.93	29%	0.287	S	S	*	.	S	Bend	trans	51	30.7	176.2	-61	-19.4	0	0	0	115.8
42	G	69	Low	88.4	Confident	39 Å²	39	53 Å²	53	40%	0.402	29%	0.287	S	S	.	.	S	Bend	trans	160.6	-178.2	-179.4	0	0	0	0	0	113.1	I40	I40-G42 PolarHBondContact O-N 3.37Å
43	P	74	Confident	88.3	Confident	112 Å²	112	53 Å²	53	73%	0.727	29%	0.286	S	S	*	.	S	Bend	trans	-61.3	130.5	173.9	25.4	-31.7	0	0	0	109.4
44	P	84.7	Confident	88.3	Confident	8 Å²	8	53 Å²	53	5%	0.052	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-67.1	144.7	-177.7	26.6	-31.6	0	0	0	110.6	R36 D37 P39 F256	R36-P44 HydrophobicContact CB-CB 4.46Å; R36-P44 HydrophobicContact CB-CG 4.25Å; R36-P44 HydrophobicContact CG-CG 4.45Å; D37-P44 WeakPolarHBondContact O-CB 3.35Å; P39-P44 HydrophobicContact CB-CG 4.43Å; P44-F256 HydrophobicContact CG-CE2 3.73Å; P44-F256 HydrophobicContact CG-CZ 4.23Å
45	P	87.5	Confident	88.2	Confident	74 Å²	74	53.3 Å²	53.3	48%	0.481	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-62.2	146.2	171.8	27.3	-34.7	0	0	0	110.8	R36 D37	R36-P45 WeakPolarHBondContact CA-O 3.4Å; D37-P45 HydrophobicContact CB-CG 4Å; D37-P45 PolarHBondContact N-O 3.05Å; D37-P45 VanDerWaalsContact N-O 3.1Å; D37-P45 WeakPolarHBondContact OD2-CG 3.48Å
46	E	92.1	Very high	88.2	Confident	84 Å²	84	53.4 Å²	53.4	39%	0.393	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	144.2	-175.1	-54.5	-175	172.7	0	0	110.4	K25 M34 V35 R36	K25-E46 WeakPolarHBondContact CD-OE1 3.09Å; K25-E46 WeakPolarHBondContact CE-OE1 3.41Å; K25-E46 IonicContact NZ-OE1 2.72Å; K25-E46 PolarHBondContact NZ-OE1 3.3Å; K25-E46 IonicContact NZ-OE2 3.15Å; K25-E46 PolarHBondContact NZ-OE2 3.38Å; M34-E46 HydrophobicContact CG-CB 4.48Å; M34-E46 VanDerWaalsContact SD-OE2 3.33Å; V35-E46 CarbonylContact O-C 3.54Å; V35-E46 WeakPolarHBondContact O-CA 3.49Å; R36-E46 HydrophobicContact CB-CG 4.1Å
47	R	93.2	Very high	88	Confident	62 Å²	62	53.1 Å²	53.1	23%	0.234	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	132.4	175.6	-61.6	-174.4	-173.5	88.8	5.2	109.2	M34 V35 D37 I49 Y95	M34-R47 WeakPolarHBondContact CA-O 2.89Å; V35-R47 PolarHBondContact N-O 3.21Å; V35-R47 PolarHBondContact O-N 2.99Å; D37-R47 IonicContact OD1-NH1 2.79Å; D37-R47 PolarHBondContact OD1-NH1 2.96Å; D37-R47 IonicContact OD2-NH1 2.66Å; D37-R47 PolarHBondContact OD2-NH1 3.36Å; D37-R47 IonicContact OD2-NH2 3.33Å; R47-I49 HydrophobicContact CB-CD1 4.26Å; R47-Y95 PolarHBondContact NH1-OH 3.35Å
48	T	96.4	Very high	88.1	Confident	54 Å²	54	58.9 Å²	58.9	33%	0.331	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	119.4	170.1	-59.3	0	0	0	0	108.7	L28 T32	L28-T48 HydrophobicContact CD1-CG2 4.09Å; T32-T48 HydrophobicContact CG2-CG2 3.46Å; T32-T48 VanDerWaalsContact CG2-CG2 3.46Å
49	I	96.8	Very high	88.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.3	179.9	-52.6	-58.5	0	0	0	108.6	I33 V35 R47 Y95 I97 K106 V110	I33-I49 PolarHBondContact N-O 2.89Å; I33-I49 PolarHBondContact O-N 3.4Å; V35-I49 HydrophobicContact CG2-CG1 4.41Å; R47-I49 HydrophobicContact CB-CD1 4.26Å; I49-Y95 HydrophobicContact CD1-CD2 3.79Å; I49-Y95 HydrophobicContact CD1-CE2 3.79Å; I49-Y95 HydrophobicContact CG1-CD2 3.81Å; I49-Y95 HydrophobicContact CG1-CE2 4.06Å; I49-Y95 HydrophobicContact CG1-CG 4.49Å; I49-I97 HydrophobicContact CD1-CD1 4.46Å; I49-I97 HydrophobicContact CD1-CG1 4.02Å; I49-K106 HydrophobicContact CD1-CB 4.21Å; I49-V110 HydrophobicContact CG2-CG2 3.96Å
50	I	97.2	Very high	89.2	Confident	17 Å²	17	49.9 Å²	49.9	9%	0.087	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.3	172.6	-54.6	170.6	0	0	0	107.7	D31 T32 S52 R105 K106 Y107 G108	D31-I50 CarbonylContact O-C 3.59Å; D31-I50 VanDerWaalsContact O-CA 3.3Å; D31-I50 WeakPolarHBondContact O-CA 3.28Å; T32-I50 HydrophobicContact CG2-CG1 4.1Å; I50-S52 PolarHBondContact O-N 2.92Å; I50-R105 HydrophobicContact CD1-CB 4.06Å; I50-R105 HydrophobicContact CD1-CG 4.21Å; I50-K106 PolarHBondContact N-O 3.48Å; I50-Y107 HydrophobicContact CB-CD1 3.78Å; I50-Y107 HydrophobicContact CB-CE1 3.89Å; I50-Y107 HydrophobicContact CB-CG 4.34Å; I50-Y107 HydrophobicContact CD1-CE1 4.06Å; I50-Y107 HydrophobicContact CD1-CE2 4.25Å; I50-Y107 HydrophobicContact CG2-CD1 3.7Å; I50-Y107 HydrophobicContact CG2-CE1 3.53Å; I50-Y107 CarbonylContact O-C 3.39Å; I50-Y107 VanDerWaalsContact O-CA 3.23Å; I50-Y107 WeakPolarHBondContact O-CA 3.26Å; I50-G108 PolarHBondContact O-N 3.44Å
51	L	97.1	Very high	89.7	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	124	-178.6	-64	-178.1	0	0	0	110.5	D31 I33 I54 G108 V110 V121 A122 L125	D31-L51 HydrophobicContact CB-CB 4.41Å; D31-L51 PolarHBondContact O-N 2.9Å; I33-L51 HydrophobicContact CD1-CD1 4.38Å; I33-L51 HydrophobicContact CD1-CD2 4.29Å; I33-L51 HydrophobicContact CD1-CG 4.45Å; L51-I54 HydrophobicContact CB-CD1 3.8Å; L51-I54 HydrophobicContact CB-CG1 3.73Å; L51-I54 HydrophobicContact CD1-CD1 3.87Å; L51-I54 HydrophobicContact CG-CD1 4.49Å; L51-G108 WeakPolarHBondContact CA-O 3.48Å; L51-V110 HydrophobicContact CD2-CB 3.83Å; L51-V110 HydrophobicContact CD2-CG2 3.6Å; L51-V121 HydrophobicContact CD1-CB 4.36Å; L51-V121 HydrophobicContact CD1-CG1 3.9Å; L51-A122 HydrophobicContact CB-CB 4.34Å; L51-A122 HydrophobicContact CD1-CB 4.32Å; L51-L125 HydrophobicContact CD1-CD1 3.68Å
52	S	94.1	Very high	90.5	Very high	7 Å²	7	49 Å²	49	5%	0.049	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	142.1	-179	-77.2	0	0	0	0	111.6	I50 I54 E98 G108	I50-S52 PolarHBondContact O-N 2.92Å; S52-I54 PolarHBondContact O-N 3.29Å; S52-E98 WeakPolarHBondContact CB-OE2 3.46Å; S52-E98 PolarHBondContact OG-OE2 3.36Å; S52-G108 PolarHBondContact N-O 3.43Å; S52-G108 VanDerWaalsContact OG-CA 3.26Å; S52-G108 WeakPolarHBondContact OG-CA 3.48Å; S52-G108 PolarHBondContact OG-N 2.65Å
53	N	94.3	Very high	91.2	Very high	24 Å²	24	49.5 Å²	49.5	13%	0.128	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	7.2	169	-48.4	-41.7	0	0	0	116.7	V133 R134 Y147 L150	N53-V133 CarbonylContact O-C 3.58Å; N53-V133 WeakPolarHBondContact O-CA 3.42Å; N53-R134 PolarHBondContact O-N 3Å; N53-Y147 HydrophobicContact CB-CD2 4.11Å; N53-L150 HydrophobicContact CB-CD1 4.05Å
54	I	96.6	Very high	91.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	164.4	177.2	65.3	159	0	0	0	112.7	D31 L51 S52 A122 L125 V126 A131 E132 R134 L150	D31-I54 HydrophobicContact CB-CD1 4.47Å; D31-I54 HydrophobicContact CB-CG1 4.44Å; L51-I54 HydrophobicContact CB-CD1 3.8Å; L51-I54 HydrophobicContact CB-CG1 3.73Å; L51-I54 HydrophobicContact CD1-CD1 3.87Å; L51-I54 HydrophobicContact CG-CD1 4.49Å; S52-I54 PolarHBondContact O-N 3.29Å; I54-A122 HydrophobicContact CD1-CB 3.75Å; I54-A122 HydrophobicContact CG1-CB 4.19Å; I54-A122 HydrophobicContact CG2-CB 4.33Å; I54-L125 HydrophobicContact CD1-CB 4.37Å; I54-L125 HydrophobicContact CD1-CD1 3.78Å; I54-V126 HydrophobicContact CG2-CG2 3.75Å; I54-A131 HydrophobicContact CB-CB 4.17Å; I54-A131 HydrophobicContact CD1-CB 3.99Å; I54-E132 CarbonylContact C-O 3.58Å; I54-E132 WeakPolarHBondContact CA-O 3.21Å; I54-R134 PolarHBondContact O-NE 3.09Å; I54-R134 PolarHBondContact O-NH1 3.45Å; I54-R134 PolarHBondContact O-NH2 2.99Å; I54-L150 HydrophobicContact CG2-CD1 4.01Å; I54-L150 HydrophobicContact CG2-CD2 4.1Å
55	S	95.6	Very high	91.1	Very high	36 Å²	36	54.1 Å²	54.1	25%	0.252	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	126	175.4	-152.1	0	0	0	0	111.1	A131 E132 R134 R164	S55-A131 WeakPolarHBondContact O-CA 3.15Å; S55-E132 PolarHBondContact N-O 3.45Å; S55-E132 PolarHBondContact O-N 3Å; S55-R134 PolarHBondContact OG-NH2 3.43Å; S55-R134 VanDerWaalsContact OG-NH2 3.11Å; S55-R164 PolarHBondContact O-NH1 3.36Å
56	C	95	Very high	90.5	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.014	29%	0.291	C	S	.	.			trans	-106	2.5	-177.5	-63.9	0	0	0	0	114.2	D31 A77 A80 A131	D31-C56 HydrophobicContact CB-CB 4.17Å; D31-C56 PolarHBondContact OD2-N 3.36Å; C56-A77 WeakPolarHBondContact O-CA 3.42Å; C56-A77 WeakPolarHBondContact O-CB 3.44Å; C56-A80 HydrophobicContact CB-CB 3.86Å; C56-A131 VanDerWaalsContact SG-CB 3.55Å
57	G	91.1	Very high	89.9	Confident	21 Å²	21	52.5 Å²	52.5	22%	0.216	29%	0.289	C	S	.	.			trans	79	174.5	-175.6	0	0	0	0	0	113.2
58	R	91	Very high	89	Confident	161 Å²	161	54.6 Å²	54.6	61%	0.608	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-96.8	128.4	-176.7	-63.3	168.5	-65.1	171.3	8	110.6	E73 D74 A77	R58-E73 WeakPolarHBondContact O-CA 2.92Å; R58-D74 WeakPolarHBondContact CB-OD2 3.43Å; R58-D74 IonicContact CZ-OD1 2.72Å; R58-D74 IonicContact CZ-OD2 3.77Å; R58-D74 PolarHBondContact N-OD2 3.22Å; R58-D74 IonicContact NE-OD1 3.85Å; R58-D74 IonicContact NE-OD2 2.97Å; R58-D74 PolarHBondContact NE-OD2 3.37Å; R58-D74 IonicContact NH2-OD1 2.65Å; R58-D74 PolarHBondContact NH2-OD1 3.15Å; R58-D74 IonicContact NH2-OD2 3.67Å; R58-D74 PolarHBondContact O-N 2.83Å; R58-A77 WeakPolarHBondContact O-CB 3.46Å
59	V	92.1	Very high	87.9	Confident	16 Å²	16	58.1 Å²	58.1	10%	0.097	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-79.9	147.2	172.5	-178.6	0	0	0	0	109.5	E73 A77 W78 R81	V59-E73 WeakPolarHBondContact CG1-OE2 3.41Å; V59-A77 HydrophobicContact CG2-CB 4.19Å; V59-A77 WeakPolarHBondContact CG2-O 3.23Å; V59-W78 HydrophobicContact CG1-CE3 4.03Å; V59-R81 HydrophobicContact CG2-CB 3.99Å
60	A	90.2	Very high	87.1	Confident	18 Å²	18	58.5 Å²	58.5	15%	0.149	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-55.4	140	176.5	0	0	0	0	0	112.2	T71 E73 I175 W177	A60-T71 WeakPolarHBondContact CA-O 3.39Å; A60-E73 HydrophobicContact CB-CB 4.12Å; A60-E73 PolarHBondContact N-OE2 2.79Å; A60-I175 HydrophobicContact CB-CD1 3.61Å; A60-W177 HydrophobicContact CB-CZ2 4.19Å
61	R	87.3	Confident	86.5	Confident	184 Å²	184	60.4 Å²	60.4	69%	0.694	35%	0.349	S	S	*	.	B	Isolated β-bridge	trans	-121.3	144.6	176.5	-62.9	-179.5	174	177.6	-2.4	110.5	G70 T71	R61-G70 VanDerWaalsContact O-CA 3.27Å; R61-G70 WeakPolarHBondContact O-CA 3.23Å; R61-T71 VanDerWaalsContact CB-OG1 3.31Å; R61-T71 WeakPolarHBondContact CB-OG1 3.39Å; R61-T71 PolarHBondContact N-O 2.81Å; R61-T71 PolarHBondContact N-OG1 3.04Å; R61-T71 VanDerWaalsContact N-OG1 3.09Å; R61-T71 PolarHBondContact O-N 3.22Å; R61-T71 VanDerWaalsContact O-N 3.16Å
62	K	85.9	Confident	85.8	Confident	109 Å²	109	64.7 Å²	64.7	47%	0.474	38%	0.379	S	S	.	.			trans	-59	149.7	179.8	83	175.5	-166.7	-174.9	0	111.7	S64 W177	K62-S64 PolarHBondContact O-N 3.34Å; K62-W177 HydrophobicContact CB-CD2 3.93Å; K62-W177 HydrophobicContact CB-CE3 3.46Å; K62-W177 VanDerWaalsContact CB-CE3 3.46Å; K62-W177 HydrophobicContact CB-CH2 4.14Å; K62-W177 HydrophobicContact CB-CZ3 3.57Å
63	P	83.8	Confident	85.5	Confident	51 Å²	51	66.3 Å²	66.3	33%	0.331	39%	0.386	S	S	.	.			trans	-46.9	131.6	164.3	-33.3	39.7	0	0	0	113.2	V67 P68 W177	P63-V67 WeakPolarHBondContact CA-O 3.26Å; P63-P68 VanDerWaalsContact CB-O 3.31Å; P63-P68 WeakPolarHBondContact CB-O 3.39Å; P63-W177 HydrophobicContact CG-CG 4.35Å
64	S	80.1	Confident	85.3	Confident	61 Å²	61	67.1 Å²	67.1	43%	0.427	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-137.3	168.2	175.8	64.9	0	0	0	0	110	K62 G66 V67	K62-S64 PolarHBondContact O-N 3.34Å; S64-G66 PolarHBondContact O-N 3Å; S64-G66 VanDerWaalsContact O-N 3.09Å; S64-V67 PolarHBondContact N-O 3.21Å; S64-V67 CarbonylContact O-C 3.49Å; S64-V67 PolarHBondContact O-N 2.9Å
65	T	76	Confident	84.9	Confident	156 Å²	156	71.5 Å²	71.5	96%	0.957	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-31.3	179.6	46	0	0	0	0	113.3
66	G	75	Confident	84.7	Confident	65 Å²	65	71.1 Å²	71.1	67%	0.67	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-17.6	175.9	0	0	0	0	0	115.4	S64	S64-G66 PolarHBondContact O-N 3Å; S64-G66 VanDerWaalsContact O-N 3.09Å
67	V	78.4	Confident	84.6	Confident	58 Å²	58	71 Å²	71	35%	0.352	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-144.6	85.3	-179	-169	0	0	0	0	109.2	P63 S64 T69 G70 T71	P63-V67 WeakPolarHBondContact CA-O 3.26Å; S64-V67 PolarHBondContact N-O 3.21Å; S64-V67 CarbonylContact O-C 3.49Å; S64-V67 PolarHBondContact O-N 2.9Å; V67-T69 VanDerWaalsContact C-N 3.29Å; V67-T69 PolarHBondContact O-N 3.26Å; V67-G70 VanDerWaalsContact CG1-O 3.28Å; V67-G70 WeakPolarHBondContact CG1-O 3.43Å; V67-G70 PolarHBondContact O-N 3.49Å; V67-G70 VanDerWaalsContact O-N 3.11Å; V67-T71 HydrophobicContact CG1-CG2 4.29Å
68	P	74.8	Confident	84.7	Confident	106 Å²	106	71.4 Å²	71.4	69%	0.688	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-27.3	-170.6	-22.6	32.8	0	0	0	114.6	P63 G70	P63-P68 VanDerWaalsContact CB-O 3.31Å; P63-P68 WeakPolarHBondContact CB-O 3.39Å; P68-G70 VanDerWaalsContact C-N 3.34Å
69	T	74.6	Confident	84.8	Confident	129 Å²	129	66.8 Å²	66.8	79%	0.791	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.1	178.4	52.9	0	0	0	0	113.1	V67	V67-T69 VanDerWaalsContact C-N 3.29Å; V67-T69 PolarHBondContact O-N 3.26Å
70	G	79.5	Confident	85	Confident	8 Å²	8	66 Å²	66	8%	0.082	39%	0.387	C	S	.	.			trans	68.6	-177.4	-164.7	0	0	0	0	0	112.3	R61 V67 P68	R61-G70 VanDerWaalsContact O-CA 3.27Å; R61-G70 WeakPolarHBondContact O-CA 3.23Å; V67-G70 VanDerWaalsContact CG1-O 3.28Å; V67-G70 WeakPolarHBondContact CG1-O 3.43Å; V67-G70 PolarHBondContact O-N 3.49Å; V67-G70 VanDerWaalsContact O-N 3.11Å; P68-G70 VanDerWaalsContact C-N 3.34Å
71	T	83.1	Confident	85.3	Confident	56 Å²	56	65.3 Å²	65.3	34%	0.344	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-106	138.3	175.6	61.9	0	0	0	0	111	A60 R61 V67	A60-T71 WeakPolarHBondContact CA-O 3.39Å; R61-T71 VanDerWaalsContact CB-OG1 3.31Å; R61-T71 WeakPolarHBondContact CB-OG1 3.39Å; R61-T71 PolarHBondContact N-O 2.81Å; R61-T71 PolarHBondContact N-OG1 3.04Å; R61-T71 VanDerWaalsContact N-OG1 3.09Å; R61-T71 PolarHBondContact O-N 3.22Å; R61-T71 VanDerWaalsContact O-N 3.16Å; V67-T71 HydrophobicContact CG1-CG2 4.29Å
72	S	83.2	Confident	85.7	Confident	91 Å²	91	58.6 Å²	58.6	64%	0.636	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-66.2	154.6	172.3	60.6	0	0	0	0	111.6
73	E	87.5	Confident	86.3	Confident	40 Å²	40	56.2 Å²	56.2	19%	0.187	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-90.5	133.6	177	-171.6	148.1	77.7	0	0	110.7	R58 V59 A60 A77 W78 R173	R58-E73 WeakPolarHBondContact O-CA 2.92Å; V59-E73 WeakPolarHBondContact CG1-OE2 3.41Å; A60-E73 HydrophobicContact CB-CB 4.12Å; A60-E73 PolarHBondContact N-OE2 2.79Å; E73-A77 HydrophobicContact CG-CB 4.25Å; E73-W78 WeakPolarHBondContact OE1-CB 3.38Å; E73-R173 IonicContact OE1-CZ 2.99Å; E73-R173 IonicContact OE1-NE 3.33Å; E73-R173 PolarHBondContact OE1-NE 3.21Å; E73-R173 IonicContact OE1-NH2 2.7Å; E73-R173 IonicContact OE2-CZ 2.95Å; E73-R173 IonicContact OE2-NE 3.46Å; E73-R173 PolarHBondContact OE2-NE 3.11Å; E73-R173 IonicContact OE2-NH2 2.63Å; E73-R173 PolarHBondContact OE2-NH2 3.33Å
74	D	90.7	Very high	86.9	Confident	42 Å²	42	53.8 Å²	53.8	23%	0.225	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-74.9	146.5	170.3	-61.3	-31.6	0	0	0	109	R58 F76 A77	R58-D74 WeakPolarHBondContact CB-OD2 3.43Å; R58-D74 IonicContact CZ-OD1 2.72Å; R58-D74 IonicContact CZ-OD2 3.77Å; R58-D74 PolarHBondContact N-OD2 3.22Å; R58-D74 IonicContact NE-OD1 3.85Å; R58-D74 IonicContact NE-OD2 2.97Å; R58-D74 PolarHBondContact NE-OD2 3.37Å; R58-D74 IonicContact NH2-OD1 2.65Å; R58-D74 PolarHBondContact NH2-OD1 3.15Å; R58-D74 IonicContact NH2-OD2 3.67Å; R58-D74 PolarHBondContact O-N 2.83Å; D74-F76 PolarHBondContact O-N 3.32Å; D74-A77 HydrophobicContact CB-CB 4.33Å; D74-A77 WeakPolarHBondContact O-CB 3.27Å; D74-A77 PolarHBondContact O-N 3.49Å; D74-A77 VanDerWaalsContact O-N 3.09Å
75	P	88.5	Confident	87.8	Confident	92 Å²	92	51.1 Å²	51.1	60%	0.597	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	136.4	-179.2	-27.2	34.9	0	0	0	112.9	A77 P170	P75-A77 PolarHBondContact O-N 2.89Å; P75-A77 VanDerWaalsContact O-N 3.16Å; P75-P170 HydrophobicContact CB-CG 3.87Å
76	F	91.3	Very high	88.8	Confident	28 Å²	28	47.9 Å²	47.9	12%	0.123	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	1	-178	-61.7	-89.8	0	0	0	115.9	D74 W78 E79 A80 L130 G163 R164 P170	D74-F76 PolarHBondContact O-N 3.32Å; F76-W78 VanDerWaalsContact C-N 3.34Å; F76-W78 PolarHBondContact O-N 3.03Å; F76-E79 WeakPolarHBondContact CA-OE2 3.31Å; F76-E79 PolarHBondContact O-N 3.5Å; F76-A80 WeakPolarHBondContact O-CB 3.43Å; F76-A80 PolarHBondContact O-N 3.45Å; F76-L130 HydrophobicContact CD1-CD2 4.41Å; F76-G163 VanDerWaalsContact CE1-C 3.44Å; F76-G163 VanDerWaalsContact CZ-C 3.45Å; F76-G163 WeakPolarHBondContact CZ-O 3.14Å; F76-R164 HydrophobicContact CB-CB 4.35Å; F76-R164 HydrophobicContact CB-CG 4.04Å; F76-R164 HydrophobicContact CD2-CB 3.47Å; F76-R164 VanDerWaalsContact CD2-CB 3.47Å; F76-R164 HydrophobicContact CD2-CG 4.1Å; F76-R164 VanDerWaalsContact CE2-CA 3.41Å; F76-R164 HydrophobicContact CE2-CB 3.89Å; F76-R164 HydrophobicContact CG-CB 3.98Å; F76-R164 HydrophobicContact CG-CG 4.1Å; F76-P170 HydrophobicContact CD1-CB 4.09Å; F76-P170 HydrophobicContact CD1-CG 4.44Å; F76-P170 HydrophobicContact CD2-CB 4.15Å; F76-P170 HydrophobicContact CD2-CG 3.62Å; F76-P170 HydrophobicContact CE1-CB 3.89Å; F76-P170 HydrophobicContact CE1-CG 4.39Å; F76-P170 HydrophobicContact CE2-CB 3.97Å; F76-P170 HydrophobicContact CE2-CG 3.57Å; F76-P170 HydrophobicContact CG-CB 4.22Å; F76-P170 HydrophobicContact CG-CG 4.08Å; F76-P170 HydrophobicContact CZ-CB 3.83Å; F76-P170 HydrophobicContact CZ-CG 3.98Å
77	A	93.3	Very high	89.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.1	-35.4	-177.5	0	0	0	0	0	112.6	C56 R58 V59 E73 D74 P75 R81	C56-A77 WeakPolarHBondContact O-CA 3.42Å; C56-A77 WeakPolarHBondContact O-CB 3.44Å; R58-A77 WeakPolarHBondContact O-CB 3.46Å; V59-A77 HydrophobicContact CG2-CB 4.19Å; V59-A77 WeakPolarHBondContact CG2-O 3.23Å; E73-A77 HydrophobicContact CG-CB 4.25Å; D74-A77 HydrophobicContact CB-CB 4.33Å; D74-A77 WeakPolarHBondContact O-CB 3.27Å; D74-A77 PolarHBondContact O-N 3.49Å; D74-A77 VanDerWaalsContact O-N 3.09Å; P75-A77 PolarHBondContact O-N 2.89Å; P75-A77 VanDerWaalsContact O-N 3.16Å; A77-R81 PolarHBondContact O-N 3.03Å
78	W	93.1	Very high	90.7	Very high	28 Å²	28	43.6 Å²	43.6	11%	0.106	25%	0.252	C	S	.	.	H	α-helix	trans	-68.2	-47.4	175	174.5	-113.8	0	0	0	111.6	V59 E73 F76 A80 R81 E82 R173 F223	V59-W78 HydrophobicContact CG1-CE3 4.03Å; E73-W78 WeakPolarHBondContact OE1-CB 3.38Å; F76-W78 VanDerWaalsContact C-N 3.34Å; F76-W78 PolarHBondContact O-N 3.03Å; W78-A80 VanDerWaalsContact C-N 3.26Å; W78-A80 PolarHBondContact O-N 2.98Å; W78-R81 CarbonylContact O-C 3.6Å; W78-R81 WeakPolarHBondContact O-CB 3.39Å; W78-R81 PolarHBondContact O-N 3.48Å; W78-R81 VanDerWaalsContact O-N 3.1Å; W78-E82 VanDerWaalsContact O-CB 3.3Å; W78-E82 WeakPolarHBondContact O-CB 3.43Å; W78-E82 PolarHBondContact O-N 2.61Å; W78-R173 VanDerWaalsContact CE2-NH1 3.26Å; W78-R173 VanDerWaalsContact CZ2-NH1 3.31Å; W78-F223 HydrophobicContact CZ2-CE1 4.03Å; W78-F223 HydrophobicContact CZ2-CZ 4.4Å
79	E	93.4	Very high	91.8	Very high	64 Å²	64	39.1 Å²	39.1	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-59.9	-39.8	178	-65.3	87.7	155.8	0	0	110.8	F76 E82 F83 L130 P170	F76-E79 WeakPolarHBondContact CA-OE2 3.31Å; F76-E79 PolarHBondContact O-N 3.5Å; E79-E82 PolarHBondContact O-N 2.85Å; E79-F83 VanDerWaalsContact O-CB 3.22Å; E79-F83 WeakPolarHBondContact O-CB 3.42Å; E79-F83 PolarHBondContact O-N 3.21Å; E79-L130 HydrophobicContact CB-CD2 3.97Å; E79-P170 WeakPolarHBondContact OE1-CB 3.38Å
80	A	96	Very high	92.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-46.3	172.9	0	0	0	0	0	112.2	C56 F76 W78 E82 V84 L125 L130	C56-A80 HydrophobicContact CB-CB 3.86Å; F76-A80 WeakPolarHBondContact O-CB 3.43Å; F76-A80 PolarHBondContact O-N 3.45Å; W78-A80 VanDerWaalsContact C-N 3.26Å; W78-A80 PolarHBondContact O-N 2.98Å; A80-E82 VanDerWaalsContact C-N 3.34Å; A80-V84 WeakPolarHBondContact O-CG2 3.14Å; A80-V84 PolarHBondContact O-N 2.88Å; A80-L125 HydrophobicContact CB-CD2 4.24Å; A80-L130 HydrophobicContact CB-CB 3.97Å
81	R	96.3	Very high	93.4	Very high	4 Å²	4	39 Å²	39	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-61.6	-43.6	175.4	178.9	-176	174.3	-88.5	16.9	111.3	V27 V59 A77 W78 V84 R85 E199	V27-R81 HydrophobicContact CG1-CG 3.98Å; V27-R81 PolarHBondContact O-NE 3.43Å; V27-R81 VanDerWaalsContact O-NE 3.09Å; V59-R81 HydrophobicContact CG2-CB 3.99Å; A77-R81 PolarHBondContact O-N 3.03Å; W78-R81 CarbonylContact O-C 3.6Å; W78-R81 WeakPolarHBondContact O-CB 3.39Å; W78-R81 PolarHBondContact O-N 3.48Å; W78-R81 VanDerWaalsContact O-N 3.1Å; R81-V84 PolarHBondContact O-N 3.07Å; R81-R85 WeakPolarHBondContact O-CB 3.34Å; R81-R85 PolarHBondContact O-N 3.3Å; R81-E199 IonicContact CZ-OE1 3.28Å; R81-E199 IonicContact CZ-OE2 3.76Å; R81-E199 IonicContact NH1-OE2 2.82Å; R81-E199 IonicContact NH2-OE1 2.88Å; R81-E199 PolarHBondContact NH2-OE1 3.01Å; R81-E199 IonicContact NH2-OE2 3.56Å; R81-E199 PolarHBondContact NH2-OE2 2.7Å
82	E	95.5	Very high	93.9	Very high	43 Å²	43	39 Å²	39	20%	0.201	21%	0.214	C	C	.	.	H	α-helix	trans	-71.4	-36.6	-175.3	-171.2	62.6	-176.4	0	0	112.1	W78 E79 A80 V84 R85 T86	W78-E82 VanDerWaalsContact O-CB 3.3Å; W78-E82 WeakPolarHBondContact O-CB 3.43Å; W78-E82 PolarHBondContact O-N 2.61Å; E79-E82 PolarHBondContact O-N 2.85Å; A80-E82 VanDerWaalsContact C-N 3.34Å; E82-V84 VanDerWaalsContact C-N 3.33Å; E82-V84 PolarHBondContact O-N 3.38Å; E82-R85 VanDerWaalsContact CD-NE 3.32Å; E82-R85 PolarHBondContact O-N 2.86Å; E82-R85 IonicContact OE1-CZ 3.32Å; E82-R85 VanDerWaalsContact OE1-CZ 3.3Å; E82-R85 IonicContact OE1-NE 3.87Å; E82-R85 PolarHBondContact OE1-NE 3.47Å; E82-R85 VanDerWaalsContact OE1-NE 3.17Å; E82-R85 IonicContact OE1-NH2 2.72Å; E82-R85 PolarHBondContact OE1-NH2 3.25Å; E82-R85 IonicContact OE2-CZ 3.65Å; E82-R85 IonicContact OE2-NE 2.98Å; E82-R85 PolarHBondContact OE2-NE 3.2Å; E82-R85 IonicContact OE2-NH2 3.53Å; E82-T86 VanDerWaalsContact O-CB 3.32Å; E82-T86 WeakPolarHBondContact O-CB 3.33Å; E82-T86 PolarHBondContact O-N 3.43Å; E82-T86 PolarHBondContact O-OG1 3.23Å
83	F	97.2	Very high	94.6	Very high	59 Å²	59	34.7 Å²	34.7	26%	0.259	18%	0.184	S	C	.	.	H	α-helix	trans	-55.9	-49.1	169.4	179.4	-96.6	0	0	0	110.9	E79 L87 L125 Q128 L130	E79-F83 VanDerWaalsContact O-CB 3.22Å; E79-F83 WeakPolarHBondContact O-CB 3.42Å; E79-F83 PolarHBondContact O-N 3.21Å; F83-L87 HydrophobicContact CE1-CD2 4.3Å; F83-L87 VanDerWaalsContact O-CB 3.25Å; F83-L87 WeakPolarHBondContact O-CB 3.5Å; F83-L87 PolarHBondContact O-N 3.28Å; F83-L125 HydrophobicContact CD1-CD2 3.86Å; F83-L125 HydrophobicContact CD1-CG 4.28Å; F83-L125 HydrophobicContact CE1-CD2 4.48Å; F83-L125 HydrophobicContact CE1-CG 4.46Å; F83-Q128 HydrophobicContact CE2-CG 3.86Å; F83-Q128 HydrophobicContact CZ-CG 3.92Å; F83-L130 HydrophobicContact CB-CD1 3.6Å; F83-L130 HydrophobicContact CD1-CD1 4.15Å; F83-L130 HydrophobicContact CD2-CD1 4Å; F83-L130 HydrophobicContact CG-CD1 3.65Å
84	V	98.1	Very high	95	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-70.8	-39.2	180	178.8	0	0	0	0	112.2	V27 G30 I33 A80 R81 E82 L87 L88 V121 L125	V27-V84 HydrophobicContact CG1-CB 3.92Å; V27-V84 HydrophobicContact CG1-CG1 3.71Å; V27-V84 HydrophobicContact CG2-CG1 3.96Å; G30-V84 WeakPolarHBondContact O-CG2 3.46Å; I33-V84 HydrophobicContact CD1-CG1 3.85Å; I33-V84 HydrophobicContact CG1-CG1 3.96Å; A80-V84 WeakPolarHBondContact O-CG2 3.14Å; A80-V84 PolarHBondContact O-N 2.88Å; R81-V84 PolarHBondContact O-N 3.07Å; E82-V84 VanDerWaalsContact C-N 3.33Å; E82-V84 PolarHBondContact O-N 3.38Å; V84-L87 PolarHBondContact O-N 3.13Å; V84-L88 HydrophobicContact CG1-CD1 3.65Å; V84-L88 HydrophobicContact CG1-CG 4.23Å; V84-L88 WeakPolarHBondContact O-CB 3.36Å; V84-L88 PolarHBondContact O-N 3.01Å; V84-V121 HydrophobicContact CG1-CG1 4.45Å; V84-V121 HydrophobicContact CG2-CG1 4.22Å; V84-L125 HydrophobicContact CG2-CD1 3.83Å; V84-L125 HydrophobicContact CG2-CD2 3.8Å; V84-L125 HydrophobicContact CG2-CG 4.03Å
85	R	97.6	Very high	95.2	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-57.3	-53	174.7	-174.1	-167.8	73.1	84.5	-5.3	110.1	V27 R81 E82 L87 L88 I89 Q264 D266	V27-R85 HydrophobicContact CB-CB 4.49Å; V27-R85 HydrophobicContact CG2-CB 4.39Å; R81-R85 WeakPolarHBondContact O-CB 3.34Å; R81-R85 PolarHBondContact O-N 3.3Å; E82-R85 VanDerWaalsContact CD-NE 3.32Å; E82-R85 PolarHBondContact O-N 2.86Å; E82-R85 IonicContact OE1-CZ 3.32Å; E82-R85 VanDerWaalsContact OE1-CZ 3.3Å; E82-R85 IonicContact OE1-NE 3.87Å; E82-R85 PolarHBondContact OE1-NE 3.47Å; E82-R85 VanDerWaalsContact OE1-NE 3.17Å; E82-R85 IonicContact OE1-NH2 2.72Å; E82-R85 PolarHBondContact OE1-NH2 3.25Å; E82-R85 IonicContact OE2-CZ 3.65Å; E82-R85 IonicContact OE2-NE 2.98Å; E82-R85 PolarHBondContact OE2-NE 3.2Å; E82-R85 IonicContact OE2-NH2 3.53Å; R85-L87 VanDerWaalsContact C-N 3.27Å; R85-L87 PolarHBondContact O-N 3.01Å; R85-L88 PolarHBondContact O-N 2.68Å; R85-I89 HydrophobicContact CG-CB 4.2Å; R85-I89 HydrophobicContact CG-CG2 4.31Å; R85-I89 VanDerWaalsContact O-CB 3.25Å; R85-I89 WeakPolarHBondContact O-CB 3.01Å; R85-I89 WeakPolarHBondContact O-CG2 3.49Å; R85-I89 PolarHBondContact O-N 3.31Å; R85-Q264 WeakPolarHBondContact CD-O 3.43Å; R85-Q264 HydrophobicContact CG-CB 4.14Å; R85-Q264 PolarHBondContact NH1-O 2.77Å; R85-D266 IonicContact CZ-OD1 3.86Å; R85-D266 IonicContact CZ-OD2 3.39Å; R85-D266 IonicContact NH1-OD1 2.77Å; R85-D266 IonicContact NH1-OD2 3.94Å; R85-D266 PolarHBondContact NH1-OD2 2.96Å; R85-D266 IonicContact NH2-OD1 3.71Å; R85-D266 PolarHBondContact NH2-OD1 3.11Å; R85-D266 IonicContact NH2-OD2 3.54Å; R85-D266 PolarHBondContact NH2-OD2 2.96Å
86	T	96.8	Very high	95.4	Very high	89 Å²	89	26.8 Å²	26.8	55%	0.546	14%	0.138	S	C	.	.	H	α-helix	trans	-60.2	-40.4	179.4	-55.8	0	0	0	0	111.3	E82	E82-T86 VanDerWaalsContact O-CB 3.32Å; E82-T86 WeakPolarHBondContact O-CB 3.33Å; E82-T86 PolarHBondContact O-N 3.43Å; E82-T86 PolarHBondContact O-OG1 3.23Å
87	L	96.8	Very high	95.5	Very high	32 Å²	32	26.3 Å²	26.3	17%	0.168	14%	0.136	C	C	.	.	H	α-helix	trans	-69.5	-40.7	-179.6	-175	61	0	0	0	112.5	F83 V84 R85 K91 V112	F83-L87 HydrophobicContact CE1-CD2 4.3Å; F83-L87 VanDerWaalsContact O-CB 3.25Å; F83-L87 WeakPolarHBondContact O-CB 3.5Å; F83-L87 PolarHBondContact O-N 3.28Å; V84-L87 PolarHBondContact O-N 3.13Å; R85-L87 VanDerWaalsContact C-N 3.27Å; R85-L87 PolarHBondContact O-N 3.01Å; L87-K91 VanDerWaalsContact O-CD 3.26Å; L87-K91 WeakPolarHBondContact O-CD 3.37Å; L87-K91 VanDerWaalsContact O-CE 3.25Å; L87-K91 WeakPolarHBondContact O-CE 3.49Å; L87-K91 PolarHBondContact O-NZ 3.12Å; L87-V112 HydrophobicContact CD1-CG2 4.36Å; L87-V112 HydrophobicContact CD2-CG2 4.08Å; L87-V112 HydrophobicContact CG-CG2 4.18Å
88	L	97.3	Very high	95.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-119.4	-22.6	-161.5	-59.6	-176	0	0	0	116.5	V24 I33 V84 R85 G90 K91 V93 V110 V112 V121	V24-L88 HydrophobicContact CB-CB 4.23Å; V24-L88 WeakPolarHBondContact CB-O 3.41Å; V24-L88 HydrophobicContact CG1-CB 4.1Å; V24-L88 HydrophobicContact CG2-CB 3.99Å; V24-L88 HydrophobicContact CG2-CD1 4.44Å; I33-L88 HydrophobicContact CD1-CD1 3.63Å; V84-L88 HydrophobicContact CG1-CD1 3.65Å; V84-L88 HydrophobicContact CG1-CG 4.23Å; V84-L88 WeakPolarHBondContact O-CB 3.36Å; V84-L88 PolarHBondContact O-N 3.01Å; R85-L88 PolarHBondContact O-N 2.68Å; L88-G90 PolarHBondContact O-N 3.22Å; L88-G90 VanDerWaalsContact O-N 3.15Å; L88-K91 WeakPolarHBondContact O-CB 3.17Å; L88-K91 PolarHBondContact O-N 2.86Å; L88-V93 HydrophobicContact CD2-CG1 3.94Å; L88-V110 HydrophobicContact CD1-CG1 4.48Å; L88-V112 HydrophobicContact CD2-CG2 3.8Å; L88-V121 HydrophobicContact CD1-CG1 4.1Å; L88-V121 HydrophobicContact CD1-CG2 3.86Å; L88-V121 HydrophobicContact CD2-CG2 4.01Å; L88-V121 HydrophobicContact CG-CG2 4.43Å
89	I	97.1	Very high	95.1	Very high	13 Å²	13	29.6 Å²	29.6	7%	0.067	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	122.8	-165.8	-166.3	62.6	0	0	0	112.8	V24 K25 R85 K91 Q264 R265	V24-I89 HydrophobicContact CG1-CD1 4.46Å; K25-I89 WeakPolarHBondContact O-CD1 3.47Å; R85-I89 HydrophobicContact CG-CB 4.2Å; R85-I89 HydrophobicContact CG-CG2 4.31Å; R85-I89 VanDerWaalsContact O-CB 3.25Å; R85-I89 WeakPolarHBondContact O-CB 3.01Å; R85-I89 WeakPolarHBondContact O-CG2 3.49Å; R85-I89 PolarHBondContact O-N 3.31Å; I89-K91 PolarHBondContact O-N 3.19Å; I89-Q264 HydrophobicContact CD1-CB 3.75Å; I89-Q264 HydrophobicContact CG1-CB 3.81Å; I89-R265 PolarHBondContact O-NH2 3.25Å
90	G	93.5	Very high	95	Very high	34 Å²	34	30.3 Å²	30.3	35%	0.351	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	15.9	-175	0	0	0	0	0	116.7	V24 L88	V24-G90 VanDerWaalsContact O-CA 3.22Å; V24-G90 WeakPolarHBondContact O-CA 3.37Å; V24-G90 PolarHBondContact O-N 2.89Å; L88-G90 PolarHBondContact O-N 3.22Å; L88-G90 VanDerWaalsContact O-N 3.15Å
91	K	94.7	Very high	94.6	Very high	101 Å²	101	33.6 Å²	33.6	44%	0.439	18%	0.175	S	C	.	.			trans	-89.1	156.2	168.2	-59.4	-173	-169.4	164.7	0	110.7	I23 V24 L87 L88 I89	I23-K91 WeakPolarHBondContact CA-O 3.33Å; V24-K91 PolarHBondContact N-O 3.26Å; L87-K91 VanDerWaalsContact O-CD 3.26Å; L87-K91 WeakPolarHBondContact O-CD 3.37Å; L87-K91 VanDerWaalsContact O-CE 3.25Å; L87-K91 WeakPolarHBondContact O-CE 3.49Å; L87-K91 PolarHBondContact O-NZ 3.12Å; L88-K91 WeakPolarHBondContact O-CB 3.17Å; L88-K91 PolarHBondContact O-N 2.86Å; I89-K91 PolarHBondContact O-N 3.19Å
92	E	94.6	Very high	94	Very high	56 Å²	56	37.8 Å²	37.8	26%	0.262	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	134.7	170.6	-69.9	-177.1	135.5	0	0	110.3	G22 I23 R38 G113 K114	G22-E92 CarbonylContact O-C 3.57Å; G22-E92 WeakPolarHBondContact O-CA 3.34Å; I23-E92 HydrophobicContact CG1-CG 3.89Å; R38-E92 IonicContact CZ-OE1 2.74Å; R38-E92 IonicContact NE-OE1 3.06Å; R38-E92 PolarHBondContact NE-OE1 3.34Å; R38-E92 IonicContact NH2-OE1 2.67Å; R38-E92 PolarHBondContact NH2-OE1 3.01Å; R38-E92 IonicContact NH2-OE2 3.86Å; E92-G113 WeakPolarHBondContact O-CA 3.33Å; E92-G113 PolarHBondContact O-N 3.15Å; E92-G113 VanDerWaalsContact O-N 3.16Å; E92-K114 WeakPolarHBondContact OE2-CE 3.47Å; E92-K114 IonicContact OE2-NZ 3.41Å; E92-K114 PolarHBondContact OE2-NZ 3.07Å
93	V	96.8	Very high	93.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.8	179	-64.6	0	0	0	0	110.6	G22 V24 V35 L88 Y95 V110 Y111 G113	G22-V93 PolarHBondContact N-O 3.38Å; G22-V93 VanDerWaalsContact N-O 3.08Å; G22-V93 PolarHBondContact O-N 2.75Å; V24-V93 HydrophobicContact CG2-CB 4.29Å; V24-V93 HydrophobicContact CG2-CG1 3.64Å; V24-V93 HydrophobicContact CG2-CG2 3.62Å; V35-V93 HydrophobicContact CG1-CG2 4.23Å; V35-V93 HydrophobicContact CG2-CG2 4.22Å; L88-V93 HydrophobicContact CD2-CG1 3.94Å; V93-Y95 HydrophobicContact CG2-CD1 4.48Å; V93-V110 HydrophobicContact CB-CG1 3.88Å; V93-V110 HydrophobicContact CG1-CG1 4.11Å; V93-V110 HydrophobicContact CG2-CG1 4.09Å; V93-Y111 WeakPolarHBondContact CA-O 3.27Å; V93-Y111 WeakPolarHBondContact CB-O 3.4Å; V93-G113 CarbonylContact C-O 3.6Å; V93-G113 WeakPolarHBondContact CA-O 3.38Å
94	C	95.5	Very high	93	Very high	6 Å²	6	38.9 Å²	38.9	4%	0.041	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.7	169.3	-178	0	0	0	0	107.7	F20 L21 Y111 G113	F20-C94 CarbonylContact O-C 3.15Å; F20-C94 WeakPolarHBondContact O-CA 3.37Å; L21-C94 HydrophobicContact CD2-CB 4.4Å; C94-Y111 PolarHBondContact N-O 3.3Å; C94-Y111 VanDerWaalsContact N-O 3.09Å; C94-Y111 PolarHBondContact O-N 3.43Å; C94-G113 PolarHBondContact N-O 3.14Å
95	Y	95.1	Very high	92.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	155.3	-177.7	68	-82.6	0	0	0	112.3	Y19 F20 V35 R47 I49 V93 C109	Y19-Y95 CarbonylContact C-O 3.56Å; Y19-Y95 WeakPolarHBondContact CA-O 3.44Å; F20-Y95 HydrophobicContact CB-CD1 4.04Å; F20-Y95 HydrophobicContact CB-CD2 4.18Å; F20-Y95 HydrophobicContact CB-CE1 3.54Å; F20-Y95 HydrophobicContact CB-CE2 3.71Å; F20-Y95 HydrophobicContact CB-CG 4.34Å; F20-Y95 HydrophobicContact CD2-CD2 4.29Å; F20-Y95 AromaticContact CD2-CE2 3.94Å; F20-Y95 HydrophobicContact CD2-CE2 3.94Å; F20-Y95 HydrophobicContact CG-CE2 4.08Å; F20-Y95 PolarHBondContact N-O 3.3Å; F20-Y95 WeakPolarHBondContact O-CD1 3.47Å; F20-Y95 PolarHBondContact O-N 2.92Å; V35-Y95 HydrophobicContact CB-CE1 4.32Å; V35-Y95 HydrophobicContact CG1-CD1 4.22Å; V35-Y95 HydrophobicContact CG1-CE1 3.73Å; R47-Y95 PolarHBondContact NH1-OH 3.35Å; I49-Y95 HydrophobicContact CD1-CD2 3.79Å; I49-Y95 HydrophobicContact CD1-CE2 3.79Å; I49-Y95 HydrophobicContact CG1-CD2 3.81Å; I49-Y95 HydrophobicContact CG1-CE2 4.06Å; I49-Y95 HydrophobicContact CG1-CG 4.49Å; V93-Y95 HydrophobicContact CG2-CD1 4.48Å; Y95-C109 CarbonylContact C-O 3.54Å; Y95-C109 WeakPolarHBondContact CA-O 3.48Å; Y95-C109 VanDerWaalsContact CB-O 3.29Å; Y95-C109 WeakPolarHBondContact CB-O 3.19Å
96	S	93.7	Very high	92.6	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.007	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	160.4	173.1	60.1	0	0	0	0	110.5	G108 C109	S96-G108 WeakPolarHBondContact O-CA 3.49Å; S96-C109 PolarHBondContact N-O 3.06Å; S96-C109 PolarHBondContact OG-N 3.1Å
97	I	93	Very high	92.4	Very high	18 Å²	18	45.3 Å²	45.3	9%	0.092	25%	0.246	C	C	.	.			trans	-115.3	110	167.6	-61.5	163	0	0	0	106.5	F20 I49 K106	F20-I97 HydrophobicContact CD2-CD1 4.5Å; F20-I97 HydrophobicContact CE2-CD1 4.06Å; F20-I97 HydrophobicContact CE2-CG1 4.37Å; I49-I97 HydrophobicContact CD1-CD1 4.46Å; I49-I97 HydrophobicContact CD1-CG1 4.02Å; I97-K106 HydrophobicContact CD1-CD 3.92Å; I97-K106 HydrophobicContact CG1-CB 4.48Å; I97-K106 HydrophobicContact CG2-CB 4.17Å; I97-K106 HydrophobicContact CG2-CG 4.31Å
98	E	89.8	Confident	92.3	Very high	44 Å²	44	43.8 Å²	43.8	21%	0.206	24%	0.238	C	C	.	.			trans	-90.9	-36.1	-178	-64.4	175.4	172	0	0	111.3	S52 Y107 C109	S52-E98 WeakPolarHBondContact CB-OE2 3.46Å; S52-E98 PolarHBondContact OG-OE2 3.36Å; E98-Y107 PolarHBondContact N-O 3.44Å; E98-C109 PolarHBondContact OE1-SG 2.9Å
99	T	89.1	Confident	92.2	Very high	53 Å²	53	44 Å²	44	33%	0.325	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	130.1	-178.5	-59	0	0	0	0	110.1	A11 Y107	A11-T99 HydrophobicContact CB-CG2 3.99Å; T99-Y107 PolarHBondContact N-O 3.28Å; T99-Y107 VanDerWaalsContact N-O 3.14Å; T99-Y107 PolarHBondContact O-N 2.93Å
100	E	90.4	Very high	92.1	Very high	80 Å²	80	43.3 Å²	43.3	37%	0.374	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119	170.5	-174.9	162.6	-169.8	0	0	108.7	K106	E100-K106 HydrophobicContact CB-CG 4.48Å; E100-K106 HydrophobicContact CG-CG 4.05Å; E100-K106 WeakPolarHBondContact OE1-CE 3.26Å; E100-K106 IonicContact OE1-NZ 3.73Å
101	Q	88.8	Confident	92.3	Very high	68 Å²	68	43 Å²	43	32%	0.318	22%	0.224	S	C	.	.			trans	-77.5	154.7	175.7	-70.1	-177.3	-14.6	0	0	110.2	S103 G104 R105 Y107	Q101-S103 WeakPolarHBondContact CB-OG 3.34Å; Q101-S103 PolarHBondContact O-N 3Å; Q101-G104 PolarHBondContact O-N 2.91Å; Q101-R105 HydrophobicContact CB-CB 4.38Å; Q101-R105 PolarHBondContact N-O 3.19Å; Q101-Y107 VanDerWaalsContact CD-CE2 3.42Å; Q101-Y107 HydrophobicContact CG-CD2 4.34Å; Q101-Y107 HydrophobicContact CG-CE2 3.85Å
102	P	82.8	Confident	92.3	Very high	92 Å²	92	39.9 Å²	39.9	60%	0.597	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-22.9	173.7	-26.2	34.1	0	0	0	114.1	E9 G104	E9-P102 HydrophobicContact CB-CG 4.44Å; E9-P102 WeakPolarHBondContact O-CG 3.43Å; P102-G104 PolarHBondContact O-N 3.43Å
103	S	85.5	Confident	92.3	Very high	81 Å²	81	38.4 Å²	38.4	57%	0.566	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-3.5	172.9	61.3	0	0	0	0	114.6	Q101 R105	Q101-S103 WeakPolarHBondContact CB-OG 3.34Å; Q101-S103 PolarHBondContact O-N 3Å; S103-R105 VanDerWaalsContact C-N 3.27Å; S103-R105 PolarHBondContact O-N 3.15Å; S103-R105 WeakPolarHBondContact OG-CG 3.46Å
104	G	87.2	Confident	91.9	Very high	44 Å²	44	44 Å²	44	45%	0.454	24%	0.238	S	C	.	.	S	Bend	trans	80.1	1.8	-172.9	0	0	0	0	0	114.2	Q101 P102 K106	Q101-G104 PolarHBondContact O-N 2.91Å; P102-G104 PolarHBondContact O-N 3.43Å; G104-K106 PolarHBondContact O-N 2.99Å
105	R	91	Very high	91.7	Very high	145 Å²	145	48.8 Å²	48.8	55%	0.547	26%	0.263	S	S	.	.			trans	-72.8	123.8	176.9	-70.3	-177.5	-179.1	-177.6	1.9	110.5	I50 Q101 S103 Y107	I50-R105 HydrophobicContact CD1-CB 4.06Å; I50-R105 HydrophobicContact CD1-CG 4.21Å; Q101-R105 HydrophobicContact CB-CB 4.38Å; Q101-R105 PolarHBondContact N-O 3.19Å; S103-R105 VanDerWaalsContact C-N 3.27Å; S103-R105 PolarHBondContact O-N 3.15Å; S103-R105 WeakPolarHBondContact OG-CG 3.46Å; R105-Y107 HydrophobicContact CB-CE2 3.91Å
106	K	94.4	Very high	91.3	Very high	48 Å²	48	53 Å²	53	21%	0.209	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	120.2	-177.7	-65.5	172.8	177.6	-173.9	0	109.9	I49 I50 I97 E100 G104	I49-K106 HydrophobicContact CD1-CB 4.21Å; I50-K106 PolarHBondContact N-O 3.48Å; I97-K106 HydrophobicContact CD1-CD 3.92Å; I97-K106 HydrophobicContact CG1-CB 4.48Å; I97-K106 HydrophobicContact CG2-CB 4.17Å; I97-K106 HydrophobicContact CG2-CG 4.31Å; E100-K106 HydrophobicContact CB-CG 4.48Å; E100-K106 HydrophobicContact CG-CG 4.05Å; E100-K106 WeakPolarHBondContact OE1-CE 3.26Å; E100-K106 IonicContact OE1-NZ 3.73Å; G104-K106 PolarHBondContact O-N 2.99Å
107	Y	94.3	Very high	91.1	Very high	35 Å²	35	58.1 Å²	58.1	14%	0.137	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.7	175.1	-64.3	-99	0	0	0	109.8	I50 E98 T99 Q101 R105	I50-Y107 HydrophobicContact CB-CD1 3.78Å; I50-Y107 HydrophobicContact CB-CE1 3.89Å; I50-Y107 HydrophobicContact CB-CG 4.34Å; I50-Y107 HydrophobicContact CD1-CE1 4.06Å; I50-Y107 HydrophobicContact CD1-CE2 4.25Å; I50-Y107 HydrophobicContact CG2-CD1 3.7Å; I50-Y107 HydrophobicContact CG2-CE1 3.53Å; I50-Y107 CarbonylContact O-C 3.39Å; I50-Y107 VanDerWaalsContact O-CA 3.23Å; I50-Y107 WeakPolarHBondContact O-CA 3.26Å; E98-Y107 PolarHBondContact N-O 3.44Å; T99-Y107 PolarHBondContact N-O 3.28Å; T99-Y107 VanDerWaalsContact N-O 3.14Å; T99-Y107 PolarHBondContact O-N 2.93Å; Q101-Y107 VanDerWaalsContact CD-CE2 3.42Å; Q101-Y107 HydrophobicContact CG-CD2 4.34Å; Q101-Y107 HydrophobicContact CG-CE2 3.85Å; R105-Y107 HydrophobicContact CB-CE2 3.91Å
108	G	94.2	Very high	90.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	-167.4	176.1	0	0	0	0	0	114	I50 L51 S52 S96	I50-G108 PolarHBondContact O-N 3.44Å; L51-G108 WeakPolarHBondContact CA-O 3.48Å; S52-G108 PolarHBondContact N-O 3.43Å; S52-G108 VanDerWaalsContact OG-CA 3.26Å; S52-G108 WeakPolarHBondContact OG-CA 3.48Å; S52-G108 PolarHBondContact OG-N 2.65Å; S96-G108 WeakPolarHBondContact O-CA 3.49Å
109	C	94	Very high	91.1	Very high	4 Å²	4	60.7 Å²	60.7	3%	0.027	34%	0.339	C	S	.	.			trans	-102.2	147.2	179.9	-71	0	0	0	0	111	Y95 S96 E98 Y111	Y95-C109 CarbonylContact C-O 3.54Å; Y95-C109 WeakPolarHBondContact CA-O 3.48Å; Y95-C109 VanDerWaalsContact CB-O 3.29Å; Y95-C109 WeakPolarHBondContact CB-O 3.19Å; S96-C109 PolarHBondContact N-O 3.06Å; S96-C109 PolarHBondContact OG-N 3.1Å; E98-C109 PolarHBondContact OE1-SG 2.9Å; C109-Y111 HydrophobicContact CB-CD2 4.49Å; C109-Y111 HydrophobicContact CB-CE2 3.65Å
110	V	96.6	Very high	91.4	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.3	173.6	-178.8	0	0	0	0	108.5	I33 I49 L51 L88 V93 V121	I33-V110 HydrophobicContact CD1-CG1 4.49Å; I33-V110 HydrophobicContact CD1-CG2 4.34Å; I49-V110 HydrophobicContact CG2-CG2 3.96Å; L51-V110 HydrophobicContact CD2-CB 3.83Å; L51-V110 HydrophobicContact CD2-CG2 3.6Å; L88-V110 HydrophobicContact CD1-CG1 4.48Å; V93-V110 HydrophobicContact CB-CG1 3.88Å; V93-V110 HydrophobicContact CG1-CG1 4.11Å; V93-V110 HydrophobicContact CG2-CG1 4.09Å; V110-V121 HydrophobicContact CB-CG2 4.29Å; V110-V121 HydrophobicContact CG1-CG2 4.09Å; V110-V121 WeakPolarHBondContact O-CG2 3.45Å; V110-V121 PolarHBondContact O-N 3.07Å
111	Y	97	Very high	91.7	Very high	27 Å²	27	55 Å²	55	11%	0.106	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	137.4	-179.9	-58.1	-92.5	0	0	0	110.1	Y19 V93 C94 C109 G113 I116 E119 N120	Y19-Y111 HydrophobicContact CE1-CE2 4.24Å; V93-Y111 WeakPolarHBondContact CA-O 3.27Å; V93-Y111 WeakPolarHBondContact CB-O 3.4Å; C94-Y111 PolarHBondContact N-O 3.3Å; C94-Y111 VanDerWaalsContact N-O 3.09Å; C94-Y111 PolarHBondContact O-N 3.43Å; C109-Y111 HydrophobicContact CB-CD2 4.49Å; C109-Y111 HydrophobicContact CB-CE2 3.65Å; Y111-G113 PolarHBondContact O-N 3.35Å; Y111-I116 HydrophobicContact CD2-CG2 4.18Å; Y111-I116 HydrophobicContact CE2-CG2 4.15Å; Y111-E119 CarbonylContact C-O 3.58Å; Y111-E119 VanDerWaalsContact CA-O 3.28Å; Y111-E119 WeakPolarHBondContact CA-O 3.29Å; Y111-N120 HydrophobicContact CD1-CB 4.01Å; Y111-N120 HydrophobicContact CE1-CB 3.86Å
112	V	95.4	Very high	92.1	Very high	35 Å²	35	51.9 Å²	51.9	21%	0.212	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	123.5	177.1	-178.8	0	0	0	0	110.1	L87 L88 G118 E119 V121	L87-V112 HydrophobicContact CD1-CG2 4.36Å; L87-V112 HydrophobicContact CD2-CG2 4.08Å; L87-V112 HydrophobicContact CG-CG2 4.18Å; L88-V112 HydrophobicContact CD2-CG2 3.8Å; V112-G118 VanDerWaalsContact O-CA 3.24Å; V112-G118 WeakPolarHBondContact O-CA 3.2Å; V112-E119 HydrophobicContact CB-CB 4.2Å; V112-E119 HydrophobicContact CG2-CB 4Å; V112-E119 PolarHBondContact N-O 2.97Å; V112-V121 HydrophobicContact CG2-CG2 4.09Å
113	G	93	Very high	92.8	Very high	26 Å²	26	49.1 Å²	49.1	27%	0.268	28%	0.275	S	S	.	.	S	Bend	trans	95.9	-164.5	179.7	0	0	0	0	0	113.4	E92 V93 C94 Y111	E92-G113 WeakPolarHBondContact O-CA 3.33Å; E92-G113 PolarHBondContact O-N 3.15Å; E92-G113 VanDerWaalsContact O-N 3.16Å; V93-G113 CarbonylContact C-O 3.6Å; V93-G113 WeakPolarHBondContact CA-O 3.38Å; C94-G113 PolarHBondContact N-O 3.14Å; Y111-G113 PolarHBondContact O-N 3.35Å
114	K	90.4	Very high	93.3	Very high	117 Å²	117	45.4 Å²	45.4	51%	0.509	25%	0.249	S	C	.	.	S	Bend	trans	-88.5	-13.7	-168	-66.4	178.1	176	177.4	0	114.9	L21 E92	L21-K114 HydrophobicContact CD2-CB 4.04Å; L21-K114 HydrophobicContact CD2-CG 4.36Å; L21-K114 WeakPolarHBondContact CD2-O 3.49Å; E92-K114 WeakPolarHBondContact OE2-CE 3.47Å; E92-K114 IonicContact OE2-NZ 3.41Å; E92-K114 PolarHBondContact OE2-NZ 3.07Å
115	N	89.5	Confident	93.8	Very high	106 Å²	106	43.3 Å²	43.3	57%	0.567	23%	0.227	S	C	*	.	S	Bend	trans	-133.7	162.9	-173.4	-62.1	-21.8	0	0	0	110.1	S117 G118	N115-S117 PolarHBondContact O-N 3.16Å; N115-S117 VanDerWaalsContact O-N 3.11Å; N115-G118 PolarHBondContact O-N 2.99Å; N115-G118 VanDerWaalsContact O-N 3.13Å
116	I	88.1	Confident	94.2	Very high	88 Å²	88	36.4 Å²	36.4	45%	0.451	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-6.6	175.9	61.7	170.1	0	0	0	114.5	Y19 Y111 G118	Y19-I116 HydrophobicContact CD1-CG2 3.53Å; Y19-I116 HydrophobicContact CD2-CG2 4.34Å; Y19-I116 HydrophobicContact CE1-CG2 3.37Å; Y19-I116 HydrophobicContact CE2-CG2 4.2Å; Y19-I116 HydrophobicContact CG-CG2 4.03Å; Y111-I116 HydrophobicContact CD2-CG2 4.18Å; Y111-I116 HydrophobicContact CE2-CG2 4.15Å; I116-G118 PolarHBondContact O-N 2.84Å
117	S	88.3	Confident	94.3	Very high	110 Å²	110	37.8 Å²	37.8	77%	0.769	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.1	171.7	60.5	0	0	0	0	112.8	N115	N115-S117 PolarHBondContact O-N 3.16Å; N115-S117 VanDerWaalsContact O-N 3.11Å
118	G	89.1	Confident	94.4	Very high	24 Å²	24	40.1 Å²	40.1	25%	0.247	22%	0.221	C	C	.	.	S	Bend	trans	-68.7	167.5	174.4	0	0	0	0	0	113.3	V112 N115 I116 N120	V112-G118 VanDerWaalsContact O-CA 3.24Å; V112-G118 WeakPolarHBondContact O-CA 3.2Å; N115-G118 PolarHBondContact O-N 2.99Å; N115-G118 VanDerWaalsContact O-N 3.13Å; I116-G118 PolarHBondContact O-N 2.84Å; G118-N120 PolarHBondContact O-N 2.93Å
119	E	93.1	Very high	94.4	Very high	92 Å²	92	40.1 Å²	40.1	43%	0.43	22%	0.221	S	C	.	.			trans	-61	128.7	174.7	-177.7	-177.6	175.5	0	0	110.9	Y111 V112 V121 S124	Y111-E119 CarbonylContact C-O 3.58Å; Y111-E119 VanDerWaalsContact CA-O 3.28Å; Y111-E119 WeakPolarHBondContact CA-O 3.29Å; V112-E119 HydrophobicContact CB-CB 4.2Å; V112-E119 HydrophobicContact CG2-CB 4Å; V112-E119 PolarHBondContact N-O 2.97Å; E119-V121 PolarHBondContact O-N 3.14Å; E119-S124 WeakPolarHBondContact CG-OG 3.26Å; E119-S124 WeakPolarHBondContact OE1-CB 3.12Å; E119-S124 PolarHBondContact OE1-OG 2.79Å
120	N	95.9	Very high	94.5	Very high	13 Å²	13	40.7 Å²	40.7	7%	0.07	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-78.6	112.9	174.7	-178.3	-28.3	0	0	0	109.5	Y111 G118 A122 L123 S124	Y111-N120 HydrophobicContact CD1-CB 4.01Å; Y111-N120 HydrophobicContact CE1-CB 3.86Å; G118-N120 PolarHBondContact O-N 2.93Å; N120-A122 VanDerWaalsContact C-N 3.26Å; N120-A122 PolarHBondContact O-N 3.04Å; N120-A122 WeakPolarHBondContact OD1-CB 3.33Å; N120-A122 PolarHBondContact OD1-N 2.91Å; N120-L123 HydrophobicContact CB-CB 4.03Å; N120-L123 WeakPolarHBondContact O-CA 3.41Å; N120-L123 WeakPolarHBondContact O-CB 3.3Å; N120-L123 PolarHBondContact O-N 2.86Å; N120-S124 PolarHBondContact O-N 3.23Å; N120-S124 VanDerWaalsContact O-N 3.07Å; N120-S124 PolarHBondContact O-OG 3.49Å; N120-S124 VanDerWaalsContact O-OG 3.11Å
121	V	97.3	Very high	94.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.6	-36.5	-173.3	179.6	0	0	0	0	112.3	I33 L51 V84 L88 V110 V112 E119 L123 S124 L125	I33-V121 HydrophobicContact CD1-CG1 4.49Å; L51-V121 HydrophobicContact CD1-CB 4.36Å; L51-V121 HydrophobicContact CD1-CG1 3.9Å; V84-V121 HydrophobicContact CG1-CG1 4.45Å; V84-V121 HydrophobicContact CG2-CG1 4.22Å; L88-V121 HydrophobicContact CD1-CG1 4.1Å; L88-V121 HydrophobicContact CD1-CG2 3.86Å; L88-V121 HydrophobicContact CD2-CG2 4.01Å; L88-V121 HydrophobicContact CG-CG2 4.43Å; V110-V121 HydrophobicContact CB-CG2 4.29Å; V110-V121 HydrophobicContact CG1-CG2 4.09Å; V110-V121 WeakPolarHBondContact O-CG2 3.45Å; V110-V121 PolarHBondContact O-N 3.07Å; V112-V121 HydrophobicContact CG2-CG2 4.09Å; E119-V121 PolarHBondContact O-N 3.14Å; V121-L123 VanDerWaalsContact C-N 3.31Å; V121-L123 PolarHBondContact O-N 3.34Å; V121-S124 PolarHBondContact O-N 2.88Å; V121-L125 HydrophobicContact CG1-CD1 4.19Å; V121-L125 WeakPolarHBondContact O-CG 3.35Å; V121-L125 PolarHBondContact O-N 2.96Å
122	A	97.2	Very high	94.4	Very high	3 Å²	3	43.6 Å²	43.6	3%	0.025	24%	0.238	C	C	.	.	H	α-helix	trans	-66.6	-36.8	178.2	0	0	0	0	0	111.6	L51 I54 N120 V126 L150	L51-A122 HydrophobicContact CB-CB 4.34Å; L51-A122 HydrophobicContact CD1-CB 4.32Å; I54-A122 HydrophobicContact CD1-CB 3.75Å; I54-A122 HydrophobicContact CG1-CB 4.19Å; I54-A122 HydrophobicContact CG2-CB 4.33Å; N120-A122 VanDerWaalsContact C-N 3.26Å; N120-A122 PolarHBondContact O-N 3.04Å; N120-A122 WeakPolarHBondContact OD1-CB 3.33Å; N120-A122 PolarHBondContact OD1-N 2.91Å; A122-V126 WeakPolarHBondContact O-CG2 3.4Å; A122-V126 PolarHBondContact O-N 3.27Å; A122-L150 HydrophobicContact CB-CD2 4.21Å
123	L	96.9	Very high	94.5	Very high	34 Å²	34	42.2 Å²	42.2	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-66.8	-47.4	176	-174.3	62.1	0	0	0	110.7	N120 V121 L125 V126 E127 Q149 L150 A153	N120-L123 HydrophobicContact CB-CB 4.03Å; N120-L123 WeakPolarHBondContact O-CA 3.41Å; N120-L123 WeakPolarHBondContact O-CB 3.3Å; N120-L123 PolarHBondContact O-N 2.86Å; V121-L123 VanDerWaalsContact C-N 3.31Å; V121-L123 PolarHBondContact O-N 3.34Å; L123-L125 VanDerWaalsContact C-N 3.31Å; L123-L125 PolarHBondContact O-N 3.24Å; L123-V126 PolarHBondContact O-N 3.22Å; L123-E127 HydrophobicContact CD1-CG 4.41Å; L123-E127 HydrophobicContact CG-CG 4.31Å; L123-E127 WeakPolarHBondContact O-CG 3.31Å; L123-E127 PolarHBondContact O-N 3.5Å; L123-Q149 HydrophobicContact CD1-CB 4.24Å; L123-L150 HydrophobicContact CB-CD2 4.27Å; L123-L150 HydrophobicContact CD1-CD2 4.17Å; L123-A153 HydrophobicContact CD1-CB 3.59Å
124	S	97.2	Very high	94.5	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-57.5	-43.1	178.3	-45.1	0	0	0	0	112.8	E119 N120 V121 V126 E127 Q128	E119-S124 WeakPolarHBondContact CG-OG 3.26Å; E119-S124 WeakPolarHBondContact OE1-CB 3.12Å; E119-S124 PolarHBondContact OE1-OG 2.79Å; N120-S124 PolarHBondContact O-N 3.23Å; N120-S124 VanDerWaalsContact O-N 3.07Å; N120-S124 PolarHBondContact O-OG 3.49Å; N120-S124 VanDerWaalsContact O-OG 3.11Å; V121-S124 PolarHBondContact O-N 2.88Å; S124-V126 VanDerWaalsContact C-N 3.33Å; S124-V126 PolarHBondContact O-N 2.74Å; S124-E127 PolarHBondContact O-N 3.23Å; S124-Q128 WeakPolarHBondContact O-CG 3.09Å; S124-Q128 PolarHBondContact O-N 3.1Å
125	L	98	Very high	94.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60	-42.9	175.5	-82.6	161.9	0	0	0	112.1	G30 L51 I54 A80 F83 V84 V121 L123 G129 L130 A131	G30-L125 WeakPolarHBondContact O-CD1 3.47Å; L51-L125 HydrophobicContact CD1-CD1 3.68Å; I54-L125 HydrophobicContact CD1-CB 4.37Å; I54-L125 HydrophobicContact CD1-CD1 3.78Å; A80-L125 HydrophobicContact CB-CD2 4.24Å; F83-L125 HydrophobicContact CD1-CD2 3.86Å; F83-L125 HydrophobicContact CD1-CG 4.28Å; F83-L125 HydrophobicContact CE1-CD2 4.48Å; F83-L125 HydrophobicContact CE1-CG 4.46Å; V84-L125 HydrophobicContact CG2-CD1 3.83Å; V84-L125 HydrophobicContact CG2-CD2 3.8Å; V84-L125 HydrophobicContact CG2-CG 4.03Å; V121-L125 HydrophobicContact CG1-CD1 4.19Å; V121-L125 WeakPolarHBondContact O-CG 3.35Å; V121-L125 PolarHBondContact O-N 2.96Å; L123-L125 VanDerWaalsContact C-N 3.31Å; L123-L125 PolarHBondContact O-N 3.24Å; L125-G129 PolarHBondContact O-N 3.35Å; L125-L130 HydrophobicContact CD2-CB 3.88Å; L125-L130 HydrophobicContact CD2-CD1 4.39Å; L125-L130 WeakPolarHBondContact O-CA 3.41Å; L125-L130 PolarHBondContact O-N 3Å; L125-A131 HydrophobicContact CB-CB 3.87Å; L125-A131 PolarHBondContact O-N 2.81Å
126	V	97.8	Very high	94.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-70.6	-41.2	178.8	174.4	0	0	0	0	111.2	I54 A122 L123 S124 Q128 G129 A131 V133 L150 A153 Q154 A157	I54-V126 HydrophobicContact CG2-CG2 3.75Å; A122-V126 WeakPolarHBondContact O-CG2 3.4Å; A122-V126 PolarHBondContact O-N 3.27Å; L123-V126 PolarHBondContact O-N 3.22Å; S124-V126 VanDerWaalsContact C-N 3.33Å; S124-V126 PolarHBondContact O-N 2.74Å; V126-Q128 VanDerWaalsContact C-N 3.29Å; V126-Q128 PolarHBondContact O-N 3.42Å; V126-G129 WeakPolarHBondContact O-CA 3.48Å; V126-G129 PolarHBondContact O-N 3.05Å; V126-A131 HydrophobicContact CG2-CB 3.93Å; V126-V133 HydrophobicContact CG1-CG2 4.03Å; V126-V133 HydrophobicContact CG2-CG2 3.95Å; V126-L150 HydrophobicContact CB-CD2 4.36Å; V126-L150 WeakPolarHBondContact CG1-O 3.41Å; V126-L150 HydrophobicContact CG2-CD2 3.94Å; V126-A153 HydrophobicContact CB-CB 4.46Å; V126-A153 HydrophobicContact CG1-CB 3.86Å; V126-Q154 HydrophobicContact CG1-CB 3.65Å; V126-Q154 HydrophobicContact CG1-CG 4.5Å; V126-Q154 VanDerWaalsContact CG1-N 3.31Å; V126-A157 VanDerWaalsContact O-CB 3.27Å; V126-A157 WeakPolarHBondContact O-CB 3.41Å
127	E	97.2	Very high	94.3	Very high	77 Å²	77	47.1 Å²	47.1	36%	0.36	24%	0.239	S	C	.	.	H	α-helix	trans	-62.2	-33.2	177.2	-74.2	178.7	167.6	0	0	113.2	L123 S124 A153 K162	L123-E127 HydrophobicContact CD1-CG 4.41Å; L123-E127 HydrophobicContact CG-CG 4.31Å; L123-E127 WeakPolarHBondContact O-CG 3.31Å; L123-E127 PolarHBondContact O-N 3.5Å; S124-E127 PolarHBondContact O-N 3.23Å; E127-A153 HydrophobicContact CG-CB 3.75Å; E127-K162 WeakPolarHBondContact O-CD 3.33Å
128	Q	95.5	Very high	94.1	Very high	84 Å²	84	46.8 Å²	46.8	39%	0.393	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-1.8	172.7	-62.9	-56.4	-29.1	0	0	113.1	F83 S124 V126 L130	F83-Q128 HydrophobicContact CE2-CG 3.86Å; F83-Q128 HydrophobicContact CZ-CG 3.92Å; S124-Q128 WeakPolarHBondContact O-CG 3.09Å; S124-Q128 PolarHBondContact O-N 3.1Å; V126-Q128 VanDerWaalsContact C-N 3.29Å; V126-Q128 PolarHBondContact O-N 3.42Å; Q128-L130 VanDerWaalsContact C-N 3.3Å; Q128-L130 HydrophobicContact CB-CD1 3.98Å; Q128-L130 HydrophobicContact CB-CG 4.04Å; Q128-L130 PolarHBondContact O-N 3.34Å
129	G	95.5	Very high	93.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	34.9	-176	0	0	0	0	0	112.4	L125 V126 G163 R164	L125-G129 PolarHBondContact O-N 3.35Å; V126-G129 WeakPolarHBondContact O-CA 3.48Å; V126-G129 PolarHBondContact O-N 3.05Å; G129-G163 CarbonylContact O-C 3.57Å; G129-G163 WeakPolarHBondContact O-CA 3.41Å; G129-R164 WeakPolarHBondContact O-CG 3.29Å; G129-R164 PolarHBondContact O-N 2.85Å
130	L	95.7	Very high	93.4	Very high	16 Å²	16	49.5 Å²	49.5	8%	0.084	25%	0.253	C	S	.	.			trans	-101.2	-10.5	177.5	-65.9	173.8	0	0	0	112.6	F76 E79 A80 F83 L125 Q128	F76-L130 HydrophobicContact CD1-CD2 4.41Å; E79-L130 HydrophobicContact CB-CD2 3.97Å; A80-L130 HydrophobicContact CB-CB 3.97Å; F83-L130 HydrophobicContact CB-CD1 3.6Å; F83-L130 HydrophobicContact CD1-CD1 4.15Å; F83-L130 HydrophobicContact CD2-CD1 4Å; F83-L130 HydrophobicContact CG-CD1 3.65Å; L125-L130 HydrophobicContact CD2-CB 3.88Å; L125-L130 HydrophobicContact CD2-CD1 4.39Å; L125-L130 WeakPolarHBondContact O-CA 3.41Å; L125-L130 PolarHBondContact O-N 3Å; Q128-L130 VanDerWaalsContact C-N 3.3Å; Q128-L130 HydrophobicContact CB-CD1 3.98Å; Q128-L130 HydrophobicContact CB-CG 4.04Å; Q128-L130 PolarHBondContact O-N 3.34Å
131	A	96.9	Very high	92.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.255	C	S	.	.			trans	-132.1	151.6	178.7	0	0	0	0	0	112.7	I54 S55 C56 L125 V126	I54-A131 HydrophobicContact CB-CB 4.17Å; I54-A131 HydrophobicContact CD1-CB 3.99Å; S55-A131 WeakPolarHBondContact O-CA 3.15Å; C56-A131 VanDerWaalsContact SG-CB 3.55Å; L125-A131 HydrophobicContact CB-CB 3.87Å; L125-A131 PolarHBondContact O-N 2.81Å; V126-A131 HydrophobicContact CG2-CB 3.93Å
132	E	95.2	Very high	92.1	Very high	87 Å²	87	52.9 Å²	52.9	41%	0.407	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	139.6	167.3	-153.1	170.8	153.6	0	0	110.8	I54 S55 R134 R164 W165	I54-E132 CarbonylContact C-O 3.58Å; I54-E132 WeakPolarHBondContact CA-O 3.21Å; S55-E132 PolarHBondContact N-O 3.45Å; S55-E132 PolarHBondContact O-N 3Å; E132-R134 PolarHBondContact O-N 2.97Å; E132-R164 VanDerWaalsContact CB-NH2 3.33Å; E132-R164 IonicContact OE2-CZ 3.61Å; E132-R164 IonicContact OE2-NH1 3.41Å; E132-R164 IonicContact OE2-NH2 3.53Å; E132-R164 PolarHBondContact OE2-NH2 2.81Å; E132-W165 HydrophobicContact CG-CH2 4.32Å
133	V	96.2	Very high	91.6	Very high	7 Å²	7	61.1 Å²	61.1	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	118.8	169.7	-174.4	0	0	0	0	109.4	N53 V126 Y147 L150 V151 Q154	N53-V133 CarbonylContact O-C 3.58Å; N53-V133 WeakPolarHBondContact O-CA 3.42Å; V126-V133 HydrophobicContact CG1-CG2 4.03Å; V126-V133 HydrophobicContact CG2-CG2 3.95Å; V133-Y147 HydrophobicContact CG1-CD2 4.12Å; V133-Y147 HydrophobicContact CG1-CE2 3.65Å; V133-L150 HydrophobicContact CG1-CB 4.19Å; V133-L150 HydrophobicContact CG2-CB 3.81Å; V133-L150 WeakPolarHBondContact CG2-O 3.22Å; V133-V151 HydrophobicContact CG1-CG2 4.09Å; V133-Q154 HydrophobicContact CG2-CB 3.91Å; V133-Q154 HydrophobicContact CG2-CG 4.44Å
134	R	93.7	Very high	91.1	Very high	91 Å²	91	61.3 Å²	61.3	34%	0.343	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-69.3	129.7	175.2	-67.5	-177	177.6	141.9	11.7	109.8	D31 N53 I54 S55 E132 L136 Y147	D31-R134 IonicContact OD2-NH2 3.54Å; N53-R134 PolarHBondContact O-N 3Å; I54-R134 PolarHBondContact O-NE 3.09Å; I54-R134 PolarHBondContact O-NH1 3.45Å; I54-R134 PolarHBondContact O-NH2 2.99Å; S55-R134 PolarHBondContact OG-NH2 3.43Å; S55-R134 VanDerWaalsContact OG-NH2 3.11Å; E132-R134 PolarHBondContact O-N 2.97Å; R134-L136 PolarHBondContact O-N 3.18Å; R134-Y147 WeakPolarHBondContact O-CE2 3.44Å
135	K	90.1	Very high	90.6	Very high	197 Å²	197	69.1 Å²	69.1	86%	0.857	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-63.1	121.3	178.3	-64.4	-179.4	-174.4	178.7	0	110.9
136	L	86.7	Confident	90.3	Very high	52 Å²	52	70.6 Å²	70.6	27%	0.272	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-93.7	161.2	171.4	-70.6	-178	0	0	0	111.7	R134 V140 A141 Y147	R134-L136 PolarHBondContact O-N 3.18Å; L136-V140 HydrophobicContact CD1-CG1 4.46Å; L136-A141 HydrophobicContact CB-CB 4.19Å; L136-Y147 HydrophobicContact CB-CD2 4.4Å; L136-Y147 HydrophobicContact CB-CE2 3.92Å; L136-Y147 HydrophobicContact CD1-CD1 4.45Å; L136-Y147 HydrophobicContact CD1-CD2 3.38Å; L136-Y147 HydrophobicContact CD1-CE2 3.74Å; L136-Y147 HydrophobicContact CD1-CG 3.76Å; L136-Y147 HydrophobicContact CG-CD2 3.8Å; L136-Y147 HydrophobicContact CG-CE2 3.6Å; L136-Y147 PolarHBondContact N-OH 3.08Å
137	N	86	Confident	90	Very high	99 Å²	99	72 Å²	72	53%	0.529	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-56.2	131.5	168.2	-179.4	-35.3	0	0	0	109.5	T139 V140 A141	N137-T139 PolarHBondContact O-N 3.5Å; N137-T139 PolarHBondContact OD1-N 2.84Å; N137-T139 PolarHBondContact OD1-OG1 3.43Å; N137-V140 HydrophobicContact CB-CG2 4.34Å; N137-V140 PolarHBondContact O-N 3.17Å; N137-A141 WeakPolarHBondContact O-CB 3.49Å; N137-A141 PolarHBondContact O-N 3.43Å
138	P	84.5	Confident	89.9	Confident	104 Å²	104	72.8 Å²	72.8	68%	0.675	37%	0.371	S	S	*	.	H	α-helix	trans	-46.7	-39.2	-179.4	-30.6	34.9	0	0	0	114.9	V140 A141 A142	P138-V140 PolarHBondContact O-N 2.8Å; P138-A141 PolarHBondContact O-N 3.02Å; P138-A142 WeakPolarHBondContact O-CB 3.15Å; P138-A142 PolarHBondContact O-N 3.41Å
139	T	84.4	Confident	89.8	Confident	93 Å²	93	73.6 Å²	73.6	57%	0.571	38%	0.375	S	S	*	.	H	α-helix	trans	-67.7	-36.4	-178.7	-45.8	0	0	0	0	112.5	N137	N137-T139 PolarHBondContact O-N 3.5Å; N137-T139 PolarHBondContact OD1-N 2.84Å; N137-T139 PolarHBondContact OD1-OG1 3.43Å
140	V	83.6	Confident	89.9	Confident	80 Å²	80	73.7 Å²	73.7	49%	0.485	38%	0.375	S	S	.	.	H	α-helix	trans	-79.9	-40.5	177.6	-178.2	0	0	0	0	110	L136 N137 P138 A142 K143 N144	L136-V140 HydrophobicContact CD1-CG1 4.46Å; N137-V140 HydrophobicContact CB-CG2 4.34Å; N137-V140 PolarHBondContact O-N 3.17Å; P138-V140 PolarHBondContact O-N 2.8Å; V140-A142 VanDerWaalsContact C-N 3.32Å; V140-A142 PolarHBondContact O-N 2.93Å; V140-K143 PolarHBondContact O-N 2.86Å; V140-K143 VanDerWaalsContact O-N 3.14Å; V140-N144 PolarHBondContact O-N 3.31Å; V140-N144 VanDerWaalsContact O-N 3.13Å
141	A	83.1	Confident	89.9	Confident	15 Å²	15	75.3 Å²	75.3	12%	0.124	39%	0.385	C	S	.	.	H	α-helix	trans	-56.7	-42.3	176.8	0	0	0	0	0	112.6	L136 N137 P138 K143 N144 Y147	L136-A141 HydrophobicContact CB-CB 4.19Å; N137-A141 WeakPolarHBondContact O-CB 3.49Å; N137-A141 PolarHBondContact O-N 3.43Å; P138-A141 PolarHBondContact O-N 3.02Å; A141-K143 VanDerWaalsContact C-N 3.28Å; A141-K143 PolarHBondContact O-N 3.48Å; A141-N144 PolarHBondContact O-N 3.4Å; A141-Y147 HydrophobicContact CB-CD1 3.69Å; A141-Y147 HydrophobicContact CB-CE1 3.41Å; A141-Y147 VanDerWaalsContact CB-CE1 3.41Å
142	A	83.3	Confident	89.9	Confident	69 Å²	69	79.8 Å²	79.8	57%	0.57	41%	0.413	S	S	*	.	H	α-helix	trans	-65.7	-28.7	178.9	0	0	0	0	0	113.5	P138 V140 Q148	P138-A142 WeakPolarHBondContact O-CB 3.15Å; P138-A142 PolarHBondContact O-N 3.41Å; V140-A142 VanDerWaalsContact C-N 3.32Å; V140-A142 PolarHBondContact O-N 2.93Å; A142-Q148 PolarHBondContact O-NE2 2.88Å
143	K	85.3	Confident	90	Very high	175 Å²	175	75.9 Å²	75.9	76%	0.761	40%	0.395	S	S	*	.	H	α-helix	trans	-89.4	-21.6	-178.7	-67.4	-179	179	-179	0	113.3	V140 A141 K145	V140-K143 PolarHBondContact O-N 2.86Å; V140-K143 VanDerWaalsContact O-N 3.14Å; A141-K143 VanDerWaalsContact C-N 3.28Å; A141-K143 PolarHBondContact O-N 3.48Å; K143-K145 PolarHBondContact O-N 3.42Å
144	N	86.9	Confident	90.1	Very high	38 Å²	38	76.4 Å²	76.4	20%	0.203	40%	0.397	C	S	.	.			trans	-91.5	101.4	-176.2	-171.8	-26.8	0	0	0	111.4	V140 A141 V146 Y147 Q148	V140-N144 PolarHBondContact O-N 3.31Å; V140-N144 VanDerWaalsContact O-N 3.13Å; A141-N144 PolarHBondContact O-N 3.4Å; N144-V146 VanDerWaalsContact C-N 3.33Å; N144-V146 PolarHBondContact O-N 2.99Å; N144-V146 PolarHBondContact OD1-N 3.29Å; N144-V146 VanDerWaalsContact OD1-N 3.08Å; N144-Y147 WeakPolarHBondContact O-CB 3.37Å; N144-Y147 PolarHBondContact O-N 3.39Å; N144-Y147 PolarHBondContact OD1-N 3.04Å; N144-Q148 PolarHBondContact O-N 3.12Å
145	K	88.1	Confident	90.2	Very high	168 Å²	168	76.7 Å²	76.7	73%	0.73	40%	0.402	S	S	*	.	H	α-helix	trans	-61.1	-37.9	179.2	-65.9	-175.9	179.5	-178.3	0	113.3	K143 Y147 Q148 Q149	K143-K145 PolarHBondContact O-N 3.42Å; K145-Y147 VanDerWaalsContact C-N 3.34Å; K145-Q148 PolarHBondContact O-N 3.19Å; K145-Q149 WeakPolarHBondContact O-CG 3.34Å; K145-Q149 PolarHBondContact O-N 3.23Å; K145-Q149 VanDerWaalsContact O-N 3.14Å
146	V	89.7	Confident	90.5	Very high	30 Å²	30	72.4 Å²	72.4	18%	0.182	39%	0.385	C	S	.	.	H	α-helix	trans	-66.2	-40.5	177.9	179.2	0	0	0	0	110	N144 Q148 Q149 L150	N144-V146 VanDerWaalsContact C-N 3.33Å; N144-V146 PolarHBondContact O-N 2.99Å; N144-V146 PolarHBondContact OD1-N 3.29Å; N144-V146 VanDerWaalsContact OD1-N 3.08Å; V146-Q148 VanDerWaalsContact C-N 3.32Å; V146-Q148 PolarHBondContact O-N 3.03Å; V146-Q149 WeakPolarHBondContact O-CB 3.46Å; V146-Q149 PolarHBondContact O-N 3.45Å; V146-L150 HydrophobicContact CG1-CD1 4.32Å; V146-L150 HydrophobicContact CG1-CG 4.48Å; V146-L150 WeakPolarHBondContact O-CG 3.37Å; V146-L150 PolarHBondContact O-N 3.02Å
147	Y	93.1	Very high	91	Very high	29 Å²	29	70 Å²	70	11%	0.114	37%	0.373	C	S	.	.	H	α-helix	trans	-58.8	-42	174.4	179.3	-97.5	0	0	0	112.5	N53 V133 R134 L136 A141 N144 K145 Q149 L150 V151	N53-Y147 HydrophobicContact CB-CD2 4.11Å; V133-Y147 HydrophobicContact CG1-CD2 4.12Å; V133-Y147 HydrophobicContact CG1-CE2 3.65Å; R134-Y147 WeakPolarHBondContact O-CE2 3.44Å; L136-Y147 HydrophobicContact CB-CD2 4.4Å; L136-Y147 HydrophobicContact CB-CE2 3.92Å; L136-Y147 HydrophobicContact CD1-CD1 4.45Å; L136-Y147 HydrophobicContact CD1-CD2 3.38Å; L136-Y147 HydrophobicContact CD1-CE2 3.74Å; L136-Y147 HydrophobicContact CD1-CG 3.76Å; L136-Y147 HydrophobicContact CG-CD2 3.8Å; L136-Y147 HydrophobicContact CG-CE2 3.6Å; L136-Y147 PolarHBondContact N-OH 3.08Å; A141-Y147 HydrophobicContact CB-CD1 3.69Å; A141-Y147 HydrophobicContact CB-CE1 3.41Å; A141-Y147 VanDerWaalsContact CB-CE1 3.41Å; N144-Y147 WeakPolarHBondContact O-CB 3.37Å; N144-Y147 PolarHBondContact O-N 3.39Å; N144-Y147 PolarHBondContact OD1-N 3.04Å; K145-Y147 VanDerWaalsContact C-N 3.34Å; Y147-Q149 VanDerWaalsContact C-N 3.34Å; Y147-Q149 PolarHBondContact O-N 3.03Å; Y147-L150 WeakPolarHBondContact O-CB 3.48Å; Y147-L150 PolarHBondContact O-N 3.44Å; Y147-V151 HydrophobicContact CD1-CG2 4.1Å; Y147-V151 HydrophobicContact CE1-CG2 3.62Å; Y147-V151 HydrophobicContact CE2-CG2 4.29Å; Y147-V151 WeakPolarHBondContact O-CG2 3.34Å; Y147-V151 PolarHBondContact O-N 2.69Å
148	Q	93.6	Very high	91.4	Very high	94 Å²	94	68.8 Å²	68.8	44%	0.439	36%	0.363	S	S	.	.	H	α-helix	trans	-64.2	-38.5	176.8	-67.3	174.4	-1.7	0	0	112.5	A142 N144 K145 V146 V151 T152	A142-Q148 PolarHBondContact O-NE2 2.88Å; N144-Q148 PolarHBondContact O-N 3.12Å; K145-Q148 PolarHBondContact O-N 3.19Å; V146-Q148 VanDerWaalsContact C-N 3.32Å; V146-Q148 PolarHBondContact O-N 3.03Å; Q148-V151 PolarHBondContact O-N 3.18Å; Q148-T152 WeakPolarHBondContact O-CB 3.49Å; Q148-T152 PolarHBondContact O-N 2.95Å; Q148-T152 PolarHBondContact O-OG1 2.95Å
149	Q	95.2	Very high	92	Very high	102 Å²	102	68.5 Å²	68.5	48%	0.477	36%	0.363	S	S	.	.	H	α-helix	trans	-62.1	-45.4	172.9	-69.6	174.7	-24.2	0	0	111.2	L123 K145 V146 Y147 V151 T152 A153	L123-Q149 HydrophobicContact CD1-CB 4.24Å; K145-Q149 WeakPolarHBondContact O-CG 3.34Å; K145-Q149 PolarHBondContact O-N 3.23Å; K145-Q149 VanDerWaalsContact O-N 3.14Å; V146-Q149 WeakPolarHBondContact O-CB 3.46Å; V146-Q149 PolarHBondContact O-N 3.45Å; Y147-Q149 VanDerWaalsContact C-N 3.34Å; Y147-Q149 PolarHBondContact O-N 3.03Å; Q149-V151 PolarHBondContact O-N 3Å; Q149-T152 PolarHBondContact O-N 2.86Å; Q149-A153 WeakPolarHBondContact O-CB 3.35Å; Q149-A153 PolarHBondContact O-N 3.08Å
150	L	96.8	Very high	92.5	Very high	2 Å²	2	68.9 Å²	68.9	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-60.1	-45.6	176.7	-67.7	171.1	0	0	0	111.8	N53 I54 A122 L123 V126 V133 V146 Y147 T152 A153 Q154	N53-L150 HydrophobicContact CB-CD1 4.05Å; I54-L150 HydrophobicContact CG2-CD1 4.01Å; I54-L150 HydrophobicContact CG2-CD2 4.1Å; A122-L150 HydrophobicContact CB-CD2 4.21Å; L123-L150 HydrophobicContact CB-CD2 4.27Å; L123-L150 HydrophobicContact CD1-CD2 4.17Å; V126-L150 HydrophobicContact CB-CD2 4.36Å; V126-L150 WeakPolarHBondContact CG1-O 3.41Å; V126-L150 HydrophobicContact CG2-CD2 3.94Å; V133-L150 HydrophobicContact CG1-CB 4.19Å; V133-L150 HydrophobicContact CG2-CB 3.81Å; V133-L150 WeakPolarHBondContact CG2-O 3.22Å; V146-L150 HydrophobicContact CG1-CD1 4.32Å; V146-L150 HydrophobicContact CG1-CG 4.48Å; V146-L150 WeakPolarHBondContact O-CG 3.37Å; V146-L150 PolarHBondContact O-N 3.02Å; Y147-L150 WeakPolarHBondContact O-CB 3.48Å; Y147-L150 PolarHBondContact O-N 3.44Å; L150-T152 VanDerWaalsContact C-N 3.33Å; L150-T152 PolarHBondContact O-N 3.23Å; L150-A153 PolarHBondContact O-N 2.8Å; L150-Q154 WeakPolarHBondContact O-CB 3.21Å; L150-Q154 PolarHBondContact O-N 3.4Å
151	V	96	Very high	92.9	Very high	50 Å²	50	66.2 Å²	66.2	30%	0.303	35%	0.35	S	S	.	.	H	α-helix	trans	-60.4	-44.5	177	172.2	0	0	0	0	111	V133 Y147 Q148 Q149 Q154 E155	V133-V151 HydrophobicContact CG1-CG2 4.09Å; Y147-V151 HydrophobicContact CD1-CG2 4.1Å; Y147-V151 HydrophobicContact CE1-CG2 3.62Å; Y147-V151 HydrophobicContact CE2-CG2 4.29Å; Y147-V151 WeakPolarHBondContact O-CG2 3.34Å; Y147-V151 PolarHBondContact O-N 2.69Å; Q148-V151 PolarHBondContact O-N 3.18Å; Q149-V151 PolarHBondContact O-N 3Å; V151-Q154 PolarHBondContact O-N 2.84Å; V151-E155 PolarHBondContact O-N 2.65Å; V151-E155 VanDerWaalsContact O-N 3.09Å
152	T	96.8	Very high	93.4	Very high	94 Å²	94	69 Å²	69	58%	0.577	36%	0.36	S	S	*	.	H	α-helix	trans	-63.2	-46.8	178.6	-53.8	0	0	0	0	111.4	Q148 Q149 L150 Q154 E155 Q156	Q148-T152 WeakPolarHBondContact O-CB 3.49Å; Q148-T152 PolarHBondContact O-N 2.95Å; Q148-T152 PolarHBondContact O-OG1 2.95Å; Q149-T152 PolarHBondContact O-N 2.86Å; L150-T152 VanDerWaalsContact C-N 3.33Å; L150-T152 PolarHBondContact O-N 3.23Å; T152-Q154 VanDerWaalsContact C-N 3.28Å; T152-Q154 PolarHBondContact O-N 3.08Å; T152-E155 PolarHBondContact O-N 3.41Å; T152-Q156 PolarHBondContact O-N 3.19Å
153	A	96.7	Very high	93.7	Very high	4 Å²	4	66.7 Å²	66.7	3%	0.033	34%	0.342	C	S	.	.	H	α-helix	trans	-61.2	-36.5	176.3	0	0	0	0	0	112.2	L123 V126 E127 Q149 L150 Q156 A157	L123-A153 HydrophobicContact CD1-CB 3.59Å; V126-A153 HydrophobicContact CB-CB 4.46Å; V126-A153 HydrophobicContact CG1-CB 3.86Å; E127-A153 HydrophobicContact CG-CB 3.75Å; Q149-A153 WeakPolarHBondContact O-CB 3.35Å; Q149-A153 PolarHBondContact O-N 3.08Å; L150-A153 PolarHBondContact O-N 2.8Å; A153-Q156 PolarHBondContact O-N 2.84Å; A153-A157 WeakPolarHBondContact O-CB 3.19Å; A153-A157 PolarHBondContact O-N 3.39Å
154	Q	97.7	Very high	94	Very high	18 Å²	18	61.3 Å²	61.3	8%	0.084	32%	0.317	C	S	.	.	H	α-helix	trans	-66.5	-44.6	177	-175.3	177.3	-100.7	0	0	111.8	V126 V133 L150 V151 T152 Q156 A157 K158 W165	V126-Q154 HydrophobicContact CG1-CB 3.65Å; V126-Q154 HydrophobicContact CG1-CG 4.5Å; V126-Q154 VanDerWaalsContact CG1-N 3.31Å; V133-Q154 HydrophobicContact CG2-CB 3.91Å; V133-Q154 HydrophobicContact CG2-CG 4.44Å; L150-Q154 WeakPolarHBondContact O-CB 3.21Å; L150-Q154 PolarHBondContact O-N 3.4Å; V151-Q154 PolarHBondContact O-N 2.84Å; T152-Q154 VanDerWaalsContact C-N 3.28Å; T152-Q154 PolarHBondContact O-N 3.08Å; Q154-Q156 VanDerWaalsContact C-N 3.26Å; Q154-Q156 PolarHBondContact O-N 3.04Å; Q154-A157 PolarHBondContact O-N 3.36Å; Q154-K158 WeakPolarHBondContact O-CG 3.44Å; Q154-K158 PolarHBondContact O-N 2.98Å; Q154-W165 HydrophobicContact CG-CZ2 3.76Å
155	E	96.9	Very high	94.3	Very high	97 Å²	97	62.8 Å²	62.8	45%	0.453	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-34	176.9	-66	-51.3	132	0	0	111.7	V151 T152 K158 S159	V151-E155 PolarHBondContact O-N 2.65Å; V151-E155 VanDerWaalsContact O-N 3.09Å; T152-E155 PolarHBondContact O-N 3.41Å; E155-K158 PolarHBondContact O-N 3.35Å; E155-K158 IonicContact OE1-NZ 3.38Å; E155-K158 PolarHBondContact OE1-NZ 3.47Å; E155-K158 IonicContact OE2-NZ 3.51Å; E155-S159 PolarHBondContact O-N 2.83Å; E155-S159 PolarHBondContact O-OG 3.33Å
156	Q	96.8	Very high	94.3	Very high	107 Å²	107	56.7 Å²	56.7	50%	0.5	30%	0.298	S	S	.	.	H	α-helix	trans	-68	-42.1	171.8	-171.2	178.5	4	0	0	112.7	T152 A153 Q154 K158 S159 L160	T152-Q156 PolarHBondContact O-N 3.19Å; A153-Q156 PolarHBondContact O-N 2.84Å; Q154-Q156 VanDerWaalsContact C-N 3.26Å; Q154-Q156 PolarHBondContact O-N 3.04Å; Q156-K158 VanDerWaalsContact C-N 3.29Å; Q156-K158 PolarHBondContact O-N 3.41Å; Q156-S159 PolarHBondContact O-N 3.47Å; Q156-S159 PolarHBondContact O-OG 2.96Å; Q156-L160 HydrophobicContact CG-CD1 4.06Å; Q156-L160 WeakPolarHBondContact O-CB 3.43Å; Q156-L160 VanDerWaalsContact O-CG 3.31Å; Q156-L160 WeakPolarHBondContact O-CG 3.32Å; Q156-L160 PolarHBondContact O-N 2.94Å
157	A	96	Very high	94.1	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-64.9	-35.4	176.3	0	0	0	0	0	111.8	V126 A153 Q154 G161 K162	V126-A157 VanDerWaalsContact O-CB 3.27Å; V126-A157 WeakPolarHBondContact O-CB 3.41Å; A153-A157 WeakPolarHBondContact O-CB 3.19Å; A153-A157 PolarHBondContact O-N 3.39Å; Q154-A157 PolarHBondContact O-N 3.36Å; A157-G161 PolarHBondContact O-N 3.11Å; A157-G161 VanDerWaalsContact O-N 3.1Å; A157-K162 HydrophobicContact CB-CB 4.46Å; A157-K162 PolarHBondContact O-N 3.14Å
158	K	95.9	Very high	93.7	Very high	75 Å²	75	65 Å²	65	33%	0.326	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-48.4	172.3	-75.2	173.9	-176.4	171	0	112.4	Q154 E155 Q156 L160 G161 W165	Q154-K158 WeakPolarHBondContact O-CG 3.44Å; Q154-K158 PolarHBondContact O-N 2.98Å; E155-K158 PolarHBondContact O-N 3.35Å; E155-K158 IonicContact OE1-NZ 3.38Å; E155-K158 PolarHBondContact OE1-NZ 3.47Å; E155-K158 IonicContact OE2-NZ 3.51Å; Q156-K158 VanDerWaalsContact C-N 3.29Å; Q156-K158 PolarHBondContact O-N 3.41Å; K158-L160 PolarHBondContact O-N 3.45Å; K158-G161 PolarHBondContact O-N 3.02Å; K158-W165 HydrophobicContact CB-CG 4.37Å; K158-W165 HydrophobicContact CD-CD2 4.48Å; K158-W165 HydrophobicContact CD-CE3 4.48Å; K158-W165 HydrophobicContact CG-CB 4.33Å; K158-W165 HydrophobicContact CG-CD2 3.46Å; K158-W165 VanDerWaalsContact CG-CD2 3.46Å; K158-W165 HydrophobicContact CG-CE3 3.8Å; K158-W165 HydrophobicContact CG-CG 3.7Å; K158-W165 HydrophobicContact CG-CZ2 4.3Å; K158-W165 HydrophobicContact CG-CZ3 4.34Å
159	S	95.5	Very high	92.8	Very high	97 Å²	97	65.9 Å²	65.9	68%	0.678	36%	0.364	S	S	*	.	H	α-helix	trans	-64.4	-30.4	-179.2	69.6	0	0	0	0	112.5	E155 Q156	E155-S159 PolarHBondContact O-N 2.83Å; E155-S159 PolarHBondContact O-OG 3.33Å; Q156-S159 PolarHBondContact O-N 3.47Å; Q156-S159 PolarHBondContact O-OG 2.96Å
160	L	95.4	Very high	92.1	Very high	101 Å²	101	62.1 Å²	62.1	53%	0.529	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-3.8	174.8	-64.5	175.2	0	0	0	114.1	Q156 K158 K162	Q156-L160 HydrophobicContact CG-CD1 4.06Å; Q156-L160 WeakPolarHBondContact O-CB 3.43Å; Q156-L160 VanDerWaalsContact O-CG 3.31Å; Q156-L160 WeakPolarHBondContact O-CG 3.32Å; Q156-L160 PolarHBondContact O-N 2.94Å; K158-L160 PolarHBondContact O-N 3.45Å; L160-K162 VanDerWaalsContact C-N 3.31Å; L160-K162 HydrophobicContact CB-CD 4.37Å; L160-K162 HydrophobicContact CB-CG 3.99Å; L160-K162 HydrophobicContact CD1-CD 4.42Å; L160-K162 PolarHBondContact O-N 3Å
161	G	92.9	Very high	91.2	Very high	24 Å²	24	66.8 Å²	66.8	25%	0.247	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	36.6	-178.1	0	0	0	0	0	113.9	A157 K158 S166	A157-G161 PolarHBondContact O-N 3.11Å; A157-G161 VanDerWaalsContact O-N 3.1Å; K158-G161 PolarHBondContact O-N 3.02Å; G161-S166 WeakPolarHBondContact O-CA 3.44Å; G161-S166 WeakPolarHBondContact O-CB 3.43Å; G161-S166 PolarHBondContact O-N 2.97Å
162	K	92.6	Very high	90.5	Very high	75 Å²	75	69.9 Å²	69.9	33%	0.326	40%	0.396	S	S	.	.			trans	-83.4	143.2	-177	-72.6	-175.8	174.9	-176.8	0	112.6	E127 A157 L160 R164 W165	E127-K162 WeakPolarHBondContact O-CD 3.33Å; A157-K162 HydrophobicContact CB-CB 4.46Å; A157-K162 PolarHBondContact O-N 3.14Å; L160-K162 VanDerWaalsContact C-N 3.31Å; L160-K162 HydrophobicContact CB-CD 4.37Å; L160-K162 HydrophobicContact CB-CG 3.99Å; L160-K162 HydrophobicContact CD1-CD 4.42Å; L160-K162 PolarHBondContact O-N 3Å; K162-R164 PolarHBondContact O-N 3.1Å; K162-W165 WeakPolarHBondContact O-CB 3.44Å; K162-W165 PolarHBondContact O-N 2.91Å
163	G	90.4	Very high	90.1	Very high	20 Å²	20	66.4 Å²	66.4	21%	0.206	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	52.8	-123.4	173.4	0	0	0	0	0	112	F76 G129 W165 S166	F76-G163 VanDerWaalsContact CE1-C 3.44Å; F76-G163 VanDerWaalsContact CZ-C 3.45Å; F76-G163 WeakPolarHBondContact CZ-O 3.14Å; G129-G163 CarbonylContact O-C 3.57Å; G129-G163 WeakPolarHBondContact O-CA 3.41Å; G163-W165 PolarHBondContact O-N 2.86Å; G163-W165 VanDerWaalsContact O-N 3.08Å; G163-S166 WeakPolarHBondContact O-CB 3.34Å; G163-S166 PolarHBondContact O-N 2.91Å
164	R	91.5	Very high	89.8	Confident	62 Å²	62	70.4 Å²	70.4	23%	0.234	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-67.4	-5.9	180	13.7	175.4	-61.6	179.6	10.8	115.1	S55 F76 G129 E132 K162	S55-R164 PolarHBondContact O-NH1 3.36Å; F76-R164 HydrophobicContact CB-CB 4.35Å; F76-R164 HydrophobicContact CB-CG 4.04Å; F76-R164 HydrophobicContact CD2-CB 3.47Å; F76-R164 VanDerWaalsContact CD2-CB 3.47Å; F76-R164 HydrophobicContact CD2-CG 4.1Å; F76-R164 VanDerWaalsContact CE2-CA 3.41Å; F76-R164 HydrophobicContact CE2-CB 3.89Å; F76-R164 HydrophobicContact CG-CB 3.98Å; F76-R164 HydrophobicContact CG-CG 4.1Å; G129-R164 WeakPolarHBondContact O-CG 3.29Å; G129-R164 PolarHBondContact O-N 2.85Å; E132-R164 VanDerWaalsContact CB-NH2 3.33Å; E132-R164 IonicContact OE2-CZ 3.61Å; E132-R164 IonicContact OE2-NH1 3.41Å; E132-R164 IonicContact OE2-NH2 3.53Å; E132-R164 PolarHBondContact OE2-NH2 2.81Å; K162-R164 PolarHBondContact O-N 3.1Å
165	W	92.5	Very high	89.5	Confident	68 Å²	68	71 Å²	71	26%	0.258	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-95.4	-2.8	169.6	-44.3	114.3	0	0	0	112.9	E132 Q154 K158 K162 G163	E132-W165 HydrophobicContact CG-CH2 4.32Å; Q154-W165 HydrophobicContact CG-CZ2 3.76Å; K158-W165 HydrophobicContact CB-CG 4.37Å; K158-W165 HydrophobicContact CD-CD2 4.48Å; K158-W165 HydrophobicContact CD-CE3 4.48Å; K158-W165 HydrophobicContact CG-CB 4.33Å; K158-W165 HydrophobicContact CG-CD2 3.46Å; K158-W165 VanDerWaalsContact CG-CD2 3.46Å; K158-W165 HydrophobicContact CG-CE3 3.8Å; K158-W165 HydrophobicContact CG-CG 3.7Å; K158-W165 HydrophobicContact CG-CZ2 4.3Å; K158-W165 HydrophobicContact CG-CZ3 4.34Å; K162-W165 WeakPolarHBondContact O-CB 3.44Å; K162-W165 PolarHBondContact O-N 2.91Å; G163-W165 PolarHBondContact O-N 2.86Å; G163-W165 VanDerWaalsContact O-N 3.08Å
