A0A3Q0KLK6_SCHMA Loading...

C2H2-type domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KLK6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 843 aa.

						>A0A3Q0KLK6_SCHMA|A0A3Q0KLK6
MVEFMISNQHNNAAVSYAYNAANRQQRQIQIVDANSLQPLSESLVNEEFKRDEIPVQNTQVVYGTSAAGFAPVVGQNVQLVSSVPNTIELANNAYDSSMVVPQEPSQAGLDIEPIDLEEVQKIQARMPAADPNAPVGSNKNPIRIIQQGNQYITTQDVSDEHLQQIIQVLTNQALLSSSGSRPSAIYNRLTNRRIIFRVTRAKRRHDDGNTGATALSGERTRSSITVKSEKKSRAGRPIGRKRRKRGSDEEDPDFEPEVPEEEVLPFPLIRRTSASGRVSKPPKHLVKDYKHLRLEDLTSKPESSEEDEHSDGGYSDYINDGLSDEGWSEDGTNRSLRWPCPLCTKVFTSRAGVARHRSIAHGPNRGRPRGRWANPYMASVRRRAKLKEAVSEATDDDLIEFVAPRLCKLISPWDHLLLRSEHGNPPLPQVPRVVLDYLSLVERARSFLCDQLEPRITKKSKQSNEMNSENQKDGEDDNDETSDSPKNKENRSDVKSQDKSNAQSNGVHADDDDDGDDVEEEEEEDDDGAIIVKVDTEEQSAALGLPCGKYIVKEPLREEYLPRRFRSILAAQRANAAAAAASDSDKGSVGHQKRAVVAMETAEDDEVDATLRSDIASTEDSVQHFGDAAVSNQTDNNSQNIVSLGEELLLLPEGGLGCPVPDEWLTSGAFLTVLTENGQTSDLVMEAATGRLFHRPTGHLVSLADSQQTNQSEVDDFQGESYEYESTNVEQKTKAVTAPKQPSSDKRKVASSKSKVPSKSQTNEESEISNDDILSQQEQILAQLAENGDVVDLNTLFPGVSVTEVSPGVCLVTKPNGDRFNVEHGGEGITLETLQAILQMDA
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39	Very low	37.3	Very low	77 Å²	77	77.4 Å²	77.4	38%	0.379	39%	0.394	S	S	.	.				0	145.9	0	170.3	-178.8	-83.3	0	0	107.8	G137 S138 P142 I143 I196	M1-G137 PolarHBondContact N-O 2.69Å; M1-S138 PolarHBondContact N-O 2.73Å; M1-P142 HydrophobicContact CB-CB 4.02Å; M1-P142 HydrophobicContact CG-CB 4.22Å; M1-P142 CarbonylContact O-C 3.6Å; M1-P142 VanDerWaalsContact O-CA 3.28Å; M1-P142 WeakPolarHBondContact O-CA 3.49Å; M1-P142 WeakPolarHBondContact O-CB 3.38Å; M1-I143 PolarHBondContact O-N 3.01Å; M1-I196 CarbonylContact C-O 3.6Å; M1-I196 WeakPolarHBondContact CA-O 3.45Å; M1-I196 HydrophobicContact CE-CG2 3.93Å
2	V	42.5	Very low	36.5	Very low	8 Å²	8	84.3 Å²	84.3	5%	0.048	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.4	-177.2	-171.5	0	0	0	0	110.2	I143 I145 I166 I195 I196 F197 R198	V2-I143 CarbonylContact C-O 3.49Å; V2-I143 VanDerWaalsContact CA-O 3.32Å; V2-I143 WeakPolarHBondContact CA-O 3.33Å; V2-I143 HydrophobicContact CG1-CG2 4.37Å; V2-I143 HydrophobicContact CG2-CB 4.38Å; V2-I145 HydrophobicContact CG1-CD1 3.94Å; V2-I145 HydrophobicContact CG1-CG1 4.37Å; V2-I166 HydrophobicContact CG1-CG2 4.44Å; V2-I195 HydrophobicContact CG2-CG2 4.1Å; V2-I196 PolarHBondContact N-O 2.87Å; V2-F197 HydrophobicContact CB-CB 4.1Å; V2-F197 CarbonylContact O-C 3.51Å; V2-F197 WeakPolarHBondContact O-CA 3.18Å; V2-F197 WeakPolarHBondContact O-CB 3.3Å; V2-R198 PolarHBondContact O-N 2.89Å
3	E	40.1	Very low	36	Very low	23 Å²	23	84.2 Å²	84.2	11%	0.107	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134.4	173	-95.5	175.5	149.3	0	0	111.3	M127 I143 R144 I145 R198	E3-M127 VanDerWaalsContact OE2-CE 3.26Å; E3-M127 WeakPolarHBondContact OE2-CE 3.42Å; E3-I143 PolarHBondContact N-O 3.33Å; E3-R144 WeakPolarHBondContact O-CA 3.37Å; E3-I145 PolarHBondContact O-N 3.07Å; E3-R198 WeakPolarHBondContact CA-O 3.48Å; E3-R198 HydrophobicContact CG-CB 3.94Å; E3-R198 WeakPolarHBondContact OE1-CD 3.33Å; E3-R198 IonicContact OE1-NH1 3.27Å; E3-R198 PolarHBondContact OE1-NH1 2.72Å
4	F	41.6	Very low	35.3	Very low	16 Å²	16	84.9 Å²	84.9	7%	0.07	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.7	-173	-130.1	-95.3	0	0	0	110.7	I6 I145 Q147 Y152 L170 R198 V199 T200	F4-I6 HydrophobicContact CD1-CG1 4.3Å; F4-I145 WeakPolarHBondContact CA-O 3.49Å; F4-I145 HydrophobicContact CD2-CB 3.85Å; F4-I145 HydrophobicContact CD2-CD1 4.44Å; F4-I145 HydrophobicContact CD2-CG2 4.21Å; F4-I145 HydrophobicContact CE2-CB 3.65Å; F4-I145 HydrophobicContact CE2-CD1 3.92Å; F4-I145 HydrophobicContact CE2-CG1 4.37Å; F4-I145 HydrophobicContact CE2-CG2 3.57Å; F4-I145 HydrophobicContact CZ-CB 4.31Å; F4-I145 HydrophobicContact CZ-CG2 3.75Å; F4-Q147 HydrophobicContact CE1-CB 4.13Å; F4-Y152 AromaticContact CE1-CD1 3.94Å; F4-Y152 HydrophobicContact CE1-CD1 3.94Å; F4-Y152 AromaticContact CE1-CE1 3.77Å; F4-Y152 HydrophobicContact CE1-CE1 3.77Å; F4-Y152 AromaticContact CZ-CD1 3.57Å; F4-Y152 HydrophobicContact CZ-CD1 3.57Å; F4-Y152 AromaticContact CZ-CE1 3.6Å; F4-Y152 HydrophobicContact CZ-CE1 3.6Å; F4-L170 HydrophobicContact CD2-CD1 3.93Å; F4-L170 HydrophobicContact CE2-CD1 3.53Å; F4-L170 HydrophobicContact CZ-CD1 4.39Å; F4-R198 PolarHBondContact N-O 3.38Å; F4-V199 HydrophobicContact CB-CG2 4.31Å; F4-T200 PolarHBondContact O-N 2.87Å; F4-T200 PolarHBondContact O-OG1 3.49Å; F4-T200 VanDerWaalsContact O-OG1 3.09Å
5	M	38.5	Very low	35	Very low	31 Å²	31	86.7 Å²	86.7	15%	0.153	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.5	171.1	-81.9	-167.2	172.5	0	0	112.9	I123 I145 Q147 T200	M5-I123 HydrophobicContact SD-CB 4.37Å; M5-I123 HydrophobicContact SD-CD1 4.07Å; M5-I123 HydrophobicContact SD-CG1 3.86Å; M5-I123 HydrophobicContact SD-CG2 3.64Å; M5-I145 PolarHBondContact N-O 3.06Å; M5-Q147 WeakPolarHBondContact O-CB 3.4Å; M5-Q147 PolarHBondContact O-N 3.49Å; M5-T200 WeakPolarHBondContact CA-O 3.2Å; M5-T200 WeakPolarHBondContact CE-OG1 3.31Å; M5-T200 VanDerWaalsContact CG-OG1 3.24Å; M5-T200 WeakPolarHBondContact CG-OG1 3.25Å
6	I	41.9	Very low	34.5	Very low	51 Å²	51	88.1 Å²	88.1	26%	0.262	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.5	178.5	-51.6	177.3	0	0	0	108.7	F4 V199 A202	F4-I6 HydrophobicContact CD1-CG1 4.3Å; I6-V199 HydrophobicContact CD1-CG1 4.21Å; I6-A202 PolarHBondContact O-N 2.96Å
7	S	35.2	Very low	34.3	Very low	52 Å²	52	95.1 Å²	95.1	36%	0.364	52%	0.524	S	S	.	.			trans	-106.1	137.4	166.6	-74.8	0	0	0	0	109.4
8	N	34.9	Very low	34.1	Very low	135 Å²	135	94.9 Å²	94.9	72%	0.722	54%	0.537	S	S	*	.			trans	-97.5	129	-179.6	-137	45.6	0	0	0	110.3
9	Q	34.4	Very low	33.9	Very low	162 Å²	162	101.4 Å²	101.4	76%	0.757	55%	0.553	S	S	*	*			trans	-110.3	136	156	-82.6	-176.7	-12	0	0	107.6	N11	Q9-N11 PolarHBondContact O-N 3.45Å
10	H	29.5	Very low	33.8	Very low	160 Å²	160	104.1 Å²	104.1	74%	0.741	57%	0.567	S	S	*	*			trans	-79.2	116.8	170.7	-78.3	-105.2	0	0	0	109.1
11	N	32.3	Very low	33.7	Very low	136 Å²	136	104 Å²	104	73%	0.727	58%	0.581	S	S	*	*			trans	-116.6	105.8	165.5	-94.6	-36.4	0	0	0	109.1	Q9 A13	Q9-N11 PolarHBondContact O-N 3.45Å; N11-A13 PolarHBondContact O-N 3Å
12	N	28.2	Very low	33.3	Very low	161 Å²	161	104.2 Å²	104.2	86%	0.861	60%	0.595	S	S	*	*			trans	-74.5	76.6	172.8	-74.8	-21.2	0	0	0	109.9	A14	N12-A14 PolarHBondContact O-N 3.01Å
13	A	29.6	Very low	32.8	Very low	82 Å²	82	111.6 Å²	111.6	68%	0.678	63%	0.634	S	S	*	*			trans	-86.4	83.7	174.9	0	0	0	0	0	110.5	N11 V15	N11-A13 PolarHBondContact O-N 3Å; A13-V15 PolarHBondContact O-N 3.21Å
14	A	27.3	Very low	32.5	Very low	95 Å²	95	122.6 Å²	122.6	79%	0.785	67%	0.674	S	S	*	*			trans	-68.3	100.7	172.1	0	0	0	0	0	110.2	N12 S16	N12-A14 PolarHBondContact O-N 3.01Å; A14-S16 PolarHBondContact O-N 3.43Å
15	V	30.2	Very low	32.1	Very low	111 Å²	111	130.9 Å²	130.9	67%	0.673	71%	0.713	S	S	*	*			trans	-74.7	92.9	177.2	-177.7	0	0	0	0	109.5	A13 Y17	A13-V15 PolarHBondContact O-N 3.21Å; V15-Y17 HydrophobicContact CG1-CD2 3.98Å; V15-Y17 HydrophobicContact CG1-CE2 3.74Å; V15-Y17 PolarHBondContact O-N 3.46Å; V15-Y17 VanDerWaalsContact O-N 3.1Å
16	S	27.3	Very low	31.7	Very low	110 Å²	110	138.7 Å²	138.7	77%	0.769	75%	0.75	S	S	*	*			trans	-73.9	95.1	177.9	48.3	0	0	0	0	111.6	A14 A18	A14-S16 PolarHBondContact O-N 3.43Å; S16-A18 VanDerWaalsContact C-N 3.35Å; S16-A18 PolarHBondContact O-N 3.06Å
17	Y	30	Very low	31.2	Very low	207 Å²	207	147.8 Å²	147.8	81%	0.812	78%	0.781	S	S	*	*			trans	-68.6	89.6	170.4	-88.2	-85.6	0	0	0	111.4	V15 Y19	V15-Y17 HydrophobicContact CG1-CD2 3.98Å; V15-Y17 HydrophobicContact CG1-CE2 3.74Å; V15-Y17 PolarHBondContact O-N 3.46Å; V15-Y17 VanDerWaalsContact O-N 3.1Å; Y17-Y19 PolarHBondContact O-N 2.95Å
18	A	30.6	Very low	30.8	Very low	91 Å²	91	153.6 Å²	153.6	75%	0.752	80%	0.802	S	S	*	*			trans	-69.7	91.8	171.1	0	0	0	0	0	110.6	S16 N20	S16-A18 VanDerWaalsContact C-N 3.35Å; S16-A18 PolarHBondContact O-N 3.06Å; A18-N20 PolarHBondContact O-N 3.31Å; A18-N20 VanDerWaalsContact O-N 3.16Å
19	Y	31.2	Very low	30.6	Very low	218 Å²	218	154.6 Å²	154.6	86%	0.855	81%	0.806	S	S	*	*			trans	-69.7	109.8	179.7	-141.6	-86.2	0	0	0	110.5	Y17 A21	Y17-Y19 PolarHBondContact O-N 2.95Å; Y19-A21 PolarHBondContact O-N 2.73Å
20	N	32.8	Very low	30.4	Very low	156 Å²	156	154.2 Å²	154.2	83%	0.834	80%	0.804	S	S	*	*			trans	-72.8	84.5	-176.2	-107.3	-43.1	0	0	0	111.7	A18 A22	A18-N20 PolarHBondContact O-N 3.31Å; A18-N20 VanDerWaalsContact O-N 3.16Å; N20-A22 VanDerWaalsContact C-N 3.33Å; N20-A22 PolarHBondContact O-N 2.95Å
21	A	30.2	Very low	30.5	Very low	103 Å²	103	154.3 Å²	154.3	85%	0.851	81%	0.808	S	S	*	*			trans	-78.2	73.3	-178.9	0	0	0	0	0	112.7	Y19	Y19-A21 PolarHBondContact O-N 2.73Å
22	A	32.1	Very low	30.7	Very low	81 Å²	81	153.4 Å²	153.4	67%	0.669	81%	0.807	S	S	*	*			trans	-135.2	136.2	169.7	0	0	0	0	0	111.3	N20	N20-A22 VanDerWaalsContact C-N 3.33Å; N20-A22 PolarHBondContact O-N 2.95Å
23	N	32	Very low	30.8	Very low	162 Å²	162	151.1 Å²	151.1	87%	0.866	80%	0.795	S	S	*	*	S	Bend	trans	58.5	77.3	178.3	-70.4	-30.9	0	0	0	117.3
24	R	32.4	Very low	31	Very low	254 Å²	254	151.9 Å²	151.9	96%	0.958	80%	0.801	S	S	*	*				-154.9	154.5	119.3	-108.9	163.6	-167.2	-138.3	1	111.9
25	Q	34.5	Very low	31.4	Very low	191 Å²	191	154.1 Å²	154.1	89%	0.893	80%	0.8	S	S	*	*			trans	-77.4	132.5	-163	-67.8	161	-20.8	0	0	112	R27	Q25-R27 PolarHBondContact O-N 2.9Å
26	Q	28.8	Very low	31.7	Very low	195 Å²	195	153.6 Å²	153.6	91%	0.911	80%	0.801	S	S	*	*			trans	-64.4	128.5	172.6	-69.5	170.6	-41.7	0	0	110.5
27	R	31	Very low	32.1	Very low	242 Å²	242	156.8 Å²	156.8	91%	0.913	81%	0.809	S	S	*	*			trans	-107.8	117.5	152.9	-77	-169.4	173.8	-162.5	-1.3	107.8	Q25 I29	Q25-R27 PolarHBondContact O-N 2.9Å; R27-I29 PolarHBondContact O-N 3.38Å
28	Q	27.9	Very low	32.4	Very low	174 Å²	174	155.5 Å²	155.5	81%	0.813	81%	0.81	S	S	*	*			trans	-77	116.5	-176.1	-175.2	175.7	2	0	0	109.7
29	I	29.8	Very low	32.4	Very low	156 Å²	156	157 Å²	157	80%	0.8	81%	0.812	S	S	*	*			trans	-108	121.5	167.3	-61.4	179.3	0	0	0	106.8	R27	R27-I29 PolarHBondContact O-N 3.38Å
30	Q	30.4	Very low	32.5	Very low	153 Å²	153	155.2 Å²	155.2	72%	0.715	82%	0.817	S	S	*	*			trans	-106.7	105.2	-175.4	-172.5	172.9	15.2	0	0	108.8	V32	Q30-V32 HydrophobicContact CG-CG2 4.36Å
31	I	32.7	Very low	32.6	Very low	163 Å²	163	152.7 Å²	152.7	84%	0.836	81%	0.811	S	S	*	*			trans	-78.3	121.8	172.7	-57.6	177	0	0	0	107.2
32	V	35	Very low	32.8	Very low	116 Å²	116	156.1 Å²	156.1	70%	0.703	81%	0.809	S	S	*	*			trans	-105.3	135.3	177.3	179.3	0	0	0	0	108.2	Q30	Q30-V32 HydrophobicContact CG-CG2 4.36Å
33	D	31.3	Very low	32.8	Very low	114 Å²	114	157.1 Å²	157.1	61%	0.61	81%	0.812	S	S	*	*			trans	-65.6	133.9	-178.8	-171.9	-8.1	0	0	0	111.4	N35	D33-N35 VanDerWaalsContact C-N 3.31Å; D33-N35 PolarHBondContact O-N 3.31Å; D33-N35 PolarHBondContact OD1-N 3.42Å; D33-N35 VanDerWaalsContact OD1-N 3.07Å; D33-N35 PolarHBondContact OD1-ND2 2.91Å
34	A	33.4	Very low	32.9	Very low	97 Å²	97	156.4 Å²	156.4	80%	0.802	81%	0.807	S	S	*	*	S	Bend	trans	-79.5	-9.9	-176.9	0	0	0	0	0	113.7	S36	A34-S36 VanDerWaalsContact C-N 3.32Å; A34-S36 PolarHBondContact O-N 2.92Å
35	N	36.3	Very low	32.9	Very low	142 Å²	142	149.8 Å²	149.8	76%	0.759	79%	0.794	S	S	*	*	S	Bend	trans	-89.3	22.8	-174.4	-67.4	-58	0	0	0	115	D33	D33-N35 VanDerWaalsContact C-N 3.31Å; D33-N35 PolarHBondContact O-N 3.31Å; D33-N35 PolarHBondContact OD1-N 3.42Å; D33-N35 VanDerWaalsContact OD1-N 3.07Å; D33-N35 PolarHBondContact OD1-ND2 2.91Å
36	S	35.6	Very low	32.9	Very low	101 Å²	101	146.6 Å²	146.6	71%	0.706	78%	0.783	S	S	*	*			trans	-135.2	90.4	174	-83.6	0	0	0	0	112.9	A34	A34-S36 VanDerWaalsContact C-N 3.32Å; A34-S36 PolarHBondContact O-N 2.92Å
37	L	35.6	Very low	33.2	Very low	177 Å²	177	144.8 Å²	144.8	93%	0.927	78%	0.775	S	S	*	*			trans	-168.7	146.7	138.3	-102	162.4	0	0	0	109.7
38	Q	36.3	Very low	33.3	Very low	179 Å²	179	141.1 Å²	141.1	84%	0.836	77%	0.768	S	S	*	*			trans	-91.7	153.1	-173.2	-72.6	-168.1	-20.2	0	0	113.1
39	P	30.4	Very low	33.7	Very low	123 Å²	123	141 Å²	141	80%	0.799	77%	0.765	S	S	*	*			trans	-76	135.5	179.1	31.2	-34.9	0	0	0	112.2
40	L	34.8	Very low	34.1	Very low	181 Å²	181	140.5 Å²	140.5	95%	0.948	76%	0.758	S	S	*	*			trans	-132.1	150.2	160.2	-73.9	177.2	0	0	0	109.2
41	S	35.2	Very low	34.2	Very low	102 Å²	102	142.9 Å²	142.9	71%	0.713	76%	0.76	S	S	*	*			trans	-113.4	162.6	-156.3	54.6	0	0	0	0	114.8
42	E	33.2	Very low	34.5	Very low	175 Å²	175	141.2 Å²	141.2	82%	0.818	75%	0.753	S	S	*	*			trans	67.2	98.4	151.5	-73.8	174.9	173.6	0	0	120.3
43	S	33.3	Very low	34.5	Very low	103 Å²	103	143 Å²	143	72%	0.72	75%	0.753	S	S	*	*				113	152.7	102.4	77.4	0	0	0	0	120.9
44	L	32.3	Very low	35	Very low	147 Å²	147	144.3 Å²	144.3	77%	0.77	76%	0.759	S	S	*	*			trans	81.4	95.9	149.8	-106.1	68	0	0	0	122.4
45	V	34.2	Very low	34.9	Very low	114 Å²	114	145.1 Å²	145.1	69%	0.691	76%	0.756	S	S	*	*				69	125.2	125.7	-60	0	0	0	0	124.7
46	N	32.7	Very low	34.8	Very low	124 Å²	124	144.1 Å²	144.1	66%	0.663	76%	0.755	S	S	*	*			trans	83.2	122.1	130.7	-72.3	30.9	0	0	0	124
47	E	35.5	Very low	34.7	Very low	158 Å²	158	147.9 Å²	147.9	74%	0.738	76%	0.761	S	S	*	*			trans	67.4	105.8	134.4	-63	179.2	165.1	0	0	118.9
48	E	33.5	Very low	34.5	Very low	164 Å²	164	147.4 Å²	147.4	77%	0.766	76%	0.759	S	S	*	*				82.6	105.2	90.7	-75.7	-146.2	131.3	0	0	115.2
49	F	35.5	Very low	34.2	Very low	172 Å²	172	145.7 Å²	145.7	75%	0.754	76%	0.761	S	S	*	*				-176	113.3	114.3	-118.9	-118.3	0	0	0	114.2
50	K	38.1	Very low	34.3	Very low	146 Å²	146	148.4 Å²	148.4	64%	0.635	76%	0.764	S	S	*	*				59	93.5	123.2	-152.4	168.3	-173.2	177.1	0	121.2
51	R	33.4	Very low	34	Very low	202 Å²	202	146.8 Å²	146.8	76%	0.762	76%	0.761	S	S	*	*				91.3	149.5	117.8	-91.7	-170	-168	159.9	5	124.4
52	D	38.6	Very low	33.8	Very low	128 Å²	128	147.2 Å²	147.2	68%	0.684	76%	0.759	S	S	*	*			trans	76.9	127.8	150.3	-57	-15.4	0	0	0	117.9
53	E	35.8	Very low	33.7	Very low	153 Å²	153	149.9 Å²	149.9	72%	0.715	76%	0.763	S	S	*	*			cis	-163.2	167.3	-3.4	-141.5	-157.6	127.2	0	0	114.9
54	I	40.6	Very low	33.5	Very low	142 Å²	142	148.5 Å²	148.5	73%	0.728	77%	0.765	S	S	*	*			trans	63.6	168	164	14.4	178.5	0	0	0	119.2
55	P	32.7	Very low	33.3	Very low	114 Å²	114	148.7 Å²	148.7	74%	0.74	77%	0.773	S	S	*	*				-129.7	175	-126.2	43.3	-25.7	0	0	0	116.8
56	V	33.1	Very low	33.3	Very low	121 Å²	121	149.3 Å²	149.3	73%	0.733	78%	0.782	S	S	*	*			trans	-167.9	129.2	139	133.1	0	0	0	0	112.2
57	Q	34.2	Very low	33.1	Very low	181 Å²	181	148.1 Å²	148.1	85%	0.846	79%	0.789	S	S	*	*			trans	31.8	94.9	155	-57.5	173.3	-11.9	0	0	119.3
58	N	30.1	Very low	33	Very low	166 Å²	166	145.8 Å²	145.8	89%	0.888	80%	0.797	S	S	*	*			trans	-79.2	123.1	168.1	-82.7	-7.9	0	0	0	112.8
59	T	30.3	Very low	32.8	Very low	143 Å²	143	141.3 Å²	141.3	88%	0.877	80%	0.795	S	S	*	*			trans	-107.9	96.8	151	46.5	0	0	0	0	109.6
60	Q	32	Very low	32.6	Very low	181 Å²	181	143.7 Å²	143.7	85%	0.846	81%	0.806	S	S	*	*			trans	-152.4	136.7	164.5	-120.2	178.2	13.6	0	0	110.7
61	V	29.8	Very low	32.3	Very low	147 Å²	147	140.9 Å²	140.9	89%	0.891	81%	0.81	S	S	*	*			trans	-112.1	104.8	-179.6	178.1	0	0	0	0	109
62	V	30.7	Very low	32.2	Very low	110 Å²	110	137.1 Å²	137.1	67%	0.667	81%	0.811	S	S	*	*			trans	-148.9	127.3	163.8	-178.1	0	0	0	0	106.7
63	Y	30.6	Very low	31.9	Very low	232 Å²	232	137.9 Å²	137.9	91%	0.91	82%	0.82	S	S	*	*			trans	-160.1	136.5	133.4	-84.2	-53.7	0	0	0	109.8
64	G	30.5	Very low	31.6	Very low	74 Å²	74	137.6 Å²	137.6	76%	0.763	83%	0.829	S	S	*	*			trans	-81.9	173.2	175.2	0	0	0	0	0	112.5
65	T	27.4	Very low	31.2	Very low	151 Å²	151	133.9 Å²	133.9	93%	0.926	83%	0.825	S	S	*	*			trans	-75.5	140	-178.2	46.2	0	0	0	0	112.9
66	S	33.5	Very low	31.3	Very low	127 Å²	127	137.6 Å²	137.6	89%	0.888	83%	0.833	S	S	*	*			trans	-153.8	138.4	160.2	-174.6	0	0	0	0	109
67	A	28.3	Very low	31.1	Very low	99 Å²	99	139.2 Å²	139.2	82%	0.818	84%	0.837	S	S	*	*			trans	-107.7	126.4	-172.5	0	0	0	0	0	112.3
68	A	34.8	Very low	31	Very low	108 Å²	108	137.3 Å²	137.3	89%	0.893	84%	0.838	S	S	*	*			trans	-161.5	131.5	156.1	0	0	0	0	0	108.1
69	G	28.8	Very low	30.8	Very low	71 Å²	71	137.4 Å²	137.4	73%	0.732	83%	0.833	S	S	*	*			trans	-109.7	165.3	-176.2	0	0	0	0	0	113.9
70	F	31.9	Very low	30.9	Very low	222 Å²	222	138.5 Å²	138.5	97%	0.974	83%	0.833	S	S	*	*			trans	-147.9	154.8	162.7	-103.6	-80.8	0	0	0	110.1
71	A	31.4	Very low	30.7	Very low	87 Å²	87	135.4 Å²	135.4	72%	0.719	83%	0.826	S	S	*	*			trans	-98	156.3	-174.9	0	0	0	0	0	112.9
72	P	31.8	Very low	30.6	Very low	122 Å²	122	133.5 Å²	133.5	79%	0.792	82%	0.819	S	S	*	*			trans	-83.9	166.6	-176.2	34.6	-36.6	0	0	0	114.2
73	V	31.9	Very low	30.6	Very low	145 Å²	145	132.4 Å²	132.4	88%	0.879	82%	0.816	S	S	*	*			trans	-123.9	148.1	174.8	174	0	0	0	0	109.3
74	V	29.3	Very low	30.6	Very low	147 Å²	147	127.8 Å²	127.8	89%	0.891	81%	0.812	S	S	*	*			trans	-119.3	143.4	-168.6	175.5	0	0	0	0	112.6
75	G	32.6	Very low	31	Very low	64 Å²	64	128.8 Å²	128.8	66%	0.66	81%	0.805	S	S	*	*			trans	154.4	157.5	164.8	0	0	0	0	0	112.1
76	Q	34.8	Very low	31.2	Very low	191 Å²	191	128.1 Å²	128.1	89%	0.893	80%	0.795	S	S	*	*			cis	-164.6	152.4	-18.6	-139.2	175.2	9	0	0	108.7
77	N	27.8	Very low	31.1	Very low	155 Å²	155	127 Å²	127	83%	0.829	78%	0.783	S	S	*	*			trans	-51.5	148.5	-171	-48.6	-19	0	0	0	117
78	V	32.6	Very low	31.2	Very low	142 Å²	142	129.1 Å²	129.1	86%	0.861	78%	0.779	S	S	*	*			trans	-135.3	147.4	144.5	-179.4	0	0	0	0	108.9
79	Q	26.4	Very low	31	Very low	168 Å²	168	131.8 Å²	131.8	79%	0.785	77%	0.774	S	S	*	*			trans	-131.8	147.1	-173.7	174.5	-168.4	51.1	0	0	108.5
80	L	31.7	Very low	31	Very low	166 Å²	166	135.7 Å²	135.7	87%	0.869	78%	0.777	S	S	*	*			trans	-160.4	169.7	160.8	-110.9	164.4	0	0	0	112.3
81	V	27.2	Very low	30.9	Very low	116 Å²	116	129.7 Å²	129.7	70%	0.703	77%	0.768	S	S	*	*			trans	-142.5	170.8	-154.4	173.2	0	0	0	0	110.8
82	S	28.5	Very low	30.6	Very low	106 Å²	106	132.4 Å²	132.4	74%	0.741	77%	0.771	S	S	*	*			trans	95.8	142.4	158.6	-130.6	0	0	0	0	116.5
83	S	31	Very low	30.4	Very low	87 Å²	87	132.6 Å²	132.6	61%	0.608	77%	0.765	S	S	*	*			cis	179.9	135.5	-20.6	48.5	0	0	0	0	112.9
84	V	31.5	Very low	30.2	Very low	135 Å²	135	129.4 Å²	129.4	82%	0.818	75%	0.753	S	S	*	*				64.3	145.9	126.3	175.4	0	0	0	0	118.9
85	P	38.7	Very low	30.3	Very low	95 Å²	95	131.9 Å²	131.9	62%	0.617	75%	0.748	S	S	*	*			cis	-145.4	-151.1	-35.7	42.9	-21.4	0	0	0	113.3
86	N	31.7	Very low	30.2	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	75%	0.754	S	S	*	*			trans	78.7	143.7	151.9	-76	4.1	0	0	0	121
87	T	30.6	Very low	29.9	Very low	104 Å²	104	131.1 Å²	131.1	64%	0.638	74%	0.742	S	S	*	*			cis	-175.7	-179.7	-24.7	23.8	0	0	0	0	107.9
88	I	30.3	Very low	30.1	Very low	143 Å²	143	129.8 Å²	129.8	73%	0.733	75%	0.746	S	S	*	*			trans	77.7	132.8	159.5	-69	157.1	0	0	0	115.1
89	E	30.9	Very low	29.9	Very low	165 Å²	165	131.9 Å²	131.9	77%	0.771	75%	0.748	S	S	*	*			cis	-157.8	-174.6	-7.5	-116.3	-177.5	178.6	0	0	112.8
90	L	28	Very low	30.1	Very low	153 Å²	153	130.9 Å²	130.9	80%	0.801	75%	0.753	S	S	*	*			trans	-47.1	167.2	173.3	-67.9	73.1	0	0	0	114.4
91	A	31	Very low	30.3	Very low	95 Å²	95	129.2 Å²	129.2	79%	0.785	75%	0.749	S	S	*	*			cis	-162.4	179.7	37.4	0	0	0	0	0	115.9
92	N	24.7	Very low	30.3	Very low	145 Å²	145	129.5 Å²	129.5	78%	0.775	75%	0.754	S	S	*	*			trans	-90.5	173.1	-172.5	-59	-49.5	0	0	0	115.6
93	N	27.3	Very low	30.4	Very low	126 Å²	126	133.5 Å²	133.5	67%	0.674	76%	0.761	S	S	*	*			trans	89.2	86.8	148.6	-62.4	-25.4	0	0	0	121.5
94	A	28.5	Very low	30.3	Very low	77 Å²	77	137.7 Å²	137.7	64%	0.636	77%	0.771	S	S	*	*				79.1	173.4	108.3	0	0	0	0	0	121.2
95	Y	30.8	Very low	30.3	Very low	199 Å²	199	137 Å²	137	78%	0.78	77%	0.769	S	S	*	*			trans	55	128.1	173.6	6.4	-95.6	0	0	0	116.5
96	D	29.5	Very low	30	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	78%	0.775	S	S	*	*			cis	-177.7	165.2	27.4	-174.4	11.9	0	0	0	109.5
97	S	28.8	Very low	29.9	Very low	93 Å²	93	140.3 Å²	140.3	65%	0.65	78%	0.784	S	S	*	*			trans	6.7	127.9	160.2	-58.9	0	0	0	0	122
98	S	31.5	Very low	30.1	Very low	128 Å²	128	139.7 Å²	139.7	90%	0.895	79%	0.789	S	S	*	*				-151.6	150.5	124	-89.7	0	0	0	0	112.9
99	M	28.6	Very low	30	Very low	185 Å²	185	136.5 Å²	136.5	91%	0.911	79%	0.792	S	S	*	*			trans	-95.3	139.7	-167.3	-54.4	165.9	72.6	0	0	112
100	V	32.4	Very low	30.3	Very low	148 Å²	148	136.3 Å²	136.3	90%	0.897	80%	0.795	S	S	*	*			trans	-131.3	142.9	158.7	-177.7	0	0	0	0	109.2
101	V	34.3	Very low	30.7	Very low	130 Å²	130	137 Å²	137	79%	0.788	80%	0.8	S	S	*	*			trans	-72	142.6	-165.3	-179.9	0	0	0	0	112.3
102	P	27.8	Very low	31.2	Very low	123 Å²	123	139.4 Å²	139.4	80%	0.799	80%	0.798	S	S	*	*			trans	-72.1	148	173.7	30.9	-36.5	0	0	0	112.5
103	Q	30	Very low	32.6	Very low	190 Å²	190	140.5 Å²	140.5	89%	0.888	80%	0.798	S	S	*	*			trans	-115.5	123.6	173.6	-178.5	174.3	-19.6	0	0	109.7
104	E	29.6	Very low	33.6	Very low	174 Å²	174	140.2 Å²	140.2	81%	0.813	80%	0.803	S	S	*	*			trans	-76.3	138.8	-178.5	-65.3	-169.6	130.7	0	0	113.1
105	P	31.8	Very low	34.9	Very low	121 Å²	121	140.7 Å²	140.7	79%	0.786	79%	0.794	S	S	*	*			trans	-88.3	98.9	154.8	32.9	-27.2	0	0	0	110.2
106	S	31.1	Very low	36.6	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	78%	0.776	S	S	*	*			trans	8.2	114.9	158.5	56.1	0	0	0	0	118.7	A108	S106-A108 PolarHBondContact O-N 2.95Å
107	Q	30.3	Very low	38.1	Very low	195 Å²	195	133.6 Å²	133.6	91%	0.911	77%	0.769	S	S	*	*			trans	-63.6	117.2	162.3	-65.6	179.8	4.3	0	0	110.7
108	A	34.1	Very low	39.9	Very low	92 Å²	92	135.5 Å²	135.5	76%	0.76	77%	0.768	S	S	*	*			trans	-102.7	114.8	159.4	0	0	0	0	0	107.7	S106 L110	S106-A108 PolarHBondContact O-N 2.95Å; A108-L110 PolarHBondContact O-N 3.36Å
109	G	29.5	Very low	41.5	Very low	76 Å²	76	131.1 Å²	131.1	78%	0.784	73%	0.733	S	S	*	*			trans	-69	128.3	-178.4	0	0	0	0	0	111.7
110	L	36.6	Very low	43	Very low	160 Å²	160	123.3 Å²	123.3	84%	0.838	70%	0.696	S	S	*	*			trans	-118.1	115.9	161.2	-66.8	176.7	0	0	0	106.7	A108 I112	A108-L110 PolarHBondContact O-N 3.36Å; L110-I112 PolarHBondContact O-N 3.33Å
111	D	36	Very low	44.7	Very low	168 Å²	168	121.6 Å²	121.6	90%	0.898	68%	0.678	S	S	*	*			trans	-66.1	123.6	-178.2	-67.5	-62.2	0	0	0	110.4	E113	D111-E113 PolarHBondContact O-N 2.89Å
112	I	42.3	Very low	46.3	Very low	146 Å²	146	120.8 Å²	120.8	75%	0.749	66%	0.664	S	S	*	*			trans	-85.1	108.3	-177.5	-60.2	169.1	0	0	0	107.9	L110	L110-I112 PolarHBondContact O-N 3.33Å
113	E	53.4	Low	47.9	Very low	167 Å²	167	116 Å²	116	78%	0.78	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-58.9	141.7	172.9	-81.7	-157.7	123.8	0	0	111.4	D111	D111-E113 PolarHBondContact O-N 2.89Å
114	P	48.8	Very low	49.3	Very low	121 Å²	121	111 Å²	111	79%	0.786	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-68.4	136.5	178.4	29	-34.4	0	0	0	111.2	D116	P114-D116 PolarHBondContact O-N 2.77Å
115	I	55.8	Low	51	Low	87 Å²	87	106.6 Å²	106.6	45%	0.446	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-56.8	122.2	-179.9	-62.6	164.5	0	0	0	110.6	L117 V120 I153	I115-L117 PolarHBondContact O-N 3.07Å; I115-V120 HydrophobicContact CG2-CG2 4.47Å; I115-I153 HydrophobicContact CD1-CD1 4.05Å; I115-I153 HydrophobicContact CG1-CD1 4.41Å; I115-I153 HydrophobicContact CG2-CD1 4.46Å
116	D	66.1	Low	52.4	Low	73 Å²	73	109.3 Å²	109.3	39%	0.39	60%	0.596	S	S	.	*			trans	-68.6	94.3	174.7	-173.9	-14.7	0	0	0	111.1	P114 E118 E119 V120	P114-D116 PolarHBondContact O-N 2.77Å; D116-E118 VanDerWaalsContact C-N 3.26Å; D116-E118 PolarHBondContact O-N 2.71Å; D116-E118 WeakPolarHBondContact OD1-CA 3.34Å; D116-E118 WeakPolarHBondContact OD1-CB 3.41Å; D116-E118 PolarHBondContact OD1-N 2.96Å; D116-E119 HydrophobicContact CB-CB 3.97Å; D116-E119 PolarHBondContact O-N 2.85Å; D116-E119 PolarHBondContact OD1-N 2.79Å; D116-E119 WeakPolarHBondContact OD2-CB 3.41Å; D116-V120 WeakPolarHBondContact O-CG2 3.34Å; D116-V120 PolarHBondContact O-N 3.1Å; D116-V120 VanDerWaalsContact O-N 3.15Å
117	L	62.2	Low	53.6	Low	123 Å²	123	106.7 Å²	106.7	64%	0.644	57%	0.573	S	S	*	*	H	α-helix	trans	-65.5	-23.2	176.3	-76.2	149.8	0	0	0	113.2	I115 Q121	I115-L117 PolarHBondContact O-N 3.07Å; L117-Q121 WeakPolarHBondContact O-CB 3.47Å; L117-Q121 WeakPolarHBondContact O-CG 3.19Å; L117-Q121 PolarHBondContact O-N 2.98Å; L117-Q121 VanDerWaalsContact O-N 3.11Å; L117-Q121 PolarHBondContact O-NE2 3.29Å
118	E	66.5	Low	55.3	Low	133 Å²	133	102.7 Å²	102.7	62%	0.621	56%	0.563	S	S	*	*	H	α-helix	trans	-80.9	-37.8	175.9	-78.2	-161.8	165.4	0	0	112.1	D116 Q121 K122	D116-E118 VanDerWaalsContact C-N 3.26Å; D116-E118 PolarHBondContact O-N 2.71Å; D116-E118 WeakPolarHBondContact OD1-CA 3.34Å; D116-E118 WeakPolarHBondContact OD1-CB 3.41Å; D116-E118 PolarHBondContact OD1-N 2.96Å; E118-Q121 PolarHBondContact O-N 3.33Å; E118-K122 WeakPolarHBondContact O-CB 3.22Å; E118-K122 WeakPolarHBondContact O-CG 3.48Å; E118-K122 PolarHBondContact O-N 3.38Å
119	E	63.4	Low	56.7	Low	36 Å²	36	99.7 Å²	99.7	17%	0.168	54%	0.539	C	S	.	.	H	α-helix	trans	-61.5	-45.5	170.8	-169.4	89	-95.3	0	0	110.2	D116 Q121 K122 I123 R204	D116-E119 HydrophobicContact CB-CB 3.97Å; D116-E119 PolarHBondContact O-N 2.85Å; D116-E119 PolarHBondContact OD1-N 2.79Å; D116-E119 WeakPolarHBondContact OD2-CB 3.41Å; E119-Q121 VanDerWaalsContact C-N 3.34Å; E119-Q121 PolarHBondContact O-N 3.21Å; E119-K122 WeakPolarHBondContact O-CB 3.46Å; E119-K122 PolarHBondContact O-N 2.79Å; E119-I123 HydrophobicContact CG-CD1 4.17Å; E119-I123 VanDerWaalsContact O-CG1 3.28Å; E119-I123 WeakPolarHBondContact O-CG1 3.2Å; E119-I123 PolarHBondContact O-N 2.58Å; E119-R204 IonicContact OE2-CZ 2.93Å; E119-R204 VanDerWaalsContact OE2-CZ 3.25Å; E119-R204 IonicContact OE2-NH1 2.7Å; E119-R204 PolarHBondContact OE2-NH1 2.97Å; E119-R204 IonicContact OE2-NH2 2.65Å; E119-R204 PolarHBondContact OE2-NH2 2.84Å
120	V	61.7	Low	58.6	Low	20 Å²	20	100.1 Å²	100.1	12%	0.121	54%	0.535	C	S	.	.	H	α-helix	trans	-60.4	-42.3	175.4	174.1	0	0	0	0	111.4	I115 D116 I123 Q124 I146 T155	I115-V120 HydrophobicContact CG2-CG2 4.47Å; D116-V120 WeakPolarHBondContact O-CG2 3.34Å; D116-V120 PolarHBondContact O-N 3.1Å; D116-V120 VanDerWaalsContact O-N 3.15Å; V120-I123 PolarHBondContact O-N 2.62Å; V120-Q124 WeakPolarHBondContact O-CG 3.21Å; V120-Q124 PolarHBondContact O-N 2.9Å; V120-I146 HydrophobicContact CG1-CD1 4.14Å; V120-I146 HydrophobicContact CG2-CD1 4.15Å; V120-T155 HydrophobicContact CG1-CG2 4.41Å
