A0A096N475_PAPAN Loading...

ADNP homeobox 2

AlphaFold DB , UniProt , Accession A0A096N475, Species PAPAN (Papio anubis, Olive baboon), Gene ADNP2, Length 1,125 aa.

						>A0A096N475_PAPAN|A0A096N475|ADNP2
MFQIPVENLDNIRKVRRKVKGILVDIGLDSCKELLKDLKGFDPGEKYFHNTSWGDVSLWEPSGKKVRYRTKPYCCGLCKYSTKVLTSFKNHLHRYHEDEIDQELVIPCPNCVFASQPKVVGRHFRMFHAPVRKVQNYTVNILGETKSSRSDVISFTCLKCNFSNTLYYSMKKHVLVAHFHYLINSYFGLRTEEMDEQPKTNDTLSIEKIPPPDKYFCKKCNANASSQDALMYHILTSDIHRDLENKLRSVISEHIKRTGLLKQTHIAPKPAAHLAAPANGSAPSAPAPPPCFHLALPQNSPSPAAGQPVTVAQGAPGSLTHSPPAAGQSHMTLVSSPLPVGQNSLTLQPPAPQPVFLSHGVPLHQSVNPPVLPLSQPVGPVNKSVGTSVLPINQTVRPGVLPLTQPVGPINRPVGPGVLPVSPSVTPGVLQAVSPGVLSVSRAVPSGVLPAGQMTPAGVIPGQTATSGVLPTGQMVQSGVLPVGQTAPSRVLPPGQTAPLRVLPAGQVVPSGLLSPSQTVSSSAVVPVNQGMNSGVLQLSQPVVSGVLPVGQPVRPGVLQLNQTVGTNILPVNQPVRPGASQNTTFLTSGSILRQLIPTGKQVNGIPTYTLAPVSVTLPVPPGGLATVAPPQMPIQLLPSGAAAPMAGSMPGMPSPPVLVTAAQSVFVPASSSATDTNQVLRQAKQWKTCPVCNELFPSNVYQVHMEVAHKHSESKSGEKLEPEKLAACAPFLKWMREKTVRCLSCKCLVSEEELIHHLLMHGLGCLFCPCTFHDIKGLSEHSRNRHLGKKKLPMDYSNRGFQLDVDANGNLLFPHLDFITILPKEKLGEREVYLAILAGIHSKSLVPVYVKVRPQAEGTPGSTGKRVSTCPFCFGPFVTTEAYELHLKERHHIMPTVHTVLKSPAFKCIHCCGVYTGNMTLAAIAVHLVRCRSAPKDSSSDLQVQPDFIQNSELLLVNGEVIHDSSFSVKRKLPDGHLGAEDLRRGEEQPPILNADAAPGPEKVTSVVPFKRQRNESRTEGPIVKDEALQILALDPKKYEGRSYEEKKQFLKDYFHKKPYPSKKEIELLSSLFWVWKIDVASFFGKRRYICMKAIKNHKPSVLLGFDMSELKNVKHRLNFEYEP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.3	Very low	46.2	Very low	232 Å²	232	140 Å²	140	100%	1.143	71%	0.714	S	S	*	*				0	142.4	0	-65.6	150.2	65.9	0	0	109.2
2	F	31	Very low	47.3	Very low	211 Å²	211	133.3 Å²	133.3	93%	0.925	68%	0.68	S	S	*	*			trans	-140.4	146.5	163.3	-89.9	-73.3	0	0	0	110.1
3	Q	37.3	Very low	48.4	Very low	176 Å²	176	134 Å²	134	82%	0.822	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-101.2	147.2	-162.9	-144.4	164.9	14.9	0	0	111.2
4	I	37.2	Very low	49.3	Very low	145 Å²	145	135.4 Å²	135.4	74%	0.744	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-64.6	143.7	177.1	-62.3	176	0	0	0	109.3	V6	I4-V6 WeakPolarHBondContact O-CG2 3.27Å; I4-V6 PolarHBondContact O-N 2.92Å; I4-V6 VanDerWaalsContact O-N 3.16Å
5	P	42.8	Very low	50.3	Low	122 Å²	122	132.3 Å²	132.3	79%	0.792	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-57.9	119.4	173.8	-22.6	33.8	0	0	0	110.5
6	V	48.9	Very low	51.1	Low	82 Å²	82	135.1 Å²	135.1	50%	0.497	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-92.5	117.3	-179.1	-148.5	0	0	0	0	109.2	I4 L9 I12	I4-V6 WeakPolarHBondContact O-CG2 3.27Å; I4-V6 PolarHBondContact O-N 2.92Å; I4-V6 VanDerWaalsContact O-N 3.16Å; V6-L9 VanDerWaalsContact O-CD2 3.27Å; V6-L9 WeakPolarHBondContact O-CD2 3.38Å; V6-L9 WeakPolarHBondContact O-CG 3.31Å; V6-I12 HydrophobicContact CB-CD1 3.87Å; V6-I12 HydrophobicContact CG1-CD1 3.36Å
7	E	53.8	Low	52.1	Low	172 Å²	172	139.5 Å²	139.5	80%	0.804	67%	0.669	S	S	*	*	S	Bend	trans	-71.5	170.7	171.6	-66.3	177.5	171.6	0	0	110.5	L9 I12	E7-L9 VanDerWaalsContact C-N 3.28Å; E7-L9 PolarHBondContact O-N 2.91Å; E7-I12 VanDerWaalsContact O-CD1 3.27Å; E7-I12 WeakPolarHBondContact O-CD1 3.36Å
8	N	50.2	Low	53	Low	123 Å²	123	140.8 Å²	140.8	66%	0.658	67%	0.671	S	S	*	*			trans	55.9	38.3	-170.3	-84	-54.5	0	0	0	114.4	D10 N11 I12	N8-D10 PolarHBondContact O-N 2.72Å; N8-N11 PolarHBondContact O-N 3.41Å; N8-I12 WeakPolarHBondContact O-CG1 3.3Å; N8-I12 PolarHBondContact O-N 2.83Å
9	L	56.3	Low	53.8	Low	84 Å²	84	136.8 Å²	136.8	44%	0.44	66%	0.656	S	S	.	*	H	α-helix	trans	-48.7	-33.3	178.8	-76.5	-179.6	0	0	0	114.1	V6 E7 I12 R13	V6-L9 VanDerWaalsContact O-CD2 3.27Å; V6-L9 WeakPolarHBondContact O-CD2 3.38Å; V6-L9 WeakPolarHBondContact O-CG 3.31Å; E7-L9 VanDerWaalsContact C-N 3.28Å; E7-L9 PolarHBondContact O-N 2.91Å; L9-I12 CarbonylContact O-C 3.5Å; L9-R13 WeakPolarHBondContact O-CB 3.33Å; L9-R13 VanDerWaalsContact O-CD 3.25Å; L9-R13 WeakPolarHBondContact O-CD 3.34Å; L9-R13 WeakPolarHBondContact O-CG 3.37Å; L9-R13 PolarHBondContact O-N 3.2Å
10	D	56.8	Low	54.8	Low	101 Å²	101	136.5 Å²	136.5	54%	0.54	65%	0.652	S	S	.	*	H	α-helix	trans	-83	-32.7	-175.8	-66.8	-63.4	0	0	0	114.1	N8 R13 K14	N8-D10 PolarHBondContact O-N 2.72Å; D10-R13 PolarHBondContact O-N 2.86Å; D10-R13 WeakPolarHBondContact OD1-CD 3.36Å; D10-R13 IonicContact OD1-CZ 2.6Å; D10-R13 IonicContact OD1-NE 3.99Å; D10-R13 IonicContact OD1-NH1 3.96Å; D10-R13 PolarHBondContact OD1-NH1 2.94Å; D10-R13 IonicContact OD2-NH1 3.48Å; D10-K14 WeakPolarHBondContact O-CG 3.26Å; D10-K14 PolarHBondContact O-N 3.06Å
11	N	57.9	Low	55.8	Low	92 Å²	92	131.2 Å²	131.2	49%	0.492	63%	0.634	S	S	.	*	H	α-helix	trans	-66.5	-40.9	164.2	-83.8	-16.1	0	0	0	110.6	N8 R13 K14 V15	N8-N11 PolarHBondContact O-N 3.41Å; N11-R13 VanDerWaalsContact C-N 3.32Å; N11-R13 PolarHBondContact O-N 2.91Å; N11-K14 PolarHBondContact O-N 2.86Å; N11-V15 WeakPolarHBondContact O-CG2 3.33Å; N11-V15 PolarHBondContact O-N 3.21Å
12	I	59.3	Low	57.5	Low	60 Å²	60	124.2 Å²	124.2	31%	0.308	60%	0.6	S	S	.	*	H	α-helix	trans	-62.6	-37.8	173.1	-64.6	168.2	0	0	0	111	V6 E7 N8 L9 R16	V6-I12 HydrophobicContact CB-CD1 3.87Å; V6-I12 HydrophobicContact CG1-CD1 3.36Å; E7-I12 VanDerWaalsContact O-CD1 3.27Å; E7-I12 WeakPolarHBondContact O-CD1 3.36Å; N8-I12 WeakPolarHBondContact O-CG1 3.3Å; N8-I12 PolarHBondContact O-N 2.83Å; L9-I12 CarbonylContact O-C 3.5Å; I12-R16 WeakPolarHBondContact O-CA 3.31Å; I12-R16 WeakPolarHBondContact O-CB 3.34Å; I12-R16 PolarHBondContact O-N 2.99Å
13	R	62	Low	59.3	Low	142 Å²	142	119.6 Å²	119.6	54%	0.536	58%	0.584	S	S	.	*	H	α-helix	trans	-68.7	-36.7	175.5	-75.9	155.6	-179.3	173.5	1.6	112.6	L9 D10 N11 R17	L9-R13 WeakPolarHBondContact O-CB 3.33Å; L9-R13 VanDerWaalsContact O-CD 3.25Å; L9-R13 WeakPolarHBondContact O-CD 3.34Å; L9-R13 WeakPolarHBondContact O-CG 3.37Å; L9-R13 PolarHBondContact O-N 3.2Å; D10-R13 PolarHBondContact O-N 2.86Å; D10-R13 WeakPolarHBondContact OD1-CD 3.36Å; D10-R13 IonicContact OD1-CZ 2.6Å; D10-R13 IonicContact OD1-NE 3.99Å; D10-R13 IonicContact OD1-NH1 3.96Å; D10-R13 PolarHBondContact OD1-NH1 2.94Å; D10-R13 IonicContact OD2-NH1 3.48Å; N11-R13 VanDerWaalsContact C-N 3.32Å; N11-R13 PolarHBondContact O-N 2.91Å; R13-R17 PolarHBondContact O-N 3.03Å
14	K	60.5	Low	61.2	Low	153 Å²	153	114.5 Å²	114.5	67%	0.665	57%	0.565	S	S	*	*	H	α-helix	trans	-61.7	-57.3	171	-75.5	177.1	177.8	179.3	0	110.4	D10 N11 R16 R17 K18	D10-K14 WeakPolarHBondContact O-CG 3.26Å; D10-K14 PolarHBondContact O-N 3.06Å; N11-K14 PolarHBondContact O-N 2.86Å; K14-R16 PolarHBondContact O-N 2.96Å; K14-R17 WeakPolarHBondContact O-CB 3.32Å; K14-R17 PolarHBondContact O-N 3.3Å; K14-R17 VanDerWaalsContact O-N 3.08Å; K14-K18 PolarHBondContact O-N 2.81Å
15	V	63.9	Low	63.1	Low	89 Å²	89	111.6 Å²	111.6	54%	0.539	55%	0.551	S	S	.	*	H	α-helix	trans	-60.7	-43.1	-179.6	174.6	0	0	0	0	111.3	N11 R17 K18 V19	N11-V15 WeakPolarHBondContact O-CG2 3.33Å; N11-V15 PolarHBondContact O-N 3.21Å; V15-R17 PolarHBondContact O-N 2.89Å; V15-K18 CarbonylContact O-C 3.58Å; V15-K18 WeakPolarHBondContact O-CA 3.34Å; V15-K18 PolarHBondContact O-N 3.33Å; V15-V19 HydrophobicContact CG1-CG2 3.79Å; V15-V19 WeakPolarHBondContact O-CG2 3.3Å; V15-V19 PolarHBondContact O-N 2.83Å
16	R	63.3	Low	64.8	Low	178 Å²	178	110.3 Å²	110.3	67%	0.672	54%	0.536	S	S	*	.	H	α-helix	trans	-62.7	-21.7	176.9	-169.6	-179.8	-152.9	167.6	9.4	113.5	I12 K14 K20	I12-R16 WeakPolarHBondContact O-CA 3.31Å; I12-R16 WeakPolarHBondContact O-CB 3.34Å; I12-R16 PolarHBondContact O-N 2.99Å; K14-R16 PolarHBondContact O-N 2.96Å; R16-K20 WeakPolarHBondContact O-CB 3.32Å; R16-K20 PolarHBondContact O-N 3.45Å
17	R	67.4	Low	66.3	Low	209 Å²	209	108 Å²	108	79%	0.789	53%	0.529	S	S	*	.	H	α-helix	trans	-72.8	-44.7	169.6	-160.6	-173.2	-61	-167.6	3.5	110.7	R13 K14 V15 K20 G21	R13-R17 PolarHBondContact O-N 3.03Å; K14-R17 WeakPolarHBondContact O-CB 3.32Å; K14-R17 PolarHBondContact O-N 3.3Å; K14-R17 VanDerWaalsContact O-N 3.08Å; V15-R17 PolarHBondContact O-N 2.89Å; R17-K20 PolarHBondContact O-N 3.24Å; R17-G21 PolarHBondContact O-N 3Å
18	K	69.1	Low	67.5	Low	164 Å²	164	103.9 Å²	103.9	71%	0.713	51%	0.512	S	S	*	.	H	α-helix	trans	-68.1	-44.3	177.1	-159.5	174.8	-174.5	-178.2	0	112.1	K14 V15 K20 G21 I22	K14-K18 PolarHBondContact O-N 2.81Å; V15-K18 CarbonylContact O-C 3.58Å; V15-K18 WeakPolarHBondContact O-CA 3.34Å; V15-K18 PolarHBondContact O-N 3.33Å; K18-K20 PolarHBondContact O-N 3.1Å; K18-G21 WeakPolarHBondContact O-CA 3.28Å; K18-G21 PolarHBondContact O-N 3.37Å; K18-I22 HydrophobicContact CG-CD1 4.38Å; K18-I22 WeakPolarHBondContact O-CG1 3.23Å; K18-I22 PolarHBondContact O-N 3.28Å
19	V	69.1	Low	69	Low	64 Å²	64	102.1 Å²	102.1	39%	0.388	50%	0.502	S	S	.	.	H	α-helix	trans	-65.7	-34	174	173.6	0	0	0	0	111.9	V15 G21 L23	V15-V19 HydrophobicContact CG1-CG2 3.79Å; V15-V19 WeakPolarHBondContact O-CG2 3.3Å; V15-V19 PolarHBondContact O-N 2.83Å; V19-G21 VanDerWaalsContact C-N 3.32Å; V19-L23 HydrophobicContact CG1-CD1 3.82Å; V19-L23 HydrophobicContact CG1-CG 4.24Å; V19-L23 WeakPolarHBondContact O-CB 3.06Å; V19-L23 VanDerWaalsContact O-CG 3.3Å; V19-L23 WeakPolarHBondContact O-CG 3.42Å; V19-L23 PolarHBondContact O-N 2.9Å
20	K	72.5	Confident	70.1	Confident	131 Å²	131	100.6 Å²	100.6	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-67.8	-32.6	169.8	-178.2	-176.1	176.9	-56.5	0	111.8	R16 R17 K18 V24	R16-K20 WeakPolarHBondContact O-CB 3.32Å; R16-K20 PolarHBondContact O-N 3.45Å; R17-K20 PolarHBondContact O-N 3.24Å; K18-K20 PolarHBondContact O-N 3.1Å; K20-V24 HydrophobicContact CG-CG2 4.43Å; K20-V24 WeakPolarHBondContact O-CB 3.21Å; K20-V24 VanDerWaalsContact O-CG2 3.23Å; K20-V24 WeakPolarHBondContact O-CG2 3.23Å; K20-V24 PolarHBondContact O-N 3.41Å; K20-V24 VanDerWaalsContact O-N 3.11Å
21	G	75.3	Confident	70.9	Confident	26 Å²	26	99.7 Å²	99.7	27%	0.268	50%	0.499	S	S	.	.	H	α-helix	trans	-57.1	-67.6	167.4	0	0	0	0	0	109.3	R17 K18 V19 L23 V24 D25	R17-G21 PolarHBondContact O-N 3Å; K18-G21 WeakPolarHBondContact O-CA 3.28Å; K18-G21 PolarHBondContact O-N 3.37Å; V19-G21 VanDerWaalsContact C-N 3.32Å; G21-L23 VanDerWaalsContact C-N 3.27Å; G21-L23 PolarHBondContact O-N 3.38Å; G21-V24 CarbonylContact O-C 3.06Å; G21-V24 WeakPolarHBondContact O-CA 3.44Å; G21-V24 WeakPolarHBondContact O-CB 3.36Å; G21-V24 PolarHBondContact O-N 3.34Å; G21-D25 PolarHBondContact O-N 3.29Å
22	I	72.4	Confident	71.8	Confident	84 Å²	84	100.4 Å²	100.4	43%	0.431	50%	0.498	S	S	.	.	H	α-helix	trans	-50.1	-41.4	-177.5	-62.8	161.1	0	0	0	113.1	K18 D25 I26	K18-I22 HydrophobicContact CG-CD1 4.38Å; K18-I22 WeakPolarHBondContact O-CG1 3.23Å; K18-I22 PolarHBondContact O-N 3.28Å; I22-D25 PolarHBondContact N-OD2 2.89Å; I22-D25 PolarHBondContact O-N 3.11Å; I22-I26 HydrophobicContact CG2-CD1 3.72Å; I22-I26 HydrophobicContact CG2-CG1 4.4Å; I22-I26 WeakPolarHBondContact O-CB 3.32Å; I22-I26 WeakPolarHBondContact O-CD1 3.37Å; I22-I26 WeakPolarHBondContact O-CG1 3.3Å; I22-I26 PolarHBondContact O-N 3.41Å
23	L	69.7	Low	72.7	Confident	114 Å²	114	103.3 Å²	103.3	60%	0.597	51%	0.51	S	S	*	.	H	α-helix	trans	-74.7	-25.6	176.7	-70.8	172.9	0	0	0	114.4	V19 G21 G27	V19-L23 HydrophobicContact CG1-CD1 3.82Å; V19-L23 HydrophobicContact CG1-CG 4.24Å; V19-L23 WeakPolarHBondContact O-CB 3.06Å; V19-L23 VanDerWaalsContact O-CG 3.3Å; V19-L23 WeakPolarHBondContact O-CG 3.42Å; V19-L23 PolarHBondContact O-N 2.9Å; G21-L23 VanDerWaalsContact C-N 3.27Å; G21-L23 PolarHBondContact O-N 3.38Å; L23-G27 PolarHBondContact O-N 3.13Å
24	V	77.4	Confident	73.2	Confident	69 Å²	69	101.2 Å²	101.2	42%	0.418	51%	0.51	S	S	.	.	H	α-helix	trans	-73.7	-43.1	167.1	165.3	0	0	0	0	109.6	K20 G21 G27 L28	K20-V24 HydrophobicContact CG-CG2 4.43Å; K20-V24 WeakPolarHBondContact O-CB 3.21Å; K20-V24 VanDerWaalsContact O-CG2 3.23Å; K20-V24 WeakPolarHBondContact O-CG2 3.23Å; K20-V24 PolarHBondContact O-N 3.41Å; K20-V24 VanDerWaalsContact O-N 3.11Å; G21-V24 CarbonylContact O-C 3.06Å; G21-V24 WeakPolarHBondContact O-CA 3.44Å; G21-V24 WeakPolarHBondContact O-CB 3.36Å; G21-V24 PolarHBondContact O-N 3.34Å; V24-G27 PolarHBondContact O-N 3.11Å; V24-L28 WeakPolarHBondContact O-CB 3.14Å; V24-L28 PolarHBondContact O-N 2.91Å
25	D	76.5	Confident	73.6	Confident	85 Å²	85	98.9 Å²	98.9	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-49.5	-178.2	-52.1	-34.8	0	0	0	110.4	G21 I22 G27 L28 D29	G21-D25 PolarHBondContact O-N 3.29Å; I22-D25 PolarHBondContact N-OD2 2.89Å; I22-D25 PolarHBondContact O-N 3.11Å; D25-G27 PolarHBondContact O-N 2.85Å; D25-L28 PolarHBondContact O-N 3.15Å; D25-D29 PolarHBondContact O-N 3.03Å
26	I	78.9	Confident	73.9	Confident	95 Å²	95	101.8 Å²	101.8	49%	0.487	51%	0.509	S	S	.	.	H	α-helix	trans	-56.7	-47.5	171.8	-69.3	166.2	0	0	0	111.1	I22 L28 D29 S30	I22-I26 HydrophobicContact CG2-CD1 3.72Å; I22-I26 HydrophobicContact CG2-CG1 4.4Å; I22-I26 WeakPolarHBondContact O-CB 3.32Å; I22-I26 WeakPolarHBondContact O-CD1 3.37Å; I22-I26 WeakPolarHBondContact O-CG1 3.3Å; I22-I26 PolarHBondContact O-N 3.41Å; I26-L28 VanDerWaalsContact C-N 3.3Å; I26-L28 PolarHBondContact O-N 3.28Å; I26-D29 PolarHBondContact O-N 3.24Å; I26-S30 PolarHBondContact O-N 2.83Å; I26-S30 PolarHBondContact O-OG 3.28Å
27	G	80.4	Confident	74.1	Confident	33 Å²	33	99 Å²	99	34%	0.34	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-33.1	179.6	0	0	0	0	0	113.3	L23 V24 D25 C31	L23-G27 PolarHBondContact O-N 3.13Å; V24-G27 PolarHBondContact O-N 3.11Å; D25-G27 PolarHBondContact O-N 2.85Å; G27-C31 WeakPolarHBondContact O-CB 3.38Å; G27-C31 PolarHBondContact O-N 3.37Å; G27-C31 PolarHBondContact O-SG 3.36Å
28	L	79.4	Confident	73.7	Confident	86 Å²	86	94.7 Å²	94.7	45%	0.45	50%	0.5	S	S	.	.	H	α-helix	trans	-73.7	-39.1	177.8	-160.2	167.7	0	0	0	110.1	V24 D25 I26 C31 K32	V24-L28 WeakPolarHBondContact O-CB 3.14Å; V24-L28 PolarHBondContact O-N 2.91Å; D25-L28 PolarHBondContact O-N 3.15Å; I26-L28 VanDerWaalsContact C-N 3.3Å; I26-L28 PolarHBondContact O-N 3.28Å; L28-C31 CarbonylContact O-C 3.54Å; L28-C31 WeakPolarHBondContact O-CB 3.26Å; L28-C31 PolarHBondContact O-N 3.46Å; L28-K32 HydrophobicContact CD2-CD 4.23Å; L28-K32 HydrophobicContact CD2-CG 4.23Å; L28-K32 WeakPolarHBondContact O-CG 3.39Å; L28-K32 PolarHBondContact O-N 2.98Å
29	D	81	Confident	73.1	Confident	85 Å²	85	95 Å²	95	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-69.7	-40.7	174	-72.5	-19.4	0	0	0	112.4	D25 I26 C31 K32 E33	D25-D29 PolarHBondContact O-N 3.03Å; I26-D29 PolarHBondContact O-N 3.24Å; D29-C31 VanDerWaalsContact C-N 3.28Å; D29-C31 PolarHBondContact O-N 3.14Å; D29-K32 WeakPolarHBondContact O-CB 3.34Å; D29-K32 PolarHBondContact O-N 3.39Å; D29-K32 VanDerWaalsContact O-N 3.07Å; D29-K32 WeakPolarHBondContact OD1-CD 3.5Å; D29-K32 WeakPolarHBondContact OD1-CE 3.31Å; D29-K32 IonicContact OD1-NZ 3.63Å; D29-K32 PolarHBondContact OD1-NZ 3.35Å; D29-E33 WeakPolarHBondContact O-CB 3.42Å; D29-E33 PolarHBondContact O-N 3.36Å
30	S	78.4	Confident	72.5	Confident	52 Å²	52	95.4 Å²	95.4	36%	0.364	52%	0.518	S	S	.	.	H	α-helix	trans	-59.7	-37.8	168.5	-61.5	0	0	0	0	112.2	I26 E33 L34	I26-S30 PolarHBondContact O-N 2.83Å; I26-S30 PolarHBondContact O-OG 3.28Å; S30-E33 PolarHBondContact O-N 2.88Å; S30-L34 WeakPolarHBondContact O-CB 3.48Å; S30-L34 PolarHBondContact O-N 3.26Å
31	C	74.3	Confident	71.9	Confident	82 Å²	82	97.2 Å²	97.2	55%	0.554	53%	0.526	S	S	*	.	H	α-helix	trans	-68.1	-33.6	172.5	-76.2	0	0	0	0	113	G27 L28 D29 E33 L35	G27-C31 WeakPolarHBondContact O-CB 3.38Å; G27-C31 PolarHBondContact O-N 3.37Å; G27-C31 PolarHBondContact O-SG 3.36Å; L28-C31 CarbonylContact O-C 3.54Å; L28-C31 WeakPolarHBondContact O-CB 3.26Å; L28-C31 PolarHBondContact O-N 3.46Å; D29-C31 VanDerWaalsContact C-N 3.28Å; D29-C31 PolarHBondContact O-N 3.14Å; C31-E33 VanDerWaalsContact C-N 3.32Å; C31-L35 WeakPolarHBondContact O-CB 3.15Å; C31-L35 PolarHBondContact O-N 3.48Å
32	K	76.5	Confident	70.7	Confident	107 Å²	107	102.9 Å²	102.9	47%	0.465	55%	0.55	S	S	.	*	H	α-helix	trans	-67.6	-33.9	171.6	-71.5	171.1	-171.7	151.1	0	111.9	L28 D29 K36	L28-K32 HydrophobicContact CD2-CD 4.23Å; L28-K32 HydrophobicContact CD2-CG 4.23Å; L28-K32 WeakPolarHBondContact O-CG 3.39Å; L28-K32 PolarHBondContact O-N 2.98Å; D29-K32 WeakPolarHBondContact O-CB 3.34Å; D29-K32 PolarHBondContact O-N 3.39Å; D29-K32 VanDerWaalsContact O-N 3.07Å; D29-K32 WeakPolarHBondContact OD1-CD 3.5Å; D29-K32 WeakPolarHBondContact OD1-CE 3.31Å; D29-K32 IonicContact OD1-NZ 3.63Å; D29-K32 PolarHBondContact OD1-NZ 3.35Å; K32-K36 WeakPolarHBondContact O-CG 3.39Å; K32-K36 PolarHBondContact O-N 2.98Å; K32-K36 VanDerWaalsContact O-N 3.14Å
33	E	78.5	Confident	69.8	Low	121 Å²	121	102.1 Å²	102.1	57%	0.565	55%	0.551	S	S	*	*	H	α-helix	trans	-69	-54.6	177.7	-164.2	159	-130.5	0	0	110.2	D29 S30 C31 L35 K36 D37	D29-E33 WeakPolarHBondContact O-CB 3.42Å; D29-E33 PolarHBondContact O-N 3.36Å; S30-E33 PolarHBondContact O-N 2.88Å; C31-E33 VanDerWaalsContact C-N 3.32Å; E33-L35 PolarHBondContact O-N 2.73Å; E33-L35 VanDerWaalsContact O-N 3.17Å; E33-K36 WeakPolarHBondContact O-CA 3.23Å; E33-K36 WeakPolarHBondContact O-CB 3.49Å; E33-K36 PolarHBondContact O-N 3.39Å; E33-D37 PolarHBondContact O-N 2.89Å; E33-D37 VanDerWaalsContact O-N 3.12Å
34	L	71.9	Confident	69.1	Low	99 Å²	99	98 Å²	98	52%	0.518	54%	0.535	S	S	.	.	H	α-helix	trans	-54.8	-33.9	170	-83.7	153.4	0	0	0	113.3	S30 K36 D37 L38	S30-L34 WeakPolarHBondContact O-CB 3.48Å; S30-L34 PolarHBondContact O-N 3.26Å; L34-K36 VanDerWaalsContact C-N 3.34Å; L34-D37 PolarHBondContact O-N 2.88Å; L34-L38 VanDerWaalsContact O-CB 3.31Å; L34-L38 WeakPolarHBondContact O-CB 3.36Å; L34-L38 WeakPolarHBondContact O-CD1 3.47Å; L34-L38 VanDerWaalsContact O-CG 3.23Å; L34-L38 WeakPolarHBondContact O-CG 3.39Å; L34-L38 PolarHBondContact O-N 3.13Å
35	L	68.9	Low	68.1	Low	104 Å²	104	102.2 Å²	102.2	55%	0.545	55%	0.551	S	S	.	*	H	α-helix	trans	-72.8	-22.3	175.1	-173.9	64	0	0	0	113.4	C31 E33 K39	C31-L35 WeakPolarHBondContact O-CB 3.15Å; C31-L35 PolarHBondContact O-N 3.48Å; E33-L35 PolarHBondContact O-N 2.73Å; E33-L35 VanDerWaalsContact O-N 3.17Å; L35-K39 WeakPolarHBondContact O-CB 3.17Å; L35-K39 VanDerWaalsContact O-CG 3.28Å; L35-K39 WeakPolarHBondContact O-CG 3.49Å; L35-K39 PolarHBondContact O-N 3.06Å
36	K	71.6	Confident	67	Low	150 Å²	150	105.2 Å²	105.2	65%	0.652	56%	0.56	S	S	*	*	H	α-helix	trans	-75.1	-41.6	168.6	-68.9	166.1	-176.2	175.3	0	110.5	K32 E33 L34 K39	K32-K36 WeakPolarHBondContact O-CG 3.39Å; K32-K36 PolarHBondContact O-N 2.98Å; K32-K36 VanDerWaalsContact O-N 3.14Å; E33-K36 WeakPolarHBondContact O-CA 3.23Å; E33-K36 WeakPolarHBondContact O-CB 3.49Å; E33-K36 PolarHBondContact O-N 3.39Å; L34-K36 VanDerWaalsContact C-N 3.34Å; K36-K39 WeakPolarHBondContact O-CB 3.15Å; K36-K39 PolarHBondContact O-N 3.33Å
37	D	66.1	Low	65.7	Low	119 Å²	119	108 Å²	108	64%	0.636	57%	0.565	S	S	*	*	H	α-helix	trans	-65	-43.7	178	-57.9	-25.7	0	0	0	111.3	E33 L34 K39 G40	E33-D37 PolarHBondContact O-N 2.89Å; E33-D37 VanDerWaalsContact O-N 3.12Å; L34-D37 PolarHBondContact O-N 2.88Å; D37-K39 VanDerWaalsContact C-N 3.29Å; D37-K39 PolarHBondContact O-N 2.66Å; D37-G40 PolarHBondContact O-N 3.26Å
38	L	59	Low	64.2	Low	119 Å²	119	113.7 Å²	113.7	62%	0.623	58%	0.581	S	S	*	*	H	α-helix	trans	-71	-18.6	178.1	-71.2	167.6	0	0	0	113.9	L34 G40 F41	L34-L38 VanDerWaalsContact O-CB 3.31Å; L34-L38 WeakPolarHBondContact O-CB 3.36Å; L34-L38 WeakPolarHBondContact O-CD1 3.47Å; L34-L38 VanDerWaalsContact O-CG 3.23Å; L34-L38 WeakPolarHBondContact O-CG 3.39Å; L34-L38 PolarHBondContact O-N 3.13Å; L38-G40 PolarHBondContact O-N 2.99Å; L38-G40 VanDerWaalsContact O-N 3.11Å; L38-F41 PolarHBondContact O-N 3.24Å
39	K	57.5	Low	62.8	Low	171 Å²	171	116.6 Å²	116.6	74%	0.743	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-10.4	176.4	-97.6	177.9	177.4	-167.4	0	114.1	L35 K36 D37 F41	L35-K39 WeakPolarHBondContact O-CB 3.17Å; L35-K39 VanDerWaalsContact O-CG 3.28Å; L35-K39 WeakPolarHBondContact O-CG 3.49Å; L35-K39 PolarHBondContact O-N 3.06Å; K36-K39 WeakPolarHBondContact O-CB 3.15Å; K36-K39 PolarHBondContact O-N 3.33Å; D37-K39 VanDerWaalsContact C-N 3.29Å; D37-K39 PolarHBondContact O-N 2.66Å; K39-F41 VanDerWaalsContact C-N 3.32Å
40	G	56.6	Low	61	Low	72 Å²	72	119.6 Å²	119.6	74%	0.742	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-7.6	172.7	0	0	0	0	0	115.3	D37 L38	D37-G40 PolarHBondContact O-N 3.26Å; L38-G40 PolarHBondContact O-N 2.99Å; L38-G40 VanDerWaalsContact O-N 3.11Å
41	F	58.9	Low	59.4	Low	168 Å²	168	120.5 Å²	120.5	74%	0.737	61%	0.611	S	S	*	*			trans	-138.1	95.5	-173	-156	-99.8	0	0	0	113.2	L38 K39 P43	L38-F41 PolarHBondContact O-N 3.24Å; K39-F41 VanDerWaalsContact C-N 3.32Å; F41-P43 HydrophobicContact CD1-CB 4.33Å; F41-P43 HydrophobicContact CD1-CG 4.08Å; F41-P43 HydrophobicContact CE1-CB 3.86Å; F41-P43 HydrophobicContact CE1-CG 4.01Å; F41-P43 VanDerWaalsContact O-CD 3.26Å; F41-P43 WeakPolarHBondContact O-CD 3.37Å
42	D	49.9	Very low	58	Low	146 Å²	146	122.9 Å²	122.9	78%	0.781	63%	0.629	S	S	*	*			trans	-103	96	167.1	178.7	15.2	0	0	0	110.3	G44	D42-G44 PolarHBondContact O-N 2.91Å; D42-G44 WeakPolarHBondContact OD1-CA 3.15Å; D42-G44 PolarHBondContact OD1-N 3.14Å
43	P	53.6	Low	56.5	Low	68 Å²	68	127.2 Å²	127.2	44%	0.442	64%	0.643	S	S	.	*			trans	-80.7	70.8	172.2	35	-33.3	0	0	0	109	F41 Y47	F41-P43 HydrophobicContact CD1-CB 4.33Å; F41-P43 HydrophobicContact CD1-CG 4.08Å; F41-P43 HydrophobicContact CE1-CB 3.86Å; F41-P43 HydrophobicContact CE1-CG 4.01Å; F41-P43 VanDerWaalsContact O-CD 3.26Å; F41-P43 WeakPolarHBondContact O-CD 3.37Å; P43-Y47 HydrophobicContact CB-CD2 4.18Å
44	G	55.3	Low	54.9	Low	26 Å²	26	124.5 Å²	124.5	27%	0.268	65%	0.647	S	S	.	*			trans	-47.1	160	-162.7	0	0	0	0	0	117.5	D42 K46 Y47	D42-G44 PolarHBondContact O-N 2.91Å; D42-G44 WeakPolarHBondContact OD1-CA 3.15Å; D42-G44 PolarHBondContact OD1-N 3.14Å; G44-K46 VanDerWaalsContact O-CG 3.32Å; G44-K46 WeakPolarHBondContact O-CG 3.29Å; G44-K46 PolarHBondContact O-N 3.41Å; G44-Y47 PolarHBondContact O-N 3.15Å
45	E	57.1	Low	53.2	Low	158 Å²	158	124.1 Å²	124.1	74%	0.738	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-36	-30.6	-158.8	-57.9	-180	149.7	0	0	118.3	Y47 F48 H49	E45-Y47 PolarHBondContact O-N 2.84Å; E45-F48 WeakPolarHBondContact O-CB 3.39Å; E45-F48 PolarHBondContact O-N 3.01Å; E45-H49 PolarHBondContact O-CD2 2.69Å; E45-H49 VanDerWaalsContact O-CD2 3.26Å
46	K	53.2	Low	52.2	Low	149 Å²	149	125.3 Å²	125.3	65%	0.648	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-51.6	-26.2	176.1	63.9	175.5	179.2	-177.5	0	115	G44	G44-K46 VanDerWaalsContact O-CG 3.32Å; G44-K46 WeakPolarHBondContact O-CG 3.29Å; G44-K46 PolarHBondContact O-N 3.41Å
47	Y	51.2	Low	50.6	Low	152 Å²	152	123 Å²	123	60%	0.596	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-87.3	-21.9	175.5	-63.4	-61	0	0	0	113.7	P43 G44 E45	P43-Y47 HydrophobicContact CB-CD2 4.18Å; G44-Y47 PolarHBondContact O-N 3.15Å; E45-Y47 PolarHBondContact O-N 2.84Å
48	F	48.6	Very low	49.3	Very low	153 Å²	153	124 Å²	124	67%	0.671	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-73.7	-37.5	-174.4	-154.5	-96.8	0	0	0	112.1	E45 N50	E45-F48 WeakPolarHBondContact O-CB 3.39Å; E45-F48 PolarHBondContact O-N 3.01Å; F48-N50 VanDerWaalsContact C-N 3.29Å; F48-N50 PolarHBondContact O-N 3.16Å
49	H	49.9	Very low	48.3	Very low	147 Å²	147	129.4 Å²	129.4	68%	0.681	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-70.5	-16.2	-174.9	-63.5	-64.5	0	0	0	115.4	E45	E45-H49 PolarHBondContact O-CD2 2.69Å; E45-H49 VanDerWaalsContact O-CD2 3.26Å
50	N	44.2	Very low	47.1	Very low	148 Å²	148	127.5 Å²	127.5	79%	0.791	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-96.1	5.2	-174.8	-76.4	-6.8	0	0	0	114.6	F48	F48-N50 VanDerWaalsContact C-N 3.29Å; F48-N50 PolarHBondContact O-N 3.16Å
51	T	45.6	Very low	46.2	Very low	72 Å²	72	130.6 Å²	130.6	44%	0.442	68%	0.677	S	S	.	*	S	Bend	trans	-132.6	116.1	175.1	41.6	0	0	0	0	111.1	W53	T51-W53 VanDerWaalsContact C-N 3.31Å; T51-W53 VanDerWaalsContact O-CD1 3.27Å; T51-W53 PolarHBondContact O-N 2.81Å; T51-W53 PolarHBondContact OG1-NE1 2.91Å
52	S	43.4	Very low	45.3	Very low	132 Å²	132	126.3 Å²	126.3	92%	0.923	67%	0.668	S	S	*	*			trans	-76.6	78.5	176.7	61	0	0	0	0	111.2
53	W	45.4	Very low	44.9	Very low	198 Å²	198	122 Å²	122	75%	0.75	66%	0.658	S	S	*	*			trans	-67.7	132.1	170.8	-65.5	93.8	0	0	0	110.3	T51 D55	T51-W53 VanDerWaalsContact C-N 3.31Å; T51-W53 VanDerWaalsContact O-CD1 3.27Å; T51-W53 PolarHBondContact O-N 2.81Å; T51-W53 PolarHBondContact OG1-NE1 2.91Å; W53-D55 PolarHBondContact O-N 2.81Å
54	G	45.8	Very low	44.1	Very low	64 Å²	64	127.6 Å²	127.6	66%	0.66	68%	0.675	S	S	*	*			trans	-67.5	123.2	164.1	0	0	0	0	0	108.6	V56	G54-V56 WeakPolarHBondContact O-CG2 3.09Å; G54-V56 PolarHBondContact O-N 3.31Å
55	D	36.4	Very low	43.4	Very low	91 Å²	91	135.2 Å²	135.2	49%	0.487	70%	0.701	S	S	.	*			trans	-64.2	103.4	-169	-177.5	20.1	0	0	0	112.8	W53 S57 L58	W53-D55 PolarHBondContact O-N 2.81Å; D55-S57 PolarHBondContact O-N 2.75Å; D55-S57 WeakPolarHBondContact OD1-CA 3.31Å; D55-S57 WeakPolarHBondContact OD1-CB 3.29Å; D55-S57 PolarHBondContact OD1-N 3.02Å; D55-S57 PolarHBondContact OD1-OG 2.81Å; D55-L58 HydrophobicContact CB-CD1 4.37Å; D55-L58 PolarHBondContact O-N 2.97Å
56	V	47.2	Very low	42.6	Very low	129 Å²	129	133.4 Å²	133.4	78%	0.782	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-70.6	-13.7	178.5	-166.9	0	0	0	0	111.3	G54 L58	G54-V56 WeakPolarHBondContact O-CG2 3.09Å; G54-V56 PolarHBondContact O-N 3.31Å; V56-L58 VanDerWaalsContact C-N 3.25Å; V56-L58 PolarHBondContact O-N 3.31Å
57	S	37.8	Very low	42.1	Very low	102 Å²	102	137.1 Å²	137.1	71%	0.713	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-68.7	-21.1	176.5	-37.7	0	0	0	0	112.9	D55 W59	D55-S57 PolarHBondContact O-N 2.75Å; D55-S57 WeakPolarHBondContact OD1-CA 3.31Å; D55-S57 WeakPolarHBondContact OD1-CB 3.29Å; D55-S57 PolarHBondContact OD1-N 3.02Å; D55-S57 PolarHBondContact OD1-OG 2.81Å; S57-W59 PolarHBondContact O-N 2.94Å
58	L	39.1	Very low	41.9	Very low	139 Å²	139	139.9 Å²	139.9	73%	0.728	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-73.1	27.5	178	-73.8	172.4	0	0	0	114.4	D55 V56 E60	D55-L58 HydrophobicContact CB-CD1 4.37Å; D55-L58 PolarHBondContact O-N 2.97Å; V56-L58 VanDerWaalsContact C-N 3.25Å; V56-L58 PolarHBondContact O-N 3.31Å; L58-E60 VanDerWaalsContact C-N 3.28Å; L58-E60 PolarHBondContact O-N 2.99Å
59	W	36.9	Very low	42.4	Very low	232 Å²	232	136.3 Å²	136.3	88%	0.879	70%	0.703	S	S	*	*			trans	-75.9	78.1	167	-168.7	-89	0	0	0	110.9	S57 P61	S57-W59 PolarHBondContact O-N 2.94Å; W59-P61 WeakPolarHBondContact O-CD 3.27Å
60	E	32.8	Very low	42.5	Very low	132 Å²	132	135.3 Å²	135.3	62%	0.617	71%	0.708	S	S	*	*			trans	-52.6	127.9	-177.8	-82.9	-154.9	148.2	0	0	113.5	L58 S62 G63	L58-E60 VanDerWaalsContact C-N 3.28Å; L58-E60 PolarHBondContact O-N 2.99Å; E60-S62 PolarHBondContact O-N 3.47Å; E60-S62 WeakPolarHBondContact OE2-CB 3.37Å; E60-S62 PolarHBondContact OE2-OG 3.04Å; E60-G63 PolarHBondContact O-N 3.47Å
61	P	37.6	Very low	43.8	Very low	137 Å²	137	132.1 Å²	132.1	89%	0.89	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-8.8	167	-23.8	35.1	0	0	0	114.3	W59 G63	W59-P61 WeakPolarHBondContact O-CD 3.27Å; P61-G63 PolarHBondContact O-N 3.38Å; P61-G63 VanDerWaalsContact O-N 3.11Å
62	S	40.6	Very low	44.9	Very low	77 Å²	77	133.4 Å²	133.4	54%	0.538	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.9	-14.6	178.8	88	0	0	0	0	113.7	E60 K64	E60-S62 PolarHBondContact O-N 3.47Å; E60-S62 WeakPolarHBondContact OE2-CB 3.37Å; E60-S62 PolarHBondContact OE2-OG 3.04Å; S62-K64 PolarHBondContact O-N 2.94Å
63	G	40.8	Very low	46.3	Very low	56 Å²	56	131.2 Å²	131.2	58%	0.577	67%	0.668	S	S	*	*			trans	-58.3	70.1	175.4	0	0	0	0	0	114.5	E60 P61 K65	E60-G63 PolarHBondContact O-N 3.47Å; P61-G63 PolarHBondContact O-N 3.38Å; P61-G63 VanDerWaalsContact O-N 3.11Å; G63-K65 VanDerWaalsContact C-N 3.31Å; G63-K65 PolarHBondContact O-N 2.91Å
64	K	37.8	Very low	47.5	Very low	185 Å²	185	123.9 Å²	123.9	80%	0.804	65%	0.647	S	S	*	*			trans	-55.5	92.3	168.9	-75.9	176.5	179	170.1	0	108.9	S62 V66	S62-K64 PolarHBondContact O-N 2.94Å; K64-V66 PolarHBondContact O-N 3.2Å
65	K	39.2	Very low	48.9	Very low	187 Å²	187	121 Å²	121	81%	0.813	62%	0.616	S	S	*	*			trans	-32.2	118.1	-173.6	-65.9	-166	176.9	-162	0	110.6	G63 R67	G63-K65 VanDerWaalsContact C-N 3.31Å; G63-K65 PolarHBondContact O-N 2.91Å; K65-R67 PolarHBondContact O-N 2.93Å
66	V	41.8	Very low	50.6	Low	119 Å²	119	119.3 Å²	119.3	72%	0.721	62%	0.621	S	S	*	*			trans	-53.6	102.8	-172.4	-178.8	0	0	0	0	108.6	K64 Y68	K64-V66 PolarHBondContact O-N 3.2Å; V66-Y68 PolarHBondContact O-N 2.84Å
67	R	43	Very low	51.5	Low	228 Å²	228	116 Å²	116	86%	0.86	60%	0.598	S	S	*	*			trans	-59.4	129	-177.6	-70.6	-170	-177.9	-170.8	2.4	107.5	K65 R69	K65-R67 PolarHBondContact O-N 2.93Å; R67-R69 WeakPolarHBondContact O-CG 3.45Å; R67-R69 PolarHBondContact O-N 3.48Å
68	Y	46	Very low	53.3	Low	210 Å²	210	113.1 Å²	113.1	82%	0.824	58%	0.578	S	S	*	*			trans	-47.4	111.3	-177	-144.4	-87.8	0	0	0	109.7	V66 T70	V66-Y68 PolarHBondContact O-N 2.84Å; Y68-T70 PolarHBondContact O-N 2.9Å
69	R	59.3	Low	55.1	Low	77 Å²	77	115.2 Å²	115.2	29%	0.291	58%	0.581	S	S	.	*			trans	-80.4	111	-166.4	-59.6	-169.9	-173.5	-156.9	16	109.5	R67 K71 C74 C75 C78 Y80	R67-R69 WeakPolarHBondContact O-CG 3.45Å; R67-R69 PolarHBondContact O-N 3.48Å; R69-K71 PolarHBondContact O-N 3.11Å; R69-K71 VanDerWaalsContact O-N 3.11Å; R69-C74 WeakPolarHBondContact CB-SG 3.2Å; R69-C74 WeakPolarHBondContact CD-SG 3.3Å; R69-C75 PolarHBondContact NH1-O 3.19Å; R69-C75 PolarHBondContact NH2-O 3.37Å; R69-C78 VanDerWaalsContact CZ-O 3.29Å; R69-C78 PolarHBondContact NH1-O 2.75Å; R69-C78 PolarHBondContact NH2-O 2.91Å; R69-Y80 PolarHBondContact NH1-O 3.17Å
70	T	52.8	Low	57	Low	126 Å²	126	108 Å²	108	77%	0.773	55%	0.554	S	S	*	*			trans	-81.3	19.2	-168.3	51.7	0	0	0	0	115.2	Y68	Y68-T70 PolarHBondContact O-N 2.9Å
71	K	70.4	Confident	59.2	Low	82 Å²	82	103 Å²	103	36%	0.357	53%	0.533	S	S	.	.	S	Bend	trans	-135.6	143.6	-176.5	-50.8	-178.5	-163.3	170.1	0	110.6	R69 Y73 C74 S81 T82 K83	R69-K71 PolarHBondContact O-N 3.11Å; R69-K71 VanDerWaalsContact O-N 3.11Å; K71-Y73 PolarHBondContact O-N 3.27Å; K71-C74 PolarHBondContact O-SG 3.34Å; K71-S81 WeakPolarHBondContact CD-O 3.49Å; K71-S81 PolarHBondContact NZ-O 3.18Å; K71-T82 WeakPolarHBondContact CB-O 3.47Å; K71-K83 HydrophobicContact CB-CG 4.36Å; K71-K83 HydrophobicContact CD-CG 4.41Å; K71-K83 HydrophobicContact CG-CG 4.3Å
72	P	68.6	Low	61.3	Low	98 Å²	98	97.1 Å²	97.1	64%	0.636	50%	0.495	S	S	*	.	S	Bend	trans	-67.5	-28.6	-169.1	25.7	-35.6	0	0	0	114.7
73	Y	72.4	Confident	63	Low	86 Å²	86	101 Å²	101	34%	0.337	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	109.6	178.4	-53.4	-73.9	0	0	0	109.6	K71 S81 T82 L85 F88	K71-Y73 PolarHBondContact O-N 3.27Å; Y73-S81 CarbonylContact O-C 3.56Å; Y73-S81 VanDerWaalsContact O-CA 3.28Å; Y73-S81 WeakPolarHBondContact O-CA 3.36Å; Y73-T82 PolarHBondContact N-O 3.5Å; Y73-T82 PolarHBondContact O-N 3.14Å; Y73-L85 HydrophobicContact CD1-CD1 4.06Å; Y73-L85 HydrophobicContact CE1-CB 4.36Å; Y73-L85 HydrophobicContact CE1-CD1 3.86Å; Y73-L85 HydrophobicContact CE2-CB 4.22Å; Y73-F88 HydrophobicContact CG-CB 4.35Å
74	C	71.3	Confident	64.5	Low	45 Å²	45	102 Å²	102	30%	0.304	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138	-179.8	-71	0	0	0	0	109.9	R69 K71 S81	R69-C74 WeakPolarHBondContact CB-SG 3.2Å; R69-C74 WeakPolarHBondContact CD-SG 3.3Å; K71-C74 PolarHBondContact O-SG 3.34Å; C74-S81 WeakPolarHBondContact SG-CB 3.3Å
75	C	75.4	Confident	66.1	Low	2 Å²	2	96.8 Å²	96.8	1%	0.014	48%	0.478	C	S	.	.			trans	-78.5	133.8	169.9	-170.4	0	0	0	0	109.1	R69 Y80 F88 H91 H96	R69-C75 PolarHBondContact NH1-O 3.19Å; R69-C75 PolarHBondContact NH2-O 3.37Å; C75-Y80 PolarHBondContact N-O 2.86Å; C75-Y80 VanDerWaalsContact N-O 3.14Å; C75-F88 HydrophobicContact CB-CE2 4.18Å; C75-H91 WeakPolarHBondContact CB-NE2 3.4Å; C75-H96 PolarHBondContact SG-NE2 3.43Å
76	G	71.3	Confident	67.7	Low	56 Å²	56	92.4 Å²	92.4	58%	0.577	47%	0.467	S	S	*	.	S	Bend	trans	-67.3	-53.2	170	0	0	0	0	0	110.2	C78	G76-C78 PolarHBondContact O-N 2.93Å; G76-C78 VanDerWaalsContact O-N 3.11Å
77	L	66.6	Low	69.3	Low	60 Å²	60	88.5 Å²	88.5	31%	0.314	45%	0.445	S	S	.	.	S	Bend	trans	-63.9	-12.6	-174.1	-57.4	156.3	0	0	0	115.7	H96 E99 E103	L77-H96 WeakPolarHBondContact CB-CE1 3.34Å; L77-H96 WeakPolarHBondContact CB-ND1 3.44Å; L77-H96 HydrophobicContact CD1-CB 4.13Å; L77-E99 HydrophobicContact CD1-CB 3.57Å; L77-E99 HydrophobicContact CD1-CG 4.21Å; L77-E103 HydrophobicContact CD1-CG 4.12Å; L77-E103 VanDerWaalsContact CD1-OE2 3.32Å; L77-E103 WeakPolarHBondContact CD1-OE2 3.42Å; L77-E103 HydrophobicContact CG-CG 4.49Å; L77-E103 WeakPolarHBondContact CG-OE1 3Å; L77-E103 WeakPolarHBondContact CG-OE2 3.49Å
78	C	76.4	Confident	71	Confident	41 Å²	41	79.5 Å²	79.5	28%	0.277	41%	0.412	S	S	.	.	S	Bend	trans	-155.2	-179.4	174.5	81	0	0	0	0	113.3	R69 G76 Y80 H91 H96	R69-C78 VanDerWaalsContact CZ-O 3.29Å; R69-C78 PolarHBondContact NH1-O 2.75Å; R69-C78 PolarHBondContact NH2-O 2.91Å; G76-C78 PolarHBondContact O-N 2.93Å; G76-C78 VanDerWaalsContact O-N 3.11Å; C78-Y80 PolarHBondContact O-N 3.09Å; C78-Y80 WeakPolarHBondContact SG-CB 3.49Å; C78-Y80 PolarHBondContact SG-N 3.01Å; C78-Y80 VanDerWaalsContact SG-N 3.41Å; C78-H91 PolarHBondContact SG-CE1 3.14Å; C78-H91 PolarHBondContact SG-NE2 3.18Å; C78-H96 PolarHBondContact SG-NE2 3.24Å; C78-H96 VanDerWaalsContact SG-NE2 3.41Å
79	K	76.6	Confident	72.4	Confident	184 Å²	184	75.3 Å²	75.3	80%	0.8	40%	0.398	S	S	*	.	S	Bend	trans	-78.9	4.7	-177.7	-73.3	162.4	-178.8	153.9	0	114.6
80	Y	77.3	Confident	73.2	Confident	81 Å²	81	76.7 Å²	76.7	32%	0.318	41%	0.411	S	S	.	.			trans	-68.7	143.7	179.8	-169.2	-97.3	0	0	0	112.8	R69 C75 C78 T82 S87 H91	R69-Y80 PolarHBondContact NH1-O 3.17Å; C75-Y80 PolarHBondContact N-O 2.86Å; C75-Y80 VanDerWaalsContact N-O 3.14Å; C78-Y80 PolarHBondContact O-N 3.09Å; C78-Y80 WeakPolarHBondContact SG-CB 3.49Å; C78-Y80 PolarHBondContact SG-N 3.01Å; C78-Y80 VanDerWaalsContact SG-N 3.41Å; Y80-T82 HydrophobicContact CE1-CG2 3.77Å; Y80-S87 PolarHBondContact OH-O 3.46Å; Y80-S87 PolarHBondContact OH-OG 2.87Å; Y80-H91 WeakPolarHBondContact CB-NE2 3.42Å; Y80-H91 HydrophobicContact CD1-CB 3.8Å; Y80-H91 AromaticContact CD1-CD2 3.31Å; Y80-H91 WeakPolarHBondContact CD1-CD2 3.47Å; Y80-H91 AromaticContact CD1-CG 3.38Å; Y80-H91 AromaticContact CD1-NE2 3.9Å; Y80-H91 AromaticContact CD2-ND1 3.97Å; Y80-H91 HydrophobicContact CE1-CB 3.52Å; Y80-H91 AromaticContact CE1-CD2 3.97Å; Y80-H91 AromaticContact CE1-CG 3.68Å; Y80-H91 HydrophobicContact CE2-CB 4.38Å; Y80-H91 HydrophobicContact CG-CB 4.33Å; Y80-H91 AromaticContact CG-CD2 3.67Å; Y80-H91 AromaticContact CG-CE1 3.85Å; Y80-H91 AromaticContact CG-CG 3.6Å; Y80-H91 AromaticContact CG-ND1 3.72Å; Y80-H91 AromaticContact CG-NE2 3.8Å
81	S	79.1	Confident	74.6	Confident	25 Å²	25	71.2 Å²	71.2	18%	0.175	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	142.6	170.5	59.7	0	0	0	0	111.2	K71 Y73 C74	K71-S81 WeakPolarHBondContact CD-O 3.49Å; K71-S81 PolarHBondContact NZ-O 3.18Å; Y73-S81 CarbonylContact O-C 3.56Å; Y73-S81 VanDerWaalsContact O-CA 3.28Å; Y73-S81 WeakPolarHBondContact O-CA 3.36Å; C74-S81 WeakPolarHBondContact SG-CB 3.3Å
82	T	80.9	Confident	74.8	Confident	15 Å²	15	68 Å²	68	9%	0.092	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	161.9	-177.8	-173.2	0	0	0	0	112.2	K71 Y73 Y80 V84 S87 F88	K71-T82 WeakPolarHBondContact CB-O 3.47Å; Y73-T82 PolarHBondContact N-O 3.5Å; Y73-T82 PolarHBondContact O-N 3.14Å; Y80-T82 HydrophobicContact CE1-CG2 3.77Å; T82-V84 VanDerWaalsContact CG2-O 3.3Å; T82-V84 WeakPolarHBondContact CG2-O 3.44Å; T82-V84 PolarHBondContact OG1-N 3.17Å; T82-S87 PolarHBondContact OG1-OG 3.16Å; T82-F88 HydrophobicContact CG2-CB 3.67Å
83	K	75.2	Confident	74.9	Confident	157 Å²	157	68.6 Å²	68.6	68%	0.683	36%	0.357	S	S	*	.	S	Bend	trans	-91.2	-11	174	-65.8	-176.1	178.4	-179.1	0	112.7	K71	K71-K83 HydrophobicContact CB-CG 4.36Å; K71-K83 HydrophobicContact CD-CG 4.41Å; K71-K83 HydrophobicContact CG-CG 4.3Å
84	V	73.2	Confident	74.7	Confident	79 Å²	79	73.4 Å²	73.4	48%	0.479	38%	0.375	S	S	.	.			trans	-120.3	126.8	-169.1	-171.6	0	0	0	0	111	T82 T86 S87 F88	T82-V84 VanDerWaalsContact CG2-O 3.3Å; T82-V84 WeakPolarHBondContact CG2-O 3.44Å; T82-V84 PolarHBondContact OG1-N 3.17Å; V84-T86 WeakPolarHBondContact CG1-OG1 3.44Å; V84-T86 PolarHBondContact O-N 2.93Å; V84-S87 WeakPolarHBondContact O-CB 3.49Å; V84-S87 PolarHBondContact O-N 3.38Å; V84-F88 PolarHBondContact O-N 3.45Å
85	L	71.1	Confident	74.4	Confident	75 Å²	75	78.6 Å²	78.6	39%	0.393	39%	0.389	S	S	.	.	H	α-helix	trans	-64.2	-36.6	-174.7	-179.6	60.2	0	0	0	113.5	Y73 F88 K89	Y73-L85 HydrophobicContact CD1-CD1 4.06Å; Y73-L85 HydrophobicContact CE1-CB 4.36Å; Y73-L85 HydrophobicContact CE1-CD1 3.86Å; Y73-L85 HydrophobicContact CE2-CB 4.22Å; L85-F88 HydrophobicContact CD1-CD1 4.35Å; L85-F88 WeakPolarHBondContact O-CB 3.25Å; L85-F88 PolarHBondContact O-N 3.22Å; L85-F88 VanDerWaalsContact O-N 3.16Å; L85-K89 HydrophobicContact CD1-CG 4.38Å; L85-K89 WeakPolarHBondContact O-CG 3.42Å; L85-K89 PolarHBondContact O-N 2.89Å
86	T	72.3	Confident	74.3	Confident	94 Å²	94	78.8 Å²	78.8	58%	0.577	39%	0.39	S	S	*	.	H	α-helix	trans	-64.3	-42	175.5	51.9	0	0	0	0	111.6	V84 F88 K89 N90	V84-T86 WeakPolarHBondContact CG1-OG1 3.44Å; V84-T86 PolarHBondContact O-N 2.93Å; T86-F88 VanDerWaalsContact C-N 3.25Å; T86-F88 PolarHBondContact O-N 3.44Å; T86-K89 PolarHBondContact O-N 2.98Å; T86-N90 WeakPolarHBondContact O-CB 3.47Å; T86-N90 VanDerWaalsContact O-CG 3.25Å; T86-N90 PolarHBondContact O-N 3.31Å
87	S	75.8	Confident	73.6	Confident	37 Å²	37	79.9 Å²	79.9	26%	0.259	38%	0.38	S	S	.	.	H	α-helix	trans	-62.6	-30.2	172.5	176	0	0	0	0	112.6	Y80 T82 V84 H91	Y80-S87 PolarHBondContact OH-O 3.46Å; Y80-S87 PolarHBondContact OH-OG 2.87Å; T82-S87 PolarHBondContact OG1-OG 3.16Å; V84-S87 WeakPolarHBondContact O-CB 3.49Å; V84-S87 PolarHBondContact O-N 3.38Å; S87-H91 WeakPolarHBondContact O-CB 3.48Å; S87-H91 PolarHBondContact O-N 3.16Å
88	F	79.6	Confident	73	Confident	39 Å²	39	80.8 Å²	80.8	17%	0.171	39%	0.385	C	S	.	.	H	α-helix	trans	-75.5	-47.4	174.4	-178.5	-115	0	0	0	111.7	Y73 C75 T82 V84 L85 T86 N90 H91 L92	Y73-F88 HydrophobicContact CG-CB 4.35Å; C75-F88 HydrophobicContact CB-CE2 4.18Å; T82-F88 HydrophobicContact CG2-CB 3.67Å; V84-F88 PolarHBondContact O-N 3.45Å; L85-F88 HydrophobicContact CD1-CD1 4.35Å; L85-F88 WeakPolarHBondContact O-CB 3.25Å; L85-F88 PolarHBondContact O-N 3.22Å; L85-F88 VanDerWaalsContact O-N 3.16Å; T86-F88 VanDerWaalsContact C-N 3.25Å; T86-F88 PolarHBondContact O-N 3.44Å; F88-N90 PolarHBondContact O-N 2.87Å; F88-H91 WeakPolarHBondContact O-CB 3.32Å; F88-H91 PolarHBondContact O-N 3.39Å; F88-H91 VanDerWaalsContact O-N 3.13Å; F88-L92 PolarHBondContact O-N 2.84Å
89	K	74.5	Confident	71.8	Confident	123 Å²	123	81.7 Å²	81.7	54%	0.535	39%	0.385	S	S	.	.	H	α-helix	trans	-58.6	-45.8	175.1	-72.2	-175.1	174.8	-169.2	0	111.7	L85 T86 H91 L92 H93	L85-K89 HydrophobicContact CD1-CG 4.38Å; L85-K89 WeakPolarHBondContact O-CG 3.42Å; L85-K89 PolarHBondContact O-N 2.89Å; T86-K89 PolarHBondContact O-N 2.98Å; K89-H91 VanDerWaalsContact C-N 3.28Å; K89-H91 PolarHBondContact O-N 3.24Å; K89-L92 PolarHBondContact O-N 3.14Å; K89-H93 WeakPolarHBondContact O-CB 3.19Å; K89-H93 PolarHBondContact O-N 2.9Å
90	N	76.6	Confident	70.7	Confident	106 Å²	106	74.4 Å²	74.4	57%	0.567	36%	0.355	S	S	*	.	H	α-helix	trans	-66.4	-27.1	176.6	-70.4	-1.6	0	0	0	113.2	T86 F88 R94	T86-N90 WeakPolarHBondContact O-CB 3.47Å; T86-N90 VanDerWaalsContact O-CG 3.25Å; T86-N90 PolarHBondContact O-N 3.31Å; F88-N90 PolarHBondContact O-N 2.87Å; N90-R94 WeakPolarHBondContact O-CG 3.41Å; N90-R94 PolarHBondContact O-N 3.44Å
91	H	83.1	Confident	69.3	Low	11 Å²	11	74.5 Å²	74.5	5%	0.051	36%	0.361	C	S	.	.	H	α-helix	trans	-71.5	-48.5	170.9	161.6	63.2	0	0	0	110.8	C75 C78 Y80 S87 F88 K89 H93 R94 Y95 H96	C75-H91 WeakPolarHBondContact CB-NE2 3.4Å; C78-H91 PolarHBondContact SG-CE1 3.14Å; C78-H91 PolarHBondContact SG-NE2 3.18Å; Y80-H91 WeakPolarHBondContact CB-NE2 3.42Å; Y80-H91 HydrophobicContact CD1-CB 3.8Å; Y80-H91 AromaticContact CD1-CD2 3.31Å; Y80-H91 WeakPolarHBondContact CD1-CD2 3.47Å; Y80-H91 AromaticContact CD1-CG 3.38Å; Y80-H91 AromaticContact CD1-NE2 3.9Å; Y80-H91 AromaticContact CD2-ND1 3.97Å; Y80-H91 HydrophobicContact CE1-CB 3.52Å; Y80-H91 AromaticContact CE1-CD2 3.97Å; Y80-H91 AromaticContact CE1-CG 3.68Å; Y80-H91 HydrophobicContact CE2-CB 4.38Å; Y80-H91 HydrophobicContact CG-CB 4.33Å; Y80-H91 AromaticContact CG-CD2 3.67Å; Y80-H91 AromaticContact CG-CE1 3.85Å; Y80-H91 AromaticContact CG-CG 3.6Å; Y80-H91 AromaticContact CG-ND1 3.72Å; Y80-H91 AromaticContact CG-NE2 3.8Å; S87-H91 WeakPolarHBondContact O-CB 3.48Å; S87-H91 PolarHBondContact O-N 3.16Å; F88-H91 WeakPolarHBondContact O-CB 3.32Å; F88-H91 PolarHBondContact O-N 3.39Å; F88-H91 VanDerWaalsContact O-N 3.13Å; K89-H91 VanDerWaalsContact C-N 3.28Å; K89-H91 PolarHBondContact O-N 3.24Å; H91-H93 VanDerWaalsContact C-N 3.33Å; H91-H93 PolarHBondContact O-N 3.33Å; H91-R94 PolarHBondContact O-N 2.85Å; H91-Y95 AromaticContact ND1-CD2 3.41Å; H91-Y95 WeakPolarHBondContact ND1-CD2 3.44Å; H91-Y95 AromaticContact ND1-CG 3.9Å; H91-Y95 WeakPolarHBondContact O-CD2 3.3Å; H91-Y95 PolarHBondContact O-N 3.1Å; H91-H96 AromaticContact CE1-CD2 3.63Å; H91-H96 AromaticContact CE1-NE2 3.61Å; H91-H96 AromaticContact NE2-CD2 3.45Å; H91-H96 PolarHBondContact NE2-CD2 2.91Å; H91-H96 AromaticContact NE2-NE2 3.57Å
92	L	74.3	Confident	67.9	Low	14 Å²	14	80.1 Å²	80.1	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-57.9	-48.2	177.3	-146.5	71.1	0	0	0	110.4	F88 K89 R94 Y95 H96 E97 I100	F88-L92 PolarHBondContact O-N 2.84Å; K89-L92 PolarHBondContact O-N 3.14Å; L92-R94 PolarHBondContact O-N 2.97Å; L92-Y95 PolarHBondContact O-N 2.94Å; L92-H96 HydrophobicContact CD1-CB 3.9Å; L92-H96 HydrophobicContact CG-CB 4.19Å; L92-H96 CarbonylContact O-C 3.54Å; L92-H96 VanDerWaalsContact O-C 3.3Å; L92-H96 WeakPolarHBondContact O-CA 3.45Å; L92-H96 PolarHBondContact O-N 3.27Å; L92-E97 PolarHBondContact O-N 3.33Å; L92-I100 HydrophobicContact CB-CG1 4.48Å; L92-I100 HydrophobicContact CD2-CG1 3.88Å; L92-I100 HydrophobicContact CG-CD1 4.46Å; L92-I100 HydrophobicContact CG-CG1 3.83Å
93	H	69.1	Low	66.5	Low	110 Å²	110	83.6 Å²	83.6	51%	0.509	40%	0.399	S	S	.	.	H	α-helix	trans	-69.1	0.8	-180	-159.4	-18.3	0	0	0	115.1	K89 H91 E97	K89-H93 WeakPolarHBondContact O-CB 3.19Å; K89-H93 PolarHBondContact O-N 2.9Å; H91-H93 VanDerWaalsContact C-N 3.33Å; H91-H93 PolarHBondContact O-N 3.33Å; H93-E97 VanDerWaalsContact CA-OE1 3.22Å; H93-E97 WeakPolarHBondContact CA-OE1 3.48Å; H93-E97 IonicContact CE1-OE1 2.85Å; H93-E97 IonicContact CE1-OE2 3.59Å; H93-E97 PolarHBondContact CE1-OE2 3.47Å; H93-E97 IonicContact CG-OE1 3.49Å; H93-E97 IonicContact ND1-OE1 2.74Å; H93-E97 PolarHBondContact ND1-OE1 3.44Å; H93-E97 IonicContact ND1-OE2 2.64Å; H93-E97 PolarHBondContact ND1-OE2 2.71Å; H93-E97 VanDerWaalsContact ND1-OE2 3.07Å
94	R	69.5	Low	65.5	Low	188 Å²	188	79.1 Å²	79.1	71%	0.709	38%	0.383	S	S	*	.	H	α-helix	trans	-126.9	-22.6	174.4	-60.5	-163.2	90	162.9	7.4	114.5	N90 H91 L92 R742	N90-R94 WeakPolarHBondContact O-CG 3.41Å; N90-R94 PolarHBondContact O-N 3.44Å; H91-R94 PolarHBondContact O-N 2.85Å; L92-R94 PolarHBondContact O-N 2.97Å; R94-R742 PolarHBondContact O-NH1 3.44Å
95	Y	64.7	Low	65	Low	154 Å²	154	79.5 Å²	79.5	60%	0.604	39%	0.385	S	S	*	.	H	α-helix	trans	-114.8	-18	-177.2	-64.6	-84.3	0	0	0	114.1	H91 L92	H91-Y95 AromaticContact ND1-CD2 3.41Å; H91-Y95 WeakPolarHBondContact ND1-CD2 3.44Å; H91-Y95 AromaticContact ND1-CG 3.9Å; H91-Y95 WeakPolarHBondContact O-CD2 3.3Å; H91-Y95 PolarHBondContact O-N 3.1Å; L92-Y95 PolarHBondContact O-N 2.94Å
96	H	73.1	Confident	65.1	Low	6 Å²	6	79 Å²	79	3%	0.028	38%	0.382	C	S	.	.			trans	-139.8	23.3	-169.7	-62.9	-70.4	0	0	0	113.2	C75 L77 C78 H91 L92 D98 E99 I100	C75-H96 PolarHBondContact SG-NE2 3.43Å; L77-H96 WeakPolarHBondContact CB-CE1 3.34Å; L77-H96 WeakPolarHBondContact CB-ND1 3.44Å; L77-H96 HydrophobicContact CD1-CB 4.13Å; C78-H96 PolarHBondContact SG-NE2 3.24Å; C78-H96 VanDerWaalsContact SG-NE2 3.41Å; H91-H96 AromaticContact CE1-CD2 3.63Å; H91-H96 AromaticContact CE1-NE2 3.61Å; H91-H96 AromaticContact NE2-CD2 3.45Å; H91-H96 PolarHBondContact NE2-CD2 2.91Å; H91-H96 AromaticContact NE2-NE2 3.57Å; L92-H96 HydrophobicContact CD1-CB 3.9Å; L92-H96 HydrophobicContact CG-CB 4.19Å; L92-H96 CarbonylContact O-C 3.54Å; L92-H96 VanDerWaalsContact O-C 3.3Å; L92-H96 WeakPolarHBondContact O-CA 3.45Å; L92-H96 PolarHBondContact O-N 3.27Å; H96-D98 PolarHBondContact O-N 3.33Å; H96-D98 VanDerWaalsContact O-N 3.1Å; H96-E99 HydrophobicContact CB-CB 4.39Å; H96-E99 IonicContact CE1-OE2 2.7Å; H96-E99 IonicContact CG-OE2 2.71Å; H96-E99 IonicContact ND1-OE2 3.01Å; H96-E99 PolarHBondContact ND1-OE2 2.83Å; H96-E99 CarbonylContact O-C 3.58Å; H96-E99 WeakPolarHBondContact O-CA 3.5Å; H96-E99 PolarHBondContact O-N 3.07Å; H96-I100 WeakPolarHBondContact O-CG1 3.43Å; H96-I100 PolarHBondContact O-N 3.44Å; H96-I100 VanDerWaalsContact O-N 3.11Å
97	E	56.9	Low	65	Low	79 Å²	79	78.7 Å²	78.7	37%	0.369	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.3	-47.3	-177.4	-73.8	-80	67.3	0	0	114.2	L92 H93 E99 I100	L92-E97 PolarHBondContact O-N 3.33Å; H93-E97 VanDerWaalsContact CA-OE1 3.22Å; H93-E97 WeakPolarHBondContact CA-OE1 3.48Å; H93-E97 IonicContact CE1-OE1 2.85Å; H93-E97 IonicContact CE1-OE2 3.59Å; H93-E97 PolarHBondContact CE1-OE2 3.47Å; H93-E97 IonicContact CG-OE1 3.49Å; H93-E97 IonicContact ND1-OE1 2.74Å; H93-E97 PolarHBondContact ND1-OE1 3.44Å; H93-E97 IonicContact ND1-OE2 2.64Å; H93-E97 PolarHBondContact ND1-OE2 2.71Å; H93-E97 VanDerWaalsContact ND1-OE2 3.07Å; E97-E99 VanDerWaalsContact C-N 3.3Å; E97-E99 PolarHBondContact O-N 3.31Å; E97-I100 WeakPolarHBondContact OE1-CD1 3.49Å
98	D	53	Low	65	Low	79 Å²	79	77.3 Å²	77.3	42%	0.422	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-17.4	-176.2	-57.6	-79.8	0	0	0	113.5	H96 K734	H96-D98 PolarHBondContact O-N 3.33Å; H96-D98 VanDerWaalsContact O-N 3.1Å; D98-K734 IonicContact OD1-NZ 3.8Å; D98-K734 PolarHBondContact OD1-NZ 3.11Å; D98-K734 WeakPolarHBondContact OD2-CD 3.33Å; D98-K734 IonicContact OD2-NZ 2.74Å; D98-K734 PolarHBondContact OD2-NZ 3.36Å
99	E	52	Low	64.8	Low	59 Å²	59	80.4 Å²	80.4	28%	0.276	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-12	-178.8	-61.4	161.6	141.8	0	0	111	L77 H96 E97 D101 Q102 E103 K747	L77-E99 HydrophobicContact CD1-CB 3.57Å; L77-E99 HydrophobicContact CD1-CG 4.21Å; H96-E99 HydrophobicContact CB-CB 4.39Å; H96-E99 IonicContact CE1-OE2 2.7Å; H96-E99 IonicContact CG-OE2 2.71Å; H96-E99 IonicContact ND1-OE2 3.01Å; H96-E99 PolarHBondContact ND1-OE2 2.83Å; H96-E99 CarbonylContact O-C 3.58Å; H96-E99 WeakPolarHBondContact O-CA 3.5Å; H96-E99 PolarHBondContact O-N 3.07Å; E97-E99 VanDerWaalsContact C-N 3.3Å; E97-E99 PolarHBondContact O-N 3.31Å; E99-D101 PolarHBondContact O-N 2.92Å; E99-Q102 PolarHBondContact O-N 2.96Å; E99-Q102 VanDerWaalsContact O-N 3.12Å; E99-E103 PolarHBondContact O-N 2.86Å; E99-K747 IonicContact OE1-NZ 3.53Å
100	I	53.5	Low	64.5	Low	31 Å²	31	79 Å²	79	16%	0.159	39%	0.394	C	S	.	.	H	α-helix	trans	-54.5	-50.3	176.6	-68.1	177	0	0	0	111.6	L92 H96 E97 Q102 E103 L104	L92-I100 HydrophobicContact CB-CG1 4.48Å; L92-I100 HydrophobicContact CD2-CG1 3.88Å; L92-I100 HydrophobicContact CG-CD1 4.46Å; L92-I100 HydrophobicContact CG-CG1 3.83Å; H96-I100 WeakPolarHBondContact O-CG1 3.43Å; H96-I100 PolarHBondContact O-N 3.44Å; H96-I100 VanDerWaalsContact O-N 3.11Å; E97-I100 WeakPolarHBondContact OE1-CD1 3.49Å; I100-Q102 PolarHBondContact O-N 2.93Å; I100-E103 PolarHBondContact O-N 2.84Å; I100-L104 HydrophobicContact CG2-CB 4.09Å; I100-L104 HydrophobicContact CG2-CD2 4.11Å; I100-L104 WeakPolarHBondContact O-CB 3.46Å; I100-L104 PolarHBondContact O-N 2.83Å
101	D	48.6	Very low	64.6	Low	84 Å²	84	76.4 Å²	76.4	45%	0.449	38%	0.384	S	S	.	.	H	α-helix	trans	-62.8	-14.3	-176.5	-100.2	11.4	0	0	0	113	E99	E99-D101 PolarHBondContact O-N 2.92Å
102	Q	50.1	Low	64.4	Low	143 Å²	143	82.9 Å²	82.9	67%	0.668	42%	0.424	S	S	*	.	H	α-helix	trans	-103.9	-41.4	179.9	-56.5	-171.7	25.3	0	0	112.9	E99 I100 Q116	E99-Q102 PolarHBondContact O-N 2.96Å; E99-Q102 VanDerWaalsContact O-N 3.12Å; I100-Q102 PolarHBondContact O-N 2.93Å; Q102-Q116 PolarHBondContact O-NE2 3.32Å
103	E	49.7	Very low	64.4	Low	87 Å²	87	86 Å²	86	41%	0.407	44%	0.437	S	S	.	.	H	α-helix	trans	-93.4	-9.8	179.6	-73	-152.4	161.4	0	0	115.2	L77 E99 I100 V105	L77-E103 HydrophobicContact CD1-CG 4.12Å; L77-E103 VanDerWaalsContact CD1-OE2 3.32Å; L77-E103 WeakPolarHBondContact CD1-OE2 3.42Å; L77-E103 HydrophobicContact CG-CG 4.49Å; L77-E103 WeakPolarHBondContact CG-OE1 3Å; L77-E103 WeakPolarHBondContact CG-OE2 3.49Å; E99-E103 PolarHBondContact O-N 2.86Å; I100-E103 PolarHBondContact O-N 2.84Å; E103-V105 PolarHBondContact O-N 2.78Å
104	L	54.2	Low	64.7	Low	63 Å²	63	83.1 Å²	83.1	33%	0.33	43%	0.432	S	S	.	.			trans	-74	76.3	-179.1	-170	72.2	0	0	0	112.1	I100 I106 P117	I100-L104 HydrophobicContact CG2-CB 4.09Å; I100-L104 HydrophobicContact CG2-CD2 4.11Å; I100-L104 WeakPolarHBondContact O-CB 3.46Å; I100-L104 PolarHBondContact O-N 2.83Å; L104-I106 HydrophobicContact CD2-CD1 3.99Å; L104-I106 HydrophobicContact CD2-CG1 4.14Å; L104-I106 HydrophobicContact CG-CD1 4.34Å; L104-I106 HydrophobicContact CG-CG1 3.92Å; L104-I106 PolarHBondContact O-N 2.62Å; L104-I106 VanDerWaalsContact O-N 3.12Å; L104-P117 HydrophobicContact CD2-CG 4.21Å; L104-P117 WeakPolarHBondContact O-CD 3.23Å
105	V	64	Low	65	Low	88 Å²	88	75.6 Å²	75.6	53%	0.533	41%	0.409	S	S	.	.			trans	-69.2	101.1	169.6	177	0	0	0	0	108.9	E103 A114 S115	E103-V105 PolarHBondContact O-N 2.78Å; V105-A114 HydrophobicContact CG1-CB 3.7Å; V105-S115 CarbonylContact C-O 3.5Å; V105-S115 WeakPolarHBondContact CA-O 3.49Å