166	S	89.3	Confident	89.2	Confident	40 Å²	40	68.8 Å²	68.8	28%	0.28	39%	0.385	S	S	.	.	S	Bend	trans	-63.9	144.6	172.3	176.7	0	0	0	0	110.7	G161 G163 N168	G161-S166 WeakPolarHBondContact O-CA 3.44Å; G161-S166 WeakPolarHBondContact O-CB 3.43Å; G161-S166 PolarHBondContact O-N 2.97Å; G163-S166 WeakPolarHBondContact O-CB 3.34Å; G163-S166 PolarHBondContact O-N 2.91Å; S166-N168 PolarHBondContact O-N 3.15Å; S166-N168 PolarHBondContact OG-N 3.03Å
167	P	85.2	Confident	89	Confident	118 Å²	118	66.9 Å²	66.9	77%	0.766	37%	0.373	S	S	*	.	S	Bend	trans	-66.4	-19.2	172.3	28.5	-35.3	0	0	0	112.8
168	N	83.7	Confident	88.6	Confident	117 Å²	117	71 Å²	71	63%	0.626	40%	0.402	S	S	*	.	S	Bend	trans	-93.2	123.1	-179.8	-65.5	-26	0	0	0	110.4	S166	S166-N168 PolarHBondContact O-N 3.15Å; S166-N168 PolarHBondContact OG-N 3.03Å
169	P	75.5	Confident	88.3	Confident	111 Å²	111	68.8 Å²	68.8	72%	0.721	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-63.4	152.5	173.5	27.7	-33.5	0	0	0	110.6
170	P	79.2	Confident	87.8	Confident	24 Å²	24	73.5 Å²	73.5	16%	0.156	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-70.2	145.2	178.3	30.8	-28.6	0	0	0	109.2	P75 F76 E79 T172	P75-P170 HydrophobicContact CB-CG 3.87Å; F76-P170 HydrophobicContact CD1-CB 4.09Å; F76-P170 HydrophobicContact CD1-CG 4.44Å; F76-P170 HydrophobicContact CD2-CB 4.15Å; F76-P170 HydrophobicContact CD2-CG 3.62Å; F76-P170 HydrophobicContact CE1-CB 3.89Å; F76-P170 HydrophobicContact CE1-CG 4.39Å; F76-P170 HydrophobicContact CE2-CB 3.97Å; F76-P170 HydrophobicContact CE2-CG 3.57Å; F76-P170 HydrophobicContact CG-CB 4.22Å; F76-P170 HydrophobicContact CG-CG 4.08Å; F76-P170 HydrophobicContact CZ-CB 3.83Å; F76-P170 HydrophobicContact CZ-CG 3.98Å; E79-P170 WeakPolarHBondContact OE1-CB 3.38Å; P170-T172 PolarHBondContact O-N 3.41Å; P170-T172 VanDerWaalsContact O-N 3.07Å
171	V	79.7	Confident	87.6	Confident	100 Å²	100	73.1 Å²	73.1	61%	0.606	40%	0.404	S	S	*	.			trans	-69	109.9	173.1	-178.7	0	0	0	0	107.8	R173 N221	V171-R173 PolarHBondContact O-N 3.29Å; V171-N221 HydrophobicContact CG1-CB 4.37Å; V171-N221 VanDerWaalsContact CG1-ND2 3.32Å; V171-N221 WeakPolarHBondContact CG1-ND2 2.92Å
172	T	79.8	Confident	87.5	Confident	114 Å²	114	73.1 Å²	73.1	70%	0.699	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-67	124.8	179.2	-53.2	0	0	0	0	109.5	P170	P170-T172 PolarHBondContact O-N 3.41Å; P170-T172 VanDerWaalsContact O-N 3.07Å
173	R	89.4	Confident	87.4	Confident	21 Å²	21	79.2 Å²	79.2	8%	0.079	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-70.2	140.7	176.6	59.9	-179	179.8	150.3	2.6	111.7	E73 W78 V171 I175 N221 F223	E73-R173 IonicContact OE1-CZ 2.99Å; E73-R173 IonicContact OE1-NE 3.33Å; E73-R173 PolarHBondContact OE1-NE 3.21Å; E73-R173 IonicContact OE1-NH2 2.7Å; E73-R173 IonicContact OE2-CZ 2.95Å; E73-R173 IonicContact OE2-NE 3.46Å; E73-R173 PolarHBondContact OE2-NE 3.11Å; E73-R173 IonicContact OE2-NH2 2.63Å; E73-R173 PolarHBondContact OE2-NH2 3.33Å; W78-R173 VanDerWaalsContact CE2-NH1 3.26Å; W78-R173 VanDerWaalsContact CZ2-NH1 3.31Å; V171-R173 PolarHBondContact O-N 3.29Å; R173-I175 HydrophobicContact CG-CD1 4.37Å; R173-I175 HydrophobicContact CG-CG1 4.19Å; R173-N221 WeakPolarHBondContact CA-O 3.45Å; R173-F223 HydrophobicContact CB-CD2 3.76Å; R173-F223 HydrophobicContact CB-CE2 3.65Å; R173-F223 HydrophobicContact CG-CD2 4.38Å; R173-F223 HydrophobicContact CG-CE2 4.39Å
174	E	88.9	Confident	87.4	Confident	88 Å²	88	81 Å²	81	41%	0.411	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	132.7	169.1	-177.6	-175.7	155.4	0	0	108.5	R219 N221 T222 F223	E174-R219 IonicContact OE1-NH1 2.71Å; E174-R219 PolarHBondContact OE1-NH1 3.04Å; E174-N221 PolarHBondContact N-O 2.91Å; E174-T222 HydrophobicContact CG-CG2 4.43Å; E174-T222 CarbonylContact O-C 3.59Å; E174-T222 WeakPolarHBondContact O-CA 3.4Å; E174-T222 PolarHBondContact OE2-OG1 3.39Å; E174-F223 PolarHBondContact O-N 3.5Å
175	I	91.7	Very high	87.5	Confident	30 Å²	30	79.2 Å²	79.2	15%	0.154	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115.7	-179.5	-53.6	174	0	0	0	109.8	A60 R173 W177 F210	A60-I175 HydrophobicContact CB-CD1 3.61Å; R173-I175 HydrophobicContact CG-CD1 4.37Å; R173-I175 HydrophobicContact CG-CG1 4.19Å; I175-W177 HydrophobicContact CB-CZ2 4.28Å; I175-W177 HydrophobicContact CD1-CH2 4.34Å; I175-W177 HydrophobicContact CD1-CZ2 3.93Å; I175-W177 HydrophobicContact CG2-CD2 3.72Å; I175-W177 HydrophobicContact CG2-CE3 4.02Å; I175-W177 HydrophobicContact CG2-CG 4.28Å; I175-W177 HydrophobicContact CG2-CH2 4.02Å; I175-W177 HydrophobicContact CG2-CZ2 3.71Å; I175-W177 HydrophobicContact CG2-CZ3 4.17Å; I175-W177 PolarHBondContact O-N 2.81Å; I175-F210 HydrophobicContact CG2-CE1 3.68Å; I175-F210 HydrophobicContact CG2-CZ 4.33Å
176	L	92	Very high	87.6	Confident	52 Å²	52	77 Å²	77	27%	0.272	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	97.9	171.4	-61.7	178.9	0	0	0	109.2	S178 T222 F223 V224 Y225	L176-S178 PolarHBondContact O-N 2.74Å; L176-T222 HydrophobicContact CD1-CG2 3.74Å; L176-T222 HydrophobicContact CG-CG2 3.84Å; L176-F223 PolarHBondContact N-O 2.89Å; L176-V224 HydrophobicContact CB-CG2 4.39Å; L176-V224 HydrophobicContact CD1-CG2 4.06Å; L176-Y225 WeakPolarHBondContact O-CB 3.36Å; L176-Y225 PolarHBondContact O-N 3.41Å
177	W	91.7	Very high	87.8	Confident	67 Å²	67	81.5 Å²	81.5	25%	0.254	43%	0.431	S	S	.	.	S	Bend	trans	-69.7	-19.6	-178.7	-63.7	108.3	0	0	0	114.2	A60 K62 P63 I175 F210 Y225	A60-W177 HydrophobicContact CB-CZ2 4.19Å; K62-W177 HydrophobicContact CB-CD2 3.93Å; K62-W177 HydrophobicContact CB-CE3 3.46Å; K62-W177 VanDerWaalsContact CB-CE3 3.46Å; K62-W177 HydrophobicContact CB-CH2 4.14Å; K62-W177 HydrophobicContact CB-CZ3 3.57Å; P63-W177 HydrophobicContact CG-CG 4.35Å; I175-W177 HydrophobicContact CB-CZ2 4.28Å; I175-W177 HydrophobicContact CD1-CH2 4.34Å; I175-W177 HydrophobicContact CD1-CZ2 3.93Å; I175-W177 HydrophobicContact CG2-CD2 3.72Å; I175-W177 HydrophobicContact CG2-CE3 4.02Å; I175-W177 HydrophobicContact CG2-CG 4.28Å; I175-W177 HydrophobicContact CG2-CH2 4.02Å; I175-W177 HydrophobicContact CG2-CZ2 3.71Å; I175-W177 HydrophobicContact CG2-CZ3 4.17Å; I175-W177 PolarHBondContact O-N 2.81Å; W177-F210 HydrophobicContact CE3-CZ 4.4Å; W177-F210 AromaticContact CH2-CZ 3.96Å; W177-F210 HydrophobicContact CH2-CZ 3.96Å; W177-F210 HydrophobicContact CZ3-CE1 4.09Å; W177-F210 AromaticContact CZ3-CZ 3.58Å; W177-F210 HydrophobicContact CZ3-CZ 3.58Å; W177-Y225 HydrophobicContact CE3-CG 4.24Å
178	S	88.8	Confident	88.1	Confident	87 Å²	87	79.8 Å²	79.8	61%	0.608	42%	0.422	S	S	*	.	S	Bend	trans	-150.5	143.5	179	56.2	0	0	0	0	110.4	L176	L176-S178 PolarHBondContact O-N 2.74Å
179	V	89.5	Confident	88.7	Confident	29 Å²	29	75.4 Å²	75.4	18%	0.176	40%	0.397	C	S	.	.			trans	-91.5	119.6	172.2	177.5	0	0	0	0	109	F185 V224 L226	V179-F185 HydrophobicContact CG1-CB 3.52Å; V179-F185 HydrophobicContact CG1-CD2 4.09Å; V179-F185 HydrophobicContact CG1-CG 3.85Å; V179-F185 HydrophobicContact CG2-CD2 4.15Å; V179-F185 HydrophobicContact CG2-CE2 4.4Å; V179-F185 HydrophobicContact CG2-CG 4.24Å; V179-V224 HydrophobicContact CG2-CG1 3.7Å; V179-L226 HydrophobicContact CG2-CD2 3.53Å
180	E	84.3	Confident	89.6	Confident	196 Å²	196	74.7 Å²	74.7	92%	0.916	38%	0.383	S	S	*	.	S	Bend	trans	-66	-47.5	-178.1	-64.6	-178.8	172.6	0	0	112.5
181	N	90	Very high	90.2	Very high	93 Å²	93	77.4 Å²	77.4	50%	0.497	40%	0.396	S	S	.	.			trans	-111.4	89.7	176	-171.3	-17.8	0	0	0	110.7	R183 S184 F185	N181-R183 VanDerWaalsContact C-N 3.27Å; N181-R183 PolarHBondContact O-N 3.08Å; N181-R183 PolarHBondContact OD1-N 3.04Å; N181-S184 VanDerWaalsContact CB-OG 3.26Å; N181-S184 WeakPolarHBondContact CB-OG 3.02Å; N181-S184 PolarHBondContact O-N 2.89Å; N181-S184 PolarHBondContact O-OG 2.7Å; N181-S184 PolarHBondContact OD1-N 3.47Å; N181-S184 VanDerWaalsContact OD1-N 3.1Å; N181-S184 PolarHBondContact OD1-OG 2.71Å; N181-F185 PolarHBondContact O-N 3.13Å; N181-F185 VanDerWaalsContact O-N 3.11Å
182	I	92.3	Very high	90.9	Very high	24 Å²	24	76.4 Å²	76.4	12%	0.123	38%	0.381	C	S	.	.	H	α-helix	trans	-59.5	-38.1	-177.4	-62.1	-168.1	0	0	0	111.8	F186 V274 Q277 F279	I182-F186 VanDerWaalsContact O-CB 3.31Å; I182-F186 WeakPolarHBondContact O-CB 3.15Å; I182-F186 PolarHBondContact O-N 3.28Å; I182-V274 HydrophobicContact CG2-CB 4.36Å; I182-V274 HydrophobicContact CG2-CG1 3.47Å; I182-V274 VanDerWaalsContact CG2-CG1 3.47Å; I182-V274 HydrophobicContact CG2-CG2 3.9Å; I182-Q277 HydrophobicContact CD1-CB 3.84Å; I182-Q277 VanDerWaalsContact CD1-O 3.27Å; I182-Q277 WeakPolarHBondContact CD1-O 3.38Å; I182-F279 HydrophobicContact CB-CZ 4.24Å; I182-F279 HydrophobicContact CG2-CD1 4.45Å; I182-F279 HydrophobicContact CG2-CD2 4.48Å; I182-F279 HydrophobicContact CG2-CE1 3.84Å; I182-F279 HydrophobicContact CG2-CE2 3.85Å; I182-F279 HydrophobicContact CG2-CZ 3.52Å
183	R	90	Very high	91.7	Very high	202 Å²	202	74.8 Å²	74.8	76%	0.762	37%	0.372	S	S	*	.	H	α-helix	trans	-69.9	-44.4	-178.1	-72.4	-174.8	-178.1	162.8	0.9	112.2	N181 F185 F186 E187	N181-R183 VanDerWaalsContact C-N 3.27Å; N181-R183 PolarHBondContact O-N 3.08Å; N181-R183 PolarHBondContact OD1-N 3.04Å; R183-F185 VanDerWaalsContact C-N 3.35Å; R183-F186 PolarHBondContact O-N 3.01Å; R183-E187 PolarHBondContact O-N 3.3Å
184	S	91.1	Very high	92.1	Very high	57 Å²	57	73.8 Å²	73.8	40%	0.399	37%	0.369	S	S	.	.	H	α-helix	trans	-65.6	-42.2	177.8	64.6	0	0	0	0	111	N181 F186 E187 S188	N181-S184 VanDerWaalsContact CB-OG 3.26Å; N181-S184 WeakPolarHBondContact CB-OG 3.02Å; N181-S184 PolarHBondContact O-N 2.89Å; N181-S184 PolarHBondContact O-OG 2.7Å; N181-S184 PolarHBondContact OD1-N 3.47Å; N181-S184 VanDerWaalsContact OD1-N 3.1Å; N181-S184 PolarHBondContact OD1-OG 2.71Å; S184-F186 VanDerWaalsContact C-N 3.35Å; S184-F186 PolarHBondContact O-N 2.86Å; S184-E187 PolarHBondContact O-N 2.86Å; S184-S188 PolarHBondContact O-N 2.95Å; S184-S188 PolarHBondContact O-OG 3.04Å; S184-S188 VanDerWaalsContact O-OG 3.05Å
185	F	93.3	Very high	92.5	Very high	25 Å²	25	74.6 Å²	74.6	11%	0.11	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-45.8	175.2	-174.2	-85	0	0	0	111.4	V179 N181 R183 E187 S188 Y189 L216 V224 L226 L271 F279	V179-F185 HydrophobicContact CG1-CB 3.52Å; V179-F185 HydrophobicContact CG1-CD2 4.09Å; V179-F185 HydrophobicContact CG1-CG 3.85Å; V179-F185 HydrophobicContact CG2-CD2 4.15Å; V179-F185 HydrophobicContact CG2-CE2 4.4Å; V179-F185 HydrophobicContact CG2-CG 4.24Å; N181-F185 PolarHBondContact O-N 3.13Å; N181-F185 VanDerWaalsContact O-N 3.11Å; R183-F185 VanDerWaalsContact C-N 3.35Å; F185-E187 PolarHBondContact O-N 3.1Å; F185-S188 PolarHBondContact O-N 3.17Å; F185-Y189 HydrophobicContact CD1-CD2 4.01Å; F185-Y189 AromaticContact CD2-CD2 3.95Å; F185-Y189 HydrophobicContact CD2-CD2 3.95Å; F185-Y189 AromaticContact CD2-CE2 3.8Å; F185-Y189 HydrophobicContact CD2-CE2 3.8Å; F185-Y189 AromaticContact CE1-CD2 3.81Å; F185-Y189 HydrophobicContact CE1-CD2 3.81Å; F185-Y189 HydrophobicContact CE1-CE2 4.43Å; F185-Y189 AromaticContact CE2-CD2 3.76Å; F185-Y189 HydrophobicContact CE2-CD2 3.76Å; F185-Y189 AromaticContact CE2-CE2 3.53Å; F185-Y189 HydrophobicContact CE2-CE2 3.53Å; F185-Y189 HydrophobicContact CG-CD2 4.07Å; F185-Y189 HydrophobicContact CG-CE2 4.37Å; F185-Y189 AromaticContact CZ-CD2 3.68Å; F185-Y189 HydrophobicContact CZ-CD2 3.68Å; F185-Y189 AromaticContact CZ-CE2 3.87Å; F185-Y189 HydrophobicContact CZ-CE2 3.87Å; F185-Y189 WeakPolarHBondContact O-CD2 3.32Å; F185-Y189 PolarHBondContact O-N 2.9Å; F185-L216 HydrophobicContact CZ-CD2 4.5Å; F185-V224 HydrophobicContact CE2-CG1 4.12Å; F185-V224 HydrophobicContact CE2-CG2 4.32Å; F185-V224 HydrophobicContact CZ-CG1 4.06Å; F185-L226 HydrophobicContact CE1-CD1 3.77Å; F185-L226 HydrophobicContact CE1-CD2 4.35Å; F185-L226 HydrophobicContact CZ-CD1 4.2Å; F185-L271 HydrophobicContact CD1-CD1 4.35Å; F185-L271 HydrophobicContact CE1-CD1 3.95Å; F185-F279 HydrophobicContact CB-CZ 4.43Å; F185-F279 AromaticContact CD1-CE1 3.75Å; F185-F279 HydrophobicContact CD1-CE1 3.75Å; F185-F279 AromaticContact CD1-CZ 3.62Å; F185-F279 HydrophobicContact CD1-CZ 3.62Å; F185-F279 HydrophobicContact CE1-CE1 4.45Å; F185-F279 HydrophobicContact CE1-CZ 4.33Å; F185-F279 HydrophobicContact CG-CZ 4.33Å
186	F	94.1	Very high	92.8	Very high	23 Å²	23	73.2 Å²	73.2	10%	0.101	36%	0.364	C	S	.	.	H	α-helix	trans	-56.4	-50.3	174.7	169.7	-107.8	0	0	0	111.8	I182 R183 S184 S188 Y189 K190 L271 E272 S273 V274 F279	I182-F186 VanDerWaalsContact O-CB 3.31Å; I182-F186 WeakPolarHBondContact O-CB 3.15Å; I182-F186 PolarHBondContact O-N 3.28Å; R183-F186 PolarHBondContact O-N 3.01Å; S184-F186 VanDerWaalsContact C-N 3.35Å; S184-F186 PolarHBondContact O-N 2.86Å; F186-S188 VanDerWaalsContact C-N 3.28Å; F186-S188 PolarHBondContact O-N 3.17Å; F186-Y189 CarbonylContact O-C 3.59Å; F186-Y189 PolarHBondContact O-N 3.37Å; F186-Y189 VanDerWaalsContact O-N 3.1Å; F186-K190 HydrophobicContact CE1-CD 3.81Å; F186-K190 HydrophobicContact CE1-CG 4.25Å; F186-K190 HydrophobicContact CE2-CB 4.07Å; F186-K190 HydrophobicContact CE2-CD 4.27Å; F186-K190 HydrophobicContact CE2-CG 3.83Å; F186-K190 HydrophobicContact CZ-CB 4.09Å; F186-K190 HydrophobicContact CZ-CD 3.5Å; F186-K190 VanDerWaalsContact CZ-CD 3.5Å; F186-K190 HydrophobicContact CZ-CG 3.57Å; F186-K190 WeakPolarHBondContact O-CA 3.44Å; F186-K190 WeakPolarHBondContact O-CB 3.4Å; F186-K190 PolarHBondContact O-N 3.27Å; F186-L271 HydrophobicContact CD2-CB 4.21Å; F186-L271 HydrophobicContact CE2-CB 4.4Å; F186-E272 VanDerWaalsContact CZ-O 3.29Å; F186-E272 WeakPolarHBondContact CZ-O 3.42Å; F186-S273 VanDerWaalsContact CE2-N 3.29Å; F186-V274 HydrophobicContact CB-CG2 3.53Å; F186-V274 HydrophobicContact CD1-CG2 4.23Å; F186-V274 HydrophobicContact CD2-CG2 3.9Å; F186-V274 HydrophobicContact CG-CG2 3.6Å; F186-F279 HydrophobicContact CB-CE1 4.03Å
187	E	92.8	Very high	93.1	Very high	133 Å²	133	70.9 Å²	70.9	62%	0.621	35%	0.352	S	S	*	.	H	α-helix	trans	-60.8	-37.9	-178.2	-163.7	62.1	-154.9	0	0	112.2	R183 S184 F185 Y189	R183-E187 PolarHBondContact O-N 3.3Å; S184-E187 PolarHBondContact O-N 2.86Å; F185-E187 PolarHBondContact O-N 3.1Å; E187-Y189 VanDerWaalsContact C-N 3.3Å; E187-Y189 PolarHBondContact O-N 3.48Å
188	S	92.8	Very high	93.4	Very high	82 Å²	82	67.7 Å²	67.7	57%	0.573	34%	0.34	S	S	*	.	H	α-helix	trans	-67.8	-24.9	177.4	-59.4	0	0	0	0	114.3	S184 F185 F186	S184-S188 PolarHBondContact O-N 2.95Å; S184-S188 PolarHBondContact O-OG 3.04Å; S184-S188 VanDerWaalsContact O-OG 3.05Å; F185-S188 PolarHBondContact O-N 3.17Å; F186-S188 VanDerWaalsContact C-N 3.28Å; F186-S188 PolarHBondContact O-N 3.17Å
189	Y	94.8	Very high	93.8	Very high	25 Å²	25	65.4 Å²	65.4	10%	0.098	32%	0.32	C	S	.	.	H	α-helix	trans	-125.3	7.6	-172.1	-62.7	-71.2	0	0	0	114.2	F185 F186 E187 N191 R192 L194 L216	F185-Y189 HydrophobicContact CD1-CD2 4.01Å; F185-Y189 AromaticContact CD2-CD2 3.95Å; F185-Y189 HydrophobicContact CD2-CD2 3.95Å; F185-Y189 AromaticContact CD2-CE2 3.8Å; F185-Y189 HydrophobicContact CD2-CE2 3.8Å; F185-Y189 AromaticContact CE1-CD2 3.81Å; F185-Y189 HydrophobicContact CE1-CD2 3.81Å; F185-Y189 HydrophobicContact CE1-CE2 4.43Å; F185-Y189 AromaticContact CE2-CD2 3.76Å; F185-Y189 HydrophobicContact CE2-CD2 3.76Å; F185-Y189 AromaticContact CE2-CE2 3.53Å; F185-Y189 HydrophobicContact CE2-CE2 3.53Å; F185-Y189 HydrophobicContact CG-CD2 4.07Å; F185-Y189 HydrophobicContact CG-CE2 4.37Å; F185-Y189 AromaticContact CZ-CD2 3.68Å; F185-Y189 HydrophobicContact CZ-CD2 3.68Å; F185-Y189 AromaticContact CZ-CE2 3.87Å; F185-Y189 HydrophobicContact CZ-CE2 3.87Å; F185-Y189 WeakPolarHBondContact O-CD2 3.32Å; F185-Y189 PolarHBondContact O-N 2.9Å; F186-Y189 CarbonylContact O-C 3.59Å; F186-Y189 PolarHBondContact O-N 3.37Å; F186-Y189 VanDerWaalsContact O-N 3.1Å; E187-Y189 VanDerWaalsContact C-N 3.3Å; E187-Y189 PolarHBondContact O-N 3.48Å; Y189-N191 PolarHBondContact O-N 2.86Å; Y189-R192 PolarHBondContact O-N 2.84Å; Y189-L194 HydrophobicContact CD1-CD2 3.85Å; Y189-L194 HydrophobicContact CG-CD2 4.39Å; Y189-L216 HydrophobicContact CE1-CD2 4Å; Y189-L216 HydrophobicContact CE2-CD2 4.29Å
190	K	94.6	Very high	94.1	Very high	97 Å²	97	67 Å²	67	42%	0.422	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-56.6	131.2	-178.4	-178.1	179.4	-178	-179.9	0	111.2	F186 R192 L271	F186-K190 HydrophobicContact CE1-CD 3.81Å; F186-K190 HydrophobicContact CE1-CG 4.25Å; F186-K190 HydrophobicContact CE2-CB 4.07Å; F186-K190 HydrophobicContact CE2-CD 4.27Å; F186-K190 HydrophobicContact CE2-CG 3.83Å; F186-K190 HydrophobicContact CZ-CB 4.09Å; F186-K190 HydrophobicContact CZ-CD 3.5Å; F186-K190 VanDerWaalsContact CZ-CD 3.5Å; F186-K190 HydrophobicContact CZ-CG 3.57Å; F186-K190 WeakPolarHBondContact O-CA 3.44Å; F186-K190 WeakPolarHBondContact O-CB 3.4Å; F186-K190 PolarHBondContact O-N 3.27Å; K190-R192 PolarHBondContact O-N 2.89Å; K190-L271 CarbonylContact C-O 3.58Å; K190-L271 WeakPolarHBondContact CA-O 3.27Å
191	N	93.1	Very high	94.6	Very high	80 Å²	80	58.1 Å²	58.1	43%	0.428	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	13.2	178.4	-61.8	-22	0	0	0	115.2	Y189 L271	Y189-N191 PolarHBondContact O-N 2.86Å; N191-L271 PolarHBondContact N-O 2.82Å; N191-L271 PolarHBondContact OD1-O 2.88Å
192	R	94.9	Very high	94.8	Very high	79 Å²	79	60.3 Å²	60.3	30%	0.298	29%	0.288	S	S	.	.			trans	-90.5	138	175	-175.3	-178.8	173.7	179.6	-0.7	109.9	Y189 K190 L194 N217	Y189-R192 PolarHBondContact O-N 2.84Å; K190-R192 PolarHBondContact O-N 2.89Å; R192-L194 HydrophobicContact CG-CD2 4.48Å; R192-L194 PolarHBondContact O-N 3.09Å; R192-N217 VanDerWaalsContact CZ-OD1 3.24Å; R192-N217 PolarHBondContact NH1-ND2 3.27Å; R192-N217 PolarHBondContact NH1-OD1 3.26Å; R192-N217 PolarHBondContact NH2-OD1 2.9Å
193	P	96.3	Very high	94.8	Very high	80 Å²	80	59.9 Å²	59.9	52%	0.519	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	116.2	172.8	26.6	-33.8	0	0	0	110.9	T268 L270	P193-T268 HydrophobicContact CB-CG2 3.49Å; P193-T268 VanDerWaalsContact CB-CG2 3.49Å; P193-L270 HydrophobicContact CB-CD2 4.06Å
194	L	97	Very high	95	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.1	175	-53.8	178.3	0	0	0	109.5	Y189 R192 A196 I211 T268 I269 L271	Y189-L194 HydrophobicContact CD1-CD2 3.85Å; Y189-L194 HydrophobicContact CG-CD2 4.39Å; R192-L194 HydrophobicContact CG-CD2 4.48Å; R192-L194 PolarHBondContact O-N 3.09Å; L194-A196 PolarHBondContact O-N 3.01Å; L194-I211 HydrophobicContact CB-CD1 4.08Å; L194-I211 HydrophobicContact CB-CG2 4.15Å; L194-I211 HydrophobicContact CD1-CD1 4.11Å; L194-I211 HydrophobicContact CD1-CG1 4.46Å; L194-I211 HydrophobicContact CD1-CG2 4.41Å; L194-T268 CarbonylContact O-C 3.58Å; L194-T268 WeakPolarHBondContact O-CA 3.47Å; L194-I269 HydrophobicContact CB-CB 4.45Å; L194-I269 PolarHBondContact N-O 3.02Å; L194-I269 PolarHBondContact O-N 3.3Å; L194-L271 HydrophobicContact CD1-CD1 3.87Å; L194-L271 HydrophobicContact CD1-CG 4.09Å
195	K	97.8	Very high	95.2	Very high	105 Å²	105	47.6 Å²	47.6	46%	0.457	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	133.1	170.9	-55.7	-143.2	-138.7	129.1	0	109.4	L212 E214 S215	K195-L212 HydrophobicContact CB-CD1 4.04Å; K195-L212 PolarHBondContact O-N 3.05Å; K195-E214 VanDerWaalsContact CB-OE1 3.3Å; K195-E214 WeakPolarHBondContact CB-OE1 2.83Å; K195-E214 WeakPolarHBondContact CD-OE1 2.84Å; K195-E214 WeakPolarHBondContact CE-OE1 3.39Å; K195-E214 WeakPolarHBondContact CG-OE1 2.65Å; K195-E214 IonicContact NZ-OE1 3.8Å; K195-E214 PolarHBondContact NZ-OE1 2.83Å; K195-E214 IonicContact NZ-OE2 2.75Å; K195-E214 PolarHBondContact NZ-OE2 2.88Å; K195-S215 PolarHBondContact N-OG 2.95Å
196	A	98.1	Very high	95.4	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	159.9	-175.3	0	0	0	0	0	111.7	L194 V209 F210 I211 D266 V267 I269	L194-A196 PolarHBondContact O-N 3.01Å; A196-V209 HydrophobicContact CB-CB 4.18Å; A196-V209 HydrophobicContact CB-CG2 4.36Å; A196-F210 CarbonylContact C-O 3.55Å; A196-F210 WeakPolarHBondContact CA-O 3.4Å; A196-F210 WeakPolarHBondContact CB-O 2.96Å; A196-I211 HydrophobicContact CB-CD1 3.8Å; A196-D266 WeakPolarHBondContact O-CA 3.38Å; A196-V267 HydrophobicContact CB-CG2 4.14Å; A196-V267 PolarHBondContact N-O 3.11Å; A196-V267 PolarHBondContact O-N 3.2Å; A196-V267 VanDerWaalsContact O-O 3.11Å; A196-I269 HydrophobicContact CB-CG1 3.78Å
197	V	98	Very high	95.5	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.024	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.1	168.5	178.7	0	0	0	0	108.5	E199 V209 F210 L212 R265 D266	V197-E199 PolarHBondContact O-N 3.41Å; V197-V209 CarbonylContact O-C 3.54Å; V197-V209 VanDerWaalsContact O-CA 3.27Å; V197-V209 WeakPolarHBondContact O-CA 3.28Å; V197-F210 PolarHBondContact N-O 3.21Å; V197-F210 PolarHBondContact O-N 2.6Å; V197-L212 HydrophobicContact CG2-CD2 4.17Å; V197-R265 WeakPolarHBondContact CA-O 3.27Å; V197-D266 WeakPolarHBondContact CG2-OD1 3.11Å
198	V	98.3	Very high	95.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	112.6	174.8	177	0	0	0	0	109.3	V201 V207 V209 L262 Q264 R265 V267	V198-V201 HydrophobicContact CG1-CG2 3.97Å; V198-V207 HydrophobicContact CG1-CB 4.1Å; V198-V207 HydrophobicContact CG1-CG1 4.27Å; V198-V209 HydrophobicContact CG2-CG1 4.05Å; V198-L262 VanDerWaalsContact CB-O 3.26Å; V198-L262 WeakPolarHBondContact CB-O 3.45Å; V198-L262 HydrophobicContact CG2-CB 4.24Å; V198-Q264 WeakPolarHBondContact O-CA 3.48Å; V198-Q264 PolarHBondContact O-N 2.76Å; V198-R265 PolarHBondContact N-O 2.86Å; V198-V267 HydrophobicContact CG2-CG1 4.03Å; V198-V267 HydrophobicContact CG2-CG2 3.77Å
199	E	96.8	Very high	95.9	Very high	38 Å²	38	36.8 Å²	36.8	18%	0.178	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-32.8	-178.9	-173.3	57.9	-155.3	0	0	112	R81 V197 Q208 F210 Y225 L263	R81-E199 IonicContact CZ-OE1 3.28Å; R81-E199 IonicContact CZ-OE2 3.76Å; R81-E199 IonicContact NH1-OE2 2.82Å; R81-E199 IonicContact NH2-OE1 2.88Å; R81-E199 PolarHBondContact NH2-OE1 3.01Å; R81-E199 IonicContact NH2-OE2 3.56Å; R81-E199 PolarHBondContact NH2-OE2 2.7Å; V197-E199 PolarHBondContact O-N 3.41Å; E199-Q208 PolarHBondContact N-O 3.4Å; E199-F210 HydrophobicContact CB-CD2 4.02Å; E199-F210 HydrophobicContact CB-CE2 4.18Å; E199-F210 HydrophobicContact CG-CD2 4.19Å; E199-F210 HydrophobicContact CG-CE2 3.85Å; E199-Y225 HydrophobicContact CB-CE2 4.14Å; E199-Y225 HydrophobicContact CG-CE2 4.28Å; E199-L263 WeakPolarHBondContact O-CD1 3.32Å
200	N	95.5	Very high	96	Very high	64 Å²	64	36 Å²	36	34%	0.342	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	152.5	-179	-171.9	27.1	0	0	0	111.1	V207 Q208	N200-V207 WeakPolarHBondContact O-CA 3.27Å; N200-Q208 HydrophobicContact CB-CB 4.16Å; N200-Q208 HydrophobicContact CB-CG 4.37Å; N200-Q208 PolarHBondContact N-O 3.38Å; N200-Q208 VanDerWaalsContact N-O 3.16Å; N200-Q208 PolarHBondContact ND2-OE1 2.76Å; N200-Q208 PolarHBondContact O-N 2.84Å
201	V	96.2	Very high	96.2	Very high	8 Å²	8	31.4 Å²	31.4	5%	0.048	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	117.3	173.6	-176.1	0	0	0	0	107.7	V198 D203 V207 L255 T258 E259 L263	V198-V201 HydrophobicContact CG1-CG2 3.97Å; V201-D203 WeakPolarHBondContact CG1-O 3.36Å; V201-V207 HydrophobicContact CG1-CG1 4.3Å; V201-V207 HydrophobicContact CG2-CG1 4.17Å; V201-L255 HydrophobicContact CB-CD1 4.01Å; V201-L255 HydrophobicContact CG1-CD1 3.62Å; V201-L255 WeakPolarHBondContact O-CD1 3.3Å; V201-T258 HydrophobicContact CG1-CG2 3.65Å; V201-T258 HydrophobicContact CG2-CG2 4.26Å; V201-E259 HydrophobicContact CB-CB 4.42Å; V201-E259 HydrophobicContact CG2-CB 4.37Å; V201-L263 HydrophobicContact CG2-CB 4.5Å
202	R	92.7	Very high	96.3	Very high	140 Å²	140	29 Å²	29	53%	0.528	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-43.6	-176.1	-177.1	-176	178.4	154.8	1.7	111.4	S206	R202-S206 PolarHBondContact N-O 2.92Å
203	D	92.7	Very high	96.2	Very high	15 Å²	15	26.3 Å²	26.3	8%	0.08	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	-175.7	175.2	61.7	44.4	0	0	0	109	V201 C205 S206 I238	V201-D203 WeakPolarHBondContact CG1-O 3.36Å; D203-C205 PolarHBondContact O-N 3.25Å; D203-C205 VanDerWaalsContact O-N 3.14Å; D203-C205 PolarHBondContact OD1-N 3.17Å; D203-C205 PolarHBondContact OD1-SG 2.82Å; D203-C205 VanDerWaalsContact OD1-SG 3.41Å; D203-S206 PolarHBondContact N-O 2.9Å; D203-S206 WeakPolarHBondContact OD1-CB 3.3Å; D203-S206 PolarHBondContact OD1-N 3.43Å; D203-S206 PolarHBondContact OD1-OG 3.3Å; D203-S206 PolarHBondContact OD2-OG 3.08Å; D203-I238 HydrophobicContact CB-CD1 4.45Å
204	G	94.5	Very high	96	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-30.6	-176.9	0	0	0	0	0	114.7	T258 L294	G204-T258 PolarHBondContact O-OG1 2.85Å; G204-L294 WeakPolarHBondContact O-CD1 3.37Å
205	C	96	Very high	95.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	0	-175.2	59	0	0	0	0	114.3	D203 T229 M230 I233 C235	D203-C205 PolarHBondContact O-N 3.25Å; D203-C205 VanDerWaalsContact O-N 3.14Å; D203-C205 PolarHBondContact OD1-N 3.17Å; D203-C205 PolarHBondContact OD1-SG 2.82Å; D203-C205 VanDerWaalsContact OD1-SG 3.41Å; C205-T229 CarbonylContact O-C 3.58Å; C205-T229 WeakPolarHBondContact O-CA 3.48Å; C205-M230 HydrophobicContact CB-CB 4.24Å; C205-M230 HydrophobicContact CB-CG 4.49Å; C205-M230 HydrophobicContact CB-SD 4.29Å; C205-M230 WeakPolarHBondContact O-CG 3.41Å; C205-M230 PolarHBondContact O-N 3.35Å; C205-I233 HydrophobicContact CB-CD1 4.09Å; C205-I233 HydrophobicContact CB-CG1 4.25Å; C205-C235 HydrophobicContact CB-CB 4.11Å; C205-C235 PolarHBondContact SG-N 2.9Å; C205-C235 VanDerWaalsContact SG-N 3.43Å
206	S	95.8	Very high	95.5	Very high	9 Å²	9	24.3 Å²	24.3	6%	0.063	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.7	-176.9	-48.7	0	0	0	0	110.7	R202 D203 V228 T229	R202-S206 PolarHBondContact N-O 2.92Å; D203-S206 PolarHBondContact N-O 2.9Å; D203-S206 WeakPolarHBondContact OD1-CB 3.3Å; D203-S206 PolarHBondContact OD1-N 3.43Å; D203-S206 PolarHBondContact OD1-OG 3.3Å; D203-S206 PolarHBondContact OD2-OG 3.08Å; S206-V228 WeakPolarHBondContact CA-O 3.17Å; S206-T229 PolarHBondContact OG-OG1 2.99Å; S206-T229 VanDerWaalsContact OG-OG1 3.14Å
207	V	97.6	Very high	94.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	160.6	-178.6	-58.6	0	0	0	0	110.9	V198 N200 V201 V209 T227 V228 T258 I283	V198-V207 HydrophobicContact CG1-CB 4.1Å; V198-V207 HydrophobicContact CG1-CG1 4.27Å; N200-V207 WeakPolarHBondContact O-CA 3.27Å; V201-V207 HydrophobicContact CG1-CG1 4.3Å; V201-V207 HydrophobicContact CG2-CG1 4.17Å; V207-V209 HydrophobicContact CB-CG1 4.42Å; V207-V209 HydrophobicContact CG2-CG1 3.62Å; V207-T227 WeakPolarHBondContact O-CA 2.92Å; V207-V228 HydrophobicContact CG2-CB 4.44Å; V207-V228 PolarHBondContact N-O 3.16Å; V207-V228 PolarHBondContact O-N 3.32Å; V207-T258 HydrophobicContact CG1-CG2 4.23Å; V207-I283 HydrophobicContact CB-CD1 4.43Å; V207-I283 HydrophobicContact CG1-CD1 4.25Å; V207-I283 HydrophobicContact CG2-CD1 3.33Å
208	Q	96.6	Very high	93.2	Very high	28 Å²	28	37.2 Å²	37.2	13%	0.131	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129.6	168.5	-47.6	-174.9	-72.7	0	0	108.3	E199 N200 Y225 L226 T227	E199-Q208 PolarHBondContact N-O 3.4Å; N200-Q208 HydrophobicContact CB-CB 4.16Å; N200-Q208 HydrophobicContact CB-CG 4.37Å; N200-Q208 PolarHBondContact N-O 3.38Å; N200-Q208 VanDerWaalsContact N-O 3.16Å; N200-Q208 PolarHBondContact ND2-OE1 2.76Å; N200-Q208 PolarHBondContact O-N 2.84Å; Q208-Y225 HydrophobicContact CB-CE1 4.22Å; Q208-Y225 HydrophobicContact CB-CE2 4.09Å; Q208-Y225 VanDerWaalsContact CB-OH 3.23Å; Q208-Y225 WeakPolarHBondContact CB-OH 2.74Å; Q208-Y225 PolarHBondContact NE2-OH 2.73Å; Q208-Y225 PolarHBondContact OE1-OH 2.82Å; Q208-L226 CarbonylContact C-O 3.59Å; Q208-L226 VanDerWaalsContact CA-O 3.26Å; Q208-L226 WeakPolarHBondContact CA-O 2.93Å; Q208-T227 HydrophobicContact CG-CG2 4.47Å; Q208-T227 PolarHBondContact NE2-OG1 3.17Å
209	V	97.7	Very high	92.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	152.3	-170.7	-54.3	0	0	0	0	111	A196 V197 V198 V207 I211 Y225 L226 V228 I269	A196-V209 HydrophobicContact CB-CB 4.18Å; A196-V209 HydrophobicContact CB-CG2 4.36Å; V197-V209 CarbonylContact O-C 3.54Å; V197-V209 VanDerWaalsContact O-CA 3.27Å; V197-V209 WeakPolarHBondContact O-CA 3.28Å; V198-V209 HydrophobicContact CG2-CG1 4.05Å; V207-V209 HydrophobicContact CB-CG1 4.42Å; V207-V209 HydrophobicContact CG2-CG1 3.62Å; V209-I211 HydrophobicContact CG2-CD1 3.99Å; V209-Y225 WeakPolarHBondContact O-CA 3.18Å; V209-L226 HydrophobicContact CG2-CB 4.07Å; V209-L226 PolarHBondContact N-O 3.31Å; V209-L226 PolarHBondContact O-N 3.48Å; V209-V228 HydrophobicContact CG2-CG2 4.05Å; V209-I269 HydrophobicContact CG1-CD1 4.34Å
210	F	96.9	Very high	91.3	Very high	8 Å²	8	46.4 Å²	46.4	4%	0.035	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.4	160.1	-79.3	-67	0	0	0	109.4	I175 W177 A196 V197 E199 F223 V224 Y225	I175-F210 HydrophobicContact CG2-CE1 3.68Å; I175-F210 HydrophobicContact CG2-CZ 4.33Å; W177-F210 HydrophobicContact CE3-CZ 4.4Å; W177-F210 AromaticContact CH2-CZ 3.96Å; W177-F210 HydrophobicContact CH2-CZ 3.96Å; W177-F210 HydrophobicContact CZ3-CE1 4.09Å; W177-F210 AromaticContact CZ3-CZ 3.58Å; W177-F210 HydrophobicContact CZ3-CZ 3.58Å; A196-F210 CarbonylContact C-O 3.55Å; A196-F210 WeakPolarHBondContact CA-O 3.4Å; A196-F210 WeakPolarHBondContact CB-O 2.96Å; V197-F210 PolarHBondContact N-O 3.21Å; V197-F210 PolarHBondContact O-N 2.6Å; E199-F210 HydrophobicContact CB-CD2 4.02Å; E199-F210 HydrophobicContact CB-CE2 4.18Å; E199-F210 HydrophobicContact CG-CD2 4.19Å; E199-F210 HydrophobicContact CG-CE2 3.85Å; F210-F223 HydrophobicContact CB-CD1 4.3Å; F210-F223 HydrophobicContact CD1-CB 3.94Å; F210-F223 HydrophobicContact CE1-CB 4.5Å; F210-V224 CarbonylContact C-O 3.47Å; F210-V224 WeakPolarHBondContact CA-O 3.18Å; F210-Y225 AromaticContact CD1-CD2 3.88Å; F210-Y225 HydrophobicContact CD1-CD2 3.88Å; F210-Y225 HydrophobicContact CD1-CG 4.5Å; F210-Y225 HydrophobicContact CD2-CD2 4.26Å; F210-Y225 AromaticContact CE1-CD2 3.56Å; F210-Y225 HydrophobicContact CE1-CD2 3.56Å; F210-Y225 HydrophobicContact CE1-CG 4.12Å; F210-Y225 AromaticContact CE2-CD2 3.98Å; F210-Y225 HydrophobicContact CE2-CD2 3.98Å; F210-Y225 HydrophobicContact CE2-CE2 4.29Å; F210-Y225 HydrophobicContact CG-CD2 4.23Å; F210-Y225 AromaticContact CZ-CD2 3.63Å; F210-Y225 HydrophobicContact CZ-CD2 3.63Å; F210-Y225 HydrophobicContact CZ-CE2 4.25Å; F210-Y225 HydrophobicContact CZ-CG 4.48Å
211	I	96.8	Very high	90.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	130.8	165	-53.7	-54.7	0	0	0	108.2	L194 A196 V209 L216 F223 V224 L226 I269	L194-I211 HydrophobicContact CB-CD1 4.08Å; L194-I211 HydrophobicContact CB-CG2 4.15Å; L194-I211 HydrophobicContact CD1-CD1 4.11Å; L194-I211 HydrophobicContact CD1-CG1 4.46Å; L194-I211 HydrophobicContact CD1-CG2 4.41Å; A196-I211 HydrophobicContact CB-CD1 3.8Å; V209-I211 HydrophobicContact CG2-CD1 3.99Å; I211-L216 HydrophobicContact CG2-CD2 3.83Å; I211-L216 HydrophobicContact CG2-CG 4.18Å; I211-F223 WeakPolarHBondContact O-CA 3.14Å; I211-V224 HydrophobicContact CB-CB 4.24Å; I211-V224 PolarHBondContact N-O 3.02Å; I211-V224 PolarHBondContact O-N 3.26Å; I211-L226 HydrophobicContact CD1-CD1 4.03Å; I211-L226 HydrophobicContact CG1-CD1 3.57Å; I211-L226 HydrophobicContact CG1-CG 4.1Å; I211-I269 HydrophobicContact CD1-CG1 4.38Å
212	L	95.5	Very high	90.6	Very high	29 Å²	29	46.8 Å²	46.8	15%	0.152	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-80.7	147.4	-176.4	-59.4	-178.7	0	0	0	111.4	K195 V197 E214 S215 F223	K195-L212 HydrophobicContact CB-CD1 4.04Å; K195-L212 PolarHBondContact O-N 3.05Å; V197-L212 HydrophobicContact CG2-CD2 4.17Å; L212-E214 HydrophobicContact CB-CG 3.91Å; L212-E214 PolarHBondContact O-N 2.69Å; L212-E214 VanDerWaalsContact O-N 3.12Å; L212-S215 PolarHBondContact O-N 3.09Å; L212-F223 HydrophobicContact CD2-CD1 4.03Å; L212-F223 HydrophobicContact CD2-CE1 3.6Å
213	P	93.5	Very high	90.7	Very high	24 Å²	24	41.1 Å²	41.1	16%	0.156	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-54.2	-35.9	-176.7	-22.3	25.9	0	0	0	114.4	S215 L216 T222 F223	P213-S215 PolarHBondContact O-N 3.29Å; P213-S215 VanDerWaalsContact O-N 3.1Å; P213-L216 PolarHBondContact O-N 2.56Å; P213-T222 VanDerWaalsContact CA-O 3.32Å; P213-T222 WeakPolarHBondContact CA-O 2.75Å; P213-T222 VanDerWaalsContact CG-O 3.27Å; P213-T222 WeakPolarHBondContact CG-O 3.32Å; P213-F223 HydrophobicContact CG-CD2 3.93Å; P213-F223 HydrophobicContact CG-CE1 4.48Å; P213-F223 HydrophobicContact CG-CE2 3.66Å; P213-F223 HydrophobicContact CG-CG 4.45Å; P213-F223 HydrophobicContact CG-CZ 3.97Å
214	E	91.7	Very high	90.8	Very high	118 Å²	118	40.6 Å²	40.6	55%	0.551	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-60.5	-18.3	178.6	53.6	171.4	-157.5	0	0	114.6	K195 L212	K195-E214 VanDerWaalsContact CB-OE1 3.3Å; K195-E214 WeakPolarHBondContact CB-OE1 2.83Å; K195-E214 WeakPolarHBondContact CD-OE1 2.84Å; K195-E214 WeakPolarHBondContact CE-OE1 3.39Å; K195-E214 WeakPolarHBondContact CG-OE1 2.65Å; K195-E214 IonicContact NZ-OE1 3.8Å; K195-E214 PolarHBondContact NZ-OE1 2.83Å; K195-E214 IonicContact NZ-OE2 2.75Å; K195-E214 PolarHBondContact NZ-OE2 2.88Å; L212-E214 HydrophobicContact CB-CG 3.91Å; L212-E214 PolarHBondContact O-N 2.69Å; L212-E214 VanDerWaalsContact O-N 3.12Å
215	S	93	Very high	90.8	Very high	8 Å²	8	41.7 Å²	41.7	6%	0.056	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-93.4	-6.1	176.8	-60.7	0	0	0	0	113.3	K195 L212 P213	K195-S215 PolarHBondContact N-OG 2.95Å; L212-S215 PolarHBondContact O-N 3.09Å; P213-S215 PolarHBondContact O-N 3.29Å; P213-S215 VanDerWaalsContact O-N 3.1Å
216	L	91.3	Very high	90.8	Very high	16 Å²	16	41.9 Å²	41.9	8%	0.084	21%	0.211	C	C	.	.			trans	-105.7	123.9	-175.8	-55.7	175.1	0	0	0	109.1	F185 Y189 I211 P213 E218 T222 V224	F185-L216 HydrophobicContact CZ-CD2 4.5Å; Y189-L216 HydrophobicContact CE1-CD2 4Å; Y189-L216 HydrophobicContact CE2-CD2 4.29Å; I211-L216 HydrophobicContact CG2-CD2 3.83Å; I211-L216 HydrophobicContact CG2-CG 4.18Å; P213-L216 PolarHBondContact O-N 2.56Å; L216-E218 VanDerWaalsContact C-N 3.26Å; L216-E218 PolarHBondContact O-N 3.24Å; L216-T222 HydrophobicContact CD1-CG2 4.49Å; L216-T222 WeakPolarHBondContact CD1-O 3.01Å; L216-V224 HydrophobicContact CD1-CG2 3.59Å; L216-V224 HydrophobicContact CD2-CG2 4.41Å
217	N	77	Confident	90.7	Very high	108 Å²	108	43.4 Å²	43.4	58%	0.578	22%	0.22	S	C	*	.	S	Bend	trans	-68.6	-21.7	-171.9	-74.2	-15.1	0	0	0	114.1	R192	R192-N217 VanDerWaalsContact CZ-OD1 3.24Å; R192-N217 PolarHBondContact NH1-ND2 3.27Å; R192-N217 PolarHBondContact NH1-OD1 3.26Å; R192-N217 PolarHBondContact NH2-OD1 2.9Å
218	E	71	Confident	90.7	Very high	168 Å²	168	43.4 Å²	43.4	79%	0.785	22%	0.22	S	C	*	.	S	Bend	trans	-131.3	4.4	-159.6	-66.8	179.7	179.8	0	0	114.7	L216	L216-E218 VanDerWaalsContact C-N 3.26Å; L216-E218 PolarHBondContact O-N 3.24Å
219	R	74.8	Confident	90.7	Very high	120 Å²	120	43.7 Å²	43.7	45%	0.453	22%	0.223	S	C	.	.			trans	-142.8	93.1	179.2	-62.3	-166.1	-175	-168.5	5.9	113.5	E174 T222	E174-R219 IonicContact OE1-NH1 2.71Å; E174-R219 PolarHBondContact OE1-NH1 3.04Å; R219-T222 HydrophobicContact CB-CG2 4.33Å; R219-T222 VanDerWaalsContact CB-OG1 3.27Å; R219-T222 WeakPolarHBondContact CB-OG1 3.21Å; R219-T222 PolarHBondContact O-N 3.29Å
220	P	80.2	Confident	90.6	Very high	111 Å²	111	43.8 Å²	43.8	72%	0.721	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	142.3	171.4	26.7	-32.8	0	0	0	109.9	T222	P220-T222 PolarHBondContact O-N 3.43Å
221	N	86.1	Confident	90.5	Very high	80 Å²	80	43.4 Å²	43.4	43%	0.428	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	10.4	-179.5	-47.3	-48.3	0	0	0	116.8	V171 R173 E174	V171-N221 HydrophobicContact CG1-CB 4.37Å; V171-N221 VanDerWaalsContact CG1-ND2 3.32Å; V171-N221 WeakPolarHBondContact CG1-ND2 2.92Å; R173-N221 WeakPolarHBondContact CA-O 3.45Å; E174-N221 PolarHBondContact N-O 2.91Å
222	T	91.9	Very high	90.2	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.4	174.5	-64.3	0	0	0	0	112.4	E174 L176 P213 L216 R219 P220 V224	E174-T222 HydrophobicContact CG-CG2 4.43Å; E174-T222 CarbonylContact O-C 3.59Å; E174-T222 WeakPolarHBondContact O-CA 3.4Å; E174-T222 PolarHBondContact OE2-OG1 3.39Å; L176-T222 HydrophobicContact CD1-CG2 3.74Å; L176-T222 HydrophobicContact CG-CG2 3.84Å; P213-T222 VanDerWaalsContact CA-O 3.32Å; P213-T222 WeakPolarHBondContact CA-O 2.75Å; P213-T222 VanDerWaalsContact CG-O 3.27Å; P213-T222 WeakPolarHBondContact CG-O 3.32Å; L216-T222 HydrophobicContact CD1-CG2 4.49Å; L216-T222 WeakPolarHBondContact CD1-O 3.01Å; R219-T222 HydrophobicContact CB-CG2 4.33Å; R219-T222 VanDerWaalsContact CB-OG1 3.27Å; R219-T222 WeakPolarHBondContact CB-OG1 3.21Å; R219-T222 PolarHBondContact O-N 3.29Å; P220-T222 PolarHBondContact O-N 3.43Å; T222-V224 HydrophobicContact CG2-CG2 4.31Å
223	F	94	Very high	90.2	Very high	21 Å²	21	42 Å²	42	9%	0.092	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.4	171.2	-68.1	-106	0	0	0	109.2	W78 R173 E174 L176 F210 I211 L212 P213	W78-F223 HydrophobicContact CZ2-CE1 4.03Å; W78-F223 HydrophobicContact CZ2-CZ 4.4Å; R173-F223 HydrophobicContact CB-CD2 3.76Å; R173-F223 HydrophobicContact CB-CE2 3.65Å; R173-F223 HydrophobicContact CG-CD2 4.38Å; R173-F223 HydrophobicContact CG-CE2 4.39Å; E174-F223 PolarHBondContact O-N 3.5Å; L176-F223 PolarHBondContact N-O 2.89Å; F210-F223 HydrophobicContact CB-CD1 4.3Å; F210-F223 HydrophobicContact CD1-CB 3.94Å; F210-F223 HydrophobicContact CE1-CB 4.5Å; I211-F223 WeakPolarHBondContact O-CA 3.14Å; L212-F223 HydrophobicContact CD2-CD1 4.03Å; L212-F223 HydrophobicContact CD2-CE1 3.6Å; P213-F223 HydrophobicContact CG-CD2 3.93Å; P213-F223 HydrophobicContact CG-CE1 4.48Å; P213-F223 HydrophobicContact CG-CE2 3.66Å; P213-F223 HydrophobicContact CG-CG 4.45Å; P213-F223 HydrophobicContact CG-CZ 3.97Å
224	V	94.9	Very high	90.2	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.8	178.2	-176.8	0	0	0	0	109.5	L176 V179 F185 F210 I211 L216 T222 L226	L176-V224 HydrophobicContact CB-CG2 4.39Å; L176-V224 HydrophobicContact CD1-CG2 4.06Å; V179-V224 HydrophobicContact CG2-CG1 3.7Å; F185-V224 HydrophobicContact CE2-CG1 4.12Å; F185-V224 HydrophobicContact CE2-CG2 4.32Å; F185-V224 HydrophobicContact CZ-CG1 4.06Å; F210-V224 CarbonylContact C-O 3.47Å; F210-V224 WeakPolarHBondContact CA-O 3.18Å; I211-V224 HydrophobicContact CB-CB 4.24Å; I211-V224 PolarHBondContact N-O 3.02Å; I211-V224 PolarHBondContact O-N 3.26Å; L216-V224 HydrophobicContact CD1-CG2 3.59Å; L216-V224 HydrophobicContact CD2-CG2 4.41Å; T222-V224 HydrophobicContact CG2-CG2 4.31Å; V224-L226 HydrophobicContact CG1-CD2 3.61Å; V224-L226 HydrophobicContact CG1-CG 3.97Å
225	Y	95	Very high	90.3	Very high	23 Å²	23	39.7 Å²	39.7	9%	0.09	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	117.9	177.6	-169.1	-103.1	0	0	0	110.7	L176 W177 E199 Q208 V209 F210	L176-Y225 WeakPolarHBondContact O-CB 3.36Å; L176-Y225 PolarHBondContact O-N 3.41Å; W177-Y225 HydrophobicContact CE3-CG 4.24Å; E199-Y225 HydrophobicContact CB-CE2 4.14Å; E199-Y225 HydrophobicContact CG-CE2 4.28Å; Q208-Y225 HydrophobicContact CB-CE1 4.22Å; Q208-Y225 HydrophobicContact CB-CE2 4.09Å; Q208-Y225 VanDerWaalsContact CB-OH 3.23Å; Q208-Y225 WeakPolarHBondContact CB-OH 2.74Å; Q208-Y225 PolarHBondContact NE2-OH 2.73Å; Q208-Y225 PolarHBondContact OE1-OH 2.82Å; V209-Y225 WeakPolarHBondContact O-CA 3.18Å; F210-Y225 AromaticContact CD1-CD2 3.88Å; F210-Y225 HydrophobicContact CD1-CD2 3.88Å; F210-Y225 HydrophobicContact CD1-CG 4.5Å; F210-Y225 HydrophobicContact CD2-CD2 4.26Å; F210-Y225 AromaticContact CE1-CD2 3.56Å; F210-Y225 HydrophobicContact CE1-CD2 3.56Å; F210-Y225 HydrophobicContact CE1-CG 4.12Å; F210-Y225 AromaticContact CE2-CD2 3.98Å; F210-Y225 HydrophobicContact CE2-CD2 3.98Å; F210-Y225 HydrophobicContact CE2-CE2 4.29Å; F210-Y225 HydrophobicContact CG-CD2 4.23Å; F210-Y225 AromaticContact CZ-CD2 3.63Å; F210-Y225 HydrophobicContact CZ-CD2 3.63Å; F210-Y225 HydrophobicContact CZ-CE2 4.25Å; F210-Y225 HydrophobicContact CZ-CG 4.48Å
226	L	94.6	Very high	90.3	Very high	5 Å²	5	40 Å²	40	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	148	-177.9	-58.4	-176.7	0	0	0	111.2	V179 F185 Q208 V209 I211 V224 V228 F279	V179-L226 HydrophobicContact CG2-CD2 3.53Å; F185-L226 HydrophobicContact CE1-CD1 3.77Å; F185-L226 HydrophobicContact CE1-CD2 4.35Å; F185-L226 HydrophobicContact CZ-CD1 4.2Å; Q208-L226 CarbonylContact C-O 3.59Å; Q208-L226 VanDerWaalsContact CA-O 3.26Å; Q208-L226 WeakPolarHBondContact CA-O 2.93Å; V209-L226 HydrophobicContact CG2-CB 4.07Å; V209-L226 PolarHBondContact N-O 3.31Å; V209-L226 PolarHBondContact O-N 3.48Å; I211-L226 HydrophobicContact CD1-CD1 4.03Å; I211-L226 HydrophobicContact CG1-CD1 3.57Å; I211-L226 HydrophobicContact CG1-CG 4.1Å; V224-L226 HydrophobicContact CG1-CD2 3.61Å; V224-L226 HydrophobicContact CG1-CG 3.97Å; L226-V228 HydrophobicContact CB-CG2 4.11Å; L226-F279 HydrophobicContact CB-CD2 4.47Å; L226-F279 HydrophobicContact CD2-CD2 4.05Å; L226-F279 HydrophobicContact CD2-CE2 3.6Å; L226-F279 HydrophobicContact CD2-CZ 4.23Å
227	T	95.3	Very high	90.1	Very high	41 Å²	41	41 Å²	41	25%	0.252	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.2	161.3	-59	0	0	0	0	108.3	V207 Q208 T278 F279	V207-T227 WeakPolarHBondContact O-CA 2.92Å; Q208-T227 HydrophobicContact CG-CG2 4.47Å; Q208-T227 PolarHBondContact NE2-OG1 3.17Å; T227-T278 HydrophobicContact CG2-CG2 4.33Å; T227-F279 PolarHBondContact O-N 2.85Å
228	V	97.1	Very high	90.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	125.8	-176.2	-174.8	0	0	0	0	109.2	S206 V207 V209 L226 I269 L271 F279	S206-V228 WeakPolarHBondContact CA-O 3.17Å; V207-V228 HydrophobicContact CG2-CB 4.44Å; V207-V228 PolarHBondContact N-O 3.16Å; V207-V228 PolarHBondContact O-N 3.32Å; V209-V228 HydrophobicContact CG2-CG2 4.05Å; L226-V228 HydrophobicContact CB-CG2 4.11Å; V228-I269 HydrophobicContact CG1-CG2 4.28Å; V228-I269 HydrophobicContact CG2-CG2 4.42Å; V228-L271 HydrophobicContact CG2-CD2 4.39Å; V228-F279 WeakPolarHBondContact CA-O 3.5Å; V228-F279 HydrophobicContact CG2-CB 4.28Å
229	T	96.1	Very high	91.2	Very high	33 Å²	33	35 Å²	35	20%	0.202	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	136.3	170.5	-62.7	0	0	0	0	109.6	C205 S206 S231 F279 V280 G281	C205-T229 CarbonylContact O-C 3.58Å; C205-T229 WeakPolarHBondContact O-CA 3.48Å; S206-T229 PolarHBondContact OG-OG1 2.99Å; S206-T229 VanDerWaalsContact OG-OG1 3.14Å; T229-S231 PolarHBondContact O-N 2.83Å; T229-F279 PolarHBondContact N-O 2.71Å; T229-V280 VanDerWaalsContact O-CA 3.26Å; T229-V280 WeakPolarHBondContact O-CA 3.27Å; T229-G281 PolarHBondContact O-N 3Å
230	M	96.9	Very high	91.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	131.7	179.1	-64.1	172.7	-159.9	0	0	110.8	C205 I233 T258 L262 G281 I283 I290 A291 L294	C205-M230 HydrophobicContact CB-CB 4.24Å; C205-M230 HydrophobicContact CB-CG 4.49Å; C205-M230 HydrophobicContact CB-SD 4.29Å; C205-M230 WeakPolarHBondContact O-CG 3.41Å; C205-M230 PolarHBondContact O-N 3.35Å; M230-I233 HydrophobicContact CB-CD1 4.11Å; M230-I233 HydrophobicContact CB-CG1 3.8Å; M230-I233 HydrophobicContact SD-CD1 3.87Å; M230-T258 HydrophobicContact CE-CG2 4.04Å; M230-L262 HydrophobicContact CE-CD1 4.41Å; M230-G281 VanDerWaalsContact CA-O 3.3Å; M230-G281 WeakPolarHBondContact CA-O 3.5Å; M230-I283 HydrophobicContact CE-CD1 3.83Å; M230-I283 HydrophobicContact CG-CD1 3.63Å; M230-I283 HydrophobicContact CG-CG1 4.1Å; M230-I290 HydrophobicContact CE-CB 4.47Å; M230-I290 HydrophobicContact CE-CG1 4.26Å; M230-I290 HydrophobicContact CE-CG2 3.38Å; M230-I290 HydrophobicContact SD-CG2 3.62Å; M230-A291 HydrophobicContact CB-CB 4.49Å; M230-A291 HydrophobicContact SD-CB 4.07Å; M230-L294 HydrophobicContact CE-CD1 4.22Å; M230-L294 HydrophobicContact SD-CD1 3.81Å
231	S	94.3	Very high	91.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	156.1	171.6	51	0	0	0	0	111.7	T229 I233 E272 G281 S282	T229-S231 PolarHBondContact O-N 2.83Å; S231-I233 PolarHBondContact O-N 2.91Å; S231-E272 WeakPolarHBondContact CB-OE2 3.31Å; S231-E272 PolarHBondContact OG-OE2 2.89Å; S231-G281 PolarHBondContact N-O 3.44Å; S231-S282 PolarHBondContact OG-OG 3.1Å
232	G	89.8	Confident	90.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	-11.4	175.6	0	0	0	0	0	116.1	C302 I303 N306	G232-C302 CarbonylContact O-C 3.54Å; G232-C302 WeakPolarHBondContact O-CA 3.46Å; G232-I303 PolarHBondContact O-N 3.08Å; G232-N306 WeakPolarHBondContact CA-OD1 3.12Å; G232-N306 PolarHBondContact N-OD1 3.04Å
233	I	95.1	Very high	90	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	153.7	-172.3	69.7	157.6	0	0	0	114.9	C205 M230 S231 A291 L294 L295 A300 H301 I303 Y319	C205-I233 HydrophobicContact CB-CD1 4.09Å; C205-I233 HydrophobicContact CB-CG1 4.25Å; M230-I233 HydrophobicContact CB-CD1 4.11Å; M230-I233 HydrophobicContact CB-CG1 3.8Å; M230-I233 HydrophobicContact SD-CD1 3.87Å; S231-I233 PolarHBondContact O-N 2.91Å; I233-A291 HydrophobicContact CD1-CB 3.55Å; I233-A291 HydrophobicContact CG1-CB 4.01Å; I233-A291 HydrophobicContact CG2-CB 4.21Å; I233-L294 HydrophobicContact CD1-CB 4.28Å; I233-L294 HydrophobicContact CD1-CD1 3.83Å; I233-L295 HydrophobicContact CB-CD2 4.5Å; I233-L295 HydrophobicContact CG2-CD1 3.49Å; I233-L295 VanDerWaalsContact CG2-CD1 3.49Å; I233-L295 HydrophobicContact CG2-CD2 3.91Å; I233-L295 HydrophobicContact CG2-CG 3.7Å; I233-A300 HydrophobicContact CB-CB 4.27Å; I233-A300 HydrophobicContact CD1-CB 4.07Å; I233-H301 CarbonylContact C-O 3.6Å; I233-H301 VanDerWaalsContact CA-O 3.23Å; I233-H301 WeakPolarHBondContact CA-O 3.46Å; I233-I303 WeakPolarHBondContact O-CD1 3.33Å; I233-Y319 HydrophobicContact CG2-CD2 3.87Å; I233-Y319 HydrophobicContact CG2-CE2 4.03Å
234	K	93.6	Very high	89.3	Confident	90 Å²	90	49.8 Å²	49.8	39%	0.391	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	125.7	170	-172.3	57.6	-178.3	166.2	0	110.8	A300 H301 I303	K234-A300 CarbonylContact O-C 3.52Å; K234-A300 WeakPolarHBondContact O-CA 3.37Å; K234-A300 WeakPolarHBondContact O-CB 3.38Å; K234-H301 PolarHBondContact N-O 3.39Å; K234-H301 PolarHBondContact O-N 3.17Å; K234-I303 HydrophobicContact CB-CD1 3.75Å; K234-I303 HydrophobicContact CB-CG1 3.77Å
235	C	94.7	Very high	88.7	Confident	2 Å²	2	54 Å²	54	1%	0.014	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-91.1	156.8	167	-70.8	0	0	0	0	111.8	C205 A254 L299	C205-C235 HydrophobicContact CB-CB 4.11Å; C205-C235 PolarHBondContact SG-N 2.9Å; C205-C235 VanDerWaalsContact SG-N 3.43Å; C235-A254 HydrophobicContact CB-CB 4.29Å; C235-L299 PolarHBondContact SG-O 3.24Å
236	P	92	Very high	88.3	Confident	16 Å²	16	55.2 Å²	55.2	10%	0.104	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-52.3	138.5	167.9	-21.9	31.4	0	0	0	110.9	D248 A249 W250 L299 V333	P236-D248 HydrophobicContact CB-CB 4.02Å; P236-A249 WeakPolarHBondContact CB-O 3.25Å; P236-A249 WeakPolarHBondContact CG-O 3.21Å; P236-W250 HydrophobicContact CG-CB 4.33Å; P236-L299 WeakPolarHBondContact CD-O 3.37Å; P236-V333 HydrophobicContact CG-CG1 3.56Å
237	S	87.2	Confident	87.9	Confident	36 Å²	36	57.4 Å²	57.4	25%	0.252	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-82.8	153.9	-169.1	-52.8	0	0	0	0	111.4	D248	S237-D248 WeakPolarHBondContact CA-OD2 3.29Å; S237-D248 VanDerWaalsContact CB-OD2 3.27Å; S237-D248 WeakPolarHBondContact CB-OD2 3.42Å; S237-D248 PolarHBondContact N-OD2 2.93Å; S237-D248 WeakPolarHBondContact O-CB 3.46Å; S237-D248 PolarHBondContact O-N 2.84Å
238	I	88	Confident	87.6	Confident	19 Å²	19	58.2 Å²	58.2	10%	0.097	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117	170.4	-65.1	169	0	0	0	108.1	D203 Y240 I245 P247 L252 L255	D203-I238 HydrophobicContact CB-CD1 4.45Å; I238-Y240 HydrophobicContact CG2-CE2 4.41Å; I238-I245 HydrophobicContact CG2-CG2 3.44Å; I238-I245 VanDerWaalsContact CG2-CG2 3.44Å; I238-P247 HydrophobicContact CG1-CB 4.19Å; I238-L252 HydrophobicContact CD1-CD2 4.41Å; I238-L255 HydrophobicContact CD1-CB 3.68Å; I238-L255 HydrophobicContact CD1-CD2 3.73Å; I238-L255 HydrophobicContact CD1-CG 4.25Å
239	R	84.1	Confident	87.2	Confident	130 Å²	130	61.7 Å²	61.7	49%	0.491	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	158.7	178	-71.4	178	-82.6	-172.4	-8.4	110.6	V246 D248	R239-V246 HydrophobicContact CB-CB 4.45Å; R239-V246 PolarHBondContact N-O 2.9Å; R239-V246 PolarHBondContact O-N 2.83Å; R239-D248 IonicContact CZ-OD1 3.7Å; R239-D248 IonicContact NE-OD1 3.6Å; R239-D248 IonicContact NH2-OD1 2.94Å; R239-D248 PolarHBondContact NH2-OD1 3.31Å
240	Y	79.1	Confident	87	Confident	138 Å²	138	63.6 Å²	63.6	54%	0.541	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	112.5	173.9	-66.1	-95.5	0	0	0	108.1	I238 K244 I245	I238-Y240 HydrophobicContact CG2-CE2 4.41Å; Y240-K244 WeakPolarHBondContact CA-O 3.37Å; Y240-I245 HydrophobicContact CD1-CG1 4.09Å; Y240-I245 HydrophobicContact CE1-CD1 4.27Å; Y240-I245 HydrophobicContact CE1-CG1 3.65Å
241	E	75.6	Confident	86.8	Confident	107 Å²	107	63.5 Å²	63.5	50%	0.5	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.7	175.4	-67.5	-178.9	-179.6	0	0	107.7	G243 K244 V246	E241-G243 PolarHBondContact O-N 3.05Å; E241-G243 VanDerWaalsContact O-N 3.1Å; E241-K244 PolarHBondContact N-O 2.82Å; E241-K244 PolarHBondContact O-N 3.4Å; E241-V246 HydrophobicContact CB-CG2 3.98Å; E241-V246 HydrophobicContact CG-CG2 4.17Å
242	D	77.2	Confident	86.6	Confident	169 Å²	169	67.2 Å²	67.2	90%	0.904	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	37	-177.2	-59.1	-31.2	0	0	0	114.8	K244	D242-K244 PolarHBondContact O-N 2.94Å
243	G	75.8	Confident	86.8	Confident	71 Å²	71	70.2 Å²	70.2	73%	0.732	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	-0.7	-178.2	0	0	0	0	0	115	E241	E241-G243 PolarHBondContact O-N 3.05Å; E241-G243 VanDerWaalsContact O-N 3.1Å
244	K	79.2	Confident	86.8	Confident	159 Å²	159	70.2 Å²	70.2	69%	0.691	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	145	173.7	-66	-179.5	-178.1	174.1	0	110.9	Y240 E241 D242	Y240-K244 WeakPolarHBondContact CA-O 3.37Å; E241-K244 PolarHBondContact N-O 2.82Å; E241-K244 PolarHBondContact O-N 3.4Å; D242-K244 PolarHBondContact O-N 2.94Å
245	I	82.5	Confident	86.9	Confident	91 Å²	91	67.3 Å²	67.3	47%	0.467	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122	177.2	-57.2	179	0	0	0	108.5	I238 Y240 P247 L252	I238-I245 HydrophobicContact CG2-CG2 3.44Å; I238-I245 VanDerWaalsContact CG2-CG2 3.44Å; Y240-I245 HydrophobicContact CD1-CG1 4.09Å; Y240-I245 HydrophobicContact CE1-CD1 4.27Å; Y240-I245 HydrophobicContact CE1-CG1 3.65Å; I245-P247 WeakPolarHBondContact O-CD 3.44Å; I245-L252 HydrophobicContact CG2-CD2 4.31Å
246	V	86.4	Confident	86.8	Confident	50 Å²	50	69.6 Å²	69.6	30%	0.303	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	91	173.3	-175.2	0	0	0	0	108	R239 E241	R239-V246 HydrophobicContact CB-CB 4.45Å; R239-V246 PolarHBondContact N-O 2.9Å; R239-V246 PolarHBondContact O-N 2.83Å; E241-V246 HydrophobicContact CB-CG2 3.98Å; E241-V246 HydrophobicContact CG-CG2 4.17Å
247	P	86.6	Confident	86.9	Confident	51 Å²	51	69.6 Å²	69.6	33%	0.331	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	142.1	179.3	34.1	-33.4	0	0	0	111.1	I238 I245 L252	I238-P247 HydrophobicContact CG1-CB 4.19Å; I245-P247 WeakPolarHBondContact O-CD 3.44Å; P247-L252 HydrophobicContact CB-CD2 4.17Å; P247-L252 HydrophobicContact CB-CG 3.82Å; P247-L252 HydrophobicContact CG-CD1 3.96Å; P247-L252 HydrophobicContact CG-CD2 4.31Å; P247-L252 HydrophobicContact CG-CG 3.78Å
248	D	88.9	Confident	87.4	Confident	57 Å²	57	67.9 Å²	67.9	31%	0.305	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-64.8	163.8	160.8	-61.1	-23	0	0	0	109.4	P236 S237 R239 W250 G251	P236-D248 HydrophobicContact CB-CB 4.02Å; S237-D248 WeakPolarHBondContact CA-OD2 3.29Å; S237-D248 VanDerWaalsContact CB-OD2 3.27Å; S237-D248 WeakPolarHBondContact CB-OD2 3.42Å; S237-D248 PolarHBondContact N-OD2 2.93Å; S237-D248 WeakPolarHBondContact O-CB 3.46Å; S237-D248 PolarHBondContact O-N 2.84Å; R239-D248 IonicContact CZ-OD1 3.7Å; R239-D248 IonicContact NE-OD1 3.6Å; R239-D248 IonicContact NH2-OD1 2.94Å; R239-D248 PolarHBondContact NH2-OD1 3.31Å; D248-W250 PolarHBondContact O-N 2.94Å; D248-G251 PolarHBondContact O-N 3.43Å
249	A	88.3	Confident	87.7	Confident	73 Å²	73	68.6 Å²	68.6	60%	0.603	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	133.3	176.5	0	0	0	0	0	111.1	P236 G251	P236-A249 WeakPolarHBondContact CB-O 3.25Å; P236-A249 WeakPolarHBondContact CG-O 3.21Å; A249-G251 PolarHBondContact O-N 2.62Å; A249-G251 VanDerWaalsContact O-N 3.14Å
250	W	91.8	Very high	88.1	Confident	73 Å²	73	64.2 Å²	64.2	28%	0.277	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	64	5	-175.5	-47.8	103.6	0	0	0	116	P236 D248 D253 A254 R332 V333 E335	P236-W250 HydrophobicContact CG-CB 4.33Å; D248-W250 PolarHBondContact O-N 2.94Å; W250-D253 HydrophobicContact CE3-CB 4.43Å; W250-D253 PolarHBondContact O-N 2.87Å; W250-A254 PolarHBondContact O-N 2.89Å; W250-R332 HydrophobicContact CD2-CB 3.66Å; W250-R332 HydrophobicContact CD2-CG 4.03Å; W250-R332 HydrophobicContact CE3-CB 4.01Å; W250-R332 HydrophobicContact CE3-CG 3.83Å; W250-R332 HydrophobicContact CG-CB 3.94Å; W250-R332 HydrophobicContact CH2-CG 4.26Å; W250-R332 HydrophobicContact CZ2-CB 4.3Å; W250-R332 HydrophobicContact CZ2-CG 4.46Å; W250-R332 HydrophobicContact CZ3-CB 4.45Å; W250-R332 HydrophobicContact CZ3-CG 3.95Å; W250-R332 PolarHBondContact NE1-O 3.26Å; W250-R332 VanDerWaalsContact NE1-O 3.11Å; W250-V333 HydrophobicContact CB-CG1 4.13Å; W250-V333 HydrophobicContact CG-CG1 4.34Å; W250-E335 WeakPolarHBondContact CZ2-OE2 3.31Å
251	G	92	Very high	88.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-44.3	179.3	0	0	0	0	0	113.3	D248 A249 A254 L255	D248-G251 PolarHBondContact O-N 3.43Å; A249-G251 PolarHBondContact O-N 2.62Å; A249-G251 VanDerWaalsContact O-N 3.14Å; G251-A254 PolarHBondContact O-N 2.95Å; G251-L255 WeakPolarHBondContact O-CB 3.46Å; G251-L255 PolarHBondContact O-N 2.69Å
252	L	91.8	Very high	89.9	Confident	79 Å²	79	57.2 Å²	57.2	41%	0.414	31%	0.314	S	S	.	.	H	α-helix	trans	-67.1	-36.5	176.7	-66.4	-179.9	0	0	0	112.4	I238 I245 P247 L255 F256	I238-L252 HydrophobicContact CD1-CD2 4.41Å; I245-L252 HydrophobicContact CG2-CD2 4.31Å; P247-L252 HydrophobicContact CB-CD2 4.17Å; P247-L252 HydrophobicContact CB-CG 3.82Å; P247-L252 HydrophobicContact CG-CD1 3.96Å; P247-L252 HydrophobicContact CG-CD2 4.31Å; P247-L252 HydrophobicContact CG-CG 3.78Å; L252-L255 PolarHBondContact O-N 2.9Å; L252-F256 WeakPolarHBondContact O-CB 3.4Å; L252-F256 PolarHBondContact O-N 2.88Å
253	D	92.4	Very high	90.9	Very high	63 Å²	63	49.5 Å²	49.5	34%	0.337	27%	0.273	S	S	.	.	H	α-helix	trans	-63.5	-42.5	173.9	-64.8	-113.1	0	0	0	111.5	W250 F256 F257 L299 R332	W250-D253 HydrophobicContact CE3-CB 4.43Å; W250-D253 PolarHBondContact O-N 2.87Å; D253-F256 PolarHBondContact O-N 3.25Å; D253-F257 WeakPolarHBondContact O-CB 3.44Å; D253-F257 PolarHBondContact O-N 2.92Å; D253-L299 HydrophobicContact CB-CD2 3.73Å; D253-R332 VanDerWaalsContact CG-NH1 3.35Å; D253-R332 IonicContact OD1-CZ 3.87Å; D253-R332 IonicContact OD1-NH1 3.65Å; D253-R332 PolarHBondContact OD1-NH1 3.29Å
254	A	95.3	Very high	92	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-44	177.6	0	0	0	0	0	111.2	C235 W250 G251 F257 T258 L299	C235-A254 HydrophobicContact CB-CB 4.29Å; W250-A254 PolarHBondContact O-N 2.89Å; G251-A254 PolarHBondContact O-N 2.95Å; A254-F257 PolarHBondContact O-N 3.45Å; A254-T258 PolarHBondContact O-N 3.37Å; A254-T258 VanDerWaalsContact O-N 3.09Å; A254-T258 PolarHBondContact O-OG1 2.79Å; A254-L299 HydrophobicContact CB-CB 4.11Å; A254-L299 HydrophobicContact CB-CD2 4.12Å
255	L	95	Very high	92.8	Very high	29 Å²	29	42 Å²	42	15%	0.152	22%	0.218	C	C	.	.	H	α-helix	trans	-57.1	-53.3	173	172.1	61	0	0	0	111	V201 I238 G251 L252 F257 T258 E259	V201-L255 HydrophobicContact CB-CD1 4.01Å; V201-L255 HydrophobicContact CG1-CD1 3.62Å; V201-L255 WeakPolarHBondContact O-CD1 3.3Å; I238-L255 HydrophobicContact CD1-CB 3.68Å; I238-L255 HydrophobicContact CD1-CD2 3.73Å; I238-L255 HydrophobicContact CD1-CG 4.25Å; G251-L255 WeakPolarHBondContact O-CB 3.46Å; G251-L255 PolarHBondContact O-N 2.69Å; L252-L255 PolarHBondContact O-N 2.9Å; L255-F257 VanDerWaalsContact C-N 3.28Å; L255-F257 PolarHBondContact O-N 3.4Å; L255-T258 PolarHBondContact O-N 3.23Å; L255-E259 WeakPolarHBondContact O-CB 3.41Å; L255-E259 PolarHBondContact O-N 3.37Å
256	F	93.2	Very high	93.6	Very high	50 Å²	50	41.4 Å²	41.4	22%	0.219	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-37.1	179.5	179.8	-103	0	0	0	112.1	P39 P44 L252 D253 S260	P39-F256 HydrophobicContact CB-CE1 4Å; P39-F256 HydrophobicContact CB-CZ 3.78Å; P39-F256 HydrophobicContact CG-CE1 3.88Å; P39-F256 HydrophobicContact CG-CZ 3.69Å; P44-F256 HydrophobicContact CG-CE2 3.73Å; P44-F256 HydrophobicContact CG-CZ 4.23Å; L252-F256 WeakPolarHBondContact O-CB 3.4Å; L252-F256 PolarHBondContact O-N 2.88Å; D253-F256 PolarHBondContact O-N 3.25Å; F256-S260 WeakPolarHBondContact O-CB 3.27Å; F256-S260 PolarHBondContact O-N 2.91Å; F256-S260 PolarHBondContact O-OG 3.25Å
257	F	95	Very high	94.1	Very high	16 Å²	16	39.3 Å²	39.3	7%	0.07	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-43.7	179.1	-170.5	-85.6	0	0	0	112.2	D253 A254 L255 S260 R261 I290 L293 L294 H297 L299	D253-F257 WeakPolarHBondContact O-CB 3.44Å; D253-F257 PolarHBondContact O-N 2.92Å; A254-F257 PolarHBondContact O-N 3.45Å; L255-F257 VanDerWaalsContact C-N 3.28Å; L255-F257 PolarHBondContact O-N 3.4Å; F257-S260 PolarHBondContact O-OG 3.04Å; F257-R261 VanDerWaalsContact CD2-NH1 3.32Å; F257-R261 VanDerWaalsContact CE2-CZ 3.47Å; F257-R261 VanDerWaalsContact CZ-CZ 3.48Å; F257-R261 PolarHBondContact O-NH1 3.39Å; F257-I290 HydrophobicContact CD1-CD1 4.24Å; F257-I290 HydrophobicContact CE1-CD1 4.04Å; F257-L293 HydrophobicContact CE1-CB 3.86Å; F257-L293 HydrophobicContact CZ-CB 4.03Å; F257-L294 HydrophobicContact CB-CD2 4.37Å; F257-L294 HydrophobicContact CD1-CD2 3.59Å; F257-L294 HydrophobicContact CD1-CG 4.12Å; F257-L294 HydrophobicContact CE1-CD2 4.26Å; F257-L294 HydrophobicContact CE1-CG 4.36Å; F257-L294 HydrophobicContact CG-CD2 4.26Å; F257-H297 HydrophobicContact CE2-CB 4.18Å; F257-H297 AromaticContact CE2-CD2 3.63Å; F257-H297 AromaticContact CE2-CG 3.79Å; F257-H297 HydrophobicContact CZ-CB 4.38Å; F257-H297 AromaticContact CZ-CD2 3.45Å; F257-H297 VanDerWaalsContact CZ-CD2 3.45Å; F257-H297 WeakPolarHBondContact CZ-CD2 3.22Å; F257-L299 HydrophobicContact CB-CD1 3.47Å; F257-L299 VanDerWaalsContact CB-CD1 3.47Å; F257-L299 HydrophobicContact CD1-CD1 4.05Å; F257-L299 HydrophobicContact CD2-CD1 3.44Å; F257-L299 VanDerWaalsContact CD2-CD1 3.44Å; F257-L299 HydrophobicContact CE2-CD1 4.14Å; F257-L299 HydrophobicContact CG-CD1 3.38Å
258	T	96.7	Very high	94.7	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-73.5	-46.1	176.2	-62.4	0	0	0	0	111.1	V201 G204 V207 M230 A254 L255 S260 R261 L262	V201-T258 HydrophobicContact CG1-CG2 3.65Å; V201-T258 HydrophobicContact CG2-CG2 4.26Å; G204-T258 PolarHBondContact O-OG1 2.85Å; V207-T258 HydrophobicContact CG1-CG2 4.23Å; M230-T258 HydrophobicContact CE-CG2 4.04Å; A254-T258 PolarHBondContact O-N 3.37Å; A254-T258 VanDerWaalsContact O-N 3.09Å; A254-T258 PolarHBondContact O-OG1 2.79Å; L255-T258 PolarHBondContact O-N 3.23Å; T258-S260 PolarHBondContact O-N 2.84Å; T258-R261 PolarHBondContact O-N 2.97Å; T258-R261 VanDerWaalsContact O-N 3.16Å; T258-L262 HydrophobicContact CG2-CB 4.48Å; T258-L262 HydrophobicContact CG2-CD1 4.06Å; T258-L262 HydrophobicContact CG2-CG 4.42Å; T258-L262 WeakPolarHBondContact O-CB 3.23Å; T258-L262 PolarHBondContact O-N 3.39Å
259	E	95	Very high	95.1	Very high	35 Å²	35	36.3 Å²	36.3	16%	0.164	19%	0.186	C	C	.	.	H	α-helix	trans	-59.7	-47.1	-179.6	-168.9	-176.3	-150.8	0	0	112.1	K25 V201 L255 R261 L263	K25-E259 WeakPolarHBondContact CE-OE1 3.34Å; K25-E259 IonicContact NZ-OE1 3.3Å; K25-E259 PolarHBondContact NZ-OE1 3.48Å; K25-E259 IonicContact NZ-OE2 3.17Å; V201-E259 HydrophobicContact CB-CB 4.42Å; V201-E259 HydrophobicContact CG2-CB 4.37Å; L255-E259 WeakPolarHBondContact O-CB 3.41Å; L255-E259 PolarHBondContact O-N 3.37Å; E259-R261 PolarHBondContact O-N 2.97Å; E259-R261 VanDerWaalsContact O-N 3.09Å; E259-L263 HydrophobicContact CG-CB 3.86Å; E259-L263 HydrophobicContact CG-CD2 3.7Å; E259-L263 HydrophobicContact CG-CG 4.31Å; E259-L263 WeakPolarHBondContact O-CB 3.24Å; E259-L263 PolarHBondContact O-N 2.94Å; E259-L263 VanDerWaalsContact O-N 3.08Å
260	S	93.4	Very high	95.6	Very high	37 Å²	37	33.8 Å²	33.8	26%	0.259	16%	0.163	S	C	.	.	H	α-helix	trans	-62.8	-18.1	179.5	59.6	0	0	0	0	114.4	F256 F257 T258	F256-S260 WeakPolarHBondContact O-CB 3.27Å; F256-S260 PolarHBondContact O-N 2.91Å; F256-S260 PolarHBondContact O-OG 3.25Å; F257-S260 PolarHBondContact O-OG 3.04Å; T258-S260 PolarHBondContact O-N 2.84Å
261	R	94.9	Very high	95.8	Very high	97 Å²	97	30.3 Å²	30.3	37%	0.366	15%	0.149	S	C	.	.	H	α-helix	trans	-108.2	-34.3	-178	-73	173.8	-179.7	72.3	0.8	113.6	F257 T258 E259 R265 I290	F257-R261 VanDerWaalsContact CD2-NH1 3.32Å; F257-R261 VanDerWaalsContact CE2-CZ 3.47Å; F257-R261 VanDerWaalsContact CZ-CZ 3.48Å; F257-R261 PolarHBondContact O-NH1 3.39Å; T258-R261 PolarHBondContact O-N 2.97Å; T258-R261 VanDerWaalsContact O-N 3.16Å; E259-R261 PolarHBondContact O-N 2.97Å; E259-R261 VanDerWaalsContact O-N 3.09Å; R261-R265 VanDerWaalsContact O-CG 3.3Å; R261-R265 WeakPolarHBondContact O-CG 3.35Å; R261-I290 HydrophobicContact CB-CD1 4.25Å
262	L	97.6	Very high	96	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-115.4	-25	-169	-62.7	-165.4	0	0	0	114.4	V198 M230 T258 Q264 R265 V267 I283 H285 I290	V198-L262 VanDerWaalsContact CB-O 3.26Å; V198-L262 WeakPolarHBondContact CB-O 3.45Å; V198-L262 HydrophobicContact CG2-CB 4.24Å; M230-L262 HydrophobicContact CE-CD1 4.41Å; T258-L262 HydrophobicContact CG2-CB 4.48Å; T258-L262 HydrophobicContact CG2-CD1 4.06Å; T258-L262 HydrophobicContact CG2-CG 4.42Å; T258-L262 WeakPolarHBondContact O-CB 3.23Å; T258-L262 PolarHBondContact O-N 3.39Å; L262-Q264 PolarHBondContact O-N 2.83Å; L262-Q264 VanDerWaalsContact O-N 3.16Å; L262-R265 WeakPolarHBondContact O-CB 3.4Å; L262-R265 PolarHBondContact O-N 3.27Å; L262-V267 HydrophobicContact CD2-CG1 4.13Å; L262-I283 HydrophobicContact CD1-CG2 3.87Å; L262-H285 HydrophobicContact CD2-CB 3.84Å; L262-I290 HydrophobicContact CD1-CB 3.93Å; L262-I290 HydrophobicContact CD1-CG1 3.85Å; L262-I290 HydrophobicContact CD1-CG2 3.79Å; L262-I290 HydrophobicContact CG-CB 4.49Å; L262-I290 HydrophobicContact CG-CD1 4.48Å; L262-I290 HydrophobicContact CG-CG1 4.21Å
263	L	97.7	Very high	96	Very high	6 Å²	6	27.8 Å²	27.8	3%	0.031	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	125.3	-176.3	-176.5	65.5	0	0	0	110.8	K25 Q26 E199 V201 E259 R265	K25-L263 HydrophobicContact CG-CD2 4.11Å; Q26-L263 HydrophobicContact CB-CD2 4.22Å; Q26-L263 HydrophobicContact CG-CD2 4.36Å; E199-L263 WeakPolarHBondContact O-CD1 3.32Å; V201-L263 HydrophobicContact CG2-CB 4.5Å; E259-L263 HydrophobicContact CG-CB 3.86Å; E259-L263 HydrophobicContact CG-CD2 3.7Å; E259-L263 HydrophobicContact CG-CG 4.31Å; E259-L263 WeakPolarHBondContact O-CB 3.24Å; E259-L263 PolarHBondContact O-N 2.94Å; E259-L263 VanDerWaalsContact O-N 3.08Å; L263-R265 PolarHBondContact O-N 3.27Å; L263-R265 VanDerWaalsContact O-N 3.17Å
264	Q	97.7	Very high	95.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	25.2	-175.8	-68.1	-170.8	-8.3	0	0	115.1	Q26 V27 R85 I89 V198 L262	Q26-Q264 HydrophobicContact CG-CG 4.39Å; V27-Q264 PolarHBondContact O-NE2 3.35Å; R85-Q264 WeakPolarHBondContact CD-O 3.43Å; R85-Q264 HydrophobicContact CG-CB 4.14Å; R85-Q264 PolarHBondContact NH1-O 2.77Å; I89-Q264 HydrophobicContact CD1-CB 3.75Å; I89-Q264 HydrophobicContact CG1-CB 3.81Å; V198-Q264 WeakPolarHBondContact O-CA 3.48Å; V198-Q264 PolarHBondContact O-N 2.76Å; L262-Q264 PolarHBondContact O-N 2.83Å; L262-Q264 VanDerWaalsContact O-N 3.16Å
265	R	97.4	Very high	95.3	Very high	72 Å²	72	29.5 Å²	29.5	27%	0.272	15%	0.145	S	C	.	.			trans	-95.3	152.2	171.1	-58.9	-52.1	-172.1	124.8	1.8	111.8	I89 V197 V198 R261 L262 L263	I89-R265 PolarHBondContact O-NH2 3.25Å; V197-R265 WeakPolarHBondContact CA-O 3.27Å; V198-R265 PolarHBondContact N-O 2.86Å; R261-R265 VanDerWaalsContact O-CG 3.3Å; R261-R265 WeakPolarHBondContact O-CG 3.35Å; L262-R265 WeakPolarHBondContact O-CB 3.4Å; L262-R265 PolarHBondContact O-N 3.27Å; L263-R265 PolarHBondContact O-N 3.27Å; L263-R265 VanDerWaalsContact O-N 3.17Å
266	D	97.9	Very high	94.6	Very high	80 Å²	80	35.9 Å²	35.9	43%	0.428	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	126.1	170.9	-53.3	-77.9	0	0	0	109.4	R85 A196 V197 H285	R85-D266 IonicContact CZ-OD1 3.86Å; R85-D266 IonicContact CZ-OD2 3.39Å; R85-D266 IonicContact NH1-OD1 2.77Å; R85-D266 IonicContact NH1-OD2 3.94Å; R85-D266 PolarHBondContact NH1-OD2 2.96Å; R85-D266 IonicContact NH2-OD1 3.71Å; R85-D266 PolarHBondContact NH2-OD1 3.11Å; R85-D266 IonicContact NH2-OD2 3.54Å; R85-D266 PolarHBondContact NH2-OD2 2.96Å; A196-D266 WeakPolarHBondContact O-CA 3.38Å; V197-D266 WeakPolarHBondContact CG2-OD1 3.11Å; D266-H285 PolarHBondContact O-CD2 3.02Å
267	V	98.3	Very high	93.9	Very high	6 Å²	6	40.3 Å²	40.3	4%	0.036	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	161	-178.1	-62.3	0	0	0	0	110.1	A196 V198 L262 I269 I283 L284 H285	A196-V267 HydrophobicContact CB-CG2 4.14Å; A196-V267 PolarHBondContact N-O 3.11Å; A196-V267 PolarHBondContact O-N 3.2Å; A196-V267 VanDerWaalsContact O-O 3.11Å; V198-V267 HydrophobicContact CG2-CG1 4.03Å; V198-V267 HydrophobicContact CG2-CG2 3.77Å; L262-V267 HydrophobicContact CD2-CG1 4.13Å; V267-I269 HydrophobicContact CG2-CD1 3.91Å; V267-I269 HydrophobicContact CG2-CG1 4.34Å; V267-I283 HydrophobicContact CB-CG2 4.22Å; V267-I283 HydrophobicContact CG1-CG2 4.27Å; V267-I283 HydrophobicContact CG2-CG2 4.27Å; V267-L284 CarbonylContact C-O 3.53Å; V267-L284 VanDerWaalsContact CA-O 3.32Å; V267-L284 WeakPolarHBondContact CA-O 3.2Å; V267-L284 WeakPolarHBondContact CB-O 3.31Å; V267-H285 HydrophobicContact CG1-CB 4.38Å
268	T	98.4	Very high	93.7	Very high	44 Å²	44	41.8 Å²	41.8	27%	0.27	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.8	167.5	-57.4	0	0	0	0	108.8	P193 L194 L284	P193-T268 HydrophobicContact CB-CG2 3.49Å; P193-T268 VanDerWaalsContact CB-CG2 3.49Å; L194-T268 CarbonylContact O-C 3.58Å; L194-T268 WeakPolarHBondContact O-CA 3.47Å; T268-L284 PolarHBondContact N-O 3.41Å; T268-L284 WeakPolarHBondContact O-CB 3.43Å; T268-L284 PolarHBondContact O-N 3.26Å
269	I	98.1	Very high	93.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.2	177.7	-54.1	-65.2	0	0	0	108.9	L194 A196 V209 I211 V228 V267 L271 S282 I283	L194-I269 HydrophobicContact CB-CB 4.45Å; L194-I269 PolarHBondContact N-O 3.02Å; L194-I269 PolarHBondContact O-N 3.3Å; A196-I269 HydrophobicContact CB-CG1 3.78Å; V209-I269 HydrophobicContact CG1-CD1 4.34Å; I211-I269 HydrophobicContact CD1-CG1 4.38Å; V228-I269 HydrophobicContact CG1-CG2 4.28Å; V228-I269 HydrophobicContact CG2-CG2 4.42Å; V267-I269 HydrophobicContact CG2-CD1 3.91Å; V267-I269 HydrophobicContact CG2-CG1 4.34Å; I269-L271 HydrophobicContact CG2-CD2 3.79Å; I269-L271 HydrophobicContact CG2-CG 4.32Å; I269-S282 WeakPolarHBondContact CA-O 3.47Å; I269-I283 HydrophobicContact CD1-CB 4.14Å; I269-I283 HydrophobicContact CD1-CG1 3.74Å; I269-I283 HydrophobicContact CD1-CG2 3.9Å
270	L	97.5	Very high	93.6	Very high	21 Å²	21	40.8 Å²	40.8	11%	0.11	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.7	166.1	-61.9	173.9	0	0	0	108.3	P193 E272 G281 S282 L284 V312	P193-L270 HydrophobicContact CB-CD2 4.06Å; L270-E272 PolarHBondContact O-N 2.85Å; L270-G281 CarbonylContact O-C 3.58Å; L270-G281 WeakPolarHBondContact O-CA 3.33Å; L270-S282 PolarHBondContact N-O 2.9Å; L270-S282 PolarHBondContact O-N 3.35Å; L270-L284 HydrophobicContact CD1-CD1 3.99Å; L270-L284 HydrophobicContact CG-CD1 4.37Å; L270-V312 HydrophobicContact CD1-CG2 3.66Å
271	L	97.4	Very high	93.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	119.7	177.7	-63.6	-178.1	0	0	0	110.1	F185 F186 K190 N191 L194 V228 I269 F279	F185-L271 HydrophobicContact CD1-CD1 4.35Å; F185-L271 HydrophobicContact CE1-CD1 3.95Å; F186-L271 HydrophobicContact CD2-CB 4.21Å; F186-L271 HydrophobicContact CE2-CB 4.4Å; K190-L271 CarbonylContact C-O 3.58Å; K190-L271 WeakPolarHBondContact CA-O 3.27Å; N191-L271 PolarHBondContact N-O 2.82Å; N191-L271 PolarHBondContact OD1-O 2.88Å; L194-L271 HydrophobicContact CD1-CD1 3.87Å; L194-L271 HydrophobicContact CD1-CG 4.09Å; V228-L271 HydrophobicContact CG2-CD2 4.39Å; I269-L271 HydrophobicContact CG2-CD2 3.79Å; I269-L271 HydrophobicContact CG2-CG 4.32Å; L271-F279 HydrophobicContact CD1-CD1 4.07Å; L271-F279 HydrophobicContact CD1-CE1 4.3Å; L271-F279 HydrophobicContact CD2-CB 3.97Å; L271-F279 HydrophobicContact CD2-CD1 4.15Å; L271-F279 HydrophobicContact CD2-CG 4.3Å
272	E	94.9	Very high	93.9	Very high	6 Å²	6	34.4 Å²	34.4	3%	0.028	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-28.5	-170.3	-70.4	162.3	173.3	0	0	112.8	F186 S231 L270 V280 S282 L309 S311	F186-E272 VanDerWaalsContact CZ-O 3.29Å; F186-E272 WeakPolarHBondContact CZ-O 3.42Å; S231-E272 WeakPolarHBondContact CB-OE2 3.31Å; S231-E272 PolarHBondContact OG-OE2 2.89Å; L270-E272 PolarHBondContact O-N 2.85Å; E272-V280 PolarHBondContact N-O 3.29Å; E272-S282 PolarHBondContact OE1-OG 2.92Å; E272-L309 HydrophobicContact CB-CB 4.48Å; E272-L309 WeakPolarHBondContact CB-O 3.42Å; E272-L309 VanDerWaalsContact CG-O 3.3Å; E272-L309 WeakPolarHBondContact CG-O 3.35Å; E272-S311 WeakPolarHBondContact CG-OG 3.24Å; E272-S311 WeakPolarHBondContact OE1-CB 3.33Å; E272-S311 PolarHBondContact OE1-N 2.72Å; E272-S311 PolarHBondContact OE1-OG 2.61Å
273	S	93.1	Very high	93.9	Very high	20 Å²	20	34.4 Å²	34.4	14%	0.14	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	177	175.2	-170.6	0	0	0	0	112.7	F186 F275 V280	F186-S273 VanDerWaalsContact CE2-N 3.29Å; S273-F275 VanDerWaalsContact OG-CZ 3.31Å; S273-F275 WeakPolarHBondContact OG-CZ 3.48Å; S273-V280 PolarHBondContact N-O 2.57Å; S273-V280 PolarHBondContact O-N 2.87Å
274	V	90.4	Very high	93.9	Very high	32 Å²	32	36.1 Å²	36.1	19%	0.194	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	123.3	170.4	176.1	0	0	0	0	108.8	I182 F186 T278 F279	I182-V274 HydrophobicContact CG2-CB 4.36Å; I182-V274 HydrophobicContact CG2-CG1 3.47Å; I182-V274 VanDerWaalsContact CG2-CG1 3.47Å; I182-V274 HydrophobicContact CG2-CG2 3.9Å; F186-V274 HydrophobicContact CB-CG2 3.53Å; F186-V274 HydrophobicContact CD1-CG2 4.23Å; F186-V274 HydrophobicContact CD2-CG2 3.9Å; F186-V274 HydrophobicContact CG-CG2 3.6Å; V274-T278 CarbonylContact C-O 3.38Å; V274-T278 WeakPolarHBondContact CA-O 3.11Å; V274-F279 HydrophobicContact CG2-CD1 3.85Å; V274-F279 HydrophobicContact CG2-CE1 4.06Å
275	F	81.9	Confident	93.9	Very high	67 Å²	67	37.7 Å²	37.7	29%	0.294	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.4	173.3	-62.1	-53.1	0	0	0	110.6	S273 Q277 T278 V280 W305 L309	S273-F275 VanDerWaalsContact OG-CZ 3.31Å; S273-F275 WeakPolarHBondContact OG-CZ 3.48Å; F275-Q277 VanDerWaalsContact C-N 3.3Å; F275-Q277 PolarHBondContact O-N 2.86Å; F275-T278 PolarHBondContact N-O 2.86Å; F275-T278 WeakPolarHBondContact O-CA 3.09Å; F275-T278 WeakPolarHBondContact O-CB 3.46Å; F275-T278 PolarHBondContact O-N 2.87Å; F275-V280 HydrophobicContact CB-CG2 4.46Å; F275-V280 HydrophobicContact CD2-CB 4.18Å; F275-V280 HydrophobicContact CD2-CG2 3.5Å; F275-V280 VanDerWaalsContact CD2-CG2 3.5Å; F275-V280 HydrophobicContact CE2-CB 4.36Å; F275-V280 HydrophobicContact CE2-CG1 4.38Å; F275-V280 HydrophobicContact CE2-CG2 4.14Å; F275-V280 HydrophobicContact CG-CG2 4.37Å; F275-W305 AromaticContact CD2-CH2 3.98Å; F275-W305 HydrophobicContact CD2-CH2 3.98Å; F275-W305 HydrophobicContact CD2-CZ3 4.42Å; F275-W305 HydrophobicContact CE1-CH2 4.31Å; F275-W305 AromaticContact CE1-CZ3 3.96Å; F275-W305 HydrophobicContact CE1-CZ3 3.96Å; F275-W305 AromaticContact CE2-CH2 3.65Å; F275-W305 HydrophobicContact CE2-CH2 3.65Å; F275-W305 AromaticContact CE2-CZ3 3.69Å; F275-W305 HydrophobicContact CE2-CZ3 3.69Å; F275-W305 AromaticContact CZ-CH2 3.84Å; F275-W305 HydrophobicContact CZ-CH2 3.84Å; F275-W305 AromaticContact CZ-CZ3 3.43Å; F275-W305 HydrophobicContact CZ-CZ3 3.43Å; F275-W305 VanDerWaalsContact CZ-CZ3 3.43Å; F275-L309 HydrophobicContact CE2-CD1 4Å; F275-L309 HydrophobicContact CZ-CD1 3.7Å
276	N	79.4	Confident	93.7	Very high	163 Å²	163	39.8 Å²	39.8	87%	0.872	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.7	50.3	176.1	-62.3	-19.1	0	0	0	113.3	T278	N276-T278 PolarHBondContact O-N 2.91Å; N276-T278 VanDerWaalsContact O-N 3.12Å; N276-T278 PolarHBondContact O-OG1 2.88Å
277	Q	80	Confident	93.5	Very high	143 Å²	143	42.8 Å²	42.8	67%	0.668	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	18.8	-177.5	-50.6	-64.8	-0	0	0	114.7	I182 F275	I182-Q277 HydrophobicContact CD1-CB 3.84Å; I182-Q277 VanDerWaalsContact CD1-O 3.27Å; I182-Q277 WeakPolarHBondContact CD1-O 3.38Å; F275-Q277 VanDerWaalsContact C-N 3.3Å; F275-Q277 PolarHBondContact O-N 2.86Å
278	T	89.1	Confident	93.1	Very high	46 Å²	46	44.1 Å²	44.1	28%	0.282	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.8	175.5	-53.9	0	0	0	0	109.3	T227 V274 F275 N276	T227-T278 HydrophobicContact CG2-CG2 4.33Å; V274-T278 CarbonylContact C-O 3.38Å; V274-T278 WeakPolarHBondContact CA-O 3.11Å; F275-T278 PolarHBondContact N-O 2.86Å; F275-T278 WeakPolarHBondContact O-CA 3.09Å; F275-T278 WeakPolarHBondContact O-CB 3.46Å; F275-T278 PolarHBondContact O-N 2.87Å; N276-T278 PolarHBondContact O-N 2.91Å; N276-T278 VanDerWaalsContact O-N 3.12Å; N276-T278 PolarHBondContact O-OG1 2.88Å