121	Q	67.2	Low	60.3	Low	113 Å²	113	95.4 Å²	95.4	53%	0.528	51%	0.511	S	S	.	.	H	α-helix	trans	-67.3	-39.4	175.1	-77	171	68.6	0	0	112.8	L117 E118 E119 I123 Q124 A125	L117-Q121 WeakPolarHBondContact O-CB 3.47Å; L117-Q121 WeakPolarHBondContact O-CG 3.19Å; L117-Q121 PolarHBondContact O-N 2.98Å; L117-Q121 VanDerWaalsContact O-N 3.11Å; L117-Q121 PolarHBondContact O-NE2 3.29Å; E118-Q121 PolarHBondContact O-N 3.33Å; E119-Q121 VanDerWaalsContact C-N 3.34Å; E119-Q121 PolarHBondContact O-N 3.21Å; Q121-I123 VanDerWaalsContact C-N 3.29Å; Q121-I123 PolarHBondContact O-N 3.44Å; Q121-Q124 PolarHBondContact O-N 2.89Å; Q121-A125 WeakPolarHBondContact O-CB 3.36Å; Q121-A125 PolarHBondContact O-N 3.09Å
122	K	68.6	Low	62	Low	112 Å²	112	92.1 Å²	92.1	49%	0.487	50%	0.498	S	S	.	.	H	α-helix	trans	-59.7	-38.4	171.9	-85.4	165.1	179.1	150	0	112	E118 E119 R126	E118-K122 WeakPolarHBondContact O-CB 3.22Å; E118-K122 WeakPolarHBondContact O-CG 3.48Å; E118-K122 PolarHBondContact O-N 3.38Å; E119-K122 WeakPolarHBondContact O-CB 3.46Å; E119-K122 PolarHBondContact O-N 2.79Å; K122-R126 WeakPolarHBondContact O-CG 3.48Å; K122-R126 PolarHBondContact O-N 3.19Å
123	I	60.5	Low	63.7	Low	24 Å²	24	92.7 Å²	92.7	12%	0.123	50%	0.503	C	S	.	.	H	α-helix	trans	-67.3	-47.4	176	-70.4	164.7	0	0	0	110.4	M5 E119 V120 Q121 A125 R126 I146	M5-I123 HydrophobicContact SD-CB 4.37Å; M5-I123 HydrophobicContact SD-CD1 4.07Å; M5-I123 HydrophobicContact SD-CG1 3.86Å; M5-I123 HydrophobicContact SD-CG2 3.64Å; E119-I123 HydrophobicContact CG-CD1 4.17Å; E119-I123 VanDerWaalsContact O-CG1 3.28Å; E119-I123 WeakPolarHBondContact O-CG1 3.2Å; E119-I123 PolarHBondContact O-N 2.58Å; V120-I123 PolarHBondContact O-N 2.62Å; Q121-I123 VanDerWaalsContact C-N 3.29Å; Q121-I123 PolarHBondContact O-N 3.44Å; I123-A125 VanDerWaalsContact C-N 3.35Å; I123-A125 PolarHBondContact O-N 2.9Å; I123-R126 PolarHBondContact O-N 3.3Å; I123-I146 HydrophobicContact CD1-CD1 4.28Å; I123-I146 HydrophobicContact CG2-CD1 4.21Å
124	Q	60.3	Low	64.7	Low	83 Å²	83	85.5 Å²	85.5	39%	0.388	47%	0.472	S	S	.	.	H	α-helix	trans	-59.6	-42.7	175.9	-71.2	175.5	2.1	0	0	112.4	V120 Q121 R126 M127 T155	V120-Q124 WeakPolarHBondContact O-CG 3.21Å; V120-Q124 PolarHBondContact O-N 2.9Å; Q121-Q124 PolarHBondContact O-N 2.89Å; Q124-R126 VanDerWaalsContact C-N 3.31Å; Q124-R126 PolarHBondContact O-N 3.16Å; Q124-M127 CarbonylContact O-C 3.57Å; Q124-M127 PolarHBondContact O-N 3.03Å; Q124-T155 HydrophobicContact CG-CG2 4.49Å
125	A	64.1	Low	66	Low	82 Å²	82	84.5 Å²	84.5	68%	0.678	47%	0.465	S	S	*	.	H	α-helix	trans	-67.3	-26.2	-179.7	0	0	0	0	0	113.8	Q121 I123	Q121-A125 WeakPolarHBondContact O-CB 3.36Å; Q121-A125 PolarHBondContact O-N 3.09Å; I123-A125 VanDerWaalsContact C-N 3.35Å; I123-A125 PolarHBondContact O-N 2.9Å
126	R	62.6	Low	66.9	Low	179 Å²	179	83.7 Å²	83.7	68%	0.675	46%	0.464	S	S	*	.	H	α-helix	trans	-73	-24.1	177.2	-82.8	179.3	173.6	129.7	-2.2	113.9	K122 I123 Q124	K122-R126 WeakPolarHBondContact O-CG 3.48Å; K122-R126 PolarHBondContact O-N 3.19Å; I123-R126 PolarHBondContact O-N 3.3Å; Q124-R126 VanDerWaalsContact C-N 3.31Å; Q124-R126 PolarHBondContact O-N 3.16Å
127	M	55.8	Low	67.1	Low	51 Å²	51	81.5 Å²	81.5	25%	0.251	46%	0.46	S	S	.	.	S	Bend	trans	-139.6	89.5	-177.9	-61.1	-161.9	-55.9	0	0	111.3	E3 Q124 R144	E3-M127 VanDerWaalsContact OE2-CE 3.26Å; E3-M127 WeakPolarHBondContact OE2-CE 3.42Å; Q124-M127 CarbonylContact O-C 3.57Å; Q124-M127 PolarHBondContact O-N 3.03Å; M127-R144 PolarHBondContact O-NH1 3.1Å; M127-R144 PolarHBondContact O-NH2 3.26Å
128	P	65.4	Low	67.6	Low	110 Å²	110	77.1 Å²	77.1	71%	0.714	44%	0.439	S	S	*	.			trans	-65.3	153.8	169.5	27.8	-34.3	0	0	0	111.6
129	A	64.8	Low	68	Low	30 Å²	30	77.3 Å²	77.3	25%	0.248	44%	0.444	C	S	.	.			trans	-74.4	145.8	171.4	0	0	0	0	0	110.5
130	A	69.4	Low	68.6	Low	84 Å²	84	80.2 Å²	80.2	69%	0.694	46%	0.456	S	S	*	.	S	Bend	trans	-72.5	-32.2	-176.8	0	0	0	0	0	112.7	K140	A130-K140 PolarHBondContact N-O 3.23Å; A130-K140 VanDerWaalsContact N-O 3.08Å
131	D	71.7	Confident	69.4	Low	62 Å²	62	80 Å²	80	33%	0.332	46%	0.455	S	S	.	.			trans	-139.5	113.8	160.4	-87.2	-65.1	0	0	0	107.9	N133 A134 K140	D131-N133 PolarHBondContact O-N 3.18Å; D131-A134 HydrophobicContact CB-CB 3.91Å; D131-A134 WeakPolarHBondContact O-CB 3.37Å; D131-A134 PolarHBondContact O-N 3.46Å; D131-A134 VanDerWaalsContact O-N 3.17Å; D131-K140 HydrophobicContact CB-CB 4.23Å; D131-K140 HydrophobicContact CB-CD 4.29Å; D131-K140 PolarHBondContact N-O 2.9Å; D131-K140 WeakPolarHBondContact OD2-CD 3.17Å; D131-K140 WeakPolarHBondContact OD2-CE 3.37Å; D131-K140 IonicContact OD2-NZ 3.58Å; D131-K140 PolarHBondContact OD2-NZ 3.04Å
132	P	70.8	Confident	70	Confident	99 Å²	99	75.3 Å²	75.3	64%	0.643	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.9	174.6	27.9	-34.5	0	0	0	112.3	A134	P132-A134 VanDerWaalsContact C-N 3.28Å; P132-A134 PolarHBondContact O-N 2.89Å
133	N	77.7	Confident	70.5	Confident	157 Å²	157	71 Å²	71	84%	0.84	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.5	176.1	-65.6	-18.6	0	0	0	113.6	D131	D131-N133 PolarHBondContact O-N 3.18Å
134	A	75.2	Confident	71.5	Confident	16 Å²	16	71.6 Å²	71.6	13%	0.132	42%	0.417	C	S	.	.	S	Bend	trans	-81.7	146.4	176.6	0	0	0	0	0	111	D131 P132 K140 N141	D131-A134 HydrophobicContact CB-CB 3.91Å; D131-A134 WeakPolarHBondContact O-CB 3.37Å; D131-A134 PolarHBondContact O-N 3.46Å; D131-A134 VanDerWaalsContact O-N 3.17Å; P132-A134 VanDerWaalsContact C-N 3.28Å; P132-A134 PolarHBondContact O-N 2.89Å; A134-K140 HydrophobicContact CB-CB 3.58Å; A134-K140 HydrophobicContact CB-CD 4.35Å; A134-N141 HydrophobicContact CB-CB 4.06Å; A134-N141 VanDerWaalsContact O-CB 3.27Å; A134-N141 WeakPolarHBondContact O-CB 3.43Å; A134-N141 PolarHBondContact O-ND2 2.94Å
135	P	76.8	Confident	72.5	Confident	100 Å²	100	67.8 Å²	67.8	65%	0.649	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-61.3	140.9	-178.6	24	-33.5	0	0	0	111.8	S138	P135-S138 WeakPolarHBondContact O-CB 3.4Å; P135-S138 PolarHBondContact O-N 3.44Å; P135-S138 VanDerWaalsContact O-N 3.15Å; P135-S138 PolarHBondContact O-OG 2.89Å
136	V	73.4	Confident	73.2	Confident	70 Å²	70	64.4 Å²	64.4	42%	0.424	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	134.9	178.7	170.6	0	0	0	0	110.6	S138 I143 V158	V136-S138 VanDerWaalsContact C-N 3.34Å; V136-I143 HydrophobicContact CG1-CD1 4.24Å; V136-I143 HydrophobicContact CG1-CG1 3.59Å; V136-V158 HydrophobicContact CG1-CG2 4.14Å
137	G	70.5	Confident	73.9	Confident	28 Å²	28	58 Å²	58	29%	0.289	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	-7.5	-177.3	0	0	0	0	0	114.8	M1 N141	M1-G137 PolarHBondContact N-O 2.69Å; G137-N141 PolarHBondContact N-O 3.45Å
138	S	73.3	Confident	74.4	Confident	30 Å²	30	58.4 Å²	58.4	21%	0.21	35%	0.348	C	S	.	.	S	Bend	trans	-64.4	-179.4	172.9	66.4	0	0	0	0	113	M1 P135 V136 K140 N141	M1-S138 PolarHBondContact N-O 2.73Å; P135-S138 WeakPolarHBondContact O-CB 3.4Å; P135-S138 PolarHBondContact O-N 3.44Å; P135-S138 VanDerWaalsContact O-N 3.15Å; P135-S138 PolarHBondContact O-OG 2.89Å; V136-S138 VanDerWaalsContact C-N 3.34Å; S138-K140 VanDerWaalsContact C-N 3.3Å; S138-K140 PolarHBondContact OG-N 2.85Å; S138-N141 PolarHBondContact N-O 3.34Å; S138-N141 PolarHBondContact OG-N 2.97Å
139	N	74.2	Confident	74.8	Confident	138 Å²	138	55.8 Å²	55.8	74%	0.738	34%	0.341	S	S	*	.	S	Bend	trans	-79.2	-11.4	170.2	65.2	-32.3	0	0	0	113.3
140	K	75.9	Confident	75.1	Confident	97 Å²	97	62.1 Å²	62.1	42%	0.422	37%	0.371	S	S	.	.	S	Bend	trans	-102.3	-28.8	179.3	-73.7	-179	157.1	-150.2	0	113.2	A130 D131 A134 S138	A130-K140 PolarHBondContact N-O 3.23Å; A130-K140 VanDerWaalsContact N-O 3.08Å; D131-K140 HydrophobicContact CB-CB 4.23Å; D131-K140 HydrophobicContact CB-CD 4.29Å; D131-K140 PolarHBondContact N-O 2.9Å; D131-K140 WeakPolarHBondContact OD2-CD 3.17Å; D131-K140 WeakPolarHBondContact OD2-CE 3.37Å; D131-K140 IonicContact OD2-NZ 3.58Å; D131-K140 PolarHBondContact OD2-NZ 3.04Å; A134-K140 HydrophobicContact CB-CB 3.58Å; A134-K140 HydrophobicContact CB-CD 4.35Å; S138-K140 VanDerWaalsContact C-N 3.3Å; S138-K140 PolarHBondContact OG-N 2.85Å
141	N	79.6	Confident	75.4	Confident	15 Å²	15	63.1 Å²	63.1	8%	0.08	36%	0.361	C	S	.	.	S	Bend	trans	-129	84	175.4	-169.7	7.5	0	0	0	109.5	A134 G137 S138 Q156	A134-N141 HydrophobicContact CB-CB 4.06Å; A134-N141 VanDerWaalsContact O-CB 3.27Å; A134-N141 WeakPolarHBondContact O-CB 3.43Å; A134-N141 PolarHBondContact O-ND2 2.94Å; G137-N141 PolarHBondContact N-O 3.45Å; S138-N141 PolarHBondContact N-O 3.34Å; S138-N141 PolarHBondContact OG-N 2.97Å; N141-Q156 PolarHBondContact OD1-NE2 3.41Å; N141-Q156 VanDerWaalsContact OD1-NE2 3.09Å
142	P	79.1	Confident	75.7	Confident	14 Å²	14	63.4 Å²	63.4	9%	0.091	36%	0.358	C	S	.	.			trans	-71.1	148.6	-179.3	30.1	-35.2	0	0	0	111.9	M1 Q156	M1-P142 HydrophobicContact CB-CB 4.02Å; M1-P142 HydrophobicContact CG-CB 4.22Å; M1-P142 CarbonylContact O-C 3.6Å; M1-P142 VanDerWaalsContact O-CA 3.28Å; M1-P142 WeakPolarHBondContact O-CA 3.49Å; M1-P142 WeakPolarHBondContact O-CB 3.38Å; P142-Q156 PolarHBondContact O-NE2 3.46Å; P142-Q156 PolarHBondContact O-OE1 3.45Å
143	I	80.1	Confident	76.1	Confident	22 Å²	22	60.7 Å²	60.7	11%	0.113	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	143.4	168	-68.2	160.9	0	0	0	108.8	M1 V2 E3 V136 I145 I166	M1-I143 PolarHBondContact O-N 3.01Å; V2-I143 CarbonylContact C-O 3.49Å; V2-I143 VanDerWaalsContact CA-O 3.32Å; V2-I143 WeakPolarHBondContact CA-O 3.33Å; V2-I143 HydrophobicContact CG1-CG2 4.37Å; V2-I143 HydrophobicContact CG2-CB 4.38Å; E3-I143 PolarHBondContact N-O 3.33Å; V136-I143 HydrophobicContact CG1-CD1 4.24Å; V136-I143 HydrophobicContact CG1-CG1 3.59Å; I143-I145 HydrophobicContact CG2-CD1 4.42Å; I143-I145 HydrophobicContact CG2-CG1 4.18Å; I143-I166 HydrophobicContact CD1-CD1 4.37Å
144	R	80.7	Confident	76.3	Confident	37 Å²	37	54.8 Å²	54.8	14%	0.14	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	123	-175.6	-63.1	166.9	-173.2	-163.4	-10.5	109.2	E3 M127 T154 T155	E3-R144 WeakPolarHBondContact O-CA 3.37Å; M127-R144 PolarHBondContact O-NH1 3.1Å; M127-R144 PolarHBondContact O-NH2 3.26Å; R144-T154 WeakPolarHBondContact O-CA 3.45Å; R144-T155 PolarHBondContact O-N 2.85Å
145	I	81.4	Confident	76.2	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.7	-179.6	-58.2	171.6	0	0	0	108	V2 E3 F4 M5 I143 Y152 I153 L163 I166	V2-I145 HydrophobicContact CG1-CD1 3.94Å; V2-I145 HydrophobicContact CG1-CG1 4.37Å; E3-I145 PolarHBondContact O-N 3.07Å; F4-I145 WeakPolarHBondContact CA-O 3.49Å; F4-I145 HydrophobicContact CD2-CB 3.85Å; F4-I145 HydrophobicContact CD2-CD1 4.44Å; F4-I145 HydrophobicContact CD2-CG2 4.21Å; F4-I145 HydrophobicContact CE2-CB 3.65Å; F4-I145 HydrophobicContact CE2-CD1 3.92Å; F4-I145 HydrophobicContact CE2-CG1 4.37Å; F4-I145 HydrophobicContact CE2-CG2 3.57Å; F4-I145 HydrophobicContact CZ-CB 4.31Å; F4-I145 HydrophobicContact CZ-CG2 3.75Å; M5-I145 PolarHBondContact N-O 3.06Å; I143-I145 HydrophobicContact CG2-CD1 4.42Å; I143-I145 HydrophobicContact CG2-CG1 4.18Å; I145-Y152 HydrophobicContact CG2-CD1 4.2Å; I145-I153 WeakPolarHBondContact CA-O 3.41Å; I145-L163 HydrophobicContact CD1-CD1 3.67Å; I145-L163 HydrophobicContact CG1-CD1 3.88Å; I145-L163 HydrophobicContact CG2-CD1 4.21Å; I145-I166 HydrophobicContact CD1-CB 4.4Å; I145-I166 HydrophobicContact CD1-CG2 3.58Å
146	I	78.7	Confident	76.1	Confident	11 Å²	11	52.5 Å²	52.5	6%	0.056	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.6	176.7	-55.2	176.6	0	0	0	107.1	V120 I123 Q148 Y152 I153 T155	V120-I146 HydrophobicContact CG1-CD1 4.14Å; V120-I146 HydrophobicContact CG2-CD1 4.15Å; I123-I146 HydrophobicContact CD1-CD1 4.28Å; I123-I146 HydrophobicContact CG2-CD1 4.21Å; I146-Q148 HydrophobicContact CG2-CG 4.18Å; I146-Y152 WeakPolarHBondContact O-CA 3.34Å; I146-I153 PolarHBondContact N-O 2.64Å; I146-I153 PolarHBondContact O-N 2.84Å; I146-T155 HydrophobicContact CD1-CG2 3.78Å; I146-T155 HydrophobicContact CG1-CG2 4.38Å
147	Q	76.8	Confident	76.3	Confident	44 Å²	44	57.3 Å²	57.3	21%	0.206	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.7	172.9	-173.5	176.4	-4.8	0	0	109.9	F4 M5 G149 Q151 Y152	F4-Q147 HydrophobicContact CE1-CB 4.13Å; M5-Q147 WeakPolarHBondContact O-CB 3.4Å; M5-Q147 PolarHBondContact O-N 3.49Å; Q147-G149 WeakPolarHBondContact CG-O 3.35Å; Q147-G149 PolarHBondContact NE2-O 2.91Å; Q147-Q151 WeakPolarHBondContact CA-O 3.48Å; Q147-Y152 HydrophobicContact CB-CD1 4.08Å; Q147-Y152 HydrophobicContact CB-CE1 4.15Å; Q147-Y152 HydrophobicContact CG-CD1 4.02Å; Q147-Y152 HydrophobicContact CG-CE1 3.76Å
148	Q	68.2	Low	76.4	Confident	61 Å²	61	57.2 Å²	57.2	29%	0.285	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	93.1	174.5	-67.3	-171.2	-15.4	0	0	108	I146 N150 Q151 I153	I146-Q148 HydrophobicContact CG2-CG 4.18Å; Q148-N150 PolarHBondContact O-N 3.24Å; Q148-N150 VanDerWaalsContact O-N 3.16Å; Q148-Q151 PolarHBondContact N-O 2.7Å; Q148-Q151 PolarHBondContact O-N 3.42Å; Q148-I153 HydrophobicContact CG-CD1 4.42Å
149	G	72.6	Confident	76.7	Confident	54 Å²	54	58.6 Å²	58.6	56%	0.557	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	-116	-170.7	0	0	0	0	0	111.4	Q147	Q147-G149 WeakPolarHBondContact CG-O 3.35Å; Q147-G149 PolarHBondContact NE2-O 2.91Å
150	N	72.2	Confident	77	Confident	163 Å²	163	57.4 Å²	57.4	87%	0.872	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-5.4	178.6	-64.1	-0.5	0	0	0	113.4	Q148	Q148-N150 PolarHBondContact O-N 3.24Å; Q148-N150 VanDerWaalsContact O-N 3.16Å
151	Q	73.9	Confident	77.3	Confident	106 Å²	106	58.7 Å²	58.7	50%	0.495	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	149.8	177.5	-65.8	-171.9	1.8	0	0	111.7	Q147 Q148	Q147-Q151 WeakPolarHBondContact CA-O 3.48Å; Q148-Q151 PolarHBondContact N-O 2.7Å; Q148-Q151 PolarHBondContact O-N 3.42Å
152	Y	79	Confident	77.2	Confident	67 Å²	67	62.7 Å²	62.7	26%	0.263	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	128.2	177.2	-60.5	-85.8	0	0	0	108.8	F4 I145 I146 Q147 I167	F4-Y152 AromaticContact CE1-CD1 3.94Å; F4-Y152 HydrophobicContact CE1-CD1 3.94Å; F4-Y152 AromaticContact CE1-CE1 3.77Å; F4-Y152 HydrophobicContact CE1-CE1 3.77Å; F4-Y152 AromaticContact CZ-CD1 3.57Å; F4-Y152 HydrophobicContact CZ-CD1 3.57Å; F4-Y152 AromaticContact CZ-CE1 3.6Å; F4-Y152 HydrophobicContact CZ-CE1 3.6Å; I145-Y152 HydrophobicContact CG2-CD1 4.2Å; I146-Y152 WeakPolarHBondContact O-CA 3.34Å; Q147-Y152 HydrophobicContact CB-CD1 4.08Å; Q147-Y152 HydrophobicContact CB-CE1 4.15Å; Q147-Y152 HydrophobicContact CG-CD1 4.02Å; Q147-Y152 HydrophobicContact CG-CE1 3.76Å; Y152-I167 HydrophobicContact CD1-CD1 4.37Å; Y152-I167 HydrophobicContact CD1-CG1 4.25Å; Y152-I167 HydrophobicContact CD2-CD1 3.53Å; Y152-I167 HydrophobicContact CD2-CG1 4.07Å; Y152-I167 HydrophobicContact CD2-CG2 4.19Å; Y152-I167 HydrophobicContact CE2-CD1 4.28Å; Y152-I167 HydrophobicContact CE2-CG1 4.47Å; Y152-I167 HydrophobicContact CE2-CG2 3.81Å; Y152-I167 HydrophobicContact CG-CD1 3.57Å; Y152-I167 HydrophobicContact CG-CG1 3.94Å
153	I	78.4	Confident	77.4	Confident	43 Å²	43	62.6 Å²	62.6	22%	0.221	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125	-171.9	-55.7	177.1	0	0	0	109.4	I115 I145 I146 Q148	I115-I153 HydrophobicContact CD1-CD1 4.05Å; I115-I153 HydrophobicContact CG1-CD1 4.41Å; I115-I153 HydrophobicContact CG2-CD1 4.46Å; I145-I153 WeakPolarHBondContact CA-O 3.41Å; I146-I153 PolarHBondContact N-O 2.64Å; I146-I153 PolarHBondContact O-N 2.84Å; Q148-I153 HydrophobicContact CG-CD1 4.42Å
154	T	81.9	Confident	77.4	Confident	32 Å²	32	67.7 Å²	67.7	20%	0.196	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	143.1	171	176.9	0	0	0	0	110.9	R144 Q156 V158 L163	R144-T154 WeakPolarHBondContact O-CA 3.45Å; T154-Q156 VanDerWaalsContact CG2-O 3.3Å; T154-Q156 WeakPolarHBondContact CG2-O 3.25Å; T154-Q156 PolarHBondContact OG1-N 2.97Å; T154-Q156 VanDerWaalsContact OG1-N 3.16Å; T154-Q156 PolarHBondContact OG1-O 3.38Å; T154-V158 HydrophobicContact CG2-CB 4.39Å; T154-L163 HydrophobicContact CG2-CD2 4.35Å
155	T	74.5	Confident	77.3	Confident	38 Å²	38	70.1 Å²	70.1	23%	0.233	37%	0.368	C	S	.	.	S	Bend	trans	-98.1	16.9	171.1	71.2	0	0	0	0	113.2	V120 Q124 R144 I146	V120-T155 HydrophobicContact CG1-CG2 4.41Å; Q124-T155 HydrophobicContact CG-CG2 4.49Å; R144-T155 PolarHBondContact O-N 2.85Å; I146-T155 HydrophobicContact CD1-CG2 3.78Å; I146-T155 HydrophobicContact CG1-CG2 4.38Å
156	Q	74.6	Confident	77	Confident	31 Å²	31	71.5 Å²	71.5	15%	0.145	38%	0.376	C	S	.	.	S	Bend	trans	-146.9	156.7	-174.9	-70.6	169.8	-5.5	0	0	110.2	N141 P142 T154 V158	N141-Q156 PolarHBondContact OD1-NE2 3.41Å; N141-Q156 VanDerWaalsContact OD1-NE2 3.09Å; P142-Q156 PolarHBondContact O-NE2 3.46Å; P142-Q156 PolarHBondContact O-OE1 3.45Å; T154-Q156 VanDerWaalsContact CG2-O 3.3Å; T154-Q156 WeakPolarHBondContact CG2-O 3.25Å; T154-Q156 PolarHBondContact OG1-N 2.97Å; T154-Q156 VanDerWaalsContact OG1-N 3.16Å; T154-Q156 PolarHBondContact OG1-O 3.38Å; Q156-V158 VanDerWaalsContact C-N 3.34Å; Q156-V158 PolarHBondContact O-N 3.08Å
157	D	76.2	Confident	76.8	Confident	171 Å²	171	72.2 Å²	72.2	91%	0.914	38%	0.379	S	S	*	.	S	Bend	trans	-65.5	85.1	-178.2	-52.3	-38.5	0	0	0	112.1
158	V	72.5	Confident	76.7	Confident	26 Å²	26	76.1 Å²	76.1	16%	0.158	40%	0.398	C	S	.	.			trans	-131.1	126.3	177.9	-180	0	0	0	0	106.8	V136 T154 Q156 H162	V136-V158 HydrophobicContact CG1-CG2 4.14Å; T154-V158 HydrophobicContact CG2-CB 4.39Å; Q156-V158 VanDerWaalsContact C-N 3.34Å; Q156-V158 PolarHBondContact O-N 3.08Å; V158-H162 HydrophobicContact CG1-CB 3.74Å
159	S	80.9	Confident	76.8	Confident	59 Å²	59	74.9 Å²	74.9	41%	0.413	39%	0.394	S	S	.	.			trans	-67.7	150.2	-179.5	53.5	0	0	0	0	112.2	E161 H162 L163	S159-E161 PolarHBondContact O-N 3.27Å; S159-E161 VanDerWaalsContact O-N 3.15Å; S159-H162 PolarHBondContact O-N 3.13Å; S159-H162 PolarHBondContact OG-ND1 3.27Å; S159-L163 PolarHBondContact O-N 3.34Å
160	D	79.1	Confident	76.5	Confident	113 Å²	113	72.8 Å²	72.8	60%	0.604	37%	0.37	S	S	*	.	H	α-helix	trans	-56.6	-33.8	-177.8	-58.5	-42.4	0	0	0	112.8	L163 Q164	D160-L163 PolarHBondContact O-N 2.76Å; D160-Q164 WeakPolarHBondContact O-CB 3.35Å; D160-Q164 WeakPolarHBondContact O-CG 3.37Å; D160-Q164 PolarHBondContact O-N 2.99Å
161	E	82.4	Confident	76.2	Confident	124 Å²	124	67.7 Å²	67.7	58%	0.579	35%	0.345	S	S	*	.	H	α-helix	trans	-61.2	-47.6	173.1	-171.4	-169.4	173.3	0	0	112.2	S159 L163 Q164 Q165	S159-E161 PolarHBondContact O-N 3.27Å; S159-E161 VanDerWaalsContact O-N 3.15Å; E161-L163 VanDerWaalsContact C-N 3.32Å; E161-L163 PolarHBondContact O-N 3.19Å; E161-Q164 PolarHBondContact O-N 3.04Å; E161-Q165 VanDerWaalsContact O-CG 3.26Å; E161-Q165 WeakPolarHBondContact O-CG 3.21Å; E161-Q165 PolarHBondContact O-N 3.05Å
162	H	79	Confident	75.6	Confident	98 Å²	98	67.7 Å²	67.7	45%	0.454	35%	0.348	S	S	.	.	H	α-helix	trans	-67.5	-34.9	175.5	-71	126.9	0	0	0	111.6	V158 S159 Q165 I166	V158-H162 HydrophobicContact CG1-CB 3.74Å; S159-H162 PolarHBondContact O-N 3.13Å; S159-H162 PolarHBondContact OG-ND1 3.27Å; H162-Q165 PolarHBondContact O-N 2.85Å; H162-I166 WeakPolarHBondContact O-CB 3.32Å; H162-I166 WeakPolarHBondContact O-CD1 3.27Å; H162-I166 WeakPolarHBondContact O-CG1 3.4Å; H162-I166 PolarHBondContact O-N 2.81Å
163	L	82	Confident	74.4	Confident	12 Å²	12	72.2 Å²	72.2	6%	0.063	37%	0.372	C	S	.	.	H	α-helix	trans	-64	-46.9	175.3	-179	57.7	0	0	0	110.7	I145 T154 S159 D160 E161 I166 I167	I145-L163 HydrophobicContact CD1-CD1 3.67Å; I145-L163 HydrophobicContact CG1-CD1 3.88Å; I145-L163 HydrophobicContact CG2-CD1 4.21Å; T154-L163 HydrophobicContact CG2-CD2 4.35Å; S159-L163 PolarHBondContact O-N 3.34Å; D160-L163 PolarHBondContact O-N 2.76Å; E161-L163 VanDerWaalsContact C-N 3.32Å; E161-L163 PolarHBondContact O-N 3.19Å; L163-I166 PolarHBondContact O-N 2.86Å; L163-I167 HydrophobicContact CD1-CD1 4.11Å; L163-I167 HydrophobicContact CD1-CG1 4.49Å; L163-I167 HydrophobicContact CG-CD1 3.87Å; L163-I167 WeakPolarHBondContact O-CD1 3.44Å; L163-I167 VanDerWaalsContact O-CG1 3.23Å; L163-I167 WeakPolarHBondContact O-CG1 3.41Å; L163-I167 PolarHBondContact O-N 3.12Å
164	Q	80.8	Confident	72.9	Confident	129 Å²	129	74.6 Å²	74.6	60%	0.603	40%	0.398	S	S	*	.	H	α-helix	trans	-60.6	-43.9	174.2	-73	168.9	19.8	0	0	112	D160 E161 I166 I167 Q168	D160-Q164 WeakPolarHBondContact O-CB 3.35Å; D160-Q164 WeakPolarHBondContact O-CG 3.37Å; D160-Q164 PolarHBondContact O-N 2.99Å; E161-Q164 PolarHBondContact O-N 3.04Å; Q164-I166 VanDerWaalsContact C-N 3.34Å; Q164-I166 PolarHBondContact O-N 3.46Å; Q164-I167 PolarHBondContact O-N 2.98Å; Q164-Q168 WeakPolarHBondContact O-CB 3.24Å; Q164-Q168 PolarHBondContact O-N 3.26Å
165	Q	78.4	Confident	71.4	Confident	88 Å²	88	76 Å²	76	41%	0.411	40%	0.404	S	S	.	.	H	α-helix	trans	-60.2	-40.5	173.7	-72	170	16.7	0	0	112.3	E161 H162 V169	E161-Q165 VanDerWaalsContact O-CG 3.26Å; E161-Q165 WeakPolarHBondContact O-CG 3.21Å; E161-Q165 PolarHBondContact O-N 3.05Å; H162-Q165 PolarHBondContact O-N 2.85Å; Q165-V169 WeakPolarHBondContact O-CB 3.11Å; Q165-V169 VanDerWaalsContact O-CG2 3.28Å; Q165-V169 WeakPolarHBondContact O-CG2 3.32Å; Q165-V169 PolarHBondContact O-N 2.98Å; Q165-V169 VanDerWaalsContact O-N 3.12Å
166	I	74.7	Confident	70.4	Confident	32 Å²	32	78.2 Å²	78.2	16%	0.164	41%	0.414	C	S	.	.	H	α-helix	trans	-67.2	-42.8	176.4	-69	162	0	0	0	110.8	V2 I143 I145 H162 L163 Q164 V169 L170	V2-I166 HydrophobicContact CG1-CG2 4.44Å; I143-I166 HydrophobicContact CD1-CD1 4.37Å; I145-I166 HydrophobicContact CD1-CB 4.4Å; I145-I166 HydrophobicContact CD1-CG2 3.58Å; H162-I166 WeakPolarHBondContact O-CB 3.32Å; H162-I166 WeakPolarHBondContact O-CD1 3.27Å; H162-I166 WeakPolarHBondContact O-CG1 3.4Å; H162-I166 PolarHBondContact O-N 2.81Å; L163-I166 PolarHBondContact O-N 2.86Å; Q164-I166 VanDerWaalsContact C-N 3.34Å; Q164-I166 PolarHBondContact O-N 3.46Å; I166-V169 PolarHBondContact O-N 3.09Å; I166-L170 HydrophobicContact CG2-CD1 3.79Å; I166-L170 WeakPolarHBondContact O-CD1 3.44Å; I166-L170 VanDerWaalsContact O-CG 3.29Å; I166-L170 WeakPolarHBondContact O-CG 3.47Å; I166-L170 PolarHBondContact O-N 3.02Å; I166-L170 VanDerWaalsContact O-N 3.14Å
167	I	75.4	Confident	69.2	Low	26 Å²	26	81.9 Å²	81.9	13%	0.133	44%	0.443	C	S	.	.	H	α-helix	trans	-61.7	-49.8	176.3	-66.7	155.2	0	0	0	110	Y152 L163 Q164 V169 L170 T171	Y152-I167 HydrophobicContact CD1-CD1 4.37Å; Y152-I167 HydrophobicContact CD1-CG1 4.25Å; Y152-I167 HydrophobicContact CD2-CD1 3.53Å; Y152-I167 HydrophobicContact CD2-CG1 4.07Å; Y152-I167 HydrophobicContact CD2-CG2 4.19Å; Y152-I167 HydrophobicContact CE2-CD1 4.28Å; Y152-I167 HydrophobicContact CE2-CG1 4.47Å; Y152-I167 HydrophobicContact CE2-CG2 3.81Å; Y152-I167 HydrophobicContact CG-CD1 3.57Å; Y152-I167 HydrophobicContact CG-CG1 3.94Å; L163-I167 HydrophobicContact CD1-CD1 4.11Å; L163-I167 HydrophobicContact CD1-CG1 4.49Å; L163-I167 HydrophobicContact CG-CD1 3.87Å; L163-I167 WeakPolarHBondContact O-CD1 3.44Å; L163-I167 VanDerWaalsContact O-CG1 3.23Å; L163-I167 WeakPolarHBondContact O-CG1 3.41Å; L163-I167 PolarHBondContact O-N 3.12Å; Q164-I167 PolarHBondContact O-N 2.98Å; I167-V169 VanDerWaalsContact C-N 3.28Å; I167-V169 PolarHBondContact O-N 3.32Å; I167-L170 CarbonylContact O-C 3.45Å; I167-L170 WeakPolarHBondContact O-CA 3.28Å; I167-L170 WeakPolarHBondContact O-CB 3.46Å; I167-L170 PolarHBondContact O-N 3.4Å; I167-T171 HydrophobicContact CG2-CG2 3.82Å; I167-T171 WeakPolarHBondContact O-CG2 3.31Å; I167-T171 PolarHBondContact O-N 3.34Å; I167-T171 PolarHBondContact O-OG1 2.9Å; I167-T171 VanDerWaalsContact O-OG1 3.13Å
168	Q	75.1	Confident	67.8	Low	126 Å²	126	76.2 Å²	76.2	59%	0.589	42%	0.417	S	S	*	.	H	α-helix	trans	-57.8	-38.9	179.9	-168.3	179.1	24.8	0	0	112.4	Q164 L170 T171 N172	Q164-Q168 WeakPolarHBondContact O-CB 3.24Å; Q164-Q168 PolarHBondContact O-N 3.26Å; Q168-L170 VanDerWaalsContact C-N 3.3Å; Q168-L170 PolarHBondContact O-N 2.97Å; Q168-T171 WeakPolarHBondContact CA-OG1 3.44Å; Q168-T171 PolarHBondContact O-OG1 2.89Å; Q168-N172 VanDerWaalsContact O-CG 3.32Å; Q168-N172 PolarHBondContact O-OD1 3.4Å
169	V	69.2	Low	66.4	Low	34 Å²	34	80 Å²	80	21%	0.206	45%	0.445	C	S	.	.	H	α-helix	trans	-70.3	-23.9	174.8	169.8	0	0	0	0	112.8	Q165 I166 I167 I186 I195	Q165-V169 WeakPolarHBondContact O-CB 3.11Å; Q165-V169 VanDerWaalsContact O-CG2 3.28Å; Q165-V169 WeakPolarHBondContact O-CG2 3.32Å; Q165-V169 PolarHBondContact O-N 2.98Å; Q165-V169 VanDerWaalsContact O-N 3.12Å; I166-V169 PolarHBondContact O-N 3.09Å; I167-V169 VanDerWaalsContact C-N 3.28Å; I167-V169 PolarHBondContact O-N 3.32Å; V169-I186 HydrophobicContact CG1-CD1 4.07Å; V169-I186 HydrophobicContact CG1-CG2 4.16Å; V169-I195 HydrophobicContact CG1-CD1 4.3Å
170	L	66	Low	65	Low	10 Å²	10	79.3 Å²	79.3	5%	0.052	45%	0.447	C	S	.	.	H	α-helix	trans	-91.2	-29.2	176.8	-71.1	166	0	0	0	113.4	F4 I166 I167 Q168 L176 I186 F197	F4-L170 HydrophobicContact CD2-CD1 3.93Å; F4-L170 HydrophobicContact CE2-CD1 3.53Å; F4-L170 HydrophobicContact CZ-CD1 4.39Å; I166-L170 HydrophobicContact CG2-CD1 3.79Å; I166-L170 WeakPolarHBondContact O-CD1 3.44Å; I166-L170 VanDerWaalsContact O-CG 3.29Å; I166-L170 WeakPolarHBondContact O-CG 3.47Å; I166-L170 PolarHBondContact O-N 3.02Å; I166-L170 VanDerWaalsContact O-N 3.14Å; I167-L170 CarbonylContact O-C 3.45Å; I167-L170 WeakPolarHBondContact O-CA 3.28Å; I167-L170 WeakPolarHBondContact O-CB 3.46Å; I167-L170 PolarHBondContact O-N 3.4Å; Q168-L170 VanDerWaalsContact C-N 3.3Å; Q168-L170 PolarHBondContact O-N 2.97Å; L170-L176 WeakPolarHBondContact O-CD1 3.26Å; L170-L176 WeakPolarHBondContact O-CG 3.3Å; L170-I186 HydrophobicContact CD2-CD1 3.83Å; L170-F197 HydrophobicContact CD2-CD1 4.43Å; L170-F197 HydrophobicContact CD2-CD2 3.89Å; L170-F197 HydrophobicContact CD2-CE2 4.06Å; L170-F197 HydrophobicContact CD2-CG 4.08Å; L170-F197 HydrophobicContact CD2-CZ 4.4Å
171	T	66.1	Low	63.8	Low	57 Å²	57	78.3 Å²	78.3	35%	0.35	45%	0.449	S	S	.	.	H	α-helix	trans	-80.5	-13.6	-179	51.2	0	0	0	0	113.9	I167 Q168 Q173	I167-T171 HydrophobicContact CG2-CG2 3.82Å; I167-T171 WeakPolarHBondContact O-CG2 3.31Å; I167-T171 PolarHBondContact O-N 3.34Å; I167-T171 PolarHBondContact O-OG1 2.9Å; I167-T171 VanDerWaalsContact O-OG1 3.13Å; Q168-T171 WeakPolarHBondContact CA-OG1 3.44Å; Q168-T171 PolarHBondContact O-OG1 2.89Å; T171-Q173 WeakPolarHBondContact O-CG 3.44Å; T171-Q173 PolarHBondContact O-N 3.38Å
172	N	62	Low	62.5	Low	106 Å²	106	82.3 Å²	82.3	57%	0.567	46%	0.458	S	S	*	.	S	Bend	trans	-70.3	111.2	173.9	-70.8	-7.8	0	0	0	109.3	Q168 A174	Q168-N172 VanDerWaalsContact O-CG 3.32Å; Q168-N172 PolarHBondContact O-OD1 3.4Å; N172-A174 VanDerWaalsContact C-N 3.3Å; N172-A174 PolarHBondContact O-N 2.83Å