106	I	71.8	Confident	65.4	Low	65 Å²	65	71.7 Å²	71.7	33%	0.333	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134.2	175.2	-60.5	-173.1	0	0	0	108.5	L104 A114 S115 P117 V120	L104-I106 HydrophobicContact CD2-CD1 3.99Å; L104-I106 HydrophobicContact CD2-CG1 4.14Å; L104-I106 HydrophobicContact CG-CD1 4.34Å; L104-I106 HydrophobicContact CG-CG1 3.92Å; L104-I106 PolarHBondContact O-N 2.62Å; L104-I106 VanDerWaalsContact O-N 3.12Å; I106-A114 VanDerWaalsContact O-CA 3.26Å; I106-A114 WeakPolarHBondContact O-CA 3.3Å; I106-S115 PolarHBondContact N-O 3.12Å; I106-S115 PolarHBondContact O-N 2.93Å; I106-S115 VanDerWaalsContact O-N 3.09Å; I106-P117 HydrophobicContact CD1-CB 3.93Å; I106-P117 HydrophobicContact CD1-CG 3.71Å; I106-P117 HydrophobicContact CG1-CG 4.16Å; I106-V120 HydrophobicContact CB-CG2 4.48Å; I106-V120 WeakPolarHBondContact O-CG2 3.5Å
107	P	70.3	Confident	65.6	Low	87 Å²	87	73.6 Å²	73.6	57%	0.565	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	140.5	167.7	31.2	-33.8	0	0	0	110.8	A114	P107-A114 HydrophobicContact CB-CB 4.3Å
108	C	77.2	Confident	66.4	Low	7 Å²	7	77.1 Å²	77.1	5%	0.047	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-59	136.8	167.9	-172.1	0	0	0	0	109.6	N110 C111 F113 V120 H123 H128	C108-N110 PolarHBondContact O-N 2.81Å; C108-C111 VanDerWaalsContact O-O 3.08Å; C108-F113 HydrophobicContact CB-CB 4.43Å; C108-F113 VanDerWaalsContact CB-O 3.27Å; C108-F113 WeakPolarHBondContact CB-O 3.43Å; C108-F113 PolarHBondContact N-O 2.92Å; C108-V120 HydrophobicContact CB-CG1 4.34Å; C108-H123 VanDerWaalsContact SG-CD2 3.58Å; C108-H123 PolarHBondContact SG-NE2 3.13Å; C108-H128 PolarHBondContact SG-CD2 2.85Å
109	P	75.1	Confident	67.6	Low	104 Å²	104	76.2 Å²	76.2	68%	0.675	42%	0.42	S	S	*	.	S	Bend	trans	-65.5	-21.8	176.7	26	-35.1	0	0	0	113.1	F124	P109-F124 HydrophobicContact CG-CD2 4.01Å; P109-F124 HydrophobicContact CG-CE2 3.81Å
110	N	66.9	Low	68.9	Low	95 Å²	95	74 Å²	74	51%	0.508	41%	0.41	S	S	.	.	S	Bend	trans	-108	-11.5	-170.2	-66.4	16.9	0	0	0	114.2	C108 H128	C108-N110 PolarHBondContact O-N 2.81Å; N110-H128 HydrophobicContact CB-CB 4.26Å
111	C	79.5	Confident	70	Confident	50 Å²	50	73.7 Å²	73.7	34%	0.338	42%	0.415	S	S	.	.	S	Bend	trans	-155.8	-177.8	176.6	80.2	0	0	0	0	113.1	C108 F113 H123 H128	C108-C111 VanDerWaalsContact O-O 3.08Å; C111-F113 VanDerWaalsContact C-N 3.27Å; C111-F113 PolarHBondContact O-N 2.81Å; C111-F113 VanDerWaalsContact SG-CB 3.53Å; C111-F113 PolarHBondContact SG-N 2.83Å; C111-F113 VanDerWaalsContact SG-N 3.43Å; C111-H123 PolarHBondContact SG-CE1 3.12Å; C111-H123 PolarHBondContact SG-NE2 2.75Å; C111-H128 PolarHBondContact SG-NE2 2.6Å
112	V	79.9	Confident	71.4	Confident	147 Å²	147	77.6 Å²	77.6	89%	0.891	42%	0.424	S	S	*	.	S	Bend	trans	-76.3	-9.9	-175.6	-167.2	0	0	0	0	113.2	A114	V112-A114 PolarHBondContact O-N 3.37Å
113	F	72.6	Confident	72.8	Confident	79 Å²	79	71.7 Å²	71.7	35%	0.346	40%	0.396	S	S	.	.			trans	-60.8	127.1	178.4	-176.8	-93.9	0	0	0	111.4	C108 C111 V119 V120 H123	C108-F113 HydrophobicContact CB-CB 4.43Å; C108-F113 VanDerWaalsContact CB-O 3.27Å; C108-F113 WeakPolarHBondContact CB-O 3.43Å; C108-F113 PolarHBondContact N-O 2.92Å; C111-F113 VanDerWaalsContact C-N 3.27Å; C111-F113 PolarHBondContact O-N 2.81Å; C111-F113 VanDerWaalsContact SG-CB 3.53Å; C111-F113 PolarHBondContact SG-N 2.83Å; C111-F113 VanDerWaalsContact SG-N 3.43Å; F113-V119 HydrophobicContact CE1-CG1 4.21Å; F113-V119 HydrophobicContact CZ-CG1 3.91Å; F113-V120 HydrophobicContact CD1-CG2 4.44Å; F113-V120 HydrophobicContact CE1-CG2 4.25Å; F113-H123 HydrophobicContact CD1-CB 3.88Å; F113-H123 AromaticContact CD1-CD2 3.42Å; F113-H123 VanDerWaalsContact CD1-CD2 3.42Å; F113-H123 WeakPolarHBondContact CD1-CD2 3.23Å; F113-H123 AromaticContact CD1-CG 3.4Å; F113-H123 VanDerWaalsContact CD1-CG 3.4Å; F113-H123 AromaticContact CD1-ND1 3.82Å; F113-H123 AromaticContact CD1-NE2 3.88Å; F113-H123 HydrophobicContact CE1-CB 3.63Å; F113-H123 AromaticContact CE1-CG 3.71Å; F113-H123 AromaticContact CG-CD2 3.94Å; F113-H123 AromaticContact CG-CE1 3.82Å; F113-H123 AromaticContact CG-CG 3.85Å; F113-H123 AromaticContact CG-ND1 3.76Å; F113-H123 AromaticContact CG-NE2 3.93Å; F113-H123 HydrophobicContact CZ-CB 4.21Å
114	A	75.6	Confident	74.2	Confident	50 Å²	50	70.8 Å²	70.8	41%	0.413	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	130	176.6	0	0	0	0	0	110.2	V105 I106 P107 V112	V105-A114 HydrophobicContact CG1-CB 3.7Å; I106-A114 VanDerWaalsContact O-CA 3.26Å; I106-A114 WeakPolarHBondContact O-CA 3.3Å; P107-A114 HydrophobicContact CB-CB 4.3Å; V112-A114 PolarHBondContact O-N 3.37Å
115	S	76.4	Confident	75.3	Confident	31 Å²	31	76.5 Å²	76.5	22%	0.217	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	-175.5	-176.9	-164.3	0	0	0	0	111.1	V105 I106 V119 V120	V105-S115 CarbonylContact C-O 3.5Å; V105-S115 WeakPolarHBondContact CA-O 3.49Å; I106-S115 PolarHBondContact N-O 3.12Å; I106-S115 PolarHBondContact O-N 2.93Å; I106-S115 VanDerWaalsContact O-N 3.09Å; S115-V119 WeakPolarHBondContact OG-CB 3.03Å; S115-V120 WeakPolarHBondContact O-CG2 3.46Å
116	Q	73.8	Confident	75.7	Confident	72 Å²	72	78.4 Å²	78.4	34%	0.336	41%	0.413	S	S	.	.			trans	-57.7	152.9	174.2	-74.7	178.7	-3.1	0	0	111.7	Q102 K118 V119 V120	Q102-Q116 PolarHBondContact O-NE2 3.32Å; Q116-K118 PolarHBondContact O-N 3.33Å; Q116-K118 VanDerWaalsContact O-N 3.11Å; Q116-V119 HydrophobicContact CB-CG2 4.31Å; Q116-V119 WeakPolarHBondContact O-CA 3.31Å; Q116-V119 PolarHBondContact O-N 3.24Å; Q116-V120 WeakPolarHBondContact O-CG2 3.28Å; Q116-V120 PolarHBondContact O-N 2.82Å
117	P	76.2	Confident	75.8	Confident	46 Å²	46	82.3 Å²	82.3	30%	0.299	43%	0.427	S	S	.	.	H	α-helix	trans	-59.5	-34.8	-170.5	-22.6	33.6	0	0	0	113.4	L104 I106 G121	L104-P117 HydrophobicContact CD2-CG 4.21Å; L104-P117 WeakPolarHBondContact O-CD 3.23Å; I106-P117 HydrophobicContact CD1-CB 3.93Å; I106-P117 HydrophobicContact CD1-CG 3.71Å; I106-P117 HydrophobicContact CG1-CG 4.16Å; P117-G121 PolarHBondContact O-N 2.84Å
118	K	73.6	Confident	76.1	Confident	153 Å²	153	80.3 Å²	80.3	67%	0.665	41%	0.41	S	S	*	.	H	α-helix	trans	-65.9	-37.7	176	-61.5	172.5	-173.8	165.8	0	112.5	Q116 R122	Q116-K118 PolarHBondContact O-N 3.33Å; Q116-K118 VanDerWaalsContact O-N 3.11Å; K118-R122 PolarHBondContact O-N 3.47Å
119	V	78.1	Confident	75.6	Confident	60 Å²	60	82.2 Å²	82.2	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-77.7	-43.5	179.7	-175.6	0	0	0	0	110	F113 S115 Q116 G121 R122 H123	F113-V119 HydrophobicContact CE1-CG1 4.21Å; F113-V119 HydrophobicContact CZ-CG1 3.91Å; S115-V119 WeakPolarHBondContact OG-CB 3.03Å; Q116-V119 HydrophobicContact CB-CG2 4.31Å; Q116-V119 WeakPolarHBondContact O-CA 3.31Å; Q116-V119 PolarHBondContact O-N 3.24Å; V119-G121 VanDerWaalsContact C-N 3.31Å; V119-G121 PolarHBondContact O-N 2.92Å; V119-R122 CarbonylContact O-C 3.56Å; V119-R122 WeakPolarHBondContact O-CA 3.5Å; V119-R122 WeakPolarHBondContact O-CB 3.18Å; V119-R122 PolarHBondContact O-N 2.62Å; V119-H123 WeakPolarHBondContact O-CB 3.33Å; V119-H123 PolarHBondContact O-N 3.21Å
120	V	80.4	Confident	74.4	Confident	11 Å²	11	81.8 Å²	81.8	7%	0.067	42%	0.424	C	S	.	.	H	α-helix	trans	-61.3	-40.7	173	179.8	0	0	0	0	110.8	I106 C108 F113 S115 Q116 R122 H123 F124	I106-V120 HydrophobicContact CB-CG2 4.48Å; I106-V120 WeakPolarHBondContact O-CG2 3.5Å; C108-V120 HydrophobicContact CB-CG1 4.34Å; F113-V120 HydrophobicContact CD1-CG2 4.44Å; F113-V120 HydrophobicContact CE1-CG2 4.25Å; S115-V120 WeakPolarHBondContact O-CG2 3.46Å; Q116-V120 WeakPolarHBondContact O-CG2 3.28Å; Q116-V120 PolarHBondContact O-N 2.82Å; V120-R122 PolarHBondContact O-N 2.66Å; V120-H123 PolarHBondContact O-N 2.82Å; V120-F124 WeakPolarHBondContact O-CB 3.31Å; V120-F124 PolarHBondContact O-N 2.64Å
121	G	75.9	Confident	73.4	Confident	26 Å²	26	83.8 Å²	83.8	27%	0.268	44%	0.439	S	S	.	.	H	α-helix	trans	-70.2	-11.1	173.4	0	0	0	0	0	115	P117 V119 R125	P117-G121 PolarHBondContact O-N 2.84Å; V119-G121 VanDerWaalsContact C-N 3.31Å; V119-G121 PolarHBondContact O-N 2.92Å; G121-R125 PolarHBondContact O-NE 2.95Å; G121-R125 PolarHBondContact O-NH2 2.99Å
122	R	77.7	Confident	71.6	Confident	166 Å²	166	92.3 Å²	92.3	63%	0.626	46%	0.464	S	S	*	.	H	α-helix	trans	-92.3	-49.9	169	-170.9	-173.9	-66.4	-136.5	1.5	110.4	K118 V119 V120 F124 R125 M126	K118-R122 PolarHBondContact O-N 3.47Å; V119-R122 CarbonylContact O-C 3.56Å; V119-R122 WeakPolarHBondContact O-CA 3.5Å; V119-R122 WeakPolarHBondContact O-CB 3.18Å; V119-R122 PolarHBondContact O-N 2.62Å; V120-R122 PolarHBondContact O-N 2.66Å; R122-F124 VanDerWaalsContact C-N 3.35Å; R122-F124 PolarHBondContact O-N 3.42Å; R122-R125 CarbonylContact O-C 3.59Å; R122-R125 WeakPolarHBondContact O-CA 3.39Å; R122-R125 WeakPolarHBondContact O-CB 2.92Å; R122-R125 PolarHBondContact O-N 3.4Å; R122-M126 HydrophobicContact CG-CE 4.23Å; R122-M126 HydrophobicContact CG-SD 3.83Å; R122-M126 WeakPolarHBondContact O-CG 3.36Å; R122-M126 PolarHBondContact O-N 2.9Å
123	H	80.3	Confident	69.5	Low	19 Å²	19	94.4 Å²	94.4	9%	0.088	46%	0.462	C	S	.	.	H	α-helix	trans	-54.2	-46.9	173.1	157.5	83.6	0	0	0	111.9	C108 C111 F113 V119 V120 R125 M126 F127 H128	C108-H123 VanDerWaalsContact SG-CD2 3.58Å; C108-H123 PolarHBondContact SG-NE2 3.13Å; C111-H123 PolarHBondContact SG-CE1 3.12Å; C111-H123 PolarHBondContact SG-NE2 2.75Å; F113-H123 HydrophobicContact CD1-CB 3.88Å; F113-H123 AromaticContact CD1-CD2 3.42Å; F113-H123 VanDerWaalsContact CD1-CD2 3.42Å; F113-H123 WeakPolarHBondContact CD1-CD2 3.23Å; F113-H123 AromaticContact CD1-CG 3.4Å; F113-H123 VanDerWaalsContact CD1-CG 3.4Å; F113-H123 AromaticContact CD1-ND1 3.82Å; F113-H123 AromaticContact CD1-NE2 3.88Å; F113-H123 HydrophobicContact CE1-CB 3.63Å; F113-H123 AromaticContact CE1-CG 3.71Å; F113-H123 AromaticContact CG-CD2 3.94Å; F113-H123 AromaticContact CG-CE1 3.82Å; F113-H123 AromaticContact CG-CG 3.85Å; F113-H123 AromaticContact CG-ND1 3.76Å; F113-H123 AromaticContact CG-NE2 3.93Å; F113-H123 HydrophobicContact CZ-CB 4.21Å; V119-H123 WeakPolarHBondContact O-CB 3.33Å; V119-H123 PolarHBondContact O-N 3.21Å; V120-H123 PolarHBondContact O-N 2.82Å; H123-R125 PolarHBondContact O-N 3.27Å; H123-M126 PolarHBondContact O-N 3.05Å; H123-F127 HydrophobicContact CB-CD2 4.38Å; H123-F127 AromaticContact CE1-CD2 3.93Å; H123-F127 AromaticContact ND1-CD2 3.27Å; H123-F127 VanDerWaalsContact ND1-CD2 3.27Å; H123-F127 WeakPolarHBondContact ND1-CD2 3.49Å; H123-F127 AromaticContact ND1-CE2 3.93Å; H123-F127 AromaticContact ND1-CG 4Å; H123-F127 WeakPolarHBondContact O-CD2 3.47Å; H123-F127 PolarHBondContact O-N 2.78Å; H123-H128 AromaticContact CE1-NE2 3.81Å; H123-H128 AromaticContact NE2-CD2 3.43Å; H123-H128 PolarHBondContact NE2-CD2 3.35Å; H123-H128 AromaticContact NE2-NE2 3.46Å; H123-H128 PolarHBondContact NE2-NE2 2.84Å
124	F	78	Confident	67.6	Low	67 Å²	67	96.6 Å²	96.6	29%	0.294	48%	0.481	S	S	.	.	H	α-helix	trans	-61.1	-34.5	175.6	-175	-88.3	0	0	0	111.6	P109 V120 R122 H128 A129	P109-F124 HydrophobicContact CG-CD2 4.01Å; P109-F124 HydrophobicContact CG-CE2 3.81Å; V120-F124 WeakPolarHBondContact O-CB 3.31Å; V120-F124 PolarHBondContact O-N 2.64Å; R122-F124 VanDerWaalsContact C-N 3.35Å; R122-F124 PolarHBondContact O-N 3.42Å; F124-H128 HydrophobicContact CD2-CB 3.71Å; F124-H128 HydrophobicContact CE2-CB 3.89Å; F124-H128 HydrophobicContact CG-CB 4.17Å; F124-H128 HydrophobicContact CZ-CB 4.48Å; F124-H128 CarbonylContact O-C 3.3Å; F124-H128 VanDerWaalsContact O-CA 3.28Å; F124-H128 WeakPolarHBondContact O-CA 3.33Å; F124-H128 WeakPolarHBondContact O-CB 3.41Å; F124-H128 PolarHBondContact O-N 3.41Å; F124-H128 VanDerWaalsContact O-N 3.08Å; F124-A129 PolarHBondContact O-N 3.05Å
125	R	78.1	Confident	65.6	Low	183 Å²	183	101.8 Å²	101.8	69%	0.691	50%	0.497	S	S	*	.	H	α-helix	trans	-76.6	-19.6	174.6	-86.3	-177	-77	-170.6	-5	114.6	G121 R122 H123 A129	G121-R125 PolarHBondContact O-NE 2.95Å; G121-R125 PolarHBondContact O-NH2 2.99Å; R122-R125 CarbonylContact O-C 3.59Å; R122-R125 WeakPolarHBondContact O-CA 3.39Å; R122-R125 WeakPolarHBondContact O-CB 2.92Å; R122-R125 PolarHBondContact O-N 3.4Å; H123-R125 PolarHBondContact O-N 3.27Å; R125-A129 WeakPolarHBondContact O-CB 3.45Å
126	M	72.8	Confident	63.2	Low	129 Å²	129	107 Å²	107	64%	0.635	52%	0.522	S	S	*	.	H	α-helix	trans	-95.2	-38.1	179.7	-74.5	170.4	152.6	0	0	113	R122 H123	R122-M126 HydrophobicContact CG-CE 4.23Å; R122-M126 HydrophobicContact CG-SD 3.83Å; R122-M126 WeakPolarHBondContact O-CG 3.36Å; R122-M126 PolarHBondContact O-N 2.9Å; H123-M126 PolarHBondContact O-N 3.05Å
127	F	74	Confident	61.1	Low	146 Å²	146	114.2 Å²	114.2	64%	0.64	55%	0.548	S	S	*	.	H	α-helix	trans	-113.5	-13.1	-171.9	-59.6	-80.6	0	0	0	113.8	H123	H123-F127 HydrophobicContact CB-CD2 4.38Å; H123-F127 AromaticContact CE1-CD2 3.93Å; H123-F127 AromaticContact ND1-CD2 3.27Å; H123-F127 VanDerWaalsContact ND1-CD2 3.27Å; H123-F127 WeakPolarHBondContact ND1-CD2 3.49Å; H123-F127 AromaticContact ND1-CE2 3.93Å; H123-F127 AromaticContact ND1-CG 4Å; H123-F127 WeakPolarHBondContact O-CD2 3.47Å; H123-F127 PolarHBondContact O-N 2.78Å
128	H	75.9	Confident	58.8	Low	45 Å²	45	118.9 Å²	118.9	21%	0.208	58%	0.576	C	S	.	*	S	Bend	trans	-140.1	13	-173.9	-59.8	-51.3	0	0	0	114	C108 N110 C111 H123 F124 P130	C108-H128 PolarHBondContact SG-CD2 2.85Å; N110-H128 HydrophobicContact CB-CB 4.26Å; C111-H128 PolarHBondContact SG-NE2 2.6Å; H123-H128 AromaticContact CE1-NE2 3.81Å; H123-H128 AromaticContact NE2-CD2 3.43Å; H123-H128 PolarHBondContact NE2-CD2 3.35Å; H123-H128 AromaticContact NE2-NE2 3.46Å; H123-H128 PolarHBondContact NE2-NE2 2.84Å; F124-H128 HydrophobicContact CD2-CB 3.71Å; F124-H128 HydrophobicContact CE2-CB 3.89Å; F124-H128 HydrophobicContact CG-CB 4.17Å; F124-H128 HydrophobicContact CZ-CB 4.48Å; F124-H128 CarbonylContact O-C 3.3Å; F124-H128 VanDerWaalsContact O-CA 3.28Å; F124-H128 WeakPolarHBondContact O-CA 3.33Å; F124-H128 WeakPolarHBondContact O-CB 3.41Å; F124-H128 PolarHBondContact O-N 3.41Å; F124-H128 VanDerWaalsContact O-N 3.08Å; H128-P130 WeakPolarHBondContact O-CD 3.27Å
129	A	66.7	Low	56.8	Low	47 Å²	47	118 Å²	118	39%	0.388	58%	0.583	S	S	.	*			trans	-64.1	127.7	171.8	0	0	0	0	0	107.6	F124 R125 V131	F124-A129 PolarHBondContact O-N 3.05Å; R125-A129 WeakPolarHBondContact O-CB 3.45Å; A129-V131 PolarHBondContact O-N 2.94Å; A129-V131 VanDerWaalsContact O-N 3.16Å
130	P	50.2	Low	55	Low	96 Å²	96	122.7 Å²	122.7	62%	0.623	61%	0.606	S	S	*	*			trans	-56.2	125.2	163.9	-19.7	32	0	0	0	107.1	H128 R132	H128-P130 WeakPolarHBondContact O-CD 3.27Å; P130-R132 VanDerWaalsContact C-N 3.28Å; P130-R132 PolarHBondContact O-N 3.26Å
131	V	46.2	Very low	52.6	Low	137 Å²	137	129.9 Å²	129.9	83%	0.83	64%	0.642	S	S	*	*			trans	-62.5	96.1	174.4	178.7	0	0	0	0	106.9	A129 K133	A129-V131 PolarHBondContact O-N 2.94Å; A129-V131 VanDerWaalsContact O-N 3.16Å; V131-K133 PolarHBondContact O-N 3.39Å
132	R	41.8	Very low	50.6	Low	228 Å²	228	137 Å²	137	86%	0.86	67%	0.674	S	S	*	*			trans	-73.5	85.6	179.1	-77.1	-171.3	174	-172.2	-2.8	108.1	P130 V134	P130-R132 VanDerWaalsContact C-N 3.28Å; P130-R132 PolarHBondContact O-N 3.26Å; R132-V134 PolarHBondContact O-N 2.8Å
133	K	35.6	Very low	48.2	Very low	192 Å²	192	132.7 Å²	132.7	84%	0.835	68%	0.681	S	S	*	*			trans	-47.2	135.8	153.4	-73.8	-167.6	174	-170.9	0	108.1	V131	V131-K133 PolarHBondContact O-N 3.39Å
134	V	32.8	Very low	46.1	Very low	125 Å²	125	140.6 Å²	140.6	76%	0.758	72%	0.718	S	S	*	*			trans	-66.6	153.6	178.4	164.9	0	0	0	0	109.8	R132	R132-V134 PolarHBondContact O-N 2.8Å
135	Q	32.8	Very low	43.9	Very low	159 Å²	159	143 Å²	143	74%	0.743	74%	0.738	S	S	*	*			trans	81.4	130.7	163	-87.2	170.8	28.6	0	0	121.8
136	N	26.4	Very low	41.8	Very low	140 Å²	140	143.7 Å²	143.7	75%	0.749	75%	0.746	S	S	*	*			trans	86.8	145	134.9	-61.2	-13	0	0	0	122.6
137	Y	29.4	Very low	39.8	Very low	224 Å²	224	143 Å²	143	88%	0.878	75%	0.753	S	S	*	*			trans	-74.6	141.8	176.5	-99.8	-114.2	0	0	0	111.5
138	T	28.1	Very low	37.9	Very low	143 Å²	143	140.7 Å²	140.7	88%	0.877	76%	0.755	S	S	*	*			trans	-161.3	170.8	145.9	3.2	0	0	0	0	110.6
139	V	32.6	Very low	36.6	Very low	134 Å²	134	151 Å²	151	81%	0.812	79%	0.793	S	S	*	*			trans	-88.5	152.4	-163.7	179.5	0	0	0	0	112.8	I141	V139-I141 PolarHBondContact O-N 3.45Å
140	N	38.5	Very low	35.3	Very low	159 Å²	159	152.5 Å²	152.5	85%	0.85	80%	0.8	S	S	*	*			trans	-52.6	131.3	171.4	-77.9	-4.6	0	0	0	112.9
141	I	30.3	Very low	35	Very low	163 Å²	163	153.8 Å²	153.8	84%	0.836	80%	0.802	S	S	*	*			trans	-131	117.4	152.7	-60.9	-176.3	0	0	0	109.7	V139	V139-I141 PolarHBondContact O-N 3.45Å
142	L	34.3	Very low	36.2	Very low	176 Å²	176	151.1 Å²	151.1	92%	0.921	79%	0.785	S	S	*	*			trans	22.5	121.1	154.1	-150.3	70.4	0	0	0	120.5
143	G	27.6	Very low	37.9	Very low	75 Å²	75	143.5 Å²	143.5	77%	0.773	76%	0.761	S	S	*	*			trans	166.2	93.6	166.3	0	0	0	0	0	113.4
144	E	35.3	Very low	40	Very low	185 Å²	185	134.9 Å²	134.9	86%	0.864	73%	0.725	S	S	*	*			trans	-81.5	147	-175.4	-61.1	-168.6	117.6	0	0	114.1
145	T	33.5	Very low	42.7	Very low	118 Å²	118	130.1 Å²	130.1	72%	0.724	69%	0.694	S	S	*	*				-166.8	134.7	112.7	15.4	0	0	0	0	113.9
146	K	32.2	Very low	45.1	Very low	197 Å²	197	123.7 Å²	123.7	86%	0.857	67%	0.666	S	S	*	*			trans	63	61.1	153.7	-60.9	168.4	-174.8	167.8	0	117.1
147	S	30.6	Very low	48.1	Very low	113 Å²	113	117 Å²	117	79%	0.79	63%	0.63	S	S	*	*			trans	-61.5	134.9	158.3	-174.1	0	0	0	0	111.3
148	S	34.6	Very low	50.8	Low	98 Å²	98	111.4 Å²	111.4	69%	0.685	62%	0.615	S	S	*	*			trans	-70.5	144.1	169.9	54.1	0	0	0	0	111.3	S150	S148-S150 PolarHBondContact O-N 3.41Å
149	R	48.1	Very low	53.3	Low	263 Å²	263	109.6 Å²	109.6	99%	0.992	60%	0.595	S	S	*	*			trans	-53	112.9	172.7	-77.4	179.2	169.8	167.6	-4.3	111
150	S	39.5	Very low	55.8	Low	78 Å²	78	106 Å²	106	55%	0.545	58%	0.575	S	S	.	*			trans	-124.2	129.1	166.8	55.1	0	0	0	0	108.7	S148 V152	S148-S150 PolarHBondContact O-N 3.41Å; S150-V152 PolarHBondContact O-N 2.98Å
151	D	44	Very low	57.6	Low	122 Å²	122	104.8 Å²	104.8	65%	0.652	57%	0.569	S	S	*	*			trans	-68.1	100.5	169.1	-64.2	-66.3	0	0	0	108.3	I153 I255	D151-I153 PolarHBondContact O-N 2.82Å; D151-I255 HydrophobicContact CB-CG2 4.06Å
152	V	71.8	Confident	60.3	Low	81 Å²	81	101.2 Å²	101.2	49%	0.491	55%	0.547	S	S	.	.			trans	-74.1	98.6	-177.4	-178.1	0	0	0	0	108.9	S150 S154 T165	S150-V152 PolarHBondContact O-N 2.98Å; V152-S154 PolarHBondContact O-N 3.25Å; V152-T165 HydrophobicContact CG1-CG2 3.75Å
153	I	77.4	Confident	62.5	Low	68 Å²	68	95.8 Å²	95.8	35%	0.349	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	125.7	171.2	-57.1	176.7	0	0	0	108.2	D151 F155 E253 I255	D151-I153 PolarHBondContact O-N 2.82Å; I153-F155 HydrophobicContact CG2-CE1 4.12Å; I153-F155 HydrophobicContact CG2-CE2 4.01Å; I153-F155 HydrophobicContact CG2-CZ 3.69Å; I153-E253 HydrophobicContact CG2-CG 3.49Å; I153-E253 VanDerWaalsContact CG2-CG 3.49Å; I153-E253 WeakPolarHBondContact CG2-OE1 3.38Å; I153-I255 HydrophobicContact CG1-CG1 4.48Å
154	S	79.9	Confident	65.4	Low	11 Å²	11	94.3 Å²	94.3	8%	0.077	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.6	177.2	60.3	0	0	0	0	110.1	V152 H254	V152-S154 PolarHBondContact O-N 3.25Å; S154-H254 PolarHBondContact N-O 3.49Å; S154-H254 PolarHBondContact O-N 2.97Å; S154-H254 PolarHBondContact OG-O 3.05Å
155	F	88.7	Confident	67.7	Low	25 Å²	25	89.5 Å²	89.5	11%	0.11	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	144.8	174.9	-57	-78.9	0	0	0	109.5	I153 S163 N164 Y167 M170 I251 S252 E253	I153-F155 HydrophobicContact CG2-CE1 4.12Å; I153-F155 HydrophobicContact CG2-CE2 4.01Å; I153-F155 HydrophobicContact CG2-CZ 3.69Å; F155-S163 CarbonylContact O-C 3.57Å; F155-S163 WeakPolarHBondContact O-CA 3.42Å; F155-N164 PolarHBondContact N-O 2.91Å; F155-N164 PolarHBondContact O-N 3Å; F155-Y167 AromaticContact CD1-CD2 3.7Å; F155-Y167 HydrophobicContact CD1-CD2 3.7Å; F155-Y167 HydrophobicContact CD1-CE2 4.39Å; F155-Y167 HydrophobicContact CD2-CD2 4.5Å; F155-Y167 AromaticContact CE1-CD2 3.75Å; F155-Y167 HydrophobicContact CE1-CD2 3.75Å; F155-Y167 HydrophobicContact CE1-CE2 4.47Å; F155-Y167 HydrophobicContact CE1-CG 4.3Å; F155-Y167 HydrophobicContact CG-CD2 4.1Å; F155-Y167 HydrophobicContact CZ-CD2 4.2Å; F155-Y167 HydrophobicContact CZ-CG 4.32Å; F155-M170 HydrophobicContact CB-CB 4.18Å; F155-M170 HydrophobicContact CB-CE 4.32Å; F155-M170 HydrophobicContact CB-CG 4.12Å; F155-M170 WeakPolarHBondContact O-CE 3.38Å; F155-I251 HydrophobicContact CB-CG2 4Å; F155-I251 HydrophobicContact CD1-CG2 4.13Å; F155-I251 HydrophobicContact CG-CG2 4.46Å; F155-S252 CarbonylContact C-O 3.57Å; F155-S252 VanDerWaalsContact CA-O 3.3Å; F155-S252 WeakPolarHBondContact CA-O 3.48Å; F155-E253 HydrophobicContact CD1-CB 4.15Å; F155-E253 HydrophobicContact CD1-CG 4.08Å; F155-E253 HydrophobicContact CE1-CB 4.15Å; F155-E253 HydrophobicContact CE1-CG 3.72Å; F155-E253 HydrophobicContact CZ-CG 4.47Å
156	T	85.3	Confident	70.2	Confident	25 Å²	25	88.9 Å²	88.9	15%	0.153	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.6	175.4	55.2	0	0	0	0	110.8	F162 I251 S252 H254	T156-F162 CarbonylContact C-O 3.59Å; T156-F162 WeakPolarHBondContact CA-O 3.31Å; T156-I251 WeakPolarHBondContact O-CA 3.49Å; T156-S252 PolarHBondContact N-O 3.01Å; T156-S252 PolarHBondContact O-N 3.09Å; T156-S252 WeakPolarHBondContact OG1-CB 3.48Å; T156-H254 PolarHBondContact OG1-CD2 3.46Å; T156-H254 PolarHBondContact OG1-NE2 2.87Å; T156-H254 VanDerWaalsContact OG1-NE2 3.15Å
157	C	89.3	Confident	72.8	Confident	0 Å²	0	82.4 Å²	82.4	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	118.7	171.8	179.3	0	0	0	0	109.9	K159 C160 N161 F162 M170 V174 H178	C157-K159 PolarHBondContact O-N 3.25Å; C157-K159 PolarHBondContact SG-N 3.2Å; C157-C160 PolarHBondContact O-N 3.46Å; C157-C160 VanDerWaalsContact SG-SG 3.64Å; C157-N161 WeakPolarHBondContact O-CA 3.44Å; C157-N161 PolarHBondContact O-N 2.83Å; C157-F162 HydrophobicContact CB-CB 4.3Å; C157-F162 PolarHBondContact N-O 3.43Å; C157-M170 HydrophobicContact CB-SD 3.73Å; C157-V174 HydrophobicContact CB-CG2 4.25Å; C157-H178 PolarHBondContact SG-CD2 3.37Å; C157-H178 PolarHBondContact SG-NE2 2.89Å; C157-H178 VanDerWaalsContact SG-NE2 3.37Å
158	L	84.8	Confident	75.5	Confident	105 Å²	105	80.2 Å²	80.2	55%	0.55	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-10.8	-179.7	-68.7	173.3	0	0	0	114.1	V250	L158-V250 PolarHBondContact N-O 2.84Å
159	K	80.6	Confident	77.9	Confident	106 Å²	106	77.4 Å²	77.4	46%	0.461	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-20.3	176.8	-81.8	179.2	179.5	-179.8	0	114.8	C157 H178 F179 V250	C157-K159 PolarHBondContact O-N 3.25Å; C157-K159 PolarHBondContact SG-N 3.2Å; K159-H178 HydrophobicContact CD-CB 3.58Å; K159-H178 PolarHBondContact NZ-O 2.89Å; K159-F179 VanDerWaalsContact NZ-CZ 3.33Å; K159-V250 HydrophobicContact CB-CG1 4.25Å; K159-V250 HydrophobicContact CD-CG1 3.81Å; K159-V250 HydrophobicContact CG-CG1 3.73Å
160	C	84.8	Confident	79.8	Confident	57 Å²	57	64.9 Å²	64.9	39%	0.385	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.6	3.2	-173.8	69.8	0	0	0	0	115.4	C157 F162 H173 H178	C157-C160 PolarHBondContact O-N 3.46Å; C157-C160 VanDerWaalsContact SG-SG 3.64Å; C160-F162 PolarHBondContact O-N 3.07Å; C160-F162 VanDerWaalsContact SG-CB 3.52Å; C160-H173 VanDerWaalsContact SG-CE1 3.59Å; C160-H173 PolarHBondContact SG-NE2 3.37Å; C160-H178 PolarHBondContact SG-NE2 2.89Å
161	N	77.4	Confident	82.1	Confident	135 Å²	135	62 Å²	62	72%	0.722	33%	0.329	S	S	*	.			trans	59.2	9.8	-176.9	-59.2	-45.5	0	0	0	116.1	C157 S163	C157-N161 WeakPolarHBondContact O-CA 3.44Å; C157-N161 PolarHBondContact O-N 2.83Å; N161-S163 PolarHBondContact O-N 3.19Å
162	F	85.8	Confident	84.2	Confident	87 Å²	87	59.2 Å²	59.2	38%	0.382	31%	0.311	S	S	.	.			trans	-53.1	137.6	166.4	179.2	-106.4	0	0	0	109.8	T156 C157 C160 N164 M170 H173	T156-F162 CarbonylContact C-O 3.59Å; T156-F162 WeakPolarHBondContact CA-O 3.31Å; C157-F162 HydrophobicContact CB-CB 4.3Å; C157-F162 PolarHBondContact N-O 3.43Å; C160-F162 PolarHBondContact O-N 3.07Å; C160-F162 VanDerWaalsContact SG-CB 3.52Å; F162-N164 HydrophobicContact CE1-CB 4.22Å; F162-M170 HydrophobicContact CD1-CE 3.67Å; F162-M170 HydrophobicContact CD1-SD 4Å; F162-M170 HydrophobicContact CE1-CE 4.13Å; F162-M170 VanDerWaalsContact O-CE 3.3Å; F162-M170 WeakPolarHBondContact O-CE 3.49Å; F162-H173 HydrophobicContact CD1-CB 3.99Å; F162-H173 AromaticContact CD1-CD2 3.54Å; F162-H173 AromaticContact CD1-CE1 3.84Å; F162-H173 AromaticContact CD1-CG 3.4Å; F162-H173 AromaticContact CD1-ND1 3.6Å; F162-H173 AromaticContact CD1-NE2 3.83Å; F162-H173 HydrophobicContact CE1-CB 3.86Å; F162-H173 AromaticContact CE1-CG 3.76Å; F162-H173 AromaticContact CG-CE1 3.81Å; F162-H173 AromaticContact CG-ND1 3.91Å; F162-H173 AromaticContact CG-NE2 3.99Å
163	S	82.4	Confident	85	Confident	62 Å²	62	57.2 Å²	57.2	43%	0.434	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145	-176.7	75	0	0	0	0	112.2	F155 N161	F155-S163 CarbonylContact O-C 3.57Å; F155-S163 WeakPolarHBondContact O-CA 3.42Å; N161-S163 PolarHBondContact O-N 3.19Å
164	N	87.1	Confident	85.5	Confident	44 Å²	44	54 Å²	54	24%	0.235	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	148.5	-178.4	-153.1	-71	0	0	0	110.9	F155 F162 L166 M170	F155-N164 PolarHBondContact N-O 2.91Å; F155-N164 PolarHBondContact O-N 3Å; F162-N164 HydrophobicContact CE1-CB 4.22Å; N164-L166 PolarHBondContact OD1-N 2.87Å; N164-M170 HydrophobicContact CB-CE 3.85Å
165	T	84.4	Confident	85.8	Confident	85 Å²	85	53.5 Å²	53.5	52%	0.521	28%	0.277	S	S	.	.	S	Bend	trans	-80.5	-18.3	174	50.6	0	0	0	0	112.7	V152	V152-T165 HydrophobicContact CG1-CG2 3.75Å
166	L	86.4	Confident	85.6	Confident	105 Å²	105	55.3 Å²	55.3	55%	0.55	29%	0.29	S	S	.	.			trans	-101.4	116.4	179.4	-61	179.5	0	0	0	111.4	N164 Y168 S169 M170	N164-L166 PolarHBondContact OD1-N 2.87Å; L166-Y168 PolarHBondContact O-N 3.34Å; L166-S169 PolarHBondContact O-N 3.08Å; L166-S169 VanDerWaalsContact O-N 3.1Å; L166-M170 PolarHBondContact O-N 3.03Å
167	Y	85.6	Confident	85.5	Confident	60 Å²	60	56.9 Å²	56.9	24%	0.235	31%	0.305	C	S	.	.	H	α-helix	trans	-59	-34	176.5	-172	-124.2	0	0	0	112.8	F155 M170 K171 R248 I251	F155-Y167 AromaticContact CD1-CD2 3.7Å; F155-Y167 HydrophobicContact CD1-CD2 3.7Å; F155-Y167 HydrophobicContact CD1-CE2 4.39Å; F155-Y167 HydrophobicContact CD2-CD2 4.5Å; F155-Y167 AromaticContact CE1-CD2 3.75Å; F155-Y167 HydrophobicContact CE1-CD2 3.75Å; F155-Y167 HydrophobicContact CE1-CE2 4.47Å; F155-Y167 HydrophobicContact CE1-CG 4.3Å; F155-Y167 HydrophobicContact CG-CD2 4.1Å; F155-Y167 HydrophobicContact CZ-CD2 4.2Å; F155-Y167 HydrophobicContact CZ-CG 4.32Å; Y167-M170 PolarHBondContact O-N 3.27Å; Y167-K171 HydrophobicContact CD1-CD 4.45Å; Y167-K171 HydrophobicContact CE1-CD 4.19Å; Y167-K171 HydrophobicContact CE1-CG 4.44Å; Y167-K171 PolarHBondContact O-N 3.01Å; Y167-R248 WeakPolarHBondContact OH-CG 3.23Å; Y167-R248 PolarHBondContact OH-NE 3.45Å; Y167-I251 HydrophobicContact CD2-CD1 4.48Å; Y167-I251 HydrophobicContact CD2-CG2 4.28Å; Y167-I251 HydrophobicContact CE2-CB 4.4Å; Y167-I251 HydrophobicContact CE2-CD1 3.88Å; Y167-I251 HydrophobicContact CE2-CG2 3.96Å
168	Y	87.3	Confident	85.3	Confident	68 Å²	68	59.3 Å²	59.3	27%	0.267	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-47.1	173.2	175.3	-97.5	0	0	0	112.2	L166 M170 K171 K172 Y232 L235 T236	L166-Y168 PolarHBondContact O-N 3.34Å; Y168-M170 PolarHBondContact O-N 3.28Å; Y168-K171 WeakPolarHBondContact O-CB 3.5Å; Y168-K171 PolarHBondContact O-N 3.49Å; Y168-K172 PolarHBondContact O-N 2.93Å; Y168-Y232 HydrophobicContact CD2-CD2 4.33Å; Y168-Y232 AromaticContact CE2-CD2 3.69Å; Y168-Y232 HydrophobicContact CE2-CD2 3.69Å; Y168-Y232 HydrophobicContact CE2-CE2 4.33Å; Y168-Y232 HydrophobicContact CE2-CG 4.46Å; Y168-Y232 AromaticContact CZ-CD2 3.89Å; Y168-L235 HydrophobicContact CD2-CB 4.35Å; Y168-L235 HydrophobicContact CD2-CD1 4.46Å; Y168-L235 HydrophobicContact CE2-CB 3.95Å; Y168-L235 HydrophobicContact CE2-CD1 3.89Å; Y168-T236 HydrophobicContact CD2-CG2 4.26Å; Y168-T236 HydrophobicContact CE2-CG2 4.41Å
169	S	86.1	Confident	85.2	Confident	38 Å²	38	54.9 Å²	54.9	27%	0.266	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-33.8	177.3	-56.9	0	0	0	0	111.6	L166 H173	L166-S169 PolarHBondContact O-N 3.08Å; L166-S169 VanDerWaalsContact O-N 3.1Å; S169-H173 VanDerWaalsContact O-CB 3.29Å; S169-H173 WeakPolarHBondContact O-CB 3.35Å; S169-H173 PolarHBondContact O-N 2.88Å
170	M	87.8	Confident	84.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.8	-45.3	171.7	-169.1	54.9	67	0	0	112.3	F155 C157 F162 N164 L166 Y167 Y168 K172 H173 V174 I251	F155-M170 HydrophobicContact CB-CB 4.18Å; F155-M170 HydrophobicContact CB-CE 4.32Å; F155-M170 HydrophobicContact CB-CG 4.12Å; F155-M170 WeakPolarHBondContact O-CE 3.38Å; C157-M170 HydrophobicContact CB-SD 3.73Å; F162-M170 HydrophobicContact CD1-CE 3.67Å; F162-M170 HydrophobicContact CD1-SD 4Å; F162-M170 HydrophobicContact CE1-CE 4.13Å; F162-M170 VanDerWaalsContact O-CE 3.3Å; F162-M170 WeakPolarHBondContact O-CE 3.49Å; N164-M170 HydrophobicContact CB-CE 3.85Å; L166-M170 PolarHBondContact O-N 3.03Å; Y167-M170 PolarHBondContact O-N 3.27Å; Y168-M170 PolarHBondContact O-N 3.28Å; M170-K172 PolarHBondContact O-N 2.98Å; M170-H173 PolarHBondContact O-N 2.86Å; M170-V174 HydrophobicContact CG-CG2 4.43Å; M170-V174 WeakPolarHBondContact O-CG2 3.5Å; M170-V174 PolarHBondContact O-N 3.38Å; M170-V174 HydrophobicContact SD-CG2 4.18Å; M170-I251 HydrophobicContact CB-CD1 4.33Å; M170-I251 HydrophobicContact CG-CB 4.35Å; M170-I251 HydrophobicContact CG-CD1 3.75Å; M170-I251 HydrophobicContact CG-CG1 3.73Å; M170-I251 HydrophobicContact CG-CG2 3.71Å
171	K	88.1	Confident	84.6	Confident	17 Å²	17	59.1 Å²	59.1	7%	0.074	30%	0.303	C	S	.	.	H	α-helix	trans	-55.6	-48	172.1	-86.5	-177.9	167.8	-178.1	0	112.1	Y167 Y168 V174 L175 L235 E244 I251	Y167-K171 HydrophobicContact CD1-CD 4.45Å; Y167-K171 HydrophobicContact CE1-CD 4.19Å; Y167-K171 HydrophobicContact CE1-CG 4.44Å; Y167-K171 PolarHBondContact O-N 3.01Å; Y168-K171 WeakPolarHBondContact O-CB 3.5Å; Y168-K171 PolarHBondContact O-N 3.49Å; K171-V174 PolarHBondContact O-N 3.28Å; K171-L175 WeakPolarHBondContact O-CB 3.49Å; K171-L175 PolarHBondContact O-N 3.07Å; K171-L235 HydrophobicContact CB-CD1 4.27Å; K171-L235 HydrophobicContact CB-CD2 4.09Å; K171-L235 PolarHBondContact NZ-O 2.9Å; K171-E244 WeakPolarHBondContact CE-OE1 3.35Å; K171-E244 VanDerWaalsContact NZ-CD 3.26Å; K171-E244 IonicContact NZ-OE1 3.57Å; K171-E244 PolarHBondContact NZ-OE1 3.1Å; K171-I251 HydrophobicContact CG-CD1 4.25Å
172	K	87.9	Confident	84.7	Confident	64 Å²	64	53.7 Å²	53.7	28%	0.278	28%	0.275	S	S	.	.	H	α-helix	trans	-62.2	-45	177.5	-175.2	173.1	174.6	177.9	0	111.2	Y168 M170 V176 D228 M231 L235	Y168-K172 PolarHBondContact O-N 2.93Å; M170-K172 PolarHBondContact O-N 2.98Å; K172-V176 HydrophobicContact CG-CG2 4.37Å; K172-V176 WeakPolarHBondContact O-CB 3.23Å; K172-V176 VanDerWaalsContact O-CG2 3.28Å; K172-V176 WeakPolarHBondContact O-CG2 3.25Å; K172-V176 PolarHBondContact O-N 2.93Å; K172-D228 IonicContact NZ-OD1 3.44Å; K172-D228 PolarHBondContact NZ-OD1 3.06Å; K172-D228 IonicContact NZ-OD2 2.63Å; K172-D228 PolarHBondContact NZ-OD2 3.47Å; K172-M231 HydrophobicContact CD-CG 4.08Å; K172-M231 HydrophobicContact CG-CG 4.12Å; K172-L235 HydrophobicContact CB-CD1 3.8Å; K172-L235 HydrophobicContact CG-CD1 4.47Å
173	H	87.8	Confident	84.5	Confident	39 Å²	39	50.5 Å²	50.5	18%	0.181	26%	0.261	C	S	.	.	H	α-helix	trans	-57.9	-52.5	173.9	164.3	79.4	0	0	0	112.2	C160 F162 S169 M170 L175 V176 A177 H178	C160-H173 VanDerWaalsContact SG-CE1 3.59Å; C160-H173 PolarHBondContact SG-NE2 3.37Å; F162-H173 HydrophobicContact CD1-CB 3.99Å; F162-H173 AromaticContact CD1-CD2 3.54Å; F162-H173 AromaticContact CD1-CE1 3.84Å; F162-H173 AromaticContact CD1-CG 3.4Å; F162-H173 AromaticContact CD1-ND1 3.6Å; F162-H173 AromaticContact CD1-NE2 3.83Å; F162-H173 HydrophobicContact CE1-CB 3.86Å; F162-H173 AromaticContact CE1-CG 3.76Å; F162-H173 AromaticContact CG-CE1 3.81Å; F162-H173 AromaticContact CG-ND1 3.91Å; F162-H173 AromaticContact CG-NE2 3.99Å; S169-H173 VanDerWaalsContact O-CB 3.29Å; S169-H173 WeakPolarHBondContact O-CB 3.35Å; S169-H173 PolarHBondContact O-N 2.88Å; M170-H173 PolarHBondContact O-N 2.86Å; H173-L175 PolarHBondContact O-N 3.48Å; H173-V176 PolarHBondContact O-N 3.42Å; H173-A177 VanDerWaalsContact O-CB 3.24Å; H173-A177 WeakPolarHBondContact O-CB 3.47Å; H173-A177 PolarHBondContact O-N 2.89Å; H173-H178 AromaticContact NE2-NE2 3.62Å
174	V	88.1	Confident	84.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-41.3	-177.8	175.1	0	0	0	0	111.2	C157 M170 K171 H178 F179 L247 V250 I251	C157-V174 HydrophobicContact CB-CG2 4.25Å; M170-V174 HydrophobicContact CG-CG2 4.43Å; M170-V174 WeakPolarHBondContact O-CG2 3.5Å; M170-V174 PolarHBondContact O-N 3.38Å; M170-V174 HydrophobicContact SD-CG2 4.18Å; K171-V174 PolarHBondContact O-N 3.28Å; V174-H178 WeakPolarHBondContact O-CA 3.24Å; V174-H178 WeakPolarHBondContact O-CB 3.38Å; V174-H178 PolarHBondContact O-N 2.95Å; V174-H178 VanDerWaalsContact O-N 3.09Å; V174-F179 HydrophobicContact CG1-CD2 3.78Å; V174-F179 HydrophobicContact CG1-CE2 3.68Å; V174-F179 WeakPolarHBondContact O-CD2 3.22Å; V174-F179 PolarHBondContact O-N 3.37Å; V174-L247 HydrophobicContact CB-CD2 4.21Å; V174-L247 HydrophobicContact CG1-CD2 3.69Å; V174-V250 HydrophobicContact CG1-CB 4.03Å; V174-V250 HydrophobicContact CG1-CG1 3.98Å; V174-I251 HydrophobicContact CG2-CD1 4.25Å; V174-I251 HydrophobicContact CG2-CG1 3.87Å
175	L	86	Confident	83.9	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-48.8	177.5	-178.3	55.4	0	0	0	111.8	K171 H173 F179 H180 L182 I183 M231 I234 L235 L243 L247	K171-L175 WeakPolarHBondContact O-CB 3.49Å; K171-L175 PolarHBondContact O-N 3.07Å; H173-L175 PolarHBondContact O-N 3.48Å; L175-F179 HydrophobicContact CD1-CB 4.14Å; L175-F179 CarbonylContact O-C 3.51Å; L175-F179 WeakPolarHBondContact O-CA 3.25Å; L175-F179 PolarHBondContact O-N 3.3Å; L175-F179 VanDerWaalsContact O-N 3.15Å; L175-H180 PolarHBondContact O-N 2.91Å; L175-L182 HydrophobicContact CD1-CB 4.25Å; L175-I183 HydrophobicContact CD1-CG1 3.83Å; L175-I183 HydrophobicContact CD2-CG1 4.34Å; L175-I183 HydrophobicContact CG-CD1 4.06Å; L175-I183 HydrophobicContact CG-CG1 3.73Å; L175-M231 HydrophobicContact CD2-SD 3.91Å; L175-I234 HydrophobicContact CD2-CG2 4.16Å; L175-L235 HydrophobicContact CB-CD2 4.35Å; L175-L235 HydrophobicContact CD2-CD2 3.56Å; L175-L235 HydrophobicContact CD2-CG 4.19Å; L175-L243 HydrophobicContact CD1-CD1 4.18Å; L175-L243 HydrophobicContact CD1-CD2 4.44Å; L175-L243 HydrophobicContact CD2-CD2 4.28Å; L175-L247 HydrophobicContact CB-CD1 4.26Å; L175-L247 HydrophobicContact CB-CD2 3.96Å; L175-L247 HydrophobicContact CD1-CD2 4.4Å
176	V	85.1	Confident	83.7	Confident	64 Å²	64	49.3 Å²	49.3	39%	0.388	25%	0.25	S	S	.	.	H	α-helix	trans	-73.1	-49.3	-176.9	176.7	0	0	0	0	112.5	K172 H173 I183 M231	K172-V176 HydrophobicContact CG-CG2 4.37Å; K172-V176 WeakPolarHBondContact O-CB 3.23Å; K172-V176 VanDerWaalsContact O-CG2 3.28Å; K172-V176 WeakPolarHBondContact O-CG2 3.25Å; K172-V176 PolarHBondContact O-N 2.93Å; H173-V176 PolarHBondContact O-N 3.42Å; V176-I183 HydrophobicContact CB-CD1 4.26Å; V176-I183 HydrophobicContact CG2-CD1 3.82Å; V176-M231 HydrophobicContact CG2-CE 3.85Å
177	A	83.5	Confident	83.7	Confident	58 Å²	58	45.7 Å²	45.7	48%	0.479	23%	0.23	S	C	.	.	H	α-helix	trans	-82	-20.7	-173.5	0	0	0	0	0	114.1	H173	H173-A177 VanDerWaalsContact O-CB 3.24Å; H173-A177 WeakPolarHBondContact O-CB 3.47Å; H173-A177 PolarHBondContact O-N 2.89Å
178	H	84.3	Confident	83.5	Confident	50 Å²	50	43 Å²	43	23%	0.231	22%	0.221	C	C	.	.	H	α-helix	trans	-133.9	-3.3	-170.5	-57.8	-38.6	0	0	0	116	C157 K159 C160 H173 V174	C157-H178 PolarHBondContact SG-CD2 3.37Å; C157-H178 PolarHBondContact SG-NE2 2.89Å; C157-H178 VanDerWaalsContact SG-NE2 3.37Å; K159-H178 HydrophobicContact CD-CB 3.58Å; K159-H178 PolarHBondContact NZ-O 2.89Å; C160-H178 PolarHBondContact SG-NE2 2.89Å; H173-H178 AromaticContact NE2-NE2 3.62Å; V174-H178 WeakPolarHBondContact O-CA 3.24Å; V174-H178 WeakPolarHBondContact O-CB 3.38Å; V174-H178 PolarHBondContact O-N 2.95Å; V174-H178 VanDerWaalsContact O-N 3.09Å
179	F	82.1	Confident	83.1	Confident	13 Å²	13	44.8 Å²	44.8	6%	0.057	23%	0.234	C	C	.	.			trans	-141.7	37	177.8	-67.6	-79.1	0	0	0	112.3	K159 V174 L175 Y181 L182 I183 K246 L247 V250	K159-F179 VanDerWaalsContact NZ-CZ 3.33Å; V174-F179 HydrophobicContact CG1-CD2 3.78Å; V174-F179 HydrophobicContact CG1-CE2 3.68Å; V174-F179 WeakPolarHBondContact O-CD2 3.22Å; V174-F179 PolarHBondContact O-N 3.37Å; L175-F179 HydrophobicContact CD1-CB 4.14Å; L175-F179 CarbonylContact O-C 3.51Å; L175-F179 WeakPolarHBondContact O-CA 3.25Å; L175-F179 PolarHBondContact O-N 3.3Å; L175-F179 VanDerWaalsContact O-N 3.15Å; F179-Y181 AromaticContact CD1-CE1 3.76Å; F179-Y181 HydrophobicContact CD1-CE1 3.76Å; F179-Y181 AromaticContact CD1-CZ 3.92Å; F179-Y181 PolarHBondContact O-N 3.18Å; F179-L182 HydrophobicContact CB-CB 4.37Å; F179-L182 HydrophobicContact CB-CD1 3.93Å; F179-L182 HydrophobicContact CB-CG 4.2Å; F179-L182 HydrophobicContact CD1-CD1 3.81Å; F179-L182 HydrophobicContact CD1-CG 4.44Å; F179-L182 HydrophobicContact CG-CD1 4.09Å; F179-L182 WeakPolarHBondContact O-CA 3.47Å; F179-L182 WeakPolarHBondContact O-CB 3.48Å; F179-L182 PolarHBondContact O-N 2.94Å; F179-I183 PolarHBondContact O-N 3.33Å; F179-K246 HydrophobicContact CE1-CG 4.41Å; F179-L247 HydrophobicContact CD2-CD2 3.84Å; F179-L247 HydrophobicContact CE2-CD2 4.26Å; F179-V250 HydrophobicContact CE2-CG2 3.96Å; F179-V250 HydrophobicContact CZ-CG2 3.96Å
180	H	75.8	Confident	82.2	Confident	117 Å²	117	49.9 Å²	49.9	54%	0.542	25%	0.248	S	C	.	.	H	α-helix	trans	-51.9	-32.5	179.1	-162.9	-84.1	0	0	0	113.7	L175 L182 I183	L175-H180 PolarHBondContact O-N 2.91Å; H180-L182 VanDerWaalsContact C-N 3.29Å; H180-L182 PolarHBondContact O-N 2.87Å; H180-I183 WeakPolarHBondContact O-CB 3.49Å; H180-I183 PolarHBondContact O-N 3.14Å
181	Y	77.8	Confident	80.4	Confident	134 Å²	134	54.6 Å²	54.6	53%	0.525	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-29.5	174.7	72.5	-90.7	0	0	0	113.7	F179 S185 K246	F179-Y181 AromaticContact CD1-CE1 3.76Å; F179-Y181 HydrophobicContact CD1-CE1 3.76Å; F179-Y181 AromaticContact CD1-CZ 3.92Å; F179-Y181 PolarHBondContact O-N 3.18Å; Y181-S185 PolarHBondContact O-OG 3.17Å; Y181-K246 PolarHBondContact OH-NZ 3.42Å; Y181-K246 VanDerWaalsContact OH-NZ 3.1Å
182	L	79.9	Confident	78.6	Confident	22 Å²	22	60.5 Å²	60.5	12%	0.115	30%	0.304	C	S	.	.	H	α-helix	trans	-73.8	-37.7	174.5	-62.9	-178.8	0	0	0	111.1	L175 F179 H180 N184 S185 Y186 L243 K246	L175-L182 HydrophobicContact CD1-CB 4.25Å; F179-L182 HydrophobicContact CB-CB 4.37Å; F179-L182 HydrophobicContact CB-CD1 3.93Å; F179-L182 HydrophobicContact CB-CG 4.2Å; F179-L182 HydrophobicContact CD1-CD1 3.81Å; F179-L182 HydrophobicContact CD1-CG 4.44Å; F179-L182 HydrophobicContact CG-CD1 4.09Å; F179-L182 WeakPolarHBondContact O-CA 3.47Å; F179-L182 WeakPolarHBondContact O-CB 3.48Å; F179-L182 PolarHBondContact O-N 2.94Å; H180-L182 VanDerWaalsContact C-N 3.29Å; H180-L182 PolarHBondContact O-N 2.87Å; L182-N184 VanDerWaalsContact C-N 3.28Å; L182-N184 PolarHBondContact O-N 2.97Å; L182-S185 WeakPolarHBondContact O-CA 3.41Å; L182-S185 VanDerWaalsContact O-CB 3.23Å; L182-S185 WeakPolarHBondContact O-CB 3.44Å; L182-S185 PolarHBondContact O-N 2.98Å; L182-Y186 WeakPolarHBondContact O-CD2 3.3Å; L182-Y186 PolarHBondContact O-N 3.4Å; L182-L243 HydrophobicContact CB-CD1 4.3Å; L182-L243 HydrophobicContact CD1-CD1 3.58Å; L182-K246 HydrophobicContact CD1-CD 4.09Å
183	I	80.6	Confident	76.2	Confident	19 Å²	19	65.5 Å²	65.5	10%	0.097	33%	0.329	C	S	.	.	H	α-helix	trans	-51.2	-48.3	179.3	-68.2	-177.4	0	0	0	111.2	L175 V176 F179 H180 S185 Y186 F187 M231	L175-I183 HydrophobicContact CD1-CG1 3.83Å; L175-I183 HydrophobicContact CD2-CG1 4.34Å; L175-I183 HydrophobicContact CG-CD1 4.06Å; L175-I183 HydrophobicContact CG-CG1 3.73Å; V176-I183 HydrophobicContact CB-CD1 4.26Å; V176-I183 HydrophobicContact CG2-CD1 3.82Å; F179-I183 PolarHBondContact O-N 3.33Å; H180-I183 WeakPolarHBondContact O-CB 3.49Å; H180-I183 PolarHBondContact O-N 3.14Å; I183-S185 PolarHBondContact O-N 3.34Å; I183-S185 VanDerWaalsContact O-N 3.1Å; I183-Y186 PolarHBondContact O-N 2.91Å; I183-F187 HydrophobicContact CB-CD2 4.43Å; I183-F187 HydrophobicContact CG2-CB 4.48Å; I183-F187 HydrophobicContact CG2-CD2 3.49Å; I183-F187 VanDerWaalsContact CG2-CD2 3.49Å; I183-F187 HydrophobicContact CG2-CE2 3.95Å; I183-F187 HydrophobicContact CG2-CG 4.11Å; I183-F187 PolarHBondContact O-N 3.01Å; I183-M231 HydrophobicContact CD1-CE 4.36Å
184	N	77.1	Confident	74.1	Confident	97 Å²	97	71.8 Å²	71.8	52%	0.519	36%	0.36	S	S	.	.	H	α-helix	trans	-63.7	-19.4	-179.4	-65.4	0.3	0	0	0	114	L182 K218	L182-N184 VanDerWaalsContact C-N 3.28Å; L182-N184 PolarHBondContact O-N 2.97Å; N184-K218 PolarHBondContact O-NZ 3.2Å
185	S	80.8	Confident	71.5	Confident	56 Å²	56	78.4 Å²	78.4	39%	0.392	40%	0.395	S	S	.	.	H	α-helix	trans	-83.3	-14.9	175.7	-52.8	0	0	0	0	113.6	Y181 L182 I183	Y181-S185 PolarHBondContact O-OG 3.17Å; L182-S185 WeakPolarHBondContact O-CA 3.41Å; L182-S185 VanDerWaalsContact O-CB 3.23Å; L182-S185 WeakPolarHBondContact O-CB 3.44Å; L182-S185 PolarHBondContact O-N 2.98Å; I183-S185 PolarHBondContact O-N 3.34Å; I183-S185 VanDerWaalsContact O-N 3.1Å
186	Y	80.5	Confident	68.9	Low	14 Å²	14	87.2 Å²	87.2	6%	0.055	44%	0.437	C	S	.	.	H	α-helix	trans	-113.6	-35	179.5	-73.4	-86.2	0	0	0	112.8	L182 I183 C217 K218 K219 I234 H240 D242 L243	L182-Y186 WeakPolarHBondContact O-CD2 3.3Å; L182-Y186 PolarHBondContact O-N 3.4Å; I183-Y186 PolarHBondContact O-N 2.91Å; Y186-C217 CarbonylContact O-C 3.57Å; Y186-C217 VanDerWaalsContact O-CA 3.31Å; Y186-C217 WeakPolarHBondContact O-CA 3.49Å; Y186-K218 PolarHBondContact O-N 2.93Å; Y186-K219 HydrophobicContact CD1-CB 4.01Å; Y186-K219 HydrophobicContact CD1-CG 3.61Å; Y186-K219 HydrophobicContact CE1-CB 4Å; Y186-K219 HydrophobicContact CE1-CG 3.57Å; Y186-K219 HydrophobicContact CG-CG 4.36Å; Y186-I234 HydrophobicContact CD1-CG2 4.42Å; Y186-I234 HydrophobicContact CG-CG2 4.25Å; Y186-H240 HydrophobicContact CE1-CB 4.26Å; Y186-H240 AromaticContact CE1-CG 3.81Å; Y186-H240 AromaticContact CE1-ND1 3.53Å; Y186-D242 PolarHBondContact OH-OD1 2.86Å; Y186-D242 PolarHBondContact OH-OD2 2.93Å; Y186-L243 HydrophobicContact CD2-CD2 4.11Å; Y186-L243 HydrophobicContact CE2-CB 4.43Å; Y186-L243 HydrophobicContact CE2-CD1 4.25Å; Y186-L243 HydrophobicContact CE2-CD2 3.88Å; Y186-L243 HydrophobicContact CE2-CG 4.42Å
187	F	85.3	Confident	66.3	Low	29 Å²	29	91.8 Å²	91.8	13%	0.127	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	119.1	-178	-84.6	-99.9	0	0	0	112.9	I183 K218 Q227 L230 M231 I234	I183-F187 HydrophobicContact CB-CD2 4.43Å; I183-F187 HydrophobicContact CG2-CB 4.48Å; I183-F187 HydrophobicContact CG2-CD2 3.49Å; I183-F187 VanDerWaalsContact CG2-CD2 3.49Å; I183-F187 HydrophobicContact CG2-CE2 3.95Å; I183-F187 HydrophobicContact CG2-CG 4.11Å; I183-F187 PolarHBondContact O-N 3.01Å; F187-K218 VanDerWaalsContact O-CD 3.27Å; F187-K218 WeakPolarHBondContact O-CD 3.48Å; F187-K218 WeakPolarHBondContact O-CE 3.4Å; F187-K218 PolarHBondContact O-NZ 3.16Å; F187-Q227 HydrophobicContact CD1-CG 4.48Å; F187-Q227 HydrophobicContact CE1-CG 3.83Å; F187-L230 HydrophobicContact CD1-CD2 3.45Å; F187-L230 VanDerWaalsContact CD1-CD2 3.45Å; F187-L230 HydrophobicContact CD1-CG 3.99Å; F187-L230 HydrophobicContact CE1-CB 3.99Å; F187-L230 HydrophobicContact CE1-CD2 3.64Å; F187-L230 HydrophobicContact CE1-CG 3.68Å; F187-L230 HydrophobicContact CG-CD2 4.14Å; F187-L230 HydrophobicContact CZ-CB 4.46Å; F187-L230 HydrophobicContact CZ-CD2 4.46Å; F187-L230 HydrophobicContact CZ-CG 4.1Å; F187-M231 HydrophobicContact CE2-CE 3.73Å; F187-M231 HydrophobicContact CE2-SD 4.17Å; F187-M231 HydrophobicContact CZ-CB 4.02Å; F187-M231 HydrophobicContact CZ-CE 3.58Å; F187-M231 HydrophobicContact CZ-SD 4.11Å; F187-I234 HydrophobicContact CD2-CD1 3.54Å; F187-I234 HydrophobicContact CE1-CD1 4.46Å; F187-I234 HydrophobicContact CE2-CD1 3.27Å; F187-I234 HydrophobicContact CG-CD1 4.27Å; F187-I234 HydrophobicContact CZ-CD1 3.77Å
188	G	81.6	Confident	64.7	Low	4 Å²	4	93.4 Å²	93.4	4%	0.041	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	147.2	166.2	0	0	0	0	0	111.5	F216	G188-F216 VanDerWaalsContact CA-O 3.29Å; G188-F216 WeakPolarHBondContact CA-O 3.26Å; G188-F216 PolarHBondContact N-O 3.02Å; G188-F216 PolarHBondContact O-N 3.25Å
189	L	79.4	Confident	62.1	Low	104 Å²	104	99.4 Å²	99.4	55%	0.545	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135	170.5	-177.6	75.3	0	0	0	106.2	K214 Y215	L189-K214 CarbonylContact C-O 3.6Å; L189-K214 WeakPolarHBondContact CA-O 3.43Å; L189-K214 HydrophobicContact CD1-CB 4.28Å; L189-Y215 HydrophobicContact CD1-CD1 3.85Å; L189-Y215 HydrophobicContact CD1-CE1 3.73Å
190	R	67.8	Low	59.7	Low	146 Å²	146	104.2 Å²	104.2	55%	0.551	52%	0.515	S	S	*	.			trans	-86.3	119.5	164.9	-71.3	-165	179.7	-147.5	2.1	109	E192 K214 F216	R190-E192 WeakPolarHBondContact CD-OE1 3.48Å; R190-K214 PolarHBondContact N-O 2.89Å; R190-F216 HydrophobicContact CG-CD1 3.96Å; R190-F216 HydrophobicContact CG-CE1 3.77Å
191	T	48.6	Very low	57.4	Low	98 Å²	98	105 Å²	105	60%	0.601	52%	0.524	S	S	*	.			trans	-86.6	118.4	153.6	-39.8	0	0	0	0	106	E193	T191-E193 HydrophobicContact CG2-CG 3.72Å; T191-E193 WeakPolarHBondContact CG2-OE1 3.34Å
192	E	50.1	Low	55.1	Low	142 Å²	142	104.8 Å²	104.8	66%	0.664	53%	0.532	S	S	*	.			trans	-85.1	114.6	168	-55	-78	121.2	0	0	105.5	R190	R190-E192 WeakPolarHBondContact CD-OE1 3.48Å
193	E	39.1	Very low	52.7	Low	169 Å²	169	108.5 Å²	108.5	79%	0.79	56%	0.556	S	S	*	*			trans	-113.4	160.7	175.6	-63	-173.7	-156.7	0	0	109	T191	T191-E193 HydrophobicContact CG2-CG 3.72Å; T191-E193 WeakPolarHBondContact CG2-OE1 3.34Å
194	M	41.8	Very low	50.4	Low	171 Å²	171	114.9 Å²	114.9	84%	0.842	59%	0.589	S	S	*	*			trans	-93.4	178.2	-144.5	-155.9	160.3	66.8	0	0	115.3
195	D	33.5	Very low	48.5	Very low	138 Å²	138	114.3 Å²	114.3	74%	0.738	59%	0.592	S	S	*	*			trans	97.4	130	174	-53.5	-22.4	0	0	0	114.9
196	E	32.5	Very low	46.3	Very low	186 Å²	186	118.6 Å²	118.6	87%	0.869	61%	0.61	S	S	*	*			cis	-147.4	167	6	-128.9	-177.7	149.8	0	0	113
197	Q	30	Very low	44.1	Very low	160 Å²	160	124.5 Å²	124.5	75%	0.748	64%	0.638	S	S	*	*			trans	-138.7	173.9	173.1	-104.9	-94.3	-37.6	0	0	106.5
198	P	51.1	Low	41.6	Very low	93 Å²	93	131.2 Å²	131.2	60%	0.604	67%	0.667	S	S	*	*			cis	-138.4	175.9	10.3	39.9	-21.1	0	0	0	116.7
199	K	29.7	Very low	39.6	Very low	175 Å²	175	138.7 Å²	138.7	76%	0.761	70%	0.704	S	S	*	*				171.1	104.9	125.5	-93.5	163	-174.7	175.4	0	113
200	T	30	Very low	37.7	Very low	114 Å²	114	139 Å²	139	70%	0.699	71%	0.712	S	S	*	*				32	131.3	122.9	60.6	0	0	0	0	119.6
201	N	28.4	Very low	37	Very low	133 Å²	133	137.3 Å²	137.3	71%	0.711	72%	0.72	S	S	*	*			cis	-162	-176.5	-1.6	-109.8	31.6	0	0	0	105
202	D	29	Very low	37.3	Very low	130 Å²	130	137.5 Å²	137.5	70%	0.695	72%	0.723	S	S	*	*			cis	-166	175.9	3.3	-125	-37.2	0	0	0	106.2
203	T	29.8	Very low	37.7	Very low	101 Å²	101	133.4 Å²	133.4	62%	0.62	71%	0.706	S	S	*	*			cis	-160	161.6	-13	-150.8	0	0	0	0	109.3
204	L	32.9	Very low	39.1	Very low	152 Å²	152	132 Å²	132	80%	0.796	70%	0.697	S	S	*	*			trans	49.3	138	167.2	-59.1	168.3	0	0	0	119.1
205	S	36.2	Very low	40.9	Very low	85 Å²	85	127.2 Å²	127.2	59%	0.594	67%	0.67	S	S	*	*			cis	-164.6	126.6	-13.7	-112.9	0	0	0	0	113.2
206	I	35.3	Very low	43.3	Very low	147 Å²	147	122.8 Å²	122.8	75%	0.754	65%	0.645	S	S	*	*			trans	56.3	113.7	133	-52.4	168.9	0	0	0	120.6
207	E	33.2	Very low	45.9	Very low	138 Å²	138	114 Å²	114	65%	0.645	60%	0.603	S	S	*	*				-163.5	120.7	114.6	-100.5	-88.4	90.5	0	0	112.4
208	K	34.5	Very low	48.5	Very low	169 Å²	169	111.4 Å²	111.4	74%	0.735	59%	0.59	S	S	*	*			trans	33.7	99.3	154.4	-63.2	168.5	-170.1	125.5	0	120.8
209	I	37.8	Very low	50	Low	162 Å²	162	113.2 Å²	113.2	83%	0.831	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-100.8	139.3	151	-58.9	174.9	0	0	0	108.7
210	P	39.8	Very low	52.6	Low	109 Å²	109	106.8 Å²	106.8	71%	0.708	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-67.3	152.4	175.5	-19.8	33.1	0	0	0	113.5
211	P	54.6	Low	55	Low	111 Å²	111	106.7 Å²	106.7	72%	0.721	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-68	152.6	177.4	29.9	-35.9	0	0	0	112.2
212	P	53.3	Low	57.7	Low	103 Å²	103	101.6 Å²	101.6	67%	0.669	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-68.8	140.3	-177.9	27.5	-34.7	0	0	0	113.1	K214	P212-K214 PolarHBondContact O-N 3.13Å
213	D	58.9	Low	60.2	Low	56 Å²	56	100.1 Å²	100.1	30%	0.299	53%	0.528	S	S	.	.			trans	-64.3	98.2	179	-81.6	-4.2	0	0	0	112	Y215 N223 A224 S225	D213-Y215 PolarHBondContact O-N 3.48Å; D213-N223 HydrophobicContact CB-CB 3.78Å; D213-N223 WeakPolarHBondContact OD2-CB 3.44Å; D213-A224 WeakPolarHBondContact OD2-CA 3.16Å; D213-A224 PolarHBondContact OD2-N 3.42Å; D213-S225 VanDerWaalsContact CG-N 3.3Å; D213-S225 WeakPolarHBondContact OD1-CA 3.4Å; D213-S225 VanDerWaalsContact OD1-CB 3.23Å; D213-S225 WeakPolarHBondContact OD1-CB 3.33Å; D213-S225 PolarHBondContact OD1-N 3.36Å; D213-S225 VanDerWaalsContact OD1-N 3.1Å; D213-S225 PolarHBondContact OD2-N 2.93Å
214	K	68.6	Low	62.6	Low	139 Å²	139	95.7 Å²	95.7	60%	0.604	50%	0.502	S	S	*	.			trans	-64.3	-24.3	-179.7	-62.7	-168.2	176.1	-169.2	0	114	L189 R190 P212	L189-K214 CarbonylContact C-O 3.6Å; L189-K214 WeakPolarHBondContact CA-O 3.43Å; L189-K214 HydrophobicContact CD1-CB 4.28Å; R190-K214 PolarHBondContact N-O 2.89Å; P212-K214 PolarHBondContact O-N 3.13Å