279	F	96.3	Very high	93	Very high	7 Å²	7	42.9 Å²	42.9	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	139	174.8	-69	-83.5	0	0	0	110.2	I182 F185 F186 L226 T227 V228 T229 L271 V274	I182-F279 HydrophobicContact CB-CZ 4.24Å; I182-F279 HydrophobicContact CG2-CD1 4.45Å; I182-F279 HydrophobicContact CG2-CD2 4.48Å; I182-F279 HydrophobicContact CG2-CE1 3.84Å; I182-F279 HydrophobicContact CG2-CE2 3.85Å; I182-F279 HydrophobicContact CG2-CZ 3.52Å; F185-F279 HydrophobicContact CB-CZ 4.43Å; F185-F279 AromaticContact CD1-CE1 3.75Å; F185-F279 HydrophobicContact CD1-CE1 3.75Å; F185-F279 AromaticContact CD1-CZ 3.62Å; F185-F279 HydrophobicContact CD1-CZ 3.62Å; F185-F279 HydrophobicContact CE1-CE1 4.45Å; F185-F279 HydrophobicContact CE1-CZ 4.33Å; F185-F279 HydrophobicContact CG-CZ 4.33Å; F186-F279 HydrophobicContact CB-CE1 4.03Å; L226-F279 HydrophobicContact CB-CD2 4.47Å; L226-F279 HydrophobicContact CD2-CD2 4.05Å; L226-F279 HydrophobicContact CD2-CE2 3.6Å; L226-F279 HydrophobicContact CD2-CZ 4.23Å; T227-F279 PolarHBondContact O-N 2.85Å; V228-F279 WeakPolarHBondContact CA-O 3.5Å; V228-F279 HydrophobicContact CG2-CB 4.28Å; T229-F279 PolarHBondContact N-O 2.71Å; L271-F279 HydrophobicContact CD1-CD1 4.07Å; L271-F279 HydrophobicContact CD1-CE1 4.3Å; L271-F279 HydrophobicContact CD2-CB 3.97Å; L271-F279 HydrophobicContact CD2-CD1 4.15Å; L271-F279 HydrophobicContact CD2-CG 4.3Å; V274-F279 HydrophobicContact CG2-CD1 3.85Å; V274-F279 HydrophobicContact CG2-CE1 4.06Å
280	V	94.9	Very high	92.9	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.6	174.9	176	0	0	0	0	109.4	T229 E272 S273 F275	T229-V280 VanDerWaalsContact O-CA 3.26Å; T229-V280 WeakPolarHBondContact O-CA 3.27Å; E272-V280 PolarHBondContact N-O 3.29Å; S273-V280 PolarHBondContact N-O 2.57Å; S273-V280 PolarHBondContact O-N 2.87Å; F275-V280 HydrophobicContact CB-CG2 4.46Å; F275-V280 HydrophobicContact CD2-CB 4.18Å; F275-V280 HydrophobicContact CD2-CG2 3.5Å; F275-V280 VanDerWaalsContact CD2-CG2 3.5Å; F275-V280 HydrophobicContact CE2-CB 4.36Å; F275-V280 HydrophobicContact CE2-CG1 4.38Å; F275-V280 HydrophobicContact CE2-CG2 4.14Å; F275-V280 HydrophobicContact CG-CG2 4.37Å
281	G	96.6	Very high	92.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.6	169.2	-174.5	0	0	0	0	0	114.7	T229 M230 S231 L270	T229-G281 PolarHBondContact O-N 3Å; M230-G281 VanDerWaalsContact CA-O 3.3Å; M230-G281 WeakPolarHBondContact CA-O 3.5Å; S231-G281 PolarHBondContact N-O 3.44Å; L270-G281 CarbonylContact O-C 3.58Å; L270-G281 WeakPolarHBondContact O-CA 3.33Å
282	S	97.6	Very high	92.9	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.007	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	139.5	178.1	-65.2	0	0	0	0	111.4	S231 I269 L270 E272 V312	S231-S282 PolarHBondContact OG-OG 3.1Å; I269-S282 WeakPolarHBondContact CA-O 3.47Å; L270-S282 PolarHBondContact N-O 2.9Å; L270-S282 PolarHBondContact O-N 3.35Å; E272-S282 PolarHBondContact OE1-OG 2.92Å; S282-V312 VanDerWaalsContact CB-CG2 3.49Å; S282-V312 WeakPolarHBondContact OG-CG2 3.46Å
283	I	98.1	Very high	93	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	109.2	178.8	-54.2	175.4	0	0	0	108.9	V207 M230 L262 V267 I269 I290	V207-I283 HydrophobicContact CB-CD1 4.43Å; V207-I283 HydrophobicContact CG1-CD1 4.25Å; V207-I283 HydrophobicContact CG2-CD1 3.33Å; M230-I283 HydrophobicContact CE-CD1 3.83Å; M230-I283 HydrophobicContact CG-CD1 3.63Å; M230-I283 HydrophobicContact CG-CG1 4.1Å; L262-I283 HydrophobicContact CD1-CG2 3.87Å; V267-I283 HydrophobicContact CB-CG2 4.22Å; V267-I283 HydrophobicContact CG1-CG2 4.27Å; V267-I283 HydrophobicContact CG2-CG2 4.27Å; I269-I283 HydrophobicContact CD1-CB 4.14Å; I269-I283 HydrophobicContact CD1-CG1 3.74Å; I269-I283 HydrophobicContact CD1-CG2 3.9Å; I283-I290 HydrophobicContact CB-CG2 4.19Å; I283-I290 HydrophobicContact CG2-CG2 4.49Å
284	L	97.7	Very high	93.3	Very high	42 Å²	42	46.7 Å²	46.7	22%	0.22	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117.7	-171	-55.1	178	0	0	0	110.1	V267 T268 L270 N289 V312	V267-L284 CarbonylContact C-O 3.53Å; V267-L284 VanDerWaalsContact CA-O 3.32Å; V267-L284 WeakPolarHBondContact CA-O 3.2Å; V267-L284 WeakPolarHBondContact CB-O 3.31Å; T268-L284 PolarHBondContact N-O 3.41Å; T268-L284 WeakPolarHBondContact O-CB 3.43Å; T268-L284 PolarHBondContact O-N 3.26Å; L270-L284 HydrophobicContact CD1-CD1 3.99Å; L270-L284 HydrophobicContact CG-CD1 4.37Å; L284-N289 HydrophobicContact CD2-CB 4.13Å; L284-V312 HydrophobicContact CD1-CG2 4.14Å; L284-V312 HydrophobicContact CD2-CG2 3.98Å; L284-V312 HydrophobicContact CG-CG2 4.48Å
285	H	97.2	Very high	93.6	Very high	34 Å²	34	45.2 Å²	45.2	16%	0.157	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	152.3	169.5	-175.3	-94.4	0	0	0	108.8	L262 D266 V267 N287 G288	L262-H285 HydrophobicContact CD2-CB 3.84Å; D266-H285 PolarHBondContact O-CD2 3.02Å; V267-H285 HydrophobicContact CG1-CB 4.38Å; H285-N287 WeakPolarHBondContact ND1-CB 3.45Å; H285-N287 PolarHBondContact ND1-N 3.29Å; H285-N287 VanDerWaalsContact ND1-N 3.11Å; H285-N287 PolarHBondContact O-N 2.85Å; H285-G288 PolarHBondContact N-O 2.61Å; H285-G288 CarbonylContact O-C 3.56Å; H285-G288 PolarHBondContact O-N 2.88Å; H285-G288 VanDerWaalsContact O-O 3.12Å
286	P	93.7	Very high	94.3	Very high	115 Å²	115	46.7 Å²	46.7	75%	0.747	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-26.1	175.4	-30.2	36.7	0	0	0	114.7	G288	P286-G288 VanDerWaalsContact C-N 3.32Å
287	N	92.2	Very high	95.1	Very high	143 Å²	143	42.8 Å²	42.8	77%	0.765	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	5.4	176.4	-59.7	-10.1	0	0	0	114.1	H285	H285-N287 WeakPolarHBondContact ND1-CB 3.45Å; H285-N287 PolarHBondContact ND1-N 3.29Å; H285-N287 VanDerWaalsContact ND1-N 3.11Å; H285-N287 PolarHBondContact O-N 2.85Å
288	G	90.5	Very high	95.9	Very high	35 Å²	35	36 Å²	36	36%	0.361	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	125.8	180	175.1	0	0	0	0	0	115.2	H285 P286	H285-G288 PolarHBondContact N-O 2.61Å; H285-G288 CarbonylContact O-C 3.56Å; H285-G288 PolarHBondContact O-N 2.88Å; H285-G288 VanDerWaalsContact O-O 3.12Å; P286-G288 VanDerWaalsContact C-N 3.32Å
289	N	95.8	Very high	96.3	Very high	17 Å²	17	33.8 Å²	33.8	9%	0.091	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	113.5	179.5	-171.1	-21.9	0	0	0	110.3	L284 A291 E292 L293 Y319	L284-N289 HydrophobicContact CD2-CB 4.13Å; N289-A291 VanDerWaalsContact C-N 3.26Å; N289-A291 PolarHBondContact O-N 3.39Å; N289-A291 PolarHBondContact OD1-N 3.5Å; N289-A291 VanDerWaalsContact OD1-N 3.16Å; N289-E292 HydrophobicContact CB-CB 4.46Å; N289-E292 PolarHBondContact O-N 3.36Å; N289-L293 PolarHBondContact O-N 3.21Å; N289-Y319 PolarHBondContact ND2-OH 3.38Å; N289-Y319 PolarHBondContact OD1-OH 2.95Å
290	I	97.2	Very high	96.3	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.026	18%	0.18	C	C	.	.	H	α-helix	trans	-62	-32.7	-176.4	-171.9	61	0	0	0	112.9	M230 F257 R261 L262 I283 E292 L293 L294	M230-I290 HydrophobicContact CE-CB 4.47Å; M230-I290 HydrophobicContact CE-CG1 4.26Å; M230-I290 HydrophobicContact CE-CG2 3.38Å; M230-I290 HydrophobicContact SD-CG2 3.62Å; F257-I290 HydrophobicContact CD1-CD1 4.24Å; F257-I290 HydrophobicContact CE1-CD1 4.04Å; R261-I290 HydrophobicContact CB-CD1 4.25Å; L262-I290 HydrophobicContact CD1-CB 3.93Å; L262-I290 HydrophobicContact CD1-CG1 3.85Å; L262-I290 HydrophobicContact CD1-CG2 3.79Å; L262-I290 HydrophobicContact CG-CB 4.49Å; L262-I290 HydrophobicContact CG-CD1 4.48Å; L262-I290 HydrophobicContact CG-CG1 4.21Å; I283-I290 HydrophobicContact CB-CG2 4.19Å; I283-I290 HydrophobicContact CG2-CG2 4.49Å; I290-E292 PolarHBondContact O-N 3.17Å; I290-L293 WeakPolarHBondContact O-CB 3.49Å; I290-L293 PolarHBondContact O-N 3.03Å; I290-L294 HydrophobicContact CG1-CD1 4.19Å; I290-L294 HydrophobicContact CG1-CG 4.45Å; I290-L294 WeakPolarHBondContact O-CG 3.28Å; I290-L294 PolarHBondContact O-N 3.27Å
291	A	97.7	Very high	96.2	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-68.3	-37.1	-176.6	0	0	0	0	0	111.8	M230 I233 N289 L293 L294 L295 Y319	M230-A291 HydrophobicContact CB-CB 4.49Å; M230-A291 HydrophobicContact SD-CB 4.07Å; I233-A291 HydrophobicContact CD1-CB 3.55Å; I233-A291 HydrophobicContact CG1-CB 4.01Å; I233-A291 HydrophobicContact CG2-CB 4.21Å; N289-A291 VanDerWaalsContact C-N 3.26Å; N289-A291 PolarHBondContact O-N 3.39Å; N289-A291 PolarHBondContact OD1-N 3.5Å; N289-A291 VanDerWaalsContact OD1-N 3.16Å; A291-L293 VanDerWaalsContact C-N 3.33Å; A291-L293 PolarHBondContact O-N 3.12Å; A291-L294 PolarHBondContact O-N 3.19Å; A291-L295 WeakPolarHBondContact O-CG 3.45Å; A291-L295 PolarHBondContact O-N 3.18Å; A291-L295 VanDerWaalsContact O-N 3.11Å; A291-Y319 HydrophobicContact CB-CE1 4.02Å; A291-Y319 HydrophobicContact CB-CE2 4.17Å; A291-Y319 VanDerWaalsContact CB-OH 3.27Å; A291-Y319 WeakPolarHBondContact CB-OH 3.3Å
292	E	96.5	Very high	95.8	Very high	67 Å²	67	35.2 Å²	35.2	31%	0.313	19%	0.188	S	C	.	.	H	α-helix	trans	-61.6	-43.1	172.1	-172.1	-171.2	146.1	0	0	111.1	N289 I290 L295 R296 A318 Y319 A322	N289-E292 HydrophobicContact CB-CB 4.46Å; N289-E292 PolarHBondContact O-N 3.36Å; I290-E292 PolarHBondContact O-N 3.17Å; E292-L295 PolarHBondContact O-N 3.2Å; E292-R296 VanDerWaalsContact O-CB 3.3Å; E292-R296 WeakPolarHBondContact O-CB 3.29Å; E292-R296 PolarHBondContact O-N 2.84Å; E292-A318 HydrophobicContact CG-CB 4.35Å; E292-Y319 HydrophobicContact CB-CD1 4.04Å; E292-Y319 HydrophobicContact CB-CE1 3.95Å; E292-A322 HydrophobicContact CG-CB 4.1Å
293	L	97.4	Very high	95	Very high	55 Å²	55	36.4 Å²	36.4	29%	0.288	19%	0.194	S	C	.	.	H	α-helix	trans	-65.9	-40.9	178.8	-64.3	178	0	0	0	112.1	F257 N289 I290 A291 R296 H297	F257-L293 HydrophobicContact CE1-CB 3.86Å; F257-L293 HydrophobicContact CZ-CB 4.03Å; N289-L293 PolarHBondContact O-N 3.21Å; I290-L293 WeakPolarHBondContact O-CB 3.49Å; I290-L293 PolarHBondContact O-N 3.03Å; A291-L293 VanDerWaalsContact C-N 3.33Å; A291-L293 PolarHBondContact O-N 3.12Å; L293-R296 PolarHBondContact O-N 2.87Å; L293-H297 WeakPolarHBondContact O-CB 3.44Å; L293-H297 PolarHBondContact O-CD2 3Å; L293-H297 VanDerWaalsContact O-CD2 3.28Å; L293-H297 PolarHBondContact O-N 2.98Å
294	L	98.3	Very high	93.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.1	-46.6	175.5	-76.6	163.3	0	0	0	111.2	G204 M230 I233 F257 I290 A291 H297 G298 L299 A300	G204-L294 WeakPolarHBondContact O-CD1 3.37Å; M230-L294 HydrophobicContact CE-CD1 4.22Å; M230-L294 HydrophobicContact SD-CD1 3.81Å; I233-L294 HydrophobicContact CD1-CB 4.28Å; I233-L294 HydrophobicContact CD1-CD1 3.83Å; F257-L294 HydrophobicContact CB-CD2 4.37Å; F257-L294 HydrophobicContact CD1-CD2 3.59Å; F257-L294 HydrophobicContact CD1-CG 4.12Å; F257-L294 HydrophobicContact CE1-CD2 4.26Å; F257-L294 HydrophobicContact CE1-CG 4.36Å; F257-L294 HydrophobicContact CG-CD2 4.26Å; I290-L294 HydrophobicContact CG1-CD1 4.19Å; I290-L294 HydrophobicContact CG1-CG 4.45Å; I290-L294 WeakPolarHBondContact O-CG 3.28Å; I290-L294 PolarHBondContact O-N 3.27Å; A291-L294 PolarHBondContact O-N 3.19Å; L294-H297 PolarHBondContact O-N 3.18Å; L294-G298 PolarHBondContact O-N 3.08Å; L294-L299 HydrophobicContact CD2-CB 3.84Å; L294-L299 HydrophobicContact CD2-CD1 4.2Å; L294-L299 WeakPolarHBondContact O-CB 3.25Å; L294-L299 PolarHBondContact O-N 2.9Å; L294-A300 HydrophobicContact CB-CB 3.98Å; L294-A300 PolarHBondContact O-N 3.29Å
295	L	97.7	Very high	92.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-49.3	175.1	-69.9	167.4	0	0	0	111.6	I233 A291 E292 H297 G298 A300 H301 Y319 A322 E323 A326	I233-L295 HydrophobicContact CB-CD2 4.5Å; I233-L295 HydrophobicContact CG2-CD1 3.49Å; I233-L295 VanDerWaalsContact CG2-CD1 3.49Å; I233-L295 HydrophobicContact CG2-CD2 3.91Å; I233-L295 HydrophobicContact CG2-CG 3.7Å; A291-L295 WeakPolarHBondContact O-CG 3.45Å; A291-L295 PolarHBondContact O-N 3.18Å; A291-L295 VanDerWaalsContact O-N 3.11Å; E292-L295 PolarHBondContact O-N 3.2Å; L295-H297 PolarHBondContact O-N 3.05Å; L295-G298 PolarHBondContact O-N 2.83Å; L295-A300 HydrophobicContact CD2-CB 3.93Å; L295-A300 HydrophobicContact CG-CB 4.29Å; L295-H301 VanDerWaalsContact CD2-C 3.44Å; L295-Y319 VanDerWaalsContact CD1-CA 3.49Å; L295-Y319 HydrophobicContact CD1-CD1 3.94Å; L295-Y319 HydrophobicContact CD1-CD2 4.09Å; L295-Y319 HydrophobicContact CD1-CG 3.53Å; L295-A322 HydrophobicContact CB-CB 3.78Å; L295-E323 HydrophobicContact CD2-CB 4.29Å; L295-E323 HydrophobicContact CD2-CG 4.47Å; L295-A326 WeakPolarHBondContact O-CB 3.29Å
296	R	97	Very high	91.8	Very high	99 Å²	99	38.9 Å²	38.9	37%	0.374	20%	0.201	S	C	.	.	H	α-helix	trans	-60.1	-30.9	-176.8	-170.1	177.5	179.4	87.7	1.9	112.9	E292 L293 A322 F325	E292-R296 VanDerWaalsContact O-CB 3.3Å; E292-R296 WeakPolarHBondContact O-CB 3.29Å; E292-R296 PolarHBondContact O-N 2.84Å; L293-R296 PolarHBondContact O-N 2.87Å; R296-A322 HydrophobicContact CB-CB 3.96Å; R296-F325 HydrophobicContact CG-CD1 3.86Å; R296-F325 HydrophobicContact CG-CE1 4.09Å
297	H	96.5	Very high	91.2	Very high	80 Å²	80	33.5 Å²	33.5	37%	0.37	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	3.1	177.2	-79.6	-80.8	0	0	0	114.2	F257 L293 L294 L295 L299 R332	F257-H297 HydrophobicContact CE2-CB 4.18Å; F257-H297 AromaticContact CE2-CD2 3.63Å; F257-H297 AromaticContact CE2-CG 3.79Å; F257-H297 HydrophobicContact CZ-CB 4.38Å; F257-H297 AromaticContact CZ-CD2 3.45Å; F257-H297 VanDerWaalsContact CZ-CD2 3.45Å; F257-H297 WeakPolarHBondContact CZ-CD2 3.22Å; L293-H297 WeakPolarHBondContact O-CB 3.44Å; L293-H297 PolarHBondContact O-CD2 3Å; L293-H297 VanDerWaalsContact O-CD2 3.28Å; L293-H297 PolarHBondContact O-N 2.98Å; L294-H297 PolarHBondContact O-N 3.18Å; L295-H297 PolarHBondContact O-N 3.05Å; H297-L299 HydrophobicContact CB-CD1 4.2Å; H297-L299 HydrophobicContact CB-CG 4.42Å; H297-R332 VanDerWaalsContact O-CD 3.31Å; H297-R332 WeakPolarHBondContact O-CD 3.29Å
298	G	96.1	Very high	90.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	30.6	-178.5	0	0	0	0	0	113.6	L294 L295 R332 V333	L294-G298 PolarHBondContact O-N 3.08Å; L295-G298 PolarHBondContact O-N 2.83Å; G298-R332 WeakPolarHBondContact O-CB 3.3Å; G298-V333 WeakPolarHBondContact O-CG1 3.25Å; G298-V333 WeakPolarHBondContact O-CG2 3.27Å; G298-V333 PolarHBondContact O-N 2.88Å; G298-V333 VanDerWaalsContact O-N 3.08Å
299	L	96.5	Very high	90.4	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.145	C	C	.	.	S	Bend	trans	-103.4	-0.1	178.3	-68.5	168.9	0	0	0	112.8	C235 P236 D253 A254 F257 L294 H297	C235-L299 PolarHBondContact SG-O 3.24Å; P236-L299 WeakPolarHBondContact CD-O 3.37Å; D253-L299 HydrophobicContact CB-CD2 3.73Å; A254-L299 HydrophobicContact CB-CB 4.11Å; A254-L299 HydrophobicContact CB-CD2 4.12Å; F257-L299 HydrophobicContact CB-CD1 3.47Å; F257-L299 VanDerWaalsContact CB-CD1 3.47Å; F257-L299 HydrophobicContact CD1-CD1 4.05Å; F257-L299 HydrophobicContact CD2-CD1 3.44Å; F257-L299 VanDerWaalsContact CD2-CD1 3.44Å; F257-L299 HydrophobicContact CE2-CD1 4.14Å; F257-L299 HydrophobicContact CG-CD1 3.38Å; L294-L299 HydrophobicContact CD2-CB 3.84Å; L294-L299 HydrophobicContact CD2-CD1 4.2Å; L294-L299 WeakPolarHBondContact O-CB 3.25Å; L294-L299 PolarHBondContact O-N 2.9Å; H297-L299 HydrophobicContact CB-CD1 4.2Å; H297-L299 HydrophobicContact CB-CG 4.42Å
300	A	97	Very high	90.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.144	C	C	.	.			trans	-149	164.7	178	0	0	0	0	0	110.7	I233 K234 L294 L295	I233-A300 HydrophobicContact CB-CB 4.27Å; I233-A300 HydrophobicContact CD1-CB 4.07Å; K234-A300 CarbonylContact O-C 3.52Å; K234-A300 WeakPolarHBondContact O-CA 3.37Å; K234-A300 WeakPolarHBondContact O-CB 3.38Å; L294-A300 HydrophobicContact CB-CB 3.98Å; L294-A300 PolarHBondContact O-N 3.29Å; L295-A300 HydrophobicContact CD2-CB 3.93Å; L295-A300 HydrophobicContact CG-CB 4.29Å
301	H	92.2	Very high	89.9	Confident	43 Å²	43	32.7 Å²	32.7	20%	0.199	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	152	167.6	-53.6	-77.6	0	0	0	111.2	I233 K234 L295 E323 V333 F334 T481	I233-H301 CarbonylContact C-O 3.6Å; I233-H301 VanDerWaalsContact CA-O 3.23Å; I233-H301 WeakPolarHBondContact CA-O 3.46Å; K234-H301 PolarHBondContact N-O 3.39Å; K234-H301 PolarHBondContact O-N 3.17Å; L295-H301 VanDerWaalsContact CD2-C 3.44Å; H301-E323 WeakPolarHBondContact CA-OE1 3.33Å; H301-V333 WeakPolarHBondContact CE1-CG2 3.1Å; H301-F334 AromaticContact CE1-CE1 3.6Å; H301-F334 AromaticContact CE1-CZ 3.86Å; H301-F334 AromaticContact ND1-CE1 3.22Å; H301-F334 WeakPolarHBondContact ND1-CE1 3.47Å; H301-F334 AromaticContact ND1-CZ 3.21Å; H301-F334 WeakPolarHBondContact ND1-CZ 3.33Å; H301-T481 HydrophobicContact CB-CG2 3.34Å
302	C	88.2	Confident	89.7	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128.8	173.1	-78.3	0	0	0	0	111.1	G232 Y319 E323 T481	G232-C302 CarbonylContact O-C 3.54Å; G232-C302 WeakPolarHBondContact O-CA 3.46Å; C302-Y319 PolarHBondContact SG-O 2.86Å; C302-E323 PolarHBondContact N-OE1 3.49Å; C302-T481 WeakPolarHBondContact O-CG2 3.48Å
303	I	80.7	Confident	89.4	Confident	26 Å²	26	36.7 Å²	36.7	13%	0.133	19%	0.189	C	C	.	.			trans	-97.1	94.7	171.9	-56.2	172.3	0	0	0	108.9	G232 I233 K234 W305 N306 L307	G232-I303 PolarHBondContact O-N 3.08Å; I233-I303 WeakPolarHBondContact O-CD1 3.33Å; K234-I303 HydrophobicContact CB-CD1 3.75Å; K234-I303 HydrophobicContact CB-CG1 3.77Å; I303-W305 VanDerWaalsContact C-N 3.29Å; I303-W305 HydrophobicContact CG2-CD2 4.04Å; I303-W305 HydrophobicContact CG2-CG 3.91Å; I303-W305 HydrophobicContact CG2-CZ2 4.15Å; I303-W305 PolarHBondContact O-N 3.01Å; I303-N306 VanDerWaalsContact CB-OD1 3.24Å; I303-N306 WeakPolarHBondContact CB-OD1 3.27Å; I303-N306 WeakPolarHBondContact CD1-ND2 3.29Å; I303-N306 HydrophobicContact CG2-CB 4.33Å; I303-N306 WeakPolarHBondContact CG2-OD1 3.3Å; I303-N306 PolarHBondContact O-N 2.94Å; I303-N306 VanDerWaalsContact O-N 3.13Å; I303-N306 PolarHBondContact O-OD1 3.33Å; I303-L307 WeakPolarHBondContact O-CB 3.23Å; I303-L307 PolarHBondContact O-N 2.72Å
304	D	74.7	Confident	88.9	Confident	31 Å²	31	36.8 Å²	36.8	17%	0.166	20%	0.203	C	C	.	.	H	α-helix	trans	-56.7	-37.2	-175.8	-72.5	38.3	0	0	0	114.8	N306 L307 R485 Y489 L493	D304-N306 PolarHBondContact O-N 3Å; D304-L307 PolarHBondContact O-N 3.15Å; D304-R485 VanDerWaalsContact CB-NH1 3.35Å; D304-R485 IonicContact OD1-CZ 3.57Å; D304-R485 IonicContact OD1-NH1 2.75Å; D304-R485 PolarHBondContact OD1-NH1 2.8Å; D304-R485 IonicContact OD1-NH2 3.86Å; D304-R485 PolarHBondContact OD1-NH2 3.24Å; D304-R485 IonicContact OD2-CZ 3.61Å; D304-R485 IonicContact OD2-NE 3.1Å; D304-R485 PolarHBondContact OD2-NE 2.85Å; D304-R485 IonicContact OD2-NH1 3.87Å; D304-R485 PolarHBondContact OD2-NH1 3.32Å; D304-R485 VanDerWaalsContact OD2-NH1 3.14Å; D304-R485 IonicContact OD2-NH2 3.61Å; D304-R485 PolarHBondContact OD2-NH2 3.5Å; D304-Y489 HydrophobicContact CB-CD1 3.68Å; D304-Y489 HydrophobicContact CB-CE1 3.46Å; D304-Y489 VanDerWaalsContact CB-CE1 3.46Å; D304-L493 WeakPolarHBondContact O-CD1 3.33Å
305	W	71.5	Confident	88.6	Confident	90 Å²	90	37.1 Å²	37.1	34%	0.341	21%	0.206	S	C	.	.	H	α-helix	trans	-68.9	-20.1	-176.7	69.6	-100.1	0	0	0	113.4	F275 I303	F275-W305 AromaticContact CD2-CH2 3.98Å; F275-W305 HydrophobicContact CD2-CH2 3.98Å; F275-W305 HydrophobicContact CD2-CZ3 4.42Å; F275-W305 HydrophobicContact CE1-CH2 4.31Å; F275-W305 AromaticContact CE1-CZ3 3.96Å; F275-W305 HydrophobicContact CE1-CZ3 3.96Å; F275-W305 AromaticContact CE2-CH2 3.65Å; F275-W305 HydrophobicContact CE2-CH2 3.65Å; F275-W305 AromaticContact CE2-CZ3 3.69Å; F275-W305 HydrophobicContact CE2-CZ3 3.69Å; F275-W305 AromaticContact CZ-CH2 3.84Å; F275-W305 HydrophobicContact CZ-CH2 3.84Å; F275-W305 AromaticContact CZ-CZ3 3.43Å; F275-W305 HydrophobicContact CZ-CZ3 3.43Å; F275-W305 VanDerWaalsContact CZ-CZ3 3.43Å; I303-W305 VanDerWaalsContact C-N 3.29Å; I303-W305 HydrophobicContact CG2-CD2 4.04Å; I303-W305 HydrophobicContact CG2-CG 3.91Å; I303-W305 HydrophobicContact CG2-CZ2 4.15Å; I303-W305 PolarHBondContact O-N 3.01Å
306	N	80.3	Confident	88.1	Confident	7 Å²	7	38.4 Å²	38.4	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-115.4	1.3	176.3	76.8	13.7	0	0	0	112.9	G232 I303 D304 N308 L309	G232-N306 WeakPolarHBondContact CA-OD1 3.12Å; G232-N306 PolarHBondContact N-OD1 3.04Å; I303-N306 VanDerWaalsContact CB-OD1 3.24Å; I303-N306 WeakPolarHBondContact CB-OD1 3.27Å; I303-N306 WeakPolarHBondContact CD1-ND2 3.29Å; I303-N306 HydrophobicContact CG2-CB 4.33Å; I303-N306 WeakPolarHBondContact CG2-OD1 3.3Å; I303-N306 PolarHBondContact O-N 2.94Å; I303-N306 VanDerWaalsContact O-N 3.13Å; I303-N306 PolarHBondContact O-OD1 3.33Å; D304-N306 PolarHBondContact O-N 3Å; N306-N308 VanDerWaalsContact C-N 3.27Å; N306-N308 PolarHBondContact O-N 3.36Å; N306-L309 HydrophobicContact CB-CD1 3.93Å; N306-L309 VanDerWaalsContact O-CB 3.31Å; N306-L309 WeakPolarHBondContact O-CB 3.4Å; N306-L309 PolarHBondContact O-N 3.17Å; N306-L309 VanDerWaalsContact O-N 3.1Å
307	L	82.3	Confident	87.5	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-33	179.5	-170.9	64.1	0	0	0	111.9	I303 D304 L309 V310 A316 Y319 K320	I303-L307 WeakPolarHBondContact O-CB 3.23Å; I303-L307 PolarHBondContact O-N 2.72Å; D304-L307 PolarHBondContact O-N 3.15Å; L307-L309 PolarHBondContact O-N 2.8Å; L307-V310 HydrophobicContact CD1-CG2 4.27Å; L307-V310 WeakPolarHBondContact O-CB 3.33Å; L307-V310 VanDerWaalsContact O-CG2 3.29Å; L307-V310 WeakPolarHBondContact O-CG2 3.38Å; L307-V310 PolarHBondContact O-N 3.18Å; L307-A316 HydrophobicContact CD1-CB 4.18Å; L307-A316 HydrophobicContact CG-CB 3.96Å; L307-Y319 HydrophobicContact CD1-CD2 3.56Å; L307-Y319 HydrophobicContact CD1-CE2 4.45Å; L307-Y319 HydrophobicContact CD1-CG 4.24Å; L307-K320 HydrophobicContact CD2-CD 4.29Å; L307-K320 VanDerWaalsContact CD2-CE 3.45Å; L307-K320 HydrophobicContact CD2-CG 3.93Å
308	N	80	Confident	87.3	Confident	78 Å²	78	35.5 Å²	35.5	42%	0.417	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-16.6	175.6	-65.6	-7.1	0	0	0	113.1	N306 V310	N306-N308 VanDerWaalsContact C-N 3.27Å; N306-N308 PolarHBondContact O-N 3.36Å; N308-V310 VanDerWaalsContact C-N 3.27Å
309	L	84.5	Confident	87.3	Confident	48 Å²	48	35.6 Å²	35.6	25%	0.251	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-17.3	176	-58.1	174.3	0	0	0	112.1	E272 F275 N306 L307 S311	E272-L309 HydrophobicContact CB-CB 4.48Å; E272-L309 WeakPolarHBondContact CB-O 3.42Å; E272-L309 VanDerWaalsContact CG-O 3.3Å; E272-L309 WeakPolarHBondContact CG-O 3.35Å; F275-L309 HydrophobicContact CE2-CD1 4Å; F275-L309 HydrophobicContact CZ-CD1 3.7Å; N306-L309 HydrophobicContact CB-CD1 3.93Å; N306-L309 VanDerWaalsContact O-CB 3.31Å; N306-L309 WeakPolarHBondContact O-CB 3.4Å; N306-L309 PolarHBondContact O-N 3.17Å; N306-L309 VanDerWaalsContact O-N 3.1Å; L307-L309 PolarHBondContact O-N 2.8Å; L309-S311 PolarHBondContact O-N 3.04Å
310	V	91.5	Very high	86.9	Confident	14 Å²	14	39.7 Å²	39.7	9%	0.085	23%	0.229	C	C	.	.			trans	-64.7	105.2	-179.7	-176.8	0	0	0	0	108.7	L307 N308 V312 A315 Y319	L307-V310 HydrophobicContact CD1-CG2 4.27Å; L307-V310 WeakPolarHBondContact O-CB 3.33Å; L307-V310 VanDerWaalsContact O-CG2 3.29Å; L307-V310 WeakPolarHBondContact O-CG2 3.38Å; L307-V310 PolarHBondContact O-N 3.18Å; N308-V310 VanDerWaalsContact C-N 3.27Å; V310-V312 VanDerWaalsContact C-N 3.32Å; V310-V312 HydrophobicContact CG1-CB 4.27Å; V310-A315 HydrophobicContact CG1-CB 3.69Å; V310-Y319 HydrophobicContact CG1-CE2 4.23Å; V310-Y319 HydrophobicContact CG2-CD2 4.44Å; V310-Y319 HydrophobicContact CG2-CE2 3.9Å
311	S	91.5	Very high	86.4	Confident	44 Å²	44	43.8 Å²	43.8	31%	0.308	25%	0.25	S	S	.	.			trans	-80.6	-14.7	-174.5	64.5	0	0	0	0	113	E272 L309 P313	E272-S311 WeakPolarHBondContact CG-OG 3.24Å; E272-S311 WeakPolarHBondContact OE1-CB 3.33Å; E272-S311 PolarHBondContact OE1-N 2.72Å; E272-S311 PolarHBondContact OE1-OG 2.61Å; L309-S311 PolarHBondContact O-N 3.04Å; S311-P313 WeakPolarHBondContact O-CD 3.4Å
312	V	93.8	Very high	86.6	Confident	26 Å²	26	41.8 Å²	41.8	16%	0.158	24%	0.241	C	C	.	.	S	Bend	trans	-67.1	119.2	178.2	-178.5	0	0	0	0	109.3	L270 S282 L284 V310 G314 A315	L270-V312 HydrophobicContact CD1-CG2 3.66Å; S282-V312 VanDerWaalsContact CB-CG2 3.49Å; S282-V312 WeakPolarHBondContact OG-CG2 3.46Å; L284-V312 HydrophobicContact CD1-CG2 4.14Å; L284-V312 HydrophobicContact CD2-CG2 3.98Å; L284-V312 HydrophobicContact CG-CG2 4.48Å; V310-V312 VanDerWaalsContact C-N 3.32Å; V310-V312 HydrophobicContact CG1-CB 4.27Å; V312-G314 PolarHBondContact O-N 3.08Å; V312-A315 HydrophobicContact CB-CB 3.64Å; V312-A315 HydrophobicContact CG1-CB 3.77Å; V312-A315 WeakPolarHBondContact O-CB 3.35Å; V312-A315 PolarHBondContact O-N 3.4Å; V312-A315 VanDerWaalsContact O-N 3.07Å
313	P	89.3	Confident	86.9	Confident	126 Å²	126	42.4 Å²	42.4	82%	0.818	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	127.9	-177.4	-27.4	35.4	0	0	0	112.5	S311 A315	S311-P313 WeakPolarHBondContact O-CD 3.4Å; P313-A315 PolarHBondContact O-N 2.72Å; P313-A315 VanDerWaalsContact O-N 3.13Å
314	G	87.8	Confident	87.2	Confident	57 Å²	57	47.9 Å²	47.9	59%	0.588	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	-9.3	178.8	0	0	0	0	0	115.8	V312 A316 E317 A318	V312-G314 PolarHBondContact O-N 3.08Å; G314-A316 PolarHBondContact O-N 3.31Å; G314-E317 PolarHBondContact O-N 2.8Å; G314-A318 PolarHBondContact O-N 2.66Å
315	A	91.9	Very high	88	Confident	6 Å²	6	49 Å²	49	5%	0.05	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-38.2	-175.8	0	0	0	0	0	112.8	V310 V312 P313 E317 A318 Y319	V310-A315 HydrophobicContact CG1-CB 3.69Å; V312-A315 HydrophobicContact CB-CB 3.64Å; V312-A315 HydrophobicContact CG1-CB 3.77Å; V312-A315 WeakPolarHBondContact O-CB 3.35Å; V312-A315 PolarHBondContact O-N 3.4Å; V312-A315 VanDerWaalsContact O-N 3.07Å; P313-A315 PolarHBondContact O-N 2.72Å; P313-A315 VanDerWaalsContact O-N 3.13Å; A315-E317 VanDerWaalsContact C-N 3.28Å; A315-E317 PolarHBondContact O-N 3.05Å; A315-A318 PolarHBondContact O-N 3.05Å; A315-Y319 HydrophobicContact CB-CE1 4.14Å; A315-Y319 WeakPolarHBondContact O-CB 3.16Å; A315-Y319 WeakPolarHBondContact O-CD1 3.47Å; A315-Y319 PolarHBondContact O-N 3.26Å
316	A	86.2	Confident	89.1	Confident	27 Å²	27	44.8 Å²	44.8	22%	0.223	25%	0.25	C	S	.	.	H	α-helix	trans	-57.1	-40.4	176.9	0	0	0	0	0	112.7	L307 G314 K320	L307-A316 HydrophobicContact CD1-CB 4.18Å; L307-A316 HydrophobicContact CG-CB 3.96Å; G314-A316 PolarHBondContact O-N 3.31Å; A316-K320 PolarHBondContact O-N 2.94Å
317	E	84.8	Confident	89.5	Confident	96 Å²	96	45.8 Å²	45.8	45%	0.449	25%	0.254	S	S	.	.	H	α-helix	trans	-74.9	-41.2	176.5	-170.6	56.7	-150.1	0	0	111.3	G314 A315 Y319 K320 I321	G314-E317 PolarHBondContact O-N 2.8Å; A315-E317 VanDerWaalsContact C-N 3.28Å; A315-E317 PolarHBondContact O-N 3.05Å; E317-Y319 PolarHBondContact O-N 3.21Å; E317-K320 PolarHBondContact O-N 2.92Å; E317-K320 VanDerWaalsContact O-N 3.14Å; E317-K320 IonicContact OE2-NZ 2.61Å; E317-I321 HydrophobicContact CG-CD1 4.14Å; E317-I321 WeakPolarHBondContact O-CG1 3.19Å; E317-I321 PolarHBondContact O-N 2.79Å
318	A	92.5	Very high	89.7	Confident	23 Å²	23	52.2 Å²	52.2	19%	0.19	29%	0.285	C	S	.	.	H	α-helix	trans	-57.5	-36.8	174	0	0	0	0	0	112.1	E292 G314 A315 I321 A322	E292-A318 HydrophobicContact CG-CB 4.35Å; G314-A318 PolarHBondContact O-N 2.66Å; A315-A318 PolarHBondContact O-N 3.05Å; A318-I321 PolarHBondContact O-N 3.42Å; A318-A322 VanDerWaalsContact O-CB 3.22Å; A318-A322 WeakPolarHBondContact O-CB 3.32Å; A318-A322 PolarHBondContact O-N 2.89Å
319	Y	96.7	Very high	90.3	Very high	1 Å²	1	54.6 Å²	54.6	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-47.1	175.8	-72.7	8.9	0	0	0	111.3	I233 N289 A291 E292 L295 C302 L307 V310 A315 E317 I321 A322 E323	I233-Y319 HydrophobicContact CG2-CD2 3.87Å; I233-Y319 HydrophobicContact CG2-CE2 4.03Å; N289-Y319 PolarHBondContact ND2-OH 3.38Å; N289-Y319 PolarHBondContact OD1-OH 2.95Å; A291-Y319 HydrophobicContact CB-CE1 4.02Å; A291-Y319 HydrophobicContact CB-CE2 4.17Å; A291-Y319 VanDerWaalsContact CB-OH 3.27Å; A291-Y319 WeakPolarHBondContact CB-OH 3.3Å; E292-Y319 HydrophobicContact CB-CD1 4.04Å; E292-Y319 HydrophobicContact CB-CE1 3.95Å; L295-Y319 VanDerWaalsContact CD1-CA 3.49Å; L295-Y319 HydrophobicContact CD1-CD1 3.94Å; L295-Y319 HydrophobicContact CD1-CD2 4.09Å; L295-Y319 HydrophobicContact CD1-CG 3.53Å; C302-Y319 PolarHBondContact SG-O 2.86Å; L307-Y319 HydrophobicContact CD1-CD2 3.56Å; L307-Y319 HydrophobicContact CD1-CE2 4.45Å; L307-Y319 HydrophobicContact CD1-CG 4.24Å; V310-Y319 HydrophobicContact CG1-CE2 4.23Å; V310-Y319 HydrophobicContact CG2-CD2 4.44Å; V310-Y319 HydrophobicContact CG2-CE2 3.9Å; A315-Y319 HydrophobicContact CB-CE1 4.14Å; A315-Y319 WeakPolarHBondContact O-CB 3.16Å; A315-Y319 WeakPolarHBondContact O-CD1 3.47Å; A315-Y319 PolarHBondContact O-N 3.26Å; E317-Y319 PolarHBondContact O-N 3.21Å; Y319-I321 VanDerWaalsContact C-N 3.33Å; Y319-I321 PolarHBondContact O-N 2.93Å; Y319-A322 PolarHBondContact O-N 3.12Å; Y319-E323 PolarHBondContact O-N 2.79Å
320	K	87.9	Confident	90.6	Very high	87 Å²	87	59.9 Å²	59.9	38%	0.378	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-42.4	175.9	-67	177.4	-173.6	171.3	0	112.1	L307 A316 E317 R324	L307-K320 HydrophobicContact CD2-CD 4.29Å; L307-K320 VanDerWaalsContact CD2-CE 3.45Å; L307-K320 HydrophobicContact CD2-CG 3.93Å; A316-K320 PolarHBondContact O-N 2.94Å; E317-K320 PolarHBondContact O-N 2.92Å; E317-K320 VanDerWaalsContact O-N 3.14Å; E317-K320 IonicContact OE2-NZ 2.61Å; K320-R324 WeakPolarHBondContact O-CB 3.46Å; K320-R324 PolarHBondContact O-N 3.5Å
321	I	87	Confident	90.6	Very high	86 Å²	86	61.7 Å²	61.7	44%	0.441	32%	0.317	S	S	.	.	H	α-helix	trans	-64	-44.9	177	-66.5	168	0	0	0	110.6	E317 A318 Y319 R324 F325	E317-I321 HydrophobicContact CG-CD1 4.14Å; E317-I321 WeakPolarHBondContact O-CG1 3.19Å; E317-I321 PolarHBondContact O-N 2.79Å; A318-I321 PolarHBondContact O-N 3.42Å; Y319-I321 VanDerWaalsContact C-N 3.33Å; Y319-I321 PolarHBondContact O-N 2.93Å; I321-R324 PolarHBondContact O-N 3.32Å; I321-F325 WeakPolarHBondContact O-CB 3.3Å; I321-F325 PolarHBondContact O-N 2.94Å
322	A	95.5	Very high	90.7	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-63.1	-43.7	179	0	0	0	0	0	112.4	E292 L295 R296 A318 Y319 F325 A326	E292-A322 HydrophobicContact CG-CB 4.1Å; L295-A322 HydrophobicContact CB-CB 3.78Å; R296-A322 HydrophobicContact CB-CB 3.96Å; A318-A322 VanDerWaalsContact O-CB 3.22Å; A318-A322 WeakPolarHBondContact O-CB 3.32Å; A318-A322 PolarHBondContact O-N 2.89Å; Y319-A322 PolarHBondContact O-N 3.12Å; A322-F325 PolarHBondContact O-N 3.4Å; A322-A326 PolarHBondContact O-N 2.94Å; A322-A326 VanDerWaalsContact O-N 3.1Å
323	E	93.8	Very high	90.6	Very high	15 Å²	15	63.6 Å²	63.6	7%	0.07	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-44	176	-165.8	-167.3	-129.5	0	0	111.7	L295 H301 C302 Y319 F325 A326 K327 F334	L295-E323 HydrophobicContact CD2-CB 4.29Å; L295-E323 HydrophobicContact CD2-CG 4.47Å; H301-E323 WeakPolarHBondContact CA-OE1 3.33Å; C302-E323 PolarHBondContact N-OE1 3.49Å; Y319-E323 PolarHBondContact O-N 2.79Å; E323-F325 VanDerWaalsContact C-N 3.31Å; E323-F325 PolarHBondContact O-N 2.98Å; E323-A326 PolarHBondContact O-N 2.83Å; E323-A326 VanDerWaalsContact O-N 3.15Å; E323-K327 VanDerWaalsContact CD-NZ 3.34Å; E323-K327 HydrophobicContact CG-CD 4.21Å; E323-K327 WeakPolarHBondContact O-CB 3.46Å; E323-K327 WeakPolarHBondContact O-CG 3.18Å; E323-K327 PolarHBondContact O-N 2.97Å; E323-K327 IonicContact OE1-NZ 3.6Å; E323-K327 WeakPolarHBondContact OE2-CE 3.48Å; E323-K327 IonicContact OE2-NZ 2.85Å; E323-K327 PolarHBondContact OE2-NZ 2.73Å; E323-F334 HydrophobicContact CG-CE1 4.33Å; E323-F334 HydrophobicContact CG-CE2 4.07Å; E323-F334 HydrophobicContact CG-CZ 3.52Å
324	R	87	Confident	90.7	Very high	140 Å²	140	57.7 Å²	57.7	53%	0.528	28%	0.279	S	S	.	.	H	α-helix	trans	-57.6	-45.8	176.6	-172.2	-173.8	-57.7	161.9	5.4	111.2	K320 I321 A326 K327 E328	K320-R324 WeakPolarHBondContact O-CB 3.46Å; K320-R324 PolarHBondContact O-N 3.5Å; I321-R324 PolarHBondContact O-N 3.32Å; R324-A326 VanDerWaalsContact C-N 3.33Å; R324-A326 PolarHBondContact O-N 3.09Å; R324-K327 WeakPolarHBondContact O-CB 3.37Å; R324-K327 PolarHBondContact O-N 3.42Å; R324-E328 WeakPolarHBondContact CG-OE1 3.26Å; R324-E328 WeakPolarHBondContact O-CG 3.49Å; R324-E328 PolarHBondContact O-N 2.95Å
325	F	92.4	Very high	90.7	Very high	56 Å²	56	59.5 Å²	59.5	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-42.4	176	176.5	-91.5	0	0	0	112.5	R296 I321 A322 E323 K329	R296-F325 HydrophobicContact CG-CD1 3.86Å; R296-F325 HydrophobicContact CG-CE1 4.09Å; I321-F325 WeakPolarHBondContact O-CB 3.3Å; I321-F325 PolarHBondContact O-N 2.94Å; A322-F325 PolarHBondContact O-N 3.4Å; E323-F325 VanDerWaalsContact C-N 3.31Å; E323-F325 PolarHBondContact O-N 2.98Å; F325-K329 HydrophobicContact CE1-CD 3.9Å; F325-K329 HydrophobicContact CE2-CD 4.12Å; F325-K329 VanDerWaalsContact CE2-CE 3.5Å; F325-K329 HydrophobicContact CZ-CD 3.68Å; F325-K329 PolarHBondContact O-N 2.94Å
326	A	94.4	Very high	90.1	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-69.2	-36.7	178	0	0	0	0	0	112.9	L295 A322 E323 R324 K329 R330 L331 F334	L295-A326 WeakPolarHBondContact O-CB 3.29Å; A322-A326 PolarHBondContact O-N 2.94Å; A322-A326 VanDerWaalsContact O-N 3.1Å; E323-A326 PolarHBondContact O-N 2.83Å; E323-A326 VanDerWaalsContact O-N 3.15Å; R324-A326 VanDerWaalsContact C-N 3.33Å; R324-A326 PolarHBondContact O-N 3.09Å; A326-K329 CarbonylContact O-C 3.56Å; A326-K329 PolarHBondContact O-N 2.84Å; A326-R330 PolarHBondContact O-N 3.12Å; A326-L331 HydrophobicContact CB-CB 4.44Å; A326-L331 HydrophobicContact CB-CD1 4.38Å; A326-L331 PolarHBondContact O-N 3.22Å; A326-F334 HydrophobicContact CB-CD2 3.73Å; A326-F334 HydrophobicContact CB-CE2 3.91Å
327	K	89.1	Confident	89.7	Confident	28 Å²	28	66.9 Å²	66.9	12%	0.122	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-49.6	173	-79.9	171.1	170.8	170.9	0	112.2	E323 R324 K329 R330 F334 Y337	E323-K327 VanDerWaalsContact CD-NZ 3.34Å; E323-K327 HydrophobicContact CG-CD 4.21Å; E323-K327 WeakPolarHBondContact O-CB 3.46Å; E323-K327 WeakPolarHBondContact O-CG 3.18Å; E323-K327 PolarHBondContact O-N 2.97Å; E323-K327 IonicContact OE1-NZ 3.6Å; E323-K327 WeakPolarHBondContact OE2-CE 3.48Å; E323-K327 IonicContact OE2-NZ 2.85Å; E323-K327 PolarHBondContact OE2-NZ 2.73Å; R324-K327 WeakPolarHBondContact O-CB 3.37Å; R324-K327 PolarHBondContact O-N 3.42Å; K327-K329 VanDerWaalsContact C-N 3.26Å; K327-K329 PolarHBondContact O-N 3.49Å; K327-R330 PolarHBondContact O-N 2.83Å; K327-R330 VanDerWaalsContact O-N 3.07Å; K327-F334 HydrophobicContact CD-CD1 4.4Å; K327-F334 HydrophobicContact CD-CE1 4.13Å; K327-F334 VanDerWaalsContact CE-CE1 3.43Å; K327-F334 HydrophobicContact CG-CD1 3.45Å; K327-F334 VanDerWaalsContact CG-CD1 3.45Å; K327-F334 HydrophobicContact CG-CD2 4.28Å; K327-F334 HydrophobicContact CG-CE1 3.58Å; K327-F334 HydrophobicContact CG-CE2 4.39Å; K327-F334 HydrophobicContact CG-CG 3.83Å; K327-F334 HydrophobicContact CG-CZ 4.06Å; K327-Y337 HydrophobicContact CB-CD1 3.74Å; K327-Y337 HydrophobicContact CB-CE1 3.64Å; K327-Y337 HydrophobicContact CB-CE2 4.48Å; K327-Y337 HydrophobicContact CB-CG 4.22Å; K327-Y337 HydrophobicContact CD-CD2 4.28Å; K327-Y337 HydrophobicContact CD-CE1 4.25Å; K327-Y337 HydrophobicContact CD-CE2 3.74Å; K327-Y337 HydrophobicContact CG-CD1 4.04Å; K327-Y337 HydrophobicContact CG-CD2 3.97Å; K327-Y337 HydrophobicContact CG-CE1 3.99Å; K327-Y337 HydrophobicContact CG-CE2 3.91Å; K327-Y337 HydrophobicContact CG-CG 4.02Å
328	E	87.1	Confident	88.9	Confident	138 Å²	138	70 Å²	70	65%	0.645	32%	0.318	S	S	*	.	H	α-helix	trans	-58.4	-39.4	177.7	-75.2	170.8	-171.8	0	0	112	R324 R330	R324-E328 WeakPolarHBondContact CG-OE1 3.26Å; R324-E328 WeakPolarHBondContact O-CG 3.49Å; R324-E328 PolarHBondContact O-N 2.95Å; E328-R330 VanDerWaalsContact C-N 3.34Å
329	K	91.6	Very high	87.3	Confident	127 Å²	127	71.7 Å²	71.7	55%	0.552	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	0.6	178.3	-69.3	-165.1	176.1	-164.8	0	114.6	F325 A326 K327 L331	F325-K329 HydrophobicContact CE1-CD 3.9Å; F325-K329 HydrophobicContact CE2-CD 4.12Å; F325-K329 VanDerWaalsContact CE2-CE 3.5Å; F325-K329 HydrophobicContact CZ-CD 3.68Å; F325-K329 PolarHBondContact O-N 2.94Å; A326-K329 CarbonylContact O-C 3.56Å; A326-K329 PolarHBondContact O-N 2.84Å; K327-K329 VanDerWaalsContact C-N 3.26Å; K327-K329 PolarHBondContact O-N 3.49Å; K329-L331 VanDerWaalsContact C-N 3.27Å; K329-L331 HydrophobicContact CB-CD1 4.16Å; K329-L331 HydrophobicContact CB-CD2 3.96Å; K329-L331 HydrophobicContact CB-CG 3.72Å; K329-L331 PolarHBondContact O-N 3.37Å
330	R	91	Very high	84.9	Confident	159 Å²	159	77.2 Å²	77.2	60%	0.6	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	46.5	-177.7	-58.7	-176.4	-178	177.3	0.6	113.1	A326 K327 E328 F334 E335	A326-R330 PolarHBondContact O-N 3.12Å; K327-R330 PolarHBondContact O-N 2.83Å; K327-R330 VanDerWaalsContact O-N 3.07Å; E328-R330 VanDerWaalsContact C-N 3.34Å; R330-F334 CarbonylContact C-O 3.57Å; R330-F334 VanDerWaalsContact CA-O 3.24Å; R330-F334 WeakPolarHBondContact CA-O 3.4Å; R330-F334 WeakPolarHBondContact CB-O 3.13Å; R330-E335 WeakPolarHBondContact O-CA 3.45Å
331	L	91.8	Very high	82.2	Confident	53 Å²	53	79 Å²	79	28%	0.277	37%	0.371	S	S	.	.			trans	-80.7	123.9	-177.2	-58.3	179.5	0	0	0	110.7	A326 K329 V333 F334	A326-L331 HydrophobicContact CB-CB 4.44Å; A326-L331 HydrophobicContact CB-CD1 4.38Å; A326-L331 PolarHBondContact O-N 3.22Å; K329-L331 VanDerWaalsContact C-N 3.27Å; K329-L331 HydrophobicContact CB-CD1 4.16Å; K329-L331 HydrophobicContact CB-CD2 3.96Å; K329-L331 HydrophobicContact CB-CG 3.72Å; K329-L331 PolarHBondContact O-N 3.37Å; L331-V333 PolarHBondContact O-N 2.85Å; L331-V333 VanDerWaalsContact O-N 3.07Å; L331-F334 WeakPolarHBondContact O-CB 3.26Å; L331-F334 PolarHBondContact O-N 3.49Å
332	R	93.4	Very high	79.7	Confident	77 Å²	77	79 Å²	79	29%	0.291	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	53.1	-104.9	163.6	-60.7	177.4	-175	-87.7	5.3	114.1	W250 D253 H297 G298 F334 E335	W250-R332 HydrophobicContact CD2-CB 3.66Å; W250-R332 HydrophobicContact CD2-CG 4.03Å; W250-R332 HydrophobicContact CE3-CB 4.01Å; W250-R332 HydrophobicContact CE3-CG 3.83Å; W250-R332 HydrophobicContact CG-CB 3.94Å; W250-R332 HydrophobicContact CH2-CG 4.26Å; W250-R332 HydrophobicContact CZ2-CB 4.3Å; W250-R332 HydrophobicContact CZ2-CG 4.46Å; W250-R332 HydrophobicContact CZ3-CB 4.45Å; W250-R332 HydrophobicContact CZ3-CG 3.95Å; W250-R332 PolarHBondContact NE1-O 3.26Å; W250-R332 VanDerWaalsContact NE1-O 3.11Å; D253-R332 VanDerWaalsContact CG-NH1 3.35Å; D253-R332 IonicContact OD1-CZ 3.87Å; D253-R332 IonicContact OD1-NH1 3.65Å; D253-R332 PolarHBondContact OD1-NH1 3.29Å; H297-R332 VanDerWaalsContact O-CD 3.31Å; H297-R332 WeakPolarHBondContact O-CD 3.29Å; G298-R332 WeakPolarHBondContact O-CB 3.3Å; R332-F334 PolarHBondContact O-N 3.32Å; R332-E335 VanDerWaalsContact O-CB 3.26Å; R332-E335 WeakPolarHBondContact O-CB 3.47Å; R332-E335 WeakPolarHBondContact O-CG 3.36Å; R332-E335 PolarHBondContact O-N 2.8Å
333	V	91.6	Very high	76.6	Confident	32 Å²	32	82.2 Å²	82.2	19%	0.194	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-59.6	-16	178	-55.7	0	0	0	0	112.6	P236 W250 G298 H301 L331	P236-V333 HydrophobicContact CG-CG1 3.56Å; W250-V333 HydrophobicContact CB-CG1 4.13Å; W250-V333 HydrophobicContact CG-CG1 4.34Å; G298-V333 WeakPolarHBondContact O-CG1 3.25Å; G298-V333 WeakPolarHBondContact O-CG2 3.27Å; G298-V333 PolarHBondContact O-N 2.88Å; G298-V333 VanDerWaalsContact O-N 3.08Å; H301-V333 WeakPolarHBondContact CE1-CG2 3.1Å; L331-V333 PolarHBondContact O-N 2.85Å; L331-V333 VanDerWaalsContact O-N 3.07Å
334	F	90.7	Very high	73.2	Confident	2 Å²	2	90.3 Å²	90.3	1%	0.009	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-103.9	14.6	174.6	-56	-67.2	0	0	0	113.8	H301 E323 A326 K327 R330 L331 R332 N336 Y337	H301-F334 AromaticContact CE1-CE1 3.6Å; H301-F334 AromaticContact CE1-CZ 3.86Å; H301-F334 AromaticContact ND1-CE1 3.22Å; H301-F334 WeakPolarHBondContact ND1-CE1 3.47Å; H301-F334 AromaticContact ND1-CZ 3.21Å; H301-F334 WeakPolarHBondContact ND1-CZ 3.33Å; E323-F334 HydrophobicContact CG-CE1 4.33Å; E323-F334 HydrophobicContact CG-CE2 4.07Å; E323-F334 HydrophobicContact CG-CZ 3.52Å; A326-F334 HydrophobicContact CB-CD2 3.73Å; A326-F334 HydrophobicContact CB-CE2 3.91Å; K327-F334 HydrophobicContact CD-CD1 4.4Å; K327-F334 HydrophobicContact CD-CE1 4.13Å; K327-F334 VanDerWaalsContact CE-CE1 3.43Å; K327-F334 HydrophobicContact CG-CD1 3.45Å; K327-F334 VanDerWaalsContact CG-CD1 3.45Å; K327-F334 HydrophobicContact CG-CD2 4.28Å; K327-F334 HydrophobicContact CG-CE1 3.58Å; K327-F334 HydrophobicContact CG-CE2 4.39Å; K327-F334 HydrophobicContact CG-CG 3.83Å; K327-F334 HydrophobicContact CG-CZ 4.06Å; R330-F334 CarbonylContact C-O 3.57Å; R330-F334 VanDerWaalsContact CA-O 3.24Å; R330-F334 WeakPolarHBondContact CA-O 3.4Å; R330-F334 WeakPolarHBondContact CB-O 3.13Å; L331-F334 WeakPolarHBondContact O-CB 3.26Å; L331-F334 PolarHBondContact O-N 3.49Å; R332-F334 PolarHBondContact O-N 3.32Å; F334-N336 PolarHBondContact O-N 3.09Å; F334-Y337 HydrophobicContact CD1-CD2 4.24Å; F334-Y337 HydrophobicContact CD1-CG 4.37Å; F334-Y337 WeakPolarHBondContact O-CB 3.38Å; F334-Y337 PolarHBondContact O-N 3.49Å
335	E	87.5	Confident	70.6	Confident	95 Å²	95	88.5 Å²	88.5	44%	0.444	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-40.1	178.2	69.9	-171.9	164.5	0	0	112.2	W250 R330 R332	W250-E335 WeakPolarHBondContact CZ2-OE2 3.31Å; R330-E335 WeakPolarHBondContact O-CA 3.45Å; R332-E335 VanDerWaalsContact O-CB 3.26Å; R332-E335 WeakPolarHBondContact O-CB 3.47Å; R332-E335 WeakPolarHBondContact O-CG 3.36Å; R332-E335 PolarHBondContact O-N 2.8Å
336	N	80.7	Confident	67.6	Low	134 Å²	134	94 Å²	94	72%	0.717	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	14.6	176.7	-62.3	-41.7	0	0	0	112	F334 Q338	F334-N336 PolarHBondContact O-N 3.09Å; N336-Q338 PolarHBondContact O-N 3.38Å
337	Y	77	Confident	64.8	Low	55 Å²	55	99.3 Å²	99.3	22%	0.216	51%	0.507	C	S	.	.			trans	-65.1	103.9	177.7	178.1	-102.9	0	0	0	109.1	K327 F334 P339	K327-Y337 HydrophobicContact CB-CD1 3.74Å; K327-Y337 HydrophobicContact CB-CE1 3.64Å; K327-Y337 HydrophobicContact CB-CE2 4.48Å; K327-Y337 HydrophobicContact CB-CG 4.22Å; K327-Y337 HydrophobicContact CD-CD2 4.28Å; K327-Y337 HydrophobicContact CD-CE1 4.25Å; K327-Y337 HydrophobicContact CD-CE2 3.74Å; K327-Y337 HydrophobicContact CG-CD1 4.04Å; K327-Y337 HydrophobicContact CG-CD2 3.97Å; K327-Y337 HydrophobicContact CG-CE1 3.99Å; K327-Y337 HydrophobicContact CG-CE2 3.91Å; K327-Y337 HydrophobicContact CG-CG 4.02Å; F334-Y337 HydrophobicContact CD1-CD2 4.24Å; F334-Y337 HydrophobicContact CD1-CG 4.37Å; F334-Y337 WeakPolarHBondContact O-CB 3.38Å; F334-Y337 PolarHBondContact O-N 3.49Å; Y337-P339 HydrophobicContact CE1-CB 4.3Å; Y337-P339 HydrophobicContact CE1-CG 4.11Å
338	Q	67.6	Low	62.4	Low	160 Å²	160	105.1 Å²	105.1	75%	0.748	54%	0.54	S	S	*	.			trans	-84.8	124.1	158.7	-63.3	177.5	9.8	0	0	104.9	N336 T340	N336-Q338 PolarHBondContact O-N 3.38Å; Q338-T340 PolarHBondContact O-N 3.44Å
339	P	59.9	Low	60	Low	59 Å²	59	104 Å²	104	38%	0.383	55%	0.547	S	S	.	.			trans	-45.8	142.6	159.8	-18.1	29	0	0	0	106.7	Y337 Q341	Y337-P339 HydrophobicContact CE1-CB 4.3Å; Y337-P339 HydrophobicContact CE1-CG 4.11Å; P339-Q341 PolarHBondContact O-N 2.91Å
340	T	45.7	Very low	57	Low	118 Å²	118	106.1 Å²	106.1	72%	0.724	56%	0.564	S	S	*	*			trans	-60.8	83.2	165.5	-43.5	0	0	0	0	106.5	Q338 T342	Q338-T340 PolarHBondContact O-N 3.44Å; T340-T342 PolarHBondContact O-N 3.33Å
341	Q	31.7	Very low	54.9	Low	124 Å²	124	102.7 Å²	102.7	58%	0.579	56%	0.562	S	S	*	*			trans	-62.7	122.5	161.1	-66.3	-178.5	19.1	0	0	101.9	P339 A343	P339-Q341 PolarHBondContact O-N 2.91Å; Q341-A343 VanDerWaalsContact C-N 3.31Å; Q341-A343 WeakPolarHBondContact O-CA 3.4Å; Q341-A343 PolarHBondContact O-N 2.93Å
342	T	35.1	Very low	53.8	Low	86 Å²	86	105.1 Å²	105.1	53%	0.528	58%	0.579	S	S	.	*			trans	-30.9	107.3	150.1	27.1	0	0	0	0	107	T340 E344 P355	T340-T342 PolarHBondContact O-N 3.33Å; T342-E344 PolarHBondContact O-N 3.01Å; T342-P355 HydrophobicContact CG2-CB 4.43Å; T342-P355 WeakPolarHBondContact CG2-O 3.31Å
343	A	29	Very low	53.2	Low	69 Å²	69	102.7 Å²	102.7	57%	0.57	57%	0.572	S	S	*	*			trans	-57.5	113.6	-165.8	0	0	0	0	0	108.1	Q341 V345	Q341-A343 VanDerWaalsContact C-N 3.31Å; Q341-A343 WeakPolarHBondContact O-CA 3.4Å; Q341-A343 PolarHBondContact O-N 2.93Å; A343-V345 HydrophobicContact CB-CG2 3.53Å; A343-V345 PolarHBondContact O-N 3.19Å
344	E	23.6	Very low	52.7	Low	184 Å²	184	104.1 Å²	104.1	86%	0.86	58%	0.581	S	S	*	*			trans	-68.8	91.5	159.1	-69.8	-177.2	177.5	0	0	105.3	T342	T342-E344 PolarHBondContact O-N 3.01Å
345	V	32.2	Very low	52.4	Low	102 Å²	102	106 Å²	106	62%	0.618	59%	0.594	S	S	*	*			trans	-91.8	133.9	178.6	-176.7	0	0	0	0	108.9	A343	A343-V345 HydrophobicContact CB-CG2 3.53Å; A343-V345 PolarHBondContact O-N 3.19Å
346	H	28.8	Very low	52.1	Low	173 Å²	173	103.6 Å²	103.6	80%	0.801	60%	0.595	S	S	*	*			trans	-23.7	129.1	173.2	-68	-79.6	0	0	0	115.4	D348	H346-D348 PolarHBondContact O-N 3.41Å
347	S	36.8	Very low	52.4	Low	111 Å²	111	100.6 Å²	100.6	78%	0.776	58%	0.575	S	S	*	*	S	Bend	trans	-53.4	98.2	167.6	54.7	0	0	0	0	110.3
348	D	37.7	Very low	53.1	Low	150 Å²	150	103 Å²	103	80%	0.802	59%	0.59	S	S	*	*	S	Bend	trans	-168.7	106.5	133.7	-85.7	-24.1	0	0	0	107.5	H346	H346-D348 PolarHBondContact O-N 3.41Å
349	S	35.8	Very low	54.3	Low	114 Å²	114	95.7 Å²	95.7	80%	0.797	56%	0.556	S	S	*	*	S	Bend	trans	74.3	109.5	-172	72	0	0	0	0	116.5	P351	S349-P351 VanDerWaalsContact O-CD 3.27Å; S349-P351 WeakPolarHBondContact O-CD 3.25Å
350	L	30.3	Very low	55.9	Low	172 Å²	172	96.3 Å²	96.3	90%	0.901	56%	0.562	S	S	*	*			trans	-58.5	119	174.7	-109.4	84.4	0	0	0	110.5	T352	L350-T352 PolarHBondContact O-N 2.99Å
351	P	45.5	Very low	58.2	Low	86 Å²	86	91 Å²	91	56%	0.558	53%	0.53	S	S	*	.			trans	-67.4	124.6	165.9	-13.3	28.2	0	0	0	108.9	S349 V353	S349-P351 VanDerWaalsContact O-CD 3.27Å; S349-P351 WeakPolarHBondContact O-CD 3.25Å; P351-V353 PolarHBondContact O-N 3.35Å
352	T	69.3	Low	61.2	Low	104 Å²	104	87 Å²	87	64%	0.638	51%	0.514	S	S	*	.	S	Bend	trans	-67.8	-15.5	-177.4	-14	0	0	0	0	112.8	L350 K357	L350-T352 PolarHBondContact O-N 2.99Å; T352-K357 PolarHBondContact O-NZ 3.34Å
353	V	79.9	Confident	64.1	Low	26 Å²	26	82.9 Å²	82.9	16%	0.158	49%	0.489	C	S	.	.			trans	-127.1	121	-174.6	-172.2	0	0	0	0	109.4	P351 F359 V437 I440 V452	P351-V353 PolarHBondContact O-N 3.35Å; V353-F359 HydrophobicContact CB-CZ 4.4Å; V353-F359 HydrophobicContact CG1-CE2 3.99Å; V353-F359 HydrophobicContact CG1-CZ 4.09Å; V353-F359 HydrophobicContact CG2-CZ 3.95Å; V353-V437 HydrophobicContact CG1-CG2 4.08Å; V353-I440 WeakPolarHBondContact O-CD1 3.39Å; V353-V452 HydrophobicContact CG1-CG1 3.68Å; V353-V452 HydrophobicContact CG1-CG2 4.13Å
354	V	82.5	Confident	67.2	Low	63 Å²	63	81.3 Å²	81.3	38%	0.382	47%	0.474	S	S	.	.			trans	-130.4	153.9	178.6	-65.2	0	0	0	0	111.1	K357	V354-K357 HydrophobicContact CG2-CB 4.19Å; V354-K357 VanDerWaalsContact O-CB 3.23Å; V354-K357 WeakPolarHBondContact O-CB 3.46Å; V354-K357 PolarHBondContact O-N 3.39Å
355	P	83.9	Confident	70.6	Confident	41 Å²	41	75 Å²	75	27%	0.266	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	142.8	170.3	-25.3	35	0	0	0	112.3	T342 K357 I440	T342-P355 HydrophobicContact CG2-CB 4.43Å; T342-P355 WeakPolarHBondContact CG2-O 3.31Å; P355-K357 VanDerWaalsContact C-N 3.25Å; P355-K357 PolarHBondContact O-N 2.86Å; P355-I440 HydrophobicContact CG-CG1 4.43Å
356	G	80.3	Confident	73.6	Confident	45 Å²	45	70.3 Å²	70.3	46%	0.464	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-12.3	-175.4	0	0	0	0	0	115.2	V437	G356-V437 PolarHBondContact N-O 2.8Å
357	K	87.1	Confident	76.6	Confident	70 Å²	70	62.8 Å²	62.8	30%	0.304	39%	0.385	S	S	.	.			trans	-70.3	140.2	175.2	-171.2	169.7	171.5	-179.3	0	110.5	T352 V354 P355 F359 V437	T352-K357 PolarHBondContact O-NZ 3.34Å; V354-K357 HydrophobicContact CG2-CB 4.19Å; V354-K357 VanDerWaalsContact O-CB 3.23Å; V354-K357 WeakPolarHBondContact O-CB 3.46Å; V354-K357 PolarHBondContact O-N 3.39Å; P355-K357 VanDerWaalsContact C-N 3.25Å; P355-K357 PolarHBondContact O-N 2.86Å; K357-F359 HydrophobicContact CB-CE2 4.04Å; K357-F359 HydrophobicContact CD-CE1 4.39Å; K357-F359 HydrophobicContact CD-CE2 3.69Å; K357-F359 HydrophobicContact CD-CZ 3.53Å; K357-F359 HydrophobicContact CG-CD2 4.25Å; K357-F359 HydrophobicContact CG-CE2 3.63Å; K357-F359 HydrophobicContact CG-CZ 3.99Å; K357-V437 WeakPolarHBondContact O-CG2 3.36Å; K357-V437 PolarHBondContact O-N 3.02Å
358	I	91.4	Very high	79.1	Confident	105 Å²	105	60.7 Å²	60.7	54%	0.538	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.9	176.3	-59.9	173.1	0	0	0	108.9	A435	I358-A435 WeakPolarHBondContact CA-O 3.49Å
359	F	93.2	Very high	81.5	Confident	7 Å²	7	53.6 Å²	53.6	3%	0.031	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	140.7	171.7	-67	-97.4	0	0	0	109.2	V353 K357 H381 F383 T434 A435 V437	V353-F359 HydrophobicContact CB-CZ 4.4Å; V353-F359 HydrophobicContact CG1-CE2 3.99Å; V353-F359 HydrophobicContact CG1-CZ 4.09Å; V353-F359 HydrophobicContact CG2-CZ 3.95Å; K357-F359 HydrophobicContact CB-CE2 4.04Å; K357-F359 HydrophobicContact CD-CE1 4.39Å; K357-F359 HydrophobicContact CD-CE2 3.69Å; K357-F359 HydrophobicContact CD-CZ 3.53Å; K357-F359 HydrophobicContact CG-CD2 4.25Å; K357-F359 HydrophobicContact CG-CE2 3.63Å; K357-F359 HydrophobicContact CG-CZ 3.99Å; F359-H381 AromaticContact CD1-CD2 3.89Å; F359-H381 AromaticContact CE1-CD2 3.91Å; F359-H381 AromaticContact CE1-CE1 3.91Å; F359-H381 AromaticContact CE1-NE2 3.69Å; F359-F383 HydrophobicContact CB-CE2 4.29Å; F359-F383 HydrophobicContact CB-CZ 3.88Å; F359-F383 HydrophobicContact CD1-CZ 4.24Å; F359-F383 AromaticContact CD2-CE1 3.9Å; F359-F383 HydrophobicContact CD2-CE1 3.9Å; F359-F383 AromaticContact CD2-CZ 3.52Å; F359-F383 HydrophobicContact CD2-CZ 3.52Å; F359-F383 HydrophobicContact CE2-CE1 4.22Å; F359-F383 HydrophobicContact CE2-CZ 4.07Å; F359-F383 HydrophobicContact CG-CE1 4.44Å; F359-F383 HydrophobicContact CG-CE2 4.42Å; F359-F383 AromaticContact CG-CZ 3.62Å; F359-F383 HydrophobicContact CG-CZ 3.62Å; F359-T434 CarbonylContact O-C 3.6Å; F359-T434 WeakPolarHBondContact O-CA 3.34Å; F359-A435 HydrophobicContact CB-CB 4.39Å; F359-A435 PolarHBondContact N-O 3.12Å; F359-A435 PolarHBondContact O-N 2.8Å; F359-V437 HydrophobicContact CD2-CG2 4.04Å; F359-V437 HydrophobicContact CE2-CG2 3.83Å
360	S	94.3	Very high	84.2	Confident	72 Å²	72	49.3 Å²	49.3	50%	0.503	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.5	174.3	-62.7	0	0	0	0	108.8	V433	S360-V433 WeakPolarHBondContact CA-O 3.06Å
361	G	93.4	Very high	87.3	Confident	6 Å²	6	41.8 Å²	41.8	6%	0.062	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.5	-168.5	-177.1	0	0	0	0	0	112.6	K375 Q432 V433	G361-K375 CarbonylContact C-O 3.55Å; G361-K375 VanDerWaalsContact CA-O 3.22Å; G361-K375 WeakPolarHBondContact CA-O 3.34Å; G361-Q432 VanDerWaalsContact C-OE1 3.26Å; G361-Q432 CarbonylContact O-C 3.57Å; G361-Q432 WeakPolarHBondContact O-CA 3.49Å; G361-Q432 PolarHBondContact O-OE1 2.81Å; G361-Q432 VanDerWaalsContact O-OE1 3.05Å; G361-V433 PolarHBondContact N-O 3.34Å; G361-V433 VanDerWaalsContact N-O 3.1Å; G361-V433 WeakPolarHBondContact O-CG2 3.43Å; G361-V433 PolarHBondContact O-N 2.91Å
362	V	95	Very high	89.8	Confident	40 Å²	40	37.7 Å²	37.7	24%	0.242	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.8	-176.3	179.2	0	0	0	0	110.2	C364 I374 K375 G430 K431 Q432	V362-C364 PolarHBondContact O-N 3.18Å; V362-I374 CarbonylContact O-C 3.57Å; V362-I374 WeakPolarHBondContact O-CA 3.45Å; V362-K375 PolarHBondContact N-O 3.04Å; V362-K375 PolarHBondContact O-N 2.9Å; V362-G430 VanDerWaalsContact CG1-CA 3.43Å; V362-G430 WeakPolarHBondContact CG1-O 3.29Å; V362-K431 WeakPolarHBondContact CA-O 3.2Å; V362-Q432 HydrophobicContact CG2-CG 4.28Å; V362-Q432 VanDerWaalsContact CG2-NE2 3.31Å
363	I	96.1	Very high	91.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	120.1	171.5	-66.2	179.5	0	0	0	108.8	V366 V372 S373 I374 F428 I429 G430 K431 V433 L463	I363-V366 HydrophobicContact CG2-CG1 3.8Å; I363-V372 HydrophobicContact CD1-CB 4.44Å; I363-V372 HydrophobicContact CD1-CG1 4.37Å; I363-V372 HydrophobicContact CG2-CB 4.47Å; I363-S373 WeakPolarHBondContact CA-O 3.09Å; I363-I374 HydrophobicContact CG1-CG1 4.26Å; I363-F428 HydrophobicContact CD1-CB 3.83Å; I363-I429 HydrophobicContact CG2-CG1 4.09Å; I363-G430 PolarHBondContact O-N 2.82Å; I363-K431 PolarHBondContact N-O 3.1Å; I363-K431 VanDerWaalsContact N-O 3.13Å; I363-V433 HydrophobicContact CD1-CB 4.46Å; I363-V433 HydrophobicContact CD1-CG1 3.59Å; I363-V433 HydrophobicContact CD1-CG2 4.19Å; I363-V433 HydrophobicContact CG1-CB 4.33Å; I363-V433 HydrophobicContact CG1-CG1 3.76Å; I363-V433 HydrophobicContact CG1-CG2 3.61Å; I363-L463 HydrophobicContact CD1-CD1 3.76Å
364	C	93.3	Very high	91.8	Very high	37 Å²	37	32.3 Å²	32.3	25%	0.25	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-18.4	178.8	61.1	0	0	0	0	113.2	V362 S373 K375	V362-C364 PolarHBondContact O-N 3.18Å; C364-S373 PolarHBondContact N-O 3.17Å; C364-S373 PolarHBondContact SG-O 2.8Å; C364-S373 VanDerWaalsContact SG-O 3.39Å; C364-K375 HydrophobicContact CB-CB 4.38Å
365	E	95	Very high	92.3	Very high	50 Å²	50	33.3 Å²	33.3	23%	0.234	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	149.2	179	-158.1	175.7	145.1	0	0	110	V372 S373 K600 M604	E365-V372 CarbonylContact O-C 3.51Å; E365-V372 WeakPolarHBondContact O-CA 3.42Å; E365-S373 PolarHBondContact N-O 3.26Å; E365-S373 PolarHBondContact O-N 2.8Å; E365-K600 WeakPolarHBondContact OE2-CE 3.37Å; E365-K600 IonicContact OE2-NZ 2.72Å; E365-K600 PolarHBondContact OE2-NZ 3.37Å; E365-M604 HydrophobicContact CG-CE 4.17Å
366	V	96.4	Very high	92.6	Very high	5 Å²	5	32 Å²	32	3%	0.03	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.1	174.3	-53.9	0	0	0	0	110.2	I363 V372 R422 L425 R426 I429 Q605	I363-V366 HydrophobicContact CG2-CG1 3.8Å; V366-V372 HydrophobicContact CB-CG1 4.4Å; V366-V372 HydrophobicContact CG1-CG1 3.99Å; V366-R422 HydrophobicContact CG2-CG 4.18Å; V366-L425 HydrophobicContact CB-CB 3.86Å; V366-L425 HydrophobicContact CG1-CB 3.84Å; V366-L425 HydrophobicContact CG2-CB 4.2Å; V366-R426 HydrophobicContact CG2-CB 4.12Å; V366-I429 HydrophobicContact CG1-CD1 4.26Å; V366-I429 HydrophobicContact CG1-CG1 3.91Å; V366-I429 HydrophobicContact CG2-CD1 4.34Å; V366-Q605 PolarHBondContact O-NE2 2.84Å; V366-Q605 PolarHBondContact O-OE1 3.31Å
367	G	92.4	Very high	92.9	Very high	14 Å²	14	36.2 Å²	36.2	14%	0.144	21%	0.21	C	C	.	.			trans	-88.6	-160.4	175.6	0	0	0	0	0	113.3	G369 N371	G367-G369 PolarHBondContact O-N 2.96Å; G367-N371 WeakPolarHBondContact CA-OD1 2.96Å; G367-N371 PolarHBondContact N-O 3.22Å
368	N	88.6	Confident	92.7	Very high	68 Å²	68	36.9 Å²	36.9	36%	0.364	22%	0.217	S	C	.	.	S	Bend	trans	-77.8	47.1	-177.9	-67.6	-23.1	0	0	0	113.1	A390 V418	N368-A390 VanDerWaalsContact O-CB 3.3Å; N368-A390 WeakPolarHBondContact O-CB 3.4Å; N368-V418 HydrophobicContact CB-CG1 3.76Å
369	G	88.3	Confident	92.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	83.9	10.8	173.4	0	0	0	0	0	116.2	G367 L467	G367-G369 PolarHBondContact O-N 2.96Å; G369-L467 WeakPolarHBondContact O-CD1 3.28Å
370	D	92.3	Very high	92.3	Very high	24 Å²	24	37.3 Å²	37.3	13%	0.128	23%	0.232	C	C	.	.	S	Bend	trans	-136.4	1	175.7	70.6	-18.2	0	0	0	114.3	F384 L385 A390 R451	D370-F384 CarbonylContact O-C 3.43Å; D370-F384 WeakPolarHBondContact O-CA 3.27Å; D370-L385 PolarHBondContact O-N 2.89Å; D370-A390 HydrophobicContact CB-CB 3.99Å; D370-R451 IonicContact OD2-NH1 3.98Å
371	N	95.5	Very high	92.2	Very high	15 Å²	15	35.5 Å²	35.5	8%	0.08	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	156.1	-178.5	67.3	88.3	0	0	0	112.7	G367 K382 F383 F384	G367-N371 WeakPolarHBondContact CA-OD1 2.96Å; G367-N371 PolarHBondContact N-O 3.22Å; N371-K382 WeakPolarHBondContact OD1-CE 3.49Å; N371-F383 CarbonylContact C-O 3.55Å; N371-F383 WeakPolarHBondContact CA-O 3.49Å; N371-F383 VanDerWaalsContact CB-O 3.3Å; N371-F383 WeakPolarHBondContact CB-O 3.22Å; N371-F384 HydrophobicContact CB-CD1 3.71Å; N371-F384 HydrophobicContact CB-CE1 3.97Å; N371-F384 HydrophobicContact CB-CG 4.07Å
372	V	97.5	Very high	92.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.4	177.6	-60.5	0	0	0	0	110.1	I363 E365 V366 I374 F383 L425 V456 L463	I363-V372 HydrophobicContact CD1-CB 4.44Å; I363-V372 HydrophobicContact CD1-CG1 4.37Å; I363-V372 HydrophobicContact CG2-CB 4.47Å; E365-V372 CarbonylContact O-C 3.51Å; E365-V372 WeakPolarHBondContact O-CA 3.42Å; V366-V372 HydrophobicContact CB-CG1 4.4Å; V366-V372 HydrophobicContact CG1-CG1 3.99Å; V372-I374 HydrophobicContact CG2-CD1 4.3Å; V372-I374 HydrophobicContact CG2-CG1 4.19Å; V372-F383 PolarHBondContact N-O 3.31Å; V372-F383 PolarHBondContact O-N 3.21Å; V372-L425 HydrophobicContact CG1-CD1 4.14Å; V372-L425 HydrophobicContact CG1-CD2 4.46Å; V372-V456 HydrophobicContact CG2-CG1 4.2Å; V372-V456 HydrophobicContact CG2-CG2 4.03Å; V372-L463 HydrophobicContact CG1-CD1 4.36Å
373	S	96.1	Very high	92.3	Very high	16 Å²	16	38.7 Å²	38.7	11%	0.112	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.2	170.5	-56.6	0	0	0	0	109.6	I363 C364 E365 H381	I363-S373 WeakPolarHBondContact CA-O 3.09Å; C364-S373 PolarHBondContact N-O 3.17Å; C364-S373 PolarHBondContact SG-O 2.8Å; C364-S373 VanDerWaalsContact SG-O 3.39Å; E365-S373 PolarHBondContact N-O 3.26Å; E365-S373 PolarHBondContact O-N 2.8Å; S373-H381 CarbonylContact C-O 3.59Å; S373-H381 WeakPolarHBondContact CA-O 3.42Å
374	I	96.1	Very high	92.3	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.3	-175	-55.5	174.7	0	0	0	108.6	V362 I363 V372 C376 V380 H381 F383 V433 A435 V456	V362-I374 CarbonylContact O-C 3.57Å; V362-I374 WeakPolarHBondContact O-CA 3.45Å; I363-I374 HydrophobicContact CG1-CG1 4.26Å; V372-I374 HydrophobicContact CG2-CD1 4.3Å; V372-I374 HydrophobicContact CG2-CG1 4.19Å; I374-C376 PolarHBondContact O-N 3.08Å; I374-V380 WeakPolarHBondContact O-CA 3.28Å; I374-H381 PolarHBondContact N-O 3.29Å; I374-H381 PolarHBondContact O-N 3.33Å; I374-F383 HydrophobicContact CB-CD2 4.33Å; I374-F383 HydrophobicContact CB-CE2 4.21Å; I374-F383 HydrophobicContact CD1-CD2 3.53Å; I374-F383 HydrophobicContact CD1-CE2 3.86Å; I374-F383 HydrophobicContact CG1-CD2 3.97Å; I374-F383 HydrophobicContact CG1-CE2 4.3Å; I374-V433 HydrophobicContact CD1-CG2 3.61Å; I374-V433 HydrophobicContact CG1-CG2 3.92Å; I374-V433 HydrophobicContact CG2-CG2 3.92Å; I374-A435 HydrophobicContact CD1-CB 3.61Å; I374-V456 HydrophobicContact CD1-CG1 4.07Å; I374-V456 HydrophobicContact CD1-CG2 4.48Å
375	K	91.7	Very high	92.5	Very high	85 Å²	85	38.5 Å²	38.5	37%	0.37	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	102.6	170.7	-175.3	178.1	178.1	-177.1	0	108.7	G361 V362 C364 V380 E601	G361-K375 CarbonylContact C-O 3.55Å; G361-K375 VanDerWaalsContact CA-O 3.22Å; G361-K375 WeakPolarHBondContact CA-O 3.34Å; V362-K375 PolarHBondContact N-O 3.04Å; V362-K375 PolarHBondContact O-N 2.9Å; C364-K375 HydrophobicContact CB-CB 4.38Å; K375-V380 HydrophobicContact CB-CG2 4.18Å; K375-V380 HydrophobicContact CG-CG2 4.22Å; K375-E601 IonicContact NZ-OE1 3.67Å; K375-E601 PolarHBondContact NZ-OE1 2.9Å; K375-E601 IonicContact NZ-OE2 3.67Å; K375-E601 PolarHBondContact NZ-OE2 2.96Å
376	C	90.7	Very high	92.6	Very high	14 Å²	14	36.1 Å²	36.1	10%	0.095	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	174.1	175	-60	0	0	0	0	110.1	I374 D378 G379	I374-C376 PolarHBondContact O-N 3.08Å; C376-D378 WeakPolarHBondContact CB-OD1 3.48Å; C376-D378 PolarHBondContact O-N 2.92Å; C376-G379 WeakPolarHBondContact CA-O 3.46Å; C376-G379 WeakPolarHBondContact CB-O 3.28Å; C376-G379 PolarHBondContact N-O 2.73Å; C376-G379 PolarHBondContact O-N 3.05Å
377	S	85.7	Confident	92.5	Very high	132 Å²	132	35.9 Å²	35.9	92%	0.923	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-25.1	175.6	54.2	0	0	0	0	113.7
378	D	83.6	Confident	92.7	Very high	84 Å²	84	35.9 Å²	35.9	45%	0.449	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-2.3	-178.1	66.3	-23.3	0	0	0	113.7	C376 H381	C376-D378 WeakPolarHBondContact CB-OD1 3.48Å; C376-D378 PolarHBondContact O-N 2.92Å; D378-H381 VanDerWaalsContact CG-NE2 3.28Å; D378-H381 IonicContact OD1-CD2 3.99Å; D378-H381 IonicContact OD1-NE2 3.71Å; D378-H381 PolarHBondContact OD1-NE2 2.84Å; D378-H381 IonicContact OD2-CE1 3.8Å; D378-H381 IonicContact OD2-NE2 2.85Å; D378-H381 PolarHBondContact OD2-NE2 3.29Å; D378-H381 VanDerWaalsContact OD2-NE2 3.16Å
379	G	86.3	Confident	92.8	Very high	32 Å²	32	38.6 Å²	38.6	33%	0.33	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	140.2	-169.9	-179.6	0	0	0	0	0	113.5	C376	C376-G379 WeakPolarHBondContact CA-O 3.46Å; C376-G379 WeakPolarHBondContact CB-O 3.28Å; C376-G379 PolarHBondContact N-O 2.73Å; C376-G379 PolarHBondContact O-N 3.05Å
380	V	89.8	Confident	93	Very high	90 Å²	90	39.5 Å²	39.5	55%	0.545	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.8	177.2	-179.6	0	0	0	0	109.5	I374 K375	I374-V380 WeakPolarHBondContact O-CA 3.28Å; K375-V380 HydrophobicContact CB-CG2 4.18Å; K375-V380 HydrophobicContact CG-CG2 4.22Å
381	H	92.9	Very high	92.9	Very high	34 Å²	34	38.9 Å²	38.9	16%	0.157	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.7	-179.1	-61.8	-84.5	0	0	0	110.9	F359 S373 I374 D378 F383	F359-H381 AromaticContact CD1-CD2 3.89Å; F359-H381 AromaticContact CE1-CD2 3.91Å; F359-H381 AromaticContact CE1-CE1 3.91Å; F359-H381 AromaticContact CE1-NE2 3.69Å; S373-H381 CarbonylContact C-O 3.59Å; S373-H381 WeakPolarHBondContact CA-O 3.42Å; I374-H381 PolarHBondContact N-O 3.29Å; I374-H381 PolarHBondContact O-N 3.33Å; D378-H381 VanDerWaalsContact CG-NE2 3.28Å; D378-H381 IonicContact OD1-CD2 3.99Å; D378-H381 IonicContact OD1-NE2 3.71Å; D378-H381 PolarHBondContact OD1-NE2 2.84Å; D378-H381 IonicContact OD2-CE1 3.8Å; D378-H381 IonicContact OD2-NE2 2.85Å; D378-H381 PolarHBondContact OD2-NE2 3.29Å; D378-H381 VanDerWaalsContact OD2-NE2 3.16Å; H381-F383 HydrophobicContact CB-CD2 4.35Å; H381-F383 HydrophobicContact CB-CE2 3.5Å; H381-F383 VanDerWaalsContact CB-CE2 3.5Å; H381-F383 HydrophobicContact CB-CZ 3.67Å
382	K	94.7	Very high	92.3	Very high	112 Å²	112	46.1 Å²	46.1	49%	0.487	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.1	176.9	-175	177.1	-177.4	174.1	0	110.5	N371	N371-K382 WeakPolarHBondContact OD1-CE 3.49Å
383	F	95.9	Very high	91	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.5	179.5	-63.1	-77.8	0	0	0	111	F359 N371 V372 I374 H381 A435 V437 V452 A454 V456	F359-F383 HydrophobicContact CB-CE2 4.29Å; F359-F383 HydrophobicContact CB-CZ 3.88Å; F359-F383 HydrophobicContact CD1-CZ 4.24Å; F359-F383 AromaticContact CD2-CE1 3.9Å; F359-F383 HydrophobicContact CD2-CE1 3.9Å; F359-F383 AromaticContact CD2-CZ 3.52Å; F359-F383 HydrophobicContact CD2-CZ 3.52Å; F359-F383 HydrophobicContact CE2-CE1 4.22Å; F359-F383 HydrophobicContact CE2-CZ 4.07Å; F359-F383 HydrophobicContact CG-CE1 4.44Å; F359-F383 HydrophobicContact CG-CE2 4.42Å; F359-F383 AromaticContact CG-CZ 3.62Å; F359-F383 HydrophobicContact CG-CZ 3.62Å; N371-F383 CarbonylContact C-O 3.55Å; N371-F383 WeakPolarHBondContact CA-O 3.49Å; N371-F383 VanDerWaalsContact CB-O 3.3Å; N371-F383 WeakPolarHBondContact CB-O 3.22Å; V372-F383 PolarHBondContact N-O 3.31Å; V372-F383 PolarHBondContact O-N 3.21Å; I374-F383 HydrophobicContact CB-CD2 4.33Å; I374-F383 HydrophobicContact CB-CE2 4.21Å; I374-F383 HydrophobicContact CD1-CD2 3.53Å; I374-F383 HydrophobicContact CD1-CE2 3.86Å; I374-F383 HydrophobicContact CG1-CD2 3.97Å; I374-F383 HydrophobicContact CG1-CE2 4.3Å; H381-F383 HydrophobicContact CB-CD2 4.35Å; H381-F383 HydrophobicContact CB-CE2 3.5Å; H381-F383 VanDerWaalsContact CB-CE2 3.5Å; H381-F383 HydrophobicContact CB-CZ 3.67Å; F383-A435 HydrophobicContact CD1-CB 4.31Å; F383-A435 HydrophobicContact CD2-CB 3.97Å; F383-A435 HydrophobicContact CE1-CB 4.33Å; F383-A435 HydrophobicContact CE2-CB 3.97Å; F383-A435 HydrophobicContact CG-CB 4.13Å; F383-A435 HydrophobicContact CZ-CB 4.17Å; F383-V437 HydrophobicContact CD1-CG2 4.44Å; F383-V437 HydrophobicContact CE1-CG2 3.82Å; F383-V452 HydrophobicContact CD1-CB 4.38Å; F383-V452 HydrophobicContact CD1-CG1 3.69Å; F383-V452 HydrophobicContact CE1-CG1 3.79Å; F383-A454 HydrophobicContact CB-CB 4.09Å; F383-A454 HydrophobicContact CD1-CB 3.62Å; F383-A454 HydrophobicContact CE1-CB 4.43Å; F383-A454 HydrophobicContact CG-CB 4.12Å; F383-V456 HydrophobicContact CB-CG2 4.22Å
384	F	96.5	Very high	89.4	Confident	28 Å²	28	55.8 Å²	55.8	12%	0.123	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	136.2	168	-69.1	-94.7	0	0	0	109.1	D370 N371 S386 R451 V452 C453 A454	D370-F384 CarbonylContact O-C 3.43Å; D370-F384 WeakPolarHBondContact O-CA 3.27Å; N371-F384 HydrophobicContact CB-CD1 3.71Å; N371-F384 HydrophobicContact CB-CE1 3.97Å; N371-F384 HydrophobicContact CB-CG 4.07Å; F384-S386 PolarHBondContact O-N 3.39Å; F384-R451 HydrophobicContact CB-CB 4.49Å; F384-R451 HydrophobicContact CD1-CG 4.47Å; F384-R451 HydrophobicContact CD2-CB 3.61Å; F384-R451 HydrophobicContact CD2-CG 3.89Å; F384-R451 HydrophobicContact CE1-CG 4.37Å; F384-R451 HydrophobicContact CE2-CB 3.95Å; F384-R451 HydrophobicContact CE2-CG 3.77Å; F384-R451 HydrophobicContact CG-CB 4.03Å; F384-R451 HydrophobicContact CG-CG 4.23Å; F384-R451 HydrophobicContact CZ-CG 4.02Å; F384-V452 PolarHBondContact N-O 3.48Å; F384-C453 CarbonylContact O-C 3.47Å; F384-C453 VanDerWaalsContact O-CA 3.25Å; F384-C453 WeakPolarHBondContact O-CA 3.46Å; F384-A454 PolarHBondContact O-N 3.37Å
385	L	97.7	Very high	87	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	121.1	178.5	-64.5	179.5	0	0	0	109.3	D370 S387 I388 L425 V456 L463 A464 L467	D370-L385 PolarHBondContact O-N 2.89Å; L385-S387 PolarHBondContact O-N 3.09Å; L385-I388 HydrophobicContact CB-CD1 3.5Å; L385-I388 VanDerWaalsContact CB-CD1 3.5Å; L385-I388 HydrophobicContact CB-CG1 3.66Å; L385-I388 HydrophobicContact CD1-CD1 3.72Å; L385-I388 HydrophobicContact CG-CD1 4.26Å; L385-I388 WeakPolarHBondContact O-CG1 3.44Å; L385-L425 HydrophobicContact CD1-CD1 4.38Å; L385-L425 HydrophobicContact CD1-CD2 4.18Å; L385-V456 HydrophobicContact CD2-CB 3.92Å; L385-V456 HydrophobicContact CD2-CG2 3.85Å; L385-L463 HydrophobicContact CD1-CB 4.31Å; L385-L463 HydrophobicContact CD2-CB 4.05Å; L385-A464 HydrophobicContact CB-CB 4.19Å; L385-L467 HydrophobicContact CD1-CD1 3.63Å
386	S	95.2	Very high	84.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	135.6	-171.3	55.4	0	0	0	0	112.3	F384 I388 D438 A454 T455 S486	F384-S386 PolarHBondContact O-N 3.39Å; S386-I388 PolarHBondContact O-N 3.14Å; S386-I388 VanDerWaalsContact O-N 3.17Å; S386-D438 WeakPolarHBondContact CB-OD2 3.33Å; S386-D438 PolarHBondContact OG-OD2 3Å; S386-A454 PolarHBondContact N-O 2.83Å; S386-A454 PolarHBondContact OG-O 2.82Å; S386-T455 PolarHBondContact OG-OG1 3.11Å; S386-S486 VanDerWaalsContact OG-CB 3.3Å; S386-S486 WeakPolarHBondContact OG-CB 3.41Å; S386-S486 PolarHBondContact OG-OG 3.32Å
387	S	94.9	Very high	81.9	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.007	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	18.4	171	-58.3	0	0	0	0	116	L385 Y439 V476 Y478 R485 S486	L385-S387 PolarHBondContact O-N 3.09Å; S387-Y439 PolarHBondContact N-OH 3.43Å; S387-V476 PolarHBondContact O-N 2.74Å; S387-Y478 VanDerWaalsContact CA-OH 3.29Å; S387-Y478 WeakPolarHBondContact CA-OH 3.48Å; S387-Y478 WeakPolarHBondContact CB-OH 3.31Å; S387-Y478 WeakPolarHBondContact OG-CE2 3.4Å; S387-Y478 PolarHBondContact OG-OH 3.09Å; S387-R485 WeakPolarHBondContact OG-CA 3.47Å; S387-S486 PolarHBondContact OG-N 2.87Å
388	I	96	Very high	79.4	Confident	13 Å²	13	70.5 Å²	70.5	7%	0.067	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	167.5	170.2	70	166.6	0	0	0	111.8	L385 S386 A464 L467 V468 A473 S474 L492	L385-I388 HydrophobicContact CB-CD1 3.5Å; L385-I388 VanDerWaalsContact CB-CD1 3.5Å; L385-I388 HydrophobicContact CB-CG1 3.66Å; L385-I388 HydrophobicContact CD1-CD1 3.72Å; L385-I388 HydrophobicContact CG-CD1 4.26Å; L385-I388 WeakPolarHBondContact O-CG1 3.44Å; S386-I388 PolarHBondContact O-N 3.14Å; S386-I388 VanDerWaalsContact O-N 3.17Å; I388-A464 HydrophobicContact CD1-CB 4.08Å; I388-A464 HydrophobicContact CG2-CB 4.05Å; I388-L467 HydrophobicContact CD1-CD1 4.05Å; I388-V468 HydrophobicContact CB-CG2 4.4Å; I388-V468 HydrophobicContact CG2-CG2 3.6Å; I388-A473 HydrophobicContact CB-CB 4.28Å; I388-A473 HydrophobicContact CD1-CB 3.89Å; I388-S474 CarbonylContact C-O 3.51Å; I388-S474 WeakPolarHBondContact CA-O 3.17Å; I388-L492 HydrophobicContact CG2-CD1 4.22Å; I388-L492 HydrophobicContact CG2-CD2 3.83Å
389	R	92.7	Very high	77.1	Confident	126 Å²	126	75.9 Å²	75.9	48%	0.475	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.2	170.3	-62.1	-176.4	178.2	-106.9	-1.6	109.3	A473 S474 V476	R389-A473 WeakPolarHBondContact O-CA 3.24Å; R389-S474 PolarHBondContact N-O 3.26Å; R389-S474 PolarHBondContact O-N 3.01Å; R389-V476 HydrophobicContact CG-CG2 3.68Å
390	A	91.2	Very high	74.5	Confident	18 Å²	18	80.8 Å²	80.8	15%	0.149	40%	0.403	C	S	.	.			trans	-55.6	156.2	166.9	0	0	0	0	0	111.3	N368 D370	N368-A390 VanDerWaalsContact O-CB 3.3Å; N368-A390 WeakPolarHBondContact O-CB 3.4Å; D370-A390 HydrophobicContact CB-CB 3.99Å
391	P	90.2	Very high	71.6	Confident	11 Å²	11	84 Å²	84	7%	0.071	42%	0.417	C	S	.	.			trans	-52.8	144.1	171.7	-24.5	34.5	0	0	0	111.6	I415 P416 V418 L472 M506	P391-I415 HydrophobicContact CB-CG2 4.49Å; P391-P416 WeakPolarHBondContact CB-O 3.48Å; P391-V418 HydrophobicContact CB-CG2 3.87Å; P391-V418 HydrophobicContact CG-CG2 4.15Å; P391-L472 VanDerWaalsContact CD-O 3.22Å; P391-L472 WeakPolarHBondContact CD-O 3.3Å; P391-L472 WeakPolarHBondContact CG-O 3.34Å; P391-M506 HydrophobicContact CG-CE 4.36Å
392	R	82.9	Confident	68.6	Low	167 Å²	167	86.9 Å²	86.9	63%	0.63	44%	0.441	S	S	*	.			trans	-105.3	153.1	-175	-77.4	-174.4	-97.6	-178.5	-3.9	111.5	Q394 I415	R392-Q394 PolarHBondContact O-N 3.25Å; R392-I415 VanDerWaalsContact C-CG2 3.48Å
393	P	70.7	Confident	66	Low	85 Å²	85	88 Å²	88	55%	0.552	46%	0.462	S	S	*	.			trans	-57	133.1	169.9	-15.4	26.5	0	0	0	109.9	S395 I415	P393-S395 PolarHBondContact O-N 2.95Å; P393-I415 HydrophobicContact CB-CG1 4.5Å; P393-I415 HydrophobicContact CG-CD1 3.85Å; P393-I415 HydrophobicContact CG-CG1 4.14Å
394	Q	62.2	Low	63.3	Low	134 Å²	134	92.3 Å²	92.3	63%	0.626	50%	0.498	S	S	*	.			trans	-68.3	121.2	172.3	-75.2	-177.6	-13.5	0	0	109.3	R392 N396	R392-Q394 PolarHBondContact O-N 3.25Å; Q394-N396 VanDerWaalsContact C-N 3.31Å; Q394-N396 PolarHBondContact O-N 2.83Å; Q394-N396 VanDerWaalsContact O-N 3.1Å
395	S	46.1	Very low	60.2	Low	104 Å²	104	99.4 Å²	99.4	73%	0.727	53%	0.532	S	S	*	.			trans	-76.5	86.8	162.8	59.4	0	0	0	0	107.6	P393 N397	P393-S395 PolarHBondContact O-N 2.95Å; S395-N397 PolarHBondContact O-N 3Å
396	N	41.4	Very low	57.3	Low	120 Å²	120	111 Å²	111	64%	0.642	58%	0.576	S	S	*	*			trans	-65.3	106.4	167.4	-86.9	-11.3	0	0	0	107.8	Q394 K398	Q394-N396 VanDerWaalsContact C-N 3.31Å; Q394-N396 PolarHBondContact O-N 2.83Å; Q394-N396 VanDerWaalsContact O-N 3.1Å; N396-K398 PolarHBondContact O-N 3.43Å
397	N	33.2	Very low	54.6	Low	156 Å²	156	113.7 Å²	113.7	83%	0.834	60%	0.603	S	S	*	*			trans	-69.4	42.5	164.2	-80.1	-4.7	0	0	0	111.2	S395	S395-N397 PolarHBondContact O-N 3Å
398	K	33.1	Very low	52.4	Low	161 Å²	161	119.1 Å²	119.1	70%	0.7	62%	0.624	S	S	*	*			trans	-103.7	109.5	166.4	-72.4	-167	175.8	-174.3	0	106.9	N396 D400	N396-K398 PolarHBondContact O-N 3.43Å; K398-D400 PolarHBondContact O-N 3.3Å
399	E	35.2	Very low	50.3	Low	196 Å²	196	124.3 Å²	124.3	92%	0.916	65%	0.65	S	S	*	*			trans	-65.2	46.2	171.5	-63.6	178.9	143	0	0	111.7	D401	E399-D401 PolarHBondContact O-N 2.67Å
400	D	31.7	Very low	49.3	Very low	136 Å²	136	122.4 Å²	122.4	73%	0.727	64%	0.643	S	S	*	*			trans	-89.3	103.6	177.1	-75	-30.7	0	0	0	109.9	K398	K398-D400 PolarHBondContact O-N 3.3Å
401	D	29.3	Very low	48.7	Very low	158 Å²	158	124.3 Å²	124.3	85%	0.845	65%	0.654	S	S	*	*			trans	-19	119	160.1	-91	-37.3	0	0	0	116	E399	E399-D401 PolarHBondContact O-N 2.67Å
402	S	31	Very low	48.6	Very low	94 Å²	94	124.8 Å²	124.8	66%	0.657	66%	0.655	S	S	*	*			trans	158.4	96.9	135	51	0	0	0	0	110.1	A404	S402-A404 PolarHBondContact O-N 3.13Å
403	S	38.4	Very low	48.9	Very low	134 Å²	134	117.8 Å²	117.8	94%	0.937	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	19.3	-177.7	48.3	0	0	0	0	115.4
404	A	40.2	Very low	49.6	Very low	92 Å²	92	117.7 Å²	117.7	76%	0.76	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	1.8	-170.3	0	0	0	0	0	116.1	S402	S402-A404 PolarHBondContact O-N 3.13Å
405	Q	31.8	Very low	50.8	Low	178 Å²	178	112.3 Å²	112.3	83%	0.832	60%	0.6	S	S	*	*			trans	-125	25.9	-178.2	-87.6	-177.5	-13	0	0	115.2	G407	Q405-G407 PolarHBondContact O-N 3.01Å
406	R	35.6	Very low	52.9	Low	247 Å²	247	108.8 Å²	108.8	93%	0.932	57%	0.574	S	S	*	*			trans	-76	70.8	165.4	-76.5	-174.1	178.3	175.3	1.2	110.6
407	G	39.3	Very low	55.4	Low	56 Å²	56	104.2 Å²	104.2	58%	0.577	55%	0.548	S	S	*	.			trans	-60.6	156.1	159.9	0	0	0	0	0	110.4	Q405 I409	Q405-G407 PolarHBondContact O-N 3.01Å; G407-I409 PolarHBondContact O-N 2.69Å
408	R	48.8	Very low	58.3	Low	116 Å²	116	96.9 Å²	96.9	44%	0.438	51%	0.509	S	S	.	.			trans	-42	112.7	175.3	-74.1	-173	-167	161.5	2.9	110.2	R410 T1020 D1021	R408-R410 PolarHBondContact O-N 3.23Å; R408-T1020 PolarHBondContact NH2-O 3.11Å; R408-D1021 IonicContact CZ-OD1 3.85Å; R408-D1021 IonicContact NE-OD1 3.51Å; R408-D1021 PolarHBondContact NE-OD1 3.36Å; R408-D1021 VanDerWaalsContact NH2-CA 3.27Å; R408-D1021 IonicContact NH2-OD1 2.7Å; R408-D1021 PolarHBondContact NH2-OD1 2.99Å
409	I	52.7	Low	61.2	Low	121 Å²	121	90.5 Å²	90.5	62%	0.621	48%	0.481	S	S	*	.			trans	-61.4	124.8	172.8	-62.9	173.1	0	0	0	107.1	G407 P411 D414	G407-I409 PolarHBondContact O-N 2.69Å; I409-P411 VanDerWaalsContact O-CD 3.3Å; I409-P411 WeakPolarHBondContact O-CD 3.47Å; I409-D414 HydrophobicContact CG2-CB 4.44Å