173	Q	53.3	Low	61.6	Low	161 Å²	161	81.6 Å²	81.6	75%	0.752	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-73.1	-2.8	-135.4	-62.5	177.1	2.9	0	0	117.5	T171 L175	T171-Q173 WeakPolarHBondContact O-CG 3.44Å; T171-Q173 PolarHBondContact O-N 3.38Å; Q173-L175 VanDerWaalsContact C-N 3.28Å; Q173-L175 PolarHBondContact O-N 3.31Å
174	A	46	Very low	60.8	Low	94 Å²	94	82.3 Å²	82.3	78%	0.777	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-77.3	0.5	-173.5	0	0	0	0	0	115.8	N172	N172-A174 VanDerWaalsContact C-N 3.3Å; N172-A174 PolarHBondContact O-N 2.83Å
175	L	50.5	Low	60.3	Low	61 Å²	61	77.9 Å²	77.9	32%	0.319	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-127.1	-6.5	-160.1	-71.3	159.2	0	0	0	115.8	Q173 I186 F197	Q173-L175 VanDerWaalsContact C-N 3.28Å; Q173-L175 PolarHBondContact O-N 3.31Å; L175-I186 HydrophobicContact CD1-CD1 3.91Å; L175-I186 HydrophobicContact CD1-CG1 3.95Å; L175-I186 HydrophobicContact CD1-CG2 3.98Å; L175-F197 HydrophobicContact CB-CZ 4.47Å; L175-F197 WeakPolarHBondContact O-CZ 3.4Å
176	L	53.7	Low	59.7	Low	85 Å²	85	74.6 Å²	74.6	45%	0.445	44%	0.439	S	S	.	.	S	Bend	trans	-95.5	-10	-177	-67.5	174.4	0	0	0	114.3	L170 S178	L170-L176 WeakPolarHBondContact O-CD1 3.26Å; L170-L176 WeakPolarHBondContact O-CG 3.3Å; L176-S178 VanDerWaalsContact C-N 3.25Å; L176-S178 PolarHBondContact O-N 3.3Å
177	S	49.2	Very low	59.6	Low	107 Å²	107	79 Å²	79	75%	0.748	45%	0.454	S	S	*	.			trans	-71	-13.3	-173.8	-47.6	0	0	0	0	114.7	S179	S177-S179 PolarHBondContact O-N 2.91Å
178	S	46.7	Very low	59.1	Low	53 Å²	53	79.1 Å²	79.1	37%	0.371	46%	0.456	S	S	.	.			trans	-75.3	89.9	178.8	64.1	0	0	0	0	111.7	L176 G180 S184	L176-S178 VanDerWaalsContact C-N 3.25Å; L176-S178 PolarHBondContact O-N 3.3Å; S178-G180 VanDerWaalsContact C-N 3.25Å; S178-G180 PolarHBondContact O-N 2.63Å; S178-S184 PolarHBondContact OG-OG 3.44Å
179	S	44.2	Very low	58.6	Low	105 Å²	105	83.3 Å²	83.3	73%	0.734	47%	0.466	S	S	*	.			trans	-72.8	-8.6	-178.7	60.8	0	0	0	0	115.3	S177	S177-S179 PolarHBondContact O-N 2.91Å
180	G	50.2	Low	58.3	Low	45 Å²	45	89.7 Å²	89.7	46%	0.464	50%	0.498	S	S	.	.	S	Bend	trans	-78.6	161.4	-177.6	0	0	0	0	0	114.9	S178 R182	S178-G180 VanDerWaalsContact C-N 3.25Å; S178-G180 PolarHBondContact O-N 2.63Å; G180-R182 PolarHBondContact O-N 3.36Å
181	S	55.4	Low	58.4	Low	92 Å²	92	92.5 Å²	92.5	64%	0.643	52%	0.516	S	S	*	.	S	Bend	trans	-71.7	5.9	-176.2	68.3	0	0	0	0	115.9	R198	S181-R198 PolarHBondContact O-NE 2.86Å; S181-R198 VanDerWaalsContact O-NE 3.08Å; S181-R198 PolarHBondContact O-NH2 3.19Å
182	R	54.6	Low	58.4	Low	207 Å²	207	95.5 Å²	95.5	78%	0.781	53%	0.53	S	S	*	.	S	Bend	trans	-80.1	150.9	-175	-67.7	-178.1	175.5	179.7	0.9	111.5	G180 S184	G180-R182 PolarHBondContact O-N 3.36Å; R182-S184 PolarHBondContact O-N 3.03Å
183	P	60.8	Low	58.8	Low	83 Å²	83	99 Å²	99	54%	0.539	54%	0.535	S	S	.	.			trans	-82.3	113.7	176.1	31.6	-32.5	0	0	0	111.7	I196 F197	P183-I196 HydrophobicContact CB-CG2 3.91Å; P183-F197 CarbonylContact C-O 3.47Å; P183-F197 WeakPolarHBondContact CA-O 3.25Å
184	S	64.8	Low	59.7	Low	28 Å²	28	99.4 Å²	99.4	20%	0.196	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	160.5	174.6	-63.3	0	0	0	0	111.1	S178 R182 I196 F197	S178-S184 PolarHBondContact OG-OG 3.44Å; R182-S184 PolarHBondContact O-N 3.03Å; S184-I196 WeakPolarHBondContact O-CA 3.21Å; S184-F197 PolarHBondContact N-O 3.39Å; S184-F197 WeakPolarHBondContact O-CD1 3.42Å; S184-F197 PolarHBondContact O-N 3.39Å; S184-F197 VanDerWaalsContact O-O 3.13Å
185	A	68.9	Low	60.8	Low	36 Å²	36	97.1 Å²	97.1	30%	0.298	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	124	-173.4	0	0	0	0	0	114.2	R194 I195 I196	A185-R194 HydrophobicContact CB-CG 4.41Å; A185-I195 CarbonylContact C-O 3.48Å; A185-I195 WeakPolarHBondContact CA-O 3.27Å; A185-I196 HydrophobicContact CB-CG1 4.22Å
186	I	67.1	Low	61.8	Low	19 Å²	19	96.8 Å²	96.8	10%	0.097	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	143.4	177.9	-42.1	-177.4	0	0	0	108.8	V169 L170 L175 R194 I195 F197	V169-I186 HydrophobicContact CG1-CD1 4.07Å; V169-I186 HydrophobicContact CG1-CG2 4.16Å; L170-I186 HydrophobicContact CD2-CD1 3.83Å; L175-I186 HydrophobicContact CD1-CD1 3.91Å; L175-I186 HydrophobicContact CD1-CG1 3.95Å; L175-I186 HydrophobicContact CD1-CG2 3.98Å; I186-R194 CarbonylContact O-C 3.55Å; I186-R194 WeakPolarHBondContact O-CA 3.4Å; I186-I195 PolarHBondContact N-O 3.29Å; I186-I195 PolarHBondContact O-N 3.27Å; I186-F197 HydrophobicContact CD1-CD1 4.14Å; I186-F197 HydrophobicContact CD1-CE1 3.81Å; I186-F197 HydrophobicContact CD1-CZ 4.4Å; I186-F197 HydrophobicContact CG1-CD1 3.86Å; I186-F197 HydrophobicContact CG1-CE1 3.48Å; I186-F197 VanDerWaalsContact CG1-CE1 3.48Å; I186-F197 HydrophobicContact CG1-CZ 4.42Å
187	Y	72.6	Confident	62.7	Low	123 Å²	123	92.9 Å²	92.9	48%	0.482	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	105.5	169.2	-173.1	-100.8	0	0	0	110.5	R189 N192 R194	Y187-R189 HydrophobicContact CD1-CG 4.21Å; Y187-R189 HydrophobicContact CE1-CG 4.33Å; Y187-R189 PolarHBondContact O-N 2.86Å; Y187-N192 PolarHBondContact OH-OD1 3.4Å; Y187-R194 HydrophobicContact CD2-CB 4.24Å
188	N	64.6	Low	63.5	Low	30 Å²	30	91.8 Å²	91.8	16%	0.16	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	107.3	176.3	178.8	-41	0	0	0	108.8	L190 T191 N192 R193 I195	N188-L190 WeakPolarHBondContact OD1-CB 3.19Å; N188-L190 PolarHBondContact OD1-N 3.48Å; N188-L190 VanDerWaalsContact OD1-N 3.07Å; N188-T191 WeakPolarHBondContact CB-OG1 3.3Å; N188-T191 PolarHBondContact O-N 3.33Å; N188-T191 PolarHBondContact OD1-N 2.71Å; N188-T191 PolarHBondContact OD1-OG1 2.6Å; N188-T191 VanDerWaalsContact OD1-OG1 3.06Å; N188-N192 WeakPolarHBondContact O-CA 3.48Å; N188-N192 PolarHBondContact O-N 3.36Å; N188-R193 PolarHBondContact N-O 2.91Å; N188-R193 PolarHBondContact O-N 2.87Å; N188-I195 HydrophobicContact CB-CD1 4.19Å
189	R	64.6	Low	64.6	Low	213 Å²	213	90.9 Å²	90.9	80%	0.804	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-42.3	179.9	-70.6	-175	176.3	-175.2	0.6	112.6	Y187 T191 N192	Y187-R189 HydrophobicContact CD1-CG 4.21Å; Y187-R189 HydrophobicContact CE1-CG 4.33Å; Y187-R189 PolarHBondContact O-N 2.86Å; R189-T191 PolarHBondContact O-N 3.15Å; R189-N192 PolarHBondContact O-N 3.24Å
190	L	63.4	Low	65.3	Low	168 Å²	168	87.4 Å²	87.4	88%	0.88	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-30.9	-177.5	-58.3	176.1	0	0	0	113	N188	N188-L190 WeakPolarHBondContact OD1-CB 3.19Å; N188-L190 PolarHBondContact OD1-N 3.48Å; N188-L190 VanDerWaalsContact OD1-N 3.07Å
191	T	68.1	Low	65.6	Low	70 Å²	70	94.1 Å²	94.1	43%	0.429	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-0.2	-178.8	59.2	0	0	0	0	114	N188 R189 R193	N188-T191 WeakPolarHBondContact CB-OG1 3.3Å; N188-T191 PolarHBondContact O-N 3.33Å; N188-T191 PolarHBondContact OD1-N 2.71Å; N188-T191 PolarHBondContact OD1-OG1 2.6Å; N188-T191 VanDerWaalsContact OD1-OG1 3.06Å; R189-T191 PolarHBondContact O-N 3.15Å; T191-R193 WeakPolarHBondContact O-CG 3.43Å; T191-R193 PolarHBondContact O-N 2.96Å; T191-R193 VanDerWaalsContact O-N 3.16Å
192	N	65.9	Low	65.6	Low	119 Å²	119	91.2 Å²	91.2	64%	0.636	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	28.4	-172	-76.1	-73.1	0	0	0	114.4	Y187 N188 R189	Y187-N192 PolarHBondContact OH-OD1 3.4Å; N188-N192 WeakPolarHBondContact O-CA 3.48Å; N188-N192 PolarHBondContact O-N 3.36Å; R189-N192 PolarHBondContact O-N 3.24Å
193	R	70.7	Confident	65.2	Low	179 Å²	179	91 Å²	91	68%	0.675	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.4	-174.4	-76.2	169.2	-178.8	-173.1	0.2	112.1	N188 T191 I195	N188-R193 PolarHBondContact N-O 2.91Å; N188-R193 PolarHBondContact O-N 2.87Å; T191-R193 WeakPolarHBondContact O-CG 3.43Å; T191-R193 PolarHBondContact O-N 2.96Å; T191-R193 VanDerWaalsContact O-N 3.16Å; R193-I195 PolarHBondContact O-N 3.06Å
194	R	71.5	Confident	64.4	Low	170 Å²	170	94.7 Å²	94.7	64%	0.642	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	105.3	167.7	-169.4	178.6	-172.2	-122.6	1.6	109.7	A185 I186 Y187 I196	A185-R194 HydrophobicContact CB-CG 4.41Å; I186-R194 CarbonylContact O-C 3.55Å; I186-R194 WeakPolarHBondContact O-CA 3.4Å; Y187-R194 HydrophobicContact CD2-CB 4.24Å; R194-I196 HydrophobicContact CG-CG1 4.46Å
195	I	69.4	Low	63.1	Low	47 Å²	47	104.9 Å²	104.9	24%	0.241	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	109.6	177.2	-57.5	174	0	0	0	107.7	V2 V169 A185 I186 N188 R193	V2-I195 HydrophobicContact CG2-CG2 4.1Å; V169-I195 HydrophobicContact CG1-CD1 4.3Å; A185-I195 CarbonylContact C-O 3.48Å; A185-I195 WeakPolarHBondContact CA-O 3.27Å; I186-I195 PolarHBondContact N-O 3.29Å; I186-I195 PolarHBondContact O-N 3.27Å; N188-I195 HydrophobicContact CB-CD1 4.19Å; R193-I195 PolarHBondContact O-N 3.06Å
196	I	71.3	Confident	61.5	Low	54 Å²	54	110.4 Å²	110.4	28%	0.277	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.7	173.3	-55.5	174.9	0	0	0	108	M1 V2 P183 S184 A185 R194	M1-I196 CarbonylContact C-O 3.6Å; M1-I196 WeakPolarHBondContact CA-O 3.45Å; M1-I196 HydrophobicContact CE-CG2 3.93Å; V2-I196 PolarHBondContact N-O 2.87Å; P183-I196 HydrophobicContact CB-CG2 3.91Å; S184-I196 WeakPolarHBondContact O-CA 3.21Å; A185-I196 HydrophobicContact CB-CG1 4.22Å; R194-I196 HydrophobicContact CG-CG1 4.46Å
197	F	72.9	Confident	60	Low	3 Å²	3	117.2 Å²	117.2	1%	0.013	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	165.1	-177.1	74.4	-77.2	0	0	0	112.1	V2 L170 L175 P183 S184 I186 V199	V2-F197 HydrophobicContact CB-CB 4.1Å; V2-F197 CarbonylContact O-C 3.51Å; V2-F197 WeakPolarHBondContact O-CA 3.18Å; V2-F197 WeakPolarHBondContact O-CB 3.3Å; L170-F197 HydrophobicContact CD2-CD1 4.43Å; L170-F197 HydrophobicContact CD2-CD2 3.89Å; L170-F197 HydrophobicContact CD2-CE2 4.06Å; L170-F197 HydrophobicContact CD2-CG 4.08Å; L170-F197 HydrophobicContact CD2-CZ 4.4Å; L175-F197 HydrophobicContact CB-CZ 4.47Å; L175-F197 WeakPolarHBondContact O-CZ 3.4Å; P183-F197 CarbonylContact C-O 3.47Å; P183-F197 WeakPolarHBondContact CA-O 3.25Å; S184-F197 PolarHBondContact N-O 3.39Å; S184-F197 WeakPolarHBondContact O-CD1 3.42Å; S184-F197 PolarHBondContact O-N 3.39Å; S184-F197 VanDerWaalsContact O-O 3.13Å; I186-F197 HydrophobicContact CD1-CD1 4.14Å; I186-F197 HydrophobicContact CD1-CE1 3.81Å; I186-F197 HydrophobicContact CD1-CZ 4.4Å; I186-F197 HydrophobicContact CG1-CD1 3.86Å; I186-F197 HydrophobicContact CG1-CE1 3.48Å; I186-F197 VanDerWaalsContact CG1-CE1 3.48Å; I186-F197 HydrophobicContact CG1-CZ 4.42Å; F197-V199 HydrophobicContact CD2-CG2 4.21Å; F197-V199 HydrophobicContact CE2-CG2 4.12Å
198	R	66.7	Low	58.5	Low	83 Å²	83	117.6 Å²	117.6	31%	0.313	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	129	178.2	-170.2	-169.2	-163.6	-160.4	3.5	109.8	V2 E3 F4 S181	V2-R198 PolarHBondContact O-N 2.89Å; E3-R198 WeakPolarHBondContact CA-O 3.48Å; E3-R198 HydrophobicContact CG-CB 3.94Å; E3-R198 WeakPolarHBondContact OE1-CD 3.33Å; E3-R198 IonicContact OE1-NH1 3.27Å; E3-R198 PolarHBondContact OE1-NH1 2.72Å; F4-R198 PolarHBondContact N-O 3.38Å; S181-R198 PolarHBondContact O-NE 2.86Å; S181-R198 VanDerWaalsContact O-NE 3.08Å; S181-R198 PolarHBondContact O-NH2 3.19Å
199	V	68.4	Low	57	Low	35 Å²	35	119.7 Å²	119.7	21%	0.212	56%	0.558	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.2	136.4	175.7	-175.1	0	0	0	0	108.8	F4 I6 F197	F4-V199 HydrophobicContact CB-CG2 4.31Å; I6-V199 HydrophobicContact CD1-CG1 4.21Å; F197-V199 HydrophobicContact CD2-CG2 4.21Å; F197-V199 HydrophobicContact CE2-CG2 4.12Å
200	T	59.5	Low	55.5	Low	31 Å²	31	116.2 Å²	116.2	19%	0.19	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.8	123.3	176.8	53.1	0	0	0	0	108.8	F4 M5	F4-T200 PolarHBondContact O-N 2.87Å; F4-T200 PolarHBondContact O-OG1 3.49Å; F4-T200 VanDerWaalsContact O-OG1 3.09Å; M5-T200 WeakPolarHBondContact CA-O 3.2Å; M5-T200 WeakPolarHBondContact CE-OG1 3.31Å; M5-T200 VanDerWaalsContact CG-OG1 3.24Å; M5-T200 WeakPolarHBondContact CG-OG1 3.25Å
201	R	57.3	Low	54.1	Low	187 Å²	187	114 Å²	114	71%	0.706	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.8	-179.3	-69.4	-179	179.6	165.1	-0.1	110.4	K203	R201-K203 PolarHBondContact O-N 3.12Å; R201-K203 VanDerWaalsContact O-N 3.1Å
202	A	53.8	Low	52.5	Low	30 Å²	30	114.6 Å²	114.6	25%	0.248	57%	0.569	C	S	.	*			trans	-81.8	87.2	-179.7	0	0	0	0	0	110	I6 R204	I6-A202 PolarHBondContact O-N 2.96Å; A202-R204 PolarHBondContact O-N 3.32Å
203	K	47.1	Very low	51	Low	203 Å²	203	113.2 Å²	113.2	88%	0.883	57%	0.574	S	S	*	*			trans	-70.6	95.3	174.1	-168.8	169.2	-174.5	173.8	0	109.5	R201 R205	R201-K203 PolarHBondContact O-N 3.12Å; R201-K203 VanDerWaalsContact O-N 3.1Å; K203-R205 PolarHBondContact O-N 3.4Å
204	R	43	Very low	49.3	Very low	161 Å²	161	111.8 Å²	111.8	61%	0.608	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-51.8	136.3	164	-68.5	-173.5	-176.6	-84.8	1.1	107.9	E119 A202	E119-R204 IonicContact OE2-CZ 2.93Å; E119-R204 VanDerWaalsContact OE2-CZ 3.25Å; E119-R204 IonicContact OE2-NH1 2.7Å; E119-R204 PolarHBondContact OE2-NH1 2.97Å; E119-R204 IonicContact OE2-NH2 2.65Å; E119-R204 PolarHBondContact OE2-NH2 2.84Å; A202-R204 PolarHBondContact O-N 3.32Å
205	R	38.5	Very low	47.5	Very low	241 Å²	241	108.2 Å²	108.2	91%	0.909	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-79.5	126.4	161.8	-71.8	-174	172.8	-154.2	-4.1	106.1	K203	K203-R205 PolarHBondContact O-N 3.4Å
206	H	35.8	Very low	46.1	Very low	153 Å²	153	114.1 Å²	114.1	71%	0.708	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-71.8	135.7	167.5	-125.4	-108.5	0	0	0	108.2	D208	H206-D208 IonicContact CE1-OD1 2.98Å; H206-D208 IonicContact CE1-OD2 3.25Å; H206-D208 PolarHBondContact CE1-OD2 2.73Å; H206-D208 IonicContact CG-OD2 3.44Å; H206-D208 IonicContact ND1-OD1 3.21Å; H206-D208 PolarHBondContact ND1-OD1 3.27Å; H206-D208 IonicContact ND1-OD2 2.66Å; H206-D208 PolarHBondContact ND1-OD2 2.66Å
207	D	34.6	Very low	44.4	Very low	161 Å²	161	117.2 Å²	117.2	86%	0.861	65%	0.65	S	S	*	*			trans	-114.6	49	-177.8	-159.4	21.4	0	0	0	109	G209	D207-G209 PolarHBondContact O-N 2.98Å; D207-G209 VanDerWaalsContact O-N 3.09Å
208	D	40.8	Very low	42.5	Very low	131 Å²	131	120.3 Å²	120.3	70%	0.701	68%	0.682	S	S	*	*			trans	-79.9	85.9	176.7	-72	-22.6	0	0	0	109.8	H206 N210	H206-D208 IonicContact CE1-OD1 2.98Å; H206-D208 IonicContact CE1-OD2 3.25Å; H206-D208 PolarHBondContact CE1-OD2 2.73Å; H206-D208 IonicContact CG-OD2 3.44Å; H206-D208 IonicContact ND1-OD1 3.21Å; H206-D208 PolarHBondContact ND1-OD1 3.27Å; H206-D208 IonicContact ND1-OD2 2.66Å; H206-D208 PolarHBondContact ND1-OD2 2.66Å; D208-N210 PolarHBondContact O-N 2.85Å
209	G	33	Very low	41	Very low	75 Å²	75	123.5 Å²	123.5	77%	0.773	70%	0.7	S	S	*	*			trans	-78.6	96.1	168.9	0	0	0	0	0	111.8	D207	D207-G209 PolarHBondContact O-N 2.98Å; D207-G209 VanDerWaalsContact O-N 3.09Å
210	N	34	Very low	39.4	Very low	140 Å²	140	131.6 Å²	131.6	75%	0.749	73%	0.727	S	S	*	*			trans	-144.4	105.8	154.3	-154.8	37.5	0	0	0	114.4	D208	D208-N210 PolarHBondContact O-N 2.85Å
211	T	35	Very low	38.2	Very low	122 Å²	122	136.8 Å²	136.8	75%	0.748	76%	0.759	S	S	*	*			trans	51.9	109.5	151.2	54	0	0	0	0	121.7
212	G	32.6	Very low	37.1	Very low	82 Å²	82	139 Å²	139	85%	0.845	77%	0.768	S	S	*	*			trans	111.8	123.6	148.4	0	0	0	0	0	115.8
213	A	36.4	Very low	36.2	Very low	90 Å²	90	142.5 Å²	142.5	74%	0.744	79%	0.79	S	S	*	*			cis	-152.4	165.7	-9.2	0	0	0	0	0	112
214	T	34.9	Very low	35.6	Very low	148 Å²	148	137.6 Å²	137.6	91%	0.908	78%	0.781	S	S	*	*			trans	54.3	94.9	167.6	52.2	0	0	0	0	118.9
215	A	32.5	Very low	35.3	Very low	96 Å²	96	136.6 Å²	136.6	79%	0.793	79%	0.786	S	S	*	*			trans	-138	135.7	153.8	0	0	0	0	0	110.7
216	L	41	Very low	35.1	Very low	170 Å²	170	130.4 Å²	130.4	89%	0.89	78%	0.776	S	S	*	*			trans	-138.8	116.2	163.4	-67.2	175.1	0	0	0	105.9
217	S	34.1	Very low	35.3	Very low	120 Å²	120	128.1 Å²	128.1	84%	0.839	77%	0.772	S	S	*	*				69.2	123.3	60.8	-164.8	0	0	0	0	112.4
218	G	34	Very low	35.5	Very low	67 Å²	67	129.5 Å²	129.5	69%	0.691	77%	0.771	S	S	*	*			cis	175.6	-179.1	-0.8	0	0	0	0	0	114.7
219	E	35.9	Very low	35.3	Very low	150 Å²	150	128 Å²	128	70%	0.701	77%	0.77	S	S	*	*			trans	41.1	116.1	160.2	-65.2	-154.5	89.6	0	0	122
220	R	33.5	Very low	35.4	Very low	205 Å²	205	131 Å²	131	77%	0.774	76%	0.764	S	S	*	*				40	119.2	121	-60.1	151.7	135.8	-172.7	-2.2	117.9
221	T	35.6	Very low	35.7	Very low	140 Å²	140	130.7 Å²	130.7	86%	0.859	76%	0.756	S	S	*	*				-168.4	160.3	104	16.1	0	0	0	0	115.3
222	R	32.4	Very low	35.8	Very low	235 Å²	235	133.9 Å²	133.9	89%	0.887	76%	0.759	S	S	*	*			trans	-37.7	151.8	158.1	-59.2	162.3	163.2	160.9	-7.4	112
223	S	36.7	Very low	35.9	Very low	102 Å²	102	134.1 Å²	134.1	71%	0.713	75%	0.748	S	S	*	*			cis	-176.5	150.1	40	33.5	0	0	0	0	115.6
224	S	33.4	Very low	35.8	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	76%	0.755	S	S	*	*			trans	64.3	163	137.8	75.8	0	0	0	0	123.1
225	I	37.5	Very low	35.7	Very low	140 Å²	140	139 Å²	139	72%	0.718	75%	0.754	S	S	*	*			trans	70.8	97.1	168.1	-66.4	171.2	0	0	0	112.8
226	T	34.6	Very low	35.9	Very low	112 Å²	112	138.3 Å²	138.3	69%	0.687	76%	0.756	S	S	*	*				62.1	146.5	63.5	80.7	0	0	0	0	113.3
227	V	39.6	Very low	35.9	Very low	105 Å²	105	141.9 Å²	141.9	64%	0.636	76%	0.758	S	S	*	*			cis	-157.9	149.3	29.8	-124.4	0	0	0	0	110.5
228	K	39.2	Very low	36.3	Very low	190 Å²	190	141 Å²	141	83%	0.826	75%	0.749	S	S	*	*			trans	64.9	165.9	148	-70.8	167.9	-175.1	173.5	0	114.9
229	S	35.2	Very low	36.9	Very low	98 Å²	98	146 Å²	146	69%	0.685	76%	0.758	S	S	*	*			cis	-174.5	157.7	-5.3	35.8	0	0	0	0	106.4
230	E	36.5	Very low	36.9	Very low	139 Å²	139	142.4 Å²	142.4	65%	0.65	76%	0.762	S	S	*	*			cis	-170.4	164.2	-1.5	-114.3	-176.5	155.3	0	0	109.6
231	K	38.6	Very low	37.6	Very low	133 Å²	133	143.9 Å²	143.9	58%	0.578	77%	0.767	S	S	*	*			trans	55.7	122	141	-69.9	168.1	-174.4	149	0	121.3
232	K	38.4	Very low	37.9	Very low	189 Å²	189	146.1 Å²	146.1	82%	0.822	77%	0.765	S	S	*	*				74.3	155.5	127.6	-62.5	175.6	-176	-175.4	0	115.8
233	S	33	Very low	38.3	Very low	88 Å²	88	144.3 Å²	144.3	62%	0.615	76%	0.758	S	S	*	*			cis	-164.3	149.8	8.9	116.2	0	0	0	0	113.4
234	R	36.3	Very low	38.6	Very low	232 Å²	232	149.5 Å²	149.5	88%	0.875	76%	0.762	S	S	*	*			trans	63.4	112.1	145.5	-67.1	174.1	166.1	164.6	-6	121.3
235	A	32	Very low	39.1	Very low	109 Å²	109	153.3 Å²	153.3	90%	0.901	77%	0.766	S	S	*	*				60.6	125.5	114.1	0	0	0	0	0	121.2
236	G	36.7	Very low	39.4	Very low	81 Å²	81	158.1 Å²	158.1	84%	0.835	78%	0.776	S	S	*	*			trans	179.1	54.5	173.4	0	0	0	0	0	116.3
237	R	41.4	Very low	39.7	Very low	244 Å²	244	155.8 Å²	155.8	92%	0.921	77%	0.773	S	S	*	*			trans	-81.3	161.1	164.2	-94.6	-171.9	173.2	-156.9	-0.5	110
238	P	40.9	Very low	40.2	Very low	102 Å²	102	156.1 Å²	156.1	66%	0.662	78%	0.78	S	S	*	*			cis	-137.7	-153.6	-21	31.4	-7	0	0	0	112.1
239	I	46.8	Very low	40.6	Very low	172 Å²	172	153.6 Å²	153.6	88%	0.882	78%	0.776	S	S	*	*			trans	85.3	128.4	163.1	-51.5	155.4	0	0	0	115.3
240	G	37.1	Very low	41.4	Very low	75 Å²	75	157.1 Å²	157.1	77%	0.773	78%	0.782	S	S	*	*			trans	152.7	59	172.9	0	0	0	0	0	117.2
241	R	47.3	Very low	42	Very low	235 Å²	235	160 Å²	160	89%	0.887	80%	0.795	S	S	*	*			trans	-42.5	141.7	169.9	-73	170.8	162.3	-174	-5.4	116.2
242	K	41.5	Very low	42.8	Very low	188 Å²	188	160 Å²	160	82%	0.817	80%	0.801	S	S	*	*			trans	87.2	106.4	148.2	-71	176.4	178.3	-176.5	0	121.5
243	R	41.8	Very low	43.5	Very low	197 Å²	197	156.8 Å²	156.8	74%	0.743	80%	0.8	S	S	*	*				72	120.7	124.4	-80.6	-174.6	164.1	-176.6	-3.7	121.7
244	R	43.2	Very low	44.7	Very low	210 Å²	210	159.7 Å²	159.7	79%	0.792	81%	0.808	S	S	*	*			trans	73.4	149.5	139.6	-62.4	175.6	167.5	-173.1	-7.4	115.5
245	K	43.8	Very low	44.6	Very low	181 Å²	181	156.4 Å²	156.4	79%	0.787	80%	0.801	S	S	*	*			cis	-155.9	135.9	12.2	-166.2	-174	171.5	-170.6	0	112.3
246	R	43.7	Very low	45.7	Very low	241 Å²	241	159.7 Å²	159.7	91%	0.909	80%	0.798	S	S	*	*			trans	37.7	142.6	152.1	-68.1	-171.8	170.5	-147.4	-3.2	123.2
247	G	41.4	Very low	46.6	Very low	62 Å²	62	160.9 Å²	160.9	64%	0.639	79%	0.791	S	S	*	*			trans	145.8	104.9	165	0	0	0	0	0	106.3
248	S	48.7	Very low	46.9	Very low	112 Å²	112	157.5 Å²	157.5	78%	0.783	79%	0.785	S	S	*	*				62.6	130.8	68.6	77.1	0	0	0	0	112
249	D	47.8	Very low	47.7	Very low	137 Å²	137	158.6 Å²	158.6	73%	0.733	79%	0.79	S	S	*	*			cis	-157	174.3	3.8	-131.8	-37.3	0	0	0	112
250	E	52.3	Low	47.9	Very low	173 Å²	173	155.8 Å²	155.8	81%	0.808	78%	0.783	S	S	*	*			trans	74.2	151.9	156.8	-65.8	157.3	133.6	0	0	120.8
251	E	49.5	Very low	48.6	Very low	198 Å²	198	162 Å²	162	93%	0.925	79%	0.791	S	S	*	*			trans	66	75.9	167	-59.5	-174	166.3	0	0	120.8
252	D	55.3	Low	48.9	Very low	134 Å²	134	159.2 Å²	159.2	72%	0.717	79%	0.788	S	S	*	*			trans	-149.4	118.5	146.2	-161.2	-19.3	0	0	0	110.6
253	P	52.8	Low	49.2	Very low	122 Å²	122	159.1 Å²	159.1	79%	0.792	79%	0.791	S	S	*	*			trans	-91.6	-8.1	-172.6	35.4	-36.2	0	0	0	116.1	F255	P253-F255 VanDerWaalsContact C-N 3.33Å; P253-F255 PolarHBondContact O-N 2.84Å
254	D	58.1	Low	49.9	Very low	148 Å²	148	155.7 Å²	155.7	79%	0.791	79%	0.792	S	S	*	*			trans	-89.6	25.6	-170.8	-78.2	-8.8	0	0	0	114.3	E256	D254-E256 PolarHBondContact O-N 2.8Å; D254-E256 VanDerWaalsContact O-N 3.07Å
255	F	35.7	Very low	50.2	Low	164 Å²	164	152.4 Å²	152.4	72%	0.719	79%	0.789	S	S	*	*			trans	-86.1	76	-174.2	-151.4	-86.8	0	0	0	113.9	P253	P253-F255 VanDerWaalsContact C-N 3.33Å; P253-F255 PolarHBondContact O-N 2.84Å
256	E	54.9	Low	50.4	Low	178 Å²	178	149.4 Å²	149.4	83%	0.832	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-66.1	133.5	167.4	-165.6	170.2	-154.1	0	0	110.4	D254	D254-E256 PolarHBondContact O-N 2.8Å; D254-E256 VanDerWaalsContact O-N 3.07Å
257	P	55.6	Low	50.2	Low	106 Å²	106	146.4 Å²	146.4	69%	0.688	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.7	137.8	-164.4	26.7	-35	0	0	0	114.3	V259	P257-V259 PolarHBondContact O-N 2.78Å
258	E	47.5	Very low	50.8	Low	173 Å²	173	148.8 Å²	148.8	81%	0.808	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59.5	116.2	178.2	-65.4	177.2	135.2	0	0	112.1
259	V	56.8	Low	51	Low	125 Å²	125	151.3 Å²	151.3	76%	0.758	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.4	138.9	169.4	178.7	0	0	0	0	109.2	P257 E261	P257-V259 PolarHBondContact O-N 2.78Å; V259-E261 PolarHBondContact O-N 2.75Å
260	P	51.8	Low	50.9	Low	113 Å²	113	152.4 Å²	152.4	73%	0.734	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-54.3	125.1	-178.4	-28.8	36.1	0	0	0	114.4	E262	P260-E262 VanDerWaalsContact C-N 3.27Å; P260-E262 PolarHBondContact O-N 2.89Å
261	E	52.3	Low	51	Low	204 Å²	204	153.9 Å²	153.9	95%	0.953	79%	0.793	S	S	*	*	S	Bend	trans	-71.1	68.7	176.8	-68.9	-166.6	120.4	0	0	112.9	V259	V259-E261 PolarHBondContact O-N 2.75Å
262	E	53	Low	51.1	Low	177 Å²	177	155.2 Å²	155.2	83%	0.827	79%	0.789	S	S	*	*			trans	-128.3	15	171.1	-158.1	153.5	-150.5	0	0	114.8	P260 V264	P260-E262 VanDerWaalsContact C-N 3.27Å; P260-E262 PolarHBondContact O-N 2.89Å; E262-V264 PolarHBondContact O-N 2.88Å
263	E	47.2	Very low	51.1	Low	187 Å²	187	153.4 Å²	153.4	87%	0.874	78%	0.783	S	S	*	*			trans	-77.5	54.6	168.6	-67.5	-154.8	147.7	0	0	113.5	L265	E263-L265 PolarHBondContact O-N 2.93Å
264	V	56.8	Low	51.8	Low	125 Å²	125	150.2 Å²	150.2	76%	0.758	76%	0.764	S	S	*	*			trans	-81.4	84.7	177.4	-174.6	0	0	0	0	111.1	E262 P266	E262-V264 PolarHBondContact O-N 2.88Å; V264-P266 WeakPolarHBondContact O-CD 3.21Å
265	L	49.1	Very low	52.2	Low	140 Å²	140	149 Å²	149	73%	0.733	77%	0.774	S	S	*	*			trans	-23.5	106.8	176.4	-63.6	174	0	0	0	116.6	E263 F267	E263-L265 PolarHBondContact O-N 2.93Å; L265-F267 VanDerWaalsContact C-N 3.29Å; L265-F267 PolarHBondContact O-N 2.7Å; L265-F267 VanDerWaalsContact O-N 3.11Å
266	P	47.3	Very low	53.8	Low	119 Å²	119	145.7 Å²	145.7	77%	0.773	77%	0.771	S	S	*	*			trans	-87.5	53.6	173.4	36	-35.5	0	0	0	112.6	V264 P268	V264-P266 WeakPolarHBondContact O-CD 3.21Å; P266-P268 WeakPolarHBondContact O-CD 3.28Å
267	F	40	Very low	54.2	Low	178 Å²	178	140.1 Å²	140.1	78%	0.781	76%	0.762	S	S	*	*			trans	-94.9	95.9	168.2	-79.6	-63.5	0	0	0	111.1	L265 L269	L265-F267 VanDerWaalsContact C-N 3.29Å; L265-F267 PolarHBondContact O-N 2.7Å; L265-F267 VanDerWaalsContact O-N 3.11Å; F267-L269 PolarHBondContact O-N 3.5Å
268	P	53.5	Low	55	Low	111 Å²	111	144.4 Å²	144.4	72%	0.721	76%	0.764	S	S	*	*			trans	-70.9	101.8	178.5	29.1	-35.5	0	0	0	111.1	P266 I270	P266-P268 WeakPolarHBondContact O-CD 3.28Å; P268-I270 PolarHBondContact O-N 2.92Å
269	L	53.9	Low	55.7	Low	165 Å²	165	139.9 Å²	139.9	86%	0.864	75%	0.748	S	S	*	*			trans	-48.7	109.3	168.5	-89.9	165.2	0	0	0	110.5	F267 R271	F267-L269 PolarHBondContact O-N 3.5Å; L269-R271 PolarHBondContact O-N 2.96Å
270	I	45.6	Very low	56.2	Low	161 Å²	161	138.5 Å²	138.5	83%	0.826	74%	0.744	S	S	*	*			trans	-64.3	96.6	-170.1	-58.6	175.6	0	0	0	110.1	P268 R272	P268-I270 PolarHBondContact O-N 2.92Å; I270-R272 PolarHBondContact O-N 3.08Å
271	R	54.7	Low	56.9	Low	204 Å²	204	142.4 Å²	142.4	77%	0.77	75%	0.749	S	S	*	*			trans	-68.1	104.7	176.6	-60.2	-178.4	-168.9	154	5.4	108.7	L269 T273 V279	L269-R271 PolarHBondContact O-N 2.96Å; R271-T273 PolarHBondContact O-N 2.9Å; R271-V279 HydrophobicContact CB-CG1 4.46Å
272	R	50.9	Low	57.6	Low	226 Å²	226	135.7 Å²	135.7	85%	0.853	72%	0.724	S	S	*	*			trans	-55.7	105.9	178.6	-66	-173.7	179.3	-144.4	-0.9	110.7	I270	I270-R272 PolarHBondContact O-N 3.08Å
273	T	56.7	Low	58.5	Low	96 Å²	96	130.7 Å²	130.7	59%	0.589	71%	0.707	S	S	*	*	B	Isolated β-bridge	trans	-72.9	139.7	172.2	50.4	0	0	0	0	109.9	R271 V279	R271-T273 PolarHBondContact O-N 2.9Å; T273-V279 HydrophobicContact CG2-CG2 4.11Å
274	S	67.6	Low	59.5	Low	55 Å²	55	131 Å²	131	39%	0.385	71%	0.705	S	S	.	*			trans	-66.9	156.2	164	64.7	0	0	0	0	110.4	S276 G277 R278	S274-S276 PolarHBondContact O-N 2.88Å; S274-G277 PolarHBondContact O-N 3.49Å; S274-R278 WeakPolarHBondContact CB-O 3.45Å; S274-R278 PolarHBondContact N-O 3.5Å; S274-R278 VanDerWaalsContact N-O 3.08Å; S274-R278 PolarHBondContact OG-N 2.96Å; S274-R278 PolarHBondContact OG-O 3.29Å
275	A	64.5	Low	60.1	Low	123 Å²	123	131.2 Å²	131.2	100%	1.017	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	21.8	176.5	0	0	0	0	0	114.7
276	S	70.1	Confident	60.7	Low	93 Å²	93	127.4 Å²	127.4	65%	0.65	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	15.3	175.9	-177.3	0	0	0	0	111.3	S274 R278	S274-S276 PolarHBondContact O-N 2.88Å; S276-R278 PolarHBondContact O-N 3.36Å
277	G	63.2	Low	61.5	Low	62 Å²	62	125.4 Å²	125.4	64%	0.639	66%	0.663	S	S	*	*	S	Bend	trans	72.5	-8.9	-177.8	0	0	0	0	0	115.3	S274 V279	S274-G277 PolarHBondContact O-N 3.49Å; G277-V279 PolarHBondContact O-N 2.9Å