215	Y	80.4	Confident	64.8	Low	71 Å²	71	93 Å²	93	28%	0.278	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	140.2	-178.7	-56.4	-85.8	0	0	0	110.8	L189 D213 A224 Q227	L189-Y215 HydrophobicContact CD1-CD1 3.85Å; L189-Y215 HydrophobicContact CD1-CE1 3.73Å; D213-Y215 PolarHBondContact O-N 3.48Å; Y215-A224 WeakPolarHBondContact CB-O 3.45Å; Y215-A224 PolarHBondContact O-N 3.26Å; Y215-Q227 HydrophobicContact CD1-CB 4.26Å; Y215-Q227 HydrophobicContact CE1-CB 3.91Å; Y215-Q227 HydrophobicContact CE1-CG 4.48Å; Y215-Q227 HydrophobicContact CE2-CB 4.48Å
216	F	82.6	Confident	67	Low	45 Å²	45	91.2 Å²	91.2	20%	0.197	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	155.9	175.3	68.4	-84.9	0	0	0	112.3	G188 R190 K218 A222 L230	G188-F216 VanDerWaalsContact CA-O 3.29Å; G188-F216 WeakPolarHBondContact CA-O 3.26Å; G188-F216 PolarHBondContact N-O 3.02Å; G188-F216 PolarHBondContact O-N 3.25Å; R190-F216 HydrophobicContact CG-CD1 3.96Å; R190-F216 HydrophobicContact CG-CE1 3.77Å; F216-K218 HydrophobicContact CE2-CG 4.27Å; F216-A222 CarbonylContact C-O 3.6Å; F216-A222 VanDerWaalsContact CA-O 3.29Å; F216-A222 WeakPolarHBondContact CA-O 3.38Å; F216-L230 WeakPolarHBondContact O-CD2 3.28Å
217	C	87.6	Confident	69.2	Low	0 Å²	0	89.6 Å²	89.6	0%	0	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	116.9	174.5	-175.8	0	0	0	0	111.4	Y186 K219 C220 N221 A222 L230 H240	Y186-C217 CarbonylContact O-C 3.57Å; Y186-C217 VanDerWaalsContact O-CA 3.31Å; Y186-C217 WeakPolarHBondContact O-CA 3.49Å; C217-K219 PolarHBondContact O-N 3.19Å; C217-C220 WeakPolarHBondContact CB-SG 2.96Å; C217-C220 PolarHBondContact O-N 3.4Å; C217-N221 WeakPolarHBondContact O-CA 3.2Å; C217-N221 PolarHBondContact O-N 3.36Å; C217-A222 HydrophobicContact CB-CB 4.47Å; C217-A222 PolarHBondContact N-O 3.08Å; C217-L230 HydrophobicContact CB-CD1 3.75Å; C217-H240 PolarHBondContact SG-NE2 3.08Å; C217-H240 VanDerWaalsContact SG-NE2 3.36Å
218	K	84.8	Confident	71.6	Confident	106 Å²	106	87.4 Å²	87.4	46%	0.461	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-9.7	176.5	-78.5	172.8	171.1	151	0	115.5	N184 Y186 F187 F216	N184-K218 PolarHBondContact O-NZ 3.2Å; Y186-K218 PolarHBondContact O-N 2.93Å; F187-K218 VanDerWaalsContact O-CD 3.27Å; F187-K218 WeakPolarHBondContact O-CD 3.48Å; F187-K218 WeakPolarHBondContact O-CE 3.4Å; F187-K218 PolarHBondContact O-NZ 3.16Å; F216-K218 HydrophobicContact CE2-CG 4.27Å
219	K	81.9	Confident	73.9	Confident	131 Å²	131	81.3 Å²	81.3	57%	0.57	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-17.7	-176.3	-69.4	-60.9	-169.6	179.5	0	115	Y186 C217	Y186-K219 HydrophobicContact CD1-CB 4.01Å; Y186-K219 HydrophobicContact CD1-CG 3.61Å; Y186-K219 HydrophobicContact CE1-CB 4Å; Y186-K219 HydrophobicContact CE1-CG 3.57Å; Y186-K219 HydrophobicContact CG-CG 4.36Å; C217-K219 PolarHBondContact O-N 3.19Å
220	C	84.7	Confident	76.2	Confident	41 Å²	41	73.6 Å²	73.6	28%	0.277	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.9	2.9	-179.4	61.3	0	0	0	0	113.2	C217 A222 H233 I239	C217-C220 WeakPolarHBondContact CB-SG 2.96Å; C217-C220 PolarHBondContact O-N 3.4Å; C220-A222 PolarHBondContact O-N 3.43Å; C220-A222 VanDerWaalsContact SG-CB 3.56Å; C220-H233 PolarHBondContact SG-NE2 3.16Å; C220-I239 HydrophobicContact CB-CD1 3.99Å; C220-I239 HydrophobicContact CB-CG2 4.01Å
221	N	81.3	Confident	78.4	Confident	112 Å²	112	68.9 Å²	68.9	60%	0.599	38%	0.376	S	S	*	.			trans	52.7	16.3	-173.7	-66.8	-9.2	0	0	0	115.6	C217 N223	C217-N221 WeakPolarHBondContact O-CA 3.2Å; C217-N221 PolarHBondContact O-N 3.36Å; N221-N223 PolarHBondContact O-N 2.83Å; N221-N223 VanDerWaalsContact O-N 3.16Å; N221-N223 PolarHBondContact O-OD1 2.99Å
222	A	83.6	Confident	79.9	Confident	25 Å²	25	70.1 Å²	70.1	21%	0.207	37%	0.367	C	S	.	.			trans	-62.7	117	175.6	0	0	0	0	0	111	F216 C217 C220 H233	F216-A222 CarbonylContact C-O 3.6Å; F216-A222 VanDerWaalsContact CA-O 3.29Å; F216-A222 WeakPolarHBondContact CA-O 3.38Å; C217-A222 HydrophobicContact CB-CB 4.47Å; C217-A222 PolarHBondContact N-O 3.08Å; C220-A222 PolarHBondContact O-N 3.43Å; C220-A222 VanDerWaalsContact SG-CB 3.56Å; A222-H233 WeakPolarHBondContact CB-CE1 3.05Å
223	N	82.1	Confident	81.5	Confident	99 Å²	99	67.5 Å²	67.5	53%	0.529	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	153.3	173.6	-60.4	79.9	0	0	0	111.9	D213 N221	D213-N223 HydrophobicContact CB-CB 3.78Å; D213-N223 WeakPolarHBondContact OD2-CB 3.44Å; N221-N223 PolarHBondContact O-N 2.83Å; N221-N223 VanDerWaalsContact O-N 3.16Å; N221-N223 PolarHBondContact O-OD1 2.99Å
224	A	80.8	Confident	82.7	Confident	9 Å²	9	65 Å²	65	7%	0.074	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	133.9	172.7	0	0	0	0	0	112.3	D213 Y215 S226 A229 L230	D213-A224 WeakPolarHBondContact OD2-CA 3.16Å; D213-A224 PolarHBondContact OD2-N 3.42Å; Y215-A224 WeakPolarHBondContact CB-O 3.45Å; Y215-A224 PolarHBondContact O-N 3.26Å; A224-S226 PolarHBondContact O-N 3.39Å; A224-S226 VanDerWaalsContact O-N 3.15Å; A224-A229 HydrophobicContact CB-CB 4.12Å; A224-L230 HydrophobicContact CB-CB 3.8Å
225	S	78.3	Confident	83.6	Confident	95 Å²	95	58.8 Å²	58.8	66%	0.664	31%	0.306	S	S	*	.	S	Bend	trans	-69.4	-8.1	178.8	59.6	0	0	0	0	114.9	D213	D213-S225 VanDerWaalsContact CG-N 3.3Å; D213-S225 WeakPolarHBondContact OD1-CA 3.4Å; D213-S225 VanDerWaalsContact OD1-CB 3.23Å; D213-S225 WeakPolarHBondContact OD1-CB 3.33Å; D213-S225 PolarHBondContact OD1-N 3.36Å; D213-S225 VanDerWaalsContact OD1-N 3.1Å; D213-S225 PolarHBondContact OD2-N 2.93Å
226	S	83.3	Confident	83.7	Confident	48 Å²	48	58.6 Å²	58.6	34%	0.336	31%	0.312	S	S	.	.	S	Bend	trans	-155.8	156.4	175.7	62.4	0	0	0	0	112.5	A224 D228 A229 L230	A224-S226 PolarHBondContact O-N 3.39Å; A224-S226 VanDerWaalsContact O-N 3.15Å; S226-D228 PolarHBondContact O-N 2.93Å; S226-A229 PolarHBondContact O-N 2.76Å; S226-A229 VanDerWaalsContact O-N 3.16Å; S226-A229 WeakPolarHBondContact OG-CB 3.26Å; S226-A229 PolarHBondContact OG-N 3.3Å; S226-L230 PolarHBondContact O-N 3.27Å
227	Q	81.8	Confident	83.7	Confident	112 Å²	112	57.6 Å²	57.6	52%	0.523	31%	0.311	S	S	.	.	H	α-helix	trans	-56.5	-33.7	174.3	-174.1	178.6	-37.9	0	0	112.7	F187 Y215 M231	F187-Q227 HydrophobicContact CD1-CG 4.48Å; F187-Q227 HydrophobicContact CE1-CG 3.83Å; Y215-Q227 HydrophobicContact CD1-CB 4.26Å; Y215-Q227 HydrophobicContact CE1-CB 3.91Å; Y215-Q227 HydrophobicContact CE1-CG 4.48Å; Y215-Q227 HydrophobicContact CE2-CB 4.48Å; Q227-M231 WeakPolarHBondContact O-CB 3.28Å; Q227-M231 PolarHBondContact O-N 3.3Å
228	D	82.5	Confident	83.1	Confident	93 Å²	93	64.5 Å²	64.5	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-79.5	-31	178.3	-107.3	-29.5	0	0	0	113.3	K172 S226 L230 M231 Y232	K172-D228 IonicContact NZ-OD1 3.44Å; K172-D228 PolarHBondContact NZ-OD1 3.06Å; K172-D228 IonicContact NZ-OD2 2.63Å; K172-D228 PolarHBondContact NZ-OD2 3.47Å; S226-D228 PolarHBondContact O-N 2.93Å; D228-L230 VanDerWaalsContact C-N 3.34Å; D228-M231 PolarHBondContact O-N 3.09Å; D228-Y232 WeakPolarHBondContact O-CB 3.41Å; D228-Y232 PolarHBondContact O-N 2.82Å
229	A	83.8	Confident	82.7	Confident	41 Å²	41	64.7 Å²	64.7	34%	0.339	35%	0.352	S	S	.	.	H	α-helix	trans	-64.9	-39.3	167.4	0	0	0	0	0	111.4	A224 S226 Y232 H233	A224-A229 HydrophobicContact CB-CB 4.12Å; S226-A229 PolarHBondContact O-N 2.76Å; S226-A229 VanDerWaalsContact O-N 3.16Å; S226-A229 WeakPolarHBondContact OG-CB 3.26Å; S226-A229 PolarHBondContact OG-N 3.3Å; A229-Y232 WeakPolarHBondContact O-CB 3.45Å; A229-Y232 PolarHBondContact O-N 3.28Å; A229-H233 PolarHBondContact O-N 2.94Å
230	L	85.8	Confident	82.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-66	-41.5	172.9	-177	53.1	0	0	0	112	F187 F216 C217 A224 S226 D228 Y232 H233 I234	F187-L230 HydrophobicContact CD1-CD2 3.45Å; F187-L230 VanDerWaalsContact CD1-CD2 3.45Å; F187-L230 HydrophobicContact CD1-CG 3.99Å; F187-L230 HydrophobicContact CE1-CB 3.99Å; F187-L230 HydrophobicContact CE1-CD2 3.64Å; F187-L230 HydrophobicContact CE1-CG 3.68Å; F187-L230 HydrophobicContact CG-CD2 4.14Å; F187-L230 HydrophobicContact CZ-CB 4.46Å; F187-L230 HydrophobicContact CZ-CD2 4.46Å; F187-L230 HydrophobicContact CZ-CG 4.1Å; F216-L230 WeakPolarHBondContact O-CD2 3.28Å; C217-L230 HydrophobicContact CB-CD1 3.75Å; A224-L230 HydrophobicContact CB-CB 3.8Å; S226-L230 PolarHBondContact O-N 3.27Å; D228-L230 VanDerWaalsContact C-N 3.34Å; L230-Y232 VanDerWaalsContact C-N 3.31Å; L230-Y232 PolarHBondContact O-N 3.29Å; L230-H233 PolarHBondContact O-N 3.39Å; L230-I234 HydrophobicContact CD1-CD1 3.77Å; L230-I234 HydrophobicContact CD1-CG1 4.13Å; L230-I234 HydrophobicContact CG-CD1 3.75Å; L230-I234 WeakPolarHBondContact O-CB 3.28Å; L230-I234 WeakPolarHBondContact O-CG1 3.47Å; L230-I234 PolarHBondContact O-N 3.15Å
231	M	86.3	Confident	82.4	Confident	9 Å²	9	64.7 Å²	64.7	4%	0.044	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-37.3	173.8	-172.4	61.7	76	0	0	111.9	K172 L175 V176 I183 F187 Q227 D228 L235	K172-M231 HydrophobicContact CD-CG 4.08Å; K172-M231 HydrophobicContact CG-CG 4.12Å; L175-M231 HydrophobicContact CD2-SD 3.91Å; V176-M231 HydrophobicContact CG2-CE 3.85Å; I183-M231 HydrophobicContact CD1-CE 4.36Å; F187-M231 HydrophobicContact CE2-CE 3.73Å; F187-M231 HydrophobicContact CE2-SD 4.17Å; F187-M231 HydrophobicContact CZ-CB 4.02Å; F187-M231 HydrophobicContact CZ-CE 3.58Å; F187-M231 HydrophobicContact CZ-SD 4.11Å; Q227-M231 WeakPolarHBondContact O-CB 3.28Å; Q227-M231 PolarHBondContact O-N 3.3Å; D228-M231 PolarHBondContact O-N 3.09Å; M231-L235 HydrophobicContact CG-CD1 4.05Å; M231-L235 WeakPolarHBondContact O-CB 3.42Å; M231-L235 VanDerWaalsContact O-CG 3.31Å; M231-L235 WeakPolarHBondContact O-CG 3.43Å; M231-L235 PolarHBondContact O-N 3.23Å; M231-L235 HydrophobicContact SD-CD1 3.97Å; M231-L235 HydrophobicContact SD-CG 4.33Å
232	Y	85.6	Confident	82.2	Confident	137 Å²	137	64 Å²	64	54%	0.537	34%	0.34	S	S	.	.	H	α-helix	trans	-62.2	-52.7	171.8	-171.1	-94.2	0	0	0	110.9	Y168 D228 A229 L230 I234 L235 T236	Y168-Y232 HydrophobicContact CD2-CD2 4.33Å; Y168-Y232 AromaticContact CE2-CD2 3.69Å; Y168-Y232 HydrophobicContact CE2-CD2 3.69Å; Y168-Y232 HydrophobicContact CE2-CE2 4.33Å; Y168-Y232 HydrophobicContact CE2-CG 4.46Å; Y168-Y232 AromaticContact CZ-CD2 3.89Å; D228-Y232 WeakPolarHBondContact O-CB 3.41Å; D228-Y232 PolarHBondContact O-N 2.82Å; A229-Y232 WeakPolarHBondContact O-CB 3.45Å; A229-Y232 PolarHBondContact O-N 3.28Å; L230-Y232 VanDerWaalsContact C-N 3.31Å; L230-Y232 PolarHBondContact O-N 3.29Å; Y232-I234 VanDerWaalsContact C-N 3.35Å; Y232-I234 PolarHBondContact O-N 3.36Å; Y232-L235 PolarHBondContact O-N 2.86Å; Y232-L235 VanDerWaalsContact O-N 3.09Å; Y232-T236 HydrophobicContact CD1-CG2 4.45Å; Y232-T236 HydrophobicContact CD2-CG2 4.24Å; Y232-T236 HydrophobicContact CE1-CG2 4.18Å; Y232-T236 WeakPolarHBondContact CE1-OG1 3.37Å; Y232-T236 HydrophobicContact CE2-CG2 3.95Å; Y232-T236 HydrophobicContact CG-CG2 4.48Å; Y232-T236 PolarHBondContact O-N 3.46Å; Y232-T236 PolarHBondContact O-OG1 3.18Å; Y232-T236 VanDerWaalsContact O-OG1 3.05Å
233	H	85.9	Confident	82.1	Confident	49 Å²	49	63 Å²	63	23%	0.227	33%	0.331	C	S	.	.	H	α-helix	trans	-51.7	-50.9	175.8	-176.1	100	0	0	0	112	C220 A222 A229 L230 L235 T236 S237 H240	C220-H233 PolarHBondContact SG-NE2 3.16Å; A222-H233 WeakPolarHBondContact CB-CE1 3.05Å; A229-H233 PolarHBondContact O-N 2.94Å; L230-H233 PolarHBondContact O-N 3.39Å; H233-L235 PolarHBondContact O-N 2.99Å; H233-T236 PolarHBondContact O-N 3.43Å; H233-S237 PolarHBondContact NE2-OG 2.72Å; H233-S237 WeakPolarHBondContact O-CB 3.2Å; H233-S237 PolarHBondContact O-N 2.85Å; H233-H240 AromaticContact CD2-CD2 3.95Å; H233-H240 AromaticContact CD2-NE2 3.67Å; H233-H240 AromaticContact NE2-NE2 3.58Å
234	I	86.1	Confident	82	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-27.8	-177.1	-70.2	162.8	0	0	0	112.6	L175 Y186 F187 L230 Y232 L243	L175-I234 HydrophobicContact CD2-CG2 4.16Å; Y186-I234 HydrophobicContact CD1-CG2 4.42Å; Y186-I234 HydrophobicContact CG-CG2 4.25Å; F187-I234 HydrophobicContact CD2-CD1 3.54Å; F187-I234 HydrophobicContact CE1-CD1 4.46Å; F187-I234 HydrophobicContact CE2-CD1 3.27Å; F187-I234 HydrophobicContact CG-CD1 4.27Å; F187-I234 HydrophobicContact CZ-CD1 3.77Å; L230-I234 HydrophobicContact CD1-CD1 3.77Å; L230-I234 HydrophobicContact CD1-CG1 4.13Å; L230-I234 HydrophobicContact CG-CD1 3.75Å; L230-I234 WeakPolarHBondContact O-CB 3.28Å; L230-I234 WeakPolarHBondContact O-CG1 3.47Å; L230-I234 PolarHBondContact O-N 3.15Å; Y232-I234 VanDerWaalsContact C-N 3.35Å; Y232-I234 PolarHBondContact O-N 3.36Å; I234-L243 HydrophobicContact CG2-CD2 3.58Å
235	L	85.9	Confident	81.9	Confident	8 Å²	8	64.4 Å²	64.4	4%	0.042	34%	0.335	C	S	.	.	H	α-helix	trans	-98.2	-12.7	-177.2	-68.2	177.9	0	0	0	115.1	Y168 K171 K172 L175 M231 Y232 H233 L247	Y168-L235 HydrophobicContact CD2-CB 4.35Å; Y168-L235 HydrophobicContact CD2-CD1 4.46Å; Y168-L235 HydrophobicContact CE2-CB 3.95Å; Y168-L235 HydrophobicContact CE2-CD1 3.89Å; K171-L235 HydrophobicContact CB-CD1 4.27Å; K171-L235 HydrophobicContact CB-CD2 4.09Å; K171-L235 PolarHBondContact NZ-O 2.9Å; K172-L235 HydrophobicContact CB-CD1 3.8Å; K172-L235 HydrophobicContact CG-CD1 4.47Å; L175-L235 HydrophobicContact CB-CD2 4.35Å; L175-L235 HydrophobicContact CD2-CD2 3.56Å; L175-L235 HydrophobicContact CD2-CG 4.19Å; M231-L235 HydrophobicContact CG-CD1 4.05Å; M231-L235 WeakPolarHBondContact O-CB 3.42Å; M231-L235 VanDerWaalsContact O-CG 3.31Å; M231-L235 WeakPolarHBondContact O-CG 3.43Å; M231-L235 PolarHBondContact O-N 3.23Å; M231-L235 HydrophobicContact SD-CD1 3.97Å; M231-L235 HydrophobicContact SD-CG 4.33Å; Y232-L235 PolarHBondContact O-N 2.86Å; Y232-L235 VanDerWaalsContact O-N 3.09Å; H233-L235 PolarHBondContact O-N 2.99Å; L235-L247 HydrophobicContact CD2-CD1 3.57Å
236	T	83.2	Confident	82	Confident	66 Å²	66	64.2 Å²	64.2	41%	0.405	32%	0.323	S	S	.	.	H	α-helix	trans	-126.5	-8.5	-177.6	71.1	0	0	0	0	115.3	Y168 Y232 H233	Y168-T236 HydrophobicContact CD2-CG2 4.26Å; Y168-T236 HydrophobicContact CE2-CG2 4.41Å; Y232-T236 HydrophobicContact CD1-CG2 4.45Å; Y232-T236 HydrophobicContact CD2-CG2 4.24Å; Y232-T236 HydrophobicContact CE1-CG2 4.18Å; Y232-T236 WeakPolarHBondContact CE1-OG1 3.37Å; Y232-T236 HydrophobicContact CE2-CG2 3.95Å; Y232-T236 HydrophobicContact CG-CG2 4.48Å; Y232-T236 PolarHBondContact O-N 3.46Å; Y232-T236 PolarHBondContact O-OG1 3.18Å; Y232-T236 VanDerWaalsContact O-OG1 3.05Å; H233-T236 PolarHBondContact O-N 3.43Å
237	S	81.6	Confident	82.1	Confident	25 Å²	25	62 Å²	62	18%	0.175	31%	0.307	C	S	.	.			trans	-77.3	128.6	177.6	-178.6	0	0	0	0	111.4	H233 I239 H240	H233-S237 PolarHBondContact NE2-OG 2.72Å; H233-S237 WeakPolarHBondContact O-CB 3.2Å; H233-S237 PolarHBondContact O-N 2.85Å; S237-I239 PolarHBondContact O-N 3.04Å; S237-I239 VanDerWaalsContact O-N 3.07Å; S237-I239 WeakPolarHBondContact OG-CG1 3.43Å; S237-I239 PolarHBondContact OG-N 2.76Å; S237-H240 PolarHBondContact O-N 3.14Å
238	D	76.2	Confident	82.2	Confident	145 Å²	145	62.5 Å²	62.5	78%	0.775	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-58.7	-19.8	175.5	-70.4	-66.2	0	0	0	113.1	H240 R241	D238-H240 PolarHBondContact O-N 2.95Å; D238-R241 WeakPolarHBondContact O-CB 3.35Å; D238-R241 PolarHBondContact O-N 3.19Å
239	I	76.2	Confident	82.3	Confident	109 Å²	109	62.1 Å²	62.1	56%	0.559	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-66.7	-19.1	176.4	-49.6	171.9	0	0	0	111.6	C220 S237	C220-I239 HydrophobicContact CB-CD1 3.99Å; C220-I239 HydrophobicContact CB-CG2 4.01Å; S237-I239 PolarHBondContact O-N 3.04Å; S237-I239 VanDerWaalsContact O-N 3.07Å; S237-I239 WeakPolarHBondContact OG-CG1 3.43Å; S237-I239 PolarHBondContact OG-N 2.76Å
240	H	81.9	Confident	82.2	Confident	6 Å²	6	61 Å²	61	3%	0.028	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-116.3	32	-176.4	-52.2	-37.7	0	0	0	112.4	Y186 C217 H233 S237 D238 D242 L243 E244	Y186-H240 HydrophobicContact CE1-CB 4.26Å; Y186-H240 AromaticContact CE1-CG 3.81Å; Y186-H240 AromaticContact CE1-ND1 3.53Å; C217-H240 PolarHBondContact SG-NE2 3.08Å; C217-H240 VanDerWaalsContact SG-NE2 3.36Å; H233-H240 AromaticContact CD2-CD2 3.95Å; H233-H240 AromaticContact CD2-NE2 3.67Å; H233-H240 AromaticContact NE2-NE2 3.58Å; S237-H240 PolarHBondContact O-N 3.14Å; D238-H240 PolarHBondContact O-N 2.95Å; H240-D242 PolarHBondContact O-N 2.82Å; H240-L243 HydrophobicContact CB-CB 4.45Å; H240-L243 WeakPolarHBondContact O-CB 3.46Å; H240-L243 PolarHBondContact O-N 3.3Å; H240-L243 VanDerWaalsContact O-N 3.08Å; H240-E244 PolarHBondContact O-N 3.45Å; H240-E244 VanDerWaalsContact O-N 3.08Å
241	R	79.3	Confident	82.3	Confident	166 Å²	166	61.9 Å²	61.9	63%	0.626	30%	0.302	S	S	*	.	H	α-helix	trans	-63.8	-23.4	-179.8	-166.2	177.4	69.2	-174.2	0.9	113.5	D238 N245	D238-R241 WeakPolarHBondContact O-CB 3.35Å; D238-R241 PolarHBondContact O-N 3.19Å; R241-N245 VanDerWaalsContact O-CG 3.29Å; R241-N245 PolarHBondContact O-N 3.41Å; R241-N245 VanDerWaalsContact O-N 3.1Å; R241-N245 PolarHBondContact O-ND2 3.41Å
242	D	75.7	Confident	82.1	Confident	98 Å²	98	62.9 Å²	62.9	52%	0.524	31%	0.31	S	S	.	.	H	α-helix	trans	-64	-45.3	170.3	68.8	-54.7	0	0	0	111.4	Y186 H240 N245 K246	Y186-D242 PolarHBondContact OH-OD1 2.86Å; Y186-D242 PolarHBondContact OH-OD2 2.93Å; H240-D242 PolarHBondContact O-N 2.82Å; D242-N245 PolarHBondContact O-N 2.97Å; D242-K246 PolarHBondContact O-N 3Å
243	L	82.1	Confident	82.1	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-65	-43.5	175	-176.8	62.9	0	0	0	110.6	L175 L182 Y186 I234 H240 N245 K246 L247	L175-L243 HydrophobicContact CD1-CD1 4.18Å; L175-L243 HydrophobicContact CD1-CD2 4.44Å; L175-L243 HydrophobicContact CD2-CD2 4.28Å; L182-L243 HydrophobicContact CB-CD1 4.3Å; L182-L243 HydrophobicContact CD1-CD1 3.58Å; Y186-L243 HydrophobicContact CD2-CD2 4.11Å; Y186-L243 HydrophobicContact CE2-CB 4.43Å; Y186-L243 HydrophobicContact CE2-CD1 4.25Å; Y186-L243 HydrophobicContact CE2-CD2 3.88Å; Y186-L243 HydrophobicContact CE2-CG 4.42Å; I234-L243 HydrophobicContact CG2-CD2 3.58Å; H240-L243 HydrophobicContact CB-CB 4.45Å; H240-L243 WeakPolarHBondContact O-CB 3.46Å; H240-L243 PolarHBondContact O-N 3.3Å; H240-L243 VanDerWaalsContact O-N 3.08Å; L243-N245 PolarHBondContact O-N 3.1Å; L243-K246 PolarHBondContact O-N 3.11Å; L243-L247 HydrophobicContact CD1-CG 4.43Å; L243-L247 HydrophobicContact CG-CD1 4.12Å; L243-L247 HydrophobicContact CG-CG 4.44Å; L243-L247 WeakPolarHBondContact O-CG 3.19Å; L243-L247 PolarHBondContact O-N 3.47Å
244	E	79.1	Confident	81.3	Confident	47 Å²	47	63.5 Å²	63.5	22%	0.22	32%	0.318	C	S	.	.	H	α-helix	trans	-56	-48.5	175.5	173	165.3	-140.4	0	0	111.9	K171 H240 K246 L247 R248	K171-E244 WeakPolarHBondContact CE-OE1 3.35Å; K171-E244 VanDerWaalsContact NZ-CD 3.26Å; K171-E244 IonicContact NZ-OE1 3.57Å; K171-E244 PolarHBondContact NZ-OE1 3.1Å; H240-E244 PolarHBondContact O-N 3.45Å; H240-E244 VanDerWaalsContact O-N 3.08Å; E244-K246 PolarHBondContact O-N 3.24Å; E244-L247 PolarHBondContact O-N 2.88Å; E244-L247 VanDerWaalsContact O-N 3.14Å; E244-R248 WeakPolarHBondContact O-CB 3.4Å; E244-R248 PolarHBondContact O-N 3.42Å; E244-R248 IonicContact OE1-CZ 2.78Å; E244-R248 IonicContact OE1-NE 2.71Å; E244-R248 IonicContact OE1-NH2 3.49Å; E244-R248 PolarHBondContact OE1-NH2 3.18Å; E244-R248 IonicContact OE2-NH2 3.79Å; E244-R248 PolarHBondContact OE2-NH2 2.91Å
245	N	79.6	Confident	80.7	Confident	91 Å²	91	68.2 Å²	68.2	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-38	-179.6	-72.9	-30.7	0	0	0	111.9	R241 D242 L243 S249	R241-N245 VanDerWaalsContact O-CG 3.29Å; R241-N245 PolarHBondContact O-N 3.41Å; R241-N245 VanDerWaalsContact O-N 3.1Å; R241-N245 PolarHBondContact O-ND2 3.41Å; D242-N245 PolarHBondContact O-N 2.97Å; L243-N245 PolarHBondContact O-N 3.1Å; N245-S249 PolarHBondContact O-N 2.63Å
246	K	80.4	Confident	79	Confident	92 Å²	92	74.8 Å²	74.8	40%	0.4	37%	0.371	S	S	.	.	H	α-helix	trans	-75.3	-23.2	178.2	-167.2	170.3	177.7	-178.7	0	114	F179 Y181 L182 D242 L243 E244 S249	F179-K246 HydrophobicContact CE1-CG 4.41Å; Y181-K246 PolarHBondContact OH-NZ 3.42Å; Y181-K246 VanDerWaalsContact OH-NZ 3.1Å; L182-K246 HydrophobicContact CD1-CD 4.09Å; D242-K246 PolarHBondContact O-N 3Å; L243-K246 PolarHBondContact O-N 3.11Å; E244-K246 PolarHBondContact O-N 3.24Å; K246-S249 PolarHBondContact O-OG 3.12Å
247	L	85.6	Confident	76.8	Confident	1 Å²	1	82.9 Å²	82.9	1%	0.005	39%	0.394	C	S	.	.	H	α-helix	trans	-81.6	-40	169.8	-65.8	174	0	0	0	111.4	V174 L175 F179 L235 L243 E244 S249 V250	V174-L247 HydrophobicContact CB-CD2 4.21Å; V174-L247 HydrophobicContact CG1-CD2 3.69Å; L175-L247 HydrophobicContact CB-CD1 4.26Å; L175-L247 HydrophobicContact CB-CD2 3.96Å; L175-L247 HydrophobicContact CD1-CD2 4.4Å; F179-L247 HydrophobicContact CD2-CD2 3.84Å; F179-L247 HydrophobicContact CE2-CD2 4.26Å; L235-L247 HydrophobicContact CD2-CD1 3.57Å; L243-L247 HydrophobicContact CD1-CG 4.43Å; L243-L247 HydrophobicContact CG-CD1 4.12Å; L243-L247 HydrophobicContact CG-CG 4.44Å; L243-L247 WeakPolarHBondContact O-CG 3.19Å; L243-L247 PolarHBondContact O-N 3.47Å; E244-L247 PolarHBondContact O-N 2.88Å; E244-L247 VanDerWaalsContact O-N 3.14Å; L247-S249 VanDerWaalsContact C-N 3.33Å; L247-S249 PolarHBondContact O-N 2.74Å; L247-V250 PolarHBondContact O-N 2.71Å; L247-V250 VanDerWaalsContact O-N 3.08Å
248	R	83.5	Confident	74.6	Confident	122 Å²	122	88.2 Å²	88.2	46%	0.46	43%	0.425	S	S	.	.	H	α-helix	trans	-63.7	-34.1	-176.6	-173.3	177.6	-65.1	176.3	4	112.8	Y167 E244 V250 I251	Y167-R248 WeakPolarHBondContact OH-CG 3.23Å; Y167-R248 PolarHBondContact OH-NE 3.45Å; E244-R248 WeakPolarHBondContact O-CB 3.4Å; E244-R248 PolarHBondContact O-N 3.42Å; E244-R248 IonicContact OE1-CZ 2.78Å; E244-R248 IonicContact OE1-NE 2.71Å; E244-R248 IonicContact OE1-NH2 3.49Å; E244-R248 PolarHBondContact OE1-NH2 3.18Å; E244-R248 IonicContact OE2-NH2 3.79Å; E244-R248 PolarHBondContact OE2-NH2 2.91Å; R248-V250 PolarHBondContact O-N 2.83Å; R248-V250 VanDerWaalsContact O-N 3.14Å; R248-I251 PolarHBondContact O-N 2.96Å
249	S	83.8	Confident	72.8	Confident	86 Å²	86	84.8 Å²	84.8	60%	0.601	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-8.4	174.7	58.8	0	0	0	0	114.8	N245 K246 L247	N245-S249 PolarHBondContact O-N 2.63Å; K246-S249 PolarHBondContact O-OG 3.12Å; L247-S249 VanDerWaalsContact C-N 3.33Å; L247-S249 PolarHBondContact O-N 2.74Å
250	V	81.8	Confident	70.7	Confident	16 Å²	16	88.1 Å²	88.1	10%	0.097	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	4	179.9	-172.7	0	0	0	0	111.6	L158 K159 V174 F179 L247 R248	L158-V250 PolarHBondContact N-O 2.84Å; K159-V250 HydrophobicContact CB-CG1 4.25Å; K159-V250 HydrophobicContact CD-CG1 3.81Å; K159-V250 HydrophobicContact CG-CG1 3.73Å; V174-V250 HydrophobicContact CG1-CB 4.03Å; V174-V250 HydrophobicContact CG1-CG1 3.98Å; F179-V250 HydrophobicContact CE2-CG2 3.96Å; F179-V250 HydrophobicContact CZ-CG2 3.96Å; L247-V250 PolarHBondContact O-N 2.71Å; L247-V250 VanDerWaalsContact O-N 3.08Å; R248-V250 PolarHBondContact O-N 2.83Å; R248-V250 VanDerWaalsContact O-N 3.14Å
251	I	88	Confident	68.8	Low	19 Å²	19	94.8 Å²	94.8	10%	0.097	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121.1	-179.2	-58.7	170.1	0	0	0	109.2	F155 T156 Y167 M170 K171 V174 R248	F155-I251 HydrophobicContact CB-CG2 4Å; F155-I251 HydrophobicContact CD1-CG2 4.13Å; F155-I251 HydrophobicContact CG-CG2 4.46Å; T156-I251 WeakPolarHBondContact O-CA 3.49Å; Y167-I251 HydrophobicContact CD2-CD1 4.48Å; Y167-I251 HydrophobicContact CD2-CG2 4.28Å; Y167-I251 HydrophobicContact CE2-CB 4.4Å; Y167-I251 HydrophobicContact CE2-CD1 3.88Å; Y167-I251 HydrophobicContact CE2-CG2 3.96Å; M170-I251 HydrophobicContact CB-CD1 4.33Å; M170-I251 HydrophobicContact CG-CB 4.35Å; M170-I251 HydrophobicContact CG-CD1 3.75Å; M170-I251 HydrophobicContact CG-CG1 3.73Å; M170-I251 HydrophobicContact CG-CG2 3.71Å; K171-I251 HydrophobicContact CG-CD1 4.25Å; V174-I251 HydrophobicContact CG2-CD1 4.25Å; V174-I251 HydrophobicContact CG2-CG1 3.87Å; R248-I251 PolarHBondContact O-N 2.96Å
252	S	82.3	Confident	66.4	Low	31 Å²	31	97.1 Å²	97.1	22%	0.217	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	155.2	169.5	178.6	0	0	0	0	110.8	F155 T156 H254	F155-S252 CarbonylContact C-O 3.57Å; F155-S252 VanDerWaalsContact CA-O 3.3Å; F155-S252 WeakPolarHBondContact CA-O 3.48Å; T156-S252 PolarHBondContact N-O 3.01Å; T156-S252 PolarHBondContact O-N 3.09Å; T156-S252 WeakPolarHBondContact OG1-CB 3.48Å; S252-H254 PolarHBondContact OG-CD2 3.02Å; S252-H254 PolarHBondContact OG-CE1 3.14Å; S252-H254 PolarHBondContact OG-NE2 3.24Å
253	E	85.6	Confident	64.5	Low	111 Å²	111	99 Å²	99	52%	0.519	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121	179.4	-172.7	179.3	147.3	0	0	109.6	I153 F155	I153-E253 HydrophobicContact CG2-CG 3.49Å; I153-E253 VanDerWaalsContact CG2-CG 3.49Å; I153-E253 WeakPolarHBondContact CG2-OE1 3.38Å; F155-E253 HydrophobicContact CD1-CB 4.15Å; F155-E253 HydrophobicContact CD1-CG 4.08Å; F155-E253 HydrophobicContact CE1-CB 4.15Å; F155-E253 HydrophobicContact CE1-CG 3.72Å; F155-E253 HydrophobicContact CZ-CG 4.47Å
254	H	70.5	Confident	61.8	Low	87 Å²	87	105.7 Å²	105.7	40%	0.403	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	118.7	-178.2	-62.1	-86.7	0	0	0	111.1	S154 T156 S252	S154-H254 PolarHBondContact N-O 3.49Å; S154-H254 PolarHBondContact O-N 2.97Å; S154-H254 PolarHBondContact OG-O 3.05Å; T156-H254 PolarHBondContact OG1-CD2 3.46Å; T156-H254 PolarHBondContact OG1-NE2 2.87Å; T156-H254 VanDerWaalsContact OG1-NE2 3.15Å; S252-H254 PolarHBondContact OG-CD2 3.02Å; S252-H254 PolarHBondContact OG-CE1 3.14Å; S252-H254 PolarHBondContact OG-NE2 3.24Å
255	I	72.1	Confident	59.6	Low	104 Å²	104	110.4 Å²	110.4	53%	0.533	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.3	104.2	172.4	-54.6	175.8	0	0	0	107.9	D151 I153 R257	D151-I255 HydrophobicContact CB-CG2 4.06Å; I153-I255 HydrophobicContact CG1-CG1 4.48Å; I255-R257 PolarHBondContact O-N 2.99Å
256	K	50	Low	57.2	Low	146 Å²	146	114.2 Å²	114.2	64%	0.635	58%	0.58	S	S	*	*			trans	-79.4	104.8	-179	-68.8	-174.5	-178	-179.3	0	110.8
257	R	38.5	Very low	54.6	Low	235 Å²	235	113.9 Å²	113.9	89%	0.887	59%	0.594	S	S	*	*			trans	-98.9	110.5	177.9	-169.9	177.3	-170.5	155.9	2.4	110.7	I255	I255-R257 PolarHBondContact O-N 2.99Å
258	T	34.8	Very low	53.1	Low	137 Å²	137	119.6 Å²	119.6	84%	0.84	63%	0.631	S	S	*	*			trans	-117	128	-170.2	-55.6	0	0	0	0	113
259	G	37.5	Very low	50.3	Low	74 Å²	74	123.3 Å²	123.3	76%	0.763	65%	0.65	S	S	*	*			trans	108.3	82.6	149.5	0	0	0	0	0	118.8
260	L	32.3	Very low	48	Very low	178 Å²	178	125.1 Å²	125.1	93%	0.932	66%	0.66	S	S	*	*				-153.2	140.6	117	-163.7	66.3	0	0	0	109.5
261	L	41.6	Very low	45.4	Very low	147 Å²	147	128.8 Å²	128.8	77%	0.77	69%	0.692	S	S	*	*			trans	-114.6	145.8	-177.9	-77.9	164.1	0	0	0	111.1
262	K	29.8	Very low	42.6	Very low	215 Å²	215	131.5 Å²	131.5	94%	0.935	72%	0.718	S	S	*	*				-160.3	161.9	111.1	-108.3	177	-179.7	-175.1	0	111.9
263	Q	35.7	Very low	40.1	Very low	137 Å²	137	137.7 Å²	137.7	64%	0.64	74%	0.743	S	S	*	*			trans	-147.5	141.4	-160.4	169.9	-168.9	14.5	0	0	107.7	H265	Q263-H265 PolarHBondContact NE2-CD2 3.3Å; Q263-H265 PolarHBondContact NE2-NE2 3.38Å
264	T	25.8	Very low	37.6	Very low	144 Å²	144	140.4 Å²	140.4	88%	0.883	76%	0.76	S	S	*	*			trans	-139.9	120.4	165.4	44.5	0	0	0	0	109.1
265	H	33.3	Very low	35.4	Very low	145 Å²	145	141.2 Å²	141.2	67%	0.671	78%	0.781	S	S	*	*			trans	-85	152.7	171.7	-84.6	-103.7	0	0	0	111.1	Q263	Q263-H265 PolarHBondContact NE2-CD2 3.3Å; Q263-H265 PolarHBondContact NE2-NE2 3.38Å
266	I	29.1	Very low	33.1	Very low	172 Å²	172	140.8 Å²	140.8	88%	0.882	79%	0.793	S	S	*	*			trans	-126.3	148.9	143.9	-60.4	-178.1	0	0	0	106.6
267	A	25	Very low	32.9	Very low	84 Å²	84	139.7 Å²	139.7	69%	0.694	80%	0.802	S	S	*	*			trans	-125.9	-175	-166	0	0	0	0	0	111
268	P	55.2	Low	32.4	Very low	121 Å²	121	132.2 Å²	132.2	79%	0.786	79%	0.79	S	S	*	*			trans	-127.5	-169.4	-130.2	37.5	-17.2	0	0	0	116.3
269	K	24.7	Very low	32.1	Very low	200 Å²	200	133.7 Å²	133.7	87%	0.87	79%	0.793	S	S	*	*			trans	91.1	159.2	176.1	-67.2	-174.4	172.3	-175.9	0	116.2
270	P	33.8	Very low	31.6	Very low	124 Å²	124	133.5 Å²	133.5	81%	0.805	79%	0.791	S	S	*	*			cis	-130.8	-161.2	-29.5	34.1	-13.8	0	0	0	112.8
271	A	27.4	Very low	31.4	Very low	94 Å²	94	130.8 Å²	130.8	78%	0.777	79%	0.787	S	S	*	*			trans	-96.3	-176.7	174.1	0	0	0	0	0	111.7
272	A	30.7	Very low	30.7	Very low	76 Å²	76	128.4 Å²	128.4	63%	0.628	79%	0.788	S	S	*	*			cis	-164.1	178.9	14.7	0	0	0	0	0	113.8
273	H	28.9	Very low	31.2	Very low	160 Å²	160	124.1 Å²	124.1	74%	0.741	78%	0.782	S	S	*	*			trans	72.3	108.2	155.2	-63	-64.3	0	0	0	124.3
274	L	32.8	Very low	30.8	Very low	168 Å²	168	123.6 Å²	123.6	88%	0.88	79%	0.794	S	S	*	*				41.6	123.7	123.8	-71	168.1	0	0	0	123.6
275	A	23.8	Very low	30.8	Very low	104 Å²	104	120.9 Å²	120.9	86%	0.86	79%	0.786	S	S	*	*			trans	-158.2	165.4	132.4	0	0	0	0	0	111.2
276	A	25.4	Very low	30.9	Very low	95 Å²	95	119.6 Å²	119.6	79%	0.785	79%	0.791	S	S	*	*			trans	-148	-174.7	175.4	0	0	0	0	0	108.1
277	P	45.2	Very low	30.8	Very low	124 Å²	124	115.7 Å²	115.7	81%	0.805	78%	0.784	S	S	*	*			cis	-140.4	-163.3	1	40	-18.1	0	0	0	115.3
278	A	28.5	Very low	31.5	Very low	78 Å²	78	117.6 Å²	117.6	65%	0.645	79%	0.789	S	S	*	*			trans	120.4	122.7	134.3	0	0	0	0	0	120.9
279	N	27.1	Very low	30.8	Very low	168 Å²	168	117 Å²	117	90%	0.898	79%	0.785	S	S	*	*			trans	61.6	145	144.3	-54.5	-10.9	0	0	0	121.5
280	G	27.7	Very low	31.5	Very low	70 Å²	70	112.6 Å²	112.6	72%	0.722	78%	0.777	S	S	*	*			cis	172.9	166.8	-8.9	0	0	0	0	0	115.6
281	S	27.6	Very low	31.1	Very low	121 Å²	121	111.8 Å²	111.8	85%	0.846	77%	0.773	S	S	*	*			trans	69.1	100.6	156.3	-55.6	0	0	0	0	123.1
282	A	27.2	Very low	31	Very low	97 Å²	97	116.5 Å²	116.5	80%	0.802	78%	0.777	S	S	*	*				48.1	165.1	109.4	0	0	0	0	0	122.8
283	P	40.3	Very low	30.6	Very low	125 Å²	125	121 Å²	121	81%	0.812	78%	0.784	S	S	*	*			cis	-136.8	180	-13.8	32.1	-10.1	0	0	0	117.4
284	S	26.7	Very low	30.4	Very low	125 Å²	125	121.3 Å²	121.3	87%	0.874	79%	0.79	S	S	*	*			trans	98.4	162.8	145.1	-138	0	0	0	0	122.3
285	A	25.9	Very low	30.2	Very low	88 Å²	88	117.6 Å²	117.6	73%	0.727	78%	0.784	S	S	*	*			trans	-141.7	-168.6	-167.8	0	0	0	0	0	110
286	P	37.1	Very low	30.6	Very low	118 Å²	118	119.6 Å²	119.6	77%	0.766	78%	0.779	S	S	*	*			cis	-143.3	174.3	7.2	45.3	-25.8	0	0	0	119
287	A	25.8	Very low	30.8	Very low	90 Å²	90	121 Å²	121	74%	0.744	78%	0.78	S	S	*	*			trans	30.5	160.9	136.9	0	0	0	0	0	124.6
288	P	39.2	Very low	29.9	Very low	123 Å²	123	122.3 Å²	122.3	80%	0.799	78%	0.776	S	S	*	*			cis	-130.2	-116.5	-19.2	29.3	-2.1	0	0	0	115.9
289	P	41.3	Very low	29.9	Very low	108 Å²	108	124.4 Å²	124.4	70%	0.701	78%	0.776	S	S	*	*			trans	-128.3	-152.7	-139.2	45.8	-22.8	0	0	0	113.6
290	P	40.1	Very low	30	Very low	108 Å²	108	120.7 Å²	120.7	70%	0.701	76%	0.763	S	S	*	*			cis	-134	174.5	-15.7	42.9	-26.2	0	0	0	116.6
291	C	24.6	Very low	30.6	Very low	107 Å²	107	122.6 Å²	122.6	72%	0.723	76%	0.763	S	S	*	*			trans	59	135.8	145.8	-70	0	0	0	0	125.5
292	F	25.4	Very low	30.7	Very low	194 Å²	194	122 Å²	122	85%	0.851	76%	0.759	S	S	*	*			trans	80.3	127.3	153.1	-64	-60.5	0	0	0	123.5
293	H	23.4	Very low	31.7	Very low	170 Å²	170	123.2 Å²	123.2	79%	0.787	76%	0.759	S	S	*	*			trans	83.1	145.4	144.8	-110.4	-95.9	0	0	0	123.3
294	L	23.6	Very low	31	Very low	166 Å²	166	121.8 Å²	121.8	87%	0.869	76%	0.757	S	S	*	*			trans	66.2	169	165.1	-77.8	153.5	0	0	0	118.3
295	A	27.7	Very low	31.1	Very low	90 Å²	90	121.2 Å²	121.2	74%	0.744	76%	0.76	S	S	*	*			trans	-141.8	149.6	-158.9	0	0	0	0	0	113.9
296	L	32.6	Very low	31.3	Very low	146 Å²	146	120.4 Å²	120.4	76%	0.764	76%	0.761	S	S	*	*			trans	66.9	147.1	-179.9	-120.1	71.6	0	0	0	115.3	Q298	L296-Q298 HydrophobicContact CD2-CG 4.02Å
297	P	30.3	Very low	31	Very low	124 Å²	124	123.9 Å²	123.9	81%	0.805	77%	0.766	S	S	*	*				-133.2	-176.2	89.2	40.6	-31.5	0	0	0	115.1
298	Q	27.1	Very low	32.2	Very low	152 Å²	152	124.4 Å²	124.4	71%	0.71	76%	0.762	S	S	*	*			trans	-93.7	-167.2	176.8	-49.6	168.9	-69.4	0	0	109.8	L296	L296-Q298 HydrophobicContact CD2-CG 4.02Å
299	N	28.3	Very low	31.7	Very low	123 Å²	123	124.9 Å²	124.9	66%	0.658	76%	0.763	S	S	*	*			cis	-167.3	170.6	9.8	-147.5	-13.5	0	0	0	113.9
300	S	28.1	Very low	31.1	Very low	89 Å²	89	125.2 Å²	125.2	62%	0.622	76%	0.763	S	S	*	*			trans	74.5	165.5	138.8	78.2	0	0	0	0	119.7
301	P	41.3	Very low	30.6	Very low	111 Å²	111	126.8 Å²	126.8	72%	0.721	77%	0.77	S	S	*	*			cis	-128.3	140.5	2.4	36.4	-18.9	0	0	0	118
302	S	28.3	Very low	30.7	Very low	108 Å²	108	126 Å²	126	76%	0.755	77%	0.771	S	S	*	*				40.7	166.3	104	-46.9	0	0	0	0	121
303	P	48.4	Very low	30.8	Very low	123 Å²	123	126.5 Å²	126.5	80%	0.799	78%	0.776	S	S	*	*			cis	-144	173.9	14	44	-25.7	0	0	0	118.7
304	A	27	Very low	31	Very low	95 Å²	95	122.3 Å²	122.3	79%	0.785	78%	0.779	S	S	*	*				169	126.7	121.1	0	0	0	0	0	114.2
305	A	28.2	Very low	31.1	Very low	113 Å²	113	119 Å²	119	93%	0.934	78%	0.775	S	S	*	*			trans	38.3	144.8	159.7	0	0	0	0	0	122.7
306	G	29.5	Very low	32.1	Very low	71 Å²	71	120.8 Å²	120.8	73%	0.732	78%	0.779	S	S	*	*			cis	166.5	102	-7.4	0	0	0	0	0	115.5
307	Q	31.8	Very low	31.6	Very low	190 Å²	190	117.3 Å²	117.3	89%	0.888	78%	0.779	S	S	*	*				60.5	170.1	124.9	-89.8	-158.1	-5.6	0	0	123.7
308	P	50.6	Low	31.4	Very low	101 Å²	101	117 Å²	117	66%	0.656	78%	0.78	S	S	*	*			cis	-130.9	-168	-5.9	25.8	-1.3	0	0	0	116.1
309	V	27.9	Very low	31.4	Very low	134 Å²	134	116.7 Å²	116.7	81%	0.812	78%	0.782	S	S	*	*			trans	100.3	142.8	164.1	-175.1	0	0	0	0	116.9
310	T	28.8	Very low	31.2	Very low	114 Å²	114	116 Å²	116	70%	0.699	78%	0.783	S	S	*	*				-177.1	122	-58.8	-91.4	0	0	0	0	112.9
311	V	29.6	Very low	31.3	Very low	141 Å²	141	119.7 Å²	119.7	86%	0.855	79%	0.79	S	S	*	*			trans	64.8	151.4	145.1	166.5	0	0	0	0	121.1
312	A	26.4	Very low	30.6	Very low	90 Å²	90	119.8 Å²	119.8	74%	0.744	79%	0.793	S	S	*	*			cis	-170.3	-168.5	-29.7	0	0	0	0	0	110.8
313	Q	28.7	Very low	31.6	Very low	206 Å²	206	120 Å²	120	96%	0.963	79%	0.792	S	S	*	*			trans	-107.8	160.6	179.1	-59.8	174	-88	0	0	113.3
314	G	26	Very low	31.3	Very low	81 Å²	81	120.2 Å²	120.2	84%	0.835	79%	0.793	S	S	*	*			trans	-174.5	152.9	168.6	0	0	0	0	0	114.7
315	A	26.9	Very low	31.3	Very low	97 Å²	97	120.6 Å²	120.6	80%	0.802	80%	0.797	S	S	*	*			trans	-165.4	177.2	176.9	0	0	0	0	0	108.9
316	P	47.6	Very low	31.3	Very low	127 Å²	127	120.3 Å²	120.3	83%	0.825	79%	0.794	S	S	*	*			cis	-130.3	160.7	-20.5	36.5	-20.2	0	0	0	115.2
317	G	23.9	Very low	31.2	Very low	74 Å²	74	120.7 Å²	120.7	76%	0.763	80%	0.798	S	S	*	*			trans	96.6	116.9	139.3	0	0	0	0	0	121.9
318	S	25	Very low	31	Very low	118 Å²	118	120.5 Å²	120.5	83%	0.825	80%	0.797	S	S	*	*			trans	69.6	151.2	156.5	-121.3	0	0	0	0	117.3
319	L	27	Very low	29.9	Very low	144 Å²	144	119.9 Å²	119.9	75%	0.754	80%	0.795	S	S	*	*			cis	-144.3	-178.3	17.3	-92.6	171.1	0	0	0	112.3
320	T	24.9	Very low	29.8	Very low	110 Å²	110	122.3 Å²	122.3	68%	0.675	80%	0.797	S	S	*	*			trans	102.2	107.6	150.7	68.9	0	0	0	0	121.7
321	H	30.4	Very low	29.6	Very low	166 Å²	166	124.9 Å²	124.9	77%	0.769	80%	0.804	S	S	*	*			trans	41.4	148.2	131.8	-41.3	-58.5	0	0	0	121.8
322	S	26.7	Very low	29.3	Very low	112 Å²	112	123.7 Å²	123.7	78%	0.783	80%	0.797	S	S	*	*			cis	-151.5	158.4	29.4	-60.1	0	0	0	0	114.5
323	P	48.3	Very low	29.1	Very low	114 Å²	114	126.4 Å²	126.4	74%	0.74	80%	0.798	S	S	*	*			trans	-106.4	177	176.7	43.9	-36.1	0	0	0	113.1
324	P	42.4	Very low	28.7	Very low	126 Å²	126	122.2 Å²	122.2	82%	0.818	79%	0.786	S	S	*	*				-128.6	-162.7	83.9	35.1	-18.9	0	0	0	111.2
325	A	27.3	Very low	28.5	Very low	104 Å²	104	123.6 Å²	123.6	86%	0.86	78%	0.783	S	S	*	*			cis	-148.3	-133	13	0	0	0	0	0	113.7
326	A	27.8	Very low	28.7	Very low	107 Å²	107	123.9 Å²	123.9	88%	0.884	78%	0.779	S	S	*	*			trans	-132.3	166.5	-162.8	0	0	0	0	0	115
327	G	27.1	Very low	27.8	Very low	79 Å²	79	123.6 Å²	123.6	81%	0.814	78%	0.777	S	S	*	*			trans	144.9	112.8	158.7	0	0	0	0	0	115.4
328	Q	26.9	Very low	28.1	Very low	186 Å²	186	127 Å²	127	87%	0.869	78%	0.777	S	S	*	*			trans	-98	154.4	-170.2	-62.2	171.7	-75.1	0	0	115.7
329	S	28.2	Very low	28.3	Very low	87 Å²	87	126.6 Å²	126.6	61%	0.608	77%	0.772	S	S	*	*			trans	51.9	126.2	141.6	58.9	0	0	0	0	122.1
330	H	26.5	Very low	28.3	Very low	185 Å²	185	125.4 Å²	125.4	86%	0.856	77%	0.77	S	S	*	*				-170.6	171.9	95.1	-101.9	-78.2	0	0	0	112.1
331	M	23.8	Very low	28.3	Very low	169 Å²	169	122.9 Å²	122.9	83%	0.833	77%	0.766	S	S	*	*			trans	-77.3	177.1	168.6	-63.9	-170.5	172.4	0	0	109.9
332	T	22.8	Very low	27.9	Very low	116 Å²	116	123.2 Å²	123.2	71%	0.712	77%	0.768	S	S	*	*				-177.9	172.3	50.4	-20.7	0	0	0	0	112.1
333	L	22.8	Very low	28.1	Very low	146 Å²	146	124.8 Å²	124.8	76%	0.764	77%	0.767	S	S	*	*			trans	54.8	107.7	149.1	-73.5	164.8	0	0	0	121.3
334	V	21	Very low	26.9	Very low	118 Å²	118	124.9 Å²	124.9	72%	0.715	77%	0.771	S	S	*	*				58.8	128.8	105.9	170.8	0	0	0	0	120.9
335	S	21.9	Very low	26	Very low	111 Å²	111	125.9 Å²	125.9	78%	0.776	77%	0.769	S	S	*	*			trans	76.7	140.4	154.7	-72.7	0	0	0	0	120.9
336	S	29.8	Very low	25.7	Very low	103 Å²	103	127 Å²	127	72%	0.72	77%	0.765	S	S	*	*			trans	-57.3	165.3	155.9	-34.5	0	0	0	0	111.6
337	P	30.1	Very low	25.6	Very low	121 Å²	121	129.1 Å²	129.1	79%	0.786	76%	0.761	S	S	*	*				-118.1	149.5	108.3	33.2	-34	0	0	0	112.7
338	L	30.3	Very low	25.7	Very low	144 Å²	144	133.9 Å²	133.9	75%	0.754	76%	0.762	S	S	*	*			trans	-66.9	143.2	163.4	-77.5	164.2	0	0	0	109.2	V340	L338-V340 HydrophobicContact CB-CG2 4.31Å
339	P	29.3	Very low	26.5	Very low	110 Å²	110	129.8 Å²	129.8	71%	0.714	75%	0.751	S	S	*	*				-89.3	141	104.7	-25.5	36.6	0	0	0	111
340	V	25.6	Very low	26.8	Very low	119 Å²	119	131.6 Å²	131.6	72%	0.721	76%	0.761	S	S	*	*			cis	62.6	130.5	37	-169.3	0	0	0	0	111	L338	L338-V340 HydrophobicContact CB-CG2 4.31Å
341	G	24.4	Very low	27	Very low	57 Å²	57	126.7 Å²	126.7	59%	0.588	75%	0.753	S	S	*	*			cis	-150.3	146.8	-5.1	0	0	0	0	0	108.6
342	Q	23.8	Very low	27.4	Very low	174 Å²	174	124.8 Å²	124.8	81%	0.813	75%	0.753	S	S	*	*				62.8	100.7	69.8	-67.6	-176.8	-56.1	0	0	113.6
343	N	29.6	Very low	27.8	Very low	144 Å²	144	126.5 Å²	126.5	77%	0.77	75%	0.753	S	S	*	*				17	110.2	125.1	-51.6	2.2	0	0	0	117
344	S	23.1	Very low	28.4	Very low	117 Å²	117	125.4 Å²	125.4	82%	0.818	75%	0.754	S	S	*	*				-83.1	120.8	119.1	43	0	0	0	0	106.3
345	L	24.8	Very low	28.6	Very low	146 Å²	146	123.9 Å²	123.9	76%	0.764	75%	0.745	S	S	*	*				49.7	98.8	51.2	-73.3	166.4	0	0	0	112.5
346	T	20.8	Very low	28.7	Very low	129 Å²	129	127.5 Å²	127.5	79%	0.791	75%	0.747	S	S	*	*				-176.4	159.4	121.8	21.3	0	0	0	0	113.7
347	L	25	Very low	28.5	Very low	151 Å²	151	129.4 Å²	129.4	79%	0.791	75%	0.749	S	S	*	*			trans	66.3	97.2	150.2	-67.3	158.6	0	0	0	121.6
348	Q	29.3	Very low	28.3	Very low	179 Å²	179	127.2 Å²	127.2	84%	0.836	74%	0.736	S	S	*	*				-72	153.8	118	162.9	-173	9.2	0	0	108.3
349	P	43.8	Very low	28.2	Very low	99 Å²	99	129.5 Å²	129.5	64%	0.643	74%	0.743	S	S	*	*			cis	-115.5	-131.4	15	38.7	-17.1	0	0	0	109.5
350	P	33.4	Very low	28.2	Very low	126 Å²	126	127.8 Å²	127.8	82%	0.818	74%	0.744	S	S	*	*			cis	-125.1	-123.7	-2.7	41.2	-19.4	0	0	0	114.3
351	A	31.8	Very low	28.4	Very low	82 Å²	82	128.8 Å²	128.8	68%	0.678	75%	0.751	S	S	*	*			trans	-146.4	-178.8	-175.4	0	0	0	0	0	110.1
352	P	31.8	Very low	29.1	Very low	128 Å²	128	131 Å²	131	83%	0.831	76%	0.755	S	S	*	*				-139.2	169.1	88.8	39.7	-27.6	0	0	0	115.5
353	Q	30.9	Very low	29.2	Very low	153 Å²	153	129.7 Å²	129.7	72%	0.715	75%	0.753	S	S	*	*			trans	-87.3	168.2	165.5	-60.6	-171.5	-0.8	0	0	110.7	V355	Q353-V355 HydrophobicContact CB-CG2 4.22Å
354	P	36.9	Very low	29.1	Very low	122 Å²	122	129.5 Å²	129.5	79%	0.792	75%	0.747	S	S	*	*				-111.5	149.1	81.1	-9.4	29.8	0	0	0	112.2
355	V	24.6	Very low	29.3	Very low	87 Å²	87	131.6 Å²	131.6	53%	0.527	74%	0.743	S	S	.	*				61.6	98.4	52	-171.8	0	0	0	0	112.6	Q353	Q353-V355 HydrophobicContact CB-CG2 4.22Å
356	F	23.7	Very low	29.3	Very low	187 Å²	187	129.4 Å²	129.4	82%	0.82	74%	0.74	S	S	*	*				-176.3	158.8	115.9	-99	-64.9	0	0	0	114.5
357	L	25	Very low	29.4	Very low	143 Å²	143	130.3 Å²	130.3	75%	0.749	75%	0.745	S	S	*	*			trans	-42.6	167.8	165	-59.2	166.1	0	0	0	114.7
358	S	25.9	Very low	29.5	Very low	75 Å²	75	130.3 Å²	130.3	52%	0.524	75%	0.746	S	S	.	*			cis	-177.3	-178.5	-16.1	-93.5	0	0	0	0	108.6
359	H	29.4	Very low	30.8	Very low	192 Å²	192	127 Å²	127	89%	0.889	74%	0.74	S	S	*	*			trans	75.7	147.6	165.7	-40.4	-78.2	0	0	0	115.9
360	G	28.5	Very low	31.1	Very low	73 Å²	73	127.4 Å²	127.4	75%	0.753	74%	0.743	S	S	*	*			cis	-168.9	163.7	-3.7	0	0	0	0	0	114.9
361	V	29	Very low	30.6	Very low	141 Å²	141	128.1 Å²	128.1	86%	0.855	75%	0.745	S	S	*	*			trans	-69.5	170.3	157.7	-121	0	0	0	0	108.8
362	P	39.2	Very low	30.1	Very low	104 Å²	104	131.8 Å²	131.8	68%	0.675	75%	0.752	S	S	*	*			cis	-151	176.8	32.8	43.9	-23.2	0	0	0	119.6
363	L	26.2	Very low	30.9	Very low	146 Å²	146	130.3 Å²	130.3	76%	0.764	74%	0.742	S	S	*	*			trans	62.1	162.9	145.6	-98.6	64.1	0	0	0	118.6
364	H	27.4	Very low	30.6	Very low	140 Å²	140	130.3 Å²	130.3	65%	0.648	75%	0.746	S	S	*	*			cis	-143.2	-169.9	0.3	-145.6	10.5	0	0	0	107.5
365	Q	27.1	Very low	30.1	Very low	160 Å²	160	129.7 Å²	129.7	75%	0.748	75%	0.745	S	S	*	*			cis	-148	-162.5	4.4	-162.4	153.6	39.9	0	0	109.7
366	S	24.8	Very low	30.3	Very low	100 Å²	100	134.3 Å²	134.3	70%	0.699	76%	0.761	S	S	*	*			trans	-143.8	161.8	-177.4	56.2	0	0	0	0	112
367	V	23.5	Very low	31.3	Very low	148 Å²	148	130.5 Å²	130.5	90%	0.897	76%	0.755	S	S	*	*			trans	-142.2	132.3	159.5	-175.3	0	0	0	0	109.7
368	N	26.5	Very low	31.4	Very low	152 Å²	152	130.4 Å²	130.4	81%	0.813	76%	0.76	S	S	*	*			trans	-178.4	178.7	178.4	-125.9	-8.2	0	0	0	108.4
369	P	57.7	Low	31.3	Very low	109 Å²	109	129.8 Å²	129.8	71%	0.708	77%	0.766	S	S	*	*			cis	-105.3	-91.7	-24.1	28	-7.6	0	0	0	110.1
370	P	50	Low	32.3	Very low	108 Å²	108	126.4 Å²	126.4	70%	0.701	76%	0.761	S	S	*	*			cis	-121.9	166.1	-22.2	39.1	-23.5	0	0	0	115.5
371	V	22.3	Very low	32.2	Very low	141 Å²	141	130.1 Å²	130.1	86%	0.855	77%	0.768	S	S	*	*			trans	163.6	143.4	132.1	157.7	0	0	0	0	111
372	L	22.7	Very low	32	Very low	159 Å²	159	128.8 Å²	128.8	83%	0.832	76%	0.757	S	S	*	*			trans	-166.1	-178.8	-171.7	-98	-178.4	0	0	0	107.6
373	P	46.8	Very low	31.5	Very low	96 Å²	96	133 Å²	133	62%	0.623	76%	0.764	S	S	*	*			cis	-138.8	-159.3	-13.6	29.8	-4.7	0	0	0	114.2
374	L	26.3	Very low	31.4	Very low	153 Å²	153	130.8 Å²	130.8	80%	0.801	76%	0.761	S	S	*	*			trans	80.2	149.3	154	-103.5	60.8	0	0	0	117.9
375	S	25.2	Very low	31.3	Very low	110 Å²	110	130.8 Å²	130.8	77%	0.769	77%	0.771	S	S	*	*			cis	-143.2	155.5	22.9	-53.4	0	0	0	0	117.7
376	Q	28.4	Very low	31.3	Very low	183 Å²	183	126.4 Å²	126.4	86%	0.855	77%	0.768	S	S	*	*			trans	-128.3	180	149.6	-104.8	-168	6.8	0	0	106.4
377	P	46.2	Very low	31.4	Very low	108 Å²	108	127.9 Å²	127.9	70%	0.701	77%	0.773	S	S	*	*			cis	-131.5	-156.4	5.6	41.7	-22.6	0	0	0	113.1
378	V	26	Very low	31.4	Very low	140 Å²	140	126 Å²	126	85%	0.848	77%	0.767	S	S	*	*			trans	148.5	146	141.1	164.9	0	0	0	0	113.4
379	G	24.5	Very low	31.3	Very low	63 Å²	63	125 Å²	125	65%	0.649	77%	0.765	S	S	*	*			trans	-147.9	-147.9	163.3	0	0	0	0	0	107.9
380	P	49.8	Very low	30.3	Very low	120 Å²	120	127.2 Å²	127.2	78%	0.779	77%	0.771	S	S	*	*			cis	-125.6	179.5	-28.5	41.5	-27.2	0	0	0	112.4
381	V	25.7	Very low	29.8	Very low	151 Å²	151	127 Å²	127	92%	0.915	77%	0.769	S	S	*	*			trans	-136.8	158	171.3	-176.4	0	0	0	0	111.9
382	N	25.4	Very low	30	Very low	113 Å²	113	125.8 Å²	125.8	60%	0.604	76%	0.757	S	S	*	*			trans	-117.6	144.2	-163.5	-89.1	-92.9	0	0	0	115.2
383	K	28.4	Very low	30.2	Very low	193 Å²	193	125.1 Å²	125.1	84%	0.839	75%	0.754	S	S	*	*			trans	62.9	164.3	140.8	-60.8	166.8	-175.9	165.7	0	116.9
384	S	24.7	Very low	29.2	Very low	100 Å²	100	127.7 Å²	127.7	70%	0.699	76%	0.758	S	S	*	*			cis	-151.3	151.9	14.9	59.2	0	0	0	0	114.8
385	V	26.2	Very low	29.1	Very low	140 Å²	140	125.7 Å²	125.7	85%	0.848	75%	0.752	S	S	*	*			trans	44.2	132	134.1	-178	0	0	0	0	120.7
386	G	26.5	Very low	29.1	Very low	67 Å²	67	126.9 Å²	126.9	69%	0.691	75%	0.754	S	S	*	*			cis	155.9	-175.6	-9.4	0	0	0	0	0	117.1
387	T	26.3	Very low	28.9	Very low	131 Å²	131	129.2 Å²	129.2	80%	0.804	76%	0.755	S	S	*	*			trans	87.4	144.6	157	-37.6	0	0	0	0	119.7
388	S	24.2	Very low	28.4	Very low	110 Å²	110	130.1 Å²	130.1	77%	0.769	76%	0.761	S	S	*	*			trans	73.4	126.4	170.2	-74.5	0	0	0	0	118.7
389	V	24.5	Very low	28.2	Very low	129 Å²	129	126.8 Å²	126.8	78%	0.782	76%	0.755	S	S	*	*			cis	-141.7	132	-11.3	-178.5	0	0	0	0	111
390	L	36.2	Very low	28.2	Very low	157 Å²	157	130.5 Å²	130.5	82%	0.822	77%	0.765	S	S	*	*			trans	-155.2	174.9	160.7	-85.7	-168	0	0	0	105.1
391	P	38.7	Very low	26.9	Very low	103 Å²	103	132.2 Å²	132.2	67%	0.669	77%	0.767	S	S	*	*			cis	-153.1	169.1	32.3	51.1	-29.9	0	0	0	117.4
392	I	27.4	Very low	27.6	Very low	115 Å²	115	130 Å²	130	59%	0.59	76%	0.755	S	S	*	*				63.8	123.1	106.7	-61.6	173.9	0	0	0	118.4	Q394	I392-Q394 HydrophobicContact CG2-CG 4.39Å
393	N	26.1	Very low	27.5	Very low	145 Å²	145	132.1 Å²	132.1	78%	0.775	77%	0.766	S	S	*	*				-171.2	142.1	109.5	-91.6	-61.2	0	0	0	108.7
394	Q	26.9	Very low	27.3	Very low	151 Å²	151	129.3 Å²	129.3	71%	0.706	77%	0.765	S	S	*	*			cis	84.9	131.3	30.3	-79.1	-157.4	68.4	0	0	117.5	I392	I392-Q394 HydrophobicContact CG2-CG 4.39Å
395	T	23.9	Very low	27.4	Very low	110 Å²	110	132.8 Å²	132.8	68%	0.675	77%	0.77	S	S	*	*			trans	83.9	100.8	145.7	-58.4	0	0	0	0	121.8
396	V	24.2	Very low	28	Very low	135 Å²	135	131.6 Å²	131.6	82%	0.818	77%	0.765	S	S	*	*				56.4	138.6	128.5	-168.3	0	0	0	0	122.1
397	R	25	Very low	28	Very low	232 Å²	232	134.7 Å²	134.7	88%	0.875	77%	0.771	S	S	*	*			trans	-45.3	177.5	162.9	-76.2	178.4	167.3	-179.7	-3.8	115.8
398	P	36.1	Very low	27.9	Very low	127 Å²	127	131.4 Å²	131.4	83%	0.825	76%	0.762	S	S	*	*			cis	-138.6	173	8.8	39.1	-20.3	0	0	0	118
399	G	22.6	Very low	29	Very low	70 Å²	70	131.7 Å²	131.7	72%	0.722	76%	0.762	S	S	*	*			trans	117.1	121.5	135.2	0	0	0	0	0	121.4
400	V	22.9	Very low	29.4	Very low	141 Å²	141	132.5 Å²	132.5	86%	0.855	76%	0.76	S	S	*	*			trans	62.8	109.4	144	-163.9	0	0	0	0	122
401	L	23	Very low	29	Very low	157 Å²	157	130.6 Å²	130.6	82%	0.822	75%	0.751	S	S	*	*			trans	7	163.4	134.1	-63.7	177	0	0	0	122.4
402	P	40.3	Very low	28.7	Very low	104 Å²	104	136.1 Å²	136.1	68%	0.675	76%	0.759	S	S	*	*			cis	-139.9	-164.6	-12.3	32.4	-8.1	0	0	0	115.8
403	L	23.8	Very low	29.9	Very low	157 Å²	157	136.1 Å²	136.1	82%	0.822	77%	0.766	S	S	*	*			trans	73.6	147.7	170.8	-92.8	63.3	0	0	0	116.9
404	T	24.2	Very low	29.9	Very low	134 Å²	134	136 Å²	136	82%	0.822	77%	0.77	S	S	*	*			cis	-133.1	168.7	2.9	9.3	0	0	0	0	112.9
405	Q	26.9	Very low	29.9	Very low	174 Å²	174	131.8 Å²	131.8	81%	0.813	77%	0.767	S	S	*	*			trans	-95	157.3	179.6	-149.7	-179.1	28.4	0	0	112.9
406	P	37.7	Very low	30.8	Very low	114 Å²	114	133.2 Å²	133.2	74%	0.74	78%	0.778	S	S	*	*				-142.5	170.8	111.2	38.4	-25.2	0	0	0	112.5
407	V	26.5	Very low	30.9	Very low	133 Å²	133	130 Å²	130	81%	0.806	77%	0.772	S	S	*	*			cis	-158.9	166.9	-19.2	132	0	0	0	0	107.4
408	G	25	Very low	31	Very low	61 Å²	61	126.2 Å²	126.2	63%	0.629	78%	0.775	S	S	*	*			trans	-114.9	-140.8	175.6	0	0	0	0	0	113.6
409	P	48.1	Very low	30.4	Very low	117 Å²	117	128.1 Å²	128.1	76%	0.76	78%	0.777	S	S	*	*			cis	-146	-158.5	8.2	42.3	-20.6	0	0	0	116.3
410	I	32	Very low	31.8	Very low	145 Å²	145	130.1 Å²	130.1	74%	0.744	78%	0.777	S	S	*	*			trans	78	142.2	164.3	-73.7	168.4	0	0	0	115
411	N	27.2	Very low	31.9	Very low	117 Å²	117	130.3 Å²	130.3	63%	0.626	78%	0.778	S	S	*	*			cis	-170.4	170.4	-17.1	-100.5	-8.9	0	0	0	107.6
412	R	34	Very low	31.9	Very low	220 Å²	220	127.8 Å²	127.8	83%	0.83	77%	0.774	S	S	*	*			cis	-163.1	167.9	-30.1	-110.9	177.6	-173.6	-129	-3.7	109.1
413	P	51	Low	32.2	Very low	114 Å²	114	128.1 Å²	128.1	74%	0.74	78%	0.776	S	S	*	*			trans	-115.2	-176	-170.1	43.3	-35	0	0	0	114.7
414	V	26.6	Very low	32.4	Very low	143 Å²	143	125.7 Å²	125.7	87%	0.867	77%	0.772	S	S	*	*			trans	174.1	157.9	139.4	143.8	0	0	0	0	113
415	G	27.7	Very low	32.5	Very low	62 Å²	62	125.9 Å²	125.9	64%	0.639	77%	0.773	S	S	*	*			trans	-94.1	-139.8	169.6	0	0	0	0	0	112.8
416	P	42.1	Very low	32.2	Very low	140 Å²	140	123.5 Å²	123.5	91%	0.909	77%	0.771	S	S	*	*			cis	-121.8	-149.2	-7.9	42.3	-24.9	0	0	0	112.1
417	G	26.7	Very low	32.6	Very low	67 Å²	67	124 Å²	124	69%	0.691	77%	0.774	S	S	*	*			trans	-130.2	175.6	-177.8	0	0	0	0	0	116.2
418	V	25.8	Very low	32.5	Very low	154 Å²	154	121.1 Å²	121.1	93%	0.933	77%	0.77	S	S	*	*			trans	-142.7	164.3	-175.2	-179.3	0	0	0	0	112.1
419	L	24.9	Very low	32.5	Very low	167 Å²	167	124.8 Å²	124.8	87%	0.874	78%	0.78	S	S	*	*			trans	-88.5	175.8	-171.2	-79.2	170.4	0	0	0	115.7
420	P	51.8	Low	31.4	Very low	111 Å²	111	126.6 Å²	126.6	72%	0.721	78%	0.783	S	S	*	*			trans	-110.8	-176.3	-161.8	43.3	-37	0	0	0	115.8
421	V	24.8	Very low	31.1	Very low	145 Å²	145	128.8 Å²	128.8	88%	0.879	79%	0.79	S	S	*	*			trans	-157.5	160.6	151.4	122.8	0	0	0	0	113.6
422	S	23.6	Very low	30.8	Very low	104 Å²	104	127.2 Å²	127.2	73%	0.727	79%	0.793	S	S	*	*			trans	-88.7	-159.3	-168.7	-27.5	0	0	0	0	113.6
423	P	46.5	Very low	30.4	Very low	111 Å²	111	123.2 Å²	123.2	72%	0.721	79%	0.793	S	S	*	*			cis	-145.9	-175.5	13.2	44.7	-24	0	0	0	119.5
424	S	27	Very low	29.1	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	79%	0.793	S	S	*	*			trans	78.3	148.2	145.6	75.1	0	0	0	0	120.1
425	V	25.7	Very low	29.8	Very low	137 Å²	137	122 Å²	122	83%	0.83	79%	0.791	S	S	*	*			cis	-156.1	173.2	-8.2	115.5	0	0	0	0	111.9
426	T	22.4	Very low	29.6	Very low	125 Å²	125	122.8 Å²	122.8	77%	0.767	80%	0.799	S	S	*	*			trans	-96.2	-152.3	180	46.8	0	0	0	0	113.7
427	P	45.2	Very low	28.7	Very low	125 Å²	125	122.3 Å²	122.3	81%	0.812	79%	0.793	S	S	*	*				-125.1	173.4	-88.9	40.1	-24.8	0	0	0	116.2
428	G	24.3	Very low	28.6	Very low	71 Å²	71	126.1 Å²	126.1	73%	0.732	80%	0.797	S	S	*	*			trans	130.8	166	168.3	0	0	0	0	0	113.6