410	R	71.6	Confident	64.1	Low	86 Å²	86	83.2 Å²	83.2	33%	0.325	45%	0.447	S	S	.	.			trans	-99.6	98.7	175.4	-62.9	173.7	-173.4	163.9	3.3	108.3	R408 L412 Y413 D414 V517 D519	R408-R410 PolarHBondContact O-N 3.23Å; R410-L412 PolarHBondContact O-N 3.42Å; R410-Y413 PolarHBondContact O-N 3.4Å; R410-Y413 VanDerWaalsContact O-N 3.15Å; R410-D414 WeakPolarHBondContact CB-OD2 3.5Å; R410-D414 PolarHBondContact N-OD2 3.1Å; R410-D414 VanDerWaalsContact O-CB 3.29Å; R410-D414 WeakPolarHBondContact O-CB 3.27Å; R410-D414 PolarHBondContact O-N 3.39Å; R410-V517 PolarHBondContact NH1-O 3.16Å; R410-D519 IonicContact CZ-OD2 2.85Å; R410-D519 IonicContact NE-OD2 2.94Å; R410-D519 VanDerWaalsContact NH1-CB 3.26Å; R410-D519 IonicContact NH2-OD2 2.82Å
411	P	78.5	Confident	67.1	Low	58 Å²	58	76.8 Å²	76.8	38%	0.377	41%	0.413	S	S	.	.	H	α-helix	trans	-56.5	-33.8	-169.7	-28	37.7	0	0	0	113.7	I409 I415 V418	I409-P411 VanDerWaalsContact O-CD 3.3Å; I409-P411 WeakPolarHBondContact O-CD 3.47Å; P411-I415 HydrophobicContact CB-CD1 3.78Å; P411-I415 WeakPolarHBondContact O-CB 3.2Å; P411-I415 PolarHBondContact O-N 3.28Å; P411-V418 WeakPolarHBondContact O-CB 3.47Å; P411-V418 WeakPolarHBondContact O-CG1 3.44Å
412	L	86.7	Confident	70.3	Confident	21 Å²	21	69.3 Å²	69.3	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-65.7	-42.5	-178.1	-177	60.8	0	0	0	113.5	R410 V418 F419 R422	R410-L412 PolarHBondContact O-N 3.42Å; L412-V418 HydrophobicContact CD1-CG1 4.3Å; L412-F419 HydrophobicContact CD1-CD2 4.47Å; L412-F419 HydrophobicContact CG-CD2 4.36Å; L412-F419 WeakPolarHBondContact O-CA 3.47Å; L412-F419 WeakPolarHBondContact O-CB 3.24Å; L412-F419 PolarHBondContact O-N 3.06Å; L412-F419 VanDerWaalsContact O-N 3.14Å; L412-R422 HydrophobicContact CD1-CB 3.59Å; L412-R422 HydrophobicContact CD1-CG 3.75Å
413	Y	89.3	Confident	73.4	Confident	20 Å²	20	66.6 Å²	66.6	8%	0.078	35%	0.35	C	S	.	.	H	α-helix	trans	-104.1	-28.3	-173.2	-55.3	-67.5	0	0	0	113.3	R410 F419 H515 V517 V563	R410-Y413 PolarHBondContact O-N 3.4Å; R410-Y413 VanDerWaalsContact O-N 3.15Å; Y413-F419 AromaticContact CD1-CD2 3.78Å; Y413-F419 HydrophobicContact CD1-CD2 3.78Å; Y413-F419 HydrophobicContact CD1-CE2 4.25Å; Y413-F419 AromaticContact CE1-CD2 3.68Å; Y413-F419 HydrophobicContact CE1-CD2 3.68Å; Y413-F419 AromaticContact CE1-CE2 3.76Å; Y413-F419 HydrophobicContact CE1-CE2 3.76Å; Y413-H515 HydrophobicContact CD1-CB 4.2Å; Y413-V517 HydrophobicContact CD1-CB 4.29Å; Y413-V517 HydrophobicContact CD1-CG2 3.59Å; Y413-V517 HydrophobicContact CD2-CB 4.34Å; Y413-V517 HydrophobicContact CD2-CG2 4.5Å; Y413-V517 HydrophobicContact CE1-CG2 3.87Å; Y413-V517 HydrophobicContact CE2-CG1 4.39Å; Y413-V517 HydrophobicContact CG-CB 4.18Å; Y413-V517 HydrophobicContact CG-CG2 3.93Å; Y413-V563 HydrophobicContact CE2-CG2 4.3Å
414	D	85.2	Confident	76.1	Confident	84 Å²	84	61.1 Å²	61.1	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-91.6	-25.7	-172.6	-60.3	-15.3	0	0	0	112.6	I409 R410 P416	I409-D414 HydrophobicContact CG2-CB 4.44Å; R410-D414 WeakPolarHBondContact CB-OD2 3.5Å; R410-D414 PolarHBondContact N-OD2 3.1Å; R410-D414 VanDerWaalsContact O-CB 3.29Å; R410-D414 WeakPolarHBondContact O-CB 3.27Å; R410-D414 PolarHBondContact O-N 3.39Å; D414-P416 WeakPolarHBondContact O-CD 3.48Å
415	I	88.3	Confident	78.8	Confident	21 Å²	21	56.8 Å²	56.8	11%	0.108	28%	0.275	C	S	.	.	S	Bend	trans	-87.4	120.9	176.7	-57.5	173.9	0	0	0	108.5	P391 R392 P393 P411 Y417 V418	P391-I415 HydrophobicContact CB-CG2 4.49Å; R392-I415 VanDerWaalsContact C-CG2 3.48Å; P393-I415 HydrophobicContact CB-CG1 4.5Å; P393-I415 HydrophobicContact CG-CD1 3.85Å; P393-I415 HydrophobicContact CG-CG1 4.14Å; P411-I415 HydrophobicContact CB-CD1 3.78Å; P411-I415 WeakPolarHBondContact O-CB 3.2Å; P411-I415 PolarHBondContact O-N 3.28Å; I415-Y417 PolarHBondContact O-N 3.42Å; I415-V418 HydrophobicContact CB-CB 4.25Å; I415-V418 HydrophobicContact CB-CG2 3.55Å; I415-V418 HydrophobicContact CG2-CG2 3.45Å; I415-V418 VanDerWaalsContact CG2-CG2 3.45Å; I415-V418 PolarHBondContact O-N 2.93Å
416	P	89.6	Confident	81.9	Confident	29 Å²	29	50.2 Å²	50.2	19%	0.188	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	135	176.5	-33	38.8	0	0	0	113.1	P391 D414 V418 A512	P391-P416 WeakPolarHBondContact CB-O 3.48Å; D414-P416 WeakPolarHBondContact O-CD 3.48Å; P416-V418 PolarHBondContact O-N 2.84Å; P416-V418 VanDerWaalsContact O-N 3.14Å; P416-A512 HydrophobicContact CB-CB 3.79Å; P416-A512 HydrophobicContact CG-CB 4.26Å
417	Y	93.8	Very high	84.7	Confident	24 Å²	24	44.8 Å²	44.8	9%	0.094	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	-5.7	176.1	-53.1	-75.1	0	0	0	116.5	I415 E420 A421 L472 G505 M506 A512 P513	I415-Y417 PolarHBondContact O-N 3.42Å; Y417-E420 WeakPolarHBondContact CA-OE2 3.1Å; Y417-A421 WeakPolarHBondContact O-CB 3.44Å; Y417-A421 PolarHBondContact O-N 3.15Å; Y417-L472 HydrophobicContact CD1-CD2 4.05Å; Y417-L472 HydrophobicContact CG-CD2 4.44Å; Y417-G505 VanDerWaalsContact CE1-C 3.41Å; Y417-G505 PolarHBondContact OH-O 2.95Å; Y417-M506 HydrophobicContact CD2-CB 3.88Å; Y417-M506 VanDerWaalsContact CE2-CA 3.47Å; Y417-M506 HydrophobicContact CE2-CB 4.16Å; Y417-A512 HydrophobicContact CD2-CB 4.49Å; Y417-A512 HydrophobicContact CE2-CB 3.65Å; Y417-P513 VanDerWaalsContact CE1-CD 3.48Å; Y417-P513 HydrophobicContact CE1-CG 4.16Å
418	V	93.7	Very high	87.4	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-70	-40.7	178.8	176.3	0	0	0	0	111.4	N368 P391 P411 L412 I415 P416 E420 A421 R422	N368-V418 HydrophobicContact CB-CG1 3.76Å; P391-V418 HydrophobicContact CB-CG2 3.87Å; P391-V418 HydrophobicContact CG-CG2 4.15Å; P411-V418 WeakPolarHBondContact O-CB 3.47Å; P411-V418 WeakPolarHBondContact O-CG1 3.44Å; L412-V418 HydrophobicContact CD1-CG1 4.3Å; I415-V418 HydrophobicContact CB-CB 4.25Å; I415-V418 HydrophobicContact CB-CG2 3.55Å; I415-V418 HydrophobicContact CG2-CG2 3.45Å; I415-V418 VanDerWaalsContact CG2-CG2 3.45Å; I415-V418 PolarHBondContact O-N 2.93Å; P416-V418 PolarHBondContact O-N 2.84Å; P416-V418 VanDerWaalsContact O-N 3.14Å; V418-E420 VanDerWaalsContact C-N 3.33Å; V418-E420 PolarHBondContact O-N 3.17Å; V418-A421 PolarHBondContact O-N 2.74Å; V418-R422 WeakPolarHBondContact O-CB 3.41Å; V418-R422 PolarHBondContact O-N 2.79Å
419	F	94.4	Very high	89.6	Confident	28 Å²	28	38.8 Å²	38.8	12%	0.123	19%	0.189	C	C	.	.	H	α-helix	trans	-57.1	-48.6	174.7	-178.7	-96.8	0	0	0	110.9	L412 Y413 A421 R422 E423 H515 Y556	L412-F419 HydrophobicContact CD1-CD2 4.47Å; L412-F419 HydrophobicContact CG-CD2 4.36Å; L412-F419 WeakPolarHBondContact O-CA 3.47Å; L412-F419 WeakPolarHBondContact O-CB 3.24Å; L412-F419 PolarHBondContact O-N 3.06Å; L412-F419 VanDerWaalsContact O-N 3.14Å; Y413-F419 AromaticContact CD1-CD2 3.78Å; Y413-F419 HydrophobicContact CD1-CD2 3.78Å; Y413-F419 HydrophobicContact CD1-CE2 4.25Å; Y413-F419 AromaticContact CE1-CD2 3.68Å; Y413-F419 HydrophobicContact CE1-CD2 3.68Å; Y413-F419 AromaticContact CE1-CE2 3.76Å; Y413-F419 HydrophobicContact CE1-CE2 3.76Å; F419-A421 PolarHBondContact O-N 2.55Å; F419-R422 PolarHBondContact O-N 3.42Å; F419-E423 HydrophobicContact CD1-CG 4.15Å; F419-E423 HydrophobicContact CE1-CG 3.73Å; F419-E423 HydrophobicContact CE2-CG 4.33Å; F419-E423 HydrophobicContact CZ-CG 3.82Å; F419-E423 WeakPolarHBondContact O-CB 3.49Å; F419-E423 WeakPolarHBondContact O-CG 3.3Å; F419-E423 PolarHBondContact O-N 3.01Å; F419-H515 AromaticContact CD1-CE1 3.34Å; F419-H515 WeakPolarHBondContact CD1-CE1 3.45Å; F419-H515 AromaticContact CD1-ND1 3.89Å; F419-H515 AromaticContact CD1-NE2 3.41Å; F419-H515 WeakPolarHBondContact CD1-NE2 3.27Å; F419-H515 AromaticContact CE1-CE1 3.81Å; F419-H515 AromaticContact CG-CD2 3.88Å; F419-H515 AromaticContact CG-CE1 3.96Å; F419-H515 AromaticContact CG-NE2 3.75Å; F419-Y556 AromaticContact CE2-CE1 3.98Å; F419-Y556 HydrophobicContact CE2-CE1 3.98Å; F419-Y556 AromaticContact CZ-CE1 3.97Å; F419-Y556 HydrophobicContact CZ-CE1 3.97Å
420	E	95.5	Very high	91.5	Very high	43 Å²	43	34.8 Å²	34.8	20%	0.201	18%	0.178	C	C	.	.	H	α-helix	trans	-63.6	-42.8	178.5	-67.3	75.5	-171.9	0	0	111.8	Y417 V418 E423 V424 L472 P513 H515	Y417-E420 WeakPolarHBondContact CA-OE2 3.1Å; V418-E420 VanDerWaalsContact C-N 3.33Å; V418-E420 PolarHBondContact O-N 3.17Å; E420-E423 PolarHBondContact O-N 2.93Å; E420-V424 WeakPolarHBondContact O-CG2 3.49Å; E420-V424 PolarHBondContact O-N 3.23Å; E420-L472 HydrophobicContact CB-CD1 4.15Å; E420-L472 HydrophobicContact CB-CD2 3.69Å; E420-P513 WeakPolarHBondContact OE1-CB 3.2Å; E420-P513 WeakPolarHBondContact OE1-CG 3.28Å; E420-H515 IonicContact OE1-CD2 3.32Å; E420-H515 IonicContact OE1-CE1 3.54Å; E420-H515 PolarHBondContact OE1-CE1 3.42Å; E420-H515 IonicContact OE1-NE2 3.69Å; E420-H515 PolarHBondContact OE1-NE2 3.3Å; E420-H515 IonicContact OE2-NE2 3.78Å
421	A	96.3	Very high	92.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-45.5	176.2	0	0	0	0	0	111.3	Y417 V418 F419 V424 L425 L467 L472	Y417-A421 WeakPolarHBondContact O-CB 3.44Å; Y417-A421 PolarHBondContact O-N 3.15Å; V418-A421 PolarHBondContact O-N 2.74Å; F419-A421 PolarHBondContact O-N 2.55Å; A421-V424 PolarHBondContact O-N 2.92Å; A421-L425 PolarHBondContact O-N 2.83Å; A421-L467 HydrophobicContact CB-CD2 4.08Å; A421-L467 WeakPolarHBondContact O-CD2 3.22Å; A421-L472 HydrophobicContact CB-CB 4.01Å
422	R	95.5	Very high	93.4	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-60.5	-45.8	174.4	-179.7	-84.4	-179	139.6	17.8	111	V366 L412 V418 F419 V424 L425 R426 E545	V366-R422 HydrophobicContact CG2-CG 4.18Å; L412-R422 HydrophobicContact CD1-CB 3.59Å; L412-R422 HydrophobicContact CD1-CG 3.75Å; V418-R422 WeakPolarHBondContact O-CB 3.41Å; V418-R422 PolarHBondContact O-N 2.79Å; F419-R422 PolarHBondContact O-N 3.42Å; R422-V424 VanDerWaalsContact C-N 3.32Å; R422-V424 PolarHBondContact O-N 2.96Å; R422-L425 PolarHBondContact O-N 2.77Å; R422-L425 VanDerWaalsContact O-N 3.16Å; R422-R426 VanDerWaalsContact CZ-CD 3.5Å; R422-R426 WeakPolarHBondContact O-CB 3.33Å; R422-R426 PolarHBondContact O-N 2.75Å; R422-E545 IonicContact CZ-OE1 3.98Å; R422-E545 IonicContact CZ-OE2 2.8Å; R422-E545 IonicContact NH1-OE1 2.72Å; R422-E545 PolarHBondContact NH1-OE1 2.81Å; R422-E545 IonicContact NH1-OE2 3.27Å; R422-E545 VanDerWaalsContact NH2-CD 3.31Å; R422-E545 IonicContact NH2-OE1 3.78Å; R422-E545 PolarHBondContact NH2-OE1 2.99Å; R422-E545 IonicContact NH2-OE2 3.14Å; R422-E545 PolarHBondContact NH2-OE2 2.75Å
423	E	95.5	Very high	93.9	Very high	37 Å²	37	37.4 Å²	37.4	17%	0.173	19%	0.187	C	C	.	.	H	α-helix	trans	-65.6	-33.7	-178.6	-76.6	-55.1	102.9	0	0	112.8	F419 E420 R426 Q427	F419-E423 HydrophobicContact CD1-CG 4.15Å; F419-E423 HydrophobicContact CE1-CG 3.73Å; F419-E423 HydrophobicContact CE2-CG 4.33Å; F419-E423 HydrophobicContact CZ-CG 3.82Å; F419-E423 WeakPolarHBondContact O-CB 3.49Å; F419-E423 WeakPolarHBondContact O-CG 3.3Å; F419-E423 PolarHBondContact O-N 3.01Å; E420-E423 PolarHBondContact O-N 2.93Å; E423-R426 VanDerWaalsContact CD-NE 3.26Å; E423-R426 PolarHBondContact O-N 3.48Å; E423-R426 VanDerWaalsContact OE1-CD 3.29Å; E423-R426 WeakPolarHBondContact OE1-CD 3.38Å; E423-R426 IonicContact OE1-CZ 3.48Å; E423-R426 IonicContact OE1-NE 3.91Å; E423-R426 PolarHBondContact OE1-NE 3.16Å; E423-R426 IonicContact OE2-CZ 2.82Å; E423-R426 VanDerWaalsContact OE2-CZ 3.27Å; E423-R426 IonicContact OE2-NE 3.52Å; E423-R426 PolarHBondContact OE2-NE 3.38Å; E423-R426 IonicContact OE2-NH2 2.83Å; E423-R426 PolarHBondContact OE2-NH2 3.21Å; E423-Q427 WeakPolarHBondContact O-CG 3.38Å; E423-Q427 PolarHBondContact O-N 3.49Å
424	V	96.5	Very high	94.2	Very high	19 Å²	19	39.4 Å²	39.4	12%	0.115	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-45.5	171.5	168.6	0	0	0	0	110.9	E420 A421 R422 F428 L467 K470 L472	E420-V424 WeakPolarHBondContact O-CG2 3.49Å; E420-V424 PolarHBondContact O-N 3.23Å; A421-V424 PolarHBondContact O-N 2.92Å; R422-V424 VanDerWaalsContact C-N 3.32Å; R422-V424 PolarHBondContact O-N 2.96Å; V424-F428 VanDerWaalsContact O-CD2 3.28Å; V424-F428 WeakPolarHBondContact O-CD2 2.91Å; V424-F428 WeakPolarHBondContact O-CE2 3.38Å; V424-L467 HydrophobicContact CB-CD2 3.92Å; V424-L467 HydrophobicContact CG1-CD2 3.85Å; V424-K470 HydrophobicContact CG2-CD 4.04Å; V424-L472 HydrophobicContact CG2-CD1 3.64Å
425	L	97.3	Very high	94.7	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-68	-37.9	177.3	-65.3	-178.2	0	0	0	112.1	V366 V372 L385 A421 R422 Q427 F428 L463 L467	V366-L425 HydrophobicContact CB-CB 3.86Å; V366-L425 HydrophobicContact CG1-CB 3.84Å; V366-L425 HydrophobicContact CG2-CB 4.2Å; V372-L425 HydrophobicContact CG1-CD1 4.14Å; V372-L425 HydrophobicContact CG1-CD2 4.46Å; L385-L425 HydrophobicContact CD1-CD1 4.38Å; L385-L425 HydrophobicContact CD1-CD2 4.18Å; A421-L425 PolarHBondContact O-N 2.83Å; R422-L425 PolarHBondContact O-N 2.77Å; R422-L425 VanDerWaalsContact O-N 3.16Å; L425-Q427 PolarHBondContact O-N 2.98Å; L425-F428 WeakPolarHBondContact O-CB 3.34Å; L425-F428 PolarHBondContact O-N 2.95Å; L425-L463 HydrophobicContact CD2-CB 4.03Å; L425-L463 HydrophobicContact CD2-CD1 4.2Å; L425-L467 HydrophobicContact CD1-CD1 4.18Å; L425-L467 HydrophobicContact CD2-CD1 3.95Å; L425-L467 HydrophobicContact CD2-CG 4.28Å; L425-L467 HydrophobicContact CG-CD1 4.12Å; L425-L467 HydrophobicContact CG-CD2 4.36Å
426	R	95.7	Very high	95	Very high	39 Å²	39	37.6 Å²	37.6	15%	0.147	19%	0.19	C	C	.	.	H	α-helix	trans	-59.3	-29.8	-177.8	-164.8	-179.5	71.6	92.2	-6.9	112.9	V366 R422 E423 F428 I429 Q605 N607	V366-R426 HydrophobicContact CG2-CB 4.12Å; R422-R426 VanDerWaalsContact CZ-CD 3.5Å; R422-R426 WeakPolarHBondContact O-CB 3.33Å; R422-R426 PolarHBondContact O-N 2.75Å; E423-R426 VanDerWaalsContact CD-NE 3.26Å; E423-R426 PolarHBondContact O-N 3.48Å; E423-R426 VanDerWaalsContact OE1-CD 3.29Å; E423-R426 WeakPolarHBondContact OE1-CD 3.38Å; E423-R426 IonicContact OE1-CZ 3.48Å; E423-R426 IonicContact OE1-NE 3.91Å; E423-R426 PolarHBondContact OE1-NE 3.16Å; E423-R426 IonicContact OE2-CZ 2.82Å; E423-R426 VanDerWaalsContact OE2-CZ 3.27Å; E423-R426 IonicContact OE2-NE 3.52Å; E423-R426 PolarHBondContact OE2-NE 3.38Å; E423-R426 IonicContact OE2-NH2 2.83Å; E423-R426 PolarHBondContact OE2-NH2 3.21Å; R426-F428 PolarHBondContact O-N 2.75Å; R426-F428 VanDerWaalsContact O-N 3.08Å; R426-I429 HydrophobicContact CB-CD1 4.46Å; R426-I429 HydrophobicContact CG-CD1 3.69Å; R426-I429 HydrophobicContact CG-CG1 4.42Å; R426-I429 WeakPolarHBondContact O-CB 3.26Å; R426-I429 WeakPolarHBondContact O-CG1 3.26Å; R426-I429 PolarHBondContact O-N 3.29Å; R426-Q605 WeakPolarHBondContact CD-O 3.35Å; R426-Q605 HydrophobicContact CG-CB 4.34Å; R426-Q605 VanDerWaalsContact CG-O 3.28Å; R426-Q605 WeakPolarHBondContact CG-O 3.45Å; R426-Q605 PolarHBondContact NH1-O 3.05Å; R426-Q605 VanDerWaalsContact NH1-O 3.1Å; R426-N607 PolarHBondContact NH1-OD1 3.48Å; R426-N607 PolarHBondContact NH2-OD1 2.98Å; R426-N607 VanDerWaalsContact NH2-OD1 3.09Å
427	Q	94.8	Very high	95.2	Very high	133 Å²	133	36.2 Å²	36.2	62%	0.621	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-12.8	173.6	-67.1	174.4	28.1	0	0	114.1	E423 L425 K431	E423-Q427 WeakPolarHBondContact O-CG 3.38Å; E423-Q427 PolarHBondContact O-N 3.49Å; L425-Q427 PolarHBondContact O-N 2.98Å; Q427-K431 WeakPolarHBondContact O-CE 3.2Å; Q427-K431 PolarHBondContact O-NZ 3.46Å; Q427-K431 VanDerWaalsContact O-NZ 3.15Å
428	F	96	Very high	95	Very high	24 Å²	24	36.2 Å²	36.2	11%	0.105	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-2.3	176.4	-60.9	-90.7	0	0	0	113.6	I363 V424 L425 R426 G430 K431 A458 V461 L463	I363-F428 HydrophobicContact CD1-CB 3.83Å; V424-F428 VanDerWaalsContact O-CD2 3.28Å; V424-F428 WeakPolarHBondContact O-CD2 2.91Å; V424-F428 WeakPolarHBondContact O-CE2 3.38Å; L425-F428 WeakPolarHBondContact O-CB 3.34Å; L425-F428 PolarHBondContact O-N 2.95Å; R426-F428 PolarHBondContact O-N 2.75Å; R426-F428 VanDerWaalsContact O-N 3.08Å; F428-G430 PolarHBondContact O-N 2.66Å; F428-K431 HydrophobicContact CD1-CD 4.03Å; F428-K431 VanDerWaalsContact O-CB 3.3Å; F428-K431 WeakPolarHBondContact O-CB 3.19Å; F428-K431 PolarHBondContact O-N 3.28Å; F428-A458 HydrophobicContact CD1-CB 3.44Å; F428-A458 VanDerWaalsContact CD1-CB 3.44Å; F428-A458 HydrophobicContact CE1-CB 3.7Å; F428-V461 HydrophobicContact CE1-CB 4.33Å; F428-V461 HydrophobicContact CE1-CG1 4.29Å; F428-V461 HydrophobicContact CZ-CB 4.48Å; F428-V461 HydrophobicContact CZ-CG1 3.96Å; F428-L463 HydrophobicContact CD1-CD2 3.8Å; F428-L463 HydrophobicContact CD2-CD2 3.72Å; F428-L463 HydrophobicContact CE1-CD2 3.74Å; F428-L463 HydrophobicContact CE2-CD2 3.67Å; F428-L463 HydrophobicContact CG-CD2 3.8Å; F428-L463 HydrophobicContact CZ-CD2 3.68Å
429	I	95	Very high	94.8	Very high	22 Å²	22	36.5 Å²	36.5	11%	0.113	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	133.8	173.2	-66.1	-178.3	0	0	0	109.8	I363 V366 R426 K431 Q605 R606	I363-I429 HydrophobicContact CG2-CG1 4.09Å; V366-I429 HydrophobicContact CG1-CD1 4.26Å; V366-I429 HydrophobicContact CG1-CG1 3.91Å; V366-I429 HydrophobicContact CG2-CD1 4.34Å; R426-I429 HydrophobicContact CB-CD1 4.46Å; R426-I429 HydrophobicContact CG-CD1 3.69Å; R426-I429 HydrophobicContact CG-CG1 4.42Å; R426-I429 WeakPolarHBondContact O-CB 3.26Å; R426-I429 WeakPolarHBondContact O-CG1 3.26Å; R426-I429 PolarHBondContact O-N 3.29Å; I429-K431 PolarHBondContact O-N 2.89Å; I429-Q605 HydrophobicContact CD1-CB 3.31Å; I429-Q605 HydrophobicContact CD1-CG 4.35Å; I429-Q605 VanDerWaalsContact CD1-OE1 3.31Å; I429-R606 HydrophobicContact CG2-CG 4.28Å
430	G	91.3	Very high	94.5	Very high	37 Å²	37	37.6 Å²	37.6	38%	0.381	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	-5	-175.8	0	0	0	0	0	114.4	V362 I363 F428	V362-G430 VanDerWaalsContact CG1-CA 3.43Å; V362-G430 WeakPolarHBondContact CG1-O 3.29Å; I363-G430 PolarHBondContact O-N 2.82Å; F428-G430 PolarHBondContact O-N 2.66Å
431	K	94.6	Very high	93.9	Very high	95 Å²	95	38.7 Å²	38.7	41%	0.413	20%	0.195	S	C	.	.			trans	-89	146.5	176.4	-59.5	-170.7	-177.2	166.6	0	111.8	V362 I363 Q427 F428 I429	V362-K431 WeakPolarHBondContact CA-O 3.2Å; I363-K431 PolarHBondContact N-O 3.1Å; I363-K431 VanDerWaalsContact N-O 3.13Å; Q427-K431 WeakPolarHBondContact O-CE 3.2Å; Q427-K431 PolarHBondContact O-NZ 3.46Å; Q427-K431 VanDerWaalsContact O-NZ 3.15Å; F428-K431 HydrophobicContact CD1-CD 4.03Å; F428-K431 VanDerWaalsContact O-CB 3.3Å; F428-K431 WeakPolarHBondContact O-CB 3.19Å; F428-K431 PolarHBondContact O-N 3.28Å; I429-K431 PolarHBondContact O-N 2.89Å
432	Q	95.3	Very high	93	Very high	120 Å²	120	43.3 Å²	43.3	56%	0.561	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	135.5	170.9	-76	-70	-7.4	0	0	110.3	G361 V362	G361-Q432 VanDerWaalsContact C-OE1 3.26Å; G361-Q432 CarbonylContact O-C 3.57Å; G361-Q432 WeakPolarHBondContact O-CA 3.49Å; G361-Q432 PolarHBondContact O-OE1 2.81Å; G361-Q432 VanDerWaalsContact O-OE1 3.05Å; V362-Q432 HydrophobicContact CG2-CG 4.28Å; V362-Q432 VanDerWaalsContact CG2-NE2 3.31Å
433	V	97.3	Very high	92.2	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	159.8	-179.5	-62.2	0	0	0	0	111.2	S360 G361 I363 I374 V456 R457 A458	S360-V433 WeakPolarHBondContact CA-O 3.06Å; G361-V433 PolarHBondContact N-O 3.34Å; G361-V433 VanDerWaalsContact N-O 3.1Å; G361-V433 WeakPolarHBondContact O-CG2 3.43Å; G361-V433 PolarHBondContact O-N 2.91Å; I363-V433 HydrophobicContact CD1-CB 4.46Å; I363-V433 HydrophobicContact CD1-CG1 3.59Å; I363-V433 HydrophobicContact CD1-CG2 4.19Å; I363-V433 HydrophobicContact CG1-CB 4.33Å; I363-V433 HydrophobicContact CG1-CG1 3.76Å; I363-V433 HydrophobicContact CG1-CG2 3.61Å; I374-V433 HydrophobicContact CD1-CG2 3.61Å; I374-V433 HydrophobicContact CG1-CG2 3.92Å; I374-V433 HydrophobicContact CG2-CG2 3.92Å; V433-V456 HydrophobicContact CB-CG1 4.12Å; V433-V456 HydrophobicContact CG2-CG1 4.22Å; V433-R457 CarbonylContact C-O 3.52Å; V433-R457 WeakPolarHBondContact CA-O 3.42Å; V433-R457 WeakPolarHBondContact CB-O 3.2Å; V433-A458 HydrophobicContact CG1-CB 3.64Å
434	T	96.6	Very high	91	Very high	62 Å²	62	51 Å²	51	38%	0.38	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.5	168.7	56.3	0	0	0	0	109.1	F359 V456 R457	F359-T434 CarbonylContact O-C 3.6Å; F359-T434 WeakPolarHBondContact O-CA 3.34Å; T434-V456 CarbonylContact O-C 3.6Å; T434-V456 WeakPolarHBondContact O-CA 3.34Å; T434-R457 PolarHBondContact N-O 3.47Å; T434-R457 PolarHBondContact O-N 2.82Å
435	A	96.1	Very high	89.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	112.5	175.9	0	0	0	0	0	109.4	I358 F359 I374 F383 A454 T455 V456	I358-A435 WeakPolarHBondContact CA-O 3.49Å; F359-A435 HydrophobicContact CB-CB 4.39Å; F359-A435 PolarHBondContact N-O 3.12Å; F359-A435 PolarHBondContact O-N 2.8Å; I374-A435 HydrophobicContact CD1-CB 3.61Å; F383-A435 HydrophobicContact CD1-CB 4.31Å; F383-A435 HydrophobicContact CD2-CB 3.97Å; F383-A435 HydrophobicContact CE1-CB 4.33Å; F383-A435 HydrophobicContact CE2-CB 3.97Å; F383-A435 HydrophobicContact CG-CB 4.13Å; F383-A435 HydrophobicContact CZ-CB 4.17Å; A435-A454 HydrophobicContact CB-CB 4.35Å; A435-T455 WeakPolarHBondContact CA-O 3.22Å; A435-V456 HydrophobicContact CB-CG2 4.02Å
436	H	93.9	Very high	87.7	Confident	68 Å²	68	64.1 Å²	64.1	32%	0.315	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	113.8	173.7	-179.3	-85.3	0	0	0	109.1	D438 A454 T455	H436-D438 IonicContact CE1-OD1 3.06Å; H436-D438 IonicContact ND1-OD1 3.74Å; H436-D438 PolarHBondContact ND1-OD1 3.06Å; H436-D438 PolarHBondContact O-N 2.68Å; H436-A454 CarbonylContact O-C 3.59Å; H436-A454 WeakPolarHBondContact O-CA 3.04Å; H436-A454 VanDerWaalsContact O-CB 3.22Å; H436-A454 WeakPolarHBondContact O-CB 3.34Å; H436-T455 PolarHBondContact N-O 3.04Å; H436-T455 PolarHBondContact O-N 3.39Å
437	V	93.4	Very high	86.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	112.7	-179.9	-176.6	0	0	0	0	109.2	V353 G356 K357 F359 F383 I440 V452	V353-V437 HydrophobicContact CG1-CG2 4.08Å; G356-V437 PolarHBondContact N-O 2.8Å; K357-V437 WeakPolarHBondContact O-CG2 3.36Å; K357-V437 PolarHBondContact O-N 3.02Å; F359-V437 HydrophobicContact CD2-CG2 4.04Å; F359-V437 HydrophobicContact CE2-CG2 3.83Å; F383-V437 HydrophobicContact CD1-CG2 4.44Å; F383-V437 HydrophobicContact CE1-CG2 3.82Å; V437-I440 HydrophobicContact CG1-CG1 4.36Å; V437-V452 HydrophobicContact CG1-CG1 3.77Å; V437-V452 HydrophobicContact CG2-CG1 3.92Å
438	D	89.9	Confident	84.8	Confident	23 Å²	23	62.9 Å²	62.9	12%	0.123	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-42.6	-179.2	-63	-43.3	0	0	0	110.7	S386 H436 C453 T455	S386-D438 WeakPolarHBondContact CB-OD2 3.33Å; S386-D438 PolarHBondContact OG-OD2 3Å; H436-D438 IonicContact CE1-OD1 3.06Å; H436-D438 IonicContact ND1-OD1 3.74Å; H436-D438 PolarHBondContact ND1-OD1 3.06Å; H436-D438 PolarHBondContact O-N 2.68Å; D438-C453 PolarHBondContact N-O 3.15Å; D438-T455 PolarHBondContact OD2-N 3.36Å; D438-T455 PolarHBondContact OD2-OG1 3.39Å
439	Y	90.2	Very high	83.7	Confident	9 Å²	9	67 Å²	67	4%	0.035	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	164.7	178.3	55.6	-84.4	0	0	0	111.4	S387 Q441 C453 Y478 S484	S387-Y439 PolarHBondContact N-OH 3.43Å; Y439-Q441 HydrophobicContact CD2-CG 3.8Å; Y439-Q441 HydrophobicContact CE2-CG 3.54Å; Y439-C453 HydrophobicContact CD1-CB 4.22Å; Y439-C453 HydrophobicContact CD2-CB 3.75Å; Y439-C453 HydrophobicContact CE1-CB 3.87Å; Y439-C453 HydrophobicContact CE2-CB 3.38Å; Y439-C453 WeakPolarHBondContact CE2-SG 3.4Å; Y439-C453 HydrophobicContact CG-CB 4.15Å; Y439-C453 VanDerWaalsContact CZ-CB 3.44Å; Y439-C453 PolarHBondContact N-O 3.03Å; Y439-C453 WeakPolarHBondContact O-CA 3.45Å; Y439-C453 WeakPolarHBondContact O-CB 3.34Å; Y439-C453 PolarHBondContact O-N 3.49Å; Y439-C453 VanDerWaalsContact O-O 3.09Å; Y439-Y478 PolarHBondContact OH-OH 2.85Å; Y439-S484 WeakPolarHBondContact CE1-O 3.46Å
440	I	88.4	Confident	83.1	Confident	50 Å²	50	71.7 Å²	71.7	26%	0.256	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.3	174.7	-57.6	175.6	0	0	0	107.3	V353 P355 V437 E450 R451	V353-I440 WeakPolarHBondContact O-CD1 3.39Å; P355-I440 HydrophobicContact CG-CG1 4.43Å; V437-I440 HydrophobicContact CG1-CG1 4.36Å; I440-E450 HydrophobicContact CG2-CB 4.26Å; I440-R451 CarbonylContact C-O 3.56Å; I440-R451 WeakPolarHBondContact CA-O 3.35Å
441	Q	82.3	Confident	83	Confident	66 Å²	66	73.6 Å²	73.6	31%	0.308	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.7	171.2	-65.2	-179.6	-20.6	0	0	108.5	Y439 E450 R451	Y439-Q441 HydrophobicContact CD2-CG 3.8Å; Y439-Q441 HydrophobicContact CE2-CG 3.54Å; Q441-E450 WeakPolarHBondContact O-CA 3.22Å; Q441-R451 HydrophobicContact CB-CB 4.18Å; Q441-R451 PolarHBondContact N-O 3.29Å; Q441-R451 PolarHBondContact O-N 3.5Å
442	P	78.3	Confident	83	Confident	97 Å²	97	69.9 Å²	69.9	63%	0.63	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-63.5	152.9	177.5	27.9	-34.1	0	0	0	110.1	T444	P442-T444 PolarHBondContact O-N 2.71Å
443	K	77	Confident	82.9	Confident	136 Å²	136	64.4 Å²	64.4	59%	0.591	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-53.4	128.1	171.4	-178.1	176	174.5	157.1	0	109.9	T447 V448	K443-T447 WeakPolarHBondContact CG-O 3.49Å; K443-V448 VanDerWaalsContact CD-O 3.26Å; K443-V448 WeakPolarHBondContact CD-O 3.29Å; K443-V448 WeakPolarHBondContact CE-O 3.33Å; K443-V448 PolarHBondContact NZ-O 3.47Å
444	T	70.9	Confident	82.9	Confident	64 Å²	64	64.1 Å²	64.1	39%	0.393	35%	0.345	S	S	.	.			trans	-106.6	164.7	173.8	65.2	0	0	0	0	109.7	P442 N446 T447	P442-T444 PolarHBondContact O-N 2.71Å; T444-N446 PolarHBondContact O-N 3.26Å; T444-T447 PolarHBondContact N-OG1 3.17Å; T444-T447 PolarHBondContact O-N 2.83Å; T444-T447 PolarHBondContact O-OG1 3.02Å; T444-T447 WeakPolarHBondContact OG1-CG2 3.36Å; T444-T447 PolarHBondContact OG1-N 2.75Å; T444-T447 PolarHBondContact OG1-OG1 3.25Å; T444-T447 VanDerWaalsContact OG1-OG1 3.04Å
445	P	62.8	Low	82.9	Confident	138 Å²	138	61.3 Å²	61.3	90%	0.896	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-22.4	174.4	-25.7	34.7	0	0	0	114.2
446	N	60.8	Low	83	Confident	159 Å²	159	61.3 Å²	61.3	85%	0.85	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-1.4	-179.2	-63.7	-6.9	0	0	0	113.5	T444	T444-N446 PolarHBondContact O-N 3.26Å
447	T	64.5	Low	83.1	Confident	31 Å²	31	61.3 Å²	61.3	19%	0.19	32%	0.324	C	S	.	.			trans	-124.3	139	-179.4	60.6	0	0	0	0	111	K443 T444 D449	K443-T447 WeakPolarHBondContact CG-O 3.49Å; T444-T447 PolarHBondContact N-OG1 3.17Å; T444-T447 PolarHBondContact O-N 2.83Å; T444-T447 PolarHBondContact O-OG1 3.02Å; T444-T447 WeakPolarHBondContact OG1-CG2 3.36Å; T444-T447 PolarHBondContact OG1-N 2.75Å; T444-T447 PolarHBondContact OG1-OG1 3.25Å; T444-T447 VanDerWaalsContact OG1-OG1 3.04Å; T447-D449 PolarHBondContact OG1-O 3.47Å
448	V	66.3	Low	83.2	Confident	115 Å²	115	61.3 Å²	61.3	70%	0.697	33%	0.325	S	S	*	.	S	Bend	trans	-68.8	-42.2	-176.1	-174.3	0	0	0	0	111.1	K443	K443-V448 VanDerWaalsContact CD-O 3.26Å; K443-V448 WeakPolarHBondContact CD-O 3.29Å; K443-V448 WeakPolarHBondContact CE-O 3.33Å; K443-V448 PolarHBondContact NZ-O 3.47Å
449	D	72.9	Confident	83.1	Confident	109 Å²	109	66.9 Å²	66.9	58%	0.583	36%	0.355	S	S	*	.	S	Bend	trans	-131.4	170.3	-177.2	-57.4	-46.9	0	0	0	111.3	T447	T447-D449 PolarHBondContact OG1-O 3.47Å
450	E	82.3	Confident	83	Confident	121 Å²	121	73.4 Å²	73.4	57%	0.565	39%	0.39	S	S	*	.			trans	-62.1	150.5	163.7	62	-179.8	-175.8	0	0	110.9	I440 Q441	I440-E450 HydrophobicContact CG2-CB 4.26Å; Q441-E450 WeakPolarHBondContact O-CA 3.22Å
451	R	89.9	Confident	83.3	Confident	78 Å²	78	74 Å²	74	29%	0.294	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	111.1	178.5	-58.9	-176.1	172.3	-148.8	-4.8	109.9	D370 F384 I440 Q441 C453	D370-R451 IonicContact OD2-NH1 3.98Å; F384-R451 HydrophobicContact CB-CB 4.49Å; F384-R451 HydrophobicContact CD1-CG 4.47Å; F384-R451 HydrophobicContact CD2-CB 3.61Å; F384-R451 HydrophobicContact CD2-CG 3.89Å; F384-R451 HydrophobicContact CE1-CG 4.37Å; F384-R451 HydrophobicContact CE2-CB 3.95Å; F384-R451 HydrophobicContact CE2-CG 3.77Å; F384-R451 HydrophobicContact CG-CB 4.03Å; F384-R451 HydrophobicContact CG-CG 4.23Å; F384-R451 HydrophobicContact CZ-CG 4.02Å; I440-R451 CarbonylContact C-O 3.56Å; I440-R451 WeakPolarHBondContact CA-O 3.35Å; Q441-R451 HydrophobicContact CB-CB 4.18Å; Q441-R451 PolarHBondContact N-O 3.29Å; Q441-R451 PolarHBondContact O-N 3.5Å; R451-C453 PolarHBondContact O-N 2.89Å; R451-C453 VanDerWaalsContact O-N 3.13Å
452	V	93.5	Very high	84	Confident	17 Å²	17	71.1 Å²	71.1	10%	0.103	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	100.7	167.5	-174.9	0	0	0	0	108	V353 F383 F384 V437	V353-V452 HydrophobicContact CG1-CG1 3.68Å; V353-V452 HydrophobicContact CG1-CG2 4.13Å; F383-V452 HydrophobicContact CD1-CB 4.38Å; F383-V452 HydrophobicContact CD1-CG1 3.69Å; F383-V452 HydrophobicContact CE1-CG1 3.79Å; F384-V452 PolarHBondContact N-O 3.48Å; V437-V452 HydrophobicContact CG1-CG1 3.77Å; V437-V452 HydrophobicContact CG2-CG1 3.92Å
453	C	94.7	Very high	85	Confident	4 Å²	4	66.6 Å²	66.6	3%	0.027	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.1	-179.6	-66.5	0	0	0	0	110.1	F384 D438 Y439 R451	F384-C453 CarbonylContact O-C 3.47Å; F384-C453 VanDerWaalsContact O-CA 3.25Å; F384-C453 WeakPolarHBondContact O-CA 3.46Å; D438-C453 PolarHBondContact N-O 3.15Å; Y439-C453 HydrophobicContact CD1-CB 4.22Å; Y439-C453 HydrophobicContact CD2-CB 3.75Å; Y439-C453 HydrophobicContact CE1-CB 3.87Å; Y439-C453 HydrophobicContact CE2-CB 3.38Å; Y439-C453 WeakPolarHBondContact CE2-SG 3.4Å; Y439-C453 HydrophobicContact CG-CB 4.15Å; Y439-C453 VanDerWaalsContact CZ-CB 3.44Å; Y439-C453 PolarHBondContact N-O 3.03Å; Y439-C453 WeakPolarHBondContact O-CA 3.45Å; Y439-C453 WeakPolarHBondContact O-CB 3.34Å; Y439-C453 PolarHBondContact O-N 3.49Å; Y439-C453 VanDerWaalsContact O-O 3.09Å; R451-C453 PolarHBondContact O-N 2.89Å; R451-C453 VanDerWaalsContact O-N 3.13Å
454	A	96	Very high	86	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.6	-174.9	0	0	0	0	0	112.3	F383 F384 S386 A435 H436 V456	F383-A454 HydrophobicContact CB-CB 4.09Å; F383-A454 HydrophobicContact CD1-CB 3.62Å; F383-A454 HydrophobicContact CE1-CB 4.43Å; F383-A454 HydrophobicContact CG-CB 4.12Å; F384-A454 PolarHBondContact O-N 3.37Å; S386-A454 PolarHBondContact N-O 2.83Å; S386-A454 PolarHBondContact OG-O 2.82Å; A435-A454 HydrophobicContact CB-CB 4.35Å; H436-A454 CarbonylContact O-C 3.59Å; H436-A454 WeakPolarHBondContact O-CA 3.04Å; H436-A454 VanDerWaalsContact O-CB 3.22Å; H436-A454 WeakPolarHBondContact O-CB 3.34Å; A454-V456 HydrophobicContact CB-CG2 4.45Å
455	T	97	Very high	87.2	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	113.6	163.2	-63.2	0	0	0	0	108.1	S386 A435 H436 D438 R457 S486 F488	S386-T455 PolarHBondContact OG-OG1 3.11Å; A435-T455 WeakPolarHBondContact CA-O 3.22Å; H436-T455 PolarHBondContact N-O 3.04Å; H436-T455 PolarHBondContact O-N 3.39Å; D438-T455 PolarHBondContact OD2-N 3.36Å; D438-T455 PolarHBondContact OD2-OG1 3.39Å; T455-R457 HydrophobicContact CG2-CG 4.15Å; T455-S486 PolarHBondContact OG1-OG 3.47Å; T455-F488 HydrophobicContact CG2-CD2 3.65Å; T455-F488 HydrophobicContact CG2-CE2 3.69Å
456	V	97.8	Very high	88.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.6	179.1	-173.3	0	0	0	0	110.1	V372 I374 F383 L385 V433 T434 A435 A454 L463	V372-V456 HydrophobicContact CG2-CG1 4.2Å; V372-V456 HydrophobicContact CG2-CG2 4.03Å; I374-V456 HydrophobicContact CD1-CG1 4.07Å; I374-V456 HydrophobicContact CD1-CG2 4.48Å; F383-V456 HydrophobicContact CB-CG2 4.22Å; L385-V456 HydrophobicContact CD2-CB 3.92Å; L385-V456 HydrophobicContact CD2-CG2 3.85Å; V433-V456 HydrophobicContact CB-CG1 4.12Å; V433-V456 HydrophobicContact CG2-CG1 4.22Å; T434-V456 CarbonylContact O-C 3.6Å; T434-V456 WeakPolarHBondContact O-CA 3.34Å; A435-V456 HydrophobicContact CB-CG2 4.02Å; A454-V456 HydrophobicContact CB-CG2 4.45Å; V456-L463 HydrophobicContact CB-CD1 4.09Å; V456-L463 HydrophobicContact CB-CG 4.41Å; V456-L463 HydrophobicContact CG1-CD1 3.7Å; V456-L463 HydrophobicContact CG1-CG 4.31Å; V456-L463 PolarHBondContact O-N 3.1Å
457	R	97	Very high	90.6	Very high	67 Å²	67	45.3 Å²	45.3	25%	0.253	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.4	-178.3	-57.9	179.8	65.1	88	5.9	111.1	V433 T434 T455 D460 V461 N462	V433-R457 CarbonylContact C-O 3.52Å; V433-R457 WeakPolarHBondContact CA-O 3.42Å; V433-R457 WeakPolarHBondContact CB-O 3.2Å; T434-R457 PolarHBondContact N-O 3.47Å; T434-R457 PolarHBondContact O-N 2.82Å; T455-R457 HydrophobicContact CG2-CG 4.15Å; R457-D460 PolarHBondContact NH2-O 2.93Å; R457-D460 VanDerWaalsContact NH2-O 3.12Å; R457-V461 CarbonylContact C-O 3.56Å; R457-V461 VanDerWaalsContact CA-O 3.27Å; R457-V461 WeakPolarHBondContact CA-O 3.43Å; R457-N462 HydrophobicContact CG-CB 4.44Å
458	A	94.2	Very high	92.2	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.008	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	109.6	167.6	0	0	0	0	0	107.6	F428 V433 D460 V461 L463	F428-A458 HydrophobicContact CD1-CB 3.44Å; F428-A458 VanDerWaalsContact CD1-CB 3.44Å; F428-A458 HydrophobicContact CE1-CB 3.7Å; V433-A458 HydrophobicContact CG1-CB 3.64Å; A458-D460 PolarHBondContact O-N 3.05Å; A458-D460 VanDerWaalsContact O-N 3.16Å; A458-V461 PolarHBondContact N-O 3.31Å; A458-V461 WeakPolarHBondContact O-CB 3.48Å; A458-V461 PolarHBondContact O-N 2.88Å; A458-L463 HydrophobicContact CB-CD2 4.44Å
459	D	87.6	Confident	93.6	Very high	140 Å²	140	40.8 Å²	40.8	75%	0.749	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	-118.2	-168	-50.6	-46.9	0	0	0	110.5
460	D	88.5	Confident	94.8	Very high	145 Å²	145	41 Å²	41	78%	0.775	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-5.4	177.3	-69.3	-39.8	0	0	0	114.3	R457 A458	R457-D460 PolarHBondContact NH2-O 2.93Å; R457-D460 VanDerWaalsContact NH2-O 3.12Å; A458-D460 PolarHBondContact O-N 3.05Å; A458-D460 VanDerWaalsContact O-N 3.16Å
461	V	95.7	Very high	95.4	Very high	63 Å²	63	35.2 Å²	35.2	38%	0.382	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	110.7	-173.5	-173.9	0	0	0	0	111	F428 R457 A458 L463 A466	F428-V461 HydrophobicContact CE1-CB 4.33Å; F428-V461 HydrophobicContact CE1-CG1 4.29Å; F428-V461 HydrophobicContact CZ-CB 4.48Å; F428-V461 HydrophobicContact CZ-CG1 3.96Å; R457-V461 CarbonylContact C-O 3.56Å; R457-V461 VanDerWaalsContact CA-O 3.27Å; R457-V461 WeakPolarHBondContact CA-O 3.43Å; A458-V461 PolarHBondContact N-O 3.31Å; A458-V461 WeakPolarHBondContact O-CB 3.48Å; A458-V461 PolarHBondContact O-N 2.88Å; V461-L463 HydrophobicContact CG1-CD2 4.48Å; V461-L463 PolarHBondContact O-N 2.64Å; V461-A466 HydrophobicContact CG1-CB 4.02Å
462	N	97.2	Very high	95.7	Very high	6 Å²	6	32 Å²	32	3%	0.032	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	116.8	165	178.4	-21.5	0	0	0	109.6	R457 A464 L465 A466	R457-N462 HydrophobicContact CG-CB 4.44Å; N462-A464 VanDerWaalsContact C-N 3.29Å; N462-A464 PolarHBondContact O-N 2.87Å; N462-A464 WeakPolarHBondContact OD1-CB 3.29Å; N462-A464 PolarHBondContact OD1-N 2.95Å; N462-L465 HydrophobicContact CB-CB 4.09Å; N462-L465 HydrophobicContact CB-CD1 3.87Å; N462-L465 HydrophobicContact CB-CG 4.23Å; N462-L465 PolarHBondContact O-N 3Å; N462-L465 PolarHBondContact OD1-N 3.3Å; N462-A466 PolarHBondContact O-N 2.7Å
463	L	97.9	Very high	95.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-64	-33.8	-173.9	-59	-172.3	0	0	0	112.8	I363 V372 L385 L425 F428 V456 A458 V461 A466 L467	I363-L463 HydrophobicContact CD1-CD1 3.76Å; V372-L463 HydrophobicContact CG1-CD1 4.36Å; L385-L463 HydrophobicContact CD1-CB 4.31Å; L385-L463 HydrophobicContact CD2-CB 4.05Å; L425-L463 HydrophobicContact CD2-CB 4.03Å; L425-L463 HydrophobicContact CD2-CD1 4.2Å; F428-L463 HydrophobicContact CD1-CD2 3.8Å; F428-L463 HydrophobicContact CD2-CD2 3.72Å; F428-L463 HydrophobicContact CE1-CD2 3.74Å; F428-L463 HydrophobicContact CE2-CD2 3.67Å; F428-L463 HydrophobicContact CG-CD2 3.8Å; F428-L463 HydrophobicContact CZ-CD2 3.68Å; V456-L463 HydrophobicContact CB-CD1 4.09Å; V456-L463 HydrophobicContact CB-CG 4.41Å; V456-L463 HydrophobicContact CG1-CD1 3.7Å; V456-L463 HydrophobicContact CG1-CG 4.31Å; V456-L463 PolarHBondContact O-N 3.1Å; A458-L463 HydrophobicContact CB-CD2 4.44Å; V461-L463 HydrophobicContact CG1-CD2 4.48Å; V461-L463 PolarHBondContact O-N 2.64Å; L463-A466 PolarHBondContact O-N 2.85Å; L463-L467 WeakPolarHBondContact O-CG 3.47Å; L463-L467 PolarHBondContact O-N 2.86Å
464	A	97.7	Very high	95.9	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-66.3	-44.8	176.7	0	0	0	0	0	111.2	L385 I388 N462 A466 L467 V468 L492	L385-A464 HydrophobicContact CB-CB 4.19Å; I388-A464 HydrophobicContact CD1-CB 4.08Å; I388-A464 HydrophobicContact CG2-CB 4.05Å; N462-A464 VanDerWaalsContact C-N 3.29Å; N462-A464 PolarHBondContact O-N 2.87Å; N462-A464 WeakPolarHBondContact OD1-CB 3.29Å; N462-A464 PolarHBondContact OD1-N 2.95Å; A464-A466 VanDerWaalsContact C-N 3.34Å; A464-A466 PolarHBondContact O-N 2.91Å; A464-L467 PolarHBondContact O-N 2.91Å; A464-V468 WeakPolarHBondContact O-CG2 3.23Å; A464-V468 PolarHBondContact O-N 2.87Å; A464-L492 HydrophobicContact CB-CD2 3.9Å
465	L	97	Very high	95.8	Very high	31 Å²	31	32.1 Å²	32.1	16%	0.162	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-37.8	175.3	-75.4	170.2	0	0	0	112	N462 L467 V468 S469 E491 L492 A495	N462-L465 HydrophobicContact CB-CB 4.09Å; N462-L465 HydrophobicContact CB-CD1 3.87Å; N462-L465 HydrophobicContact CB-CG 4.23Å; N462-L465 PolarHBondContact O-N 3Å; N462-L465 PolarHBondContact OD1-N 3.3Å; L465-L467 VanDerWaalsContact C-N 3.31Å; L465-L467 PolarHBondContact O-N 3.29Å; L465-V468 PolarHBondContact O-N 2.9Å; L465-S469 WeakPolarHBondContact O-CB 3.17Å; L465-S469 PolarHBondContact O-N 3.01Å; L465-S469 PolarHBondContact O-OG 3.49Å; L465-E491 HydrophobicContact CD1-CB 4.13Å; L465-E491 WeakPolarHBondContact CD1-OE2 3.39Å; L465-E491 HydrophobicContact CD2-CB 3.79Å; L465-L492 HydrophobicContact CD2-CB 4.48Å; L465-L492 HydrophobicContact CD2-CD2 3.71Å; L465-L492 HydrophobicContact CD2-CG 4.03Å; L465-L492 HydrophobicContact CG-CD2 3.95Å; L465-L492 HydrophobicContact CG-CG 4.47Å; L465-A495 HydrophobicContact CD2-CB 4.02Å
466	A	97.1	Very high	95.5	Very high	18 Å²	18	32.7 Å²	32.7	15%	0.149	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-38.5	177.5	0	0	0	0	0	112.5	V461 N462 L463 A464 S469 K470	V461-A466 HydrophobicContact CG1-CB 4.02Å; N462-A466 PolarHBondContact O-N 2.7Å; L463-A466 PolarHBondContact O-N 2.85Å; A464-A466 VanDerWaalsContact C-N 3.34Å; A464-A466 PolarHBondContact O-N 2.91Å; A466-S469 PolarHBondContact O-OG 2.89Å; A466-K470 WeakPolarHBondContact O-CD 3.4Å; A466-K470 WeakPolarHBondContact O-CG 3.49Å
467	L	98	Very high	95	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-73.3	-48.4	175.9	-69.3	172.6	0	0	0	112.3	G369 L385 I388 A421 V424 L425 L463 A464 L465 S469 K470 G471 L472 A473	G369-L467 WeakPolarHBondContact O-CD1 3.28Å; L385-L467 HydrophobicContact CD1-CD1 3.63Å; I388-L467 HydrophobicContact CD1-CD1 4.05Å; A421-L467 HydrophobicContact CB-CD2 4.08Å; A421-L467 WeakPolarHBondContact O-CD2 3.22Å; V424-L467 HydrophobicContact CB-CD2 3.92Å; V424-L467 HydrophobicContact CG1-CD2 3.85Å; L425-L467 HydrophobicContact CD1-CD1 4.18Å; L425-L467 HydrophobicContact CD2-CD1 3.95Å; L425-L467 HydrophobicContact CD2-CG 4.28Å; L425-L467 HydrophobicContact CG-CD1 4.12Å; L425-L467 HydrophobicContact CG-CD2 4.36Å; L463-L467 WeakPolarHBondContact O-CG 3.47Å; L463-L467 PolarHBondContact O-N 2.86Å; A464-L467 PolarHBondContact O-N 2.91Å; L465-L467 VanDerWaalsContact C-N 3.31Å; L465-L467 PolarHBondContact O-N 3.29Å; L467-S469 PolarHBondContact O-N 3.08Å; L467-K470 PolarHBondContact O-N 2.81Å; L467-G471 PolarHBondContact O-N 3.31Å; L467-L472 HydrophobicContact CD2-CB 4.19Å; L467-L472 PolarHBondContact O-N 2.89Å; L467-A473 HydrophobicContact CB-CB 3.84Å
468	V	97.8	Very high	94.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-43.3	-177	173.2	0	0	0	0	111.4	I388 A464 L465 K470 G471 A473 V475 L492 A495 E496 A499	I388-V468 HydrophobicContact CB-CG2 4.4Å; I388-V468 HydrophobicContact CG2-CG2 3.6Å; A464-V468 WeakPolarHBondContact O-CG2 3.23Å; A464-V468 PolarHBondContact O-N 2.87Å; L465-V468 PolarHBondContact O-N 2.9Å; V468-K470 PolarHBondContact O-N 2.79Å; V468-G471 PolarHBondContact O-N 2.84Å; V468-A473 HydrophobicContact CG2-CB 3.98Å; V468-V475 HydrophobicContact CG1-CG2 3.8Å; V468-V475 HydrophobicContact CG2-CG2 4.03Å; V468-L492 HydrophobicContact CB-CD2 4.44Å; V468-L492 WeakPolarHBondContact CG1-O 3.24Å; V468-L492 HydrophobicContact CG2-CD2 4.01Å; V468-A495 HydrophobicContact CB-CB 4.42Å; V468-A495 HydrophobicContact CG1-CB 3.86Å; V468-E496 HydrophobicContact CG1-CB 3.63Å; V468-E496 HydrophobicContact CG1-CG 4.37Å; V468-A499 WeakPolarHBondContact O-CB 3.34Å
469	S	96.9	Very high	92.7	Very high	52 Å²	52	46.9 Å²	46.9	36%	0.364	23%	0.229	S	C	.	.	H	α-helix	trans	-62.7	-22.8	178.7	59.2	0	0	0	0	114	L465 A466 L467	L465-S469 WeakPolarHBondContact O-CB 3.17Å; L465-S469 PolarHBondContact O-N 3.01Å; L465-S469 PolarHBondContact O-OG 3.49Å; A466-S469 PolarHBondContact O-OG 2.89Å; L467-S469 PolarHBondContact O-N 3.08Å
470	K	96.7	Very high	91.5	Very high	112 Å²	112	45 Å²	45	49%	0.487	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-0.6	174.2	-69.2	174.7	179.9	-77.8	0	113.2	V424 A466 L467 V468 L472	V424-K470 HydrophobicContact CG2-CD 4.04Å; A466-K470 WeakPolarHBondContact O-CD 3.4Å; A466-K470 WeakPolarHBondContact O-CG 3.49Å; L467-K470 PolarHBondContact O-N 2.81Å; V468-K470 PolarHBondContact O-N 2.79Å; K470-L472 VanDerWaalsContact C-N 3.28Å; K470-L472 HydrophobicContact CB-CD1 3.91Å; K470-L472 HydrophobicContact CB-CG 3.88Å; K470-L472 HydrophobicContact CD-CD1 4.2Å; K470-L472 PolarHBondContact O-N 3.02Å
471	G	95.6	Very high	90	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	26.5	-173.6	0	0	0	0	0	113.4	L467 V468 M506	L467-G471 PolarHBondContact O-N 3.31Å; V468-G471 PolarHBondContact O-N 2.84Å; G471-M506 WeakPolarHBondContact O-CE 3.33Å; G471-M506 WeakPolarHBondContact O-CG 3.35Å; G471-M506 PolarHBondContact O-N 3.33Å
472	L	96.3	Very high	88.3	Confident	12 Å²	12	41.2 Å²	41.2	6%	0.063	20%	0.197	C	C	.	.	S	Bend	trans	-102.5	-2.5	-179.2	-61.2	178.2	0	0	0	113.1	P391 Y417 E420 A421 V424 L467 K470 M506	P391-L472 VanDerWaalsContact CD-O 3.22Å; P391-L472 WeakPolarHBondContact CD-O 3.3Å; P391-L472 WeakPolarHBondContact CG-O 3.34Å; Y417-L472 HydrophobicContact CD1-CD2 4.05Å; Y417-L472 HydrophobicContact CG-CD2 4.44Å; E420-L472 HydrophobicContact CB-CD1 4.15Å; E420-L472 HydrophobicContact CB-CD2 3.69Å; A421-L472 HydrophobicContact CB-CB 4.01Å; V424-L472 HydrophobicContact CG2-CD1 3.64Å; L467-L472 HydrophobicContact CD2-CB 4.19Å; L467-L472 PolarHBondContact O-N 2.89Å; K470-L472 VanDerWaalsContact C-N 3.28Å; K470-L472 HydrophobicContact CB-CD1 3.91Å; K470-L472 HydrophobicContact CB-CG 3.88Å; K470-L472 HydrophobicContact CD-CD1 4.2Å; K470-L472 PolarHBondContact O-N 3.02Å; L472-M506 VanDerWaalsContact C-CE 3.47Å
473	A	96.7	Very high	87.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.208	C	C	.	.	S	Bend	trans	-145.5	153.7	168.3	0	0	0	0	0	109.9	I388 R389 L467 V468 M506	I388-A473 HydrophobicContact CB-CB 4.28Å; I388-A473 HydrophobicContact CD1-CB 3.89Å; R389-A473 WeakPolarHBondContact O-CA 3.24Å; L467-A473 HydrophobicContact CB-CB 3.84Å; V468-A473 HydrophobicContact CG2-CB 3.98Å; A473-M506 VanDerWaalsContact CA-CE 3.41Å; A473-M506 WeakPolarHBondContact O-CE 3.47Å
474	S	94.7	Very high	86.3	Confident	15 Å²	15	46 Å²	46	11%	0.105	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	151.8	174	59.2	0	0	0	0	110.5	I388 R389 E496	I388-S474 CarbonylContact C-O 3.51Å; I388-S474 WeakPolarHBondContact CA-O 3.17Å; R389-S474 PolarHBondContact N-O 3.26Å; R389-S474 PolarHBondContact O-N 3.01Å; S474-E496 VanDerWaalsContact CA-OE1 3.3Å; S474-E496 WeakPolarHBondContact CA-OE1 3.38Å
475	V	94.7	Very high	85.8	Confident	7 Å²	7	48.5 Å²	48.5	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132.2	-178.8	-178.1	0	0	0	0	109.7	V468 R477 Y489 L492 L493 E496	V468-V475 HydrophobicContact CG1-CG2 3.8Å; V468-V475 HydrophobicContact CG2-CG2 4.03Å; V475-R477 PolarHBondContact O-N 3.4Å; V475-Y489 HydrophobicContact CG1-CD2 4.08Å; V475-Y489 HydrophobicContact CG1-CE2 3.54Å; V475-L492 HydrophobicContact CG1-CB 4.14Å; V475-L492 HydrophobicContact CG2-CB 3.89Å; V475-L492 WeakPolarHBondContact CG2-O 3.16Å; V475-L493 HydrophobicContact CB-CD2 4.43Å; V475-L493 HydrophobicContact CG1-CD2 3.84Å; V475-L493 HydrophobicContact CG1-CG 4.4Å; V475-E496 HydrophobicContact CG2-CB 3.83Å; V475-E496 HydrophobicContact CG2-CG 4.28Å; V475-E496 PolarHBondContact N-OE1 3.17Å
476	V	91.1	Very high	85.4	Confident	15 Å²	15	47.2 Å²	47.2	9%	0.091	23%	0.23	C	C	.	.			trans	-62.6	122.8	178.3	177.3	0	0	0	0	109.5	S387 R389 Y478 Y489	S387-V476 PolarHBondContact O-N 2.74Å; R389-V476 HydrophobicContact CG-CG2 3.68Å; V476-Y478 HydrophobicContact CB-CD2 4.46Å; V476-Y478 HydrophobicContact CB-CE2 3.87Å; V476-Y478 HydrophobicContact CG1-CD1 4.06Å; V476-Y478 HydrophobicContact CG1-CD2 4.21Å; V476-Y478 HydrophobicContact CG1-CE1 3.77Å; V476-Y478 HydrophobicContact CG1-CE2 3.9Å; V476-Y478 HydrophobicContact CG1-CG 4.29Å; V476-Y478 WeakPolarHBondContact O-CD2 3.18Å; V476-Y478 PolarHBondContact O-N 3.48Å; V476-Y489 VanDerWaalsContact O-CE2 3.29Å; V476-Y489 WeakPolarHBondContact O-CE2 3.31Å; V476-Y489 PolarHBondContact O-OH 2.82Å; V476-Y489 VanDerWaalsContact O-OH 3.05Å
477	R	86.6	Confident	84.8	Confident	114 Å²	114	51.6 Å²	51.6	43%	0.43	26%	0.255	S	S	.	.			trans	-84.9	96.4	172.2	-59.7	-59.3	-168.9	-122.8	-4.4	110.2	V475 E496	V475-R477 PolarHBondContact O-N 3.4Å; R477-E496 IonicContact CZ-OE2 2.71Å; R477-E496 IonicContact NH1-OE2 3.73Å; R477-E496 PolarHBondContact NH1-OE2 2.89Å; R477-E496 IonicContact NH2-OE2 3.87Å; R477-E496 PolarHBondContact NH2-OE2 2.89Å
478	Y	80.3	Confident	84.5	Confident	19 Å²	19	54.1 Å²	54.1	8%	0.075	27%	0.266	C	S	.	.			trans	-70.3	138.4	175.6	-62.8	-79.6	0	0	0	111.4	S387 Y439 V476 D483 S484 R485 Y489	S387-Y478 VanDerWaalsContact CA-OH 3.29Å; S387-Y478 WeakPolarHBondContact CA-OH 3.48Å; S387-Y478 WeakPolarHBondContact CB-OH 3.31Å; S387-Y478 WeakPolarHBondContact OG-CE2 3.4Å; S387-Y478 PolarHBondContact OG-OH 3.09Å; Y439-Y478 PolarHBondContact OH-OH 2.85Å; V476-Y478 HydrophobicContact CB-CD2 4.46Å; V476-Y478 HydrophobicContact CB-CE2 3.87Å; V476-Y478 HydrophobicContact CG1-CD1 4.06Å; V476-Y478 HydrophobicContact CG1-CD2 4.21Å; V476-Y478 HydrophobicContact CG1-CE1 3.77Å; V476-Y478 HydrophobicContact CG1-CE2 3.9Å; V476-Y478 HydrophobicContact CG1-CG 4.29Å; V476-Y478 WeakPolarHBondContact O-CD2 3.18Å; V476-Y478 PolarHBondContact O-N 3.48Å; Y478-D483 HydrophobicContact CD1-CB 3.53Å; Y478-D483 HydrophobicContact CE1-CB 4.32Å; Y478-D483 HydrophobicContact CG-CB 4.14Å; Y478-S484 WeakPolarHBondContact CE1-O 3.41Å; Y478-R485 HydrophobicContact CD2-CB 3.98Å; Y478-R485 HydrophobicContact CE1-CB 4.24Å; Y478-R485 HydrophobicContact CE2-CB 3.48Å; Y478-R485 VanDerWaalsContact CE2-CB 3.48Å; Y478-Y489 HydrophobicContact CD2-CD2 4.26Å; Y478-Y489 HydrophobicContact CD2-CE1 4.48Å; Y478-Y489 AromaticContact CD2-CE2 3.6Å; Y478-Y489 HydrophobicContact CD2-CE2 3.6Å; Y478-Y489 AromaticContact CD2-CZ 3.74Å; Y478-Y489 HydrophobicContact CE2-CD2 4.02Å; Y478-Y489 AromaticContact CE2-CE2 3.65Å; Y478-Y489 HydrophobicContact CE2-CE2 3.65Å
479	R	61.5	Low	84.1	Confident	234 Å²	234	54.3 Å²	54.3	88%	0.883	27%	0.266	S	S	*	.	S	Bend	trans	-94.8	-38	-177.1	-74.6	-175.4	175.2	171.5	-1.4	111.5	D483	R479-D483 PolarHBondContact N-OD2 3.21Å; R479-D483 VanDerWaalsContact N-OD2 3.16Å
480	N	64.1	Low	83.5	Confident	101 Å²	101	53.4 Å²	53.4	54%	0.54	27%	0.266	S	S	.	.	S	Bend	trans	-104.4	147.3	-179.9	-42.1	-53.2	0	0	0	110.1	N482 D483	N480-N482 PolarHBondContact O-N 2.94Å; N480-D483 WeakPolarHBondContact CB-OD1 3.35Å; N480-D483 PolarHBondContact N-OD2 3.14Å; N480-D483 PolarHBondContact ND2-OD1 3.1Å; N480-D483 VanDerWaalsContact O-CB 3.31Å; N480-D483 WeakPolarHBondContact O-CB 3.24Å; N480-D483 VanDerWaalsContact O-CG 3.3Å; N480-D483 PolarHBondContact O-N 2.82Å
481	T	55.8	Low	83.2	Confident	25 Å²	25	53.1 Å²	53.1	15%	0.153	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-19	178.2	52.8	0	0	0	0	114	H301 C302 D483	H301-T481 HydrophobicContact CB-CG2 3.34Å; C302-T481 WeakPolarHBondContact O-CG2 3.48Å; T481-D483 VanDerWaalsContact C-N 3.33Å
482	N	60.5	Low	83.2	Confident	102 Å²	102	53.1 Å²	53.1	55%	0.545	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	0.5	175.2	-58.3	-10.7	0	0	0	111.8	N480 S484	N480-N482 PolarHBondContact O-N 2.94Å; N482-S484 PolarHBondContact O-N 3.39Å
483	D	72.5	Confident	83	Confident	49 Å²	49	53.1 Å²	53.1	26%	0.262	27%	0.266	S	S	.	.	S	Bend	trans	-65.7	122.9	174.6	-66.4	-20.3	0	0	0	108.6	Y478 R479 N480 T481 R485	Y478-D483 HydrophobicContact CD1-CB 3.53Å; Y478-D483 HydrophobicContact CE1-CB 4.32Å; Y478-D483 HydrophobicContact CG-CB 4.14Å; R479-D483 PolarHBondContact N-OD2 3.21Å; R479-D483 VanDerWaalsContact N-OD2 3.16Å; N480-D483 WeakPolarHBondContact CB-OD1 3.35Å; N480-D483 PolarHBondContact N-OD2 3.14Å; N480-D483 PolarHBondContact ND2-OD1 3.1Å; N480-D483 VanDerWaalsContact O-CB 3.31Å; N480-D483 WeakPolarHBondContact O-CB 3.24Å; N480-D483 VanDerWaalsContact O-CG 3.3Å; N480-D483 PolarHBondContact O-N 2.82Å; T481-D483 VanDerWaalsContact C-N 3.33Å; D483-R485 PolarHBondContact O-N 3.14Å
484	S	80.8	Confident	82.6	Confident	58 Å²	58	55.4 Å²	55.4	41%	0.406	29%	0.285	S	S	.	.			trans	-64.5	131.3	178.5	-45.7	0	0	0	0	111.3	Y439 Y478 N482	Y439-S484 WeakPolarHBondContact CE1-O 3.46Å; Y478-S484 WeakPolarHBondContact CE1-O 3.41Å; N482-S484 PolarHBondContact O-N 3.39Å
485	R	87.5	Confident	82.6	Confident	54 Å²	54	55.3 Å²	55.3	20%	0.204	29%	0.285	C	S	.	.			trans	-149	168.8	-171.5	61.8	-172.9	166.9	-162.1	-2.7	112	D304 S387 Y478 D483	D304-R485 VanDerWaalsContact CB-NH1 3.35Å; D304-R485 IonicContact OD1-CZ 3.57Å; D304-R485 IonicContact OD1-NH1 2.75Å; D304-R485 PolarHBondContact OD1-NH1 2.8Å; D304-R485 IonicContact OD1-NH2 3.86Å; D304-R485 PolarHBondContact OD1-NH2 3.24Å; D304-R485 IonicContact OD2-CZ 3.61Å; D304-R485 IonicContact OD2-NE 3.1Å; D304-R485 PolarHBondContact OD2-NE 2.85Å; D304-R485 IonicContact OD2-NH1 3.87Å; D304-R485 PolarHBondContact OD2-NH1 3.32Å; D304-R485 VanDerWaalsContact OD2-NH1 3.14Å; D304-R485 IonicContact OD2-NH2 3.61Å; D304-R485 PolarHBondContact OD2-NH2 3.5Å; S387-R485 WeakPolarHBondContact OG-CA 3.47Å; Y478-R485 HydrophobicContact CD2-CB 3.98Å; Y478-R485 HydrophobicContact CE1-CB 4.24Å; Y478-R485 HydrophobicContact CE2-CB 3.48Å; Y478-R485 VanDerWaalsContact CE2-CB 3.48Å; D483-R485 PolarHBondContact O-N 3.14Å
486	S	88.7	Confident	82.6	Confident	5 Å²	5	55.2 Å²	55.2	4%	0.035	28%	0.284	C	S	.	.			trans	-62.6	144.8	176.7	-176	0	0	0	0	111.4	S386 S387 T455 F488 Y489	S386-S486 VanDerWaalsContact OG-CB 3.3Å; S386-S486 WeakPolarHBondContact OG-CB 3.41Å; S386-S486 PolarHBondContact OG-OG 3.32Å; S387-S486 PolarHBondContact OG-N 2.87Å; T455-S486 PolarHBondContact OG1-OG 3.47Å; S486-F488 PolarHBondContact O-N 2.98Å; S486-F488 PolarHBondContact OG-N 3.14Å; S486-F488 VanDerWaalsContact OG-N 3.11Å; S486-Y489 VanDerWaalsContact O-CB 3.25Å; S486-Y489 WeakPolarHBondContact O-CB 3.29Å; S486-Y489 PolarHBondContact O-N 3.19Å
487	V	84.5	Confident	82.6	Confident	110 Å²	110	59.7 Å²	59.7	67%	0.667	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-23.9	168.7	-60.4	0	0	0	0	112.2	Y489	V487-Y489 VanDerWaalsContact C-N 3.27Å; V487-Y489 PolarHBondContact O-N 3.03Å
488	F	90.1	Very high	82.8	Confident	52 Å²	52	57.8 Å²	57.8	23%	0.228	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	16.3	176.8	-59.9	-82.8	0	0	0	112.8	T455 S486 G490 E491 L492	T455-F488 HydrophobicContact CG2-CD2 3.65Å; T455-F488 HydrophobicContact CG2-CE2 3.69Å; S486-F488 PolarHBondContact O-N 2.98Å; S486-F488 PolarHBondContact OG-N 3.14Å; S486-F488 VanDerWaalsContact OG-N 3.11Å; F488-G490 VanDerWaalsContact C-N 3.28Å; F488-G490 PolarHBondContact O-N 3.41Å; F488-E491 WeakPolarHBondContact CD1-OE1 3.31Å; F488-E491 PolarHBondContact O-N 3.42Å; F488-E491 VanDerWaalsContact O-N 3.08Å; F488-L492 WeakPolarHBondContact O-CG 3.42Å; F488-L492 PolarHBondContact O-N 3.38Å
489	Y	91	Very high	83.5	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-55.9	-40.1	-176.2	-174.9	-116	0	0	0	113.2	D304 V475 V476 Y478 S486 V487 E491 L492 L493	D304-Y489 HydrophobicContact CB-CD1 3.68Å; D304-Y489 HydrophobicContact CB-CE1 3.46Å; D304-Y489 VanDerWaalsContact CB-CE1 3.46Å; V475-Y489 HydrophobicContact CG1-CD2 4.08Å; V475-Y489 HydrophobicContact CG1-CE2 3.54Å; V476-Y489 VanDerWaalsContact O-CE2 3.29Å; V476-Y489 WeakPolarHBondContact O-CE2 3.31Å; V476-Y489 PolarHBondContact O-OH 2.82Å; V476-Y489 VanDerWaalsContact O-OH 3.05Å; Y478-Y489 HydrophobicContact CD2-CD2 4.26Å; Y478-Y489 HydrophobicContact CD2-CE1 4.48Å; Y478-Y489 AromaticContact CD2-CE2 3.6Å; Y478-Y489 HydrophobicContact CD2-CE2 3.6Å; Y478-Y489 AromaticContact CD2-CZ 3.74Å; Y478-Y489 HydrophobicContact CE2-CD2 4.02Å; Y478-Y489 AromaticContact CE2-CE2 3.65Å; Y478-Y489 HydrophobicContact CE2-CE2 3.65Å; S486-Y489 VanDerWaalsContact O-CB 3.25Å; S486-Y489 WeakPolarHBondContact O-CB 3.29Å; S486-Y489 PolarHBondContact O-N 3.19Å; V487-Y489 VanDerWaalsContact C-N 3.27Å; V487-Y489 PolarHBondContact O-N 3.03Å; Y489-E491 PolarHBondContact O-N 3.06Å; Y489-L492 PolarHBondContact O-N 3.47Å; Y489-L493 HydrophobicContact CD1-CD1 3.99Å; Y489-L493 HydrophobicContact CD1-CG 4.49Å; Y489-L493 HydrophobicContact CE1-CD1 3.62Å; Y489-L493 HydrophobicContact CE1-CD2 4.42Å; Y489-L493 HydrophobicContact CE1-CG 4.16Å; Y489-L493 HydrophobicContact CE2-CD2 4.35Å; Y489-L493 HydrophobicContact CE2-CG 4.44Å; Y489-L493 WeakPolarHBondContact O-CG 3.47Å; Y489-L493 PolarHBondContact O-N 3.4Å
490	G	83.8	Confident	85	Confident	34 Å²	34	49.8 Å²	49.8	35%	0.351	28%	0.276	S	S	.	.	H	α-helix	trans	-62	-41.1	176.3	0	0	0	0	0	113.6	F488 L493 A494	F488-G490 VanDerWaalsContact C-N 3.28Å; F488-G490 PolarHBondContact O-N 3.41Å; G490-L493 PolarHBondContact O-N 3.45Å; G490-A494 PolarHBondContact O-N 2.86Å; G490-A494 VanDerWaalsContact O-N 3.12Å
491	E	91	Very high	86.2	Confident	105 Å²	105	49.5 Å²	49.5	49%	0.491	28%	0.282	S	S	.	.	H	α-helix	trans	-68.3	-38	176.5	-67.9	176.8	-138	0	0	111.6	L465 F488 Y489 A494 A495	L465-E491 HydrophobicContact CD1-CB 4.13Å; L465-E491 WeakPolarHBondContact CD1-OE2 3.39Å; L465-E491 HydrophobicContact CD2-CB 3.79Å; F488-E491 WeakPolarHBondContact CD1-OE1 3.31Å; F488-E491 PolarHBondContact O-N 3.42Å; F488-E491 VanDerWaalsContact O-N 3.08Å; Y489-E491 PolarHBondContact O-N 3.06Å; E491-A494 PolarHBondContact O-N 2.89Å; E491-A495 VanDerWaalsContact O-CB 3.31Å; E491-A495 WeakPolarHBondContact O-CB 3.35Å; E491-A495 PolarHBondContact O-N 2.99Å
492	L	95.3	Very high	88	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-45.9	175.5	-71.7	168.2	0	0	0	110.7	I388 A464 L465 V468 V475 F488 Y489 A494 A495 E496	I388-L492 HydrophobicContact CG2-CD1 4.22Å; I388-L492 HydrophobicContact CG2-CD2 3.83Å; A464-L492 HydrophobicContact CB-CD2 3.9Å; L465-L492 HydrophobicContact CD2-CB 4.48Å; L465-L492 HydrophobicContact CD2-CD2 3.71Å; L465-L492 HydrophobicContact CD2-CG 4.03Å; L465-L492 HydrophobicContact CG-CD2 3.95Å; L465-L492 HydrophobicContact CG-CG 4.47Å; V468-L492 HydrophobicContact CB-CD2 4.44Å; V468-L492 WeakPolarHBondContact CG1-O 3.24Å; V468-L492 HydrophobicContact CG2-CD2 4.01Å; V475-L492 HydrophobicContact CG1-CB 4.14Å; V475-L492 HydrophobicContact CG2-CB 3.89Å; V475-L492 WeakPolarHBondContact CG2-O 3.16Å; F488-L492 WeakPolarHBondContact O-CG 3.42Å; F488-L492 PolarHBondContact O-N 3.38Å; Y489-L492 PolarHBondContact O-N 3.47Å; L492-A494 PolarHBondContact O-N 3.31Å; L492-A495 PolarHBondContact O-N 3.44Å; L492-E496 PolarHBondContact O-N 2.72Å
493	L	92.2	Very high	89.5	Confident	12 Å²	12	51 Å²	51	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-47.4	176	-68.1	173.1	0	0	0	112	D304 V475 Y489 G490 A495 E496 E497	D304-L493 WeakPolarHBondContact O-CD1 3.33Å; V475-L493 HydrophobicContact CB-CD2 4.43Å; V475-L493 HydrophobicContact CG1-CD2 3.84Å; V475-L493 HydrophobicContact CG1-CG 4.4Å; Y489-L493 HydrophobicContact CD1-CD1 3.99Å; Y489-L493 HydrophobicContact CD1-CG 4.49Å; Y489-L493 HydrophobicContact CE1-CD1 3.62Å; Y489-L493 HydrophobicContact CE1-CD2 4.42Å; Y489-L493 HydrophobicContact CE1-CG 4.16Å; Y489-L493 HydrophobicContact CE2-CD2 4.35Å; Y489-L493 HydrophobicContact CE2-CG 4.44Å; Y489-L493 WeakPolarHBondContact O-CG 3.47Å; Y489-L493 PolarHBondContact O-N 3.4Å; G490-L493 PolarHBondContact O-N 3.45Å; L493-A495 VanDerWaalsContact C-N 3.34Å; L493-A495 PolarHBondContact O-N 2.99Å; L493-E496 PolarHBondContact O-N 3.32Å; L493-E497 PolarHBondContact O-N 2.76Å
494	A	87.8	Confident	90.5	Very high	48 Å²	48	51.9 Å²	51.9	40%	0.397	29%	0.293	S	S	.	.	H	α-helix	trans	-64.2	-38.7	178.7	0	0	0	0	0	112.2	G490 E491 L492 E496 E497 N498	G490-A494 PolarHBondContact O-N 2.86Å; G490-A494 VanDerWaalsContact O-N 3.12Å; E491-A494 PolarHBondContact O-N 2.89Å; L492-A494 PolarHBondContact O-N 3.31Å; A494-E496 VanDerWaalsContact C-N 3.34Å; A494-E497 PolarHBondContact O-N 2.88Å; A494-N498 WeakPolarHBondContact O-CB 3.29Å; A494-N498 PolarHBondContact O-N 3.25Å
495	A	93.8	Very high	91.1	Very high	13 Å²	13	50 Å²	50	11%	0.107	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-39.1	175.5	0	0	0	0	0	112	L465 V468 E491 L492 L493 N498 A499	L465-A495 HydrophobicContact CD2-CB 4.02Å; V468-A495 HydrophobicContact CB-CB 4.42Å; V468-A495 HydrophobicContact CG1-CB 3.86Å; E491-A495 VanDerWaalsContact O-CB 3.31Å; E491-A495 WeakPolarHBondContact O-CB 3.35Å; E491-A495 PolarHBondContact O-N 2.99Å; L492-A495 PolarHBondContact O-N 3.44Å; L493-A495 VanDerWaalsContact C-N 3.34Å; L493-A495 PolarHBondContact O-N 2.99Å; A495-N498 PolarHBondContact O-N 3.13Å; A495-A499 WeakPolarHBondContact O-CB 3.12Å; A495-A499 PolarHBondContact O-N 2.83Å
496	E	95.8	Very high	91.3	Very high	5 Å²	5	49.9 Å²	49.9	2%	0.023	29%	0.285	C	S	.	.	H	α-helix	trans	-68.9	-42.6	177.7	-168.7	-178.9	-134.2	0	0	111.8	V468 S474 V475 R477 L492 L493 A494 N498 A499 Q500 Y507	V468-E496 HydrophobicContact CG1-CB 3.63Å; V468-E496 HydrophobicContact CG1-CG 4.37Å; S474-E496 VanDerWaalsContact CA-OE1 3.3Å; S474-E496 WeakPolarHBondContact CA-OE1 3.38Å; V475-E496 HydrophobicContact CG2-CB 3.83Å; V475-E496 HydrophobicContact CG2-CG 4.28Å; V475-E496 PolarHBondContact N-OE1 3.17Å; R477-E496 IonicContact CZ-OE2 2.71Å; R477-E496 IonicContact NH1-OE2 3.73Å; R477-E496 PolarHBondContact NH1-OE2 2.89Å; R477-E496 IonicContact NH2-OE2 3.87Å; R477-E496 PolarHBondContact NH2-OE2 2.89Å; L492-E496 PolarHBondContact O-N 2.72Å; L493-E496 PolarHBondContact O-N 3.32Å; A494-E496 VanDerWaalsContact C-N 3.34Å; E496-N498 VanDerWaalsContact C-N 3.31Å; E496-N498 PolarHBondContact O-N 2.92Å; E496-A499 PolarHBondContact O-N 2.99Å; E496-Q500 WeakPolarHBondContact O-CB 3.29Å; E496-Q500 VanDerWaalsContact O-CG 3.3Å; E496-Q500 WeakPolarHBondContact O-CG 3.46Å; E496-Q500 PolarHBondContact O-N 2.91Å; E496-Y507 HydrophobicContact CG-CE2 4.08Å; E496-Y507 VanDerWaalsContact CG-OH 3.26Å; E496-Y507 WeakPolarHBondContact CG-OH 3.22Å; E496-Y507 PolarHBondContact OE1-OH 2.97Å
497	E	90.9	Very high	91.4	Very high	109 Å²	109	52.2 Å²	52.2	51%	0.509	29%	0.293	S	S	.	.	H	α-helix	trans	-61.2	-40.5	174.6	-176.5	177.2	-172.2	0	0	111.7	L493 A494 Q500 S501	L493-E497 PolarHBondContact O-N 2.76Å; A494-E497 PolarHBondContact O-N 2.88Å; E497-Q500 PolarHBondContact O-N 3.18Å; E497-S501 WeakPolarHBondContact O-CB 3.45Å; E497-S501 PolarHBondContact O-N 3.12Å; E497-S501 PolarHBondContact O-OG 2.95Å
498	N	91.4	Very high	91.7	Very high	74 Å²	74	48.7 Å²	48.7	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-63.8	-42.2	173.8	-167.3	-2	0	0	0	111.7	A494 A495 E496 Q500 S501 K502	A494-N498 WeakPolarHBondContact O-CB 3.29Å; A494-N498 PolarHBondContact O-N 3.25Å; A495-N498 PolarHBondContact O-N 3.13Å; E496-N498 VanDerWaalsContact C-N 3.31Å; E496-N498 PolarHBondContact O-N 2.92Å; N498-Q500 VanDerWaalsContact C-N 3.34Å; N498-Q500 PolarHBondContact O-N 2.87Å; N498-S501 WeakPolarHBondContact CA-OG 3.21Å; N498-S501 PolarHBondContact O-OG 3Å; N498-K502 WeakPolarHBondContact O-CB 3.41Å; N498-K502 WeakPolarHBondContact O-CG 3.34Å; N498-K502 PolarHBondContact O-N 2.78Å; N498-K502 VanDerWaalsContact O-N 3.08Å; N498-K502 VanDerWaalsContact OD1-CD 3.31Å; N498-K502 WeakPolarHBondContact OD1-CD 3.4Å; N498-K502 WeakPolarHBondContact OD1-CE 3.29Å; N498-K502 PolarHBondContact OD1-NZ 3.38Å
499	A	94.6	Very high	91.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.6	-38.1	175.1	0	0	0	0	0	112.2	V468 A495 E496 G503 L504 Y507	V468-A499 WeakPolarHBondContact O-CB 3.34Å; A495-A499 WeakPolarHBondContact O-CB 3.12Å; A495-A499 PolarHBondContact O-N 2.83Å; E496-A499 PolarHBondContact O-N 2.99Å; A499-G503 PolarHBondContact O-N 3.09Å; A499-L504 HydrophobicContact CB-CB 4.34Å; A499-L504 PolarHBondContact O-N 3.17Å; A499-Y507 HydrophobicContact CB-CD2 3.93Å; A499-Y507 HydrophobicContact CB-CE2 4.16Å
500	Q	92.6	Very high	91.4	Very high	85 Å²	85	63.8 Å²	63.8	40%	0.397	34%	0.341	S	S	.	.	H	α-helix	trans	-66.5	-49.4	176.2	-75.7	172.9	3.7	0	0	112.3	E496 E497 N498 K502 G503 Y507	E496-Q500 WeakPolarHBondContact O-CB 3.29Å; E496-Q500 VanDerWaalsContact O-CG 3.3Å; E496-Q500 WeakPolarHBondContact O-CG 3.46Å; E496-Q500 PolarHBondContact O-N 2.91Å; E497-Q500 PolarHBondContact O-N 3.18Å; N498-Q500 VanDerWaalsContact C-N 3.34Å; N498-Q500 PolarHBondContact O-N 2.87Å; Q500-K502 VanDerWaalsContact C-N 3.28Å; Q500-K502 PolarHBondContact O-N 2.95Å; Q500-G503 PolarHBondContact O-N 3Å; Q500-G503 VanDerWaalsContact O-N 3.1Å; Q500-Y507 HydrophobicContact CB-CG 4.35Å; Q500-Y507 HydrophobicContact CG-CD1 3.49Å; Q500-Y507 VanDerWaalsContact CG-CD1 3.49Å; Q500-Y507 HydrophobicContact CG-CD2 3.76Å; Q500-Y507 HydrophobicContact CG-CE1 3.62Å; Q500-Y507 HydrophobicContact CG-CE2 3.87Å; Q500-Y507 HydrophobicContact CG-CG 3.55Å
501	S	89.8	Confident	91.3	Very high	95 Å²	95	69.8 Å²	69.8	66%	0.664	37%	0.365	S	S	*	.	H	α-helix	trans	-63.3	-33.1	179.7	55.1	0	0	0	0	112.9	E497 N498	E497-S501 WeakPolarHBondContact O-CB 3.45Å; E497-S501 PolarHBondContact O-N 3.12Å; E497-S501 PolarHBondContact O-OG 2.95Å; N498-S501 WeakPolarHBondContact CA-OG 3.21Å; N498-S501 PolarHBondContact O-OG 3Å
502	K	93.3	Very high	91	Very high	134 Å²	134	65.9 Å²	65.9	58%	0.583	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.1	174.9	-70.1	178.1	179	164.3	0	114.5	N498 Q500 L504	N498-K502 WeakPolarHBondContact O-CB 3.41Å; N498-K502 WeakPolarHBondContact O-CG 3.34Å; N498-K502 PolarHBondContact O-N 2.78Å; N498-K502 VanDerWaalsContact O-N 3.08Å; N498-K502 VanDerWaalsContact OD1-CD 3.31Å; N498-K502 WeakPolarHBondContact OD1-CD 3.4Å; N498-K502 WeakPolarHBondContact OD1-CE 3.29Å; N498-K502 PolarHBondContact OD1-NZ 3.38Å; Q500-K502 VanDerWaalsContact C-N 3.28Å; Q500-K502 PolarHBondContact O-N 2.95Å; K502-L504 HydrophobicContact CB-CD1 4.07Å; K502-L504 HydrophobicContact CB-CD2 4.24Å; K502-L504 HydrophobicContact CB-CG 3.75Å; K502-L504 HydrophobicContact CD-CD1 4.25Å
503	G	92.3	Very high	90.5	Very high	25 Å²	25	68.5 Å²	68.5	26%	0.258	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	45.8	-177	0	0	0	0	0	113.1	A499 Q500 Y507 S508	A499-G503 PolarHBondContact O-N 3.09Å; Q500-G503 PolarHBondContact O-N 3Å; Q500-G503 VanDerWaalsContact O-N 3.1Å; G503-Y507 WeakPolarHBondContact CA-O 3.25Å; G503-S508 WeakPolarHBondContact O-CA 3.13Å; G503-S508 VanDerWaalsContact O-CB 3.22Å; G503-S508 WeakPolarHBondContact O-CB 3.36Å; G503-S508 PolarHBondContact O-N 3.4Å
504	L	94.2	Very high	90	Very high	68 Å²	68	74.1 Å²	74.1	36%	0.356	40%	0.397	S	S	.	.			trans	-91.8	144.2	-178.8	-58.4	178.7	0	0	0	111.8	A499 K502 M506 Y507	A499-L504 HydrophobicContact CB-CB 4.34Å; A499-L504 PolarHBondContact O-N 3.17Å; K502-L504 HydrophobicContact CB-CD1 4.07Å; K502-L504 HydrophobicContact CB-CD2 4.24Å; K502-L504 HydrophobicContact CB-CG 3.75Å; K502-L504 HydrophobicContact CD-CD1 4.25Å; L504-M506 PolarHBondContact O-N 3.14Å; L504-Y507 WeakPolarHBondContact O-CB 3.43Å; L504-Y507 PolarHBondContact O-N 2.92Å
505	G	92.4	Very high	90	Very high	17 Å²	17	73.8 Å²	73.8	18%	0.175	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	53.1	-126.1	175.1	0	0	0	0	0	111.9	Y417 Y507 S508	Y417-G505 VanDerWaalsContact CE1-C 3.41Å; Y417-G505 PolarHBondContact OH-O 2.95Å; G505-Y507 PolarHBondContact O-N 3.39Å; G505-S508 VanDerWaalsContact O-CB 3.24Å; G505-S508 WeakPolarHBondContact O-CB 3.36Å; G505-S508 PolarHBondContact O-N 2.96Å
506	M	91.7	Very high	89.7	Confident	53 Å²	53	83.1 Å²	83.1	26%	0.261	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-60.5	-11.6	-179.7	76.7	-176.4	86.7	0	0	115.2	P391 Y417 G471 L472 A473 L504	P391-M506 HydrophobicContact CG-CE 4.36Å; Y417-M506 HydrophobicContact CD2-CB 3.88Å; Y417-M506 VanDerWaalsContact CE2-CA 3.47Å; Y417-M506 HydrophobicContact CE2-CB 4.16Å; G471-M506 WeakPolarHBondContact O-CE 3.33Å; G471-M506 WeakPolarHBondContact O-CG 3.35Å; G471-M506 PolarHBondContact O-N 3.33Å; L472-M506 VanDerWaalsContact C-CE 3.47Å; A473-M506 VanDerWaalsContact CA-CE 3.41Å; A473-M506 WeakPolarHBondContact O-CE 3.47Å; L504-M506 PolarHBondContact O-N 3.14Å
507	Y	91.7	Very high	89.4	Confident	53 Å²	53	83.6 Å²	83.6	21%	0.208	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-99.1	-2.2	176.7	-52	-62.6	0	0	0	113.3	E496 A499 Q500 G503 L504 G505	E496-Y507 HydrophobicContact CG-CE2 4.08Å; E496-Y507 VanDerWaalsContact CG-OH 3.26Å; E496-Y507 WeakPolarHBondContact CG-OH 3.22Å; E496-Y507 PolarHBondContact OE1-OH 2.97Å; A499-Y507 HydrophobicContact CB-CD2 3.93Å; A499-Y507 HydrophobicContact CB-CE2 4.16Å; Q500-Y507 HydrophobicContact CB-CG 4.35Å; Q500-Y507 HydrophobicContact CG-CD1 3.49Å; Q500-Y507 VanDerWaalsContact CG-CD1 3.49Å; Q500-Y507 HydrophobicContact CG-CD2 3.76Å; Q500-Y507 HydrophobicContact CG-CE1 3.62Å; Q500-Y507 HydrophobicContact CG-CE2 3.87Å; Q500-Y507 HydrophobicContact CG-CG 3.55Å; G503-Y507 WeakPolarHBondContact CA-O 3.25Å; L504-Y507 WeakPolarHBondContact O-CB 3.43Å; L504-Y507 PolarHBondContact O-N 2.92Å; G505-Y507 PolarHBondContact O-N 3.39Å
508	S	90.7	Very high	89.4	Confident	36 Å²	36	79.7 Å²	79.7	25%	0.252	41%	0.409	S	S	.	.			trans	-64.9	144.6	173.5	-174.8	0	0	0	0	111.2	G503 G505 Q510	G503-S508 WeakPolarHBondContact O-CA 3.13Å; G503-S508 VanDerWaalsContact O-CB 3.22Å; G503-S508 WeakPolarHBondContact O-CB 3.36Å; G503-S508 PolarHBondContact O-N 3.4Å; G505-S508 VanDerWaalsContact O-CB 3.24Å; G505-S508 WeakPolarHBondContact O-CB 3.36Å; G505-S508 PolarHBondContact O-N 2.96Å; S508-Q510 VanDerWaalsContact C-N 3.3Å; S508-Q510 WeakPolarHBondContact OG-CB 3.45Å; S508-Q510 PolarHBondContact OG-N 2.94Å; S508-Q510 VanDerWaalsContact OG-N 3.09Å
509	K	86.6	Confident	89.3	Confident	215 Å²	215	77.2 Å²	77.2	94%	0.935	40%	0.395	S	S	*	.	S	Bend	trans	-83.6	-8.9	170	-64.9	-177.3	-179.9	177.8	0	112.7
510	Q	87.3	Confident	89.1	Confident	159 Å²	159	77.2 Å²	77.2	74%	0.743	40%	0.396	S	S	*	.	S	Bend	trans	-76.1	157.2	175	-62.3	-178.2	-8.2	0	0	110.2	S508 A512	S508-Q510 VanDerWaalsContact C-N 3.3Å; S508-Q510 WeakPolarHBondContact OG-CB 3.45Å; S508-Q510 PolarHBondContact OG-N 2.94Å; S508-Q510 VanDerWaalsContact OG-N 3.09Å; Q510-A512 PolarHBondContact O-N 3.42Å
511	D	82.8	Confident	88.7	Confident	160 Å²	160	74.8 Å²	74.8	86%	0.856	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-58.2	134.7	175	-67.3	-38.8	0	0	0	110.3
512	A	84.9	Confident	88.1	Confident	22 Å²	22	73.3 Å²	73.3	18%	0.182	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-64.8	147.7	179.8	0	0	0	0	0	110.9	P416 Y417 Q510 I514	P416-A512 HydrophobicContact CB-CB 3.79Å; P416-A512 HydrophobicContact CG-CB 4.26Å; Y417-A512 HydrophobicContact CD2-CB 4.49Å; Y417-A512 HydrophobicContact CE2-CB 3.65Å; Q510-A512 PolarHBondContact O-N 3.42Å; A512-I514 PolarHBondContact O-N 2.97Å
513	P	84.1	Confident	87.7	Confident	55 Å²	55	69.7 Å²	69.7	36%	0.357	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-57.9	130.3	174.4	-21.9	32.6	0	0	0	111.2	Y417 E420	Y417-P513 VanDerWaalsContact CE1-CD 3.48Å; Y417-P513 HydrophobicContact CE1-CG 4.16Å; E420-P513 WeakPolarHBondContact OE1-CB 3.2Å; E420-P513 WeakPolarHBondContact OE1-CG 3.28Å
514	I	82.2	Confident	87.3	Confident	131 Å²	131	70.6 Å²	70.6	67%	0.672	37%	0.373	S	S	*	.			trans	-110.7	113.7	177.9	-56.3	177.5	0	0	0	108.9	A512 R516	A512-I514 PolarHBondContact O-N 2.97Å; I514-R516 HydrophobicContact CG2-CG 3.95Å; I514-R516 PolarHBondContact O-N 3.26Å
515	H	87.1	Confident	87	Confident	40 Å²	40	70.4 Å²	70.4	19%	0.185	38%	0.382	C	S	.	.			trans	-92.8	88.6	178.7	-63.5	-73.5	0	0	0	110.7	Y413 F419 E420 V517	Y413-H515 HydrophobicContact CD1-CB 4.2Å; F419-H515 AromaticContact CD1-CE1 3.34Å; F419-H515 WeakPolarHBondContact CD1-CE1 3.45Å; F419-H515 AromaticContact CD1-ND1 3.89Å; F419-H515 AromaticContact CD1-NE2 3.41Å; F419-H515 WeakPolarHBondContact CD1-NE2 3.27Å; F419-H515 AromaticContact CE1-CE1 3.81Å; F419-H515 AromaticContact CG-CD2 3.88Å; F419-H515 AromaticContact CG-CE1 3.96Å; F419-H515 AromaticContact CG-NE2 3.75Å; E420-H515 IonicContact OE1-CD2 3.32Å; E420-H515 IonicContact OE1-CE1 3.54Å; E420-H515 PolarHBondContact OE1-CE1 3.42Å; E420-H515 IonicContact OE1-NE2 3.69Å; E420-H515 PolarHBondContact OE1-NE2 3.3Å; E420-H515 IonicContact OE2-NE2 3.78Å; H515-V517 VanDerWaalsContact C-N 3.32Å; H515-V517 HydrophobicContact CB-CG2 4.22Å; H515-V517 PolarHBondContact O-N 2.84Å
516	R	87	Confident	86.8	Confident	209 Å²	209	74.3 Å²	74.3	79%	0.789	39%	0.394	S	S	*	.			trans	-77.1	81.3	177.5	-65.5	-171.9	-179.5	180	0.9	111.1	I514	I514-R516 HydrophobicContact CG2-CG 3.95Å; I514-R516 PolarHBondContact O-N 3.26Å
517	V	90.3	Very high	86.9	Confident	15 Å²	15	71.8 Å²	71.8	9%	0.091	38%	0.381	C	S	.	.			trans	-96.2	118.2	-176.7	-177.6	0	0	0	0	111.9	R410 Y413 H515 D519 Y556 T561 V563	R410-V517 PolarHBondContact NH1-O 3.16Å; Y413-V517 HydrophobicContact CD1-CB 4.29Å; Y413-V517 HydrophobicContact CD1-CG2 3.59Å; Y413-V517 HydrophobicContact CD2-CB 4.34Å; Y413-V517 HydrophobicContact CD2-CG2 4.5Å; Y413-V517 HydrophobicContact CE1-CG2 3.87Å; Y413-V517 HydrophobicContact CE2-CG1 4.39Å; Y413-V517 HydrophobicContact CG-CB 4.18Å; Y413-V517 HydrophobicContact CG-CG2 3.93Å; H515-V517 VanDerWaalsContact C-N 3.32Å; H515-V517 HydrophobicContact CB-CG2 4.22Å; H515-V517 PolarHBondContact O-N 2.84Å; V517-D519 PolarHBondContact O-N 2.87Å; V517-Y556 HydrophobicContact CB-CE2 4.45Å; V517-Y556 HydrophobicContact CG1-CD2 3.93Å; V517-Y556 HydrophobicContact CG1-CE2 3.78Å; V517-Y556 HydrophobicContact CG2-CE2 3.75Å; V517-T561 CarbonylContact C-O 3.41Å; V517-T561 WeakPolarHBondContact CA-O 3.11Å; V517-V563 HydrophobicContact CG1-CB 4.49Å; V517-V563 HydrophobicContact CG1-CG2 3.59Å
518	A	90.8	Very high	86.9	Confident	27 Å²	27	76.6 Å²	76.6	22%	0.223	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	107.9	174.4	0	0	0	0	0	110.6	L520 F530 T561 C562 V563	A518-L520 HydrophobicContact CB-CD2 4.37Å; A518-F530 HydrophobicContact CB-CE2 4.41Å; A518-F530 HydrophobicContact CB-CZ 3.88Å; A518-T561 PolarHBondContact N-O 3.04Å; A518-C562 HydrophobicContact CB-CB 4.11Å; A518-C562 CarbonylContact O-C 3.53Å; A518-C562 WeakPolarHBondContact O-CA 3.35Å; A518-C562 VanDerWaalsContact O-CB 3.28Å; A518-C562 WeakPolarHBondContact O-CB 3.37Å; A518-V563 PolarHBondContact O-N 3.08Å
519	D	88.9	Confident	87	Confident	22 Å²	22	81 Å²	81	12%	0.118	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	117.3	173	-170.2	-6.1	0	0	0	109.7	R410 V517 T521 R554	R410-D519 IonicContact CZ-OD2 2.85Å; R410-D519 IonicContact NE-OD2 2.94Å; R410-D519 VanDerWaalsContact NH1-CB 3.26Å; R410-D519 IonicContact NH2-OD2 2.82Å; V517-D519 PolarHBondContact O-N 2.87Å; D519-T521 VanDerWaalsContact CG-OG1 3.24Å; D519-T521 VanDerWaalsContact OD1-CB 3.27Å; D519-T521 WeakPolarHBondContact OD1-CB 3.2Å; D519-T521 VanDerWaalsContact OD1-CG2 3.29Å; D519-T521 WeakPolarHBondContact OD1-CG2 3.48Å; D519-T521 PolarHBondContact OD1-N 2.93Å; D519-T521 PolarHBondContact OD1-OG1 3.19Å; D519-T521 PolarHBondContact OD2-OG1 2.85Å; D519-R554 VanDerWaalsContact CG-NH2 3.35Å; D519-R554 IonicContact OD1-NH1 2.72Å; D519-R554 IonicContact OD1-NH2 2.72Å; D519-R554 IonicContact OD2-CZ 3.27Å; D519-R554 IonicContact OD2-NH1 2.88Å; D519-R554 IonicContact OD2-NH2 3.94Å; D519-R554 PolarHBondContact OD2-NH2 2.8Å
520	L	91.1	Very high	87.4	Confident	1 Å²	1	73.2 Å²	73.2	1%	0.005	38%	0.382	C	S	.	.			trans	-97	-5.2	-178.7	-51.8	-176.1	0	0	0	111.3	A518 G522 N523 K526 S527 F530 C562 V563 I564 F621	A518-L520 HydrophobicContact CB-CD2 4.37Å; L520-G522 PolarHBondContact O-N 3.44Å; L520-N523 PolarHBondContact O-N 3.39Å; L520-N523 VanDerWaalsContact O-N 3.11Å; L520-K526 HydrophobicContact CD2-CB 3.74Å; L520-S527 PolarHBondContact O-OG 2.81Å; L520-F530 HydrophobicContact CD1-CB 3.56Å; L520-F530 HydrophobicContact CD1-CD1 3.89Å; L520-F530 HydrophobicContact CD1-CD2 3.93Å; L520-F530 HydrophobicContact CD1-CG 3.52Å; L520-F530 HydrophobicContact CD2-CD2 3.77Å; L520-F530 HydrophobicContact CD2-CE2 3.96Å; L520-F530 HydrophobicContact CD2-CG 4.23Å; L520-C562 HydrophobicContact CD1-CB 4.11Å; L520-C562 HydrophobicContact CG-CB 4.33Å; L520-V563 WeakPolarHBondContact CB-O 3.33Å; L520-V563 PolarHBondContact N-O 3.36Å; L520-I564 HydrophobicContact CB-CG2 4.3Å; L520-I564 HydrophobicContact CD1-CG2 3.81Å; L520-I564 HydrophobicContact CG-CG2 4.4Å; L520-F621 HydrophobicContact CB-CE2 4.14Å; L520-F621 HydrophobicContact CD1-CE2 4.09Å; L520-F621 HydrophobicContact CD1-CZ 4.05Å
521	T	83	Confident	87.7	Confident	34 Å²	34	67 Å²	67	21%	0.209	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	121.6	-179.7	60.6	0	0	0	0	111	D519 N523 R554 V563 T565	D519-T521 VanDerWaalsContact CG-OG1 3.24Å; D519-T521 VanDerWaalsContact OD1-CB 3.27Å; D519-T521 WeakPolarHBondContact OD1-CB 3.2Å; D519-T521 VanDerWaalsContact OD1-CG2 3.29Å; D519-T521 WeakPolarHBondContact OD1-CG2 3.48Å; D519-T521 PolarHBondContact OD1-N 2.93Å; D519-T521 PolarHBondContact OD1-OG1 3.19Å; D519-T521 PolarHBondContact OD2-OG1 2.85Å; T521-N523 PolarHBondContact O-N 2.72Å; T521-N523 VanDerWaalsContact O-N 3.17Å; T521-R554 PolarHBondContact OG1-NH1 2.72Å; T521-V563 HydrophobicContact CG2-CG1 4.45Å; T521-T565 WeakPolarHBondContact CG2-OG1 3.36Å