278	R	71.6	Confident	62.7	Low	195 Å²	195	124.1 Å²	124.1	74%	0.736	66%	0.657	S	S	*	*			trans	-76.5	118.6	179	-67.5	-178	176.5	179.4	-1.3	110.6	S274 S276	S274-R278 WeakPolarHBondContact CB-O 3.45Å; S274-R278 PolarHBondContact N-O 3.5Å; S274-R278 VanDerWaalsContact N-O 3.08Å; S274-R278 PolarHBondContact OG-N 2.96Å; S274-R278 PolarHBondContact OG-O 3.29Å; S276-R278 PolarHBondContact O-N 3.36Å
279	V	62.5	Low	63	Low	78 Å²	78	122.4 Å²	122.4	47%	0.473	64%	0.642	S	S	.	*	B	Isolated β-bridge	trans	-73.1	123.7	163.3	179.5	0	0	0	0	108.5	R271 T273 G277 K281	R271-V279 HydrophobicContact CB-CG1 4.46Å; T273-V279 HydrophobicContact CG2-CG2 4.11Å; G277-V279 PolarHBondContact O-N 2.9Å; V279-K281 PolarHBondContact O-N 3.22Å
280	S	68.4	Low	63.3	Low	96 Å²	96	122 Å²	122	67%	0.671	63%	0.63	S	S	*	*			trans	-73.5	104.8	174.9	51.6	0	0	0	0	110.6
281	K	66.8	Low	64.1	Low	195 Å²	195	122.8 Å²	122.8	85%	0.848	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-65.3	129	161.4	-68.5	-179.5	178.4	177.8	0	107.9	V279	V279-K281 PolarHBondContact O-N 3.22Å
282	P	65.8	Low	64.5	Low	64 Å²	64	119.5 Å²	119.5	42%	0.416	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-62.4	156.8	177.8	22.9	-30.4	0	0	0	111.3	K284 V287 Y290	P282-K284 PolarHBondContact O-N 3.4Å; P282-V287 HydrophobicContact CG-CG2 4.02Å; P282-Y290 HydrophobicContact CB-CE2 4.27Å
283	P	72.9	Confident	65	Low	72 Å²	72	112.9 Å²	112.9	47%	0.468	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-48	137.6	179.1	-30.4	35.6	0	0	0	113.2	H285 L286 V287	P283-H285 CarbonylContact O-C 3.49Å; P283-H285 PolarHBondContact O-N 3.17Å; P283-L286 HydrophobicContact CB-CD1 4.38Å; P283-L286 HydrophobicContact CG-CD1 4.17Å; P283-L286 PolarHBondContact O-N 2.79Å; P283-V287 PolarHBondContact O-N 3.28Å
284	K	66.8	Low	65.4	Low	194 Å²	194	115.6 Å²	115.6	84%	0.843	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-12.1	-168	-156.7	178.2	-178.5	-176.6	0	114.7	P282	P282-K284 PolarHBondContact O-N 3.4Å
285	H	69.6	Low	64.9	Low	128 Å²	128	119.8 Å²	119.8	59%	0.593	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-56	167.8	56.6	-93.4	0	0	0	111.4	P283 V287 K288	P283-H285 CarbonylContact O-C 3.49Å; P283-H285 PolarHBondContact O-N 3.17Å; H285-V287 PolarHBondContact O-N 2.94Å; H285-K288 WeakPolarHBondContact O-CB 3.31Å; H285-K288 PolarHBondContact O-N 3.07Å
286	L	62.8	Low	64.8	Low	60 Å²	60	119.7 Å²	119.7	31%	0.314	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-55.4	-25	179.8	-64.2	176.5	0	0	0	114.6	P283 K288 D289 Y290	P283-L286 HydrophobicContact CB-CD1 4.38Å; P283-L286 HydrophobicContact CG-CD1 4.17Å; P283-L286 PolarHBondContact O-N 2.79Å; L286-K288 PolarHBondContact O-N 3.44Å; L286-K288 VanDerWaalsContact O-N 3.12Å; L286-D289 WeakPolarHBondContact CA-OD2 3.42Å; L286-D289 PolarHBondContact O-N 2.87Å; L286-Y290 HydrophobicContact CB-CD2 4.42Å; L286-Y290 HydrophobicContact CB-CE2 4Å; L286-Y290 WeakPolarHBondContact O-CD2 3.43Å; L286-Y290 PolarHBondContact O-N 2.82Å
287	V	62.8	Low	64.4	Low	78 Å²	78	120.1 Å²	120.1	47%	0.473	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-55.6	-25.3	172.4	175.6	0	0	0	0	112.8	P282 P283 H285	P282-V287 HydrophobicContact CG-CG2 4.02Å; P283-V287 PolarHBondContact O-N 3.28Å; H285-V287 PolarHBondContact O-N 2.94Å
288	K	65.1	Low	64.3	Low	150 Å²	150	123.3 Å²	123.3	65%	0.652	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-77.9	-29.8	174	-68.4	-176.2	176.7	-179.1	0	112.9	H285 L286 K291 H292	H285-K288 WeakPolarHBondContact O-CB 3.31Å; H285-K288 PolarHBondContact O-N 3.07Å; L286-K288 PolarHBondContact O-N 3.44Å; L286-K288 VanDerWaalsContact O-N 3.12Å; K288-K291 PolarHBondContact O-N 3.2Å; K288-H292 PolarHBondContact O-CE1 3.13Å; K288-H292 PolarHBondContact O-ND1 2.88Å
289	D	60.7	Low	63.4	Low	76 Å²	76	118.4 Å²	118.4	41%	0.406	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-84.4	-38.7	-168.7	-50	-38	0	0	0	110.2	L286 K291 H292 L293	L286-D289 WeakPolarHBondContact CA-OD2 3.42Å; L286-D289 PolarHBondContact O-N 2.87Å; D289-K291 PolarHBondContact O-N 3.07Å; D289-H292 PolarHBondContact O-N 3.36Å; D289-L293 VanDerWaalsContact O-CD1 3.27Å; D289-L293 WeakPolarHBondContact O-CD1 3.5Å; D289-L293 PolarHBondContact O-N 3.39Å
290	Y	59.9	Low	62.4	Low	155 Å²	155	120.1 Å²	120.1	61%	0.608	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-61.3	-5.6	167.2	-64.1	-62.6	0	0	0	114.8	P282 L286	P282-Y290 HydrophobicContact CB-CE2 4.27Å; L286-Y290 HydrophobicContact CB-CD2 4.42Å; L286-Y290 HydrophobicContact CB-CE2 4Å; L286-Y290 WeakPolarHBondContact O-CD2 3.43Å; L286-Y290 PolarHBondContact O-N 2.82Å
291	K	63.9	Low	61.4	Low	178 Å²	178	124.2 Å²	124.2	77%	0.774	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-97.6	0.6	171.3	-149.6	-175.8	177.6	179.8	0	113.3	K288 D289	K288-K291 PolarHBondContact O-N 3.2Å; D289-K291 PolarHBondContact O-N 3.07Å
292	H	62.9	Low	60.3	Low	136 Å²	136	120 Å²	120	63%	0.63	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-18.5	-179.4	-60.9	109.8	0	0	0	114	K288 D289 R294	K288-H292 PolarHBondContact O-CE1 3.13Å; K288-H292 PolarHBondContact O-ND1 2.88Å; D289-H292 PolarHBondContact O-N 3.36Å; H292-R294 PolarHBondContact O-N 3.5Å
293	L	60.6	Low	59.4	Low	86 Å²	86	125 Å²	125	45%	0.45	62%	0.617	S	S	.	*			trans	-57.7	121.3	162.1	-86	75.2	0	0	0	108.9	D289 L298	D289-L293 VanDerWaalsContact O-CD1 3.27Å; D289-L293 WeakPolarHBondContact O-CD1 3.5Å; D289-L293 PolarHBondContact O-N 3.39Å; L293-L298 HydrophobicContact CD2-CD2 4.16Å
294	R	65.2	Low	58	Low	153 Å²	153	127.1 Å²	127.1	58%	0.577	63%	0.634	S	S	*	*			trans	-86.2	170.7	167.6	-59.7	-169.7	176.6	68.9	-0.2	110.3	H292 E296 D297	H292-R294 PolarHBondContact O-N 3.5Å; R294-E296 WeakPolarHBondContact CB-OE1 3.34Å; R294-E296 WeakPolarHBondContact CD-OE2 3.46Å; R294-E296 PolarHBondContact O-N 3.1Å; R294-D297 PolarHBondContact N-OD2 3.03Å; R294-D297 PolarHBondContact O-N 3.1Å
295	L	56	Low	56.7	Low	143 Å²	143	121.8 Å²	121.8	75%	0.749	62%	0.621	S	S	*	*	S	Bend	trans	-65.4	-36.2	172.7	-107.1	66.3	0	0	0	110.4	D297 L298	L295-D297 VanDerWaalsContact C-N 3.26Å; L295-D297 PolarHBondContact O-N 2.77Å; L295-L298 PolarHBondContact O-N 2.91Å; L295-L298 VanDerWaalsContact O-N 3.08Å
296	E	62.6	Low	55.5	Low	122 Å²	122	123 Å²	123	57%	0.57	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-56.3	-37.4	176.4	-51.1	90.3	-87.7	0	0	112.8	R294 L298 T299	R294-E296 WeakPolarHBondContact CB-OE1 3.34Å; R294-E296 WeakPolarHBondContact CD-OE2 3.46Å; R294-E296 PolarHBondContact O-N 3.1Å; E296-L298 PolarHBondContact O-N 3.01Å; E296-L298 VanDerWaalsContact O-N 3.13Å; E296-T299 PolarHBondContact O-N 2.84Å
297	D	62.6	Low	54.8	Low	102 Å²	102	128.5 Å²	128.5	55%	0.545	65%	0.651	S	S	.	*	G	3₁₀ helix	trans	-68.9	-9.6	-179.2	-58.1	-43.3	0	0	0	113.1	R294 L295	R294-D297 PolarHBondContact N-OD2 3.03Å; R294-D297 PolarHBondContact O-N 3.1Å; L295-D297 VanDerWaalsContact C-N 3.26Å; L295-D297 PolarHBondContact O-N 2.77Å
298	L	60.8	Low	54.3	Low	128 Å²	128	133 Å²	133	67%	0.67	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-107.4	-2	-179.5	-65.8	173.1	0	0	0	113.3	L293 L295 E296	L293-L298 HydrophobicContact CD2-CD2 4.16Å; L295-L298 PolarHBondContact O-N 2.91Å; L295-L298 VanDerWaalsContact O-N 3.08Å; E296-L298 PolarHBondContact O-N 3.01Å; E296-L298 VanDerWaalsContact O-N 3.13Å
299	T	52.8	Low	53.8	Low	92 Å²	92	133.2 Å²	133.2	56%	0.564	68%	0.676	S	S	*	*	S	Bend	trans	-135.7	111.7	-173	57.9	0	0	0	0	113.2	E296	E296-T299 PolarHBondContact O-N 2.84Å
300	S	41.9	Very low	53.2	Low	115 Å²	115	137.6 Å²	137.6	80%	0.804	69%	0.693	S	S	*	*			trans	67.5	150.5	-177.3	86.5	0	0	0	0	114.2
301	K	46.6	Very low	52.9	Low	182 Å²	182	135.4 Å²	135.4	79%	0.791	70%	0.701	S	S	*	*			cis	-153.1	145.3	-0.3	-143	171.4	-177.5	-174.7	0	108.3
302	P	43.3	Very low	52	Low	106 Å²	106	134.9 Å²	134.9	69%	0.688	71%	0.706	S	S	*	*			trans	-74.2	149	166.8	33.1	-34.6	0	0	0	110.4
303	E	48.2	Very low	51.7	Low	169 Å²	169	131.7 Å²	131.7	79%	0.79	71%	0.711	S	S	*	*			trans	148.6	130.1	149	-85.7	158.2	-144.5	0	0	110.8
304	S	43	Very low	51	Low	116 Å²	116	130.4 Å²	130.4	81%	0.811	72%	0.718	S	S	*	*			trans	62.3	147.9	159.9	66.2	0	0	0	0	118.4
305	S	40.5	Very low	50.2	Low	83 Å²	83	133.2 Å²	133.2	58%	0.58	73%	0.73	S	S	*	*			cis	-167	173.3	-21.4	37	0	0	0	0	107.8
306	E	44.6	Very low	49.8	Very low	153 Å²	153	132.5 Å²	132.5	72%	0.715	74%	0.737	S	S	*	*			trans	39.9	134.7	160.3	63.1	-124	134.9	0	0	122.6
307	E	46.6	Very low	49.2	Very low	175 Å²	175	130.1 Å²	130.1	82%	0.818	73%	0.728	S	S	*	*			trans	62.7	99.6	149.1	-66.7	162.5	-143.7	0	0	119
308	D	52.4	Low	48.6	Very low	172 Å²	172	134.8 Å²	134.8	92%	0.92	74%	0.739	S	S	*	*				-161.4	153.7	113.2	-110.8	-27.4	0	0	0	111.7
309	E	54.4	Low	47.7	Very low	156 Å²	156	136.7 Å²	136.7	73%	0.729	75%	0.749	S	S	*	*			trans	-105.1	170.5	-166	-57.7	-169	123.7	0	0	115.1
310	H	48.8	Very low	47.1	Very low	167 Å²	167	139.3 Å²	139.3	77%	0.773	76%	0.759	S	S	*	*			trans	73.1	107.9	163.8	-34.3	-47	0	0	0	118.8
311	S	53.8	Low	47.2	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	75%	0.753	S	S	*	*				163.2	94.2	119	179.5	0	0	0	0	110.7	G313	S311-G313 PolarHBondContact O-N 2.75Å
312	D	43.9	Very low	46.9	Very low	166 Å²	166	135.2 Å²	135.2	89%	0.888	76%	0.757	S	S	*	*			trans	-78.2	53.8	179.1	60.1	-28.1	0	0	0	112.9	G314	D312-G314 VanDerWaalsContact C-N 3.31Å; D312-G314 PolarHBondContact O-N 2.79Å
313	G	58.4	Low	47	Very low	70 Å²	70	137.8 Å²	137.8	72%	0.722	76%	0.764	S	S	*	*			trans	-67.1	61.7	-164.4	0	0	0	0	0	118.4	S311	S311-G313 PolarHBondContact O-N 2.75Å
314	G	44.1	Very low	46.6	Very low	58 Å²	58	134.8 Å²	134.8	60%	0.598	76%	0.762	S	S	*	*			trans	65.3	67.5	139.4	0	0	0	0	0	118.7	D312	D312-G314 VanDerWaalsContact C-N 3.31Å; D312-G314 PolarHBondContact O-N 2.79Å
315	Y	48.9	Very low	46.6	Very low	213 Å²	213	136.3 Å²	136.3	84%	0.835	76%	0.76	S	S	*	*			trans	-130.8	85.9	145.3	-97.4	-88.3	0	0	0	108.9
316	S	48.6	Very low	46.7	Very low	127 Å²	127	140.6 Å²	140.6	89%	0.888	77%	0.771	S	S	*	*			trans	-105.3	54	-178.9	65.8	0	0	0	0	111.1
317	D	49.2	Very low	46.4	Very low	73 Å²	73	136.2 Å²	136.2	39%	0.39	77%	0.767	S	S	.	*			trans	-107.1	147.3	165.4	50.6	-12.8	0	0	0	110.9
318	Y	49.4	Very low	46.1	Very low	199 Å²	199	139.5 Å²	139.5	78%	0.78	77%	0.773	S	S	*	*	S	Bend	trans	66.9	39.3	177.5	-23.7	-73.5	0	0	0	119
319	I	42.5	Very low	45.4	Very low	169 Å²	169	136 Å²	136	87%	0.867	76%	0.762	S	S	*	*			trans	-160.6	102.1	139.6	-93.6	139.6	0	0	0	109.5
320	N	39.9	Very low	45	Very low	147 Å²	147	137.8 Å²	137.8	79%	0.786	77%	0.77	S	S	*	*			trans	-163.4	-171.4	147.2	-152.8	55	0	0	0	108.9
321	D	44.5	Very low	44.7	Very low	127 Å²	127	136.5 Å²	136.5	68%	0.679	77%	0.769	S	S	*	*			trans	65.9	51.4	168.2	-59.3	-4.1	0	0	0	115.9	L323	D321-L323 PolarHBondContact O-N 3.33Å
322	G	39.6	Very low	44.2	Very low	84 Å²	84	134.6 Å²	134.6	87%	0.866	77%	0.766	S	S	*	*			trans	-76.6	76.3	146.5	0	0	0	0	0	110.8
323	L	45.5	Very low	44.6	Very low	159 Å²	159	131.5 Å²	131.5	83%	0.832	75%	0.753	S	S	*	*			trans	-132.9	164.4	173	-81.1	-179.8	0	0	0	112.4	D321	D321-L323 PolarHBondContact O-N 3.33Å
324	S	39.9	Very low	44.3	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	75%	0.748	S	S	*	*			trans	-86	138.8	-169.7	54	0	0	0	0	114.3
325	D	42.3	Very low	44.6	Very low	147 Å²	147	141.5 Å²	141.5	79%	0.786	76%	0.76	S	S	*	*	S	Bend	trans	72	162.3	144.8	-137.4	-15.2	0	0	0	119.5
326	E	43.7	Very low	45.1	Very low	173 Å²	173	135.1 Å²	135.1	81%	0.808	75%	0.747	S	S	*	*			trans	27.4	102.1	162	60	-170.4	173.3	0	0	121.3
327	G	39	Very low	45.9	Very low	61 Å²	61	134.6 Å²	134.6	63%	0.629	73%	0.733	S	S	*	*			trans	176.8	93.7	160.4	0	0	0	0	0	118.4
328	W	39.7	Very low	47.5	Very low	245 Å²	245	139.9 Å²	139.9	93%	0.928	75%	0.748	S	S	*	*			trans	44.2	80.1	144.6	-43.9	102.3	0	0	0	117.7
329	S	36.6	Very low	49.3	Very low	99 Å²	99	134.6 Å²	134.6	69%	0.692	73%	0.726	S	S	*	*			cis	77	80.2	49.7	92.4	0	0	0	0	116.6
330	E	46.8	Very low	51.6	Low	193 Å²	193	130.7 Å²	130.7	90%	0.902	71%	0.712	S	S	*	*			trans	-159.6	164.2	143.2	-116.1	168.4	174.9	0	0	111.9
331	D	41.6	Very low	54	Low	140 Å²	140	124.2 Å²	124.2	75%	0.749	68%	0.678	S	S	*	*			trans	45.9	70.7	174.1	-79.1	-0.3	0	0	0	119.9	T333	D331-T333 HydrophobicContact CB-CG2 4.47Å; D331-T333 PolarHBondContact O-N 3.2Å
332	G	44.2	Very low	56.1	Low	70 Å²	70	122.4 Å²	122.4	72%	0.722	67%	0.673	S	S	*	*			trans	-67.4	35.6	173.7	0	0	0	0	0	117.5	N334	G332-N334 PolarHBondContact O-N 3.27Å
333	T	52.8	Low	58.4	Low	100 Å²	100	122.8 Å²	122.8	61%	0.613	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-59.9	-24.7	-175.8	57.6	0	0	0	0	114.7	D331 R335 S336	D331-T333 HydrophobicContact CB-CG2 4.47Å; D331-T333 PolarHBondContact O-N 3.2Å; T333-R335 PolarHBondContact O-N 3.32Å; T333-R335 VanDerWaalsContact O-N 3.14Å; T333-S336 VanDerWaalsContact O-CB 3.28Å; T333-S336 WeakPolarHBondContact O-CB 3.36Å; T333-S336 PolarHBondContact O-N 2.87Å; T333-S336 VanDerWaalsContact O-N 3.15Å; T333-S336 PolarHBondContact O-OG 3.03Å
334	N	50.8	Low	60.4	Low	113 Å²	113	117.3 Å²	117.3	60%	0.604	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-73.3	-4	-171.3	-148.1	-12.6	0	0	0	114.7	G332 S336 L337	G332-N334 PolarHBondContact O-N 3.27Å; N334-S336 PolarHBondContact O-N 3.26Å; N334-L337 WeakPolarHBondContact OD1-CD1 3.46Å
335	R	52.1	Low	62.8	Low	225 Å²	225	119 Å²	119	85%	0.849	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-67.1	-23.5	167.6	-67	-170.3	-179.3	-158.2	0.9	112.3	T333 L337	T333-R335 PolarHBondContact O-N 3.32Å; T333-R335 VanDerWaalsContact O-N 3.14Å; R335-L337 VanDerWaalsContact C-N 3.27Å; R335-L337 PolarHBondContact O-N 3.44Å
336	S	58.2	Low	65.1	Low	80 Å²	80	118 Å²	118	56%	0.559	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-66.2	-17	-176.7	-53.5	0	0	0	0	115.6	T333 N334 W339	T333-S336 VanDerWaalsContact O-CB 3.28Å; T333-S336 WeakPolarHBondContact O-CB 3.36Å; T333-S336 PolarHBondContact O-N 2.87Å; T333-S336 VanDerWaalsContact O-N 3.15Å; T333-S336 PolarHBondContact O-OG 3.03Å; N334-S336 PolarHBondContact O-N 3.26Å; S336-W339 PolarHBondContact O-NE1 2.97Å; S336-W339 VanDerWaalsContact O-NE1 3.09Å
337	L	66.3	Low	67.4	Low	116 Å²	116	113.8 Å²	113.8	61%	0.607	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-89.5	-11.3	-175.2	-59.5	-173.1	0	0	0	114	N334 R335	N334-L337 WeakPolarHBondContact OD1-CD1 3.46Å; R335-L337 VanDerWaalsContact C-N 3.27Å; R335-L337 PolarHBondContact O-N 3.44Å
338	R	82.5	Confident	69.8	Low	183 Å²	183	113.4 Å²	113.4	69%	0.691	59%	0.591	S	S	*	*			trans	-110.1	117.1	176.8	-81.9	-174	-87.1	-99.4	4.7	110.8	P340 V347	R338-P340 WeakPolarHBondContact O-CD 3.05Å; R338-V347 HydrophobicContact CB-CG1 3.88Å; R338-V347 HydrophobicContact CG-CG1 4.21Å
339	W	86.9	Confident	72.1	Confident	89 Å²	89	108 Å²	108	34%	0.337	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.5	100.1	-175.5	-63.8	77.6	0	0	0	109.2	S336 F348 S350 R351 V354	S336-W339 PolarHBondContact O-NE1 2.97Å; S336-W339 VanDerWaalsContact O-NE1 3.09Å; W339-F348 PolarHBondContact N-O 3.3Å; W339-F348 PolarHBondContact O-N 2.88Å; W339-S350 VanDerWaalsContact CD1-C 3.49Å; W339-S350 VanDerWaalsContact CD1-CA 3.47Å; W339-S350 VanDerWaalsContact CG-C 3.49Å; W339-R351 HydrophobicContact CD2-CB 3.76Å; W339-R351 HydrophobicContact CD2-CG 4.38Å; W339-R351 HydrophobicContact CE3-CB 3.66Å; W339-R351 HydrophobicContact CE3-CG 3.75Å; W339-R351 HydrophobicContact CG-CB 4.48Å; W339-R351 HydrophobicContact CH2-CB 4.05Å; W339-R351 HydrophobicContact CH2-CG 4.21Å; W339-R351 HydrophobicContact CZ2-CB 4.12Å; W339-R351 HydrophobicContact CZ3-CB 3.82Å; W339-R351 HydrophobicContact CZ3-CG 3.67Å; W339-V354 HydrophobicContact CB-CG2 3.5Å; W339-V354 VanDerWaalsContact CB-CG2 3.5Å; W339-V354 WeakPolarHBondContact O-CG2 3.49Å
340	P	91.4	Very high	74.6	Confident	87 Å²	87	105.2 Å²	105.2	57%	0.565	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72	150.5	175.8	29.8	-34.6	0	0	0	111.4	R338 V347	R338-P340 WeakPolarHBondContact O-CD 3.05Å; P340-V347 HydrophobicContact CB-CG2 4.28Å
341	C	90.5	Very high	76.6	Confident	10 Å²	10	104.4 Å²	104.4	7%	0.068	56%	0.555	C	S	.	*			trans	-73.6	132.8	164.3	-171.7	0	0	0	0	110	L343 K346 H357 H362	C341-L343 PolarHBondContact O-N 3.36Å; C341-L343 PolarHBondContact SG-N 3.06Å; C341-L343 VanDerWaalsContact SG-N 3.44Å; C341-K346 WeakPolarHBondContact CB-O 3.43Å; C341-K346 PolarHBondContact N-O 3.28Å; C341-H357 PolarHBondContact SG-CD2 2.96Å; C341-H357 PolarHBondContact SG-NE2 3.27Å; C341-H362 VanDerWaalsContact SG-CD2 3.54Å
342	P	88.2	Confident	78.8	Confident	89 Å²	89	100.6 Å²	100.6	58%	0.578	54%	0.542	S	S	*	.	S	Bend	trans	-75	0.6	174.3	30.2	-34.6	0	0	0	113.8
343	L	86.8	Confident	81	Confident	93 Å²	93	97.6 Å²	97.6	49%	0.487	51%	0.511	S	S	.	.	S	Bend	trans	-129.6	-3.3	-171.9	-61.3	172.3	0	0	0	114.1	C341 R358 H362	C341-L343 PolarHBondContact O-N 3.36Å; C341-L343 PolarHBondContact SG-N 3.06Å; C341-L343 VanDerWaalsContact SG-N 3.44Å; L343-R358 HydrophobicContact CD1-CG 4.4Å; L343-H362 HydrophobicContact CB-CB 4.38Å; L343-H362 HydrophobicContact CD1-CB 3.61Å; L343-H362 PolarHBondContact O-CE1 2.87Å
344	C	88.9	Confident	82.7	Confident	44 Å²	44	93.6 Å²	93.6	30%	0.297	49%	0.487	S	S	.	.	S	Bend	trans	-160.1	174.1	163.9	76.3	0	0	0	0	111.1	K346 H357	C344-K346 PolarHBondContact O-N 3.08Å; C344-H357 VanDerWaalsContact SG-CE1 3.57Å; C344-H357 PolarHBondContact SG-NE2 3.04Å
345	T	90	Very high	84.4	Confident	143 Å²	143	91 Å²	91	88%	0.877	48%	0.481	S	S	*	.	S	Bend	trans	-69.6	1	-175.6	51.6	0	0	0	0	115.9
346	K	89.6	Confident	86	Confident	125 Å²	125	88 Å²	88	54%	0.543	47%	0.47	S	S	.	.			trans	-79.2	128.3	-175.5	-66.2	-179.9	179.9	178.6	0	111.9	C341 C344 F348	C341-K346 WeakPolarHBondContact CB-O 3.43Å; C341-K346 PolarHBondContact N-O 3.28Å; C344-K346 PolarHBondContact O-N 3.08Å; K346-F348 HydrophobicContact CB-CE2 3.6Å; K346-F348 HydrophobicContact CB-CZ 3.84Å; K346-F348 WeakPolarHBondContact O-CE2 3.45Å
347	V	91.6	Very high	87.5	Confident	85 Å²	85	85.1 Å²	85.1	52%	0.515	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137.8	177.9	-173.7	0	0	0	0	110.1	R338 P340	R338-V347 HydrophobicContact CB-CG1 3.88Å; R338-V347 HydrophobicContact CG-CG1 4.21Å; P340-V347 HydrophobicContact CB-CG2 4.28Å
348	F	90.2	Very high	88.5	Confident	53 Å²	53	86 Å²	86	23%	0.232	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.2	-175	-61.7	-94	0	0	0	111.4	W339 K346 S350 V354 H357	W339-F348 PolarHBondContact N-O 3.3Å; W339-F348 PolarHBondContact O-N 2.88Å; K346-F348 HydrophobicContact CB-CE2 3.6Å; K346-F348 HydrophobicContact CB-CZ 3.84Å; K346-F348 WeakPolarHBondContact O-CE2 3.45Å; F348-S350 PolarHBondContact O-N 3.14Å; F348-V354 HydrophobicContact CB-CG2 4.07Å; F348-V354 HydrophobicContact CD2-CG2 3.83Å; F348-V354 HydrophobicContact CG-CG2 4.27Å; F348-H357 HydrophobicContact CE1-CB 3.82Å; F348-H357 HydrophobicContact CE2-CB 3.74Å; F348-H357 AromaticContact CE2-CD2 3.28Å; F348-H357 WeakPolarHBondContact CE2-CD2 3.45Å; F348-H357 AromaticContact CE2-CG 3.51Å; F348-H357 HydrophobicContact CZ-CB 3.34Å; F348-H357 AromaticContact CZ-CD2 3.54Å; F348-H357 AromaticContact CZ-CG 3.23Å; F348-H357 AromaticContact CZ-ND1 3.83Å
349	T	88.8	Confident	88.5	Confident	130 Å²	130	80.8 Å²	80.8	80%	0.798	43%	0.434	S	S	*	.	S	Bend	trans	-75.5	1.2	178.6	52.3	0	0	0	0	114.2
350	S	87.7	Confident	88.1	Confident	41 Å²	41	82 Å²	82	29%	0.287	45%	0.447	S	S	.	.	S	Bend	trans	-161.1	154.1	180	58.2	0	0	0	0	112.5	W339 F348 A352 G353 V354	W339-S350 VanDerWaalsContact CD1-C 3.49Å; W339-S350 VanDerWaalsContact CD1-CA 3.47Å; W339-S350 VanDerWaalsContact CG-C 3.49Å; F348-S350 PolarHBondContact O-N 3.14Å; S350-A352 PolarHBondContact O-N 3.46Å; S350-G353 WeakPolarHBondContact O-CA 3.46Å; S350-G353 PolarHBondContact O-N 3.29Å; S350-G353 PolarHBondContact OG-N 3.37Å; S350-G353 VanDerWaalsContact OG-N 3.11Å; S350-V354 PolarHBondContact O-N 3.25Å; S350-V354 VanDerWaalsContact O-N 3.16Å
351	R	89.1	Confident	87.7	Confident	177 Å²	177	79.8 Å²	79.8	67%	0.668	44%	0.435	S	S	*	.	H	α-helix	trans	-56.7	-33.5	170.5	-164.5	175.8	-178.5	131.1	-5.2	112.3	W339 G353 V354 A355	W339-R351 HydrophobicContact CD2-CB 3.76Å; W339-R351 HydrophobicContact CD2-CG 4.38Å; W339-R351 HydrophobicContact CE3-CB 3.66Å; W339-R351 HydrophobicContact CE3-CG 3.75Å; W339-R351 HydrophobicContact CG-CB 4.48Å; W339-R351 HydrophobicContact CH2-CB 4.05Å; W339-R351 HydrophobicContact CH2-CG 4.21Å; W339-R351 HydrophobicContact CZ2-CB 4.12Å; W339-R351 HydrophobicContact CZ3-CB 3.82Å; W339-R351 HydrophobicContact CZ3-CG 3.67Å; R351-G353 VanDerWaalsContact C-N 3.33Å; R351-V354 PolarHBondContact O-N 3.43Å; R351-A355 WeakPolarHBondContact O-CB 2.94Å; R351-A355 PolarHBondContact O-N 3.05Å
352	A	88.4	Confident	87.3	Confident	59 Å²	59	80.9 Å²	80.9	49%	0.488	44%	0.439	S	S	.	.	H	α-helix	trans	-71.3	-24.2	173.7	0	0	0	0	0	113.6	S350 R356	S350-A352 PolarHBondContact O-N 3.46Å; A352-R356 WeakPolarHBondContact O-CG 3.49Å; A352-R356 PolarHBondContact O-N 2.98Å; A352-R356 PolarHBondContact O-NE 2.85Å
353	G	89.3	Confident	86.6	Confident	7 Å²	7	77.1 Å²	77.1	7%	0.072	42%	0.416	C	S	.	.	H	α-helix	trans	-66.9	-52.1	166.3	0	0	0	0	0	111.3	S350 R351 A355 R356 H357	S350-G353 WeakPolarHBondContact O-CA 3.46Å; S350-G353 PolarHBondContact O-N 3.29Å; S350-G353 PolarHBondContact OG-N 3.37Å; S350-G353 VanDerWaalsContact OG-N 3.11Å; R351-G353 VanDerWaalsContact C-N 3.33Å; G353-A355 PolarHBondContact O-N 3.07Å; G353-R356 PolarHBondContact O-N 3.33Å; G353-H357 WeakPolarHBondContact O-CB 3.43Å; G353-H357 PolarHBondContact O-N 3Å
354	V	89.5	Confident	85.7	Confident	17 Å²	17	79.1 Å²	79.1	10%	0.103	44%	0.435	C	S	.	.	H	α-helix	trans	-60.4	-42.1	175.6	176.9	0	0	0	0	111.9	W339 F348 S350 R351 H357 R358	W339-V354 HydrophobicContact CB-CG2 3.5Å; W339-V354 VanDerWaalsContact CB-CG2 3.5Å; W339-V354 WeakPolarHBondContact O-CG2 3.49Å; F348-V354 HydrophobicContact CB-CG2 4.07Å; F348-V354 HydrophobicContact CD2-CG2 3.83Å; F348-V354 HydrophobicContact CG-CG2 4.27Å; S350-V354 PolarHBondContact O-N 3.25Å; S350-V354 VanDerWaalsContact O-N 3.16Å; R351-V354 PolarHBondContact O-N 3.43Å; V354-H357 PolarHBondContact O-N 2.73Å; V354-R358 WeakPolarHBondContact O-CB 3.4Å; V354-R358 PolarHBondContact O-N 3.07Å
355	A	87	Confident	84.2	Confident	59 Å²	59	82 Å²	82	49%	0.488	45%	0.448	S	S	.	.	H	α-helix	trans	-60.6	-50.1	179.5	0	0	0	0	0	111.9	R351 G353 R358 S359	R351-A355 WeakPolarHBondContact O-CB 2.94Å; R351-A355 PolarHBondContact O-N 3.05Å; G353-A355 PolarHBondContact O-N 3.07Å; A355-R358 PolarHBondContact O-N 3.44Å; A355-S359 PolarHBondContact O-N 3.29Å; A355-S359 PolarHBondContact O-OG 2.89Å
356	R	85.9	Confident	82.5	Confident	161 Å²	161	84 Å²	84	61%	0.608	44%	0.439	S	S	*	.	H	α-helix	trans	-62.4	-44.4	175.9	-74.1	-177.1	-67.8	165.9	-2.3	112.1	A352 G353 R358 S359 I360	A352-R356 WeakPolarHBondContact O-CG 3.49Å; A352-R356 PolarHBondContact O-N 2.98Å; A352-R356 PolarHBondContact O-NE 2.85Å; G353-R356 PolarHBondContact O-N 3.33Å; R356-R358 PolarHBondContact O-N 3.1Å; R356-S359 WeakPolarHBondContact CA-OG 3.32Å; R356-S359 PolarHBondContact O-N 3.4Å; R356-S359 PolarHBondContact O-OG 3.13Å; R356-I360 HydrophobicContact CB-CD1 4.45Å; R356-I360 WeakPolarHBondContact O-CB 3.37Å; R356-I360 WeakPolarHBondContact O-CD1 3.26Å; R356-I360 WeakPolarHBondContact O-CG1 3.49Å; R356-I360 PolarHBondContact O-N 3.45Å
357	H	89.3	Confident	80.8	Confident	20 Å²	20	81.3 Å²	81.3	9%	0.093	45%	0.447	C	S	.	.	H	α-helix	trans	-63.9	-41	177.3	166.8	58.6	0	0	0	112.3	C341 C344 F348 G353 V354 S359 I360 A361 H362	C341-H357 PolarHBondContact SG-CD2 2.96Å; C341-H357 PolarHBondContact SG-NE2 3.27Å; C344-H357 VanDerWaalsContact SG-CE1 3.57Å; C344-H357 PolarHBondContact SG-NE2 3.04Å; F348-H357 HydrophobicContact CE1-CB 3.82Å; F348-H357 HydrophobicContact CE2-CB 3.74Å; F348-H357 AromaticContact CE2-CD2 3.28Å; F348-H357 WeakPolarHBondContact CE2-CD2 3.45Å; F348-H357 AromaticContact CE2-CG 3.51Å; F348-H357 HydrophobicContact CZ-CB 3.34Å; F348-H357 AromaticContact CZ-CD2 3.54Å; F348-H357 AromaticContact CZ-CG 3.23Å; F348-H357 AromaticContact CZ-ND1 3.83Å; G353-H357 WeakPolarHBondContact O-CB 3.43Å; G353-H357 PolarHBondContact O-N 3Å; V354-H357 PolarHBondContact O-N 2.73Å; H357-S359 VanDerWaalsContact C-N 3.33Å; H357-S359 PolarHBondContact O-N 3.02Å; H357-I360 PolarHBondContact O-N 3.04Å; H357-A361 VanDerWaalsContact CE1-CB 3.44Å; H357-A361 WeakPolarHBondContact CE1-CB 3.15Å; H357-A361 WeakPolarHBondContact O-CB 3.16Å; H357-A361 PolarHBondContact O-N 3.12Å; H357-H362 AromaticContact CE1-CD2 3.87Å; H357-H362 AromaticContact CE1-NE2 3.6Å; H357-H362 AromaticContact NE2-CD2 3.57Å; H357-H362 AromaticContact NE2-NE2 3.31Å; H357-H362 PolarHBondContact NE2-NE2 2.94Å
358	R	86.4	Confident	79	Confident	134 Å²	134	87.1 Å²	87.1	51%	0.506	46%	0.46	S	S	.	.	H	α-helix	trans	-64.1	-36.7	175	-170.8	174	-179	171.9	0.1	111.4	L343 V354 A355 R356 H362 G363	L343-R358 HydrophobicContact CD1-CG 4.4Å; V354-R358 WeakPolarHBondContact O-CB 3.4Å; V354-R358 PolarHBondContact O-N 3.07Å; A355-R358 PolarHBondContact O-N 3.44Å; R356-R358 PolarHBondContact O-N 3.1Å; R358-H362 HydrophobicContact CG-CB 4.29Å; R358-H362 CarbonylContact O-C 3.57Å; R358-H362 VanDerWaalsContact O-CA 3.31Å; R358-H362 WeakPolarHBondContact O-CA 3.35Å; R358-H362 WeakPolarHBondContact O-CB 3.47Å; R358-H362 PolarHBondContact O-N 3.13Å; R358-G363 PolarHBondContact O-N 2.9Å
359	S	82.9	Confident	77	Confident	73 Å²	73	89.6 Å²	89.6	51%	0.51	48%	0.481	S	S	.	.	H	α-helix	trans	-72.7	-29.4	174.2	62.3	0	0	0	0	114.1	A355 R356 H357	A355-S359 PolarHBondContact O-N 3.29Å; A355-S359 PolarHBondContact O-OG 2.89Å; R356-S359 WeakPolarHBondContact CA-OG 3.32Å; R356-S359 PolarHBondContact O-N 3.4Å; R356-S359 PolarHBondContact O-OG 3.13Å; H357-S359 VanDerWaalsContact C-N 3.33Å; H357-S359 PolarHBondContact O-N 3.02Å
360	I	79.6	Confident	75.2	Confident	116 Å²	116	94.4 Å²	94.4	60%	0.595	48%	0.484	S	S	*	.	H	α-helix	trans	-91.4	-43.3	-174.2	-66.9	164.5	0	0	0	112.6	R356 H357	R356-I360 HydrophobicContact CB-CD1 4.45Å; R356-I360 WeakPolarHBondContact O-CB 3.37Å; R356-I360 WeakPolarHBondContact O-CD1 3.26Å; R356-I360 WeakPolarHBondContact O-CG1 3.49Å; R356-I360 PolarHBondContact O-N 3.45Å; H357-I360 PolarHBondContact O-N 3.04Å
361	A	81.7	Confident	73.4	Confident	39 Å²	39	96.2 Å²	96.2	32%	0.322	51%	0.51	S	S	.	.	H	α-helix	trans	-100.9	-17.3	-176.3	0	0	0	0	0	113.8	H357	H357-A361 VanDerWaalsContact CE1-CB 3.44Å; H357-A361 WeakPolarHBondContact CE1-CB 3.15Å; H357-A361 WeakPolarHBondContact O-CB 3.16Å; H357-A361 PolarHBondContact O-N 3.12Å