429	V	25.4	Very low	28.5	Very low	138 Å²	138	123.4 Å²	123.4	84%	0.836	78%	0.784	S	S	*	*			cis	-145.4	173.7	-2.7	172.3	0	0	0	0	108.7
430	L	23.8	Very low	28.5	Very low	155 Å²	155	121.2 Å²	121.2	81%	0.812	78%	0.778	S	S	*	*			trans	-40.2	160.1	163.4	-54.9	169.9	0	0	0	113.1
431	Q	25.8	Very low	27.1	Very low	191 Å²	191	120.9 Å²	120.9	89%	0.893	78%	0.778	S	S	*	*				-171.4	178.2	65.4	-162.1	162.1	1.5	0	0	113
432	A	22.6	Very low	27.2	Very low	84 Å²	84	124.9 Å²	124.9	69%	0.694	78%	0.777	S	S	*	*			trans	-67.4	171	175.7	0	0	0	0	0	112.6
433	V	25.1	Very low	27.1	Very low	137 Å²	137	123.6 Å²	123.6	83%	0.83	77%	0.773	S	S	*	*				-168	153.9	72.1	158.6	0	0	0	0	110.8
434	S	22.4	Very low	26	Very low	106 Å²	106	124.8 Å²	124.8	74%	0.741	78%	0.778	S	S	*	*			trans	-111.9	175.4	170.5	-32.6	0	0	0	0	110.6
435	P	42.1	Very low	26.7	Very low	125 Å²	125	125 Å²	125	81%	0.812	78%	0.777	S	S	*	*			cis	-125.8	177.9	-22.1	37.5	-21.6	0	0	0	112.6
436	G	24.6	Very low	26.6	Very low	79 Å²	79	124.3 Å²	124.3	81%	0.814	78%	0.778	S	S	*	*			trans	-131.2	136	174.2	0	0	0	0	0	112.5
437	V	23.4	Very low	26.7	Very low	129 Å²	129	121.5 Å²	121.5	78%	0.782	77%	0.774	S	S	*	*			trans	-109	163.6	-163.8	-158.1	0	0	0	0	111.9
438	L	24.3	Very low	25.7	Very low	147 Å²	147	121.9 Å²	121.9	77%	0.77	77%	0.774	S	S	*	*			trans	91.4	108.8	156.6	-57.8	177.7	0	0	0	120.9
439	S	22.8	Very low	25.7	Very low	97 Å²	97	125.9 Å²	125.9	68%	0.678	78%	0.778	S	S	*	*				72.5	131.5	107	-57.4	0	0	0	0	124.8
440	V	24.9	Very low	26	Very low	122 Å²	122	125.7 Å²	125.7	74%	0.739	78%	0.779	S	S	*	*				81.2	92.7	125.4	173.7	0	0	0	0	120.8
441	S	23.1	Very low	26	Very low	103 Å²	103	123.2 Å²	123.2	72%	0.72	78%	0.781	S	S	*	*				83.7	159.4	123.1	81.2	0	0	0	0	124
442	R	25.8	Very low	26	Very low	229 Å²	229	117.6 Å²	117.6	86%	0.864	77%	0.774	S	S	*	*			trans	97.4	89.1	137.9	-157.7	168.7	-170.2	149.9	2.3	121.3
443	A	22.2	Very low	26.2	Very low	77 Å²	77	121.9 Å²	121.9	64%	0.636	78%	0.78	S	S	*	*				73	133.8	121.3	0	0	0	0	0	123.1
444	V	22.7	Very low	26.1	Very low	137 Å²	137	123.6 Å²	123.6	83%	0.83	78%	0.781	S	S	*	*				59.1	152.5	119.9	178.3	0	0	0	0	119.4
445	P	41.2	Very low	26.2	Very low	110 Å²	110	124.7 Å²	124.7	71%	0.714	78%	0.784	S	S	*	*			cis	-124.4	176.7	-10.4	36.6	-21	0	0	0	115.3
446	S	24.5	Very low	26.2	Very low	124 Å²	124	124.4 Å²	124.4	87%	0.867	78%	0.781	S	S	*	*			trans	151.2	155.5	134.8	-69.3	0	0	0	0	111.7
447	G	25.1	Very low	26.2	Very low	66 Å²	66	125.6 Å²	125.6	68%	0.68	78%	0.784	S	S	*	*			cis	160.8	110.4	-10.1	0	0	0	0	0	113.8
448	V	24.1	Very low	26.3	Very low	133 Å²	133	123.1 Å²	123.1	81%	0.806	78%	0.784	S	S	*	*			trans	62.4	114.2	154.1	-174.8	0	0	0	0	120.6
449	L	22.9	Very low	26.4	Very low	155 Å²	155	122.9 Å²	122.9	81%	0.812	79%	0.789	S	S	*	*			trans	35.5	144.9	133	-51.2	178.1	0	0	0	121.7
450	P	32.8	Very low	26.6	Very low	133 Å²	133	125.7 Å²	125.7	86%	0.864	79%	0.794	S	S	*	*				-140.6	-170.5	78.5	37.4	-19.3	0	0	0	115.3
451	A	23.9	Very low	27.4	Very low	104 Å²	104	126 Å²	126	86%	0.86	80%	0.799	S	S	*	*			trans	-147	168.2	-169	0	0	0	0	0	114.5
452	G	25.8	Very low	27.5	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	80%	0.799	S	S	*	*			trans	126.6	159.2	172.1	0	0	0	0	0	114
453	Q	26.2	Very low	27.6	Very low	175 Å²	175	122.2 Å²	122.2	82%	0.818	80%	0.798	S	S	*	*			cis	-162.8	151.9	-10.6	-116.5	-169.9	31.4	0	0	111.9
454	M	24.2	Very low	27.8	Very low	172 Å²	172	124.9 Å²	124.9	85%	0.847	81%	0.807	S	S	*	*			trans	64.8	166.5	148.8	-72.8	-165.4	158.6	0	0	123.8
455	T	24.1	Very low	28	Very low	130 Å²	130	122 Å²	122	80%	0.798	80%	0.797	S	S	*	*			trans	-124.9	178.8	-174.2	57.7	0	0	0	0	110
456	P	40.8	Very low	27.4	Very low	118 Å²	118	123.2 Å²	123.2	77%	0.766	80%	0.803	S	S	*	*				-155.8	153.3	98.1	39.2	-20.2	0	0	0	119.2
457	A	25.2	Very low	27.4	Very low	105 Å²	105	123.2 Å²	123.2	87%	0.868	80%	0.803	S	S	*	*			trans	48.5	136.4	136.9	0	0	0	0	0	125.3
458	G	25.8	Very low	27.4	Very low	77 Å²	77	123.2 Å²	123.2	79%	0.794	80%	0.803	S	S	*	*			trans	-156.8	153.1	156.9	0	0	0	0	0	109.1
459	V	25.9	Very low	27.4	Very low	141 Å²	141	124.2 Å²	124.2	86%	0.855	81%	0.81	S	S	*	*			trans	-121.8	155.4	-156.3	-177.9	0	0	0	0	115.3
460	I	27.2	Very low	27.6	Very low	156 Å²	156	124.3 Å²	124.3	80%	0.8	81%	0.81	S	S	*	*			trans	-70.3	178.9	179.3	6.6	173.8	0	0	0	113.5
461	P	41.2	Very low	27.8	Very low	130 Å²	130	123.2 Å²	123.2	84%	0.844	80%	0.803	S	S	*	*			cis	-150.9	-173.4	40.2	44.1	-22	0	0	0	118.9
462	G	25.2	Very low	28	Very low	70 Å²	70	125 Å²	125	72%	0.722	80%	0.803	S	S	*	*			trans	141.5	136.3	156.4	0	0	0	0	0	117.2
463	Q	29.2	Very low	28	Very low	181 Å²	181	125.1 Å²	125.1	85%	0.846	80%	0.804	S	S	*	*			trans	-150.1	-170.2	175.7	-69.1	-165	6.8	0	0	111.8
464	T	26	Very low	28.1	Very low	134 Å²	134	126 Å²	126	82%	0.822	81%	0.808	S	S	*	*			trans	80.6	149.1	157.6	56.8	0	0	0	0	119.2
465	A	26.7	Very low	28.1	Very low	75 Å²	75	126 Å²	126	62%	0.62	81%	0.809	S	S	*	*			cis	-174	-169.3	-15.4	0	0	0	0	0	112.2
466	T	28.1	Very low	28.1	Very low	137 Å²	137	125.9 Å²	125.9	84%	0.84	81%	0.807	S	S	*	*			trans	79.6	150.9	162.2	72.4	0	0	0	0	118.1
467	S	24.8	Very low	27.3	Very low	123 Å²	123	128.5 Å²	128.5	86%	0.86	81%	0.809	S	S	*	*			cis	-169.6	173.9	-16.2	-94.2	0	0	0	0	108.7
468	G	26.3	Very low	27.4	Very low	67 Å²	67	128.6 Å²	128.6	69%	0.691	80%	0.804	S	S	*	*			cis	160.5	-172.5	-3.5	0	0	0	0	0	112.7
469	V	24.1	Very low	27.4	Very low	154 Å²	154	128.2 Å²	128.2	93%	0.933	80%	0.8	S	S	*	*			trans	87.2	154.1	161.4	-167.4	0	0	0	0	119.8
470	L	25.7	Very low	27.3	Very low	156 Å²	156	128.6 Å²	128.6	82%	0.817	80%	0.802	S	S	*	*			trans	-121.8	-164.4	-163.5	-92.5	161	0	0	0	110.5
471	P	37.6	Very low	27.4	Very low	111 Å²	111	128.8 Å²	128.8	72%	0.721	80%	0.804	S	S	*	*			cis	-146.5	165.4	12.5	40.8	-18.3	0	0	0	121.4
472	T	27.8	Very low	27.2	Very low	141 Å²	141	127.9 Å²	127.9	87%	0.865	80%	0.798	S	S	*	*			trans	48.3	131.1	141.4	-47.7	0	0	0	0	125
473	G	25.9	Very low	27.2	Very low	74 Å²	74	130.9 Å²	130.9	76%	0.763	80%	0.802	S	S	*	*			trans	-170.3	157	163.7	0	0	0	0	0	114.2
474	Q	27.6	Very low	27	Very low	193 Å²	193	125.3 Å²	125.3	90%	0.902	79%	0.793	S	S	*	*			trans	-111.8	160.3	-159.6	-56.9	173.8	-54.6	0	0	118.8
475	M	24.1	Very low	27.1	Very low	174 Å²	174	127.9 Å²	127.9	86%	0.857	80%	0.796	S	S	*	*			trans	84.4	98.2	139	-130.7	170.5	-170.9	0	0	126
476	V	23.9	Very low	27	Very low	127 Å²	127	130.3 Å²	130.3	77%	0.77	80%	0.803	S	S	*	*				19.9	127.6	125.4	-164.8	0	0	0	0	122.8
477	Q	24.8	Very low	26.8	Very low	172 Å²	172	127.9 Å²	127.9	80%	0.804	80%	0.797	S	S	*	*				-179	143.8	113.3	-98.5	-157.2	27	0	0	117.6
478	S	26.9	Very low	27.5	Very low	108 Å²	108	128 Å²	128	76%	0.755	80%	0.795	S	S	*	*			trans	36.1	150.9	138	-47.6	0	0	0	0	123.3
479	G	26.6	Very low	27.4	Very low	69 Å²	69	130.2 Å²	130.2	71%	0.711	80%	0.8	S	S	*	*			cis	162.7	-173.4	-1.3	0	0	0	0	0	112.9
480	V	23.2	Very low	27.4	Very low	149 Å²	149	134.1 Å²	134.1	90%	0.903	80%	0.798	S	S	*	*			trans	89.2	139.2	168.3	-172	0	0	0	0	119.5
481	L	30.5	Very low	27.4	Very low	159 Å²	159	132.4 Å²	132.4	83%	0.832	79%	0.793	S	S	*	*			trans	-129.8	168.4	169.7	-73.2	174.3	0	0	0	106.7
482	P	35.2	Very low	26.8	Very low	112 Å²	112	134.9 Å²	134.9	73%	0.727	80%	0.8	S	S	*	*			cis	-160.7	-160.4	39.1	46.3	-22.2	0	0	0	118.4
483	V	25.3	Very low	27.6	Very low	133 Å²	133	133.8 Å²	133.8	81%	0.806	80%	0.795	S	S	*	*			trans	68.7	109.6	154.6	175.6	0	0	0	0	120.8
484	G	24.9	Very low	28.6	Very low	64 Å²	64	136.4 Å²	136.4	66%	0.66	80%	0.799	S	S	*	*				114.4	144.4	99.1	0	0	0	0	0	121.6
485	Q	28.2	Very low	28.5	Very low	187 Å²	187	130.9 Å²	130.9	87%	0.874	79%	0.793	S	S	*	*			trans	70.1	144.1	154.1	-67.6	-170.9	58.6	0	0	119.9
486	T	25.5	Very low	28.6	Very low	127 Å²	127	131.6 Å²	131.6	78%	0.779	80%	0.795	S	S	*	*			cis	-157	166.2	-37.1	-14.5	0	0	0	0	110.4
487	A	24.1	Very low	28.6	Very low	86 Å²	86	132.1 Å²	132.1	71%	0.711	80%	0.799	S	S	*	*			trans	-89.1	-171	169.9	0	0	0	0	0	111
488	P	38.2	Very low	28.6	Very low	125 Å²	125	128 Å²	128	81%	0.812	79%	0.794	S	S	*	*			cis	-146.3	-156.7	27.3	44.4	-21.1	0	0	0	117
489	S	24.7	Very low	29.1	Very low	114 Å²	114	128 Å²	128	80%	0.797	79%	0.791	S	S	*	*			trans	-103.4	176.4	-159.3	-31.8	0	0	0	0	117
490	R	24.7	Very low	28.9	Very low	235 Å²	235	132 Å²	132	89%	0.887	80%	0.795	S	S	*	*				116.6	152.2	128.4	-150.3	-167	-177.7	-151.1	3.1	119.1
491	V	25.2	Very low	28.9	Very low	120 Å²	120	135.3 Å²	135.3	73%	0.727	79%	0.792	S	S	*	*			trans	88.2	152.6	160.2	-159.8	0	0	0	0	117.9
492	L	25.6	Very low	28.6	Very low	163 Å²	163	133.6 Å²	133.6	85%	0.853	79%	0.788	S	S	*	*			trans	-107.7	-151.6	178.1	-65.2	163.2	0	0	0	110.9
493	P	45.2	Very low	28.2	Very low	118 Å²	118	135.8 Å²	135.8	77%	0.766	79%	0.793	S	S	*	*				-110.1	-152.3	-122.8	43.9	-24.3	0	0	0	111.4
494	P	45.3	Very low	28.6	Very low	130 Å²	130	135.1 Å²	135.1	84%	0.844	79%	0.791	S	S	*	*			cis	-127.5	-173	-18	41.7	-25.9	0	0	0	113.5
495	G	25.9	Very low	28.5	Very low	76 Å²	76	137 Å²	137	78%	0.784	80%	0.8	S	S	*	*			trans	-170.9	147.2	166.6	0	0	0	0	0	114.3
496	Q	27.4	Very low	28.3	Very low	189 Å²	189	131.6 Å²	131.6	88%	0.883	80%	0.795	S	S	*	*			trans	-127.4	158.5	174.9	-62.8	-177.6	6.2	0	0	110.3
497	T	22.9	Very low	28.3	Very low	139 Å²	139	134.6 Å²	134.6	85%	0.853	80%	0.8	S	S	*	*				165	153.2	115.4	-59.3	0	0	0	0	110
498	A	24.7	Very low	28.4	Very low	86 Å²	86	136.6 Å²	136.6	71%	0.711	80%	0.803	S	S	*	*			trans	-92.3	-157.7	173.2	0	0	0	0	0	110.4
499	P	37.3	Very low	27.8	Very low	107 Å²	107	137.3 Å²	137.3	70%	0.695	80%	0.804	S	S	*	*			cis	-145.5	172.6	35.2	42.2	-20.5	0	0	0	118
500	L	22.6	Very low	28.1	Very low	153 Å²	153	136.8 Å²	136.8	80%	0.801	80%	0.799	S	S	*	*			trans	36.6	146	135.5	-57.6	171.9	0	0	0	120.6
501	R	22.9	Very low	28.3	Very low	218 Å²	218	131.8 Å²	131.8	82%	0.823	80%	0.799	S	S	*	*			cis	-176.9	169	30.8	-140.1	178.2	-172.9	-160.9	3.6	113
502	V	25.2	Very low	28.5	Very low	123 Å²	123	129.2 Å²	129.2	75%	0.745	80%	0.797	S	S	*	*			trans	76.6	138	154.9	178.7	0	0	0	0	120.3
503	L	27.2	Very low	28.5	Very low	159 Å²	159	129.7 Å²	129.7	83%	0.832	80%	0.8	S	S	*	*			trans	-136.4	169.7	167.4	-79.1	169.6	0	0	0	106.3
504	P	34	Very low	27.4	Very low	119 Å²	119	131.3 Å²	131.3	77%	0.773	80%	0.801	S	S	*	*			cis	-146	-165.4	22.8	44.4	-24	0	0	0	117.1
505	A	22.1	Very low	26.5	Very low	104 Å²	104	130.4 Å²	130.4	86%	0.86	80%	0.798	S	S	*	*			trans	95.1	142.1	158.3	0	0	0	0	0	119.3
506	G	23.9	Very low	26.9	Very low	73 Å²	73	132.4 Å²	132.4	75%	0.753	80%	0.797	S	S	*	*			trans	92.5	88.1	-173.3	0	0	0	0	0	112.5
507	Q	25	Very low	26.6	Very low	189 Å²	189	128 Å²	128	88%	0.883	79%	0.787	S	S	*	*				73.6	115.8	72.2	-72.2	-159.2	2.1	0	0	116.8
508	V	25.6	Very low	26.7	Very low	128 Å²	128	129.6 Å²	129.6	78%	0.776	79%	0.785	S	S	*	*			trans	66.4	105.2	152.2	-172.3	0	0	0	0	120.1
509	V	25.9	Very low	26.6	Very low	140 Å²	140	131 Å²	131	85%	0.848	79%	0.785	S	S	*	*			trans	-145.1	138.1	146.9	-179.4	0	0	0	0	108.6
510	P	31.5	Very low	25.8	Very low	104 Å²	104	131.7 Å²	131.7	68%	0.675	79%	0.787	S	S	*	*			trans	-107.8	149.4	-179.7	38.2	-32	0	0	0	114.7
511	S	29.2	Very low	25.8	Very low	129 Å²	129	129.4 Å²	129.4	90%	0.902	78%	0.784	S	S	*	*			trans	175.2	94.8	150	-82.8	0	0	0	0	110.6
512	G	28.8	Very low	25.8	Very low	66 Å²	66	124.4 Å²	124.4	68%	0.68	78%	0.782	S	S	*	*			cis	91.1	46.7	-5.3	0	0	0	0	0	115.3	L514	G512-L514 VanDerWaalsContact C-N 3.31Å; G512-L514 PolarHBondContact O-N 3.32Å
513	L	25	Very low	25.7	Very low	173 Å²	173	124.4 Å²	124.4	91%	0.906	79%	0.787	S	S	*	*			trans	-70	87.5	169.4	-82.6	166.8	0	0	0	111.5
514	L	22.8	Very low	25.5	Very low	152 Å²	152	120.7 Å²	120.7	80%	0.796	78%	0.78	S	S	*	*			trans	42.6	109.8	142.2	-53.7	-179.9	0	0	0	119.6	G512	G512-L514 VanDerWaalsContact C-N 3.31Å; G512-L514 PolarHBondContact O-N 3.32Å
515	S	26.4	Very low	25.2	Very low	111 Å²	111	121.9 Å²	121.9	78%	0.776	78%	0.784	S	S	*	*			trans	-75.2	163.8	135.1	-38.2	0	0	0	0	109.2
516	P	34.2	Very low	25.4	Very low	118 Å²	118	123.1 Å²	123.1	77%	0.766	78%	0.781	S	S	*	*				-135.9	-173.7	63.3	41.8	-24.6	0	0	0	112
517	S	21.3	Very low	26.4	Very low	96 Å²	96	124.8 Å²	124.8	67%	0.671	78%	0.779	S	S	*	*			cis	-142.5	151.2	12.2	-50.4	0	0	0	0	109.3
518	Q	24.8	Very low	26.3	Very low	174 Å²	174	121.5 Å²	121.5	81%	0.813	77%	0.771	S	S	*	*				46.6	140.7	98.5	-49.8	-161.7	15.5	0	0	116.3
519	T	22.3	Very low	26.4	Very low	115 Å²	115	121.2 Å²	121.2	71%	0.706	77%	0.765	S	S	*	*			cis	-164.8	166.3	16.2	-8	0	0	0	0	115
520	V	22.1	Very low	26.6	Very low	122 Å²	122	123 Å²	123	74%	0.739	76%	0.764	S	S	*	*			trans	38	123.8	161	-108.2	0	0	0	0	123.6
521	S	22.3	Very low	26.3	Very low	105 Å²	105	121.3 Å²	121.3	73%	0.734	77%	0.766	S	S	*	*				159.2	124	115.2	-71.8	0	0	0	0	109.5
522	S	22.2	Very low	26.2	Very low	113 Å²	113	123.7 Å²	123.7	79%	0.79	77%	0.765	S	S	*	*				67.3	132.8	69.1	-61.7	0	0	0	0	112.8
523	S	24	Very low	26	Very low	122 Å²	122	127 Å²	127	85%	0.853	77%	0.767	S	S	*	*			cis	-148.2	-175.9	12.2	-158.9	0	0	0	0	113.5
524	A	23.1	Very low	26	Very low	82 Å²	82	124.7 Å²	124.7	68%	0.678	77%	0.766	S	S	*	*			trans	-70.3	173.4	-176.8	0	0	0	0	0	115.3
525	V	27.1	Very low	26.2	Very low	143 Å²	143	120.7 Å²	120.7	87%	0.867	76%	0.761	S	S	*	*				-168.2	141	116.4	143.6	0	0	0	0	111.9
526	V	25.7	Very low	26.2	Very low	130 Å²	130	121.8 Å²	121.8	79%	0.788	76%	0.763	S	S	*	*			trans	-136.5	178.8	172.3	-123.8	0	0	0	0	105.2
527	P	44.2	Very low	25.7	Very low	109 Å²	109	123.1 Å²	123.1	71%	0.708	76%	0.763	S	S	*	*			cis	-138.4	-144.8	-0.3	42.2	-20.9	0	0	0	113.7
528	V	24.4	Very low	25.9	Very low	119 Å²	119	126.3 Å²	126.3	72%	0.721	77%	0.767	S	S	*	*			trans	122.8	94.3	155.7	176.9	0	0	0	0	112.1
529	N	26.4	Very low	25.8	Very low	122 Å²	122	125.9 Å²	125.9	65%	0.652	77%	0.77	S	S	*	*				75	148	81.8	-69.1	-42.9	0	0	0	114
530	Q	29.9	Very low	25.9	Very low	177 Å²	177	125.3 Å²	125.3	83%	0.827	77%	0.77	S	S	*	*			cis	-165.6	178.5	-15.1	-111.5	178.5	60	0	0	107.4
531	G	27.1	Very low	26	Very low	69 Å²	69	128.1 Å²	128.1	71%	0.711	78%	0.775	S	S	*	*			cis	-128.9	-127.9	-1.5	0	0	0	0	0	110.5
532	M	25.9	Very low	27.2	Very low	179 Å²	179	128.3 Å²	128.3	88%	0.882	77%	0.774	S	S	*	*			cis	-150.5	168.9	-7.1	-177.6	48.5	164.9	0	0	108.9
533	N	24.3	Very low	27.3	Very low	136 Å²	136	129 Å²	129	73%	0.727	77%	0.773	S	S	*	*			trans	-87.7	170.2	-150.1	-80.5	-69	0	0	0	120.5
534	S	25.4	Very low	27.2	Very low	125 Å²	125	128.7 Å²	128.7	87%	0.874	77%	0.766	S	S	*	*			trans	93.5	126.9	153.3	-54.6	0	0	0	0	119
535	G	26.8	Very low	27.2	Very low	68 Å²	68	130.7 Å²	130.7	70%	0.701	78%	0.775	S	S	*	*			cis	163.1	142.9	-14.9	0	0	0	0	0	116.1
536	V	26	Very low	27	Very low	133 Å²	133	126.9 Å²	126.9	81%	0.806	77%	0.765	S	S	*	*			trans	61.3	125.5	136.4	178	0	0	0	0	118.9
537	L	23.8	Very low	26.9	Very low	146 Å²	146	127.4 Å²	127.4	76%	0.764	77%	0.768	S	S	*	*			cis	-128.8	169.2	2.9	-74.2	174.5	0	0	0	110.7
538	Q	25.2	Very low	26.3	Very low	164 Å²	164	130.1 Å²	130.1	77%	0.766	78%	0.775	S	S	*	*			cis	93.9	69.8	-1.7	-157	176.3	-16.9	0	0	120.4
539	L	24.3	Very low	26.8	Very low	165 Å²	165	129.8 Å²	129.8	86%	0.864	78%	0.776	S	S	*	*			trans	-162	146.4	154.4	-129.3	73.8	0	0	0	108.5
540	S	24	Very low	26.8	Very low	102 Å²	102	131 Å²	131	71%	0.713	79%	0.787	S	S	*	*			cis	-148.4	167.1	1.5	-33.1	0	0	0	0	111
541	Q	23.9	Very low	26.6	Very low	181 Å²	181	125.6 Å²	125.6	85%	0.846	78%	0.779	S	S	*	*			trans	-102.3	-164.8	170.3	-68.8	-170.5	0.2	0	0	111.6
542	P	47.8	Very low	26.7	Very low	109 Å²	109	131.6 Å²	131.6	71%	0.708	79%	0.788	S	S	*	*				-125.5	-113.6	-62.7	36.2	-18.5	0	0	0	112.3
543	V	23.9	Very low	27	Very low	127 Å²	127	128.3 Å²	128.3	77%	0.77	78%	0.781	S	S	*	*			trans	84.1	122.6	-177.2	-174.1	0	0	0	0	114.5
544	V	22.7	Very low	26.9	Very low	117 Å²	117	127.7 Å²	127.7	71%	0.709	78%	0.781	S	S	*	*			cis	114.6	119.3	12.2	170.4	0	0	0	0	112.9
545	S	22.8	Very low	26.9	Very low	124 Å²	124	132.8 Å²	132.8	87%	0.867	78%	0.781	S	S	*	*			trans	59.6	162.4	166.7	-65.8	0	0	0	0	118
546	G	22.8	Very low	27.4	Very low	63 Å²	63	135.4 Å²	135.4	65%	0.649	79%	0.786	S	S	*	*			cis	160.7	172.5	-8.4	0	0	0	0	0	112.2
547	V	23.6	Very low	27.3	Very low	141 Å²	141	132.3 Å²	132.3	86%	0.855	78%	0.781	S	S	*	*			trans	73.8	136.6	164.4	-172.5	0	0	0	0	119
548	L	30.8	Very low	27.4	Very low	165 Å²	165	131.6 Å²	131.6	86%	0.864	78%	0.783	S	S	*	*			trans	-117.5	148.5	159	-69	169.2	0	0	0	107.1
549	P	35.4	Very low	27.4	Very low	113 Å²	113	130.5 Å²	130.5	73%	0.734	78%	0.781	S	S	*	*				-157.3	169.7	91.8	39.6	-19.4	0	0	0	118.4
550	V	26.3	Very low	27.4	Very low	148 Å²	148	130 Å²	130	90%	0.897	77%	0.774	S	S	*	*			trans	12.3	139.2	143.4	-171.4	0	0	0	0	119.8
551	G	25	Very low	27.5	Very low	63 Å²	63	131.3 Å²	131.3	65%	0.649	77%	0.773	S	S	*	*			cis	154	146.7	-6	0	0	0	0	0	115.3
552	Q	29.9	Very low	27.5	Very low	194 Å²	194	128.8 Å²	128.8	91%	0.907	77%	0.765	S	S	*	*			trans	66.9	165.9	178.9	-62.2	-166	-6.8	0	0	116.6
553	P	32.1	Very low	26.5	Very low	111 Å²	111	131.4 Å²	131.4	72%	0.721	77%	0.768	S	S	*	*			cis	-133.7	161.9	2.9	42.3	-25.3	0	0	0	119.1
554	V	21.7	Very low	26.6	Very low	122 Å²	122	130.4 Å²	130.4	74%	0.739	76%	0.762	S	S	*	*			trans	20.9	124.8	140	-172	0	0	0	0	123.9
555	R	25.6	Very low	26.7	Very low	232 Å²	232	131.5 Å²	131.5	88%	0.875	77%	0.769	S	S	*	*			trans	68.5	170.8	152.7	-83	179.3	169.1	178.2	-3.2	119.6
556	P	37.3	Very low	26.8	Very low	123 Å²	123	129 Å²	129	80%	0.799	76%	0.762	S	S	*	*			cis	-114.1	-175.2	-8.6	23.2	-0.6	0	0	0	112.7
557	G	25.1	Very low	26.8	Very low	69 Å²	69	132 Å²	132	71%	0.711	77%	0.769	S	S	*	*			cis	124.6	121.4	-4.5	0	0	0	0	0	114.2
558	V	24.3	Very low	26.7	Very low	131 Å²	131	132.6 Å²	132.6	79%	0.794	77%	0.767	S	S	*	*			trans	-162	129.9	170.8	117.6	0	0	0	0	112.8
559	L	25.2	Very low	26.5	Very low	140 Å²	140	132.7 Å²	132.7	73%	0.733	77%	0.766	S	S	*	*			trans	52.4	146.2	158.3	-50.3	178.3	0	0	0	119.7
560	Q	25.5	Very low	25.9	Very low	154 Å²	154	134.8 Å²	134.8	72%	0.72	77%	0.771	S	S	*	*			cis	-173.5	170.6	-1.2	-111.1	176.2	-17	0	0	107.6
561	L	25.2	Very low	26.5	Very low	130 Å²	130	132.9 Å²	132.9	68%	0.681	76%	0.761	S	S	*	*			cis	-165.1	162.1	-14.4	-168.7	56.4	0	0	0	109.3
562	N	24.5	Very low	26.3	Very low	128 Å²	128	136 Å²	136	68%	0.684	77%	0.768	S	S	*	*			trans	61.7	132.6	168	-65.4	-21.1	0	0	0	119.6
563	Q	26.5	Very low	26.1	Very low	164 Å²	164	132.5 Å²	132.5	77%	0.766	76%	0.755	S	S	*	*			cis	94.7	137.6	18.6	-62.5	-136.2	113.2	0	0	116.3
564	T	26	Very low	25.8	Very low	107 Å²	107	135 Å²	135	66%	0.656	76%	0.757	S	S	*	*			cis	-171.7	171.5	-16.8	27.7	0	0	0	0	112.1
565	V	24.8	Very low	26.6	Very low	140 Å²	140	134.3 Å²	134.3	85%	0.848	76%	0.755	S	S	*	*			trans	85.6	136.8	156.8	-164.7	0	0	0	0	119.6
566	G	25.6	Very low	26.5	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	75%	0.753	S	S	*	*			trans	149.2	109.3	152.6	0	0	0	0	0	117.4
567	T	22.1	Very low	26	Very low	128 Å²	128	135 Å²	135	79%	0.785	76%	0.757	S	S	*	*			trans	-142.7	141.2	170.8	48.9	0	0	0	0	111.7
568	N	22.8	Very low	26.7	Very low	152 Å²	152	137.5 Å²	137.5	81%	0.813	76%	0.761	S	S	*	*			trans	154.6	162.2	132.3	-79.6	-38.2	0	0	0	115.6
569	I	26.3	Very low	26.7	Very low	167 Å²	167	135 Å²	135	86%	0.856	76%	0.761	S	S	*	*			trans	80.2	141.4	160	-29.7	-170	0	0	0	120.2
570	L	21.9	Very low	26.7	Very low	158 Å²	158	133.7 Å²	133.7	83%	0.827	77%	0.77	S	S	*	*			trans	-85.1	-163.8	172.8	-73.1	158	0	0	0	111.6
571	P	39	Very low	26.8	Very low	108 Å²	108	131 Å²	131	70%	0.701	77%	0.769	S	S	*	*			cis	-134.8	177.2	-13.9	20.4	5.4	0	0	0	116.1
572	V	21.9	Very low	27.1	Very low	129 Å²	129	132.5 Å²	132.5	78%	0.782	77%	0.772	S	S	*	*			trans	65.3	137.7	140.9	157.6	0	0	0	0	120
573	N	24.3	Very low	27.4	Very low	119 Å²	119	132.1 Å²	132.1	64%	0.636	77%	0.77	S	S	*	*			cis	-158.1	145.5	-8.7	-121.6	-25.7	0	0	0	112.8
574	Q	26.2	Very low	27.4	Very low	163 Å²	163	130.3 Å²	130.3	76%	0.762	77%	0.771	S	S	*	*			trans	23.9	166.3	133.5	-72.3	-175.6	84.3	0	0	124.6
575	P	37.8	Very low	27.6	Very low	108 Å²	108	130.4 Å²	130.4	70%	0.701	77%	0.771	S	S	*	*			cis	-125.1	-170.7	-22.7	28.4	-4.7	0	0	0	111.1
576	V	23.9	Very low	27.7	Very low	139 Å²	139	132.4 Å²	132.4	84%	0.842	77%	0.769	S	S	*	*			cis	-150.7	178.9	37.3	176.8	0	0	0	0	110.7
577	R	26.2	Very low	27.7	Very low	232 Å²	232	136 Å²	136	88%	0.875	77%	0.77	S	S	*	*			trans	-129.9	-172.9	-165.8	-115.6	-176.6	173.3	155	-3.8	111.3
578	P	39.9	Very low	27.8	Very low	121 Å²	121	136.2 Å²	136.2	79%	0.786	77%	0.772	S	S	*	*			cis	-136.4	176.7	-28.6	38	-21.3	0	0	0	114.8
579	G	24.1	Very low	28	Very low	78 Å²	78	134.2 Å²	134.2	80%	0.804	77%	0.77	S	S	*	*			trans	161.2	107.8	154.6	0	0	0	0	0	116
580	A	26.6	Very low	28.3	Very low	112 Å²	112	130.2 Å²	130.2	93%	0.926	77%	0.77	S	S	*	*			trans	-150.8	176.2	-179.1	0	0	0	0	0	112.8
581	S	27.4	Very low	28.7	Very low	99 Å²	99	127 Å²	127	69%	0.692	76%	0.761	S	S	*	*			trans	-140.5	159.1	-157.1	76.2	0	0	0	0	118.5
582	Q	31.9	Very low	28.5	Very low	161 Å²	161	130.2 Å²	130.2	75%	0.752	77%	0.77	S	S	*	*			trans	88.1	120.1	148.1	-73.7	-175.5	53.1	0	0	123.8
583	N	29.2	Very low	29	Very low	119 Å²	119	131.1 Å²	131.1	64%	0.636	77%	0.77	S	S	*	*				81.5	118.2	129.4	-63	-17.4	0	0	0	125.6
584	T	28.4	Very low	29.5	Very low	127 Å²	127	134.7 Å²	134.7	78%	0.779	77%	0.774	S	S	*	*			trans	67.4	144.8	139.8	56	0	0	0	0	120
585	T	29.9	Very low	30	Very low	109 Å²	109	135.6 Å²	135.6	67%	0.669	78%	0.779	S	S	*	*			cis	-157.9	157.4	12.3	-14.5	0	0	0	0	114.3
586	F	26.4	Very low	29.8	Very low	181 Å²	181	134.5 Å²	134.5	79%	0.794	77%	0.767	S	S	*	*			trans	68.2	124.4	150.3	-74.7	-49.6	0	0	0	126.1
587	L	26.5	Very low	30.7	Very low	145 Å²	145	134 Å²	134	76%	0.759	76%	0.758	S	S	*	*			trans	76.3	142.3	135.8	-66.2	175.6	0	0	0	124
588	T	23.2	Very low	31.4	Very low	133 Å²	133	126.6 Å²	126.6	82%	0.816	74%	0.74	S	S	*	*			trans	63.1	142.7	163.5	33.4	0	0	0	0	117.3
589	S	27	Very low	31.9	Very low	110 Å²	110	124.2 Å²	124.2	77%	0.769	72%	0.723	S	S	*	*			cis	-142.6	170.7	0.3	-82.3	0	0	0	0	110.2
590	G	33.5	Very low	33.1	Very low	84 Å²	84	124.8 Å²	124.8	87%	0.866	73%	0.729	S	S	*	*			trans	-79.2	125.4	-179.4	0	0	0	0	0	114.6
591	S	29.3	Very low	34	Very low	90 Å²	90	127.7 Å²	127.7	63%	0.629	72%	0.721	S	S	*	*			trans	-166.3	121.6	155.4	-176.8	0	0	0	0	110	L593	S591-L593 VanDerWaalsContact C-N 3.34Å; S591-L593 PolarHBondContact O-N 3.32Å
592	I	34.3	Very low	35	Very low	175 Å²	175	129.4 Å²	129.4	90%	0.897	72%	0.718	S	S	*	*			trans	-96.6	70.5	166.2	-54.6	-177.7	0	0	0	107.9
593	L	32.7	Very low	35.3	Very low	148 Å²	148	126.8 Å²	126.8	78%	0.775	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-80.2	140.8	157.4	-79.7	168.4	0	0	0	108.7	S591 Q595	S591-L593 VanDerWaalsContact C-N 3.34Å; S591-L593 PolarHBondContact O-N 3.32Å; L593-Q595 PolarHBondContact O-N 3.35Å
594	R	34.9	Very low	35.8	Very low	194 Å²	194	128.8 Å²	128.8	73%	0.732	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-68.2	123.5	-178.3	-63.7	179.3	177.7	172.8	-3.3	109.6	L596 L611	R594-L596 PolarHBondContact O-N 3.33Å; R594-L611 HydrophobicContact CB-CD2 3.97Å
595	Q	37	Very low	36.7	Very low	182 Å²	182	125.5 Å²	125.5	85%	0.85	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-73	116.6	178	-168	171.1	7.2	0	0	110.1	L593	L593-Q595 PolarHBondContact O-N 3.35Å
596	L	32.7	Very low	37.3	Very low	86 Å²	86	126.2 Å²	126.2	45%	0.45	71%	0.713	S	S	.	*	P	Polyproline II helix	trans	-91.2	128.4	-179.2	-68.2	165.8	0	0	0	109.9	R594 Y609 L611	R594-L596 PolarHBondContact O-N 3.33Å; L596-Y609 HydrophobicContact CB-CD1 3.49Å; L596-Y609 VanDerWaalsContact CB-CD1 3.49Å; L596-Y609 HydrophobicContact CB-CE1 4.1Å; L596-Y609 HydrophobicContact CB-CG 3.89Å; L596-Y609 HydrophobicContact CD1-CG 4.42Å; L596-L611 HydrophobicContact CD2-CD1 4.38Å; L596-L611 HydrophobicContact CD2-CD2 3.61Å; L596-L611 HydrophobicContact CD2-CG 3.79Å
597	I	43.7	Very low	37.9	Very low	129 Å²	129	120.6 Å²	120.6	66%	0.662	70%	0.695	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.6	125.1	173.8	-58.4	178.6	0	0	0	108.4	T599	I597-T599 PolarHBondContact O-N 2.92Å
598	P	40.6	Very low	38.6	Very low	76 Å²	76	117 Å²	117	49%	0.494	68%	0.679	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.2	123.6	-178.3	27.9	-31.5	0	0	0	110.6	Y609	P598-Y609 HydrophobicContact CB-CD1 3.94Å; P598-Y609 HydrophobicContact CB-CE1 3.62Å; P598-Y609 HydrophobicContact CG-CE1 4.13Å
599	T	51.1	Low	39.6	Very low	70 Å²	70	115.9 Å²	115.9	43%	0.429	66%	0.66	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.5	129	165.9	46.9	0	0	0	0	108.9	I597 K601 T608	I597-T599 PolarHBondContact O-N 2.92Å; T599-K601 PolarHBondContact O-N 3.49Å; T599-T608 PolarHBondContact N-O 3.37Å; T599-T608 VanDerWaalsContact N-O 3.09Å; T599-T608 PolarHBondContact OG1-O 3.07Å; T599-T608 VanDerWaalsContact OG1-O 3.05Å
600	G	48.4	Very low	40.4	Very low	90 Å²	90	115 Å²	115	93%	0.928	65%	0.65	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.7	39.6	-170.8	0	0	0	0	0	116.9
601	K	45.5	Very low	40.5	Very low	174 Å²	174	115 Å²	115	76%	0.757	63%	0.63	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-126.2	123.9	169	-67.7	-167.4	175.7	-171.8	0	109.1	T599	T599-K601 PolarHBondContact O-N 3.49Å
602	Q	49.3	Very low	40.7	Very low	134 Å²	134	114.7 Å²	114.7	63%	0.626	63%	0.633	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.5	145.5	172.4	-63.5	-166.5	76	0	0	109.8	G605	Q602-G605 VanDerWaalsContact OE1-C 3.29Å; Q602-G605 PolarHBondContact OE1-O 3.36Å
603	V	37.4	Very low	40.7	Very low	106 Å²	106	112.1 Å²	112.1	64%	0.642	63%	0.628	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-123.7	125.5	161.6	-178.1	0	0	0	0	105.8	G605 I606	V603-G605 VanDerWaalsContact C-N 3.27Å; V603-G605 PolarHBondContact O-N 3.39Å; V603-G605 VanDerWaalsContact O-N 3.17Å; V603-I606 PolarHBondContact O-N 3.06Å
604	N	39.9	Very low	40.5	Very low	161 Å²	161	111.7 Å²	111.7	86%	0.861	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.3	42.7	-178.4	-61.4	7.1	0	0	0	114.9	I606	N604-I606 PolarHBondContact O-N 2.9Å
605	G	48.2	Very low	40.2	Very low	58 Å²	58	107.1 Å²	107.1	60%	0.598	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.7	9.7	168.7	0	0	0	0	0	116.7	Q602 V603	Q602-G605 VanDerWaalsContact OE1-C 3.29Å; Q602-G605 PolarHBondContact OE1-O 3.36Å; V603-G605 VanDerWaalsContact C-N 3.27Å; V603-G605 PolarHBondContact O-N 3.39Å; V603-G605 VanDerWaalsContact O-N 3.17Å
606	I	42.8	Very low	39.9	Very low	124 Å²	124	104.5 Å²	104.5	64%	0.636	63%	0.625	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.3	131.9	177.4	-56.4	179.2	0	0	0	109.9	V603 N604	V603-I606 PolarHBondContact O-N 3.06Å; N604-I606 PolarHBondContact O-N 2.9Å
607	P	37.4	Very low	39.7	Very low	63 Å²	63	105.9 Å²	105.9	41%	0.409	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.1	131.5	175.8	-20.4	32.7	0	0	0	112.4	Y609	P607-Y609 HydrophobicContact CB-CE2 3.92Å; P607-Y609 WeakPolarHBondContact O-CD2 3.16Å
608	T	42.1	Very low	38.9	Very low	69 Å²	69	107.4 Å²	107.4	42%	0.423	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.7	138.6	173.2	-55.6	0	0	0	0	110.6	T599	T599-T608 PolarHBondContact N-O 3.37Å; T599-T608 VanDerWaalsContact N-O 3.09Å; T599-T608 PolarHBondContact OG1-O 3.07Å; T599-T608 VanDerWaalsContact OG1-O 3.05Å
609	Y	44.1	Very low	38.4	Very low	111 Å²	111	109.6 Å²	109.6	44%	0.435	66%	0.66	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.5	139.7	-178.5	-61.8	-91.7	0	0	0	111	L596 P598 P607	L596-Y609 HydrophobicContact CB-CD1 3.49Å; L596-Y609 VanDerWaalsContact CB-CD1 3.49Å; L596-Y609 HydrophobicContact CB-CE1 4.1Å; L596-Y609 HydrophobicContact CB-CG 3.89Å; L596-Y609 HydrophobicContact CD1-CG 4.42Å; P598-Y609 HydrophobicContact CB-CD1 3.94Å; P598-Y609 HydrophobicContact CB-CE1 3.62Å; P598-Y609 HydrophobicContact CG-CE1 4.13Å; P607-Y609 HydrophobicContact CB-CE2 3.92Å; P607-Y609 WeakPolarHBondContact O-CD2 3.16Å
610	T	44.3	Very low	37.3	Very low	91 Å²	91	113.2 Å²	113.2	56%	0.558	68%	0.681	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-121.4	139.1	-179.4	-55.1	0	0	0	0	110.8
611	L	35.7	Very low	37	Very low	85 Å²	85	114.4 Å²	114.4	45%	0.445	67%	0.673	S	S	.	*			trans	-103.4	118.7	172.3	-69.3	173.5	0	0	0	109.7	R594 L596	R594-L611 HydrophobicContact CB-CD2 3.97Å; L596-L611 HydrophobicContact CD2-CD1 4.38Å; L596-L611 HydrophobicContact CD2-CD2 3.61Å; L596-L611 HydrophobicContact CD2-CG 3.79Å
612	A	32.6	Very low	36.9	Very low	82 Å²	82	112.2 Å²	112.2	68%	0.678	68%	0.676	S	S	*	*			trans	-118.1	123.2	176.3	0	0	0	0	0	110.8
613	P	33.8	Very low	35.8	Very low	122 Å²	122	109.8 Å²	109.8	79%	0.792	69%	0.687	S	S	*	*			trans	-80.2	133.3	162.6	32.6	-29.8	0	0	0	109.4
614	V	28.8	Very low	35.5	Very low	139 Å²	139	108 Å²	108	84%	0.842	69%	0.691	S	S	*	*			trans	-128.5	140.2	173.5	-179.5	0	0	0	0	108.9
615	S	29.4	Very low	35	Very low	97 Å²	97	109.2 Å²	109.2	68%	0.678	70%	0.696	S	S	*	*			trans	-129.2	162.7	-164.6	-49.3	0	0	0	0	111.9
616	V	31.1	Very low	34	Very low	128 Å²	128	110.8 Å²	110.8	78%	0.776	70%	0.704	S	S	*	*			trans	73	112.8	158.1	-174.8	0	0	0	0	118.9
617	T	26.6	Very low	33.1	Very low	115 Å²	115	111.1 Å²	111.1	71%	0.706	71%	0.711	S	S	*	*				22.8	119.9	126.7	-38	0	0	0	0	121.6
618	L	28.1	Very low	32.6	Very low	161 Å²	161	114.8 Å²	114.8	84%	0.843	73%	0.732	S	S	*	*			trans	42.8	125.1	145.1	-57.4	173.6	0	0	0	121.9
619	P	28.9	Very low	31.7	Very low	122 Å²	122	115.4 Å²	115.4	79%	0.792	75%	0.745	S	S	*	*			trans	-102	156.6	167.4	38.5	-32.6	0	0	0	114.8
620	V	28.5	Very low	31.9	Very low	145 Å²	145	116 Å²	116	88%	0.879	76%	0.762	S	S	*	*			trans	-137.6	148.1	165	169.5	0	0	0	0	107.7
621	P	42.2	Very low	31.7	Very low	115 Å²	115	116.3 Å²	116.3	75%	0.747	77%	0.766	S	S	*	*			trans	-113.4	-153.6	-143.3	45.1	-34.5	0	0	0	115
622	P	43.2	Very low	31.2	Very low	128 Å²	128	121.6 Å²	121.6	83%	0.831	79%	0.788	S	S	*	*				-137.1	178	-98	43.5	-24.9	0	0	0	117.2
623	G	27.7	Very low	30.8	Very low	83 Å²	83	126.1 Å²	126.1	86%	0.856	80%	0.797	S	S	*	*			trans	153.2	150	161.5	0	0	0	0	0	113.4
624	G	30.3	Very low	31.5	Very low	70 Å²	70	124.9 Å²	124.9	72%	0.722	79%	0.79	S	S	*	*			cis	168.1	120.7	-12.9	0	0	0	0	0	114.2
625	L	28.9	Very low	31.4	Very low	185 Å²	185	125 Å²	125	97%	0.969	78%	0.784	S	S	*	*			trans	66.7	158.2	171	-53.1	172.5	0	0	0	115.7
626	A	27.6	Very low	31.2	Very low	92 Å²	92	128.1 Å²	128.1	76%	0.76	79%	0.788	S	S	*	*			cis	-144	-173.9	9.8	0	0	0	0	0	114.3
627	T	24.5	Very low	31	Very low	130 Å²	130	129.3 Å²	129.3	80%	0.798	79%	0.789	S	S	*	*			trans	-64.9	172.8	177.4	47.1	0	0	0	0	114.5
628	V	26.6	Very low	31	Very low	140 Å²	140	131.3 Å²	131.3	85%	0.848	80%	0.795	S	S	*	*			cis	-152	173.2	35.1	-160.4	0	0	0	0	111.4
629	A	23.4	Very low	31.7	Very low	83 Å²	83	128.5 Å²	128.5	69%	0.686	79%	0.786	S	S	*	*			trans	-119.2	-172.5	175.8	0	0	0	0	0	111.1
630	P	47.5	Very low	31.6	Very low	122 Å²	122	128.7 Å²	128.7	79%	0.792	79%	0.79	S	S	*	*			cis	-120.4	-117	-1.6	26	2.1	0	0	0	110.4
631	P	41	Very low	31.5	Very low	99 Å²	99	125.5 Å²	125.5	64%	0.643	79%	0.786	S	S	*	*			cis	-138.5	148.1	-28.1	35.9	-14.9	0	0	0	119.3
632	Q	24.7	Very low	30.8	Very low	196 Å²	196	125.1 Å²	125.1	92%	0.916	79%	0.793	S	S	*	*			trans	64.7	175.2	145.7	-60	-177.2	26.5	0	0	120.9
633	M	24.6	Very low	30.1	Very low	176 Å²	176	123.9 Å²	123.9	87%	0.867	79%	0.793	S	S	*	*			trans	-130.7	-164.6	-166.3	-41.7	-158	-55.3	0	0	110.7
634	P	49.1	Very low	30.1	Very low	97 Å²	97	124.3 Å²	124.3	63%	0.63	79%	0.789	S	S	*	*			cis	-136.3	-146	-11.2	31.3	-5.2	0	0	0	113
635	I	26.3	Very low	31	Very low	142 Å²	142	126.4 Å²	126.4	73%	0.728	79%	0.79	S	S	*	*			trans	81.5	135.8	157.8	-73.4	163.9	0	0	0	115.3
636	Q	25.2	Very low	31.2	Very low	162 Å²	162	126.4 Å²	126.4	76%	0.757	79%	0.787	S	S	*	*			cis	-159.9	-175.2	7.8	-138.2	171.9	32.2	0	0	114.3
637	L	25.8	Very low	31.3	Very low	153 Å²	153	126.6 Å²	126.6	80%	0.801	79%	0.789	S	S	*	*			trans	107.8	146.9	146.8	-80	156.3	0	0	0	122.8
638	L	27.9	Very low	31.6	Very low	157 Å²	157	123.7 Å²	123.7	82%	0.822	79%	0.785	S	S	*	*			trans	-103.8	-167.5	-166.1	-121.3	65.8	0	0	0	110.4
639	P	41.4	Very low	31.6	Very low	101 Å²	101	123.2 Å²	123.2	66%	0.656	79%	0.788	S	S	*	*			cis	-138.8	179.2	-14.4	33.3	-11.6	0	0	0	116.5
640	S	26.9	Very low	31.9	Very low	127 Å²	127	128 Å²	128	89%	0.888	80%	0.798	S	S	*	*			trans	47	158.2	141.7	-63.1	0	0	0	0	123.6
641	G	27.5	Very low	31.9	Very low	77 Å²	77	128.4 Å²	128.4	79%	0.794	80%	0.8	S	S	*	*			cis	-167.6	-157.4	8.5	0	0	0	0	0	115.5
642	A	27.6	Very low	31.1	Very low	107 Å²	107	127.3 Å²	127.3	88%	0.884	81%	0.807	S	S	*	*			trans	-101.7	-169.4	-168.7	0	0	0	0	0	113.5
643	A	27.1	Very low	31.1	Very low	102 Å²	102	126.3 Å²	126.3	84%	0.843	80%	0.804	S	S	*	*			cis	-159.5	-167.6	19.1	0	0	0	0	0	115.3
644	A	29.2	Very low	31.6	Very low	92 Å²	92	123 Å²	123	76%	0.76	80%	0.796	S	S	*	*			trans	-82.7	-173.1	-174.2	0	0	0	0	0	115.4
645	P	48.6	Very low	30.7	Very low	115 Å²	115	123.2 Å²	123.2	75%	0.747	80%	0.8	S	S	*	*				-161.8	167.3	81.5	42.5	-21.3	0	0	0	121.2
646	M	33.1	Very low	32.3	Very low	185 Å²	185	121.9 Å²	121.9	91%	0.911	80%	0.801	S	S	*	*			trans	55.1	172.1	143.7	-70.8	-56.6	174.2	0	0	122.2
647	A	29.9	Very low	33.8	Very low	96 Å²	96	119.3 Å²	119.3	79%	0.793	80%	0.798	S	S	*	*			cis	-166.2	-178.1	-24.5	0	0	0	0	0	108.3
648	G	29.9	Very low	33.9	Very low	69 Å²	69	118.3 Å²	118.3	71%	0.711	80%	0.798	S	S	*	*			cis	170.3	-170.1	-1	0	0	0	0	0	113.6
649	S	27.6	Very low	33.8	Very low	130 Å²	130	117.7 Å²	117.7	91%	0.909	79%	0.794	S	S	*	*			trans	87.3	145.1	162.3	-57.1	0	0	0	0	123.6
650	M	28.7	Very low	33.1	Very low	184 Å²	184	118.7 Å²	118.7	91%	0.906	80%	0.798	S	S	*	*			trans	-157.2	-166	-178.6	-57.2	-164.6	-57.3	0	0	109.4
651	P	47.7	Very low	32.9	Very low	129 Å²	129	118.1 Å²	118.1	84%	0.838	79%	0.79	S	S	*	*			cis	-139.1	-156.4	-4	45.3	-24.3	0	0	0	115.5
652	G	24.2	Very low	32.8	Very low	76 Å²	76	119.2 Å²	119.2	78%	0.784	79%	0.792	S	S	*	*			trans	174.5	161.6	169.3	0	0	0	0	0	117.1
653	M	25.8	Very low	32.8	Very low	175 Å²	175	118.7 Å²	118.7	86%	0.862	79%	0.787	S	S	*	*			trans	-148.2	178	-177.2	-108.2	-179.2	67.6	0	0	110.7
654	P	35	Very low	32.9	Very low	108 Å²	108	123.2 Å²	123.2	70%	0.701	79%	0.791	S	S	*	*			cis	-138.8	178.8	10.9	43.5	-24.3	0	0	0	119
655	S	29.1	Very low	32.7	Very low	100 Å²	100	123.5 Å²	123.5	70%	0.699	79%	0.787	S	S	*	*			trans	-11.8	168.9	151.1	-63.6	0	0	0	0	123.7
656	P	61.3	Low	31.5	Very low	115 Å²	115	125 Å²	125	75%	0.747	79%	0.794	S	S	*	*			cis	-139.6	-155.1	-25.9	42.4	-21.8	0	0	0	112.1
657	P	55.4	Low	31.2	Very low	108 Å²	108	124.9 Å²	124.9	70%	0.701	79%	0.789	S	S	*	*			cis	-137.9	175.6	-7.6	46.8	-30.3	0	0	0	117.9
658	V	28.6	Very low	31.1	Very low	131 Å²	131	126 Å²	126	79%	0.794	79%	0.785	S	S	*	*			trans	64	132.6	161.7	179.3	0	0	0	0	117.7
659	L	26.2	Very low	31.3	Very low	144 Å²	144	128.5 Å²	128.5	75%	0.754	79%	0.789	S	S	*	*			cis	-169.7	-170.1	-19.3	-150.2	45	0	0	0	105.2
660	V	24.8	Very low	31.1	Very low	122 Å²	122	126.2 Å²	126.2	74%	0.739	78%	0.778	S	S	*	*			cis	-148.3	127.7	14.1	-178	0	0	0	0	112.5
661	T	23.8	Very low	31	Very low	116 Å²	116	123 Å²	123	71%	0.712	77%	0.774	S	S	*	*			trans	23.4	101.7	140.2	-42.7	0	0	0	0	124
662	A	25.1	Very low	29.9	Very low	100 Å²	100	122.1 Å²	122.1	83%	0.826	77%	0.77	S	S	*	*				63.2	169.5	115	0	0	0	0	0	124.2
663	A	28.2	Very low	30.6	Very low	95 Å²	95	123.8 Å²	123.8	79%	0.785	77%	0.77	S	S	*	*			trans	-133.3	178.7	-175.1	0	0	0	0	0	111.5
664	Q	28.5	Very low	30.6	Very low	197 Å²	197	119.5 Å²	119.5	92%	0.921	76%	0.763	S	S	*	*			trans	-155.5	162.6	162.2	-124.2	168.9	67.1	0	0	113.8
665	S	24.6	Very low	30.3	Very low	98 Å²	98	119.8 Å²	119.8	69%	0.685	76%	0.763	S	S	*	*			trans	-150.6	138.2	-168.6	57.2	0	0	0	0	112.3
666	V	25.1	Very low	30.1	Very low	148 Å²	148	121.6 Å²	121.6	90%	0.897	76%	0.764	S	S	*	*			trans	-136.6	155.2	166.1	-175.4	0	0	0	0	108.4
667	F	26.2	Very low	28.6	Very low	181 Å²	181	121.6 Å²	121.6	79%	0.794	76%	0.762	S	S	*	*			trans	-144.6	166.8	-151.2	-126.7	-80.3	0	0	0	113
668	V	28.1	Very low	27.2	Very low	120 Å²	120	124.5 Å²	124.5	73%	0.727	77%	0.772	S	S	*	*			trans	73.1	148.6	168	176.8	0	0	0	0	114.4
669	P	33.6	Very low	27.7	Very low	122 Å²	122	126.7 Å²	126.7	79%	0.792	77%	0.774	S	S	*	*			cis	-116.8	-177.5	1.9	19.6	3.8	0	0	0	114.8
670	A	23.4	Very low	27.9	Very low	82 Å²	82	126.2 Å²	126.2	68%	0.678	78%	0.776	S	S	*	*			cis	166.9	112.8	-38.6	0	0	0	0	0	108.5
671	S	26.7	Very low	28.2	Very low	117 Å²	117	126.9 Å²	126.9	82%	0.818	78%	0.775	S	S	*	*			trans	-179.1	60.2	158.5	20.5	0	0	0	0	109.3
672	S	24.2	Very low	28.8	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	78%	0.781	S	S	*	*				77.1	89.9	83.5	74.3	0	0	0	0	113.8
673	S	38.3	Very low	29.6	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	78%	0.784	S	S	*	*			trans	-59.9	143.7	139.8	51.2	0	0	0	0	110.2
674	A	27.2	Very low	30	Very low	86 Å²	86	136 Å²	136	71%	0.711	78%	0.783	S	S	*	*			trans	-130.6	104	161.6	0	0	0	0	0	106.4
675	T	27.1	Very low	31.1	Very low	114 Å²	114	133.8 Å²	133.8	70%	0.699	77%	0.77	S	S	*	*				73.2	150.1	74.4	66.6	0	0	0	0	112.5
676	D	24.9	Very low	32.8	Very low	137 Å²	137	135.7 Å²	135.7	73%	0.733	77%	0.768	S	S	*	*			cis	-136.1	165.1	15.3	-135.6	-50.7	0	0	0	115.6
677	T	30.8	Very low	34.8	Very low	115 Å²	115	136 Å²	136	71%	0.706	75%	0.753	S	S	*	*			trans	-70.7	150.6	168.3	49.6	0	0	0	0	112.5
678	N	26.1	Very low	37	Very low	169 Å²	169	131.4 Å²	131.4	90%	0.904	73%	0.733	S	S	*	*			trans	-145.5	144.5	144.6	-117.6	-100.6	0	0	0	108.4
679	Q	39.2	Very low	38.7	Very low	178 Å²	178	129 Å²	129	83%	0.832	72%	0.719	S	S	*	*			trans	-109.4	162.9	-170.5	-156.1	176.5	60.2	0	0	110.5
680	V	31.2	Very low	40.5	Very low	133 Å²	133	123.2 Å²	123.2	81%	0.806	68%	0.681	S	S	*	*			trans	84.4	130.3	173.2	-172.7	0	0	0	0	116.4
681	L	30.8	Very low	42.8	Very low	137 Å²	137	123.8 Å²	123.8	72%	0.717	68%	0.678	S	S	*	*			trans	61.5	95.6	164.7	-163.6	72.8	0	0	0	119.4
682	R	35	Very low	44.7	Very low	218 Å²	218	122.7 Å²	122.7	82%	0.823	67%	0.666	S	S	*	*				-170.5	106.5	110.7	-93.2	-62.5	161.8	-175.8	-6.1	110.5	A684	R682-A684 PolarHBondContact O-N 2.88Å; R682-A684 VanDerWaalsContact O-N 3.1Å
683	Q	41.7	Very low	47.1	Very low	193 Å²	193	119.9 Å²	119.9	90%	0.902	65%	0.646	S	S	*	*			trans	-72.9	99.1	166.8	-72.7	-178.6	-4.7	0	0	109.9	K685	Q683-K685 PolarHBondContact O-N 2.84Å
684	A	37.3	Very low	48.6	Very low	92 Å²	92	120.3 Å²	120.3	76%	0.76	64%	0.639	S	S	*	*			trans	-73.4	109.5	165.6	0	0	0	0	0	108.9	R682 Q686	R682-A684 PolarHBondContact O-N 2.88Å; R682-A684 VanDerWaalsContact O-N 3.1Å; A684-Q686 PolarHBondContact O-N 3.37Å; A684-Q686 VanDerWaalsContact O-N 3.09Å
685	K	51.9	Low	50.4	Low	150 Å²	150	121.8 Å²	121.8	65%	0.652	63%	0.631	S	S	*	*			trans	-56.3	117.3	171.6	-70	-178.8	178.9	178.6	0	108.4	Q683 W687	Q683-K685 PolarHBondContact O-N 2.84Å; K685-W687 PolarHBondContact O-N 2.96Å; K685-W687 PolarHBondContact O-NE1 3.26Å
686	Q	60.2	Low	52.2	Low	138 Å²	138	121.3 Å²	121.3	65%	0.645	62%	0.624	S	S	*	*			trans	-61.3	136.5	167.5	-75.1	-179.4	-14.2	0	0	108.9	A684 P698 S699	A684-Q686 PolarHBondContact O-N 3.37Å; A684-Q686 VanDerWaalsContact O-N 3.09Å; Q686-P698 CarbonylContact O-C 3.55Å; Q686-S699 WeakPolarHBondContact O-CB 3.41Å; Q686-S699 PolarHBondContact O-N 3.46Å
687	W	67.1	Low	54.3	Low	154 Å²	154	116.6 Å²	116.6	58%	0.583	60%	0.597	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.7	143.2	170	-62.7	74.3	0	0	0	108.9	K685 L696 F697 P698	K685-W687 PolarHBondContact O-N 2.96Å; K685-W687 PolarHBondContact O-NE1 3.26Å; W687-L696 HydrophobicContact CB-CD2 3.97Å; W687-L696 HydrophobicContact CE3-CB 4.38Å; W687-F697 CarbonylContact C-O 3.56Å; W687-F697 WeakPolarHBondContact CA-O 3.48Å; W687-P698 HydrophobicContact CD2-CG 4.26Å; W687-P698 HydrophobicContact CE3-CG 3.95Å; W687-P698 HydrophobicContact CH2-CG 3.86Å; W687-P698 HydrophobicContact CZ2-CG 4.16Å; W687-P698 HydrophobicContact CZ3-CG 3.75Å
688	K	72.4	Confident	56	Low	85 Å²	85	112.3 Å²	112.3	37%	0.37	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.8	130.9	179.2	-72.2	173.7	174.6	161.5	0	108.5	F697 S699 Y702	K688-F697 PolarHBondContact N-O 3.24Å; K688-F697 PolarHBondContact O-N 3.04Å; K688-S699 WeakPolarHBondContact CE-OG 3.39Å; K688-S699 PolarHBondContact NZ-OG 3.29Å; K688-Y702 HydrophobicContact CB-CD1 4.4Å; K688-Y702 HydrophobicContact CB-CD2 3.27Å; K688-Y702 HydrophobicContact CB-CE2 3.66Å; K688-Y702 HydrophobicContact CB-CG 3.68Å; K688-Y702 HydrophobicContact CD-CD1 3.79Å; K688-Y702 HydrophobicContact CD-CD2 4.19Å; K688-Y702 HydrophobicContact CD-CE1 4.27Å; K688-Y702 HydrophobicContact CD-CG 3.76Å; K688-Y702 HydrophobicContact CG-CD2 4.38Å; K688-Y702 HydrophobicContact CG-CG 4.39Å; K688-Y702 WeakPolarHBondContact O-CD2 3.49Å
689	T	64.1	Low	58.1	Low	70 Å²	70	105.7 Å²	105.7	43%	0.429	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	126.9	175.4	-44.8	0	0	0	0	109.7	N694 E695 L696	T689-N694 VanDerWaalsContact CG2-O 3.26Å; T689-N694 WeakPolarHBondContact CG2-O 3.35Å; T689-E695 CarbonylContact C-O 3.59Å; T689-E695 WeakPolarHBondContact CA-O 3.2Å; T689-L696 HydrophobicContact CG2-CG 4.48Å; T689-L696 VanDerWaalsContact OG1-CD2 3.24Å; T689-L696 WeakPolarHBondContact OG1-CD2 3.34Å
690	C	71.7	Confident	59.6	Low	0 Å²	0	102.9 Å²	102.9	0%	0	53%	0.529	C	S	.	.			trans	-68.9	123.6	173.4	178.7	0	0	0	0	110	V692 N694 E695 F697 Y702 H705 H710	C690-V692 PolarHBondContact O-N 3.03Å; C690-V692 VanDerWaalsContact O-N 3.16Å; C690-N694 WeakPolarHBondContact O-CA 3.46Å; C690-N694 PolarHBondContact O-N 3.35Å; C690-E695 PolarHBondContact N-O 2.84Å; C690-F697 HydrophobicContact CB-CD2 4.28Å; C690-F697 HydrophobicContact CB-CE2 4.16Å; C690-Y702 HydrophobicContact CB-CE2 4.34Å; C690-H705 WeakPolarHBondContact CB-NE2 3.42Å; C690-H705 PolarHBondContact SG-NE2 2.88Å; C690-H710 PolarHBondContact SG-CD2 2.8Å; C690-H710 PolarHBondContact SG-NE2 2.82Å
691	P	70.2	Confident	61.4	Low	93 Å²	93	99.6 Å²	99.6	60%	0.604	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.3	-177.8	29.9	-36	0	0	0	113.8	Y702	P691-Y702 WeakPolarHBondContact CD-OH 3.09Å
692	V	67.6	Low	63.5	Low	95 Å²	95	94.6 Å²	94.6	58%	0.576	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-40.9	-177.5	-172.3	0	0	0	0	111.8	C690	C690-V692 PolarHBondContact O-N 3.03Å; C690-V692 VanDerWaalsContact O-N 3.16Å
693	C	75.1	Confident	65.3	Low	49 Å²	49	89.1 Å²	89.1	33%	0.331	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-9.2	177	67.2	0	0	0	0	115	E695	C693-E695 PolarHBondContact O-N 3.4Å
694	N	68.1	Low	66.7	Low	121 Å²	121	83.7 Å²	83.7	65%	0.647	44%	0.444	S	S	*	.			trans	62.5	14.2	-174.5	-63.4	-71.4	0	0	0	116.5	T689 C690	T689-N694 VanDerWaalsContact CG2-O 3.26Å; T689-N694 WeakPolarHBondContact CG2-O 3.35Å; C690-N694 WeakPolarHBondContact O-CA 3.46Å; C690-N694 PolarHBondContact O-N 3.35Å
695	E	66.4	Low	68.5	Low	116 Å²	116	80.5 Å²	80.5	54%	0.542	41%	0.414	S	S	.	.			trans	-84.3	149.6	174.2	-63	-174.3	148.2	0	0	112.6	T689 C690 C693 F697	T689-E695 CarbonylContact C-O 3.59Å; T689-E695 WeakPolarHBondContact CA-O 3.2Å; C690-E695 PolarHBondContact N-O 2.84Å; C693-E695 PolarHBondContact O-N 3.4Å; E695-F697 HydrophobicContact CB-CE2 3.62Å; E695-F697 HydrophobicContact CB-CZ 3.79Å
696	L	65.1	Low	69.5	Low	104 Å²	104	76.1 Å²	76.1	55%	0.545	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116	-176.9	-90.9	160.3	0	0	0	111.6	W687 T689	W687-L696 HydrophobicContact CB-CD2 3.97Å; W687-L696 HydrophobicContact CE3-CB 4.38Å; T689-L696 HydrophobicContact CG2-CG 4.48Å; T689-L696 VanDerWaalsContact OG1-CD2 3.24Å; T689-L696 WeakPolarHBondContact OG1-CD2 3.34Å
697	F	68.4	Low	69.9	Low	39 Å²	39	74.2 Å²	74.2	17%	0.171	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	145.1	178.4	-62.1	-79.3	0	0	0	111.9	W687 K688 C690 E695 V701 H705	W687-F697 CarbonylContact C-O 3.56Å; W687-F697 WeakPolarHBondContact CA-O 3.48Å; K688-F697 PolarHBondContact N-O 3.24Å; K688-F697 PolarHBondContact O-N 3.04Å; C690-F697 HydrophobicContact CB-CD2 4.28Å; C690-F697 HydrophobicContact CB-CE2 4.16Å; E695-F697 HydrophobicContact CB-CE2 3.62Å; E695-F697 HydrophobicContact CB-CZ 3.79Å; F697-V701 HydrophobicContact CD1-CG1 4.43Å; F697-H705 HydrophobicContact CD2-CB 4.41Å; F697-H705 AromaticContact CD2-CD2 3.73Å; F697-H705 AromaticContact CD2-CG 3.86Å; F697-H705 AromaticContact CE1-ND1 3.97Å; F697-H705 AromaticContact CE2-CD2 3.53Å; F697-H705 AromaticContact CE2-CE1 3.39Å; F697-H705 WeakPolarHBondContact CE2-CE1 3.43Å; F697-H705 AromaticContact CE2-CG 3.62Å; F697-H705 AromaticContact CE2-ND1 3.53Å; F697-H705 AromaticContact CE2-NE2 3.39Å; F697-H705 WeakPolarHBondContact CE2-NE2 3.3Å; F697-H705 HydrophobicContact CG-CB 4.4Å; F697-H705 AromaticContact CZ-CE1 3.5Å; F697-H705 AromaticContact CZ-CG 3.86Å; F697-H705 AromaticContact CZ-ND1 3.39Å; F697-H705 WeakPolarHBondContact CZ-ND1 3.49Å
698	P	66.9	Low	69.8	Low	24 Å²	24	71.6 Å²	71.6	16%	0.156	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	142.4	166.1	-24.6	36	0	0	0	110.8	Q686 W687 N700 V701 Y702	Q686-P698 CarbonylContact O-C 3.55Å; W687-P698 HydrophobicContact CD2-CG 4.26Å; W687-P698 HydrophobicContact CE3-CG 3.95Å; W687-P698 HydrophobicContact CH2-CG 3.86Å; W687-P698 HydrophobicContact CZ2-CG 4.16Å; W687-P698 HydrophobicContact CZ3-CG 3.75Å; P698-N700 WeakPolarHBondContact CB-OD1 3.41Å; P698-N700 PolarHBondContact O-N 2.83Å; P698-V701 HydrophobicContact CB-CG2 4.36Å; P698-V701 WeakPolarHBondContact O-CA 3.43Å; P698-V701 PolarHBondContact O-N 3.47Å; P698-Y702 PolarHBondContact O-N 3.1Å
699	S	70	Confident	68.9	Low	30 Å²	30	70.4 Å²	70.4	21%	0.21	39%	0.394	C	S	.	.	H	α-helix	trans	-58	-26.4	-170	-167.5	0	0	0	0	114.2	Q686 K688	Q686-S699 WeakPolarHBondContact O-CB 3.41Å; Q686-S699 PolarHBondContact O-N 3.46Å; K688-S699 WeakPolarHBondContact CE-OG 3.39Å; K688-S699 PolarHBondContact NZ-OG 3.29Å
700	N	70.3	Confident	68.9	Low	119 Å²	119	69.8 Å²	69.8	64%	0.636	39%	0.386	S	S	*	.	H	α-helix	trans	-81.7	-18.8	174.7	67.9	-53.4	0	0	0	114.3	P698	P698-N700 WeakPolarHBondContact CB-OD1 3.41Å; P698-N700 PolarHBondContact O-N 2.83Å
701	V	69	Low	67.9	Low	64 Å²	64	77 Å²	77	39%	0.388	42%	0.418	S	S	.	.	H	α-helix	trans	-97	-30.2	175.3	-177.4	0	0	0	0	110.8	F697 P698 Q703 V704 H705	F697-V701 HydrophobicContact CD1-CG1 4.43Å; P698-V701 HydrophobicContact CB-CG2 4.36Å; P698-V701 WeakPolarHBondContact O-CA 3.43Å; P698-V701 PolarHBondContact O-N 3.47Å; V701-Q703 VanDerWaalsContact C-N 3.3Å; V701-Q703 PolarHBondContact O-N 3.36Å; V701-V704 PolarHBondContact O-N 3.19Å; V701-V704 VanDerWaalsContact O-N 3.16Å; V701-H705 WeakPolarHBondContact O-CB 3.39Å; V701-H705 PolarHBondContact O-N 3.43Å
702	Y	75.6	Confident	66.9	Low	33 Å²	33	80.6 Å²	80.6	13%	0.129	43%	0.426	C	S	.	.	H	α-helix	trans	-49.9	-45.3	179.6	178.3	-87.2	0	0	0	113.7	K688 C690 P691 P698 H705 M706	K688-Y702 HydrophobicContact CB-CD1 4.4Å; K688-Y702 HydrophobicContact CB-CD2 3.27Å; K688-Y702 HydrophobicContact CB-CE2 3.66Å; K688-Y702 HydrophobicContact CB-CG 3.68Å; K688-Y702 HydrophobicContact CD-CD1 3.79Å; K688-Y702 HydrophobicContact CD-CD2 4.19Å; K688-Y702 HydrophobicContact CD-CE1 4.27Å; K688-Y702 HydrophobicContact CD-CG 3.76Å; K688-Y702 HydrophobicContact CG-CD2 4.38Å; K688-Y702 HydrophobicContact CG-CG 4.39Å; K688-Y702 WeakPolarHBondContact O-CD2 3.49Å; C690-Y702 HydrophobicContact CB-CE2 4.34Å; P691-Y702 WeakPolarHBondContact CD-OH 3.09Å; P698-Y702 PolarHBondContact O-N 3.1Å; Y702-H705 PolarHBondContact O-N 3.28Å; Y702-M706 HydrophobicContact CD1-SD 4.38Å; Y702-M706 HydrophobicContact CE1-CG 4.09Å; Y702-M706 HydrophobicContact CE1-SD 3.43Å; Y702-M706 WeakPolarHBondContact CE1-SD 3.41Å; Y702-M706 PolarHBondContact O-N 3.01Å; Y702-M706 PolarHBondContact OH-SD 3.37Å; Y702-M706 VanDerWaalsContact OH-SD 3.37Å
703	Q	72.9	Confident	65.1	Low	103 Å²	103	81 Å²	81	48%	0.481	43%	0.433	S	S	.	.	H	α-helix	trans	-62.5	-50.1	180	-172.4	64.3	30.2	0	0	111.1	V701 H705 M706 E707	V701-Q703 VanDerWaalsContact C-N 3.3Å; V701-Q703 PolarHBondContact O-N 3.36Å; Q703-H705 VanDerWaalsContact C-N 3.31Å; Q703-H705 PolarHBondContact O-N 2.86Å; Q703-M706 PolarHBondContact O-N 3.4Å; Q703-E707 WeakPolarHBondContact CG-OE1 3.29Å; Q703-E707 PolarHBondContact NE2-OE1 2.85Å; Q703-E707 WeakPolarHBondContact O-CG 3.43Å; Q703-E707 PolarHBondContact O-N 3.38Å
704	V	71.1	Confident	63.3	Low	78 Å²	78	87.3 Å²	87.3	47%	0.473	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-36.8	177.4	-174.3	0	0	0	0	111.3	V701 E707 V708	V701-V704 PolarHBondContact O-N 3.19Å; V701-V704 VanDerWaalsContact O-N 3.16Å; V704-E707 PolarHBondContact O-N 3.43Å; V704-V708 HydrophobicContact CG1-CG2 3.97Å; V704-V708 VanDerWaalsContact O-CB 3.28Å; V704-V708 WeakPolarHBondContact O-CB 3.44Å; V704-V708 VanDerWaalsContact O-CG2 3.26Å; V704-V708 WeakPolarHBondContact O-CG2 3.5Å; V704-V708 PolarHBondContact O-N 3.14Å
705	H	74.3	Confident	61.4	Low	25 Å²	25	85.5 Å²	85.5	12%	0.116	45%	0.454	C	S	.	.	H	α-helix	trans	-60.6	-45.8	174	164.2	79	0	0	0	111.6	C690 F697 V701 Y702 Q703 E707 V708 A709 H710	C690-H705 WeakPolarHBondContact CB-NE2 3.42Å; C690-H705 PolarHBondContact SG-NE2 2.88Å; F697-H705 HydrophobicContact CD2-CB 4.41Å; F697-H705 AromaticContact CD2-CD2 3.73Å; F697-H705 AromaticContact CD2-CG 3.86Å; F697-H705 AromaticContact CE1-ND1 3.97Å; F697-H705 AromaticContact CE2-CD2 3.53Å; F697-H705 AromaticContact CE2-CE1 3.39Å; F697-H705 WeakPolarHBondContact CE2-CE1 3.43Å; F697-H705 AromaticContact CE2-CG 3.62Å; F697-H705 AromaticContact CE2-ND1 3.53Å; F697-H705 AromaticContact CE2-NE2 3.39Å; F697-H705 WeakPolarHBondContact CE2-NE2 3.3Å; F697-H705 HydrophobicContact CG-CB 4.4Å; F697-H705 AromaticContact CZ-CE1 3.5Å; F697-H705 AromaticContact CZ-CG 3.86Å; F697-H705 AromaticContact CZ-ND1 3.39Å; F697-H705 WeakPolarHBondContact CZ-ND1 3.49Å; V701-H705 WeakPolarHBondContact O-CB 3.39Å; V701-H705 PolarHBondContact O-N 3.43Å; Y702-H705 PolarHBondContact O-N 3.28Å; Q703-H705 VanDerWaalsContact C-N 3.31Å; Q703-H705 PolarHBondContact O-N 2.86Å; H705-E707 PolarHBondContact O-N 3.37Å; H705-V708 PolarHBondContact O-N 3.29Å; H705-A709 VanDerWaalsContact O-CB 3.31Å; H705-A709 WeakPolarHBondContact O-CB 3.38Å; H705-A709 PolarHBondContact O-N 3.27Å; H705-H710 AromaticContact CE1-NE2 3.75Å; H705-H710 AromaticContact NE2-CD2 3.58Å; H705-H710 AromaticContact NE2-NE2 3.4Å; H705-H710 PolarHBondContact NE2-NE2 2.8Å