522	G	78.1	Confident	88.2	Confident	63 Å²	63	62 Å²	62	65%	0.649	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	3.9	-177.5	0	0	0	0	0	115.9	L520	L520-G522 PolarHBondContact O-N 3.44Å
523	N	84	Confident	88.5	Confident	59 Å²	59	67 Å²	67	32%	0.316	35%	0.349	S	S	.	.			trans	-106.2	81.7	-179.6	-166.3	-42.6	0	0	0	111.6	L520 T521 A525 K526 S527	L520-N523 PolarHBondContact O-N 3.39Å; L520-N523 VanDerWaalsContact O-N 3.11Å; T521-N523 PolarHBondContact O-N 2.72Å; T521-N523 VanDerWaalsContact O-N 3.17Å; N523-A525 VanDerWaalsContact C-N 3.27Å; N523-A525 PolarHBondContact O-N 3.04Å; N523-A525 VanDerWaalsContact O-N 3.17Å; N523-A525 PolarHBondContact OD1-N 3.47Å; N523-K526 HydrophobicContact CB-CB 4.24Å; N523-K526 PolarHBondContact O-N 3.27Å; N523-K526 WeakPolarHBondContact OD1-CB 3.46Å; N523-K526 WeakPolarHBondContact OD1-CG 3.01Å; N523-K526 PolarHBondContact OD1-N 3.09Å; N523-S527 WeakPolarHBondContact O-CB 3.29Å; N523-S527 PolarHBondContact O-N 3.45Å; N523-S527 PolarHBondContact O-OG 2.81Å; N523-S527 VanDerWaalsContact O-OG 3.09Å
524	V	85	Confident	89	Confident	43 Å²	43	64.4 Å²	64.4	26%	0.261	33%	0.332	S	S	.	.	H	α-helix	trans	-49.4	-45.2	-177.8	-179.5	0	0	0	0	112.8	S527 R528 V618	V524-S527 PolarHBondContact O-N 2.93Å; V524-R528 WeakPolarHBondContact O-CG 2.96Å; V524-R528 PolarHBondContact O-N 3.39Å; V524-V618 VanDerWaalsContact CG2-C 3.45Å; V524-V618 WeakPolarHBondContact CG2-O 3.46Å
525	A	87.5	Confident	89.6	Confident	64 Å²	64	61.7 Å²	61.7	53%	0.529	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-46.9	-176.4	0	0	0	0	0	111.8	N523 Q529	N523-A525 VanDerWaalsContact C-N 3.27Å; N523-A525 PolarHBondContact O-N 3.04Å; N523-A525 VanDerWaalsContact O-N 3.17Å; N523-A525 PolarHBondContact OD1-N 3.47Å; A525-Q529 WeakPolarHBondContact O-CG 3.22Å; A525-Q529 PolarHBondContact O-N 3.45Å
526	K	89.1	Confident	89.9	Confident	99 Å²	99	68.8 Å²	68.8	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-68.3	-40.6	175.2	-70.4	-174.2	-179.4	178.6	0	111.6	L520 N523 R528 Q529 F530	L520-K526 HydrophobicContact CD2-CB 3.74Å; N523-K526 HydrophobicContact CB-CB 4.24Å; N523-K526 PolarHBondContact O-N 3.27Å; N523-K526 WeakPolarHBondContact OD1-CB 3.46Å; N523-K526 WeakPolarHBondContact OD1-CG 3.01Å; N523-K526 PolarHBondContact OD1-N 3.09Å; K526-R528 VanDerWaalsContact C-N 3.3Å; K526-R528 PolarHBondContact O-N 3.37Å; K526-Q529 WeakPolarHBondContact O-CB 3.26Å; K526-Q529 PolarHBondContact O-N 3.49Å; K526-F530 WeakPolarHBondContact O-CD2 3.46Å; K526-F530 PolarHBondContact O-N 3.39Å
527	S	92.1	Very high	90.2	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.1	-43.1	177.2	-64.1	0	0	0	0	111.9	L520 N523 V524 Q529 F530 L531 M615 G619	L520-S527 PolarHBondContact O-OG 2.81Å; N523-S527 WeakPolarHBondContact O-CB 3.29Å; N523-S527 PolarHBondContact O-N 3.45Å; N523-S527 PolarHBondContact O-OG 2.81Å; N523-S527 VanDerWaalsContact O-OG 3.09Å; V524-S527 PolarHBondContact O-N 2.93Å; S527-Q529 VanDerWaalsContact C-N 3.3Å; S527-Q529 PolarHBondContact O-N 3.45Å; S527-F530 PolarHBondContact O-N 3.17Å; S527-F530 VanDerWaalsContact O-N 3.17Å; S527-L531 WeakPolarHBondContact O-CB 3.44Å; S527-L531 PolarHBondContact O-N 3.46Å; S527-M615 WeakPolarHBondContact CB-SD 3.5Å; S527-G619 WeakPolarHBondContact CB-O 3.36Å; S527-G619 PolarHBondContact OG-O 3.13Å
528	R	92.2	Very high	90.2	Very high	155 Å²	155	66.7 Å²	66.7	59%	0.585	34%	0.344	S	S	*	.	H	α-helix	trans	-60.1	-37.1	174.9	-73.1	-179.1	-156.6	-106.7	0.2	113.1	V524 K526 F530 L531 M615	V524-R528 WeakPolarHBondContact O-CG 2.96Å; V524-R528 PolarHBondContact O-N 3.39Å; K526-R528 VanDerWaalsContact C-N 3.3Å; K526-R528 PolarHBondContact O-N 3.37Å; R528-F530 VanDerWaalsContact C-N 3.32Å; R528-L531 PolarHBondContact O-N 2.89Å; R528-M615 HydrophobicContact CG-CE 3.41Å; R528-M615 VanDerWaalsContact CG-CE 3.41Å; R528-M615 HydrophobicContact CG-SD 4.16Å
529	Q	92.9	Very high	90.4	Very high	128 Å²	128	69.7 Å²	69.7	60%	0.598	35%	0.35	S	S	*	.	H	α-helix	trans	-66.9	-34.3	178	-66.1	172.1	7.8	0	0	112	A525 K526 S527 F533	A525-Q529 WeakPolarHBondContact O-CG 3.22Å; A525-Q529 PolarHBondContact O-N 3.45Å; K526-Q529 WeakPolarHBondContact O-CB 3.26Å; K526-Q529 PolarHBondContact O-N 3.49Å; S527-Q529 VanDerWaalsContact C-N 3.3Å; S527-Q529 PolarHBondContact O-N 3.45Å; Q529-F533 WeakPolarHBondContact O-CD2 3.39Å; Q529-F533 WeakPolarHBondContact O-CE2 3.3Å
530	F	94.8	Very high	90.8	Very high	51 Å²	51	68.9 Å²	68.9	22%	0.224	35%	0.346	C	S	.	.	H	α-helix	trans	-84.3	-25.2	178.3	-81.9	-105.9	0	0	0	113.2	A518 L520 K526 S527 R528 S532 F533 L534 C562	A518-F530 HydrophobicContact CB-CE2 4.41Å; A518-F530 HydrophobicContact CB-CZ 3.88Å; L520-F530 HydrophobicContact CD1-CB 3.56Å; L520-F530 HydrophobicContact CD1-CD1 3.89Å; L520-F530 HydrophobicContact CD1-CD2 3.93Å; L520-F530 HydrophobicContact CD1-CG 3.52Å; L520-F530 HydrophobicContact CD2-CD2 3.77Å; L520-F530 HydrophobicContact CD2-CE2 3.96Å; L520-F530 HydrophobicContact CD2-CG 4.23Å; K526-F530 WeakPolarHBondContact O-CD2 3.46Å; K526-F530 PolarHBondContact O-N 3.39Å; S527-F530 PolarHBondContact O-N 3.17Å; S527-F530 VanDerWaalsContact O-N 3.17Å; R528-F530 VanDerWaalsContact C-N 3.32Å; F530-S532 VanDerWaalsContact C-N 3.34Å; F530-S532 PolarHBondContact O-N 3.49Å; F530-F533 PolarHBondContact O-N 3.5Å; F530-L534 HydrophobicContact CB-CD1 4.07Å; F530-L534 HydrophobicContact CB-CG 4.44Å; F530-L534 WeakPolarHBondContact O-CG 3.21Å; F530-L534 PolarHBondContact O-N 2.89Å; F530-C562 HydrophobicContact CD1-CB 4.22Å; F530-C562 HydrophobicContact CE1-CB 3.91Å
531	L	94	Very high	91.1	Very high	29 Å²	29	74.2 Å²	74.2	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-51.4	-47.2	-172.1	-179.5	59.9	0	0	0	113.6	S527 R528 F533 L534 Q535 V612 M615 F621	S527-L531 WeakPolarHBondContact O-CB 3.44Å; S527-L531 PolarHBondContact O-N 3.46Å; R528-L531 PolarHBondContact O-N 2.89Å; L531-F533 VanDerWaalsContact C-N 3.27Å; L531-F533 PolarHBondContact O-N 2.77Å; L531-L534 PolarHBondContact O-N 2.93Å; L531-Q535 HydrophobicContact CD1-CG 3.73Å; L531-Q535 HydrophobicContact CG-CG 4.23Å; L531-Q535 WeakPolarHBondContact O-CB 3.31Å; L531-Q535 WeakPolarHBondContact O-CG 3.35Å; L531-Q535 PolarHBondContact O-N 3.36Å; L531-V612 HydrophobicContact CD1-CG1 4.12Å; L531-M615 HydrophobicContact CD1-CB 3.94Å; L531-M615 HydrophobicContact CD2-CB 3.82Å; L531-M615 HydrophobicContact CG-CB 4.48Å; L531-F621 HydrophobicContact CB-CE1 4.16Å; L531-F621 HydrophobicContact CD1-CD1 3.84Å; L531-F621 HydrophobicContact CD1-CE1 3.81Å
532	S	92.5	Very high	91.7	Very high	55 Å²	55	72.8 Å²	72.8	39%	0.385	37%	0.366	S	S	.	.	H	α-helix	trans	-62.8	-33.2	-178.9	54.7	0	0	0	0	113.5	F530 R536	F530-S532 VanDerWaalsContact C-N 3.34Å; F530-S532 PolarHBondContact O-N 3.49Å; S532-R536 WeakPolarHBondContact O-CB 3.5Å; S532-R536 PolarHBondContact O-N 3.15Å
533	F	91.6	Very high	92.6	Very high	127 Å²	127	70.1 Å²	70.1	56%	0.557	34%	0.337	S	S	*	.	H	α-helix	trans	-75.4	-44.2	178	-58.2	-80	0	0	0	110.6	Q529 F530 L531 R536 A537	Q529-F533 WeakPolarHBondContact O-CD2 3.39Å; Q529-F533 WeakPolarHBondContact O-CE2 3.3Å; F530-F533 PolarHBondContact O-N 3.5Å; L531-F533 VanDerWaalsContact C-N 3.27Å; L531-F533 PolarHBondContact O-N 2.77Å; F533-R536 PolarHBondContact O-N 3.02Å; F533-A537 PolarHBondContact O-N 3.29Å
534	L	95.6	Very high	93.2	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-38	180	-62.4	175.5	0	0	0	112.3	F530 L531 L540 I557 E560 I564 V612 F621	F530-L534 HydrophobicContact CB-CD1 4.07Å; F530-L534 HydrophobicContact CB-CG 4.44Å; F530-L534 WeakPolarHBondContact O-CG 3.21Å; F530-L534 PolarHBondContact O-N 2.89Å; L531-L534 PolarHBondContact O-N 2.93Å; L534-L540 HydrophobicContact CB-CD1 4.25Å; L534-L540 HydrophobicContact CD2-CD1 3.67Å; L534-I557 HydrophobicContact CD2-CD1 3.75Å; L534-E560 HydrophobicContact CD2-CG 4.18Å; L534-I564 HydrophobicContact CD1-CG2 4.12Å; L534-V612 HydrophobicContact CB-CB 4.11Å; L534-V612 HydrophobicContact CB-CG1 4.25Å; L534-V612 HydrophobicContact CB-CG2 4.09Å; L534-F621 HydrophobicContact CD1-CD1 4.1Å; L534-F621 HydrophobicContact CD1-CE1 3.62Å; L534-F621 HydrophobicContact CD1-CE2 4.36Å; L534-F621 HydrophobicContact CD1-CZ 3.74Å
535	Q	94.5	Very high	93.7	Very high	74 Å²	74	66.2 Å²	66.2	35%	0.346	31%	0.314	S	S	.	.	H	α-helix	trans	-68.4	-33.9	176.8	-80.1	176.2	-40.3	0	0	113.3	L531 A537 K611 V612 E613	L531-Q535 HydrophobicContact CD1-CG 3.73Å; L531-Q535 HydrophobicContact CG-CG 4.23Å; L531-Q535 WeakPolarHBondContact O-CB 3.31Å; L531-Q535 WeakPolarHBondContact O-CG 3.35Å; L531-Q535 PolarHBondContact O-N 3.36Å; Q535-A537 VanDerWaalsContact C-N 3.34Å; Q535-K611 PolarHBondContact O-NZ 2.92Å; Q535-V612 HydrophobicContact CG-CG1 4.16Å; Q535-E613 PolarHBondContact NE2-O 3.04Å
536	R	93.4	Very high	94	Very high	190 Å²	190	66.9 Å²	66.9	72%	0.717	31%	0.305	S	S	*	.	H	α-helix	trans	-70.2	-31.3	-177.3	-170.2	-179.2	-60.9	149.8	3.4	112.3	S532 F533	S532-R536 WeakPolarHBondContact O-CB 3.5Å; S532-R536 PolarHBondContact O-N 3.15Å; F533-R536 PolarHBondContact O-N 3.02Å
537	A	92.4	Very high	94.2	Very high	25 Å²	25	62.2 Å²	62.2	21%	0.207	29%	0.285	C	S	.	.			trans	-68	134.3	177.1	0	0	0	0	0	111.2	F533 Q535 L540 K611	F533-A537 PolarHBondContact O-N 3.29Å; Q535-A537 VanDerWaalsContact C-N 3.34Å; A537-L540 HydrophobicContact CB-CD1 4.17Å; A537-L540 HydrophobicContact CB-CD2 3.38Å; A537-L540 HydrophobicContact CB-CG 3.58Å; A537-K611 WeakPolarHBondContact O-CD 3.33Å; A537-K611 PolarHBondContact O-NZ 3.16Å
538	E	91.2	Very high	94	Very high	155 Å²	155	65.9 Å²	65.9	72%	0.724	30%	0.301	S	S	*	.	S	Bend	trans	-71.9	-45.2	177.4	-174.1	-176.8	178	0	0	112	K611	E538-K611 WeakPolarHBondContact O-CD 3.4Å
539	R	94.2	Very high	94	Very high	89 Å²	89	59.4 Å²	59.4	34%	0.336	28%	0.28	S	S	.	.			trans	-140.6	134.8	172.3	-66.6	-67.6	-177	-99.9	1.7	108.3	E609 I610 Y626	R539-E609 HydrophobicContact CB-CB 4.45Å; R539-E609 HydrophobicContact CB-CG 4.5Å; R539-I610 CarbonylContact C-O 3.59Å; R539-I610 WeakPolarHBondContact CA-O 3.37Å; R539-Y626 VanDerWaalsContact NE-CE2 3.33Å; R539-Y626 PolarHBondContact NH1-OH 3.24Å; R539-Y626 PolarHBondContact NH2-OH 3.49Å; R539-Y626 VanDerWaalsContact NH2-OH 3.12Å
540	L	96.9	Very high	93.9	Very high	6 Å²	6	53.5 Å²	53.5	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.4	174.6	-67.9	164.1	0	0	0	108.7	L534 A537 G542 I557 E609 I610	L534-L540 HydrophobicContact CB-CD1 4.25Å; L534-L540 HydrophobicContact CD2-CD1 3.67Å; A537-L540 HydrophobicContact CB-CD1 4.17Å; A537-L540 HydrophobicContact CB-CD2 3.38Å; A537-L540 HydrophobicContact CB-CG 3.58Å; L540-G542 PolarHBondContact O-N 3Å; L540-I557 HydrophobicContact CB-CG2 4.28Å; L540-I557 HydrophobicContact CD1-CD1 4.32Å; L540-E609 CarbonylContact O-C 3.45Å; L540-E609 VanDerWaalsContact O-CA 3.27Å; L540-E609 WeakPolarHBondContact O-CA 3.21Å; L540-I610 HydrophobicContact CB-CG1 3.8Å; L540-I610 HydrophobicContact CD1-CG1 4.39Å; L540-I610 PolarHBondContact N-O 2.91Å; L540-I610 PolarHBondContact O-N 3.38Å
541	D	97.2	Very high	93.8	Very high	113 Å²	113	52.3 Å²	52.3	60%	0.604	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	128.8	170.6	-67.7	-47	0	0	0	109.7	I557 P558	D541-I557 WeakPolarHBondContact O-CG2 3.21Å; D541-P558 WeakPolarHBondContact O-CD 3.3Å
542	G	96.7	Very high	93.9	Very high	3 Å²	3	54.7 Å²	54.7	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	162	-179.5	0	0	0	0	0	112.6	L540 Y556 N607 V608	L540-G542 PolarHBondContact O-N 3Å; G542-Y556 CarbonylContact C-O 3.6Å; G542-Y556 WeakPolarHBondContact CA-O 3.22Å; G542-N607 CarbonylContact O-C 3.49Å; G542-N607 WeakPolarHBondContact O-CA 3.38Å; G542-V608 PolarHBondContact N-O 3.13Å; G542-V608 PolarHBondContact O-N 3.42Å; G542-V608 VanDerWaalsContact O-O 3.11Å
543	V	97	Very high	94.1	Very high	7 Å²	7	52.1 Å²	52.1	4%	0.042	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	124.6	169.1	-176.9	0	0	0	0	107.6	E545 I555 Y556 R606	V543-E545 PolarHBondContact O-N 2.82Å; V543-I555 CarbonylContact O-C 3.58Å; V543-I555 WeakPolarHBondContact O-CA 3.45Å; V543-Y556 PolarHBondContact N-O 3.16Å; V543-Y556 PolarHBondContact O-N 2.85Å; V543-R606 WeakPolarHBondContact CA-O 3.29Å
544	V	97.3	Very high	94.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	99.5	174.4	178.6	0	0	0	0	108.2	V547 F553 R554 C603 Q605 R606 V608 L625	V544-V547 HydrophobicContact CG1-CG2 3.81Å; V544-F553 HydrophobicContact CG1-CD1 3.95Å; V544-R554 CarbonylContact C-O 3.49Å; V544-C603 WeakPolarHBondContact CB-O 3.22Å; V544-C603 HydrophobicContact CG2-CB 4.17Å; V544-Q605 WeakPolarHBondContact O-CA 3.24Å; V544-Q605 PolarHBondContact O-N 2.97Å; V544-R606 PolarHBondContact N-O 2.86Å; V544-R606 VanDerWaalsContact N-O 3.12Å; V544-V608 HydrophobicContact CG2-CB 4.38Å; V544-V608 HydrophobicContact CG2-CG1 3.72Å; V544-V608 HydrophobicContact CG2-CG2 3.71Å; V544-L625 HydrophobicContact CG2-CD1 4.07Å
545	E	94.2	Very high	94.4	Very high	20 Å²	20	48.4 Å²	48.4	9%	0.093	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-34.6	177.5	-73	-61	154.2	0	0	111.8	R422 V543 R554 M604	R422-E545 IonicContact CZ-OE1 3.98Å; R422-E545 IonicContact CZ-OE2 2.8Å; R422-E545 IonicContact NH1-OE1 2.72Å; R422-E545 PolarHBondContact NH1-OE1 2.81Å; R422-E545 IonicContact NH1-OE2 3.27Å; R422-E545 VanDerWaalsContact NH2-CD 3.31Å; R422-E545 IonicContact NH2-OE1 3.78Å; R422-E545 PolarHBondContact NH2-OE1 2.99Å; R422-E545 IonicContact NH2-OE2 3.14Å; R422-E545 PolarHBondContact NH2-OE2 2.75Å; V543-E545 PolarHBondContact O-N 2.82Å; E545-R554 HydrophobicContact CB-CB 4.43Å; E545-R554 HydrophobicContact CB-CG 4.31Å; E545-R554 PolarHBondContact N-O 3.31Å; E545-M604 WeakPolarHBondContact O-CE 3.49Å
546	F	93.4	Very high	94.5	Very high	79 Å²	79	45.7 Å²	45.7	35%	0.346	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	148.4	-179	-164.7	-101.1	0	0	0	112.3	F548 F553 R554 M604	F546-F548 AromaticContact CD1-CD1 3.63Å; F546-F548 HydrophobicContact CD1-CD1 3.63Å; F546-F548 HydrophobicContact CD1-CD2 4.23Å; F546-F548 AromaticContact CD1-CE1 3.68Å; F546-F548 HydrophobicContact CD1-CE1 3.68Å; F546-F548 HydrophobicContact CD1-CE2 4.33Å; F546-F548 AromaticContact CD1-CG 3.92Å; F546-F548 HydrophobicContact CD1-CG 3.92Å; F546-F548 HydrophobicContact CD1-CZ 4.06Å; F546-F548 AromaticContact CE1-CD1 3.65Å; F546-F548 HydrophobicContact CE1-CD1 3.65Å; F546-F548 AromaticContact CE1-CE1 3.97Å; F546-F548 HydrophobicContact CE1-CE1 3.97Å; F546-F548 HydrophobicContact CE1-CG 4.18Å; F546-F553 CarbonylContact O-C 3.56Å; F546-F553 WeakPolarHBondContact O-CA 3.41Å; F546-R554 HydrophobicContact CB-CB 3.8Å; F546-R554 PolarHBondContact N-O 3.37Å; F546-R554 PolarHBondContact O-N 2.8Å; F546-M604 HydrophobicContact CD2-CE 3.86Å
547	V	93.5	Very high	94.6	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	115.7	172.8	-179.3	0	0	0	0	108.1	V544 S549 F553 Y596 V599 M604	V544-V547 HydrophobicContact CG1-CG2 3.81Å; V547-S549 VanDerWaalsContact CG1-O 3.24Å; V547-S549 WeakPolarHBondContact CG1-O 3.33Å; V547-F553 HydrophobicContact CG1-CD1 4.45Å; V547-F553 HydrophobicContact CG1-CE1 4.17Å; V547-F553 HydrophobicContact CG2-CD1 3.99Å; V547-F553 HydrophobicContact CG2-CE1 4.06Å; V547-Y596 HydrophobicContact CB-CE2 4.3Å; V547-Y596 HydrophobicContact CG1-CD2 3.95Å; V547-Y596 HydrophobicContact CG1-CE2 3.95Å; V547-Y596 WeakPolarHBondContact O-CE2 3.47Å; V547-V599 HydrophobicContact CG1-CG1 3.83Å; V547-V599 HydrophobicContact CG2-CG1 4.43Å; V547-M604 HydrophobicContact CG2-CB 4.5Å; V547-M604 HydrophobicContact CG2-SD 4.08Å
548	F	88.9	Confident	94.7	Very high	76 Å²	76	38.1 Å²	38.1	33%	0.333	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-37	177.7	-62.3	-80.7	0	0	0	111.9	F546 R552 R554	F546-F548 AromaticContact CD1-CD1 3.63Å; F546-F548 HydrophobicContact CD1-CD1 3.63Å; F546-F548 HydrophobicContact CD1-CD2 4.23Å; F546-F548 AromaticContact CD1-CE1 3.68Å; F546-F548 HydrophobicContact CD1-CE1 3.68Å; F546-F548 HydrophobicContact CD1-CE2 4.33Å; F546-F548 AromaticContact CD1-CG 3.92Å; F546-F548 HydrophobicContact CD1-CG 3.92Å; F546-F548 HydrophobicContact CD1-CZ 4.06Å; F546-F548 AromaticContact CE1-CD1 3.65Å; F546-F548 HydrophobicContact CE1-CD1 3.65Å; F546-F548 AromaticContact CE1-CE1 3.97Å; F546-F548 HydrophobicContact CE1-CE1 3.97Å; F546-F548 HydrophobicContact CE1-CG 4.18Å; F548-R552 HydrophobicContact CB-CB 4.1Å; F548-R552 HydrophobicContact CB-CG 3.89Å; F548-R552 HydrophobicContact CD2-CG 3.84Å; F548-R552 HydrophobicContact CG-CG 4.21Å; F548-R552 PolarHBondContact N-O 2.91Å; F548-R554 HydrophobicContact CE2-CB 3.69Å; F548-R554 HydrophobicContact CZ-CB 4.13Å
549	S	90.7	Very high	94.8	Very high	20 Å²	20	41.2 Å²	41.2	14%	0.14	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	177.9	175.4	70.2	0	0	0	0	109.2	V547 S551 R552	V547-S549 VanDerWaalsContact CG1-O 3.24Å; V547-S549 WeakPolarHBondContact CG1-O 3.33Å; S549-S551 PolarHBondContact O-N 2.78Å; S549-S551 VanDerWaalsContact O-N 3.09Å; S549-S551 PolarHBondContact OG-N 2.91Å; S549-R552 PolarHBondContact N-O 3.39Å; S549-R552 PolarHBondContact O-N 2.82Å; S549-R552 VanDerWaalsContact OG-CB 3.3Å; S549-R552 WeakPolarHBondContact OG-CB 3.44Å; S549-R552 PolarHBondContact OG-N 2.83Å
550	A	91.6	Very high	94.7	Very high	4 Å²	4	39.2 Å²	39.2	3%	0.033	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.3	176	0	0	0	0	0	113.6	F553 C573 A595 V599 L666	A550-F553 WeakPolarHBondContact O-CZ 3.41Å; A550-C573 HydrophobicContact CB-CB 4.21Å; A550-A595 HydrophobicContact CB-CB 3.77Å; A550-V599 HydrophobicContact CB-CG2 4.12Å; A550-L666 HydrophobicContact CB-CD1 4.46Å; A550-L666 VanDerWaalsContact O-CD1 3.27Å; A550-L666 WeakPolarHBondContact O-CD1 3.46Å
551	S	93.8	Very high	94.5	Very high	25 Å²	25	42.2 Å²	42.2	18%	0.175	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	8	-178	59.9	0	0	0	0	114.8	S549 L567 L568	S549-S551 PolarHBondContact O-N 2.78Å; S549-S551 VanDerWaalsContact O-N 3.09Å; S549-S551 PolarHBondContact OG-N 2.91Å; S551-L567 CarbonylContact O-C 3.57Å; S551-L567 WeakPolarHBondContact O-CA 3.17Å; S551-L568 PolarHBondContact O-N 3.21Å
552	R	94.6	Very high	94.4	Very high	80 Å²	80	36.9 Å²	36.9	30%	0.302	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	126	-176.7	-176.5	178.7	-178.6	-171.6	3.4	112.4	F548 S549 T565 L566 L567	F548-R552 HydrophobicContact CB-CB 4.1Å; F548-R552 HydrophobicContact CB-CG 3.89Å; F548-R552 HydrophobicContact CD2-CG 3.84Å; F548-R552 HydrophobicContact CG-CG 4.21Å; F548-R552 PolarHBondContact N-O 2.91Å; S549-R552 PolarHBondContact N-O 3.39Å; S549-R552 PolarHBondContact O-N 2.82Å; S549-R552 VanDerWaalsContact OG-CB 3.3Å; S549-R552 WeakPolarHBondContact OG-CB 3.44Å; S549-R552 PolarHBondContact OG-N 2.83Å; R552-T565 HydrophobicContact CG-CG2 3.95Å; R552-L566 CarbonylContact C-O 2.86Å; R552-L566 WeakPolarHBondContact CA-O 3.41Å; R552-L567 HydrophobicContact CB-CD2 3.85Å; R552-L567 HydrophobicContact CG-CD2 3.59Å
553	F	97.1	Very high	94.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.5	-170.2	-56.2	-91	0	0	0	112.1	V544 F546 V547 A550 I555 T565 L566 L568 V599 L625 L662	V544-F553 HydrophobicContact CG1-CD1 3.95Å; F546-F553 CarbonylContact O-C 3.56Å; F546-F553 WeakPolarHBondContact O-CA 3.41Å; V547-F553 HydrophobicContact CG1-CD1 4.45Å; V547-F553 HydrophobicContact CG1-CE1 4.17Å; V547-F553 HydrophobicContact CG2-CD1 3.99Å; V547-F553 HydrophobicContact CG2-CE1 4.06Å; A550-F553 WeakPolarHBondContact O-CZ 3.41Å; F553-I555 HydrophobicContact CB-CD1 3.93Å; F553-I555 HydrophobicContact CB-CG1 3.77Å; F553-T565 CarbonylContact O-C 3.52Å; F553-T565 VanDerWaalsContact O-CA 3.25Å; F553-T565 WeakPolarHBondContact O-CA 3.47Å; F553-L566 HydrophobicContact CB-CB 4.46Å; F553-L566 PolarHBondContact N-O 2.85Å; F553-L566 PolarHBondContact O-N 3.32Å; F553-L568 HydrophobicContact CD2-CG 4.46Å; F553-L568 HydrophobicContact CE2-CD1 3.91Å; F553-L568 HydrophobicContact CE2-CD2 4.03Å; F553-L568 HydrophobicContact CE2-CG 3.75Å; F553-L568 HydrophobicContact CZ-CD1 4.42Å; F553-V599 HydrophobicContact CE1-CG1 3.28Å; F553-V599 HydrophobicContact CZ-CG1 3.43Å; F553-V599 VanDerWaalsContact CZ-CG1 3.43Å; F553-L625 HydrophobicContact CD1-CD1 4.32Å; F553-L625 HydrophobicContact CD2-CD1 4.47Å; F553-L625 HydrophobicContact CE1-CD1 4.43Å; F553-L625 HydrophobicContact CG-CD1 4.34Å; F553-L662 HydrophobicContact CE1-CD2 4.22Å; F553-L662 HydrophobicContact CE2-CD2 4.27Å; F553-L662 HydrophobicContact CZ-CD2 3.57Å
554	R	95.8	Very high	94.2	Very high	50 Å²	50	36.4 Å²	36.4	19%	0.189	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	121	160.8	-167.9	174.8	174.2	94.7	4.2	107.7	D519 T521 V544 E545 F546 F548 V563 I564	D519-R554 VanDerWaalsContact CG-NH2 3.35Å; D519-R554 IonicContact OD1-NH1 2.72Å; D519-R554 IonicContact OD1-NH2 2.72Å; D519-R554 IonicContact OD2-CZ 3.27Å; D519-R554 IonicContact OD2-NH1 2.88Å; D519-R554 IonicContact OD2-NH2 3.94Å; D519-R554 PolarHBondContact OD2-NH2 2.8Å; T521-R554 PolarHBondContact OG1-NH1 2.72Å; V544-R554 CarbonylContact C-O 3.49Å; E545-R554 HydrophobicContact CB-CB 4.43Å; E545-R554 HydrophobicContact CB-CG 4.31Å; E545-R554 PolarHBondContact N-O 3.31Å; F546-R554 HydrophobicContact CB-CB 3.8Å; F546-R554 PolarHBondContact N-O 3.37Å; F546-R554 PolarHBondContact O-N 2.8Å; F548-R554 HydrophobicContact CE2-CB 3.69Å; F548-R554 HydrophobicContact CZ-CB 4.13Å; R554-V563 HydrophobicContact CG-CG1 3.52Å; R554-I564 CarbonylContact C-O 2.74Å; R554-I564 WeakPolarHBondContact CA-O 3.15Å
555	I	97.5	Very high	94.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	123.4	-173.4	-55	-176	0	0	0	109.6	V543 F553 I557 V563 I564 L566 I610 L625	V543-I555 CarbonylContact O-C 3.58Å; V543-I555 WeakPolarHBondContact O-CA 3.45Å; F553-I555 HydrophobicContact CB-CD1 3.93Å; F553-I555 HydrophobicContact CB-CG1 3.77Å; I555-I557 HydrophobicContact CG2-CG1 4.36Å; I555-V563 CarbonylContact O-C 3.1Å; I555-V563 VanDerWaalsContact O-CA 3.3Å; I555-V563 WeakPolarHBondContact O-CA 3.28Å; I555-I564 HydrophobicContact CB-CG1 4.13Å; I555-I564 PolarHBondContact N-O 2.87Å; I555-I564 PolarHBondContact O-N 3.08Å; I555-L566 HydrophobicContact CD1-CB 3.74Å; I555-L566 HydrophobicContact CD1-CD2 3.52Å; I555-L566 HydrophobicContact CD1-CG 4.27Å; I555-L566 HydrophobicContact CG1-CB 4.37Å; I555-I610 HydrophobicContact CD1-CD1 4.46Å; I555-I610 HydrophobicContact CD1-CG2 3.68Å; I555-I610 HydrophobicContact CG2-CD1 4.31Å; I555-L625 HydrophobicContact CD1-CD1 4.07Å
556	Y	96.9	Very high	94.3	Very high	17 Å²	17	35.7 Å²	35.7	7%	0.067	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	127.9	167.9	174.2	-129	0	0	0	109.2	F419 V517 G542 V543 P558 C562 V563	F419-Y556 AromaticContact CE2-CE1 3.98Å; F419-Y556 HydrophobicContact CE2-CE1 3.98Å; F419-Y556 AromaticContact CZ-CE1 3.97Å; F419-Y556 HydrophobicContact CZ-CE1 3.97Å; V517-Y556 HydrophobicContact CB-CE2 4.45Å; V517-Y556 HydrophobicContact CG1-CD2 3.93Å; V517-Y556 HydrophobicContact CG1-CE2 3.78Å; V517-Y556 HydrophobicContact CG2-CE2 3.75Å; G542-Y556 CarbonylContact C-O 3.6Å; G542-Y556 WeakPolarHBondContact CA-O 3.22Å; V543-Y556 PolarHBondContact N-O 3.16Å; V543-Y556 PolarHBondContact O-N 2.85Å; Y556-P558 HydrophobicContact CD1-CG 4.02Å; Y556-P558 HydrophobicContact CE1-CB 4.02Å; Y556-P558 HydrophobicContact CE1-CG 3.8Å; Y556-P558 WeakPolarHBondContact O-CD 3.49Å; Y556-C562 WeakPolarHBondContact CD2-O 3.46Å; Y556-V563 HydrophobicContact CD2-CG2 3.82Å; Y556-V563 HydrophobicContact CG-CG2 4.35Å
557	I	96.6	Very high	94.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	101.7	178.8	-47.2	180	0	0	0	107	L534 L540 D541 I555 R559 E560 T561 C562 I564 I610	L534-I557 HydrophobicContact CD2-CD1 3.75Å; L540-I557 HydrophobicContact CB-CG2 4.28Å; L540-I557 HydrophobicContact CD1-CD1 4.32Å; D541-I557 WeakPolarHBondContact O-CG2 3.21Å; I555-I557 HydrophobicContact CG2-CG1 4.36Å; I557-R559 PolarHBondContact O-N 2.96Å; I557-E560 HydrophobicContact CG2-CB 4.23Å; I557-E560 HydrophobicContact CG2-CG 4.49Å; I557-E560 WeakPolarHBondContact CG2-OE2 3.47Å; I557-T561 PolarHBondContact O-N 2.9Å; I557-C562 PolarHBondContact N-O 3.04Å; I557-C562 PolarHBondContact O-N 3.1Å; I557-I564 HydrophobicContact CD1-CD1 3.93Å; I557-I564 HydrophobicContact CD1-CG1 4.1Å; I557-I564 HydrophobicContact CD1-CG2 4.37Å; I557-I610 HydrophobicContact CD1-CD1 3.85Å; I557-I610 HydrophobicContact CG1-CD1 4.33Å
558	P	93.5	Very high	94.6	Very high	56 Å²	56	34.3 Å²	34.3	36%	0.364	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-39.5	-168.9	-25.1	34.8	0	0	0	114.2	D541 Y556 T561	D541-P558 WeakPolarHBondContact O-CD 3.3Å; Y556-P558 HydrophobicContact CD1-CG 4.02Å; Y556-P558 HydrophobicContact CE1-CB 4.02Å; Y556-P558 HydrophobicContact CE1-CG 3.8Å; Y556-P558 WeakPolarHBondContact O-CD 3.49Å; P558-T561 WeakPolarHBondContact O-CG2 3.3Å; P558-T561 PolarHBondContact O-N 3.38Å
559	R	92.9	Very high	94.8	Very high	219 Å²	219	31 Å²	31	83%	0.826	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-39.5	-176.2	177.1	-177	-172.5	175.8	1.4	112	I557 T561	I557-R559 PolarHBondContact O-N 2.96Å; R559-T561 VanDerWaalsContact C-N 3.3Å
560	E	92.5	Very high	94.8	Very high	47 Å²	47	30.3 Å²	30.3	22%	0.22	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-3.1	177.7	-69.9	65.8	-151	0	0	111.9	L534 I557 C562	L534-E560 HydrophobicContact CD2-CG 4.18Å; I557-E560 HydrophobicContact CG2-CB 4.23Å; I557-E560 HydrophobicContact CG2-CG 4.49Å; I557-E560 WeakPolarHBondContact CG2-OE2 3.47Å; E560-C562 PolarHBondContact O-N 2.85Å
561	T	92.8	Very high	94.9	Very high	70 Å²	70	30.6 Å²	30.6	43%	0.429	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	41.6	179.6	58.5	0	0	0	0	112.6	V517 A518 I557 P558 R559	V517-T561 CarbonylContact C-O 3.41Å; V517-T561 WeakPolarHBondContact CA-O 3.11Å; A518-T561 PolarHBondContact N-O 3.04Å; I557-T561 PolarHBondContact O-N 2.9Å; P558-T561 WeakPolarHBondContact O-CG2 3.3Å; P558-T561 PolarHBondContact O-N 3.38Å; R559-T561 VanDerWaalsContact C-N 3.3Å
562	C	94.4	Very high	94.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154.4	-176.5	68.6	0	0	0	0	113.1	A518 L520 F530 Y556 I557 E560	A518-C562 HydrophobicContact CB-CB 4.11Å; A518-C562 CarbonylContact O-C 3.53Å; A518-C562 WeakPolarHBondContact O-CA 3.35Å; A518-C562 VanDerWaalsContact O-CB 3.28Å; A518-C562 WeakPolarHBondContact O-CB 3.37Å; L520-C562 HydrophobicContact CD1-CB 4.11Å; L520-C562 HydrophobicContact CG-CB 4.33Å; F530-C562 HydrophobicContact CD1-CB 4.22Å; F530-C562 HydrophobicContact CE1-CB 3.91Å; Y556-C562 WeakPolarHBondContact CD2-O 3.46Å; I557-C562 PolarHBondContact N-O 3.04Å; I557-C562 PolarHBondContact O-N 3.1Å; E560-C562 PolarHBondContact O-N 2.85Å
563	V	95.4	Very high	94.4	Very high	1 Å²	1	30 Å²	30	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	129.8	171.2	176.5	0	0	0	0	109	Y413 V517 A518 L520 T521 R554 I555 Y556	Y413-V563 HydrophobicContact CE2-CG2 4.3Å; V517-V563 HydrophobicContact CG1-CB 4.49Å; V517-V563 HydrophobicContact CG1-CG2 3.59Å; A518-V563 PolarHBondContact O-N 3.08Å; L520-V563 WeakPolarHBondContact CB-O 3.33Å; L520-V563 PolarHBondContact N-O 3.36Å; T521-V563 HydrophobicContact CG2-CG1 4.45Å; R554-V563 HydrophobicContact CG-CG1 3.52Å; I555-V563 CarbonylContact O-C 3.1Å; I555-V563 VanDerWaalsContact O-CA 3.3Å; I555-V563 WeakPolarHBondContact O-CA 3.28Å; Y556-V563 HydrophobicContact CD2-CG2 3.82Å; Y556-V563 HydrophobicContact CG-CG2 4.35Å
564	I	95.9	Very high	93.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	158.4	180	63.4	163.3	0	0	0	111.9	L520 L534 R554 I555 I557 L566 I610 V612 F621	L520-I564 HydrophobicContact CB-CG2 4.3Å; L520-I564 HydrophobicContact CD1-CG2 3.81Å; L520-I564 HydrophobicContact CG-CG2 4.4Å; L534-I564 HydrophobicContact CD1-CG2 4.12Å; R554-I564 CarbonylContact C-O 2.74Å; R554-I564 WeakPolarHBondContact CA-O 3.15Å; I555-I564 HydrophobicContact CB-CG1 4.13Å; I555-I564 PolarHBondContact N-O 2.87Å; I555-I564 PolarHBondContact O-N 3.08Å; I557-I564 HydrophobicContact CD1-CD1 3.93Å; I557-I564 HydrophobicContact CD1-CG1 4.1Å; I557-I564 HydrophobicContact CD1-CG2 4.37Å; I564-L566 HydrophobicContact CD1-CB 4.33Å; I564-I610 HydrophobicContact CD1-CD1 3.7Å; I564-V612 HydrophobicContact CD1-CG2 4.33Å; I564-F621 HydrophobicContact CB-CD2 3.66Å; I564-F621 HydrophobicContact CB-CE2 3.99Å; I564-F621 HydrophobicContact CD1-CB 4.22Å; I564-F621 HydrophobicContact CD1-CD2 4.27Å; I564-F621 HydrophobicContact CD1-CG 4.36Å; I564-F621 HydrophobicContact CG2-CD2 3.69Å; I564-F621 HydrophobicContact CG2-CE2 3.53Å; I564-F621 HydrophobicContact CG2-CZ 4.31Å
565	T	96.1	Very high	92.9	Very high	4 Å²	4	35 Å²	35	3%	0.025	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	117.9	158.1	-63.7	0	0	0	0	108.3	T521 R552 F553 N620 F621	T521-T565 WeakPolarHBondContact CG2-OG1 3.36Å; R552-T565 HydrophobicContact CG-CG2 3.95Å; F553-T565 CarbonylContact O-C 3.52Å; F553-T565 VanDerWaalsContact O-CA 3.25Å; F553-T565 WeakPolarHBondContact O-CA 3.47Å; T565-N620 VanDerWaalsContact CB-OD1 3.3Å; T565-N620 WeakPolarHBondContact CB-OD1 3.49Å; T565-N620 HydrophobicContact CG2-CB 4.13Å; T565-N620 VanDerWaalsContact CG2-OD1 3.3Å; T565-N620 WeakPolarHBondContact CG2-OD1 3.38Å; T565-F621 PolarHBondContact O-N 3Å
566	L	97.5	Very high	91.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.1	175.3	-176	73	0	0	0	110	R552 F553 I555 I564 I610 F621 L625	R552-L566 CarbonylContact C-O 2.86Å; R552-L566 WeakPolarHBondContact CA-O 3.41Å; F553-L566 HydrophobicContact CB-CB 4.46Å; F553-L566 PolarHBondContact N-O 2.85Å; F553-L566 PolarHBondContact O-N 3.32Å; I555-L566 HydrophobicContact CD1-CB 3.74Å; I555-L566 HydrophobicContact CD1-CD2 3.52Å; I555-L566 HydrophobicContact CD1-CG 4.27Å; I555-L566 HydrophobicContact CG1-CB 4.37Å; I564-L566 HydrophobicContact CD1-CB 4.33Å; L566-I610 HydrophobicContact CD2-CB 4.18Å; L566-I610 HydrophobicContact CD2-CG2 3.82Å; L566-F621 CarbonylContact C-O 3.55Å; L566-F621 WeakPolarHBondContact CA-O 3.45Å; L566-F621 HydrophobicContact CD1-CB 4.43Å; L566-L625 HydrophobicContact CD2-CB 4.28Å
567	L	96.3	Very high	90.3	Very high	42 Å²	42	39.1 Å²	39.1	22%	0.22	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.5	166.9	-57.4	177.1	0	0	0	108.6	S551 R552 G569 N620 F621 V622 G623	S551-L567 CarbonylContact O-C 3.57Å; S551-L567 WeakPolarHBondContact O-CA 3.17Å; R552-L567 HydrophobicContact CB-CD2 3.85Å; R552-L567 HydrophobicContact CG-CD2 3.59Å; L567-G569 PolarHBondContact O-N 2.96Å; L567-N620 HydrophobicContact CD1-CB 3.91Å; L567-N620 HydrophobicContact CG-CB 4.05Å; L567-F621 PolarHBondContact N-O 3.27Å; L567-V622 HydrophobicContact CB-CG2 4.31Å; L567-V622 HydrophobicContact CD1-CG2 4.33Å; L567-V622 WeakPolarHBondContact O-CA 3.05Å; L567-G623 PolarHBondContact O-N 3.5Å
568	L	96.4	Very high	88.4	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.052	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	125.5	174.1	-65.8	-176.3	0	0	0	110.5	S551 F553 I571 G623 L625 L662 L666	S551-L568 PolarHBondContact O-N 3.21Å; F553-L568 HydrophobicContact CD2-CG 4.46Å; F553-L568 HydrophobicContact CE2-CD1 3.91Å; F553-L568 HydrophobicContact CE2-CD2 4.03Å; F553-L568 HydrophobicContact CE2-CG 3.75Å; F553-L568 HydrophobicContact CZ-CD1 4.42Å; L568-I571 HydrophobicContact CB-CG2 3.48Å; L568-I571 VanDerWaalsContact CB-CG2 3.48Å; L568-I571 HydrophobicContact CD1-CG2 4.41Å; L568-G623 CarbonylContact C-O 3.5Å; L568-G623 VanDerWaalsContact CA-O 3.29Å; L568-G623 WeakPolarHBondContact CA-O 3.13Å; L568-L625 HydrophobicContact CD2-CB 3.86Å; L568-L662 HydrophobicContact CD1-CB 4.46Å; L568-L662 HydrophobicContact CD1-CD2 4.16Å; L568-L662 HydrophobicContact CD1-CG 4.12Å; L568-L666 HydrophobicContact CD1-CD1 3.87Å
569	G	92.9	Very high	86.3	Confident	5 Å²	5	47.1 Å²	47.1	5%	0.052	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	146.3	174.4	0	0	0	0	0	111.6	L567 I571 G623 Y624 S663	L567-G569 PolarHBondContact O-N 2.96Å; G569-I571 VanDerWaalsContact C-N 3.27Å; G569-I571 PolarHBondContact O-N 3.46Å; G569-G623 PolarHBondContact N-O 3.34Å; G569-Y624 WeakPolarHBondContact O-CE1 3.41Å; G569-S663 PolarHBondContact O-OG 3.28Å
570	G	90.6	Very high	84	Confident	6 Å²	6	37.2 Å²	37.2	6%	0.062	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	3.2	170.5	0	0	0	0	0	117.1	H675	G570-H675 PolarHBondContact O-N 3.18Å
571	I	92.9	Very high	81.6	Confident	11 Å²	11	37.1 Å²	37.1	6%	0.056	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.9	-176.5	-172.7	175.2	0	0	0	111.6	L568 G569 C573 L666 I667 T673	L568-I571 HydrophobicContact CB-CG2 3.48Å; L568-I571 VanDerWaalsContact CB-CG2 3.48Å; L568-I571 HydrophobicContact CD1-CG2 4.41Å; G569-I571 VanDerWaalsContact C-N 3.27Å; G569-I571 PolarHBondContact O-N 3.46Å; I571-C573 VanDerWaalsContact CD1-SG 3.57Å; I571-L666 HydrophobicContact CD1-CB 3.6Å; I571-L666 HydrophobicContact CD1-CD1 4.15Å; I571-I667 HydrophobicContact CB-CD1 4.27Å; I571-I667 HydrophobicContact CD1-CD1 4.3Å; I571-I667 HydrophobicContact CD1-CG1 3.73Å; I571-I667 HydrophobicContact CG1-CD1 4.12Å; I571-I667 HydrophobicContact CG1-CG1 3.84Å; I571-T673 WeakPolarHBondContact CA-O 3.45Å
572	Q	90.7	Very high	79.1	Confident	83 Å²	83	34 Å²	34	39%	0.388	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111.5	167.6	-176.6	60.8	38.6	0	0	109	G672 T673 H675	Q572-G672 CarbonylContact O-C 3.53Å; Q572-G672 WeakPolarHBondContact O-CA 3.39Å; Q572-T673 PolarHBondContact N-O 3.2Å; Q572-T673 PolarHBondContact O-N 2.88Å; Q572-H675 HydrophobicContact CB-CB 4.47Å
573	C	88.9	Confident	76.5	Confident	8 Å²	8	34.6 Å²	34.6	5%	0.054	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-96.8	148.1	176.3	-74.5	0	0	0	0	111.3	A550 I571 R575 F671	A550-C573 HydrophobicContact CB-CB 4.21Å; I571-C573 VanDerWaalsContact CD1-SG 3.57Å; C573-R575 PolarHBondContact O-N 2.74Å; C573-F671 PolarHBondContact SG-O 2.91Å; C573-F671 VanDerWaalsContact SG-O 3.39Å
574	P	81.4	Confident	73.9	Confident	14 Å²	14	36.2 Å²	36.2	9%	0.091	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-62.1	135.1	172.6	27.5	-31.2	0	0	0	109.1	M589 S592 F671 L703	P574-M589 HydrophobicContact CB-CB 3.88Å; P574-S592 WeakPolarHBondContact O-CB 3.39Å; P574-F671 WeakPolarHBondContact CD-O 3.25Å; P574-L703 HydrophobicContact CB-CD2 4.26Å; P574-L703 HydrophobicContact CG-CD1 4.32Å; P574-L703 HydrophobicContact CG-CD2 4.19Å
575	R	78.2	Confident	71.5	Confident	142 Å²	142	39.5 Å²	39.5	54%	0.536	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-79.8	131.1	-174.8	-62.9	177.7	-178	172.8	1.7	109	C573 M589 S592	C573-R575 PolarHBondContact O-N 2.74Å; R575-M589 HydrophobicContact CB-CG 4.42Å; R575-M589 HydrophobicContact CB-SD 3.86Å; R575-M589 HydrophobicContact CG-SD 4.23Å; R575-M589 PolarHBondContact N-SD 3.03Å; R575-M589 WeakPolarHBondContact O-CB 3.12Å; R575-M589 WeakPolarHBondContact O-CG 3.41Å; R575-M589 PolarHBondContact O-N 3.44Å; R575-S592 VanDerWaalsContact C-CB 3.47Å; R575-S592 WeakPolarHBondContact O-CB 3.3Å; R575-S592 PolarHBondContact O-OG 3.05Å
576	R	76.2	Confident	69.6	Low	78 Å²	78	42.3 Å²	42.3	29%	0.294	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-62	153.4	166.3	-67.3	-175.6	73.8	-146.6	-8.8	109.7	R578 D588 S592 N593	R576-R578 PolarHBondContact O-N 3.17Å; R576-D588 WeakPolarHBondContact CA-OD1 3.46Å; R576-S592 WeakPolarHBondContact CA-OG 3.49Å; R576-N593 PolarHBondContact NE-OD1 3.41Å; R576-N593 PolarHBondContact NH2-OD1 3.35Å
577	G	63.7	Low	68.2	Low	26 Å²	26	47.4 Å²	47.4	27%	0.268	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-56.5	121	171.2	0	0	0	0	0	108	L586 D588	G577-L586 WeakPolarHBondContact CA-O 3.47Å; G577-D588 PolarHBondContact N-OD1 2.79Å
578	R	57.9	Low	66.9	Low	129 Å²	129	48.5 Å²	48.5	49%	0.487	26%	0.264	S	S	.	.			trans	-109	151.3	169.3	-61.2	-178.9	-146.9	-141.7	6.7	105.5	R576 G580 A585 L586	R576-R578 PolarHBondContact O-N 3.17Å; R578-G580 VanDerWaalsContact C-N 3.33Å; R578-G580 PolarHBondContact O-N 2.94Å; R578-A585 CarbonylContact O-C 3.4Å; R578-A585 WeakPolarHBondContact O-CA 3.37Å; R578-L586 PolarHBondContact O-N 2.94Å
579	I	49.7	Very low	66.1	Low	95 Å²	95	52.7 Å²	52.7	49%	0.487	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-55.1	116.1	148.9	-66.8	153.2	0	0	0	103.5	N935	I579-N935 VanDerWaalsContact CD1-ND2 3.26Å; I579-N935 WeakPolarHBondContact CD1-ND2 3.28Å
580	G	44.7	Very low	65.3	Low	10 Å²	10	56.5 Å²	56.5	10%	0.103	31%	0.308	C	S	.	.			trans	-56	-171.6	175.7	0	0	0	0	0	109.5	R578 D582 V584	R578-G580 VanDerWaalsContact C-N 3.33Å; R578-G580 PolarHBondContact O-N 2.94Å; G580-D582 PolarHBondContact O-N 3.48Å; G580-V584 PolarHBondContact N-O 3.32Å
581	P	41.4	Very low	65	Low	45 Å²	45	58.6 Å²	58.6	29%	0.292	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	8.9	159.4	-23.8	32.9	0	0	0	116	P981 I982	P581-P981 CarbonylContact O-C 3.5Å; P581-P981 WeakPolarHBondContact O-CA 3.41Å; P581-P981 WeakPolarHBondContact O-CB 3.3Å; P581-I982 CarbonylContact C-O 3.59Å; P581-I982 CarbonylContact O-C 3.53Å; P581-I982 PolarHBondContact O-N 3.39Å
582	D	39	Very low	64.6	Low	4 Å²	4	58.1 Å²	58.1	2%	0.021	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn		-162.9	8.2	-110.1	-122	16.7	0	0	0	109.7	G580 V584 I982 Q983 P984	G580-D582 PolarHBondContact O-N 3.48Å; D582-V584 PolarHBondContact O-N 3.21Å; D582-I982 WeakPolarHBondContact CA-O 3.48Å; D582-I982 WeakPolarHBondContact CB-O 3.35Å; D582-I982 VanDerWaalsContact CG-C 3.45Å; D582-I982 PolarHBondContact N-O 3.37Å; D582-Q983 HydrophobicContact CB-CB 4.45Å; D582-Q983 WeakPolarHBondContact O-CA 3.46Å; D582-Q983 WeakPolarHBondContact O-CB 3.43Å; D582-Q983 VanDerWaalsContact O-CD 3.23Å; D582-Q983 WeakPolarHBondContact O-CG 3.36Å; D582-Q983 WeakPolarHBondContact OD1-CA 3.38Å; D582-Q983 PolarHBondContact OD1-N 3.14Å; D582-Q983 VanDerWaalsContact OD1-O 3.07Å; D582-P984 HydrophobicContact CB-CG 3.97Å; D582-P984 WeakPolarHBondContact O-CD 3.48Å; D582-P984 WeakPolarHBondContact OD2-CA 3.29Å; D582-P984 WeakPolarHBondContact OD2-CB 3.39Å; D582-P984 WeakPolarHBondContact OD2-CD 3.42Å; D582-P984 WeakPolarHBondContact OD2-CG 3.13Å
583	G	41.4	Very low	64.2	Low	14 Å²	14	56.4 Å²	56.4	14%	0.144	31%	0.307	C	S	.	.	S	Bend	trans	57.9	-16.4	168.9	0	0	0	0	0	117.2	N935	G583-N935 WeakPolarHBondContact CA-OD1 3.5Å; G583-N935 PolarHBondContact O-OD1 3.18Å
584	V	40.5	Very low	64.1	Low	35 Å²	35	61 Å²	61	21%	0.212	33%	0.327	C	S	.	.	S	Bend	trans	-99.7	127.3	179.8	166.6	0	0	0	0	105	G580 D582 L586 Q983 P984 Q985	G580-V584 PolarHBondContact N-O 3.32Å; D582-V584 PolarHBondContact O-N 3.21Å; V584-L586 VanDerWaalsContact C-N 3.28Å; V584-L586 PolarHBondContact O-N 2.7Å; V584-Q983 HydrophobicContact CG2-CB 4.4Å; V584-P984 HydrophobicContact CB-CG 3.95Å; V584-P984 HydrophobicContact CG1-CG 4.07Å; V584-Q985 VanDerWaalsContact CG2-NE2 3.27Å
585	A	45.3	Very low	64.4	Low	68 Å²	68	60.3 Å²	60.3	56%	0.562	32%	0.323	S	S	*	.	B	Isolated β-bridge	trans	-54.6	101.7	164.4	0	0	0	0	0	107.3	R578	R578-A585 CarbonylContact O-C 3.4Å; R578-A585 WeakPolarHBondContact O-CA 3.37Å
586	L	57.1	Low	65	Low	64 Å²	64	54.7 Å²	54.7	34%	0.335	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-51.1	126.5	151.5	-73.1	169.2	0	0	0	104.5	G577 R578 V584	G577-L586 WeakPolarHBondContact CA-O 3.47Å; R578-L586 PolarHBondContact O-N 2.94Å; V584-L586 VanDerWaalsContact C-N 3.28Å; V584-L586 PolarHBondContact O-N 2.7Å
587	P	67.1	Low	65.6	Low	107 Å²	107	56.2 Å²	56.2	70%	0.695	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-59.8	151.2	-179.1	26.5	-33.5	0	0	0	108.6	M589	P587-M589 PolarHBondContact O-N 2.66Å
588	D	69.6	Low	66.9	Low	65 Å²	65	56.9 Å²	56.9	35%	0.348	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-50.3	127.2	166.3	-69.9	-65.7	0	0	0	109.3	R576 G577 S592 N593	R576-D588 WeakPolarHBondContact CA-OD1 3.46Å; G577-D588 PolarHBondContact N-OD1 2.79Å; D588-S592 WeakPolarHBondContact CB-OG 3.44Å; D588-N593 PolarHBondContact OD1-ND2 3.46Å; D588-N593 PolarHBondContact OD1-OD1 3Å; D588-N593 PolarHBondContact OD2-ND2 3.17Å
589	M	78.5	Confident	68.6	Low	97 Å²	97	50.7 Å²	50.7	48%	0.478	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-58.4	145.3	165.4	-66.5	-176.9	79.5	0	0	107.7	P574 R575 P587 F591 S592	P574-M589 HydrophobicContact CB-CB 3.88Å; R575-M589 HydrophobicContact CB-CG 4.42Å; R575-M589 HydrophobicContact CB-SD 3.86Å; R575-M589 HydrophobicContact CG-SD 4.23Å; R575-M589 PolarHBondContact N-SD 3.03Å; R575-M589 WeakPolarHBondContact O-CB 3.12Å; R575-M589 WeakPolarHBondContact O-CG 3.41Å; R575-M589 PolarHBondContact O-N 3.44Å; P587-M589 PolarHBondContact O-N 2.66Å; M589-F591 PolarHBondContact O-N 2.98Å; M589-S592 PolarHBondContact N-OG 3.24Å; M589-S592 WeakPolarHBondContact O-CB 3.43Å; M589-S592 PolarHBondContact O-N 3.1Å; M589-S592 PolarHBondContact O-OG 2.87Å
590	P	77.7	Confident	70.6	Confident	85 Å²	85	48.8 Å²	48.8	55%	0.552	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.7	137.4	177	-28.6	34.9	0	0	0	111.8	S592	P590-S592 PolarHBondContact O-N 2.81Å; P590-S592 VanDerWaalsContact O-N 3.13Å
591	F	82.3	Confident	72.7	Confident	50 Å²	50	53.4 Å²	53.4	22%	0.219	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	-1	-179	-52.9	-83.7	0	0	0	116.7	M589 E594 A595 G702 L703 S705	M589-F591 PolarHBondContact O-N 2.98Å; F591-E594 VanDerWaalsContact C-OE2 3.3Å; F591-E594 WeakPolarHBondContact CA-OE2 3.47Å; F591-A595 VanDerWaalsContact O-CB 3.24Å; F591-A595 WeakPolarHBondContact O-CB 3.48Å; F591-A595 PolarHBondContact O-N 3.24Å; F591-G702 WeakPolarHBondContact CE1-O 3.49Å; F591-G702 WeakPolarHBondContact CE2-O 3.24Å; F591-G702 WeakPolarHBondContact CZ-O 3.03Å; F591-L703 HydrophobicContact CB-CD2 4.31Å; F591-L703 HydrophobicContact CB-CG 4.49Å; F591-L703 HydrophobicContact CD2-CD2 3.93Å; F591-L703 HydrophobicContact CD2-CG 4.36Å; F591-S705 WeakPolarHBondContact CZ-OG 3.26Å
592	S	84.6	Confident	75.1	Confident	1 Å²	1	52 Å²	52	1%	0.007	28%	0.283	C	S	.	.	H	α-helix	trans	-68.8	-37.3	-178.1	63.9	0	0	0	0	114	P574 R575 R576 D588 M589 P590 Y596	P574-S592 WeakPolarHBondContact O-CB 3.39Å; R575-S592 VanDerWaalsContact C-CB 3.47Å; R575-S592 WeakPolarHBondContact O-CB 3.3Å; R575-S592 PolarHBondContact O-OG 3.05Å; R576-S592 WeakPolarHBondContact CA-OG 3.49Å; D588-S592 WeakPolarHBondContact CB-OG 3.44Å; M589-S592 PolarHBondContact N-OG 3.24Å; M589-S592 WeakPolarHBondContact O-CB 3.43Å; M589-S592 PolarHBondContact O-N 3.1Å; M589-S592 PolarHBondContact O-OG 2.87Å; P590-S592 PolarHBondContact O-N 2.81Å; P590-S592 VanDerWaalsContact O-N 3.13Å; S592-Y596 WeakPolarHBondContact O-CB 3.15Å; S592-Y596 PolarHBondContact O-N 3.46Å
593	N	83.9	Confident	77.7	Confident	47 Å²	47	51.8 Å²	51.8	25%	0.251	28%	0.282	S	S	.	.	H	α-helix	trans	-71.6	-40.9	175.7	-85.9	-30.5	0	0	0	111.4	R576 D588 Y596 M597	R576-N593 PolarHBondContact NE-OD1 3.41Å; R576-N593 PolarHBondContact NH2-OD1 3.35Å; D588-N593 PolarHBondContact OD1-ND2 3.46Å; D588-N593 PolarHBondContact OD1-OD1 3Å; D588-N593 PolarHBondContact OD2-ND2 3.17Å; N593-Y596 PolarHBondContact O-N 3.46Å; N593-M597 WeakPolarHBondContact O-CB 3.22Å; N593-M597 VanDerWaalsContact O-CG 3.24Å; N593-M597 WeakPolarHBondContact O-CG 3.4Å; N593-M597 PolarHBondContact O-N 3.3Å
594	E	85.1	Confident	80.2	Confident	105 Å²	105	51.3 Å²	51.3	49%	0.491	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-47.4	176.3	-66.8	79.7	177	0	0	110.4	F591 Y596 M597 F598 F671	F591-E594 VanDerWaalsContact C-OE2 3.3Å; F591-E594 WeakPolarHBondContact CA-OE2 3.47Å; E594-Y596 PolarHBondContact O-N 2.79Å; E594-M597 PolarHBondContact O-N 2.71Å; E594-F598 VanDerWaalsContact O-CB 3.23Å; E594-F598 WeakPolarHBondContact O-CB 3.16Å; E594-F598 PolarHBondContact O-N 3.04Å; E594-F671 HydrophobicContact CB-CE1 3.87Å; E594-F671 HydrophobicContact CB-CZ 4.44Å
595	A	89.2	Confident	82.9	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-46.1	175.1	0	0	0	0	0	112	A550 F591 V599 F671	A550-A595 HydrophobicContact CB-CB 3.77Å; F591-A595 VanDerWaalsContact O-CB 3.24Å; F591-A595 WeakPolarHBondContact O-CB 3.48Å; F591-A595 PolarHBondContact O-N 3.24Å; A595-V599 WeakPolarHBondContact O-CG2 3.39Å; A595-V599 PolarHBondContact O-N 3.02Å; A595-F671 HydrophobicContact CB-CB 3.65Å; A595-F671 HydrophobicContact CB-CD1 3.66Å; A595-F671 HydrophobicContact CB-CE1 4.45Å; A595-F671 HydrophobicContact CB-CG 3.7Å
596	Y	90.5	Very high	85.2	Confident	23 Å²	23	50.8 Å²	50.8	9%	0.09	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-46	177.9	163	-102.4	0	0	0	112.8	V547 S592 N593 E594 F598 V599 K600	V547-Y596 HydrophobicContact CB-CE2 4.3Å; V547-Y596 HydrophobicContact CG1-CD2 3.95Å; V547-Y596 HydrophobicContact CG1-CE2 3.95Å; V547-Y596 WeakPolarHBondContact O-CE2 3.47Å; S592-Y596 WeakPolarHBondContact O-CB 3.15Å; S592-Y596 PolarHBondContact O-N 3.46Å; N593-Y596 PolarHBondContact O-N 3.46Å; E594-Y596 PolarHBondContact O-N 2.79Å; Y596-F598 VanDerWaalsContact C-N 3.33Å; Y596-V599 PolarHBondContact O-N 3.05Å; Y596-K600 HydrophobicContact CE1-CD 4.42Å; Y596-K600 VanDerWaalsContact O-CB 3.28Å; Y596-K600 WeakPolarHBondContact O-CB 3.4Å; Y596-K600 PolarHBondContact O-N 3.13Å
597	M	87.8	Confident	87	Confident	110 Å²	110	52.9 Å²	52.9	54%	0.542	27%	0.268	S	S	.	.	H	α-helix	trans	-64	-41.2	178.5	-71.3	-62	-171.6	0	0	111	N593 E594 K600 E601	N593-M597 WeakPolarHBondContact O-CB 3.22Å; N593-M597 VanDerWaalsContact O-CG 3.24Å; N593-M597 WeakPolarHBondContact O-CG 3.4Å; N593-M597 PolarHBondContact O-N 3.3Å; E594-M597 PolarHBondContact O-N 2.71Å; M597-K600 PolarHBondContact O-N 3.18Å; M597-E601 VanDerWaalsContact O-CB 3.29Å; M597-E601 WeakPolarHBondContact O-CB 3.43Å; M597-E601 PolarHBondContact O-N 2.75Å
598	F	91	Very high	88.5	Confident	40 Å²	40	47.9 Å²	47.9	18%	0.175	24%	0.235	C	C	.	.	H	α-helix	trans	-57.1	-50.8	174.3	177.2	-105	0	0	0	111.5	E594 Y596 E601 L602 L665 L666 Q669 F671	E594-F598 VanDerWaalsContact O-CB 3.23Å; E594-F598 WeakPolarHBondContact O-CB 3.16Å; E594-F598 PolarHBondContact O-N 3.04Å; Y596-F598 VanDerWaalsContact C-N 3.33Å; F598-E601 PolarHBondContact O-N 2.78Å; F598-L602 HydrophobicContact CD1-CD1 3.82Å; F598-L602 HydrophobicContact CD2-CD1 4.36Å; F598-L602 HydrophobicContact CE1-CD1 3.4Å; F598-L602 VanDerWaalsContact CE1-CD1 3.4Å; F598-L602 HydrophobicContact CE2-CD1 3.99Å; F598-L602 HydrophobicContact CG-CD1 4.28Å; F598-L602 HydrophobicContact CZ-CD1 3.51Å; F598-L602 WeakPolarHBondContact O-CB 3.3Å; F598-L602 VanDerWaalsContact O-CG 3.27Å; F598-L602 WeakPolarHBondContact O-CG 3.47Å; F598-L602 PolarHBondContact O-N 3Å; F598-L665 HydrophobicContact CE1-CD2 3.99Å; F598-L665 HydrophobicContact CE1-CG 4.25Å; F598-L665 HydrophobicContact CZ-CD2 4.04Å; F598-L665 HydrophobicContact CZ-CG 4.32Å; F598-L666 HydrophobicContact CD1-CD2 3.73Å; F598-L666 HydrophobicContact CE1-CD2 3.93Å; F598-Q669 HydrophobicContact CE1-CG 4.42Å; F598-Q669 HydrophobicContact CZ-CG 4.13Å; F598-F671 HydrophobicContact CB-CD2 4.43Å; F598-F671 HydrophobicContact CB-CE2 3.83Å; F598-F671 HydrophobicContact CB-CZ 4.3Å; F598-F671 AromaticContact CD1-CD2 3.77Å; F598-F671 HydrophobicContact CD1-CD2 3.77Å; F598-F671 AromaticContact CD1-CE2 3.65Å; F598-F671 HydrophobicContact CD1-CE2 3.65Å; F598-F671 HydrophobicContact CD2-CE2 4.05Å; F598-F671 HydrophobicContact CE1-CD2 4.21Å; F598-F671 HydrophobicContact CE1-CE2 4.16Å; F598-F671 HydrophobicContact CG-CD2 4.16Å; F598-F671 AromaticContact CG-CE2 3.58Å; F598-F671 HydrophobicContact CG-CE2 3.58Å; F598-F671 HydrophobicContact CG-CZ 4.43Å
599	V	93.9	Very high	89.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-43.9	178.1	170.1	0	0	0	0	112.3	V547 A550 F553 A595 Y596 E601 L602 C603 L662 L666	V547-V599 HydrophobicContact CG1-CG1 3.83Å; V547-V599 HydrophobicContact CG2-CG1 4.43Å; A550-V599 HydrophobicContact CB-CG2 4.12Å; F553-V599 HydrophobicContact CE1-CG1 3.28Å; F553-V599 HydrophobicContact CZ-CG1 3.43Å; F553-V599 VanDerWaalsContact CZ-CG1 3.43Å; A595-V599 WeakPolarHBondContact O-CG2 3.39Å; A595-V599 PolarHBondContact O-N 3.02Å; Y596-V599 PolarHBondContact O-N 3.05Å; V599-E601 VanDerWaalsContact C-N 3.34Å; V599-E601 PolarHBondContact O-N 2.85Å; V599-L602 PolarHBondContact O-N 3.18Å; V599-C603 PolarHBondContact O-N 2.84Å; V599-C603 PolarHBondContact O-SG 3.46Å; V599-L662 HydrophobicContact CG1-CD2 4.34Å; V599-L666 HydrophobicContact CG2-CD1 3.9Å; V599-L666 HydrophobicContact CG2-CD2 3.43Å; V599-L666 VanDerWaalsContact CG2-CD2 3.43Å; V599-L666 HydrophobicContact CG2-CG 4.21Å
600	K	92	Very high	90.7	Very high	54 Å²	54	42.1 Å²	42.1	24%	0.235	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-47	178.5	-171.7	-178.7	179.9	-178.7	0	110.3	E365 Y596 M597 L602 M604	E365-K600 WeakPolarHBondContact OE2-CE 3.37Å; E365-K600 IonicContact OE2-NZ 2.72Å; E365-K600 PolarHBondContact OE2-NZ 3.37Å; Y596-K600 HydrophobicContact CE1-CD 4.42Å; Y596-K600 VanDerWaalsContact O-CB 3.28Å; Y596-K600 WeakPolarHBondContact O-CB 3.4Å; Y596-K600 PolarHBondContact O-N 3.13Å; M597-K600 PolarHBondContact O-N 3.18Å; K600-L602 VanDerWaalsContact C-N 3.3Å; K600-L602 PolarHBondContact O-N 2.98Å; K600-M604 HydrophobicContact CG-CB 3.84Å; K600-M604 HydrophobicContact CG-CG 4.12Å; K600-M604 WeakPolarHBondContact O-CB 3.49Å; K600-M604 PolarHBondContact O-N 3Å
601	E	89.8	Confident	91.6	Very high	107 Å²	107	40 Å²	40	50%	0.5	19%	0.187	S	C	.	.	H	α-helix	trans	-63.1	-37	178.3	179.6	159.7	-163.2	0	0	112.8	K375 M597 F598 V599 R606	K375-E601 IonicContact NZ-OE1 3.67Å; K375-E601 PolarHBondContact NZ-OE1 2.9Å; K375-E601 IonicContact NZ-OE2 3.67Å; K375-E601 PolarHBondContact NZ-OE2 2.96Å; M597-E601 VanDerWaalsContact O-CB 3.29Å; M597-E601 WeakPolarHBondContact O-CB 3.43Å; M597-E601 PolarHBondContact O-N 2.75Å; F598-E601 PolarHBondContact O-N 2.78Å; V599-E601 VanDerWaalsContact C-N 3.34Å; V599-E601 PolarHBondContact O-N 2.85Å; E601-R606 PolarHBondContact O-NH2 3.34Å
602	L	91	Very high	92.3	Very high	16 Å²	16	37.6 Å²	37.6	8%	0.084	18%	0.177	C	C	.	.	H	α-helix	trans	-68.7	-49.6	179.4	-78.6	174.6	0	0	0	112.7	F598 V599 K600 R606 M627 L665	F598-L602 HydrophobicContact CD1-CD1 3.82Å; F598-L602 HydrophobicContact CD2-CD1 4.36Å; F598-L602 HydrophobicContact CE1-CD1 3.4Å; F598-L602 VanDerWaalsContact CE1-CD1 3.4Å; F598-L602 HydrophobicContact CE2-CD1 3.99Å; F598-L602 HydrophobicContact CG-CD1 4.28Å; F598-L602 HydrophobicContact CZ-CD1 3.51Å; F598-L602 WeakPolarHBondContact O-CB 3.3Å; F598-L602 VanDerWaalsContact O-CG 3.27Å; F598-L602 WeakPolarHBondContact O-CG 3.47Å; F598-L602 PolarHBondContact O-N 3Å; V599-L602 PolarHBondContact O-N 3.18Å; K600-L602 VanDerWaalsContact C-N 3.3Å; K600-L602 PolarHBondContact O-N 2.98Å; L602-R606 VanDerWaalsContact O-CD 3.25Å; L602-R606 WeakPolarHBondContact O-CD 3.41Å; L602-R606 PolarHBondContact O-NE 3.49Å; L602-M627 HydrophobicContact CB-CE 3.87Å; L602-M627 HydrophobicContact CB-SD 4.22Å; L602-M627 VanDerWaalsContact O-CE 3.22Å; L602-M627 WeakPolarHBondContact O-CE 3.39Å; L602-L665 HydrophobicContact CD1-CD2 3.96Å
603	C	93.4	Very high	92.7	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-126.1	-9.2	-162.8	70.8	0	0	0	0	116.8	V544 V599 Q605 R606 V608 M627	V544-C603 WeakPolarHBondContact CB-O 3.22Å; V544-C603 HydrophobicContact CG2-CB 4.17Å; V599-C603 PolarHBondContact O-N 2.84Å; V599-C603 PolarHBondContact O-SG 3.46Å; C603-Q605 PolarHBondContact O-N 3.48Å; C603-R606 WeakPolarHBondContact O-CB 3.21Å; C603-R606 PolarHBondContact O-N 3.32Å; C603-V608 HydrophobicContact CB-CG1 4.19Å; C603-M627 HydrophobicContact CB-CE 3.59Å; C603-M627 HydrophobicContact CB-SD 4.12Å
604	M	94.9	Very high	93.1	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.02	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	123.5	-177.8	-175.2	66.1	-178.9	0	0	111.7	E365 E545 F546 V547 K600 R606	E365-M604 HydrophobicContact CG-CE 4.17Å; E545-M604 WeakPolarHBondContact O-CE 3.49Å; F546-M604 HydrophobicContact CD2-CE 3.86Å; V547-M604 HydrophobicContact CG2-CB 4.5Å; V547-M604 HydrophobicContact CG2-SD 4.08Å; K600-M604 HydrophobicContact CG-CB 3.84Å; K600-M604 HydrophobicContact CG-CG 4.12Å; K600-M604 WeakPolarHBondContact O-CB 3.49Å; K600-M604 PolarHBondContact O-N 3Å; M604-R606 WeakPolarHBondContact O-CG 3.46Å; M604-R606 PolarHBondContact O-N 2.86Å; M604-R606 VanDerWaalsContact O-N 3.14Å
605	Q	95.7	Very high	93.4	Very high	13 Å²	13	37.3 Å²	37.3	6%	0.061	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	21.4	-177.7	-60.3	-178.6	-28.4	0	0	114.8	V366 R426 I429 V544 C603	V366-Q605 PolarHBondContact O-NE2 2.84Å; V366-Q605 PolarHBondContact O-OE1 3.31Å; R426-Q605 WeakPolarHBondContact CD-O 3.35Å; R426-Q605 HydrophobicContact CG-CB 4.34Å; R426-Q605 VanDerWaalsContact CG-O 3.28Å; R426-Q605 WeakPolarHBondContact CG-O 3.45Å; R426-Q605 PolarHBondContact NH1-O 3.05Å; R426-Q605 VanDerWaalsContact NH1-O 3.1Å; I429-Q605 HydrophobicContact CD1-CB 3.31Å; I429-Q605 HydrophobicContact CD1-CG 4.35Å; I429-Q605 VanDerWaalsContact CD1-OE1 3.31Å; V544-Q605 WeakPolarHBondContact O-CA 3.24Å; V544-Q605 PolarHBondContact O-N 2.97Å; C603-Q605 PolarHBondContact O-N 3.48Å
606	R	94.8	Very high	93.2	Very high	78 Å²	78	39.4 Å²	39.4	29%	0.294	19%	0.192	S	C	.	.	S	Bend	trans	-101.6	159.9	175.1	-56	-164.3	-171	-173.2	-2	111.7	I429 V543 V544 E601 L602 C603 M604	I429-R606 HydrophobicContact CG2-CG 4.28Å; V543-R606 WeakPolarHBondContact CA-O 3.29Å; V544-R606 PolarHBondContact N-O 2.86Å; V544-R606 VanDerWaalsContact N-O 3.12Å; E601-R606 PolarHBondContact O-NH2 3.34Å; L602-R606 VanDerWaalsContact O-CD 3.25Å; L602-R606 WeakPolarHBondContact O-CD 3.41Å; L602-R606 PolarHBondContact O-NE 3.49Å; C603-R606 WeakPolarHBondContact O-CB 3.21Å; C603-R606 PolarHBondContact O-N 3.32Å; M604-R606 WeakPolarHBondContact O-CG 3.46Å; M604-R606 PolarHBondContact O-N 2.86Å; M604-R606 VanDerWaalsContact O-N 3.14Å
607	N	95.4	Very high	92.9	Very high	108 Å²	108	49.2 Å²	49.2	58%	0.578	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	136.2	172.1	-57.3	-25.2	0	0	0	109.2	R426 G542	R426-N607 PolarHBondContact NH1-OD1 3.48Å; R426-N607 PolarHBondContact NH2-OD1 2.98Å; R426-N607 VanDerWaalsContact NH2-OD1 3.09Å; G542-N607 CarbonylContact O-C 3.49Å; G542-N607 WeakPolarHBondContact O-CA 3.38Å
608	V	96.6	Very high	92.5	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	163.8	178.6	-62.4	0	0	0	0	108.9	G542 V544 C603 I610 L625 M627	G542-V608 PolarHBondContact N-O 3.13Å; G542-V608 PolarHBondContact O-N 3.42Å; G542-V608 VanDerWaalsContact O-O 3.11Å; V544-V608 HydrophobicContact CG2-CB 4.38Å; V544-V608 HydrophobicContact CG2-CG1 3.72Å; V544-V608 HydrophobicContact CG2-CG2 3.71Å; C603-V608 HydrophobicContact CB-CG1 4.19Å; V608-I610 HydrophobicContact CG2-CG2 4.13Å; V608-L625 HydrophobicContact CB-CD1 4.35Å; V608-L625 HydrophobicContact CB-CD2 4.08Å; V608-L625 HydrophobicContact CB-CG 4.07Å; V608-L625 HydrophobicContact CG1-CD1 4.34Å; V608-L625 HydrophobicContact CG1-CD2 3.93Å; V608-L625 HydrophobicContact CG1-CG 4.32Å; V608-L625 HydrophobicContact CG2-CD1 4.13Å; V608-L625 HydrophobicContact CG2-CG 4.23Å; V608-M627 HydrophobicContact CG1-CB 4.4Å
609	E	97.7	Very high	92.3	Very high	42 Å²	42	45.3 Å²	45.3	20%	0.196	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	145.3	164.1	-76.6	173.6	-153.9	0	0	109.4	R539 L540 L625 Y626 K659	R539-E609 HydrophobicContact CB-CB 4.45Å; R539-E609 HydrophobicContact CB-CG 4.5Å; L540-E609 CarbonylContact O-C 3.45Å; L540-E609 VanDerWaalsContact O-CA 3.27Å; L540-E609 WeakPolarHBondContact O-CA 3.21Å; E609-L625 CarbonylContact O-C 3.47Å; E609-L625 WeakPolarHBondContact O-CA 3.33Å; E609-Y626 PolarHBondContact N-O 3.03Å; E609-Y626 PolarHBondContact O-N 3.45Å; E609-K659 VanDerWaalsContact CD-NZ 3.32Å; E609-K659 HydrophobicContact CG-CD 4.24Å; E609-K659 WeakPolarHBondContact OE1-CD 3.46Å; E609-K659 WeakPolarHBondContact OE1-CE 3.43Å; E609-K659 IonicContact OE1-NZ 3.54Å; E609-K659 PolarHBondContact OE1-NZ 3.12Å
610	I	97.6	Very high	92.1	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.9	176.5	67.5	171	0	0	0	111.9	R539 L540 I555 I557 I564 L566 V608 V612 Y624 L625	R539-I610 CarbonylContact C-O 3.59Å; R539-I610 WeakPolarHBondContact CA-O 3.37Å; L540-I610 HydrophobicContact CB-CG1 3.8Å; L540-I610 HydrophobicContact CD1-CG1 4.39Å; L540-I610 PolarHBondContact N-O 2.91Å; L540-I610 PolarHBondContact O-N 3.38Å; I555-I610 HydrophobicContact CD1-CD1 4.46Å; I555-I610 HydrophobicContact CD1-CG2 3.68Å; I555-I610 HydrophobicContact CG2-CD1 4.31Å; I557-I610 HydrophobicContact CD1-CD1 3.85Å; I557-I610 HydrophobicContact CG1-CD1 4.33Å; I564-I610 HydrophobicContact CD1-CD1 3.7Å; L566-I610 HydrophobicContact CD2-CB 4.18Å; L566-I610 HydrophobicContact CD2-CG2 3.82Å; V608-I610 HydrophobicContact CG2-CG2 4.13Å; I610-V612 HydrophobicContact CD1-CG2 4.37Å; I610-Y624 CarbonylContact C-O 3.54Å; I610-Y624 VanDerWaalsContact CA-O 3.22Å; I610-Y624 WeakPolarHBondContact CA-O 3.35Å; I610-L625 HydrophobicContact CG2-CB 4.36Å; I610-L625 HydrophobicContact CG2-CD1 4.48Å; I610-L625 HydrophobicContact CG2-CG 4.2Å
611	K	96.9	Very high	92.4	Very high	40 Å²	40	43.4 Å²	43.4	17%	0.174	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.3	167.7	173.7	70.6	-161.4	176.3	0	108.1	Q535 A537 E538 E613 G623 Y624 Y626	Q535-K611 PolarHBondContact O-NZ 2.92Å; A537-K611 WeakPolarHBondContact O-CD 3.33Å; A537-K611 PolarHBondContact O-NZ 3.16Å; E538-K611 WeakPolarHBondContact O-CD 3.4Å; K611-E613 HydrophobicContact CG-CG 4.4Å; K611-G623 CarbonylContact O-C 3.51Å; K611-G623 WeakPolarHBondContact O-CA 3.36Å; K611-Y624 HydrophobicContact CB-CD2 4.48Å; K611-Y624 PolarHBondContact N-O 2.87Å; K611-Y624 PolarHBondContact O-N 3.12Å; K611-Y626 HydrophobicContact CB-CE2 3.95Å
612	V	96.7	Very high	92.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.7	172.6	175	0	0	0	0	109	L531 L534 Q535 I564 I610 F621	L531-V612 HydrophobicContact CD1-CG1 4.12Å; L534-V612 HydrophobicContact CB-CB 4.11Å; L534-V612 HydrophobicContact CB-CG1 4.25Å; L534-V612 HydrophobicContact CB-CG2 4.09Å; Q535-V612 HydrophobicContact CG-CG1 4.16Å; I564-V612 HydrophobicContact CD1-CG2 4.33Å; I610-V612 HydrophobicContact CD1-CG2 4.37Å; V612-F621 HydrophobicContact CG1-CB 4.14Å; V612-F621 HydrophobicContact CG1-CD1 3.73Å; V612-F621 HydrophobicContact CG1-CG 4.36Å; V612-F621 HydrophobicContact CG2-CB 4.37Å
613	E	93.4	Very high	92.8	Very high	71 Å²	71	39.4 Å²	39.4	33%	0.332	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-37.7	177.4	-68.2	-158.4	133.4	0	0	112.6	Q535 K611 V622 Y624	Q535-E613 PolarHBondContact NE2-O 3.04Å; K611-E613 HydrophobicContact CG-CG 4.4Å; E613-V622 PolarHBondContact N-O 3.47Å; E613-Y624 HydrophobicContact CG-CD2 4.39Å; E613-Y624 HydrophobicContact CG-CE2 3.88Å; E613-Y624 WeakPolarHBondContact OE1-CE2 3.44Å; E613-Y624 WeakPolarHBondContact OE2-CE2 3.18Å; E613-Y624 VanDerWaalsContact OE2-CZ 3.25Å; E613-Y624 PolarHBondContact OE2-OH 3.1Å
614	A	92.3	Very high	92.9	Very high	41 Å²	41	39.6 Å²	39.6	34%	0.339	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	-177.2	-175.1	0	0	0	0	0	111.7	F621 V622	A614-F621 WeakPolarHBondContact O-CA 3.48Å; A614-V622 HydrophobicContact CB-CB 4.34Å; A614-V622 PolarHBondContact N-O 3.12Å; A614-V622 PolarHBondContact O-N 2.97Å
615	M	90.7	Very high	93.1	Very high	35 Å²	35	39.4 Å²	39.4	17%	0.172	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	137.7	172.7	-167.9	-170.6	71.7	0	0	108.6	S527 R528 L531 N620 F621	S527-M615 WeakPolarHBondContact CB-SD 3.5Å; R528-M615 HydrophobicContact CG-CE 3.41Å; R528-M615 VanDerWaalsContact CG-CE 3.41Å; R528-M615 HydrophobicContact CG-SD 4.16Å; L531-M615 HydrophobicContact CD1-CB 3.94Å; L531-M615 HydrophobicContact CD2-CB 3.82Å; L531-M615 HydrophobicContact CG-CB 4.48Å; M615-N620 CarbonylContact C-O 3.51Å; M615-N620 VanDerWaalsContact CA-O 3.26Å; M615-N620 WeakPolarHBondContact CA-O 3.21Å; M615-N620 VanDerWaalsContact CG-O 3.27Å; M615-N620 WeakPolarHBondContact CG-O 3.29Å; M615-F621 HydrophobicContact CG-CD1 4.46Å
616	D	86.2	Confident	93.1	Very high	43 Å²	43	39.1 Å²	39.1	23%	0.23	19%	0.189	C	C	.	.			trans	-76.4	-179.1	173.3	73.5	11.5	0	0	0	111.6	V618 G619 N620	D616-V618 VanDerWaalsContact C-N 3.29Å; D616-V618 PolarHBondContact O-N 3.33Å; D616-V618 WeakPolarHBondContact OD1-CG2 3.22Å; D616-V618 PolarHBondContact OD1-N 3.11Å; D616-V618 VanDerWaalsContact OD2-CG2 3.29Å; D616-V618 WeakPolarHBondContact OD2-CG2 3.25Å; D616-G619 PolarHBondContact O-N 2.96Å; D616-G619 PolarHBondContact OD1-N 3.37Å; D616-N620 PolarHBondContact N-O 3.42Å; D616-N620 PolarHBondContact OD1-N 3.33Å; D616-N620 VanDerWaalsContact OD2-CB 3.3Å; D616-N620 WeakPolarHBondContact OD2-CB 3.12Å; D616-N620 PolarHBondContact OD2-ND2 2.9Å
617	R	82.4	Confident	93	Very high	229 Å²	229	35.8 Å²	35.8	86%	0.864	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-25.4	-177.2	-63.2	-179	-178	174.6	1.1	113.2
618	V	80.8	Confident	92.7	Very high	67 Å²	67	35.2 Å²	35.2	41%	0.406	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	2.4	-178.4	-61.3	0	0	0	0	112.9	V524 D616 N620	V524-V618 VanDerWaalsContact CG2-C 3.45Å; V524-V618 WeakPolarHBondContact CG2-O 3.46Å; D616-V618 VanDerWaalsContact C-N 3.29Å; D616-V618 PolarHBondContact O-N 3.33Å; D616-V618 WeakPolarHBondContact OD1-CG2 3.22Å; D616-V618 PolarHBondContact OD1-N 3.11Å; D616-V618 VanDerWaalsContact OD2-CG2 3.29Å; D616-V618 WeakPolarHBondContact OD2-CG2 3.25Å; V618-N620 WeakPolarHBondContact CG2-ND2 3.46Å
619	G	85.4	Confident	91.8	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.01	18%	0.181	C	C	.	.	S	Bend	trans	89.4	13.2	172.7	0	0	0	0	0	114.5	S527 D616	S527-G619 WeakPolarHBondContact CB-O 3.36Å; S527-G619 PolarHBondContact OG-O 3.13Å; D616-G619 PolarHBondContact O-N 2.96Å; D616-G619 PolarHBondContact OD1-N 3.37Å
620	N	91.5	Very high	90.1	Very high	15 Å²	15	38.6 Å²	38.6	8%	0.08	20%	0.197	C	C	.	.			trans	-77.7	144.5	166	-50.1	-56	0	0	0	109.4	T565 L567 M615 D616 V618	T565-N620 VanDerWaalsContact CB-OD1 3.3Å; T565-N620 WeakPolarHBondContact CB-OD1 3.49Å; T565-N620 HydrophobicContact CG2-CB 4.13Å; T565-N620 VanDerWaalsContact CG2-OD1 3.3Å; T565-N620 WeakPolarHBondContact CG2-OD1 3.38Å; L567-N620 HydrophobicContact CD1-CB 3.91Å; L567-N620 HydrophobicContact CG-CB 4.05Å; M615-N620 CarbonylContact C-O 3.51Å; M615-N620 VanDerWaalsContact CA-O 3.26Å; M615-N620 WeakPolarHBondContact CA-O 3.21Å; M615-N620 VanDerWaalsContact CG-O 3.27Å; M615-N620 WeakPolarHBondContact CG-O 3.29Å; D616-N620 PolarHBondContact N-O 3.42Å; D616-N620 PolarHBondContact OD1-N 3.33Å; D616-N620 VanDerWaalsContact OD2-CB 3.3Å; D616-N620 WeakPolarHBondContact OD2-CB 3.12Å; D616-N620 PolarHBondContact OD2-ND2 2.9Å; V618-N620 WeakPolarHBondContact CG2-ND2 3.46Å
621	F	96.5	Very high	87.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	138.5	178.4	-64.4	-89.1	0	0	0	109.6	L520 L531 L534 I564 T565 L566 L567 V612 A614 M615	L520-F621 HydrophobicContact CB-CE2 4.14Å; L520-F621 HydrophobicContact CD1-CE2 4.09Å; L520-F621 HydrophobicContact CD1-CZ 4.05Å; L531-F621 HydrophobicContact CB-CE1 4.16Å; L531-F621 HydrophobicContact CD1-CD1 3.84Å; L531-F621 HydrophobicContact CD1-CE1 3.81Å; L534-F621 HydrophobicContact CD1-CD1 4.1Å; L534-F621 HydrophobicContact CD1-CE1 3.62Å; L534-F621 HydrophobicContact CD1-CE2 4.36Å; L534-F621 HydrophobicContact CD1-CZ 3.74Å; I564-F621 HydrophobicContact CB-CD2 3.66Å; I564-F621 HydrophobicContact CB-CE2 3.99Å; I564-F621 HydrophobicContact CD1-CB 4.22Å; I564-F621 HydrophobicContact CD1-CD2 4.27Å; I564-F621 HydrophobicContact CD1-CG 4.36Å; I564-F621 HydrophobicContact CG2-CD2 3.69Å; I564-F621 HydrophobicContact CG2-CE2 3.53Å; I564-F621 HydrophobicContact CG2-CZ 4.31Å; T565-F621 PolarHBondContact O-N 3Å; L566-F621 CarbonylContact C-O 3.55Å; L566-F621 WeakPolarHBondContact CA-O 3.45Å; L566-F621 HydrophobicContact CD1-CB 4.43Å; L567-F621 PolarHBondContact N-O 3.27Å; V612-F621 HydrophobicContact CG1-CB 4.14Å; V612-F621 HydrophobicContact CG1-CD1 3.73Å; V612-F621 HydrophobicContact CG1-CG 4.36Å; V612-F621 HydrophobicContact CG2-CB 4.37Å; A614-F621 WeakPolarHBondContact O-CA 3.48Å; M615-F621 HydrophobicContact CG-CD1 4.46Å
622	V	94	Very high	84.9	Confident	39 Å²	39	48.7 Å²	48.7	24%	0.236	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.3	177.3	-176.2	0	0	0	0	108.5	L567 E613 A614	L567-V622 HydrophobicContact CB-CG2 4.31Å; L567-V622 HydrophobicContact CD1-CG2 4.33Å; L567-V622 WeakPolarHBondContact O-CA 3.05Å; E613-V622 PolarHBondContact N-O 3.47Å; A614-V622 HydrophobicContact CB-CB 4.34Å; A614-V622 PolarHBondContact N-O 3.12Å; A614-V622 PolarHBondContact O-N 2.97Å
623	G	95.5	Very high	81.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.4	-160.5	-175.9	0	0	0	0	0	114.3	L567 L568 G569 K611	L567-G623 PolarHBondContact O-N 3.5Å; L568-G623 CarbonylContact C-O 3.5Å; L568-G623 VanDerWaalsContact CA-O 3.29Å; L568-G623 WeakPolarHBondContact CA-O 3.13Å; G569-G623 PolarHBondContact N-O 3.34Å; K611-G623 CarbonylContact O-C 3.51Å; K611-G623 WeakPolarHBondContact O-CA 3.36Å
624	Y	97.1	Very high	78.5	Confident	3 Å²	3	54.8 Å²	54.8	1%	0.012	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	149.7	-177.3	-50.6	-73	0	0	0	111.6	G569 I610 K611 E613 Y626 S683 H685	G569-Y624 WeakPolarHBondContact O-CE1 3.41Å; I610-Y624 CarbonylContact C-O 3.54Å; I610-Y624 VanDerWaalsContact CA-O 3.22Å; I610-Y624 WeakPolarHBondContact CA-O 3.35Å; K611-Y624 HydrophobicContact CB-CD2 4.48Å; K611-Y624 PolarHBondContact N-O 2.87Å; K611-Y624 PolarHBondContact O-N 3.12Å; E613-Y624 HydrophobicContact CG-CD2 4.39Å; E613-Y624 HydrophobicContact CG-CE2 3.88Å; E613-Y624 WeakPolarHBondContact OE1-CE2 3.44Å; E613-Y624 WeakPolarHBondContact OE2-CE2 3.18Å; E613-Y624 VanDerWaalsContact OE2-CZ 3.25Å; E613-Y624 PolarHBondContact OE2-OH 3.1Å; Y624-Y626 WeakPolarHBondContact CB-OH 3.45Å; Y624-S683 WeakPolarHBondContact OH-CB 3.31Å; Y624-S683 PolarHBondContact OH-OG 3.1Å; Y624-H685 AromaticContact CD2-CD2 3.68Å; Y624-H685 AromaticContact CE2-CD2 3.63Å; Y624-H685 AromaticContact CG-CD2 3.94Å; Y624-H685 AromaticContact CZ-CD2 3.91Å
625	L	97.7	Very high	75.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.1	173.6	-174.2	155.9	0	0	0	108.9	V544 F553 I555 L566 L568 V608 E609 I610 M627 L662	V544-L625 HydrophobicContact CG2-CD1 4.07Å; F553-L625 HydrophobicContact CD1-CD1 4.32Å; F553-L625 HydrophobicContact CD2-CD1 4.47Å; F553-L625 HydrophobicContact CE1-CD1 4.43Å; F553-L625 HydrophobicContact CG-CD1 4.34Å; I555-L625 HydrophobicContact CD1-CD1 4.07Å; L566-L625 HydrophobicContact CD2-CB 4.28Å; L568-L625 HydrophobicContact CD2-CB 3.86Å; V608-L625 HydrophobicContact CB-CD1 4.35Å; V608-L625 HydrophobicContact CB-CD2 4.08Å; V608-L625 HydrophobicContact CB-CG 4.07Å; V608-L625 HydrophobicContact CG1-CD1 4.34Å; V608-L625 HydrophobicContact CG1-CD2 3.93Å; V608-L625 HydrophobicContact CG1-CG 4.32Å; V608-L625 HydrophobicContact CG2-CD1 4.13Å; V608-L625 HydrophobicContact CG2-CG 4.23Å; E609-L625 CarbonylContact O-C 3.47Å; E609-L625 WeakPolarHBondContact O-CA 3.33Å; I610-L625 HydrophobicContact CG2-CB 4.36Å; I610-L625 HydrophobicContact CG2-CD1 4.48Å; I610-L625 HydrophobicContact CG2-CG 4.2Å; L625-M627 HydrophobicContact CD2-CB 4.31Å; L625-M627 HydrophobicContact CD2-CG 4.41Å; L625-M627 HydrophobicContact CD2-SD 4.2Å; L625-L662 HydrophobicContact CB-CB 4.31Å; L625-L662 HydrophobicContact CD1-CD2 4.47Å; L625-L662 HydrophobicContact CD2-CB 4.02Å; L625-L662 HydrophobicContact CD2-CD2 3.9Å; L625-L662 WeakPolarHBondContact O-CB 3.37Å; L625-L662 PolarHBondContact O-N 3.44Å
626	Y	97.1	Very high	72.1	Confident	7 Å²	7	68 Å²	68	3%	0.027	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.5	179.7	-51.8	-93.2	0	0	0	110.2	R539 E609 K611 Y624 T660 N661 H685	R539-Y626 VanDerWaalsContact NE-CE2 3.33Å; R539-Y626 PolarHBondContact NH1-OH 3.24Å; R539-Y626 PolarHBondContact NH2-OH 3.49Å; R539-Y626 VanDerWaalsContact NH2-OH 3.12Å; E609-Y626 PolarHBondContact N-O 3.03Å; E609-Y626 PolarHBondContact O-N 3.45Å; K611-Y626 HydrophobicContact CB-CE2 3.95Å; Y624-Y626 WeakPolarHBondContact CB-OH 3.45Å; Y626-T660 VanDerWaalsContact CA-O 3.29Å; Y626-T660 WeakPolarHBondContact CA-O 3.44Å; Y626-N661 HydrophobicContact CD1-CB 3.98Å; Y626-N661 HydrophobicContact CE1-CB 3.79Å; Y626-H685 AromaticContact CZ-NE2 3.84Å; Y626-H685 PolarHBondContact OH-NE2 3Å
627	M	92.3	Very high	69.2	Low	8 Å²	8	71.2 Å²	71.2	4%	0.039	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	159.2	-178.7	64.8	-171.5	-51.8	0	0	112.5	L602 C603 V608 L625 T660 L662	L602-M627 HydrophobicContact CB-CE 3.87Å; L602-M627 HydrophobicContact CB-SD 4.22Å; L602-M627 VanDerWaalsContact O-CE 3.22Å; L602-M627 WeakPolarHBondContact O-CE 3.39Å; C603-M627 HydrophobicContact CB-CE 3.59Å; C603-M627 HydrophobicContact CB-SD 4.12Å; V608-M627 HydrophobicContact CG1-CB 4.4Å; L625-M627 HydrophobicContact CD2-CB 4.31Å; L625-M627 HydrophobicContact CD2-CG 4.41Å; L625-M627 HydrophobicContact CD2-SD 4.2Å; M627-T660 PolarHBondContact N-O 2.82Å; M627-T660 VanDerWaalsContact N-O 3.1Å; M627-T660 PolarHBondContact O-N 3.3Å; M627-L662 HydrophobicContact SD-CD1 4.33Å
628	D	87.5	Confident	66.3	Low	97 Å²	97	68.7 Å²	68.7	52%	0.519	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-80.2	119.8	170.5	-65	-54.2	0	0	0	109.5	P630 K659	D628-P630 WeakPolarHBondContact O-CD 3.27Å; D628-K659 WeakPolarHBondContact OD1-CG 3.44Å; D628-K659 VanDerWaalsContact OD2-CE 3.29Å; D628-K659 WeakPolarHBondContact OD2-CE 3.41Å
629	I	78.4	Confident	63.7	Low	33 Å²	33	71.8 Å²	71.8	17%	0.169	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-87.8	120.4	173.3	-57	178.7	0	0	0	108.6	N631 L632 T660 L665	I629-N631 PolarHBondContact O-N 2.81Å; I629-L632 HydrophobicContact CG2-CD1 3.77Å; I629-T660 VanDerWaalsContact CD1-CB 3.47Å; I629-T660 HydrophobicContact CD1-CG2 3.52Å; I629-T660 WeakPolarHBondContact CD1-OG1 3.02Å; I629-T660 HydrophobicContact CG1-CG2 4.44Å; I629-L665 HydrophobicContact CD1-CD1 3.88Å; I629-L665 HydrophobicContact CD1-CD2 3.6Å; I629-L665 HydrophobicContact CD1-CG 4.29Å; I629-L665 HydrophobicContact CG1-CD2 4.45Å
630	P	63	Low	60.8	Low	81 Å²	81	78.8 Å²	78.8	53%	0.526	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-61	127.9	166.1	-14.1	27.9	0	0	0	108.5	D628 L632	D628-P630 WeakPolarHBondContact O-CD 3.27Å; P630-L632 PolarHBondContact O-N 2.84Å
631	N	46.4	Very low	57.5	Low	123 Å²	123	88.2 Å²	88.2	66%	0.658	48%	0.48	S	S	*	.			trans	-42.8	109.8	-173.4	-71.5	-16.7	0	0	0	112.5	I629 S633 K657	I629-N631 PolarHBondContact O-N 2.81Å; N631-S633 PolarHBondContact O-N 3.36Å; N631-K657 PolarHBondContact OD1-NZ 2.87Å
632	L	39.2	Very low	53.9	Low	129 Å²	129	93 Å²	93	68%	0.675	51%	0.513	S	S	*	.			trans	-77.8	6.9	171	-100.6	96.7	0	0	0	113	I629 P630 S634	I629-L632 HydrophobicContact CG2-CD1 3.77Å; P630-L632 PolarHBondContact O-N 2.84Å; L632-S634 PolarHBondContact O-N 2.89Å; L632-S634 VanDerWaalsContact O-N 3.14Å
633	S	28.6	Very low	50.5	Low	101 Å²	101	96.7 Å²	96.7	71%	0.706	54%	0.54	S	S	*	.			trans	-87.2	76.2	-175.9	67.5	0	0	0	0	112.9	N631	N631-S633 PolarHBondContact O-N 3.36Å
634	S	26.7	Very low	47	Very low	99 Å²	99	100 Å²	100	69%	0.692	58%	0.575	S	S	*	*			trans	-159.9	71.5	154.4	64	0	0	0	0	109.8	L632	L632-S634 PolarHBondContact O-N 2.89Å; L632-S634 VanDerWaalsContact O-N 3.14Å
635	N	24.1	Very low	43.6	Very low	167 Å²	167	109.7 Å²	109.7	89%	0.893	62%	0.617	S	S	*	*			trans	-167.7	53.7	156.9	-91.7	-16.1	0	0	0	108.4
636	E	23.9	Very low	40	Very low	187 Å²	187	119.1 Å²	119.1	87%	0.874	66%	0.658	S	S	*	*	S	Bend	trans	-96.8	129.5	151.2	-93.2	-168.1	161.1	0	0	106.9	D638	E636-D638 PolarHBondContact O-N 3.11Å
637	P	24.8	Very low	36.4	Very low	110 Å²	110	128.7 Å²	128.7	71%	0.714	70%	0.7	S	S	*	*			trans	-66.9	134.3	179.1	24.9	-28.6	0	0	0	110.2	I639	P637-I639 VanDerWaalsContact C-N 3.35Å; P637-I639 PolarHBondContact O-N 3.2Å
638	D	23	Very low	33.2	Very low	175 Å²	175	138.7 Å²	138.7	94%	0.936	74%	0.743	S	S	*	*			trans	-49.4	88.5	175.4	-89.9	-43.2	0	0	0	112.2	E636	E636-D638 PolarHBondContact O-N 3.11Å
639	I	24.6	Very low	30	Very low	133 Å²	133	143.1 Å²	143.1	68%	0.682	76%	0.758	S	S	*	*			trans	-129.2	81	164.5	-55	179.9	0	0	0	107	P637	P637-I639 VanDerWaalsContact C-N 3.35Å; P637-I639 PolarHBondContact O-N 3.2Å
640	N	24.7	Very low	27.3	Very low	147 Å²	147	151 Å²	151	79%	0.786	79%	0.791	S	S	*	*				165.6	91.2	129.7	-82.4	-36	0	0	0	111.3	S642	N640-S642 PolarHBondContact O-N 2.54Å
641	K	21.6	Very low	25.5	Very low	214 Å²	214	151.7 Å²	151.7	93%	0.93	80%	0.798	S	S	*	*			trans	-71.4	107.6	146.7	-79.2	179.3	178.9	170.8	0	108
642	S	22.2	Very low	24.7	Very low	101 Å²	101	153 Å²	153	71%	0.706	81%	0.811	S	S	*	*			trans	-169.3	118.9	132.9	46.6	0	0	0	0	113.6	N640	N640-S642 PolarHBondContact O-N 2.54Å
643	S	21.9	Very low	24.3	Very low	115 Å²	115	154.2 Å²	154.2	80%	0.804	81%	0.813	S	S	*	*			trans	52.9	93.2	142.3	62.1	0	0	0	0	120
644	G	23	Very low	24.6	Very low	71 Å²	71	155.9 Å²	155.9	73%	0.732	82%	0.819	S	S	*	*				85.4	114.1	108.2	0	0	0	0	0	118.6
645	K	24.2	Very low	25.1	Very low	205 Å²	205	158.3 Å²	158.3	89%	0.891	82%	0.824	S	S	*	*				179.1	117.5	113.4	-98.2	166.2	-175.6	172.9	0	111.9
646	K	22	Very low	26	Very low	198 Å²	198	156.7 Å²	156.7	86%	0.861	82%	0.82	S	S	*	*			trans	31.8	111.6	140.3	-71.1	178.9	176.2	175.9	0	119.4
647	K	22.2	Very low	27.8	Very low	209 Å²	209	154.3 Å²	154.3	91%	0.909	81%	0.807	S	S	*	*				39.9	109.5	121	-74.1	-178.5	174.8	175.3	0	117.1
648	K	24.5	Very low	30.4	Very low	217 Å²	217	157.1 Å²	157.1	94%	0.943	81%	0.81	S	S	*	*			trans	-130.1	136.3	137.2	-139.3	174.6	-176	179.3	0	109.3
649	K	21.5	Very low	33.5	Very low	190 Å²	190	151.5 Å²	151.5	83%	0.826	78%	0.778	S	S	*	*			trans	-100.7	157	-173.1	-163.7	-177.9	-173.3	-178.3	0	107.9
650	K	21.7	Very low	36.7	Very low	199 Å²	199	147.5 Å²	147.5	87%	0.865	76%	0.759	S	S	*	*			trans	86.2	135.5	173.3	-53.3	173.7	175	-174.9	0	112.9