362	H	82.8	Confident	71.6	Confident	33 Å²	33	98.1 Å²	98.1	15%	0.153	52%	0.517	C	S	.	.	S	Bend	trans	-135.5	13	-174.9	-54	-70.3	0	0	0	113.3	C341 L343 H357 R358	C341-H362 VanDerWaalsContact SG-CD2 3.54Å; L343-H362 HydrophobicContact CB-CB 4.38Å; L343-H362 HydrophobicContact CD1-CB 3.61Å; L343-H362 PolarHBondContact O-CE1 2.87Å; H357-H362 AromaticContact CE1-CD2 3.87Å; H357-H362 AromaticContact CE1-NE2 3.6Å; H357-H362 AromaticContact NE2-CD2 3.57Å; H357-H362 AromaticContact NE2-NE2 3.31Å; H357-H362 PolarHBondContact NE2-NE2 2.94Å; R358-H362 HydrophobicContact CG-CB 4.29Å; R358-H362 CarbonylContact O-C 3.57Å; R358-H362 VanDerWaalsContact O-CA 3.31Å; R358-H362 WeakPolarHBondContact O-CA 3.35Å; R358-H362 WeakPolarHBondContact O-CB 3.47Å; R358-H362 PolarHBondContact O-N 3.13Å
363	G	73.1	Confident	69.5	Low	10 Å²	10	106 Å²	106	10%	0.103	53%	0.534	C	S	.	.	S	Bend	trans	-72.2	166.1	171.9	0	0	0	0	0	110.5	R358 N365 R366	R358-G363 PolarHBondContact O-N 2.9Å; G363-N365 PolarHBondContact O-N 3.34Å; G363-R366 WeakPolarHBondContact O-CG 3.48Å; G363-R366 PolarHBondContact O-N 3.28Å
364	P	68.3	Low	68.3	Low	135 Å²	135	108.9 Å²	108.9	88%	0.877	56%	0.557	S	S	*	*	S	Bend	trans	-59.2	-35.6	172.5	24.2	-32.8	0	0	0	111.2	R366	P364-R366 PolarHBondContact O-N 3.24Å
365	N	57.7	Low	67.3	Low	106 Å²	106	111 Å²	111	57%	0.567	57%	0.568	S	S	*	*	S	Bend	trans	-77.6	61.5	171.2	-77.1	-90.9	0	0	0	112	G363 G367	G363-N365 PolarHBondContact O-N 3.34Å; N365-G367 PolarHBondContact O-N 3.18Å
366	R	54.7	Low	67	Low	183 Å²	183	113.1 Å²	113.1	69%	0.691	58%	0.577	S	S	*	*			trans	-70.3	120.5	167.2	-55.7	-166	-163.4	-147.7	15.2	108.4	G363 P364	G363-R366 WeakPolarHBondContact O-CG 3.48Å; G363-R366 PolarHBondContact O-N 3.28Å; P364-R366 PolarHBondContact O-N 3.24Å
367	G	53.2	Low	66.8	Low	69 Å²	69	110.9 Å²	110.9	71%	0.711	57%	0.569	S	S	*	*	S	Bend	trans	125.2	-45.2	171.3	0	0	0	0	0	115.1	N365 P369	N365-G367 PolarHBondContact O-N 3.18Å; G367-P369 WeakPolarHBondContact O-CD 3.21Å
368	R	54	Low	66.4	Low	207 Å²	207	113.7 Å²	113.7	78%	0.781	58%	0.583	S	S	*	*			trans	-65.1	117.1	-176.4	-86.7	-161.4	177.1	-81.6	2.6	112.3	R370	R368-R370 PolarHBondContact O-N 3.12Å
369	P	48	Very low	66	Low	105 Å²	105	109.1 Å²	109.1	68%	0.682	57%	0.574	S	S	*	*			trans	-73.3	95	-179.2	-16.3	32.2	0	0	0	111.4	G367 G371	G367-P369 WeakPolarHBondContact O-CD 3.21Å; P369-G371 PolarHBondContact O-N 2.86Å
370	R	50.8	Low	65.9	Low	231 Å²	231	106.6 Å²	106.6	87%	0.872	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	102	175.7	-73.8	-164	177.5	-144	-0.3	111	R368	R368-R370 PolarHBondContact O-N 3.12Å
371	G	50.7	Low	66.3	Low	79 Å²	79	103.5 Å²	103.5	81%	0.814	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.9	46.1	162.7	0	0	0	0	0	116.6	P369	P369-G371 PolarHBondContact O-N 2.86Å
372	R	50.6	Low	66.6	Low	217 Å²	217	108.8 Å²	108.8	82%	0.819	56%	0.555	S	S	*	*	S	Bend	trans	-134.8	-44.4	161.8	-166.6	164.4	-67.3	-80.6	0.5	115.1
373	W	44.6	Very low	66.8	Low	226 Å²	226	115 Å²	115	86%	0.856	58%	0.577	S	S	*	*			trans	-123.9	112.2	170.5	-63.8	-29.2	0	0	0	109.7
374	A	63.7	Low	67.6	Low	67 Å²	67	117.5 Å²	117.5	55%	0.554	58%	0.583	S	S	*	*			trans	-85	130.3	152.7	0	0	0	0	0	106.1	P376	A374-P376 VanDerWaalsContact O-N 3.14Å
375	N	69.5	Low	68.7	Low	61 Å²	61	113.9 Å²	113.9	33%	0.326	57%	0.565	S	S	.	*			trans	-53.5	122.5	174.9	173.2	-10.4	0	0	0	108.1	Y377 M378 A379	N375-Y377 PolarHBondContact O-N 2.84Å; N375-Y377 VanDerWaalsContact OD1-CB 3.29Å; N375-Y377 WeakPolarHBondContact OD1-CB 3.29Å; N375-Y377 PolarHBondContact OD1-N 2.68Å; N375-M378 HydrophobicContact CB-CB 4.17Å; N375-M378 HydrophobicContact CB-CG 4.43Å; N375-M378 CarbonylContact O-C 3.56Å; N375-M378 PolarHBondContact O-N 3.27Å; N375-M378 VanDerWaalsContact O-N 3.13Å; N375-A379 PolarHBondContact O-N 3.28Å
376	P	80.5	Confident	70.4	Confident	104 Å²	104	113.6 Å²	113.6	68%	0.675	56%	0.558	S	S	*	*	H	α-helix	trans	-59.7	-32.2	-175.9	23.6	-33.9	0	0	0	112.1	A374 A379 S380	A374-P376 VanDerWaalsContact O-N 3.14Å; P376-A379 PolarHBondContact O-N 3.01Å; P376-S380 WeakPolarHBondContact O-CB 3.48Å; P376-S380 PolarHBondContact O-N 2.6Å
377	Y	80.8	Confident	72.3	Confident	113 Å²	113	110.2 Å²	110.2	44%	0.443	55%	0.553	S	S	.	*	H	α-helix	trans	-59.7	-57.8	171.8	-178.6	-110.6	0	0	0	110.9	N375 A379 S380 V381 E828	N375-Y377 PolarHBondContact O-N 2.84Å; N375-Y377 VanDerWaalsContact OD1-CB 3.29Å; N375-Y377 WeakPolarHBondContact OD1-CB 3.29Å; N375-Y377 PolarHBondContact OD1-N 2.68Å; Y377-A379 PolarHBondContact O-N 3.26Å; Y377-A379 VanDerWaalsContact O-N 3.15Å; Y377-S380 CarbonylContact O-C 3.58Å; Y377-S380 WeakPolarHBondContact O-CA 3.45Å; Y377-S380 WeakPolarHBondContact O-CB 3.23Å; Y377-S380 PolarHBondContact O-N 2.97Å; Y377-S380 PolarHBondContact O-OG 2.98Å; Y377-V381 HydrophobicContact CD1-CG2 4.42Å; Y377-V381 HydrophobicContact CE1-CG2 4.14Å; Y377-V381 HydrophobicContact CE2-CG2 4.25Å; Y377-V381 WeakPolarHBondContact O-CG2 3.33Å; Y377-V381 PolarHBondContact O-N 2.92Å; Y377-E828 WeakPolarHBondContact CE1-OE1 3.32Å
378	M	81.6	Confident	74.2	Confident	80 Å²	80	114.9 Å²	114.9	39%	0.394	55%	0.554	S	S	.	*	H	α-helix	trans	-64.4	-18	176.8	-73.2	-72.8	150.1	0	0	114.2	N375 R382 E828	N375-M378 HydrophobicContact CB-CB 4.17Å; N375-M378 HydrophobicContact CB-CG 4.43Å; N375-M378 CarbonylContact O-C 3.56Å; N375-M378 PolarHBondContact O-N 3.27Å; N375-M378 VanDerWaalsContact O-N 3.13Å; M378-R382 PolarHBondContact O-NE 3.37Å; M378-R382 PolarHBondContact O-NH2 3.4Å; M378-R382 VanDerWaalsContact O-NH2 3.09Å; M378-E828 WeakPolarHBondContact CE-OE1 3.47Å
379	A	77.1	Confident	76.1	Confident	37 Å²	37	109.5 Å²	109.5	31%	0.306	54%	0.538	S	S	.	.	H	α-helix	trans	-80.4	-39.4	168.5	0	0	0	0	0	111.5	N375 P376 Y377 R383	N375-A379 PolarHBondContact O-N 3.28Å; P376-A379 PolarHBondContact O-N 3.01Å; Y377-A379 PolarHBondContact O-N 3.26Å; Y377-A379 VanDerWaalsContact O-N 3.15Å; A379-R383 WeakPolarHBondContact O-CB 3.3Å; A379-R383 PolarHBondContact O-N 3.49Å
380	S	81.8	Confident	78.3	Confident	20 Å²	20	106.9 Å²	106.9	14%	0.14	53%	0.525	C	S	.	.	H	α-helix	trans	-67.7	-41.2	175.9	79.5	0	0	0	0	112.4	P376 Y377 R382 R383 R384	P376-S380 WeakPolarHBondContact O-CB 3.48Å; P376-S380 PolarHBondContact O-N 2.6Å; Y377-S380 CarbonylContact O-C 3.58Å; Y377-S380 WeakPolarHBondContact O-CA 3.45Å; Y377-S380 WeakPolarHBondContact O-CB 3.23Å; Y377-S380 PolarHBondContact O-N 2.97Å; Y377-S380 PolarHBondContact O-OG 2.98Å; S380-R382 PolarHBondContact O-N 2.82Å; S380-R383 CarbonylContact O-C 3.48Å; S380-R383 WeakPolarHBondContact O-CA 3.47Å; S380-R383 WeakPolarHBondContact O-CB 3.48Å; S380-R383 PolarHBondContact O-N 3.13Å; S380-R384 PolarHBondContact O-N 3.08Å; S380-R384 PolarHBondContact OG-NH2 2.88Å
381	V	87.5	Confident	80.3	Confident	52 Å²	52	99.2 Å²	99.2	32%	0.315	50%	0.504	S	S	.	.	H	α-helix	trans	-60	-47.7	175.2	172.6	0	0	0	0	110.4	Y377 R383 R384 A385	Y377-V381 HydrophobicContact CD1-CG2 4.42Å; Y377-V381 HydrophobicContact CE1-CG2 4.14Å; Y377-V381 HydrophobicContact CE2-CG2 4.25Å; Y377-V381 WeakPolarHBondContact O-CG2 3.33Å; Y377-V381 PolarHBondContact O-N 2.92Å; V381-R383 PolarHBondContact O-N 2.91Å; V381-R384 PolarHBondContact O-N 3.33Å; V381-A385 WeakPolarHBondContact O-CB 3.49Å; V381-A385 PolarHBondContact O-N 3.1Å
382	R	87.9	Confident	82.3	Confident	150 Å²	150	100.1 Å²	100.1	57%	0.566	50%	0.497	S	S	*	.	H	α-helix	trans	-68.9	-14.6	173.3	-75.9	177.8	-67.4	151.9	4.1	114.1	M378 S380 K386	M378-R382 PolarHBondContact O-NE 3.37Å; M378-R382 PolarHBondContact O-NH2 3.4Å; M378-R382 VanDerWaalsContact O-NH2 3.09Å; S380-R382 PolarHBondContact O-N 2.82Å; R382-K386 VanDerWaalsContact O-CG 3.26Å; R382-K386 WeakPolarHBondContact O-CG 3.39Å
383	R	87.1	Confident	84.4	Confident	163 Å²	163	97 Å²	97	62%	0.615	49%	0.492	S	S	*	.	H	α-helix	trans	-82.4	-45.5	169.2	-168	-168.7	-70.4	145.3	-9.3	110.4	A379 S380 V381 K386 L387	A379-R383 WeakPolarHBondContact O-CB 3.3Å; A379-R383 PolarHBondContact O-N 3.49Å; S380-R383 CarbonylContact O-C 3.48Å; S380-R383 WeakPolarHBondContact O-CA 3.47Å; S380-R383 WeakPolarHBondContact O-CB 3.48Å; S380-R383 PolarHBondContact O-N 3.13Å; V381-R383 PolarHBondContact O-N 2.91Å; R383-K386 PolarHBondContact O-N 3.22Å; R383-L387 WeakPolarHBondContact O-CB 3.17Å; R383-L387 PolarHBondContact O-N 3.35Å
384	R	90	Very high	86.7	Confident	62 Å²	62	87.9 Å²	87.9	23%	0.234	47%	0.465	C	S	.	.	H	α-helix	trans	-63.7	-45.4	176.9	-68.8	-171.3	-156.2	109.2	23.1	112.2	S380 V381 K386 L387 K388 V643 L645	S380-R384 PolarHBondContact O-N 3.08Å; S380-R384 PolarHBondContact OG-NH2 2.88Å; V381-R384 PolarHBondContact O-N 3.33Å; R384-K386 VanDerWaalsContact C-N 3.3Å; R384-K386 PolarHBondContact O-N 3.11Å; R384-L387 PolarHBondContact O-N 3.32Å; R384-L387 VanDerWaalsContact O-N 3.13Å; R384-K388 WeakPolarHBondContact O-CB 3.39Å; R384-K388 PolarHBondContact O-N 2.93Å; R384-V643 VanDerWaalsContact NH1-CG1 3.3Å; R384-L645 VanDerWaalsContact NH2-CD2 3.27Å
385	A	91.7	Very high	88.1	Confident	60 Å²	60	88.3 Å²	88.3	50%	0.496	46%	0.461	S	S	.	.	H	α-helix	trans	-56.3	-46.3	176.4	0	0	0	0	0	111.4	V381 L387 K388 E389	V381-A385 WeakPolarHBondContact O-CB 3.49Å; V381-A385 PolarHBondContact O-N 3.1Å; A385-L387 PolarHBondContact O-N 2.57Å; A385-K388 PolarHBondContact O-N 2.92Å; A385-E389 VanDerWaalsContact O-CB 3.3Å; A385-E389 WeakPolarHBondContact O-CB 3.46Å; A385-E389 PolarHBondContact O-N 3.21Å
386	K	93.7	Very high	89.2	Confident	100 Å²	100	91.6 Å²	91.6	44%	0.435	48%	0.478	S	S	.	.	H	α-helix	trans	-71.4	-26	177.6	-67.4	-163.4	154	-66	0	114.5	R382 R383 R384 E389 A390	R382-K386 VanDerWaalsContact O-CG 3.26Å; R382-K386 WeakPolarHBondContact O-CG 3.39Å; R383-K386 PolarHBondContact O-N 3.22Å; R384-K386 VanDerWaalsContact C-N 3.3Å; R384-K386 PolarHBondContact O-N 3.11Å; K386-E389 IonicContact NZ-OE2 3.84Å; K386-E389 PolarHBondContact NZ-OE2 3.29Å; K386-A390 VanDerWaalsContact O-CB 3.32Å; K386-A390 WeakPolarHBondContact O-CB 3.26Å; K386-A390 PolarHBondContact O-N 2.87Å
387	L	93.3	Very high	89.6	Confident	112 Å²	112	91 Å²	91	59%	0.586	47%	0.47	S	S	*	.	H	α-helix	trans	-75.3	-39.7	172.2	-175.9	61.8	0	0	0	110.8	R383 R384 A385 A390 V391	R383-L387 WeakPolarHBondContact O-CB 3.17Å; R383-L387 PolarHBondContact O-N 3.35Å; R384-L387 PolarHBondContact O-N 3.32Å; R384-L387 VanDerWaalsContact O-N 3.13Å; A385-L387 PolarHBondContact O-N 2.57Å; L387-A390 PolarHBondContact O-N 3.27Å; L387-V391 HydrophobicContact CD1-CG2 4.13Å; L387-V391 HydrophobicContact CG-CG2 4.39Å; L387-V391 VanDerWaalsContact O-CB 3.29Å; L387-V391 WeakPolarHBondContact O-CB 3.43Å; L387-V391 WeakPolarHBondContact O-CG2 3.33Å; L387-V391 PolarHBondContact O-N 2.99Å
388	K	93.8	Very high	90.1	Very high	167 Å²	167	88.7 Å²	88.7	73%	0.726	47%	0.465	S	S	*	.	H	α-helix	trans	-63.3	-45.6	173.9	-172	175.2	-178.4	176.3	0	111.1	R384 A385 V391 S392	R384-K388 WeakPolarHBondContact O-CB 3.39Å; R384-K388 PolarHBondContact O-N 2.93Å; A385-K388 PolarHBondContact O-N 2.92Å; K388-V391 PolarHBondContact O-N 2.84Å; K388-S392 WeakPolarHBondContact O-CB 3.47Å; K388-S392 PolarHBondContact O-N 3.24Å; K388-S392 PolarHBondContact O-OG 2.89Å; K388-S392 VanDerWaalsContact O-OG 3.07Å
389	E	93.8	Very high	90.5	Very high	94 Å²	94	87 Å²	87	44%	0.439	46%	0.457	S	S	.	.	H	α-helix	trans	-50.9	-61.3	170	-176	175.4	-129.7	0	0	110.3	A385 K386 V391 S392 E393	A385-E389 VanDerWaalsContact O-CB 3.3Å; A385-E389 WeakPolarHBondContact O-CB 3.46Å; A385-E389 PolarHBondContact O-N 3.21Å; K386-E389 IonicContact NZ-OE2 3.84Å; K386-E389 PolarHBondContact NZ-OE2 3.29Å; E389-V391 PolarHBondContact O-N 3.07Å; E389-S392 PolarHBondContact O-N 2.79Å; E389-S392 PolarHBondContact O-OG 3.26Å; E389-E393 PolarHBondContact O-N 3.47Å; E389-E393 VanDerWaalsContact O-N 3.1Å
390	A	93.6	Very high	91.1	Very high	49 Å²	49	89.9 Å²	89.9	41%	0.405	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-33.3	-178.8	0	0	0	0	0	114.9	K386 L387 S392 E393 A394	K386-A390 VanDerWaalsContact O-CB 3.32Å; K386-A390 WeakPolarHBondContact O-CB 3.26Å; K386-A390 PolarHBondContact O-N 2.87Å; L387-A390 PolarHBondContact O-N 3.27Å; A390-S392 VanDerWaalsContact C-N 3.34Å; A390-E393 PolarHBondContact O-N 2.97Å; A390-A394 WeakPolarHBondContact O-CB 3.39Å; A390-A394 PolarHBondContact O-N 3.05Å; A390-A394 VanDerWaalsContact O-N 3.07Å
391	V	93.9	Very high	91.3	Very high	71 Å²	71	94.7 Å²	94.7	43%	0.43	49%	0.486	S	S	.	.	H	α-helix	trans	-73.1	-27.1	175.4	169.3	0	0	0	0	111.6	L387 K388 E389	L387-V391 HydrophobicContact CD1-CG2 4.13Å; L387-V391 HydrophobicContact CG-CG2 4.39Å; L387-V391 VanDerWaalsContact O-CB 3.29Å; L387-V391 WeakPolarHBondContact O-CB 3.43Å; L387-V391 WeakPolarHBondContact O-CG2 3.33Å; L387-V391 PolarHBondContact O-N 2.99Å; K388-V391 PolarHBondContact O-N 2.84Å; E389-V391 PolarHBondContact O-N 3.07Å
392	S	92.7	Very high	91.3	Very high	98 Å²	98	98.7 Å²	98.7	69%	0.685	50%	0.5	S	S	*	.	H	α-helix	trans	-81.4	-14.5	171.5	60.9	0	0	0	0	114.5	K388 E389 A390	K388-S392 WeakPolarHBondContact O-CB 3.47Å; K388-S392 PolarHBondContact O-N 3.24Å; K388-S392 PolarHBondContact O-OG 2.89Å; K388-S392 VanDerWaalsContact O-OG 3.07Å; E389-S392 PolarHBondContact O-N 2.79Å; E389-S392 PolarHBondContact O-OG 3.26Å; A390-S392 VanDerWaalsContact C-N 3.34Å
393	E	93.5	Very high	91.5	Very high	151 Å²	151	94.4 Å²	94.4	71%	0.706	49%	0.49	S	S	*	.	H	α-helix	trans	-94.1	-24.1	174.6	-70	-179.9	150.6	0	0	113.2	E389 A390	E389-E393 PolarHBondContact O-N 3.47Å; E389-E393 VanDerWaalsContact O-N 3.1Å; A390-E393 PolarHBondContact O-N 2.97Å
394	A	92.5	Very high	91.6	Very high	34 Å²	34	88.1 Å²	88.1	28%	0.281	47%	0.473	S	S	.	.	S	Bend	trans	-75.3	149.2	179.8	0	0	0	0	0	112.7	A390 D398 L399	A390-A394 WeakPolarHBondContact O-CB 3.39Å; A390-A394 PolarHBondContact O-N 3.05Å; A390-A394 VanDerWaalsContact O-N 3.07Å; A394-D398 HydrophobicContact CB-CB 4.32Å; A394-L399 HydrophobicContact CB-CD2 3.92Å; A394-L399 HydrophobicContact CB-CG 4.1Å
395	T	93.9	Very high	91.5	Very high	77 Å²	77	87.5 Å²	87.5	47%	0.472	48%	0.477	S	S	.	.			trans	-84.4	161.3	171.5	72.8	0	0	0	0	111.9	D397 D398 L399	T395-D397 VanDerWaalsContact C-N 3.27Å; T395-D397 PolarHBondContact O-N 2.99Å; T395-D398 VanDerWaalsContact CB-OD2 3.31Å; T395-D398 WeakPolarHBondContact CB-OD2 3.49Å; T395-D398 WeakPolarHBondContact CG2-OD2 3.18Å; T395-D398 PolarHBondContact N-OD2 2.97Å; T395-D398 WeakPolarHBondContact O-CB 3.38Å; T395-D398 PolarHBondContact O-N 2.99Å; T395-D398 VanDerWaalsContact OG1-CG 3.23Å; T395-D398 PolarHBondContact OG1-N 3.15Å; T395-D398 PolarHBondContact OG1-OD2 3.16Å; T395-L399 WeakPolarHBondContact O-CG 3.07Å; T395-L399 PolarHBondContact O-N 3.23Å
396	D	91.7	Very high	91.5	Very high	129 Å²	129	92.9 Å²	92.9	69%	0.69	49%	0.485	S	S	*	.	H	α-helix	trans	-57.6	-38.5	176	-66.3	-23.7	0	0	0	112.5	L399 I400	D396-L399 PolarHBondContact O-N 3.09Å; D396-I400 WeakPolarHBondContact O-CB 3.48Å; D396-I400 WeakPolarHBondContact O-CD1 3.29Å; D396-I400 WeakPolarHBondContact O-CG1 3.48Å; D396-I400 PolarHBondContact O-N 2.92Å
397	D	89.8	Confident	91.4	Very high	93 Å²	93	91.8 Å²	91.8	50%	0.497	48%	0.483	S	S	.	.	H	α-helix	trans	-65.1	-40.2	175	-88.3	-53.7	0	0	0	110.6	T395 I400 E401 R564	T395-D397 VanDerWaalsContact C-N 3.27Å; T395-D397 PolarHBondContact O-N 2.99Å; D397-I400 PolarHBondContact O-N 3.06Å; D397-E401 WeakPolarHBondContact O-CB 3.43Å; D397-E401 PolarHBondContact O-N 3.19Å; D397-R564 IonicContact OD1-NH1 3.97Å; D397-R564 PolarHBondContact OD1-NH1 3.29Å; D397-R564 IonicContact OD2-NH1 2.64Å; D397-R564 PolarHBondContact OD2-NH1 3.26Å
398	D	90.9	Very high	91.2	Very high	64 Å²	64	91.2 Å²	91.2	34%	0.342	49%	0.487	S	S	.	.	H	α-helix	trans	-63.3	-41.9	174.6	-61.4	-59.9	0	0	0	112.1	A394 T395 I400 E401 F402	A394-D398 HydrophobicContact CB-CB 4.32Å; T395-D398 VanDerWaalsContact CB-OD2 3.31Å; T395-D398 WeakPolarHBondContact CB-OD2 3.49Å; T395-D398 WeakPolarHBondContact CG2-OD2 3.18Å; T395-D398 PolarHBondContact N-OD2 2.97Å; T395-D398 WeakPolarHBondContact O-CB 3.38Å; T395-D398 PolarHBondContact O-N 2.99Å; T395-D398 VanDerWaalsContact OG1-CG 3.23Å; T395-D398 PolarHBondContact OG1-N 3.15Å; T395-D398 PolarHBondContact OG1-OD2 3.16Å; D398-I400 VanDerWaalsContact C-N 3.32Å; D398-I400 PolarHBondContact O-N 2.89Å; D398-E401 PolarHBondContact O-N 3.01Å; D398-F402 HydrophobicContact CB-CD2 4.17Å; D398-F402 HydrophobicContact CB-CE2 4.47Å; D398-F402 WeakPolarHBondContact O-CB 3.46Å; D398-F402 VanDerWaalsContact O-CD2 3.31Å; D398-F402 WeakPolarHBondContact O-CD2 3.45Å; D398-F402 PolarHBondContact O-N 2.87Å
399	L	91.3	Very high	91	Very high	45 Å²	45	90.4 Å²	90.4	24%	0.236	48%	0.484	C	S	.	.	I	π-helix	trans	-65.2	-37.6	177.3	-66.6	176.5	0	0	0	111	A394 T395 D396 V403 A404	A394-L399 HydrophobicContact CB-CD2 3.92Å; A394-L399 HydrophobicContact CB-CG 4.1Å; T395-L399 WeakPolarHBondContact O-CG 3.07Å; T395-L399 PolarHBondContact O-N 3.23Å; D396-L399 PolarHBondContact O-N 3.09Å; L399-V403 HydrophobicContact CD2-CB 4.32Å; L399-V403 HydrophobicContact CD2-CG2 3.82Å; L399-V403 CarbonylContact O-C 3.53Å; L399-V403 WeakPolarHBondContact O-CA 3.42Å; L399-V403 WeakPolarHBondContact O-CB 3.47Å; L399-V403 PolarHBondContact O-N 2.88Å; L399-V403 VanDerWaalsContact O-N 3.13Å; L399-A404 PolarHBondContact O-N 3.11Å
400	I	88.4	Confident	90.9	Very high	97 Å²	97	91.6 Å²	91.6	50%	0.497	49%	0.492	S	S	.	.	I	π-helix	trans	-72.5	-34.6	176.5	-70.1	165	0	0	0	112.2	D396 D397 D398	D396-I400 WeakPolarHBondContact O-CB 3.48Å; D396-I400 WeakPolarHBondContact O-CD1 3.29Å; D396-I400 WeakPolarHBondContact O-CG1 3.48Å; D396-I400 PolarHBondContact O-N 2.92Å; D397-I400 PolarHBondContact O-N 3.06Å; D398-I400 VanDerWaalsContact C-N 3.32Å; D398-I400 PolarHBondContact O-N 2.89Å
401	E	86.5	Confident	90.8	Very high	120 Å²	120	91.8 Å²	91.8	56%	0.561	49%	0.486	S	S	*	.	I	π-helix	trans	-80.1	-48.8	180	-171.4	161.8	157.3	0	0	112.6	D397 D398 P405	D397-E401 WeakPolarHBondContact O-CB 3.43Å; D397-E401 PolarHBondContact O-N 3.19Å; D398-E401 PolarHBondContact O-N 3.01Å; E401-P405 WeakPolarHBondContact O-CD 3.34Å; E401-P405 WeakPolarHBondContact O-CG 3.17Å
402	F	88.1	Confident	90.8	Very high	137 Å²	137	90.6 Å²	90.6	60%	0.601	48%	0.481	S	S	*	.	I	π-helix	trans	-100.2	-33.5	-170.4	-55.8	-64.7	0	0	0	114.5	D398	D398-F402 HydrophobicContact CB-CD2 4.17Å; D398-F402 HydrophobicContact CB-CE2 4.47Å; D398-F402 WeakPolarHBondContact O-CB 3.46Å; D398-F402 VanDerWaalsContact O-CD2 3.31Å; D398-F402 WeakPolarHBondContact O-CD2 3.45Å; D398-F402 PolarHBondContact O-N 2.87Å
403	V	91.5	Very high	90.7	Very high	59 Å²	59	91.6 Å²	91.6	36%	0.358	49%	0.485	S	S	.	.	I	π-helix	trans	-96.5	-44.7	-172.1	-175.4	0	0	0	0	111.8	L399 R406 L407	L399-V403 HydrophobicContact CD2-CB 4.32Å; L399-V403 HydrophobicContact CD2-CG2 3.82Å; L399-V403 CarbonylContact O-C 3.53Å; L399-V403 WeakPolarHBondContact O-CA 3.42Å; L399-V403 WeakPolarHBondContact O-CB 3.47Å; L399-V403 PolarHBondContact O-N 2.88Å; L399-V403 VanDerWaalsContact O-N 3.13Å; V403-R406 PolarHBondContact O-N 2.78Å; V403-L407 HydrophobicContact CG1-CD1 3.81Å; V403-L407 HydrophobicContact CG1-CG 3.96Å; V403-L407 PolarHBondContact O-N 3.15Å
404	A	88.2	Confident	90.7	Very high	31 Å²	31	91.8 Å²	91.8	26%	0.256	48%	0.479	S	S	.	.	H	α-helix	trans	-56.8	-41.8	-177.5	0	0	0	0	0	114.4	L399 R406 L407 C408	L399-A404 PolarHBondContact O-N 3.11Å; A404-R406 PolarHBondContact O-N 2.85Å; A404-R406 VanDerWaalsContact O-N 3.13Å; A404-L407 PolarHBondContact O-N 2.73Å; A404-L407 VanDerWaalsContact O-N 3.12Å; A404-C408 PolarHBondContact O-N 3.34Å; A404-C408 PolarHBondContact O-SG 3.47Å
405	P	89.1	Confident	90.7	Very high	49 Å²	49	93.6 Å²	93.6	32%	0.318	48%	0.484	S	S	.	.	H	α-helix	trans	-60.7	-25.2	177	-24.2	35.5	0	0	0	114	E401	E401-P405 WeakPolarHBondContact O-CD 3.34Å; E401-P405 WeakPolarHBondContact O-CG 3.17Å
406	R	90.8	Very high	90.7	Very high	174 Å²	174	94.7 Å²	94.7	66%	0.657	48%	0.484	S	S	*	.	H	α-helix	trans	-86.9	-34.5	175.2	-170.9	169.2	-179.4	-87.4	-7.9	112.3	V403 A404 K409 L410	V403-R406 PolarHBondContact O-N 2.78Å; A404-R406 PolarHBondContact O-N 2.85Å; A404-R406 VanDerWaalsContact O-N 3.13Å; R406-K409 PolarHBondContact O-N 2.81Å; R406-L410 HydrophobicContact CG-CD1 4.34Å; R406-L410 WeakPolarHBondContact O-CD1 3.34Å; R406-L410 WeakPolarHBondContact O-CG 3.5Å
407	L	91.3	Very high	90.7	Very high	77 Å²	77	89.3 Å²	89.3	40%	0.403	46%	0.455	S	S	.	.	H	α-helix	trans	-68.6	-38.6	174.4	-66.8	-179.9	0	0	0	112.4	V403 A404 K409 L410 I411	V403-L407 HydrophobicContact CG1-CD1 3.81Å; V403-L407 HydrophobicContact CG1-CG 3.96Å; V403-L407 PolarHBondContact O-N 3.15Å; A404-L407 PolarHBondContact O-N 2.73Å; A404-L407 VanDerWaalsContact O-N 3.12Å; L407-K409 PolarHBondContact O-N 3.48Å; L407-K409 VanDerWaalsContact O-N 3.1Å; L407-L410 PolarHBondContact O-N 2.94Å; L407-I411 HydrophobicContact CB-CD1 4.13Å; L407-I411 HydrophobicContact CD2-CD1 4.31Å; L407-I411 PolarHBondContact O-N 3.34Å
408	C	88.8	Confident	90.9	Very high	100 Å²	100	87 Å²	87	68%	0.676	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-8.8	176.9	-64.5	0	0	0	0	114.6	A404	A404-C408 PolarHBondContact O-N 3.34Å; A404-C408 PolarHBondContact O-SG 3.47Å
409	K	90.2	Very high	91	Very high	150 Å²	150	87.9 Å²	87.9	65%	0.652	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-14.7	168	-84.9	-162.5	164.6	-159.5	0	113.7	R406 L407 D605	R406-K409 PolarHBondContact O-N 2.81Å; L407-K409 PolarHBondContact O-N 3.48Å; L407-K409 VanDerWaalsContact O-N 3.1Å; K409-D605 IonicContact NZ-OD2 3.56Å; K409-D605 PolarHBondContact NZ-OD2 3.14Å
410	L	91.8	Very high	90.9	Very high	118 Å²	118	92 Å²	92	62%	0.618	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-14.5	-168.2	-64.1	173.1	0	0	0	113.8	R406 L407	R406-L410 HydrophobicContact CG-CD1 4.34Å; R406-L410 WeakPolarHBondContact O-CD1 3.34Å; R406-L410 WeakPolarHBondContact O-CG 3.5Å; L407-L410 PolarHBondContact O-N 2.94Å
411	I	92.1	Very high	91.1	Very high	54 Å²	54	87.4 Å²	87.4	28%	0.277	44%	0.436	S	S	.	.	S	Bend	trans	-120	129.6	-177	-57.9	179.3	0	0	0	107.1	L407 D415 H416 L419	L407-I411 HydrophobicContact CB-CD1 4.13Å; L407-I411 HydrophobicContact CD2-CD1 4.31Å; L407-I411 PolarHBondContact O-N 3.34Å; I411-D415 HydrophobicContact CG2-CB 3.73Å; I411-H416 HydrophobicContact CG2-CB 4.16Å; I411-L419 HydrophobicContact CD1-CD1 4.22Å; I411-L419 HydrophobicContact CG2-CD1 3.94Å
412	S	92.7	Very high	91.3	Very high	45 Å²	45	85.9 Å²	85.9	32%	0.315	43%	0.429	S	S	.	.			trans	-70.2	160.1	179	82.6	0	0	0	0	111.5	W414 D415 H416	S412-W414 PolarHBondContact O-N 2.55Å; S412-W414 PolarHBondContact OG-N 2.8Å; S412-D415 WeakPolarHBondContact CB-OD2 3.38Å; S412-D415 PolarHBondContact N-OD2 3.1Å; S412-D415 PolarHBondContact O-N 3.26Å; S412-D415 PolarHBondContact OG-N 3.22Å; S412-D415 VanDerWaalsContact OG-N 3.11Å; S412-D415 PolarHBondContact OG-OD2 3.01Å; S412-H416 WeakPolarHBondContact O-CB 3.37Å; S412-H416 PolarHBondContact O-N 3.28Å
413	P	91.1	Very high	91.1	Very high	119 Å²	119	85.7 Å²	85.7	77%	0.773	43%	0.43	S	S	*	.	H	α-helix	trans	-58.3	-28.2	174.3	-25	35.3	0	0	0	113.4	L417	P413-L417 PolarHBondContact O-N 3.45Å
414	W	93.5	Very high	90.7	Very high	155 Å²	155	84.7 Å²	84.7	59%	0.587	43%	0.431	S	S	*	.	H	α-helix	trans	-73.7	-49.4	176	176.2	-106	0	0	0	111.6	S412 H416 L417 L418	S412-W414 PolarHBondContact O-N 2.55Å; S412-W414 PolarHBondContact OG-N 2.8Å; W414-H416 VanDerWaalsContact C-N 3.27Å; W414-H416 PolarHBondContact O-N 3.37Å; W414-L417 HydrophobicContact CE3-CD2 4.45Å; W414-L417 HydrophobicContact CZ3-CD2 4.43Å; W414-L417 WeakPolarHBondContact O-CA 3.29Å; W414-L417 WeakPolarHBondContact O-CB 3.35Å; W414-L417 PolarHBondContact O-N 3.12Å; W414-L418 HydrophobicContact CZ2-CD1 4.4Å; W414-L418 HydrophobicContact CZ2-CD2 4.18Å; W414-L418 HydrophobicContact CZ2-CG 4.49Å; W414-L418 PolarHBondContact O-N 3.37Å
415	D	94	Very high	90.2	Very high	72 Å²	72	91.1 Å²	91.1	39%	0.385	46%	0.461	S	S	.	.	H	α-helix	trans	-63.5	-36.9	178.7	-49.3	-44.3	0	0	0	111	I411 S412 L417 L418 L419	I411-D415 HydrophobicContact CG2-CB 3.73Å; S412-D415 WeakPolarHBondContact CB-OD2 3.38Å; S412-D415 PolarHBondContact N-OD2 3.1Å; S412-D415 PolarHBondContact O-N 3.26Å; S412-D415 PolarHBondContact OG-N 3.22Å; S412-D415 VanDerWaalsContact OG-N 3.11Å; S412-D415 PolarHBondContact OG-OD2 3.01Å; D415-L417 VanDerWaalsContact C-N 3.31Å; D415-L417 PolarHBondContact O-N 2.98Å; D415-L418 PolarHBondContact O-N 3.18Å; D415-L419 WeakPolarHBondContact O-CB 3.3Å; D415-L419 WeakPolarHBondContact O-CD1 3.45Å; D415-L419 VanDerWaalsContact O-CG 3.23Å; D415-L419 WeakPolarHBondContact O-CG 3.34Å; D415-L419 PolarHBondContact O-N 3.08Å
416	H	92.1	Very high	89.8	Confident	100 Å²	100	93.3 Å²	93.3	46%	0.463	48%	0.475	S	S	.	.	H	α-helix	trans	-61.2	-39.6	173.2	-178.7	62.2	0	0	0	112.2	I411 S412 W414 R420	I411-H416 HydrophobicContact CG2-CB 4.16Å; S412-H416 WeakPolarHBondContact O-CB 3.37Å; S412-H416 PolarHBondContact O-N 3.28Å; W414-H416 VanDerWaalsContact C-N 3.27Å; W414-H416 PolarHBondContact O-N 3.37Å; H416-R420 WeakPolarHBondContact O-CB 3.38Å; H416-R420 PolarHBondContact O-N 3.47Å
417	L	92.8	Very high	89.6	Confident	16 Å²	16	88.2 Å²	88.2	8%	0.084	47%	0.465	C	S	.	.	H	α-helix	trans	-66.9	-39.6	175.7	-179.1	66.8	0	0	0	111.7	P413 W414 D415 S421 V434 D437	P413-L417 PolarHBondContact O-N 3.45Å; W414-L417 HydrophobicContact CE3-CD2 4.45Å; W414-L417 HydrophobicContact CZ3-CD2 4.43Å; W414-L417 WeakPolarHBondContact O-CA 3.29Å; W414-L417 WeakPolarHBondContact O-CB 3.35Å; W414-L417 PolarHBondContact O-N 3.12Å; D415-L417 VanDerWaalsContact C-N 3.31Å; D415-L417 PolarHBondContact O-N 2.98Å; L417-S421 WeakPolarHBondContact O-CB 3.22Å; L417-S421 PolarHBondContact O-N 2.76Å; L417-V434 HydrophobicContact CD2-CG1 3.86Å; L417-V434 HydrophobicContact CG-CG1 4.1Å; L417-D437 HydrophobicContact CD1-CB 3.7Å
418	L	93.7	Very high	89.5	Confident	46 Å²	46	89.8 Å²	89.8	24%	0.241	47%	0.473	C	S	.	.	H	α-helix	trans	-65.7	-53.9	175.4	-66.3	-177	0	0	0	111.7	W414 D415 R420 S421 E422 P429 V434	W414-L418 HydrophobicContact CZ2-CD1 4.4Å; W414-L418 HydrophobicContact CZ2-CD2 4.18Å; W414-L418 HydrophobicContact CZ2-CG 4.49Å; W414-L418 PolarHBondContact O-N 3.37Å; D415-L418 PolarHBondContact O-N 3.18Å; L418-R420 PolarHBondContact O-N 3.06Å; L418-S421 CarbonylContact O-C 3.47Å; L418-S421 WeakPolarHBondContact O-CA 3.49Å; L418-S421 WeakPolarHBondContact O-CB 3.42Å; L418-S421 PolarHBondContact O-N 2.92Å; L418-S421 PolarHBondContact O-OG 3.35Å; L418-E422 PolarHBondContact O-N 2.84Å; L418-P429 HydrophobicContact CB-CB 4.37Å; L418-P429 HydrophobicContact CD2-CB 3.99Å; L418-P429 HydrophobicContact CD2-CG 4.32Å; L418-V434 HydrophobicContact CD2-CG2 4.14Å