706	M	73.9	Confident	60.4	Low	59 Å²	59	90.4 Å²	90.4	29%	0.291	47%	0.474	S	S	.	.	H	α-helix	trans	-61.5	-43.2	173.5	-70	-166.2	68.3	0	0	111.8	Y702 Q703 V708 H710	Y702-M706 HydrophobicContact CD1-SD 4.38Å; Y702-M706 HydrophobicContact CE1-CG 4.09Å; Y702-M706 HydrophobicContact CE1-SD 3.43Å; Y702-M706 WeakPolarHBondContact CE1-SD 3.41Å; Y702-M706 PolarHBondContact O-N 3.01Å; Y702-M706 PolarHBondContact OH-SD 3.37Å; Y702-M706 VanDerWaalsContact OH-SD 3.37Å; Q703-M706 PolarHBondContact O-N 3.4Å; M706-V708 VanDerWaalsContact C-N 3.3Å; M706-V708 PolarHBondContact O-N 3.34Å; M706-H710 CarbonylContact O-C 3.56Å; M706-H710 WeakPolarHBondContact O-CA 3.42Å; M706-H710 PolarHBondContact O-N 3.37Å
707	E	68.1	Low	58.6	Low	97 Å²	97	90.3 Å²	90.3	45%	0.453	48%	0.482	S	S	.	.	H	α-helix	trans	-73.9	-13.5	-177.8	-70.9	167.8	-165.4	0	0	115.2	Q703 V704 H705 K711	Q703-E707 WeakPolarHBondContact CG-OE1 3.29Å; Q703-E707 PolarHBondContact NE2-OE1 2.85Å; Q703-E707 WeakPolarHBondContact O-CG 3.43Å; Q703-E707 PolarHBondContact O-N 3.38Å; V704-E707 PolarHBondContact O-N 3.43Å; H705-E707 PolarHBondContact O-N 3.37Å; E707-K711 WeakPolarHBondContact O-CG 3.42Å; E707-K711 PolarHBondContact O-NZ 3.26Å
708	V	65.1	Low	56.8	Low	100 Å²	100	91.8 Å²	91.8	61%	0.606	51%	0.508	S	S	*	.	H	α-helix	trans	-114.8	-49.4	-178	176.2	0	0	0	0	112.4	V704 H705 M706	V704-V708 HydrophobicContact CG1-CG2 3.97Å; V704-V708 VanDerWaalsContact O-CB 3.28Å; V704-V708 WeakPolarHBondContact O-CB 3.44Å; V704-V708 VanDerWaalsContact O-CG2 3.26Å; V704-V708 WeakPolarHBondContact O-CG2 3.5Å; V704-V708 PolarHBondContact O-N 3.14Å; H705-V708 PolarHBondContact O-N 3.29Å; M706-V708 VanDerWaalsContact C-N 3.3Å; M706-V708 PolarHBondContact O-N 3.34Å
709	A	52.8	Low	55.2	Low	60 Å²	60	98.4 Å²	98.4	50%	0.496	54%	0.537	S	S	.	.	H	α-helix	trans	-85	-24.3	-178.4	0	0	0	0	0	113.2	H705	H705-A709 VanDerWaalsContact O-CB 3.31Å; H705-A709 WeakPolarHBondContact O-CB 3.38Å; H705-A709 PolarHBondContact O-N 3.27Å
710	H	64.6	Low	53.7	Low	57 Å²	57	106.1 Å²	106.1	26%	0.264	57%	0.567	S	S	.	*	S	Bend	trans	-125.3	40.1	-179.6	-57.5	-45.5	0	0	0	111.2	C690 H705 M706 H712	C690-H710 PolarHBondContact SG-CD2 2.8Å; C690-H710 PolarHBondContact SG-NE2 2.82Å; H705-H710 AromaticContact CE1-NE2 3.75Å; H705-H710 AromaticContact NE2-CD2 3.58Å; H705-H710 AromaticContact NE2-NE2 3.4Å; H705-H710 PolarHBondContact NE2-NE2 2.8Å; M706-H710 CarbonylContact O-C 3.56Å; M706-H710 WeakPolarHBondContact O-CA 3.42Å; M706-H710 PolarHBondContact O-N 3.37Å; H710-H712 PolarHBondContact O-N 3.09Å; H710-H712 VanDerWaalsContact O-N 3.13Å
711	K	51.5	Low	52.8	Low	152 Å²	152	102.8 Å²	102.8	66%	0.661	55%	0.549	S	S	*	.			trans	-43.3	120.2	-178.4	-97.2	-161.3	177.5	-50.5	0	111.7	E707 S713	E707-K711 WeakPolarHBondContact O-CG 3.42Å; E707-K711 PolarHBondContact O-NZ 3.26Å; K711-S713 PolarHBondContact O-N 3.23Å
712	H	48.6	Very low	52.1	Low	168 Å²	168	106.3 Å²	106.3	78%	0.778	56%	0.561	S	S	*	*			trans	-53.2	115.8	164.5	-86.9	-102.5	0	0	0	108.8	H710 E714	H710-H712 PolarHBondContact O-N 3.09Å; H710-H712 VanDerWaalsContact O-N 3.13Å; H712-E714 PolarHBondContact O-N 3.38Å
713	S	29.7	Very low	51.6	Low	102 Å²	102	106.1 Å²	106.1	71%	0.713	56%	0.564	S	S	*	*			trans	-76.9	72.4	173.3	63.8	0	0	0	0	109.4	K711 S715	K711-S713 PolarHBondContact O-N 3.23Å; S713-S715 PolarHBondContact O-N 3.35Å
714	E	36.7	Very low	51.7	Low	183 Å²	183	103.1 Å²	103.1	86%	0.855	55%	0.55	S	S	*	.			trans	-73.9	48.4	155.8	-64.1	-168	150.3	0	0	109.7	H712	H712-E714 PolarHBondContact O-N 3.38Å
715	S	29.4	Very low	52	Low	82 Å²	82	103.3 Å²	103.3	57%	0.573	54%	0.544	S	S	*	.			trans	-68.9	137.6	160.7	44.7	0	0	0	0	107.7	S713 S717	S713-S715 PolarHBondContact O-N 3.35Å; S715-S717 VanDerWaalsContact C-N 3.27Å; S715-S717 PolarHBondContact O-N 3.08Å
716	K	44	Very low	52.2	Low	219 Å²	219	102.4 Å²	102.4	95%	0.952	54%	0.54	S	S	*	.			trans	-61.6	88.3	175	-69	-179.5	178.4	179	0	110.1
717	S	27.8	Very low	52.5	Low	103 Å²	103	100.1 Å²	100.1	72%	0.72	53%	0.531	S	S	*	.			trans	-84.1	149.7	155.8	37.4	0	0	0	0	107.8	S715	S715-S717 VanDerWaalsContact C-N 3.27Å; S715-S717 PolarHBondContact O-N 3.08Å
718	G	31.4	Very low	53.2	Low	70 Å²	70	95.5 Å²	95.5	72%	0.722	51%	0.509	S	S	*	.	S	Bend	trans	-56.9	154.6	-175.7	0	0	0	0	0	112.3	K720	G718-K720 PolarHBondContact O-N 3.28Å
719	E	32	Very low	54	Low	163 Å²	163	91.4 Å²	91.4	76%	0.762	48%	0.484	S	S	*	.			trans	2	113.5	159.8	-169.3	-176.6	-167.3	0	0	113.5	L721	E719-L721 HydrophobicContact CB-CD2 4.23Å; E719-L721 VanDerWaalsContact CD-CD2 3.47Å; E719-L721 HydrophobicContact CG-CD2 3.79Å; E719-L721 WeakPolarHBondContact O-CG 3.39Å; E719-L721 PolarHBondContact O-N 2.84Å; E719-L721 WeakPolarHBondContact OE2-CD2 3.14Å
720	K	39	Very low	55.5	Low	192 Å²	192	88.5 Å²	88.5	84%	0.835	46%	0.461	S	S	*	.			trans	-70.9	81	179.8	-172.7	-164.1	171.4	-161.6	0	109.7	G718 E722	G718-K720 PolarHBondContact O-N 3.28Å; K720-E722 PolarHBondContact O-N 3.12Å; K720-E722 VanDerWaalsContact O-N 3.14Å
721	L	51.1	Low	56	Low	49 Å²	49	87.9 Å²	87.9	26%	0.257	46%	0.462	S	S	.	.			trans	-57.8	115.5	-173.5	-66.8	173.8	0	0	0	109.6	E719 R831	E719-L721 HydrophobicContact CB-CD2 4.23Å; E719-L721 VanDerWaalsContact CD-CD2 3.47Å; E719-L721 HydrophobicContact CG-CD2 3.79Å; E719-L721 WeakPolarHBondContact O-CG 3.39Å; E719-L721 PolarHBondContact O-N 2.84Å; E719-L721 WeakPolarHBondContact OE2-CD2 3.14Å; L721-R831 HydrophobicContact CB-CG 3.88Å; L721-R831 HydrophobicContact CD1-CG 3.85Å; L721-R831 HydrophobicContact CG-CG 4.49Å
722	E	55.3	Low	57.3	Low	137 Å²	137	81.5 Å²	81.5	64%	0.64	43%	0.434	S	S	*	.			trans	-52.7	134	178.9	-86	-66	112.9	0	0	110.2	K720 E724	K720-E722 PolarHBondContact O-N 3.12Å; K720-E722 VanDerWaalsContact O-N 3.14Å; E722-E724 PolarHBondContact O-N 2.77Å
723	P	64.6	Low	58.8	Low	29 Å²	29	73.8 Å²	73.8	19%	0.188	40%	0.399	C	S	.	.			trans	-64.7	134	-167.7	25.1	-34.2	0	0	0	111	K725 E832 Y834	P723-K725 PolarHBondContact O-N 3.1Å; P723-E832 CarbonylContact C-O 3.55Å; P723-E832 VanDerWaalsContact CA-O 3.25Å; P723-E832 WeakPolarHBondContact CA-O 3.49Å; P723-E832 HydrophobicContact CB-CB 4.13Å; P723-E832 WeakPolarHBondContact CB-O 3.28Å; P723-Y834 HydrophobicContact CB-CD2 3.58Å; P723-Y834 HydrophobicContact CB-CE2 3.51Å; P723-Y834 HydrophobicContact CG-CD2 4.16Å; P723-Y834 HydrophobicContact CG-CE2 3.81Å
724	E	74.3	Confident	61.2	Low	41 Å²	41	71.2 Å²	71.2	19%	0.192	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	115.7	-171.8	-164.8	172.5	163.8	0	0	110.5	E722 L726 S780 E832 V833 Y834	E722-E724 PolarHBondContact O-N 2.77Å; E724-L726 HydrophobicContact CG-CD2 4.17Å; E724-L726 HydrophobicContact CG-CG 4.25Å; E724-S780 WeakPolarHBondContact OE1-CA 3.47Å; E724-S780 WeakPolarHBondContact OE1-CB 3.47Å; E724-S780 PolarHBondContact OE1-OG 3.11Å; E724-S780 PolarHBondContact OE2-OG 3.47Å; E724-E832 PolarHBondContact N-O 2.87Å; E724-V833 HydrophobicContact CB-CG2 4.48Å; E724-V833 WeakPolarHBondContact O-CA 3.43Å; E724-V833 WeakPolarHBondContact O-CG1 3.37Å; E724-Y834 PolarHBondContact O-N 2.98Å
725	K	78.6	Confident	62.9	Low	82 Å²	82	67.6 Å²	67.6	36%	0.357	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	108.7	-177.3	-70.3	172.5	168.4	-168.8	0	110.2	P723 L812 F814 Y834	P723-K725 PolarHBondContact O-N 3.1Å; K725-L812 HydrophobicContact CB-CB 4.31Å; K725-L812 HydrophobicContact CB-CD1 4.44Å; K725-L812 VanDerWaalsContact CD-O 3.31Å; K725-L812 WeakPolarHBondContact CD-O 3.32Å; K725-L812 WeakPolarHBondContact CE-O 3.32Å; K725-L812 PolarHBondContact NZ-O 2.86Å; K725-F814 HydrophobicContact CB-CE2 4.03Å; K725-F814 HydrophobicContact CD-CE2 4.28Å; K725-F814 HydrophobicContact CG-CD2 4.44Å; K725-F814 HydrophobicContact CG-CE2 3.83Å; K725-Y834 WeakPolarHBondContact CA-O 3.36Å
726	L	78.2	Confident	65	Low	6 Å²	6	67 Å²	67	3%	0.031	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	154.7	-178.4	-62	179.6	0	0	0	111.5	E724 I776 L779 V833 Y834 L835 A836	E724-L726 HydrophobicContact CG-CD2 4.17Å; E724-L726 HydrophobicContact CG-CG 4.25Å; L726-I776 HydrophobicContact CD1-CG2 4.33Å; L726-L779 HydrophobicContact CD1-CD2 4.4Å; L726-L779 HydrophobicContact CD1-CG 4.41Å; L726-V833 HydrophobicContact CD1-CG1 3.85Å; L726-V833 HydrophobicContact CG-CG1 4.24Å; L726-Y834 PolarHBondContact N-O 3.23Å; L726-L835 HydrophobicContact CB-CD1 3.77Å; L726-L835 WeakPolarHBondContact O-CA 3.38Å; L726-A836 PolarHBondContact O-N 3.44Å
727	A	79.2	Confident	65.6	Low	11 Å²	11	68.3 Å²	68.3	9%	0.091	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136	169.9	0	0	0	0	0	110.3	L767 L804 L812 A836	A727-L767 HydrophobicContact CB-CD1 3.58Å; A727-L767 HydrophobicContact CB-CG 4.34Å; A727-L804 HydrophobicContact CB-CD1 4.07Å; A727-L812 HydrophobicContact CB-CD1 3.86Å; A727-A836 CarbonylContact C-O 3.6Å; A727-A836 VanDerWaalsContact CA-O 3.3Å; A727-A836 WeakPolarHBondContact CA-O 3.31Å; A727-A836 HydrophobicContact CB-CB 4.22Å
728	A	83.8	Confident	67.1	Low	0 Å²	0	71.1 Å²	71.1	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	159.7	-173.6	0	0	0	0	0	111.6	L764 G765 L767 L779 L835 A836 I837 L838	A728-L764 HydrophobicContact CB-CB 4.4Å; A728-L764 HydrophobicContact CB-CD2 4.1Å; A728-G765 CarbonylContact C-O 3.54Å; A728-G765 VanDerWaalsContact CA-O 3.3Å; A728-G765 WeakPolarHBondContact CA-O 3.48Å; A728-G765 WeakPolarHBondContact CB-O 3.48Å; A728-L767 VanDerWaalsContact C-CD2 3.41Å; A728-L779 HydrophobicContact CB-CD2 3.95Å; A728-L835 HydrophobicContact CB-CD1 3.94Å; A728-A836 PolarHBondContact N-O 3.07Å; A728-I837 WeakPolarHBondContact O-CA 3.31Å; A728-L838 PolarHBondContact O-N 2.79Å
729	C	82.4	Confident	68.4	Low	13 Å²	13	73.1 Å²	73.1	9%	0.088	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	138.1	167.2	59.5	0	0	0	0	111.5	P731 G765 L767 L838	C729-P731 VanDerWaalsContact C-CD 3.5Å; C729-P731 WeakPolarHBondContact O-CD 3.29Å; C729-G765 PolarHBondContact N-O 2.78Å; C729-G765 PolarHBondContact O-N 2.71Å; C729-L767 HydrophobicContact CB-CD2 3.55Å; C729-L838 HydrophobicContact CB-CB 4.24Å
730	A	83.8	Confident	70.1	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	73.8	167	0	0	0	0	0	107.8	F732 L733 L759 I837 L838	A730-F732 HydrophobicContact CB-CE1 4.21Å; A730-F732 HydrophobicContact CB-CE2 4.35Å; A730-F732 HydrophobicContact CB-CZ 3.99Å; A730-F732 PolarHBondContact O-N 2.79Å; A730-L733 HydrophobicContact CB-CB 4.22Å; A730-L733 HydrophobicContact CB-CD1 3.82Å; A730-L733 HydrophobicContact CB-CG 3.87Å; A730-L733 PolarHBondContact O-N 2.83Å; A730-L759 HydrophobicContact CB-CD2 3.38Å; A730-I837 HydrophobicContact CB-CG2 3.66Å; A730-L838 CarbonylContact C-O 3.5Å; A730-L838 PolarHBondContact N-O 3.42Å
731	P	75.3	Confident	72	Confident	44 Å²	44	58.6 Å²	58.6	29%	0.286	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.6	-171.9	24.6	-34.8	0	0	0	113	C729 I841	C729-P731 VanDerWaalsContact C-CD 3.5Å; C729-P731 WeakPolarHBondContact O-CD 3.29Å; P731-I841 HydrophobicContact CB-CB 4.38Å; P731-I841 HydrophobicContact CB-CD1 3.59Å; P731-I841 HydrophobicContact CB-CG1 3.65Å; P731-I841 HydrophobicContact CB-CG2 3.87Å
732	F	78.9	Confident	73.3	Confident	18 Å²	18	59.1 Å²	59.1	8%	0.079	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-10.2	176.1	55.3	-91.4	0	0	0	114.8	A730 C743 L744 S745 L759 H762 G763	A730-F732 HydrophobicContact CB-CE1 4.21Å; A730-F732 HydrophobicContact CB-CE2 4.35Å; A730-F732 HydrophobicContact CB-CZ 3.99Å; A730-F732 PolarHBondContact O-N 2.79Å; F732-C743 CarbonylContact O-C 3.53Å; F732-C743 WeakPolarHBondContact O-CA 3.46Å; F732-L744 WeakPolarHBondContact O-CB 3.47Å; F732-L744 WeakPolarHBondContact O-CG 3.44Å; F732-L744 PolarHBondContact O-N 3.2Å; F732-S745 WeakPolarHBondContact CB-OG 3.24Å; F732-L759 HydrophobicContact CE2-CD2 4Å; F732-L759 HydrophobicContact CZ-CD2 3.84Å; F732-H762 HydrophobicContact CD1-CB 4.4Å; F732-H762 HydrophobicContact CD2-CB 4.06Å; F732-H762 HydrophobicContact CE1-CB 3.97Å; F732-H762 HydrophobicContact CE2-CB 3.56Å; F732-H762 HydrophobicContact CG-CB 4.46Å; F732-H762 HydrophobicContact CZ-CB 3.51Å; F732-G763 VanDerWaalsContact CE1-O 3.25Å; F732-G763 WeakPolarHBondContact CE1-O 3.27Å
733	L	79.3	Confident	74.6	Confident	6 Å²	6	52.6 Å²	52.6	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	139	177.4	-68.5	-173.3	0	0	0	112	A730 V741 C743 L755 L759 A839 G840	A730-L733 HydrophobicContact CB-CB 4.22Å; A730-L733 HydrophobicContact CB-CD1 3.82Å; A730-L733 HydrophobicContact CB-CG 3.87Å; A730-L733 PolarHBondContact O-N 2.83Å; L733-V741 HydrophobicContact CB-CG1 3.93Å; L733-V741 HydrophobicContact CD1-CG1 4.09Å; L733-V741 HydrophobicContact CD2-CG1 3.88Å; L733-V741 HydrophobicContact CG-CG1 4.18Å; L733-C743 HydrophobicContact CD2-CB 4.06Å; L733-L755 HydrophobicContact CD1-CD1 3.95Å; L733-L759 HydrophobicContact CD1-CD1 4.31Å; L733-L759 HydrophobicContact CD1-CD2 3.37Å; L733-L759 HydrophobicContact CD1-CG 3.9Å; L733-L759 HydrophobicContact CG-CD2 4.09Å; L733-A839 HydrophobicContact CB-CB 4.12Å; L733-G840 VanDerWaalsContact O-CA 3.24Å; L733-G840 WeakPolarHBondContact O-CA 3.11Å; L733-G840 PolarHBondContact O-N 2.89Å
734	K	79.4	Confident	75.2	Confident	47 Å²	47	53.9 Å²	53.9	20%	0.204	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120.4	166.2	172.9	172.6	169.9	174.1	0	109.4	D98 V741 R742 L744	D98-K734 IonicContact OD1-NZ 3.8Å; D98-K734 PolarHBondContact OD1-NZ 3.11Å; D98-K734 WeakPolarHBondContact OD2-CD 3.33Å; D98-K734 IonicContact OD2-NZ 2.74Å; D98-K734 PolarHBondContact OD2-NZ 3.36Å; K734-V741 WeakPolarHBondContact O-CG1 3.35Å; K734-R742 PolarHBondContact N-O 3.1Å; K734-R742 PolarHBondContact O-N 3.45Å; K734-L744 HydrophobicContact CB-CD2 4.17Å; K734-L744 HydrophobicContact CB-CG 4.37Å
735	W	73.8	Confident	75.2	Confident	108 Å²	108	55.8 Å²	55.8	41%	0.409	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	140	178.5	-144.6	81.2	0	0	0	111.3	F819	W735-F819 AromaticContact CE2-CZ 3.97Å; W735-F819 HydrophobicContact CZ2-CE2 4.29Å; W735-F819 AromaticContact CZ2-CZ 3.77Å; W735-F819 HydrophobicContact CZ2-CZ 3.77Å; W735-F819 AromaticContact NE1-CE2 3.48Å; W735-F819 AromaticContact NE1-CZ 3.53Å
736	M	72.1	Confident	75.3	Confident	69 Å²	69	54.3 Å²	54.3	34%	0.34	26%	0.26	S	S	.	.			trans	-111.3	152.3	175.8	-60.4	-71.4	-67.2	0	0	110	E738 T740	M736-E738 PolarHBondContact O-N 3.28Å; M736-T740 VanDerWaalsContact CB-O 3.29Å; M736-T740 WeakPolarHBondContact CB-O 3.26Å; M736-T740 PolarHBondContact N-O 3.03Å
737	R	58.3	Low	75.2	Confident	246 Å²	246	59.6 Å²	59.6	93%	0.928	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	3.8	-175.2	-77.5	-177.8	-81.1	152	-5.9	116.3
738	E	58.7	Low	75.2	Confident	162 Å²	162	62 Å²	62	76%	0.757	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	37.3	-171.3	-64.2	171.8	-175.4	0	0	110.9	M736 T740	M736-E738 PolarHBondContact O-N 3.28Å; E738-T740 PolarHBondContact O-N 3Å
739	K	59.3	Low	74.9	Confident	112 Å²	112	67 Å²	67	49%	0.487	33%	0.325	S	S	.	.	S	Bend	trans	57.5	-12.4	-172.5	-79.3	-171.3	150.2	-145	0	116.8	E752	K739-E752 IonicContact NZ-OE1 2.64Å; K739-E752 IonicContact NZ-OE2 2.62Å; K739-E752 PolarHBondContact NZ-OE2 2.79Å
740	T	67.4	Low	74.8	Confident	48 Å²	48	66.5 Å²	66.5	29%	0.294	32%	0.321	S	S	.	.			trans	-77	144.2	179.3	48.4	0	0	0	0	111.7	M736 E738	M736-T740 VanDerWaalsContact CB-O 3.29Å; M736-T740 WeakPolarHBondContact CB-O 3.26Å; M736-T740 PolarHBondContact N-O 3.03Å; E738-T740 PolarHBondContact O-N 3Å
741	V	78.7	Confident	74.5	Confident	3 Å²	3	68.6 Å²	68.6	2%	0.018	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.6	176.6	-161.7	0	0	0	0	109.2	L733 K734 V750 L755	L733-V741 HydrophobicContact CB-CG1 3.93Å; L733-V741 HydrophobicContact CD1-CG1 4.09Å; L733-V741 HydrophobicContact CD2-CG1 3.88Å; L733-V741 HydrophobicContact CG-CG1 4.18Å; K734-V741 WeakPolarHBondContact O-CG1 3.35Å; V741-V750 PolarHBondContact N-O 2.88Å; V741-V750 VanDerWaalsContact N-O 3.1Å; V741-V750 WeakPolarHBondContact O-CB 3.45Å; V741-V750 PolarHBondContact O-N 3.34Å; V741-L755 HydrophobicContact CB-CD1 4.08Å; V741-L755 HydrophobicContact CG1-CD1 4.42Å; V741-L755 HydrophobicContact CG2-CD1 3.8Å; V741-L755 HydrophobicContact CG2-CD2 4.17Å
742	R	78.9	Confident	74.5	Confident	60 Å²	60	69.8 Å²	69.8	23%	0.226	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.8	171.7	-175.6	176.7	-68.4	-163.5	-0.5	108.9	R94 K734 C748 L749	R94-R742 PolarHBondContact O-NH1 3.44Å; K734-R742 PolarHBondContact N-O 3.1Å; K734-R742 PolarHBondContact O-N 3.45Å; R742-C748 WeakPolarHBondContact CA-O 3.39Å; R742-L749 HydrophobicContact CB-CD2 4Å; R742-L749 HydrophobicContact CG-CD2 4.22Å
743	C	81.4	Confident	74.2	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	127.7	164.8	176.2	0	0	0	0	109.4	F732 L733 S745 C746 K747 C748 H758 H762	F732-C743 CarbonylContact O-C 3.53Å; F732-C743 WeakPolarHBondContact O-CA 3.46Å; L733-C743 HydrophobicContact CD2-CB 4.06Å; C743-S745 PolarHBondContact SG-N 2.78Å; C743-C746 VanDerWaalsContact CB-SG 3.54Å; C743-C746 PolarHBondContact SG-SG 3.4Å; C743-K747 WeakPolarHBondContact O-CA 3.45Å; C743-K747 PolarHBondContact O-N 3.25Å; C743-C748 PolarHBondContact N-O 2.74Å; C743-H758 WeakPolarHBondContact CB-NE2 3.02Å; C743-H762 VanDerWaalsContact SG-CD2 3.6Å
744	L	77.6	Confident	74.1	Confident	56 Å²	56	81.1 Å²	81.1	29%	0.293	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-33.3	179.6	-59.2	176	0	0	0	111.6	F732 K734 K747	F732-L744 WeakPolarHBondContact O-CB 3.47Å; F732-L744 WeakPolarHBondContact O-CG 3.44Å; F732-L744 PolarHBondContact O-N 3.2Å; K734-L744 HydrophobicContact CB-CD2 4.17Å; K734-L744 HydrophobicContact CB-CG 4.37Å; L744-K747 WeakPolarHBondContact O-CG 3.32Å
745	S	75.1	Confident	74.2	Confident	80 Å²	80	79.1 Å²	79.1	56%	0.559	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-54.4	-178.3	-56.8	0	0	0	0	112.7	F732 C743	F732-S745 WeakPolarHBondContact CB-OG 3.24Å; C743-S745 PolarHBondContact SG-N 2.78Å
746	C	79.4	Confident	74.6	Confident	51 Å²	51	74 Å²	74	35%	0.345	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-10.8	179.3	64.7	0	0	0	0	114	C743 C748 H758 H762	C743-C746 VanDerWaalsContact CB-SG 3.54Å; C743-C746 PolarHBondContact SG-SG 3.4Å; C746-C748 PolarHBondContact O-N 3.24Å; C746-C748 VanDerWaalsContact SG-CB 3.59Å; C746-C748 VanDerWaalsContact SG-SG 3.63Å; C746-H758 PolarHBondContact SG-CE1 3.43Å; C746-H758 PolarHBondContact SG-NE2 3.1Å; C746-H758 VanDerWaalsContact SG-NE2 3.37Å; C746-H762 PolarHBondContact SG-NE2 2.93Å
747	K	76.9	Confident	75	Confident	118 Å²	118	75.4 Å²	75.4	51%	0.513	37%	0.368	S	S	.	.			trans	63.9	16.7	-177.2	-50.3	-162.3	178.5	-157.8	0	114.4	E99 C743 L744	E99-K747 IonicContact OE1-NZ 3.53Å; C743-K747 WeakPolarHBondContact O-CA 3.45Å; C743-K747 PolarHBondContact O-N 3.25Å; L744-K747 WeakPolarHBondContact O-CG 3.32Å
748	C	78.1	Confident	76.1	Confident	61 Å²	61	65.1 Å²	65.1	41%	0.412	33%	0.331	S	S	.	.			trans	-72.5	150.5	171.3	-65.1	0	0	0	0	112.3	R742 C743 C746	R742-C748 WeakPolarHBondContact CA-O 3.39Å; C743-C748 PolarHBondContact N-O 2.74Å; C746-C748 PolarHBondContact O-N 3.24Å; C746-C748 VanDerWaalsContact SG-CB 3.59Å; C746-C748 VanDerWaalsContact SG-SG 3.63Å
749	L	78.9	Confident	77.4	Confident	105 Å²	105	57.4 Å²	57.4	55%	0.55	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	136.6	158.1	-62.7	176.2	0	0	0	107.5	R742	R742-L749 HydrophobicContact CB-CD2 4Å; R742-L749 HydrophobicContact CG-CD2 4.22Å
750	V	79.9	Confident	78.5	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.018	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	133.5	-172.1	-166.4	0	0	0	0	108.3	V741 E754 L755 H758	V741-V750 PolarHBondContact N-O 2.88Å; V741-V750 VanDerWaalsContact N-O 3.1Å; V741-V750 WeakPolarHBondContact O-CB 3.45Å; V741-V750 PolarHBondContact O-N 3.34Å; V750-E754 HydrophobicContact CG1-CB 4Å; V750-L755 HydrophobicContact CG1-CB 4.48Å; V750-L755 HydrophobicContact CG1-CD1 4.41Å; V750-H758 HydrophobicContact CG1-CB 3.63Å; V750-H758 HydrophobicContact CG2-CB 4.29Å
751	S	77.3	Confident	79.2	Confident	44 Å²	44	57.5 Å²	57.5	31%	0.308	30%	0.296	S	S	.	.			trans	-81.2	167.9	175.1	64.1	0	0	0	0	111.7	E753 E754 L755	S751-E753 VanDerWaalsContact C-N 3.28Å; S751-E753 PolarHBondContact O-N 2.54Å; S751-E754 PolarHBondContact O-N 3.35Å; S751-E754 WeakPolarHBondContact OG-CB 3.49Å; S751-E754 WeakPolarHBondContact OG-CG 3.22Å; S751-E754 PolarHBondContact OG-N 3.18Å; S751-L755 WeakPolarHBondContact O-CB 3.31Å; S751-L755 PolarHBondContact O-N 3.38Å
752	E	74.4	Confident	79.3	Confident	69 Å²	69	60.5 Å²	60.5	32%	0.322	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-41.6	172.4	176.5	162.9	172.6	0	0	112	K739 F819	K739-E752 IonicContact NZ-OE1 2.64Å; K739-E752 IonicContact NZ-OE2 2.62Å; K739-E752 PolarHBondContact NZ-OE2 2.79Å; E752-F819 HydrophobicContact CB-CD1 4.23Å; E752-F819 HydrophobicContact CB-CE1 4.19Å; E752-F819 HydrophobicContact CG-CD1 3.49Å; E752-F819 VanDerWaalsContact CG-CD1 3.49Å; E752-F819 HydrophobicContact CG-CE1 3.92Å; E752-F819 HydrophobicContact CG-CG 4.39Å
753	E	73.3	Confident	79.4	Confident	156 Å²	156	57.8 Å²	57.8	73%	0.729	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-43.5	178.2	-65.2	166	-145.1	0	0	112.8	S751 L755	S751-E753 VanDerWaalsContact C-N 3.28Å; S751-E753 PolarHBondContact O-N 2.54Å; E753-L755 VanDerWaalsContact C-N 3.34Å
754	E	77.1	Confident	79.7	Confident	105 Å²	105	57.8 Å²	57.8	49%	0.491	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-9.5	-177	-66.2	-178.6	171.1	0	0	113	V750 S751 I756 H757 H758	V750-E754 HydrophobicContact CG1-CB 4Å; S751-E754 PolarHBondContact O-N 3.35Å; S751-E754 WeakPolarHBondContact OG-CB 3.49Å; S751-E754 WeakPolarHBondContact OG-CG 3.22Å; S751-E754 PolarHBondContact OG-N 3.18Å; E754-I756 PolarHBondContact O-N 2.64Å; E754-H757 PolarHBondContact O-N 3.49Å; E754-H758 VanDerWaalsContact O-CB 3.3Å; E754-H758 WeakPolarHBondContact O-CB 3.47Å; E754-H758 PolarHBondContact O-N 3.09Å
755	L	80.8	Confident	79.9	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-57.2	-50.3	-168.5	-176.6	57	0	0	0	114.1	L733 V741 V750 S751 E753 H758 L759 F819	L733-L755 HydrophobicContact CD1-CD1 3.95Å; V741-L755 HydrophobicContact CB-CD1 4.08Å; V741-L755 HydrophobicContact CG1-CD1 4.42Å; V741-L755 HydrophobicContact CG2-CD1 3.8Å; V741-L755 HydrophobicContact CG2-CD2 4.17Å; V750-L755 HydrophobicContact CG1-CB 4.48Å; V750-L755 HydrophobicContact CG1-CD1 4.41Å; S751-L755 WeakPolarHBondContact O-CB 3.31Å; S751-L755 PolarHBondContact O-N 3.38Å; E753-L755 VanDerWaalsContact C-N 3.34Å; L755-H758 PolarHBondContact O-N 3.43Å; L755-L759 HydrophobicContact CD1-CD1 4.23Å; L755-L759 HydrophobicContact CD1-CG 4.48Å; L755-L759 HydrophobicContact CG-CD1 4.07Å; L755-L759 WeakPolarHBondContact O-CB 3.44Å; L755-L759 WeakPolarHBondContact O-CD1 3.49Å; L755-L759 VanDerWaalsContact O-CG 3.3Å; L755-L759 WeakPolarHBondContact O-CG 3.07Å; L755-L759 PolarHBondContact O-N 3.16Å; L755-F819 HydrophobicContact CD2-CD2 3.88Å; L755-F819 HydrophobicContact CD2-CE2 3.89Å
756	I	82.8	Confident	80.3	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-70.4	-39	-179.8	-74.3	-71.6	0	0	0	111.4	E754 H758 L759 L760 I776 T821 L823 L835 V851 V853	E754-I756 PolarHBondContact O-N 2.64Å; I756-H758 VanDerWaalsContact C-N 3.3Å; I756-H758 PolarHBondContact O-N 2.81Å; I756-L759 HydrophobicContact CD1-CD1 3.87Å; I756-L759 WeakPolarHBondContact O-CB 3.29Å; I756-L759 PolarHBondContact O-N 3.23Å; I756-L760 HydrophobicContact CG2-CD1 3.97Å; I756-L760 HydrophobicContact CG2-CG 4.37Å; I756-L760 WeakPolarHBondContact O-CB 3.18Å; I756-L760 VanDerWaalsContact O-CG 3.26Å; I756-L760 WeakPolarHBondContact O-CG 3.2Å; I756-L760 PolarHBondContact O-N 3.45Å; I756-I776 HydrophobicContact CG2-CD1 4.11Å; I756-T821 HydrophobicContact CB-CG2 3.91Å; I756-T821 HydrophobicContact CG1-CG2 3.61Å; I756-T821 HydrophobicContact CG2-CG2 4.47Å; I756-L823 HydrophobicContact CG2-CD1 4.15Å; I756-L823 HydrophobicContact CG2-CD2 4.34Å; I756-L835 HydrophobicContact CD1-CD2 4.21Å; I756-V851 HydrophobicContact CD1-CG1 4.13Å; I756-V851 HydrophobicContact CG1-CG1 4.1Å; I756-V853 HydrophobicContact CD1-CG2 4.03Å; I756-V853 HydrophobicContact CG1-CG2 4.16Å
757	H	80.3	Confident	80.2	Confident	97 Å²	97	49.7 Å²	49.7	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-59.6	-43.4	172.8	-77.4	-90	0	0	0	111.3	E754 L760 M761	E754-H757 PolarHBondContact O-N 3.49Å; H757-L760 PolarHBondContact O-N 3.48Å; H757-M761 VanDerWaalsContact O-CG 3.29Å; H757-M761 WeakPolarHBondContact O-CG 3.45Å; H757-M761 PolarHBondContact O-N 2.81Å
758	H	82.8	Confident	80	Confident	30 Å²	30	46.7 Å²	46.7	14%	0.139	24%	0.236	C	C	.	.	H	α-helix	trans	-66.5	-38.1	178.8	-163.4	86.9	0	0	0	113.4	C743 C746 V750 E754 L755 I756 M761 H762	C743-H758 WeakPolarHBondContact CB-NE2 3.02Å; C746-H758 PolarHBondContact SG-CE1 3.43Å; C746-H758 PolarHBondContact SG-NE2 3.1Å; C746-H758 VanDerWaalsContact SG-NE2 3.37Å; V750-H758 HydrophobicContact CG1-CB 3.63Å; V750-H758 HydrophobicContact CG2-CB 4.29Å; E754-H758 VanDerWaalsContact O-CB 3.3Å; E754-H758 WeakPolarHBondContact O-CB 3.47Å; E754-H758 PolarHBondContact O-N 3.09Å; L755-H758 PolarHBondContact O-N 3.43Å; I756-H758 VanDerWaalsContact C-N 3.3Å; I756-H758 PolarHBondContact O-N 2.81Å; H758-M761 PolarHBondContact O-N 3.45Å; H758-H762 AromaticContact CD2-CD2 3.72Å; H758-H762 AromaticContact CE1-CD2 3.98Å; H758-H762 AromaticContact CE1-NE2 3.91Å; H758-H762 AromaticContact NE2-CD2 3.35Å; H758-H762 PolarHBondContact NE2-CD2 3.48Å; H758-H762 AromaticContact NE2-NE2 3.55Å; H758-H762 PolarHBondContact O-N 2.86Å
759	L	84	Confident	79.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.4	-46.5	172.6	-82.8	163.4	0	0	0	111.7	A730 F732 L733 L755 I756 H762 G763 L764 I837	A730-L759 HydrophobicContact CB-CD2 3.38Å; F732-L759 HydrophobicContact CE2-CD2 4Å; F732-L759 HydrophobicContact CZ-CD2 3.84Å; L733-L759 HydrophobicContact CD1-CD1 4.31Å; L733-L759 HydrophobicContact CD1-CD2 3.37Å; L733-L759 HydrophobicContact CD1-CG 3.9Å; L733-L759 HydrophobicContact CG-CD2 4.09Å; L755-L759 HydrophobicContact CD1-CD1 4.23Å; L755-L759 HydrophobicContact CD1-CG 4.48Å; L755-L759 HydrophobicContact CG-CD1 4.07Å; L755-L759 WeakPolarHBondContact O-CB 3.44Å; L755-L759 WeakPolarHBondContact O-CD1 3.49Å; L755-L759 VanDerWaalsContact O-CG 3.3Å; L755-L759 WeakPolarHBondContact O-CG 3.07Å; L755-L759 PolarHBondContact O-N 3.16Å; I756-L759 HydrophobicContact CD1-CD1 3.87Å; I756-L759 WeakPolarHBondContact O-CB 3.29Å; I756-L759 PolarHBondContact O-N 3.23Å; L759-H762 CarbonylContact O-C 3.55Å; L759-H762 PolarHBondContact O-N 2.92Å; L759-G763 PolarHBondContact O-N 2.85Å; L759-L764 HydrophobicContact CB-CD2 4.22Å; L759-L764 HydrophobicContact CB-CG 4.4Å; L759-L764 HydrophobicContact CD1-CD2 4.45Å; L759-L764 HydrophobicContact CD2-CD2 3.78Å; L759-L764 HydrophobicContact CG-CD2 4.39Å; L759-I837 HydrophobicContact CD1-CD1 3.51Å
760	L	83.8	Confident	79.9	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.052	24%	0.242	C	C	.	.	H	α-helix	trans	-68.5	-33.2	179.6	-65.8	178.6	0	0	0	112.3	I756 H757 H762 L764 H774 I776 L823	I756-L760 HydrophobicContact CG2-CD1 3.97Å; I756-L760 HydrophobicContact CG2-CG 4.37Å; I756-L760 WeakPolarHBondContact O-CB 3.18Å; I756-L760 VanDerWaalsContact O-CG 3.26Å; I756-L760 WeakPolarHBondContact O-CG 3.2Å; I756-L760 PolarHBondContact O-N 3.45Å; H757-L760 PolarHBondContact O-N 3.48Å; L760-H762 VanDerWaalsContact C-N 3.26Å; L760-H762 PolarHBondContact O-N 3.28Å; L760-L764 HydrophobicContact CD2-CD1 3.8Å; L760-L764 HydrophobicContact CD2-CG 4.48Å; L760-H774 WeakPolarHBondContact CB-O 3.37Å; L760-H774 PolarHBondContact O-CD2 2.88Å; L760-I776 HydrophobicContact CD1-CG1 4.24Å; L760-I776 HydrophobicContact CD2-CG1 3.84Å; L760-L823 HydrophobicContact CD1-CD1 4.31Å; L760-L823 HydrophobicContact CD1-CD2 3.95Å
761	M	81.9	Confident	79.9	Confident	152 Å²	152	49.2 Å²	49.2	75%	0.749	26%	0.259	S	S	*	.	H	α-helix	trans	-68	-19.1	172	-71.1	-58.6	-57.9	0	0	114.4	H757 H758	H757-M761 VanDerWaalsContact O-CG 3.29Å; H757-M761 WeakPolarHBondContact O-CG 3.45Å; H757-M761 PolarHBondContact O-N 2.81Å; H758-M761 PolarHBondContact O-N 3.45Å
762	H	79.6	Confident	80.3	Confident	67 Å²	67	51.3 Å²	51.3	31%	0.31	27%	0.27	S	S	.	.	H	α-helix	trans	-110.6	-6.5	177.5	-80.9	-56	0	0	0	114.4	F732 C743 C746 H758 L759 L760	F732-H762 HydrophobicContact CD1-CB 4.4Å; F732-H762 HydrophobicContact CD2-CB 4.06Å; F732-H762 HydrophobicContact CE1-CB 3.97Å; F732-H762 HydrophobicContact CE2-CB 3.56Å; F732-H762 HydrophobicContact CG-CB 4.46Å; F732-H762 HydrophobicContact CZ-CB 3.51Å; C743-H762 VanDerWaalsContact SG-CD2 3.6Å; C746-H762 PolarHBondContact SG-NE2 2.93Å; H758-H762 AromaticContact CD2-CD2 3.72Å; H758-H762 AromaticContact CE1-CD2 3.98Å; H758-H762 AromaticContact CE1-NE2 3.91Å; H758-H762 AromaticContact NE2-CD2 3.35Å; H758-H762 PolarHBondContact NE2-CD2 3.48Å; H758-H762 AromaticContact NE2-NE2 3.55Å; H758-H762 PolarHBondContact O-N 2.86Å; L759-H762 CarbonylContact O-C 3.55Å; L759-H762 PolarHBondContact O-N 2.92Å; L760-H762 VanDerWaalsContact C-N 3.26Å; L760-H762 PolarHBondContact O-N 3.28Å
763	G	82.9	Confident	80.8	Confident	3 Å²	3	49.8 Å²	49.8	3%	0.031	26%	0.263	C	S	.	.			trans	83.4	124	-179.6	0	0	0	0	0	113.6	F732 L759 F773	F732-G763 VanDerWaalsContact CE1-O 3.25Å; F732-G763 WeakPolarHBondContact CE1-O 3.27Å; L759-G763 PolarHBondContact O-N 2.85Å; G763-F773 CarbonylContact C-O 3.54Å; G763-F773 WeakPolarHBondContact CA-O 3.47Å
764	L	86.3	Confident	81.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.3	168.9	-74.9	165.8	0	0	0	109.9	A728 L759 L760 T772 F773 I776 L779 L835	A728-L764 HydrophobicContact CB-CB 4.4Å; A728-L764 HydrophobicContact CB-CD2 4.1Å; L759-L764 HydrophobicContact CB-CD2 4.22Å; L759-L764 HydrophobicContact CB-CG 4.4Å; L759-L764 HydrophobicContact CD1-CD2 4.45Å; L759-L764 HydrophobicContact CD2-CD2 3.78Å; L759-L764 HydrophobicContact CG-CD2 4.39Å; L760-L764 HydrophobicContact CD2-CD1 3.8Å; L760-L764 HydrophobicContact CD2-CG 4.48Å; L764-T772 CarbonylContact O-C 3.59Å; L764-T772 WeakPolarHBondContact O-CA 3.14Å; L764-F773 PolarHBondContact N-O 2.94Å; L764-F773 PolarHBondContact O-N 3.43Å; L764-I776 HydrophobicContact CD1-CG1 4.44Å; L764-L779 HydrophobicContact CB-CD2 4.33Å; L764-L779 HydrophobicContact CD1-CD2 4.37Å; L764-L835 HydrophobicContact CD1-CD2 3.94Å; L764-L835 HydrophobicContact CD2-CD2 4.38Å
765	G	83.1	Confident	81.7	Confident	6 Å²	6	45.2 Å²	45.2	6%	0.062	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	143.9	174.8	0	0	0	0	0	112.4	A728 C729	A728-G765 CarbonylContact C-O 3.54Å; A728-G765 VanDerWaalsContact CA-O 3.3Å; A728-G765 WeakPolarHBondContact CA-O 3.48Å; A728-G765 WeakPolarHBondContact CB-O 3.48Å; C729-G765 PolarHBondContact N-O 2.78Å; C729-G765 PolarHBondContact O-N 2.71Å
766	C	83.6	Confident	81.9	Confident	6 Å²	6	45 Å²	45	4%	0.041	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	146.3	168.4	-171.2	0	0	0	0	110.8	F768 C771 F773	C766-F768 VanDerWaalsContact C-N 3.29Å; C766-F768 PolarHBondContact SG-N 2.83Å; C766-F768 VanDerWaalsContact SG-N 3.39Å; C766-C771 PolarHBondContact N-O 2.89Å; C766-F773 HydrophobicContact CB-CE2 4.38Å
767	L	75.9	Confident	81.9	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.021	27%	0.265	C	S	.	.	S	Bend	trans	-79.4	-9.3	172.2	-65.2	-168.1	0	0	0	114.3	A727 A728 C729 L793 P794 L804 L838	A727-L767 HydrophobicContact CB-CD1 3.58Å; A727-L767 HydrophobicContact CB-CG 4.34Å; A728-L767 VanDerWaalsContact C-CD2 3.41Å; C729-L767 HydrophobicContact CB-CD2 3.55Å; L767-L793 HydrophobicContact CB-CD2 4.11Å; L767-L793 HydrophobicContact CD1-CD2 3.81Å; L767-P794 WeakPolarHBondContact O-CD 3.33Å; L767-P794 VanDerWaalsContact O-CG 3.23Å; L767-P794 WeakPolarHBondContact O-CG 3.38Å; L767-L804 HydrophobicContact CD1-CD1 4.39Å; L767-L838 HydrophobicContact CD1-CD1 4.27Å; L767-L838 HydrophobicContact CD2-CB 4.37Å; L767-L838 HydrophobicContact CD2-CD1 3.85Å; L767-L838 HydrophobicContact CD2-CG 4.43Å
768	F	72.4	Confident	82	Confident	56 Å²	56	47 Å²	47	25%	0.246	26%	0.257	C	S	.	.	S	Bend	trans	-119.6	-4.8	-169.1	-54.3	-76.9	0	0	0	113.8	C766 H787 K790 L793	C766-F768 VanDerWaalsContact C-N 3.29Å; C766-F768 PolarHBondContact SG-N 2.83Å; C766-F768 VanDerWaalsContact SG-N 3.39Å; F768-H787 WeakPolarHBondContact CB-CE1 3.32Å; F768-H787 VanDerWaalsContact CB-ND1 3.3Å; F768-H787 WeakPolarHBondContact CB-ND1 3.33Å; F768-H787 PolarHBondContact O-CE1 3.05Å; F768-H787 VanDerWaalsContact O-CE1 3.28Å; F768-K790 VanDerWaalsContact CE1-O 3.3Å; F768-K790 WeakPolarHBondContact CE1-O 3.19Å; F768-L793 HydrophobicContact CE1-CD2 4.18Å; F768-L793 HydrophobicContact CZ-CD2 4.37Å
769	C	77.6	Confident	82.1	Confident	34 Å²	34	45.7 Å²	45.7	23%	0.23	25%	0.252	C	S	.	.	S	Bend	trans	-159.8	167.8	175.2	78	0	0	0	0	110.5	C771 H782 H787	C769-C771 PolarHBondContact O-N 3.34Å; C769-C771 VanDerWaalsContact O-N 3.15Å; C769-C771 VanDerWaalsContact SG-SG 3.65Å; C769-H782 PolarHBondContact SG-CE1 2.94Å; C769-H782 PolarHBondContact SG-NE2 3.36Å; C769-H787 PolarHBondContact SG-NE2 3.33Å
770	P	78.4	Confident	81.9	Confident	131 Å²	131	46 Å²	46	85%	0.851	25%	0.254	S	S	*	.	S	Bend	trans	-76.7	9.7	-177.5	32.2	-36.7	0	0	0	115.3
771	C	80.1	Confident	81.8	Confident	56 Å²	56	49.2 Å²	49.2	38%	0.378	27%	0.269	S	S	.	.			trans	-77	141.3	-177.9	-62.5	0	0	0	0	112.9	C766 C769 F773	C766-C771 PolarHBondContact N-O 2.89Å; C769-C771 PolarHBondContact O-N 3.34Å; C769-C771 VanDerWaalsContact O-N 3.15Å; C769-C771 VanDerWaalsContact SG-SG 3.65Å; C771-F773 HydrophobicContact CB-CE2 3.51Å; C771-F773 HydrophobicContact CB-CZ 3.52Å
772	T	85.6	Confident	81.9	Confident	88 Å²	88	43.2 Å²	43.2	54%	0.54	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141	178.1	53.5	0	0	0	0	112	L764	L764-T772 CarbonylContact O-C 3.59Å; L764-T772 WeakPolarHBondContact O-CA 3.14Å
773	F	84.8	Confident	81.9	Confident	38 Å²	38	41.5 Å²	41.5	17%	0.167	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	127.7	-169.6	-60.9	-84.3	0	0	0	112	G763 L764 C766 C771 L779 H782	G763-F773 CarbonylContact C-O 3.54Å; G763-F773 WeakPolarHBondContact CA-O 3.47Å; L764-F773 PolarHBondContact N-O 2.94Å; L764-F773 PolarHBondContact O-N 3.43Å; C766-F773 HydrophobicContact CB-CE2 4.38Å; C771-F773 HydrophobicContact CB-CE2 3.51Å; C771-F773 HydrophobicContact CB-CZ 3.52Å; F773-L779 HydrophobicContact CB-CB 4.01Å; F773-L779 HydrophobicContact CD2-CB 4.25Å; F773-L779 HydrophobicContact CD2-CD1 3.67Å; F773-L779 HydrophobicContact CE2-CD1 4.18Å; F773-L779 HydrophobicContact CG-CB 4.08Å; F773-L779 HydrophobicContact CG-CD1 4.35Å; F773-H782 HydrophobicContact CD1-CB 4.49Å; F773-H782 HydrophobicContact CE1-CB 3.62Å; F773-H782 AromaticContact CE1-CG 3.85Å; F773-H782 HydrophobicContact CE2-CB 4.17Å; F773-H782 AromaticContact CE2-CD2 3.48Å; F773-H782 VanDerWaalsContact CE2-CD2 3.48Å; F773-H782 WeakPolarHBondContact CE2-CD2 3.35Å; F773-H782 AromaticContact CE2-CG 3.72Å; F773-H782 AromaticContact CE2-NE2 3.93Å; F773-H782 HydrophobicContact CZ-CB 3.45Å; F773-H782 VanDerWaalsContact CZ-CB 3.45Å; F773-H782 AromaticContact CZ-CD2 3.42Å; F773-H782 VanDerWaalsContact CZ-CD2 3.42Å; F773-H782 WeakPolarHBondContact CZ-CD2 3.3Å; F773-H782 AromaticContact CZ-CE1 3.93Å; F773-H782 AromaticContact CZ-CG 3.14Å; F773-H782 AromaticContact CZ-ND1 3.5Å; F773-H782 WeakPolarHBondContact CZ-ND1 3.42Å; F773-H782 AromaticContact CZ-NE2 3.9Å
774	H	85.5	Confident	81.6	Confident	104 Å²	104	47 Å²	47	48%	0.481	25%	0.254	S	S	.	.	S	Bend	trans	-92.1	2.7	179.4	-55.6	95	0	0	0	113.1	L760	L760-H774 WeakPolarHBondContact CB-O 3.37Å; L760-H774 PolarHBondContact O-CD2 2.88Å
775	D	83.6	Confident	81.1	Confident	61 Å²	61	51.6 Å²	51.6	33%	0.326	28%	0.279	S	S	.	.	S	Bend	trans	-141.3	140.9	176.6	-72.9	-66.7	0	0	0	110.8	G778 L779 K827	D775-G778 PolarHBondContact O-N 3.49Å; D775-L779 PolarHBondContact O-N 3.04Å; D775-K827 WeakPolarHBondContact OD1-CG 3.39Å; D775-K827 IonicContact OD1-NZ 2.71Å; D775-K827 PolarHBondContact OD1-NZ 3.17Å; D775-K827 IonicContact OD2-NZ 3.81Å
776	I	84.2	Confident	80.5	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-68.3	-38.5	-176.6	-56.5	-174.6	0	0	0	110.8	L726 I756 L760 L764 G778 L779 S780 L823 K827 L828 V833 V853	L726-I776 HydrophobicContact CD1-CG2 4.33Å; I756-I776 HydrophobicContact CG2-CD1 4.11Å; L760-I776 HydrophobicContact CD1-CG1 4.24Å; L760-I776 HydrophobicContact CD2-CG1 3.84Å; L764-I776 HydrophobicContact CD1-CG1 4.44Å; I776-G778 VanDerWaalsContact C-N 3.28Å; I776-G778 PolarHBondContact O-N 3.44Å; I776-L779 WeakPolarHBondContact O-CB 3.39Å; I776-L779 PolarHBondContact O-N 3.21Å; I776-L779 VanDerWaalsContact O-N 3.14Å; I776-S780 PolarHBondContact O-N 3.14Å; I776-L823 HydrophobicContact CD1-CD2 3.82Å; I776-L823 HydrophobicContact CG1-CD2 4.24Å; I776-K827 PolarHBondContact N-O 2.9Å; I776-L828 HydrophobicContact CB-CD1 4.09Å; I776-L828 HydrophobicContact CD1-CD1 3.84Å; I776-L828 HydrophobicContact CG1-CD1 4.49Å; I776-L828 HydrophobicContact CG2-CD1 3.95Å; I776-V833 HydrophobicContact CG2-CB 4.39Å; I776-V833 HydrophobicContact CG2-CG1 3.9Å; I776-V833 HydrophobicContact CG2-CG2 4.26Å; I776-V853 HydrophobicContact CD1-CG1 4.23Å; I776-V853 HydrophobicContact CD1-CG2 4.14Å
777	K	82.9	Confident	80	Confident	110 Å²	110	60.8 Å²	60.8	48%	0.478	31%	0.312	S	S	.	.	H	α-helix	trans	-55.3	-42	172.8	-176.3	179.7	176.5	-177.8	0	112.4	L779 S780 E781 K827	K777-L779 PolarHBondContact O-N 3.14Å; K777-S780 WeakPolarHBondContact O-CB 3.39Å; K777-S780 PolarHBondContact O-N 3.06Å; K777-E781 WeakPolarHBondContact O-CB 3.36Å; K777-E781 PolarHBondContact O-N 3.2Å; K777-K827 PolarHBondContact N-O 2.84Å
778	G	82.8	Confident	79	Confident	29 Å²	29	67.4 Å²	67.4	30%	0.299	35%	0.346	S	S	.	.	H	α-helix	trans	-64.7	-38.8	177.5	0	0	0	0	0	112.9	D775 I776 H782	D775-G778 PolarHBondContact O-N 3.49Å; I776-G778 VanDerWaalsContact C-N 3.28Å; I776-G778 PolarHBondContact O-N 3.44Å; G778-H782 WeakPolarHBondContact O-CB 3.21Å; G778-H782 PolarHBondContact O-N 3.47Å
779	L	83.9	Confident	78.3	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.016	36%	0.364	C	S	.	.	H	α-helix	trans	-67.5	-42.3	174.4	178	67.4	0	0	0	112.4	L726 A728 L764 F773 D775 I776 K777 S783 L835	L726-L779 HydrophobicContact CD1-CD2 4.4Å; L726-L779 HydrophobicContact CD1-CG 4.41Å; A728-L779 HydrophobicContact CB-CD2 3.95Å; L764-L779 HydrophobicContact CB-CD2 4.33Å; L764-L779 HydrophobicContact CD1-CD2 4.37Å; F773-L779 HydrophobicContact CB-CB 4.01Å; F773-L779 HydrophobicContact CD2-CB 4.25Å; F773-L779 HydrophobicContact CD2-CD1 3.67Å; F773-L779 HydrophobicContact CE2-CD1 4.18Å; F773-L779 HydrophobicContact CG-CB 4.08Å; F773-L779 HydrophobicContact CG-CD1 4.35Å; D775-L779 PolarHBondContact O-N 3.04Å; I776-L779 WeakPolarHBondContact O-CB 3.39Å; I776-L779 PolarHBondContact O-N 3.21Å; I776-L779 VanDerWaalsContact O-N 3.14Å; K777-L779 PolarHBondContact O-N 3.14Å; L779-S783 VanDerWaalsContact O-CB 3.23Å; L779-S783 WeakPolarHBondContact O-CB 3.21Å; L779-S783 PolarHBondContact O-N 2.88Å; L779-L835 HydrophobicContact CD2-CD1 4.15Å
780	S	80.4	Confident	77.1	Confident	8 Å²	8	72.8 Å²	72.8	6%	0.056	38%	0.382	C	S	.	.	H	α-helix	trans	-53.5	-58.2	171.9	155.1	0	0	0	0	110.7	E724 I776 K777 H782 S783 R784	E724-S780 WeakPolarHBondContact OE1-CA 3.47Å; E724-S780 WeakPolarHBondContact OE1-CB 3.47Å; E724-S780 PolarHBondContact OE1-OG 3.11Å; E724-S780 PolarHBondContact OE2-OG 3.47Å; I776-S780 PolarHBondContact O-N 3.14Å; K777-S780 WeakPolarHBondContact O-CB 3.39Å; K777-S780 PolarHBondContact O-N 3.06Å; S780-H782 VanDerWaalsContact C-N 3.33Å; S780-H782 PolarHBondContact O-N 3.26Å; S780-S783 WeakPolarHBondContact O-CB 3.36Å; S780-S783 PolarHBondContact O-N 3.29Å; S780-S783 VanDerWaalsContact O-N 3.13Å; S780-R784 VanDerWaalsContact O-CB 3.3Å; S780-R784 WeakPolarHBondContact O-CB 3.42Å; S780-R784 PolarHBondContact O-N 3.28Å; S780-R784 PolarHBondContact OG-NH2 2.76Å
781	E	82.7	Confident	76	Confident	77 Å²	77	72.8 Å²	72.8	36%	0.36	37%	0.369	S	S	.	.	H	α-helix	trans	-63.9	-40.5	-174	-161.9	127.8	-96.8	0	0	111.7	K777 R784 N785	K777-E781 WeakPolarHBondContact O-CB 3.36Å; K777-E781 PolarHBondContact O-N 3.2Å; E781-R784 IonicContact OE1-CZ 3.74Å; E781-R784 IonicContact OE1-NH1 3.96Å; E781-R784 PolarHBondContact OE1-NH1 3.43Å; E781-R784 IonicContact OE1-NH2 2.76Å; E781-R784 PolarHBondContact OE1-NH2 2.88Å; E781-N785 WeakPolarHBondContact O-CB 3.3Å; E781-N785 PolarHBondContact O-N 3.11Å; E781-N785 PolarHBondContact O-ND2 2.84Å
782	H	84.3	Confident	74.5	Confident	25 Å²	25	79 Å²	79	12%	0.116	39%	0.39	C	S	.	.	H	α-helix	trans	-62.4	-47.9	171.5	168.3	78.6	0	0	0	112.8	C769 F773 G778 S780 R784 N785 R786 H787	C769-H782 PolarHBondContact SG-CE1 2.94Å; C769-H782 PolarHBondContact SG-NE2 3.36Å; F773-H782 HydrophobicContact CD1-CB 4.49Å; F773-H782 HydrophobicContact CE1-CB 3.62Å; F773-H782 AromaticContact CE1-CG 3.85Å; F773-H782 HydrophobicContact CE2-CB 4.17Å; F773-H782 AromaticContact CE2-CD2 3.48Å; F773-H782 VanDerWaalsContact CE2-CD2 3.48Å; F773-H782 WeakPolarHBondContact CE2-CD2 3.35Å; F773-H782 AromaticContact CE2-CG 3.72Å; F773-H782 AromaticContact CE2-NE2 3.93Å; F773-H782 HydrophobicContact CZ-CB 3.45Å; F773-H782 VanDerWaalsContact CZ-CB 3.45Å; F773-H782 AromaticContact CZ-CD2 3.42Å; F773-H782 VanDerWaalsContact CZ-CD2 3.42Å; F773-H782 WeakPolarHBondContact CZ-CD2 3.3Å; F773-H782 AromaticContact CZ-CE1 3.93Å; F773-H782 AromaticContact CZ-CG 3.14Å; F773-H782 AromaticContact CZ-ND1 3.5Å; F773-H782 WeakPolarHBondContact CZ-ND1 3.42Å; F773-H782 AromaticContact CZ-NE2 3.9Å; G778-H782 WeakPolarHBondContact O-CB 3.21Å; G778-H782 PolarHBondContact O-N 3.47Å; S780-H782 VanDerWaalsContact C-N 3.33Å; S780-H782 PolarHBondContact O-N 3.26Å; H782-R784 PolarHBondContact O-N 3.23Å; H782-N785 PolarHBondContact O-N 3.49Å; H782-R786 VanDerWaalsContact O-CB 3.28Å; H782-R786 WeakPolarHBondContact O-CB 3.43Å; H782-R786 PolarHBondContact O-N 2.88Å; H782-H787 AromaticContact CE1-NE2 3.81Å; H782-H787 AromaticContact NE2-CD2 3.51Å; H782-H787 AromaticContact NE2-NE2 3.37Å; H782-H787 PolarHBondContact NE2-NE2 3.41Å
783	S	78.1	Confident	73.1	Confident	32 Å²	32	76 Å²	76	22%	0.224	37%	0.37	C	S	.	.	I	π-helix	trans	-59.1	-48.9	179.5	-174.9	0	0	0	0	111	L779 S780 H787 L788	L779-S783 VanDerWaalsContact O-CB 3.23Å; L779-S783 WeakPolarHBondContact O-CB 3.21Å; L779-S783 PolarHBondContact O-N 2.88Å; S780-S783 WeakPolarHBondContact O-CB 3.36Å; S780-S783 PolarHBondContact O-N 3.29Å; S780-S783 VanDerWaalsContact O-N 3.13Å; S783-H787 CarbonylContact O-C 3.59Å; S783-H787 WeakPolarHBondContact O-CA 3.5Å; S783-H787 VanDerWaalsContact O-CB 3.31Å; S783-H787 WeakPolarHBondContact O-CB 3.37Å; S783-H787 PolarHBondContact O-N 3.41Å; S783-L788 PolarHBondContact O-N 3Å
784	R	76.6	Confident	71.6	Confident	117 Å²	117	76.3 Å²	76.3	44%	0.442	38%	0.376	S	S	.	.	I	π-helix	trans	-58.1	-50.3	175.9	177.9	157.5	38.4	92.9	2.1	111.8	S780 E781 H782 L788	S780-R784 VanDerWaalsContact O-CB 3.3Å; S780-R784 WeakPolarHBondContact O-CB 3.42Å; S780-R784 PolarHBondContact O-N 3.28Å; S780-R784 PolarHBondContact OG-NH2 2.76Å; E781-R784 IonicContact OE1-CZ 3.74Å; E781-R784 IonicContact OE1-NH1 3.96Å; E781-R784 PolarHBondContact OE1-NH1 3.43Å; E781-R784 IonicContact OE1-NH2 2.76Å; E781-R784 PolarHBondContact OE1-NH2 2.88Å; H782-R784 PolarHBondContact O-N 3.23Å; R784-L788 WeakPolarHBondContact O-CD2 3.3Å
785	N	76.6	Confident	69.7	Low	98 Å²	98	78.6 Å²	78.6	52%	0.524	39%	0.389	S	S	.	.	I	π-helix	trans	-86.7	-26.6	-170.9	-61.4	-10.7	0	0	0	114.9	E781 H782	E781-N785 WeakPolarHBondContact O-CB 3.3Å; E781-N785 PolarHBondContact O-N 3.11Å; E781-N785 PolarHBondContact O-ND2 2.84Å; H782-N785 PolarHBondContact O-N 3.49Å
786	R	70.7	Confident	68.2	Low	187 Å²	187	80.8 Å²	80.8	71%	0.706	40%	0.401	S	S	*	.	I	π-helix	trans	-104.5	-26.3	-179.4	-65.8	-59.9	-143.8	-175.1	6.8	113.8	H782	H782-R786 VanDerWaalsContact O-CB 3.28Å; H782-R786 WeakPolarHBondContact O-CB 3.43Å; H782-R786 PolarHBondContact O-N 2.88Å
787	H	72.3	Confident	66.9	Low	18 Å²	18	82.9 Å²	82.9	8%	0.083	41%	0.409	C	S	.	.	I	π-helix	trans	-112.7	-12.7	-173.1	-66.6	-66.9	0	0	0	115.1	F768 C769 H782 S783 G789 K790	F768-H787 WeakPolarHBondContact CB-CE1 3.32Å; F768-H787 VanDerWaalsContact CB-ND1 3.3Å; F768-H787 WeakPolarHBondContact CB-ND1 3.33Å; F768-H787 PolarHBondContact O-CE1 3.05Å; F768-H787 VanDerWaalsContact O-CE1 3.28Å; C769-H787 PolarHBondContact SG-NE2 3.33Å; H782-H787 AromaticContact CE1-NE2 3.81Å; H782-H787 AromaticContact NE2-CD2 3.51Å; H782-H787 AromaticContact NE2-NE2 3.37Å; H782-H787 PolarHBondContact NE2-NE2 3.41Å; S783-H787 CarbonylContact O-C 3.59Å; S783-H787 WeakPolarHBondContact O-CA 3.5Å; S783-H787 VanDerWaalsContact O-CB 3.31Å; S783-H787 WeakPolarHBondContact O-CB 3.37Å; S783-H787 PolarHBondContact O-N 3.41Å; H787-G789 VanDerWaalsContact C-N 3.29Å; H787-G789 PolarHBondContact O-N 3.45Å; H787-K790 VanDerWaalsContact O-CB 3.26Å; H787-K790 WeakPolarHBondContact O-CB 3.48Å; H787-K790 VanDerWaalsContact O-CG 3.27Å; H787-K790 WeakPolarHBondContact O-CG 3.35Å; H787-K790 PolarHBondContact O-N 3.31Å
788	L	56.4	Low	65.4	Low	143 Å²	143	80.8 Å²	80.8	75%	0.749	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	38.4	51.7	160.3	-70.9	170.5	0	0	0	114.6	S783 R784 K790	S783-L788 PolarHBondContact O-N 3Å; R784-L788 WeakPolarHBondContact O-CD2 3.3Å; L788-K790 PolarHBondContact O-N 3.18Å
789	G	56.4	Low	64	Low	59 Å²	59	85.5 Å²	85.5	61%	0.608	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	22.6	177.6	0	0	0	0	0	116.1	H787 K791	H787-G789 VanDerWaalsContact C-N 3.29Å; H787-G789 PolarHBondContact O-N 3.45Å; G789-K791 VanDerWaalsContact O-CG 3.31Å; G789-K791 WeakPolarHBondContact O-CG 3.33Å; G789-K791 PolarHBondContact O-N 3.19Å
790	K	53.4	Low	62.7	Low	143 Å²	143	91.8 Å²	91.8	62%	0.622	45%	0.45	S	S	*	.			trans	-66.9	89.8	172.2	-77.8	178.3	178.2	179.1	0	111.6	F768 H787 L788 K792	F768-K790 VanDerWaalsContact CE1-O 3.3Å; F768-K790 WeakPolarHBondContact CE1-O 3.19Å; H787-K790 VanDerWaalsContact O-CB 3.26Å; H787-K790 WeakPolarHBondContact O-CB 3.48Å; H787-K790 VanDerWaalsContact O-CG 3.27Å; H787-K790 WeakPolarHBondContact O-CG 3.35Å; H787-K790 PolarHBondContact O-N 3.31Å; L788-K790 PolarHBondContact O-N 3.18Å; K790-K792 VanDerWaalsContact C-N 3.25Å; K790-K792 PolarHBondContact O-N 2.7Å
791	K	54.6	Low	61.3	Low	131 Å²	131	95 Å²	95	57%	0.57	48%	0.484	S	S	*	.			trans	-72.7	-0.1	-174	-72.2	150.8	-179.8	-171.2	0	116.3	G789 N809 G810	G789-K791 VanDerWaalsContact O-CG 3.31Å; G789-K791 WeakPolarHBondContact O-CG 3.33Å; G789-K791 PolarHBondContact O-N 3.19Å; K791-N809 PolarHBondContact NZ-O 2.75Å; K791-G810 WeakPolarHBondContact CE-O 3.29Å; K791-G810 WeakPolarHBondContact CG-O 3.46Å
792	K	47.6	Very low	60.2	Low	187 Å²	187	91.7 Å²	91.7	81%	0.813	47%	0.468	S	S	*	.			trans	-113.7	119.6	-174	-162	170.1	-174.4	175.4	0	110.6	K790	K790-K792 VanDerWaalsContact C-N 3.25Å; K790-K792 PolarHBondContact O-N 2.7Å
793	L	56.6	Low	58.9	Low	24 Å²	24	98 Å²	98	13%	0.126	50%	0.498	C	S	.	.			trans	-64.3	153	176.5	-69.3	165.4	0	0	0	111.5	L767 F768 F802 L804	L767-L793 HydrophobicContact CB-CD2 4.11Å; L767-L793 HydrophobicContact CD1-CD2 3.81Å; F768-L793 HydrophobicContact CE1-CD2 4.18Å; F768-L793 HydrophobicContact CZ-CD2 4.37Å; L793-F802 HydrophobicContact CD1-CD1 3.71Å; L793-F802 HydrophobicContact CD1-CE1 3.59Å; L793-L804 HydrophobicContact CD1-CD1 4.04Å; L793-L804 HydrophobicContact CD1-CG 4.27Å; L793-L804 HydrophobicContact CD2-CD1 4.04Å; L793-L804 HydrophobicContact CG-CD1 4.34Å
794	P	53.5	Low	58.3	Low	46 Å²	46	97.2 Å²	97.2	30%	0.299	49%	0.491	S	S	.	.			trans	-57.3	145.7	168.1	-24.6	34.8	0	0	0	112.6	L767 D796 Y797	L767-P794 WeakPolarHBondContact O-CD 3.33Å; L767-P794 VanDerWaalsContact O-CG 3.23Å; L767-P794 WeakPolarHBondContact O-CG 3.38Å; P794-D796 PolarHBondContact O-N 2.87Å; P794-D796 VanDerWaalsContact O-N 3.11Å; P794-Y797 HydrophobicContact CB-CD2 4.05Å; P794-Y797 HydrophobicContact CB-CE2 4.2Å; P794-Y797 HydrophobicContact CG-CD2 4.28Å; P794-Y797 HydrophobicContact CG-CE2 4.17Å; P794-Y797 PolarHBondContact O-N 3.39Å; P794-Y797 VanDerWaalsContact O-N 3.13Å
795	M	46.3	Very low	57.5	Low	151 Å²	151	95.1 Å²	95.1	74%	0.744	49%	0.489	S	S	*	.	H	α-helix	trans	-60.5	-28.2	-168.1	-152.4	168.2	-171.3	0	0	113.7	Y797 S798 N799	M795-Y797 PolarHBondContact O-N 2.81Å; M795-S798 PolarHBondContact O-N 3.11Å; M795-N799 PolarHBondContact O-N 3.31Å; M795-N799 PolarHBondContact O-ND2 3.31Å
796	D	52.4	Low	57.1	Low	108 Å²	108	93.4 Å²	93.4	58%	0.578	48%	0.482	S	S	*	.	H	α-helix	trans	-61.9	-22.2	177.8	-66.4	-70.4	0	0	0	115.2	P794 R800	P794-D796 PolarHBondContact O-N 2.87Å; P794-D796 VanDerWaalsContact O-N 3.11Å; D796-R800 WeakPolarHBondContact O-CD 3.24Å; D796-R800 WeakPolarHBondContact O-CG 3.37Å; D796-R800 PolarHBondContact O-NE 2.82Å
797	Y	55.4	Low	56.7	Low	44 Å²	44	86.7 Å²	86.7	17%	0.173	46%	0.46	C	S	.	.	H	α-helix	trans	-88.2	-43.9	178.1	-62.8	-76.2	0	0	0	111.8	P794 M795 N799 R800 F802 L838 L846	P794-Y797 HydrophobicContact CB-CD2 4.05Å; P794-Y797 HydrophobicContact CB-CE2 4.2Å; P794-Y797 HydrophobicContact CG-CD2 4.28Å; P794-Y797 HydrophobicContact CG-CE2 4.17Å; P794-Y797 PolarHBondContact O-N 3.39Å; P794-Y797 VanDerWaalsContact O-N 3.13Å; M795-Y797 PolarHBondContact O-N 2.81Å; Y797-N799 VanDerWaalsContact C-N 3.28Å; Y797-N799 PolarHBondContact O-N 2.9Å; Y797-R800 WeakPolarHBondContact O-CB 3.23Å; Y797-R800 PolarHBondContact O-N 3.5Å; Y797-F802 PolarHBondContact O-N 2.78Å; Y797-L838 HydrophobicContact CD1-CD1 3.64Å; Y797-L838 HydrophobicContact CE1-CD1 3.75Å; Y797-L838 HydrophobicContact CG-CD1 4.43Å; Y797-L846 HydrophobicContact CD1-CD1 4.18Å