651	S	24.8	Very low	40.1	Very low	95 Å²	95	141.1 Å²	141.1	66%	0.664	73%	0.725	S	S	*	*			cis	-148.3	152.5	21	35.9	0	0	0	0	110.2	E653	S651-E653 VanDerWaalsContact C-N 3.35Å; S651-E653 PolarHBondContact O-N 3.22Å
652	T	29.7	Very low	43.7	Very low	152 Å²	152	131 Å²	131	93%	0.933	68%	0.681	S	S	*	*			trans	-68.8	85.2	171	39.6	0	0	0	0	110
653	E	30.7	Very low	47.2	Very low	154 Å²	154	126.1 Å²	126.1	72%	0.72	65%	0.647	S	S	*	*			trans	-99.2	123.5	155	-82.3	172.1	170.7	0	0	106.7	S651 N655	S651-E653 VanDerWaalsContact C-N 3.35Å; S651-E653 PolarHBondContact O-N 3.22Å; E653-N655 PolarHBondContact O-N 3.01Å
654	T	35.2	Very low	50.7	Low	135 Å²	135	122 Å²	122	83%	0.828	62%	0.617	S	S	*	*			trans	-61.4	86.2	169.3	42.5	0	0	0	0	107.9	V656	T654-V656 VanDerWaalsContact C-N 3.3Å; T654-V656 PolarHBondContact O-N 2.66Å
655	N	36.4	Very low	54.1	Low	150 Å²	150	119.8 Å²	119.8	80%	0.802	59%	0.588	S	S	*	*			trans	-58.6	97.7	168	-89	-36.9	0	0	0	106.9	E653 K657	E653-N655 PolarHBondContact O-N 3.01Å; N655-K657 VanDerWaalsContact C-N 3.28Å; N655-K657 PolarHBondContact O-N 2.92Å
656	V	43.7	Very low	57.5	Low	134 Å²	134	110 Å²	110	81%	0.812	55%	0.546	S	S	*	.			trans	-61.3	100.1	164.8	178.3	0	0	0	0	104.9	T654 Q658	T654-V656 VanDerWaalsContact C-N 3.3Å; T654-V656 PolarHBondContact O-N 2.66Å; V656-Q658 PolarHBondContact O-N 2.89Å
657	K	62.2	Low	61.1	Low	136 Å²	136	100.6 Å²	100.6	59%	0.591	51%	0.505	S	S	*	.			trans	-60.9	111.1	178.1	-165.2	-179.4	-176.8	-172.8	0	106.3	N631 N655 K659	N631-K657 PolarHBondContact OD1-NZ 2.87Å; N655-K657 VanDerWaalsContact C-N 3.28Å; N655-K657 PolarHBondContact O-N 2.92Å; K657-K659 PolarHBondContact O-N 2.78Å
658	Q	77.9	Confident	64.5	Low	169 Å²	169	92.1 Å²	92.1	79%	0.79	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-59.5	126.2	179.9	-175.2	176	-3.6	0	0	109	V656	V656-Q658 PolarHBondContact O-N 2.89Å
659	K	88.7	Confident	67.8	Low	58 Å²	58	85.4 Å²	85.4	25%	0.252	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-58.1	140.6	176.7	-74.8	-177.6	174.8	177.1	0	110.4	E609 D628 K657	E609-K659 VanDerWaalsContact CD-NZ 3.32Å; E609-K659 HydrophobicContact CG-CD 4.24Å; E609-K659 WeakPolarHBondContact OE1-CD 3.46Å; E609-K659 WeakPolarHBondContact OE1-CE 3.43Å; E609-K659 IonicContact OE1-NZ 3.54Å; E609-K659 PolarHBondContact OE1-NZ 3.12Å; D628-K659 WeakPolarHBondContact OD1-CG 3.44Å; D628-K659 VanDerWaalsContact OD2-CE 3.29Å; D628-K659 WeakPolarHBondContact OD2-CE 3.41Å; K657-K659 PolarHBondContact O-N 2.78Å
660	T	92.8	Very high	71.1	Confident	49 Å²	49	76.4 Å²	76.4	30%	0.301	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	132.7	-176.2	-50.7	0	0	0	0	110.7	Y626 M627 I629 L662 L665	Y626-T660 VanDerWaalsContact CA-O 3.29Å; Y626-T660 WeakPolarHBondContact CA-O 3.44Å; M627-T660 PolarHBondContact N-O 2.82Å; M627-T660 VanDerWaalsContact N-O 3.1Å; M627-T660 PolarHBondContact O-N 3.3Å; I629-T660 VanDerWaalsContact CD1-CB 3.47Å; I629-T660 HydrophobicContact CD1-CG2 3.52Å; I629-T660 WeakPolarHBondContact CD1-OG1 3.02Å; I629-T660 HydrophobicContact CG1-CG2 4.44Å; T660-L662 PolarHBondContact O-N 3.21Å; T660-L665 HydrophobicContact CG2-CB 4.21Å
661	N	95.8	Very high	74.5	Confident	12 Å²	12	68.1 Å²	68.1	6%	0.064	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	120.3	171.6	-176	-34.1	0	0	0	109.7	Y626 S663 V664 L665 H685	Y626-N661 HydrophobicContact CD1-CB 3.98Å; Y626-N661 HydrophobicContact CE1-CB 3.79Å; N661-S663 PolarHBondContact O-N 2.77Å; N661-S663 WeakPolarHBondContact OD1-CB 3.31Å; N661-S663 PolarHBondContact OD1-N 2.89Å; N661-V664 HydrophobicContact CB-CB 4.27Å; N661-V664 HydrophobicContact CB-CG2 4.01Å; N661-V664 PolarHBondContact O-N 2.95Å; N661-L665 PolarHBondContact O-N 3.49Å; N661-H685 PolarHBondContact ND2-CD2 3.4Å
662	L	95.9	Very high	77.7	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-65.4	-34.5	-176.2	-175.4	60.4	0	0	0	112.9	F553 L568 V599 L625 M627 T660 V664 L665 L666	F553-L662 HydrophobicContact CE1-CD2 4.22Å; F553-L662 HydrophobicContact CE2-CD2 4.27Å; F553-L662 HydrophobicContact CZ-CD2 3.57Å; L568-L662 HydrophobicContact CD1-CB 4.46Å; L568-L662 HydrophobicContact CD1-CD2 4.16Å; L568-L662 HydrophobicContact CD1-CG 4.12Å; V599-L662 HydrophobicContact CG1-CD2 4.34Å; L625-L662 HydrophobicContact CB-CB 4.31Å; L625-L662 HydrophobicContact CD1-CD2 4.47Å; L625-L662 HydrophobicContact CD2-CB 4.02Å; L625-L662 HydrophobicContact CD2-CD2 3.9Å; L625-L662 WeakPolarHBondContact O-CB 3.37Å; L625-L662 PolarHBondContact O-N 3.44Å; M627-L662 HydrophobicContact SD-CD1 4.33Å; T660-L662 PolarHBondContact O-N 3.21Å; L662-V664 PolarHBondContact O-N 3.16Å; L662-L665 HydrophobicContact CD1-CD2 4.02Å; L662-L665 PolarHBondContact O-N 3.07Å; L662-L666 HydrophobicContact CD1-CD1 4.31Å; L662-L666 HydrophobicContact CD1-CD2 4.41Å; L662-L666 HydrophobicContact CD1-CG 4.04Å; L662-L666 HydrophobicContact CG-CD1 4.01Å; L662-L666 HydrophobicContact CG-CG 4.22Å; L662-L666 WeakPolarHBondContact O-CB 3.31Å; L662-L666 VanDerWaalsContact O-CG 3.28Å; L662-L666 WeakPolarHBondContact O-CG 3.27Å; L662-L666 PolarHBondContact O-N 3.17Å
663	S	95.8	Very high	80.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-48.2	175.8	-58.6	0	0	0	0	110.7	G569 N661 L665 L666 I667	G569-S663 PolarHBondContact O-OG 3.28Å; N661-S663 PolarHBondContact O-N 2.77Å; N661-S663 WeakPolarHBondContact OD1-CB 3.31Å; N661-S663 PolarHBondContact OD1-N 2.89Å; S663-L665 PolarHBondContact O-N 2.94Å; S663-L666 PolarHBondContact O-N 3.37Å; S663-I667 WeakPolarHBondContact O-CD1 3.33Å; S663-I667 VanDerWaalsContact O-CG1 3.28Å; S663-I667 WeakPolarHBondContact O-CG1 3.45Å; S663-I667 PolarHBondContact O-N 3.18Å; S663-I667 VanDerWaalsContact O-N 3.09Å
664	V	96.2	Very high	83.5	Confident	29 Å²	29	50 Å²	50	18%	0.176	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-43	178.5	-179.9	0	0	0	0	110.7	N661 L662 I667 S668 D688 M689 A692	N661-V664 HydrophobicContact CB-CB 4.27Å; N661-V664 HydrophobicContact CB-CG2 4.01Å; N661-V664 PolarHBondContact O-N 2.95Å; L662-V664 PolarHBondContact O-N 3.16Å; V664-I667 PolarHBondContact O-N 3.38Å; V664-S668 WeakPolarHBondContact O-CB 3.26Å; V664-S668 PolarHBondContact O-N 2.98Å; V664-D688 HydrophobicContact CG1-CB 4.26Å; V664-D688 HydrophobicContact CG2-CB 3.95Å; V664-M689 HydrophobicContact CG2-CG 3.92Å; V664-A692 HydrophobicContact CG1-CB 3.92Å
665	L	95.3	Very high	86	Confident	23 Å²	23	48 Å²	48	12%	0.12	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-48.9	177.1	-179.9	67.4	0	0	0	111.7	F598 L602 I629 T660 N661 L662 S663 I667 S668 Q669	F598-L665 HydrophobicContact CE1-CD2 3.99Å; F598-L665 HydrophobicContact CE1-CG 4.25Å; F598-L665 HydrophobicContact CZ-CD2 4.04Å; F598-L665 HydrophobicContact CZ-CG 4.32Å; L602-L665 HydrophobicContact CD1-CD2 3.96Å; I629-L665 HydrophobicContact CD1-CD1 3.88Å; I629-L665 HydrophobicContact CD1-CD2 3.6Å; I629-L665 HydrophobicContact CD1-CG 4.29Å; I629-L665 HydrophobicContact CG1-CD2 4.45Å; T660-L665 HydrophobicContact CG2-CB 4.21Å; N661-L665 PolarHBondContact O-N 3.49Å; L662-L665 HydrophobicContact CD1-CD2 4.02Å; L662-L665 PolarHBondContact O-N 3.07Å; S663-L665 PolarHBondContact O-N 2.94Å; L665-I667 VanDerWaalsContact C-N 3.32Å; L665-I667 PolarHBondContact O-N 3.18Å; L665-S668 PolarHBondContact O-N 2.83Å; L665-S668 PolarHBondContact O-OG 2.98Å; L665-Q669 HydrophobicContact CD1-CG 4.42Å; L665-Q669 WeakPolarHBondContact O-CG 3.31Å; L665-Q669 PolarHBondContact O-N 3.43Å
666	L	95.7	Very high	88.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-40.6	-178.8	-69.9	173.3	0	0	0	112	A550 L568 I571 F598 V599 L662 S663 Q669 G670 F671	A550-L666 HydrophobicContact CB-CD1 4.46Å; A550-L666 VanDerWaalsContact O-CD1 3.27Å; A550-L666 WeakPolarHBondContact O-CD1 3.46Å; L568-L666 HydrophobicContact CD1-CD1 3.87Å; I571-L666 HydrophobicContact CD1-CB 3.6Å; I571-L666 HydrophobicContact CD1-CD1 4.15Å; F598-L666 HydrophobicContact CD1-CD2 3.73Å; F598-L666 HydrophobicContact CE1-CD2 3.93Å; V599-L666 HydrophobicContact CG2-CD1 3.9Å; V599-L666 HydrophobicContact CG2-CD2 3.43Å; V599-L666 VanDerWaalsContact CG2-CD2 3.43Å; V599-L666 HydrophobicContact CG2-CG 4.21Å; L662-L666 HydrophobicContact CD1-CD1 4.31Å; L662-L666 HydrophobicContact CD1-CD2 4.41Å; L662-L666 HydrophobicContact CD1-CG 4.04Å; L662-L666 HydrophobicContact CG-CD1 4.01Å; L662-L666 HydrophobicContact CG-CG 4.22Å; L662-L666 WeakPolarHBondContact O-CB 3.31Å; L662-L666 VanDerWaalsContact O-CG 3.28Å; L662-L666 WeakPolarHBondContact O-CG 3.27Å; L662-L666 PolarHBondContact O-N 3.17Å; S663-L666 PolarHBondContact O-N 3.37Å; L666-Q669 PolarHBondContact O-N 3.27Å; L666-G670 PolarHBondContact O-N 3.03Å; L666-F671 HydrophobicContact CB-CB 4.32Å; L666-F671 HydrophobicContact CD2-CB 4.09Å; L666-F671 HydrophobicContact CD2-CD2 4.06Å; L666-F671 WeakPolarHBondContact O-CA 3.49Å; L666-F671 WeakPolarHBondContact O-CB 3.32Å; L666-F671 PolarHBondContact O-N 3.09Å
667	I	96.5	Very high	90	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.7	-45.7	174.8	-65.5	163.4	0	0	0	110.2	I571 S663 V664 L665 Q669 G670 V674 M689 A692 E693 A696	I571-I667 HydrophobicContact CB-CD1 4.27Å; I571-I667 HydrophobicContact CD1-CD1 4.3Å; I571-I667 HydrophobicContact CD1-CG1 3.73Å; I571-I667 HydrophobicContact CG1-CD1 4.12Å; I571-I667 HydrophobicContact CG1-CG1 3.84Å; S663-I667 WeakPolarHBondContact O-CD1 3.33Å; S663-I667 VanDerWaalsContact O-CG1 3.28Å; S663-I667 WeakPolarHBondContact O-CG1 3.45Å; S663-I667 PolarHBondContact O-N 3.18Å; S663-I667 VanDerWaalsContact O-N 3.09Å; V664-I667 PolarHBondContact O-N 3.38Å; L665-I667 VanDerWaalsContact C-N 3.32Å; L665-I667 PolarHBondContact O-N 3.18Å; I667-Q669 PolarHBondContact O-N 2.93Å; I667-G670 WeakPolarHBondContact O-CA 3.39Å; I667-G670 PolarHBondContact O-N 2.94Å; I667-V674 HydrophobicContact CD1-CG2 4.18Å; I667-V674 HydrophobicContact CG2-CG2 4.47Å; I667-M689 HydrophobicContact CD1-CB 3.86Å; I667-M689 HydrophobicContact CD1-CG 3.75Å; I667-M689 HydrophobicContact CD1-SD 4.05Å; I667-A692 HydrophobicContact CB-CB 4.12Å; I667-A692 HydrophobicContact CG2-CB 3.86Å; I667-E693 VanDerWaalsContact CG2-CA 3.47Å; I667-E693 HydrophobicContact CG2-CB 3.69Å; I667-E693 HydrophobicContact CG2-CG 4.26Å; I667-E693 VanDerWaalsContact CG2-N 3.29Å; I667-A696 WeakPolarHBondContact O-CB 3.38Å
668	S	94.6	Very high	90.9	Very high	31 Å²	31	37.7 Å²	37.7	22%	0.217	19%	0.193	C	C	.	.	H	α-helix	trans	-62.5	-27.8	-179.7	74.3	0	0	0	0	113.9	V664 L665 G670	V664-S668 WeakPolarHBondContact O-CB 3.26Å; V664-S668 PolarHBondContact O-N 2.98Å; L665-S668 PolarHBondContact O-N 2.83Å; L665-S668 PolarHBondContact O-OG 2.98Å; S668-G670 VanDerWaalsContact C-N 3.3Å
669	Q	92.5	Very high	90.9	Very high	77 Å²	77	34.8 Å²	34.8	36%	0.36	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.3	175.3	-62.9	-59.1	-53.5	0	0	112.6	F598 L665 L666 I667 F671 G702	F598-Q669 HydrophobicContact CE1-CG 4.42Å; F598-Q669 HydrophobicContact CZ-CG 4.13Å; L665-Q669 HydrophobicContact CD1-CG 4.42Å; L665-Q669 WeakPolarHBondContact O-CG 3.31Å; L665-Q669 PolarHBondContact O-N 3.43Å; L666-Q669 PolarHBondContact O-N 3.27Å; I667-Q669 PolarHBondContact O-N 2.93Å; Q669-F671 VanDerWaalsContact C-N 3.31Å; Q669-F671 HydrophobicContact CB-CD2 3.56Å; Q669-F671 HydrophobicContact CB-CE2 3.75Å; Q669-F671 HydrophobicContact CB-CG 4.33Å; Q669-F671 HydrophobicContact CG-CD2 4.47Å; Q669-F671 HydrophobicContact CG-CE2 4.46Å; Q669-F671 PolarHBondContact O-N 3.1Å; Q669-G702 PolarHBondContact O-N 3.01Å
670	G	91.7	Very high	90.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	22.3	-175.8	0	0	0	0	0	114.1	L666 I667 S668 G672 C701 L703	L666-G670 PolarHBondContact O-N 3.03Å; I667-G670 WeakPolarHBondContact O-CA 3.39Å; I667-G670 PolarHBondContact O-N 2.94Å; S668-G670 VanDerWaalsContact C-N 3.3Å; G670-G672 VanDerWaalsContact C-N 3.32Å; G670-C701 WeakPolarHBondContact CA-O 3.31Å; G670-L703 WeakPolarHBondContact O-CB 3.34Å; G670-L703 VanDerWaalsContact O-CG 3.22Å; G670-L703 WeakPolarHBondContact O-CG 3.29Å; G670-L703 PolarHBondContact O-N 3.25Å
671	F	93.4	Very high	90.3	Very high	25 Å²	25	34.7 Å²	34.7	11%	0.11	18%	0.184	C	C	.	.	S	Bend	trans	-89.9	6.1	176.2	-67.5	-43.5	0	0	0	113.5	C573 P574 E594 A595 F598 L666 Q669	C573-F671 PolarHBondContact SG-O 2.91Å; C573-F671 VanDerWaalsContact SG-O 3.39Å; P574-F671 WeakPolarHBondContact CD-O 3.25Å; E594-F671 HydrophobicContact CB-CE1 3.87Å; E594-F671 HydrophobicContact CB-CZ 4.44Å; A595-F671 HydrophobicContact CB-CB 3.65Å; A595-F671 HydrophobicContact CB-CD1 3.66Å; A595-F671 HydrophobicContact CB-CE1 4.45Å; A595-F671 HydrophobicContact CB-CG 3.7Å; F598-F671 HydrophobicContact CB-CD2 4.43Å; F598-F671 HydrophobicContact CB-CE2 3.83Å; F598-F671 HydrophobicContact CB-CZ 4.3Å; F598-F671 AromaticContact CD1-CD2 3.77Å; F598-F671 HydrophobicContact CD1-CD2 3.77Å; F598-F671 AromaticContact CD1-CE2 3.65Å; F598-F671 HydrophobicContact CD1-CE2 3.65Å; F598-F671 HydrophobicContact CD2-CE2 4.05Å; F598-F671 HydrophobicContact CE1-CD2 4.21Å; F598-F671 HydrophobicContact CE1-CE2 4.16Å; F598-F671 HydrophobicContact CG-CD2 4.16Å; F598-F671 AromaticContact CG-CE2 3.58Å; F598-F671 HydrophobicContact CG-CE2 3.58Å; F598-F671 HydrophobicContact CG-CZ 4.43Å; L666-F671 HydrophobicContact CB-CB 4.32Å; L666-F671 HydrophobicContact CD2-CB 4.09Å; L666-F671 HydrophobicContact CD2-CD2 4.06Å; L666-F671 WeakPolarHBondContact O-CA 3.49Å; L666-F671 WeakPolarHBondContact O-CB 3.32Å; L666-F671 PolarHBondContact O-N 3.09Å; Q669-F671 VanDerWaalsContact C-N 3.31Å; Q669-F671 HydrophobicContact CB-CD2 3.56Å; Q669-F671 HydrophobicContact CB-CE2 3.75Å; Q669-F671 HydrophobicContact CB-CG 4.33Å; Q669-F671 HydrophobicContact CG-CD2 4.47Å; Q669-F671 HydrophobicContact CG-CE2 4.46Å; Q669-F671 PolarHBondContact O-N 3.1Å
672	G	90.3	Very high	90	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.			trans	-174.6	167	173.1	0	0	0	0	0	111.7	Q572 G670	Q572-G672 CarbonylContact O-C 3.53Å; Q572-G672 WeakPolarHBondContact O-CA 3.39Å; G670-G672 VanDerWaalsContact C-N 3.32Å
673	T	91.5	Very high	89.6	Confident	16 Å²	16	44.7 Å²	44.7	10%	0.098	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	164.4	174.9	58.4	0	0	0	0	110.9	I571 Q572 H675 W704 F709	I571-T673 WeakPolarHBondContact CA-O 3.45Å; Q572-T673 PolarHBondContact N-O 3.2Å; Q572-T673 PolarHBondContact O-N 2.88Å; T673-H675 PolarHBondContact O-N 3.34Å; T673-W704 HydrophobicContact CG2-CH2 4.06Å; T673-W704 HydrophobicContact CG2-CZ2 3.78Å; T673-F709 HydrophobicContact CG2-CE1 4.4Å; T673-F709 HydrophobicContact CG2-CZ 3.73Å
674	V	92.1	Very high	89.3	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.03	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123	175.7	-174.5	0	0	0	0	109.6	I667 R676 Y686 M689 L690 E693	I667-V674 HydrophobicContact CD1-CG2 4.18Å; I667-V674 HydrophobicContact CG2-CG2 4.47Å; V674-R676 HydrophobicContact CG1-CG 4.31Å; V674-R676 PolarHBondContact O-N 3.03Å; V674-R676 PolarHBondContact O-NH1 3.31Å; V674-Y686 HydrophobicContact CG1-CD2 4.21Å; V674-Y686 HydrophobicContact CG1-CE2 3.82Å; V674-M689 HydrophobicContact CG1-CB 4.39Å; V674-M689 HydrophobicContact CG2-CB 4Å; V674-M689 WeakPolarHBondContact CG2-O 3.3Å; V674-L690 HydrophobicContact CG1-CD2 4.45Å; V674-L690 HydrophobicContact CG2-CD2 4.4Å; V674-E693 HydrophobicContact CG2-CB 3.84Å; V674-E693 HydrophobicContact CG2-CG 4.23Å; V674-E693 WeakPolarHBondContact CG2-OE1 3.41Å; V674-E693 PolarHBondContact N-OE1 3.05Å
675	H	87.5	Confident	89.1	Confident	93 Å²	93	49.3 Å²	49.3	43%	0.431	25%	0.251	S	S	.	.			trans	-82.2	101.1	171.6	-177.3	61.4	0	0	0	110.3	G570 Q572 T673 A677 T680	G570-H675 PolarHBondContact O-N 3.18Å; Q572-H675 HydrophobicContact CB-CB 4.47Å; T673-H675 PolarHBondContact O-N 3.34Å; H675-A677 WeakPolarHBondContact NE2-CB 3.27Å; H675-A677 PolarHBondContact O-N 3.25Å; H675-T680 WeakPolarHBondContact O-CB 3.42Å; H675-T680 VanDerWaalsContact O-CG2 3.27Å; H675-T680 WeakPolarHBondContact O-CG2 3.5Å; H675-T680 PolarHBondContact O-OG1 3.47Å
676	R	86.2	Confident	89	Confident	96 Å²	96	50.3 Å²	50.3	36%	0.362	25%	0.254	S	S	.	.			trans	-80.7	43.5	-171.1	-63.7	167.5	175.2	73	-1.9	114.1	V674 E693	V674-R676 HydrophobicContact CG1-CG 4.31Å; V674-R676 PolarHBondContact O-N 3.03Å; V674-R676 PolarHBondContact O-NH1 3.31Å; R676-E693 IonicContact CZ-OE1 3.87Å; R676-E693 IonicContact CZ-OE2 2.61Å; R676-E693 IonicContact NH1-OE1 2.69Å; R676-E693 PolarHBondContact NH1-OE1 3.38Å; R676-E693 IonicContact NH1-OE2 3.81Å; R676-E693 IonicContact NH2-OE1 3.02Å; R676-E693 IonicContact NH2-OE2 3.98Å; R676-E693 PolarHBondContact NH2-OE2 2.92Å
677	A	78.6	Confident	88.9	Confident	20 Å²	20	57 Å²	57	17%	0.165	28%	0.284	C	S	.	.			trans	-75.9	150.4	171.8	0	0	0	0	0	111.1	H675 T679 T680 E681	H675-A677 WeakPolarHBondContact NE2-CB 3.27Å; H675-A677 PolarHBondContact O-N 3.25Å; A677-T679 PolarHBondContact O-N 3.47Å; A677-T680 WeakPolarHBondContact O-CA 3.42Å; A677-T680 WeakPolarHBondContact O-CB 3.33Å; A677-T680 PolarHBondContact O-N 3.28Å; A677-E681 PolarHBondContact O-N 2.79Å; A677-E681 VanDerWaalsContact O-N 3.1Å
678	P	80	Confident	88.9	Confident	88 Å²	88	60.6 Å²	60.6	57%	0.571	30%	0.304	S	S	*	.	H	α-helix	trans	-54.4	-28.3	179.6	-28.4	34.7	0	0	0	114.7	R682	P678-R682 WeakPolarHBondContact O-CG 3.47Å; P678-R682 PolarHBondContact O-N 3.08Å
679	T	78.9	Confident	88.9	Confident	107 Å²	107	59.1 Å²	59.1	66%	0.656	29%	0.293	S	S	*	.	H	α-helix	trans	-70.5	-37.2	174.3	48.8	0	0	0	0	112.5	A677	A677-T679 PolarHBondContact O-N 3.47Å
680	T	81	Confident	89	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.043	29%	0.29	C	S	.	.	H	α-helix	trans	-69.7	-40.4	175.7	-53.2	0	0	0	0	111.1	H675 A677 R682 S683 Y686 M689	H675-T680 WeakPolarHBondContact O-CB 3.42Å; H675-T680 VanDerWaalsContact O-CG2 3.27Å; H675-T680 WeakPolarHBondContact O-CG2 3.5Å; H675-T680 PolarHBondContact O-OG1 3.47Å; A677-T680 WeakPolarHBondContact O-CA 3.42Å; A677-T680 WeakPolarHBondContact O-CB 3.33Å; A677-T680 PolarHBondContact O-N 3.28Å; T680-R682 PolarHBondContact O-N 3.48Å; T680-S683 WeakPolarHBondContact O-CB 3.31Å; T680-S683 PolarHBondContact O-N 3Å; T680-Y686 HydrophobicContact CG2-CD2 4Å; T680-Y686 HydrophobicContact CG2-CE2 4.48Å; T680-M689 HydrophobicContact CG2-CE 3.77Å
681	E	87.8	Confident	89.2	Confident	99 Å²	99	64.1 Å²	64.1	46%	0.463	32%	0.316	S	S	.	.	H	α-helix	trans	-62.8	-27.8	-179.6	-60.7	-169.9	147.9	0	0	112.9	A677 S683 Y686	A677-E681 PolarHBondContact O-N 2.79Å; A677-E681 VanDerWaalsContact O-N 3.1Å; E681-S683 VanDerWaalsContact C-N 3.3Å; E681-Y686 HydrophobicContact CB-CD1 4.3Å; E681-Y686 HydrophobicContact CB-CE1 4.11Å; E681-Y686 HydrophobicContact CG-CE1 3.96Å; E681-Y686 HydrophobicContact CG-CE2 4.13Å; E681-Y686 PolarHBondContact OE1-OH 3.1Å
682	R	88.3	Confident	89.3	Confident	212 Å²	212	63.1 Å²	63.1	80%	0.8	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.9	174.1	-65.4	172.8	-170.1	-179.6	3.2	113.3	P678 T680	P678-R682 WeakPolarHBondContact O-CG 3.47Å; P678-R682 PolarHBondContact O-N 3.08Å; T680-R682 PolarHBondContact O-N 3.48Å
683	S	88.4	Confident	89.5	Confident	11 Å²	11	63.2 Å²	63.2	8%	0.077	31%	0.313	C	S	.	.	S	Bend	trans	-67	140.2	179.5	177.3	0	0	0	0	110.8	Y624 T680 E681 H685 Y686	Y624-S683 WeakPolarHBondContact OH-CB 3.31Å; Y624-S683 PolarHBondContact OH-OG 3.1Å; T680-S683 WeakPolarHBondContact O-CB 3.31Å; T680-S683 PolarHBondContact O-N 3Å; E681-S683 VanDerWaalsContact C-N 3.3Å; S683-H685 PolarHBondContact O-N 2.85Å; S683-H685 VanDerWaalsContact O-N 3.08Å; S683-H685 PolarHBondContact OG-N 3.31Å; S683-H685 VanDerWaalsContact OG-N 3.1Å; S683-Y686 WeakPolarHBondContact O-CB 3.14Å; S683-Y686 PolarHBondContact O-N 2.83Å; S683-Y686 VanDerWaalsContact O-N 3.13Å
684	P	89.2	Confident	89.6	Confident	99 Å²	99	67 Å²	67	64%	0.643	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-15.9	170.8	28.2	-35.9	0	0	0	112.9
685	H	92.8	Very high	89.6	Confident	27 Å²	27	70 Å²	70	13%	0.125	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-0.5	179.7	-61.7	-51.4	0	0	0	113.7	Y624 Y626 N661 S683 H687 D688 M689	Y624-H685 AromaticContact CD2-CD2 3.68Å; Y624-H685 AromaticContact CE2-CD2 3.63Å; Y624-H685 AromaticContact CG-CD2 3.94Å; Y624-H685 AromaticContact CZ-CD2 3.91Å; Y626-H685 AromaticContact CZ-NE2 3.84Å; Y626-H685 PolarHBondContact OH-NE2 3Å; N661-H685 PolarHBondContact ND2-CD2 3.4Å; S683-H685 PolarHBondContact O-N 2.85Å; S683-H685 VanDerWaalsContact O-N 3.08Å; S683-H685 PolarHBondContact OG-N 3.31Å; S683-H685 VanDerWaalsContact OG-N 3.1Å; H685-H687 VanDerWaalsContact C-N 3.35Å; H685-H687 PolarHBondContact O-N 3.27Å; H685-D688 IonicContact ND1-OD2 3.71Å; H685-D688 PolarHBondContact O-N 3.24Å; H685-M689 HydrophobicContact CB-CE 3.99Å; H685-M689 WeakPolarHBondContact O-CE 3.43Å; H685-M689 WeakPolarHBondContact O-CG 3.23Å; H685-M689 PolarHBondContact O-N 3.43Å
686	Y	93.1	Very high	89.9	Confident	44 Å²	44	65.5 Å²	65.5	17%	0.173	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-44.7	-174.8	-174.5	-129.4	0	0	0	112.7	V674 T680 E681 S683 D688 M689 L690	V674-Y686 HydrophobicContact CG1-CD2 4.21Å; V674-Y686 HydrophobicContact CG1-CE2 3.82Å; T680-Y686 HydrophobicContact CG2-CD2 4Å; T680-Y686 HydrophobicContact CG2-CE2 4.48Å; E681-Y686 HydrophobicContact CB-CD1 4.3Å; E681-Y686 HydrophobicContact CB-CE1 4.11Å; E681-Y686 HydrophobicContact CG-CE1 3.96Å; E681-Y686 HydrophobicContact CG-CE2 4.13Å; E681-Y686 PolarHBondContact OE1-OH 3.1Å; S683-Y686 WeakPolarHBondContact O-CB 3.14Å; S683-Y686 PolarHBondContact O-N 2.83Å; S683-Y686 VanDerWaalsContact O-N 3.13Å; Y686-D688 PolarHBondContact O-N 2.96Å; Y686-M689 PolarHBondContact O-N 3.34Å; Y686-L690 HydrophobicContact CD1-CD1 4.08Å; Y686-L690 HydrophobicContact CD2-CG 4.41Å; Y686-L690 HydrophobicContact CE1-CD1 3.7Å; Y686-L690 HydrophobicContact CE1-CG 4.42Å; Y686-L690 HydrophobicContact CE2-CD1 4.26Å; Y686-L690 HydrophobicContact CE2-CD2 4.2Å; Y686-L690 HydrophobicContact CE2-CG 4.1Å; Y686-L690 WeakPolarHBondContact O-CG 3.35Å; Y686-L690 PolarHBondContact O-N 3.13Å
687	H	93.3	Very high	90.1	Very high	139 Å²	139	63.5 Å²	63.5	64%	0.644	32%	0.318	S	S	*	.	H	α-helix	trans	-65.1	-40	179.3	-170.3	61.9	0	0	0	112.6	H685 M689 L690 K691	H685-H687 VanDerWaalsContact C-N 3.35Å; H685-H687 PolarHBondContact O-N 3.27Å; H687-M689 VanDerWaalsContact C-N 3.32Å; H687-M689 PolarHBondContact O-N 3.34Å; H687-L690 PolarHBondContact O-N 2.85Å; H687-K691 WeakPolarHBondContact O-CB 3.33Å; H687-K691 PolarHBondContact O-N 2.95Å
688	D	95.6	Very high	90.7	Very high	77 Å²	77	67.9 Å²	67.9	41%	0.412	34%	0.338	S	S	.	.	H	α-helix	trans	-64.7	-38.8	176.2	-62.3	-30	0	0	0	111.4	V664 H685 Y686 A692	V664-D688 HydrophobicContact CG1-CB 4.26Å; V664-D688 HydrophobicContact CG2-CB 3.95Å; H685-D688 IonicContact ND1-OD2 3.71Å; H685-D688 PolarHBondContact O-N 3.24Å; Y686-D688 PolarHBondContact O-N 2.96Å; D688-A692 VanDerWaalsContact O-CB 3.27Å; D688-A692 WeakPolarHBondContact O-CB 3.22Å; D688-A692 PolarHBondContact O-N 3.21Å
689	M	95.9	Very high	91.3	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-67.1	-42.4	176.6	-72.3	-172.1	-76.9	0	0	111.8	V664 I667 V674 T680 H685 Y686 H687 A692 E693	V664-M689 HydrophobicContact CG2-CG 3.92Å; I667-M689 HydrophobicContact CD1-CB 3.86Å; I667-M689 HydrophobicContact CD1-CG 3.75Å; I667-M689 HydrophobicContact CD1-SD 4.05Å; V674-M689 HydrophobicContact CG1-CB 4.39Å; V674-M689 HydrophobicContact CG2-CB 4Å; V674-M689 WeakPolarHBondContact CG2-O 3.3Å; T680-M689 HydrophobicContact CG2-CE 3.77Å; H685-M689 HydrophobicContact CB-CE 3.99Å; H685-M689 WeakPolarHBondContact O-CE 3.43Å; H685-M689 WeakPolarHBondContact O-CG 3.23Å; H685-M689 PolarHBondContact O-N 3.43Å; Y686-M689 PolarHBondContact O-N 3.34Å; H687-M689 VanDerWaalsContact C-N 3.32Å; H687-M689 PolarHBondContact O-N 3.34Å; M689-A692 PolarHBondContact O-N 3.36Å; M689-E693 PolarHBondContact O-N 3.5Å
690	L	94.3	Very high	91.8	Very high	56 Å²	56	71.7 Å²	71.7	29%	0.293	34%	0.337	S	S	.	.	H	α-helix	trans	-62.3	-45.4	174.5	-72.6	176	0	0	0	111.8	V674 Y686 H687 E693 E694	V674-L690 HydrophobicContact CG1-CD2 4.45Å; V674-L690 HydrophobicContact CG2-CD2 4.4Å; Y686-L690 HydrophobicContact CD1-CD1 4.08Å; Y686-L690 HydrophobicContact CD2-CG 4.41Å; Y686-L690 HydrophobicContact CE1-CD1 3.7Å; Y686-L690 HydrophobicContact CE1-CG 4.42Å; Y686-L690 HydrophobicContact CE2-CD1 4.26Å; Y686-L690 HydrophobicContact CE2-CD2 4.2Å; Y686-L690 HydrophobicContact CE2-CG 4.1Å; Y686-L690 WeakPolarHBondContact O-CG 3.35Å; Y686-L690 PolarHBondContact O-N 3.13Å; H687-L690 PolarHBondContact O-N 2.85Å; L690-E693 PolarHBondContact O-N 3.42Å; L690-E694 PolarHBondContact O-N 2.89Å
691	K	95.5	Very high	92.1	Very high	125 Å²	125	73 Å²	73	54%	0.543	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-45.3	176.8	-176.4	-178	175.1	-175.6	0	111.5	H687 E693 E694 D695	H687-K691 WeakPolarHBondContact O-CB 3.33Å; H687-K691 PolarHBondContact O-N 2.95Å; K691-E693 VanDerWaalsContact C-N 3.28Å; K691-E693 PolarHBondContact O-N 3.17Å; K691-E694 PolarHBondContact O-N 3.35Å; K691-D695 WeakPolarHBondContact O-CB 3.42Å; K691-D695 VanDerWaalsContact O-CG 3.27Å; K691-D695 PolarHBondContact O-N 2.92Å
692	A	95.2	Very high	92.2	Very high	4 Å²	4	69 Å²	69	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-61.1	-36.7	176.6	0	0	0	0	0	112.4	V664 I667 D688 M689 A696	V664-A692 HydrophobicContact CG1-CB 3.92Å; I667-A692 HydrophobicContact CB-CB 4.12Å; I667-A692 HydrophobicContact CG2-CB 3.86Å; D688-A692 VanDerWaalsContact O-CB 3.27Å; D688-A692 WeakPolarHBondContact O-CB 3.22Å; D688-A692 PolarHBondContact O-N 3.21Å; M689-A692 PolarHBondContact O-N 3.36Å; A692-A696 WeakPolarHBondContact O-CB 3.34Å; A692-A696 PolarHBondContact O-N 3.39Å
693	E	94.6	Very high	92.2	Very high	3 Å²	3	59.3 Å²	59.3	1%	0.014	30%	0.295	C	S	.	.	H	α-helix	trans	-67.2	-42.7	177.1	-161.9	-170.7	-107.4	0	0	110.9	I667 V674 R676 M689 L690 K691 A696 K697 W704	I667-E693 VanDerWaalsContact CG2-CA 3.47Å; I667-E693 HydrophobicContact CG2-CB 3.69Å; I667-E693 HydrophobicContact CG2-CG 4.26Å; I667-E693 VanDerWaalsContact CG2-N 3.29Å; V674-E693 HydrophobicContact CG2-CB 3.84Å; V674-E693 HydrophobicContact CG2-CG 4.23Å; V674-E693 WeakPolarHBondContact CG2-OE1 3.41Å; V674-E693 PolarHBondContact N-OE1 3.05Å; R676-E693 IonicContact CZ-OE1 3.87Å; R676-E693 IonicContact CZ-OE2 2.61Å; R676-E693 IonicContact NH1-OE1 2.69Å; R676-E693 PolarHBondContact NH1-OE1 3.38Å; R676-E693 IonicContact NH1-OE2 3.81Å; R676-E693 IonicContact NH2-OE1 3.02Å; R676-E693 IonicContact NH2-OE2 3.98Å; R676-E693 PolarHBondContact NH2-OE2 2.92Å; M689-E693 PolarHBondContact O-N 3.5Å; L690-E693 PolarHBondContact O-N 3.42Å; K691-E693 VanDerWaalsContact C-N 3.28Å; K691-E693 PolarHBondContact O-N 3.17Å; E693-A696 PolarHBondContact O-N 3.49Å; E693-K697 WeakPolarHBondContact O-CG 3.26Å; E693-K697 PolarHBondContact O-N 2.79Å; E693-K697 IonicContact OE2-NZ 3.88Å; E693-K697 PolarHBondContact OE2-NZ 2.76Å; E693-W704 HydrophobicContact CG-CH2 4.29Å; E693-W704 HydrophobicContact CG-CZ2 3.5Å
694	E	93.5	Very high	92.2	Very high	96 Å²	96	59.2 Å²	59.2	45%	0.449	29%	0.293	S	S	.	.	H	α-helix	trans	-64.2	-45.2	175.8	-171.2	58.2	-153.5	0	0	111.9	L690 K691 A696 K697 I698	L690-E694 PolarHBondContact O-N 2.89Å; K691-E694 PolarHBondContact O-N 3.35Å; E694-A696 VanDerWaalsContact C-N 3.28Å; E694-A696 PolarHBondContact O-N 3.14Å; E694-K697 WeakPolarHBondContact O-CB 3.29Å; E694-K697 PolarHBondContact O-N 2.8Å; E694-I698 HydrophobicContact CG-CD1 3.97Å; E694-I698 WeakPolarHBondContact O-CG1 3.42Å; E694-I698 PolarHBondContact O-N 3.14Å
695	D	92.1	Very high	92.2	Very high	66 Å²	66	57.4 Å²	57.4	35%	0.353	28%	0.283	S	S	.	.	H	α-helix	trans	-59.3	-41	175.6	-70.8	-24.1	0	0	0	110.8	K691 N699	K691-D695 WeakPolarHBondContact O-CB 3.42Å; K691-D695 VanDerWaalsContact O-CG 3.27Å; K691-D695 PolarHBondContact O-N 2.92Å; D695-N699 VanDerWaalsContact O-CB 3.31Å; D695-N699 WeakPolarHBondContact O-CB 3.31Å; D695-N699 VanDerWaalsContact O-CG 3.32Å; D695-N699 PolarHBondContact O-N 3.27Å; D695-N699 PolarHBondContact O-ND2 3.11Å
696	A	93.1	Very high	91.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69.6	-34.5	178.1	0	0	0	0	0	112.7	I667 A692 E693 E694 R700 C701 W704	I667-A696 WeakPolarHBondContact O-CB 3.38Å; A692-A696 WeakPolarHBondContact O-CB 3.34Å; A692-A696 PolarHBondContact O-N 3.39Å; E693-A696 PolarHBondContact O-N 3.49Å; E694-A696 VanDerWaalsContact C-N 3.28Å; E694-A696 PolarHBondContact O-N 3.14Å; A696-R700 WeakPolarHBondContact O-CA 3.48Å; A696-R700 PolarHBondContact O-N 2.99Å; A696-C701 HydrophobicContact CB-CB 4.4Å; A696-C701 PolarHBondContact O-N 3.23Å; A696-W704 VanDerWaalsContact C-CD1 3.45Å; A696-W704 VanDerWaalsContact CB-CD1 3.42Å
697	K	91.8	Very high	91.5	Very high	53 Å²	53	60.5 Å²	60.5	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-64.3	-52.8	172.1	-75.7	170.7	-172.8	166.3	0	111.6	E693 E694 N699 R700 W704	E693-K697 WeakPolarHBondContact O-CG 3.26Å; E693-K697 PolarHBondContact O-N 2.79Å; E693-K697 IonicContact OE2-NZ 3.88Å; E693-K697 PolarHBondContact OE2-NZ 2.76Å; E694-K697 WeakPolarHBondContact O-CB 3.29Å; E694-K697 PolarHBondContact O-N 2.8Å; K697-N699 VanDerWaalsContact C-N 3.26Å; K697-N699 PolarHBondContact O-N 3.16Å; K697-R700 PolarHBondContact O-N 3.42Å; K697-R700 VanDerWaalsContact O-N 3.08Å; K697-W704 HydrophobicContact CB-CD2 4.43Å; K697-W704 HydrophobicContact CD-CE3 4.36Å; K697-W704 HydrophobicContact CD-CH2 4.18Å; K697-W704 HydrophobicContact CD-CZ2 4.39Å; K697-W704 HydrophobicContact CD-CZ3 4.15Å; K697-W704 VanDerWaalsContact CE-CZ3 3.42Å; K697-W704 HydrophobicContact CG-CD2 3.46Å; K697-W704 VanDerWaalsContact CG-CD2 3.46Å; K697-W704 HydrophobicContact CG-CE3 3.5Å; K697-W704 VanDerWaalsContact CG-CE3 3.5Å; K697-W704 HydrophobicContact CG-CG 4.07Å; K697-W704 HydrophobicContact CG-CH2 4.01Å; K697-W704 HydrophobicContact CG-CZ2 3.95Å; K697-W704 HydrophobicContact CG-CZ3 3.77Å
698	I	90.8	Very high	90.9	Very high	112 Å²	112	59.2 Å²	59.2	57%	0.574	30%	0.3	S	S	*	.	H	α-helix	trans	-57	-43.8	-179.7	-70.3	169.2	0	0	0	110.4	E694 R700	E694-I698 HydrophobicContact CG-CD1 3.97Å; E694-I698 WeakPolarHBondContact O-CG1 3.42Å; E694-I698 PolarHBondContact O-N 3.14Å; I698-R700 VanDerWaalsContact C-N 3.31Å; I698-R700 PolarHBondContact O-N 3.36Å
699	N	91.4	Very high	90.4	Very high	109 Å²	109	57.6 Å²	57.6	58%	0.583	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	0.5	-177.8	-64.4	-50.2	0	0	0	113.9	D695 K697 C701	D695-N699 VanDerWaalsContact O-CB 3.31Å; D695-N699 WeakPolarHBondContact O-CB 3.31Å; D695-N699 VanDerWaalsContact O-CG 3.32Å; D695-N699 PolarHBondContact O-N 3.27Å; D695-N699 PolarHBondContact O-ND2 3.11Å; K697-N699 VanDerWaalsContact C-N 3.26Å; K697-N699 PolarHBondContact O-N 3.16Å; N699-C701 VanDerWaalsContact C-N 3.26Å; N699-C701 WeakPolarHBondContact CB-SG 3.46Å; N699-C701 PolarHBondContact O-N 3.31Å
700	R	89.7	Confident	89.8	Confident	166 Å²	166	59.1 Å²	59.1	63%	0.626	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	46.3	-175.5	-63.3	-173.6	174.1	-154.9	-5.7	112.7	A696 K697 I698 S705	A696-R700 WeakPolarHBondContact O-CA 3.48Å; A696-R700 PolarHBondContact O-N 2.99Å; K697-R700 PolarHBondContact O-N 3.42Å; K697-R700 VanDerWaalsContact O-N 3.08Å; I698-R700 VanDerWaalsContact C-N 3.31Å; I698-R700 PolarHBondContact O-N 3.36Å; R700-S705 WeakPolarHBondContact O-CB 3.14Å
701	C	87.8	Confident	89.3	Confident	36 Å²	36	63 Å²	63	24%	0.243	31%	0.314	C	S	.	.			trans	-83.5	143.8	-179.7	-60.3	0	0	0	0	111.5	G670 A696 N699 L703 W704	G670-C701 WeakPolarHBondContact CA-O 3.31Å; A696-C701 HydrophobicContact CB-CB 4.4Å; A696-C701 PolarHBondContact O-N 3.23Å; N699-C701 VanDerWaalsContact C-N 3.26Å; N699-C701 WeakPolarHBondContact CB-SG 3.46Å; N699-C701 PolarHBondContact O-N 3.31Å; C701-L703 PolarHBondContact O-N 2.92Å; C701-W704 WeakPolarHBondContact O-CB 3.36Å; C701-W704 VanDerWaalsContact O-CD1 3.31Å; C701-W704 PolarHBondContact O-N 2.88Å
702	G	89.1	Confident	88.5	Confident	14 Å²	14	62.3 Å²	62.3	14%	0.144	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	51.4	-124	172.8	0	0	0	0	0	113.1	F591 Q669 W704 S705	F591-G702 WeakPolarHBondContact CE1-O 3.49Å; F591-G702 WeakPolarHBondContact CE2-O 3.24Å; F591-G702 WeakPolarHBondContact CZ-O 3.03Å; Q669-G702 PolarHBondContact O-N 3.01Å; G702-W704 PolarHBondContact O-N 2.81Å; G702-W704 VanDerWaalsContact O-N 3.11Å; G702-S705 WeakPolarHBondContact O-CB 3.27Å; G702-S705 PolarHBondContact O-N 3.06Å; G702-S705 PolarHBondContact O-OG 2.58Å
703	L	88.3	Confident	87.9	Confident	8 Å²	8	63.9 Å²	63.9	4%	0.042	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-49.5	-36.5	177.6	-68.8	165.3	0	0	0	113.1	P574 F591 G670 C701 S705 S706 F709	P574-L703 HydrophobicContact CB-CD2 4.26Å; P574-L703 HydrophobicContact CG-CD1 4.32Å; P574-L703 HydrophobicContact CG-CD2 4.19Å; F591-L703 HydrophobicContact CB-CD2 4.31Å; F591-L703 HydrophobicContact CB-CG 4.49Å; F591-L703 HydrophobicContact CD2-CD2 3.93Å; F591-L703 HydrophobicContact CD2-CG 4.36Å; G670-L703 WeakPolarHBondContact O-CB 3.34Å; G670-L703 VanDerWaalsContact O-CG 3.22Å; G670-L703 WeakPolarHBondContact O-CG 3.29Å; G670-L703 PolarHBondContact O-N 3.25Å; C701-L703 PolarHBondContact O-N 2.92Å; L703-S705 PolarHBondContact O-N 2.94Å; L703-S706 WeakPolarHBondContact O-CB 3.43Å; L703-S706 PolarHBondContact O-N 2.98Å; L703-S706 VanDerWaalsContact O-N 3.14Å; L703-F709 HydrophobicContact CB-CD1 3.78Å; L703-F709 HydrophobicContact CB-CD2 4.47Å; L703-F709 HydrophobicContact CB-CE1 3.62Å; L703-F709 HydrophobicContact CB-CE2 4.32Å; L703-F709 HydrophobicContact CB-CG 4.21Å; L703-F709 HydrophobicContact CB-CZ 3.91Å; L703-F709 HydrophobicContact CD1-CE2 4.31Å; L703-F709 HydrophobicContact CD1-CZ 4.04Å; L703-F709 HydrophobicContact CD2-CD2 4.07Å; L703-F709 HydrophobicContact CD2-CE2 4.04Å; L703-F709 HydrophobicContact CD2-CG 4.45Å; L703-F709 HydrophobicContact CD2-CZ 4.42Å; L703-F709 HydrophobicContact CG-CE2 4.47Å; L703-F709 HydrophobicContact CG-CZ 4.36Å; L703-F709 VanDerWaalsContact O-CD1 3.23Å; L703-F709 WeakPolarHBondContact O-CD1 3.46Å
704	W	89.4	Confident	87.2	Confident	10 Å²	10	68.9 Å²	68.9	4%	0.038	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-74.2	-6.8	-178.8	-51.3	108.6	0	0	0	114.4	T673 E693 A696 K697 C701 G702 S706 F709 V710 W713	T673-W704 HydrophobicContact CG2-CH2 4.06Å; T673-W704 HydrophobicContact CG2-CZ2 3.78Å; E693-W704 HydrophobicContact CG-CH2 4.29Å; E693-W704 HydrophobicContact CG-CZ2 3.5Å; A696-W704 VanDerWaalsContact C-CD1 3.45Å; A696-W704 VanDerWaalsContact CB-CD1 3.42Å; K697-W704 HydrophobicContact CB-CD2 4.43Å; K697-W704 HydrophobicContact CD-CE3 4.36Å; K697-W704 HydrophobicContact CD-CH2 4.18Å; K697-W704 HydrophobicContact CD-CZ2 4.39Å; K697-W704 HydrophobicContact CD-CZ3 4.15Å; K697-W704 VanDerWaalsContact CE-CZ3 3.42Å; K697-W704 HydrophobicContact CG-CD2 3.46Å; K697-W704 VanDerWaalsContact CG-CD2 3.46Å; K697-W704 HydrophobicContact CG-CE3 3.5Å; K697-W704 VanDerWaalsContact CG-CE3 3.5Å; K697-W704 HydrophobicContact CG-CG 4.07Å; K697-W704 HydrophobicContact CG-CH2 4.01Å; K697-W704 HydrophobicContact CG-CZ2 3.95Å; K697-W704 HydrophobicContact CG-CZ3 3.77Å; C701-W704 WeakPolarHBondContact O-CB 3.36Å; C701-W704 VanDerWaalsContact O-CD1 3.31Å; C701-W704 PolarHBondContact O-N 2.88Å; G702-W704 PolarHBondContact O-N 2.81Å; G702-W704 VanDerWaalsContact O-N 3.11Å; W704-S706 VanDerWaalsContact C-N 3.3Å; W704-F709 HydrophobicContact CD2-CE1 4.26Å; W704-F709 HydrophobicContact CE3-CD1 4.32Å; W704-F709 AromaticContact CE3-CE1 3.89Å; W704-F709 HydrophobicContact CE3-CE1 3.89Å; W704-F709 HydrophobicContact CH2-CE1 4.08Å; W704-F709 HydrophobicContact CZ2-CE1 4.45Å; W704-F709 AromaticContact CZ3-CE1 3.79Å; W704-F709 HydrophobicContact CZ3-CE1 3.79Å; W704-V710 HydrophobicContact CE3-CG2 4.23Å; W704-W713 AromaticContact CH2-CD2 3.84Å; W704-W713 HydrophobicContact CH2-CD2 3.84Å; W704-W713 AromaticContact CH2-CE2 3.85Å; W704-W713 HydrophobicContact CH2-CE3 4.14Å; W704-W713 HydrophobicContact CH2-CG 4.28Å; W704-W713 HydrophobicContact CH2-CH2 4.49Å; W704-W713 HydrophobicContact CH2-CZ2 4.18Å; W704-W713 HydrophobicContact CH2-CZ3 4.47Å; W704-W713 AromaticContact CZ3-CD2 3.99Å; W704-W713 HydrophobicContact CZ3-CD2 3.99Å; W704-W713 HydrophobicContact CZ3-CE3 4Å; W704-W713 HydrophobicContact CZ3-CG 4.36Å; W704-W713 HydrophobicContact CZ3-CZ3 4.5Å
705	S	88.8	Confident	86.3	Confident	60 Å²	60	66.5 Å²	66.5	42%	0.42	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-79.3	-13.6	169.4	69.3	0	0	0	0	113.1	F591 R700 G702 L703	F591-S705 WeakPolarHBondContact CZ-OG 3.26Å; R700-S705 WeakPolarHBondContact O-CB 3.14Å; G702-S705 WeakPolarHBondContact O-CB 3.27Å; G702-S705 PolarHBondContact O-N 3.06Å; G702-S705 PolarHBondContact O-OG 2.58Å; L703-S705 PolarHBondContact O-N 2.94Å
706	S	87	Confident	85.4	Confident	33 Å²	33	69 Å²	69	23%	0.231	35%	0.347	C	S	.	.			trans	-95.4	110.3	-179.9	173.2	0	0	0	0	111.2	L703 W704 Q708 F709 V710	L703-S706 WeakPolarHBondContact O-CB 3.43Å; L703-S706 PolarHBondContact O-N 2.98Å; L703-S706 VanDerWaalsContact O-N 3.14Å; W704-S706 VanDerWaalsContact C-N 3.3Å; S706-Q708 PolarHBondContact O-N 2.98Å; S706-F709 PolarHBondContact O-N 3.26Å; S706-F709 VanDerWaalsContact O-N 3.12Å; S706-F709 PolarHBondContact OG-N 2.98Å; S706-V710 WeakPolarHBondContact O-CG2 3.49Å; S706-V710 PolarHBondContact O-N 2.98Å
707	D	84	Confident	84.3	Confident	104 Å²	104	72.2 Å²	72.2	56%	0.556	37%	0.367	S	S	*	.	H	α-helix	trans	-59.3	-29.4	176.1	-66.4	-35.5	0	0	0	112.5	K711	D707-K711 WeakPolarHBondContact O-CG 2.98Å; D707-K711 PolarHBondContact O-N 3.37Å
708	Q	81	Confident	82.7	Confident	112 Å²	112	76.6 Å²	76.6	52%	0.523	39%	0.388	S	S	.	.	H	α-helix	trans	-67.5	-47	175.9	-177.5	63.3	22.1	0	0	111.2	S706 V710 K711 E712	S706-Q708 PolarHBondContact O-N 2.98Å; Q708-V710 PolarHBondContact O-N 3.25Å; Q708-K711 PolarHBondContact O-N 2.77Å; Q708-E712 PolarHBondContact NE2-OE1 2.8Å; Q708-E712 WeakPolarHBondContact O-CG 3.28Å; Q708-E712 PolarHBondContact O-N 2.79Å; Q708-E712 VanDerWaalsContact O-N 3.08Å
709	F	85.2	Confident	80.7	Confident	42 Å²	42	77.4 Å²	77.4	18%	0.184	39%	0.393	C	S	.	.	H	α-helix	trans	-62.3	-44.2	177.8	171.6	-95.7	0	0	0	111.2	T673 L703 W704 S706 K711 E712 W713	T673-F709 HydrophobicContact CG2-CE1 4.4Å; T673-F709 HydrophobicContact CG2-CZ 3.73Å; L703-F709 HydrophobicContact CB-CD1 3.78Å; L703-F709 HydrophobicContact CB-CD2 4.47Å; L703-F709 HydrophobicContact CB-CE1 3.62Å; L703-F709 HydrophobicContact CB-CE2 4.32Å; L703-F709 HydrophobicContact CB-CG 4.21Å; L703-F709 HydrophobicContact CB-CZ 3.91Å; L703-F709 HydrophobicContact CD1-CE2 4.31Å; L703-F709 HydrophobicContact CD1-CZ 4.04Å; L703-F709 HydrophobicContact CD2-CD2 4.07Å; L703-F709 HydrophobicContact CD2-CE2 4.04Å; L703-F709 HydrophobicContact CD2-CG 4.45Å; L703-F709 HydrophobicContact CD2-CZ 4.42Å; L703-F709 HydrophobicContact CG-CE2 4.47Å; L703-F709 HydrophobicContact CG-CZ 4.36Å; L703-F709 VanDerWaalsContact O-CD1 3.23Å; L703-F709 WeakPolarHBondContact O-CD1 3.46Å; W704-F709 HydrophobicContact CD2-CE1 4.26Å; W704-F709 HydrophobicContact CE3-CD1 4.32Å; W704-F709 AromaticContact CE3-CE1 3.89Å; W704-F709 HydrophobicContact CE3-CE1 3.89Å; W704-F709 HydrophobicContact CH2-CE1 4.08Å; W704-F709 HydrophobicContact CZ2-CE1 4.45Å; W704-F709 AromaticContact CZ3-CE1 3.79Å; W704-F709 HydrophobicContact CZ3-CE1 3.79Å; S706-F709 PolarHBondContact O-N 3.26Å; S706-F709 VanDerWaalsContact O-N 3.12Å; S706-F709 PolarHBondContact OG-N 2.98Å; F709-K711 VanDerWaalsContact C-N 3.32Å; F709-K711 PolarHBondContact O-N 2.97Å; F709-E712 PolarHBondContact O-N 3.27Å; F709-W713 HydrophobicContact CE1-CB 4.35Å; F709-W713 HydrophobicContact CZ-CB 4.34Å; F709-W713 HydrophobicContact CZ-CG 4.42Å; F709-W713 VanDerWaalsContact O-CB 3.27Å; F709-W713 WeakPolarHBondContact O-CB 3.42Å; F709-W713 PolarHBondContact O-N 3.25Å
710	V	83.9	Confident	78.6	Confident	33 Å²	33	78.6 Å²	78.6	20%	0.2	40%	0.399	C	S	.	.	H	α-helix	trans	-57.6	-46.1	179	174.5	0	0	0	0	110.7	W704 S706 Q708 W713 E714	W704-V710 HydrophobicContact CE3-CG2 4.23Å; S706-V710 WeakPolarHBondContact O-CG2 3.49Å; S706-V710 PolarHBondContact O-N 2.98Å; Q708-V710 PolarHBondContact O-N 3.25Å; V710-W713 PolarHBondContact O-N 3.39Å; V710-E714 HydrophobicContact CG1-CG 4.39Å; V710-E714 WeakPolarHBondContact O-CB 3.27Å; V710-E714 VanDerWaalsContact O-CG 3.28Å; V710-E714 WeakPolarHBondContact O-CG 3.5Å; V710-E714 PolarHBondContact O-N 2.86Å
711	K	82.3	Confident	76	Confident	138 Å²	138	74.5 Å²	74.5	60%	0.6	40%	0.396	S	S	*	.	H	α-helix	trans	-63.8	-44.4	178.1	-74.1	175.1	-178.3	176.7	0	113.4	D707 Q708 F709 W713 A715	D707-K711 WeakPolarHBondContact O-CG 2.98Å; D707-K711 PolarHBondContact O-N 3.37Å; Q708-K711 PolarHBondContact O-N 2.77Å; F709-K711 VanDerWaalsContact C-N 3.32Å; F709-K711 PolarHBondContact O-N 2.97Å; K711-W713 VanDerWaalsContact C-N 3.34Å; K711-A715 WeakPolarHBondContact O-CB 3.42Å; K711-A715 PolarHBondContact O-N 2.98Å
712	E	79.3	Confident	73.1	Confident	110 Å²	110	78.5 Å²	78.5	51%	0.514	42%	0.416	S	S	.	.	H	α-helix	trans	-63.4	-43	178.3	-73.4	170.2	-176.1	0	0	111.1	Q708 F709 A715 E716	Q708-E712 PolarHBondContact NE2-OE1 2.8Å; Q708-E712 WeakPolarHBondContact O-CG 3.28Å; Q708-E712 PolarHBondContact O-N 2.79Å; Q708-E712 VanDerWaalsContact O-N 3.08Å; F709-E712 PolarHBondContact O-N 3.27Å; E712-A715 PolarHBondContact O-N 2.98Å; E712-E716 PolarHBondContact O-N 2.49Å
713	W	82.1	Confident	70.6	Confident	36 Å²	36	83.1 Å²	83.1	14%	0.136	44%	0.443	C	S	.	.	H	α-helix	trans	-66.9	-43.4	178.2	-174.8	83.8	0	0	0	112.3	W704 F709 V710 K711 A715 E716 V717	W704-W713 AromaticContact CH2-CD2 3.84Å; W704-W713 HydrophobicContact CH2-CD2 3.84Å; W704-W713 AromaticContact CH2-CE2 3.85Å; W704-W713 HydrophobicContact CH2-CE3 4.14Å; W704-W713 HydrophobicContact CH2-CG 4.28Å; W704-W713 HydrophobicContact CH2-CH2 4.49Å; W704-W713 HydrophobicContact CH2-CZ2 4.18Å; W704-W713 HydrophobicContact CH2-CZ3 4.47Å; W704-W713 AromaticContact CZ3-CD2 3.99Å; W704-W713 HydrophobicContact CZ3-CD2 3.99Å; W704-W713 HydrophobicContact CZ3-CE3 4Å; W704-W713 HydrophobicContact CZ3-CG 4.36Å; W704-W713 HydrophobicContact CZ3-CZ3 4.5Å; F709-W713 HydrophobicContact CE1-CB 4.35Å; F709-W713 HydrophobicContact CZ-CB 4.34Å; F709-W713 HydrophobicContact CZ-CG 4.42Å; F709-W713 VanDerWaalsContact O-CB 3.27Å; F709-W713 WeakPolarHBondContact O-CB 3.42Å; F709-W713 PolarHBondContact O-N 3.25Å; V710-W713 PolarHBondContact O-N 3.39Å; K711-W713 VanDerWaalsContact C-N 3.34Å; W713-A715 VanDerWaalsContact C-N 3.32Å; W713-A715 PolarHBondContact O-N 3.48Å; W713-E716 PolarHBondContact O-N 2.74Å; W713-V717 HydrophobicContact CD2-CG2 4Å; W713-V717 HydrophobicContact CE3-CG2 4.1Å; W713-V717 HydrophobicContact CH2-CG2 3.74Å; W713-V717 HydrophobicContact CZ2-CG2 3.64Å; W713-V717 HydrophobicContact CZ3-CG2 3.98Å; W713-V717 WeakPolarHBondContact O-CG2 3.43Å; W713-V717 PolarHBondContact O-N 3.21Å
714	E	80.7	Confident	67.7	Low	108 Å²	108	88.3 Å²	88.3	51%	0.505	48%	0.475	S	S	.	.	H	α-helix	trans	-60.5	-40.9	174.6	-76.4	174.5	171.4	0	0	111.7	V710 V717 Q718	V710-E714 HydrophobicContact CG1-CG 4.39Å; V710-E714 WeakPolarHBondContact O-CB 3.27Å; V710-E714 VanDerWaalsContact O-CG 3.28Å; V710-E714 WeakPolarHBondContact O-CG 3.5Å; V710-E714 PolarHBondContact O-N 2.86Å; E714-V717 PolarHBondContact O-N 2.84Å; E714-Q718 WeakPolarHBondContact O-CB 3.27Å; E714-Q718 PolarHBondContact O-N 2.85Å
715	A	75.4	Confident	64.7	Low	46 Å²	46	94.3 Å²	94.3	38%	0.38	51%	0.512	S	S	.	.	H	α-helix	trans	-64.6	-40.7	176.2	0	0	0	0	0	112.5	K711 E712 W713 Q718 N719	K711-A715 WeakPolarHBondContact O-CB 3.42Å; K711-A715 PolarHBondContact O-N 2.98Å; E712-A715 PolarHBondContact O-N 2.98Å; W713-A715 VanDerWaalsContact C-N 3.32Å; W713-A715 PolarHBondContact O-N 3.48Å; A715-Q718 PolarHBondContact O-N 2.9Å; A715-N719 WeakPolarHBondContact O-CB 3.41Å; A715-N719 PolarHBondContact O-N 2.87Å
716	E	72.4	Confident	61.6	Low	120 Å²	120	96.7 Å²	96.7	56%	0.561	53%	0.529	S	S	*	.	H	α-helix	trans	-64.5	-43.4	175.7	-171.4	-175.4	173	0	0	111.8	E712 W713 Q718 N719 N720	E712-E716 PolarHBondContact O-N 2.49Å; W713-E716 PolarHBondContact O-N 2.74Å; E716-Q718 VanDerWaalsContact C-N 3.32Å; E716-Q718 PolarHBondContact O-N 3.44Å; E716-N719 PolarHBondContact O-N 3.26Å; E716-N720 PolarHBondContact O-N 2.79Å; E716-N720 VanDerWaalsContact O-N 3.11Å
717	V	69	Low	58.5	Low	67 Å²	67	101.1 Å²	101.1	41%	0.406	56%	0.56	S	S	.	*	H	α-helix	trans	-65.2	-37.5	177	173	0	0	0	0	111.3	W713 E714	W713-V717 HydrophobicContact CD2-CG2 4Å; W713-V717 HydrophobicContact CE3-CG2 4.1Å; W713-V717 HydrophobicContact CH2-CG2 3.74Å; W713-V717 HydrophobicContact CZ2-CG2 3.64Å; W713-V717 HydrophobicContact CZ3-CG2 3.98Å; W713-V717 WeakPolarHBondContact O-CG2 3.43Å; W713-V717 PolarHBondContact O-N 3.21Å; E714-V717 PolarHBondContact O-N 2.84Å
718	Q	58.6	Low	55.5	Low	144 Å²	144	100.1 Å²	100.1	67%	0.673	58%	0.575	S	S	*	*	H	α-helix	trans	-70.7	-39.8	177.9	-165.4	167.6	3.1	0	0	112	E714 A715 E716 S721	E714-Q718 WeakPolarHBondContact O-CB 3.27Å; E714-Q718 PolarHBondContact O-N 2.85Å; A715-Q718 PolarHBondContact O-N 2.9Å; E716-Q718 VanDerWaalsContact C-N 3.32Å; E716-Q718 PolarHBondContact O-N 3.44Å; Q718-S721 PolarHBondContact O-N 3.44Å; Q718-S721 PolarHBondContact O-OG 3.49Å
719	N	49.4	Very low	52.7	Low	130 Å²	130	98.9 Å²	98.9	70%	0.695	58%	0.583	S	S	*	*	H	α-helix	trans	-67.9	-34.1	177.3	-77.1	-11.5	0	0	0	113.4	A715 E716 S721	A715-N719 WeakPolarHBondContact O-CB 3.41Å; A715-N719 PolarHBondContact O-N 2.87Å; E716-N719 PolarHBondContact O-N 3.26Å; N719-S721 PolarHBondContact O-N 3.07Å
720	N	47.6	Very low	49.6	Very low	133 Å²	133	105.2 Å²	105.2	71%	0.711	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-0	175.9	-82.8	-32.9	0	0	0	114.1	E716	E716-N720 PolarHBondContact O-N 2.79Å; E716-N720 VanDerWaalsContact O-N 3.11Å
721	S	35	Very low	46.7	Very low	80 Å²	80	111.3 Å²	111.3	56%	0.559	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	2.5	-179.1	71.8	0	0	0	0	114.8	Q718 N719 P723	Q718-S721 PolarHBondContact O-N 3.44Å; Q718-S721 PolarHBondContact O-OG 3.49Å; N719-S721 PolarHBondContact O-N 3.07Å; S721-P723 VanDerWaalsContact O-CD 3.25Å; S721-P723 WeakPolarHBondContact O-CD 3.3Å
722	D	26.5	Very low	43.9	Very low	121 Å²	121	108.2 Å²	108.2	65%	0.647	65%	0.653	S	S	*	*			trans	-85.2	107.9	177.9	-150.2	-22	0	0	0	111.5	T724	D722-T724 VanDerWaalsContact C-N 3.33Å; D722-T724 PolarHBondContact O-N 2.97Å; D722-T724 PolarHBondContact OD1-OG1 2.8Å
723	P	36.8	Very low	41.2	Very low	111 Å²	111	109 Å²	109	72%	0.721	67%	0.67	S	S	*	*			trans	-88.2	13.4	-165.9	-2.1	22.4	0	0	0	114.7	S721 V725	S721-P723 VanDerWaalsContact O-CD 3.25Å; S721-P723 WeakPolarHBondContact O-CD 3.3Å; P723-V725 PolarHBondContact O-N 2.92Å
724	T	27.2	Very low	38.4	Very low	116 Å²	116	114.7 Å²	114.7	71%	0.712	70%	0.702	S	S	*	*			trans	-89.8	2.7	-162.3	50.9	0	0	0	0	116.5	D722	D722-T724 VanDerWaalsContact C-N 3.33Å; D722-T724 PolarHBondContact O-N 2.97Å; D722-T724 PolarHBondContact OD1-OG1 2.8Å
725	V	25.6	Very low	35.6	Very low	136 Å²	136	116 Å²	116	82%	0.824	72%	0.717	S	S	*	*			trans	-116.8	75.7	175.6	-164.4	0	0	0	0	110.1	P723	P723-V725 PolarHBondContact O-N 2.92Å
726	S	24	Very low	33.2	Very low	111 Å²	111	118.9 Å²	118.9	78%	0.776	73%	0.732	S	S	*	*			trans	-143.3	81.9	174.2	-178.9	0	0	0	0	110
727	S	22.3	Very low	31	Very low	125 Å²	125	120.9 Å²	120.9	87%	0.874	75%	0.746	S	S	*	*			trans	-171.8	107.1	154.6	60.8	0	0	0	0	110.1
728	G	21.5	Very low	29.1	Very low	84 Å²	84	121.4 Å²	121.4	87%	0.866	76%	0.757	S	S	*	*			trans	-176.6	79.8	176.9	0	0	0	0	0	110.5
729	A	22.9	Very low	27.7	Very low	85 Å²	85	118.3 Å²	118.3	70%	0.702	76%	0.764	S	S	*	*			trans	-76.4	150.1	179.9	0	0	0	0	0	112.3
730	E	20.2	Very low	26.6	Very low	175 Å²	175	116.8 Å²	116.8	82%	0.818	76%	0.756	S	S	*	*			trans	71.4	132.6	138.6	-71.2	175.6	-177.9	0	0	122.1
731	D	22.9	Very low	25.9	Very low	161 Å²	161	114.3 Å²	114.3	86%	0.861	75%	0.749	S	S	*	*			trans	66	109.9	148.6	-71	-8.4	0	0	0	121.3
732	G	23	Very low	25.9	Very low	74 Å²	74	118.3 Å²	118.3	76%	0.763	76%	0.759	S	S	*	*			trans	179.9	80.8	167.2	0	0	0	0	0	113.2	L734	G732-L734 PolarHBondContact O-N 2.75Å
733	S	22.3	Very low	26	Very low	126 Å²	126	118.5 Å²	118.5	88%	0.881	75%	0.751	S	S	*	*			trans	-51.1	106.9	169.7	-172.9	0	0	0	0	112
734	L	23.2	Very low	25.9	Very low	156 Å²	156	116.4 Å²	116.4	82%	0.817	73%	0.734	S	S	*	*			trans	-147.8	122.7	158.7	-107.9	154.4	0	0	0	107.3	G732 P736	G732-L734 PolarHBondContact O-N 2.75Å; L734-P736 WeakPolarHBondContact O-CD 3.39Å; L734-P736 VanDerWaalsContact O-N 3.07Å
735	V	22.7	Very low	26.2	Very low	134 Å²	134	116.7 Å²	116.7	81%	0.812	73%	0.731	S	S	*	*			trans	-55.3	109.7	-178.4	-176.3	0	0	0	0	108.6	L737	V735-L737 PolarHBondContact O-N 3.43Å
736	P	24.4	Very low	26.5	Very low	108 Å²	108	113.8 Å²	113.8	70%	0.701	71%	0.71	S	S	*	*			trans	-70	130.2	-170.9	-20.3	33.2	0	0	0	110.5	L734 A738	L734-P736 WeakPolarHBondContact O-CD 3.39Å; L734-P736 VanDerWaalsContact O-N 3.07Å; P736-A738 PolarHBondContact O-N 3.41Å
737	L	25.6	Very low	26.9	Very low	161 Å²	161	112.4 Å²	112.4	84%	0.843	69%	0.694	S	S	*	*			trans	-63.4	39.9	172.4	-116.1	127.1	0	0	0	112.8	V735 G739	V735-L737 PolarHBondContact O-N 3.43Å; L737-G739 PolarHBondContact O-N 2.84Å
738	A	29.4	Very low	27.7	Very low	78 Å²	78	111.3 Å²	111.3	65%	0.645	69%	0.686	S	S	*	*			trans	-79.7	26.5	-176.7	0	0	0	0	0	113.5	P736 L740	P736-A738 PolarHBondContact O-N 3.41Å; A738-L740 VanDerWaalsContact C-N 3.25Å; A738-L740 PolarHBondContact O-N 2.85Å
739	G	28.3	Very low	28.1	Very low	80 Å²	80	116.2 Å²	116.2	83%	0.825	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	3.2	174.7	0	0	0	0	0	114.5	L737	L737-G739 PolarHBondContact O-N 2.84Å
740	L	28.2	Very low	28.5	Very low	97 Å²	97	115.4 Å²	115.4	51%	0.508	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.9	-2.4	-177.6	-89.1	133.1	0	0	0	114.4	A738 E742 L744	A738-L740 VanDerWaalsContact C-N 3.25Å; A738-L740 PolarHBondContact O-N 2.85Å; L740-E742 VanDerWaalsContact C-N 3.3Å; L740-E742 PolarHBondContact O-N 2.72Å; L740-L744 HydrophobicContact CB-CD1 4.17Å; L740-L744 HydrophobicContact CD2-CD1 3.29Å; L740-L744 HydrophobicContact CG-CD1 4.34Å
741	S	32.1	Very low	28.8	Very low	81 Å²	81	115.9 Å²	115.9	57%	0.566	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-9.4	-171.6	-170	0	0	0	0	115.6
742	E	35.4	Very low	29	Very low	165 Å²	165	115.4 Å²	115.4	77%	0.771	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	0.3	178.6	-85.9	-177.1	171.6	0	0	114.4	L740	L740-E742 VanDerWaalsContact C-N 3.3Å; L740-E742 PolarHBondContact O-N 2.72Å
743	Y	28.8	Very low	29.2	Very low	124 Å²	124	118.6 Å²	118.6	49%	0.486	67%	0.668	S	S	.	*	S	Bend	trans	-141	15.1	177.8	-90.3	-81.1	0	0	0	115.5	R1019	Y743-R1019 PolarHBondContact OH-NH2 3.14Å
744	L	33.3	Very low	30.1	Very low	68 Å²	68	121.2 Å²	121.2	36%	0.356	67%	0.666	S	S	.	*			trans	-137.4	26.8	-166.9	-103.4	146.2	0	0	0	116.1	L740 D746 L747	L740-L744 HydrophobicContact CB-CD1 4.17Å; L740-L744 HydrophobicContact CD2-CD1 3.29Å; L740-L744 HydrophobicContact CG-CD1 4.34Å; L744-D746 PolarHBondContact O-N 3.09Å; L744-L747 HydrophobicContact CD2-CB 4.07Å; L744-L747 HydrophobicContact CD2-CD1 3.36Å; L744-L747 HydrophobicContact CD2-CG 3.75Å
745	D	33.6	Very low	30.6	Very low	121 Å²	121	121.1 Å²	121.1	65%	0.647	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-2.5	179.5	-85.8	-3.2	0	0	0	115
746	D	32.5	Very low	31.3	Very low	75 Å²	75	118.8 Å²	118.8	40%	0.401	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.6	17.9	179.8	-88.5	-14.5	0	0	0	114.7	L744	L744-D746 PolarHBondContact O-N 3.09Å
747	L	32.9	Very low	31.5	Very low	82 Å²	82	120.5 Å²	120.5	43%	0.429	67%	0.673	S	S	.	*			trans	-96.4	5.9	163.1	-69.6	-172.2	0	0	0	113.5	L744 E749 L750	L744-L747 HydrophobicContact CD2-CB 4.07Å; L744-L747 HydrophobicContact CD2-CD1 3.36Å; L744-L747 HydrophobicContact CD2-CG 3.75Å; L747-E749 PolarHBondContact O-N 2.88Å; L747-E749 VanDerWaalsContact O-N 3.13Å; L747-L750 HydrophobicContact CD2-CD1 4.08Å; L747-L750 PolarHBondContact O-N 2.95Å
748	S	37.9	Very low	31.6	Very low	102 Å²	102	119.7 Å²	119.7	71%	0.713	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-9.5	178	57.7	0	0	0	0	114.6	L750	S748-L750 VanDerWaalsContact C-N 3.27Å
749	E	31.3	Very low	31.5	Very low	188 Å²	188	125.1 Å²	125.1	88%	0.879	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-1.9	169.6	-71.2	-168.8	173.1	0	0	113.7	L747 Q751	L747-E749 PolarHBondContact O-N 2.88Å; L747-E749 VanDerWaalsContact O-N 3.13Å; E749-Q751 PolarHBondContact O-N 3.34Å
750	L	29.9	Very low	31.4	Very low	68 Å²	68	127.1 Å²	127.1	36%	0.356	67%	0.674	S	S	.	*	S	Bend	trans	-90.8	96.4	166.3	-73.2	159.4	0	0	0	108.2	L747 S748 I752	L747-L750 HydrophobicContact CD2-CD1 4.08Å; L747-L750 PolarHBondContact O-N 2.95Å; S748-L750 VanDerWaalsContact C-N 3.27Å; L750-I752 WeakPolarHBondContact O-CG1 3.32Å; L750-I752 PolarHBondContact O-N 2.94Å
751	Q	27.4	Very low	31.2	Very low	185 Å²	185	128.5 Å²	128.5	86%	0.864	69%	0.686	S	S	*	*			trans	-53.1	110	169.1	-69.6	173.3	-32	0	0	109.4	E749	E749-Q751 PolarHBondContact O-N 3.34Å
752	I	27.5	Very low	31.1	Very low	150 Å²	150	129.6 Å²	129.6	77%	0.769	69%	0.685	S	S	*	*			trans	-118.4	98.4	174.3	-62.9	166.7	0	0	0	105.1	L750	L750-I752 WeakPolarHBondContact O-CG1 3.32Å; L750-I752 PolarHBondContact O-N 2.94Å
753	D	26.7	Very low	30.7	Very low	141 Å²	141	127.2 Å²	127.2	75%	0.754	68%	0.678	S	S	*	*			trans	-82.6	160	176.1	-68.1	-17	0	0	0	111.4	D755	D753-D755 VanDerWaalsContact C-N 3.34Å; D753-D755 PolarHBondContact O-N 3.14Å
754	E	41.3	Very low	30.8	Very low	182 Å²	182	125.8 Å²	125.8	85%	0.85	68%	0.678	S	S	*	*	S	Bend	trans	-72.6	1.5	-143.8	-64	-167.2	134.9	0	0	118.6
755	D	33.9	Very low	30.8	Very low	153 Å²	153	127.9 Å²	127.9	82%	0.818	69%	0.686	S	S	*	*			trans	-108.4	95.9	-179.1	-69.7	-42.2	0	0	0	110	D753 D757	D753-D755 VanDerWaalsContact C-N 3.34Å; D753-D755 PolarHBondContact O-N 3.14Å; D755-D757 PolarHBondContact O-N 3.24Å
756	G	36.8	Very low	31	Very low	86 Å²	86	127.1 Å²	127.1	89%	0.887	68%	0.682	S	S	*	*			trans	-61	34.2	-173.1	0	0	0	0	0	118.1
757	D	28.1	Very low	31.5	Very low	144 Å²	144	126.9 Å²	126.9	77%	0.77	68%	0.68	S	S	*	*			trans	-102.5	109.3	168.7	-93.9	-24.2	0	0	0	110.9	D755 K759	D755-D757 PolarHBondContact O-N 3.24Å; D757-K759 PolarHBondContact O-N 2.85Å
758	L	29.1	Very low	31.8	Very low	143 Å²	143	130.6 Å²	130.6	75%	0.749	69%	0.693	S	S	*	*			trans	-62.2	85.1	179.4	-169.3	71.7	0	0	0	111.5	I762	L758-I762 HydrophobicContact CD2-CD1 3.89Å; L758-I762 HydrophobicContact CD2-CG1 4.25Å
759	K	27	Very low	32.7	Very low	192 Å²	192	133.4 Å²	133.4	84%	0.835	70%	0.695	S	S	*	*			trans	-128.7	58.9	170.7	-76.6	-172.6	-179.3	169.8	0	112.8	D757	D757-K759 PolarHBondContact O-N 2.85Å
760	T	25.7	Very low	34.6	Very low	123 Å²	123	125.7 Å²	125.7	76%	0.755	66%	0.659	S	S	*	*	S	Bend	trans	-130.2	104.9	140.4	50.5	0	0	0	0	108.2	I762	T760-I762 PolarHBondContact O-N 3.49Å
761	V	25	Very low	37.1	Very low	125 Å²	125	126.1 Å²	126.1	76%	0.758	67%	0.668	S	S	*	*			trans	-2.8	101.1	166.7	-172.8	0	0	0	0	113.7	N763	V761-N763 VanDerWaalsContact C-N 3.32Å; V761-N763 WeakPolarHBondContact CG1-OD1 2.98Å; V761-N763 PolarHBondContact O-N 2.95Å
762	I	28.5	Very low	40.1	Very low	105 Å²	105	119.1 Å²	119.1	54%	0.538	63%	0.634	S	S	.	*			trans	-54.9	102.4	159.4	-58.2	171.1	0	0	0	105.7	L758 T760 D764	L758-I762 HydrophobicContact CD2-CD1 3.89Å; L758-I762 HydrophobicContact CD2-CG1 4.25Å; T760-I762 PolarHBondContact O-N 3.49Å; I762-D764 HydrophobicContact CG2-CB 4.32Å; I762-D764 PolarHBondContact O-N 3.32Å
763	N	27.4	Very low	43.2	Very low	115 Å²	115	116.8 Å²	116.8	62%	0.615	62%	0.618	S	S	*	*			trans	-73.9	81.5	162.4	-81.8	-10.6	0	0	0	106.8	V761 E765	V761-N763 VanDerWaalsContact C-N 3.32Å; V761-N763 WeakPolarHBondContact CG1-OD1 2.98Å; V761-N763 PolarHBondContact O-N 2.95Å; N763-E765 PolarHBondContact O-N 3.14Å
764	D	31.1	Very low	46.4	Very low	93 Å²	93	113.4 Å²	113.4	50%	0.497	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-55.1	-2.8	166.2	-97.9	-29.2	0	0	0	112.6	I762 N766	I762-D764 HydrophobicContact CG2-CB 4.32Å; I762-D764 PolarHBondContact O-N 3.32Å; D764-N766 VanDerWaalsContact C-N 3.3Å; D764-N766 PolarHBondContact O-N 2.9Å
765	E	32.7	Very low	49	Very low	112 Å²	112	104.7 Å²	104.7	52%	0.523	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-63.2	-25.5	179	-68.2	-78.5	118.2	0	0	113.6	N763 I767 K768	N763-E765 PolarHBondContact O-N 3.14Å; E765-I767 PolarHBondContact O-N 2.96Å; E765-K768 WeakPolarHBondContact O-CB 2.95Å; E765-K768 PolarHBondContact O-N 2.96Å; E765-K768 IonicContact OE1-NZ 3.27Å; E765-K768 PolarHBondContact OE1-NZ 2.91Å
766	N	39.3	Very low	51.9	Low	106 Å²	106	101 Å²	101	57%	0.567	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-73.9	-24.2	-177	-78.6	-10.5	0	0	0	114.4	D764	D764-N766 VanDerWaalsContact C-N 3.3Å; D764-N766 PolarHBondContact O-N 2.9Å
767	I	41.1	Very low	54.7	Low	70 Å²	70	97.6 Å²	97.6	36%	0.359	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-27.9	171.8	-63.3	174.2	0	0	0	110.6	E765 Q769 L770 N993	E765-I767 PolarHBondContact O-N 2.96Å; I767-Q769 PolarHBondContact O-N 3.34Å; I767-L770 PolarHBondContact O-N 3.07Å; I767-N993 HydrophobicContact CD1-CB 3.65Å; I767-N993 WeakPolarHBondContact CD1-ND2 3.42Å
768	K	40.5	Very low	57.8	Low	159 Å²	159	92.7 Å²	92.7	69%	0.691	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-11.8	173.7	-69.8	-176.3	-174	166.2	0	113.6	E765	E765-K768 WeakPolarHBondContact O-CB 2.95Å; E765-K768 PolarHBondContact O-N 2.96Å; E765-K768 IonicContact OE1-NZ 3.27Å; E765-K768 PolarHBondContact OE1-NZ 2.91Å
769	Q	57	Low	60.8	Low	162 Å²	162	87 Å²	87	76%	0.757	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-2.5	-179.3	-118.2	175	13.1	0	0	115.4	I767 S771	I767-Q769 PolarHBondContact O-N 3.34Å; Q769-S771 PolarHBondContact O-N 3.11Å
770	L	71.4	Confident	64	Low	25 Å²	25	78.8 Å²	78.8	13%	0.131	42%	0.419	C	S	.	.			trans	-68.6	116.4	173.3	-75.8	167	0	0	0	110.1	I767 W772 A925	I767-L770 PolarHBondContact O-N 3.07Å; L770-W772 HydrophobicContact CB-CZ2 4.46Å; L770-W772 HydrophobicContact CD1-CZ2 4.1Å; L770-W772 PolarHBondContact O-N 3.08Å; L770-A925 HydrophobicContact CB-CB 3.91Å; L770-A925 HydrophobicContact CD2-CB 4Å; L770-A925 HydrophobicContact CG-CB 4.38Å
771	S	82.2	Confident	67.2	Low	78 Å²	78	73.6 Å²	73.6	55%	0.545	39%	0.387	S	S	.	.			trans	-75.8	95	174.4	-178.3	0	0	0	0	109.8	Q769	Q769-S771 PolarHBondContact O-N 3.11Å
772	W	89.8	Confident	70.4	Confident	38 Å²	38	74.5 Å²	74.5	14%	0.144	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	129.2	176.9	-66	95.1	0	0	0	111	L770 R923 L924 A925 T945 V947 V960	L770-W772 HydrophobicContact CB-CZ2 4.46Å; L770-W772 HydrophobicContact CD1-CZ2 4.1Å; L770-W772 PolarHBondContact O-N 3.08Å; W772-R923 HydrophobicContact CE3-CB 3.8Å; W772-R923 HydrophobicContact CZ3-CB 4.43Å; W772-L924 WeakPolarHBondContact CA-O 3.22Å; W772-A925 HydrophobicContact CD2-CB 3.71Å; W772-A925 HydrophobicContact CE3-CB 3.66Å; W772-A925 HydrophobicContact CG-CB 4.33Å; W772-A925 HydrophobicContact CH2-CB 4.07Å; W772-A925 HydrophobicContact CZ2-CB 4.06Å; W772-A925 HydrophobicContact CZ3-CB 3.86Å; W772-T945 HydrophobicContact CH2-CG2 3.44Å; W772-T945 VanDerWaalsContact CH2-CG2 3.44Å; W772-T945 HydrophobicContact CZ2-CG2 4.16Å; W772-T945 HydrophobicContact CZ3-CG2 3.98Å; W772-V947 HydrophobicContact CH2-CB 4.42Å; W772-V947 HydrophobicContact CH2-CG2 3.6Å; W772-V947 HydrophobicContact CZ3-CB 4.05Å; W772-V947 HydrophobicContact CZ3-CG2 3.68Å; W772-V960 HydrophobicContact CD2-CG2 3.82Å; W772-V960 HydrophobicContact CE3-CG2 4.28Å; W772-V960 HydrophobicContact CG-CG2 4.45Å; W772-V960 HydrophobicContact CH2-CG2 3.79Å; W772-V960 HydrophobicContact CZ2-CG2 3.3Å; W772-V960 HydrophobicContact CZ3-CG2 4.26Å
773	K	92.3	Very high	73.2	Confident	101 Å²	101	71.1 Å²	71.1	44%	0.439	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.6	177	-64.7	-176.4	-179.9	-177.6	0	110.3	V775 R923 L924	K773-V775 PolarHBondContact O-N 2.95Å; K773-R923 WeakPolarHBondContact O-CA 3.33Å; K773-L924 PolarHBondContact N-O 2.92Å; K773-L924 PolarHBondContact O-N 3.32Å
774	P	93.7	Very high	75.8	Confident	69 Å²	69	71.3 Å²	71.3	45%	0.448	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	130.4	174.3	29.4	-33.1	0	0	0	109.8	L796 L922	P774-L796 HydrophobicContact CB-CB 4.09Å; P774-L796 HydrophobicContact CB-CD2 4.13Å; P774-L796 HydrophobicContact CG-CB 4.07Å; P774-L796 PolarHBondContact O-N 2.83Å; P774-L922 CarbonylContact C-O 3.57Å; P774-L922 WeakPolarHBondContact CA-O 3.14Å
775	V	96.3	Very high	78.3	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	160.1	-177.6	-65.2	0	0	0	0	112.6	K773 I777 A793 Q794 L796 L922 L924 L946	K773-V775 PolarHBondContact O-N 2.95Å; V775-I777 HydrophobicContact CG2-CD1 4.42Å; V775-A793 HydrophobicContact CB-CB 4.41Å; V775-Q794 CarbonylContact C-O 3.56Å; V775-Q794 WeakPolarHBondContact CA-O 3.29Å; V775-Q794 WeakPolarHBondContact CB-O 3.43Å; V775-L796 VanDerWaalsContact CA-CD1 3.49Å; V775-L922 HydrophobicContact CG2-CB 4.3Å; V775-L922 PolarHBondContact N-O 3.15Å; V775-L922 PolarHBondContact O-N 2.81Å; V775-L924 HydrophobicContact CB-CD2 3.99Å; V775-L924 HydrophobicContact CB-CG 4.5Å; V775-L924 HydrophobicContact CG1-CB 4.45Å; V775-L924 HydrophobicContact CG1-CD2 3.23Å; V775-L924 HydrophobicContact CG1-CG 3.68Å; V775-L924 HydrophobicContact CG2-CB 3.9Å; V775-L924 HydrophobicContact CG2-CD2 3.8Å; V775-L924 HydrophobicContact CG2-CG 4.07Å; V775-L946 HydrophobicContact CG2-CD1 4.13Å
776	Q	94.4	Very high	80.9	Confident	75 Å²	75	64.1 Å²	64.1	35%	0.35	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133.5	165.6	-171	174.4	-3.9	0	0	108.9	A793 Q794 L796	Q776-A793 WeakPolarHBondContact O-CA 3.35Å; Q776-Q794 PolarHBondContact N-O 2.88Å; Q776-Q794 PolarHBondContact O-N 3.29Å; Q776-L796 HydrophobicContact CB-CD1 4.17Å
777	I	96.4	Very high	83.4	Confident	14 Å²	14	62.3 Å²	62.3	7%	0.072	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	125.1	175.6	-53.1	-49.9	0	0	0	108.3	V775 F791 F792 A793 F913 V917 L922 L946	V775-I777 HydrophobicContact CG2-CD1 4.42Å; I777-F791 HydrophobicContact CD1-CD2 3.59Å; I777-F791 HydrophobicContact CD1-CE2 3.49Å; I777-F791 VanDerWaalsContact CD1-CE2 3.49Å; I777-F791 HydrophobicContact CG1-CD2 4.45Å; I777-F791 HydrophobicContact CG2-CB 4.25Å; I777-F791 HydrophobicContact CG2-CD2 4.19Å; I777-F792 WeakPolarHBondContact CA-O 3.44Å; I777-F792 WeakPolarHBondContact CG2-O 3.38Å; I777-A793 HydrophobicContact CD1-CB 3.63Å; I777-F913 HydrophobicContact CG2-CE1 4.16Å; I777-F913 HydrophobicContact CG2-CZ 4.34Å; I777-V917 HydrophobicContact CB-CB 4.23Å; I777-V917 HydrophobicContact CB-CG2 3.87Å; I777-V917 HydrophobicContact CG1-CB 4Å; I777-V917 HydrophobicContact CG1-CG1 4.49Å; I777-V917 HydrophobicContact CG1-CG2 4.08Å; I777-V917 HydrophobicContact CG2-CG2 3.88Å; I777-L922 HydrophobicContact CG1-CD1 3.96Å; I777-L946 HydrophobicContact CD1-CD1 4.15Å; I777-L946 HydrophobicContact CD1-CD2 4.31Å; I777-L946 HydrophobicContact CG1-CD2 4.22Å
778	T	93.2	Very high	85.9	Confident	41 Å²	41	59 Å²	59	25%	0.252	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-18.2	-177.4	53.7	0	0	0	0	113	F792 Q794 F859	T778-F792 PolarHBondContact N-O 2.82Å; T778-F792 WeakPolarHBondContact OG1-CB 3.47Å; T778-F792 PolarHBondContact OG1-O 3.5Å; T778-Q794 HydrophobicContact CG2-CB 4.49Å; T778-Q794 VanDerWaalsContact CG2-CD 3.46Å; T778-Q794 HydrophobicContact CG2-CG 3.7Å; T778-F859 WeakPolarHBondContact CB-O 3.42Å; T778-F859 HydrophobicContact CG2-CD1 4.33Å; T778-F859 PolarHBondContact OG1-O 3.32Å
779	G	90.9	Very high	88.5	Confident	25 Å²	25	51.5 Å²	51.5	26%	0.258	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	167.9	171.7	175.1	0	0	0	0	0	113.8	F791 F792	G779-F791 WeakPolarHBondContact O-CA 3.22Å; G779-F791 WeakPolarHBondContact O-CB 3.23Å; G779-F792 PolarHBondContact O-N 2.91Å
780	I	95.2	Very high	90.4	Very high	18 Å²	18	44.1 Å²	44.1	9%	0.092	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	135.6	174.6	-65.2	-179	0	0	0	109.9	R782 R790 E910 F913 C914	I780-R782 HydrophobicContact CG2-CG 3.8Å; I780-R790 WeakPolarHBondContact CG2-O 3.26Å; I780-E910 HydrophobicContact CD1-CB 3.6Å; I780-E910 HydrophobicContact CD1-CG 4.06Å; I780-E910 WeakPolarHBondContact CD1-O 3.2Å; I780-E910 HydrophobicContact CG2-CG 4.41Å; I780-F913 HydrophobicContact CD1-CD1 3.92Å; I780-F913 HydrophobicContact CG1-CD1 3.9Å; I780-F913 HydrophobicContact CG1-CE1 4.16Å; I780-C914 WeakPolarHBondContact CD1-SG 3.43Å
781	S	93.6	Very high	91.6	Very high	14 Å²	14	43 Å²	43	10%	0.098	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.1	170.5	-176.3	0	0	0	0	109	P783 R790 F792 E891	S781-P783 VanDerWaalsContact O-CD 3.26Å; S781-P783 WeakPolarHBondContact O-CD 3.41Å; S781-P783 WeakPolarHBondContact OG-CD 3.37Å; S781-R790 PolarHBondContact N-O 3.26Å; S781-F792 VanDerWaalsContact CB-CE2 3.45Å; S781-F792 WeakPolarHBondContact OG-CZ 3.23Å; S781-E891 VanDerWaalsContact CB-OE1 3.3Å; S781-E891 WeakPolarHBondContact CB-OE1 3.3Å; S781-E891 PolarHBondContact OG-OE1 2.92Å
782	R	91.7	Very high	92.3	Very high	145 Å²	145	40 Å²	40	55%	0.547	23%	0.225	S	C	.	.			trans	-117.9	58.6	-177.1	-60.5	-177.6	-179.4	85.1	2.5	112.9	I780 S784 E910	I780-R782 HydrophobicContact CG2-CG 3.8Å; R782-S784 PolarHBondContact O-N 2.83Å; R782-E910 IonicContact CZ-OE2 3.78Å; R782-E910 IonicContact NE-OE2 2.96Å; R782-E910 PolarHBondContact NE-OE2 2.65Å; R782-E910 IonicContact NH2-OE2 3.16Å; R782-E910 PolarHBondContact NH2-OE2 3.28Å
783	P	87.2	Confident	92.7	Very high	34 Å²	34	38.2 Å²	38.2	22%	0.221	22%	0.219	C	C	.	.			trans	-66.7	135	176.1	23.3	-23.2	0	0	0	109.7	S781 G785 S786 L938	S781-P783 VanDerWaalsContact O-CD 3.26Å; S781-P783 WeakPolarHBondContact O-CD 3.41Å; S781-P783 WeakPolarHBondContact OG-CD 3.37Å; P783-G785 PolarHBondContact O-N 2.76Å; P783-S786 WeakPolarHBondContact O-CB 3.47Å; P783-S786 PolarHBondContact O-N 3.18Å; P783-S786 VanDerWaalsContact O-N 3.1Å; P783-L938 HydrophobicContact CB-CD1 3.78Å; P783-L938 HydrophobicContact CB-CD2 4.23Å; P783-L938 HydrophobicContact CG-CD1 3.74Å
784	S	81.6	Confident	92.9	Very high	118 Å²	118	34.1 Å²	34.1	83%	0.825	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	128.5	179.1	-171.5	0	0	0	0	110.4	R782	R782-S784 PolarHBondContact O-N 2.83Å
785	G	82.8	Confident	92.9	Very high	53 Å²	53	32 Å²	32	55%	0.546	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	4.2	-179.3	0	0	0	0	0	115.8	P783	P783-G785 PolarHBondContact O-N 2.76Å
786	S	88.8	Confident	92.7	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.007	20%	0.198	C	C	.	.			trans	-70.6	136.5	174.9	-165.2	0	0	0	0	112.1	P783 G788 R790 R906 E936 L938	P783-S786 WeakPolarHBondContact O-CB 3.47Å; P783-S786 PolarHBondContact O-N 3.18Å; P783-S786 VanDerWaalsContact O-N 3.1Å; S786-G788 PolarHBondContact OG-O 3.23Å; S786-R790 VanDerWaalsContact OG-CD 3.3Å; S786-R790 WeakPolarHBondContact OG-CD 3.34Å; S786-R790 PolarHBondContact OG-NE 2.99Å; S786-R906 PolarHBondContact O-NH1 3.48Å; S786-R906 VanDerWaalsContact O-NH1 3.08Å; S786-R906 PolarHBondContact O-NH2 3.38Å; S786-E936 WeakPolarHBondContact CA-OE2 3.37Å; S786-E936 PolarHBondContact OG-OE2 3.1Å; S786-L938 VanDerWaalsContact CB-CD1 3.48Å
787	Q	91.2	Very high	92.6	Very high	69 Å²	69	35.4 Å²	35.4	32%	0.322	21%	0.213	S	C	.	.			trans	-97.3	-30.3	175.3	-64.8	-69.6	-8.8	0	0	111.5	Q898 L899 C933 E936	Q787-Q898 HydrophobicContact CB-CG 4.24Å; Q787-Q898 WeakPolarHBondContact O-CG 3.33Å; Q787-Q898 VanDerWaalsContact OE1-NE2 3.16Å; Q787-L899 PolarHBondContact O-N 2.87Å; Q787-C933 HydrophobicContact CB-CB 4.48Å; Q787-E936 HydrophobicContact CB-CB 4.5Å; Q787-E936 HydrophobicContact CG-CB 4.25Å; Q787-E936 PolarHBondContact N-OE2 2.99Å
788	G	92.8	Very high	92.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	158.1	178.8	0	0	0	0	0	113.2	S786 R790 L899 C933	S786-G788 PolarHBondContact OG-O 3.23Å; G788-R790 PolarHBondContact O-N 2.88Å; G788-L899 WeakPolarHBondContact O-CD1 3.3Å; G788-C933 WeakPolarHBondContact CA-SG 3.4Å
789	L	96.2	Very high	92.2	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	99.2	168.1	-162	163.7	0	0	0	108.9	F791 R893 L894 V897 L899 F913 L971	L789-F791 HydrophobicContact CD2-CD1 3.99Å; L789-R893 VanDerWaalsContact O-CA 3.29Å; L789-R893 WeakPolarHBondContact O-CA 3.41Å; L789-L894 HydrophobicContact CB-CD1 4.35Å; L789-L894 HydrophobicContact CD1-CD1 4.13Å; L789-L894 HydrophobicContact CD2-CD1 4.37Å; L789-L894 PolarHBondContact O-N 2.67Å; L789-L894 VanDerWaalsContact O-N 3.1Å; L789-V897 HydrophobicContact CB-CG1 4.38Å; L789-L899 HydrophobicContact CB-CD1 4.36Å; L789-L899 HydrophobicContact CB-CD2 4.15Å; L789-L899 HydrophobicContact CB-CG 4.06Å; L789-L899 HydrophobicContact CD1-CD2 4.07Å; L789-L899 HydrophobicContact CG-CD2 4.11Å; L789-L899 HydrophobicContact CG-CG 4.48Å; L789-F913 HydrophobicContact CD1-CB 3.8Å; L789-F913 HydrophobicContact CD1-CD2 4.11Å; L789-F913 HydrophobicContact CD1-CG 3.93Å; L789-F913 HydrophobicContact CD2-CB 4.46Å; L789-F913 HydrophobicContact CD2-CD1 3.79Å; L789-F913 HydrophobicContact CD2-CD2 3.93Å; L789-F913 HydrophobicContact CD2-CE1 3.9Å; L789-F913 HydrophobicContact CD2-CE2 4.04Å; L789-F913 HydrophobicContact CD2-CG 3.79Å; L789-F913 HydrophobicContact CD2-CZ 4.02Å; L789-L971 HydrophobicContact CD1-CD1 3.95Å
790	R	96.8	Very high	92.1	Very high	7 Å²	7	40.2 Å²	40.2	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	143.7	179.6	-65.9	179.7	173.8	-134.2	-0.5	111.7	I780 S781 S786 G788 E891 Y892 R893 E936 K939 V941	I780-R790 WeakPolarHBondContact CG2-O 3.26Å; S781-R790 PolarHBondContact N-O 3.26Å; S786-R790 VanDerWaalsContact OG-CD 3.3Å; S786-R790 WeakPolarHBondContact OG-CD 3.34Å; S786-R790 PolarHBondContact OG-NE 2.99Å; G788-R790 PolarHBondContact O-N 2.88Å; R790-E891 IonicContact NH1-OE1 3.82Å; R790-Y892 CarbonylContact C-O 3.51Å; R790-Y892 VanDerWaalsContact CA-O 3.22Å; R790-Y892 WeakPolarHBondContact CA-O 3.5Å; R790-R893 HydrophobicContact CG-CB 4.08Å; R790-E936 IonicContact CZ-OE1 3.07Å; R790-E936 IonicContact NE-OE1 2.66Å; R790-E936 IonicContact NE-OE2 2.7Å; R790-E936 IonicContact NH2-OE1 3.08Å; R790-E936 PolarHBondContact NH2-OE1 2.78Å; R790-E936 IonicContact NH2-OE2 3.55Å; R790-K939 PolarHBondContact NH1-O 3.07Å; R790-K939 VanDerWaalsContact NH1-O 3.08Å; R790-K939 PolarHBondContact NH2-O 3.07Å; R790-V941 HydrophobicContact CG-CG2 4.41Å
791	F	97.1	Very high	92.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	163.6	-178.1	58.9	-92.6	0	0	0	111.6	I777 G779 L789 A793 E891 Y892 L894 F913 V944	I777-F791 HydrophobicContact CD1-CD2 3.59Å; I777-F791 HydrophobicContact CD1-CE2 3.49Å; I777-F791 VanDerWaalsContact CD1-CE2 3.49Å; I777-F791 HydrophobicContact CG1-CD2 4.45Å; I777-F791 HydrophobicContact CG2-CB 4.25Å; I777-F791 HydrophobicContact CG2-CD2 4.19Å; G779-F791 WeakPolarHBondContact O-CA 3.22Å; G779-F791 WeakPolarHBondContact O-CB 3.23Å; L789-F791 HydrophobicContact CD2-CD1 3.99Å; F791-A793 HydrophobicContact CD2-CB 4.44Å; F791-A793 HydrophobicContact CE2-CB 4.36Å; F791-E891 WeakPolarHBondContact O-CA 3.46Å; F791-Y892 HydrophobicContact CE2-CD2 4.48Å; F791-Y892 PolarHBondContact N-O 2.97Å; F791-Y892 PolarHBondContact O-N 2.91Å; F791-L894 HydrophobicContact CE1-CD2 3.67Å; F791-L894 HydrophobicContact CE1-CG 3.86Å; F791-L894 HydrophobicContact CZ-CD2 4.17Å; F791-F913 HydrophobicContact CB-CE1 3.89Å; F791-F913 HydrophobicContact CB-CZ 4.03Å; F791-F913 HydrophobicContact CD1-CE1 4.24Å; F791-F913 HydrophobicContact CD1-CE2 4.29Å; F791-F913 AromaticContact CD1-CZ 3.62Å; F791-F913 HydrophobicContact CD1-CZ 3.62Å; F791-F913 HydrophobicContact CD2-CZ 4.34Å; F791-F913 HydrophobicContact CE1-CE2 4.46Å; F791-F913 HydrophobicContact CE1-CZ 4.11Å; F791-F913 HydrophobicContact CG-CE1 4.12Å; F791-F913 AromaticContact CG-CZ 3.73Å; F791-F913 HydrophobicContact CG-CZ 3.73Å; F791-V944 HydrophobicContact CE1-CG2 4.35Å; F791-V944 HydrophobicContact CE2-CG2 4.46Å; F791-V944 HydrophobicContact CZ-CG2 3.59Å
792	F	97.4	Very high	92	Very high	16 Å²	16	41.7 Å²	41.7	7%	0.07	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132	178.6	-71.9	-62.8	0	0	0	109.9	I777 T778 G779 S781 Q855 G860 V889 E891	I777-F792 WeakPolarHBondContact CA-O 3.44Å; I777-F792 WeakPolarHBondContact CG2-O 3.38Å; T778-F792 PolarHBondContact N-O 2.82Å; T778-F792 WeakPolarHBondContact OG1-CB 3.47Å; T778-F792 PolarHBondContact OG1-O 3.5Å; G779-F792 PolarHBondContact O-N 2.91Å; S781-F792 VanDerWaalsContact CB-CE2 3.45Å; S781-F792 WeakPolarHBondContact OG-CZ 3.23Å; F792-Q855 VanDerWaalsContact CZ-NE2 3.3Å; F792-G860 VanDerWaalsContact CE2-O 3.29Å; F792-G860 WeakPolarHBondContact CE2-O 3.31Å; F792-V889 HydrophobicContact CB-CG2 3.56Å; F792-V889 HydrophobicContact CD1-CG1 4.1Å; F792-V889 HydrophobicContact CD1-CG2 4.07Å; F792-V889 HydrophobicContact CG-CG2 4.17Å; F792-E891 HydrophobicContact CD1-CB 4.04Å; F792-E891 HydrophobicContact CD1-CG 4.33Å; F792-E891 HydrophobicContact CE1-CB 3.81Å; F792-E891 HydrophobicContact CE1-CG 3.98Å
793	A	97	Very high	91.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.9	178.6	0	0	0	0	0	111.8	V775 Q776 I777 F791 K890 Y892 L924	V775-A793 HydrophobicContact CB-CB 4.41Å; Q776-A793 WeakPolarHBondContact O-CA 3.35Å; I777-A793 HydrophobicContact CD1-CB 3.63Å; F791-A793 HydrophobicContact CD2-CB 4.44Å; F791-A793 HydrophobicContact CE2-CB 4.36Å; A793-K890 PolarHBondContact N-O 3Å; A793-K890 PolarHBondContact O-N 3.14Å; A793-Y892 HydrophobicContact CB-CD2 3.88Å; A793-Y892 HydrophobicContact CB-CE2 4.02Å; A793-L924 HydrophobicContact CB-CD2 4.43Å
794	Q	96	Very high	92.2	Very high	15 Å²	15	42.5 Å²	42.5	7%	0.07	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	137.2	170.2	-69.7	172.4	-22.3	0	0	109.3	V775 Q776 T778 L802 D858 V889	V775-Q794 CarbonylContact C-O 3.56Å; V775-Q794 WeakPolarHBondContact CA-O 3.29Å; V775-Q794 WeakPolarHBondContact CB-O 3.43Å; Q776-Q794 PolarHBondContact N-O 2.88Å; Q776-Q794 PolarHBondContact O-N 3.29Å; T778-Q794 HydrophobicContact CG2-CB 4.49Å; T778-Q794 VanDerWaalsContact CG2-CD 3.46Å; T778-Q794 HydrophobicContact CG2-CG 3.7Å; Q794-L802 HydrophobicContact CB-CD1 4.39Å; Q794-L802 VanDerWaalsContact CD-CD1 3.42Å; Q794-L802 HydrophobicContact CG-CD1 4.13Å; Q794-D858 PolarHBondContact NE2-O 2.83Å; Q794-V889 HydrophobicContact CG-CG2 4.41Å