419	L	92.3	Very high	89.6	Confident	81 Å²	81	87.5 Å²	87.5	42%	0.424	46%	0.457	S	S	.	.	H	α-helix	trans	-53.7	-41.2	176.6	-72.7	163.9	0	0	0	112	I411 D415 S421 E422	I411-L419 HydrophobicContact CD1-CD1 4.22Å; I411-L419 HydrophobicContact CG2-CD1 3.94Å; D415-L419 WeakPolarHBondContact O-CB 3.3Å; D415-L419 WeakPolarHBondContact O-CD1 3.45Å; D415-L419 VanDerWaalsContact O-CG 3.23Å; D415-L419 WeakPolarHBondContact O-CG 3.34Å; D415-L419 PolarHBondContact O-N 3.08Å; L419-S421 PolarHBondContact O-N 2.74Å; L419-E422 PolarHBondContact O-N 2.95Å
420	R	90.1	Very high	89.6	Confident	131 Å²	131	84.4 Å²	84.4	49%	0.494	44%	0.444	S	S	.	.	H	α-helix	trans	-67.2	-20	176.7	178.5	177.1	172.3	109.6	4.3	113.8	H416 L418 D437	H416-R420 WeakPolarHBondContact O-CB 3.38Å; H416-R420 PolarHBondContact O-N 3.47Å; L418-R420 PolarHBondContact O-N 3.06Å; R420-D437 IonicContact CZ-OD1 2.85Å; R420-D437 IonicContact NE-OD1 2.73Å; R420-D437 PolarHBondContact NE-OD1 3.4Å; R420-D437 IonicContact NE-OD2 3.25Å; R420-D437 IonicContact NH2-OD1 2.66Å; R420-D437 PolarHBondContact NH2-OD1 3.03Å
421	S	92	Very high	89.6	Confident	2 Å²	2	83.9 Å²	83.9	1%	0.014	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-1.9	178.9	77.8	0	0	0	0	114.2	L417 L418 L419 H423 P429 Q430 V434	L417-S421 WeakPolarHBondContact O-CB 3.22Å; L417-S421 PolarHBondContact O-N 2.76Å; L418-S421 CarbonylContact O-C 3.47Å; L418-S421 WeakPolarHBondContact O-CA 3.49Å; L418-S421 WeakPolarHBondContact O-CB 3.42Å; L418-S421 PolarHBondContact O-N 2.92Å; L418-S421 PolarHBondContact O-OG 3.35Å; L419-S421 PolarHBondContact O-N 2.74Å; S421-H423 PolarHBondContact O-N 3Å; S421-P429 WeakPolarHBondContact OG-CA 3.33Å; S421-P429 WeakPolarHBondContact OG-CB 3.4Å; S421-Q430 PolarHBondContact O-N 3.3Å; S421-V434 WeakPolarHBondContact OG-CG2 3.27Å
422	E	90.8	Very high	89.7	Confident	87 Å²	87	85.8 Å²	85.8	41%	0.407	46%	0.462	S	S	.	.	B	Isolated β-bridge	trans	-62.7	124.8	179.1	-75.4	-177.1	179.5	0	0	111.5	L418 L419 P427 L428	L418-E422 PolarHBondContact O-N 2.84Å; L419-E422 PolarHBondContact O-N 2.95Å; E422-P427 HydrophobicContact CB-CB 4.25Å; E422-P427 HydrophobicContact CG-CB 4.44Å; E422-L428 WeakPolarHBondContact CA-O 3.49Å
423	H	85.1	Confident	89.6	Confident	134 Å²	134	89.2 Å²	89.2	62%	0.62	47%	0.468	S	S	*	.			trans	-157.5	107.8	175.7	-176.9	-54.2	0	0	0	111.8	S421 L428 Q430	S421-H423 PolarHBondContact O-N 3Å; H423-L428 PolarHBondContact N-O 3.09Å; H423-Q430 HydrophobicContact CB-CG 4.13Å; H423-Q430 PolarHBondContact ND1-NE2 3.05Å; H423-Q430 PolarHBondContact O-NE2 3.37Å
424	G	81.5	Confident	89.7	Confident	37 Å²	37	84.4 Å²	84.4	38%	0.381	44%	0.437	S	S	.	.	S	Bend	trans	154	-178.3	177.9	0	0	0	0	0	111.7	P426	G424-P426 CarbonylContact C-O 3.58Å; G424-P426 CarbonylContact O-C 3.57Å
425	N	79.4	Confident	89.8	Confident	167 Å²	167	80.5 Å²	80.5	89%	0.893	43%	0.43	S	S	*	.	S	Bend	trans	-129.8	110.6	164.7	-71.6	-49.9	0	0	0	107.2
426	P	80.8	Confident	89.8	Confident	94 Å²	94	82.6 Å²	82.6	61%	0.61	44%	0.44	S	S	*	.	S	Bend	cis	-61	156	-3.7	28.7	-36.5	0	0	0	112.8	G424 L428	G424-P426 CarbonylContact C-O 3.58Å; G424-P426 CarbonylContact O-C 3.57Å; P426-L428 HydrophobicContact CG-CD1 4.3Å; P426-L428 HydrophobicContact CG-CG 4.37Å; P426-L428 PolarHBondContact O-N 2.87Å
427	P	85.9	Confident	89.9	Confident	68 Å²	68	78.3 Å²	78.3	44%	0.442	42%	0.42	S	S	.	.			trans	-65	121.2	172.3	27.9	-33.4	0	0	0	109.1	E422	E422-P427 HydrophobicContact CB-CB 4.25Å; E422-P427 HydrophobicContact CG-CB 4.44Å
428	L	89.4	Confident	90	Very high	109 Å²	109	83.5 Å²	83.5	57%	0.571	44%	0.44	S	S	*	.			trans	-135.1	142.8	177.4	-70.1	173.5	0	0	0	109.2	E422 H423 P426 Q430	E422-L428 WeakPolarHBondContact CA-O 3.49Å; H423-L428 PolarHBondContact N-O 3.09Å; P426-L428 HydrophobicContact CG-CD1 4.3Å; P426-L428 HydrophobicContact CG-CG 4.37Å; P426-L428 PolarHBondContact O-N 2.87Å; L428-Q430 PolarHBondContact O-N 3.13Å
429	P	90.2	Very high	90	Very high	52 Å²	52	86 Å²	86	34%	0.338	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-68.3	117.8	-179.6	27.3	-34.3	0	0	0	110.6	L418 S421 V431 V434	L418-P429 HydrophobicContact CB-CB 4.37Å; L418-P429 HydrophobicContact CD2-CB 3.99Å; L418-P429 HydrophobicContact CD2-CG 4.32Å; S421-P429 WeakPolarHBondContact OG-CA 3.33Å; S421-P429 WeakPolarHBondContact OG-CB 3.4Å; P429-V431 PolarHBondContact O-N 3.25Å; P429-V434 HydrophobicContact CB-CG2 4.4Å
430	Q	90.3	Very high	90	Very high	85 Å²	85	83.8 Å²	83.8	40%	0.397	44%	0.444	S	S	.	.			trans	-78.7	109	178	-67.6	-167.9	3.5	0	0	110.1	S421 H423 L428 P432 R433 V434	S421-Q430 PolarHBondContact O-N 3.3Å; H423-Q430 HydrophobicContact CB-CG 4.13Å; H423-Q430 PolarHBondContact ND1-NE2 3.05Å; H423-Q430 PolarHBondContact O-NE2 3.37Å; L428-Q430 PolarHBondContact O-N 3.13Å; Q430-P432 VanDerWaalsContact C-CD 3.44Å; Q430-P432 VanDerWaalsContact C-N 3.34Å; Q430-R433 HydrophobicContact CB-CB 4Å; Q430-R433 CarbonylContact O-C 2.98Å; Q430-R433 VanDerWaalsContact O-CA 3.31Å; Q430-R433 WeakPolarHBondContact O-CA 3.34Å; Q430-R433 VanDerWaalsContact O-CB 3.25Å; Q430-R433 WeakPolarHBondContact O-CB 3.48Å; Q430-R433 PolarHBondContact O-N 2.94Å; Q430-V434 PolarHBondContact O-N 3.2Å
431	V	92.4	Very high	90.2	Very high	107 Å²	107	82.6 Å²	82.6	65%	0.648	45%	0.447	S	S	*	.	H	α-helix	trans	-49.9	-42.1	-178.2	-177.9	0	0	0	0	114.2	P429 R433 V434 V435	P429-V431 PolarHBondContact O-N 3.25Å; V431-R433 PolarHBondContact O-N 2.8Å; V431-V434 WeakPolarHBondContact O-CB 3.39Å; V431-V434 PolarHBondContact O-N 3.43Å; V431-V435 WeakPolarHBondContact O-CG2 3.02Å; V431-V435 PolarHBondContact O-N 2.92Å
432	P	93.3	Very high	90.2	Very high	95 Å²	95	83.8 Å²	83.8	62%	0.617	45%	0.454	S	S	*	.	H	α-helix	trans	-60.7	-32.7	174.2	-23.5	35.1	0	0	0	113.2	Q430 L436	Q430-P432 VanDerWaalsContact C-CD 3.44Å; Q430-P432 VanDerWaalsContact C-N 3.34Å; P432-L436 WeakPolarHBondContact O-CG 3.36Å; P432-L436 PolarHBondContact O-N 3.34Å; P432-L436 VanDerWaalsContact O-N 3.17Å
433	R	91.4	Very high	90.3	Very high	117 Å²	117	86 Å²	86	44%	0.442	47%	0.465	S	S	.	.	H	α-helix	trans	-75.9	-40.2	177.1	-173.9	66.6	-160	-120.7	-8.4	111.9	Q430 V431 V435 L436 D437	Q430-R433 HydrophobicContact CB-CB 4Å; Q430-R433 CarbonylContact O-C 2.98Å; Q430-R433 VanDerWaalsContact O-CA 3.31Å; Q430-R433 WeakPolarHBondContact O-CA 3.34Å; Q430-R433 VanDerWaalsContact O-CB 3.25Å; Q430-R433 WeakPolarHBondContact O-CB 3.48Å; Q430-R433 PolarHBondContact O-N 2.94Å; V431-R433 PolarHBondContact O-N 2.8Å; R433-V435 VanDerWaalsContact C-N 3.29Å; R433-V435 PolarHBondContact O-N 3.43Å; R433-L436 PolarHBondContact O-N 3.25Å; R433-D437 IonicContact CZ-OD2 2.93Å; R433-D437 VanDerWaalsContact CZ-OD2 3.27Å; R433-D437 IonicContact NE-OD2 3.15Å; R433-D437 PolarHBondContact NE-OD2 3.34Å; R433-D437 IonicContact NH2-OD1 3.9Å; R433-D437 IonicContact NH2-OD2 4Å; R433-D437 PolarHBondContact NH2-OD2 2.93Å; R433-D437 PolarHBondContact O-N 3.46Å
434	V	93.9	Very high	90.5	Very high	18 Å²	18	86.3 Å²	86.3	11%	0.109	46%	0.46	C	S	.	.	H	α-helix	trans	-52.5	-48.8	170.3	176.7	0	0	0	0	110.4	L417 L418 S421 P429 Q430 V431 Y438	L417-V434 HydrophobicContact CD2-CG1 3.86Å; L417-V434 HydrophobicContact CG-CG1 4.1Å; L418-V434 HydrophobicContact CD2-CG2 4.14Å; S421-V434 WeakPolarHBondContact OG-CG2 3.27Å; P429-V434 HydrophobicContact CB-CG2 4.4Å; Q430-V434 PolarHBondContact O-N 3.2Å; V431-V434 WeakPolarHBondContact O-CB 3.39Å; V431-V434 PolarHBondContact O-N 3.43Å; V434-Y438 WeakPolarHBondContact O-CB 3.16Å; V434-Y438 PolarHBondContact O-N 3.34Å
435	V	94.7	Very high	91	Very high	73 Å²	73	86.4 Å²	86.4	44%	0.442	46%	0.457	S	S	.	.	H	α-helix	trans	-63.3	-43.8	179.2	173.7	0	0	0	0	111.8	V431 R433 Y438 L439	V431-V435 WeakPolarHBondContact O-CG2 3.02Å; V431-V435 PolarHBondContact O-N 2.92Å; R433-V435 VanDerWaalsContact C-N 3.29Å; R433-V435 PolarHBondContact O-N 3.43Å; V435-Y438 PolarHBondContact O-N 2.89Å; V435-L439 HydrophobicContact CG1-CD1 3.9Å; V435-L439 HydrophobicContact CG1-CG 4.41Å; V435-L439 WeakPolarHBondContact O-CB 3.29Å; V435-L439 VanDerWaalsContact O-CG 3.28Å; V435-L439 WeakPolarHBondContact O-CG 3.29Å; V435-L439 PolarHBondContact O-N 2.93Å
436	L	94.4	Very high	91.6	Very high	116 Å²	116	83.3 Å²	83.3	61%	0.607	43%	0.433	S	S	*	.	H	α-helix	trans	-66	-45.7	178.9	-73.1	169.8	0	0	0	112.9	P432 R433 L439 S440	P432-L436 WeakPolarHBondContact O-CG 3.36Å; P432-L436 PolarHBondContact O-N 3.34Å; P432-L436 VanDerWaalsContact O-N 3.17Å; R433-L436 PolarHBondContact O-N 3.25Å; L436-L439 PolarHBondContact O-N 3Å; L436-S440 WeakPolarHBondContact O-CB 3.45Å; L436-S440 PolarHBondContact O-N 3.35Å
437	D	93.1	Very high	92.1	Very high	9 Å²	9	81.4 Å²	81.4	5%	0.048	42%	0.422	C	S	.	.	H	α-helix	trans	-65.9	-39.8	177	-87.7	-62.3	0	0	0	111.2	L417 R420 R433 S440 L441	L417-D437 HydrophobicContact CD1-CB 3.7Å; R420-D437 IonicContact CZ-OD1 2.85Å; R420-D437 IonicContact NE-OD1 2.73Å; R420-D437 PolarHBondContact NE-OD1 3.4Å; R420-D437 IonicContact NE-OD2 3.25Å; R420-D437 IonicContact NH2-OD1 2.66Å; R420-D437 PolarHBondContact NH2-OD1 3.03Å; R433-D437 IonicContact CZ-OD2 2.93Å; R433-D437 VanDerWaalsContact CZ-OD2 3.27Å; R433-D437 IonicContact NE-OD2 3.15Å; R433-D437 PolarHBondContact NE-OD2 3.34Å; R433-D437 IonicContact NH2-OD1 3.9Å; R433-D437 IonicContact NH2-OD2 4Å; R433-D437 PolarHBondContact NH2-OD2 2.93Å; R433-D437 PolarHBondContact O-N 3.46Å; D437-S440 PolarHBondContact O-N 3.04Å; D437-S440 PolarHBondContact O-OG 2.86Å; D437-L441 WeakPolarHBondContact O-CB 3.42Å; D437-L441 PolarHBondContact O-N 3.07Å
438	Y	94.6	Very high	92.3	Very high	126 Å²	126	80.6 Å²	80.6	49%	0.494	41%	0.412	S	S	.	.	H	α-helix	trans	-59.4	-50.1	173.4	173.5	-104.4	0	0	0	112.6	V434 V435 S440 L441 V442	V434-Y438 WeakPolarHBondContact O-CB 3.16Å; V434-Y438 PolarHBondContact O-N 3.34Å; V435-Y438 PolarHBondContact O-N 2.89Å; Y438-S440 VanDerWaalsContact C-N 3.31Å; Y438-S440 PolarHBondContact O-N 2.89Å; Y438-L441 WeakPolarHBondContact O-CB 3.49Å; Y438-L441 PolarHBondContact O-N 3.32Å; Y438-L441 VanDerWaalsContact O-N 3.08Å; Y438-V442 HydrophobicContact CD1-CG2 4.37Å; Y438-V442 HydrophobicContact CD2-CG2 4.2Å; Y438-V442 HydrophobicContact CE1-CG2 3.91Å; Y438-V442 HydrophobicContact CE2-CG2 3.72Å; Y438-V442 WeakPolarHBondContact O-CG2 3.47Å; Y438-V442 PolarHBondContact O-N 2.99Å
439	L	94.5	Very high	92.4	Very high	97 Å²	97	77.6 Å²	77.6	51%	0.508	40%	0.396	S	S	.	.	H	α-helix	trans	-61.6	-40.5	178.4	-71	172.1	0	0	0	111.4	V435 L436 L441 V442 E443	V435-L439 HydrophobicContact CG1-CD1 3.9Å; V435-L439 HydrophobicContact CG1-CG 4.41Å; V435-L439 WeakPolarHBondContact O-CB 3.29Å; V435-L439 VanDerWaalsContact O-CG 3.28Å; V435-L439 WeakPolarHBondContact O-CG 3.29Å; V435-L439 PolarHBondContact O-N 2.93Å; L436-L439 PolarHBondContact O-N 3Å; L439-L441 VanDerWaalsContact C-N 3.26Å; L439-L441 PolarHBondContact O-N 3.23Å; L439-V442 PolarHBondContact O-N 3.16Å; L439-E443 WeakPolarHBondContact O-CB 3.25Å; L439-E443 PolarHBondContact O-N 3.1Å
440	S	92.6	Very high	92.2	Very high	35 Å²	35	77.8 Å²	77.8	25%	0.245	40%	0.398	C	S	.	.	H	α-helix	trans	-67.7	-24.2	175.9	86	0	0	0	0	113.9	L436 D437 Y438 R444	L436-S440 WeakPolarHBondContact O-CB 3.45Å; L436-S440 PolarHBondContact O-N 3.35Å; D437-S440 PolarHBondContact O-N 3.04Å; D437-S440 PolarHBondContact O-OG 2.86Å; Y438-S440 VanDerWaalsContact C-N 3.31Å; Y438-S440 PolarHBondContact O-N 2.89Å; S440-R444 WeakPolarHBondContact O-CB 3.5Å; S440-R444 PolarHBondContact O-N 3.41Å; S440-R444 PolarHBondContact O-NH1 2.95Å
441	L	92.9	Very high	92.2	Very high	107 Å²	107	75.7 Å²	75.7	56%	0.56	39%	0.389	S	S	*	.	H	α-helix	trans	-77.7	-46.9	173.4	177.5	62.4	0	0	0	110.4	D437 Y438 L439 R444 A445	D437-L441 WeakPolarHBondContact O-CB 3.42Å; D437-L441 PolarHBondContact O-N 3.07Å; Y438-L441 WeakPolarHBondContact O-CB 3.49Å; Y438-L441 PolarHBondContact O-N 3.32Å; Y438-L441 VanDerWaalsContact O-N 3.08Å; L439-L441 VanDerWaalsContact C-N 3.26Å; L439-L441 PolarHBondContact O-N 3.23Å; L441-R444 PolarHBondContact O-N 3.27Å; L441-A445 WeakPolarHBondContact O-CB 3.37Å; L441-A445 PolarHBondContact O-N 2.89Å
442	V	92.5	Very high	91.9	Very high	27 Å²	27	70.8 Å²	70.8	16%	0.164	36%	0.359	C	S	.	.	H	α-helix	trans	-61.5	-45.3	177.4	171.8	0	0	0	0	111.3	Y438 L439 A445 R446	Y438-V442 HydrophobicContact CD1-CG2 4.37Å; Y438-V442 HydrophobicContact CD2-CG2 4.2Å; Y438-V442 HydrophobicContact CE1-CG2 3.91Å; Y438-V442 HydrophobicContact CE2-CG2 3.72Å; Y438-V442 WeakPolarHBondContact O-CG2 3.47Å; Y438-V442 PolarHBondContact O-N 2.99Å; L439-V442 PolarHBondContact O-N 3.16Å; V442-A445 PolarHBondContact O-N 3.35Å; V442-R446 HydrophobicContact CG1-CG 4.34Å; V442-R446 WeakPolarHBondContact O-CB 3.49Å; V442-R446 VanDerWaalsContact O-CG 3.27Å; V442-R446 WeakPolarHBondContact O-CG 3.19Å; V442-R446 PolarHBondContact O-N 2.78Å
443	E	92.4	Very high	91.8	Very high	133 Å²	133	67 Å²	67	62%	0.621	33%	0.334	S	S	*	.	H	α-helix	trans	-56	-54.3	175.6	-177.9	-179.5	-151.1	0	0	111.1	L439 A445 R446 S447	L439-E443 WeakPolarHBondContact O-CB 3.25Å; L439-E443 PolarHBondContact O-N 3.1Å; E443-A445 VanDerWaalsContact C-N 3.34Å; E443-A445 PolarHBondContact O-N 2.92Å; E443-R446 PolarHBondContact O-N 2.9Å; E443-S447 PolarHBondContact O-N 2.78Å; E443-S447 PolarHBondContact O-OG 2.81Å; E443-S447 VanDerWaalsContact O-OG 3.1Å
444	R	90	Very high	91.6	Very high	141 Å²	141	66 Å²	66	53%	0.532	33%	0.334	S	S	.	.	H	α-helix	trans	-65.5	-34.9	-179.3	-172.2	175.4	-66.5	95.3	4.9	113.1	S440 L441 F448 Y561	S440-R444 WeakPolarHBondContact O-CB 3.5Å; S440-R444 PolarHBondContact O-N 3.41Å; S440-R444 PolarHBondContact O-NH1 2.95Å; L441-R444 PolarHBondContact O-N 3.27Å; R444-F448 WeakPolarHBondContact O-CB 3.41Å; R444-F448 PolarHBondContact O-N 3.4Å; R444-Y561 HydrophobicContact CG-CD1 4.46Å
445	A	91.4	Very high	91.2	Very high	38 Å²	38	69.2 Å²	69.2	31%	0.314	36%	0.355	S	S	.	.	H	α-helix	trans	-67.7	-46.2	176.2	0	0	0	0	0	111.3	L441 V442 E443 F448 L449	L441-A445 WeakPolarHBondContact O-CB 3.37Å; L441-A445 PolarHBondContact O-N 2.89Å; V442-A445 PolarHBondContact O-N 3.35Å; E443-A445 VanDerWaalsContact C-N 3.34Å; E443-A445 PolarHBondContact O-N 2.92Å; A445-F448 PolarHBondContact O-N 3.3Å; A445-L449 WeakPolarHBondContact O-CB 3.47Å; A445-L449 VanDerWaalsContact O-CG 3.25Å; A445-L449 WeakPolarHBondContact O-CG 3.49Å; A445-L449 PolarHBondContact O-N 3.12Å
446	R	92.6	Very high	90.5	Very high	103 Å²	103	68.1 Å²	68.1	39%	0.389	34%	0.343	S	S	.	.	H	α-helix	trans	-58.5	-49.1	173.9	-72.7	176.1	172.6	168.7	-4.5	111.2	V442 E443 F448 L449 C450 A542 A543	V442-R446 HydrophobicContact CG1-CG 4.34Å; V442-R446 WeakPolarHBondContact O-CB 3.49Å; V442-R446 VanDerWaalsContact O-CG 3.27Å; V442-R446 WeakPolarHBondContact O-CG 3.19Å; V442-R446 PolarHBondContact O-N 2.78Å; E443-R446 PolarHBondContact O-N 2.9Å; R446-F448 PolarHBondContact O-N 2.93Å; R446-L449 PolarHBondContact O-N 3.37Å; R446-C450 WeakPolarHBondContact O-CB 3.38Å; R446-C450 PolarHBondContact O-N 2.71Å; R446-C450 PolarHBondContact O-SG 3.05Å; R446-A542 PolarHBondContact NH2-O 3.14Å; R446-A543 PolarHBondContact NE-O 3.13Å
447	S	90.9	Very high	89.4	Confident	53 Å²	53	69.6 Å²	69.6	37%	0.371	35%	0.35	S	S	.	.	H	α-helix	trans	-56.3	-47.5	176.3	-57.3	0	0	0	0	112.2	E443 D451 Y561	E443-S447 PolarHBondContact O-N 2.78Å; E443-S447 PolarHBondContact O-OG 2.81Å; E443-S447 VanDerWaalsContact O-OG 3.1Å; S447-D451 WeakPolarHBondContact O-CB 3.46Å; S447-D451 PolarHBondContact O-N 3.02Å; S447-D451 VanDerWaalsContact O-N 3.16Å; S447-Y561 PolarHBondContact O-OH 2.78Å
448	F	91.1	Very high	87.8	Confident	52 Å²	52	72.1 Å²	72.1	23%	0.228	37%	0.366	C	S	.	.	H	α-helix	trans	-63.5	-43.5	178.4	173.5	-109.4	0	0	0	113.1	R444 A445 R446 D451 Q452 L557 Y561 L562	R444-F448 WeakPolarHBondContact O-CB 3.41Å; R444-F448 PolarHBondContact O-N 3.4Å; A445-F448 PolarHBondContact O-N 3.3Å; R446-F448 PolarHBondContact O-N 2.93Å; F448-D451 CarbonylContact O-C 3.5Å; F448-D451 WeakPolarHBondContact O-CB 3.5Å; F448-D451 PolarHBondContact O-N 3.32Å; F448-Q452 HydrophobicContact CD1-CG 4.46Å; F448-Q452 HydrophobicContact CD2-CG 3.97Å; F448-Q452 HydrophobicContact CE1-CG 4.05Å; F448-Q452 HydrophobicContact CE2-CG 3.53Å; F448-Q452 HydrophobicContact CG-CG 4.44Å; F448-Q452 HydrophobicContact CZ-CG 3.57Å; F448-Q452 WeakPolarHBondContact O-CB 3.31Å; F448-Q452 WeakPolarHBondContact O-CG 3.39Å; F448-Q452 PolarHBondContact O-N 3.49Å; F448-Q452 PolarHBondContact O-NE2 3.48Å; F448-L557 HydrophobicContact CZ-CD2 4.43Å; F448-Y561 HydrophobicContact CB-CD1 3.97Å; F448-Y561 HydrophobicContact CB-CD2 4.37Å; F448-Y561 HydrophobicContact CB-CE1 4.31Å; F448-Y561 HydrophobicContact CB-CG 4Å; F448-Y561 AromaticContact CD2-CD2 3.7Å; F448-Y561 HydrophobicContact CD2-CD2 3.7Å; F448-Y561 AromaticContact CD2-CG 3.68Å; F448-Y561 HydrophobicContact CD2-CG 3.68Å; F448-Y561 HydrophobicContact CG-CG 4.29Å; F448-L562 HydrophobicContact CE2-CD2 4.38Å
449	L	90.6	Very high	85.8	Confident	46 Å²	46	75.5 Å²	75.5	24%	0.241	38%	0.383	C	S	.	.	H	α-helix	trans	-74.5	-43.8	-175.4	-69.6	172.8	0	0	0	112.2	A445 R446 D451 Q452 L453 L544	A445-L449 WeakPolarHBondContact O-CB 3.47Å; A445-L449 VanDerWaalsContact O-CG 3.25Å; A445-L449 WeakPolarHBondContact O-CG 3.49Å; A445-L449 PolarHBondContact O-N 3.12Å; R446-L449 PolarHBondContact O-N 3.37Å; L449-D451 PolarHBondContact O-N 2.96Å; L449-Q452 PolarHBondContact O-N 3.14Å; L449-L453 HydrophobicContact CB-CD1 4.33Å; L449-L453 HydrophobicContact CD2-CD1 4.29Å; L449-L453 WeakPolarHBondContact O-CB 3.24Å; L449-L453 PolarHBondContact O-N 3.22Å; L449-L544 HydrophobicContact CD1-CD2 3.78Å
450	C	87.6	Confident	83.5	Confident	56 Å²	56	80.3 Å²	80.3	38%	0.378	40%	0.4	S	S	.	.	H	α-helix	trans	-60.5	-25	170.2	-63.7	0	0	0	0	112.4	R446 L546	R446-C450 WeakPolarHBondContact O-CB 3.38Å; R446-C450 PolarHBondContact O-N 2.71Å; R446-C450 PolarHBondContact O-SG 3.05Å; C450-L546 HydrophobicContact CB-CD2 4.38Å
451	D	88.3	Confident	81	Confident	40 Å²	40	83.2 Å²	83.2	21%	0.214	42%	0.42	C	S	.	.	H	α-helix	trans	-84.4	-17.6	175.1	-89.9	-14.1	0	0	0	114.9	S447 F448 L449 R558 Y561	S447-D451 WeakPolarHBondContact O-CB 3.46Å; S447-D451 PolarHBondContact O-N 3.02Å; S447-D451 VanDerWaalsContact O-N 3.16Å; F448-D451 CarbonylContact O-C 3.5Å; F448-D451 WeakPolarHBondContact O-CB 3.5Å; F448-D451 PolarHBondContact O-N 3.32Å; L449-D451 PolarHBondContact O-N 2.96Å; D451-R558 VanDerWaalsContact CA-NH2 3.28Å; D451-R558 PolarHBondContact O-NE 2.89Å; D451-R558 VanDerWaalsContact O-NE 3.09Å; D451-R558 PolarHBondContact O-NH2 3.03Å; D451-R558 IonicContact OD1-CZ 3.52Å; D451-R558 IonicContact OD1-NE 3.01Å; D451-R558 IonicContact OD1-NH1 2.73Å; D451-R558 PolarHBondContact OD1-NH1 3.23Å; D451-R558 IonicContact OD1-NH2 3.96Å; D451-R558 PolarHBondContact OD1-NH2 3.47Å; D451-R558 IonicContact OD2-CZ 2.75Å; D451-R558 IonicContact OD2-NE 2.79Å; D451-R558 IonicContact OD2-NH1 3.01Å; D451-R558 PolarHBondContact OD2-NH1 2.9Å; D451-Y561 HydrophobicContact CB-CE2 4.12Å; D451-Y561 VanDerWaalsContact OD2-CE2 3.22Å; D451-Y561 WeakPolarHBondContact OD2-CE2 3.41Å; D451-Y561 PolarHBondContact OD2-OH 3.09Å
452	Q	88.1	Confident	78.4	Confident	4 Å²	4	88.5 Å²	88.5	2%	0.019	44%	0.439	C	S	.	.	H	α-helix	trans	-108.5	-19.8	-177.9	-75.8	1.7	-97.9	0	0	113.7	F448 L449 K554 L557	F448-Q452 HydrophobicContact CD1-CG 4.46Å; F448-Q452 HydrophobicContact CD2-CG 3.97Å; F448-Q452 HydrophobicContact CE1-CG 4.05Å; F448-Q452 HydrophobicContact CE2-CG 3.53Å; F448-Q452 HydrophobicContact CG-CG 4.44Å; F448-Q452 HydrophobicContact CZ-CG 3.57Å; F448-Q452 WeakPolarHBondContact O-CB 3.31Å; F448-Q452 WeakPolarHBondContact O-CG 3.39Å; F448-Q452 PolarHBondContact O-N 3.49Å; F448-Q452 PolarHBondContact O-NE2 3.48Å; L449-Q452 PolarHBondContact O-N 3.14Å; Q452-K554 WeakPolarHBondContact O-CB 3.42Å; Q452-K554 PolarHBondContact O-N 3.19Å; Q452-L557 HydrophobicContact CG-CD2 4.04Å
453	L	90.3	Very high	76	Confident	16 Å²	16	95 Å²	95	8%	0.084	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	114.8	-171.9	-67.1	177.5	0	0	0	111.4	L449 V533 L546 Y551 V553	L449-L453 HydrophobicContact CB-CD1 4.33Å; L449-L453 HydrophobicContact CD2-CD1 4.29Å; L449-L453 WeakPolarHBondContact O-CB 3.24Å; L449-L453 PolarHBondContact O-N 3.22Å; L453-V533 HydrophobicContact CD1-CG1 4.37Å; L453-V533 HydrophobicContact CD2-CB 4.13Å; L453-V533 HydrophobicContact CD2-CG2 3.86Å; L453-L546 HydrophobicContact CB-CD1 4.07Å; L453-L546 HydrophobicContact CD1-CD1 3.61Å; L453-L546 HydrophobicContact CG-CD1 4.45Å; L453-Y551 HydrophobicContact CB-CD1 3.91Å; L453-Y551 HydrophobicContact CB-CG 4.2Å; L453-V553 HydrophobicContact CD2-CG2 3.94Å
454	E	86.8	Confident	73.3	Confident	96 Å²	96	93.6 Å²	93.6	45%	0.449	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.4	177.6	-64.6	-172.3	165.8	0	0	110.3	R456 Y551 I552 K554	E454-R456 PolarHBondContact O-N 2.78Å; E454-Y551 CarbonylContact O-C 3.59Å; E454-Y551 WeakPolarHBondContact O-CA 3.4Å; E454-I552 PolarHBondContact N-O 2.89Å; E454-I552 PolarHBondContact O-N 3.39Å; E454-K554 HydrophobicContact CG-CB 4.39Å; E454-K554 WeakPolarHBondContact OE1-CD 3.47Å; E454-K554 IonicContact OE1-NZ 2.58Å; E454-K554 PolarHBondContact OE1-NZ 2.84Å
455	P	85.9	Confident	70.7	Confident	85 Å²	85	93.7 Å²	93.7	55%	0.552	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	129.4	-175.4	27.2	-34.1	0	0	0	111.9	I457 Y551	P455-I457 PolarHBondContact O-N 3Å; P455-I457 VanDerWaalsContact O-N 3.09Å; P455-Y551 HydrophobicContact CB-CD1 4.18Å; P455-Y551 HydrophobicContact CB-CE1 3.95Å
456	R	79.1	Confident	68.4	Low	51 Å²	51	101 Å²	101	19%	0.192	51%	0.511	C	S	.	.			trans	-75.9	95.8	175.5	-176.4	-179.3	-179.6	141	-15.5	109.6	E454 T458 E525 D527 I532 K550 I552	E454-R456 PolarHBondContact O-N 2.78Å; R456-T458 PolarHBondContact O-N 2.93Å; R456-T458 VanDerWaalsContact O-N 3.12Å; R456-E525 IonicContact CZ-OE2 3.38Å; R456-E525 VanDerWaalsContact CZ-OE2 3.25Å; R456-E525 IonicContact NE-OE2 3.21Å; R456-E525 PolarHBondContact NE-OE2 3.32Å; R456-E525 IonicContact NH2-OE2 2.97Å; R456-E525 PolarHBondContact NH2-OE2 2.88Å; R456-D527 IonicContact CZ-OD1 3.01Å; R456-D527 IonicContact NH1-OD1 3.68Å; R456-D527 PolarHBondContact NH1-OD1 3.06Å; R456-D527 IonicContact NH2-OD1 2.6Å; R456-D527 PolarHBondContact NH2-OD1 2.84Å; R456-I532 VanDerWaalsContact NH1-CD1 3.31Å; R456-K550 HydrophobicContact CB-CB 4.23Å; R456-K550 WeakPolarHBondContact CB-O 3.43Å; R456-K550 PolarHBondContact N-O 3.26Å; R456-I552 HydrophobicContact CB-CD1 4.13Å; R456-I552 HydrophobicContact CB-CG1 4.3Å; R456-I552 HydrophobicContact CG-CD1 4.16Å
457	I	72.5	Confident	66.1	Low	146 Å²	146	103.7 Å²	103.7	75%	0.749	53%	0.53	S	S	*	.			trans	-74.7	97.6	172	-54.4	175.7	0	0	0	108.6	P455	P455-I457 PolarHBondContact O-N 3Å; P455-I457 VanDerWaalsContact O-N 3.09Å
458	T	60.1	Low	63.7	Low	62 Å²	62	108 Å²	108	38%	0.38	55%	0.549	S	S	.	.			trans	-65	135.5	169.5	57.3	0	0	0	0	109.6	R456 K460 E525	R456-T458 PolarHBondContact O-N 2.93Å; R456-T458 VanDerWaalsContact O-N 3.12Å; T458-K460 VanDerWaalsContact C-N 3.32Å; T458-K460 PolarHBondContact O-N 2.94Å; T458-E525 WeakPolarHBondContact CG2-OE1 3.37Å
459	K	52.4	Low	61.3	Low	197 Å²	197	111 Å²	111	86%	0.857	58%	0.576	S	S	*	*			trans	-85.3	69.4	-171	-67.5	172.9	-173.5	155.9	0	111	S461	K459-S461 PolarHBondContact O-N 3.02Å
460	K	46.6	Very low	59.1	Low	199 Å²	199	117.1 Å²	117.1	87%	0.865	60%	0.603	S	S	*	*			trans	-50.1	131.4	173.2	-74.4	-152.1	172.6	-161.3	0	110.4	T458	T458-K460 VanDerWaalsContact C-N 3.32Å; T458-K460 PolarHBondContact O-N 2.94Å
461	S	39.7	Very low	56.9	Low	95 Å²	95	122.2 Å²	122.2	66%	0.664	63%	0.627	S	S	*	*			trans	-67.9	133.3	-158	51.2	0	0	0	0	113	K459 Q463	K459-S461 PolarHBondContact O-N 3.02Å; S461-Q463 VanDerWaalsContact C-N 3.29Å; S461-Q463 PolarHBondContact O-N 2.93Å
462	K	37.3	Very low	54.7	Low	219 Å²	219	129 Å²	129	95%	0.952	66%	0.657	S	S	*	*			trans	-83.9	70.6	177.7	-134	-176.5	-172.7	-175.6	0	110.1
463	Q	42.3	Very low	52.5	Low	163 Å²	163	138 Å²	138	76%	0.762	70%	0.696	S	S	*	*			trans	-79.7	130.3	173.9	-76	-170.1	-9.1	0	0	111.9	S461	S461-Q463 VanDerWaalsContact C-N 3.29Å; S461-Q463 PolarHBondContact O-N 2.93Å
464	S	35.1	Very low	50.2	Low	104 Å²	104	144.5 Å²	144.5	73%	0.727	73%	0.731	S	S	*	*			trans	16.9	117.9	158.2	56.6	0	0	0	0	119.7
465	N	36.8	Very low	48.2	Very low	143 Å²	143	143.6 Å²	143.6	77%	0.765	75%	0.748	S	S	*	*			trans	-145.6	70.9	140.1	-151.5	-11.8	0	0	0	110.4
466	E	42.5	Very low	46.2	Very low	191 Å²	191	148.5 Å²	148.5	89%	0.893	76%	0.763	S	S	*	*			trans	-82	111.3	175	-67.4	-171.9	126.5	0	0	110.3
467	M	45	Very low	44.6	Very low	160 Å²	160	153.1 Å²	153.1	79%	0.788	79%	0.792	S	S	*	*			trans	-120.9	72.4	166.3	-69	-159.4	-165.1	0	0	111.5
468	N	39.3	Very low	43.5	Very low	143 Å²	143	152.6 Å²	152.6	77%	0.765	79%	0.791	S	S	*	*			trans	21.1	105.1	133.9	-165.5	10.2	0	0	0	117.7
469	S	42.2	Very low	42.8	Very low	115 Å²	115	157.4 Å²	157.4	80%	0.804	81%	0.814	S	S	*	*			trans	-159.1	116.2	134.9	40.2	0	0	0	0	111.2
470	E	43	Very low	42.2	Very low	174 Å²	174	155.2 Å²	155.2	81%	0.813	81%	0.812	S	S	*	*			trans	-72.3	137	168.3	-61.5	170.6	102.1	0	0	110
471	N	41.1	Very low	42	Very low	164 Å²	164	153.2 Å²	153.2	88%	0.877	81%	0.806	S	S	*	*				-161.3	141.5	129.1	-108.1	-59.7	0	0	0	112.4
472	Q	42.1	Very low	42.1	Very low	181 Å²	181	154.3 Å²	154.3	85%	0.846	81%	0.808	S	S	*	*			trans	-72	147.5	169.9	-61	161.6	-22.3	0	0	109.4
473	K	43.1	Very low	42.3	Very low	193 Å²	193	148.7 Å²	148.7	84%	0.839	80%	0.796	S	S	*	*				-170.8	153.9	97.3	-154.8	159.4	-175.7	176.5	0	113.1
474	D	42.1	Very low	42.3	Very low	153 Å²	153	147.9 Å²	147.9	82%	0.818	80%	0.798	S	S	*	*			trans	-70.6	151.5	178.4	-29.9	-96.3	0	0	0	112.5
475	G	43.8	Very low	42.7	Very low	77 Å²	77	148.5 Å²	148.5	79%	0.794	80%	0.802	S	S	*	*			trans	-178.9	106.1	174.9	0	0	0	0	0	111.1
476	E	44.7	Very low	43	Very low	188 Å²	188	147.6 Å²	147.6	88%	0.879	80%	0.803	S	S	*	*			trans	-85	177.8	178.1	-66.3	164.9	116.8	0	0	111.9
477	D	45.3	Very low	43.1	Very low	148 Å²	148	148.3 Å²	148.3	79%	0.791	80%	0.804	S	S	*	*			trans	105.2	106.1	163.1	-60.9	-10	0	0	0	118.7
478	D	48.3	Very low	42.8	Very low	135 Å²	135	147.8 Å²	147.8	72%	0.722	80%	0.804	S	S	*	*			trans	18.3	127.5	133.5	-52.5	-16.4	0	0	0	119.5
479	N	46.8	Very low	43.1	Very low	163 Å²	163	151 Å²	151	87%	0.872	81%	0.811	S	S	*	*				-174.3	172.2	91.4	-99.7	-79.1	0	0	0	113.5