798	S	53.3	Low	55.7	Low	67 Å²	67	91 Å²	91	47%	0.469	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-38.7	178.6	-57.1	0	0	0	0	112.1	M795 R800 G801	M795-S798 PolarHBondContact O-N 3.11Å; S798-R800 PolarHBondContact O-N 3.06Å; S798-G801 PolarHBondContact O-N 3.1Å; S798-G801 VanDerWaalsContact O-N 3.11Å
799	N	53	Low	55.5	Low	128 Å²	128	90 Å²	90	68%	0.684	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-4.6	175.7	-70.3	-20.8	0	0	0	114.4	M795 Y797	M795-N799 PolarHBondContact O-N 3.31Å; M795-N799 PolarHBondContact O-ND2 3.31Å; Y797-N799 VanDerWaalsContact C-N 3.28Å; Y797-N799 PolarHBondContact O-N 2.9Å
800	R	56.3	Low	55.4	Low	135 Å²	135	88 Å²	88	51%	0.509	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	14.1	176.6	-60.1	174.6	-167.1	-98.8	-7.3	112.8	D796 Y797 S798 F802 L846	D796-R800 WeakPolarHBondContact O-CD 3.24Å; D796-R800 WeakPolarHBondContact O-CG 3.37Å; D796-R800 PolarHBondContact O-NE 2.82Å; Y797-R800 WeakPolarHBondContact O-CB 3.23Å; Y797-R800 PolarHBondContact O-N 3.5Å; S798-R800 PolarHBondContact O-N 3.06Å; R800-F802 VanDerWaalsContact C-N 3.27Å; R800-F802 PolarHBondContact O-N 3.5Å; R800-L846 HydrophobicContact CB-CD1 4.19Å
801	G	50.7	Low	55.8	Low	74 Å²	74	84.9 Å²	84.9	76%	0.763	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	17.8	-177.3	0	0	0	0	0	113.7	S798	S798-G801 PolarHBondContact O-N 3.1Å; S798-G801 VanDerWaalsContact O-N 3.11Å
802	F	59	Low	56.5	Low	9 Å²	9	80 Å²	80	4%	0.039	44%	0.444	C	S	.	.			trans	-91.8	119	176.3	-177.6	-113.4	0	0	0	111.4	L793 Y797 R800 L804 L838 L846 P848	L793-F802 HydrophobicContact CD1-CD1 3.71Å; L793-F802 HydrophobicContact CD1-CE1 3.59Å; Y797-F802 PolarHBondContact O-N 2.78Å; R800-F802 VanDerWaalsContact C-N 3.27Å; R800-F802 PolarHBondContact O-N 3.5Å; F802-L804 HydrophobicContact CE1-CD1 4.25Å; F802-L804 HydrophobicContact CE1-CD2 4.32Å; F802-L804 HydrophobicContact CE1-CG 3.79Å; F802-L804 HydrophobicContact CE2-CD2 4.42Å; F802-L804 HydrophobicContact CZ-CD1 4.33Å; F802-L804 HydrophobicContact CZ-CD2 3.6Å; F802-L804 HydrophobicContact CZ-CG 3.55Å; F802-L838 HydrophobicContact CD1-CD1 3.88Å; F802-L838 HydrophobicContact CD1-CD2 4.04Å; F802-L838 HydrophobicContact CD1-CG 4.37Å; F802-L838 HydrophobicContact CD2-CD2 3.7Å; F802-L838 HydrophobicContact CE1-CD1 3.61Å; F802-L838 HydrophobicContact CE1-CD2 3.8Å; F802-L838 HydrophobicContact CE1-CG 3.83Å; F802-L838 HydrophobicContact CE2-CD2 3.46Å; F802-L838 VanDerWaalsContact CE2-CD2 3.46Å; F802-L838 HydrophobicContact CE2-CG 4.26Å; F802-L838 HydrophobicContact CG-CD2 3.98Å; F802-L838 HydrophobicContact CZ-CD1 4.09Å; F802-L838 HydrophobicContact CZ-CD2 3.49Å; F802-L838 VanDerWaalsContact CZ-CD2 3.49Å; F802-L838 HydrophobicContact CZ-CG 3.75Å; F802-L846 HydrophobicContact CB-CB 4.32Å; F802-L846 HydrophobicContact CB-CD1 4.21Å; F802-L846 HydrophobicContact CD2-CB 4.46Å; F802-P848 HydrophobicContact CE2-CB 3.91Å; F802-P848 HydrophobicContact CE2-CG 3.95Å; F802-P848 HydrophobicContact CZ-CB 4.4Å
803	Q	57.9	Low	57.3	Low	157 Å²	157	74.6 Å²	74.6	73%	0.734	42%	0.423	S	S	*	.			trans	-126.7	127.4	169.8	-177.4	165.1	-3.3	0	0	107.2
804	L	64.7	Low	58.1	Low	15 Å²	15	75 Å²	75	8%	0.079	42%	0.424	C	S	.	.			trans	-75.1	136.5	161.9	-75.9	163.8	0	0	0	107.2	A727 L767 L793 F802 V806 L812 A836	A727-L804 HydrophobicContact CB-CD1 4.07Å; L767-L804 HydrophobicContact CD1-CD1 4.39Å; L793-L804 HydrophobicContact CD1-CD1 4.04Å; L793-L804 HydrophobicContact CD1-CG 4.27Å; L793-L804 HydrophobicContact CD2-CD1 4.04Å; L793-L804 HydrophobicContact CG-CD1 4.34Å; F802-L804 HydrophobicContact CE1-CD1 4.25Å; F802-L804 HydrophobicContact CE1-CD2 4.32Å; F802-L804 HydrophobicContact CE1-CG 3.79Å; F802-L804 HydrophobicContact CE2-CD2 4.42Å; F802-L804 HydrophobicContact CZ-CD1 4.33Å; F802-L804 HydrophobicContact CZ-CD2 3.6Å; F802-L804 HydrophobicContact CZ-CG 3.55Å; L804-V806 HydrophobicContact CB-CG2 4.25Å; L804-L812 HydrophobicContact CB-CD2 4.19Å; L804-L812 HydrophobicContact CD1-CD2 3.77Å; L804-L812 HydrophobicContact CG-CD2 4.36Å; L804-A836 HydrophobicContact CD2-CB 4.09Å
805	D	59.6	Low	58.7	Low	74 Å²	74	76.7 Å²	76.7	40%	0.396	44%	0.435	S	S	.	.			trans	-68.7	132.8	165.8	-68	-48.3	0	0	0	108.4	L813 P815	D805-L813 HydrophobicContact CB-CB 3.78Å; D805-L813 HydrophobicContact CB-CD1 4.39Å; D805-L813 PolarHBondContact O-N 2.84Å; D805-P815 HydrophobicContact CB-CG 4.34Å; D805-P815 WeakPolarHBondContact OD2-CG 3.47Å
806	V	69.2	Low	59.6	Low	62 Å²	62	74.3 Å²	74.3	38%	0.376	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-139.3	135.6	-173.9	179.9	0	0	0	0	108.1	L804 G810 N811 L812	L804-V806 HydrophobicContact CB-CG2 4.25Å; V806-G810 VanDerWaalsContact CG1-CA 3.4Å; V806-N811 CarbonylContact C-O 3.55Å; V806-N811 VanDerWaalsContact CA-O 3.32Å; V806-N811 WeakPolarHBondContact CA-O 3.26Å; V806-L812 HydrophobicContact CG2-CD2 4.37Å
807	D	62.9	Low	60.6	Low	45 Å²	45	72.3 Å²	72.3	24%	0.241	41%	0.411	C	S	.	.			trans	-72.7	169.3	177.8	70.6	24.6	0	0	0	112.3	N809 G810 N811 L813	D807-N809 PolarHBondContact O-N 2.86Å; D807-N809 WeakPolarHBondContact OD1-CA 3.34Å; D807-N809 WeakPolarHBondContact OD1-CB 3.38Å; D807-N809 PolarHBondContact OD1-N 3.15Å; D807-G810 PolarHBondContact O-N 3.49Å; D807-G810 PolarHBondContact OD1-N 3.13Å; D807-N811 PolarHBondContact N-O 3Å; D807-N811 PolarHBondContact OD1-N 2.82Å; D807-N811 PolarHBondContact OD1-ND2 2.96Å; D807-N811 WeakPolarHBondContact OD2-CB 3.32Å; D807-N811 PolarHBondContact OD2-ND2 3.37Å; D807-L813 HydrophobicContact CB-CD1 4.25Å; D807-L813 HydrophobicContact CB-CD2 4.04Å; D807-L813 HydrophobicContact CB-CG 4.1Å
808	A	50.8	Low	61.2	Low	108 Å²	108	72.7 Å²	72.7	89%	0.893	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.3	179.5	0	0	0	0	0	113.8
809	N	51.2	Low	62.3	Low	123 Å²	123	69.7 Å²	69.7	66%	0.658	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-10.1	177.6	-61.2	-17.8	0	0	0	112	K791 D807	K791-N809 PolarHBondContact NZ-O 2.75Å; D807-N809 PolarHBondContact O-N 2.86Å; D807-N809 WeakPolarHBondContact OD1-CA 3.34Å; D807-N809 WeakPolarHBondContact OD1-CB 3.38Å; D807-N809 PolarHBondContact OD1-N 3.15Å
810	G	55.4	Low	63.3	Low	18 Å²	18	67.6 Å²	67.6	19%	0.186	38%	0.382	C	S	.	.	S	Bend	trans	93.7	18	179.7	0	0	0	0	0	115.4	K791 V806 D807	K791-G810 WeakPolarHBondContact CE-O 3.29Å; K791-G810 WeakPolarHBondContact CG-O 3.46Å; V806-G810 VanDerWaalsContact CG1-CA 3.4Å; D807-G810 PolarHBondContact O-N 3.49Å; D807-G810 PolarHBondContact OD1-N 3.13Å
811	N	61.8	Low	64.2	Low	76 Å²	76	62.2 Å²	62.2	41%	0.406	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-92.3	147.7	174.8	-42.6	-69.7	0	0	0	111	V806 D807 L813	V806-N811 CarbonylContact C-O 3.55Å; V806-N811 VanDerWaalsContact CA-O 3.32Å; V806-N811 WeakPolarHBondContact CA-O 3.26Å; D807-N811 PolarHBondContact N-O 3Å; D807-N811 PolarHBondContact OD1-N 2.82Å; D807-N811 PolarHBondContact OD1-ND2 2.96Å; D807-N811 WeakPolarHBondContact OD2-CB 3.32Å; D807-N811 PolarHBondContact OD2-ND2 3.37Å; N811-L813 PolarHBondContact O-N 3.4Å
812	L	69.8	Low	65.3	Low	30 Å²	30	63.5 Å²	63.5	16%	0.157	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-58.6	130.9	175.3	-59.7	176.9	0	0	0	111.2	K725 A727 L804 V806 F814	K725-L812 HydrophobicContact CB-CB 4.31Å; K725-L812 HydrophobicContact CB-CD1 4.44Å; K725-L812 VanDerWaalsContact CD-O 3.31Å; K725-L812 WeakPolarHBondContact CD-O 3.32Å; K725-L812 WeakPolarHBondContact CE-O 3.32Å; K725-L812 PolarHBondContact NZ-O 2.86Å; A727-L812 HydrophobicContact CB-CD1 3.86Å; L804-L812 HydrophobicContact CB-CD2 4.19Å; L804-L812 HydrophobicContact CD1-CD2 3.77Å; L804-L812 HydrophobicContact CG-CD2 4.36Å; V806-L812 HydrophobicContact CG2-CD2 4.37Å; L812-F814 HydrophobicContact CB-CD2 4.38Å; L812-F814 HydrophobicContact CB-CE2 3.71Å; L812-F814 HydrophobicContact CD1-CE2 4.49Å
813	L	64.3	Low	66	Low	72 Å²	72	63.1 Å²	63.1	38%	0.377	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-92.9	147.2	167.4	-69.9	172.7	0	0	0	109.5	D805 D807 N811	D805-L813 HydrophobicContact CB-CB 3.78Å; D805-L813 HydrophobicContact CB-CD1 4.39Å; D805-L813 PolarHBondContact O-N 2.84Å; D807-L813 HydrophobicContact CB-CD1 4.25Å; D807-L813 HydrophobicContact CB-CD2 4.04Å; D807-L813 HydrophobicContact CB-CG 4.1Å; N811-L813 PolarHBondContact O-N 3.4Å
814	F	72.8	Confident	66.6	Low	34 Å²	34	57.6 Å²	57.6	15%	0.149	33%	0.329	C	S	.	.			trans	-125.2	87.3	178.8	-73.3	-105.7	0	0	0	106.3	K725 L812 H816 L817 Y834 A836 Y850	K725-F814 HydrophobicContact CB-CE2 4.03Å; K725-F814 HydrophobicContact CD-CE2 4.28Å; K725-F814 HydrophobicContact CG-CD2 4.44Å; K725-F814 HydrophobicContact CG-CE2 3.83Å; L812-F814 HydrophobicContact CB-CD2 4.38Å; L812-F814 HydrophobicContact CB-CE2 3.71Å; L812-F814 HydrophobicContact CD1-CE2 4.49Å; F814-H816 PolarHBondContact O-N 3.18Å; F814-L817 HydrophobicContact CD1-CD2 4.28Å; F814-Y834 HydrophobicContact CD1-CD1 4.17Å; F814-Y834 HydrophobicContact CD2-CD1 4.44Å; F814-Y834 HydrophobicContact CG-CD1 4.14Å; F814-Y834 WeakPolarHBondContact CZ-O 3.41Å; F814-A836 HydrophobicContact CE1-CB 4.13Å; F814-A836 HydrophobicContact CZ-CB 4.19Å; F814-Y850 AromaticContact CD1-CD1 3.38Å; F814-Y850 HydrophobicContact CD1-CD1 3.38Å; F814-Y850 HydrophobicContact CD1-CE1 4.16Å; F814-Y850 HydrophobicContact CD1-CG 4.03Å; F814-Y850 AromaticContact CE1-CD1 3.68Å; F814-Y850 HydrophobicContact CE1-CD1 3.68Å; F814-Y850 HydrophobicContact CE1-CE1 4.42Å; F814-Y850 HydrophobicContact CG-CD1 4.16Å
815	P	66.1	Low	66.8	Low	80 Å²	80	60.4 Å²	60.4	52%	0.519	34%	0.34	S	S	.	.	S	Bend	trans	-64.8	-21.9	-173.2	-19.9	31.5	0	0	0	113.3	D805	D805-P815 HydrophobicContact CB-CG 4.34Å; D805-P815 WeakPolarHBondContact OD2-CG 3.47Å
816	H	64.8	Low	67.1	Low	101 Å²	101	64.2 Å²	64.2	47%	0.468	36%	0.356	S	S	.	.			trans	-150.1	170	173.3	47.9	-77.5	0	0	0	109.1	F814 D818 Y850	F814-H816 PolarHBondContact O-N 3.18Å; H816-D818 IonicContact CD2-OD1 3.07Å; H816-D818 PolarHBondContact CD2-OD1 3.33Å; H816-D818 IonicContact CD2-OD2 3.88Å; H816-D818 IonicContact NE2-OD1 3.62Å; H816-Y850 AromaticContact CD2-CD2 3.96Å; H816-Y850 AromaticContact CE1-CD2 3.96Å; H816-Y850 AromaticContact CE1-CE2 3.87Å; H816-Y850 AromaticContact NE2-CD2 3.71Å; H816-Y850 AromaticContact NE2-CE2 4Å; H816-Y850 VanDerWaalsContact O-CB 3.3Å; H816-Y850 WeakPolarHBondContact O-CB 3.37Å
817	L	72.9	Confident	66.8	Low	67 Å²	67	65.1 Å²	65.1	35%	0.351	36%	0.355	S	S	.	.			trans	-121.1	119.4	168	-64.8	175.6	0	0	0	107.3	F814 Y834 K852	F814-L817 HydrophobicContact CD1-CD2 4.28Å; L817-Y834 HydrophobicContact CD1-CE1 4.22Å; L817-Y834 HydrophobicContact CD2-CD1 3.94Å; L817-Y834 HydrophobicContact CD2-CE1 4.05Å; L817-K852 HydrophobicContact CD1-CB 3.99Å; L817-K852 HydrophobicContact CD1-CD 4.06Å; L817-K852 HydrophobicContact CD2-CB 4.17Å
818	D	68.3	Low	66.9	Low	51 Å²	51	63.4 Å²	63.4	27%	0.273	35%	0.346	S	S	.	.	S	Bend	trans	-76.9	-37.1	178.7	-63.6	-63.9	0	0	0	111.6	H816 V849 Y850	H816-D818 IonicContact CD2-OD1 3.07Å; H816-D818 PolarHBondContact CD2-OD1 3.33Å; H816-D818 IonicContact CD2-OD2 3.88Å; H816-D818 IonicContact NE2-OD1 3.62Å; D818-V849 HydrophobicContact CB-CG1 4.16Å; D818-V849 WeakPolarHBondContact OD2-CA 3.34Å; D818-Y850 PolarHBondContact N-O 3.06Å; D818-Y850 PolarHBondContact OD2-N 3.33Å
819	F	76.1	Confident	67.4	Low	5 Å²	5	59.3 Å²	59.3	2%	0.022	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	145.3	-170.1	-60.4	-58.8	0	0	0	111.5	W735 E752 L755 V849 Y850 V851 K852	W735-F819 AromaticContact CE2-CZ 3.97Å; W735-F819 HydrophobicContact CZ2-CE2 4.29Å; W735-F819 AromaticContact CZ2-CZ 3.77Å; W735-F819 HydrophobicContact CZ2-CZ 3.77Å; W735-F819 AromaticContact NE1-CE2 3.48Å; W735-F819 AromaticContact NE1-CZ 3.53Å; E752-F819 HydrophobicContact CB-CD1 4.23Å; E752-F819 HydrophobicContact CB-CE1 4.19Å; E752-F819 HydrophobicContact CG-CD1 3.49Å; E752-F819 VanDerWaalsContact CG-CD1 3.49Å; E752-F819 HydrophobicContact CG-CE1 3.92Å; E752-F819 HydrophobicContact CG-CG 4.39Å; L755-F819 HydrophobicContact CD2-CD2 3.88Å; L755-F819 HydrophobicContact CD2-CE2 3.89Å; F819-V849 HydrophobicContact CD2-CG1 3.58Å; F819-V849 HydrophobicContact CE2-CG1 3.61Å; F819-Y850 PolarHBondContact N-O 3.03Å; F819-V851 HydrophobicContact CB-CG1 4.21Å; F819-V851 HydrophobicContact CB-CG2 4.31Å; F819-V851 HydrophobicContact CD2-CG2 4.24Å; F819-K852 PolarHBondContact O-N 2.88Å
820	I	74.6	Confident	68.1	Low	83 Å²	83	61.2 Å²	61.2	43%	0.426	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127.7	171.5	-52.8	-179.5	0	0	0	107.9	K852	I820-K852 WeakPolarHBondContact CA-O 3.47Å; I820-K852 HydrophobicContact CG1-CB 4.38Å
821	T	75.4	Confident	68.8	Low	23 Å²	23	65.4 Å²	65.4	14%	0.141	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	167	174.6	-155.9	0	0	0	0	112.3	I756 K852 V853 R854	I756-T821 HydrophobicContact CB-CG2 3.91Å; I756-T821 HydrophobicContact CG1-CG2 3.61Å; I756-T821 HydrophobicContact CG2-CG2 4.47Å; T821-K852 PolarHBondContact N-O 2.88Å; T821-V853 HydrophobicContact CG2-CG1 4.13Å; T821-V853 HydrophobicContact CG2-CG2 4.3Å; T821-V853 WeakPolarHBondContact O-CA 3.35Å; T821-R854 PolarHBondContact O-N 3.18Å
822	I	73.9	Confident	69.7	Low	101 Å²	101	64.7 Å²	64.7	52%	0.518	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.1	-180	-55.7	175.4	0	0	0	107.7	R854 Q856	I822-R854 WeakPolarHBondContact CA-O 3.15Å; I822-Q856 HydrophobicContact CG2-CB 3.87Å; I822-Q856 HydrophobicContact CG2-CG 4.3Å
823	L	73.2	Confident	70.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.8	177.4	-165	68.3	0	0	0	109.8	I756 L760 I776 K827 L828 V853 R854 Q856	I756-L823 HydrophobicContact CG2-CD1 4.15Å; I756-L823 HydrophobicContact CG2-CD2 4.34Å; L760-L823 HydrophobicContact CD1-CD1 4.31Å; L760-L823 HydrophobicContact CD1-CD2 3.95Å; I776-L823 HydrophobicContact CD1-CD2 3.82Å; I776-L823 HydrophobicContact CG1-CD2 4.24Å; L823-K827 HydrophobicContact CD2-CB 3.82Å; L823-K827 HydrophobicContact CG-CB 4.14Å; L823-L828 HydrophobicContact CB-CB 4.45Å; L823-L828 HydrophobicContact CD2-CB 4.27Å; L823-L828 HydrophobicContact CD2-CD1 4.2Å; L823-V853 HydrophobicContact CB-CG1 3.71Å; L823-V853 HydrophobicContact CD2-CG1 4.46Å; L823-R854 PolarHBondContact N-O 3.43Å; L823-Q856 PolarHBondContact O-N 3.36Å
824	P	70.9	Confident	71.1	Confident	42 Å²	42	62.2 Å²	62.2	27%	0.273	31%	0.307	S	S	.	.			trans	-56.5	142.8	173.5	-26.4	36.5	0	0	0	112.3	E826 K827 L828	P824-E826 VanDerWaalsContact C-OE2 3.29Å; P824-E826 WeakPolarHBondContact CB-OE2 3.49Å; P824-E826 PolarHBondContact O-N 2.86Å; P824-E826 VanDerWaalsContact O-N 3.13Å; P824-K827 PolarHBondContact O-N 3.36Å; P824-K827 VanDerWaalsContact O-N 3.12Å; P824-L828 PolarHBondContact O-N 3.13Å
825	K	68.2	Low	71.6	Confident	73 Å²	73	60.6 Å²	60.6	32%	0.317	30%	0.3	S	S	.	.	H	α-helix	trans	-56.5	-32	-172.1	-71.6	-172.8	172.8	-169.5	0	112.8	K827 L828 G829 P855 Q856 E858	K825-K827 PolarHBondContact O-N 3.2Å; K825-L828 PolarHBondContact O-N 3.46Å; K825-G829 WeakPolarHBondContact O-CA 3.4Å; K825-G829 PolarHBondContact O-N 3.33Å; K825-P855 HydrophobicContact CG-CB 4.22Å; K825-Q856 WeakPolarHBondContact CE-O 3.47Å; K825-E858 WeakPolarHBondContact CE-OE2 3.34Å; K825-E858 IonicContact NZ-OE2 3.26Å; K825-E858 PolarHBondContact NZ-OE2 3.16Å
826	E	66.2	Low	72.3	Confident	155 Å²	155	57 Å²	57	72%	0.724	28%	0.276	S	S	*	.	H	α-helix	trans	-61.1	-32.4	-177.9	-53.3	77.8	-173.5	0	0	112.3	P824	P824-E826 VanDerWaalsContact C-OE2 3.29Å; P824-E826 WeakPolarHBondContact CB-OE2 3.49Å; P824-E826 PolarHBondContact O-N 2.86Å; P824-E826 VanDerWaalsContact O-N 3.13Å
827	K	62.6	Low	73.3	Confident	81 Å²	81	52.3 Å²	52.3	35%	0.352	26%	0.255	S	S	.	.	H	α-helix	trans	-98	-21.1	-177.4	-68.3	-172.6	160.3	-78.6	0	114.2	D775 I776 K777 L823 P824 K825	D775-K827 WeakPolarHBondContact OD1-CG 3.39Å; D775-K827 IonicContact OD1-NZ 2.71Å; D775-K827 PolarHBondContact OD1-NZ 3.17Å; D775-K827 IonicContact OD2-NZ 3.81Å; I776-K827 PolarHBondContact N-O 2.9Å; K777-K827 PolarHBondContact N-O 2.84Å; L823-K827 HydrophobicContact CD2-CB 3.82Å; L823-K827 HydrophobicContact CG-CB 4.14Å; P824-K827 PolarHBondContact O-N 3.36Å; P824-K827 VanDerWaalsContact O-N 3.12Å; K825-K827 PolarHBondContact O-N 3.2Å
828	L	65.4	Low	73.5	Confident	9 Å²	9	49.3 Å²	49.3	5%	0.047	24%	0.239	C	C	.	.	H	α-helix	trans	-101.5	-34.3	-178.2	-162.7	69.9	0	0	0	113.5	I776 L823 P824 K825 V833 V853 P855	I776-L828 HydrophobicContact CB-CD1 4.09Å; I776-L828 HydrophobicContact CD1-CD1 3.84Å; I776-L828 HydrophobicContact CG1-CD1 4.49Å; I776-L828 HydrophobicContact CG2-CD1 3.95Å; L823-L828 HydrophobicContact CB-CB 4.45Å; L823-L828 HydrophobicContact CD2-CB 4.27Å; L823-L828 HydrophobicContact CD2-CD1 4.2Å; P824-L828 PolarHBondContact O-N 3.13Å; K825-L828 PolarHBondContact O-N 3.46Å; L828-V833 HydrophobicContact CD1-CB 3.98Å; L828-V833 HydrophobicContact CD1-CG2 3.62Å; L828-V833 HydrophobicContact CG-CG2 3.96Å; L828-V853 HydrophobicContact CD1-CB 3.99Å; L828-V853 HydrophobicContact CD1-CG1 3.59Å; L828-V853 HydrophobicContact CD2-CG1 4.02Å; L828-V853 HydrophobicContact CG-CG1 4.46Å; L828-P855 HydrophobicContact CD2-CB 4.02Å; L828-P855 HydrophobicContact CD2-CG 4.44Å
829	G	62.4	Low	73.7	Confident	21 Å²	21	47.5 Å²	47.5	22%	0.216	23%	0.231	C	C	.	.			trans	83.9	-170	-158.5	0	0	0	0	0	112.2	K825	K825-G829 WeakPolarHBondContact O-CA 3.4Å; K825-G829 PolarHBondContact O-N 3.33Å
830	E	65.4	Low	73.1	Confident	164 Å²	164	47.4 Å²	47.4	77%	0.766	23%	0.232	S	C	*	.	S	Bend	trans	-87	-12.1	-172.3	-61	175.7	158.8	0	0	113.9
831	R	70.4	Confident	72.4	Confident	106 Å²	106	46.2 Å²	46.2	40%	0.4	23%	0.226	S	C	.	.	S	Bend	trans	-91.5	150.4	-177.1	-55.6	-173.8	-173.4	-136.7	-4	111.5	L721	L721-R831 HydrophobicContact CB-CG 3.88Å; L721-R831 HydrophobicContact CD1-CG 3.85Å; L721-R831 HydrophobicContact CG-CG 4.49Å
832	E	80.1	Confident	71.3	Confident	61 Å²	61	52.6 Å²	52.6	29%	0.285	25%	0.254	S	S	.	.			trans	-67.2	139.8	159.2	-70.1	-171.1	131.3	0	0	109.4	P723 E724 K852 R854	P723-E832 CarbonylContact C-O 3.55Å; P723-E832 VanDerWaalsContact CA-O 3.25Å; P723-E832 WeakPolarHBondContact CA-O 3.49Å; P723-E832 HydrophobicContact CB-CB 4.13Å; P723-E832 WeakPolarHBondContact CB-O 3.28Å; E724-E832 PolarHBondContact N-O 2.87Å; E832-K852 WeakPolarHBondContact OE1-CE 3.46Å; E832-K852 IonicContact OE1-NZ 3.06Å; E832-K852 PolarHBondContact OE1-NZ 2.89Å; E832-K852 WeakPolarHBondContact OE2-CE 3.35Å; E832-K852 IonicContact OE2-NZ 3.45Å; E832-K852 PolarHBondContact OE2-NZ 3.23Å; E832-R854 HydrophobicContact CG-CG 4.25Å; E832-R854 VanDerWaalsContact OE1-CD 3.23Å; E832-R854 WeakPolarHBondContact OE1-CD 3.41Å; E832-R854 VanDerWaalsContact OE1-CG 3.31Å; E832-R854 WeakPolarHBondContact OE1-CG 3.44Å; E832-R854 IonicContact OE1-CZ 2.66Å; E832-R854 IonicContact OE1-NE 2.99Å; E832-R854 PolarHBondContact OE1-NE 2.85Å
833	V	81.9	Confident	70.6	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.6	179	-178.1	0	0	0	0	109.6	E724 L726 I776 L828 V853	E724-V833 HydrophobicContact CB-CG2 4.48Å; E724-V833 WeakPolarHBondContact O-CA 3.43Å; E724-V833 WeakPolarHBondContact O-CG1 3.37Å; L726-V833 HydrophobicContact CD1-CG1 3.85Å; L726-V833 HydrophobicContact CG-CG1 4.24Å; I776-V833 HydrophobicContact CG2-CB 4.39Å; I776-V833 HydrophobicContact CG2-CG1 3.9Å; I776-V833 HydrophobicContact CG2-CG2 4.26Å; L828-V833 HydrophobicContact CD1-CB 3.98Å; L828-V833 HydrophobicContact CD1-CG2 3.62Å; L828-V833 HydrophobicContact CG-CG2 3.96Å; V833-V853 PolarHBondContact N-O 3.22Å; V833-V853 PolarHBondContact O-N 3.47Å
834	Y	81	Confident	69.6	Low	48 Å²	48	59.4 Å²	59.4	19%	0.188	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	114.6	175.8	-78.7	-126.8	0	0	0	107.6	P723 E724 K725 L726 F814 L817 K852	P723-Y834 HydrophobicContact CB-CD2 3.58Å; P723-Y834 HydrophobicContact CB-CE2 3.51Å; P723-Y834 HydrophobicContact CG-CD2 4.16Å; P723-Y834 HydrophobicContact CG-CE2 3.81Å; E724-Y834 PolarHBondContact O-N 2.98Å; K725-Y834 WeakPolarHBondContact CA-O 3.36Å; L726-Y834 PolarHBondContact N-O 3.23Å; F814-Y834 HydrophobicContact CD1-CD1 4.17Å; F814-Y834 HydrophobicContact CD2-CD1 4.44Å; F814-Y834 HydrophobicContact CG-CD1 4.14Å; F814-Y834 WeakPolarHBondContact CZ-O 3.41Å; L817-Y834 HydrophobicContact CD1-CE1 4.22Å; L817-Y834 HydrophobicContact CD2-CD1 3.94Å; L817-Y834 HydrophobicContact CD2-CE1 4.05Å; Y834-K852 HydrophobicContact CD2-CD 4.41Å; Y834-K852 HydrophobicContact CD2-CG 4.23Å; Y834-K852 HydrophobicContact CE1-CD 4.23Å; Y834-K852 HydrophobicContact CE2-CD 3.69Å; Y834-K852 VanDerWaalsContact CE2-CE 3.45Å; Y834-K852 HydrophobicContact CE2-CG 4Å; Y834-K852 PolarHBondContact OH-NZ 3.48Å
835	L	83.3	Confident	68.8	Low	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	113.5	-169.3	-174.2	65.4	0	0	0	110.8	L726 A728 I756 L764 L779 I837 V851	L726-L835 HydrophobicContact CB-CD1 3.77Å; L726-L835 WeakPolarHBondContact O-CA 3.38Å; A728-L835 HydrophobicContact CB-CD1 3.94Å; I756-L835 HydrophobicContact CD1-CD2 4.21Å; L764-L835 HydrophobicContact CD1-CD2 3.94Å; L764-L835 HydrophobicContact CD2-CD2 4.38Å; L779-L835 HydrophobicContact CD2-CD1 4.15Å; L835-I837 HydrophobicContact CD2-CD1 3.9Å; L835-I837 HydrophobicContact CD2-CG1 3.92Å; L835-I837 HydrophobicContact CG-CD1 4.27Å; L835-I837 HydrophobicContact CG-CG1 3.77Å; L835-V851 PolarHBondContact N-O 3.34Å; L835-V851 PolarHBondContact O-N 3.43Å
836	A	82.2	Confident	68.6	Low	3 Å²	3	58.4 Å²	58.4	3%	0.025	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	114.7	170.5	0	0	0	0	0	109.7	L726 A727 A728 L804 F814 Y850	L726-A836 PolarHBondContact O-N 3.44Å; A727-A836 CarbonylContact C-O 3.6Å; A727-A836 VanDerWaalsContact CA-O 3.3Å; A727-A836 WeakPolarHBondContact CA-O 3.31Å; A727-A836 HydrophobicContact CB-CB 4.22Å; A728-A836 PolarHBondContact N-O 3.07Å; L804-A836 HydrophobicContact CD2-CB 4.09Å; F814-A836 HydrophobicContact CE1-CB 4.13Å; F814-A836 HydrophobicContact CZ-CB 4.19Å; A836-Y850 HydrophobicContact CB-CD1 3.89Å; A836-Y850 HydrophobicContact CB-CE1 3.83Å
837	I	84.3	Confident	68.5	Low	4 Å²	4	55.5 Å²	55.5	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	119.4	-173.3	-53	179.7	0	0	0	110.6	A728 A730 L759 L835 A839 V849 V851	A728-I837 WeakPolarHBondContact O-CA 3.31Å; A730-I837 HydrophobicContact CB-CG2 3.66Å; L759-I837 HydrophobicContact CD1-CD1 3.51Å; L835-I837 HydrophobicContact CD2-CD1 3.9Å; L835-I837 HydrophobicContact CD2-CG1 3.92Å; L835-I837 HydrophobicContact CG-CD1 4.27Å; L835-I837 HydrophobicContact CG-CG1 3.77Å; I837-A839 PolarHBondContact O-N 3.34Å; I837-V849 PolarHBondContact N-O 2.99Å; I837-V849 PolarHBondContact O-N 2.93Å; I837-V851 HydrophobicContact CD1-CG2 3.7Å; I837-V851 HydrophobicContact CG1-CG2 4.4Å
838	L	77.9	Confident	68.9	Low	3 Å²	3	52.8 Å²	52.8	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	108.3	165.8	-86.9	-174.9	0	0	0	110.9	A728 C729 A730 L767 Y797 F802 L846	A728-L838 PolarHBondContact O-N 2.79Å; C729-L838 HydrophobicContact CB-CB 4.24Å; A730-L838 CarbonylContact C-O 3.5Å; A730-L838 PolarHBondContact N-O 3.42Å; L767-L838 HydrophobicContact CD1-CD1 4.27Å; L767-L838 HydrophobicContact CD2-CB 4.37Å; L767-L838 HydrophobicContact CD2-CD1 3.85Å; L767-L838 HydrophobicContact CD2-CG 4.43Å; Y797-L838 HydrophobicContact CD1-CD1 3.64Å; Y797-L838 HydrophobicContact CE1-CD1 3.75Å; Y797-L838 HydrophobicContact CG-CD1 4.43Å; F802-L838 HydrophobicContact CD1-CD1 3.88Å; F802-L838 HydrophobicContact CD1-CD2 4.04Å; F802-L838 HydrophobicContact CD1-CG 4.37Å; F802-L838 HydrophobicContact CD2-CD2 3.7Å; F802-L838 HydrophobicContact CE1-CD1 3.61Å; F802-L838 HydrophobicContact CE1-CD2 3.8Å; F802-L838 HydrophobicContact CE1-CG 3.83Å; F802-L838 HydrophobicContact CE2-CD2 3.46Å; F802-L838 VanDerWaalsContact CE2-CD2 3.46Å; F802-L838 HydrophobicContact CE2-CG 4.26Å; F802-L838 HydrophobicContact CG-CD2 3.98Å; F802-L838 HydrophobicContact CZ-CD1 4.09Å; F802-L838 HydrophobicContact CZ-CD2 3.49Å; F802-L838 VanDerWaalsContact CZ-CD2 3.49Å; F802-L838 HydrophobicContact CZ-CG 3.75Å; L838-L846 HydrophobicContact CD2-CB 4.03Å; L838-L846 HydrophobicContact CD2-CD1 4.39Å
839	A	72.6	Confident	69.4	Low	13 Å²	13	53 Å²	53	11%	0.107	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	145.1	173	0	0	0	0	0	112	L733 I837	L733-A839 HydrophobicContact CB-CB 4.12Å; I837-A839 PolarHBondContact O-N 3.34Å
840	G	63.4	Low	70.3	Confident	4 Å²	4	52.2 Å²	52.2	4%	0.041	26%	0.263	C	S	.	.			trans	67.9	63.6	161.6	0	0	0	0	0	116.3	L733 H842 S843 L846	L733-G840 VanDerWaalsContact O-CA 3.24Å; L733-G840 WeakPolarHBondContact O-CA 3.11Å; L733-G840 PolarHBondContact O-N 2.89Å; G840-H842 PolarHBondContact O-N 2.98Å; G840-S843 VanDerWaalsContact O-CB 3.23Å; G840-S843 WeakPolarHBondContact O-CB 3.43Å; G840-S843 PolarHBondContact O-N 3.43Å; G840-S843 PolarHBondContact O-OG 3.29Å; G840-L846 WeakPolarHBondContact O-CD2 3.41Å
841	I	58.8	Low	71.2	Confident	58 Å²	58	44.5 Å²	44.5	30%	0.297	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-16.1	178.1	57.8	165.4	0	0	0	115.8	P731	P731-I841 HydrophobicContact CB-CB 4.38Å; P731-I841 HydrophobicContact CB-CD1 3.59Å; P731-I841 HydrophobicContact CB-CG1 3.65Å; P731-I841 HydrophobicContact CB-CG2 3.87Å
842	H	53.3	Low	71.7	Confident	157 Å²	157	40.1 Å²	40.1	73%	0.727	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-4.1	177.5	-53	-60	0	0	0	113.6	G840	G840-H842 PolarHBondContact O-N 2.98Å
843	S	58.4	Low	71.9	Confident	48 Å²	48	37.2 Å²	37.2	34%	0.336	20%	0.197	S	C	.	.	S	Bend	trans	-76.2	148.6	179	-54.4	0	0	0	0	111.7	G840 S845	G840-S843 VanDerWaalsContact O-CB 3.23Å; G840-S843 WeakPolarHBondContact O-CB 3.43Å; G840-S843 PolarHBondContact O-N 3.43Å; G840-S843 PolarHBondContact O-OG 3.29Å; S843-S845 VanDerWaalsContact CB-O 3.25Å; S843-S845 WeakPolarHBondContact CB-O 3.36Å; S843-S845 PolarHBondContact O-N 3.49Å
844	K	53.6	Low	71.8	Confident	196 Å²	196	41.8 Å²	41.8	85%	0.852	21%	0.214	S	C	*	.	S	Bend	trans	-72.7	-10.1	176.1	-64.8	173.9	-173.8	162.2	0	113.8
845	S	53.8	Low	71.6	Confident	78 Å²	78	40.9 Å²	40.9	55%	0.545	21%	0.214	S	C	.	.	S	Bend	trans	-142.5	130.5	174.8	173.8	0	0	0	0	106.8	S843	S843-S845 VanDerWaalsContact CB-O 3.25Å; S843-S845 WeakPolarHBondContact CB-O 3.36Å; S843-S845 PolarHBondContact O-N 3.49Å
846	L	64	Low	71.1	Confident	15 Å²	15	46.2 Å²	46.2	8%	0.079	24%	0.239	C	C	.	.			trans	-96.4	124.8	173.6	-63.9	177.1	0	0	0	108	Y797 R800 F802 L838 G840	Y797-L846 HydrophobicContact CD1-CD1 4.18Å; R800-L846 HydrophobicContact CB-CD1 4.19Å; F802-L846 HydrophobicContact CB-CB 4.32Å; F802-L846 HydrophobicContact CB-CD1 4.21Å; F802-L846 HydrophobicContact CD2-CB 4.46Å; L838-L846 HydrophobicContact CD2-CB 4.03Å; L838-L846 HydrophobicContact CD2-CD1 4.39Å; G840-L846 WeakPolarHBondContact O-CD2 3.41Å
847	V	64.3	Low	69.9	Low	95 Å²	95	50.5 Å²	50.5	58%	0.576	28%	0.275	S	S	*	.			trans	-114.2	122.1	175.2	-177.8	0	0	0	0	107.3
848	P	69.8	Low	68.4	Low	23 Å²	23	58 Å²	58	15%	0.149	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	143.1	171.9	29.1	-31.5	0	0	0	109.7	F802 Y850	F802-P848 HydrophobicContact CE2-CB 3.91Å; F802-P848 HydrophobicContact CE2-CG 3.95Å; F802-P848 HydrophobicContact CZ-CB 4.4Å; P848-Y850 HydrophobicContact CB-CE1 4.27Å; P848-Y850 HydrophobicContact CB-CE2 4.29Å; P848-Y850 HydrophobicContact CG-CE2 3.94Å
849	V	77.4	Confident	66.4	Low	13 Å²	13	61.1 Å²	61.1	8%	0.079	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.9	169.7	175.9	0	0	0	0	108.2	D818 F819 I837 V851	D818-V849 HydrophobicContact CB-CG1 4.16Å; D818-V849 WeakPolarHBondContact OD2-CA 3.34Å; F819-V849 HydrophobicContact CD2-CG1 3.58Å; F819-V849 HydrophobicContact CE2-CG1 3.61Å; I837-V849 PolarHBondContact N-O 2.99Å; I837-V849 PolarHBondContact O-N 2.93Å; V849-V851 HydrophobicContact CG1-CG2 4.11Å
850	Y	80.4	Confident	64.5	Low	6 Å²	6	67.3 Å²	67.3	2%	0.024	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	104.3	-174	-65.1	-64.9	0	0	0	110.9	F814 H816 D818 F819 A836 P848	F814-Y850 AromaticContact CD1-CD1 3.38Å; F814-Y850 HydrophobicContact CD1-CD1 3.38Å; F814-Y850 HydrophobicContact CD1-CE1 4.16Å; F814-Y850 HydrophobicContact CD1-CG 4.03Å; F814-Y850 AromaticContact CE1-CD1 3.68Å; F814-Y850 HydrophobicContact CE1-CD1 3.68Å; F814-Y850 HydrophobicContact CE1-CE1 4.42Å; F814-Y850 HydrophobicContact CG-CD1 4.16Å; H816-Y850 AromaticContact CD2-CD2 3.96Å; H816-Y850 AromaticContact CE1-CD2 3.96Å; H816-Y850 AromaticContact CE1-CE2 3.87Å; H816-Y850 AromaticContact NE2-CD2 3.71Å; H816-Y850 AromaticContact NE2-CE2 4Å; H816-Y850 VanDerWaalsContact O-CB 3.3Å; H816-Y850 WeakPolarHBondContact O-CB 3.37Å; D818-Y850 PolarHBondContact N-O 3.06Å; D818-Y850 PolarHBondContact OD2-N 3.33Å; F819-Y850 PolarHBondContact N-O 3.03Å; A836-Y850 HydrophobicContact CB-CD1 3.89Å; A836-Y850 HydrophobicContact CB-CE1 3.83Å; P848-Y850 HydrophobicContact CB-CE1 4.27Å; P848-Y850 HydrophobicContact CB-CE2 4.29Å; P848-Y850 HydrophobicContact CG-CE2 3.94Å
851	V	83.6	Confident	63.8	Low	1 Å²	1	73.3 Å²	73.3	1%	0.006	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.2	-178.1	-171.1	0	0	0	0	110.5	I756 F819 L835 I837 V849 V853	I756-V851 HydrophobicContact CD1-CG1 4.13Å; I756-V851 HydrophobicContact CG1-CG1 4.1Å; F819-V851 HydrophobicContact CB-CG1 4.21Å; F819-V851 HydrophobicContact CB-CG2 4.31Å; F819-V851 HydrophobicContact CD2-CG2 4.24Å; L835-V851 PolarHBondContact N-O 3.34Å; L835-V851 PolarHBondContact O-N 3.43Å; I837-V851 HydrophobicContact CD1-CG2 3.7Å; I837-V851 HydrophobicContact CG1-CG2 4.4Å; V849-V851 HydrophobicContact CG1-CG2 4.11Å; V851-V853 HydrophobicContact CG1-CG2 4.05Å
852	K	82.6	Confident	62.6	Low	14 Å²	14	74 Å²	74	6%	0.061	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.2	165.8	-179.9	168.2	-176.3	161.6	0	110.1	L817 F819 I820 T821 E832 Y834	L817-K852 HydrophobicContact CD1-CB 3.99Å; L817-K852 HydrophobicContact CD1-CD 4.06Å; L817-K852 HydrophobicContact CD2-CB 4.17Å; F819-K852 PolarHBondContact O-N 2.88Å; I820-K852 WeakPolarHBondContact CA-O 3.47Å; I820-K852 HydrophobicContact CG1-CB 4.38Å; T821-K852 PolarHBondContact N-O 2.88Å; E832-K852 WeakPolarHBondContact OE1-CE 3.46Å; E832-K852 IonicContact OE1-NZ 3.06Å; E832-K852 PolarHBondContact OE1-NZ 2.89Å; E832-K852 WeakPolarHBondContact OE2-CE 3.35Å; E832-K852 IonicContact OE2-NZ 3.45Å; E832-K852 PolarHBondContact OE2-NZ 3.23Å; Y834-K852 HydrophobicContact CD2-CD 4.41Å; Y834-K852 HydrophobicContact CD2-CG 4.23Å; Y834-K852 HydrophobicContact CE1-CD 4.23Å; Y834-K852 HydrophobicContact CE2-CD 3.69Å; Y834-K852 VanDerWaalsContact CE2-CE 3.45Å; Y834-K852 HydrophobicContact CE2-CG 4Å; Y834-K852 PolarHBondContact OH-NZ 3.48Å
853	V	83.6	Confident	61.9	Low	0 Å²	0	72 Å²	72	0%	0	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123	175.9	-166.4	0	0	0	0	109	I756 I776 T821 L823 L828 V833 V851	I756-V853 HydrophobicContact CD1-CG2 4.03Å; I756-V853 HydrophobicContact CG1-CG2 4.16Å; I776-V853 HydrophobicContact CD1-CG1 4.23Å; I776-V853 HydrophobicContact CD1-CG2 4.14Å; T821-V853 HydrophobicContact CG2-CG1 4.13Å; T821-V853 HydrophobicContact CG2-CG2 4.3Å; T821-V853 WeakPolarHBondContact O-CA 3.35Å; L823-V853 HydrophobicContact CB-CG1 3.71Å; L823-V853 HydrophobicContact CD2-CG1 4.46Å; L828-V853 HydrophobicContact CD1-CB 3.99Å; L828-V853 HydrophobicContact CD1-CG1 3.59Å; L828-V853 HydrophobicContact CD2-CG1 4.02Å; L828-V853 HydrophobicContact CG-CG1 4.46Å; V833-V853 PolarHBondContact N-O 3.22Å; V833-V853 PolarHBondContact O-N 3.47Å; V851-V853 HydrophobicContact CG1-CG2 4.05Å
854	R	79.9	Confident	61	Low	98 Å²	98	73.9 Å²	73.9	37%	0.37	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	144.8	176.2	-62.2	-162	174.1	111.9	-4.7	111.5	T821 I822 L823 E832	T821-R854 PolarHBondContact O-N 3.18Å; I822-R854 WeakPolarHBondContact CA-O 3.15Å; L823-R854 PolarHBondContact N-O 3.43Å; E832-R854 HydrophobicContact CG-CG 4.25Å; E832-R854 VanDerWaalsContact OE1-CD 3.23Å; E832-R854 WeakPolarHBondContact OE1-CD 3.41Å; E832-R854 VanDerWaalsContact OE1-CG 3.31Å; E832-R854 WeakPolarHBondContact OE1-CG 3.44Å; E832-R854 IonicContact OE1-CZ 2.66Å; E832-R854 IonicContact OE1-NE 2.99Å; E832-R854 PolarHBondContact OE1-NE 2.85Å
855	P	75.8	Confident	60.1	Low	29 Å²	29	68.8 Å²	68.8	19%	0.188	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	144.3	166.3	28.1	-31.9	0	0	0	109.1	K825 L828 A857	K825-P855 HydrophobicContact CG-CB 4.22Å; L828-P855 HydrophobicContact CD2-CB 4.02Å; L828-P855 HydrophobicContact CD2-CG 4.44Å; P855-A857 PolarHBondContact O-N 3.11Å
856	Q	73.6	Confident	59.7	Low	112 Å²	112	72.7 Å²	72.7	52%	0.523	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-64	120.6	170.5	-170.3	169.2	12.1	0	0	109.7	I822 L823 K825	I822-Q856 HydrophobicContact CG2-CB 3.87Å; I822-Q856 HydrophobicContact CG2-CG 4.3Å; L823-Q856 PolarHBondContact O-N 3.36Å; K825-Q856 WeakPolarHBondContact CE-O 3.47Å
857	A	56.1	Low	58.8	Low	93 Å²	93	82.4 Å²	82.4	77%	0.769	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-69.8	136.7	175.9	0	0	0	0	0	110.3	P855	P855-A857 PolarHBondContact O-N 3.11Å
858	E	53.1	Low	58	Low	162 Å²	162	80.4 Å²	80.4	76%	0.757	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-87.7	128.6	176.3	-75.8	175.8	112.4	0	0	110.5	K825	K825-E858 WeakPolarHBondContact CE-OE2 3.34Å; K825-E858 IonicContact NZ-OE2 3.26Å; K825-E858 PolarHBondContact NZ-OE2 3.16Å
859	G	36.3	Very low	57.7	Low	68 Å²	68	80.9 Å²	80.9	70%	0.701	49%	0.489	S	S	*	.			trans	-155.7	143.7	176.1	0	0	0	0	0	109.6
860	T	32.2	Very low	57.4	Low	143 Å²	143	83.6 Å²	83.6	88%	0.877	51%	0.506	S	S	*	.			trans	-48.4	138.3	-170.5	-49.4	0	0	0	0	113.3	G862	T860-G862 PolarHBondContact O-N 2.96Å
861	P	49.2	Very low	57.2	Low	131 Å²	131	83.3 Å²	83.3	85%	0.851	51%	0.505	S	S	*	.			trans	-76.1	126.3	-154.5	27.5	-36.5	0	0	0	115.4
862	G	33.8	Very low	56.6	Low	73 Å²	73	85 Å²	85	75%	0.753	52%	0.516	S	S	*	.			trans	-150	109.3	169.6	0	0	0	0	0	112.7	T860	T860-G862 PolarHBondContact O-N 2.96Å
863	S	37.8	Very low	56.1	Low	113 Å²	113	86.3 Å²	86.3	79%	0.79	52%	0.522	S	S	*	.	S	Bend	trans	55.9	77.7	165.8	-140.4	0	0	0	0	119.6
864	T	39.5	Very low	55.6	Low	89 Å²	89	89.2 Å²	89.2	55%	0.546	54%	0.541	S	S	.	.				57.7	102.9	128.9	59.8	0	0	0	0	121.5	V868	T864-V868 HydrophobicContact CG2-CG2 3.81Å
865	G	34.8	Very low	55.3	Low	88 Å²	88	92 Å²	92	91%	0.907	56%	0.557	S	S	*	*	S	Bend	trans	-91.8	-9.2	140.9	0	0	0	0	0	114.1
866	K	46.2	Very low	55.3	Low	161 Å²	161	91.5 Å²	91.5	70%	0.7	56%	0.556	S	S	*	*	S	Bend	trans	-72.5	128.9	171.5	-66.5	-175.4	179.4	-178.3	0	109	V868	K866-V868 PolarHBondContact O-N 3.17Å
867	R	44.2	Very low	55	Low	218 Å²	218	90.6 Å²	90.6	82%	0.823	56%	0.56	S	S	*	*			trans	-66.8	93.9	179.5	-72	-172.9	-178.8	173.6	4.3	110.9	S869	R867-S869 PolarHBondContact O-N 3.31Å; R867-S869 VanDerWaalsContact O-N 3.1Å; R867-S869 PolarHBondContact O-OG 3.38Å
868	V	47.5	Very low	55.9	Low	54 Å²	54	88.1 Å²	88.1	33%	0.327	53%	0.532	S	S	.	.			trans	-58.2	114.7	167.8	178	0	0	0	0	108	T864 K866 T870 P877 F878	T864-V868 HydrophobicContact CG2-CG2 3.81Å; K866-V868 PolarHBondContact O-N 3.17Å; V868-T870 PolarHBondContact O-N 3.45Å; V868-P877 HydrophobicContact CG1-CB 3.5Å; V868-P877 VanDerWaalsContact CG1-CB 3.5Å; V868-F878 CarbonylContact C-O 3.31Å; V868-F878 WeakPolarHBondContact CA-O 3.32Å
869	S	64.3	Low	56.5	Low	32 Å²	32	85.1 Å²	85.1	22%	0.224	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	102.2	-175.8	-63.9	0	0	0	0	108.4	R867 F878 Y884	R867-S869 PolarHBondContact O-N 3.31Å; R867-S869 VanDerWaalsContact O-N 3.1Å; R867-S869 PolarHBondContact O-OG 3.38Å; S869-F878 PolarHBondContact N-O 3.02Å; S869-F878 WeakPolarHBondContact O-CB 3.46Å; S869-F878 WeakPolarHBondContact O-CD2 3.37Å; S869-F878 PolarHBondContact O-N 3.05Å; S869-F878 VanDerWaalsContact O-N 3.11Å; S869-Y884 WeakPolarHBondContact O-CD2 3.29Å
870	T	70.6	Confident	57.9	Low	70 Å²	70	85.4 Å²	85.4	43%	0.429	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.8	-177.5	-54.6	0	0	0	0	111	V868 P872 F875 G876	V868-T870 PolarHBondContact O-N 3.45Å; T870-P872 WeakPolarHBondContact O-CD 3.44Å; T870-F875 HydrophobicContact CG2-CB 4.48Å; T870-F875 WeakPolarHBondContact CG2-O 3.42Å; T870-G876 WeakPolarHBondContact CA-O 3.26Å
871	C	77.1	Confident	59.9	Low	0 Å²	0	82.8 Å²	82.8	0%	0	50%	0.497	C	S	.	.			trans	-69.7	123.9	179.2	178.4	0	0	0	0	111.8	F873 F875 G876 F878 H887 H892	C871-F873 PolarHBondContact O-N 3.09Å; C871-F873 VanDerWaalsContact O-N 3.08Å; C871-F873 PolarHBondContact SG-N 3.33Å; C871-F873 VanDerWaalsContact SG-N 3.45Å; C871-F875 VanDerWaalsContact O-CA 3.23Å; C871-F875 WeakPolarHBondContact O-CA 3.15Å; C871-F875 PolarHBondContact O-N 2.85Å; C871-G876 PolarHBondContact N-O 2.65Å; C871-F878 HydrophobicContact CB-CE2 4.13Å; C871-H887 WeakPolarHBondContact CB-NE2 3.44Å; C871-H887 PolarHBondContact SG-NE2 2.82Å; C871-H892 VanDerWaalsContact SG-CD2 3.54Å
872	P	71.2	Confident	61.3	Low	37 Å²	37	84.2 Å²	84.2	24%	0.24	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-10.8	179.2	-23.4	35.2	0	0	0	115.4	T870 F907 L922	T870-P872 WeakPolarHBondContact O-CD 3.44Å; P872-F907 HydrophobicContact CG-CE2 4.4Å; P872-F907 HydrophobicContact CG-CZ 4Å; P872-L922 HydrophobicContact CB-CD1 4.17Å; P872-L922 HydrophobicContact CB-CD2 3.88Å
873	F	71.1	Confident	63.3	Low	42 Å²	42	82.5 Å²	82.5	18%	0.184	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-17.8	-172.1	-61.2	-87.8	0	0	0	114.1	C871 L888 H892 I894 F907 L922 I925	C871-F873 PolarHBondContact O-N 3.09Å; C871-F873 VanDerWaalsContact O-N 3.08Å; C871-F873 PolarHBondContact SG-N 3.33Å; C871-F873 VanDerWaalsContact SG-N 3.45Å; F873-L888 HydrophobicContact CD2-CD2 4.43Å; F873-H892 WeakPolarHBondContact CB-CE1 3.31Å; F873-H892 WeakPolarHBondContact CB-ND1 3.43Å; F873-I894 HydrophobicContact CD2-CD1 3.72Å; F873-I894 HydrophobicContact CE2-CD1 3.28Å; F873-I894 HydrophobicContact CZ-CD1 3.79Å; F873-F907 HydrophobicContact CE2-CD2 4.34Å; F873-F907 HydrophobicContact CE2-CE2 4.33Å; F873-F907 HydrophobicContact CE2-CZ 4.5Å; F873-F907 HydrophobicContact CZ-CD2 4.5Å; F873-L922 HydrophobicContact CD1-CD2 4.39Å; F873-L922 HydrophobicContact CE1-CD2 3.76Å; F873-L922 HydrophobicContact CE2-CD2 4.18Å; F873-L922 HydrophobicContact CZ-CD2 3.64Å; F873-I925 HydrophobicContact CE1-CB 4.15Å; F873-I925 HydrophobicContact CE1-CG2 3.9Å; F873-I925 HydrophobicContact CZ-CB 4.42Å; F873-I925 HydrophobicContact CZ-CD1 4.4Å; F873-I925 HydrophobicContact CZ-CG2 3.91Å
874	C	74.1	Confident	65.4	Low	60 Å²	60	78.9 Å²	78.9	41%	0.405	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	-1.6	175.3	73.3	0	0	0	0	114.3	G876 H887	C874-G876 PolarHBondContact O-N 2.87Å; C874-G876 VanDerWaalsContact O-N 3.09Å; C874-G876 PolarHBondContact SG-N 2.74Å; C874-G876 VanDerWaalsContact SG-N 3.41Å; C874-H887 PolarHBondContact SG-CE1 3.45Å; C874-H887 PolarHBondContact SG-NE2 3.2Å
875	F	73.4	Confident	67.4	Low	158 Å²	158	79 Å²	79	69%	0.693	44%	0.435	S	S	*	.			trans	58.9	14.6	-176.9	-52.2	-79.5	0	0	0	115.7	T870 C871	T870-F875 HydrophobicContact CG2-CB 4.48Å; T870-F875 WeakPolarHBondContact CG2-O 3.42Å; C871-F875 VanDerWaalsContact O-CA 3.23Å; C871-F875 WeakPolarHBondContact O-CA 3.15Å; C871-F875 PolarHBondContact O-N 2.85Å
876	G	74.4	Confident	69.6	Low	17 Å²	17	79 Å²	79	18%	0.175	41%	0.413	C	S	.	.			trans	-63.4	130.7	172.8	0	0	0	0	0	112.1	T870 C871 C874 F878	T870-G876 WeakPolarHBondContact CA-O 3.26Å; C871-G876 PolarHBondContact N-O 2.65Å; C874-G876 PolarHBondContact O-N 2.87Å; C874-G876 VanDerWaalsContact O-N 3.09Å; C874-G876 PolarHBondContact SG-N 2.74Å; C874-G876 VanDerWaalsContact SG-N 3.41Å; G876-F878 VanDerWaalsContact O-CD2 3.23Å; G876-F878 WeakPolarHBondContact O-CD2 3.5Å; G876-F878 WeakPolarHBondContact O-CE2 3.45Å
877	P	67.3	Low	71.3	Confident	93 Å²	93	72.4 Å²	72.4	60%	0.604	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	130.7	176.1	32.2	-31.9	0	0	0	111.8	V868	V868-P877 HydrophobicContact CG1-CB 3.5Å; V868-P877 VanDerWaalsContact CG1-CB 3.5Å
878	F	75.6	Confident	73.2	Confident	41 Å²	41	62 Å²	62	18%	0.18	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	129	179.1	-63.3	-86.5	0	0	0	111.8	V868 S869 C871 G876 A883 Y884 H887	V868-F878 CarbonylContact C-O 3.31Å; V868-F878 WeakPolarHBondContact CA-O 3.32Å; S869-F878 PolarHBondContact N-O 3.02Å; S869-F878 WeakPolarHBondContact O-CB 3.46Å; S869-F878 WeakPolarHBondContact O-CD2 3.37Å; S869-F878 PolarHBondContact O-N 3.05Å; S869-F878 VanDerWaalsContact O-N 3.11Å; C871-F878 HydrophobicContact CB-CE2 4.13Å; G876-F878 VanDerWaalsContact O-CD2 3.23Å; G876-F878 WeakPolarHBondContact O-CD2 3.5Å; G876-F878 WeakPolarHBondContact O-CE2 3.45Å; F878-A883 HydrophobicContact CD1-CB 4.19Å; F878-Y884 HydrophobicContact CB-CD2 4.36Å; F878-Y884 AromaticContact CD2-CD2 3.98Å; F878-Y884 HydrophobicContact CD2-CD2 3.98Å; F878-Y884 HydrophobicContact CG-CD2 4.42Å; F878-H887 HydrophobicContact CD1-CB 4.34Å; F878-H887 HydrophobicContact CE1-CB 3.67Å; F878-H887 AromaticContact CE1-CG 3.8Å; F878-H887 HydrophobicContact CE2-CB 4.16Å; F878-H887 AromaticContact CE2-CD2 3.38Å; F878-H887 WeakPolarHBondContact CE2-CD2 3.3Å; F878-H887 AromaticContact CE2-CG 3.6Å; F878-H887 AromaticContact CE2-NE2 3.81Å; F878-H887 HydrophobicContact CZ-CB 3.58Å; F878-H887 AromaticContact CZ-CD2 3.48Å; F878-H887 VanDerWaalsContact CZ-CD2 3.48Å; F878-H887 WeakPolarHBondContact CZ-CD2 3.49Å; F878-H887 AromaticContact CZ-CE1 3.89Å; F878-H887 AromaticContact CZ-CG 3.16Å; F878-H887 AromaticContact CZ-ND1 3.45Å; F878-H887 WeakPolarHBondContact CZ-ND1 3.44Å; F878-H887 AromaticContact CZ-NE2 3.92Å
879	V	66.2	Low	74.8	Confident	100 Å²	100	65.4 Å²	65.4	61%	0.606	36%	0.356	S	S	*	.	S	Bend	trans	-83.8	-21.2	-173.7	-177	0	0	0	0	112.7
880	T	65.1	Low	75.4	Confident	73 Å²	73	69.3 Å²	69.3	45%	0.448	37%	0.371	S	S	.	.	S	Bend	trans	-125	148.6	175.9	60.7	0	0	0	0	111.1	E882 A883 Y884	T880-E882 VanDerWaalsContact C-N 3.34Å; T880-E882 PolarHBondContact O-N 3.25Å; T880-A883 PolarHBondContact O-N 3.06Å; T880-A883 WeakPolarHBondContact OG1-CB 3.47Å; T880-A883 PolarHBondContact OG1-N 3.16Å; T880-Y884 PolarHBondContact O-N 3.36Å
881	T	75.3	Confident	75.7	Confident	89 Å²	89	74.8 Å²	74.8	55%	0.546	38%	0.383	S	S	.	.	H	α-helix	trans	-64.6	-38.3	179.3	-50.4	0	0	0	0	111.7	A883 Y884 E885	T881-A883 PolarHBondContact O-N 2.79Å; T881-Y884 WeakPolarHBondContact O-CB 3.38Å; T881-Y884 PolarHBondContact O-N 3.19Å; T881-E885 HydrophobicContact CG2-CG 4.42Å; T881-E885 WeakPolarHBondContact O-CG 3.22Å; T881-E885 PolarHBondContact O-N 3.05Å
882	E	77.3	Confident	75.8	Confident	160 Å²	160	76.6 Å²	76.6	75%	0.748	39%	0.392	S	S	*	.	H	α-helix	trans	-60.6	-44.7	177.2	-68.2	147.3	-139.1	0	0	112.3	T880 Y884 E885 L886	T880-E882 VanDerWaalsContact C-N 3.34Å; T880-E882 PolarHBondContact O-N 3.25Å; E882-Y884 VanDerWaalsContact C-N 3.33Å; E882-Y884 PolarHBondContact O-N 3.44Å; E882-E885 PolarHBondContact O-N 3.18Å; E882-L886 WeakPolarHBondContact O-CB 3.28Å; E882-L886 PolarHBondContact O-N 3.22Å
883	A	76.9	Confident	76.2	Confident	38 Å²	38	77.6 Å²	77.6	31%	0.314	39%	0.393	S	S	.	.	H	α-helix	trans	-67	-35.4	177	0	0	0	0	0	112.1	F878 T880 T881 H887	F878-A883 HydrophobicContact CD1-CB 4.19Å; T880-A883 PolarHBondContact O-N 3.06Å; T880-A883 WeakPolarHBondContact OG1-CB 3.47Å; T880-A883 PolarHBondContact OG1-N 3.16Å; T881-A883 PolarHBondContact O-N 2.79Å; A883-H887 WeakPolarHBondContact O-CB 3.43Å; A883-H887 PolarHBondContact O-N 3.2Å
884	Y	80.6	Confident	76.7	Confident	36 Å²	36	75.6 Å²	75.6	14%	0.141	38%	0.384	C	S	.	.	H	α-helix	trans	-64	-45.2	173.1	176.2	-102.6	0	0	0	112.1	S869 F878 T880 T881 E882 H887 L888	S869-Y884 WeakPolarHBondContact O-CD2 3.29Å; F878-Y884 HydrophobicContact CB-CD2 4.36Å; F878-Y884 AromaticContact CD2-CD2 3.98Å; F878-Y884 HydrophobicContact CD2-CD2 3.98Å; F878-Y884 HydrophobicContact CG-CD2 4.42Å; T880-Y884 PolarHBondContact O-N 3.36Å; T881-Y884 WeakPolarHBondContact O-CB 3.38Å; T881-Y884 PolarHBondContact O-N 3.19Å; E882-Y884 VanDerWaalsContact C-N 3.33Å; E882-Y884 PolarHBondContact O-N 3.44Å; Y884-H887 PolarHBondContact O-N 3.17Å; Y884-L888 HydrophobicContact CD1-CD1 3.92Å; Y884-L888 HydrophobicContact CE1-CD1 3.45Å; Y884-L888 VanDerWaalsContact CE1-CD1 3.45Å; Y884-L888 HydrophobicContact CE1-CG 4.48Å; Y884-L888 HydrophobicContact CE2-CD1 4.31Å; Y884-L888 WeakPolarHBondContact O-CG 2.95Å; Y884-L888 PolarHBondContact O-N 2.88Å
885	E	81.8	Confident	77.1	Confident	93 Å²	93	76.3 Å²	76.3	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-69.4	-41.7	179	-70.6	-168.4	176.9	0	0	112.5	T881 E882 L888 K889 P896	T881-E885 HydrophobicContact CG2-CG 4.42Å; T881-E885 WeakPolarHBondContact O-CG 3.22Å; T881-E885 PolarHBondContact O-N 3.05Å; E882-E885 PolarHBondContact O-N 3.18Å; E885-L888 PolarHBondContact O-N 3.44Å; E885-K889 VanDerWaalsContact O-CB 3.31Å; E885-K889 WeakPolarHBondContact O-CB 3.43Å; E885-K889 PolarHBondContact O-N 3.35Å; E885-P896 HydrophobicContact CG-CG 3.74Å
886	L	80.6	Confident	77.4	Confident	87 Å²	87	70.8 Å²	70.8	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-61.4	-45.6	173.8	-172.2	66.1	0	0	0	111.1	E882 L888 K889 E890	E882-L886 WeakPolarHBondContact O-CB 3.28Å; E882-L886 PolarHBondContact O-N 3.22Å; L886-L888 PolarHBondContact O-N 3.49Å; L886-K889 WeakPolarHBondContact O-CB 3.4Å; L886-K889 PolarHBondContact O-N 3.43Å; L886-E890 HydrophobicContact CD1-CG 4.24Å; L886-E890 WeakPolarHBondContact CD1-OE1 3.38Å; L886-E890 HydrophobicContact CG-CG 4.42Å; L886-E890 WeakPolarHBondContact O-CB 3.38Å; L886-E890 WeakPolarHBondContact O-CG 3.47Å; L886-E890 PolarHBondContact O-N 3.45Å
887	H	83.6	Confident	77.6	Confident	22 Å²	22	72.5 Å²	72.5	10%	0.102	37%	0.37	C	S	.	.	H	α-helix	trans	-58.4	-46.1	175.3	164.7	71.6	0	0	0	112.8	C871 C874 F878 A883 Y884 K889 E890 R891 H892	C871-H887 WeakPolarHBondContact CB-NE2 3.44Å; C871-H887 PolarHBondContact SG-NE2 2.82Å; C874-H887 PolarHBondContact SG-CE1 3.45Å; C874-H887 PolarHBondContact SG-NE2 3.2Å; F878-H887 HydrophobicContact CD1-CB 4.34Å; F878-H887 HydrophobicContact CE1-CB 3.67Å; F878-H887 AromaticContact CE1-CG 3.8Å; F878-H887 HydrophobicContact CE2-CB 4.16Å; F878-H887 AromaticContact CE2-CD2 3.38Å; F878-H887 WeakPolarHBondContact CE2-CD2 3.3Å; F878-H887 AromaticContact CE2-CG 3.6Å; F878-H887 AromaticContact CE2-NE2 3.81Å; F878-H887 HydrophobicContact CZ-CB 3.58Å; F878-H887 AromaticContact CZ-CD2 3.48Å; F878-H887 VanDerWaalsContact CZ-CD2 3.48Å; F878-H887 WeakPolarHBondContact CZ-CD2 3.49Å; F878-H887 AromaticContact CZ-CE1 3.89Å; F878-H887 AromaticContact CZ-CG 3.16Å; F878-H887 AromaticContact CZ-ND1 3.45Å; F878-H887 WeakPolarHBondContact CZ-ND1 3.44Å; F878-H887 AromaticContact CZ-NE2 3.92Å; A883-H887 WeakPolarHBondContact O-CB 3.43Å; A883-H887 PolarHBondContact O-N 3.2Å; Y884-H887 PolarHBondContact O-N 3.17Å; H887-K889 VanDerWaalsContact C-N 3.32Å; H887-K889 PolarHBondContact O-N 2.94Å; H887-E890 PolarHBondContact O-N 3.42Å; H887-R891 WeakPolarHBondContact ND1-CG 3.35Å; H887-R891 WeakPolarHBondContact O-CB 3.48Å; H887-R891 PolarHBondContact O-N 2.86Å; H887-H892 AromaticContact CE1-CD2 3.75Å; H887-H892 AromaticContact CE1-NE2 3.58Å; H887-H892 AromaticContact NE2-CD2 3.37Å; H887-H892 PolarHBondContact NE2-CD2 3.36Å; H887-H892 AromaticContact NE2-NE2 3.39Å; H887-H892 PolarHBondContact NE2-NE2 3.11Å
888	L	83.6	Confident	77.9	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61.8	-41	176.3	-75.1	175.6	0	0	0	111.6	F873 Y884 E885 L886 H892 H893 I894 P896 F907	F873-L888 HydrophobicContact CD2-CD2 4.43Å; Y884-L888 HydrophobicContact CD1-CD1 3.92Å; Y884-L888 HydrophobicContact CE1-CD1 3.45Å; Y884-L888 VanDerWaalsContact CE1-CD1 3.45Å; Y884-L888 HydrophobicContact CE1-CG 4.48Å; Y884-L888 HydrophobicContact CE2-CD1 4.31Å; Y884-L888 WeakPolarHBondContact O-CG 2.95Å; Y884-L888 PolarHBondContact O-N 2.88Å; E885-L888 PolarHBondContact O-N 3.44Å; L886-L888 PolarHBondContact O-N 3.49Å; L888-H892 CarbonylContact O-C 3.12Å; L888-H892 VanDerWaalsContact O-C 3.31Å; L888-H892 WeakPolarHBondContact O-CA 3.41Å; L888-H892 PolarHBondContact O-N 2.87Å; L888-H893 PolarHBondContact O-N 2.81Å; L888-I894 CarbonylContact C-O 3Å; L888-I894 HydrophobicContact CB-CG1 4.24Å; L888-I894 WeakPolarHBondContact CB-O 3.49Å; L888-I894 HydrophobicContact CD2-CD1 3.96Å; L888-I894 HydrophobicContact CD2-CG1 4.14Å; L888-I894 PolarHBondContact O-N 3.41Å; L888-I894 VanDerWaalsContact O-O 3.09Å; L888-P896 HydrophobicContact CD1-CG 4.42Å; L888-F907 HydrophobicContact CD1-CD1 4.46Å; L888-F907 HydrophobicContact CD1-CE1 3.96Å
889	K	81.1	Confident	77.8	Confident	126 Å²	126	72.7 Å²	72.7	55%	0.548	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-46.5	179	-172.6	-173.1	-179.3	-173.7	0	111.9	E885 L886 H887 H893 I894 I910	E885-K889 VanDerWaalsContact O-CB 3.31Å; E885-K889 WeakPolarHBondContact O-CB 3.43Å; E885-K889 PolarHBondContact O-N 3.35Å; L886-K889 WeakPolarHBondContact O-CB 3.4Å; L886-K889 PolarHBondContact O-N 3.43Å; H887-K889 VanDerWaalsContact C-N 3.32Å; H887-K889 PolarHBondContact O-N 2.94Å; K889-H893 WeakPolarHBondContact O-CA 3.43Å; K889-H893 PolarHBondContact O-N 3.37Å; K889-I894 WeakPolarHBondContact CA-O 3.45Å; K889-I894 PolarHBondContact N-O 3.22Å; K889-I910 HydrophobicContact CB-CD1 4.29Å; K889-I910 HydrophobicContact CG-CD1 3.69Å
890	E	77.4	Confident	77.7	Confident	114 Å²	114	74.3 Å²	74.3	53%	0.533	38%	0.379	S	S	.	.	H	α-helix	trans	-85.5	-47	-173.9	-67.5	179.1	171.7	0	0	113.9	L886 H887 H893	L886-E890 HydrophobicContact CD1-CG 4.24Å; L886-E890 WeakPolarHBondContact CD1-OE1 3.38Å; L886-E890 HydrophobicContact CG-CG 4.42Å; L886-E890 WeakPolarHBondContact O-CB 3.38Å; L886-E890 WeakPolarHBondContact O-CG 3.47Å; L886-E890 PolarHBondContact O-N 3.45Å; H887-E890 PolarHBondContact O-N 3.42Å; E890-H893 PolarHBondContact O-CE1 3.01Å; E890-H893 PolarHBondContact O-ND1 3.49Å