795	H	94.9	Very high	92.8	Very high	24 Å²	24	37.2 Å²	37.2	11%	0.111	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	132.2	172.2	-67.6	-87.5	0	0	0	109.7	S797 D798 Y892	H795-S797 PolarHBondContact O-N 3.19Å; H795-S797 VanDerWaalsContact O-N 3.15Å; H795-D798 PolarHBondContact O-N 3.31Å; H795-Y892 PolarHBondContact CE1-OH 2.94Å; H795-Y892 AromaticContact NE2-CZ 3.97Å; H795-Y892 PolarHBondContact NE2-OH 3.28Å
796	L	91.9	Very high	93.2	Very high	52 Å²	52	37 Å²	37	27%	0.272	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-62.6	-23.2	178.7	-94.5	68.5	0	0	0	112.3	P774 V775 Q776 D798 A799 E921	P774-L796 HydrophobicContact CB-CB 4.09Å; P774-L796 HydrophobicContact CB-CD2 4.13Å; P774-L796 HydrophobicContact CG-CB 4.07Å; P774-L796 PolarHBondContact O-N 2.83Å; V775-L796 VanDerWaalsContact CA-CD1 3.49Å; Q776-L796 HydrophobicContact CB-CD1 4.17Å; L796-D798 PolarHBondContact O-N 3.42Å; L796-A799 WeakPolarHBondContact O-CB 3.16Å; L796-A799 PolarHBondContact O-N 2.81Å; L796-E921 HydrophobicContact CD2-CG 4.04Å
797	S	91.6	Very high	93.3	Very high	95 Å²	95	43 Å²	43	66%	0.664	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-60.5	-24.8	171.6	56.1	0	0	0	0	113.4	H795	H795-S797 PolarHBondContact O-N 3.19Å; H795-S797 VanDerWaalsContact O-N 3.15Å
798	D	92.3	Very high	93.2	Very high	55 Å²	55	43.9 Å²	43.9	29%	0.294	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-98.1	2.5	-176.3	-59.2	-33.7	0	0	0	112.7	H795 L796 C800 T801 L802	H795-D798 PolarHBondContact O-N 3.31Å; L796-D798 PolarHBondContact O-N 3.42Å; D798-C800 VanDerWaalsContact C-N 3.27Å; D798-C800 PolarHBondContact O-N 2.96Å; D798-T801 WeakPolarHBondContact O-CA 3.47Å; D798-T801 VanDerWaalsContact O-CB 3.29Å; D798-T801 WeakPolarHBondContact O-CB 3.18Å; D798-T801 PolarHBondContact O-N 3.02Å; D798-L802 PolarHBondContact O-N 3.28Å; D798-L802 VanDerWaalsContact O-N 3.11Å
799	A	88.8	Confident	93.1	Very high	48 Å²	48	43.9 Å²	43.9	40%	0.397	25%	0.247	S	C	.	.	H	α-helix	trans	-56	-38.7	-178.2	0	0	0	0	0	113.1	L796 T801 L802 V803	L796-A799 WeakPolarHBondContact O-CB 3.16Å; L796-A799 PolarHBondContact O-N 2.81Å; A799-T801 VanDerWaalsContact C-N 3.29Å; A799-T801 PolarHBondContact O-N 3.38Å; A799-L802 PolarHBondContact O-N 3.42Å; A799-V803 WeakPolarHBondContact O-CG2 3.22Å; A799-V803 PolarHBondContact O-N 2.82Å
800	C	89.8	Confident	92.9	Very high	78 Å²	78	46.6 Å²	46.6	53%	0.527	26%	0.262	S	S	.	.	H	α-helix	trans	-64.4	-34.5	176	-176.2	0	0	0	0	112.2	D798 K804	D798-C800 VanDerWaalsContact C-N 3.27Å; D798-C800 PolarHBondContact O-N 2.96Å; C800-K804 VanDerWaalsContact O-CG 3.31Å; C800-K804 WeakPolarHBondContact O-CG 3.21Å; C800-K804 PolarHBondContact O-N 3.14Å
801	T	93.8	Very high	92.4	Very high	38 Å²	38	48.1 Å²	48.1	23%	0.233	27%	0.274	C	S	.	.	H	α-helix	trans	-68.4	-41.8	176.1	-53.9	0	0	0	0	110.9	D798 A799 K804 I805 L885 Q888	D798-T801 WeakPolarHBondContact O-CA 3.47Å; D798-T801 VanDerWaalsContact O-CB 3.29Å; D798-T801 WeakPolarHBondContact O-CB 3.18Å; D798-T801 PolarHBondContact O-N 3.02Å; A799-T801 VanDerWaalsContact C-N 3.29Å; A799-T801 PolarHBondContact O-N 3.38Å; T801-K804 PolarHBondContact O-N 3.26Å; T801-I805 HydrophobicContact CG2-CD1 4.08Å; T801-I805 WeakPolarHBondContact O-CG1 3.17Å; T801-I805 PolarHBondContact O-N 3.45Å; T801-L885 HydrophobicContact CG2-CD1 4.31Å; T801-L885 HydrophobicContact CG2-CD2 4.32Å; T801-Q888 VanDerWaalsContact CG2-OE1 3.28Å
802	L	91.7	Very high	91.2	Very high	26 Å²	26	58.2 Å²	58.2	14%	0.136	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-45	174.1	-77.4	165.5	0	0	0	112.3	Q794 D798 A799 K804 I805 S806 D858 F859 Q888	Q794-L802 HydrophobicContact CB-CD1 4.39Å; Q794-L802 VanDerWaalsContact CD-CD1 3.42Å; Q794-L802 HydrophobicContact CG-CD1 4.13Å; D798-L802 PolarHBondContact O-N 3.28Å; D798-L802 VanDerWaalsContact O-N 3.11Å; A799-L802 PolarHBondContact O-N 3.42Å; L802-K804 VanDerWaalsContact C-N 3.33Å; L802-K804 PolarHBondContact O-N 2.9Å; L802-I805 PolarHBondContact O-N 3.24Å; L802-S806 WeakPolarHBondContact O-CB 3.21Å; L802-S806 PolarHBondContact O-N 2.95Å; L802-D858 HydrophobicContact CD2-CB 3.94Å; L802-F859 HydrophobicContact CD2-CE2 4.48Å; L802-F859 HydrophobicContact CD2-CZ 4.45Å; L802-Q888 HydrophobicContact CD2-CB 3.53Å; L802-Q888 HydrophobicContact CD2-CG 3.79Å; L802-Q888 HydrophobicContact CG-CB 3.97Å; L802-Q888 HydrophobicContact CG-CG 4.12Å
803	V	91.1	Very high	89.8	Confident	79 Å²	79	62.2 Å²	62.2	48%	0.479	35%	0.351	S	S	.	.	H	α-helix	trans	-59.8	-44.2	175.3	172.8	0	0	0	0	110.8	A799 S806 Q807	A799-V803 WeakPolarHBondContact O-CG2 3.22Å; A799-V803 PolarHBondContact O-N 2.82Å; V803-S806 PolarHBondContact O-N 3.16Å; V803-Q807 HydrophobicContact CG1-CG 4.36Å; V803-Q807 WeakPolarHBondContact O-CB 3.22Å; V803-Q807 VanDerWaalsContact O-CG 3.27Å; V803-Q807 WeakPolarHBondContact O-CG 3.38Å; V803-Q807 PolarHBondContact O-N 3.01Å
804	K	91.8	Very high	88.3	Confident	117 Å²	117	64.2 Å²	64.2	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-62.8	-44.6	176.2	-73.5	170.2	-177.8	173.4	0	112.5	C800 T801 L802 S806 Q807 M808	C800-K804 VanDerWaalsContact O-CG 3.31Å; C800-K804 WeakPolarHBondContact O-CG 3.21Å; C800-K804 PolarHBondContact O-N 3.14Å; T801-K804 PolarHBondContact O-N 3.26Å; L802-K804 VanDerWaalsContact C-N 3.33Å; L802-K804 PolarHBondContact O-N 2.9Å; K804-S806 VanDerWaalsContact C-N 3.34Å; K804-S806 PolarHBondContact O-N 3.27Å; K804-Q807 PolarHBondContact O-N 2.87Å; K804-M808 WeakPolarHBondContact O-CB 3.43Å; K804-M808 VanDerWaalsContact O-CG 3.25Å; K804-M808 WeakPolarHBondContact O-CG 3.5Å; K804-M808 PolarHBondContact O-N 2.9Å
805	I	94.2	Very high	86.7	Confident	6 Å²	6	65 Å²	65	3%	0.031	37%	0.366	C	S	.	.	H	α-helix	trans	-58.8	-48.7	176.6	-71.1	164.5	0	0	0	109.8	T801 L802 M808 L809 R841 L882 L885 Q888	T801-I805 HydrophobicContact CG2-CD1 4.08Å; T801-I805 WeakPolarHBondContact O-CG1 3.17Å; T801-I805 PolarHBondContact O-N 3.45Å; L802-I805 PolarHBondContact O-N 3.24Å; I805-M808 PolarHBondContact O-N 3.42Å; I805-L809 HydrophobicContact CG2-CD1 3.74Å; I805-L809 HydrophobicContact CG2-CG 4.34Å; I805-L809 WeakPolarHBondContact O-CB 3.35Å; I805-L809 WeakPolarHBondContact O-CG 3.36Å; I805-L809 PolarHBondContact O-N 3.05Å; I805-R841 HydrophobicContact CG2-CG 4.13Å; I805-L882 HydrophobicContact CB-CD2 4.4Å; I805-L882 HydrophobicContact CG1-CD2 4.1Å; I805-L882 HydrophobicContact CG2-CD2 4.35Å; I805-L885 HydrophobicContact CD1-CD1 3.97Å; I805-L885 HydrophobicContact CG1-CD1 3.66Å; I805-Q888 HydrophobicContact CD1-CG 3.59Å
806	S	91.6	Very high	85.5	Confident	48 Å²	48	67.5 Å²	67.5	34%	0.336	39%	0.386	S	S	.	.	H	α-helix	trans	-61	-46.7	179	179.1	0	0	0	0	111.9	L802 V803 K804 M808 L809 N810	L802-S806 WeakPolarHBondContact O-CB 3.21Å; L802-S806 PolarHBondContact O-N 2.95Å; V803-S806 PolarHBondContact O-N 3.16Å; K804-S806 VanDerWaalsContact C-N 3.34Å; K804-S806 PolarHBondContact O-N 3.27Å; S806-M808 VanDerWaalsContact C-N 3.35Å; S806-M808 PolarHBondContact O-N 2.99Å; S806-L809 PolarHBondContact O-N 3.38Å; S806-N810 VanDerWaalsContact O-CB 3.31Å; S806-N810 WeakPolarHBondContact O-CB 3.26Å; S806-N810 PolarHBondContact O-N 2.72Å; S806-N810 PolarHBondContact O-ND2 2.8Å
807	Q	90.4	Very high	84.5	Confident	129 Å²	129	69.7 Å²	69.7	60%	0.603	39%	0.393	S	S	*	.	H	α-helix	trans	-60.5	-41.2	176.8	-75.6	174.5	-8.7	0	0	112.6	V803 K804 S811	V803-Q807 HydrophobicContact CG1-CG 4.36Å; V803-Q807 WeakPolarHBondContact O-CB 3.22Å; V803-Q807 VanDerWaalsContact O-CG 3.27Å; V803-Q807 WeakPolarHBondContact O-CG 3.38Å; V803-Q807 PolarHBondContact O-N 3.01Å; K804-Q807 PolarHBondContact O-N 2.87Å; Q807-S811 VanDerWaalsContact O-CB 3.31Å; Q807-S811 WeakPolarHBondContact O-CB 3.35Å; Q807-S811 PolarHBondContact O-N 3.16Å; Q807-S811 VanDerWaalsContact O-N 3.09Å
808	M	89.9	Confident	83.6	Confident	86 Å²	86	68 Å²	68	42%	0.424	38%	0.381	S	S	.	.	H	α-helix	trans	-68.6	-46.6	178.6	-70.9	178.7	73.2	0	0	111.7	K804 I805 S806 N810 S811 L882	K804-M808 WeakPolarHBondContact O-CB 3.43Å; K804-M808 VanDerWaalsContact O-CG 3.25Å; K804-M808 WeakPolarHBondContact O-CG 3.5Å; K804-M808 PolarHBondContact O-N 2.9Å; I805-M808 PolarHBondContact O-N 3.42Å; S806-M808 VanDerWaalsContact C-N 3.35Å; S806-M808 PolarHBondContact O-N 2.99Å; M808-N810 PolarHBondContact O-N 2.71Å; M808-S811 PolarHBondContact O-OG 2.73Å; M808-L882 HydrophobicContact CB-CD1 4.06Å; M808-L882 HydrophobicContact CB-CD2 4.08Å; M808-L882 HydrophobicContact CB-CG 4.41Å; M808-L882 HydrophobicContact CE-CD1 4.34Å; M808-L882 HydrophobicContact CE-CD2 4.13Å; M808-L882 HydrophobicContact CE-CG 3.86Å; M808-L882 HydrophobicContact SD-CD2 3.79Å; M808-L882 HydrophobicContact SD-CG 4.21Å
809	L	91.5	Very high	82.3	Confident	1 Å²	1	72 Å²	72	1%	0.005	41%	0.412	C	S	.	.	H	α-helix	trans	-69	-30.5	-178.6	-74.8	178.2	0	0	0	113.9	I805 S806 F814 I830 W839 R841 L877 L882	I805-L809 HydrophobicContact CG2-CD1 3.74Å; I805-L809 HydrophobicContact CG2-CG 4.34Å; I805-L809 WeakPolarHBondContact O-CB 3.35Å; I805-L809 WeakPolarHBondContact O-CG 3.36Å; I805-L809 PolarHBondContact O-N 3.05Å; S806-L809 PolarHBondContact O-N 3.38Å; L809-F814 HydrophobicContact CD2-CD1 3.94Å; L809-F814 HydrophobicContact CD2-CE1 3.88Å; L809-I830 HydrophobicContact CD2-CG2 3.53Å; L809-W839 HydrophobicContact CB-CB 4.18Å; L809-W839 WeakPolarHBondContact CD1-O 3.33Å; L809-R841 HydrophobicContact CD1-CG 3.76Å; L809-L877 HydrophobicContact CD2-CD1 4.39Å; L809-L882 HydrophobicContact CD2-CD1 3.63Å; L809-L882 HydrophobicContact CG-CD1 3.98Å
810	N	91.1	Very high	81.5	Confident	58 Å²	58	78.5 Å²	78.5	31%	0.31	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	14.9	-177.9	-61.6	-77.6	0	0	0	112.6	S806 M808 W839	S806-N810 VanDerWaalsContact O-CB 3.31Å; S806-N810 WeakPolarHBondContact O-CB 3.26Å; S806-N810 PolarHBondContact O-N 2.72Å; S806-N810 PolarHBondContact O-ND2 2.8Å; M808-N810 PolarHBondContact O-N 2.71Å; N810-W839 PolarHBondContact ND2-O 3.31Å; N810-W839 VanDerWaalsContact ND2-O 3.12Å; N810-W839 PolarHBondContact OD1-N 3.09Å
811	S	86.6	Confident	81	Confident	39 Å²	39	77 Å²	77	27%	0.273	42%	0.418	S	S	.	.	S	Bend	trans	-71	156.4	170.7	65	0	0	0	0	111.1	Q807 M808 S813 F814	Q807-S811 VanDerWaalsContact O-CB 3.31Å; Q807-S811 WeakPolarHBondContact O-CB 3.35Å; Q807-S811 PolarHBondContact O-N 3.16Å; Q807-S811 VanDerWaalsContact O-N 3.09Å; M808-S811 PolarHBondContact O-OG 2.73Å; S811-S813 PolarHBondContact O-N 3.25Å; S811-S813 PolarHBondContact OG-OG 3.18Å; S811-F814 PolarHBondContact O-N 3.11Å
812	Q	71.5	Confident	80.6	Confident	212 Å²	212	80.2 Å²	80.2	99%	0.991	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.6	179.6	-68.8	-176.6	0.7	0	0	114.3	F814	Q812-F814 VanDerWaalsContact C-N 3.28Å; Q812-F814 PolarHBondContact O-N 3.39Å
813	S	68.6	Low	80.3	Confident	101 Å²	101	79.3 Å²	79.3	71%	0.706	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-2.2	177.3	43.4	0	0	0	0	114.7	S811	S811-S813 PolarHBondContact O-N 3.25Å; S811-S813 PolarHBondContact OG-OG 3.18Å
814	F	65.3	Low	80.2	Confident	42 Å²	42	82.8 Å²	82.8	18%	0.184	45%	0.445	C	S	.	.			trans	-139.8	139.7	-170.5	-137.7	-101	0	0	0	110.3	L809 S811 Q812 I830 P878	L809-F814 HydrophobicContact CD2-CD1 3.94Å; L809-F814 HydrophobicContact CD2-CE1 3.88Å; S811-F814 PolarHBondContact O-N 3.11Å; Q812-F814 VanDerWaalsContact C-N 3.28Å; Q812-F814 PolarHBondContact O-N 3.39Å; F814-I830 HydrophobicContact CD1-CD1 4.07Å; F814-I830 HydrophobicContact CE1-CD1 3.41Å; F814-I830 VanDerWaalsContact CE1-CD1 3.41Å; F814-I830 HydrophobicContact CE1-CG1 4.3Å; F814-I830 HydrophobicContact CE1-CG2 4.3Å; F814-I830 HydrophobicContact CZ-CD1 4.24Å; F814-P878 HydrophobicContact CE1-CG 4.37Å; F814-P878 HydrophobicContact CE2-CG 3.45Å; F814-P878 VanDerWaalsContact CE2-CG 3.45Å; F814-P878 HydrophobicContact CZ-CG 3.16Å
815	P	63.1	Low	80.2	Confident	32 Å²	32	85.2 Å²	85.2	21%	0.208	46%	0.456	C	S	.	.	P	Polyproline II helix	cis	-87.5	153.9	4.1	37.3	-40.5	0	0	0	114.6	F817 I830 W839	P815-F817 HydrophobicContact CB-CE2 4.4Å; P815-F817 HydrophobicContact CB-CZ 4.26Å; P815-F817 HydrophobicContact CG-CD2 4.37Å; P815-F817 HydrophobicContact CG-CE1 4.25Å; P815-F817 HydrophobicContact CG-CE2 3.54Å; P815-F817 HydrophobicContact CG-CZ 3.47Å; P815-F817 VanDerWaalsContact CG-CZ 3.47Å; P815-I830 HydrophobicContact CB-CD1 3.49Å; P815-I830 VanDerWaalsContact CB-CD1 3.49Å; P815-W839 HydrophobicContact CB-CD2 4.41Å; P815-W839 HydrophobicContact CB-CZ2 4.41Å; P815-W839 HydrophobicContact CG-CD2 4.17Å; P815-W839 HydrophobicContact CG-CH2 4.19Å; P815-W839 HydrophobicContact CG-CZ2 3.62Å
816	S	68.9	Low	80.1	Confident	75 Å²	75	87.1 Å²	87.1	52%	0.524	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-95.9	126	161.5	71.1	0	0	0	0	110	S875	S816-S875 PolarHBondContact O-OG 3.2Å
817	F	71.8	Confident	80.1	Confident	98 Å²	98	86.6 Å²	86.6	43%	0.43	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-94.7	119.9	177.9	-63.9	-78.8	0	0	0	110.7	P815 W839 S871	P815-F817 HydrophobicContact CB-CE2 4.4Å; P815-F817 HydrophobicContact CB-CZ 4.26Å; P815-F817 HydrophobicContact CG-CD2 4.37Å; P815-F817 HydrophobicContact CG-CE1 4.25Å; P815-F817 HydrophobicContact CG-CE2 3.54Å; P815-F817 HydrophobicContact CG-CZ 3.47Å; P815-F817 VanDerWaalsContact CG-CZ 3.47Å; F817-W839 AromaticContact CE1-CH2 3.73Å; F817-W839 HydrophobicContact CE1-CH2 3.73Å; F817-W839 HydrophobicContact CE1-CZ2 4.18Å; F817-W839 AromaticContact CZ-CH2 3.74Å; F817-W839 HydrophobicContact CZ-CH2 3.74Å; F817-W839 AromaticContact CZ-CZ2 3.68Å; F817-W839 HydrophobicContact CZ-CZ2 3.68Å; F817-S871 VanDerWaalsContact CD1-O 3.29Å; F817-S871 WeakPolarHBondContact CD1-O 3.46Å; F817-S871 VanDerWaalsContact CE1-O 3.29Å; F817-S871 WeakPolarHBondContact CE1-O 3.13Å
818	P	71.5	Confident	80.2	Confident	61 Å²	61	83.1 Å²	83.1	40%	0.396	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-67.2	153.9	166.2	30.6	-33.8	0	0	0	109.7	E820 P876	P818-E820 PolarHBondContact O-N 3.49Å; P818-E820 VanDerWaalsContact O-N 3.17Å; P818-P876 HydrophobicContact CG-CG 4.07Å
819	S	65.6	Low	80.4	Confident	137 Å²	137	79 Å²	79	96%	0.958	44%	0.439	S	S	*	.	S	Bend	trans	-60	-24.8	178.1	27.1	0	0	0	0	113.4
820	E	71.8	Confident	80.6	Confident	185 Å²	185	79 Å²	79	86%	0.864	44%	0.438	S	S	*	.			trans	-146.1	123	177.1	-129.3	171.9	-175.1	0	0	110	P818	P818-E820 PolarHBondContact O-N 3.49Å; P818-E820 VanDerWaalsContact O-N 3.17Å
821	Y	79.8	Confident	80.8	Confident	48 Å²	48	76.2 Å²	76.2	19%	0.188	42%	0.424	C	S	.	.			trans	-124.3	119	171.5	179.9	-131.5	0	0	0	110.7	P823 C829 L874 P876	Y821-P823 HydrophobicContact CD1-CB 4.5Å; Y821-P823 HydrophobicContact CE1-CB 3.78Å; Y821-P823 HydrophobicContact CE1-CG 4.38Å; Y821-P823 WeakPolarHBondContact O-CD 3.45Å; Y821-C829 HydrophobicContact CE1-CB 4.46Å; Y821-L874 HydrophobicContact CD1-CD2 4.05Å; Y821-L874 HydrophobicContact CD1-CG 4Å; Y821-L874 HydrophobicContact CE1-CD1 4.45Å; Y821-L874 HydrophobicContact CE1-CD2 3.73Å; Y821-L874 HydrophobicContact CE1-CG 3.67Å; Y821-P876 HydrophobicContact CD2-CB 4.5Å; Y821-P876 HydrophobicContact CD2-CG 3.44Å; Y821-P876 VanDerWaalsContact CD2-CG 3.44Å; Y821-P876 HydrophobicContact CE2-CB 4.2Å; Y821-P876 HydrophobicContact CE2-CG 3.6Å; Y821-P876 HydrophobicContact CG-CG 4Å
822	C	84.2	Confident	81.1	Confident	104 Å²	104	74.9 Å²	74.9	70%	0.703	41%	0.414	S	S	*	.			trans	-109	95.4	175.1	-171.7	0	0	0	0	109.8	K824	C822-K824 PolarHBondContact O-N 3.39Å
823	P	85.4	Confident	82.2	Confident	8 Å²	8	66.6 Å²	66.6	5%	0.052	38%	0.375	C	S	.	.			trans	-66.1	127.9	-176.4	24.7	-34.1	0	0	0	112.6	Y821 V844 S847 V852 Y870 L874	Y821-P823 HydrophobicContact CD1-CB 4.5Å; Y821-P823 HydrophobicContact CE1-CB 3.78Å; Y821-P823 HydrophobicContact CE1-CG 4.38Å; Y821-P823 WeakPolarHBondContact O-CD 3.45Å; P823-V844 HydrophobicContact CB-CG2 3.86Å; P823-S847 PolarHBondContact O-OG 3.5Å; P823-V852 HydrophobicContact CB-CG1 3.98Å; P823-V852 HydrophobicContact CG-CG1 3.52Å; P823-V852 HydrophobicContact CG-CG2 4.42Å; P823-Y870 HydrophobicContact CG-CD2 4.28Å; P823-Y870 HydrophobicContact CG-CE2 3.86Å; P823-L874 HydrophobicContact CB-CD2 3.9Å; P823-L874 HydrophobicContact CG-CD2 3.76Å
824	K	88.9	Confident	83.4	Confident	152 Å²	152	64.4 Å²	64.4	66%	0.661	36%	0.359	S	S	*	.			trans	-110.2	141.6	-179.5	-66.1	-178	-178.5	178.3	0	111	C822 G826 S827 V844	C822-K824 PolarHBondContact O-N 3.39Å; K824-G826 PolarHBondContact O-N 3.44Å; K824-S827 WeakPolarHBondContact O-CB 3.24Å; K824-S827 PolarHBondContact O-N 3.49Å; K824-S827 PolarHBondContact O-OG 3.1Å; K824-V844 WeakPolarHBondContact O-CB 3.34Å
825	K	92.7	Very high	84.4	Confident	167 Å²	167	69.2 Å²	69.2	73%	0.726	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	129.5	174.2	-176.3	-179.4	178.8	-174.3	0	110.6	I845	K825-I845 WeakPolarHBondContact CE-O 3.07Å
826	G	91.1	Very high	85.6	Confident	46 Å²	46	70.9 Å²	70.9	47%	0.474	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-16.3	-177.9	0	0	0	0	0	115.2	K824 V844	K824-G826 PolarHBondContact O-N 3.44Å; G826-V844 PolarHBondContact N-O 3.07Å
827	S	92	Very high	86.7	Confident	37 Å²	37	72.9 Å²	72.9	26%	0.259	40%	0.398	S	S	.	.			trans	-71.1	141.2	-178.7	68.2	0	0	0	0	112.1	K824 R843 V844	K824-S827 WeakPolarHBondContact O-CB 3.24Å; K824-S827 PolarHBondContact O-N 3.49Å; K824-S827 PolarHBondContact O-OG 3.1Å; S827-R843 WeakPolarHBondContact O-CA 3.44Å; S827-V844 PolarHBondContact O-N 3.34Å; S827-V844 VanDerWaalsContact O-N 3.08Å
828	L	93.8	Very high	87.7	Confident	57 Å²	57	70.1 Å²	70.1	30%	0.298	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	137.4	168.3	-65.9	178.8	0	0	0	110.4	A842 R843 I857 L877 M883	L828-A842 WeakPolarHBondContact CA-O 3.38Å; L828-R843 HydrophobicContact CD2-CB 4.22Å; L828-I857 HydrophobicContact CD2-CD1 4.09Å; L828-L877 HydrophobicContact CB-CB 4.43Å; L828-L877 HydrophobicContact CB-CD2 4.36Å; L828-M883 HydrophobicContact CB-SD 4.37Å; L828-M883 HydrophobicContact CD1-SD 4.09Å
829	C	94.3	Very high	88.7	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	175.3	179.3	55.8	0	0	0	0	110.2	Y821 A842 L874 S875	Y821-C829 HydrophobicContact CE1-CB 4.46Å; C829-A842 PolarHBondContact N-O 2.91Å; C829-A842 PolarHBondContact O-N 3.18Å; C829-A842 VanDerWaalsContact O-O 3.09Å; C829-L874 HydrophobicContact CB-CD1 4.15Å; C829-S875 CarbonylContact C-O 3.6Å; C829-S875 WeakPolarHBondContact CA-O 3Å; C829-S875 VanDerWaalsContact CB-O 3.31Å; C829-S875 WeakPolarHBondContact CB-O 3.36Å
830	I	94.3	Very high	90.2	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.3	159.1	51.8	151.6	0	0	0	108.7	L809 F814 P815 W839 Y840 S875 L877	L809-I830 HydrophobicContact CD2-CG2 3.53Å; F814-I830 HydrophobicContact CD1-CD1 4.07Å; F814-I830 HydrophobicContact CE1-CD1 3.41Å; F814-I830 VanDerWaalsContact CE1-CD1 3.41Å; F814-I830 HydrophobicContact CE1-CG1 4.3Å; F814-I830 HydrophobicContact CE1-CG2 4.3Å; F814-I830 HydrophobicContact CZ-CD1 4.24Å; P815-I830 HydrophobicContact CB-CD1 3.49Å; P815-I830 VanDerWaalsContact CB-CD1 3.49Å; I830-W839 HydrophobicContact CB-CE3 4.08Å; I830-W839 HydrophobicContact CD1-CD2 4.23Å; I830-W839 HydrophobicContact CD1-CE3 3.58Å; I830-W839 HydrophobicContact CD1-CZ3 3.9Å; I830-W839 HydrophobicContact CG1-CE3 4.07Å; I830-W839 HydrophobicContact CG1-CZ3 4.25Å; I830-Y840 CarbonylContact C-O 3.59Å; I830-Y840 WeakPolarHBondContact CA-O 3.46Å; I830-S875 VanDerWaalsContact CG1-O 3.31Å; I830-S875 WeakPolarHBondContact CG1-O 3.3Å; I830-S875 PolarHBondContact N-O 2.93Å; I830-S875 PolarHBondContact O-N 3.16Å; I830-L877 HydrophobicContact CG2-CB 4.34Å; I830-L877 HydrophobicContact CG2-CD1 3.4Å; I830-L877 VanDerWaalsContact CG2-CD1 3.4Å; I830-L877 HydrophobicContact CG2-CG 4.45Å
831	A	95.2	Very high	91.3	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141	178.3	0	0	0	0	0	109.9	Y840 A842 V854 F856 I865 R873 L874	A831-Y840 PolarHBondContact N-O 3.49Å; A831-Y840 PolarHBondContact O-N 2.84Å; A831-A842 HydrophobicContact CB-CB 3.91Å; A831-V854 HydrophobicContact CB-CG2 4.02Å; A831-F856 HydrophobicContact CB-CE1 3.77Å; A831-F856 HydrophobicContact CB-CZ 4.25Å; A831-I865 HydrophobicContact CB-CD1 3.92Å; A831-R873 CarbonylContact C-O 3.49Å; A831-R873 VanDerWaalsContact CA-O 3.29Å; A831-R873 WeakPolarHBondContact CA-O 3.49Å; A831-L874 HydrophobicContact CB-CD1 4.12Å
832	C	93.9	Very high	92.2	Very high	10 Å²	10	52.7 Å²	52.7	7%	0.068	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	115.4	174.3	-176.1	0	0	0	0	109.1	N837 C838 W839 R873	C832-N837 PolarHBondContact SG-O 2.75Å; C832-C838 CarbonylContact C-O 3.51Å; C832-C838 WeakPolarHBondContact CA-O 3.35Å; C832-W839 HydrophobicContact CB-CD2 4.04Å; C832-W839 HydrophobicContact CB-CE3 4.05Å; C832-W839 HydrophobicContact CB-CH2 3.9Å; C832-W839 HydrophobicContact CB-CZ2 3.82Å; C832-W839 HydrophobicContact CB-CZ3 4.01Å; C832-R873 HydrophobicContact CB-CB 4.18Å; C832-R873 HydrophobicContact CB-CG 4.26Å; C832-R873 PolarHBondContact N-O 3.4Å; C832-R873 PolarHBondContact O-NE 3.06Å; C832-R873 PolarHBondContact O-NH2 2.82Å
833	F	94.5	Very high	92.7	Very high	39 Å²	39	52.3 Å²	52.3	17%	0.171	27%	0.272	C	S	.	.			trans	-74.3	129.9	-178.7	-175.5	-134.3	0	0	0	110.5	L835 N837 C838 Y840 F856 N861 E863	F833-L835 VanDerWaalsContact C-N 3.29Å; F833-L835 HydrophobicContact CD1-CB 4.12Å; F833-L835 HydrophobicContact CE1-CB 3.69Å; F833-L835 HydrophobicContact CE1-CD1 3.82Å; F833-L835 HydrophobicContact CE1-CG 3.98Å; F833-L835 HydrophobicContact CE2-CG 4.45Å; F833-L835 HydrophobicContact CZ-CB 4.08Å; F833-L835 HydrophobicContact CZ-CD1 3.56Å; F833-L835 HydrophobicContact CZ-CG 3.82Å; F833-L835 PolarHBondContact O-N 2.75Å; F833-N837 VanDerWaalsContact O-CA 3.25Å; F833-N837 WeakPolarHBondContact O-CA 3.32Å; F833-N837 PolarHBondContact O-N 2.69Å; F833-C838 PolarHBondContact N-O 3.29Å; F833-Y840 HydrophobicContact CB-CD2 3.66Å; F833-Y840 HydrophobicContact CB-CE2 3.66Å; F833-Y840 HydrophobicContact CD1-CE2 4.47Å; F833-Y840 HydrophobicContact CG-CE2 4.49Å; F833-F856 HydrophobicContact CB-CE1 4.22Å; F833-F856 HydrophobicContact CB-CE2 4.45Å; F833-F856 HydrophobicContact CB-CZ 3.84Å; F833-F856 HydrophobicContact CD2-CD2 4.43Å; F833-F856 AromaticContact CD2-CE2 3.53Å; F833-F856 HydrophobicContact CD2-CE2 3.53Å; F833-F856 AromaticContact CD2-CZ 3.71Å; F833-F856 HydrophobicContact CD2-CZ 3.71Å; F833-F856 HydrophobicContact CE2-CE2 4.13Å; F833-F856 HydrophobicContact CG-CE2 4.28Å; F833-F856 HydrophobicContact CG-CZ 4.16Å; F833-N861 WeakPolarHBondContact CE2-ND2 3.47Å; F833-E863 WeakPolarHBondContact CD2-OE2 3.41Å
834	S	92.8	Very high	93.2	Very high	54 Å²	54	52 Å²	52	38%	0.378	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-24.6	-170.1	50.4	0	0	0	0	115	E863	S834-E863 WeakPolarHBondContact CB-OE1 3.38Å; S834-E863 PolarHBondContact N-OE2 2.94Å; S834-E863 PolarHBondContact OG-OE1 3.18Å
835	L	87	Confident	93.5	Very high	144 Å²	144	46.4 Å²	46.4	75%	0.754	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-32.8	-174.6	-66.2	-178	0	0	0	113.2	F833	F833-L835 VanDerWaalsContact C-N 3.29Å; F833-L835 HydrophobicContact CD1-CB 4.12Å; F833-L835 HydrophobicContact CE1-CB 3.69Å; F833-L835 HydrophobicContact CE1-CD1 3.82Å; F833-L835 HydrophobicContact CE1-CG 3.98Å; F833-L835 HydrophobicContact CE2-CG 4.45Å; F833-L835 HydrophobicContact CZ-CB 4.08Å; F833-L835 HydrophobicContact CZ-CD1 3.56Å; F833-L835 HydrophobicContact CZ-CG 3.82Å; F833-L835 PolarHBondContact O-N 2.75Å
836	D	89.1	Confident	93.4	Very high	66 Å²	66	46.2 Å²	46.2	35%	0.353	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-3.9	-177.3	58.4	23.1	0	0	0	113.9	C838 Y840	D836-C838 PolarHBondContact O-N 2.8Å; D836-C838 WeakPolarHBondContact OD1-CB 3.44Å; D836-C838 PolarHBondContact OD1-N 3.39Å; D836-Y840 PolarHBondContact OD2-OH 3.35Å
837	N	90.6	Very high	93.3	Very high	117 Å²	117	47.2 Å²	47.2	63%	0.626	24%	0.241	S	C	*	.			trans	55.1	27.9	-176.6	-57.6	-67.6	0	0	0	113.8	C832 F833	C832-N837 PolarHBondContact SG-O 2.75Å; F833-N837 VanDerWaalsContact O-CA 3.25Å; F833-N837 WeakPolarHBondContact O-CA 3.32Å; F833-N837 PolarHBondContact O-N 2.69Å
838	C	92.2	Very high	93.2	Very high	41 Å²	41	47.9 Å²	47.9	28%	0.277	25%	0.246	S	C	.	.			trans	-97.5	152.3	176.7	-67.1	0	0	0	0	111.4	C832 F833 D836 Y840	C832-C838 CarbonylContact C-O 3.51Å; C832-C838 WeakPolarHBondContact CA-O 3.35Å; F833-C838 PolarHBondContact N-O 3.29Å; D836-C838 PolarHBondContact O-N 2.8Å; D836-C838 WeakPolarHBondContact OD1-CB 3.44Å; D836-C838 PolarHBondContact OD1-N 3.39Å; C838-Y840 HydrophobicContact CB-CD2 4.46Å; C838-Y840 HydrophobicContact CB-CE2 3.54Å; C838-Y840 WeakPolarHBondContact O-CD2 3.27Å; C838-Y840 VanDerWaalsContact O-CE2 3.27Å; C838-Y840 WeakPolarHBondContact O-CE2 3.47Å
839	W	93.9	Very high	92.8	Very high	26 Å²	26	51.5 Å²	51.5	10%	0.098	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	132.9	177.7	-69	92.9	0	0	0	112	L809 N810 P815 F817 I830 C832 S872 R873	L809-W839 HydrophobicContact CB-CB 4.18Å; L809-W839 WeakPolarHBondContact CD1-O 3.33Å; N810-W839 PolarHBondContact ND2-O 3.31Å; N810-W839 VanDerWaalsContact ND2-O 3.12Å; N810-W839 PolarHBondContact OD1-N 3.09Å; P815-W839 HydrophobicContact CB-CD2 4.41Å; P815-W839 HydrophobicContact CB-CZ2 4.41Å; P815-W839 HydrophobicContact CG-CD2 4.17Å; P815-W839 HydrophobicContact CG-CH2 4.19Å; P815-W839 HydrophobicContact CG-CZ2 3.62Å; F817-W839 AromaticContact CE1-CH2 3.73Å; F817-W839 HydrophobicContact CE1-CH2 3.73Å; F817-W839 HydrophobicContact CE1-CZ2 4.18Å; F817-W839 AromaticContact CZ-CH2 3.74Å; F817-W839 HydrophobicContact CZ-CH2 3.74Å; F817-W839 AromaticContact CZ-CZ2 3.68Å; F817-W839 HydrophobicContact CZ-CZ2 3.68Å; I830-W839 HydrophobicContact CB-CE3 4.08Å; I830-W839 HydrophobicContact CD1-CD2 4.23Å; I830-W839 HydrophobicContact CD1-CE3 3.58Å; I830-W839 HydrophobicContact CD1-CZ3 3.9Å; I830-W839 HydrophobicContact CG1-CE3 4.07Å; I830-W839 HydrophobicContact CG1-CZ3 4.25Å; C832-W839 HydrophobicContact CB-CD2 4.04Å; C832-W839 HydrophobicContact CB-CE3 4.05Å; C832-W839 HydrophobicContact CB-CH2 3.9Å; C832-W839 HydrophobicContact CB-CZ2 3.82Å; C832-W839 HydrophobicContact CB-CZ3 4.01Å; W839-S872 WeakPolarHBondContact CH2-O 3.46Å; W839-S872 WeakPolarHBondContact CZ2-O 3.48Å; W839-R873 VanDerWaalsContact CH2-C 3.45Å; W839-R873 WeakPolarHBondContact CZ3-O 3.32Å
840	Y	96	Very high	92.6	Very high	35 Å²	35	59.5 Å²	59.5	14%	0.137	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	154.2	-178.3	-65.7	-83.4	0	0	0	111.3	I830 A831 F833 D836 C838 F856 F859	I830-Y840 CarbonylContact C-O 3.59Å; I830-Y840 WeakPolarHBondContact CA-O 3.46Å; A831-Y840 PolarHBondContact N-O 3.49Å; A831-Y840 PolarHBondContact O-N 2.84Å; F833-Y840 HydrophobicContact CB-CD2 3.66Å; F833-Y840 HydrophobicContact CB-CE2 3.66Å; F833-Y840 HydrophobicContact CD1-CE2 4.47Å; F833-Y840 HydrophobicContact CG-CE2 4.49Å; D836-Y840 PolarHBondContact OD2-OH 3.35Å; C838-Y840 HydrophobicContact CB-CD2 4.46Å; C838-Y840 HydrophobicContact CB-CE2 3.54Å; C838-Y840 WeakPolarHBondContact O-CD2 3.27Å; C838-Y840 VanDerWaalsContact O-CE2 3.27Å; C838-Y840 WeakPolarHBondContact O-CE2 3.47Å; Y840-F856 VanDerWaalsContact CB-CD1 3.41Å; Y840-F856 HydrophobicContact CD2-CD1 4.45Å; Y840-F856 HydrophobicContact CD2-CE1 4.27Å; Y840-F856 HydrophobicContact CG-CD1 4.14Å; Y840-F856 HydrophobicContact CG-CE1 4.38Å; Y840-F859 AromaticContact CD1-CD2 3.94Å; Y840-F859 HydrophobicContact CD1-CD2 3.94Å; Y840-F859 AromaticContact CD1-CE2 3.46Å; Y840-F859 HydrophobicContact CD1-CE2 3.46Å; Y840-F859 VanDerWaalsContact CD1-CE2 3.46Å; Y840-F859 HydrophobicContact CD1-CZ 4.33Å; Y840-F859 HydrophobicContact CE1-CD2 4.2Å; Y840-F859 AromaticContact CE1-CE2 3.46Å; Y840-F859 HydrophobicContact CE1-CE2 3.46Å; Y840-F859 VanDerWaalsContact CE1-CE2 3.46Å; Y840-F859 AromaticContact CE1-CZ 3.88Å; Y840-F859 HydrophobicContact CE1-CZ 3.88Å
841	R	96.4	Very high	92.6	Very high	3 Å²	3	60.7 Å²	60.7	1%	0.011	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	133.5	169.5	-53.6	-168	-62.5	159.7	1.7	109.2	I805 L809 F856 I857 D858 L877 L882 L885 P886	I805-R841 HydrophobicContact CG2-CG 4.13Å; L809-R841 HydrophobicContact CD1-CG 3.76Å; R841-F856 CarbonylContact O-C 3.49Å; R841-F856 WeakPolarHBondContact O-CA 3.45Å; R841-I857 HydrophobicContact CB-CD1 3.84Å; R841-I857 HydrophobicContact CB-CG1 3.69Å; R841-I857 PolarHBondContact O-N 2.83Å; R841-D858 IonicContact CZ-OD1 3.84Å; R841-D858 IonicContact CZ-OD2 3.34Å; R841-D858 IonicContact NE-OD1 3.93Å; R841-D858 IonicContact NE-OD2 2.92Å; R841-D858 PolarHBondContact NE-OD2 3.12Å; R841-D858 IonicContact NH2-OD1 2.94Å; R841-D858 PolarHBondContact NH2-OD1 3.12Å; R841-D858 IonicContact NH2-OD2 2.76Å; R841-D858 PolarHBondContact NH2-OD2 2.82Å; R841-L877 HydrophobicContact CG-CD1 4.31Å; R841-L882 WeakPolarHBondContact CD-O 3.41Å; R841-L882 PolarHBondContact NH1-O 3Å; R841-L885 PolarHBondContact NH1-O 2.93Å; R841-P886 PolarHBondContact NH2-O 2.82Å
842	A	97	Very high	92.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	165.8	-177.9	0	0	0	0	0	112.1	L828 C829 A831 V854 Q855 F856	L828-A842 WeakPolarHBondContact CA-O 3.38Å; C829-A842 PolarHBondContact N-O 2.91Å; C829-A842 PolarHBondContact O-N 3.18Å; C829-A842 VanDerWaalsContact O-O 3.09Å; A831-A842 HydrophobicContact CB-CB 3.91Å; A842-V854 HydrophobicContact CB-CB 4.11Å; A842-V854 HydrophobicContact CB-CG2 4.44Å; A842-Q855 CarbonylContact C-O 3.57Å; A842-Q855 WeakPolarHBondContact CA-O 3.33Å; A842-F856 HydrophobicContact CB-CD1 4.14Å
843	R	96.4	Very high	92.8	Very high	97 Å²	97	61.1 Å²	61.1	37%	0.366	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.3	172.6	-178.9	-177	-67.4	156.9	0.3	109.3	S827 L828 I845 V854 Q855 I857	S827-R843 WeakPolarHBondContact O-CA 3.44Å; L828-R843 HydrophobicContact CD2-CB 4.22Å; R843-I845 PolarHBondContact O-N 3.25Å; R843-V854 CarbonylContact O-C 3.57Å; R843-V854 WeakPolarHBondContact O-CA 3.38Å; R843-Q855 PolarHBondContact N-O 2.63Å; R843-Q855 PolarHBondContact O-N 3.29Å; R843-I857 HydrophobicContact CB-CG2 3.7Å
844	V	96	Very high	92.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	117.1	173.4	-178.1	0	0	0	0	109.1	P823 K824 G826 S827 V852 V854	P823-V844 HydrophobicContact CB-CG2 3.86Å; K824-V844 WeakPolarHBondContact O-CB 3.34Å; G826-V844 PolarHBondContact N-O 3.07Å; S827-V844 PolarHBondContact O-N 3.34Å; S827-V844 VanDerWaalsContact O-N 3.08Å; V844-V852 HydrophobicContact CG1-CB 4.36Å; V844-V852 HydrophobicContact CG1-CG1 4.34Å; V844-V854 HydrophobicContact CG2-CG1 4.37Å
845	I	93.2	Very high	93.1	Very high	36 Å²	36	58.4 Å²	58.4	19%	0.185	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-27.9	-179.9	51.4	162.1	0	0	0	112.4	K825 R843 T853 Q855 E862	K825-I845 WeakPolarHBondContact CE-O 3.07Å; R843-I845 PolarHBondContact O-N 3.25Å; I845-T853 HydrophobicContact CD1-CG2 3.74Å; I845-T853 HydrophobicContact CG1-CG2 3.96Å; I845-T853 WeakPolarHBondContact CG1-O 3.46Å; I845-T853 PolarHBondContact N-O 2.84Å; I845-Q855 HydrophobicContact CD1-CB 4.34Å; I845-Q855 HydrophobicContact CG2-CB 3.97Å; I845-E862 HydrophobicContact CD1-CG 3.77Å; I845-E862 WeakPolarHBondContact CD1-OE1 3.17Å; I845-E862 VanDerWaalsContact CD1-OE2 3.29Å; I845-E862 WeakPolarHBondContact CD1-OE2 3.45Å
846	R	91.9	Very high	93.6	Very high	162 Å²	162	51.6 Å²	51.6	61%	0.611	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.5	143.1	172.7	-59.8	179.4	-175	144.3	4.4	109.4	V852 T853	R846-V852 WeakPolarHBondContact O-CA 3.27Å; R846-T853 PolarHBondContact N-O 2.89Å; R846-T853 PolarHBondContact O-N 3.45Å
847	S	89.2	Confident	93.9	Very high	67 Å²	67	48.9 Å²	48.9	47%	0.469	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	132.4	177.1	178.9	0	0	0	0	109.1	P823	P823-S847 PolarHBondContact O-OG 3.5Å
848	S	88.7	Confident	94.2	Very high	51 Å²	51	43.4 Å²	43.4	36%	0.357	22%	0.22	S	C	.	.			trans	-132.3	165.2	174.7	80.5	0	0	0	0	109.4	K850 S851	S848-K850 PolarHBondContact O-N 2.95Å; S848-K850 VanDerWaalsContact O-N 3.13Å; S848-K850 PolarHBondContact OG-N 2.99Å; S848-S851 WeakPolarHBondContact CA-O 3.27Å; S848-S851 PolarHBondContact N-O 3.45Å; S848-S851 VanDerWaalsContact O-O 3.13Å; S848-S851 PolarHBondContact OG-N 3.02Å; S848-S851 VanDerWaalsContact OG-N 3.09Å; S848-S851 PolarHBondContact OG-O 3.41Å; S848-S851 PolarHBondContact OG-OG 3.15Å
849	P	86	Confident	94.3	Very high	133 Å²	133	44.4 Å²	44.4	86%	0.864	22%	0.22	S	C	*	.	S	Bend	trans	-60.3	-23.1	177.4	-24.8	34.7	0	0	0	114.5
850	K	91.1	Very high	94.3	Very high	168 Å²	168	43.3 Å²	43.3	73%	0.73	22%	0.217	S	C	*	.	S	Bend	trans	-103.9	-23.3	-174.6	-65.6	-172.5	178.7	-176.5	0	114	S848 A867	S848-K850 PolarHBondContact O-N 2.95Å; S848-K850 VanDerWaalsContact O-N 3.13Å; S848-K850 PolarHBondContact OG-N 2.99Å; K850-A867 VanDerWaalsContact O-CB 3.28Å; K850-A867 WeakPolarHBondContact O-CB 3.32Å; K850-A867 PolarHBondContact O-N 2.87Å
851	S	93.8	Very high	94.2	Very high	26 Å²	26	44.2 Å²	44.2	18%	0.182	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	160.2	-176	59.7	0	0	0	0	111.9	S848 I865 Y870	S848-S851 WeakPolarHBondContact CA-O 3.27Å; S848-S851 PolarHBondContact N-O 3.45Å; S848-S851 VanDerWaalsContact O-O 3.13Å; S848-S851 PolarHBondContact OG-N 3.02Å; S848-S851 VanDerWaalsContact OG-N 3.09Å; S848-S851 PolarHBondContact OG-O 3.41Å; S848-S851 PolarHBondContact OG-OG 3.15Å; S851-I865 CarbonylContact C-O 3.6Å; S851-I865 WeakPolarHBondContact CA-O 3.18Å; S851-I865 WeakPolarHBondContact CB-O 3.32Å; S851-Y870 VanDerWaalsContact CA-OH 3.3Å; S851-Y870 WeakPolarHBondContact CA-OH 3.1Å
852	V	95.5	Very high	94.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.1	168.2	-67	0	0	0	0	110.4	P823 V844 R846 V854 V864 I865 Y870 L874	P823-V852 HydrophobicContact CB-CG1 3.98Å; P823-V852 HydrophobicContact CG-CG1 3.52Å; P823-V852 HydrophobicContact CG-CG2 4.42Å; V844-V852 HydrophobicContact CG1-CB 4.36Å; V844-V852 HydrophobicContact CG1-CG1 4.34Å; R846-V852 WeakPolarHBondContact O-CA 3.27Å; V852-V854 HydrophobicContact CG2-CG1 4.13Å; V852-V864 CarbonylContact O-C 3.55Å; V852-V864 WeakPolarHBondContact O-CA 2.8Å; V852-I865 HydrophobicContact CG2-CB 4.29Å; V852-I865 PolarHBondContact N-O 3.48Å; V852-I865 PolarHBondContact O-N 3.28Å; V852-Y870 HydrophobicContact CG1-CE1 4.43Å; V852-Y870 VanDerWaalsContact CG1-OH 3.31Å; V852-Y870 WeakPolarHBondContact CG1-OH 3.37Å; V852-Y870 HydrophobicContact CG2-CE1 3.72Å; V852-Y870 PolarHBondContact N-OH 3.33Å; V852-Y870 VanDerWaalsContact N-OH 3.17Å; V852-L874 HydrophobicContact CG2-CD2 3.84Å
853	T	96.4	Very high	94	Very high	18 Å²	18	50 Å²	50	11%	0.11	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.9	165.4	-47.1	0	0	0	0	108.1	I845 R846 E862 E863 V864	I845-T853 HydrophobicContact CD1-CG2 3.74Å; I845-T853 HydrophobicContact CG1-CG2 3.96Å; I845-T853 WeakPolarHBondContact CG1-O 3.46Å; I845-T853 PolarHBondContact N-O 2.84Å; R846-T853 PolarHBondContact N-O 2.89Å; R846-T853 PolarHBondContact O-N 3.45Å; T853-E862 HydrophobicContact CG2-CB 4.2Å; T853-E863 WeakPolarHBondContact CA-O 3.47Å; T853-V864 HydrophobicContact CG2-CG2 4.31Å
854	V	97.1	Very high	94	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	147.3	175.5	-61	0	0	0	0	110	A831 A842 R843 V844 V852 F856 E862 E863 I865 L874	A831-V854 HydrophobicContact CB-CG2 4.02Å; A842-V854 HydrophobicContact CB-CB 4.11Å; A842-V854 HydrophobicContact CB-CG2 4.44Å; R843-V854 CarbonylContact O-C 3.57Å; R843-V854 WeakPolarHBondContact O-CA 3.38Å; V844-V854 HydrophobicContact CG2-CG1 4.37Å; V852-V854 HydrophobicContact CG2-CG1 4.13Å; V854-F856 HydrophobicContact CG2-CZ 4.44Å; V854-E862 CarbonylContact O-C 3.55Å; V854-E862 WeakPolarHBondContact O-CA 3.5Å; V854-E863 HydrophobicContact CG2-CB 4.46Å; V854-E863 PolarHBondContact N-O 2.83Å; V854-E863 PolarHBondContact O-N 2.79Å; V854-I865 HydrophobicContact CG1-CD1 4.36Å; V854-I865 HydrophobicContact CG2-CD1 3.86Å; V854-I865 HydrophobicContact CG2-CG1 4.43Å; V854-L874 HydrophobicContact CG1-CD1 4.07Å
855	Q	96.9	Very high	94	Very high	36 Å²	36	49.2 Å²	49.2	17%	0.168	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.6	168.4	-176.9	179.3	48.5	0	0	108.8	F792 A842 R843 I845 I857 G860 N861 E862	F792-Q855 VanDerWaalsContact CZ-NE2 3.3Å; A842-Q855 CarbonylContact C-O 3.57Å; A842-Q855 WeakPolarHBondContact CA-O 3.33Å; R843-Q855 PolarHBondContact N-O 2.63Å; R843-Q855 PolarHBondContact O-N 3.29Å; I845-Q855 HydrophobicContact CD1-CB 4.34Å; I845-Q855 HydrophobicContact CG2-CB 3.97Å; Q855-I857 PolarHBondContact O-N 2.99Å; Q855-I857 VanDerWaalsContact O-N 3.17Å; Q855-G860 WeakPolarHBondContact CG-O 3.26Å; Q855-G860 PolarHBondContact NE2-O 2.7Å; Q855-G860 VanDerWaalsContact NE2-O 3.15Å; Q855-N861 WeakPolarHBondContact CA-O 3.2Å; Q855-E862 HydrophobicContact CB-CG 4.23Å; Q855-E862 HydrophobicContact CG-CG 4.3Å
856	F	97.2	Very high	94	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	106.1	176.1	-64.9	-75.3	0	0	0	109.2	A831 F833 Y840 R841 A842 V854 D858 F859 G860 N861 E863	A831-F856 HydrophobicContact CB-CE1 3.77Å; A831-F856 HydrophobicContact CB-CZ 4.25Å; F833-F856 HydrophobicContact CB-CE1 4.22Å; F833-F856 HydrophobicContact CB-CE2 4.45Å; F833-F856 HydrophobicContact CB-CZ 3.84Å; F833-F856 HydrophobicContact CD2-CD2 4.43Å; F833-F856 AromaticContact CD2-CE2 3.53Å; F833-F856 HydrophobicContact CD2-CE2 3.53Å; F833-F856 AromaticContact CD2-CZ 3.71Å; F833-F856 HydrophobicContact CD2-CZ 3.71Å; F833-F856 HydrophobicContact CE2-CE2 4.13Å; F833-F856 HydrophobicContact CG-CE2 4.28Å; F833-F856 HydrophobicContact CG-CZ 4.16Å; Y840-F856 VanDerWaalsContact CB-CD1 3.41Å; Y840-F856 HydrophobicContact CD2-CD1 4.45Å; Y840-F856 HydrophobicContact CD2-CE1 4.27Å; Y840-F856 HydrophobicContact CG-CD1 4.14Å; Y840-F856 HydrophobicContact CG-CE1 4.38Å; R841-F856 CarbonylContact O-C 3.49Å; R841-F856 WeakPolarHBondContact O-CA 3.45Å; A842-F856 HydrophobicContact CB-CD1 4.14Å; V854-F856 HydrophobicContact CG2-CZ 4.44Å; F856-D858 PolarHBondContact O-N 2.98Å; F856-F859 HydrophobicContact CB-CB 4.35Å; F856-F859 PolarHBondContact O-N 3.23Å; F856-G860 WeakPolarHBondContact O-CA 3.07Å; F856-G860 PolarHBondContact O-N 3.13Å; F856-N861 WeakPolarHBondContact CD2-ND2 3.35Å; F856-N861 WeakPolarHBondContact CD2-O 3.4Å; F856-N861 PolarHBondContact N-O 2.85Å; F856-E863 HydrophobicContact CE2-CB 3.84Å; F856-E863 HydrophobicContact CZ-CB 4.37Å
857	I	96.9	Very high	94	Very high	9 Å²	9	45.7 Å²	45.7	5%	0.046	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.3	-167.8	63.9	170.5	0	0	0	113.5	L828 R841 R843 Q855 P887 V889	L828-I857 HydrophobicContact CD2-CD1 4.09Å; R841-I857 HydrophobicContact CB-CD1 3.84Å; R841-I857 HydrophobicContact CB-CG1 3.69Å; R841-I857 PolarHBondContact O-N 2.83Å; R843-I857 HydrophobicContact CB-CG2 3.7Å; Q855-I857 PolarHBondContact O-N 2.99Å; Q855-I857 VanDerWaalsContact O-N 3.17Å; I857-P887 HydrophobicContact CB-CB 4.28Å; I857-P887 HydrophobicContact CB-CG 4.48Å; I857-P887 VanDerWaalsContact O-CB 3.29Å; I857-P887 WeakPolarHBondContact O-CB 3.43Å; I857-V889 VanDerWaalsContact O-CG1 3.26Å; I857-V889 WeakPolarHBondContact O-CG1 3.47Å
858	D	96.7	Very high	94.1	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.011	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-12.4	177.3	-65.3	-37.2	0	0	0	112.7	Q794 L802 R841 F856 Q888	Q794-D858 PolarHBondContact NE2-O 2.83Å; L802-D858 HydrophobicContact CD2-CB 3.94Å; R841-D858 IonicContact CZ-OD1 3.84Å; R841-D858 IonicContact CZ-OD2 3.34Å; R841-D858 IonicContact NE-OD1 3.93Å; R841-D858 IonicContact NE-OD2 2.92Å; R841-D858 PolarHBondContact NE-OD2 3.12Å; R841-D858 IonicContact NH2-OD1 2.94Å; R841-D858 PolarHBondContact NH2-OD1 3.12Å; R841-D858 IonicContact NH2-OD2 2.76Å; R841-D858 PolarHBondContact NH2-OD2 2.82Å; F856-D858 PolarHBondContact O-N 2.98Å; D858-Q888 HydrophobicContact CB-CB 4.1Å; D858-Q888 HydrophobicContact CB-CG 4.47Å; D858-Q888 WeakPolarHBondContact OD1-CB 3.35Å; D858-Q888 VanDerWaalsContact OD1-CG 3.31Å; D858-Q888 WeakPolarHBondContact OD1-CG 3.48Å; D858-Q888 PolarHBondContact OD1-N 3.16Å
859	F	94.5	Very high	94.1	Very high	63 Å²	63	47.7 Å²	47.7	28%	0.276	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.4	-22.7	-175.4	-67.7	-91.7	0	0	0	113.9	T778 L802 Y840 F856 N861	T778-F859 WeakPolarHBondContact CB-O 3.42Å; T778-F859 HydrophobicContact CG2-CD1 4.33Å; T778-F859 PolarHBondContact OG1-O 3.32Å; L802-F859 HydrophobicContact CD2-CE2 4.48Å; L802-F859 HydrophobicContact CD2-CZ 4.45Å; Y840-F859 AromaticContact CD1-CD2 3.94Å; Y840-F859 HydrophobicContact CD1-CD2 3.94Å; Y840-F859 AromaticContact CD1-CE2 3.46Å; Y840-F859 HydrophobicContact CD1-CE2 3.46Å; Y840-F859 VanDerWaalsContact CD1-CE2 3.46Å; Y840-F859 HydrophobicContact CD1-CZ 4.33Å; Y840-F859 HydrophobicContact CE1-CD2 4.2Å; Y840-F859 AromaticContact CE1-CE2 3.46Å; Y840-F859 HydrophobicContact CE1-CE2 3.46Å; Y840-F859 VanDerWaalsContact CE1-CE2 3.46Å; Y840-F859 AromaticContact CE1-CZ 3.88Å; Y840-F859 HydrophobicContact CE1-CZ 3.88Å; F856-F859 HydrophobicContact CB-CB 4.35Å; F856-F859 PolarHBondContact O-N 3.23Å; F859-N861 VanDerWaalsContact C-N 3.33Å; F859-N861 WeakPolarHBondContact CB-OD1 3.44Å; F859-N861 PolarHBondContact O-N 3.31Å
860	G	93.8	Very high	94.3	Very high	2 Å²	2	43 Å²	43	2%	0.021	23%	0.234	C	C	.	.			trans	88.7	-20.6	174.7	0	0	0	0	0	115.3	F792 Q855 F856	F792-G860 VanDerWaalsContact CE2-O 3.29Å; F792-G860 WeakPolarHBondContact CE2-O 3.31Å; Q855-G860 WeakPolarHBondContact CG-O 3.26Å; Q855-G860 PolarHBondContact NE2-O 2.7Å; Q855-G860 VanDerWaalsContact NE2-O 3.15Å; F856-G860 WeakPolarHBondContact O-CA 3.07Å; F856-G860 PolarHBondContact O-N 3.13Å
861	N	93.1	Very high	94.1	Very high	54 Å²	54	39.6 Å²	39.6	29%	0.289	23%	0.23	S	C	.	.			trans	-66.2	154.5	176.7	62.3	-56.8	0	0	0	112.2	F833 Q855 F856 F859	F833-N861 WeakPolarHBondContact CE2-ND2 3.47Å; Q855-N861 WeakPolarHBondContact CA-O 3.2Å; F856-N861 WeakPolarHBondContact CD2-ND2 3.35Å; F856-N861 WeakPolarHBondContact CD2-O 3.4Å; F856-N861 PolarHBondContact N-O 2.85Å; F859-N861 VanDerWaalsContact C-N 3.33Å; F859-N861 WeakPolarHBondContact CB-OD1 3.44Å; F859-N861 PolarHBondContact O-N 3.31Å
862	E	95.2	Very high	93.8	Very high	101 Å²	101	41.4 Å²	41.4	47%	0.472	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	150.1	-179.6	-59.6	-178.1	-176.5	0	0	110.8	I845 T853 V854 Q855	I845-E862 HydrophobicContact CD1-CG 3.77Å; I845-E862 WeakPolarHBondContact CD1-OE1 3.17Å; I845-E862 VanDerWaalsContact CD1-OE2 3.29Å; I845-E862 WeakPolarHBondContact CD1-OE2 3.45Å; T853-E862 HydrophobicContact CG2-CB 4.2Å; V854-E862 CarbonylContact O-C 3.55Å; V854-E862 WeakPolarHBondContact O-CA 3.5Å; Q855-E862 HydrophobicContact CB-CG 4.23Å; Q855-E862 HydrophobicContact CG-CG 4.3Å
863	E	95	Very high	93.6	Very high	24 Å²	24	43 Å²	43	11%	0.112	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	143.5	171.8	-174.4	172.2	-162.7	0	0	110.5	F833 S834 T853 V854 F856 R873	F833-E863 WeakPolarHBondContact CD2-OE2 3.41Å; S834-E863 WeakPolarHBondContact CB-OE1 3.38Å; S834-E863 PolarHBondContact N-OE2 2.94Å; S834-E863 PolarHBondContact OG-OE1 3.18Å; T853-E863 WeakPolarHBondContact CA-O 3.47Å; V854-E863 HydrophobicContact CG2-CB 4.46Å; V854-E863 PolarHBondContact N-O 2.83Å; V854-E863 PolarHBondContact O-N 2.79Å; F856-E863 HydrophobicContact CE2-CB 3.84Å; F856-E863 HydrophobicContact CZ-CB 4.37Å; E863-R873 IonicContact OE1-CZ 3.35Å; E863-R873 IonicContact OE1-NH1 2.79Å; E863-R873 IonicContact OE1-NH2 3.82Å; E863-R873 PolarHBondContact OE1-NH2 3.17Å; E863-R873 IonicContact OE2-NH2 3.25Å; E863-R873 PolarHBondContact OE2-NH2 2.91Å
864	V	96.7	Very high	93.5	Very high	81 Å²	81	42.3 Å²	42.3	49%	0.491	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125	171.9	-177	0	0	0	0	108.3	V852 T853	V852-V864 CarbonylContact O-C 3.55Å; V852-V864 WeakPolarHBondContact O-CA 2.8Å; T853-V864 HydrophobicContact CG2-CG2 4.31Å
865	I	95	Very high	93.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.9	177.1	-57.7	173.3	0	0	0	107.7	A831 S851 V852 V854 E869 Y870 R873 L874	A831-I865 HydrophobicContact CB-CD1 3.92Å; S851-I865 CarbonylContact C-O 3.6Å; S851-I865 WeakPolarHBondContact CA-O 3.18Å; S851-I865 WeakPolarHBondContact CB-O 3.32Å; V852-I865 HydrophobicContact CG2-CB 4.29Å; V852-I865 PolarHBondContact N-O 3.48Å; V852-I865 PolarHBondContact O-N 3.28Å; V854-I865 HydrophobicContact CG1-CD1 4.36Å; V854-I865 HydrophobicContact CG2-CD1 3.86Å; V854-I865 HydrophobicContact CG2-CG1 4.43Å; I865-E869 HydrophobicContact CG2-CB 4.09Å; I865-Y870 HydrophobicContact CG2-CD1 3.97Å; I865-Y870 HydrophobicContact CG2-CE1 4.23Å; I865-Y870 WeakPolarHBondContact O-CE1 3.2Å; I865-R873 HydrophobicContact CG2-CB 4.29Å; I865-L874 HydrophobicContact CD1-CD1 4.18Å
866	D	94.2	Very high	92.9	Very high	83 Å²	83	42.9 Å²	42.9	44%	0.444	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	148.6	177.8	-75.7	-29.6	0	0	0	111.8	A868 E869 Y870	D866-A868 PolarHBondContact O-N 3.35Å; D866-A868 VanDerWaalsContact O-N 3.13Å; D866-E869 PolarHBondContact O-N 2.84Å; D866-Y870 WeakPolarHBondContact O-CD1 3.31Å; D866-Y870 WeakPolarHBondContact O-CE1 3.17Å
867	A	91.1	Very high	92.6	Very high	41 Å²	41	43.2 Å²	43.2	34%	0.339	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-57.7	-29.4	-179.4	0	0	0	0	0	113.2	K850 E869 Y870	K850-A867 VanDerWaalsContact O-CB 3.28Å; K850-A867 WeakPolarHBondContact O-CB 3.32Å; K850-A867 PolarHBondContact O-N 2.87Å; A867-E869 PolarHBondContact O-N 3.41Å; A867-Y870 VanDerWaalsContact CA-CE1 3.46Å; A867-Y870 VanDerWaalsContact CA-CZ 3.45Å; A867-Y870 HydrophobicContact CB-CD2 4.39Å; A867-Y870 HydrophobicContact CB-CE1 4.37Å; A867-Y870 HydrophobicContact CB-CE2 3.9Å; A867-Y870 PolarHBondContact O-N 3.16Å
868	A	90.3	Very high	91.8	Very high	91 Å²	91	44.6 Å²	44.6	75%	0.752	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-66.1	-24.2	174.9	0	0	0	0	0	113.2	D866	D866-A868 PolarHBondContact O-N 3.35Å; D866-A868 VanDerWaalsContact O-N 3.13Å
869	E	90.8	Very high	91.2	Very high	68 Å²	68	50.3 Å²	50.3	32%	0.318	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-97.2	-7.6	-176	-59.2	-173.6	167.3	0	0	113	I865 D866 A867 S871 S872 R873	I865-E869 HydrophobicContact CG2-CB 4.09Å; D866-E869 PolarHBondContact O-N 2.84Å; A867-E869 PolarHBondContact O-N 3.41Å; E869-S871 VanDerWaalsContact C-N 3.28Å; E869-S871 PolarHBondContact O-N 3.09Å; E869-S872 PolarHBondContact O-N 3.42Å; E869-S872 PolarHBondContact O-OG 3.02Å; E869-R873 HydrophobicContact CB-CB 4.48Å; E869-R873 HydrophobicContact CB-CG 4.37Å; E869-R873 PolarHBondContact O-N 2.77Å; E869-R873 VanDerWaalsContact OE2-CD 3.24Å; E869-R873 WeakPolarHBondContact OE2-CD 3.45Å; E869-R873 IonicContact OE2-CZ 3.57Å; E869-R873 IonicContact OE2-NE 3.42Å; E869-R873 IonicContact OE2-NH1 3.21Å; E869-R873 PolarHBondContact OE2-NH1 3.36Å
870	Y	89.8	Confident	90.7	Very high	36 Å²	36	49 Å²	49	14%	0.141	31%	0.305	C	S	.	.	H	α-helix	trans	-52.4	-45	-173.9	-71.7	-2.9	0	0	0	112.6	P823 S851 V852 I865 D866 A867 S872 R873 L874	P823-Y870 HydrophobicContact CG-CD2 4.28Å; P823-Y870 HydrophobicContact CG-CE2 3.86Å; S851-Y870 VanDerWaalsContact CA-OH 3.3Å; S851-Y870 WeakPolarHBondContact CA-OH 3.1Å; V852-Y870 HydrophobicContact CG1-CE1 4.43Å; V852-Y870 VanDerWaalsContact CG1-OH 3.31Å; V852-Y870 WeakPolarHBondContact CG1-OH 3.37Å; V852-Y870 HydrophobicContact CG2-CE1 3.72Å; V852-Y870 PolarHBondContact N-OH 3.33Å; V852-Y870 VanDerWaalsContact N-OH 3.17Å; I865-Y870 HydrophobicContact CG2-CD1 3.97Å; I865-Y870 HydrophobicContact CG2-CE1 4.23Å; I865-Y870 WeakPolarHBondContact O-CE1 3.2Å; D866-Y870 WeakPolarHBondContact O-CD1 3.31Å; D866-Y870 WeakPolarHBondContact O-CE1 3.17Å; A867-Y870 VanDerWaalsContact CA-CE1 3.46Å; A867-Y870 VanDerWaalsContact CA-CZ 3.45Å; A867-Y870 HydrophobicContact CB-CD2 4.39Å; A867-Y870 HydrophobicContact CB-CE1 4.37Å; A867-Y870 HydrophobicContact CB-CE2 3.9Å; A867-Y870 PolarHBondContact O-N 3.16Å; Y870-S872 PolarHBondContact O-N 3.44Å; Y870-S872 VanDerWaalsContact O-N 3.12Å; Y870-R873 PolarHBondContact O-N 3.1Å; Y870-L874 HydrophobicContact CD1-CD2 3.93Å; Y870-L874 HydrophobicContact CE1-CD2 4.27Å; Y870-L874 HydrophobicContact CG-CD2 4.23Å; Y870-L874 CarbonylContact O-C 3.48Å; Y870-L874 PolarHBondContact O-N 2.8Å
871	S	85.8	Confident	90.3	Very high	95 Å²	95	52.8 Å²	52.8	66%	0.664	33%	0.331	S	S	*	.	H	α-helix	trans	-62.3	-19.6	-179.8	55.9	0	0	0	0	114.4	F817 E869	F817-S871 VanDerWaalsContact CD1-O 3.29Å; F817-S871 WeakPolarHBondContact CD1-O 3.46Å; F817-S871 VanDerWaalsContact CE1-O 3.29Å; F817-S871 WeakPolarHBondContact CE1-O 3.13Å; E869-S871 VanDerWaalsContact C-N 3.28Å; E869-S871 PolarHBondContact O-N 3.09Å
872	S	87.7	Confident	90.2	Very high	65 Å²	65	51 Å²	51	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-111.5	-25.7	-176.5	63.9	0	0	0	0	113.7	W839 E869 Y870	W839-S872 WeakPolarHBondContact CH2-O 3.46Å; W839-S872 WeakPolarHBondContact CZ2-O 3.48Å; E869-S872 PolarHBondContact O-N 3.42Å; E869-S872 PolarHBondContact O-OG 3.02Å; Y870-S872 PolarHBondContact O-N 3.44Å; Y870-S872 VanDerWaalsContact O-N 3.12Å
873	R	92.5	Very high	89.9	Confident	34 Å²	34	50 Å²	50	13%	0.128	32%	0.317	C	S	.	.	H	α-helix	trans	-123.2	-3.9	-170.2	-66.4	-171.8	65.7	-160.3	-2.5	114.8	A831 C832 W839 E863 I865 E869 Y870	A831-R873 CarbonylContact C-O 3.49Å; A831-R873 VanDerWaalsContact CA-O 3.29Å; A831-R873 WeakPolarHBondContact CA-O 3.49Å; C832-R873 HydrophobicContact CB-CB 4.18Å; C832-R873 HydrophobicContact CB-CG 4.26Å; C832-R873 PolarHBondContact N-O 3.4Å; C832-R873 PolarHBondContact O-NE 3.06Å; C832-R873 PolarHBondContact O-NH2 2.82Å; W839-R873 VanDerWaalsContact CH2-C 3.45Å; W839-R873 WeakPolarHBondContact CZ3-O 3.32Å; E863-R873 IonicContact OE1-CZ 3.35Å; E863-R873 IonicContact OE1-NH1 2.79Å; E863-R873 IonicContact OE1-NH2 3.82Å; E863-R873 PolarHBondContact OE1-NH2 3.17Å; E863-R873 IonicContact OE2-NH2 3.25Å; E863-R873 PolarHBondContact OE2-NH2 2.91Å; I865-R873 HydrophobicContact CG2-CB 4.29Å; E869-R873 HydrophobicContact CB-CB 4.48Å; E869-R873 HydrophobicContact CB-CG 4.37Å; E869-R873 PolarHBondContact O-N 2.77Å; E869-R873 VanDerWaalsContact OE2-CD 3.24Å; E869-R873 WeakPolarHBondContact OE2-CD 3.45Å; E869-R873 IonicContact OE2-CZ 3.57Å; E869-R873 IonicContact OE2-NE 3.42Å; E869-R873 IonicContact OE2-NH1 3.21Å; E869-R873 PolarHBondContact OE2-NH1 3.36Å; Y870-R873 PolarHBondContact O-N 3.1Å
874	L	92.8	Very high	89.7	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.016	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	124.8	-173.4	-170	71.5	0	0	0	111.8	Y821 P823 C829 A831 V852 V854 I865 Y870	Y821-L874 HydrophobicContact CD1-CD2 4.05Å; Y821-L874 HydrophobicContact CD1-CG 4Å; Y821-L874 HydrophobicContact CE1-CD1 4.45Å; Y821-L874 HydrophobicContact CE1-CD2 3.73Å; Y821-L874 HydrophobicContact CE1-CG 3.67Å; P823-L874 HydrophobicContact CB-CD2 3.9Å; P823-L874 HydrophobicContact CG-CD2 3.76Å; C829-L874 HydrophobicContact CB-CD1 4.15Å; A831-L874 HydrophobicContact CB-CD1 4.12Å; V852-L874 HydrophobicContact CG2-CD2 3.84Å; V854-L874 HydrophobicContact CG1-CD1 4.07Å; I865-L874 HydrophobicContact CD1-CD1 4.18Å; Y870-L874 HydrophobicContact CD1-CD2 3.93Å; Y870-L874 HydrophobicContact CE1-CD2 4.27Å; Y870-L874 HydrophobicContact CG-CD2 4.23Å; Y870-L874 CarbonylContact O-C 3.48Å; Y870-L874 PolarHBondContact O-N 2.8Å
875	S	91.8	Very high	89.5	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.014	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	153.3	176.9	-173.9	0	0	0	0	110.6	S816 C829 I830	S816-S875 PolarHBondContact O-OG 3.2Å; C829-S875 CarbonylContact C-O 3.6Å; C829-S875 WeakPolarHBondContact CA-O 3Å; C829-S875 VanDerWaalsContact CB-O 3.31Å; C829-S875 WeakPolarHBondContact CB-O 3.36Å; I830-S875 VanDerWaalsContact CG1-O 3.31Å; I830-S875 WeakPolarHBondContact CG1-O 3.3Å; I830-S875 PolarHBondContact N-O 2.93Å; I830-S875 PolarHBondContact O-N 3.16Å
876	P	90.4	Very high	89.4	Confident	45 Å²	45	59.5 Å²	59.5	29%	0.292	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	143.7	170.1	-17.9	25.9	0	0	0	111.5	P818 Y821 P878	P818-P876 HydrophobicContact CG-CG 4.07Å; Y821-P876 HydrophobicContact CD2-CB 4.5Å; Y821-P876 HydrophobicContact CD2-CG 3.44Å; Y821-P876 VanDerWaalsContact CD2-CG 3.44Å; Y821-P876 HydrophobicContact CE2-CB 4.2Å; Y821-P876 HydrophobicContact CE2-CG 3.6Å; Y821-P876 HydrophobicContact CG-CG 4Å; P876-P878 WeakPolarHBondContact O-CD 3.44Å
877	L	90.2	Very high	89.5	Confident	8 Å²	8	58.5 Å²	58.5	4%	0.042	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-73.5	119	167.6	-176.2	67.3	0	0	0	107.6	L809 L828 I830 R841 L882 M883	L809-L877 HydrophobicContact CD2-CD1 4.39Å; L828-L877 HydrophobicContact CB-CB 4.43Å; L828-L877 HydrophobicContact CB-CD2 4.36Å; I830-L877 HydrophobicContact CG2-CB 4.34Å; I830-L877 HydrophobicContact CG2-CD1 3.4Å; I830-L877 VanDerWaalsContact CG2-CD1 3.4Å; I830-L877 HydrophobicContact CG2-CG 4.45Å; R841-L877 HydrophobicContact CG-CD1 4.31Å; L877-L882 HydrophobicContact CD1-CB 4.18Å; L877-M883 HydrophobicContact CB-CG 4.48Å; L877-M883 HydrophobicContact CB-SD 4.14Å; L877-M883 HydrophobicContact CD2-CB 4.41Å; L877-M883 HydrophobicContact CD2-CG 3.68Å; L877-M883 HydrophobicContact CD2-SD 3.77Å; L877-M883 HydrophobicContact CG-CG 3.76Å; L877-M883 HydrophobicContact CG-SD 4Å
878	P	81.7	Confident	89.7	Confident	39 Å²	39	57.2 Å²	57.2	25%	0.253	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-68.4	151.1	-175.7	-12.7	23.4	0	0	0	111.2	F814 P876 G880 M883	F814-P878 HydrophobicContact CE1-CG 4.37Å; F814-P878 HydrophobicContact CE2-CG 3.45Å; F814-P878 VanDerWaalsContact CE2-CG 3.45Å; F814-P878 HydrophobicContact CZ-CG 3.16Å; P876-P878 WeakPolarHBondContact O-CD 3.44Å; P878-G880 PolarHBondContact O-N 2.89Å; P878-M883 WeakPolarHBondContact O-CG 3.48Å
879	P	82.1	Confident	90	Very high	121 Å²	121	53.8 Å²	53.8	79%	0.786	32%	0.32	S	S	*	.	S	Bend	trans	-54.7	129.2	168.2	-19.5	31.2	0	0	0	110.5
880	G	84.6	Confident	90.3	Very high	37 Å²	37	54.4 Å²	54.4	38%	0.381	32%	0.322	S	S	.	.	S	Bend	trans	158.8	-169.6	-179.6	0	0	0	0	0	112.7	P878 L882 M883	P878-G880 PolarHBondContact O-N 2.89Å; G880-L882 PolarHBondContact O-N 3.34Å; G880-M883 WeakPolarHBondContact O-CB 3.19Å; G880-M883 PolarHBondContact O-N 3.41Å
881	S	86	Confident	90.6	Very high	80 Å²	80	55.1 Å²	55.1	56%	0.559	33%	0.326	S	S	*	.	H	α-helix	trans	-57.4	-34.9	-176.7	-51.9	0	0	0	0	113	M883 Q884 L885	S881-M883 VanDerWaalsContact C-N 3.31Å; S881-M883 PolarHBondContact O-N 2.88Å; S881-Q884 PolarHBondContact O-N 3.09Å; S881-Q884 VanDerWaalsContact O-N 3.16Å; S881-L885 PolarHBondContact O-N 3.08Å
882	L	90.3	Very high	91.1	Very high	16 Å²	16	50.8 Å²	50.8	8%	0.084	30%	0.296	C	S	.	.	H	α-helix	trans	-65.4	-29	177.8	-68.9	176.8	0	0	0	113.8	I805 M808 L809 R841 L877 G880 L885	I805-L882 HydrophobicContact CB-CD2 4.4Å; I805-L882 HydrophobicContact CG1-CD2 4.1Å; I805-L882 HydrophobicContact CG2-CD2 4.35Å; M808-L882 HydrophobicContact CB-CD1 4.06Å; M808-L882 HydrophobicContact CB-CD2 4.08Å; M808-L882 HydrophobicContact CB-CG 4.41Å; M808-L882 HydrophobicContact CE-CD1 4.34Å; M808-L882 HydrophobicContact CE-CD2 4.13Å; M808-L882 HydrophobicContact CE-CG 3.86Å; M808-L882 HydrophobicContact SD-CD2 3.79Å; M808-L882 HydrophobicContact SD-CG 4.21Å; L809-L882 HydrophobicContact CD2-CD1 3.63Å; L809-L882 HydrophobicContact CG-CD1 3.98Å; R841-L882 WeakPolarHBondContact CD-O 3.41Å; R841-L882 PolarHBondContact NH1-O 3Å; L877-L882 HydrophobicContact CD1-CB 4.18Å; G880-L882 PolarHBondContact O-N 3.34Å; L882-L885 HydrophobicContact CD2-CD1 4.37Å
883	M	89.6	Confident	91.5	Very high	80 Å²	80	47.7 Å²	47.7	39%	0.394	27%	0.274	S	S	.	.	H	α-helix	trans	-73.3	-29	174.3	-78.5	-99.9	-84.8	0	0	112.4	L828 L877 P878 G880 S881	L828-M883 HydrophobicContact CB-SD 4.37Å; L828-M883 HydrophobicContact CD1-SD 4.09Å; L877-M883 HydrophobicContact CB-CG 4.48Å; L877-M883 HydrophobicContact CB-SD 4.14Å; L877-M883 HydrophobicContact CD2-CB 4.41Å; L877-M883 HydrophobicContact CD2-CG 3.68Å; L877-M883 HydrophobicContact CD2-SD 3.77Å; L877-M883 HydrophobicContact CG-CG 3.76Å; L877-M883 HydrophobicContact CG-SD 4Å; P878-M883 WeakPolarHBondContact O-CG 3.48Å; G880-M883 WeakPolarHBondContact O-CB 3.19Å; G880-M883 PolarHBondContact O-N 3.41Å; S881-M883 VanDerWaalsContact C-N 3.31Å; S881-M883 PolarHBondContact O-N 2.88Å
884	Q	89.5	Confident	91.7	Very high	163 Å²	163	46.1 Å²	46.1	76%	0.762	27%	0.268	S	S	*	.	H	α-helix	trans	-84	-22.9	-175	-65.5	177.1	-4.6	0	0	113	S881	S881-Q884 PolarHBondContact O-N 3.09Å; S881-Q884 VanDerWaalsContact O-N 3.16Å
885	L	92.9	Very high	91.6	Very high	59 Å²	59	46 Å²	46	31%	0.309	27%	0.267	S	S	.	.	S	Bend	trans	-65.8	133.6	175.9	-67.8	172.8	0	0	0	110.1	T801 I805 R841 S881 L882	T801-L885 HydrophobicContact CG2-CD1 4.31Å; T801-L885 HydrophobicContact CG2-CD2 4.32Å; I805-L885 HydrophobicContact CD1-CD1 3.97Å; I805-L885 HydrophobicContact CG1-CD1 3.66Å; R841-L885 PolarHBondContact NH1-O 2.93Å; S881-L885 PolarHBondContact O-N 3.08Å; L882-L885 HydrophobicContact CD2-CD1 4.37Å
886	P	93.6	Very high	91.5	Very high	84 Å²	84	45.9 Å²	45.9	55%	0.545	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-64.1	159.3	174.9	27.8	-34.1	0	0	0	110.8	R841 Q888	R841-P886 PolarHBondContact NH2-O 2.82Å; P886-Q888 PolarHBondContact O-N 3.45Å; P886-Q888 PolarHBondContact O-NE2 3.09Å
887	P	95.8	Very high	91.6	Very high	62 Å²	62	43.7 Å²	43.7	40%	0.403	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-48.5	129	165	-27.9	37.1	0	0	0	110.5	I857 V889	I857-P887 HydrophobicContact CB-CB 4.28Å; I857-P887 HydrophobicContact CB-CG 4.48Å; I857-P887 VanDerWaalsContact O-CB 3.29Å; I857-P887 WeakPolarHBondContact O-CB 3.43Å; P887-V889 VanDerWaalsContact C-N 3.25Å
888	Q	95.5	Very high	91.8	Very high	14 Å²	14	44.9 Å²	44.9	7%	0.065	26%	0.258	C	S	.	.	S	Bend	trans	-81.9	-7.8	-179.4	-61	-56.9	-76.8	0	0	113	T801 L802 I805 D858 P886	T801-Q888 VanDerWaalsContact CG2-OE1 3.28Å; L802-Q888 HydrophobicContact CD2-CB 3.53Å; L802-Q888 HydrophobicContact CD2-CG 3.79Å; L802-Q888 HydrophobicContact CG-CB 3.97Å; L802-Q888 HydrophobicContact CG-CG 4.12Å; I805-Q888 HydrophobicContact CD1-CG 3.59Å; D858-Q888 HydrophobicContact CB-CB 4.1Å; D858-Q888 HydrophobicContact CB-CG 4.47Å; D858-Q888 WeakPolarHBondContact OD1-CB 3.35Å; D858-Q888 VanDerWaalsContact OD1-CG 3.31Å; D858-Q888 WeakPolarHBondContact OD1-CG 3.48Å; D858-Q888 PolarHBondContact OD1-N 3.16Å; P886-Q888 PolarHBondContact O-N 3.45Å; P886-Q888 PolarHBondContact O-NE2 3.09Å
889	V	96.9	Very high	92.4	Very high	19 Å²	19	43.2 Å²	43.2	12%	0.115	25%	0.247	C	C	.	.			trans	-102.3	141.5	172.7	84.8	0	0	0	0	110.8	F792 Q794 I857 P887	F792-V889 HydrophobicContact CB-CG2 3.56Å; F792-V889 HydrophobicContact CD1-CG1 4.1Å; F792-V889 HydrophobicContact CD1-CG2 4.07Å; F792-V889 HydrophobicContact CG-CG2 4.17Å; Q794-V889 HydrophobicContact CG-CG2 4.41Å; I857-V889 VanDerWaalsContact O-CG1 3.26Å; I857-V889 WeakPolarHBondContact O-CG1 3.47Å; P887-V889 VanDerWaalsContact C-N 3.25Å
890	K	96.1	Very high	92.9	Very high	81 Å²	81	37.5 Å²	37.5	35%	0.352	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	137.5	170.6	-174.3	162.2	169.7	-174.6	0	109.7	A793 Y892 E929	A793-K890 PolarHBondContact N-O 3Å; A793-K890 PolarHBondContact O-N 3.14Å; K890-Y892 HydrophobicContact CB-CD2 4.39Å; K890-Y892 HydrophobicContact CB-CE2 3.63Å; K890-Y892 HydrophobicContact CD-CE1 4.19Å; K890-Y892 HydrophobicContact CD-CE2 4.26Å; K890-Y892 WeakPolarHBondContact CD-OH 3.22Å; K890-Y892 HydrophobicContact CG-CD2 4.39Å; K890-Y892 HydrophobicContact CG-CE1 4.23Å; K890-Y892 HydrophobicContact CG-CE2 3.73Å; K890-Y892 WeakPolarHBondContact O-CD2 3.32Å; K890-E929 IonicContact NZ-OE1 2.86Å
891	E	96.6	Very high	93	Very high	50 Å²	50	39.2 Å²	39.2	23%	0.234	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	135.4	174.8	-167.2	-178	-172	0	0	109.7	S781 R790 F791 F792 V941	S781-E891 VanDerWaalsContact CB-OE1 3.3Å; S781-E891 WeakPolarHBondContact CB-OE1 3.3Å; S781-E891 PolarHBondContact OG-OE1 2.92Å; R790-E891 IonicContact NH1-OE1 3.82Å; F791-E891 WeakPolarHBondContact O-CA 3.46Å; F792-E891 HydrophobicContact CD1-CB 4.04Å; F792-E891 HydrophobicContact CD1-CG 4.33Å; F792-E891 HydrophobicContact CE1-CB 3.81Å; F792-E891 HydrophobicContact CE1-CG 3.98Å; E891-V941 HydrophobicContact CB-CG1 4.13Å; E891-V941 HydrophobicContact CG-CG1 4.01Å
892	Y	97.1	Very high	93.1	Very high	5 Å²	5	39 Å²	39	2%	0.02	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	168.2	179	-66.1	-78.2	0	0	0	110.3	R790 F791 A793 H795 K890 L924 V926 P942 V944	R790-Y892 CarbonylContact C-O 3.51Å; R790-Y892 VanDerWaalsContact CA-O 3.22Å; R790-Y892 WeakPolarHBondContact CA-O 3.5Å; F791-Y892 HydrophobicContact CE2-CD2 4.48Å; F791-Y892 PolarHBondContact N-O 2.97Å; F791-Y892 PolarHBondContact O-N 2.91Å; A793-Y892 HydrophobicContact CB-CD2 3.88Å; A793-Y892 HydrophobicContact CB-CE2 4.02Å; H795-Y892 PolarHBondContact CE1-OH 2.94Å; H795-Y892 AromaticContact NE2-CZ 3.97Å; H795-Y892 PolarHBondContact NE2-OH 3.28Å; K890-Y892 HydrophobicContact CB-CD2 4.39Å; K890-Y892 HydrophobicContact CB-CE2 3.63Å; K890-Y892 HydrophobicContact CD-CE1 4.19Å; K890-Y892 HydrophobicContact CD-CE2 4.26Å; K890-Y892 WeakPolarHBondContact CD-OH 3.22Å; K890-Y892 HydrophobicContact CG-CD2 4.39Å; K890-Y892 HydrophobicContact CG-CE1 4.23Å; K890-Y892 HydrophobicContact CG-CE2 3.73Å; K890-Y892 WeakPolarHBondContact O-CD2 3.32Å; Y892-L924 HydrophobicContact CD2-CD2 4.27Å; Y892-L924 HydrophobicContact CE1-CD1 4.48Å; Y892-L924 HydrophobicContact CE2-CD2 3.85Å; Y892-V926 HydrophobicContact CE1-CG2 4.33Å; Y892-P942 HydrophobicContact CD1-CB 3.86Å; Y892-P942 HydrophobicContact CD1-CG 4.1Å; Y892-P942 HydrophobicContact CE1-CB 4.02Å; Y892-P942 HydrophobicContact CE1-CG 4.05Å; Y892-V944 HydrophobicContact CD1-CG1 3.34Å; Y892-V944 HydrophobicContact CE1-CG1 3.88Å; Y892-V944 HydrophobicContact CG-CG1 4.02Å
893	R	95.9	Very high	93.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	154.5	164.9	70.2	174.2	-172.9	91.6	-17	111.1	L789 R790 A895 V931 P932 V941 P942 A943 V944 E980	L789-R893 VanDerWaalsContact O-CA 3.29Å; L789-R893 WeakPolarHBondContact O-CA 3.41Å; R790-R893 HydrophobicContact CG-CB 4.08Å; R893-A895 PolarHBondContact O-N 3.29Å; R893-V931 PolarHBondContact NE-O 3.18Å; R893-V931 PolarHBondContact NH2-O 3.11Å; R893-P932 PolarHBondContact NH2-O 2.84Å; R893-V941 HydrophobicContact CB-CG2 4Å; R893-V941 HydrophobicContact CG-CG2 4.13Å; R893-P942 PolarHBondContact N-O 3.03Å; R893-A943 HydrophobicContact CG-CB 3.96Å; R893-A943 WeakPolarHBondContact O-CA 3.16Å; R893-V944 WeakPolarHBondContact O-CG2 3.22Å; R893-V944 PolarHBondContact O-N 2.84Å; R893-E980 IonicContact CZ-OE1 2.74Å; R893-E980 IonicContact NH1-OE1 3.48Å; R893-E980 PolarHBondContact NH1-OE1 3.18Å; R893-E980 IonicContact NH1-OE2 3.87Å; R893-E980 IonicContact NH2-OE1 3.68Å; R893-E980 PolarHBondContact NH2-OE1 2.76Å; R893-E980 IonicContact NH2-OE2 2.81Å
894	L	95.9	Very high	93.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132.3	166.9	-66.3	-178	0	0	0	110.1	L789 F791 V897 F913 L946 L971	L789-L894 HydrophobicContact CB-CD1 4.35Å; L789-L894 HydrophobicContact CD1-CD1 4.13Å; L789-L894 HydrophobicContact CD2-CD1 4.37Å; L789-L894 PolarHBondContact O-N 2.67Å; L789-L894 VanDerWaalsContact O-N 3.1Å; F791-L894 HydrophobicContact CE1-CD2 3.67Å; F791-L894 HydrophobicContact CE1-CG 3.86Å; F791-L894 HydrophobicContact CZ-CD2 4.17Å; L894-V897 HydrophobicContact CB-CB 3.74Å; L894-V897 HydrophobicContact CB-CG1 4.25Å; L894-V897 HydrophobicContact CB-CG2 4Å; L894-V897 HydrophobicContact CD1-CG1 4.29Å; L894-V897 HydrophobicContact CD1-CG2 4.45Å; L894-F913 HydrophobicContact CD1-CD2 4.17Å; L894-F913 HydrophobicContact CD1-CE2 4.15Å; L894-F913 HydrophobicContact CD2-CE2 4.35Å; L894-F913 HydrophobicContact CG-CE2 4.45Å; L894-L946 HydrophobicContact CD2-CB 4.03Å; L894-L971 HydrophobicContact CD1-CD1 3.85Å
895	A	90.9	Very high	93.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	138.6	176.2	0	0	0	0	0	110.2	R893 V897 V927 A943 V944 Y998	R893-A895 PolarHBondContact O-N 3.29Å; A895-V897 PolarHBondContact O-N 3.29Å; A895-V897 VanDerWaalsContact O-N 3.08Å; A895-V927 HydrophobicContact CB-CB 4.19Å; A895-V927 HydrophobicContact CB-CG2 4Å; A895-A943 HydrophobicContact CB-CB 4.07Å; A895-V944 WeakPolarHBondContact CB-O 3.49Å; A895-V944 PolarHBondContact N-O 2.6Å; A895-Y998 WeakPolarHBondContact O-CE2 3.34Å
896	F	89.4	Confident	93.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	62.6	6.5	179.4	-48.2	-68.5	0	0	0	115.8	V927 Y928 V979 E980 I982 L986 L990 L994 L995 Y998	F896-V927 HydrophobicContact CE2-CG1 4.43Å; F896-Y928 HydrophobicContact CE1-CE2 4.09Å; F896-Y928 HydrophobicContact CE2-CE2 4.35Å; F896-Y928 AromaticContact CZ-CE2 3.71Å; F896-Y928 HydrophobicContact CZ-CE2 3.71Å; F896-Y928 WeakPolarHBondContact CZ-OH 3.4Å; F896-V979 CarbonylContact O-C 3.5Å; F896-V979 WeakPolarHBondContact O-CA 3.4Å; F896-E980 WeakPolarHBondContact CA-OE1 3.43Å; F896-E980 PolarHBondContact N-OE1 3.06Å; F896-E980 PolarHBondContact O-N 2.96Å; F896-I982 HydrophobicContact CB-CD1 4.45Å; F896-I982 HydrophobicContact CD1-CD1 3.62Å; F896-I982 HydrophobicContact CE1-CD1 4.29Å; F896-I982 HydrophobicContact CG-CD1 4.39Å; F896-L986 HydrophobicContact CD1-CD1 4.12Å; F896-L986 HydrophobicContact CE1-CB 4.08Å; F896-L986 HydrophobicContact CE1-CD1 4.1Å; F896-L986 HydrophobicContact CE1-CG 4.47Å; F896-L990 HydrophobicContact CZ-CD2 4.21Å; F896-L994 HydrophobicContact CE2-CD2 4.22Å; F896-L995 HydrophobicContact CD1-CD1 4.19Å; F896-L995 HydrophobicContact CG-CD1 4.29Å; F896-Y998 HydrophobicContact CB-CD2 3.91Å; F896-Y998 HydrophobicContact CB-CE2 4.34Å; F896-Y998 HydrophobicContact CD2-CD2 4.05Å; F896-Y998 HydrophobicContact CD2-CE2 4.03Å; F896-Y998 HydrophobicContact CG-CD2 4.44Å
897	V	93.7	Very high	93.2	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.3	-174.8	169.9	0	0	0	0	110.8	L789 L894 A895 C933 L972 V977	L789-V897 HydrophobicContact CB-CG1 4.38Å; L894-V897 HydrophobicContact CB-CB 3.74Å; L894-V897 HydrophobicContact CB-CG1 4.25Å; L894-V897 HydrophobicContact CB-CG2 4Å; L894-V897 HydrophobicContact CD1-CG1 4.29Å; L894-V897 HydrophobicContact CD1-CG2 4.45Å; A895-V897 PolarHBondContact O-N 3.29Å; A895-V897 VanDerWaalsContact O-N 3.08Å; V897-C933 PolarHBondContact O-SG 3.47Å; V897-L972 HydrophobicContact CG2-CD1 4.39Å; V897-V977 HydrophobicContact CG1-CB 3.77Å; V897-V977 HydrophobicContact CG1-CG1 4.04Å; V897-V977 HydrophobicContact CG1-CG2 3.61Å; V897-V977 HydrophobicContact CG2-CG2 4.47Å
898	Q	93.7	Very high	93.1	Very high	33 Å²	33	41.3 Å²	41.3	15%	0.154	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	136.5	173.2	-172.6	177.5	2.3	0	0	110.7	Q787 V977 C978 E980	Q787-Q898 HydrophobicContact CB-CG 4.24Å; Q787-Q898 WeakPolarHBondContact O-CG 3.33Å; Q787-Q898 VanDerWaalsContact OE1-NE2 3.16Å; Q898-V977 WeakPolarHBondContact O-CB 3.37Å; Q898-C978 PolarHBondContact N-O 2.87Å; Q898-C978 PolarHBondContact O-N 3.33Å; Q898-C978 VanDerWaalsContact O-N 3.08Å; Q898-E980 HydrophobicContact CB-CB 3.91Å
899	L	94.9	Very high	93.2	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	21%	0.214	C	C	.	.			trans	-72.5	147.9	173.2	-74	168.7	0	0	0	110.8	Q787 G788 L789 R906 A909 E910 V977	Q787-L899 PolarHBondContact O-N 2.87Å; G788-L899 WeakPolarHBondContact O-CD1 3.3Å; L789-L899 HydrophobicContact CB-CD1 4.36Å; L789-L899 HydrophobicContact CB-CD2 4.15Å; L789-L899 HydrophobicContact CB-CG 4.06Å; L789-L899 HydrophobicContact CD1-CD2 4.07Å; L789-L899 HydrophobicContact CG-CD2 4.11Å; L789-L899 HydrophobicContact CG-CG 4.48Å; L899-R906 HydrophobicContact CB-CG 4.38Å; L899-R906 HydrophobicContact CD1-CG 4.2Å; L899-R906 HydrophobicContact CD2-CG 4.44Å; L899-A909 HydrophobicContact CD2-CB 3.98Å; L899-E910 HydrophobicContact CD1-CG 4.45Å; L899-E910 HydrophobicContact CD2-CG 4.23Å; L899-V977 HydrophobicContact CD2-CG1 4.25Å
900	P	92	Very high	93.1	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.013	21%	0.21	C	C	.	.			trans	-64.9	149.5	173.3	29.1	-35.3	0	0	0	111.1	D905 R906 I1012 F1018	P900-D905 HydrophobicContact CB-CB 4.09Å; P900-D905 HydrophobicContact CG-CB 3.8Å; P900-R906 HydrophobicContact CG-CB 4.37Å; P900-I1012 HydrophobicContact CB-CG2 4.01Å; P900-I1012 HydrophobicContact CG-CG2 4.09Å; P900-F1018 HydrophobicContact CB-CZ 4.45Å
901	P	86.4	Confident	93	Very high	73 Å²	73	44.4 Å²	44.4	47%	0.474	22%	0.224	S	C	.	.	S	Bend	trans	-74.5	-26.7	-178.8	29.6	-35.2	0	0	0	112.9	F1018 V1022	P901-F1018 HydrophobicContact CG-CD2 4.03Å; P901-F1018 HydrophobicContact CG-CE2 3.9Å; P901-V1022 HydrophobicContact CG-CG2 4.19Å
902	D	88.8	Confident	93	Very high	76 Å²	76	42.8 Å²	42.8	41%	0.406	22%	0.22	S	C	.	.	S	Bend	trans	-66.7	132.4	175.6	178.4	74.8	0	0	0	110.6	S904 D905 R906	D902-S904 VanDerWaalsContact C-N 3.32Å; D902-S904 PolarHBondContact O-N 3.3Å; D902-S904 WeakPolarHBondContact OD2-CA 3.48Å; D902-S904 VanDerWaalsContact OD2-CB 3.24Å; D902-S904 WeakPolarHBondContact OD2-CB 3.36Å; D902-S904 PolarHBondContact OD2-N 3.24Å; D902-D905 HydrophobicContact CB-CB 4.16Å; D902-D905 PolarHBondContact OD2-N 2.78Å; D902-R906 WeakPolarHBondContact O-CB 3.49Å; D902-R906 PolarHBondContact O-N 2.83Å
903	T	88.9	Confident	93	Very high	106 Å²	106	42.6 Å²	42.6	65%	0.65	22%	0.219	S	C	*	.	H	α-helix	trans	-66.3	-34.9	-174.7	-57.1	0	0	0	0	112.2	M907	T903-M907 WeakPolarHBondContact O-CB 3.42Å; T903-M907 WeakPolarHBondContact O-CG 3.5Å; T903-M907 PolarHBondContact O-N 3.06Å
904	S	89.6	Confident	93	Very high	87 Å²	87	44.3 Å²	44.3	61%	0.608	23%	0.231	S	C	*	.	H	α-helix	trans	-74.1	-46.4	-178.9	-49.3	0	0	0	0	110.8	D902 R906 M907 F908	D902-S904 VanDerWaalsContact C-N 3.32Å; D902-S904 PolarHBondContact O-N 3.3Å; D902-S904 WeakPolarHBondContact OD2-CA 3.48Å; D902-S904 VanDerWaalsContact OD2-CB 3.24Å; D902-S904 WeakPolarHBondContact OD2-CB 3.36Å; D902-S904 PolarHBondContact OD2-N 3.24Å; S904-R906 VanDerWaalsContact C-N 3.29Å; S904-R906 PolarHBondContact O-N 3.44Å; S904-M907 PolarHBondContact O-N 3.15Å; S904-F908 PolarHBondContact O-N 2.71Å
905	D	93	Very high	92.8	Very high	32 Å²	32	49 Å²	49	17%	0.171	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-37.4	175.7	-69.5	-36.8	0	0	0	110.8	P900 D902 F908 A909 I1012 R1014	P900-D905 HydrophobicContact CB-CB 4.09Å; P900-D905 HydrophobicContact CG-CB 3.8Å; D902-D905 HydrophobicContact CB-CB 4.16Å; D902-D905 PolarHBondContact OD2-N 2.78Å; D905-F908 PolarHBondContact O-N 2.88Å; D905-A909 WeakPolarHBondContact O-CB 3.45Å; D905-A909 PolarHBondContact O-N 2.72Å; D905-I1012 HydrophobicContact CB-CG2 4Å; D905-R1014 IonicContact OD1-CZ 3.79Å; D905-R1014 IonicContact OD1-NH1 3.83Å; D905-R1014 PolarHBondContact OD1-NH1 3.46Å; D905-R1014 IonicContact OD1-NH2 3.73Å; D905-R1014 PolarHBondContact OD1-NH2 3.13Å; D905-R1014 IonicContact OD2-NH1 3.86Å; D905-R1014 IonicContact OD2-NH2 3.18Å
906	R	94.6	Very high	93	Very high	59 Å²	59	50.9 Å²	50.9	22%	0.223	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-48.3	174.2	-179.2	-179.4	-171	140.4	14.4	112	S786 L899 P900 D902 S904 F908 A909 E910	S786-R906 PolarHBondContact O-NH1 3.48Å; S786-R906 VanDerWaalsContact O-NH1 3.08Å; S786-R906 PolarHBondContact O-NH2 3.38Å; L899-R906 HydrophobicContact CB-CG 4.38Å; L899-R906 HydrophobicContact CD1-CG 4.2Å; L899-R906 HydrophobicContact CD2-CG 4.44Å; P900-R906 HydrophobicContact CG-CB 4.37Å; D902-R906 WeakPolarHBondContact O-CB 3.49Å; D902-R906 PolarHBondContact O-N 2.83Å; S904-R906 VanDerWaalsContact C-N 3.29Å; S904-R906 PolarHBondContact O-N 3.44Å; R906-F908 PolarHBondContact O-N 3.45Å; R906-A909 PolarHBondContact O-N 3.2Å; R906-E910 HydrophobicContact CG-CG 4.48Å; R906-E910 IonicContact NE-OE1 3.77Å; R906-E910 PolarHBondContact NE-OE1 3.3Å; R906-E910 VanDerWaalsContact NE-OE1 3.15Å; R906-E910 WeakPolarHBondContact O-CB 3.3Å; R906-E910 WeakPolarHBondContact O-CG 3.46Å; R906-E910 PolarHBondContact O-N 2.91Å
907	M	92.2	Very high	93.2	Very high	117 Å²	117	51.1 Å²	51.1	58%	0.576	27%	0.267	S	S	*	.	H	α-helix	trans	-59.8	-36.6	176.7	-73.5	-73.9	-72.3	0	0	111.5	T903 S904 R911	T903-M907 WeakPolarHBondContact O-CB 3.42Å; T903-M907 WeakPolarHBondContact O-CG 3.5Å; T903-M907 PolarHBondContact O-N 3.06Å; S904-M907 PolarHBondContact O-N 3.15Å; M907-R911 WeakPolarHBondContact O-CB 3.45Å; M907-R911 PolarHBondContact O-N 2.88Å
908	F	93.4	Very high	92.9	Very high	111 Å²	111	56.5 Å²	56.5	49%	0.487	29%	0.292	S	S	.	.	H	α-helix	trans	-69.3	-42.8	176.5	-163.6	-108.6	0	0	0	112.3	S904 D905 R906 R911 A912 L976	S904-F908 PolarHBondContact O-N 2.71Å; D905-F908 PolarHBondContact O-N 2.88Å; R906-F908 PolarHBondContact O-N 3.45Å; F908-R911 PolarHBondContact O-N 2.97Å; F908-A912 WeakPolarHBondContact O-CB 3.48Å; F908-A912 PolarHBondContact O-N 2.98Å; F908-L976 HydrophobicContact CD1-CD2 3.35Å; F908-L976 HydrophobicContact CE1-CD2 3.48Å; F908-L976 VanDerWaalsContact CE1-CD2 3.48Å
909	A	96.4	Very high	92.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-44.3	175.4	0	0	0	0	0	112.5	L899 D905 R906 A912 F913 L976 V977	L899-A909 HydrophobicContact CD2-CB 3.98Å; D905-A909 WeakPolarHBondContact O-CB 3.45Å; D905-A909 PolarHBondContact O-N 2.72Å; R906-A909 PolarHBondContact O-N 3.2Å; A909-A912 PolarHBondContact O-N 3.48Å; A909-F913 PolarHBondContact O-N 3.01Å; A909-L976 HydrophobicContact CB-CB 4.27Å; A909-L976 VanDerWaalsContact CB-O 3.22Å; A909-L976 WeakPolarHBondContact CB-O 3.25Å; A909-V977 HydrophobicContact CB-CG1 3.99Å