480	D	38.9	Very low	43	Very low	151 Å²	151	153.4 Å²	153.4	81%	0.807	81%	0.81	S	S	*	*			trans	-96.8	-178.1	-170.4	-163.7	7.2	0	0	0	113.6
481	E	43.6	Very low	42.9	Very low	158 Å²	158	153.2 Å²	153.2	74%	0.738	82%	0.815	S	S	*	*			trans	83.6	94.8	159.6	-58.9	-152	101.2	0	0	121.1
482	T	41.2	Very low	42.7	Very low	117 Å²	117	156.8 Å²	156.8	72%	0.718	82%	0.816	S	S	*	*				86.2	142.4	111.4	-58.5	0	0	0	0	121.6
483	S	41.8	Very low	42.9	Very low	101 Å²	101	153.7 Å²	153.7	71%	0.706	81%	0.814	S	S	*	*			trans	103.1	134.6	154.5	70.4	0	0	0	0	122.6
484	D	41.6	Very low	42.7	Very low	147 Å²	147	151.5 Å²	151.5	79%	0.786	81%	0.812	S	S	*	*			trans	69.2	81.9	144.6	-63.5	4.7	0	0	0	123.7
485	S	44.5	Very low	42.8	Very low	116 Å²	116	151.5 Å²	151.5	81%	0.811	82%	0.817	S	S	*	*				47.9	146	115.5	-62.7	0	0	0	0	123.9
486	P	41.8	Very low	42.6	Very low	124 Å²	124	156.8 Å²	156.8	81%	0.805	82%	0.818	S	S	*	*			trans	-94.9	177	-164.2	40	-39.6	0	0	0	115.9
487	K	44.4	Very low	42.6	Very low	206 Å²	206	152 Å²	152	90%	0.896	81%	0.806	S	S	*	*			trans	-137.2	140.7	170.1	-74.4	-178.2	178.6	167.7	0	113.8
488	N	39.9	Very low	42.4	Very low	150 Å²	150	153.2 Å²	153.2	80%	0.802	81%	0.806	S	S	*	*			trans	-59.5	161.1	-178.9	-60.2	-1.4	0	0	0	114.9
489	K	45.5	Very low	41.9	Very low	210 Å²	210	152.1 Å²	152.1	91%	0.913	80%	0.8	S	S	*	*				-154.4	118.7	129	-114.2	167.8	-174	176.5	0	112.7
490	E	40	Very low	41.7	Very low	165 Å²	165	152.8 Å²	152.8	77%	0.771	80%	0.796	S	S	*	*			trans	-85.2	160.2	161.9	-59.6	172.1	107	0	0	110
491	N	40.9	Very low	41.8	Very low	171 Å²	171	150.8 Å²	150.8	91%	0.914	79%	0.793	S	S	*	*				-170.6	140.4	129.2	-100	-21.4	0	0	0	112
492	R	37.5	Very low	41.4	Very low	238 Å²	238	150.7 Å²	150.7	90%	0.898	80%	0.798	S	S	*	*			trans	-98.3	152.8	169.3	-86	174.2	157.9	165.5	-8	110.6
493	S	44.9	Very low	41.3	Very low	117 Å²	117	148.3 Å²	148.3	82%	0.818	79%	0.79	S	S	*	*			trans	-164.1	130.1	138.8	56.8	0	0	0	0	111.5
494	D	39.6	Very low	41.3	Very low	147 Å²	147	151.7 Å²	151.7	79%	0.786	80%	0.795	S	S	*	*			trans	-67.2	164.7	173.5	-49.4	-110.4	0	0	0	113.2
495	V	44.5	Very low	41.4	Very low	152 Å²	152	149.8 Å²	149.8	92%	0.921	79%	0.793	S	S	*	*				-167.4	157.6	119.2	141.1	0	0	0	0	110.8
496	K	38.8	Very low	41.1	Very low	188 Å²	188	151.9 Å²	151.9	82%	0.817	80%	0.795	S	S	*	*			trans	-116.9	146.2	-161.8	171.8	-168	-179.3	-179.6	0	110.7
497	S	44.8	Very low	41	Very low	89 Å²	89	149.5 Å²	149.5	62%	0.622	79%	0.792	S	S	*	*				156.2	127.3	126.7	-69.1	0	0	0	0	117
498	Q	40.9	Very low	40.9	Very low	173 Å²	173	145.8 Å²	145.8	81%	0.808	79%	0.787	S	S	*	*			trans	67.2	106.3	131.1	-63.5	-175.6	-70.6	0	0	123.7
499	D	38.2	Very low	41	Very low	111 Å²	111	146.1 Å²	146.1	59%	0.594	78%	0.783	S	S	*	*				65.2	122.9	105.6	-112.4	-8.5	0	0	0	122.6
500	K	41.9	Very low	41	Very low	178 Å²	178	140.7 Å²	140.7	77%	0.774	78%	0.778	S	S	*	*			trans	69	146.3	145.2	-67	154.1	-173.1	150.8	0	118
501	S	42.6	Very low	41.2	Very low	108 Å²	108	138.9 Å²	138.9	76%	0.755	77%	0.773	S	S	*	*			cis	-160.2	142.7	12.1	50.9	0	0	0	0	114.9
502	N	34.9	Very low	41.8	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	77%	0.772	S	S	*	*			trans	26.1	149.8	139.5	-156.3	23	0	0	0	124.6
503	A	39.1	Very low	42.2	Very low	67 Å²	67	135.3 Å²	135.3	55%	0.554	77%	0.772	S	S	*	*			trans	109.4	102.5	141.9	0	0	0	0	0	121.1
504	Q	40.4	Very low	42.6	Very low	173 Å²	173	137.7 Å²	137.7	81%	0.808	78%	0.775	S	S	*	*			trans	47	133.5	134.6	-62.9	170.5	-85.4	0	0	120.5
505	S	43.7	Very low	42.9	Very low	106 Å²	106	138.6 Å²	138.6	74%	0.741	78%	0.781	S	S	*	*				-176	145.4	66.8	34	0	0	0	0	115.4
506	N	38.2	Very low	43	Very low	161 Å²	161	134.5 Å²	134.5	86%	0.861	77%	0.769	S	S	*	*			trans	34.5	130.2	148.3	-54.3	4.3	0	0	0	122.1
507	G	39.4	Very low	43.3	Very low	73 Å²	73	133.2 Å²	133.2	75%	0.753	77%	0.771	S	S	*	*			trans	-141.4	-22.9	-175.2	0	0	0	0	0	120.9
508	V	43.4	Very low	43.6	Very low	129 Å²	129	136.7 Å²	136.7	78%	0.782	78%	0.782	S	S	*	*			trans	74	133.4	167.1	-175.5	0	0	0	0	119.5
509	H	42.7	Very low	44	Very low	157 Å²	157	134 Å²	134	73%	0.727	78%	0.778	S	S	*	*			trans	35.7	120.9	164.9	-74.7	-72.5	0	0	0	121.8	D511	H509-D511 IonicContact CE1-OD2 3.21Å; H509-D511 IonicContact CG-OD2 2.67Å; H509-D511 IonicContact ND1-OD1 3.47Å; H509-D511 IonicContact ND1-OD2 3.63Å; H509-D511 PolarHBondContact ND1-OD2 2.82Å
510	A	45.5	Very low	44.7	Very low	96 Å²	96	137.5 Å²	137.5	79%	0.793	79%	0.791	S	S	*	*				-145.9	152.7	103.6	0	0	0	0	0	108.9
511	D	42.7	Very low	44.8	Very low	127 Å²	127	137.4 Å²	137.4	68%	0.679	79%	0.793	S	S	*	*			trans	-113.6	123.7	-175.9	-49.4	-101.6	0	0	0	108.1	H509	H509-D511 IonicContact CE1-OD2 3.21Å; H509-D511 IonicContact CG-OD2 2.67Å; H509-D511 IonicContact ND1-OD1 3.47Å; H509-D511 IonicContact ND1-OD2 3.63Å; H509-D511 PolarHBondContact ND1-OD2 2.82Å
512	D	53.1	Low	45.3	Very low	164 Å²	164	141 Å²	141	88%	0.877	80%	0.798	S	S	*	*			trans	-149.3	123.8	169.8	-86.8	-54	0	0	0	107.6
513	D	46.8	Very low	46.2	Very low	170 Å²	170	141.9 Å²	141.9	91%	0.909	80%	0.797	S	S	*	*			trans	-86.9	136.7	176.3	-52.6	-84.2	0	0	0	110.4
514	D	54.2	Low	46.8	Very low	166 Å²	166	147.9 Å²	147.9	89%	0.888	81%	0.813	S	S	*	*			trans	-145.9	132.8	168.7	-159.4	27.5	0	0	0	109.8
515	D	45.6	Very low	47.7	Very low	167 Å²	167	143.3 Å²	143.3	89%	0.893	79%	0.792	S	S	*	*			trans	-82.5	140.8	-171.6	-67.2	-79.9	0	0	0	112.2
516	G	45.6	Very low	48.3	Very low	65 Å²	65	145.8 Å²	145.8	67%	0.67	80%	0.797	S	S	*	*			trans	-169.6	43.6	-173.7	0	0	0	0	0	116.8	D518	G516-D518 VanDerWaalsContact C-N 3.26Å; G516-D518 PolarHBondContact O-N 3.26Å
517	D	45.6	Very low	49.2	Very low	162 Å²	162	142.5 Å²	142.5	87%	0.866	78%	0.779	S	S	*	*			trans	-73.2	81.5	165.5	-87.5	-38.4	0	0	0	110	V519	D517-V519 PolarHBondContact O-N 2.99Å
518	D	51.2	Low	50.3	Low	161 Å²	161	146.9 Å²	146.9	86%	0.861	79%	0.786	S	S	*	*			trans	-66.5	81.1	167.4	-86.7	-40.6	0	0	0	109.8	G516 E520	G516-D518 VanDerWaalsContact C-N 3.26Å; G516-D518 PolarHBondContact O-N 3.26Å; D518-E520 PolarHBondContact O-N 3.25Å; D518-E520 VanDerWaalsContact O-N 3.12Å
519	V	49.6	Very low	51.5	Low	118 Å²	118	144.1 Å²	144.1	72%	0.715	78%	0.783	S	S	*	*			trans	-71.3	100.2	165.6	-178.4	0	0	0	0	107.4	D517 E521	D517-V519 PolarHBondContact O-N 2.99Å; V519-E521 VanDerWaalsContact C-N 3.35Å; V519-E521 PolarHBondContact O-N 2.94Å
520	E	51.6	Low	52.9	Low	184 Å²	184	138.4 Å²	138.4	86%	0.86	76%	0.763	S	S	*	*			trans	-61.7	96.5	169.3	-70.4	-165.3	163.3	0	0	109	D518 E522	D518-E520 PolarHBondContact O-N 3.25Å; D518-E520 VanDerWaalsContact O-N 3.12Å; E520-E522 PolarHBondContact O-N 3.21Å; E520-E522 VanDerWaalsContact O-N 3.13Å
521	E	45.9	Very low	54.6	Low	176 Å²	176	139.4 Å²	139.4	82%	0.822	75%	0.753	S	S	*	*			trans	-60.7	112.3	169.8	-65.9	-172.9	154.7	0	0	108.3	V519 E523	V519-E521 VanDerWaalsContact C-N 3.35Å; V519-E521 PolarHBondContact O-N 2.94Å; E521-E523 PolarHBondContact O-N 2.89Å
522	E	52.5	Low	56.6	Low	184 Å²	184	136 Å²	136	86%	0.86	74%	0.735	S	S	*	*			trans	-64.5	100.4	173	-70.6	-160.8	141.7	0	0	108.6	E520 E524	E520-E522 PolarHBondContact O-N 3.21Å; E520-E522 VanDerWaalsContact O-N 3.13Å; E522-E524 PolarHBondContact O-N 3.25Å
523	E	54.1	Low	58.3	Low	173 Å²	173	130.4 Å²	130.4	81%	0.808	71%	0.707	S	S	*	*			trans	-52.3	114.1	174.4	-69.5	-175.6	158.7	0	0	109.6	E521 E525	E521-E523 PolarHBondContact O-N 2.89Å; E523-E525 PolarHBondContact O-N 3.38Å
524	E	51.2	Low	60.4	Low	193 Å²	193	128 Å²	128	90%	0.902	69%	0.688	S	S	*	*			trans	-68	73.8	171.3	-67.2	-170.7	147.1	0	0	109.4	E522 D526	E522-E524 PolarHBondContact O-N 3.25Å; E524-D526 PolarHBondContact O-N 3.5Å; E524-D526 VanDerWaalsContact O-N 3.12Å
525	E	58.8	Low	62.1	Low	78 Å²	78	120.1 Å²	120.1	36%	0.364	65%	0.646	S	S	.	*			trans	-53.9	115.7	169	-78.2	-169.9	155.3	0	0	108.7	R456 T458 E523 D527	R456-E525 IonicContact CZ-OE2 3.38Å; R456-E525 VanDerWaalsContact CZ-OE2 3.25Å; R456-E525 IonicContact NE-OE2 3.21Å; R456-E525 PolarHBondContact NE-OE2 3.32Å; R456-E525 IonicContact NH2-OE2 2.97Å; R456-E525 PolarHBondContact NH2-OE2 2.88Å; T458-E525 WeakPolarHBondContact CG2-OE1 3.37Å; E523-E525 PolarHBondContact O-N 3.38Å; E525-D527 PolarHBondContact O-N 3.19Å
526	D	56.3	Low	64.2	Low	158 Å²	158	116.6 Å²	116.6	85%	0.845	63%	0.627	S	S	*	*			trans	-46.2	101.4	178.2	-76.8	-69.9	0	0	0	111.9	E524 D528	E524-D526 PolarHBondContact O-N 3.5Å; E524-D526 VanDerWaalsContact O-N 3.12Å; D526-D528 PolarHBondContact O-N 3.36Å
527	D	56.8	Low	66.5	Low	91 Å²	91	116.2 Å²	116.2	49%	0.487	61%	0.612	S	S	.	*			trans	-75.9	109.2	179.4	-87.3	-18.6	0	0	0	110.3	R456 E525 G529 I532	R456-D527 IonicContact CZ-OD1 3.01Å; R456-D527 IonicContact NH1-OD1 3.68Å; R456-D527 PolarHBondContact NH1-OD1 3.06Å; R456-D527 IonicContact NH2-OD1 2.6Å; R456-D527 PolarHBondContact NH2-OD1 2.84Å; E525-D527 PolarHBondContact O-N 3.19Å; D527-G529 PolarHBondContact O-N 2.97Å; D527-I532 VanDerWaalsContact OD2-CD1 3.3Å; D527-I532 WeakPolarHBondContact OD2-CD1 3.33Å
528	D	63.4	Low	68.7	Low	166 Å²	166	116.3 Å²	116.3	89%	0.888	61%	0.607	S	S	*	*			trans	-60.5	24.2	179.5	-88.8	-45.4	0	0	0	115.2	D526 A530	D526-D528 PolarHBondContact O-N 3.36Å; D528-A530 PolarHBondContact O-N 2.97Å
529	G	67.5	Low	70.6	Confident	70 Å²	70	116.5 Å²	116.5	72%	0.722	60%	0.603	S	S	*	*	S	Bend	trans	71.4	13.8	-172	0	0	0	0	0	113.6	D527	D527-G529 PolarHBondContact O-N 2.97Å
530	A	74.2	Confident	72.6	Confident	37 Å²	37	114.7 Å²	114.7	31%	0.306	59%	0.586	S	S	.	*			trans	-74.4	136	179.9	0	0	0	0	0	111.5	D528 I532 I552	D528-A530 PolarHBondContact O-N 2.97Å; A530-I532 PolarHBondContact O-N 2.98Å; A530-I552 HydrophobicContact CB-CG2 4.17Å
531	I	79.3	Confident	74.4	Confident	117 Å²	117	107.2 Å²	107.2	60%	0.6	55%	0.554	S	S	*	*			trans	-76.1	113.8	175	-59.7	174.4	0	0	0	108.6	V553	I531-V553 HydrophobicContact CB-CB 4.39Å; I531-V553 HydrophobicContact CB-CG2 4.02Å; I531-V553 HydrophobicContact CG2-CG2 3.88Å; I531-V553 PolarHBondContact O-N 3.09Å
532	I	85.7	Confident	76.6	Confident	55 Å²	55	101.7 Å²	101.7	28%	0.282	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128.6	178	-54.1	174.5	0	0	0	110.1	R456 D527 A530 K550 Y551	R456-I532 VanDerWaalsContact NH1-CD1 3.31Å; D527-I532 VanDerWaalsContact OD2-CD1 3.3Å; D527-I532 WeakPolarHBondContact OD2-CD1 3.33Å; A530-I532 PolarHBondContact O-N 2.98Å; I532-K550 HydrophobicContact CG2-CB 4.07Å; I532-K550 HydrophobicContact CG2-CG 4.35Å; I532-Y551 CarbonylContact C-O 3.53Å; I532-Y551 VanDerWaalsContact CA-O 3.27Å; I532-Y551 WeakPolarHBondContact CA-O 3.2Å
533	V	88	Confident	78.3	Confident	48 Å²	48	95.8 Å²	95.8	29%	0.291	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.4	169.1	179.8	0	0	0	0	108.2	L453 Y551 V553	L453-V533 HydrophobicContact CD1-CG1 4.37Å; L453-V533 HydrophobicContact CD2-CB 4.13Å; L453-V533 HydrophobicContact CD2-CG2 3.86Å; V533-Y551 PolarHBondContact N-O 3.09Å; V533-Y551 PolarHBondContact O-N 3.41Å; V533-V553 HydrophobicContact CG2-CG2 4.04Å
534	K	91	Very high	80	Confident	119 Å²	119	89.9 Å²	89.9	52%	0.517	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.8	-179.7	-162.3	-177.4	-177.9	-128	0	109.6	D536 K550	K534-D536 WeakPolarHBondContact CD-OD1 3.31Å; K534-D536 WeakPolarHBondContact CD-OD2 3.18Å; K534-D536 WeakPolarHBondContact CE-OD1 3.47Å; K534-D536 WeakPolarHBondContact CE-OD2 3.36Å; K534-D536 WeakPolarHBondContact CG-OD1 3.41Å; K534-D536 IonicContact NZ-OD1 2.71Å; K534-D536 PolarHBondContact NZ-OD1 3.21Å; K534-D536 IonicContact NZ-OD2 3.41Å; K534-D536 PolarHBondContact NZ-OD2 3.39Å; K534-K550 HydrophobicContact CG-CG 4.48Å
535	V	91.3	Very high	81.8	Confident	0 Å²	0	82.9 Å²	82.9	0%	0	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	104.1	174.4	-178.6	0	0	0	0	106.9	Q540 L544 C548 G549 Y551	V535-Q540 HydrophobicContact CG1-CB 3.93Å; V535-L544 HydrophobicContact CG1-CD1 4.43Å; V535-L544 HydrophobicContact CG2-CD1 3.77Å; V535-C548 CarbonylContact O-C 3.56Å; V535-C548 WeakPolarHBondContact O-CA 3.33Å; V535-C548 WeakPolarHBondContact O-CB 3.46Å; V535-G549 PolarHBondContact N-O 3.09Å; V535-G549 PolarHBondContact O-N 3.21Å; V535-Y551 HydrophobicContact CB-CE2 4.28Å; V535-Y551 HydrophobicContact CG2-CD2 3.98Å; V535-Y551 HydrophobicContact CG2-CE2 3.86Å
536	D	89.6	Confident	83.3	Confident	93 Å²	93	79.9 Å²	79.9	50%	0.497	46%	0.462	S	S	.	.			trans	-100.6	-39.8	-171.7	-81.3	-29.2	0	0	0	113	K534	K534-D536 WeakPolarHBondContact CD-OD1 3.31Å; K534-D536 WeakPolarHBondContact CD-OD2 3.18Å; K534-D536 WeakPolarHBondContact CE-OD1 3.47Å; K534-D536 WeakPolarHBondContact CE-OD2 3.36Å; K534-D536 WeakPolarHBondContact CG-OD1 3.41Å; K534-D536 IonicContact NZ-OD1 2.71Å; K534-D536 PolarHBondContact NZ-OD1 3.21Å; K534-D536 IonicContact NZ-OD2 3.41Å; K534-D536 PolarHBondContact NZ-OD2 3.39Å
537	T	92.8	Very high	84.9	Confident	58 Å²	58	76.6 Å²	76.6	36%	0.356	45%	0.449	S	S	.	.	S	Bend	trans	-99.1	150.8	-174.9	75.3	0	0	0	0	112.8	E539 Q540 S541	T537-E539 PolarHBondContact O-N 3.32Å; T537-Q540 WeakPolarHBondContact O-CB 3.37Å; T537-Q540 PolarHBondContact O-N 3.15Å; T537-Q540 VanDerWaalsContact O-N 3.14Å; T537-Q540 VanDerWaalsContact OG1-CG 3.26Å; T537-Q540 WeakPolarHBondContact OG1-CG 3.15Å; T537-Q540 PolarHBondContact OG1-N 2.95Å; T537-Q540 VanDerWaalsContact OG1-N 3.08Å; T537-S541 PolarHBondContact O-N 3.44Å
538	E	91.6	Very high	86.4	Confident	164 Å²	164	75.6 Å²	75.6	77%	0.766	45%	0.448	S	S	*	.	H	α-helix	trans	-59.3	-32.7	172.8	-172	173.2	-172.2	0	0	111.6	S541 A542	E538-S541 WeakPolarHBondContact O-CB 3.16Å; E538-S541 PolarHBondContact O-N 3.33Å; E538-A542 VanDerWaalsContact O-CB 3.28Å; E538-A542 WeakPolarHBondContact O-CB 3.34Å; E538-A542 PolarHBondContact O-N 2.9Å
539	E	91.6	Very high	87.7	Confident	164 Å²	164	69.2 Å²	69.2	77%	0.766	42%	0.421	S	S	*	.	H	α-helix	trans	-65.1	-42.8	174.2	-60.7	-177.4	160.5	0	0	112.6	T537 A543	T537-E539 PolarHBondContact O-N 3.32Å; E539-A543 VanDerWaalsContact O-CB 3.25Å; E539-A543 WeakPolarHBondContact O-CB 3.48Å; E539-A543 PolarHBondContact O-N 3.41Å
540	Q	91.1	Very high	88.8	Confident	80 Å²	80	70.7 Å²	70.7	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-63.4	-44.9	173.3	-71.1	164	2.1	0	0	110.5	V535 T537 A542 A543 L544	V535-Q540 HydrophobicContact CG1-CB 3.93Å; T537-Q540 WeakPolarHBondContact O-CB 3.37Å; T537-Q540 PolarHBondContact O-N 3.15Å; T537-Q540 VanDerWaalsContact O-N 3.14Å; T537-Q540 VanDerWaalsContact OG1-CG 3.26Å; T537-Q540 WeakPolarHBondContact OG1-CG 3.15Å; T537-Q540 PolarHBondContact OG1-N 2.95Å; T537-Q540 VanDerWaalsContact OG1-N 3.08Å; Q540-A542 PolarHBondContact O-N 3.25Å; Q540-A543 PolarHBondContact O-N 2.99Å; Q540-L544 VanDerWaalsContact O-CB 3.3Å; Q540-L544 WeakPolarHBondContact O-CB 3.35Å; Q540-L544 WeakPolarHBondContact O-CG 3.35Å; Q540-L544 PolarHBondContact O-N 3.21Å
541	S	90.8	Very high	89.6	Confident	27 Å²	27	69.4 Å²	69.4	19%	0.189	40%	0.395	C	S	.	.	H	α-helix	trans	-57.8	-49.3	176.6	159.9	0	0	0	0	111.9	T537 E538 A543 G545 L546	T537-S541 PolarHBondContact O-N 3.44Å; E538-S541 WeakPolarHBondContact O-CB 3.16Å; E538-S541 PolarHBondContact O-N 3.33Å; S541-A543 PolarHBondContact O-N 3.3Å; S541-G545 WeakPolarHBondContact O-CA 3.48Å; S541-G545 PolarHBondContact O-N 2.95Å; S541-L546 WeakPolarHBondContact CA-O 3.35Å; S541-L546 VanDerWaalsContact CB-O 3.24Å; S541-L546 WeakPolarHBondContact CB-O 3.39Å; S541-L546 PolarHBondContact O-N 3.41Å; S541-L546 PolarHBondContact OG-O 2.71Å
542	A	90.9	Very high	90.1	Very high	61 Å²	61	66.5 Å²	66.5	50%	0.504	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-38.2	177	0	0	0	0	0	112.7	R446 E538 Q540	R446-A542 PolarHBondContact NH2-O 3.14Å; E538-A542 VanDerWaalsContact O-CB 3.28Å; E538-A542 WeakPolarHBondContact O-CB 3.34Å; E538-A542 PolarHBondContact O-N 2.9Å; Q540-A542 PolarHBondContact O-N 3.25Å
543	A	89.3	Confident	90.2	Very high	59 Å²	59	65.9 Å²	65.9	49%	0.488	38%	0.379	S	S	.	.	H	α-helix	trans	-66.1	-51	176.3	0	0	0	0	0	111.6	R446 E539 Q540 S541	R446-A543 PolarHBondContact NE-O 3.13Å; E539-A543 VanDerWaalsContact O-CB 3.25Å; E539-A543 WeakPolarHBondContact O-CB 3.48Å; E539-A543 PolarHBondContact O-N 3.41Å; Q540-A543 PolarHBondContact O-N 2.99Å; S541-A543 PolarHBondContact O-N 3.3Å
544	L	89	Confident	90.1	Very high	49 Å²	49	67.2 Å²	67.2	26%	0.257	38%	0.381	S	S	.	.	H	α-helix	trans	-77.9	-20.5	-174.6	-60.5	171.1	0	0	0	113.6	L449 V535 Q540 L546	L449-L544 HydrophobicContact CD1-CD2 3.78Å; V535-L544 HydrophobicContact CG1-CD1 4.43Å; V535-L544 HydrophobicContact CG2-CD1 3.77Å; Q540-L544 VanDerWaalsContact O-CB 3.3Å; Q540-L544 WeakPolarHBondContact O-CB 3.35Å; Q540-L544 WeakPolarHBondContact O-CG 3.35Å; Q540-L544 PolarHBondContact O-N 3.21Å; L544-L546 VanDerWaalsContact C-N 3.34Å; L544-L546 HydrophobicContact CB-CB 4.36Å
545	G	88.4	Confident	89.6	Confident	46 Å²	46	66.8 Å²	66.8	47%	0.474	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	22	-174	0	0	0	0	0	113.6	S541	S541-G545 WeakPolarHBondContact O-CA 3.48Å; S541-G545 PolarHBondContact O-N 2.95Å
546	L	90.3	Very high	89	Confident	16 Å²	16	72 Å²	72	8%	0.084	41%	0.414	C	S	.	.	S	Bend	trans	-129.1	129.1	-173	-73	174.7	0	0	0	109.9	C450 L453 S541 L544 Y551	C450-L546 HydrophobicContact CB-CD2 4.38Å; L453-L546 HydrophobicContact CB-CD1 4.07Å; L453-L546 HydrophobicContact CD1-CD1 3.61Å; L453-L546 HydrophobicContact CG-CD1 4.45Å; S541-L546 WeakPolarHBondContact CA-O 3.35Å; S541-L546 VanDerWaalsContact CB-O 3.24Å; S541-L546 WeakPolarHBondContact CB-O 3.39Å; S541-L546 PolarHBondContact O-N 3.41Å; S541-L546 PolarHBondContact OG-O 2.71Å; L544-L546 VanDerWaalsContact C-N 3.34Å; L544-L546 HydrophobicContact CB-CB 4.36Å; L546-Y551 HydrophobicContact CB-CE2 4.41Å; L546-Y551 HydrophobicContact CD1-CE1 4.43Å; L546-Y551 HydrophobicContact CD2-CE1 4.07Å
547	P	90.1	Very high	88.6	Confident	89 Å²	89	70.5 Å²	70.5	58%	0.578	41%	0.406	S	S	*	.			trans	-61	154.6	178.9	24.7	-33	0	0	0	112.3	Y551	P547-Y551 WeakPolarHBondContact CD-OH 3.28Å; P547-Y551 WeakPolarHBondContact CG-OH 3.4Å; P547-Y551 VanDerWaalsContact O-CE2 3.32Å; P547-Y551 WeakPolarHBondContact O-CE2 3.49Å; P547-Y551 PolarHBondContact O-OH 2.89Å
548	C	89.7	Confident	88.2	Confident	69 Å²	69	72.4 Å²	72.4	47%	0.466	41%	0.407	S	S	.	.	S	Bend	trans	-57.8	138.9	179	-55.1	0	0	0	0	112	V535	V535-C548 CarbonylContact O-C 3.56Å; V535-C548 WeakPolarHBondContact O-CA 3.33Å; V535-C548 WeakPolarHBondContact O-CB 3.46Å
549	G	89.5	Confident	87.7	Confident	32 Å²	32	67 Å²	67	33%	0.33	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	156.4	180	-175.9	0	0	0	0	0	114.6	V535	V535-G549 PolarHBondContact N-O 3.09Å; V535-G549 PolarHBondContact O-N 3.21Å
550	K	90.2	Very high	87.4	Confident	101 Å²	101	66.9 Å²	66.9	44%	0.439	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.2	171.4	-65.1	-177.9	-178.7	-177.6	0	109.5	R456 I532 K534	R456-K550 HydrophobicContact CB-CB 4.23Å; R456-K550 WeakPolarHBondContact CB-O 3.43Å; R456-K550 PolarHBondContact N-O 3.26Å; I532-K550 HydrophobicContact CG2-CB 4.07Å; I532-K550 HydrophobicContact CG2-CG 4.35Å; K534-K550 HydrophobicContact CG-CG 4.48Å
551	Y	91.1	Very high	87	Confident	10 Å²	10	66.5 Å²	66.5	4%	0.039	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	151.2	177.2	-68	-94.9	0	0	0	111.1	L453 E454 P455 I532 V533 V535 L546 P547	L453-Y551 HydrophobicContact CB-CD1 3.91Å; L453-Y551 HydrophobicContact CB-CG 4.2Å; E454-Y551 CarbonylContact O-C 3.59Å; E454-Y551 WeakPolarHBondContact O-CA 3.4Å; P455-Y551 HydrophobicContact CB-CD1 4.18Å; P455-Y551 HydrophobicContact CB-CE1 3.95Å; I532-Y551 CarbonylContact C-O 3.53Å; I532-Y551 VanDerWaalsContact CA-O 3.27Å; I532-Y551 WeakPolarHBondContact CA-O 3.2Å; V533-Y551 PolarHBondContact N-O 3.09Å; V533-Y551 PolarHBondContact O-N 3.41Å; V535-Y551 HydrophobicContact CB-CE2 4.28Å; V535-Y551 HydrophobicContact CG2-CD2 3.98Å; V535-Y551 HydrophobicContact CG2-CE2 3.86Å; L546-Y551 HydrophobicContact CB-CE2 4.41Å; L546-Y551 HydrophobicContact CD1-CE1 4.43Å; L546-Y551 HydrophobicContact CD2-CE1 4.07Å; P547-Y551 WeakPolarHBondContact CD-OH 3.28Å; P547-Y551 WeakPolarHBondContact CG-OH 3.4Å; P547-Y551 VanDerWaalsContact O-CE2 3.32Å; P547-Y551 WeakPolarHBondContact O-CE2 3.49Å; P547-Y551 PolarHBondContact O-OH 2.89Å
552	I	89.4	Confident	86.7	Confident	57 Å²	57	66.3 Å²	66.3	29%	0.292	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	137.1	173.2	-66.4	166.5	0	0	0	108.8	E454 R456 A530 K554	E454-I552 PolarHBondContact N-O 2.89Å; E454-I552 PolarHBondContact O-N 3.39Å; R456-I552 HydrophobicContact CB-CD1 4.13Å; R456-I552 HydrophobicContact CB-CG1 4.3Å; R456-I552 HydrophobicContact CG-CD1 4.16Å; A530-I552 HydrophobicContact CB-CG2 4.17Å; I552-K554 PolarHBondContact O-N 3.47Å
553	V	88.3	Confident	86.3	Confident	41 Å²	41	66.9 Å²	66.9	25%	0.248	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	116.6	174	-177	0	0	0	0	110.3	L453 I531 V533	L453-V553 HydrophobicContact CD2-CG2 3.94Å; I531-V553 HydrophobicContact CB-CB 4.39Å; I531-V553 HydrophobicContact CB-CG2 4.02Å; I531-V553 HydrophobicContact CG2-CG2 3.88Å; I531-V553 PolarHBondContact O-N 3.09Å; V533-V553 HydrophobicContact CG2-CG2 4.04Å
554	K	85.9	Confident	85.8	Confident	76 Å²	76	72.9 Å²	72.9	33%	0.33	38%	0.382	S	S	.	.			trans	-69.7	138.7	174.2	-170	-170.7	-172.9	70.4	0	110.8	Q452 E454 I552	Q452-K554 WeakPolarHBondContact O-CB 3.42Å; Q452-K554 PolarHBondContact O-N 3.19Å; E454-K554 HydrophobicContact CG-CB 4.39Å; E454-K554 WeakPolarHBondContact OE1-CD 3.47Å; E454-K554 IonicContact OE1-NZ 2.58Å; E454-K554 PolarHBondContact OE1-NZ 2.84Å; I552-K554 PolarHBondContact O-N 3.47Å
555	E	81	Confident	85.4	Confident	110 Å²	110	74.9 Å²	74.9	51%	0.514	39%	0.386	S	S	.	.	S	Bend	trans	-129.7	149.3	174.9	-60.9	-174.5	108.3	0	0	111.6	R595	E555-R595 IonicContact OE1-CZ 2.84Å; E555-R595 IonicContact OE1-NH1 3.68Å; E555-R595 IonicContact OE1-NH2 2.9Å; E555-R595 PolarHBondContact OE1-NH2 2.81Å; E555-R595 IonicContact OE2-CZ 2.7Å; E555-R595 IonicContact OE2-NH1 3.12Å; E555-R595 PolarHBondContact OE2-NH1 2.92Å; E555-R595 IonicContact OE2-NH2 3.99Å; E555-R595 PolarHBondContact OE2-NH2 3.41Å
556	P	78.2	Confident	85.1	Confident	109 Å²	109	76.4 Å²	76.4	71%	0.708	38%	0.38	S	S	*	.	S	Bend	cis	-72.1	155.5	-6.1	32.3	-36.3	0	0	0	112.4
557	L	82.1	Confident	84.8	Confident	62 Å²	62	80.9 Å²	80.9	33%	0.325	40%	0.396	S	S	.	.			trans	-57.4	137.3	175.5	-61.7	176	0	0	0	111.3	F448 Q452 E559 L562	F448-L557 HydrophobicContact CZ-CD2 4.43Å; Q452-L557 HydrophobicContact CG-CD2 4.04Å; L557-E559 PolarHBondContact O-N 2.85Å; L557-L562 HydrophobicContact CB-CD1 4.06Å; L557-L562 HydrophobicContact CD1-CD1 4.46Å
558	R	83.2	Confident	84.4	Confident	98 Å²	98	80.1 Å²	80.1	37%	0.37	39%	0.392	S	S	.	.			trans	-67.5	108.5	178.4	-62.5	-164.6	-156.2	177.3	14.6	111.3	D451 E560 Y561	D451-R558 VanDerWaalsContact CA-NH2 3.28Å; D451-R558 PolarHBondContact O-NE 2.89Å; D451-R558 VanDerWaalsContact O-NE 3.09Å; D451-R558 PolarHBondContact O-NH2 3.03Å; D451-R558 IonicContact OD1-CZ 3.52Å; D451-R558 IonicContact OD1-NE 3.01Å; D451-R558 IonicContact OD1-NH1 2.73Å; D451-R558 PolarHBondContact OD1-NH1 3.23Å; D451-R558 IonicContact OD1-NH2 3.96Å; D451-R558 PolarHBondContact OD1-NH2 3.47Å; D451-R558 IonicContact OD2-CZ 2.75Å; D451-R558 IonicContact OD2-NE 2.79Å; D451-R558 IonicContact OD2-NH1 3.01Å; D451-R558 PolarHBondContact OD2-NH1 2.9Å; R558-E560 PolarHBondContact O-N 2.67Å; R558-E560 VanDerWaalsContact O-N 3.1Å; R558-Y561 HydrophobicContact CB-CD2 4.07Å; R558-Y561 HydrophobicContact CB-CE2 4.31Å; R558-Y561 PolarHBondContact O-N 3.48Å
559	E	82.5	Confident	84.1	Confident	50 Å²	50	80.8 Å²	80.8	23%	0.234	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-63.3	-21.6	-170.8	-53.7	-161.3	109.2	0	0	114.2	L557 Y561 L562 R567 L570 R574	L557-E559 PolarHBondContact O-N 2.85Å; E559-Y561 VanDerWaalsContact C-N 3.27Å; E559-Y561 PolarHBondContact O-N 3.41Å; E559-L562 PolarHBondContact O-N 2.76Å; E559-R567 HydrophobicContact CB-CG 4.28Å; E559-R567 VanDerWaalsContact O-CZ 3.25Å; E559-R567 PolarHBondContact O-NE 3.16Å; E559-R567 PolarHBondContact O-NH2 3.11Å; E559-L570 HydrophobicContact CG-CD1 4.18Å; E559-L570 WeakPolarHBondContact OE1-CB 3.5Å; E559-R574 IonicContact OE1-CZ 3.4Å; E559-R574 IonicContact OE1-NH1 3.83Å; E559-R574 IonicContact OE1-NH2 2.71Å; E559-R574 PolarHBondContact OE1-NH2 3.22Å; E559-R574 IonicContact OE2-CZ 3.17Å; E559-R574 IonicContact OE2-NH1 2.85Å; E559-R574 PolarHBondContact OE2-NH1 3.38Å; E559-R574 IonicContact OE2-NH2 2.77Å; E559-R574 PolarHBondContact OE2-NH2 3.08Å
560	E	84.7	Confident	83.8	Confident	163 Å²	163	81 Å²	81	76%	0.762	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-59.3	-34.6	-179.1	-64.6	-178.8	-178.4	0	0	113.1	R558 R567	R558-E560 PolarHBondContact O-N 2.67Å; R558-E560 VanDerWaalsContact O-N 3.1Å; E560-R567 PolarHBondContact O-NH2 3.23Å
561	Y	83.4	Confident	83.5	Confident	72 Å²	72	78.3 Å²	78.3	28%	0.282	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-80.2	-17.1	175.4	-60.6	-81	0	0	0	113.5	R444 S447 F448 D451 R558 E559	R444-Y561 HydrophobicContact CG-CD1 4.46Å; S447-Y561 PolarHBondContact O-OH 2.78Å; F448-Y561 HydrophobicContact CB-CD1 3.97Å; F448-Y561 HydrophobicContact CB-CD2 4.37Å; F448-Y561 HydrophobicContact CB-CE1 4.31Å; F448-Y561 HydrophobicContact CB-CG 4Å; F448-Y561 AromaticContact CD2-CD2 3.7Å; F448-Y561 HydrophobicContact CD2-CD2 3.7Å; F448-Y561 AromaticContact CD2-CG 3.68Å; F448-Y561 HydrophobicContact CD2-CG 3.68Å; F448-Y561 HydrophobicContact CG-CG 4.29Å; D451-Y561 HydrophobicContact CB-CE2 4.12Å; D451-Y561 VanDerWaalsContact OD2-CE2 3.22Å; D451-Y561 WeakPolarHBondContact OD2-CE2 3.41Å; D451-Y561 PolarHBondContact OD2-OH 3.09Å; R558-Y561 HydrophobicContact CB-CD2 4.07Å; R558-Y561 HydrophobicContact CB-CE2 4.31Å; R558-Y561 PolarHBondContact O-N 3.48Å; E559-Y561 VanDerWaalsContact C-N 3.27Å; E559-Y561 PolarHBondContact O-N 3.41Å
562	L	83.4	Confident	83.2	Confident	23 Å²	23	80.1 Å²	80.1	12%	0.12	40%	0.397	C	S	.	.	S	Bend	trans	-90.7	134.1	-169.6	-60.5	-178.6	0	0	0	112.2	F448 L557 E559 F566 R567 L570	F448-L562 HydrophobicContact CE2-CD2 4.38Å; L557-L562 HydrophobicContact CB-CD1 4.06Å; L557-L562 HydrophobicContact CD1-CD1 4.46Å; E559-L562 PolarHBondContact O-N 2.76Å; L562-F566 HydrophobicContact CB-CB 3.99Å; L562-F566 HydrophobicContact CD1-CB 4.3Å; L562-R567 HydrophobicContact CB-CG 4.41Å; L562-R567 PolarHBondContact O-NE 2.92Å; L562-R567 PolarHBondContact O-NH2 3.42Å; L562-L570 HydrophobicContact CD1-CD1 3.5Å