891	R	76.9	Confident	77.4	Confident	184 Å²	184	76.4 Å²	76.4	69%	0.694	39%	0.392	S	S	*	.	H	α-helix	trans	-84.3	-37.1	-175.9	-61.3	-57.7	-171.8	93	-1.4	112.2	H887	H887-R891 WeakPolarHBondContact ND1-CG 3.35Å; H887-R891 WeakPolarHBondContact O-CB 3.48Å; H887-R891 PolarHBondContact O-N 2.86Å
892	H	78.4	Confident	76.7	Confident	38 Å²	38	77 Å²	77	18%	0.176	39%	0.391	C	S	.	.	S	Bend	trans	-113	-2	-171.4	-61.9	-65.5	0	0	0	114.3	C871 F873 H887 L888 I894	C871-H892 VanDerWaalsContact SG-CD2 3.54Å; F873-H892 WeakPolarHBondContact CB-CE1 3.31Å; F873-H892 WeakPolarHBondContact CB-ND1 3.43Å; H887-H892 AromaticContact CE1-CD2 3.75Å; H887-H892 AromaticContact CE1-NE2 3.58Å; H887-H892 AromaticContact NE2-CD2 3.37Å; H887-H892 PolarHBondContact NE2-CD2 3.36Å; H887-H892 AromaticContact NE2-NE2 3.39Å; H887-H892 PolarHBondContact NE2-NE2 3.11Å; L888-H892 CarbonylContact O-C 3.12Å; L888-H892 VanDerWaalsContact O-C 3.31Å; L888-H892 WeakPolarHBondContact O-CA 3.41Å; L888-H892 PolarHBondContact O-N 2.87Å; H892-I894 HydrophobicContact CB-CD1 3.86Å; H892-I894 HydrophobicContact CB-CG1 3.72Å; H892-I894 PolarHBondContact O-N 3.06Å
893	H	80.3	Confident	76.4	Confident	58 Å²	58	77.9 Å²	77.9	27%	0.269	39%	0.393	S	S	.	.	S	Bend	trans	55.3	34	175.6	-62.5	63.9	0	0	0	113.2	L888 K889 E890 I910 H911	L888-H893 PolarHBondContact O-N 2.81Å; K889-H893 WeakPolarHBondContact O-CA 3.43Å; K889-H893 PolarHBondContact O-N 3.37Å; E890-H893 PolarHBondContact O-CE1 3.01Å; E890-H893 PolarHBondContact O-ND1 3.49Å; H893-I910 WeakPolarHBondContact O-CB 3.22Å; H893-I910 WeakPolarHBondContact O-CG1 3.43Å; H893-I910 PolarHBondContact O-N 3.25Å; H893-H911 AromaticContact CD2-CE1 3.75Å; H893-H911 AromaticContact CD2-NE2 3.27Å; H893-H911 PolarHBondContact CD2-NE2 3.08Å; H893-H911 VanDerWaalsContact CD2-NE2 3.27Å; H893-H911 AromaticContact CG-NE2 3.75Å
894	I	81.6	Confident	75.8	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	153.1	-179.6	52.3	-178.5	0	0	0	110.8	F873 L888 K889 H892 F907 K908 L929	F873-I894 HydrophobicContact CD2-CD1 3.72Å; F873-I894 HydrophobicContact CE2-CD1 3.28Å; F873-I894 HydrophobicContact CZ-CD1 3.79Å; L888-I894 CarbonylContact C-O 3Å; L888-I894 HydrophobicContact CB-CG1 4.24Å; L888-I894 WeakPolarHBondContact CB-O 3.49Å; L888-I894 HydrophobicContact CD2-CD1 3.96Å; L888-I894 HydrophobicContact CD2-CG1 4.14Å; L888-I894 PolarHBondContact O-N 3.41Å; L888-I894 VanDerWaalsContact O-O 3.09Å; K889-I894 WeakPolarHBondContact CA-O 3.45Å; K889-I894 PolarHBondContact N-O 3.22Å; H892-I894 HydrophobicContact CB-CD1 3.86Å; H892-I894 HydrophobicContact CB-CG1 3.72Å; H892-I894 PolarHBondContact O-N 3.06Å; I894-F907 HydrophobicContact CB-CB 4.47Å; I894-F907 HydrophobicContact CD1-CB 4.34Å; I894-F907 HydrophobicContact CD1-CD1 4.02Å; I894-F907 HydrophobicContact CD1-CG 4.24Å; I894-K908 CarbonylContact C-O 3.09Å; I894-K908 VanDerWaalsContact CA-O 3.25Å; I894-K908 WeakPolarHBondContact CA-O 3.45Å; I894-L929 HydrophobicContact CG2-CD1 3.79Å; I894-L929 HydrophobicContact CG2-CD2 3.59Å; I894-L929 HydrophobicContact CG2-CG 4.29Å
895	M	82.2	Confident	75.2	Confident	76 Å²	76	81.4 Å²	81.4	37%	0.374	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	144.4	167.7	61.1	-176.9	67.3	0	0	109.7	F907 K908 I910	M895-F907 WeakPolarHBondContact O-CA 3.38Å; M895-K908 HydrophobicContact CG-CB 3.8Å; M895-K908 HydrophobicContact CG-CD 4.33Å; M895-K908 HydrophobicContact CG-CG 4.4Å; M895-K908 PolarHBondContact N-O 2.78Å; M895-K908 PolarHBondContact O-N 3.17Å; M895-K908 HydrophobicContact SD-CD 3.94Å; M895-I910 HydrophobicContact CE-CG1 4.05Å
896	P	79	Confident	75	Confident	42 Å²	42	77.1 Å²	77.1	27%	0.273	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	149.1	168	29.3	-32.3	0	0	0	110.1	E885 L888	E885-P896 HydrophobicContact CG-CG 3.74Å; L888-P896 HydrophobicContact CD1-CG 4.42Å
897	T	78.3	Confident	75.2	Confident	53 Å²	53	74.7 Å²	74.7	33%	0.325	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	167.6	177.2	-160.5	0	0	0	0	110.5	A906 K908 V915	T897-A906 HydrophobicContact CG2-CB 4.01Å; T897-A906 PolarHBondContact N-O 3.24Å; T897-A906 PolarHBondContact O-N 3.16Å; T897-K908 HydrophobicContact CG2-CB 4.05Å; T897-V915 HydrophobicContact CG2-CG1 3.87Å; T897-V915 HydrophobicContact CG2-CG2 4.49Å
898	V	75.3	Confident	75.2	Confident	91 Å²	91	76.4 Å²	76.4	55%	0.552	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.5	172.9	179.2	0	0	0	0	108.5	T900 S904	V898-T900 PolarHBondContact O-N 3.14Å; V898-T900 VanDerWaalsContact O-N 3.12Å; V898-S904 WeakPolarHBondContact CA-O 3.33Å
899	H	72	Confident	75.3	Confident	46 Å²	46	76.4 Å²	76.4	21%	0.213	39%	0.391	C	S	.	.			trans	-66.3	116.2	-178.3	-178.8	-120.7	0	0	0	110.7	V901 L902 K903 S904 A906 T917	H899-V901 PolarHBondContact O-N 2.81Å; H899-L902 WeakPolarHBondContact ND1-CG 3.48Å; H899-L902 PolarHBondContact ND1-N 2.83Å; H899-L902 PolarHBondContact O-N 3.23Å; H899-L902 VanDerWaalsContact O-N 3.09Å; H899-K903 WeakPolarHBondContact O-CA 3.48Å; H899-K903 PolarHBondContact O-N 3.43Å; H899-S904 PolarHBondContact N-O 3.11Å; H899-A906 HydrophobicContact CB-CB 3.98Å; H899-T917 HydrophobicContact CB-CG2 3.65Å; H899-T917 VanDerWaalsContact CG-CG2 3.41Å
900	T	65.1	Low	75.4	Confident	134 Å²	134	73.4 Å²	73.4	82%	0.822	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.8	-166.4	56.7	0	0	0	0	114.9	V898	V898-T900 PolarHBondContact O-N 3.14Å; V898-T900 VanDerWaalsContact O-N 3.12Å
901	V	58.3	Low	75.4	Confident	118 Å²	118	72.3 Å²	72.3	72%	0.715	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-35.8	178.9	-175.5	0	0	0	0	112.8	H899	H899-V901 PolarHBondContact O-N 2.81Å
902	L	61.4	Low	75.5	Confident	101 Å²	101	66.4 Å²	66.4	53%	0.529	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-16	-174.5	-65.5	178.3	0	0	0	114.2	H899 S904 T917	H899-L902 WeakPolarHBondContact ND1-CG 3.48Å; H899-L902 PolarHBondContact ND1-N 2.83Å; H899-L902 PolarHBondContact O-N 3.23Å; H899-L902 VanDerWaalsContact O-N 3.09Å; L902-S904 PolarHBondContact O-N 3.39Å; L902-S904 VanDerWaalsContact O-N 3.09Å; L902-T917 HydrophobicContact CD1-CG2 4.03Å
903	K	69.3	Low	75.5	Confident	179 Å²	179	68.1 Å²	68.1	78%	0.778	38%	0.377	S	S	*	.			trans	55.4	14.7	-169.8	-60	-172	173.1	-167.5	0	115.1	H899	H899-K903 WeakPolarHBondContact O-CA 3.48Å; H899-K903 PolarHBondContact O-N 3.43Å
904	S	65.8	Low	75.5	Confident	34 Å²	34	66.5 Å²	66.5	24%	0.238	38%	0.376	C	S	.	.	S	Bend	trans	-81.2	155	173.7	64.3	0	0	0	0	111	V898 H899 L902	V898-S904 WeakPolarHBondContact CA-O 3.33Å; H899-S904 PolarHBondContact N-O 3.11Å; L902-S904 PolarHBondContact O-N 3.39Å; L902-S904 VanDerWaalsContact O-N 3.09Å
905	P	68.6	Low	75.5	Confident	113 Å²	113	69.4 Å²	69.4	73%	0.734	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.6	147.9	159.9	27.5	-34.6	0	0	0	110.2
906	A	77.1	Confident	75.2	Confident	4 Å²	4	66.9 Å²	66.9	3%	0.033	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	165.1	-176.5	0	0	0	0	0	109.6	T897 H899 V915 Y916 T917	T897-A906 HydrophobicContact CG2-CB 4.01Å; T897-A906 PolarHBondContact N-O 3.24Å; T897-A906 PolarHBondContact O-N 3.16Å; H899-A906 HydrophobicContact CB-CB 3.98Å; A906-V915 HydrophobicContact CB-CG1 3.71Å; A906-Y916 CarbonylContact C-O 3.57Å; A906-Y916 WeakPolarHBondContact CA-O 3.45Å; A906-Y916 WeakPolarHBondContact CB-O 3.5Å; A906-T917 HydrophobicContact CB-CG2 4.38Å
907	F	83.9	Confident	75	Confident	36 Å²	36	66.2 Å²	66.2	16%	0.158	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	135.9	174	-62.6	-75.7	0	0	0	110	P872 F873 L888 I894 M895 V915 Y916	P872-F907 HydrophobicContact CG-CE2 4.4Å; P872-F907 HydrophobicContact CG-CZ 4Å; F873-F907 HydrophobicContact CE2-CD2 4.34Å; F873-F907 HydrophobicContact CE2-CE2 4.33Å; F873-F907 HydrophobicContact CE2-CZ 4.5Å; F873-F907 HydrophobicContact CZ-CD2 4.5Å; L888-F907 HydrophobicContact CD1-CD1 4.46Å; L888-F907 HydrophobicContact CD1-CE1 3.96Å; I894-F907 HydrophobicContact CB-CB 4.47Å; I894-F907 HydrophobicContact CD1-CB 4.34Å; I894-F907 HydrophobicContact CD1-CD1 4.02Å; I894-F907 HydrophobicContact CD1-CG 4.24Å; M895-F907 WeakPolarHBondContact O-CA 3.38Å; F907-V915 CarbonylContact O-C 3.6Å; F907-V915 WeakPolarHBondContact O-CA 3.21Å; F907-Y916 HydrophobicContact CB-CD2 4.5Å; F907-Y916 PolarHBondContact N-O 3.44Å; F907-Y916 VanDerWaalsContact O-CD2 3.27Å; F907-Y916 WeakPolarHBondContact O-CD2 3.23Å; F907-Y916 PolarHBondContact O-N 3.4Å
908	K	82.9	Confident	74	Confident	58 Å²	58	67.3 Å²	67.3	25%	0.252	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.6	175.7	-179.3	-174.6	172.5	-163.7	0	109.7	I894 M895 T897 C913 G914 V915	I894-K908 CarbonylContact C-O 3.09Å; I894-K908 VanDerWaalsContact CA-O 3.25Å; I894-K908 WeakPolarHBondContact CA-O 3.45Å; M895-K908 HydrophobicContact CG-CB 3.8Å; M895-K908 HydrophobicContact CG-CD 4.33Å; M895-K908 HydrophobicContact CG-CG 4.4Å; M895-K908 PolarHBondContact N-O 2.78Å; M895-K908 PolarHBondContact O-N 3.17Å; M895-K908 HydrophobicContact SD-CD 3.94Å; T897-K908 HydrophobicContact CG2-CB 4.05Å; K908-C913 VanDerWaalsContact CE-CB 3.41Å; K908-C913 WeakPolarHBondContact CE-SG 3.42Å; K908-C913 PolarHBondContact NZ-SG 3.41Å; K908-C913 VanDerWaalsContact NZ-SG 3.37Å; K908-G914 CarbonylContact C-O 3.54Å; K908-G914 WeakPolarHBondContact CA-O 3.48Å; K908-V915 HydrophobicContact CB-CG2 4.18Å; K908-V915 HydrophobicContact CG-CG2 4.1Å
909	C	85.9	Confident	73	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.9	171	175.8	0	0	0	0	110.4	H911 C912 C913 G914 Y916 L929	C909-H911 VanDerWaalsContact C-N 3.34Å; C909-H911 PolarHBondContact SG-N 3.18Å; C909-H911 VanDerWaalsContact SG-N 3.4Å; C909-C912 VanDerWaalsContact CB-SG 3.58Å; C909-C912 VanDerWaalsContact SG-SG 3.6Å; C909-C913 WeakPolarHBondContact O-CA 3.37Å; C909-C913 PolarHBondContact O-N 2.99Å; C909-G914 PolarHBondContact N-O 3.09Å; C909-Y916 HydrophobicContact CB-CE2 3.92Å; C909-L929 HydrophobicContact CB-CD2 4.05Å
910	I	83.3	Confident	72.7	Confident	62 Å²	62	72.7 Å²	72.7	32%	0.318	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-34.5	179.3	-65	174.6	0	0	0	111	K889 H893 M895	K889-I910 HydrophobicContact CB-CD1 4.29Å; K889-I910 HydrophobicContact CG-CD1 3.69Å; H893-I910 WeakPolarHBondContact O-CB 3.22Å; H893-I910 WeakPolarHBondContact O-CG1 3.43Å; H893-I910 PolarHBondContact O-N 3.25Å; M895-I910 HydrophobicContact CE-CG1 4.05Å
911	H	78.6	Confident	72.8	Confident	92 Å²	92	70.7 Å²	70.7	43%	0.426	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-45.3	-174.9	-59.3	-63.3	0	0	0	114.2	H893 C909 C932	H893-H911 AromaticContact CD2-CE1 3.75Å; H893-H911 AromaticContact CD2-NE2 3.27Å; H893-H911 PolarHBondContact CD2-NE2 3.08Å; H893-H911 VanDerWaalsContact CD2-NE2 3.27Å; H893-H911 AromaticContact CG-NE2 3.75Å; C909-H911 VanDerWaalsContact C-N 3.34Å; C909-H911 PolarHBondContact SG-N 3.18Å; C909-H911 VanDerWaalsContact SG-N 3.4Å; H911-C932 VanDerWaalsContact CB-SG 3.56Å
912	C	77.7	Confident	73.3	Confident	60 Å²	60	69 Å²	69	41%	0.405	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-0.9	-176.7	68.4	0	0	0	0	114.7	C909 G914 H928	C909-C912 VanDerWaalsContact CB-SG 3.58Å; C909-C912 VanDerWaalsContact SG-SG 3.6Å; C912-G914 PolarHBondContact O-N 3.42Å; C912-G914 PolarHBondContact SG-N 2.81Å; C912-H928 VanDerWaalsContact SG-CE1 3.54Å; C912-H928 PolarHBondContact SG-NE2 2.76Å
913	C	79.1	Confident	73.6	Confident	73 Å²	73	67.4 Å²	67.4	49%	0.493	40%	0.398	S	S	.	.			trans	58	7	-170.9	-71.8	0	0	0	0	116.4	K908 C909	K908-C913 VanDerWaalsContact CE-CB 3.41Å; K908-C913 WeakPolarHBondContact CE-SG 3.42Å; K908-C913 PolarHBondContact NZ-SG 3.41Å; K908-C913 VanDerWaalsContact NZ-SG 3.37Å; C909-C913 WeakPolarHBondContact O-CA 3.37Å; C909-C913 PolarHBondContact O-N 2.99Å
914	G	79.8	Confident	73.7	Confident	24 Å²	24	60.7 Å²	60.7	25%	0.247	38%	0.376	C	S	.	.			trans	-63.3	141.5	176	0	0	0	0	0	112.8	K908 C909 C912 Y916	K908-G914 CarbonylContact C-O 3.54Å; K908-G914 WeakPolarHBondContact CA-O 3.48Å; C909-G914 PolarHBondContact N-O 3.09Å; C912-G914 PolarHBondContact O-N 3.42Å; C912-G914 PolarHBondContact SG-N 2.81Å; G914-Y916 WeakPolarHBondContact O-CE2 3.43Å
915	V	81.3	Confident	74	Confident	61 Å²	61	59.3 Å²	59.3	37%	0.37	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.9	-172.2	-178.4	0	0	0	0	111.3	T897 A906 F907 K908	T897-V915 HydrophobicContact CG2-CG1 3.87Å; T897-V915 HydrophobicContact CG2-CG2 4.49Å; A906-V915 HydrophobicContact CB-CG1 3.71Å; F907-V915 CarbonylContact O-C 3.6Å; F907-V915 WeakPolarHBondContact O-CA 3.21Å; K908-V915 HydrophobicContact CB-CG2 4.18Å; K908-V915 HydrophobicContact CG-CG2 4.1Å
916	Y	77.8	Confident	74.2	Confident	23 Å²	23	56 Å²	56	9%	0.09	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.8	-178.2	-47.2	-69.7	0	0	0	111	A906 F907 C909 G914 M920 I925 H928	A906-Y916 CarbonylContact C-O 3.57Å; A906-Y916 WeakPolarHBondContact CA-O 3.45Å; A906-Y916 WeakPolarHBondContact CB-O 3.5Å; F907-Y916 HydrophobicContact CB-CD2 4.5Å; F907-Y916 PolarHBondContact N-O 3.44Å; F907-Y916 VanDerWaalsContact O-CD2 3.27Å; F907-Y916 WeakPolarHBondContact O-CD2 3.23Å; F907-Y916 PolarHBondContact O-N 3.4Å; C909-Y916 HydrophobicContact CB-CE2 3.92Å; G914-Y916 WeakPolarHBondContact O-CE2 3.43Å; Y916-M920 HydrophobicContact CD1-CG 4.41Å; Y916-I925 HydrophobicContact CD1-CG1 4.04Å; Y916-I925 HydrophobicContact CD2-CG1 4.33Å; Y916-I925 HydrophobicContact CD2-CG2 3.79Å; Y916-I925 HydrophobicContact CE2-CG2 4.27Å; Y916-I925 HydrophobicContact CG-CB 4.47Å; Y916-I925 HydrophobicContact CG-CD1 4.03Å; Y916-I925 HydrophobicContact CG-CG1 3.73Å; Y916-I925 HydrophobicContact CG-CG2 4.08Å; Y916-H928 AromaticContact CZ-CD2 3.79Å; Y916-H928 PolarHBondContact OH-CD2 3Å; Y916-H928 PolarHBondContact OH-CE1 3.09Å; Y916-H928 PolarHBondContact OH-NE2 3.12Å
917	T	72.9	Confident	74.1	Confident	29 Å²	29	59.1 Å²	59.1	18%	0.178	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	158.5	174.4	54.4	0	0	0	0	110.8	H899 L902 A906 N919 M920	H899-T917 HydrophobicContact CB-CG2 3.65Å; H899-T917 VanDerWaalsContact CG-CG2 3.41Å; L902-T917 HydrophobicContact CD1-CG2 4.03Å; A906-T917 HydrophobicContact CB-CG2 4.38Å; T917-N919 PolarHBondContact O-N 2.94Å; T917-M920 WeakPolarHBondContact O-CB 3.21Å; T917-M920 PolarHBondContact O-N 2.84Å
918	G	57.4	Low	73.9	Confident	75 Å²	75	60.2 Å²	60.2	77%	0.773	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-1.2	-173.6	0	0	0	0	0	118.4	M920	G918-M920 VanDerWaalsContact C-N 3.34Å
919	N	56.1	Low	73.7	Confident	156 Å²	156	58.4 Å²	58.4	83%	0.834	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-12.5	168.8	-61	15.8	0	0	0	112.6	T917	T917-N919 PolarHBondContact O-N 2.94Å
920	M	64.6	Low	73.1	Confident	94 Å²	94	63 Å²	63	46%	0.463	39%	0.392	S	S	.	.	S	Bend	trans	-90.7	131.3	178	-166.3	69.9	71.6	0	0	109.7	Y916 T917 G918 A924 I925	Y916-M920 HydrophobicContact CD1-CG 4.41Å; T917-M920 WeakPolarHBondContact O-CB 3.21Å; T917-M920 PolarHBondContact O-N 2.84Å; G918-M920 VanDerWaalsContact C-N 3.34Å; M920-A924 HydrophobicContact CG-CB 4.11Å; M920-A924 HydrophobicContact SD-CB 3.93Å; M920-I925 HydrophobicContact CB-CD1 4.46Å; M920-I925 HydrophobicContact CB-CG1 4.37Å; M920-I925 HydrophobicContact CG-CD1 4.45Å; M920-I925 HydrophobicContact CG-CG1 3.84Å
921	T	67.1	Low	72.6	Confident	93 Å²	93	68.9 Å²	68.9	57%	0.571	41%	0.411	S	S	*	.			trans	-69.5	144.5	178.5	61.5	0	0	0	0	111.2	A923 A924 I925	T921-A923 PolarHBondContact O-N 2.82Å; T921-A923 VanDerWaalsContact O-N 3.17Å; T921-A924 WeakPolarHBondContact O-CB 3.22Å; T921-A924 PolarHBondContact O-N 2.95Å; T921-A924 WeakPolarHBondContact OG1-CB 3.42Å; T921-A924 PolarHBondContact OG1-N 3.47Å; T921-I925 PolarHBondContact O-N 3.31Å; T921-I925 VanDerWaalsContact O-N 3.13Å
922	L	69.9	Low	72.5	Confident	81 Å²	81	65.8 Å²	65.8	42%	0.424	40%	0.399	S	S	.	.	H	α-helix	trans	-56.5	-33.2	177.3	-67.3	167.9	0	0	0	111.9	P872 F873 I925 A926	P872-L922 HydrophobicContact CB-CD1 4.17Å; P872-L922 HydrophobicContact CB-CD2 3.88Å; F873-L922 HydrophobicContact CD1-CD2 4.39Å; F873-L922 HydrophobicContact CE1-CD2 3.76Å; F873-L922 HydrophobicContact CE2-CD2 4.18Å; F873-L922 HydrophobicContact CZ-CD2 3.64Å; L922-I925 HydrophobicContact CD2-CD1 4.49Å; L922-I925 PolarHBondContact O-N 3.19Å; L922-A926 WeakPolarHBondContact O-CB 3.35Å; L922-A926 PolarHBondContact O-N 3.36Å
923	A	66.8	Low	72.2	Confident	68 Å²	68	71.5 Å²	71.5	56%	0.562	41%	0.412	S	S	*	.	H	α-helix	trans	-62.2	-43.8	173	0	0	0	0	0	112.9	T921 I925 A926 V927	T921-A923 PolarHBondContact O-N 2.82Å; T921-A923 VanDerWaalsContact O-N 3.17Å; A923-I925 VanDerWaalsContact C-N 3.32Å; A923-I925 PolarHBondContact O-N 3.2Å; A923-A926 PolarHBondContact O-N 3Å; A923-V927 WeakPolarHBondContact O-CB 3.32Å; A923-V927 WeakPolarHBondContact O-CG2 3.42Å; A923-V927 PolarHBondContact O-N 3.45Å
924	A	70.6	Confident	71.1	Confident	39 Å²	39	72.6 Å²	72.6	32%	0.322	42%	0.42	S	S	.	.	H	α-helix	trans	-65.6	-35.6	176	0	0	0	0	0	112.1	M920 T921 H928	M920-A924 HydrophobicContact CG-CB 4.11Å; M920-A924 HydrophobicContact SD-CB 3.93Å; T921-A924 WeakPolarHBondContact O-CB 3.22Å; T921-A924 PolarHBondContact O-N 2.95Å; T921-A924 WeakPolarHBondContact OG1-CB 3.42Å; T921-A924 PolarHBondContact OG1-N 3.47Å; A924-H928 WeakPolarHBondContact O-CB 3.45Å; A924-H928 PolarHBondContact O-N 2.94Å
925	I	73	Confident	70	Confident	5 Å²	5	74.2 Å²	74.2	3%	0.026	43%	0.431	C	S	.	.	H	α-helix	trans	-66	-46	173.9	-56.8	172.3	0	0	0	110.4	F873 Y916 M920 T921 L922 A923 H928 L929	F873-I925 HydrophobicContact CE1-CB 4.15Å; F873-I925 HydrophobicContact CE1-CG2 3.9Å; F873-I925 HydrophobicContact CZ-CB 4.42Å; F873-I925 HydrophobicContact CZ-CD1 4.4Å; F873-I925 HydrophobicContact CZ-CG2 3.91Å; Y916-I925 HydrophobicContact CD1-CG1 4.04Å; Y916-I925 HydrophobicContact CD2-CG1 4.33Å; Y916-I925 HydrophobicContact CD2-CG2 3.79Å; Y916-I925 HydrophobicContact CE2-CG2 4.27Å; Y916-I925 HydrophobicContact CG-CB 4.47Å; Y916-I925 HydrophobicContact CG-CD1 4.03Å; Y916-I925 HydrophobicContact CG-CG1 3.73Å; Y916-I925 HydrophobicContact CG-CG2 4.08Å; M920-I925 HydrophobicContact CB-CD1 4.46Å; M920-I925 HydrophobicContact CB-CG1 4.37Å; M920-I925 HydrophobicContact CG-CD1 4.45Å; M920-I925 HydrophobicContact CG-CG1 3.84Å; T921-I925 PolarHBondContact O-N 3.31Å; T921-I925 VanDerWaalsContact O-N 3.13Å; L922-I925 HydrophobicContact CD2-CD1 4.49Å; L922-I925 PolarHBondContact O-N 3.19Å; A923-I925 VanDerWaalsContact C-N 3.32Å; A923-I925 PolarHBondContact O-N 3.2Å; I925-H928 WeakPolarHBondContact O-CB 3.35Å; I925-H928 PolarHBondContact O-N 2.9Å; I925-L929 HydrophobicContact CG2-CD1 3.89Å; I925-L929 HydrophobicContact CG2-CG 4.39Å; I925-L929 VanDerWaalsContact O-CG 3.3Å; I925-L929 WeakPolarHBondContact O-CG 3.37Å; I925-L929 PolarHBondContact O-N 3Å
926	A	71.9	Confident	68.1	Low	42 Å²	42	76.9 Å²	76.9	35%	0.347	45%	0.45	S	S	.	.	H	α-helix	trans	-61.3	-45.3	177	0	0	0	0	0	112.4	L922 A923 H928 L929 V930	L922-A926 WeakPolarHBondContact O-CB 3.35Å; L922-A926 PolarHBondContact O-N 3.36Å; A923-A926 PolarHBondContact O-N 3Å; A926-H928 VanDerWaalsContact C-N 3.31Å; A926-H928 PolarHBondContact O-N 3.24Å; A926-L929 PolarHBondContact O-N 3.11Å; A926-L929 VanDerWaalsContact O-N 3.16Å; A926-V930 WeakPolarHBondContact O-CG2 3.34Å; A926-V930 PolarHBondContact O-N 2.97Å
927	V	74.8	Confident	66.5	Low	70 Å²	70	84.6 Å²	84.6	42%	0.424	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-38.6	175.3	169.5	0	0	0	0	111.6	A923 R931	A923-V927 WeakPolarHBondContact O-CB 3.32Å; A923-V927 WeakPolarHBondContact O-CG2 3.42Å; A923-V927 PolarHBondContact O-N 3.45Å; V927-R931 WeakPolarHBondContact O-CB 3.32Å; V927-R931 WeakPolarHBondContact O-CG 3.27Å; V927-R931 PolarHBondContact O-N 3.49Å
928	H	79.9	Confident	64.5	Low	59 Å²	59	90.8 Å²	90.8	27%	0.273	52%	0.516	S	S	.	.	H	α-helix	trans	-61.9	-50.5	171.3	174.2	91.1	0	0	0	111.3	C912 Y916 A924 I925 A926 V930 R931 C932	C912-H928 VanDerWaalsContact SG-CE1 3.54Å; C912-H928 PolarHBondContact SG-NE2 2.76Å; Y916-H928 AromaticContact CZ-CD2 3.79Å; Y916-H928 PolarHBondContact OH-CD2 3Å; Y916-H928 PolarHBondContact OH-CE1 3.09Å; Y916-H928 PolarHBondContact OH-NE2 3.12Å; A924-H928 WeakPolarHBondContact O-CB 3.45Å; A924-H928 PolarHBondContact O-N 2.94Å; I925-H928 WeakPolarHBondContact O-CB 3.35Å; I925-H928 PolarHBondContact O-N 2.9Å; A926-H928 VanDerWaalsContact C-N 3.31Å; A926-H928 PolarHBondContact O-N 3.24Å; H928-V930 VanDerWaalsContact C-N 3.33Å; H928-V930 PolarHBondContact O-N 3.32Å; H928-R931 PolarHBondContact O-N 2.66Å; H928-C932 WeakPolarHBondContact NE2-CB 3.44Å; H928-C932 WeakPolarHBondContact O-CB 3.27Å; H928-C932 PolarHBondContact O-N 3.19Å
929	L	79.2	Confident	63.5	Low	20 Å²	20	92.5 Å²	92.5	11%	0.105	52%	0.516	C	S	.	.	H	α-helix	trans	-61.8	-40.2	-174.8	-70.4	165.6	0	0	0	112.1	I894 C909 I925 A926 R933	I894-L929 HydrophobicContact CG2-CD1 3.79Å; I894-L929 HydrophobicContact CG2-CD2 3.59Å; I894-L929 HydrophobicContact CG2-CG 4.29Å; C909-L929 HydrophobicContact CB-CD2 4.05Å; I925-L929 HydrophobicContact CG2-CD1 3.89Å; I925-L929 HydrophobicContact CG2-CG 4.39Å; I925-L929 VanDerWaalsContact O-CG 3.3Å; I925-L929 WeakPolarHBondContact O-CG 3.37Å; I925-L929 PolarHBondContact O-N 3Å; A926-L929 PolarHBondContact O-N 3.11Å; A926-L929 VanDerWaalsContact O-N 3.16Å; L929-R933 WeakPolarHBondContact O-CB 3.43Å; L929-R933 PolarHBondContact O-N 3.39Å
930	V	73.4	Confident	62.2	Low	97 Å²	97	90.2 Å²	90.2	59%	0.588	51%	0.513	S	S	*	.	H	α-helix	trans	-60.8	-52.5	172.9	173.3	0	0	0	0	110.7	A926 H928 C932 R933 S934	A926-V930 WeakPolarHBondContact O-CG2 3.34Å; A926-V930 PolarHBondContact O-N 2.97Å; H928-V930 VanDerWaalsContact C-N 3.33Å; H928-V930 PolarHBondContact O-N 3.32Å; V930-C932 VanDerWaalsContact C-N 3.32Å; V930-C932 PolarHBondContact O-N 2.71Å; V930-R933 PolarHBondContact O-N 2.93Å; V930-S934 PolarHBondContact O-N 3.11Å; V930-S934 VanDerWaalsContact O-N 3.1Å; V930-S934 PolarHBondContact O-OG 3.01Å
931	R	71.9	Confident	60.6	Low	186 Å²	186	91.3 Å²	91.3	70%	0.702	53%	0.529	S	S	*	.	H	α-helix	trans	-63.6	-35.8	-179.6	-70.3	174.7	-179.5	174.1	1.1	113	V927 H928 S934 A935	V927-R931 WeakPolarHBondContact O-CB 3.32Å; V927-R931 WeakPolarHBondContact O-CG 3.27Å; V927-R931 PolarHBondContact O-N 3.49Å; H928-R931 PolarHBondContact O-N 2.66Å; R931-S934 PolarHBondContact O-N 2.7Å; R931-A935 PolarHBondContact O-N 3.38Å
932	C	76.9	Confident	59	Low	27 Å²	27	94.2 Å²	94.2	18%	0.182	54%	0.542	C	S	.	.	H	α-helix	trans	-76.3	-22.7	179.7	-164.8	0	0	0	0	113	H911 H928 V930	H911-C932 VanDerWaalsContact CB-SG 3.56Å; H928-C932 WeakPolarHBondContact NE2-CB 3.44Å; H928-C932 WeakPolarHBondContact O-CB 3.27Å; H928-C932 PolarHBondContact O-N 3.19Å; V930-C932 VanDerWaalsContact C-N 3.32Å; V930-C932 PolarHBondContact O-N 2.71Å
933	R	72.4	Confident	57.3	Low	179 Å²	179	98.2 Å²	98.2	68%	0.675	56%	0.562	S	S	*	*	H	α-helix	trans	-79.3	-32	170.4	-175.2	178.7	178.1	-162.1	-0.6	112.2	L929 V930	L929-R933 WeakPolarHBondContact O-CB 3.43Å; L929-R933 PolarHBondContact O-N 3.39Å; V930-R933 PolarHBondContact O-N 2.93Å
934	S	55.4	Low	55.5	Low	96 Å²	96	103.3 Å²	103.3	67%	0.671	58%	0.575	S	S	*	*	S	Bend	trans	-89.5	5.6	179.1	-56.9	0	0	0	0	114.8	V930 R931	V930-S934 PolarHBondContact O-N 3.11Å; V930-S934 VanDerWaalsContact O-N 3.1Å; V930-S934 PolarHBondContact O-OG 3.01Å; R931-S934 PolarHBondContact O-N 2.7Å
935	A	56.6	Low	53.4	Low	58 Å²	58	107.9 Å²	107.9	48%	0.479	60%	0.598	S	S	.	*	S	Bend	trans	-77.2	133.4	177.1	0	0	0	0	0	110.9	R931	R931-A935 PolarHBondContact O-N 3.38Å
936	P	40.9	Very low	51.2	Low	117 Å²	117	115 Å²	115	76%	0.76	63%	0.631	S	S	*	*			trans	-55.4	144	168.8	-24.8	35.1	0	0	0	111.4
937	K	44.4	Very low	49.2	Very low	186 Å²	186	118.2 Å²	118.2	81%	0.809	65%	0.648	S	S	*	*			trans	-116.3	69.9	-168.2	-162.3	-172.8	-179.2	-164.8	0	111.5	S939	K937-S939 PolarHBondContact O-N 2.82Å; K937-S939 VanDerWaalsContact O-N 3.14Å; K937-S939 PolarHBondContact O-OG 3.19Å
938	D	31	Very low	46.9	Very low	159 Å²	159	122.2 Å²	122.2	85%	0.85	67%	0.668	S	S	*	*			trans	-63.4	112.8	175.5	-65.3	-46.6	0	0	0	110.4
939	S	36.9	Very low	44.4	Very low	110 Å²	110	129.3 Å²	129.3	77%	0.769	70%	0.698	S	S	*	*			trans	-89.6	129.1	-175.4	-63.7	0	0	0	0	111.2	K937	K937-S939 PolarHBondContact O-N 2.82Å; K937-S939 VanDerWaalsContact O-N 3.14Å; K937-S939 PolarHBondContact O-OG 3.19Å
940	S	28.7	Very low	42.3	Very low	109 Å²	109	135.3 Å²	135.3	76%	0.762	73%	0.728	S	S	*	*			trans	-149.8	150.3	158.9	58.5	0	0	0	0	111
941	S	31.5	Very low	40.2	Very low	116 Å²	116	138.2 Å²	138.2	81%	0.811	74%	0.736	S	S	*	*			trans	59.4	84.2	-176.8	56.1	0	0	0	0	116.7
942	D	32.6	Very low	38.1	Very low	155 Å²	155	135.7 Å²	135.7	83%	0.829	74%	0.736	S	S	*	*			trans	-63.9	125.1	150.8	-94.2	-62.3	0	0	0	110.5
943	L	34.3	Very low	35.6	Very low	164 Å²	164	139.5 Å²	139.5	86%	0.859	76%	0.763	S	S	*	*			trans	-136.7	98.2	151.1	-82.7	-178.4	0	0	0	107.6	V945	L943-V945 PolarHBondContact O-N 3.46Å
944	Q	29.8	Very low	33.4	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.822	77%	0.769	S	S	*	*			trans	-70.5	116.2	-177.6	-172.8	-176.5	92.3	0	0	110.5
945	V	26.1	Very low	31.9	Very low	134 Å²	134	141.4 Å²	141.4	81%	0.812	77%	0.773	S	S	*	*			trans	-128.9	104.9	164.8	179.4	0	0	0	0	107.3	L943	L943-V945 PolarHBondContact O-N 3.46Å
946	Q	26.4	Very low	30.4	Very low	156 Å²	156	145.5 Å²	145.5	73%	0.729	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77.9	151.6	166.7	-79.9	-78.2	31.2	0	0	110.1
947	P	31	Very low	29.7	Very low	108 Å²	108	147.4 Å²	147.4	70%	0.701	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-76.6	160.3	171.3	-10	27.6	0	0	0	112.8
948	D	26.3	Very low	28.9	Very low	155 Å²	155	145 Å²	145	83%	0.829	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.7	151.8	174.8	-50.3	-86.6	0	0	0	113.7
949	F	27	Very low	28.6	Very low	208 Å²	208	145.2 Å²	145.2	91%	0.912	79%	0.791	S	S	*	*			trans	-147.9	145.3	156.2	-123.4	-87.2	0	0	0	110.9
950	I	34.1	Very low	28.1	Very low	145 Å²	145	143.4 Å²	143.4	74%	0.744	79%	0.789	S	S	*	*			trans	-125.4	136.1	172.6	-62.7	176	0	0	0	104
951	Q	30.1	Very low	27.9	Very low	158 Å²	158	147.1 Å²	147.1	74%	0.738	80%	0.795	S	S	*	*				-180	135.2	83.3	-174.7	167.8	-6.9	0	0	112.8
952	N	26.9	Very low	27.6	Very low	134 Å²	134	146.6 Å²	146.6	72%	0.717	79%	0.786	S	S	*	*			trans	52.5	148.1	157.4	-53.6	-1.3	0	0	0	118.9
953	S	26.2	Very low	27.2	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	78%	0.78	S	S	*	*			cis	-156.1	158.7	30	-59.4	0	0	0	0	113.8
954	E	24.6	Very low	26.7	Very low	172 Å²	172	145.7 Å²	145.7	80%	0.804	78%	0.775	S	S	*	*			trans	44.8	133.1	149	-83.3	-172.2	123.6	0	0	126
955	L	25.2	Very low	26.3	Very low	143 Å²	143	143.2 Å²	143.2	75%	0.749	77%	0.768	S	S	*	*			trans	91.4	136.3	140	-74.5	169.8	0	0	0	123.8
956	L	25.3	Very low	26.1	Very low	144 Å²	144	140.8 Å²	140.8	75%	0.754	76%	0.757	S	S	*	*			trans	75.4	94.2	155	-66.1	168.5	0	0	0	123
957	L	25.9	Very low	26	Very low	157 Å²	157	137.5 Å²	137.5	82%	0.822	75%	0.751	S	S	*	*				44.3	151.2	120	-64.6	173.9	0	0	0	124.6
958	V	26.3	Very low	25.6	Very low	135 Å²	135	141.5 Å²	141.5	82%	0.818	76%	0.758	S	S	*	*			trans	113.5	141.8	150.5	-173.1	0	0	0	0	117.1
959	N	25.9	Very low	25.5	Very low	163 Å²	163	138.5 Å²	138.5	87%	0.872	75%	0.749	S	S	*	*			trans	-94.5	170.1	-176.6	-60.2	-22.7	0	0	0	113.3
960	G	27	Very low	25.4	Very low	72 Å²	72	134 Å²	134	74%	0.742	74%	0.738	S	S	*	*			trans	138.6	102	170.8	0	0	0	0	0	110.5
961	E	23	Very low	25	Very low	187 Å²	187	135.7 Å²	135.7	87%	0.874	74%	0.74	S	S	*	*				77.3	138.8	51	-122	-159.4	147.2	0	0	116
962	V	25.7	Very low	24.8	Very low	105 Å²	105	138.4 Å²	138.4	64%	0.636	74%	0.744	S	S	*	*			trans	82.7	102.2	149.6	167.9	0	0	0	0	121.6
963	I	23.6	Very low	24.7	Very low	136 Å²	136	141 Å²	141	70%	0.697	75%	0.749	S	S	*	*				74.4	121.5	123.8	-67.4	-177.3	0	0	0	122.6
964	H	24	Very low	24.7	Very low	165 Å²	165	143.1 Å²	143.1	76%	0.764	75%	0.751	S	S	*	*			trans	52.1	172.3	139.5	-72.9	-114.9	0	0	0	120.3
965	D	21.2	Very low	25.5	Very low	123 Å²	123	139.7 Å²	139.7	66%	0.658	74%	0.743	S	S	*	*			cis	-153.9	-179.9	12.3	-153.5	31.2	0	0	0	115.2
966	S	23.4	Very low	25.4	Very low	83 Å²	83	139.9 Å²	139.9	58%	0.58	75%	0.745	S	S	*	*			trans	44.8	123.3	145.9	-78.4	0	0	0	0	120.8
967	S	23.5	Very low	25.5	Very low	88 Å²	88	135.9 Å²	135.9	62%	0.615	74%	0.738	S	S	*	*			cis	97.1	167.4	42.4	78.4	0	0	0	0	114.7
968	F	23.1	Very low	25.4	Very low	191 Å²	191	137.2 Å²	137.2	84%	0.838	74%	0.74	S	S	*	*			trans	77.6	142.2	179.2	-63.2	-69.5	0	0	0	117
969	S	24.7	Very low	25.4	Very low	92 Å²	92	138.4 Å²	138.4	64%	0.643	74%	0.741	S	S	*	*			cis	-166.6	161.8	-5	52.2	0	0	0	0	116.2
970	V	24.5	Very low	25.4	Very low	113 Å²	113	134.4 Å²	134.4	69%	0.685	74%	0.738	S	S	*	*			trans	71.7	135	136.9	154	0	0	0	0	119.3
971	K	24.1	Very low	25.4	Very low	182 Å²	182	135.4 Å²	135.4	79%	0.791	74%	0.739	S	S	*	*			cis	-150.3	-154.6	-8.4	-101.3	165.4	-177.5	154.6	0	106.6
972	R	26.9	Very low	25.6	Very low	214 Å²	214	135.3 Å²	135.3	81%	0.808	74%	0.739	S	S	*	*			cis	-169	143	16	-158.9	-160.4	-70.2	104.4	-7.4	112.8
973	K	25.8	Very low	25.5	Very low	189 Å²	189	136.5 Å²	136.5	82%	0.822	74%	0.742	S	S	*	*			trans	74.4	144.7	153.2	-80.1	-101.7	-178.2	176.1	0	122.5
974	L	25.3	Very low	25.7	Very low	151 Å²	151	135.9 Å²	135.9	79%	0.791	74%	0.739	S	S	*	*			trans	-140.4	-173.3	168.3	-135.2	74.3	0	0	0	107.1
975	P	41.3	Very low	25.8	Very low	100 Å²	100	137.1 Å²	137.1	65%	0.649	74%	0.737	S	S	*	*			cis	-105	-155.4	28.4	45.4	-40.2	0	0	0	113.2
976	D	23.6	Very low	25.9	Very low	148 Å²	148	141 Å²	141	79%	0.791	74%	0.742	S	S	*	*			cis	-153.4	-174.4	13.6	-122.1	-48.2	0	0	0	110
977	G	26.4	Very low	26	Very low	59 Å²	59	140.2 Å²	140.2	61%	0.608	75%	0.748	S	S	*	*			cis	-177.9	-149.4	7.3	0	0	0	0	0	113.6
978	H	25.1	Very low	26	Very low	185 Å²	185	144.1 Å²	144.1	86%	0.856	76%	0.756	S	S	*	*			trans	-115.6	171.9	-173.2	-72.4	-101.5	0	0	0	113.9
979	L	25.6	Very low	26.1	Very low	161 Å²	161	144 Å²	144	84%	0.843	76%	0.759	S	S	*	*			cis	-136.9	153.5	17.2	-64.2	155.8	0	0	0	109.6
980	G	25	Very low	26.1	Very low	79 Å²	79	148.1 Å²	148.1	81%	0.814	77%	0.768	S	S	*	*				92.5	147	80.1	0	0	0	0	0	113.2
981	A	27.7	Very low	27.1	Very low	92 Å²	92	147.9 Å²	147.9	76%	0.76	77%	0.769	S	S	*	*			cis	-167.5	148.6	-11.7	0	0	0	0	0	112.5
982	E	26.5	Very low	28.1	Very low	185 Å²	185	144.1 Å²	144.1	86%	0.864	76%	0.763	S	S	*	*			trans	59.3	166.2	154.2	-24.3	-144.6	114	0	0	120.1
983	D	24.5	Very low	28.1	Very low	131 Å²	131	140.7 Å²	140.7	70%	0.701	76%	0.759	S	S	*	*			cis	-150.1	173.7	-3.4	-158	20.6	0	0	0	115.4
984	L	26.6	Very low	28.2	Very low	122 Å²	122	138.3 Å²	138.3	64%	0.639	75%	0.754	S	S	*	*			trans	-37.8	162.1	175.4	-112	64.2	0	0	0	125.1
985	R	27.6	Very low	28.5	Very low	191 Å²	191	137.7 Å²	137.7	72%	0.721	75%	0.752	S	S	*	*			trans	102.2	117.8	135.9	-69.5	-112.7	-109.9	-105.1	-7.4	124.8
986	R	23.2	Very low	28	Very low	204 Å²	204	136.9 Å²	136.9	77%	0.77	75%	0.753	S	S	*	*				64.6	128.3	116.5	-168.1	-163.9	-67.6	-83	4.3	123.2
987	G	25	Very low	28.4	Very low	68 Å²	68	137.3 Å²	137.3	70%	0.701	76%	0.756	S	S	*	*			trans	90.4	167.6	145.3	0	0	0	0	0	117
988	E	24.1	Very low	28.4	Very low	169 Å²	169	138.6 Å²	138.6	79%	0.79	76%	0.761	S	S	*	*			cis	-169.2	150.8	-32.5	-132.5	165.6	134.4	0	0	108.8
989	E	24.2	Very low	28.5	Very low	190 Å²	190	134.4 Å²	134.4	89%	0.888	76%	0.758	S	S	*	*			trans	57.1	177.9	164.6	-58.7	-154	107.5	0	0	122.7
990	Q	24	Very low	29.5	Very low	178 Å²	178	133.2 Å²	133.2	83%	0.832	76%	0.76	S	S	*	*			trans	-172.1	165.5	-161.8	171.7	174.3	8.7	0	0	109.6
991	P	46.5	Very low	29.5	Very low	108 Å²	108	132.9 Å²	132.9	70%	0.701	76%	0.757	S	S	*	*			cis	-110.9	-95.6	-9.1	25.5	-1.5	0	0	0	114.4
992	P	45.6	Very low	30.4	Very low	103 Å²	103	134.5 Å²	134.5	67%	0.669	76%	0.759	S	S	*	*			cis	-138.2	174.2	-23.2	41.7	-22.4	0	0	0	118.8
993	I	25.7	Very low	30.5	Very low	142 Å²	142	134.8 Å²	134.8	73%	0.728	76%	0.761	S	S	*	*			trans	78.1	110.7	141.9	-69.8	-97.7	0	0	0	124.3
994	L	29.3	Very low	30.7	Very low	138 Å²	138	137.2 Å²	137.2	72%	0.723	77%	0.765	S	S	*	*			trans	60.4	166.1	136	-53.7	179.9	0	0	0	123
995	N	30.2	Very low	30.8	Very low	138 Å²	138	137.4 Å²	137.4	74%	0.738	77%	0.771	S	S	*	*			cis	-161.6	171.2	5.5	-137.5	-7.1	0	0	0	117.2
996	A	32.1	Very low	30.8	Very low	83 Å²	83	134.5 Å²	134.5	69%	0.686	78%	0.775	S	S	*	*			trans	67.9	169.7	154.6	0	0	0	0	0	119.8
997	D	31.7	Very low	30.8	Very low	157 Å²	157	129.5 Å²	129.5	84%	0.84	77%	0.771	S	S	*	*			cis	-162.7	-166.1	-18.2	-131.6	-101.7	0	0	0	109.6
998	A	26.9	Very low	30.8	Very low	87 Å²	87	133 Å²	133	72%	0.719	78%	0.778	S	S	*	*			cis	-161.1	177.8	0	0	0	0	0	0	111.9
999	A	25.9	Very low	31.2	Very low	96 Å²	96	130.5 Å²	130.5	79%	0.793	77%	0.774	S	S	*	*			trans	-164.7	-170.8	172.4	0	0	0	0	0	112.1
1000	P	46.3	Very low	32	Very low	137 Å²	137	126.6 Å²	126.6	89%	0.89	77%	0.766	S	S	*	*			cis	-137.9	-161.3	-9.7	44.9	-25.2	0	0	0	115.7
1001	G	25.7	Very low	32.3	Very low	72 Å²	72	126.1 Å²	126.1	74%	0.742	76%	0.761	S	S	*	*			trans	166.3	144.9	164.6	0	0	0	0	0	118.2
1002	P	46.5	Very low	31.6	Very low	125 Å²	125	129.8 Å²	129.8	81%	0.812	77%	0.766	S	S	*	*			trans	-133.2	165.2	-172.8	43.5	-29.6	0	0	0	119.3
1003	E	28.7	Very low	30.9	Very low	191 Å²	191	136.4 Å²	136.4	89%	0.893	78%	0.778	S	S	*	*				179.2	-164.5	127.8	-92.8	-140.7	173.9	0	0	114.4
1004	K	29.6	Very low	31	Very low	182 Å²	182	138.5 Å²	138.5	79%	0.791	78%	0.784	S	S	*	*			trans	-131.7	147.3	-132.9	179.7	-171	-174.5	-178.6	0	115.5
1005	V	27.1	Very low	31.2	Very low	126 Å²	126	141.2 Å²	141.2	76%	0.764	79%	0.785	S	S	*	*			trans	162.9	138.3	135.6	156	0	0	0	0	115.2
1006	T	27.8	Very low	31	Very low	131 Å²	131	141.1 Å²	141.1	80%	0.804	79%	0.785	S	S	*	*			trans	-3.9	152.5	159.1	-50.1	0	0	0	0	121.2
1007	S	23	Very low	31.3	Very low	98 Å²	98	145.3 Å²	145.3	69%	0.685	79%	0.79	S	S	*	*			cis	169.9	155	-26	-171.4	0	0	0	0	109.5
1008	V	27	Very low	31.2	Very low	142 Å²	142	143.4 Å²	143.4	86%	0.861	79%	0.789	S	S	*	*			trans	179.8	157.1	144.5	146.6	0	0	0	0	110.2
1009	V	31.6	Very low	31.7	Very low	116 Å²	116	150.2 Å²	150.2	70%	0.703	80%	0.796	S	S	*	*			trans	-136.4	139.8	-161.8	168.9	0	0	0	0	107.6
1010	P	41	Very low	32	Very low	109 Å²	109	152.2 Å²	152.2	71%	0.708	80%	0.799	S	S	*	*				-156.3	154.5	81.3	41.4	-19.5	0	0	0	122.9
1011	F	29.5	Very low	31.6	Very low	168 Å²	168	154 Å²	154	74%	0.737	80%	0.795	S	S	*	*			trans	81.7	92.5	145.2	-77.3	-52.9	0	0	0	124.4
1012	K	31.9	Very low	31.9	Very low	184 Å²	184	153.4 Å²	153.4	80%	0.8	79%	0.788	S	S	*	*				60.8	101.8	127.1	-82.2	177.6	-174.1	171	0	119.8
1013	R	32	Very low	31.6	Very low	243 Å²	243	153 Å²	153	92%	0.917	79%	0.786	S	S	*	*				-152.8	148.3	119.5	-119.1	175.9	-178.6	169.7	1.3	110.3
1014	Q	27.8	Very low	32.3	Very low	186 Å²	186	152 Å²	152	87%	0.869	79%	0.785	S	S	*	*			trans	67.6	152	166.8	-158.9	165.8	-46.5	0	0	114.8
1015	R	33.4	Very low	33	Very low	195 Å²	195	146 Å²	146	74%	0.736	76%	0.763	S	S	*	*			cis	-179.4	130	-35.6	168.1	-151.9	170.5	163.1	0	105.8
1016	N	25.3	Very low	34	Very low	136 Å²	136	147.9 Å²	147.9	73%	0.727	76%	0.761	S	S	*	*			trans	175.6	164.1	134.8	-94.1	-7.4	0	0	0	113.1
1017	E	37.8	Very low	35.1	Very low	171 Å²	171	146.4 Å²	146.4	80%	0.799	75%	0.749	S	S	*	*			trans	-77	151.3	177.1	-64	136.3	104.3	0	0	112.1
1018	S	30.1	Very low	36.4	Very low	116 Å²	116	149.1 Å²	149.1	81%	0.811	75%	0.75	S	S	*	*			trans	-122.9	144.4	156.5	46.4	0	0	0	0	108.5
1019	R	38.8	Very low	37.6	Very low	230 Å²	230	143.6 Å²	143.6	87%	0.868	72%	0.72	S	S	*	*			trans	-66.2	147.9	-175.5	-75.9	175.7	168.6	174.2	-5.2	111.5
1020	T	31.3	Very low	38.8	Very low	139 Å²	139	139.3 Å²	139.3	85%	0.853	69%	0.693	S	S	*	*			trans	-133.6	135	146.9	-52.2	0	0	0	0	106.5
1021	E	38.5	Very low	39.5	Very low	175 Å²	175	142.4 Å²	142.4	82%	0.818	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-76.5	137.5	-167.5	-66.3	172.1	125.3	0	0	112
1022	G	31.2	Very low	41.1	Very low	58 Å²	58	138.8 Å²	138.8	60%	0.598	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-88.6	142.1	175	0	0	0	0	0	111.2
1023	P	40.4	Very low	42.7	Very low	118 Å²	118	130.8 Å²	130.8	77%	0.766	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-67.6	148.5	-174.2	-20.5	32.9	0	0	0	113.9	V1025	P1023-V1025 PolarHBondContact O-N 2.8Å; P1023-V1025 VanDerWaalsContact O-N 3.14Å
1024	I	44.1	Very low	44.3	Very low	168 Å²	168	120.7 Å²	120.7	86%	0.862	62%	0.62	S	S	*	*			trans	-62.2	112.9	170.2	-59.9	172.7	0	0	0	109	K1026	I1024-K1026 PolarHBondContact O-N 2.88Å
1025	V	43.8	Very low	46.3	Very low	57 Å²	57	113.9 Å²	113.9	35%	0.345	59%	0.589	S	S	.	*			trans	-78.6	111.2	179.2	178.5	0	0	0	0	109.4	P1023 A1029 L1030 L1069	P1023-V1025 PolarHBondContact O-N 2.8Å; P1023-V1025 VanDerWaalsContact O-N 3.14Å; V1025-A1029 HydrophobicContact CG1-CB 3.81Å; V1025-L1030 HydrophobicContact CG1-CD2 4.18Å; V1025-L1069 HydrophobicContact CG1-CD1 3.92Å; V1025-L1069 HydrophobicContact CG2-CD1 4.47Å
1026	K	46.7	Very low	47.8	Very low	165 Å²	165	108.5 Å²	108.5	72%	0.717	58%	0.575	S	S	*	*			trans	-62.6	144.8	174.1	-73.9	-173	173.2	-174.1	0	111.5	I1024 E1028 A1029	I1024-K1026 PolarHBondContact O-N 2.88Å; K1026-E1028 PolarHBondContact O-N 3.15Å; K1026-E1028 VanDerWaalsContact O-N 3.11Å; K1026-A1029 WeakPolarHBondContact O-CB 3.21Å; K1026-A1029 PolarHBondContact O-N 2.8Å
1027	D	51.7	Low	49.5	Very low	101 Å²	101	102.2 Å²	102.2	54%	0.54	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-55.2	-32.9	-172.7	-132.1	-45.3	0	0	0	113.9	A1029 L1030 K1038	D1027-A1029 PolarHBondContact O-N 3.32Å; D1027-L1030 VanDerWaalsContact O-CB 3.32Å; D1027-L1030 WeakPolarHBondContact O-CB 3.37Å; D1027-L1030 PolarHBondContact O-N 2.92Å; D1027-K1038 IonicContact OD1-NZ 3.35Å; D1027-K1038 PolarHBondContact OD1-NZ 3.4Å; D1027-K1038 IonicContact OD2-NZ 3.16Å; D1027-K1038 PolarHBondContact OD2-NZ 2.89Å
1028	E	49.9	Very low	50.6	Low	154 Å²	154	99 Å²	99	72%	0.72	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-57.5	-31.6	176.7	-61.5	-175.7	148.2	0	0	113.5	K1026 L1030 Q1031	K1026-E1028 PolarHBondContact O-N 3.15Å; K1026-E1028 VanDerWaalsContact O-N 3.11Å; E1028-L1030 PolarHBondContact O-N 3.31Å; E1028-Q1031 PolarHBondContact O-N 2.89Å
1029	A	52.7	Low	51.8	Low	27 Å²	27	101.3 Å²	101.3	22%	0.223	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-67.5	-25.1	177.3	0	0	0	0	0	112.4	V1025 K1026 D1027 Q1031 I1032 L1069	V1025-A1029 HydrophobicContact CG1-CB 3.81Å; K1026-A1029 WeakPolarHBondContact O-CB 3.21Å; K1026-A1029 PolarHBondContact O-N 2.8Å; D1027-A1029 PolarHBondContact O-N 3.32Å; A1029-Q1031 VanDerWaalsContact C-N 3.3Å; A1029-Q1031 PolarHBondContact O-N 3.08Å; A1029-I1032 WeakPolarHBondContact O-CB 3.43Å; A1029-I1032 PolarHBondContact O-N 3.25Å; A1029-L1069 HydrophobicContact CB-CD1 4.18Å; A1029-L1069 HydrophobicContact CB-CD2 4.17Å; A1029-L1069 WeakPolarHBondContact O-CD2 3.5Å
1030	L	56.8	Low	52.6	Low	26 Å²	26	94 Å²	94	14%	0.136	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-72	-24.6	-178.8	-54.3	-173.4	0	0	0	112.3	V1025 D1027 E1028 I1032 L1033 P1037 K1038 L1073	V1025-L1030 HydrophobicContact CG1-CD2 4.18Å; D1027-L1030 VanDerWaalsContact O-CB 3.32Å; D1027-L1030 WeakPolarHBondContact O-CB 3.37Å; D1027-L1030 PolarHBondContact O-N 2.92Å; E1028-L1030 PolarHBondContact O-N 3.31Å; L1030-I1032 PolarHBondContact O-N 3.08Å; L1030-L1033 HydrophobicContact CD2-CD1 4.44Å; L1030-L1033 WeakPolarHBondContact O-CB 3.16Å; L1030-L1033 PolarHBondContact O-N 3.42Å; L1030-L1033 VanDerWaalsContact O-N 3.09Å; L1030-P1037 HydrophobicContact CD1-CG 4.35Å; L1030-P1037 HydrophobicContact CD2-CG 3.87Å; L1030-K1038 HydrophobicContact CD1-CD 4.37Å; L1030-K1038 HydrophobicContact CD1-CG 4.38Å; L1030-L1073 HydrophobicContact CD2-CD1 4.32Å; L1030-L1073 HydrophobicContact CD2-CD2 4.33Å
1031	Q	56.7	Low	53.7	Low	173 Å²	173	94 Å²	94	81%	0.808	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-64	-17.8	174.4	-62.9	-173.2	-1.6	0	0	113.5	E1028 A1029 L1033	E1028-Q1031 PolarHBondContact O-N 2.89Å; A1029-Q1031 VanDerWaalsContact C-N 3.3Å; A1029-Q1031 PolarHBondContact O-N 3.08Å; Q1031-L1033 VanDerWaalsContact C-N 3.27Å
1032	I	62.2	Low	54.6	Low	92 Å²	92	89.6 Å²	89.6	47%	0.472	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-76.4	-18.2	177.6	-55.4	176.4	0	0	0	111.3	A1029 L1030 E1066	A1029-I1032 WeakPolarHBondContact O-CB 3.43Å; A1029-I1032 PolarHBondContact O-N 3.25Å; L1030-I1032 PolarHBondContact O-N 3.08Å; I1032-E1066 HydrophobicContact CG2-CG 4.1Å
1033	L	65.8	Low	56	Low	16 Å²	16	93 Å²	93	8%	0.084	48%	0.48	C	S	.	.	S	Bend	trans	-88.1	138.3	-176.7	-65	177	0	0	0	112.5	L1030 Q1031 L1035 P1037 Y1055 E1066 L1069 L1070 L1073	L1030-L1033 HydrophobicContact CD2-CD1 4.44Å; L1030-L1033 WeakPolarHBondContact O-CB 3.16Å; L1030-L1033 PolarHBondContact O-N 3.42Å; L1030-L1033 VanDerWaalsContact O-N 3.09Å; Q1031-L1033 VanDerWaalsContact C-N 3.27Å; L1033-L1035 WeakPolarHBondContact CB-O 3.37Å; L1033-L1035 PolarHBondContact O-N 3.35Å; L1033-L1035 VanDerWaalsContact O-N 3.16Å; L1033-P1037 HydrophobicContact CD1-CG 4.19Å; L1033-Y1055 WeakPolarHBondContact CA-OH 3.41Å; L1033-Y1055 HydrophobicContact CB-CE2 4.06Å; L1033-Y1055 HydrophobicContact CD2-CE2 3.93Å; L1033-E1066 HydrophobicContact CD2-CB 4.49Å; L1033-E1066 HydrophobicContact CD2-CG 4.41Å; L1033-L1069 HydrophobicContact CD1-CD2 3.96Å; L1033-L1069 HydrophobicContact CD2-CD2 4.15Å; L1033-L1069 HydrophobicContact CG-CD2 3.91Å; L1033-L1070 HydrophobicContact CD2-CD2 4.1Å; L1033-L1070 HydrophobicContact CD2-CG 4.08Å; L1033-L1073 HydrophobicContact CD1-CD1 3.47Å; L1033-L1073 VanDerWaalsContact CD1-CD1 3.47Å
1034	A	64.7	Low	57.3	Low	32 Å²	32	90.2 Å²	90.2	26%	0.264	46%	0.464	S	S	.	.	S	Bend	trans	-70.4	-6.6	176.8	0	0	0	0	0	114.6	Y1055 K1058 K1059	A1034-Y1055 HydrophobicContact CB-CE1 4.41Å; A1034-Y1055 HydrophobicContact CB-CE2 4.03Å; A1034-Y1055 PolarHBondContact N-OH 3.45Å; A1034-K1058 HydrophobicContact CB-CB 4.26Å; A1034-K1058 VanDerWaalsContact O-CD 3.32Å; A1034-K1058 WeakPolarHBondContact O-CD 3.27Å; A1034-K1059 HydrophobicContact CB-CB 4.11Å; A1034-K1059 HydrophobicContact CB-CD 4.26Å
1035	L	69.6	Low	58.4	Low	42 Å²	42	89.5 Å²	89.5	22%	0.22	45%	0.451	C	S	.	.	S	Bend	trans	-147.7	136.4	177.3	-69	177.1	0	0	0	109.4	L1033 F1051 D1054 Y1055 K1058	L1033-L1035 WeakPolarHBondContact CB-O 3.37Å; L1033-L1035 PolarHBondContact O-N 3.35Å; L1033-L1035 VanDerWaalsContact O-N 3.16Å; L1035-F1051 HydrophobicContact CB-CE2 3.87Å; L1035-F1051 HydrophobicContact CB-CZ 3.73Å; L1035-F1051 HydrophobicContact CD1-CE2 4.39Å; L1035-F1051 HydrophobicContact CD1-CZ 4.49Å; L1035-D1054 HydrophobicContact CD1-CB 4.27Å; L1035-Y1055 HydrophobicContact CB-CD2 4.21Å; L1035-Y1055 HydrophobicContact CD1-CD2 4.43Å; L1035-Y1055 HydrophobicContact CG-CD2 4.46Å; L1035-K1058 HydrophobicContact CD2-CD 3.71Å; L1035-K1058 HydrophobicContact CG-CD 4.18Å
1036	D	65.6	Low	59.7	Low	82 Å²	82	91.7 Å²	91.7	44%	0.439	46%	0.457	S	S	.	.			trans	-67.4	122.5	173.3	171.4	21.2	0	0	0	111.2	K1038	D1036-K1038 VanDerWaalsContact OD1-CB 3.27Å; D1036-K1038 WeakPolarHBondContact OD1-CB 3.27Å; D1036-K1038 WeakPolarHBondContact OD1-CG 3.27Å; D1036-K1038 PolarHBondContact OD1-N 3.1Å
1037	P	62.2	Low	60.9	Low	5 Å²	5	86.4 Å²	86.4	3%	0.032	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-78.6	-14.6	178.8	32.8	-35.8	0	0	0	114.3	L1030 L1033 K1039 Y1040 F1051 L1073	L1030-P1037 HydrophobicContact CD1-CG 4.35Å; L1030-P1037 HydrophobicContact CD2-CG 3.87Å; L1033-P1037 HydrophobicContact CD1-CG 4.19Å; P1037-K1039 PolarHBondContact O-N 3.43Å; P1037-Y1040 PolarHBondContact O-N 3.02Å; P1037-F1051 HydrophobicContact CB-CZ 4.47Å; P1037-L1073 HydrophobicContact CB-CD1 4.06Å; P1037-L1073 HydrophobicContact CB-CD2 4.19Å; P1037-L1073 HydrophobicContact CG-CD1 3.85Å; P1037-L1073 HydrophobicContact CG-CD2 3.97Å
1038	K	59.4	Low	62.1	Low	103 Å²	103	84 Å²	84	45%	0.448	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-59.6	-11	-172.4	-71.1	172.4	166.2	170.6	0	114.9	D1027 L1030 D1036	D1027-K1038 IonicContact OD1-NZ 3.35Å; D1027-K1038 PolarHBondContact OD1-NZ 3.4Å; D1027-K1038 IonicContact OD2-NZ 3.16Å; D1027-K1038 PolarHBondContact OD2-NZ 2.89Å; L1030-K1038 HydrophobicContact CD1-CD 4.37Å; L1030-K1038 HydrophobicContact CD1-CG 4.38Å; D1036-K1038 VanDerWaalsContact OD1-CB 3.27Å; D1036-K1038 WeakPolarHBondContact OD1-CB 3.27Å; D1036-K1038 WeakPolarHBondContact OD1-CG 3.27Å; D1036-K1038 PolarHBondContact OD1-N 3.1Å
1039	K	56.4	Low	63.4	Low	164 Å²	164	80.3 Å²	80.3	71%	0.713	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-90	-4.6	174	-61.1	-170.5	180	-173.6	0	115.1	P1037	P1037-K1039 PolarHBondContact O-N 3.43Å
1040	Y	55.8	Low	64.6	Low	78 Å²	78	82.3 Å²	82.3	31%	0.306	41%	0.407	S	S	.	.	S	Bend	trans	-130	4.6	-172.4	-66.5	-84.7	0	0	0	114.3	P1037 R1043 F1051	P1037-Y1040 PolarHBondContact O-N 3.02Å; Y1040-R1043 PolarHBondContact O-N 2.96Å; Y1040-F1051 AromaticContact CD2-CD2 3.51Å; Y1040-F1051 HydrophobicContact CD2-CD2 3.51Å; Y1040-F1051 HydrophobicContact CD2-CE2 4.1Å; Y1040-F1051 AromaticContact CE2-CD2 3.89Å; Y1040-F1051 HydrophobicContact CE2-CD2 3.89Å; Y1040-F1051 HydrophobicContact CG-CB 4.5Å; Y1040-F1051 HydrophobicContact CG-CD2 4.04Å
1041	E	53.4	Low	66	Low	137 Å²	137	81.3 Å²	81.3	64%	0.64	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	132.5	173.1	-148.1	137.5	-133	0	0	109.7	R1043	E1041-R1043 PolarHBondContact O-N 2.84Å
1042	G	56.9	Low	67.2	Low	83 Å²	83	73.7 Å²	73.7	86%	0.856	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	3.8	-176.1	0	0	0	0	0	117.4
1043	R	60.6	Low	68.3	Low	130 Å²	130	72 Å²	72	49%	0.491	36%	0.355	S	S	.	.			trans	-94.6	164.5	-174.8	-66.3	-73.8	-83.4	-94.9	-2.7	114.7	Y1040 E1041 E1047 K1048	Y1040-R1043 PolarHBondContact O-N 2.96Å; E1041-R1043 PolarHBondContact O-N 2.84Å; R1043-E1047 HydrophobicContact CB-CB 4.12Å; R1043-E1047 IonicContact CZ-OE1 2.81Å; R1043-E1047 VanDerWaalsContact NE-CD 3.34Å; R1043-E1047 IonicContact NE-OE1 2.61Å; R1043-E1047 PolarHBondContact NE-OE1 3.18Å; R1043-E1047 IonicContact NE-OE2 2.86Å; R1043-E1047 PolarHBondContact NE-OE2 2.74Å; R1043-E1047 IonicContact NH2-OE1 3.3Å; R1043-E1047 PolarHBondContact NH2-OE1 2.7Å; R1043-K1048 VanDerWaalsContact O-CE 3.29Å; R1043-K1048 WeakPolarHBondContact O-CE 3.43Å
1044	S	68.1	Low	69	Low	60 Å²	60	73.9 Å²	73.9	42%	0.42	37%	0.365	S	S	.	.			trans	-67.8	162.6	-167.4	68.8	0	0	0	0	114.3	E1046 E1047 K1048	S1044-E1046 VanDerWaalsContact C-N 3.28Å; S1044-E1046 PolarHBondContact O-N 2.87Å; S1044-E1047 WeakPolarHBondContact CB-OE2 3.18Å; S1044-E1047 PolarHBondContact N-OE2 3.14Å; S1044-E1047 WeakPolarHBondContact O-CA 3.43Å; S1044-E1047 WeakPolarHBondContact O-CB 3.34Å; S1044-E1047 PolarHBondContact O-N 3.37Å; S1044-E1047 VanDerWaalsContact OG-CD 3.32Å; S1044-E1047 WeakPolarHBondContact OG-CG 3.08Å; S1044-E1047 PolarHBondContact OG-OE2 2.89Å; S1044-K1048 WeakPolarHBondContact O-CG 3.4Å; S1044-K1048 PolarHBondContact O-N 3.25Å
1045	Y	66.7	Low	70	Confident	152 Å²	152	72.3 Å²	72.3	60%	0.596	35%	0.352	S	S	*	.	H	α-helix	trans	-55.7	-40.4	-179.3	179.1	-111.6	0	0	0	112.9	E1047 K1048 K1049	Y1045-E1047 VanDerWaalsContact C-N 3.27Å; Y1045-E1047 PolarHBondContact O-N 2.98Å; Y1045-K1048 PolarHBondContact O-N 2.94Å; Y1045-K1049 HydrophobicContact CE1-CD 4.26Å; Y1045-K1049 WeakPolarHBondContact O-CB 3.38Å; Y1045-K1049 PolarHBondContact O-N 3.42Å
1046	E	71.8	Confident	70.7	Confident	103 Å²	103	71 Å²	71	48%	0.481	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-31.7	174.7	-99.5	38	-117.5	0	0	113.4	S1044 K1049 Q1050	S1044-E1046 VanDerWaalsContact C-N 3.28Å; S1044-E1046 PolarHBondContact O-N 2.87Å; E1046-K1049 WeakPolarHBondContact OE1-CD 3.37Å; E1046-K1049 WeakPolarHBondContact OE1-CE 3.2Å; E1046-K1049 IonicContact OE1-NZ 2.72Å; E1046-K1049 PolarHBondContact OE1-NZ 3.09Å; E1046-Q1050 WeakPolarHBondContact O-CB 3.19Å; E1046-Q1050 PolarHBondContact O-N 3.05Å
1047	E	72.3	Confident	71.5	Confident	55 Å²	55	72.7 Å²	72.7	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-83.2	-39.9	178.8	-65.4	169.7	114.1	0	0	111.7	R1043 S1044 Y1045 K1049 Q1050 F1051	R1043-E1047 HydrophobicContact CB-CB 4.12Å; R1043-E1047 IonicContact CZ-OE1 2.81Å; R1043-E1047 VanDerWaalsContact NE-CD 3.34Å; R1043-E1047 IonicContact NE-OE1 2.61Å; R1043-E1047 PolarHBondContact NE-OE1 3.18Å; R1043-E1047 IonicContact NE-OE2 2.86Å; R1043-E1047 PolarHBondContact NE-OE2 2.74Å; R1043-E1047 IonicContact NH2-OE1 3.3Å; R1043-E1047 PolarHBondContact NH2-OE1 2.7Å; S1044-E1047 WeakPolarHBondContact CB-OE2 3.18Å; S1044-E1047 PolarHBondContact N-OE2 3.14Å; S1044-E1047 WeakPolarHBondContact O-CA 3.43Å; S1044-E1047 WeakPolarHBondContact O-CB 3.34Å; S1044-E1047 PolarHBondContact O-N 3.37Å; S1044-E1047 VanDerWaalsContact OG-CD 3.32Å; S1044-E1047 WeakPolarHBondContact OG-CG 3.08Å; S1044-E1047 PolarHBondContact OG-OE2 2.89Å; Y1045-E1047 VanDerWaalsContact C-N 3.27Å; Y1045-E1047 PolarHBondContact O-N 2.98Å; E1047-K1049 VanDerWaalsContact C-N 3.27Å; E1047-K1049 PolarHBondContact O-N 2.75Å; E1047-Q1050 CarbonylContact O-C 3.57Å; E1047-Q1050 WeakPolarHBondContact O-CA 3.33Å; E1047-Q1050 WeakPolarHBondContact O-CB 3.25Å; E1047-Q1050 PolarHBondContact O-N 3.01Å; E1047-F1051 PolarHBondContact O-N 2.77Å
1048	K	76.6	Confident	72.4	Confident	49 Å²	49	79.4 Å²	79.4	21%	0.213	38%	0.378	C	S	.	.	H	α-helix	trans	-55.8	-45.1	167.1	-62	-178	172.3	-173.8	0	110.7	R1043 S1044 Y1045 Q1050 F1051 L1052 F1074	R1043-K1048 VanDerWaalsContact O-CE 3.29Å; R1043-K1048 WeakPolarHBondContact O-CE 3.43Å; S1044-K1048 WeakPolarHBondContact O-CG 3.4Å; S1044-K1048 PolarHBondContact O-N 3.25Å; Y1045-K1048 PolarHBondContact O-N 2.94Å; K1048-Q1050 VanDerWaalsContact C-N 3.32Å; K1048-Q1050 PolarHBondContact O-N 3.41Å; K1048-F1051 PolarHBondContact O-N 3.34Å; K1048-L1052 WeakPolarHBondContact O-CG 3.25Å; K1048-L1052 PolarHBondContact O-N 3Å; K1048-L1052 VanDerWaalsContact O-N 3.08Å; K1048-F1074 HydrophobicContact CB-CD1 3.9Å; K1048-F1074 HydrophobicContact CB-CE1 4.48Å; K1048-F1074 HydrophobicContact CB-CG 4.31Å; K1048-F1074 HydrophobicContact CD-CB 4.17Å; K1048-F1074 HydrophobicContact CD-CD1 4.01Å; K1048-F1074 HydrophobicContact CG-CD1 3.63Å; K1048-F1074 HydrophobicContact CG-CE1 4.28Å; K1048-F1074 HydrophobicContact CG-CG 4.38Å; K1048-F1074 PolarHBondContact NZ-O 3.45Å