910	E	96.4	Very high	92.3	Very high	7 Å²	7	64.7 Å²	64.7	3%	0.033	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-42.5	175.5	-75.1	179.1	-171.1	0	0	111.5	I780 R782 L899 R906 F913 C914	I780-E910 HydrophobicContact CD1-CB 3.6Å; I780-E910 HydrophobicContact CD1-CG 4.06Å; I780-E910 WeakPolarHBondContact CD1-O 3.2Å; I780-E910 HydrophobicContact CG2-CG 4.41Å; R782-E910 IonicContact CZ-OE2 3.78Å; R782-E910 IonicContact NE-OE2 2.96Å; R782-E910 PolarHBondContact NE-OE2 2.65Å; R782-E910 IonicContact NH2-OE2 3.16Å; R782-E910 PolarHBondContact NH2-OE2 3.28Å; L899-E910 HydrophobicContact CD1-CG 4.45Å; L899-E910 HydrophobicContact CD2-CG 4.23Å; R906-E910 HydrophobicContact CG-CG 4.48Å; R906-E910 IonicContact NE-OE1 3.77Å; R906-E910 PolarHBondContact NE-OE1 3.3Å; R906-E910 VanDerWaalsContact NE-OE1 3.15Å; R906-E910 WeakPolarHBondContact O-CB 3.3Å; R906-E910 WeakPolarHBondContact O-CG 3.46Å; R906-E910 PolarHBondContact O-N 2.91Å; E910-F913 PolarHBondContact O-N 3.11Å; E910-C914 PolarHBondContact O-N 2.83Å
911	R	94.2	Very high	92.2	Very high	171 Å²	171	71 Å²	71	65%	0.645	36%	0.363	S	S	*	.	H	α-helix	trans	-61.9	-46	175.4	-174.9	176	-173.9	119.7	4.5	112	M907 F908 F913 C914 D915	M907-R911 WeakPolarHBondContact O-CB 3.45Å; M907-R911 PolarHBondContact O-N 2.88Å; F908-R911 PolarHBondContact O-N 2.97Å; R911-F913 VanDerWaalsContact C-N 3.3Å; R911-F913 PolarHBondContact O-N 2.83Å; R911-C914 WeakPolarHBondContact O-CB 3.33Å; R911-C914 PolarHBondContact O-N 3.17Å; R911-C914 VanDerWaalsContact O-N 3.11Å; R911-D915 VanDerWaalsContact O-CG 3.31Å; R911-D915 PolarHBondContact O-N 2.86Å
912	A	95.7	Very high	92.6	Very high	17 Å²	17	67.6 Å²	67.6	14%	0.14	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-36	178.3	0	0	0	0	0	112.5	F908 A909 D915 L916 L971 L976	F908-A912 WeakPolarHBondContact O-CB 3.48Å; F908-A912 PolarHBondContact O-N 2.98Å; A909-A912 PolarHBondContact O-N 3.48Å; A912-D915 PolarHBondContact O-N 3.43Å; A912-L916 WeakPolarHBondContact O-CG 3.18Å; A912-L916 PolarHBondContact O-N 3.4Å; A912-L916 VanDerWaalsContact O-N 3.15Å; A912-L971 HydrophobicContact CB-CD2 4.14Å; A912-L976 HydrophobicContact CB-CD1 3.45Å; A912-L976 VanDerWaalsContact CB-CD1 3.45Å; A912-L976 HydrophobicContact CB-CD2 4.37Å; A912-L976 HydrophobicContact CB-CG 4.48Å
913	F	97.9	Very high	92.8	Very high	0 Å²	0	67 Å²	67	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.5	-47.1	170.3	173	-97.5	0	0	0	111.5	I777 I780 L789 F791 L894 A909 E910 R911 D915 L916 V917 L946 I967 L971	I777-F913 HydrophobicContact CG2-CE1 4.16Å; I777-F913 HydrophobicContact CG2-CZ 4.34Å; I780-F913 HydrophobicContact CD1-CD1 3.92Å; I780-F913 HydrophobicContact CG1-CD1 3.9Å; I780-F913 HydrophobicContact CG1-CE1 4.16Å; L789-F913 HydrophobicContact CD1-CB 3.8Å; L789-F913 HydrophobicContact CD1-CD2 4.11Å; L789-F913 HydrophobicContact CD1-CG 3.93Å; L789-F913 HydrophobicContact CD2-CB 4.46Å; L789-F913 HydrophobicContact CD2-CD1 3.79Å; L789-F913 HydrophobicContact CD2-CD2 3.93Å; L789-F913 HydrophobicContact CD2-CE1 3.9Å; L789-F913 HydrophobicContact CD2-CE2 4.04Å; L789-F913 HydrophobicContact CD2-CG 3.79Å; L789-F913 HydrophobicContact CD2-CZ 4.02Å; F791-F913 HydrophobicContact CB-CE1 3.89Å; F791-F913 HydrophobicContact CB-CZ 4.03Å; F791-F913 HydrophobicContact CD1-CE1 4.24Å; F791-F913 HydrophobicContact CD1-CE2 4.29Å; F791-F913 AromaticContact CD1-CZ 3.62Å; F791-F913 HydrophobicContact CD1-CZ 3.62Å; F791-F913 HydrophobicContact CD2-CZ 4.34Å; F791-F913 HydrophobicContact CE1-CE2 4.46Å; F791-F913 HydrophobicContact CE1-CZ 4.11Å; F791-F913 HydrophobicContact CG-CE1 4.12Å; F791-F913 AromaticContact CG-CZ 3.73Å; F791-F913 HydrophobicContact CG-CZ 3.73Å; L894-F913 HydrophobicContact CD1-CD2 4.17Å; L894-F913 HydrophobicContact CD1-CE2 4.15Å; L894-F913 HydrophobicContact CD2-CE2 4.35Å; L894-F913 HydrophobicContact CG-CE2 4.45Å; A909-F913 PolarHBondContact O-N 3.01Å; E910-F913 PolarHBondContact O-N 3.11Å; R911-F913 VanDerWaalsContact C-N 3.3Å; R911-F913 PolarHBondContact O-N 2.83Å; F913-D915 PolarHBondContact O-N 2.79Å; F913-L916 WeakPolarHBondContact O-CB 3.16Å; F913-L916 PolarHBondContact O-N 3.48Å; F913-L916 VanDerWaalsContact O-N 3.16Å; F913-V917 HydrophobicContact CD1-CG2 4.15Å; F913-V917 HydrophobicContact CD2-CG1 4.13Å; F913-V917 HydrophobicContact CE1-CG1 4.49Å; F913-V917 HydrophobicContact CE1-CG2 3.81Å; F913-V917 HydrophobicContact CE2-CG1 3.77Å; F913-V917 HydrophobicContact CZ-CG1 3.98Å; F913-V917 HydrophobicContact CZ-CG2 4.04Å; F913-V917 WeakPolarHBondContact O-CG2 3.18Å; F913-V917 PolarHBondContact O-N 3.27Å; F913-V917 VanDerWaalsContact O-N 3.14Å; F913-L946 HydrophobicContact CE2-CD2 4.03Å; F913-L946 HydrophobicContact CZ-CD2 4.31Å; F913-I967 HydrophobicContact CD2-CG2 3.8Å; F913-I967 HydrophobicContact CE2-CG2 3.94Å; F913-L971 HydrophobicContact CB-CD1 4.18Å; F913-L971 HydrophobicContact CB-CD2 4.48Å; F913-L971 HydrophobicContact CD2-CD1 4.07Å
914	C	94.5	Very high	93.1	Very high	37 Å²	37	62.1 Å²	62.1	25%	0.25	30%	0.303	C	S	.	.	H	α-helix	trans	-55.5	-50	174.9	-75	0	0	0	0	111.7	I780 E910 R911 L916 V917 E918	I780-C914 WeakPolarHBondContact CD1-SG 3.43Å; E910-C914 PolarHBondContact O-N 2.83Å; R911-C914 WeakPolarHBondContact O-CB 3.33Å; R911-C914 PolarHBondContact O-N 3.17Å; R911-C914 VanDerWaalsContact O-N 3.11Å; C914-L916 PolarHBondContact O-N 2.75Å; C914-L916 VanDerWaalsContact O-N 3.14Å; C914-V917 PolarHBondContact O-N 2.93Å; C914-E918 WeakPolarHBondContact O-CB 2.93Å; C914-E918 PolarHBondContact O-N 2.91Å
915	D	92.8	Very high	93.2	Very high	99 Å²	99	58 Å²	58	53%	0.529	27%	0.274	S	S	.	.	H	α-helix	trans	-58.1	-31.9	-179.7	-63.1	-23.4	0	0	0	112.1	R911 A912 F913 K920	R911-D915 VanDerWaalsContact O-CG 3.31Å; R911-D915 PolarHBondContact O-N 2.86Å; A912-D915 PolarHBondContact O-N 3.43Å; F913-D915 PolarHBondContact O-N 2.79Å; D915-K920 PolarHBondContact O-NZ 2.92Å
916	L	94.1	Very high	93.1	Very high	39 Å²	39	58.6 Å²	58.6	20%	0.204	28%	0.279	C	S	.	.	H	α-helix	trans	-75.9	-31.6	177.4	-75	174.1	0	0	0	113.9	A912 F913 C914 K920 I967 L971	A912-L916 WeakPolarHBondContact O-CG 3.18Å; A912-L916 PolarHBondContact O-N 3.4Å; A912-L916 VanDerWaalsContact O-N 3.15Å; F913-L916 WeakPolarHBondContact O-CB 3.16Å; F913-L916 PolarHBondContact O-N 3.48Å; F913-L916 VanDerWaalsContact O-N 3.16Å; C914-L916 PolarHBondContact O-N 2.75Å; C914-L916 VanDerWaalsContact O-N 3.14Å; L916-K920 WeakPolarHBondContact O-CD 3.45Å; L916-K920 PolarHBondContact O-NZ 3.39Å; L916-I967 HydrophobicContact CB-CD1 4.17Å; L916-I967 HydrophobicContact CD1-CG2 4.28Å; L916-L971 HydrophobicContact CD1-CD2 3.92Å; L916-L971 HydrophobicContact CD1-CG 4.18Å
917	V	94.9	Very high	92.8	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.024	27%	0.273	C	S	.	.	H	α-helix	trans	-114.7	-20.1	-169.2	-53.2	0	0	0	0	115	I777 F913 C914 K920 L922 L946 I967	I777-V917 HydrophobicContact CB-CB 4.23Å; I777-V917 HydrophobicContact CB-CG2 3.87Å; I777-V917 HydrophobicContact CG1-CB 4Å; I777-V917 HydrophobicContact CG1-CG1 4.49Å; I777-V917 HydrophobicContact CG1-CG2 4.08Å; I777-V917 HydrophobicContact CG2-CG2 3.88Å; F913-V917 HydrophobicContact CD1-CG2 4.15Å; F913-V917 HydrophobicContact CD2-CG1 4.13Å; F913-V917 HydrophobicContact CE1-CG1 4.49Å; F913-V917 HydrophobicContact CE1-CG2 3.81Å; F913-V917 HydrophobicContact CE2-CG1 3.77Å; F913-V917 HydrophobicContact CZ-CG1 3.98Å; F913-V917 HydrophobicContact CZ-CG2 4.04Å; F913-V917 WeakPolarHBondContact O-CG2 3.18Å; F913-V917 PolarHBondContact O-N 3.27Å; F913-V917 VanDerWaalsContact O-N 3.14Å; C914-V917 PolarHBondContact O-N 2.93Å; V917-K920 PolarHBondContact O-N 3.3Å; V917-L922 HydrophobicContact CB-CD1 3.94Å; V917-L922 HydrophobicContact CB-CD2 4.38Å; V917-L922 HydrophobicContact CG1-CD1 4.4Å; V917-L922 HydrophobicContact CG1-CD2 4Å; V917-L946 HydrophobicContact CG1-CD2 3.76Å; V917-I967 HydrophobicContact CG1-CD1 4.48Å; V917-I967 HydrophobicContact CG1-CG1 4.34Å; V917-I967 HydrophobicContact CG1-CG2 4.17Å
918	E	86.9	Confident	92.5	Very high	113 Å²	113	51.7 Å²	51.7	53%	0.528	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	137.4	-176	-171.2	175.8	-170.1	0	0	111	C914 K920	C914-E918 WeakPolarHBondContact O-CB 2.93Å; C914-E918 PolarHBondContact O-N 2.91Å; E918-K920 WeakPolarHBondContact O-CG 3.17Å; E918-K920 PolarHBondContact O-N 3.23Å; E918-K920 VanDerWaalsContact O-N 3.14Å
919	N	83.9	Confident	92.1	Very high	138 Å²	138	52.2 Å²	52.2	74%	0.738	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	27.5	-179.3	-59.2	-42.7	0	0	0	114.7
920	K	91	Very high	91.4	Very high	71 Å²	71	55.9 Å²	55.9	31%	0.309	28%	0.277	S	S	.	.			trans	-123	145.2	178.9	-68.7	156.2	177.3	169.7	0	111.2	D915 L916 V917 E918 L922 L948	D915-K920 PolarHBondContact O-NZ 2.92Å; L916-K920 WeakPolarHBondContact O-CD 3.45Å; L916-K920 PolarHBondContact O-NZ 3.39Å; V917-K920 PolarHBondContact O-N 3.3Å; E918-K920 WeakPolarHBondContact O-CG 3.17Å; E918-K920 PolarHBondContact O-N 3.23Å; E918-K920 VanDerWaalsContact O-N 3.14Å; K920-L922 HydrophobicContact CB-CD1 4.24Å; K920-L922 WeakPolarHBondContact O-CD1 2.87Å; K920-L948 HydrophobicContact CB-CD1 3.8Å; K920-L948 HydrophobicContact CD-CD1 4Å; K920-L948 HydrophobicContact CD-CD2 3.98Å; K920-L948 HydrophobicContact CG-CD1 4.09Å
921	E	91.1	Very high	90.6	Very high	133 Å²	133	56.6 Å²	56.6	62%	0.621	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	122.7	167	-65.1	-174.6	176.7	0	0	108.9	L796	L796-E921 HydrophobicContact CD2-CG 4.04Å
922	L	95.2	Very high	90.1	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	167.3	-179.5	-61	109.2	0	0	0	110.3	P774 V775 I777 V917 K920 L946 L948 I967	P774-L922 CarbonylContact C-O 3.57Å; P774-L922 WeakPolarHBondContact CA-O 3.14Å; V775-L922 HydrophobicContact CG2-CB 4.3Å; V775-L922 PolarHBondContact N-O 3.15Å; V775-L922 PolarHBondContact O-N 2.81Å; I777-L922 HydrophobicContact CG1-CD1 3.96Å; V917-L922 HydrophobicContact CB-CD1 3.94Å; V917-L922 HydrophobicContact CB-CD2 4.38Å; V917-L922 HydrophobicContact CG1-CD1 4.4Å; V917-L922 HydrophobicContact CG1-CD2 4Å; K920-L922 HydrophobicContact CB-CD1 4.24Å; K920-L922 WeakPolarHBondContact O-CD1 2.87Å; L922-L946 HydrophobicContact CB-CD1 3.91Å; L922-L946 HydrophobicContact CB-CG 4.18Å; L922-L946 HydrophobicContact CD2-CD1 4.44Å; L922-L946 HydrophobicContact CD2-CD2 3.83Å; L922-L946 HydrophobicContact CD2-CG 3.83Å; L922-L948 HydrophobicContact CD2-CB 3.95Å; L922-L948 HydrophobicContact CD2-CD1 4.33Å; L922-L948 HydrophobicContact CG-CD1 4.28Å; L922-I967 HydrophobicContact CD2-CD1 4.07Å; L922-I967 HydrophobicContact CD2-CG1 3.87Å
923	R	92.6	Very high	89.6	Confident	65 Å²	65	49.4 Å²	49.4	25%	0.245	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.6	167.2	-61.2	-179.1	-172.7	150.1	1.3	108.6	W772 K773 V947 P949 S959 D964	W772-R923 HydrophobicContact CE3-CB 3.8Å; W772-R923 HydrophobicContact CZ3-CB 4.43Å; K773-R923 WeakPolarHBondContact O-CA 3.33Å; R923-V947 PolarHBondContact N-O 3.1Å; R923-V947 PolarHBondContact O-N 2.81Å; R923-P949 HydrophobicContact CG-CG 4.38Å; R923-S959 PolarHBondContact NH1-O 3.07Å; R923-D964 IonicContact NH1-OD2 3.65Å
924	L	94.7	Very high	88.7	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	144.2	171.5	83.1	80.7	0	0	0	110.3	W772 K773 V775 A793 Y892 V926 V944 T945 L946	W772-L924 WeakPolarHBondContact CA-O 3.22Å; K773-L924 PolarHBondContact N-O 2.92Å; K773-L924 PolarHBondContact O-N 3.32Å; V775-L924 HydrophobicContact CB-CD2 3.99Å; V775-L924 HydrophobicContact CB-CG 4.5Å; V775-L924 HydrophobicContact CG1-CB 4.45Å; V775-L924 HydrophobicContact CG1-CD2 3.23Å; V775-L924 HydrophobicContact CG1-CG 3.68Å; V775-L924 HydrophobicContact CG2-CB 3.9Å; V775-L924 HydrophobicContact CG2-CD2 3.8Å; V775-L924 HydrophobicContact CG2-CG 4.07Å; A793-L924 HydrophobicContact CB-CD2 4.43Å; Y892-L924 HydrophobicContact CD2-CD2 4.27Å; Y892-L924 HydrophobicContact CE1-CD1 4.48Å; Y892-L924 HydrophobicContact CE2-CD2 3.85Å; L924-V926 HydrophobicContact CD1-CG2 4.14Å; L924-V944 HydrophobicContact CD1-CG1 4.11Å; L924-T945 WeakPolarHBondContact CA-O 3.15Å; L924-L946 HydrophobicContact CB-CD1 3.93Å
925	A	91.6	Very high	87.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.1	165.4	0	0	0	0	0	109.8	L770 W772 V927 V944 T945	L770-A925 HydrophobicContact CB-CB 3.91Å; L770-A925 HydrophobicContact CD2-CB 4Å; L770-A925 HydrophobicContact CG-CB 4.38Å; W772-A925 HydrophobicContact CD2-CB 3.71Å; W772-A925 HydrophobicContact CE3-CB 3.66Å; W772-A925 HydrophobicContact CG-CB 4.33Å; W772-A925 HydrophobicContact CH2-CB 4.07Å; W772-A925 HydrophobicContact CZ2-CB 4.06Å; W772-A925 HydrophobicContact CZ3-CB 3.86Å; A925-V927 PolarHBondContact O-N 3.15Å; A925-V944 CarbonylContact O-C 3.48Å; A925-V944 WeakPolarHBondContact O-CA 3.25Å; A925-V944 WeakPolarHBondContact O-CB 3.21Å; A925-T945 HydrophobicContact CB-CG2 4.02Å; A925-T945 PolarHBondContact N-O 2.89Å; A925-T945 PolarHBondContact O-N 2.8Å
926	V	91.1	Very high	86.9	Confident	46 Å²	46	48.4 Å²	48.4	28%	0.279	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	118.4	176.8	-178.7	0	0	0	0	108.9	Y892 L924 Y928 P942 V944	Y892-V926 HydrophobicContact CE1-CG2 4.33Å; L924-V926 HydrophobicContact CD1-CG2 4.14Å; V926-Y928 WeakPolarHBondContact CG1-O 3.43Å; V926-P942 HydrophobicContact CG1-CB 4.05Å; V926-V944 HydrophobicContact CG2-CG1 4.1Å
927	V	87.8	Confident	86.1	Confident	17 Å²	17	52.7 Å²	52.7	10%	0.103	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-40.3	174.9	-168.2	0	0	0	0	109.4	A895 F896 A925 A943 T945 P991 L994	A895-V927 HydrophobicContact CB-CB 4.19Å; A895-V927 HydrophobicContact CB-CG2 4Å; F896-V927 HydrophobicContact CE2-CG1 4.43Å; A925-V927 PolarHBondContact O-N 3.15Å; V927-A943 PolarHBondContact N-O 2.98Å; V927-T945 HydrophobicContact CG2-CG2 4.08Å; V927-P991 HydrophobicContact CG1-CG 3.99Å; V927-L994 HydrophobicContact CG2-CD2 4.28Å
928	Y	86.7	Confident	85.5	Confident	14 Å²	14	54.7 Å²	54.7	6%	0.055	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	133.9	175.6	-53.3	-89	0	0	0	111.2	F896 V926 V931 P942 A943 L986 R989	F896-Y928 HydrophobicContact CE1-CE2 4.09Å; F896-Y928 HydrophobicContact CE2-CE2 4.35Å; F896-Y928 AromaticContact CZ-CE2 3.71Å; F896-Y928 HydrophobicContact CZ-CE2 3.71Å; F896-Y928 WeakPolarHBondContact CZ-OH 3.4Å; V926-Y928 WeakPolarHBondContact CG1-O 3.43Å; Y928-V931 HydrophobicContact CD1-CG2 4.29Å; Y928-V931 HydrophobicContact CG-CG2 4.12Å; Y928-P942 CarbonylContact O-C 3.6Å; Y928-P942 VanDerWaalsContact O-CA 3.23Å; Y928-P942 WeakPolarHBondContact O-CA 3.08Å; Y928-A943 HydrophobicContact CD2-CB 4.13Å; Y928-A943 PolarHBondContact N-O 3.28Å; Y928-A943 VanDerWaalsContact N-O 3.1Å; Y928-A943 PolarHBondContact O-N 3.12Å; Y928-L986 HydrophobicContact CD1-CD2 3.83Å; Y928-L986 HydrophobicContact CD2-CD2 3.5Å; Y928-L986 HydrophobicContact CE1-CB 4.29Å; Y928-L986 HydrophobicContact CE1-CD2 3.64Å; Y928-L986 HydrophobicContact CE2-CB 4.49Å; Y928-L986 HydrophobicContact CE2-CD2 3.31Å; Y928-L986 HydrophobicContact CE2-CG 4.44Å; Y928-L986 HydrophobicContact CG-CD2 3.78Å; Y928-L986 WeakPolarHBondContact OH-CA 3.26Å; Y928-L986 PolarHBondContact OH-O 3.38Å; Y928-R989 HydrophobicContact CE1-CB 3.99Å
929	E	84.3	Confident	85.5	Confident	122 Å²	122	58 Å²	58	57%	0.57	31%	0.306	S	S	*	.	S	Bend	trans	-73	-30.8	-173.8	-165.7	60.5	-145.3	0	0	113.6	K890 P942	K890-E929 IonicContact NZ-OE1 2.86Å; E929-P942 VanDerWaalsContact O-CA 3.27Å; E929-P942 WeakPolarHBondContact O-CA 3.29Å; E929-P942 WeakPolarHBondContact O-CB 3.16Å; E929-P942 VanDerWaalsContact O-CG 3.24Å; E929-P942 WeakPolarHBondContact O-CG 3.32Å
930	S	81.6	Confident	85.8	Confident	76 Å²	76	53.6 Å²	53.6	53%	0.531	29%	0.285	S	S	.	.	S	Bend	trans	-162.6	88.5	-177.2	-168.3	0	0	0	0	111
931	V	79.1	Confident	85.9	Confident	22 Å²	22	50.8 Å²	50.8	13%	0.133	27%	0.273	C	S	.	.			trans	-137.5	127.4	179.8	-175.6	0	0	0	0	109.3	R893 Y928 L986	R893-V931 PolarHBondContact NE-O 3.18Å; R893-V931 PolarHBondContact NH2-O 3.11Å; Y928-V931 HydrophobicContact CD1-CG2 4.29Å; Y928-V931 HydrophobicContact CG-CG2 4.12Å; V931-L986 HydrophobicContact CB-CD2 4.44Å; V931-L986 HydrophobicContact CG1-CD2 3.92Å; V931-L986 HydrophobicContact CG1-CG 4.49Å; V931-L986 HydrophobicContact CG2-CD2 4.49Å
932	P	83.9	Confident	86	Confident	38 Å²	38	45 Å²	45	25%	0.247	25%	0.247	C	C	.	.			trans	-63.3	156.3	176.3	27.4	-34	0	0	0	111.1	R893 E936 P940	R893-P932 PolarHBondContact NH2-O 2.84Å; P932-E936 HydrophobicContact CB-CG 3.87Å; P932-P940 HydrophobicContact CB-CG 4.45Å
933	C	86.1	Confident	85.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-87.2	123.2	167.3	-176.2	0	0	0	0	110.6	Q787 G788 V897 N935 E936 E980	Q787-C933 HydrophobicContact CB-CB 4.48Å; G788-C933 WeakPolarHBondContact CA-SG 3.4Å; V897-C933 PolarHBondContact O-SG 3.47Å; C933-N935 PolarHBondContact O-N 3.22Å; C933-E936 PolarHBondContact N-OE1 3.21Å; C933-E936 WeakPolarHBondContact O-CG 3.3Å; C933-E936 PolarHBondContact O-N 2.82Å; C933-E980 VanDerWaalsContact CA-OE2 3.25Å; C933-E980 WeakPolarHBondContact CA-OE2 3.41Å; C933-E980 PolarHBondContact SG-OE2 3.31Å
934	G	78.3	Confident	85.9	Confident	6 Å²	6	41.8 Å²	41.8	6%	0.062	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	-127.9	-173.2	0	0	0	0	0	111.8	E980 Q983	G934-E980 PolarHBondContact N-OE2 3.39Å; G934-Q983 PolarHBondContact O-NE2 3.1Å
935	N	72.7	Confident	85.8	Confident	95 Å²	95	41.8 Å²	41.8	51%	0.508	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	22.7	-178	-60.9	-10.3	0	0	0	113.7	I579 G583 C933 S937	I579-N935 VanDerWaalsContact CD1-ND2 3.26Å; I579-N935 WeakPolarHBondContact CD1-ND2 3.28Å; G583-N935 WeakPolarHBondContact CA-OD1 3.5Å; G583-N935 PolarHBondContact O-OD1 3.18Å; C933-N935 PolarHBondContact O-N 3.22Å; N935-S937 PolarHBondContact O-N 2.85Å
936	E	77.4	Confident	86	Confident	13 Å²	13	41.8 Å²	41.8	6%	0.061	24%	0.235	C	C	.	.			trans	-63.8	132.3	-177.5	72.1	-174.4	-177.1	0	0	112	S786 Q787 R790 P932 C933 L938	S786-E936 WeakPolarHBondContact CA-OE2 3.37Å; S786-E936 PolarHBondContact OG-OE2 3.1Å; Q787-E936 HydrophobicContact CB-CB 4.5Å; Q787-E936 HydrophobicContact CG-CB 4.25Å; Q787-E936 PolarHBondContact N-OE2 2.99Å; R790-E936 IonicContact CZ-OE1 3.07Å; R790-E936 IonicContact NE-OE1 2.66Å; R790-E936 IonicContact NE-OE2 2.7Å; R790-E936 IonicContact NH2-OE1 3.08Å; R790-E936 PolarHBondContact NH2-OE1 2.78Å; R790-E936 IonicContact NH2-OE2 3.55Å; P932-E936 HydrophobicContact CB-CG 3.87Å; C933-E936 PolarHBondContact N-OE1 3.21Å; C933-E936 WeakPolarHBondContact O-CG 3.3Å; C933-E936 PolarHBondContact O-N 2.82Å; E936-L938 PolarHBondContact O-N 2.89Å
937	S	77.7	Confident	86.1	Confident	130 Å²	130	39.9 Å²	39.9	91%	0.909	22%	0.224	S	C	*	.			trans	-85.6	9	177.6	-45.4	0	0	0	0	113.6	N935	N935-S937 PolarHBondContact O-N 2.85Å
938	L	82.3	Confident	86.3	Confident	45 Å²	45	40.2 Å²	40.2	24%	0.236	23%	0.225	C	C	.	.	S	Bend	trans	-72.7	155.2	177.5	-68.8	174.5	0	0	0	110.5	P783 S786 E936 P940	P783-L938 HydrophobicContact CB-CD1 3.78Å; P783-L938 HydrophobicContact CB-CD2 4.23Å; P783-L938 HydrophobicContact CG-CD1 3.74Å; S786-L938 VanDerWaalsContact CB-CD1 3.48Å; E936-L938 PolarHBondContact O-N 2.89Å; L938-P940 VanDerWaalsContact O-CD 3.26Å; L938-P940 WeakPolarHBondContact O-CD 3.47Å; L938-P940 VanDerWaalsContact O-N 3.09Å
939	K	87.4	Confident	86.3	Confident	183 Å²	183	41.4 Å²	41.4	80%	0.796	23%	0.234	S	C	*	.	P	Polyproline II helix	trans	-52	121.4	170.4	-174.6	-179.3	176.7	-176.5	0	108.7	R790	R790-K939 PolarHBondContact NH1-O 3.07Å; R790-K939 VanDerWaalsContact NH1-O 3.08Å; R790-K939 PolarHBondContact NH2-O 3.07Å
940	P	88.8	Confident	85.9	Confident	45 Å²	45	39.7 Å²	39.7	29%	0.292	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-63	146.1	178.7	-22.9	33.7	0	0	0	111	P932 L938	P932-P940 HydrophobicContact CB-CG 4.45Å; L938-P940 VanDerWaalsContact O-CD 3.26Å; L938-P940 WeakPolarHBondContact O-CD 3.47Å; L938-P940 VanDerWaalsContact O-N 3.09Å
941	V	93	Very high	84.9	Confident	12 Å²	12	38.1 Å²	38.1	7%	0.073	22%	0.224	C	C	.	.			trans	-121.6	159.7	174.6	-65.7	0	0	0	0	108.6	R790 E891 R893 A943	R790-V941 HydrophobicContact CG-CG2 4.41Å; E891-V941 HydrophobicContact CB-CG1 4.13Å; E891-V941 HydrophobicContact CG-CG1 4.01Å; R893-V941 HydrophobicContact CB-CG2 4Å; R893-V941 HydrophobicContact CG-CG2 4.13Å; V941-A943 PolarHBondContact O-N 3.02Å
942	P	93.8	Very high	83.5	Confident	11 Å²	11	45.3 Å²	45.3	7%	0.071	26%	0.261	C	S	.	.			trans	-61.7	135.2	178.2	-14.6	25	0	0	0	111.4	Y892 R893 V926 Y928 E929	Y892-P942 HydrophobicContact CD1-CB 3.86Å; Y892-P942 HydrophobicContact CD1-CG 4.1Å; Y892-P942 HydrophobicContact CE1-CB 4.02Å; Y892-P942 HydrophobicContact CE1-CG 4.05Å; R893-P942 PolarHBondContact N-O 3.03Å; V926-P942 HydrophobicContact CG1-CB 4.05Å; Y928-P942 CarbonylContact O-C 3.6Å; Y928-P942 VanDerWaalsContact O-CA 3.23Å; Y928-P942 WeakPolarHBondContact O-CA 3.08Å; E929-P942 VanDerWaalsContact O-CA 3.27Å; E929-P942 WeakPolarHBondContact O-CA 3.29Å; E929-P942 WeakPolarHBondContact O-CB 3.16Å; E929-P942 VanDerWaalsContact O-CG 3.24Å; E929-P942 WeakPolarHBondContact O-CG 3.32Å
943	A	92.1	Very high	81.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	127	175.8	0	0	0	0	0	109.5	R893 A895 V927 Y928 V941	R893-A943 HydrophobicContact CG-CB 3.96Å; R893-A943 WeakPolarHBondContact O-CA 3.16Å; A895-A943 HydrophobicContact CB-CB 4.07Å; V927-A943 PolarHBondContact N-O 2.98Å; Y928-A943 HydrophobicContact CD2-CB 4.13Å; Y928-A943 PolarHBondContact N-O 3.28Å; Y928-A943 VanDerWaalsContact N-O 3.1Å; Y928-A943 PolarHBondContact O-N 3.12Å; V941-A943 PolarHBondContact O-N 3.02Å
944	V	94	Very high	79.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.4	-170.8	-51.6	0	0	0	0	111.7	F791 Y892 R893 A895 L924 A925 V926	F791-V944 HydrophobicContact CE1-CG2 4.35Å; F791-V944 HydrophobicContact CE2-CG2 4.46Å; F791-V944 HydrophobicContact CZ-CG2 3.59Å; Y892-V944 HydrophobicContact CD1-CG1 3.34Å; Y892-V944 HydrophobicContact CE1-CG1 3.88Å; Y892-V944 HydrophobicContact CG-CG1 4.02Å; R893-V944 WeakPolarHBondContact O-CG2 3.22Å; R893-V944 PolarHBondContact O-N 2.84Å; A895-V944 WeakPolarHBondContact CB-O 3.49Å; A895-V944 PolarHBondContact N-O 2.6Å; L924-V944 HydrophobicContact CD1-CG1 4.11Å; A925-V944 CarbonylContact O-C 3.48Å; A925-V944 WeakPolarHBondContact O-CA 3.25Å; A925-V944 WeakPolarHBondContact O-CB 3.21Å; V926-V944 HydrophobicContact CG2-CG1 4.1Å
945	T	92.8	Very high	77.6	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.012	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	145.5	157.2	177.6	0	0	0	0	108.8	W772 L924 A925 V927 L994 Y998	W772-T945 HydrophobicContact CH2-CG2 3.44Å; W772-T945 VanDerWaalsContact CH2-CG2 3.44Å; W772-T945 HydrophobicContact CZ2-CG2 4.16Å; W772-T945 HydrophobicContact CZ3-CG2 3.98Å; L924-T945 WeakPolarHBondContact CA-O 3.15Å; A925-T945 HydrophobicContact CB-CG2 4.02Å; A925-T945 PolarHBondContact N-O 2.89Å; A925-T945 PolarHBondContact O-N 2.8Å; V927-T945 HydrophobicContact CG2-CG2 4.08Å; T945-L994 HydrophobicContact CG2-CD2 4.38Å; T945-Y998 PolarHBondContact OG1-OH 3.38Å
946	L	95.2	Very high	76.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126	-175.2	-167.3	76.5	0	0	0	108.5	V775 I777 L894 F913 V917 L922 L924 I967	V775-L946 HydrophobicContact CG2-CD1 4.13Å; I777-L946 HydrophobicContact CD1-CD1 4.15Å; I777-L946 HydrophobicContact CD1-CD2 4.31Å; I777-L946 HydrophobicContact CG1-CD2 4.22Å; L894-L946 HydrophobicContact CD2-CB 4.03Å; F913-L946 HydrophobicContact CE2-CD2 4.03Å; F913-L946 HydrophobicContact CZ-CD2 4.31Å; V917-L946 HydrophobicContact CG1-CD2 3.76Å; L922-L946 HydrophobicContact CB-CD1 3.91Å; L922-L946 HydrophobicContact CB-CG 4.18Å; L922-L946 HydrophobicContact CD2-CD1 4.44Å; L922-L946 HydrophobicContact CD2-CD2 3.83Å; L922-L946 HydrophobicContact CD2-CG 3.83Å; L924-L946 HydrophobicContact CB-CD1 3.93Å; L946-I967 HydrophobicContact CB-CB 4.25Å; L946-I967 HydrophobicContact CB-CG1 4.22Å; L946-I967 HydrophobicContact CD2-CB 4.29Å; L946-I967 HydrophobicContact CD2-CG1 3.93Å; L946-I967 HydrophobicContact CD2-CG2 4.37Å; L946-I967 HydrophobicContact CG-CG1 4.07Å; L946-I967 WeakPolarHBondContact O-CG1 3.37Å; L946-I967 PolarHBondContact O-N 2.77Å
947	V	93.5	Very high	74.3	Confident	6 Å²	6	68.1 Å²	68.1	4%	0.036	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.9	-174.3	175.1	0	0	0	0	109.5	W772 R923 V960 D964 I965	W772-V947 HydrophobicContact CH2-CB 4.42Å; W772-V947 HydrophobicContact CH2-CG2 3.6Å; W772-V947 HydrophobicContact CZ3-CB 4.05Å; W772-V947 HydrophobicContact CZ3-CG2 3.68Å; R923-V947 PolarHBondContact N-O 3.1Å; R923-V947 PolarHBondContact O-N 2.81Å; V947-V960 HydrophobicContact CG1-CG1 4.14Å; V947-D964 HydrophobicContact CG1-CB 3.2Å; V947-I965 WeakPolarHBondContact CA-O 3.41Å
948	L	92	Very high	73	Confident	24 Å²	24	66 Å²	66	13%	0.126	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	114.9	173.1	175.7	66.9	0	0	0	109.4	K920 L922 V950 D964 I965 I967	K920-L948 HydrophobicContact CB-CD1 3.8Å; K920-L948 HydrophobicContact CD-CD1 4Å; K920-L948 HydrophobicContact CD-CD2 3.98Å; K920-L948 HydrophobicContact CG-CD1 4.09Å; L922-L948 HydrophobicContact CD2-CB 3.95Å; L922-L948 HydrophobicContact CD2-CD1 4.33Å; L922-L948 HydrophobicContact CG-CD1 4.28Å; L948-V950 PolarHBondContact O-N 2.85Å; L948-D964 WeakPolarHBondContact O-CA 3.42Å; L948-I965 HydrophobicContact CB-CB 4.26Å; L948-I965 HydrophobicContact CD2-CD1 4.25Å; L948-I965 PolarHBondContact N-O 2.9Å; L948-I965 PolarHBondContact O-N 2.8Å; L948-I967 HydrophobicContact CB-CD1 4.01Å
949	P	85.7	Confident	71.5	Confident	40 Å²	40	68.1 Å²	68.1	26%	0.26	40%	0.395	S	S	.	.			trans	-64.6	131.1	177.8	-20.7	33.3	0	0	0	112.2	R923 D964	R923-P949 HydrophobicContact CG-CG 4.38Å; P949-D964 VanDerWaalsContact CA-OD1 3.28Å; P949-D964 WeakPolarHBondContact CA-OD1 3.48Å
950	V	77.6	Confident	69.9	Low	86 Å²	86	61.8 Å²	61.8	52%	0.521	37%	0.372	S	S	.	.			trans	-95.4	-21.9	-179.5	175	0	0	0	0	112.7	L948 N963 D964 I965	L948-V950 PolarHBondContact O-N 2.85Å; V950-N963 WeakPolarHBondContact CB-O 3.41Å; V950-N963 WeakPolarHBondContact CG2-O 3.23Å; V950-D964 PolarHBondContact N-OD1 2.98Å; V950-I965 HydrophobicContact CG2-CD1 3.69Å; V950-I965 HydrophobicContact CG2-CG1 3.61Å
951	A	59.6	Low	68.3	Low	43 Å²	43	61.5 Å²	61.5	36%	0.355	37%	0.37	S	S	.	.	S	Bend	trans	-113.7	134.4	-177	0	0	0	0	0	112.9	H953	A951-H953 PolarHBondContact O-N 3.14Å
952	D	50.4	Low	66.8	Low	173 Å²	173	67.3 Å²	67.3	93%	0.925	41%	0.408	S	S	*	.			trans	-68.4	23.1	171.2	-86.4	-23.6	0	0	0	114	K954	D952-K954 PolarHBondContact O-N 2.82Å
953	H	47.1	Very low	65.7	Low	140 Å²	140	72.8 Å²	72.8	65%	0.648	44%	0.437	S	S	*	.			trans	-70.8	104.8	176.4	-81.9	-65.5	0	0	0	109.8	A951 T955	A951-H953 PolarHBondContact O-N 3.14Å; H953-T955 PolarHBondContact O-N 2.99Å; H953-T955 PolarHBondContact O-OG1 3.32Å
954	K	40	Very low	65.3	Low	211 Å²	211	73.4 Å²	73.4	92%	0.917	44%	0.44	S	S	*	.			trans	-64.5	47.5	167.5	-67.1	-176.8	177.5	177.9	0	112.7	D952 S956	D952-K954 PolarHBondContact O-N 2.82Å; K954-S956 PolarHBondContact O-N 2.8Å
955	T	37.4	Very low	65.1	Low	96 Å²	96	76.6 Å²	76.6	59%	0.589	46%	0.457	S	S	*	.			trans	-80.8	100.4	165.8	41.3	0	0	0	0	108.4	H953 G957	H953-T955 PolarHBondContact O-N 2.99Å; H953-T955 PolarHBondContact O-OG1 3.32Å; T955-G957 PolarHBondContact O-N 3.39Å
956	S	40.2	Very low	65.1	Low	133 Å²	133	76.9 Å²	76.9	93%	0.93	46%	0.458	S	S	*	.			trans	-62.7	94.2	169.8	-170.7	0	0	0	0	109.4	K954	K954-S956 PolarHBondContact O-N 2.8Å
957	G	40.8	Very low	65.2	Low	51 Å²	51	76.9 Å²	76.9	53%	0.526	46%	0.458	S	S	.	.	S	Bend	trans	175.6	141.7	176.7	0	0	0	0	0	112.5	T955 S959	T955-G957 PolarHBondContact O-N 3.39Å; G957-S959 PolarHBondContact O-N 3.29Å
958	S	48.7	Very low	65.3	Low	85 Å²	85	76.6 Å²	76.6	59%	0.594	46%	0.457	S	S	*	.	S	Bend	trans	-65.1	30.9	-171	-172.5	0	0	0	0	116.1
959	S	52.2	Low	65.4	Low	90 Å²	90	78.2 Å²	78.2	63%	0.629	46%	0.463	S	S	*	.			trans	-114	135.2	-173.8	-167.3	0	0	0	0	112	R923 G957	R923-S959 PolarHBondContact NH1-O 3.07Å; G957-S959 PolarHBondContact O-N 3.29Å
960	V	53.4	Low	65.9	Low	49 Å²	49	77.5 Å²	77.5	30%	0.297	46%	0.46	S	S	.	.			trans	-75.1	134.7	174.8	175.9	0	0	0	0	109.5	W772 V947 D964	W772-V960 HydrophobicContact CD2-CG2 3.82Å; W772-V960 HydrophobicContact CE3-CG2 4.28Å; W772-V960 HydrophobicContact CG-CG2 4.45Å; W772-V960 HydrophobicContact CH2-CG2 3.79Å; W772-V960 HydrophobicContact CZ2-CG2 3.3Å; W772-V960 HydrophobicContact CZ3-CG2 4.26Å; V947-V960 HydrophobicContact CG1-CG1 4.14Å; V960-D964 HydrophobicContact CG1-CB 4.17Å
961	C	55.3	Low	66.9	Low	39 Å²	39	73.4 Å²	73.4	26%	0.264	44%	0.435	S	S	.	.			trans	-81	143.8	174.4	-64.1	0	0	0	0	109.7	N963 D964	C961-N963 PolarHBondContact O-N 3.34Å; C961-D964 WeakPolarHBondContact CB-OD1 3.3Å; C961-D964 PolarHBondContact N-OD2 3.47Å; C961-D964 WeakPolarHBondContact O-CB 3.43Å; C961-D964 PolarHBondContact O-N 2.89Å
962	P	61	Low	68.6	Low	134 Å²	134	71.4 Å²	71.4	87%	0.87	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-24	-179.7	-24.7	32.7	0	0	0	114.8
963	N	70.6	Confident	70.7	Confident	126 Å²	126	64.5 Å²	64.5	67%	0.674	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-3.2	-179.2	-65.6	-14.4	0	0	0	113.5	V950 C961	V950-N963 WeakPolarHBondContact CB-O 3.41Å; V950-N963 WeakPolarHBondContact CG2-O 3.23Å; C961-N963 PolarHBondContact O-N 3.34Å
964	D	84.1	Confident	72.9	Confident	14 Å²	14	61 Å²	61	8%	0.075	37%	0.369	C	S	.	.	S	Bend	trans	-66.4	142.2	178.7	-62.5	-20.2	0	0	0	110.2	R923 V947 L948 P949 V950 V960 C961 D966	R923-D964 IonicContact NH1-OD2 3.65Å; V947-D964 HydrophobicContact CG1-CB 3.2Å; L948-D964 WeakPolarHBondContact O-CA 3.42Å; P949-D964 VanDerWaalsContact CA-OD1 3.28Å; P949-D964 WeakPolarHBondContact CA-OD1 3.48Å; V950-D964 PolarHBondContact N-OD1 2.98Å; V960-D964 HydrophobicContact CG1-CB 4.17Å; C961-D964 WeakPolarHBondContact CB-OD1 3.3Å; C961-D964 PolarHBondContact N-OD2 3.47Å; C961-D964 WeakPolarHBondContact O-CB 3.43Å; C961-D964 PolarHBondContact O-N 2.89Å; D964-D966 PolarHBondContact O-N 3.08Å
965	I	89.8	Confident	75.6	Confident	67 Å²	67	50.9 Å²	50.9	34%	0.344	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	113	-177.8	-63.4	160.5	0	0	0	108.6	V947 L948 V950 I967	V947-I965 WeakPolarHBondContact CA-O 3.41Å; L948-I965 HydrophobicContact CB-CB 4.26Å; L948-I965 HydrophobicContact CD2-CD1 4.25Å; L948-I965 PolarHBondContact N-O 2.9Å; L948-I965 PolarHBondContact O-N 2.8Å; V950-I965 HydrophobicContact CG2-CD1 3.69Å; V950-I965 HydrophobicContact CG2-CG1 3.61Å; I965-I967 HydrophobicContact CG2-CD1 4.31Å; I965-I967 PolarHBondContact O-N 3.34Å
966	D	93.2	Very high	78.4	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.043	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	117	167.2	-173.9	-44.9	0	0	0	109.4	D964 S968 E969 S970 Y998	D964-D966 PolarHBondContact O-N 3.08Å; D966-S968 VanDerWaalsContact C-N 3.33Å; D966-S968 PolarHBondContact O-N 2.97Å; D966-S968 WeakPolarHBondContact OD1-CB 3.01Å; D966-S968 PolarHBondContact OD1-N 3.37Å; D966-E969 HydrophobicContact CB-CB 3.81Å; D966-E969 PolarHBondContact O-N 3.3Å; D966-E969 PolarHBondContact OD1-N 3.24Å; D966-S970 WeakPolarHBondContact O-CB 3.42Å; D966-S970 PolarHBondContact O-N 3.21Å; D966-Y998 PolarHBondContact OD1-OH 3.39Å; D966-Y998 WeakPolarHBondContact OD2-CE1 3.38Å; D966-Y998 PolarHBondContact OD2-OH 3.37Å
967	I	96.6	Very high	81.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.6	-37.5	-174.6	-58.9	-53.4	0	0	0	111.2	F913 L916 V917 L922 L946 L948 I965 S970 L971	F913-I967 HydrophobicContact CD2-CG2 3.8Å; F913-I967 HydrophobicContact CE2-CG2 3.94Å; L916-I967 HydrophobicContact CB-CD1 4.17Å; L916-I967 HydrophobicContact CD1-CG2 4.28Å; V917-I967 HydrophobicContact CG1-CD1 4.48Å; V917-I967 HydrophobicContact CG1-CG1 4.34Å; V917-I967 HydrophobicContact CG1-CG2 4.17Å; L922-I967 HydrophobicContact CD2-CD1 4.07Å; L922-I967 HydrophobicContact CD2-CG1 3.87Å; L946-I967 HydrophobicContact CB-CB 4.25Å; L946-I967 HydrophobicContact CB-CG1 4.22Å; L946-I967 HydrophobicContact CD2-CB 4.29Å; L946-I967 HydrophobicContact CD2-CG1 3.93Å; L946-I967 HydrophobicContact CD2-CG2 4.37Å; L946-I967 HydrophobicContact CG-CG1 4.07Å; L946-I967 WeakPolarHBondContact O-CG1 3.37Å; L946-I967 PolarHBondContact O-N 2.77Å; L948-I967 HydrophobicContact CB-CD1 4.01Å; I965-I967 HydrophobicContact CG2-CD1 4.31Å; I965-I967 PolarHBondContact O-N 3.34Å; I967-S970 PolarHBondContact O-N 2.88Å; I967-L971 HydrophobicContact CG2-CD1 4.33Å; I967-L971 VanDerWaalsContact O-CG 3.31Å; I967-L971 WeakPolarHBondContact O-CG 3.35Å; I967-L971 PolarHBondContact O-N 2.77Å; I967-L971 VanDerWaalsContact O-N 3.1Å
968	S	96.3	Very high	83.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-70.8	-44.5	-178.8	-56.1	0	0	0	0	110.5	D966 S970 L971 L972 Y998	D966-S968 VanDerWaalsContact C-N 3.33Å; D966-S968 PolarHBondContact O-N 2.97Å; D966-S968 WeakPolarHBondContact OD1-CB 3.01Å; D966-S968 PolarHBondContact OD1-N 3.37Å; S968-S970 VanDerWaalsContact C-N 3.32Å; S968-S970 PolarHBondContact O-N 3.46Å; S968-L971 PolarHBondContact O-N 3.06Å; S968-L972 WeakPolarHBondContact O-CB 3.43Å; S968-L972 WeakPolarHBondContact O-CD1 3.25Å; S968-L972 VanDerWaalsContact O-CG 3.23Å; S968-L972 WeakPolarHBondContact O-CG 3.5Å; S968-L972 PolarHBondContact O-N 3.21Å; S968-Y998 WeakPolarHBondContact CB-OH 3.43Å; S968-Y998 PolarHBondContact OG-OH 2.84Å
969	E	94.3	Very high	85.5	Confident	57 Å²	57	34.4 Å²	34.4	27%	0.266	20%	0.204	S	C	.	.	H	α-helix	trans	-59.5	-42.5	174.8	-173.9	-172.4	-166.7	0	0	111.9	D966 L971 L972 S973 K997 Y998 A1001	D966-E969 HydrophobicContact CB-CB 3.81Å; D966-E969 PolarHBondContact O-N 3.3Å; D966-E969 PolarHBondContact OD1-N 3.24Å; E969-L971 PolarHBondContact O-N 3.34Å; E969-L972 PolarHBondContact O-N 3.07Å; E969-S973 VanDerWaalsContact O-CB 3.26Å; E969-S973 WeakPolarHBondContact O-CB 3.45Å; E969-S973 PolarHBondContact O-N 2.87Å; E969-S973 PolarHBondContact O-OG 2.85Å; E969-K997 HydrophobicContact CG-CD 4.43Å; E969-K997 HydrophobicContact CG-CG 4.37Å; E969-K997 VanDerWaalsContact OE1-CE 3.23Å; E969-K997 WeakPolarHBondContact OE1-CE 3.16Å; E969-K997 IonicContact OE1-NZ 3.61Å; E969-K997 WeakPolarHBondContact OE2-CE 3.33Å; E969-K997 IonicContact OE2-NZ 3.44Å; E969-K997 PolarHBondContact OE2-NZ 2.77Å; E969-Y998 HydrophobicContact CB-CD1 4.27Å; E969-Y998 HydrophobicContact CB-CE1 4.22Å; E969-A1001 HydrophobicContact CG-CB 3.93Å
970	S	95.1	Very high	87.1	Confident	26 Å²	26	30.2 Å²	30.2	18%	0.182	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-44.7	176.7	-176.8	0	0	0	0	111.9	D966 I967 S968 S973 N974	D966-S970 WeakPolarHBondContact O-CB 3.42Å; D966-S970 PolarHBondContact O-N 3.21Å; I967-S970 PolarHBondContact O-N 2.88Å; S968-S970 VanDerWaalsContact C-N 3.32Å; S968-S970 PolarHBondContact O-N 3.46Å; S970-S973 WeakPolarHBondContact CA-OG 3.35Å; S970-S973 PolarHBondContact O-OG 3.29Å; S970-N974 WeakPolarHBondContact O-CB 3.26Å; S970-N974 PolarHBondContact O-N 3.25Å; S970-N974 PolarHBondContact O-ND2 2.97Å
971	L	98.1	Very high	88.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.4	-40.5	176.9	-66.7	173.1	0	0	0	112.3	L789 L894 A912 F913 L916 I967 S968 E969 G975 L976 V977	L789-L971 HydrophobicContact CD1-CD1 3.95Å; L894-L971 HydrophobicContact CD1-CD1 3.85Å; A912-L971 HydrophobicContact CB-CD2 4.14Å; F913-L971 HydrophobicContact CB-CD1 4.18Å; F913-L971 HydrophobicContact CB-CD2 4.48Å; F913-L971 HydrophobicContact CD2-CD1 4.07Å; L916-L971 HydrophobicContact CD1-CD2 3.92Å; L916-L971 HydrophobicContact CD1-CG 4.18Å; I967-L971 HydrophobicContact CG2-CD1 4.33Å; I967-L971 VanDerWaalsContact O-CG 3.31Å; I967-L971 WeakPolarHBondContact O-CG 3.35Å; I967-L971 PolarHBondContact O-N 2.77Å; I967-L971 VanDerWaalsContact O-N 3.1Å; S968-L971 PolarHBondContact O-N 3.06Å; E969-L971 PolarHBondContact O-N 3.34Å; L971-G975 PolarHBondContact O-N 3.41Å; L971-L976 HydrophobicContact CD2-CB 4.39Å; L971-L976 HydrophobicContact CD2-CD1 3.76Å; L971-L976 PolarHBondContact O-N 3.02Å; L971-V977 HydrophobicContact CB-CG1 4.36Å; L971-V977 HydrophobicContact CB-CG2 3.57Å
972	L	97	Very high	88.8	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.2	-46.7	179.2	-73.4	165.9	0	0	0	112	V897 S968 E969 N974 G975 V977 C978 V979 Y998 A1001 Q1002 A1005	V897-L972 HydrophobicContact CG2-CD1 4.39Å; S968-L972 WeakPolarHBondContact O-CB 3.43Å; S968-L972 WeakPolarHBondContact O-CD1 3.25Å; S968-L972 VanDerWaalsContact O-CG 3.23Å; S968-L972 WeakPolarHBondContact O-CG 3.5Å; S968-L972 PolarHBondContact O-N 3.21Å; E969-L972 PolarHBondContact O-N 3.07Å; L972-N974 VanDerWaalsContact C-N 3.25Å; L972-N974 PolarHBondContact O-N 3.49Å; L972-G975 PolarHBondContact O-N 3.08Å; L972-V977 HydrophobicContact CD2-CG2 3.78Å; L972-V977 HydrophobicContact CG-CG2 3.89Å; L972-C978 VanDerWaalsContact CD2-C 3.48Å; L972-V979 HydrophobicContact CD1-CG2 4.1Å; L972-V979 HydrophobicContact CD2-CG2 3.74Å; L972-Y998 HydrophobicContact CD1-CD1 4.2Å; L972-Y998 HydrophobicContact CD1-CD2 3.96Å; L972-Y998 HydrophobicContact CD1-CG 3.63Å; L972-A1001 HydrophobicContact CB-CB 3.94Å; L972-Q1002 HydrophobicContact CD2-CB 4.39Å; L972-A1005 WeakPolarHBondContact O-CB 3.4Å
973	S	92.9	Very high	88.8	Confident	29 Å²	29	23 Å²	23	20%	0.203	13%	0.127	C	C	.	.	H	α-helix	trans	-66.7	-24.4	179	58.8	0	0	0	0	113.7	E969 S970 G975 A1001 K1010	E969-S973 VanDerWaalsContact O-CB 3.26Å; E969-S973 WeakPolarHBondContact O-CB 3.45Å; E969-S973 PolarHBondContact O-N 2.87Å; E969-S973 PolarHBondContact O-OG 2.85Å; S970-S973 WeakPolarHBondContact CA-OG 3.35Å; S970-S973 PolarHBondContact O-OG 3.29Å; S973-G975 VanDerWaalsContact C-N 3.34Å; S973-A1001 WeakPolarHBondContact CA-O 3.12Å; S973-K1010 VanDerWaalsContact O-CD 3.26Å; S973-K1010 WeakPolarHBondContact O-CD 3.33Å; S973-K1010 PolarHBondContact O-NZ 2.67Å
974	N	95	Very high	88.2	Confident	65 Å²	65	18.3 Å²	18.3	35%	0.348	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.2	170.2	-75.9	-68.2	0	0	0	113.2	S970 L972 L976 K1010 N1011	S970-N974 WeakPolarHBondContact O-CB 3.26Å; S970-N974 PolarHBondContact O-N 3.25Å; S970-N974 PolarHBondContact O-ND2 2.97Å; L972-N974 VanDerWaalsContact C-N 3.25Å; L972-N974 PolarHBondContact O-N 3.49Å; N974-L976 VanDerWaalsContact C-N 3.27Å; N974-L976 HydrophobicContact CB-CD1 3.81Å; N974-L976 HydrophobicContact CB-CG 3.98Å; N974-L976 PolarHBondContact O-N 3.03Å; N974-K1010 WeakPolarHBondContact O-CB 3.44Å; N974-N1011 PolarHBondContact O-ND2 2.92Å
975	G	95.4	Very high	86.8	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	64	30.5	-179.2	0	0	0	0	0	113.5	L971 L972 S973 N1011 I1012	L971-G975 PolarHBondContact O-N 3.41Å; L972-G975 PolarHBondContact O-N 3.08Å; S973-G975 VanDerWaalsContact C-N 3.34Å; G975-N1011 WeakPolarHBondContact O-CB 3.39Å; G975-I1012 WeakPolarHBondContact O-CG1 3.33Å; G975-I1012 WeakPolarHBondContact O-CG2 3.21Å; G975-I1012 PolarHBondContact O-N 3.02Å
976	L	96.2	Very high	85.3	Confident	12 Å²	12	18.4 Å²	18.4	6%	0.063	10%	0.102	C	C	.	.	S	Bend	trans	-87.5	-30.5	178.8	-66	164.3	0	0	0	111.6	F908 A909 A912 L971 N974 N1011	F908-L976 HydrophobicContact CD1-CD2 3.35Å; F908-L976 HydrophobicContact CE1-CD2 3.48Å; F908-L976 VanDerWaalsContact CE1-CD2 3.48Å; A909-L976 HydrophobicContact CB-CB 4.27Å; A909-L976 VanDerWaalsContact CB-O 3.22Å; A909-L976 WeakPolarHBondContact CB-O 3.25Å; A912-L976 HydrophobicContact CB-CD1 3.45Å; A912-L976 VanDerWaalsContact CB-CD1 3.45Å; A912-L976 HydrophobicContact CB-CD2 4.37Å; A912-L976 HydrophobicContact CB-CG 4.48Å; L971-L976 HydrophobicContact CD2-CB 4.39Å; L971-L976 HydrophobicContact CD2-CD1 3.76Å; L971-L976 PolarHBondContact O-N 3.02Å; N974-L976 VanDerWaalsContact C-N 3.27Å; N974-L976 HydrophobicContact CB-CD1 3.81Å; N974-L976 HydrophobicContact CB-CG 3.98Å; N974-L976 PolarHBondContact O-N 3.03Å; L976-N1011 HydrophobicContact CD2-CB 4.3Å
977	V	96.6	Very high	83.5	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.113	C	C	.	.	S	Bend	trans	-131.5	169.6	177.8	-59.5	0	0	0	0	109.4	V897 Q898 L899 A909 L971 L972 I1012	V897-V977 HydrophobicContact CG1-CB 3.77Å; V897-V977 HydrophobicContact CG1-CG1 4.04Å; V897-V977 HydrophobicContact CG1-CG2 3.61Å; V897-V977 HydrophobicContact CG2-CG2 4.47Å; Q898-V977 WeakPolarHBondContact O-CB 3.37Å; L899-V977 HydrophobicContact CD2-CG1 4.25Å; A909-V977 HydrophobicContact CB-CG1 3.99Å; L971-V977 HydrophobicContact CB-CG1 4.36Å; L971-V977 HydrophobicContact CB-CG2 3.57Å; L972-V977 HydrophobicContact CD2-CG2 3.78Å; L972-V977 HydrophobicContact CG-CG2 3.89Å; V977-I1012 WeakPolarHBondContact O-CD1 3.19Å
978	C	92.8	Very high	81.4	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.014	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	160.2	173.9	61	0	0	0	0	111	Q898 L972 E980 Q1002 I1012 W1013	Q898-C978 PolarHBondContact N-O 2.87Å; Q898-C978 PolarHBondContact O-N 3.33Å; Q898-C978 VanDerWaalsContact O-N 3.08Å; L972-C978 VanDerWaalsContact CD2-C 3.48Å; C978-E980 PolarHBondContact O-N 3.06Å; C978-Q1002 VanDerWaalsContact CA-OE1 3.28Å; C978-Q1002 VanDerWaalsContact CB-OE1 3.26Å; C978-I1012 HydrophobicContact CB-CD1 4.31Å; C978-W1013 HydrophobicContact CB-CH2 3.84Å; C978-W1013 HydrophobicContact CB-CZ2 3.7Å
979	V	90	Very high	79.2	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.024	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	125.9	169.6	-178.8	0	0	0	0	107.3	F896 L972 I982 L995 L999 Q1002 R1019	F896-V979 CarbonylContact O-C 3.5Å; F896-V979 WeakPolarHBondContact O-CA 3.4Å; L972-V979 HydrophobicContact CD1-CG2 4.1Å; L972-V979 HydrophobicContact CD2-CG2 3.74Å; V979-I982 HydrophobicContact CG1-CD1 3.63Å; V979-I982 HydrophobicContact CG1-CG1 4.26Å; V979-L995 HydrophobicContact CG1-CD1 4.31Å; V979-L999 HydrophobicContact CB-CD2 4.35Å; V979-L999 HydrophobicContact CG1-CD2 4Å; V979-L999 HydrophobicContact CG2-CD2 4.27Å; V979-Q1002 HydrophobicContact CG2-CB 4Å; V979-R1019 PolarHBondContact O-NH1 3.43Å
980	E	85.9	Confident	77.1	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.009	18%	0.181	C	C	.	.			trans	-59.4	153.7	174.1	79.4	-176.4	124.8	0	0	109.3	R893 F896 Q898 C933 G934 C978 I982	R893-E980 IonicContact CZ-OE1 2.74Å; R893-E980 IonicContact NH1-OE1 3.48Å; R893-E980 PolarHBondContact NH1-OE1 3.18Å; R893-E980 IonicContact NH1-OE2 3.87Å; R893-E980 IonicContact NH2-OE1 3.68Å; R893-E980 PolarHBondContact NH2-OE1 2.76Å; R893-E980 IonicContact NH2-OE2 2.81Å; F896-E980 WeakPolarHBondContact CA-OE1 3.43Å; F896-E980 PolarHBondContact N-OE1 3.06Å; F896-E980 PolarHBondContact O-N 2.96Å; Q898-E980 HydrophobicContact CB-CB 3.91Å; C933-E980 VanDerWaalsContact CA-OE2 3.25Å; C933-E980 WeakPolarHBondContact CA-OE2 3.41Å; C933-E980 PolarHBondContact SG-OE2 3.31Å; G934-E980 PolarHBondContact N-OE2 3.39Å; C978-E980 PolarHBondContact O-N 3.06Å; E980-I982 PolarHBondContact O-N 2.63Å
981	P	76.9	Confident	75.1	Confident	42 Å²	42	36.7 Å²	36.7	27%	0.273	18%	0.176	S	C	.	.			trans	-50.9	104.6	165.4	-26.6	35.1	0	0	0	109.8	P581 Q983	P581-P981 CarbonylContact O-C 3.5Å; P581-P981 WeakPolarHBondContact O-CA 3.41Å; P581-P981 WeakPolarHBondContact O-CB 3.3Å; P981-Q983 WeakPolarHBondContact O-CG 3.19Å; P981-Q983 PolarHBondContact O-N 3.06Å
982	I	67.2	Low	72.9	Confident	22 Å²	22	44 Å²	44	11%	0.113	20%	0.203	C	C	.	.			trans	-57.3	119.4	176.6	-59.3	-49.6	0	0	0	107.3	P581 D582 F896 V979 E980 L987 L995	P581-I982 CarbonylContact C-O 3.59Å; P581-I982 CarbonylContact O-C 3.53Å; P581-I982 PolarHBondContact O-N 3.39Å; D582-I982 WeakPolarHBondContact CA-O 3.48Å; D582-I982 WeakPolarHBondContact CB-O 3.35Å; D582-I982 VanDerWaalsContact CG-C 3.45Å; D582-I982 PolarHBondContact N-O 3.37Å; F896-I982 HydrophobicContact CB-CD1 4.45Å; F896-I982 HydrophobicContact CD1-CD1 3.62Å; F896-I982 HydrophobicContact CE1-CD1 4.29Å; F896-I982 HydrophobicContact CG-CD1 4.39Å; V979-I982 HydrophobicContact CG1-CD1 3.63Å; V979-I982 HydrophobicContact CG1-CG1 4.26Å; E980-I982 PolarHBondContact O-N 2.63Å; I982-L987 HydrophobicContact CG2-CD2 3.56Å; I982-L987 HydrophobicContact CG2-CG 4.23Å; I982-L995 HydrophobicContact CD1-CD1 3.25Å; I982-L995 HydrophobicContact CD1-CD2 3.98Å; I982-L995 HydrophobicContact CD1-CG 4.27Å; I982-L995 HydrophobicContact CG1-CD1 3.88Å; I982-L995 HydrophobicContact CG1-CD2 4Å; I982-L995 HydrophobicContact CG2-CD2 3.86Å
983	Q	60.4	Low	71.4	Confident	8 Å²	8	48.3 Å²	48.3	4%	0.037	23%	0.227	C	C	.	.			trans	-91.5	144.2	-172.8	-44.4	-153.7	-14.8	0	0	117.1	D582 V584 G934 P981 Q985 L986 L987	D582-Q983 HydrophobicContact CB-CB 4.45Å; D582-Q983 WeakPolarHBondContact O-CA 3.46Å; D582-Q983 WeakPolarHBondContact O-CB 3.43Å; D582-Q983 VanDerWaalsContact O-CD 3.23Å; D582-Q983 WeakPolarHBondContact O-CG 3.36Å; D582-Q983 WeakPolarHBondContact OD1-CA 3.38Å; D582-Q983 PolarHBondContact OD1-N 3.14Å; D582-Q983 VanDerWaalsContact OD1-O 3.07Å; V584-Q983 HydrophobicContact CG2-CB 4.4Å; G934-Q983 PolarHBondContact O-NE2 3.1Å; P981-Q983 WeakPolarHBondContact O-CG 3.19Å; P981-Q983 PolarHBondContact O-N 3.06Å; Q983-Q985 PolarHBondContact O-N 3.36Å; Q983-Q985 VanDerWaalsContact O-N 3.09Å; Q983-L986 HydrophobicContact CB-CB 4.26Å; Q983-L986 HydrophobicContact CB-CD1 3.88Å; Q983-L986 HydrophobicContact CB-CG 3.79Å; Q983-L986 HydrophobicContact CG-CD1 3.82Å; Q983-L986 HydrophobicContact CG-CG 4.23Å; Q983-L986 CarbonylContact O-C 3.6Å; Q983-L986 WeakPolarHBondContact O-CA 3.33Å; Q983-L986 WeakPolarHBondContact O-CB 3.45Å; Q983-L986 PolarHBondContact O-N 2.93Å; Q983-L987 PolarHBondContact O-N 3.05Å
984	P	58.6	Low	70.7	Confident	27 Å²	27	48 Å²	48	18%	0.175	22%	0.223	C	C	.	.	H	α-helix	trans	-67.8	-26.4	-170.5	-2.5	12.2	0	0	0	109.2	D582 V584 L987 K988	D582-P984 HydrophobicContact CB-CG 3.97Å; D582-P984 WeakPolarHBondContact O-CD 3.48Å; D582-P984 WeakPolarHBondContact OD2-CA 3.29Å; D582-P984 WeakPolarHBondContact OD2-CB 3.39Å; D582-P984 WeakPolarHBondContact OD2-CD 3.42Å; D582-P984 WeakPolarHBondContact OD2-CG 3.13Å; V584-P984 HydrophobicContact CB-CG 3.95Å; V584-P984 HydrophobicContact CG1-CG 4.07Å; P984-L987 WeakPolarHBondContact O-CB 3.38Å; P984-L987 PolarHBondContact O-N 3.32Å; P984-K988 PolarHBondContact O-N 3.05Å
985	Q	54	Low	69.9	Low	82 Å²	82	45.6 Å²	45.6	38%	0.383	21%	0.21	S	C	.	.	H	α-helix	trans	-71.6	-28.9	170.1	-57.4	76.5	8.9	0	0	112.4	V584 Q983	V584-Q985 VanDerWaalsContact CG2-NE2 3.27Å; Q983-Q985 PolarHBondContact O-N 3.36Å; Q983-Q985 VanDerWaalsContact O-N 3.09Å
986	L	57.9	Low	69	Low	0 Å²	0	51 Å²	51	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.8	-37.3	167.6	-60.9	175.5	0	0	0	110.4	F896 Y928 V931 Q983 K988 R989	F896-L986 HydrophobicContact CD1-CD1 4.12Å; F896-L986 HydrophobicContact CE1-CB 4.08Å; F896-L986 HydrophobicContact CE1-CD1 4.1Å; F896-L986 HydrophobicContact CE1-CG 4.47Å; Y928-L986 HydrophobicContact CD1-CD2 3.83Å; Y928-L986 HydrophobicContact CD2-CD2 3.5Å; Y928-L986 HydrophobicContact CE1-CB 4.29Å; Y928-L986 HydrophobicContact CE1-CD2 3.64Å; Y928-L986 HydrophobicContact CE2-CB 4.49Å; Y928-L986 HydrophobicContact CE2-CD2 3.31Å; Y928-L986 HydrophobicContact CE2-CG 4.44Å; Y928-L986 HydrophobicContact CG-CD2 3.78Å; Y928-L986 WeakPolarHBondContact OH-CA 3.26Å; Y928-L986 PolarHBondContact OH-O 3.38Å; V931-L986 HydrophobicContact CB-CD2 4.44Å; V931-L986 HydrophobicContact CG1-CD2 3.92Å; V931-L986 HydrophobicContact CG1-CG 4.49Å; V931-L986 HydrophobicContact CG2-CD2 4.49Å; Q983-L986 HydrophobicContact CB-CB 4.26Å; Q983-L986 HydrophobicContact CB-CD1 3.88Å; Q983-L986 HydrophobicContact CB-CG 3.79Å; Q983-L986 HydrophobicContact CG-CD1 3.82Å; Q983-L986 HydrophobicContact CG-CG 4.23Å; Q983-L986 CarbonylContact O-C 3.6Å; Q983-L986 WeakPolarHBondContact O-CA 3.33Å; Q983-L986 WeakPolarHBondContact O-CB 3.45Å; Q983-L986 PolarHBondContact O-N 2.93Å; L986-K988 VanDerWaalsContact C-N 3.31Å; L986-K988 PolarHBondContact O-N 2.96Å; L986-R989 PolarHBondContact O-N 3.45Å
987	L	57.1	Low	68.4	Low	54 Å²	54	54.2 Å²	54.2	28%	0.283	25%	0.248	S	C	.	.	H	α-helix	trans	-60.8	-35.6	177.4	-60.9	178.4	0	0	0	113.1	I982 Q983 P984 R989 L990	I982-L987 HydrophobicContact CG2-CD2 3.56Å; I982-L987 HydrophobicContact CG2-CG 4.23Å; Q983-L987 PolarHBondContact O-N 3.05Å; P984-L987 WeakPolarHBondContact O-CB 3.38Å; P984-L987 PolarHBondContact O-N 3.32Å; L987-R989 VanDerWaalsContact C-N 3.26Å; L987-R989 PolarHBondContact O-N 3.49Å; L987-L990 HydrophobicContact CB-CD1 4.29Å; L987-L990 HydrophobicContact CD2-CD1 3.53Å
988	K	51.8	Low	68.1	Low	175 Å²	175	54.2 Å²	54.2	76%	0.761	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.9	-177.7	-72.4	-179.1	-176.3	-175	0	115.6	P984 L986	P984-K988 PolarHBondContact O-N 3.05Å; L986-K988 VanDerWaalsContact C-N 3.31Å; L986-K988 PolarHBondContact O-N 2.96Å
989	R	50.4	Low	67.8	Low	203 Å²	203	56.5 Å²	56.5	77%	0.766	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.4	31.9	-177.4	-80.7	-174.5	167.1	162	-3.1	112.6	Y928 L986 L987 P991	Y928-R989 HydrophobicContact CE1-CB 3.99Å; L986-R989 PolarHBondContact O-N 3.45Å; L987-R989 VanDerWaalsContact C-N 3.26Å; L987-R989 PolarHBondContact O-N 3.49Å; R989-P991 WeakPolarHBondContact O-CD 3.48Å
990	L	49.4	Very low	67.4	Low	31 Å²	31	60.2 Å²	60.2	16%	0.162	28%	0.28	C	S	.	.			trans	-63.6	118.5	-177.6	-100.3	165.3	0	0	0	113	F896 L987 R992 L995	F896-L990 HydrophobicContact CZ-CD2 4.21Å; L987-L990 HydrophobicContact CB-CD1 4.29Å; L987-L990 HydrophobicContact CD2-CD1 3.53Å; L990-R992 HydrophobicContact CB-CG 3.96Å; L990-R992 HydrophobicContact CD1-CG 4.5Å; L990-R992 PolarHBondContact O-N 2.91Å; L990-L995 HydrophobicContact CD1-CD2 4.38Å; L990-L995 HydrophobicContact CD2-CB 3.57Å; L990-L995 HydrophobicContact CD2-CD2 3.65Å; L990-L995 HydrophobicContact CD2-CG 4.24Å
991	P	53.4	Low	67.4	Low	13 Å²	13	60.5 Å²	60.5	8%	0.084	28%	0.283	C	S	.	.			trans	-71.7	87	146	28.6	-26.2	0	0	0	107	V927 R989 N993 L994	V927-P991 HydrophobicContact CG1-CG 3.99Å; R989-P991 WeakPolarHBondContact O-CD 3.48Å; P991-N993 PolarHBondContact O-N 3.24Å; P991-L994 HydrophobicContact CB-CB 4.4Å; P991-L994 HydrophobicContact CG-CB 4.15Å; P991-L994 HydrophobicContact CG-CD2 4.33Å; P991-L994 WeakPolarHBondContact O-CB 3.4Å; P991-L994 PolarHBondContact O-N 2.85Å
992	R	52.9	Low	68.1	Low	152 Å²	152	59.1 Å²	59.1	57%	0.574	27%	0.272	S	S	*	.	H	α-helix	trans	-49.6	-36.4	-170.1	-71.9	-174.7	178.3	-172.3	-0.8	113.7	L990 L994 H996	L990-R992 HydrophobicContact CB-CG 3.96Å; L990-R992 HydrophobicContact CD1-CG 4.5Å; L990-R992 PolarHBondContact O-N 2.91Å; R992-L994 VanDerWaalsContact C-N 3.27Å; R992-L994 PolarHBondContact O-N 2.99Å; R992-H996 PolarHBondContact O-N 3.37Å
993	N	65.1	Low	68.8	Low	91 Å²	91	60.6 Å²	60.6	49%	0.487	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-29.5	-180	-56.4	-8.1	0	0	0	112.7	I767 P991 K997	I767-N993 HydrophobicContact CD1-CB 3.65Å; I767-N993 WeakPolarHBondContact CD1-ND2 3.42Å; P991-N993 PolarHBondContact O-N 3.24Å; N993-K997 WeakPolarHBondContact O-CB 3.32Å; N993-K997 PolarHBondContact O-N 3.38Å
994	L	77.3	Confident	69.8	Low	23 Å²	23	64 Å²	64	12%	0.12	31%	0.306	C	S	.	.	H	α-helix	trans	-72.1	-47.9	-179.4	-171.2	67.8	0	0	0	111.6	F896 V927 T945 P991 R992 H996 K997 Y998	F896-L994 HydrophobicContact CE2-CD2 4.22Å; V927-L994 HydrophobicContact CG2-CD2 4.28Å; T945-L994 HydrophobicContact CG2-CD2 4.38Å; P991-L994 HydrophobicContact CB-CB 4.4Å; P991-L994 HydrophobicContact CG-CB 4.15Å; P991-L994 HydrophobicContact CG-CD2 4.33Å; P991-L994 WeakPolarHBondContact O-CB 3.4Å; P991-L994 PolarHBondContact O-N 2.85Å; R992-L994 VanDerWaalsContact C-N 3.27Å; R992-L994 PolarHBondContact O-N 2.99Å; L994-H996 PolarHBondContact O-N 3.29Å; L994-K997 WeakPolarHBondContact O-CB 3.42Å; L994-K997 PolarHBondContact O-N 3.29Å; L994-Y998 HydrophobicContact CD1-CD1 4.49Å; L994-Y998 HydrophobicContact CD1-CE1 3.64Å; L994-Y998 HydrophobicContact CD1-CE2 4.47Å; L994-Y998 HydrophobicContact CD2-CE2 4.48Å; L994-Y998 HydrophobicContact CG-CE1 4.1Å; L994-Y998 HydrophobicContact CG-CE2 4.17Å; L994-Y998 WeakPolarHBondContact O-CD1 3.27Å; L994-Y998 PolarHBondContact O-N 2.9Å; L994-Y998 VanDerWaalsContact O-N 3.15Å
995	L	79.4	Confident	71.2	Confident	15 Å²	15	62.7 Å²	62.7	8%	0.079	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-42.7	179.5	174	57.8	0	0	0	111.4	F896 V979 I982 L990 K997 Y998 L999	F896-L995 HydrophobicContact CD1-CD1 4.19Å; F896-L995 HydrophobicContact CG-CD1 4.29Å; V979-L995 HydrophobicContact CG1-CD1 4.31Å; I982-L995 HydrophobicContact CD1-CD1 3.25Å; I982-L995 HydrophobicContact CD1-CD2 3.98Å; I982-L995 HydrophobicContact CD1-CG 4.27Å; I982-L995 HydrophobicContact CG1-CD1 3.88Å; I982-L995 HydrophobicContact CG1-CD2 4Å; I982-L995 HydrophobicContact CG2-CD2 3.86Å; L990-L995 HydrophobicContact CD1-CD2 4.38Å; L990-L995 HydrophobicContact CD2-CB 3.57Å; L990-L995 HydrophobicContact CD2-CD2 3.65Å; L990-L995 HydrophobicContact CD2-CG 4.24Å; L995-K997 VanDerWaalsContact C-N 3.33Å; L995-K997 PolarHBondContact O-N 3.44Å; L995-Y998 PolarHBondContact O-N 3.03Å; L995-Y998 VanDerWaalsContact O-N 3.15Å; L995-L999 HydrophobicContact CD1-CD1 4Å; L995-L999 HydrophobicContact CD1-CG 3.9Å; L995-L999 HydrophobicContact CD2-CD1 4.44Å; L995-L999 HydrophobicContact CG-CD1 3.88Å; L995-L999 HydrophobicContact CG-CG 4.28Å; L995-L999 WeakPolarHBondContact O-CG 3.38Å; L995-L999 PolarHBondContact O-N 3.07Å
996	H	76.6	Confident	72.6	Confident	114 Å²	114	61.6 Å²	61.6	53%	0.528	29%	0.291	S	S	.	.	H	α-helix	trans	-58.8	-46.5	178.1	-160.8	-96.5	0	0	0	111.2	R992 L994 Y998 L999 D1000	R992-H996 PolarHBondContact O-N 3.37Å; L994-H996 PolarHBondContact O-N 3.29Å; H996-Y998 VanDerWaalsContact C-N 3.27Å; H996-Y998 PolarHBondContact O-N 3.09Å; H996-L999 PolarHBondContact O-N 3.43Å; H996-D1000 IonicContact CE1-OD1 2.71Å; H996-D1000 IonicContact CE1-OD2 3.68Å; H996-D1000 PolarHBondContact CE1-OD2 3.45Å; H996-D1000 IonicContact CG-OD2 3.41Å; H996-D1000 IonicContact ND1-OD2 2.66Å; H996-D1000 PolarHBondContact ND1-OD2 3.11Å; H996-D1000 WeakPolarHBondContact O-CB 3.45Å; H996-D1000 VanDerWaalsContact O-CG 3.26Å; H996-D1000 PolarHBondContact O-N 3.43Å
997	K	81.7	Confident	73.8	Confident	79 Å²	79	70.2 Å²	70.2	34%	0.343	33%	0.329	S	S	.	.	H	α-helix	trans	-54.3	-42.3	174.8	-163.8	-168.8	-153.9	-156.5	0	112.5	E969 N993 L994 L995 A1001	E969-K997 HydrophobicContact CG-CD 4.43Å; E969-K997 HydrophobicContact CG-CG 4.37Å; E969-K997 VanDerWaalsContact OE1-CE 3.23Å; E969-K997 WeakPolarHBondContact OE1-CE 3.16Å; E969-K997 IonicContact OE1-NZ 3.61Å; E969-K997 WeakPolarHBondContact OE2-CE 3.33Å; E969-K997 IonicContact OE2-NZ 3.44Å; E969-K997 PolarHBondContact OE2-NZ 2.77Å; N993-K997 WeakPolarHBondContact O-CB 3.32Å; N993-K997 PolarHBondContact O-N 3.38Å; L994-K997 WeakPolarHBondContact O-CB 3.42Å; L994-K997 PolarHBondContact O-N 3.29Å; L995-K997 VanDerWaalsContact C-N 3.33Å; L995-K997 PolarHBondContact O-N 3.44Å; K997-A1001 WeakPolarHBondContact O-CB 3.38Å; K997-A1001 PolarHBondContact O-N 3.48Å
998	Y	90.7	Very high	75.3	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-73.6	-38.5	-179.2	-72.2	8.1	0	0	0	113	A895 F896 T945 D966 S968 E969 L972 L994 L995 H996 A1001 Q1002	A895-Y998 WeakPolarHBondContact O-CE2 3.34Å; F896-Y998 HydrophobicContact CB-CD2 3.91Å; F896-Y998 HydrophobicContact CB-CE2 4.34Å; F896-Y998 HydrophobicContact CD2-CD2 4.05Å; F896-Y998 HydrophobicContact CD2-CE2 4.03Å; F896-Y998 HydrophobicContact CG-CD2 4.44Å; T945-Y998 PolarHBondContact OG1-OH 3.38Å; D966-Y998 PolarHBondContact OD1-OH 3.39Å; D966-Y998 WeakPolarHBondContact OD2-CE1 3.38Å; D966-Y998 PolarHBondContact OD2-OH 3.37Å; S968-Y998 WeakPolarHBondContact CB-OH 3.43Å; S968-Y998 PolarHBondContact OG-OH 2.84Å; E969-Y998 HydrophobicContact CB-CD1 4.27Å; E969-Y998 HydrophobicContact CB-CE1 4.22Å; L972-Y998 HydrophobicContact CD1-CD1 4.2Å; L972-Y998 HydrophobicContact CD1-CD2 3.96Å; L972-Y998 HydrophobicContact CD1-CG 3.63Å; L994-Y998 HydrophobicContact CD1-CD1 4.49Å; L994-Y998 HydrophobicContact CD1-CE1 3.64Å; L994-Y998 HydrophobicContact CD1-CE2 4.47Å; L994-Y998 HydrophobicContact CD2-CE2 4.48Å; L994-Y998 HydrophobicContact CG-CE1 4.1Å; L994-Y998 HydrophobicContact CG-CE2 4.17Å; L994-Y998 WeakPolarHBondContact O-CD1 3.27Å; L994-Y998 PolarHBondContact O-N 2.9Å; L994-Y998 VanDerWaalsContact O-N 3.15Å; L995-Y998 PolarHBondContact O-N 3.03Å; L995-Y998 VanDerWaalsContact O-N 3.15Å; H996-Y998 VanDerWaalsContact C-N 3.27Å; H996-Y998 PolarHBondContact O-N 3.09Å; Y998-A1001 PolarHBondContact O-N 2.94Å; Y998-Q1002 PolarHBondContact O-N 3.45Å
999	L	86.1	Confident	77.1	Confident	50 Å²	50	72.6 Å²	72.6	26%	0.262	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-43.2	173.4	-72.3	171	0	0	0	110.9	V979 L995 H996 Q1002 A1003	V979-L999 HydrophobicContact CB-CD2 4.35Å; V979-L999 HydrophobicContact CG1-CD2 4Å; V979-L999 HydrophobicContact CG2-CD2 4.27Å; L995-L999 HydrophobicContact CD1-CD1 4Å; L995-L999 HydrophobicContact CD1-CG 3.9Å; L995-L999 HydrophobicContact CD2-CD1 4.44Å; L995-L999 HydrophobicContact CG-CD1 3.88Å; L995-L999 HydrophobicContact CG-CG 4.28Å; L995-L999 WeakPolarHBondContact O-CG 3.38Å; L995-L999 PolarHBondContact O-N 3.07Å; H996-L999 PolarHBondContact O-N 3.43Å; L999-Q1002 PolarHBondContact O-N 3.25Å; L999-A1003 WeakPolarHBondContact O-CB 3.18Å; L999-A1003 PolarHBondContact O-N 2.98Å
1000	D	82.7	Confident	78.8	Confident	82 Å²	82	66 Å²	66	44%	0.439	31%	0.31	S	S	.	.	H	α-helix	trans	-61.4	-46.4	175.4	-70.5	-27.1	0	0	0	111.4	H996 Q1002 A1003 L1004	H996-D1000 IonicContact CE1-OD1 2.71Å; H996-D1000 IonicContact CE1-OD2 3.68Å; H996-D1000 PolarHBondContact CE1-OD2 3.45Å; H996-D1000 IonicContact CG-OD2 3.41Å; H996-D1000 IonicContact ND1-OD2 2.66Å; H996-D1000 PolarHBondContact ND1-OD2 3.11Å; H996-D1000 WeakPolarHBondContact O-CB 3.45Å; H996-D1000 VanDerWaalsContact O-CG 3.26Å; H996-D1000 PolarHBondContact O-N 3.43Å; D1000-Q1002 PolarHBondContact O-N 2.51Å; D1000-A1003 PolarHBondContact O-N 3.4Å; D1000-L1004 PolarHBondContact O-N 3.42Å
1001	A	85.7	Confident	80.9	Confident	8 Å²	8	67.2 Å²	67.2	7%	0.066	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-44.2	176.5	0	0	0	0	0	112.3	E969 L972 S973 K997 Y998 L1004 A1005	E969-A1001 HydrophobicContact CG-CB 3.93Å; L972-A1001 HydrophobicContact CB-CB 3.94Å; S973-A1001 WeakPolarHBondContact CA-O 3.12Å; K997-A1001 WeakPolarHBondContact O-CB 3.38Å; K997-A1001 PolarHBondContact O-N 3.48Å; Y998-A1001 PolarHBondContact O-N 2.94Å; A1001-L1004 PolarHBondContact O-N 2.9Å; A1001-A1005 PolarHBondContact O-N 3.16Å; A1001-A1005 VanDerWaalsContact O-N 3.09Å
1002	Q	91.9	Very high	82.8	Confident	12 Å²	12	67.1 Å²	67.1	6%	0.056	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-43.2	174.9	178.5	178.2	-105.7	0	0	112	L972 C978 V979 Y998 L999 D1000 L1004 A1005 K1006 W1013	L972-Q1002 HydrophobicContact CD2-CB 4.39Å; C978-Q1002 VanDerWaalsContact CA-OE1 3.28Å; C978-Q1002 VanDerWaalsContact CB-OE1 3.26Å; V979-Q1002 HydrophobicContact CG2-CB 4Å; Y998-Q1002 PolarHBondContact O-N 3.45Å; L999-Q1002 PolarHBondContact O-N 3.25Å; D1000-Q1002 PolarHBondContact O-N 2.51Å; Q1002-L1004 VanDerWaalsContact C-N 3.27Å; Q1002-L1004 PolarHBondContact O-N 3.09Å; Q1002-A1005 PolarHBondContact O-N 2.95Å; Q1002-K1006 HydrophobicContact CG-CD 4.43Å; Q1002-K1006 HydrophobicContact CG-CG 4.42Å; Q1002-K1006 WeakPolarHBondContact O-CG 3.34Å; Q1002-K1006 PolarHBondContact O-N 3.41Å; Q1002-W1013 HydrophobicContact CG-CH2 4.48Å; Q1002-W1013 HydrophobicContact CG-CZ2 3.73Å
1003	A	82.4	Confident	84.4	Confident	54 Å²	54	60 Å²	60	45%	0.446	29%	0.289	S	S	.	.	H	α-helix	trans	-60	-40.3	179	0	0	0	0	0	111.2	L999 D1000 K1006 K1007	L999-A1003 WeakPolarHBondContact O-CB 3.18Å; L999-A1003 PolarHBondContact O-N 2.98Å; D1000-A1003 PolarHBondContact O-N 3.4Å; A1003-K1006 PolarHBondContact O-N 3.02Å; A1003-K1007 WeakPolarHBondContact O-CB 3.49Å; A1003-K1007 PolarHBondContact O-N 3.47Å
1004	L	81.6	Confident	85.5	Confident	79 Å²	79	60.4 Å²	60.4	41%	0.414	28%	0.284	S	S	.	.	H	α-helix	trans	-61	-49.1	172.6	-177	64.2	0	0	0	111.7	D1000 A1001 Q1002 K1006 K1007 E1008	D1000-L1004 PolarHBondContact O-N 3.42Å; A1001-L1004 PolarHBondContact O-N 2.9Å; Q1002-L1004 VanDerWaalsContact C-N 3.27Å; Q1002-L1004 PolarHBondContact O-N 3.09Å; L1004-K1006 VanDerWaalsContact C-N 3.31Å; L1004-K1006 PolarHBondContact O-N 3.39Å; L1004-K1007 WeakPolarHBondContact O-CB 3.35Å; L1004-K1007 PolarHBondContact O-N 3.23Å; L1004-E1008 HydrophobicContact CD1-CG 4.34Å; L1004-E1008 WeakPolarHBondContact O-CG 3.49Å; L1004-E1008 PolarHBondContact O-N 2.98Å
1005	A	86.3	Confident	85.8	Confident	0 Å²	0	69 Å²	69	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-36	179	0	0	0	0	0	113.3	L972 A1001 Q1002 R1009 K1010	L972-A1005 WeakPolarHBondContact O-CB 3.4Å; A1001-A1005 PolarHBondContact O-N 3.16Å; A1001-A1005 VanDerWaalsContact O-N 3.09Å; Q1002-A1005 PolarHBondContact O-N 2.95Å; A1005-R1009 PolarHBondContact O-N 3.12Å; A1005-K1010 HydrophobicContact CB-CB 4.5Å; A1005-K1010 PolarHBondContact O-N 2.89Å
1006	K	85.2	Confident	85.8	Confident	58 Å²	58	69.9 Å²	69.9	25%	0.252	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-48	172.5	-75.8	-175.8	-178.3	-169.2	0	111.8	Q1002 A1003 L1004 E1008 R1009 W1013 D1017	Q1002-K1006 HydrophobicContact CG-CD 4.43Å; Q1002-K1006 HydrophobicContact CG-CG 4.42Å; Q1002-K1006 WeakPolarHBondContact O-CG 3.34Å; Q1002-K1006 PolarHBondContact O-N 3.41Å; A1003-K1006 PolarHBondContact O-N 3.02Å; L1004-K1006 VanDerWaalsContact C-N 3.31Å; L1004-K1006 PolarHBondContact O-N 3.39Å; K1006-E1008 VanDerWaalsContact C-N 3.26Å; K1006-E1008 PolarHBondContact O-N 3.2Å; K1006-R1009 PolarHBondContact O-N 2.77Å; K1006-R1009 VanDerWaalsContact O-N 3.12Å; K1006-W1013 HydrophobicContact CD-CE3 4.39Å; K1006-W1013 HydrophobicContact CD-CH2 4.5Å; K1006-W1013 HydrophobicContact CD-CZ3 4.37Å; K1006-W1013 VanDerWaalsContact CE-CZ3 3.48Å; K1006-W1013 HydrophobicContact CG-CD2 3.56Å; K1006-W1013 HydrophobicContact CG-CE3 3.77Å; K1006-W1013 HydrophobicContact CG-CG 3.97Å; K1006-W1013 HydrophobicContact CG-CH2 4.38Å; K1006-W1013 HydrophobicContact CG-CZ2 4.2Å; K1006-W1013 HydrophobicContact CG-CZ3 4.19Å; K1006-D1017 WeakPolarHBondContact CE-OD2 3.49Å; K1006-D1017 IonicContact NZ-OD2 3.26Å; K1006-D1017 PolarHBondContact NZ-OD2 3.13Å
1007	K	82.8	Confident	85.8	Confident	182 Å²	182	66.5 Å²	66.5	79%	0.791	31%	0.314	S	S	*	.	H	α-helix	trans	-58.2	-40.8	177.8	-177.3	-177.5	177.4	-176.4	0	111.4	A1003 L1004 R1009	A1003-K1007 WeakPolarHBondContact O-CB 3.49Å; A1003-K1007 PolarHBondContact O-N 3.47Å; L1004-K1007 WeakPolarHBondContact O-CB 3.35Å; L1004-K1007 PolarHBondContact O-N 3.23Å; K1007-R1009 VanDerWaalsContact C-N 3.34Å
1008	E	88	Confident	85.5	Confident	99 Å²	99	64.6 Å²	64.6	46%	0.463	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-1.4	180	-65.5	-178.2	168.5	0	0	113.9	L1004 K1006 K1010	L1004-E1008 HydrophobicContact CD1-CG 4.34Å; L1004-E1008 WeakPolarHBondContact O-CG 3.49Å; L1004-E1008 PolarHBondContact O-N 2.98Å; K1006-E1008 VanDerWaalsContact C-N 3.26Å; K1006-E1008 PolarHBondContact O-N 3.2Å; E1008-K1010 VanDerWaalsContact C-N 3.3Å; E1008-K1010 HydrophobicContact CB-CD 4.36Å; E1008-K1010 HydrophobicContact CB-CG 4.04Å; E1008-K1010 PolarHBondContact O-N 3.39Å; E1008-K1010 WeakPolarHBondContact OE2-CE 2.75Å; E1008-K1010 IonicContact OE2-NZ 3.91Å; E1008-K1010 PolarHBondContact OE2-NZ 3.48Å
1009	R	88.5	Confident	84.4	Confident	179 Å²	179	66.2 Å²	66.2	68%	0.675	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	43.3	-178.7	-62.1	-173.3	174.5	164.4	-1.3	113.6	A1005 K1006 K1007 R1014	A1005-R1009 PolarHBondContact O-N 3.12Å; K1006-R1009 PolarHBondContact O-N 2.77Å; K1006-R1009 VanDerWaalsContact O-N 3.12Å; K1007-R1009 VanDerWaalsContact C-N 3.34Å; R1009-R1014 VanDerWaalsContact O-CA 3.27Å; R1009-R1014 WeakPolarHBondContact O-CA 3.28Å
1010	K	87	Confident	82.9	Confident	64 Å²	64	68.3 Å²	68.3	28%	0.278	33%	0.327	S	S	.	.			trans	-78.5	138.3	-179.3	-70.3	177.7	165.8	158.6	0	112.3	S973 N974 A1005 E1008 I1012 W1013	S973-K1010 VanDerWaalsContact O-CD 3.26Å; S973-K1010 WeakPolarHBondContact O-CD 3.33Å; S973-K1010 PolarHBondContact O-NZ 2.67Å; N974-K1010 WeakPolarHBondContact O-CB 3.44Å; A1005-K1010 HydrophobicContact CB-CB 4.5Å; A1005-K1010 PolarHBondContact O-N 2.89Å; E1008-K1010 VanDerWaalsContact C-N 3.3Å; E1008-K1010 HydrophobicContact CB-CD 4.36Å; E1008-K1010 HydrophobicContact CB-CG 4.04Å; E1008-K1010 PolarHBondContact O-N 3.39Å; E1008-K1010 WeakPolarHBondContact OE2-CE 2.75Å; E1008-K1010 IonicContact OE2-NZ 3.91Å; E1008-K1010 PolarHBondContact OE2-NZ 3.48Å; K1010-I1012 PolarHBondContact O-N 2.86Å; K1010-W1013 WeakPolarHBondContact O-CB 3.48Å; K1010-W1013 PolarHBondContact O-N 3.45Å
1011	N	93.7	Very high	81.2	Confident	58 Å²	58	68 Å²	68	31%	0.31	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	46.4	-105.6	169.3	-72.3	-52.2	0	0	0	114.4	N974 G975 L976 W1013 R1014	N974-N1011 PolarHBondContact O-ND2 2.92Å; G975-N1011 WeakPolarHBondContact O-CB 3.39Å; L976-N1011 HydrophobicContact CD2-CB 4.3Å; N1011-W1013 PolarHBondContact O-N 3.38Å; N1011-R1014 VanDerWaalsContact O-CB 3.26Å; N1011-R1014 WeakPolarHBondContact O-CB 3.35Å; N1011-R1014 VanDerWaalsContact O-CD 3.3Å; N1011-R1014 WeakPolarHBondContact O-CD 3.5Å; N1011-R1014 WeakPolarHBondContact O-CG 3.31Å; N1011-R1014 PolarHBondContact O-N 3.37Å; N1011-R1014 VanDerWaalsContact O-N 3.12Å; N1011-R1014 PolarHBondContact O-NH1 3.14Å
1012	I	92.5	Very high	79	Confident	11 Å²	11	70.7 Å²	70.7	6%	0.056	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-66.1	-18.3	-178	74.4	-168	0	0	0	112.5	P900 D905 G975 V977 C978 K1010 F1018	P900-I1012 HydrophobicContact CB-CG2 4.01Å; P900-I1012 HydrophobicContact CG-CG2 4.09Å; D905-I1012 HydrophobicContact CB-CG2 4Å; G975-I1012 WeakPolarHBondContact O-CG1 3.33Å; G975-I1012 WeakPolarHBondContact O-CG2 3.21Å; G975-I1012 PolarHBondContact O-N 3.02Å; V977-I1012 WeakPolarHBondContact O-CD1 3.19Å; C978-I1012 HydrophobicContact CB-CD1 4.31Å; K1010-I1012 PolarHBondContact O-N 2.86Å; I1012-F1018 HydrophobicContact CB-CD1 4.3Å; I1012-F1018 HydrophobicContact CB-CE1 3.96Å; I1012-F1018 HydrophobicContact CD1-CE1 3.66Å; I1012-F1018 HydrophobicContact CD1-CZ 4.15Å; I1012-F1018 HydrophobicContact CG1-CD1 4.3Å; I1012-F1018 HydrophobicContact CG1-CE1 3.66Å
1013	W	87.5	Confident	76.3	Confident	2 Å²	2	79 Å²	79	1%	0.008	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-92.9	2	178	-48.4	113.1	0	0	0	113.6	C978 Q1002 K1006 K1010 N1011 Y1015 G1016 D1017 F1018	C978-W1013 HydrophobicContact CB-CH2 3.84Å; C978-W1013 HydrophobicContact CB-CZ2 3.7Å; Q1002-W1013 HydrophobicContact CG-CH2 4.48Å; Q1002-W1013 HydrophobicContact CG-CZ2 3.73Å; K1006-W1013 HydrophobicContact CD-CE3 4.39Å; K1006-W1013 HydrophobicContact CD-CH2 4.5Å; K1006-W1013 HydrophobicContact CD-CZ3 4.37Å; K1006-W1013 VanDerWaalsContact CE-CZ3 3.48Å; K1006-W1013 HydrophobicContact CG-CD2 3.56Å; K1006-W1013 HydrophobicContact CG-CE3 3.77Å; K1006-W1013 HydrophobicContact CG-CG 3.97Å; K1006-W1013 HydrophobicContact CG-CH2 4.38Å; K1006-W1013 HydrophobicContact CG-CZ2 4.2Å; K1006-W1013 HydrophobicContact CG-CZ3 4.19Å; K1010-W1013 WeakPolarHBondContact O-CB 3.48Å; K1010-W1013 PolarHBondContact O-N 3.45Å; N1011-W1013 PolarHBondContact O-N 3.38Å; W1013-Y1015 PolarHBondContact O-N 2.75Å; W1013-Y1015 VanDerWaalsContact O-N 3.08Å; W1013-G1016 PolarHBondContact O-N 3.43Å; W1013-D1017 HydrophobicContact CE3-CB 4.44Å; W1013-D1017 HydrophobicContact CZ3-CB 4.12Å; W1013-D1017 WeakPolarHBondContact CZ3-OD1 3.44Å; W1013-F1018 HydrophobicContact CE3-CD1 4.23Å; W1013-F1018 HydrophobicContact CE3-CE1 4.23Å; W1013-F1018 AromaticContact CH2-CE1 3.95Å; W1013-F1018 HydrophobicContact CH2-CE1 3.95Å; W1013-F1018 AromaticContact CZ3-CD1 3.99Å; W1013-F1018 HydrophobicContact CZ3-CD1 3.99Å; W1013-F1018 AromaticContact CZ3-CE1 3.76Å; W1013-F1018 HydrophobicContact CZ3-CE1 3.76Å
1014	R	87.1	Confident	73.8	Confident	99 Å²	99	82.5 Å²	82.5	37%	0.374	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.3	-175.4	69.9	-169.3	172.7	-98.6	2.9	114.3	D905 R1009 N1011	D905-R1014 IonicContact OD1-CZ 3.79Å; D905-R1014 IonicContact OD1-NH1 3.83Å; D905-R1014 PolarHBondContact OD1-NH1 3.46Å; D905-R1014 IonicContact OD1-NH2 3.73Å; D905-R1014 PolarHBondContact OD1-NH2 3.13Å; D905-R1014 IonicContact OD2-NH1 3.86Å; D905-R1014 IonicContact OD2-NH2 3.18Å; R1009-R1014 VanDerWaalsContact O-CA 3.27Å; R1009-R1014 WeakPolarHBondContact O-CA 3.28Å; N1011-R1014 VanDerWaalsContact O-CB 3.26Å; N1011-R1014 WeakPolarHBondContact O-CB 3.35Å; N1011-R1014 VanDerWaalsContact O-CD 3.3Å; N1011-R1014 WeakPolarHBondContact O-CD 3.5Å; N1011-R1014 WeakPolarHBondContact O-CG 3.31Å; N1011-R1014 PolarHBondContact O-N 3.37Å; N1011-R1014 VanDerWaalsContact O-N 3.12Å; N1011-R1014 PolarHBondContact O-NH1 3.14Å
1015	Y	84.5	Confident	71.4	Confident	204 Å²	204	88.7 Å²	88.7	80%	0.8	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.3	6.9	179.4	-55.3	-53	0	0	0	113.7	W1013	W1013-Y1015 PolarHBondContact O-N 2.75Å; W1013-Y1015 VanDerWaalsContact O-N 3.08Å
1016	G	78.5	Confident	70.6	Confident	33 Å²	33	93.1 Å²	93.1	34%	0.34	44%	0.441	S	S	.	.	S	Bend	trans	109.4	-171.3	-173.2	0	0	0	0	0	113.6	W1013 F1018	W1013-G1016 PolarHBondContact O-N 3.43Å; G1016-F1018 PolarHBondContact O-N 3.04Å
1017	D	77	Confident	69.9	Low	43 Å²	43	94.9 Å²	94.9	23%	0.23	45%	0.45	C	S	.	.			trans	-80.1	97.5	177.9	-166	-25.9	0	0	0	111.1	K1006 W1013 R1019 T1020	K1006-D1017 WeakPolarHBondContact CE-OD2 3.49Å; K1006-D1017 IonicContact NZ-OD2 3.26Å; K1006-D1017 PolarHBondContact NZ-OD2 3.13Å; W1013-D1017 HydrophobicContact CE3-CB 4.44Å; W1013-D1017 HydrophobicContact CZ3-CB 4.12Å; W1013-D1017 WeakPolarHBondContact CZ3-OD1 3.44Å; D1017-R1019 PolarHBondContact O-N 2.87Å; D1017-R1019 VanDerWaalsContact O-N 3.16Å; D1017-R1019 VanDerWaalsContact OD1-CB 3.31Å; D1017-R1019 WeakPolarHBondContact OD1-CB 3.24Å; D1017-R1019 IonicContact OD1-CZ 3.34Å; D1017-R1019 PolarHBondContact OD1-N 3.03Å; D1017-R1019 IonicContact OD1-NE 3.71Å; D1017-R1019 PolarHBondContact OD1-NE 3.26Å; D1017-R1019 IonicContact OD1-NH2 4Å; D1017-R1019 IonicContact OD2-CZ 2.65Å; D1017-R1019 IonicContact OD2-NE 2.83Å; D1017-R1019 IonicContact OD2-NH2 3Å; D1017-R1019 PolarHBondContact OD2-NH2 3.3Å; D1017-T1020 PolarHBondContact O-N 3.39Å; D1017-T1020 PolarHBondContact O-OG1 2.83Å
1018	F	75.1	Confident	69.1	Low	40 Å²	40	90.1 Å²	90.1	18%	0.175	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.1	179.7	68.4	-88.4	0	0	0	113.7	P900 P901 I1012 W1013 G1016 T1020 D1021	P900-F1018 HydrophobicContact CB-CZ 4.45Å; P901-F1018 HydrophobicContact CG-CD2 4.03Å; P901-F1018 HydrophobicContact CG-CE2 3.9Å; I1012-F1018 HydrophobicContact CB-CD1 4.3Å; I1012-F1018 HydrophobicContact CB-CE1 3.96Å; I1012-F1018 HydrophobicContact CD1-CE1 3.66Å; I1012-F1018 HydrophobicContact CD1-CZ 4.15Å; I1012-F1018 HydrophobicContact CG1-CD1 4.3Å; I1012-F1018 HydrophobicContact CG1-CE1 3.66Å; W1013-F1018 HydrophobicContact CE3-CD1 4.23Å; W1013-F1018 HydrophobicContact CE3-CE1 4.23Å; W1013-F1018 AromaticContact CH2-CE1 3.95Å; W1013-F1018 HydrophobicContact CH2-CE1 3.95Å; W1013-F1018 AromaticContact CZ3-CD1 3.99Å; W1013-F1018 HydrophobicContact CZ3-CD1 3.99Å; W1013-F1018 AromaticContact CZ3-CE1 3.76Å; W1013-F1018 HydrophobicContact CZ3-CE1 3.76Å; G1016-F1018 PolarHBondContact O-N 3.04Å; F1018-T1020 VanDerWaalsContact C-N 3.26Å; F1018-T1020 PolarHBondContact O-N 3.2Å; F1018-D1021 WeakPolarHBondContact O-CB 3.43Å; F1018-D1021 PolarHBondContact O-N 3.41Å; F1018-D1021 VanDerWaalsContact O-N 3.08Å
1019	R	67.7	Low	68	Low	33 Å²	33	89.6 Å²	89.6	13%	0.125	43%	0.43	C	S	.	.	H	α-helix	trans	-73.6	-21	-176.1	-61.7	173.1	-62.6	161.4	19.1	112.5	Y743 V979 D1017 D1021 V1022	Y743-R1019 PolarHBondContact OH-NH2 3.14Å; V979-R1019 PolarHBondContact O-NH1 3.43Å; D1017-R1019 PolarHBondContact O-N 2.87Å; D1017-R1019 VanDerWaalsContact O-N 3.16Å; D1017-R1019 VanDerWaalsContact OD1-CB 3.31Å; D1017-R1019 WeakPolarHBondContact OD1-CB 3.24Å; D1017-R1019 IonicContact OD1-CZ 3.34Å; D1017-R1019 PolarHBondContact OD1-N 3.03Å; D1017-R1019 IonicContact OD1-NE 3.71Å; D1017-R1019 PolarHBondContact OD1-NE 3.26Å; D1017-R1019 IonicContact OD1-NH2 4Å; D1017-R1019 IonicContact OD2-CZ 2.65Å; D1017-R1019 IonicContact OD2-NE 2.83Å; D1017-R1019 IonicContact OD2-NH2 3Å; D1017-R1019 PolarHBondContact OD2-NH2 3.3Å; R1019-D1021 PolarHBondContact O-N 3.08Å; R1019-V1022 PolarHBondContact O-N 3.11Å; R1019-V1022 VanDerWaalsContact O-N 3.17Å
1020	T	55.4	Low	66.7	Low	94 Å²	94	84 Å²	84	58%	0.577	41%	0.414	S	S	*	.	H	α-helix	trans	-64	-14.3	169.3	62.6	0	0	0	0	113.3	R408 D1017 F1018	R408-T1020 PolarHBondContact NH2-O 3.11Å; D1017-T1020 PolarHBondContact O-N 3.39Å; D1017-T1020 PolarHBondContact O-OG1 2.83Å; F1018-T1020 VanDerWaalsContact C-N 3.26Å; F1018-T1020 PolarHBondContact O-N 3.2Å
1021	D	46	Very low	65.4	Low	75 Å²	75	85.3 Å²	85.3	40%	0.401	42%	0.423	S	S	.	.	H	α-helix	trans	-89.1	-25.7	173.9	-59.5	-55	0	0	0	113.9	R408 F1018 R1019	R408-D1021 IonicContact CZ-OD1 3.85Å; R408-D1021 IonicContact NE-OD1 3.51Å; R408-D1021 PolarHBondContact NE-OD1 3.36Å; R408-D1021 VanDerWaalsContact NH2-CA 3.27Å; R408-D1021 IonicContact NH2-OD1 2.7Å; R408-D1021 PolarHBondContact NH2-OD1 2.99Å; F1018-D1021 WeakPolarHBondContact O-CB 3.43Å; F1018-D1021 PolarHBondContact O-N 3.41Å; F1018-D1021 VanDerWaalsContact O-N 3.08Å; R1019-D1021 PolarHBondContact O-N 3.08Å
1022	V	40.4	Very low	63.4	Low	65 Å²	65	87.3 Å²	87.3	39%	0.394	43%	0.431	S	S	.	.	H	α-helix	trans	-79.8	-30	-170.6	-176.9	0	0	0	0	112.8	P901 R1019 Q1024 L1025	P901-V1022 HydrophobicContact CG-CG2 4.19Å; R1019-V1022 PolarHBondContact O-N 3.11Å; R1019-V1022 VanDerWaalsContact O-N 3.17Å; V1022-Q1024 PolarHBondContact O-N 3.05Å; V1022-L1025 PolarHBondContact O-N 3.46Å; V1022-L1025 VanDerWaalsContact O-N 3.11Å
1023	E	34.8	Very low	61.1	Low	187 Å²	187	93.2 Å²	93.2	87%	0.874	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-3.8	175.1	-70.7	-171.1	161.6	0	0	114.2
1024	Q	31.1	Very low	58.9	Low	127 Å²	127	100.8 Å²	100.8	59%	0.593	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-9.4	175.7	-61.4	-162.1	-14.5	0	0	114.5	V1022	V1022-Q1024 PolarHBondContact O-N 3.05Å
1025	L	29.6	Very low	56.4	Low	209 Å²	209	100.9 Å²	100.9	100%	1.094	51%	0.509	S	S	*	.			trans	-98.9	0	173.8	-78.5	163.4	0	0	0	109.6	V1022	V1022-L1025 PolarHBondContact O-N 3.46Å; V1022-L1025 VanDerWaalsContact O-N 3.11Å

Retrieved 1,025 of 1,025 residues in 510 ms (Link to these results)

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