1049	K	77.4	Confident	73.4	Confident	77 Å²	77	78 Å²	78	34%	0.335	37%	0.372	S	S	.	.	H	α-helix	trans	-66	-28.2	174.2	178	179	170.4	-172	0	112.7	Y1045 E1046 E1047 K1053 F1084	Y1045-K1049 HydrophobicContact CE1-CD 4.26Å; Y1045-K1049 WeakPolarHBondContact O-CB 3.38Å; Y1045-K1049 PolarHBondContact O-N 3.42Å; E1046-K1049 WeakPolarHBondContact OE1-CD 3.37Å; E1046-K1049 WeakPolarHBondContact OE1-CE 3.2Å; E1046-K1049 IonicContact OE1-NZ 2.72Å; E1046-K1049 PolarHBondContact OE1-NZ 3.09Å; E1047-K1049 VanDerWaalsContact C-N 3.27Å; E1047-K1049 PolarHBondContact O-N 2.75Å; K1049-K1053 WeakPolarHBondContact O-CE 3.27Å; K1049-K1053 WeakPolarHBondContact O-CG 3.47Å; K1049-K1053 PolarHBondContact O-N 2.98Å; K1049-F1084 HydrophobicContact CG-CE2 4.26Å
1050	Q	78.9	Confident	74.6	Confident	70 Å²	70	72.3 Å²	72.3	33%	0.327	35%	0.352	S	S	.	.	H	α-helix	trans	-72.1	-47.8	170.8	-178.1	61.3	38.7	0	0	111	E1046 E1047 K1048 L1052 K1053 D1054	E1046-Q1050 WeakPolarHBondContact O-CB 3.19Å; E1046-Q1050 PolarHBondContact O-N 3.05Å; E1047-Q1050 CarbonylContact O-C 3.57Å; E1047-Q1050 WeakPolarHBondContact O-CA 3.33Å; E1047-Q1050 WeakPolarHBondContact O-CB 3.25Å; E1047-Q1050 PolarHBondContact O-N 3.01Å; K1048-Q1050 VanDerWaalsContact C-N 3.32Å; K1048-Q1050 PolarHBondContact O-N 3.41Å; Q1050-L1052 VanDerWaalsContact C-N 3.26Å; Q1050-L1052 PolarHBondContact O-N 3.37Å; Q1050-K1053 WeakPolarHBondContact O-CA 3.39Å; Q1050-K1053 VanDerWaalsContact O-CB 3.27Å; Q1050-K1053 WeakPolarHBondContact O-CB 3.48Å; Q1050-K1053 PolarHBondContact O-N 3.05Å; Q1050-D1054 PolarHBondContact NE2-OD1 2.98Å; Q1050-D1054 PolarHBondContact NE2-OD2 3.37Å; Q1050-D1054 PolarHBondContact O-N 3.19Å; Q1050-D1054 VanDerWaalsContact O-N 3.14Å
1051	F	84.2	Confident	75.9	Confident	5 Å²	5	75.4 Å²	75.4	2%	0.022	37%	0.365	C	S	.	.	H	α-helix	trans	-53	-44.2	174.5	-178	-82.7	0	0	0	111.6	L1035 P1037 Y1040 E1047 K1048 K1053 D1054 Y1055 L1070 F1074	L1035-F1051 HydrophobicContact CB-CE2 3.87Å; L1035-F1051 HydrophobicContact CB-CZ 3.73Å; L1035-F1051 HydrophobicContact CD1-CE2 4.39Å; L1035-F1051 HydrophobicContact CD1-CZ 4.49Å; P1037-F1051 HydrophobicContact CB-CZ 4.47Å; Y1040-F1051 AromaticContact CD2-CD2 3.51Å; Y1040-F1051 HydrophobicContact CD2-CD2 3.51Å; Y1040-F1051 HydrophobicContact CD2-CE2 4.1Å; Y1040-F1051 AromaticContact CE2-CD2 3.89Å; Y1040-F1051 HydrophobicContact CE2-CD2 3.89Å; Y1040-F1051 HydrophobicContact CG-CB 4.5Å; Y1040-F1051 HydrophobicContact CG-CD2 4.04Å; E1047-F1051 PolarHBondContact O-N 2.77Å; K1048-F1051 PolarHBondContact O-N 3.34Å; F1051-K1053 VanDerWaalsContact C-N 3.29Å; F1051-K1053 PolarHBondContact O-N 2.94Å; F1051-D1054 PolarHBondContact O-N 2.79Å; F1051-D1054 VanDerWaalsContact O-N 3.08Å; F1051-Y1055 AromaticContact CE1-CD2 3.77Å; F1051-Y1055 HydrophobicContact CE1-CD2 3.77Å; F1051-Y1055 HydrophobicContact CE1-CG 4.45Å; F1051-Y1055 HydrophobicContact CZ-CD2 4.16Å; F1051-Y1055 WeakPolarHBondContact O-CB 3.41Å; F1051-Y1055 PolarHBondContact O-N 3.23Å; F1051-L1070 HydrophobicContact CE1-CD2 3.76Å; F1051-F1074 HydrophobicContact CB-CZ 4.01Å; F1051-F1074 HydrophobicContact CD1-CE1 4.49Å; F1051-F1074 AromaticContact CD1-CE2 3.32Å; F1051-F1074 HydrophobicContact CD1-CE2 3.32Å; F1051-F1074 AromaticContact CD1-CZ 3.28Å; F1051-F1074 HydrophobicContact CD1-CZ 3.28Å; F1051-F1074 HydrophobicContact CD2-CZ 4.13Å; F1051-F1074 AromaticContact CE1-CE2 3.58Å; F1051-F1074 HydrophobicContact CE1-CE2 3.58Å; F1051-F1074 AromaticContact CE1-CZ 3.66Å; F1051-F1074 HydrophobicContact CE1-CZ 3.66Å; F1051-F1074 HydrophobicContact CE2-CZ 4.43Å; F1051-F1074 HydrophobicContact CG-CE1 4.46Å; F1051-F1074 HydrophobicContact CG-CE2 4.07Å; F1051-F1074 AromaticContact CG-CZ 3.54Å; F1051-F1074 HydrophobicContact CG-CZ 3.54Å; F1051-F1074 HydrophobicContact CZ-CE2 4.48Å; F1051-F1074 HydrophobicContact CZ-CZ 4.21Å
1052	L	83.4	Confident	77.3	Confident	12 Å²	12	69.6 Å²	69.6	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-63.9	-28.5	176.1	-66.5	177.5	0	0	0	113.7	K1048 Q1050 F1056 L1070 F1074 V1081 F1084 F1085	K1048-L1052 WeakPolarHBondContact O-CG 3.25Å; K1048-L1052 PolarHBondContact O-N 3Å; K1048-L1052 VanDerWaalsContact O-N 3.08Å; Q1050-L1052 VanDerWaalsContact C-N 3.26Å; Q1050-L1052 PolarHBondContact O-N 3.37Å; L1052-F1056 WeakPolarHBondContact O-CB 3.28Å; L1052-F1056 PolarHBondContact O-N 3.08Å; L1052-F1056 VanDerWaalsContact O-N 3.15Å; L1052-L1070 HydrophobicContact CD2-CD1 4.37Å; L1052-L1070 HydrophobicContact CD2-CD2 4.45Å; L1052-F1074 HydrophobicContact CD2-CD2 4.38Å; L1052-F1074 HydrophobicContact CD2-CE2 4.44Å; L1052-V1081 HydrophobicContact CD2-CG1 4.37Å; L1052-F1084 HydrophobicContact CB-CD1 3.93Å; L1052-F1084 HydrophobicContact CB-CE1 3.61Å; L1052-F1084 HydrophobicContact CB-CZ 3.97Å; L1052-F1084 WeakPolarHBondContact O-CE1 3.19Å; L1052-F1085 HydrophobicContact CD2-CE2 4.07Å; L1052-F1085 HydrophobicContact CD2-CZ 4.39Å
1053	K	83.9	Confident	78.5	Confident	58 Å²	58	68.1 Å²	68.1	25%	0.252	32%	0.315	S	S	.	.	H	α-helix	trans	-66.6	-42.6	170.8	-62.3	168.7	-146.4	162.8	0	110.7	K1049 Q1050 F1051 F1056 H1057 F1084	K1049-K1053 WeakPolarHBondContact O-CE 3.27Å; K1049-K1053 WeakPolarHBondContact O-CG 3.47Å; K1049-K1053 PolarHBondContact O-N 2.98Å; Q1050-K1053 WeakPolarHBondContact O-CA 3.39Å; Q1050-K1053 VanDerWaalsContact O-CB 3.27Å; Q1050-K1053 WeakPolarHBondContact O-CB 3.48Å; Q1050-K1053 PolarHBondContact O-N 3.05Å; F1051-K1053 VanDerWaalsContact C-N 3.29Å; F1051-K1053 PolarHBondContact O-N 2.94Å; K1053-F1056 WeakPolarHBondContact O-CB 3.39Å; K1053-F1056 PolarHBondContact O-N 3.09Å; K1053-H1057 PolarHBondContact O-CE1 3.2Å; K1053-H1057 PolarHBondContact O-N 3.41Å; K1053-H1057 PolarHBondContact O-ND1 2.83Å; K1053-H1057 VanDerWaalsContact O-ND1 3.1Å; K1053-F1084 HydrophobicContact CG-CZ 3.86Å
1054	D	81.9	Confident	79.5	Confident	54 Å²	54	69.6 Å²	69.6	29%	0.289	33%	0.325	S	S	.	.	H	α-helix	trans	-81.8	-31.2	-172.6	-60.9	-34.8	0	0	0	111.9	L1035 Q1050 F1051 F1056 H1057 K1058	L1035-D1054 HydrophobicContact CD1-CB 4.27Å; Q1050-D1054 PolarHBondContact NE2-OD1 2.98Å; Q1050-D1054 PolarHBondContact NE2-OD2 3.37Å; Q1050-D1054 PolarHBondContact O-N 3.19Å; Q1050-D1054 VanDerWaalsContact O-N 3.14Å; F1051-D1054 PolarHBondContact O-N 2.79Å; F1051-D1054 VanDerWaalsContact O-N 3.08Å; D1054-F1056 VanDerWaalsContact C-N 3.32Å; D1054-H1057 PolarHBondContact O-N 3.45Å; D1054-H1057 VanDerWaalsContact O-N 3.17Å; D1054-H1057 IonicContact OD1-CE1 3.83Å; D1054-H1057 PolarHBondContact OD1-CE1 3.39Å; D1054-H1057 IonicContact OD1-ND1 2.71Å; D1054-H1057 PolarHBondContact OD1-ND1 3.18Å; D1054-K1058 PolarHBondContact O-N 3.47Å
1055	Y	84.4	Confident	80.1	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-58.9	-44.5	163.3	-158.9	-77.3	0	0	0	110.9	L1033 A1034 L1035 F1051 H1057 K1058 K1059 P1062 E1066 L1070 F1085	L1033-Y1055 WeakPolarHBondContact CA-OH 3.41Å; L1033-Y1055 HydrophobicContact CB-CE2 4.06Å; L1033-Y1055 HydrophobicContact CD2-CE2 3.93Å; A1034-Y1055 HydrophobicContact CB-CE1 4.41Å; A1034-Y1055 HydrophobicContact CB-CE2 4.03Å; A1034-Y1055 PolarHBondContact N-OH 3.45Å; L1035-Y1055 HydrophobicContact CB-CD2 4.21Å; L1035-Y1055 HydrophobicContact CD1-CD2 4.43Å; L1035-Y1055 HydrophobicContact CG-CD2 4.46Å; F1051-Y1055 AromaticContact CE1-CD2 3.77Å; F1051-Y1055 HydrophobicContact CE1-CD2 3.77Å; F1051-Y1055 HydrophobicContact CE1-CG 4.45Å; F1051-Y1055 HydrophobicContact CZ-CD2 4.16Å; F1051-Y1055 WeakPolarHBondContact O-CB 3.41Å; F1051-Y1055 PolarHBondContact O-N 3.23Å; Y1055-H1057 VanDerWaalsContact C-N 3.28Å; Y1055-H1057 PolarHBondContact O-N 3.31Å; Y1055-K1058 PolarHBondContact O-N 3.49Å; Y1055-K1059 HydrophobicContact CD1-CB 4.44Å; Y1055-K1059 HydrophobicContact CE1-CB 4.05Å; Y1055-K1059 PolarHBondContact O-N 2.88Å; Y1055-P1062 HydrophobicContact CE1-CB 4.27Å; Y1055-E1066 PolarHBondContact OH-OE1 2.89Å; Y1055-L1070 HydrophobicContact CD1-CD1 4.24Å; Y1055-L1070 HydrophobicContact CD2-CD2 4.22Å; Y1055-L1070 HydrophobicContact CE1-CD1 4.17Å; Y1055-L1070 HydrophobicContact CE2-CD1 4.45Å; Y1055-L1070 HydrophobicContact CE2-CD2 4.29Å; Y1055-L1070 HydrophobicContact CG-CD1 4.41Å; Y1055-F1085 HydrophobicContact CD1-CE1 4.04Å; Y1055-F1085 AromaticContact CD1-CZ 3.74Å; Y1055-F1085 HydrophobicContact CD1-CZ 3.74Å; Y1055-F1085 HydrophobicContact CG-CZ 4.35Å
1056	F	85	Confident	80.8	Confident	15 Å²	15	67.4 Å²	67.4	7%	0.066	31%	0.311	C	S	.	.	H	α-helix	trans	-60.9	-35.4	174.6	-179.3	-76.8	0	0	0	112.6	L1052 K1053 D1054 K1058 P1060 F1085 R1088 R1089	L1052-F1056 WeakPolarHBondContact O-CB 3.28Å; L1052-F1056 PolarHBondContact O-N 3.08Å; L1052-F1056 VanDerWaalsContact O-N 3.15Å; K1053-F1056 WeakPolarHBondContact O-CB 3.39Å; K1053-F1056 PolarHBondContact O-N 3.09Å; D1054-F1056 VanDerWaalsContact C-N 3.32Å; F1056-K1058 VanDerWaalsContact C-N 3.34Å; F1056-P1060 HydrophobicContact CD1-CB 4.26Å; F1056-P1060 HydrophobicContact CD2-CB 4.23Å; F1056-P1060 HydrophobicContact CE1-CB 4Å; F1056-P1060 HydrophobicContact CE2-CB 3.99Å; F1056-P1060 HydrophobicContact CG-CB 4.34Å; F1056-P1060 HydrophobicContact CZ-CB 3.85Å; F1056-P1060 WeakPolarHBondContact O-CA 3.23Å; F1056-P1060 WeakPolarHBondContact O-CB 3.36Å; F1056-P1060 WeakPolarHBondContact O-CD 3.38Å; F1056-F1085 HydrophobicContact CB-CD1 4.29Å; F1056-F1085 HydrophobicContact CB-CE1 3.92Å; F1056-F1085 AromaticContact CD2-CD1 3.68Å; F1056-F1085 HydrophobicContact CD2-CD1 3.68Å; F1056-F1085 HydrophobicContact CD2-CE1 4.18Å; F1056-F1085 HydrophobicContact CG-CD1 4.46Å; F1056-R1088 HydrophobicContact CD1-CG 3.96Å; F1056-R1088 HydrophobicContact CD2-CB 3.81Å; F1056-R1088 HydrophobicContact CD2-CG 3.74Å; F1056-R1088 HydrophobicContact CE1-CG 3.84Å; F1056-R1088 HydrophobicContact CE2-CB 3.52Å; F1056-R1088 HydrophobicContact CE2-CG 3.6Å; F1056-R1088 HydrophobicContact CG-CB 4.49Å; F1056-R1088 VanDerWaalsContact CG-CD 3.44Å; F1056-R1088 HydrophobicContact CG-CG 3.94Å; F1056-R1088 HydrophobicContact CZ-CB 4Å; F1056-R1088 HydrophobicContact CZ-CG 3.68Å; F1056-R1089 HydrophobicContact CE2-CG 3.83Å; F1056-R1089 HydrophobicContact CZ-CG 4.22Å
1057	H	82.8	Confident	81.4	Confident	117 Å²	117	63.7 Å²	63.7	54%	0.542	29%	0.294	S	S	.	.	H	α-helix	trans	-67.2	-32.2	177.6	-60.7	141.2	0	0	0	112.8	K1053 D1054 Y1055 R1088	K1053-H1057 PolarHBondContact O-CE1 3.2Å; K1053-H1057 PolarHBondContact O-N 3.41Å; K1053-H1057 PolarHBondContact O-ND1 2.83Å; K1053-H1057 VanDerWaalsContact O-ND1 3.1Å; D1054-H1057 PolarHBondContact O-N 3.45Å; D1054-H1057 VanDerWaalsContact O-N 3.17Å; D1054-H1057 IonicContact OD1-CE1 3.83Å; D1054-H1057 PolarHBondContact OD1-CE1 3.39Å; D1054-H1057 IonicContact OD1-ND1 2.71Å; D1054-H1057 PolarHBondContact OD1-ND1 3.18Å; Y1055-H1057 VanDerWaalsContact C-N 3.28Å; Y1055-H1057 PolarHBondContact O-N 3.31Å; H1057-R1088 PolarHBondContact CE1-NH2 2.86Å; H1057-R1088 PolarHBondContact NE2-NH2 3.16Å
1058	K	81.1	Confident	81.8	Confident	145 Å²	145	65.4 Å²	65.4	63%	0.63	30%	0.302	S	S	*	.	H	α-helix	trans	-84.1	-41.2	172.2	-77.5	-160.3	176.4	-172.9	0	113.9	A1034 L1035 D1054 Y1055 F1056	A1034-K1058 HydrophobicContact CB-CB 4.26Å; A1034-K1058 VanDerWaalsContact O-CD 3.32Å; A1034-K1058 WeakPolarHBondContact O-CD 3.27Å; L1035-K1058 HydrophobicContact CD2-CD 3.71Å; L1035-K1058 HydrophobicContact CG-CD 4.18Å; D1054-K1058 PolarHBondContact O-N 3.47Å; Y1055-K1058 PolarHBondContact O-N 3.49Å; F1056-K1058 VanDerWaalsContact C-N 3.34Å
1059	K	80.3	Confident	82	Confident	73 Å²	73	64.4 Å²	64.4	32%	0.317	30%	0.299	S	S	.	.			trans	-141.9	83.1	-172.9	-163.7	164.9	176	-169	0	110.9	A1034 Y1055 Y1061 E1066	A1034-K1059 HydrophobicContact CB-CB 4.11Å; A1034-K1059 HydrophobicContact CB-CD 4.26Å; Y1055-K1059 HydrophobicContact CD1-CB 4.44Å; Y1055-K1059 HydrophobicContact CE1-CB 4.05Å; Y1055-K1059 PolarHBondContact O-N 2.88Å; K1059-Y1061 PolarHBondContact O-N 3.44Å; K1059-E1066 VanDerWaalsContact CD-OE1 3.26Å; K1059-E1066 WeakPolarHBondContact CD-OE1 3.27Å; K1059-E1066 WeakPolarHBondContact CE-OE1 3.48Å; K1059-E1066 WeakPolarHBondContact CE-OE2 3.24Å; K1059-E1066 IonicContact NZ-OE1 2.7Å; K1059-E1066 PolarHBondContact NZ-OE1 3.31Å; K1059-E1066 IonicContact NZ-OE2 3.53Å; K1059-E1066 PolarHBondContact NZ-OE2 2.94Å
1060	P	80.9	Confident	82.2	Confident	46 Å²	46	60.8 Å²	60.8	30%	0.299	28%	0.283	S	S	.	.	S	Bend	trans	-71.1	-8.9	-177.2	24.5	-30.8	0	0	0	114.4	F1056 R1089	F1056-P1060 HydrophobicContact CD1-CB 4.26Å; F1056-P1060 HydrophobicContact CD2-CB 4.23Å; F1056-P1060 HydrophobicContact CE1-CB 4Å; F1056-P1060 HydrophobicContact CE2-CB 3.99Å; F1056-P1060 HydrophobicContact CG-CB 4.34Å; F1056-P1060 HydrophobicContact CZ-CB 3.85Å; F1056-P1060 WeakPolarHBondContact O-CA 3.23Å; F1056-P1060 WeakPolarHBondContact O-CB 3.36Å; F1056-P1060 WeakPolarHBondContact O-CD 3.38Å; P1060-R1089 WeakPolarHBondContact O-CD 3.43Å
1061	Y	82.8	Confident	82.4	Confident	143 Å²	143	58.5 Å²	58.5	56%	0.561	28%	0.275	S	S	*	.	S	Bend	trans	-123.3	75.7	174.7	-62.9	-100	0	0	0	110	K1059	K1059-Y1061 PolarHBondContact O-N 3.44Å
1062	P	83.1	Confident	82.2	Confident	15 Å²	15	61.3 Å²	61.3	10%	0.097	30%	0.295	C	S	.	.			trans	-68.2	145.8	173.2	29.8	-35.5	0	0	0	111.1	Y1055 E1066 I1067 F1085	Y1055-P1062 HydrophobicContact CE1-CB 4.27Å; P1062-E1066 HydrophobicContact CB-CB 4.01Å; P1062-I1067 HydrophobicContact CB-CG1 4.04Å; P1062-I1067 HydrophobicContact CG-CD1 4.14Å; P1062-I1067 HydrophobicContact CG-CG1 3.79Å; P1062-F1085 HydrophobicContact CG-CB 4.45Å; P1062-F1085 HydrophobicContact CG-CD1 3.65Å; P1062-F1085 HydrophobicContact CG-CD2 3.94Å; P1062-F1085 HydrophobicContact CG-CE1 3.8Å; P1062-F1085 HydrophobicContact CG-CE2 4.09Å; P1062-F1085 HydrophobicContact CG-CG 3.76Å; P1062-F1085 HydrophobicContact CG-CZ 4.04Å
1063	S	82.2	Confident	81.8	Confident	51 Å²	51	61.9 Å²	61.9	36%	0.357	30%	0.299	S	S	.	.			trans	-71.2	165.5	174	68.4	0	0	0	0	112.4	K1065 E1066 I1067	S1063-K1065 PolarHBondContact O-N 3.43Å; S1063-E1066 WeakPolarHBondContact CB-OE2 3.47Å; S1063-E1066 PolarHBondContact N-OE2 3.35Å; S1063-E1066 PolarHBondContact O-N 3.39Å; S1063-E1066 VanDerWaalsContact O-N 3.11Å; S1063-E1066 WeakPolarHBondContact OG-CG 3.38Å; S1063-E1066 PolarHBondContact OG-N 3.19Å; S1063-E1066 PolarHBondContact OG-OE2 3.35Å; S1063-I1067 WeakPolarHBondContact O-CG1 3.33Å; S1063-I1067 PolarHBondContact O-N 2.71Å
1064	K	81.8	Confident	81.2	Confident	161 Å²	161	59.4 Å²	59.4	70%	0.7	29%	0.288	S	S	*	.	H	α-helix	trans	-55.9	-36.7	175.8	-172.3	179.6	176.7	-174.4	0	112.2	E1068	K1064-E1068 WeakPolarHBondContact O-CB 3.35Å; K1064-E1068 PolarHBondContact O-N 3.14Å
1065	K	80.6	Confident	80.7	Confident	161 Å²	161	67.2 Å²	67.2	70%	0.7	31%	0.313	S	S	*	.	H	α-helix	trans	-68.2	-39.7	176.6	-66.5	-172.7	176.9	-174	0	112.4	S1063 E1068 L1069	S1063-K1065 PolarHBondContact O-N 3.43Å; K1065-E1068 WeakPolarHBondContact O-CB 3.29Å; K1065-E1068 PolarHBondContact O-N 2.85Å; K1065-L1069 WeakPolarHBondContact O-CB 3.44Å; K1065-L1069 PolarHBondContact O-N 3.5Å
1066	E	81.9	Confident	80.5	Confident	5 Å²	5	68.5 Å²	68.5	2%	0.023	32%	0.321	C	S	.	.	H	α-helix	trans	-69.6	-41.1	176.7	-70	161.6	82.5	0	0	112.4	I1032 L1033 Y1055 K1059 P1062 S1063 E1068 L1069 L1070	I1032-E1066 HydrophobicContact CG2-CG 4.1Å; L1033-E1066 HydrophobicContact CD2-CB 4.49Å; L1033-E1066 HydrophobicContact CD2-CG 4.41Å; Y1055-E1066 PolarHBondContact OH-OE1 2.89Å; K1059-E1066 VanDerWaalsContact CD-OE1 3.26Å; K1059-E1066 WeakPolarHBondContact CD-OE1 3.27Å; K1059-E1066 WeakPolarHBondContact CE-OE1 3.48Å; K1059-E1066 WeakPolarHBondContact CE-OE2 3.24Å; K1059-E1066 IonicContact NZ-OE1 2.7Å; K1059-E1066 PolarHBondContact NZ-OE1 3.31Å; K1059-E1066 IonicContact NZ-OE2 3.53Å; K1059-E1066 PolarHBondContact NZ-OE2 2.94Å; P1062-E1066 HydrophobicContact CB-CB 4.01Å; S1063-E1066 WeakPolarHBondContact CB-OE2 3.47Å; S1063-E1066 PolarHBondContact N-OE2 3.35Å; S1063-E1066 PolarHBondContact O-N 3.39Å; S1063-E1066 VanDerWaalsContact O-N 3.11Å; S1063-E1066 WeakPolarHBondContact OG-CG 3.38Å; S1063-E1066 PolarHBondContact OG-N 3.19Å; S1063-E1066 PolarHBondContact OG-OE2 3.35Å; E1066-E1068 PolarHBondContact O-N 3.49Å; E1066-L1069 PolarHBondContact O-N 3.11Å; E1066-L1070 VanDerWaalsContact O-CB 3.27Å; E1066-L1070 WeakPolarHBondContact O-CB 3.5Å; E1066-L1070 WeakPolarHBondContact O-CD1 3.16Å; E1066-L1070 WeakPolarHBondContact O-CG 3.29Å; E1066-L1070 PolarHBondContact O-N 3.35Å
1067	I	83.9	Confident	80.3	Confident	26 Å²	26	77.5 Å²	77.5	13%	0.133	36%	0.355	C	S	.	.	H	α-helix	trans	-61.3	-35.7	175.9	-63.7	168.7	0	0	0	110.6	P1062 S1063 S1071 K1078 V1081 A1082	P1062-I1067 HydrophobicContact CB-CG1 4.04Å; P1062-I1067 HydrophobicContact CG-CD1 4.14Å; P1062-I1067 HydrophobicContact CG-CG1 3.79Å; S1063-I1067 WeakPolarHBondContact O-CG1 3.33Å; S1063-I1067 PolarHBondContact O-N 2.71Å; I1067-S1071 VanDerWaalsContact O-CB 3.24Å; I1067-S1071 WeakPolarHBondContact O-CB 3.27Å; I1067-S1071 PolarHBondContact O-N 3Å; I1067-K1078 HydrophobicContact CG2-CG 4.01Å; I1067-V1081 HydrophobicContact CG2-CB 4.22Å; I1067-V1081 HydrophobicContact CG2-CG1 4.06Å; I1067-A1082 HydrophobicContact CG2-CB 4.19Å
1068	E	81.6	Confident	80.4	Confident	91 Å²	91	75.3 Å²	75.3	43%	0.425	34%	0.344	S	S	.	.	H	α-helix	trans	-67.9	-50.3	174.8	-168.9	130.9	-125.8	0	0	111.7	K1064 K1065 E1066 L1070 S1071 S1072 K1078	K1064-E1068 WeakPolarHBondContact O-CB 3.35Å; K1064-E1068 PolarHBondContact O-N 3.14Å; K1065-E1068 WeakPolarHBondContact O-CB 3.29Å; K1065-E1068 PolarHBondContact O-N 2.85Å; E1066-E1068 PolarHBondContact O-N 3.49Å; E1068-L1070 PolarHBondContact O-N 2.77Å; E1068-S1071 VanDerWaalsContact O-CB 3.29Å; E1068-S1071 WeakPolarHBondContact O-CB 3.44Å; E1068-S1071 PolarHBondContact O-N 3.1Å; E1068-S1071 VanDerWaalsContact O-N 3.1Å; E1068-S1072 PolarHBondContact O-N 3.34Å; E1068-S1072 PolarHBondContact O-OG 3.41Å; E1068-K1078 IonicContact OE1-NZ 2.62Å; E1068-K1078 PolarHBondContact OE1-NZ 3.05Å; E1068-K1078 IonicContact OE2-NZ 2.69Å; E1068-K1078 PolarHBondContact OE2-NZ 3.18Å
1069	L	80.6	Confident	80.5	Confident	28 Å²	28	74.1 Å²	74.1	15%	0.147	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-39.3	178.7	-159.7	70.3	0	0	0	112.5	V1025 A1029 L1033 K1065 E1066 S1071 S1072 L1073	V1025-L1069 HydrophobicContact CG1-CD1 3.92Å; V1025-L1069 HydrophobicContact CG2-CD1 4.47Å; A1029-L1069 HydrophobicContact CB-CD1 4.18Å; A1029-L1069 HydrophobicContact CB-CD2 4.17Å; A1029-L1069 WeakPolarHBondContact O-CD2 3.5Å; L1033-L1069 HydrophobicContact CD1-CD2 3.96Å; L1033-L1069 HydrophobicContact CD2-CD2 4.15Å; L1033-L1069 HydrophobicContact CG-CD2 3.91Å; K1065-L1069 WeakPolarHBondContact O-CB 3.44Å; K1065-L1069 PolarHBondContact O-N 3.5Å; E1066-L1069 PolarHBondContact O-N 3.11Å; L1069-S1071 VanDerWaalsContact C-N 3.32Å; L1069-S1071 PolarHBondContact O-N 3.19Å; L1069-S1072 PolarHBondContact O-N 2.81Å; L1069-L1073 HydrophobicContact CG-CD1 4.16Å; L1069-L1073 WeakPolarHBondContact O-CB 3.18Å; L1069-L1073 WeakPolarHBondContact O-CD1 3.28Å; L1069-L1073 WeakPolarHBondContact O-CG 3.49Å; L1069-L1073 PolarHBondContact O-N 2.82Å
1070	L	80.6	Confident	80.6	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.9	-32.6	173.1	-69.5	168.8	0	0	0	112.4	L1033 F1051 L1052 Y1055 E1066 E1068 F1074 V1081 F1085	L1033-L1070 HydrophobicContact CD2-CD2 4.1Å; L1033-L1070 HydrophobicContact CD2-CG 4.08Å; F1051-L1070 HydrophobicContact CE1-CD2 3.76Å; L1052-L1070 HydrophobicContact CD2-CD1 4.37Å; L1052-L1070 HydrophobicContact CD2-CD2 4.45Å; Y1055-L1070 HydrophobicContact CD1-CD1 4.24Å; Y1055-L1070 HydrophobicContact CD2-CD2 4.22Å; Y1055-L1070 HydrophobicContact CE1-CD1 4.17Å; Y1055-L1070 HydrophobicContact CE2-CD1 4.45Å; Y1055-L1070 HydrophobicContact CE2-CD2 4.29Å; Y1055-L1070 HydrophobicContact CG-CD1 4.41Å; E1066-L1070 VanDerWaalsContact O-CB 3.27Å; E1066-L1070 WeakPolarHBondContact O-CB 3.5Å; E1066-L1070 WeakPolarHBondContact O-CD1 3.16Å; E1066-L1070 WeakPolarHBondContact O-CG 3.29Å; E1066-L1070 PolarHBondContact O-N 3.35Å; E1068-L1070 PolarHBondContact O-N 2.77Å; L1070-F1074 HydrophobicContact CD2-CD2 4.4Å; L1070-F1074 HydrophobicContact CD2-CE2 3.89Å; L1070-F1074 WeakPolarHBondContact O-CD2 3.38Å; L1070-F1074 PolarHBondContact O-N 3.49Å; L1070-V1081 HydrophobicContact CB-CG1 4.19Å; L1070-F1085 HydrophobicContact CD1-CE2 4.12Å; L1070-F1085 HydrophobicContact CD1-CZ 4.22Å
1071	S	83.2	Confident	80.8	Confident	22 Å²	22	72.6 Å²	72.6	15%	0.154	34%	0.336	C	S	.	.	H	α-helix	trans	-66.6	-46	174.3	179	0	0	0	0	110.9	I1067 E1068 L1069 W1075 V1076 K1078	I1067-S1071 VanDerWaalsContact O-CB 3.24Å; I1067-S1071 WeakPolarHBondContact O-CB 3.27Å; I1067-S1071 PolarHBondContact O-N 3Å; E1068-S1071 VanDerWaalsContact O-CB 3.29Å; E1068-S1071 WeakPolarHBondContact O-CB 3.44Å; E1068-S1071 PolarHBondContact O-N 3.1Å; E1068-S1071 VanDerWaalsContact O-N 3.1Å; L1069-S1071 VanDerWaalsContact C-N 3.32Å; L1069-S1071 PolarHBondContact O-N 3.19Å; S1071-W1075 PolarHBondContact O-N 3.33Å; S1071-W1075 VanDerWaalsContact O-N 3.1Å; S1071-V1076 WeakPolarHBondContact CA-O 3.45Å; S1071-V1076 WeakPolarHBondContact CB-O 3.48Å; S1071-V1076 PolarHBondContact O-N 2.95Å; S1071-V1076 PolarHBondContact OG-O 3.47Å; S1071-K1078 WeakPolarHBondContact OG-CA 3.47Å; S1071-K1078 PolarHBondContact OG-N 3.37Å; S1071-K1078 VanDerWaalsContact OG-N 3.07Å
1072	S	79.6	Confident	80.8	Confident	64 Å²	64	67.7 Å²	67.7	45%	0.448	33%	0.325	S	S	.	.	H	α-helix	trans	-62.8	-51.8	174.2	-59.1	0	0	0	0	112.6	E1068 L1069 F1074 W1075	E1068-S1072 PolarHBondContact O-N 3.34Å; E1068-S1072 PolarHBondContact O-OG 3.41Å; L1069-S1072 PolarHBondContact O-N 2.81Å; S1072-F1074 PolarHBondContact O-N 3.32Å; S1072-W1075 PolarHBondContact O-N 3.43Å
1073	L	75.1	Confident	80.9	Confident	25 Å²	25	70.2 Å²	70.2	13%	0.131	34%	0.343	C	S	.	.	H	α-helix	trans	-59.1	-42.2	-177.7	-79.1	162.2	0	0	0	113.1	L1030 L1033 P1037 L1069	L1030-L1073 HydrophobicContact CD2-CD1 4.32Å; L1030-L1073 HydrophobicContact CD2-CD2 4.33Å; L1033-L1073 HydrophobicContact CD1-CD1 3.47Å; L1033-L1073 VanDerWaalsContact CD1-CD1 3.47Å; P1037-L1073 HydrophobicContact CB-CD1 4.06Å; P1037-L1073 HydrophobicContact CB-CD2 4.19Å; P1037-L1073 HydrophobicContact CG-CD1 3.85Å; P1037-L1073 HydrophobicContact CG-CD2 3.97Å; L1069-L1073 HydrophobicContact CG-CD1 4.16Å; L1069-L1073 WeakPolarHBondContact O-CB 3.18Å; L1069-L1073 WeakPolarHBondContact O-CD1 3.28Å; L1069-L1073 WeakPolarHBondContact O-CG 3.49Å; L1069-L1073 PolarHBondContact O-N 2.82Å
1074	F	72.3	Confident	81.2	Confident	6 Å²	6	70.2 Å²	70.2	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-91.9	-5.3	-177.3	-67.4	-57.2	0	0	0	114.7	K1048 F1051 L1052 L1070 S1072 V1076	K1048-F1074 HydrophobicContact CB-CD1 3.9Å; K1048-F1074 HydrophobicContact CB-CE1 4.48Å; K1048-F1074 HydrophobicContact CB-CG 4.31Å; K1048-F1074 HydrophobicContact CD-CB 4.17Å; K1048-F1074 HydrophobicContact CD-CD1 4.01Å; K1048-F1074 HydrophobicContact CG-CD1 3.63Å; K1048-F1074 HydrophobicContact CG-CE1 4.28Å; K1048-F1074 HydrophobicContact CG-CG 4.38Å; K1048-F1074 PolarHBondContact NZ-O 3.45Å; F1051-F1074 HydrophobicContact CB-CZ 4.01Å; F1051-F1074 HydrophobicContact CD1-CE1 4.49Å; F1051-F1074 AromaticContact CD1-CE2 3.32Å; F1051-F1074 HydrophobicContact CD1-CE2 3.32Å; F1051-F1074 AromaticContact CD1-CZ 3.28Å; F1051-F1074 HydrophobicContact CD1-CZ 3.28Å; F1051-F1074 HydrophobicContact CD2-CZ 4.13Å; F1051-F1074 AromaticContact CE1-CE2 3.58Å; F1051-F1074 HydrophobicContact CE1-CE2 3.58Å; F1051-F1074 AromaticContact CE1-CZ 3.66Å; F1051-F1074 HydrophobicContact CE1-CZ 3.66Å; F1051-F1074 HydrophobicContact CE2-CZ 4.43Å; F1051-F1074 HydrophobicContact CG-CE1 4.46Å; F1051-F1074 HydrophobicContact CG-CE2 4.07Å; F1051-F1074 AromaticContact CG-CZ 3.54Å; F1051-F1074 HydrophobicContact CG-CZ 3.54Å; F1051-F1074 HydrophobicContact CZ-CE2 4.48Å; F1051-F1074 HydrophobicContact CZ-CZ 4.21Å; L1052-F1074 HydrophobicContact CD2-CD2 4.38Å; L1052-F1074 HydrophobicContact CD2-CE2 4.44Å; L1070-F1074 HydrophobicContact CD2-CD2 4.4Å; L1070-F1074 HydrophobicContact CD2-CE2 3.89Å; L1070-F1074 WeakPolarHBondContact O-CD2 3.38Å; L1070-F1074 PolarHBondContact O-N 3.49Å; S1072-F1074 PolarHBondContact O-N 3.32Å; F1074-V1076 HydrophobicContact CB-CB 4.45Å; F1074-V1076 HydrophobicContact CB-CG2 4.07Å; F1074-V1076 PolarHBondContact O-N 3.24Å
1075	W	71.8	Confident	81.5	Confident	217 Å²	217	62.6 Å²	62.6	82%	0.822	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	42.3	-174.3	-61	45.2	0	0	0	110.8	S1071 S1072	S1071-W1075 PolarHBondContact O-N 3.33Å; S1071-W1075 VanDerWaalsContact O-N 3.1Å; S1072-W1075 PolarHBondContact O-N 3.43Å
1076	V	79.1	Confident	81.7	Confident	27 Å²	27	56.2 Å²	56.2	16%	0.164	28%	0.283	C	S	.	.			trans	-121.5	140.5	-178.5	172.6	0	0	0	0	108.2	S1071 F1074 K1078 D1080 V1081	S1071-V1076 WeakPolarHBondContact CA-O 3.45Å; S1071-V1076 WeakPolarHBondContact CB-O 3.48Å; S1071-V1076 PolarHBondContact O-N 2.95Å; S1071-V1076 PolarHBondContact OG-O 3.47Å; F1074-V1076 HydrophobicContact CB-CB 4.45Å; F1074-V1076 HydrophobicContact CB-CG2 4.07Å; F1074-V1076 PolarHBondContact O-N 3.24Å; V1076-K1078 PolarHBondContact O-N 2.92Å; V1076-D1080 HydrophobicContact CG1-CB 3.84Å; V1076-V1081 HydrophobicContact CB-CG2 4.27Å; V1076-V1081 HydrophobicContact CG1-CG2 3.94Å
1077	W	82.2	Confident	82	Confident	204 Å²	204	62.9 Å²	62.9	77%	0.773	31%	0.312	S	S	*	.			trans	-61.5	139.1	-174.5	-70.1	49.8	0	0	0	111.3	I1079 D1080 V1081	W1077-I1079 HydrophobicContact CB-CG2 4.09Å; W1077-I1079 PolarHBondContact O-N 3.02Å; W1077-D1080 WeakPolarHBondContact O-CB 3.42Å; W1077-D1080 PolarHBondContact O-N 3.42Å; W1077-V1081 PolarHBondContact O-N 3.34Å; W1077-V1081 VanDerWaalsContact O-N 3.14Å
1078	K	83.3	Confident	82	Confident	71 Å²	71	64.9 Å²	64.9	31%	0.309	32%	0.318	S	S	.	.	H	α-helix	trans	-54.1	-32.2	-178.7	-165	179.1	-172.8	175.5	0	113	I1067 E1068 S1071 V1076 A1082	I1067-K1078 HydrophobicContact CG2-CG 4.01Å; E1068-K1078 IonicContact OE1-NZ 2.62Å; E1068-K1078 PolarHBondContact OE1-NZ 3.05Å; E1068-K1078 IonicContact OE2-NZ 2.69Å; E1068-K1078 PolarHBondContact OE2-NZ 3.18Å; S1071-K1078 WeakPolarHBondContact OG-CA 3.47Å; S1071-K1078 PolarHBondContact OG-N 3.37Å; S1071-K1078 VanDerWaalsContact OG-N 3.07Å; V1076-K1078 PolarHBondContact O-N 2.92Å; K1078-A1082 VanDerWaalsContact O-CB 3.27Å; K1078-A1082 WeakPolarHBondContact O-CB 3.44Å; K1078-A1082 PolarHBondContact O-N 3.44Å
1079	I	83.5	Confident	82.2	Confident	120 Å²	120	64.7 Å²	64.7	62%	0.615	31%	0.313	S	S	*	.	H	α-helix	trans	-69.5	-36.4	175.3	-164.7	168.2	0	0	0	112.8	W1077 S1083	W1077-I1079 HydrophobicContact CB-CG2 4.09Å; W1077-I1079 PolarHBondContact O-N 3.02Å; I1079-S1083 WeakPolarHBondContact O-CA 3.08Å; I1079-S1083 WeakPolarHBondContact O-CB 3.35Å; I1079-S1083 PolarHBondContact O-N 3.37Å
1080	D	82.3	Confident	82.5	Confident	88 Å²	88	70.1 Å²	70.1	47%	0.471	33%	0.333	S	S	.	.	H	α-helix	trans	-73.3	-40.3	178.4	-68.9	-40.3	0	0	0	111.5	V1076 W1077 S1083 F1084	V1076-D1080 HydrophobicContact CG1-CB 3.84Å; W1077-D1080 WeakPolarHBondContact O-CB 3.42Å; W1077-D1080 PolarHBondContact O-N 3.42Å; D1080-S1083 PolarHBondContact O-N 2.93Å; D1080-F1084 WeakPolarHBondContact O-CB 3.34Å; D1080-F1084 PolarHBondContact O-N 2.88Å
1081	V	84.4	Confident	82.7	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60	-52.1	171.1	-176.4	0	0	0	0	109.6	L1052 I1067 L1070 V1076 W1077 S1083 F1084 F1085	L1052-V1081 HydrophobicContact CD2-CG1 4.37Å; I1067-V1081 HydrophobicContact CG2-CB 4.22Å; I1067-V1081 HydrophobicContact CG2-CG1 4.06Å; L1070-V1081 HydrophobicContact CB-CG1 4.19Å; V1076-V1081 HydrophobicContact CB-CG2 4.27Å; V1076-V1081 HydrophobicContact CG1-CG2 3.94Å; W1077-V1081 PolarHBondContact O-N 3.34Å; W1077-V1081 VanDerWaalsContact O-N 3.14Å; V1081-S1083 VanDerWaalsContact C-N 3.32Å; V1081-S1083 PolarHBondContact O-N 3.4Å; V1081-F1084 WeakPolarHBondContact O-CB 3.4Å; V1081-F1084 PolarHBondContact O-N 2.69Å; V1081-F1085 HydrophobicContact CG1-CD2 4.01Å; V1081-F1085 HydrophobicContact CG1-CE2 3.85Å; V1081-F1085 VanDerWaalsContact O-CD2 3.29Å; V1081-F1085 WeakPolarHBondContact O-CD2 3.3Å; V1081-F1085 PolarHBondContact O-N 2.81Å; V1081-F1085 VanDerWaalsContact O-N 3.11Å
1082	A	84.3	Confident	82.5	Confident	40 Å²	40	76.2 Å²	76.2	33%	0.331	37%	0.366	S	S	.	.	H	α-helix	trans	-59.6	-40.2	177.3	0	0	0	0	0	112.9	I1067 K1078 F1085 G1086	I1067-A1082 HydrophobicContact CG2-CB 4.19Å; K1078-A1082 VanDerWaalsContact O-CB 3.27Å; K1078-A1082 WeakPolarHBondContact O-CB 3.44Å; K1078-A1082 PolarHBondContact O-N 3.44Å; A1082-F1085 PolarHBondContact O-N 3.3Å; A1082-G1086 PolarHBondContact O-N 2.94Å
1083	S	85.5	Confident	82.6	Confident	68 Å²	68	78.1 Å²	78.1	48%	0.476	37%	0.369	S	S	.	.	H	α-helix	trans	-65.6	-39	176.4	-178.2	0	0	0	0	111.8	I1079 D1080 V1081 G1086 K1087	I1079-S1083 WeakPolarHBondContact O-CA 3.08Å; I1079-S1083 WeakPolarHBondContact O-CB 3.35Å; I1079-S1083 PolarHBondContact O-N 3.37Å; D1080-S1083 PolarHBondContact O-N 2.93Å; V1081-S1083 VanDerWaalsContact C-N 3.32Å; V1081-S1083 PolarHBondContact O-N 3.4Å; S1083-G1086 PolarHBondContact O-N 2.9Å; S1083-K1087 WeakPolarHBondContact O-CB 3.34Å; S1083-K1087 PolarHBondContact O-N 2.98Å
1084	F	87.1	Confident	83.1	Confident	50 Å²	50	81.7 Å²	81.7	22%	0.219	38%	0.384	C	S	.	.	H	α-helix	trans	-61	-52.5	174.3	-176.1	-85	0	0	0	111.3	K1049 L1052 K1053 D1080 V1081 G1086 K1087 R1088	K1049-F1084 HydrophobicContact CG-CE2 4.26Å; L1052-F1084 HydrophobicContact CB-CD1 3.93Å; L1052-F1084 HydrophobicContact CB-CE1 3.61Å; L1052-F1084 HydrophobicContact CB-CZ 3.97Å; L1052-F1084 WeakPolarHBondContact O-CE1 3.19Å; K1053-F1084 HydrophobicContact CG-CZ 3.86Å; D1080-F1084 WeakPolarHBondContact O-CB 3.34Å; D1080-F1084 PolarHBondContact O-N 2.88Å; V1081-F1084 WeakPolarHBondContact O-CB 3.4Å; V1081-F1084 PolarHBondContact O-N 2.69Å; F1084-G1086 VanDerWaalsContact C-N 3.32Å; F1084-G1086 PolarHBondContact O-N 2.81Å; F1084-K1087 PolarHBondContact O-N 3.33Å; F1084-R1088 WeakPolarHBondContact O-CB 3.43Å; F1084-R1088 PolarHBondContact O-N 2.99Å
1085	F	87.9	Confident	83.3	Confident	1 Å²	1	83.2 Å²	83.2	0%	0.004	40%	0.397	C	S	.	.	H	α-helix	trans	-63.3	-36.3	175.2	-76.1	-84.1	0	0	0	112.1	L1052 Y1055 F1056 P1062 L1070 V1081 A1082 R1089	L1052-F1085 HydrophobicContact CD2-CE2 4.07Å; L1052-F1085 HydrophobicContact CD2-CZ 4.39Å; Y1055-F1085 HydrophobicContact CD1-CE1 4.04Å; Y1055-F1085 AromaticContact CD1-CZ 3.74Å; Y1055-F1085 HydrophobicContact CD1-CZ 3.74Å; Y1055-F1085 HydrophobicContact CG-CZ 4.35Å; F1056-F1085 HydrophobicContact CB-CD1 4.29Å; F1056-F1085 HydrophobicContact CB-CE1 3.92Å; F1056-F1085 AromaticContact CD2-CD1 3.68Å; F1056-F1085 HydrophobicContact CD2-CD1 3.68Å; F1056-F1085 HydrophobicContact CD2-CE1 4.18Å; F1056-F1085 HydrophobicContact CG-CD1 4.46Å; P1062-F1085 HydrophobicContact CG-CB 4.45Å; P1062-F1085 HydrophobicContact CG-CD1 3.65Å; P1062-F1085 HydrophobicContact CG-CD2 3.94Å; P1062-F1085 HydrophobicContact CG-CE1 3.8Å; P1062-F1085 HydrophobicContact CG-CE2 4.09Å; P1062-F1085 HydrophobicContact CG-CG 3.76Å; P1062-F1085 HydrophobicContact CG-CZ 4.04Å; L1070-F1085 HydrophobicContact CD1-CE2 4.12Å; L1070-F1085 HydrophobicContact CD1-CZ 4.22Å; V1081-F1085 HydrophobicContact CG1-CD2 4.01Å; V1081-F1085 HydrophobicContact CG1-CE2 3.85Å; V1081-F1085 VanDerWaalsContact O-CD2 3.29Å; V1081-F1085 WeakPolarHBondContact O-CD2 3.3Å; V1081-F1085 PolarHBondContact O-N 2.81Å; V1081-F1085 VanDerWaalsContact O-N 3.11Å; A1082-F1085 PolarHBondContact O-N 3.3Å; F1085-R1089 VanDerWaalsContact O-CB 3.27Å; F1085-R1089 WeakPolarHBondContact O-CB 3.36Å; F1085-R1089 WeakPolarHBondContact O-CG 3.33Å; F1085-R1089 PolarHBondContact O-N 2.64Å; F1085-R1089 PolarHBondContact O-NE 2.61Å
1086	G	85.4	Confident	83.5	Confident	27 Å²	27	77 Å²	77	28%	0.278	38%	0.379	S	S	.	.	H	α-helix	trans	-64.2	-52.3	175.6	0	0	0	0	0	113	A1082 S1083 F1084 R1088 R1089 Y1090	A1082-G1086 PolarHBondContact O-N 2.94Å; S1083-G1086 PolarHBondContact O-N 2.9Å; F1084-G1086 VanDerWaalsContact C-N 3.32Å; F1084-G1086 PolarHBondContact O-N 2.81Å; G1086-R1088 PolarHBondContact O-N 3.32Å; G1086-R1089 PolarHBondContact O-N 3.02Å; G1086-Y1090 WeakPolarHBondContact O-CB 3.4Å; G1086-Y1090 PolarHBondContact O-N 3.07Å
1087	K	87.7	Confident	83.3	Confident	146 Å²	146	84 Å²	84	64%	0.635	41%	0.407	S	S	*	.	H	α-helix	trans	-62.8	-40.8	178.5	-171.5	171.9	-175.7	173.2	0	111.5	S1083 F1084 Y1090 I1091	S1083-K1087 WeakPolarHBondContact O-CB 3.34Å; S1083-K1087 PolarHBondContact O-N 2.98Å; F1084-K1087 PolarHBondContact O-N 3.33Å; K1087-Y1090 PolarHBondContact O-N 3.48Å; K1087-I1091 HydrophobicContact CG-CD1 4.38Å; K1087-I1091 WeakPolarHBondContact O-CD1 3.43Å; K1087-I1091 VanDerWaalsContact O-CG1 3.28Å; K1087-I1091 WeakPolarHBondContact O-CG1 3.05Å; K1087-I1091 PolarHBondContact O-N 3.01Å
1088	R	84.3	Confident	82.8	Confident	67 Å²	67	79.5 Å²	79.5	25%	0.253	40%	0.399	S	S	.	.	H	α-helix	trans	-70.5	-40.3	177.7	-159.7	170.4	178.1	85.8	0.7	111.8	F1056 H1057 F1084 G1086 I1091 C1092	F1056-R1088 HydrophobicContact CD1-CG 3.96Å; F1056-R1088 HydrophobicContact CD2-CB 3.81Å; F1056-R1088 HydrophobicContact CD2-CG 3.74Å; F1056-R1088 HydrophobicContact CE1-CG 3.84Å; F1056-R1088 HydrophobicContact CE2-CB 3.52Å; F1056-R1088 HydrophobicContact CE2-CG 3.6Å; F1056-R1088 HydrophobicContact CG-CB 4.49Å; F1056-R1088 VanDerWaalsContact CG-CD 3.44Å; F1056-R1088 HydrophobicContact CG-CG 3.94Å; F1056-R1088 HydrophobicContact CZ-CB 4Å; F1056-R1088 HydrophobicContact CZ-CG 3.68Å; H1057-R1088 PolarHBondContact CE1-NH2 2.86Å; H1057-R1088 PolarHBondContact NE2-NH2 3.16Å; F1084-R1088 WeakPolarHBondContact O-CB 3.43Å; F1084-R1088 PolarHBondContact O-N 2.99Å; G1086-R1088 PolarHBondContact O-N 3.32Å; R1088-I1091 PolarHBondContact O-N 2.87Å; R1088-C1092 PolarHBondContact O-N 3.14Å; R1088-C1092 PolarHBondContact O-SG 3.1Å
1089	R	86.7	Confident	82.2	Confident	87 Å²	87	83.1 Å²	83.1	33%	0.328	42%	0.417	S	S	.	.	H	α-helix	trans	-61.3	-43.6	168.1	-80.7	-175.3	-67	173.7	1.4	112.2	F1056 P1060 F1085 G1086 I1091 C1092 M1093	F1056-R1089 HydrophobicContact CE2-CG 3.83Å; F1056-R1089 HydrophobicContact CZ-CG 4.22Å; P1060-R1089 WeakPolarHBondContact O-CD 3.43Å; F1085-R1089 VanDerWaalsContact O-CB 3.27Å; F1085-R1089 WeakPolarHBondContact O-CB 3.36Å; F1085-R1089 WeakPolarHBondContact O-CG 3.33Å; F1085-R1089 PolarHBondContact O-N 2.64Å; F1085-R1089 PolarHBondContact O-NE 2.61Å; G1086-R1089 PolarHBondContact O-N 3.02Å; R1089-I1091 PolarHBondContact O-N 3.4Å; R1089-C1092 PolarHBondContact O-N 3.27Å; R1089-M1093 WeakPolarHBondContact O-CB 3.29Å; R1089-M1093 WeakPolarHBondContact O-CG 3.45Å; R1089-M1093 PolarHBondContact O-N 2.61Å
1090	Y	87.1	Confident	81.5	Confident	142 Å²	142	85.9 Å²	85.9	56%	0.557	42%	0.424	S	S	*	.	H	α-helix	trans	-61	-42.6	177	172.4	-98.1	0	0	0	111.9	G1086 K1087 M1093 K1094	G1086-Y1090 WeakPolarHBondContact O-CB 3.4Å; G1086-Y1090 PolarHBondContact O-N 3.07Å; K1087-Y1090 PolarHBondContact O-N 3.48Å; Y1090-M1093 PolarHBondContact O-N 3.14Å; Y1090-K1094 HydrophobicContact CE1-CD 3.88Å; Y1090-K1094 WeakPolarHBondContact O-CB 3.49Å; Y1090-K1094 PolarHBondContact O-N 3.07Å; Y1090-K1094 PolarHBondContact OH-NZ 2.79Å
1091	I	84.8	Confident	80.5	Confident	101 Å²	101	85.4 Å²	85.4	52%	0.518	43%	0.426	S	S	.	.	H	α-helix	trans	-60.6	-45.4	173.8	-69.7	162.4	0	0	0	110.6	K1087 R1088 R1089 K1094 A1095	K1087-I1091 HydrophobicContact CG-CD1 4.38Å; K1087-I1091 WeakPolarHBondContact O-CD1 3.43Å; K1087-I1091 VanDerWaalsContact O-CG1 3.28Å; K1087-I1091 WeakPolarHBondContact O-CG1 3.05Å; K1087-I1091 PolarHBondContact O-N 3.01Å; R1088-I1091 PolarHBondContact O-N 2.87Å; R1089-I1091 PolarHBondContact O-N 3.4Å; I1091-K1094 PolarHBondContact O-N 3.3Å; I1091-A1095 WeakPolarHBondContact O-CB 3.33Å; I1091-A1095 PolarHBondContact O-N 2.95Å
1092	C	78.8	Confident	78.8	Confident	50 Å²	50	90.3 Å²	90.3	34%	0.338	46%	0.46	S	S	.	.	H	α-helix	trans	-64.2	-46.1	177.5	-63.7	0	0	0	0	112.4	R1088 R1089 K1094 A1095 I1096	R1088-C1092 PolarHBondContact O-N 3.14Å; R1088-C1092 PolarHBondContact O-SG 3.1Å; R1089-C1092 PolarHBondContact O-N 3.27Å; C1092-K1094 VanDerWaalsContact C-N 3.34Å; C1092-K1094 PolarHBondContact O-N 3.36Å; C1092-A1095 WeakPolarHBondContact O-CB 3.5Å; C1092-A1095 PolarHBondContact O-N 3.17Å; C1092-I1096 VanDerWaalsContact O-CG1 3.28Å; C1092-I1096 WeakPolarHBondContact O-CG1 3.47Å; C1092-I1096 PolarHBondContact O-N 3.44Å
1093	M	81.6	Confident	77.3	Confident	104 Å²	104	94.1 Å²	94.1	51%	0.512	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-35.5	177.4	-70.9	-60.6	-69.1	0	0	112.4	R1089 Y1090 I1096 K1097	R1089-M1093 WeakPolarHBondContact O-CB 3.29Å; R1089-M1093 WeakPolarHBondContact O-CG 3.45Å; R1089-M1093 PolarHBondContact O-N 2.61Å; Y1090-M1093 PolarHBondContact O-N 3.14Å; M1093-I1096 PolarHBondContact O-N 3.26Å; M1093-I1096 HydrophobicContact SD-CD1 4.21Å; M1093-K1097 VanDerWaalsContact O-CB 3.29Å; M1093-K1097 WeakPolarHBondContact O-CB 3.46Å; M1093-K1097 PolarHBondContact O-N 3.34Å
1094	K	85.1	Confident	75.4	Confident	100 Å²	100	98.6 Å²	98.6	44%	0.435	50%	0.497	S	S	.	.	H	α-helix	trans	-67.6	-40.1	172.6	-170.7	171	-171	166.7	0	111.2	Y1090 I1091 C1092 N1098	Y1090-K1094 HydrophobicContact CE1-CD 3.88Å; Y1090-K1094 WeakPolarHBondContact O-CB 3.49Å; Y1090-K1094 PolarHBondContact O-N 3.07Å; Y1090-K1094 PolarHBondContact OH-NZ 2.79Å; I1091-K1094 PolarHBondContact O-N 3.3Å; C1092-K1094 VanDerWaalsContact C-N 3.34Å; C1092-K1094 PolarHBondContact O-N 3.36Å; K1094-N1098 VanDerWaalsContact O-CB 3.22Å; K1094-N1098 WeakPolarHBondContact O-CB 3.47Å; K1094-N1098 PolarHBondContact O-N 2.87Å; K1094-N1098 PolarHBondContact O-ND2 3.37Å; K1094-N1098 PolarHBondContact O-OD1 2.78Å
1095	A	77.1	Confident	73.6	Confident	37 Å²	37	102.3 Å²	102.3	31%	0.306	52%	0.518	S	S	.	.	H	α-helix	trans	-62.9	-47.8	172.3	0	0	0	0	0	111.4	I1091 C1092 K1097 N1098 H1099	I1091-A1095 WeakPolarHBondContact O-CB 3.33Å; I1091-A1095 PolarHBondContact O-N 2.95Å; C1092-A1095 WeakPolarHBondContact O-CB 3.5Å; C1092-A1095 PolarHBondContact O-N 3.17Å; A1095-K1097 PolarHBondContact O-N 2.97Å; A1095-N1098 PolarHBondContact O-N 3.17Å; A1095-H1099 WeakPolarHBondContact O-CB 3.5Å; A1095-H1099 PolarHBondContact O-CD2 3.16Å; A1095-H1099 PolarHBondContact O-N 3.13Å
1096	I	75.3	Confident	71.4	Confident	86 Å²	86	105.9 Å²	105.9	44%	0.441	56%	0.555	S	S	.	*	H	α-helix	trans	-58.4	-47.3	176.1	-68.5	161.7	0	0	0	110.7	C1092 M1093 N1098 K1100 P1101	C1092-I1096 VanDerWaalsContact O-CG1 3.28Å; C1092-I1096 WeakPolarHBondContact O-CG1 3.47Å; C1092-I1096 PolarHBondContact O-N 3.44Å; M1093-I1096 PolarHBondContact O-N 3.26Å; M1093-I1096 HydrophobicContact SD-CD1 4.21Å; I1096-N1098 VanDerWaalsContact C-N 3.33Å; I1096-N1098 PolarHBondContact O-N 2.62Å; I1096-K1100 WeakPolarHBondContact O-CA 3.35Å; I1096-K1100 PolarHBondContact O-N 2.9Å; I1096-P1101 HydrophobicContact CB-CG 4.42Å; I1096-P1101 HydrophobicContact CG1-CG 4.17Å; I1096-P1101 HydrophobicContact CG2-CG 4.27Å; I1096-P1101 VanDerWaalsContact O-CD 3.29Å; I1096-P1101 WeakPolarHBondContact O-CD 3.46Å
1097	K	74.1	Confident	69.9	Low	174 Å²	174	111.4 Å²	111.4	76%	0.757	57%	0.572	S	S	*	*	H	α-helix	trans	-64.5	-34.4	178.3	-172	170	-177.9	172.4	0	113.2	M1093 A1095	M1093-K1097 VanDerWaalsContact O-CB 3.29Å; M1093-K1097 WeakPolarHBondContact O-CB 3.46Å; M1093-K1097 PolarHBondContact O-N 3.34Å; A1095-K1097 PolarHBondContact O-N 2.97Å
1098	N	72.6	Confident	68.2	Low	111 Å²	111	108.5 Å²	108.5	59%	0.594	56%	0.563	S	S	*	*	H	α-helix	trans	-80.6	-38.1	179.9	-71.8	-4.1	0	0	0	113.3	K1094 A1095 I1096	K1094-N1098 VanDerWaalsContact O-CB 3.22Å; K1094-N1098 WeakPolarHBondContact O-CB 3.47Å; K1094-N1098 PolarHBondContact O-N 2.87Å; K1094-N1098 PolarHBondContact O-ND2 3.37Å; K1094-N1098 PolarHBondContact O-OD1 2.78Å; A1095-N1098 PolarHBondContact O-N 3.17Å; I1096-N1098 VanDerWaalsContact C-N 3.33Å; I1096-N1098 PolarHBondContact O-N 2.62Å
1099	H	71.6	Confident	67	Low	147 Å²	147	110.8 Å²	110.8	68%	0.681	58%	0.578	S	S	*	*	H	α-helix	trans	-98.8	-12.6	-173.7	-61.6	-61.7	0	0	0	113.8	A1095	A1095-H1099 WeakPolarHBondContact O-CB 3.5Å; A1095-H1099 PolarHBondContact O-CD2 3.16Å; A1095-H1099 PolarHBondContact O-N 3.13Å
1100	K	68.6	Low	65.8	Low	177 Å²	177	110.1 Å²	110.1	77%	0.77	59%	0.587	S	S	*	*			trans	42.9	53.6	-177.3	-62.1	-173.7	176.9	-174.3	0	113.5	I1096 S1102	I1096-K1100 WeakPolarHBondContact O-CA 3.35Å; I1096-K1100 PolarHBondContact O-N 2.9Å; K1100-S1102 PolarHBondContact O-N 3.19Å
1101	P	60.7	Low	64.5	Low	78 Å²	78	109.9 Å²	109.9	51%	0.506	59%	0.591	S	S	.	*			trans	-64.2	111.3	-177.6	28.3	-33.8	0	0	0	110.4	I1096 V1103	I1096-P1101 HydrophobicContact CB-CG 4.42Å; I1096-P1101 HydrophobicContact CG1-CG 4.17Å; I1096-P1101 HydrophobicContact CG2-CG 4.27Å; I1096-P1101 VanDerWaalsContact O-CD 3.29Å; I1096-P1101 WeakPolarHBondContact O-CD 3.46Å; P1101-V1103 PolarHBondContact O-N 2.78Å
1102	S	49.7	Very low	63.2	Low	103 Å²	103	108.8 Å²	108.8	72%	0.72	59%	0.585	S	S	*	*			trans	-80.4	110	170.6	47.6	0	0	0	0	109.5	K1100 L1104	K1100-S1102 PolarHBondContact O-N 3.19Å; S1102-L1104 PolarHBondContact O-N 3.38Å
1103	V	51.8	Low	62.3	Low	120 Å²	120	114.3 Å²	114.3	73%	0.727	60%	0.604	S	S	*	*			trans	-75.7	109.2	165.8	-178.8	0	0	0	0	107.1	P1101 L1105	P1101-V1103 PolarHBondContact O-N 2.78Å; V1103-L1105 HydrophobicContact CG1-CD2 4.03Å; V1103-L1105 HydrophobicContact CG1-CG 4.19Å; V1103-L1105 PolarHBondContact O-N 3.24Å; V1103-L1105 VanDerWaalsContact O-N 3.14Å
1104	L	45.8	Very low	61.4	Low	162 Å²	162	115.6 Å²	115.6	85%	0.848	61%	0.613	S	S	*	*			trans	-74.3	98.3	165.3	-68.1	175.3	0	0	0	107.4	S1102 G1106	S1102-L1104 PolarHBondContact O-N 3.38Å; L1104-G1106 VanDerWaalsContact C-N 3.26Å; L1104-G1106 PolarHBondContact O-N 2.98Å
1105	L	50.1	Low	60.3	Low	129 Å²	129	114.6 Å²	114.6	68%	0.675	62%	0.615	S	S	*	*			trans	-71.4	89.5	166	-69.8	174	0	0	0	107.7	V1103 F1107	V1103-L1105 HydrophobicContact CG1-CD2 4.03Å; V1103-L1105 HydrophobicContact CG1-CG 4.19Å; V1103-L1105 PolarHBondContact O-N 3.24Å; V1103-L1105 VanDerWaalsContact O-N 3.14Å; L1105-F1107 VanDerWaalsContact C-N 3.34Å; L1105-F1107 HydrophobicContact CB-CE2 4.09Å; L1105-F1107 HydrophobicContact CB-CZ 4.4Å; L1105-F1107 WeakPolarHBondContact O-CD2 3.2Å; L1105-F1107 PolarHBondContact O-N 3.42Å
1106	G	40.9	Very low	59.5	Low	76 Å²	76	122.2 Å²	122.2	78%	0.784	64%	0.641	S	S	*	*			trans	-70.5	92.6	166.7	0	0	0	0	0	109	L1104	L1104-G1106 VanDerWaalsContact C-N 3.26Å; L1104-G1106 PolarHBondContact O-N 2.98Å
1107	F	54.2	Low	58.7	Low	143 Å²	143	125.1 Å²	125.1	63%	0.627	65%	0.652	S	S	*	*			trans	-64.6	134.4	158.5	-59.9	-81.4	0	0	0	107.6	L1105 M1109	L1105-F1107 VanDerWaalsContact C-N 3.34Å; L1105-F1107 HydrophobicContact CB-CE2 4.09Å; L1105-F1107 HydrophobicContact CB-CZ 4.4Å; L1105-F1107 WeakPolarHBondContact O-CD2 3.2Å; L1105-F1107 PolarHBondContact O-N 3.42Å; F1107-M1109 PolarHBondContact O-N 2.91Å; F1107-M1109 VanDerWaalsContact O-N 3.14Å
1108	D	52.1	Low	57.2	Low	84 Å²	84	128.7 Å²	128.7	45%	0.449	66%	0.661	S	S	.	*			trans	-65.8	117.5	168.5	-174.3	-2.7	0	0	0	107.9	S1110 E1111 L1112	D1108-S1110 PolarHBondContact O-N 3.32Å; D1108-S1110 WeakPolarHBondContact OD1-CB 3.46Å; D1108-S1110 PolarHBondContact OD1-N 2.88Å; D1108-S1110 PolarHBondContact OD1-OG 3.46Å; D1108-S1110 WeakPolarHBondContact OD2-CB 3.48Å; D1108-S1110 PolarHBondContact OD2-OG 3.33Å; D1108-E1111 HydrophobicContact CB-CB 4.36Å; D1108-E1111 HydrophobicContact CB-CG 4.26Å; D1108-E1111 PolarHBondContact O-N 3.24Å; D1108-E1111 VanDerWaalsContact O-N 3.14Å; D1108-L1112 WeakPolarHBondContact O-CB 3.45Å; D1108-L1112 PolarHBondContact O-N 3Å
1109	M	57.9	Low	55.7	Low	116 Å²	116	129.3 Å²	129.3	57%	0.571	66%	0.664	S	S	*	*	H	α-helix	trans	-65.6	-15.4	177.5	-65.3	-60.7	-59	0	0	111.9	F1107 L1112 K1113	F1107-M1109 PolarHBondContact O-N 2.91Å; F1107-M1109 VanDerWaalsContact O-N 3.14Å; M1109-L1112 HydrophobicContact CE-CD2 4.05Å; M1109-L1112 HydrophobicContact SD-CD2 3.82Å; M1109-K1113 WeakPolarHBondContact O-CB 3.33Å; M1109-K1113 WeakPolarHBondContact O-CD 3.34Å; M1109-K1113 WeakPolarHBondContact O-CG 3.48Å; M1109-K1113 PolarHBondContact O-N 3.37Å; M1109-K1113 VanDerWaalsContact O-N 3.16Å
1110	S	61.5	Low	54.1	Low	72 Å²	72	129.6 Å²	129.6	50%	0.503	67%	0.67	S	S	.	*	H	α-helix	trans	-70.5	-50.4	170.3	-38.9	0	0	0	0	110.7	D1108 K1113 N1114	D1108-S1110 PolarHBondContact O-N 3.32Å; D1108-S1110 WeakPolarHBondContact OD1-CB 3.46Å; D1108-S1110 PolarHBondContact OD1-N 2.88Å; D1108-S1110 PolarHBondContact OD1-OG 3.46Å; D1108-S1110 WeakPolarHBondContact OD2-CB 3.48Å; D1108-S1110 PolarHBondContact OD2-OG 3.33Å; S1110-K1113 PolarHBondContact O-N 3.29Å; S1110-N1114 PolarHBondContact O-ND2 3.14Å
1111	E	59.7	Low	52.7	Low	138 Å²	138	129.6 Å²	129.6	65%	0.645	67%	0.671	S	S	*	*	H	α-helix	trans	-67.1	-40.3	173.9	-66.2	-166.5	151.7	0	0	111.9	D1108 K1113 N1114 V1115	D1108-E1111 HydrophobicContact CB-CB 4.36Å; D1108-E1111 HydrophobicContact CB-CG 4.26Å; D1108-E1111 PolarHBondContact O-N 3.24Å; D1108-E1111 VanDerWaalsContact O-N 3.14Å; E1111-K1113 VanDerWaalsContact C-N 3.27Å; E1111-K1113 PolarHBondContact O-N 3.1Å; E1111-N1114 WeakPolarHBondContact O-CA 3.44Å; E1111-N1114 VanDerWaalsContact O-CB 3.3Å; E1111-N1114 WeakPolarHBondContact O-CB 3.32Å; E1111-N1114 PolarHBondContact O-N 3Å; E1111-V1115 PolarHBondContact O-N 2.93Å
1112	L	57.2	Low	51.6	Low	77 Å²	77	135 Å²	135	40%	0.403	69%	0.689	S	S	.	*	H	α-helix	trans	-64	-31.8	179.5	-162.7	69.5	0	0	0	112.2	D1108 M1109 N1114 V1115	D1108-L1112 WeakPolarHBondContact O-CB 3.45Å; D1108-L1112 PolarHBondContact O-N 3Å; M1109-L1112 HydrophobicContact CE-CD2 4.05Å; M1109-L1112 HydrophobicContact SD-CD2 3.82Å; L1112-N1114 VanDerWaalsContact C-N 3.27Å; L1112-N1114 PolarHBondContact O-N 3.46Å; L1112-V1115 WeakPolarHBondContact O-CB 3.49Å; L1112-V1115 PolarHBondContact O-N 3.23Å
1113	K	61.1	Low	51.1	Low	167 Å²	167	140 Å²	140	73%	0.726	69%	0.694	S	S	*	*	H	α-helix	trans	-66.8	-24.5	170.8	-81.6	170.2	-179	-179.6	0	113.5	M1109 S1110 E1111 V1115	M1109-K1113 WeakPolarHBondContact O-CB 3.33Å; M1109-K1113 WeakPolarHBondContact O-CD 3.34Å; M1109-K1113 WeakPolarHBondContact O-CG 3.48Å; M1109-K1113 PolarHBondContact O-N 3.37Å; M1109-K1113 VanDerWaalsContact O-N 3.16Å; S1110-K1113 PolarHBondContact O-N 3.29Å; E1111-K1113 VanDerWaalsContact C-N 3.27Å; E1111-K1113 PolarHBondContact O-N 3.1Å; K1113-V1115 VanDerWaalsContact C-N 3.28Å
1114	N	62.6	Low	50	Low	131 Å²	131	143.1 Å²	143.1	70%	0.701	70%	0.7	S	S	*	*	H	α-helix	trans	-77.1	-17.6	175.3	-59.6	-27.9	0	0	0	111.9	S1110 E1111 L1112 K1116	S1110-N1114 PolarHBondContact O-ND2 3.14Å; E1111-N1114 WeakPolarHBondContact O-CA 3.44Å; E1111-N1114 VanDerWaalsContact O-CB 3.3Å; E1111-N1114 WeakPolarHBondContact O-CB 3.32Å; E1111-N1114 PolarHBondContact O-N 3Å; L1112-N1114 VanDerWaalsContact C-N 3.27Å; L1112-N1114 PolarHBondContact O-N 3.46Å; N1114-K1116 PolarHBondContact O-N 3.19Å
1115	V	62	Low	50.4	Low	78 Å²	78	144 Å²	144	47%	0.473	72%	0.716	S	S	.	*			trans	-77.8	84.7	176.3	-171.1	0	0	0	0	110.6	E1111 L1112 K1113 H1117	E1111-V1115 PolarHBondContact O-N 2.93Å; L1112-V1115 WeakPolarHBondContact O-CB 3.49Å; L1112-V1115 PolarHBondContact O-N 3.23Å; K1113-V1115 VanDerWaalsContact C-N 3.28Å; V1115-H1117 PolarHBondContact O-N 3.26Å
1116	K	60.4	Low	50.4	Low	197 Å²	197	144.8 Å²	144.8	86%	0.857	72%	0.718	S	S	*	*			trans	-69.2	108.5	173	-69.1	-174.2	178.5	-178.2	0	111.3	N1114	N1114-K1116 PolarHBondContact O-N 3.19Å
1117	H	57.5	Low	50.9	Low	147 Å²	147	148.4 Å²	148.4	68%	0.681	71%	0.714	S	S	*	*			trans	-80.9	134.9	168.2	-58.9	-43.5	0	0	0	111	V1115 L1119	V1115-H1117 PolarHBondContact O-N 3.26Å; H1117-L1119 VanDerWaalsContact C-N 3.31Å; H1117-L1119 PolarHBondContact O-N 3.42Å; H1117-L1119 VanDerWaalsContact O-N 3.09Å
1118	R	42.8	Very low	50.7	Low	250 Å²	250	148.7 Å²	148.7	94%	0.943	72%	0.719	S	S	*	*			trans	-82.9	70.1	173.6	-69.8	-171	178.7	-161.4	1.5	111.1
1119	L	41.2	Very low	50.6	Low	123 Å²	123	152.5 Å²	152.5	64%	0.644	74%	0.735	S	S	*	*			trans	-132.8	105.2	174.6	-68	174.3	0	0	0	109.5	H1117 F1121	H1117-L1119 VanDerWaalsContact C-N 3.31Å; H1117-L1119 PolarHBondContact O-N 3.42Å; H1117-L1119 VanDerWaalsContact O-N 3.09Å; L1119-F1121 HydrophobicContact CB-CE2 3.97Å; L1119-F1121 HydrophobicContact CB-CZ 4.38Å
1120	N	37.9	Very low	50.1	Low	153 Å²	153	154.8 Å²	154.8	82%	0.818	75%	0.745	S	S	*	*			trans	-72.9	135.1	166.5	-72.5	1.1	0	0	0	108.6
1121	F	39.9	Very low	49.4	Very low	178 Å²	178	160.3 Å²	160.3	78%	0.781	76%	0.762	S	S	*	*			trans	-117.1	106	163.3	-67.7	-79.8	0	0	0	106.9	L1119	L1119-F1121 HydrophobicContact CB-CE2 3.97Å; L1119-F1121 HydrophobicContact CB-CZ 4.38Å
1122	E	37.3	Very low	48.7	Very low	191 Å²	191	161.9 Å²	161.9	89%	0.893	77%	0.77	S	S	*	*			trans	-69.8	145	167.9	-68.1	177.3	163.3	0	0	108.9
1123	Y	39	Very low	48	Very low	209 Å²	209	168.5 Å²	168.5	82%	0.82	80%	0.798	S	S	*	*			trans	-123	103.7	-173.8	-169.8	-77.9	0	0	0	107.9
1124	E	29.2	Very low	46.9	Very low	185 Å²	185	168.6 Å²	168.6	86%	0.864	80%	0.804	S	S	*	*			trans	-76.6	145.1	164.6	-80.1	-169.6	112.4	0	0	110.1
1125	P	53.2	Low	45.5	Very low	181 Å²	181	172 Å²	172	100%	1.175	81%	0.813	S	S	*	*			trans	-77.3	0	-169	32	-36.9	0	0	0	115.3

Retrieved 1,125 of 1,125 residues in 1827.2 ms (Link to these results)

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