563	P	82.5	Confident	83	Confident	73 Å²	73	82.8 Å²	82.8	47%	0.474	41%	0.409	S	S	.	.			trans	-55.9	155.6	170.8	-28.8	34.4	0	0	0	114.4	R565 F566 R567	P563-R565 VanDerWaalsContact C-N 3.27Å; P563-R565 HydrophobicContact CB-CG 4.25Å; P563-R565 PolarHBondContact O-N 3.27Å; P563-R565 VanDerWaalsContact O-N 3.08Å; P563-F566 HydrophobicContact CB-CD2 4.2Å; P563-F566 HydrophobicContact CG-CD2 4.21Å; P563-F566 HydrophobicContact CG-CE2 4.45Å; P563-F566 PolarHBondContact O-N 2.84Å; P563-R567 PolarHBondContact O-N 3.35Å
564	R	79.1	Confident	82.8	Confident	185 Å²	185	86.8 Å²	86.8	70%	0.698	42%	0.419	S	S	*	.	H	α-helix	trans	-42.9	-48.2	-178	-73.2	179	176.4	163.3	-5.5	113.6	D397 F566 R567 S568	D397-R564 IonicContact OD1-NH1 3.97Å; D397-R564 PolarHBondContact OD1-NH1 3.29Å; D397-R564 IonicContact OD2-NH1 2.64Å; D397-R564 PolarHBondContact OD2-NH1 3.26Å; R564-F566 VanDerWaalsContact C-N 3.29Å; R564-F566 PolarHBondContact O-N 3.08Å; R564-R567 PolarHBondContact O-N 3.13Å; R564-R567 VanDerWaalsContact O-N 3.13Å; R564-S568 PolarHBondContact O-N 3.26Å; R564-S568 PolarHBondContact O-OG 2.75Å
565	R	80	Confident	82.7	Confident	90 Å²	90	86 Å²	86	34%	0.34	43%	0.427	S	S	.	.	H	α-helix	trans	-55.1	-35.9	178.5	52.7	170.7	-78.9	-122.1	-4.1	114.5	P563 S568 I569	P563-R565 VanDerWaalsContact C-N 3.27Å; P563-R565 HydrophobicContact CB-CG 4.25Å; P563-R565 PolarHBondContact O-N 3.27Å; P563-R565 VanDerWaalsContact O-N 3.08Å; R565-S568 PolarHBondContact O-OG 3.38Å; R565-I569 VanDerWaalsContact O-CD1 3.3Å; R565-I569 WeakPolarHBondContact O-CD1 3.2Å; R565-I569 VanDerWaalsContact O-CG1 3.26Å; R565-I569 WeakPolarHBondContact O-CG1 3.31Å; R565-I569 PolarHBondContact O-N 2.92Å
566	F	83.2	Confident	82.9	Confident	79 Å²	79	86.2 Å²	86.2	35%	0.346	43%	0.432	S	S	.	.	H	α-helix	trans	-79.5	-38.8	176.7	-68.3	-78.1	0	0	0	111.5	L562 P563 R564 S568 I569 L570	L562-F566 HydrophobicContact CB-CB 3.99Å; L562-F566 HydrophobicContact CD1-CB 4.3Å; P563-F566 HydrophobicContact CB-CD2 4.2Å; P563-F566 HydrophobicContact CG-CD2 4.21Å; P563-F566 HydrophobicContact CG-CE2 4.45Å; P563-F566 PolarHBondContact O-N 2.84Å; R564-F566 VanDerWaalsContact C-N 3.29Å; R564-F566 PolarHBondContact O-N 3.08Å; F566-S568 VanDerWaalsContact C-N 3.31Å; F566-S568 PolarHBondContact O-N 3.43Å; F566-I569 PolarHBondContact O-N 2.88Å; F566-L570 WeakPolarHBondContact O-CG 3.42Å; F566-L570 PolarHBondContact O-N 3.2Å
567	R	84.4	Confident	83.2	Confident	110 Å²	110	84 Å²	84	42%	0.415	42%	0.422	S	S	.	.	H	α-helix	trans	-60.5	-39.7	175.2	-55.9	-170.6	-170.4	-175	-1.4	111.8	E559 E560 L562 P563 R564 L570 A571	E559-R567 HydrophobicContact CB-CG 4.28Å; E559-R567 VanDerWaalsContact O-CZ 3.25Å; E559-R567 PolarHBondContact O-NE 3.16Å; E559-R567 PolarHBondContact O-NH2 3.11Å; E560-R567 PolarHBondContact O-NH2 3.23Å; L562-R567 HydrophobicContact CB-CG 4.41Å; L562-R567 PolarHBondContact O-NE 2.92Å; L562-R567 PolarHBondContact O-NH2 3.42Å; P563-R567 PolarHBondContact O-N 3.35Å; R564-R567 PolarHBondContact O-N 3.13Å; R564-R567 VanDerWaalsContact O-N 3.13Å; R567-L570 PolarHBondContact O-N 3.47Å; R567-A571 WeakPolarHBondContact O-CB 3.4Å; R567-A571 PolarHBondContact O-N 3.28Å
568	S	80.4	Confident	83.4	Confident	72 Å²	72	84 Å²	84	50%	0.503	43%	0.432	S	S	.	.	H	α-helix	trans	-66.5	-39.9	176.6	61.9	0	0	0	0	112.2	R564 R565 F566 A571 A572	R564-S568 PolarHBondContact O-N 3.26Å; R564-S568 PolarHBondContact O-OG 2.75Å; R565-S568 PolarHBondContact O-OG 3.38Å; F566-S568 VanDerWaalsContact C-N 3.31Å; F566-S568 PolarHBondContact O-N 3.43Å; S568-A571 PolarHBondContact O-N 2.93Å; S568-A572 WeakPolarHBondContact O-CB 3.44Å; S568-A572 PolarHBondContact O-N 3.24Å
569	I	83.5	Confident	83.4	Confident	84 Å²	84	82.2 Å²	82.2	43%	0.431	44%	0.438	S	S	.	.	H	α-helix	trans	-63.4	-48.2	174	-67.4	165.5	0	0	0	111	R565 F566 A571 A572 Q573	R565-I569 VanDerWaalsContact O-CD1 3.3Å; R565-I569 WeakPolarHBondContact O-CD1 3.2Å; R565-I569 VanDerWaalsContact O-CG1 3.26Å; R565-I569 WeakPolarHBondContact O-CG1 3.31Å; R565-I569 PolarHBondContact O-N 2.92Å; F566-I569 PolarHBondContact O-N 2.88Å; I569-A571 VanDerWaalsContact C-N 3.34Å; I569-A571 PolarHBondContact O-N 3.5Å; I569-A572 PolarHBondContact O-N 2.96Å; I569-Q573 WeakPolarHBondContact O-CG 3.36Å; I569-Q573 PolarHBondContact O-N 3.33Å
570	L	83.3	Confident	83.3	Confident	35 Å²	35	82.1 Å²	82.1	18%	0.183	45%	0.446	C	S	.	.	H	α-helix	trans	-66.5	-33.3	178.1	-70.2	173.8	0	0	0	112.5	E559 L562 F566 R567 R574	E559-L570 HydrophobicContact CG-CD1 4.18Å; E559-L570 WeakPolarHBondContact OE1-CB 3.5Å; L562-L570 HydrophobicContact CD1-CD1 3.5Å; F566-L570 WeakPolarHBondContact O-CG 3.42Å; F566-L570 PolarHBondContact O-N 3.2Å; R567-L570 PolarHBondContact O-N 3.47Å; L570-R574 WeakPolarHBondContact O-CB 3.44Å; L570-R574 WeakPolarHBondContact O-CG 3.41Å; L570-R574 PolarHBondContact O-N 3.44Å; L570-R574 PolarHBondContact O-NE 2.95Å
571	A	84.6	Confident	83.1	Confident	45 Å²	45	77.7 Å²	77.7	37%	0.372	44%	0.437	S	S	.	.	H	α-helix	trans	-66.3	-43.8	170.8	0	0	0	0	0	111.9	R567 S568 I569 R574 A575	R567-A571 WeakPolarHBondContact O-CB 3.4Å; R567-A571 PolarHBondContact O-N 3.28Å; S568-A571 PolarHBondContact O-N 2.93Å; I569-A571 VanDerWaalsContact C-N 3.34Å; I569-A571 PolarHBondContact O-N 3.5Å; A571-R574 PolarHBondContact O-N 3.34Å; A571-A575 WeakPolarHBondContact O-CB 3.25Å; A571-A575 PolarHBondContact O-N 2.83Å
572	A	84.9	Confident	82.8	Confident	48 Å²	48	77.3 Å²	77.3	40%	0.397	45%	0.449	S	S	.	.	H	α-helix	trans	-64.6	-40.8	175.8	0	0	0	0	0	112.2	S568 I569 A575 N576	S568-A572 WeakPolarHBondContact O-CB 3.44Å; S568-A572 PolarHBondContact O-N 3.24Å; I569-A572 PolarHBondContact O-N 2.96Å; A572-A575 PolarHBondContact O-N 2.87Å; A572-N576 WeakPolarHBondContact O-CB 3.41Å; A572-N576 PolarHBondContact O-N 2.95Å; A572-N576 PolarHBondContact O-ND2 3.47Å
573	Q	84.5	Confident	82.1	Confident	113 Å²	113	80.3 Å²	80.3	53%	0.528	47%	0.472	S	S	.	.	H	α-helix	trans	-61.6	-45.1	173.8	-74.5	176.9	-6.3	0	0	111.8	I569 N576 A577	I569-Q573 WeakPolarHBondContact O-CG 3.36Å; I569-Q573 PolarHBondContact O-N 3.33Å; Q573-N576 PolarHBondContact O-N 2.95Å; Q573-A577 WeakPolarHBondContact O-CB 3.47Å; Q573-A577 PolarHBondContact O-N 2.66Å
574	R	84.3	Confident	81.1	Confident	125 Å²	125	82.1 Å²	82.1	47%	0.472	48%	0.477	S	S	.	.	H	α-helix	trans	-63.7	-39.5	174.7	-75.5	174.1	-65.6	173.1	0.8	112.5	E559 L570 A571 A577 A578	E559-R574 IonicContact OE1-CZ 3.4Å; E559-R574 IonicContact OE1-NH1 3.83Å; E559-R574 IonicContact OE1-NH2 2.71Å; E559-R574 PolarHBondContact OE1-NH2 3.22Å; E559-R574 IonicContact OE2-CZ 3.17Å; E559-R574 IonicContact OE2-NH1 2.85Å; E559-R574 PolarHBondContact OE2-NH1 3.38Å; E559-R574 IonicContact OE2-NH2 2.77Å; E559-R574 PolarHBondContact OE2-NH2 3.08Å; L570-R574 WeakPolarHBondContact O-CB 3.44Å; L570-R574 WeakPolarHBondContact O-CG 3.41Å; L570-R574 PolarHBondContact O-N 3.44Å; L570-R574 PolarHBondContact O-NE 2.95Å; A571-R574 PolarHBondContact O-N 3.34Å; R574-A577 PolarHBondContact O-N 3.09Å; R574-A578 WeakPolarHBondContact O-CB 3.47Å; R574-A578 PolarHBondContact O-N 2.86Å
575	A	84.5	Confident	80.1	Confident	59 Å²	59	78.1 Å²	78.1	49%	0.488	48%	0.477	S	S	.	.	H	α-helix	trans	-63.8	-43	175	0	0	0	0	0	111.9	A571 A572 A578 A579	A571-A575 WeakPolarHBondContact O-CB 3.25Å; A571-A575 PolarHBondContact O-N 2.83Å; A572-A575 PolarHBondContact O-N 2.87Å; A575-A578 PolarHBondContact O-N 3.5Å; A575-A579 WeakPolarHBondContact O-CB 3.33Å; A575-A579 PolarHBondContact O-N 3.34Å
576	N	83.6	Confident	79	Confident	116 Å²	116	81 Å²	81	62%	0.62	50%	0.5	S	S	*	.	H	α-helix	trans	-65.3	-42	175.8	-70.4	-14.8	0	0	0	112	A572 Q573 A579 A580	A572-N576 WeakPolarHBondContact O-CB 3.41Å; A572-N576 PolarHBondContact O-N 2.95Å; A572-N576 PolarHBondContact O-ND2 3.47Å; Q573-N576 PolarHBondContact O-N 2.95Å; N576-A579 PolarHBondContact O-N 3.3Å; N576-A580 WeakPolarHBondContact O-CB 3.28Å; N576-A580 PolarHBondContact O-N 2.84Å
577	A	85.4	Confident	77.2	Confident	61 Å²	61	85.8 Å²	85.8	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-41.1	175.5	0	0	0	0	0	112.2	Q573 R574 A580 A581	Q573-A577 WeakPolarHBondContact O-CB 3.47Å; Q573-A577 PolarHBondContact O-N 2.66Å; R574-A577 PolarHBondContact O-N 3.09Å; A577-A580 PolarHBondContact O-N 2.86Å; A577-A581 WeakPolarHBondContact O-CB 3.04Å; A577-A581 PolarHBondContact O-N 3.1Å
578	A	85.2	Confident	75.1	Confident	64 Å²	64	84.7 Å²	84.7	53%	0.529	54%	0.544	S	S	.	.	H	α-helix	trans	-65	-38.6	174	0	0	0	0	0	112.3	R574 A575 A582	R574-A578 WeakPolarHBondContact O-CB 3.47Å; R574-A578 PolarHBondContact O-N 2.86Å; A575-A578 PolarHBondContact O-N 3.5Å; A578-A582 WeakPolarHBondContact O-CB 3.43Å; A578-A582 PolarHBondContact O-N 3.46Å
579	A	83.3	Confident	73.5	Confident	60 Å²	60	86.5 Å²	86.5	50%	0.496	56%	0.556	S	S	.	*	H	α-helix	trans	-66.5	-40.3	174.7	0	0	0	0	0	112.3	A575 N576 A582 S583	A575-A579 WeakPolarHBondContact O-CB 3.33Å; A575-A579 PolarHBondContact O-N 3.34Å; N576-A579 PolarHBondContact O-N 3.3Å; A579-A582 PolarHBondContact O-N 2.81Å; A579-S583 PolarHBondContact O-N 2.82Å
580	A	80.9	Confident	71.3	Confident	48 Å²	48	89.5 Å²	89.5	40%	0.397	58%	0.578	S	S	.	*	H	α-helix	trans	-62	-50.9	174	0	0	0	0	0	111.3	N576 A577 A582 S583 D584	N576-A580 WeakPolarHBondContact O-CB 3.28Å; N576-A580 PolarHBondContact O-N 2.84Å; A577-A580 PolarHBondContact O-N 2.86Å; A580-A582 VanDerWaalsContact C-N 3.28Å; A580-A582 PolarHBondContact O-N 2.96Å; A580-S583 WeakPolarHBondContact O-CA 3.47Å; A580-S583 PolarHBondContact O-N 3.02Å; A580-S583 PolarHBondContact O-OG 2.99Å; A580-D584 PolarHBondContact O-N 3.36Å
581	A	81.4	Confident	69.3	Low	70 Å²	70	90.9 Å²	90.9	58%	0.579	60%	0.601	S	S	*	*	H	α-helix	trans	-60.3	-35.1	177.4	0	0	0	0	0	113.1	A577	A577-A581 WeakPolarHBondContact O-CB 3.04Å; A577-A581 PolarHBondContact O-N 3.1Å
582	A	76	Confident	67.4	Low	64 Å²	64	98 Å²	98	53%	0.529	63%	0.626	S	S	.	*	H	α-helix	trans	-65.9	-39.5	171.3	0	0	0	0	0	111.9	A578 A579 A580 S585	A578-A582 WeakPolarHBondContact O-CB 3.43Å; A578-A582 PolarHBondContact O-N 3.46Å; A579-A582 PolarHBondContact O-N 2.81Å; A580-A582 VanDerWaalsContact C-N 3.28Å; A580-A582 PolarHBondContact O-N 2.96Å; A582-S585 WeakPolarHBondContact O-CB 3.28Å; A582-S585 PolarHBondContact O-N 2.83Å; A582-S585 PolarHBondContact O-OG 3.17Å
583	S	69.3	Low	65.6	Low	86 Å²	86	104.1 Å²	104.1	60%	0.601	65%	0.646	S	S	*	*	H	α-helix	trans	-72.5	-31.5	-177.6	72.3	0	0	0	0	114.9	A579 A580 S585	A579-S583 PolarHBondContact O-N 2.82Å; A580-S583 WeakPolarHBondContact O-CA 3.47Å; A580-S583 PolarHBondContact O-N 3.02Å; A580-S583 PolarHBondContact O-OG 2.99Å; S583-S585 VanDerWaalsContact C-N 3.28Å; S583-S585 PolarHBondContact O-N 3.21Å
584	D	60.9	Low	63.9	Low	110 Å²	110	108.4 Å²	108.4	59%	0.588	66%	0.663	S	S	*	*	H	α-helix	trans	-74.7	-16.8	176.6	-88	-30.3	0	0	0	113.3	A580 D586 K587	A580-D584 PolarHBondContact O-N 3.36Å; D584-D586 PolarHBondContact O-N 3.39Å; D584-K587 PolarHBondContact O-N 3.4Å
585	S	58.4	Low	61.7	Low	101 Å²	101	111.1 Å²	111.1	71%	0.706	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-18.5	-176.9	70.7	0	0	0	0	114.7	A582 S583	A582-S585 WeakPolarHBondContact O-CB 3.28Å; A582-S585 PolarHBondContact O-N 2.83Å; A582-S585 PolarHBondContact O-OG 3.17Å; S583-S585 VanDerWaalsContact C-N 3.28Å; S583-S585 PolarHBondContact O-N 3.21Å
586	D	56.3	Low	59.4	Low	151 Å²	151	112.6 Å²	112.6	81%	0.807	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-3.3	-176.5	-130.6	-1.8	0	0	0	113.6	D584	D584-D586 PolarHBondContact O-N 3.39Å
587	K	46.6	Very low	57	Low	179 Å²	179	113.3 Å²	113.3	78%	0.778	69%	0.694	S	S	*	*			trans	-146.5	85.8	179.1	-71.3	-175.2	-174.6	158.6	0	114.2	D584 S589	D584-K587 PolarHBondContact O-N 3.4Å; K587-S589 PolarHBondContact O-N 3.13Å
588	G	39	Very low	54.5	Low	88 Å²	88	116.7 Å²	116.7	91%	0.907	71%	0.708	S	S	*	*			trans	-64.6	101.5	171.6	0	0	0	0	0	113.8
589	S	46.8	Very low	52	Low	109 Å²	109	117 Å²	117	76%	0.762	71%	0.71	S	S	*	*			trans	-160.5	94	160.4	-177.9	0	0	0	0	112.4	K587	K587-S589 PolarHBondContact O-N 3.13Å
590	V	38.8	Very low	49.6	Very low	147 Å²	147	122.7 Å²	122.7	89%	0.891	73%	0.729	S	S	*	*			trans	12.7	114.3	154.8	-172.3	0	0	0	0	117.5
591	G	41.6	Very low	47.4	Very low	65 Å²	65	128.3 Å²	128.3	67%	0.67	75%	0.747	S	S	*	*			trans	-167.8	106.6	163.9	0	0	0	0	0	112.3	Q593	G591-Q593 PolarHBondContact O-N 2.9Å
592	H	43.7	Very low	45.2	Very low	195 Å²	195	131.3 Å²	131.3	90%	0.903	76%	0.758	S	S	*	*			trans	-65.2	112.8	173.6	-87.6	-96.8	0	0	0	110.2
593	Q	48.1	Very low	43.4	Very low	175 Å²	175	131.7 Å²	131.7	82%	0.818	76%	0.762	S	S	*	*			trans	-88.2	114.9	166	-63.9	-172	18.8	0	0	108.6	G591	G591-Q593 PolarHBondContact O-N 2.9Å
594	K	47.3	Very low	42	Very low	204 Å²	204	136.8 Å²	136.8	89%	0.887	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-65.1	136	173.8	-71.4	-171.9	174.8	-171.2	0	109.2
595	R	38.1	Very low	41.1	Very low	182 Å²	182	137.3 Å²	137.3	69%	0.687	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-68.6	136	178.7	-171.3	171.4	178.2	-162.6	-10.8	109.9	E555 V597	E555-R595 IonicContact OE1-CZ 2.84Å; E555-R595 IonicContact OE1-NH1 3.68Å; E555-R595 IonicContact OE1-NH2 2.9Å; E555-R595 PolarHBondContact OE1-NH2 2.81Å; E555-R595 IonicContact OE2-CZ 2.7Å; E555-R595 IonicContact OE2-NH1 3.12Å; E555-R595 PolarHBondContact OE2-NH1 2.92Å; E555-R595 IonicContact OE2-NH2 3.99Å; E555-R595 PolarHBondContact OE2-NH2 3.41Å; R595-V597 PolarHBondContact O-N 3.22Å
596	A	36	Very low	40.6	Very low	89 Å²	89	139.5 Å²	139.5	74%	0.736	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-67.2	124.6	-178.4	0	0	0	0	0	111.2	V598	A596-V598 PolarHBondContact O-N 3.02Å
597	V	33.7	Very low	40.3	Very low	131 Å²	131	141.1 Å²	141.1	79%	0.794	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-71.9	117.8	170	176.3	0	0	0	0	108.2	R595 A599	R595-V597 PolarHBondContact O-N 3.22Å; V597-A599 PolarHBondContact O-N 3.24Å
598	V	34.1	Very low	40.3	Very low	132 Å²	132	139.2 Å²	139.2	80%	0.8	79%	0.788	S	S	*	*			trans	-83	91.2	168.6	179.8	0	0	0	0	107.2	A596 M600	A596-V598 PolarHBondContact O-N 3.02Å; V598-M600 PolarHBondContact O-N 3.34Å; V598-M600 VanDerWaalsContact O-N 3.1Å
599	A	30.8	Very low	40.4	Very low	70 Å²	70	141.9 Å²	141.9	58%	0.579	78%	0.782	S	S	*	*			trans	-64.6	109.4	173	0	0	0	0	0	109.2	V597 E601	V597-A599 PolarHBondContact O-N 3.24Å; A599-E601 HydrophobicContact CB-CG 4.17Å; A599-E601 PolarHBondContact O-N 3.13Å
600	M	33.5	Very low	40	Very low	180 Å²	180	140.5 Å²	140.5	89%	0.887	78%	0.777	S	S	*	*			trans	-81.2	66.1	172.4	-175.5	166.8	162.1	0	0	109.1	V598 T602	V598-M600 PolarHBondContact O-N 3.34Å; V598-M600 VanDerWaalsContact O-N 3.1Å; M600-T602 PolarHBondContact O-N 3.28Å
601	E	36	Very low	40.1	Very low	167 Å²	167	138.8 Å²	138.8	78%	0.78	77%	0.767	S	S	*	*			trans	-66.8	126.4	174.1	-65.9	-171.2	145.4	0	0	109.9	A599 A603	A599-E601 HydrophobicContact CB-CG 4.17Å; A599-E601 PolarHBondContact O-N 3.13Å; E601-A603 PolarHBondContact O-N 2.79Å
602	T	34.2	Very low	39.8	Very low	132 Å²	132	143.4 Å²	143.4	81%	0.81	78%	0.775	S	S	*	*			trans	-74.5	75.1	172.9	49.3	0	0	0	0	109.6	M600 E604	M600-T602 PolarHBondContact O-N 3.28Å; T602-E604 PolarHBondContact O-N 2.98Å
603	A	39	Very low	39.4	Very low	73 Å²	73	144.1 Å²	144.1	60%	0.603	77%	0.77	S	S	*	*			trans	-69.4	117.2	179.4	0	0	0	0	0	111.4	E601 D605	E601-A603 PolarHBondContact O-N 2.79Å; A603-D605 PolarHBondContact O-N 3.44Å; A603-D605 VanDerWaalsContact O-N 3.08Å
604	E	38.4	Very low	38.9	Very low	193 Å²	193	140.2 Å²	140.2	90%	0.902	76%	0.762	S	S	*	*			trans	-73.1	90.4	170.7	-62.2	173.7	166.9	0	0	108.6	T602 D606	T602-E604 PolarHBondContact O-N 2.98Å; E604-D606 VanDerWaalsContact C-N 3.35Å; E604-D606 PolarHBondContact O-N 3.08Å
605	D	43.2	Very low	38.5	Very low	120 Å²	120	137.9 Å²	137.9	64%	0.642	76%	0.759	S	S	*	*			trans	-70.6	79.7	-176.1	-88.6	-30.7	0	0	0	112.6	K409 A603	K409-D605 IonicContact NZ-OD2 3.56Å; K409-D605 PolarHBondContact NZ-OD2 3.14Å; A603-D605 PolarHBondContact O-N 3.44Å; A603-D605 VanDerWaalsContact O-N 3.08Å
606	D	46.7	Very low	38.6	Very low	147 Å²	147	136 Å²	136	79%	0.786	76%	0.761	S	S	*	*			trans	-76.7	148.7	173.6	-136.9	-10.1	0	0	0	112.5	E604	E604-D606 VanDerWaalsContact C-N 3.35Å; E604-D606 PolarHBondContact O-N 3.08Å
607	E	50.9	Low	38.4	Very low	186 Å²	186	136.6 Å²	136.6	87%	0.869	77%	0.766	S	S	*	*			trans	17.4	105	176.4	-65.6	-164.5	119.2	0	0	120.4
608	V	47.4	Very low	38.7	Very low	138 Å²	138	134.6 Å²	134.6	84%	0.836	76%	0.758	S	S	*	*			trans	-114.1	101.5	156.9	-72.9	0	0	0	0	113.1	A610	V608-A610 PolarHBondContact O-N 3.49Å
609	D	39.7	Very low	38.7	Very low	145 Å²	145	133.8 Å²	133.8	78%	0.775	75%	0.754	S	S	*	*			trans	-68.2	117.6	-177.6	-173	9.8	0	0	0	112.5	T611	D609-T611 PolarHBondContact O-N 2.94Å
610	A	38.9	Very low	39.1	Very low	80 Å²	80	138.3 Å²	138.3	66%	0.661	76%	0.763	S	S	*	*			trans	-80	72.2	-165.5	0	0	0	0	0	113.7	V608	V608-A610 PolarHBondContact O-N 3.49Å
611	T	40.4	Very low	39.2	Very low	110 Å²	110	136.5 Å²	136.5	68%	0.675	76%	0.757	S	S	*	*			trans	-120.9	97.1	170.4	59.2	0	0	0	0	113.6	D609	D609-T611 PolarHBondContact O-N 2.94Å
612	L	35.8	Very low	39.2	Very low	163 Å²	163	133.4 Å²	133.4	85%	0.853	75%	0.754	S	S	*	*			trans	-167.2	143.2	132.1	-105.5	162.8	0	0	0	112.4
613	R	35.9	Very low	39.3	Very low	210 Å²	210	132.8 Å²	132.8	79%	0.792	75%	0.749	S	S	*	*			trans	-132.6	107.5	168.6	-117.6	-167.7	163.4	97.3	6.5	106.2
614	S	37.3	Very low	39.2	Very low	93 Å²	93	137.7 Å²	137.7	65%	0.65	76%	0.76	S	S	*	*			trans	-172.7	103.6	165.3	51.7	0	0	0	0	111
615	D	37.7	Very low	38.9	Very low	155 Å²	155	136.9 Å²	136.9	83%	0.829	76%	0.756	S	S	*	*			trans	-172.4	144.3	159.1	-89.3	-29.8	0	0	0	106.3
616	I	41.8	Very low	38.4	Very low	141 Å²	141	140.8 Å²	140.8	72%	0.723	77%	0.767	S	S	*	*			cis	-133.3	154.7	-14.3	-94.1	152.4	0	0	0	107.1
617	A	31.1	Very low	37.7	Very low	102 Å²	102	137.2 Å²	137.2	84%	0.843	77%	0.765	S	S	*	*			trans	-138.2	92	175.1	0	0	0	0	0	112.3
618	S	39.8	Very low	36.7	Very low	90 Å²	90	136.8 Å²	136.8	63%	0.629	77%	0.769	S	S	*	*			trans	-143.1	122.2	170.7	-57.8	0	0	0	0	106.1
619	T	35.3	Very low	36	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	77%	0.77	S	S	*	*				49.4	116.1	78.4	64.6	0	0	0	0	111.7
620	E	38.5	Very low	35.6	Very low	166 Å²	166	133.2 Å²	133.2	78%	0.776	77%	0.774	S	S	*	*			cis	-156.8	169.5	22.3	-108.6	142.8	-149	0	0	113.7
621	D	34.9	Very low	35.4	Very low	142 Å²	142	135.9 Å²	135.9	76%	0.759	78%	0.781	S	S	*	*			trans	65.4	117.4	150.1	-78.8	15.1	0	0	0	125.2
622	S	36.5	Very low	35.2	Very low	102 Å²	102	135.8 Å²	135.8	71%	0.713	79%	0.785	S	S	*	*				94.7	141.9	122.6	-70.4	0	0	0	0	123.1
623	V	36.4	Very low	34.9	Very low	119 Å²	119	135.1 Å²	135.1	72%	0.721	78%	0.783	S	S	*	*			trans	92.3	95	161.6	-166.3	0	0	0	0	119.3
624	Q	36.7	Very low	34.8	Very low	175 Å²	175	134.6 Å²	134.6	82%	0.818	79%	0.789	S	S	*	*			trans	51	114.5	134.4	-57	167.5	14.3	0	0	119.8
625	H	31.6	Very low	34.6	Very low	177 Å²	177	135.6 Å²	135.6	82%	0.819	79%	0.792	S	S	*	*				90.8	159.5	66.8	-151.7	35.2	0	0	0	113.5
626	F	32.5	Very low	34.5	Very low	202 Å²	202	136.5 Å²	136.5	89%	0.886	80%	0.796	S	S	*	*			trans	68.2	139.5	-155.4	-49	-74.4	0	0	0	114.1
627	G	33.2	Very low	34.1	Very low	72 Å²	72	137.2 Å²	137.2	74%	0.742	80%	0.802	S	S	*	*			cis	-179.2	142.6	-10.3	0	0	0	0	0	111.3
628	D	29.1	Very low	34.1	Very low	177 Å²	177	139.1 Å²	139.1	95%	0.947	80%	0.798	S	S	*	*			trans	-71.9	137.7	-172.6	-58.6	-74.6	0	0	0	114.3
629	A	33.6	Very low	34	Very low	103 Å²	103	139.3 Å²	139.3	85%	0.851	80%	0.799	S	S	*	*			trans	-150.7	130.8	161.9	0	0	0	0	0	110.3
630	A	30.9	Very low	33.9	Very low	104 Å²	104	142 Å²	142	86%	0.86	80%	0.804	S	S	*	*			trans	-116.2	122.7	-177.9	0	0	0	0	0	111.8
631	V	35.4	Very low	33.7	Very low	136 Å²	136	140.9 Å²	140.9	82%	0.824	80%	0.803	S	S	*	*			trans	-142.9	100.6	169.1	-177.3	0	0	0	0	105
632	S	35.2	Very low	33.5	Very low	108 Å²	108	140.2 Å²	140.2	76%	0.755	80%	0.798	S	S	*	*				66.8	115.7	89	-165.4	0	0	0	0	113.2
633	N	28.9	Very low	33.4	Very low	150 Å²	150	139.4 Å²	139.4	80%	0.802	79%	0.789	S	S	*	*			trans	-68.8	147.8	-177.9	-56.2	-18.8	0	0	0	112.4
634	Q	35.4	Very low	33.2	Very low	198 Å²	198	137.9 Å²	137.9	93%	0.925	78%	0.783	S	S	*	*			trans	-147.1	145.2	131	-116.6	168.5	5.3	0	0	109.5
635	T	32.7	Very low	33	Very low	115 Å²	115	134.6 Å²	134.6	71%	0.706	77%	0.771	S	S	*	*			trans	-114.8	134.9	-171.7	46.9	0	0	0	0	110.3
636	D	35.4	Very low	33	Very low	173 Å²	173	129.4 Å²	129.4	93%	0.925	77%	0.766	S	S	*	*			trans	-122	141.1	164.1	-88.5	-51.9	0	0	0	110.5
637	N	32.5	Very low	33.1	Very low	157 Å²	157	128.1 Å²	128.1	84%	0.84	76%	0.762	S	S	*	*			trans	-98.4	119.9	-169.4	-63.2	-51.9	0	0	0	111.8
638	N	30.6	Very low	33.4	Very low	142 Å²	142	134 Å²	134	76%	0.759	77%	0.771	S	S	*	*			trans	-160.6	119.1	141.1	-156.1	-12.1	0	0	0	111.6
639	S	37.9	Very low	33.7	Very low	94 Å²	94	129.6 Å²	129.6	66%	0.657	75%	0.747	S	S	*	*			trans	-153	84.7	171.4	65.6	0	0	0	0	112	N641	S639-N641 PolarHBondContact O-N 2.97Å
640	Q	34	Very low	34.1	Very low	169 Å²	169	129.9 Å²	129.9	79%	0.79	73%	0.733	S	S	*	*			trans	-62.4	115.9	165.8	-66.9	169.7	-37.7	0	0	109.3	I642	Q640-I642 PolarHBondContact O-N 3.44Å; Q640-I642 VanDerWaalsContact O-N 3.1Å
641	N	33.3	Very low	34.7	Very low	144 Å²	144	131.7 Å²	131.7	77%	0.77	73%	0.728	S	S	*	*			trans	-87.3	73.1	-175.2	-85.3	-45.1	0	0	0	112.4	S639 V643	S639-N641 PolarHBondContact O-N 2.97Å; N641-V643 PolarHBondContact O-N 3.04Å
642	I	32.4	Very low	35.6	Very low	127 Å²	127	126.2 Å²	126.2	65%	0.651	69%	0.693	S	S	*	*			trans	-71.9	122.1	164.3	-62.3	174.5	0	0	0	108.6	Q640	Q640-I642 PolarHBondContact O-N 3.44Å; Q640-I642 VanDerWaalsContact O-N 3.1Å
643	V	34.4	Very low	36.6	Very low	85 Å²	85	125.2 Å²	125.2	52%	0.515	69%	0.685	S	S	.	*			trans	-132.7	78.9	179.3	-173.3	0	0	0	0	110.2	R384 N641	R384-V643 VanDerWaalsContact NH1-CG1 3.3Å; N641-V643 PolarHBondContact O-N 3.04Å
644	S	31.4	Very low	38.1	Very low	87 Å²	87	125 Å²	125	61%	0.608	68%	0.679	S	S	*	*			trans	-60.7	138.3	177.8	-43.8	0	0	0	0	112.4
645	L	32.6	Very low	39.1	Very low	106 Å²	106	118.5 Å²	118.5	56%	0.555	66%	0.664	S	S	*	*			trans	-119.2	138.1	161.3	-105.1	171.3	0	0	0	107.3	R384	R384-L645 VanDerWaalsContact NH2-CD2 3.27Å
646	G	31.3	Very low	40.7	Very low	69 Å²	69	113.5 Å²	113.5	71%	0.711	64%	0.636	S	S	*	*	S	Bend	trans	-83.9	118.8	-178.4	0	0	0	0	0	111.4
647	E	35.5	Very low	42.3	Very low	175 Å²	175	107.2 Å²	107.2	82%	0.818	60%	0.602	S	S	*	*	S	Bend	trans	179.7	77.3	155.6	-102.1	163	-137.9	0	0	106.2	L649	E647-L649 VanDerWaalsContact C-N 3.31Å; E647-L649 WeakPolarHBondContact O-CG 3.44Å; E647-L649 PolarHBondContact O-N 2.58Å
648	E	39.4	Very low	44.1	Very low	195 Å²	195	102.4 Å²	102.4	91%	0.911	59%	0.59	S	S	*	*			trans	40.2	42.4	174.2	-149.2	176.9	170	0	0	117.6	L650	E648-L650 PolarHBondContact O-N 3.48Å
649	L	35.5	Very low	46.5	Very low	85 Å²	85	98.5 Å²	98.5	45%	0.445	57%	0.573	S	S	.	*			trans	-79.8	106.2	-178.6	-67.5	-180	0	0	0	112.5	E647 L651 A689	E647-L649 VanDerWaalsContact C-N 3.31Å; E647-L649 WeakPolarHBondContact O-CG 3.44Å; E647-L649 PolarHBondContact O-N 2.58Å; L649-L651 PolarHBondContact O-N 3.14Å; L649-A689 HydrophobicContact CD1-CB 3.82Å; L649-A689 HydrophobicContact CD2-CB 4.03Å; L649-A689 HydrophobicContact CG-CB 4.39Å
650	L	41.5	Very low	48.8	Very low	109 Å²	109	98.2 Å²	98.2	57%	0.571	57%	0.569	S	S	*	*			trans	-60	102.3	165.1	-69.8	171.4	0	0	0	110.1	E648 L652 W665	E648-L650 PolarHBondContact O-N 3.48Å; L650-L652 HydrophobicContact CB-CD2 4.12Å; L650-L652 PolarHBondContact O-N 2.74Å; L650-L652 VanDerWaalsContact O-N 3.09Å; L650-W665 HydrophobicContact CD1-CH2 3.92Å; L650-W665 HydrophobicContact CD1-CZ2 3.48Å; L650-W665 VanDerWaalsContact CD1-CZ2 3.48Å
651	L	43.8	Very low	51.3	Low	141 Å²	141	90.4 Å²	90.4	74%	0.738	53%	0.533	S	S	*	.			trans	-71.5	100.2	171.8	-82.2	168.6	0	0	0	109.9	L649	L649-L651 PolarHBondContact O-N 3.14Å
652	L	55	Low	53.7	Low	21 Å²	21	85.6 Å²	85.6	11%	0.11	51%	0.509	C	S	.	.			trans	-75.5	140.8	-176.5	-58.8	-176.7	0	0	0	112.2	L650 L657 W665 F671 F694	L650-L652 HydrophobicContact CB-CD2 4.12Å; L650-L652 PolarHBondContact O-N 2.74Å; L650-L652 VanDerWaalsContact O-N 3.09Å; L652-L657 HydrophobicContact CD1-CD1 4.1Å; L652-L657 HydrophobicContact CD1-CD2 3.96Å; L652-L657 HydrophobicContact CD1-CG 4.02Å; L652-L657 HydrophobicContact CD2-CD2 3.77Å; L652-L657 HydrophobicContact CG-CD2 4.43Å; L652-W665 HydrophobicContact CD1-CZ3 3.99Å; L652-W665 HydrophobicContact CD2-CH2 4.02Å; L652-W665 HydrophobicContact CD2-CZ3 4.04Å; L652-F671 HydrophobicContact CD1-CE2 3.84Å; L652-F671 HydrophobicContact CD1-CZ 3.58Å; L652-F694 HydrophobicContact CB-CZ 4.48Å; L652-F694 HydrophobicContact CD1-CE1 4.14Å; L652-F694 HydrophobicContact CD1-CZ 4.08Å
653	P	56.3	Low	56.1	Low	88 Å²	88	84.2 Å²	84.2	57%	0.571	50%	0.503	S	S	*	.			trans	-66.9	153.2	-179.2	28.9	-35.4	0	0	0	111.6	G655 G656	P653-G655 PolarHBondContact O-N 2.92Å; P653-G656 PolarHBondContact O-N 3.22Å
654	E	58.6	Low	58.5	Low	146 Å²	146	87.3 Å²	87.3	68%	0.682	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-13.4	-168.6	-53	-164.3	114	0	0	114.7	G656 R692 L701	E654-G656 VanDerWaalsContact C-N 3.28Å; E654-R692 IonicContact OE1-NH2 3.79Å; E654-R692 PolarHBondContact OE1-NH2 3.17Å; E654-R692 VanDerWaalsContact OE1-NH2 3.15Å; E654-L701 VanDerWaalsContact O-CD2 3.29Å; E654-L701 WeakPolarHBondContact O-CD2 3.22Å
655	G	57.2	Low	61	Low	60 Å²	60	85.9 Å²	85.9	62%	0.619	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.4	170	0	0	0	0	0	114.9	P653	P653-G655 PolarHBondContact O-N 2.92Å
656	G	65.3	Low	63.4	Low	10 Å²	10	82.4 Å²	82.4	10%	0.103	48%	0.475	C	S	.	.			trans	79.6	-168.5	-169.5	0	0	0	0	0	113.3	P653 E654	P653-G656 PolarHBondContact O-N 3.22Å; E654-G656 VanDerWaalsContact C-N 3.28Å
657	L	69.4	Low	65.8	Low	41 Å²	41	84 Å²	84	22%	0.215	47%	0.471	C	S	.	.			trans	-82.3	-30.9	-172.7	-70.1	157.6	0	0	0	114	L652 C659 V661 W665 F671 G699	L652-L657 HydrophobicContact CD1-CD1 4.1Å; L652-L657 HydrophobicContact CD1-CD2 3.96Å; L652-L657 HydrophobicContact CD1-CG 4.02Å; L652-L657 HydrophobicContact CD2-CD2 3.77Å; L652-L657 HydrophobicContact CG-CD2 4.43Å; L657-C659 PolarHBondContact O-N 2.88Å; L657-V661 HydrophobicContact CD1-CG2 3.93Å; L657-W665 HydrophobicContact CD1-CE3 4.38Å; L657-W665 HydrophobicContact CD1-CZ3 3.74Å; L657-W665 HydrophobicContact CD2-CH2 3.58Å; L657-W665 HydrophobicContact CD2-CZ3 3.48Å; L657-W665 VanDerWaalsContact CD2-CZ3 3.48Å; L657-W665 HydrophobicContact CG-CZ3 4.22Å; L657-F671 HydrophobicContact CD1-CZ 4.42Å; L657-G699 PolarHBondContact N-O 3.27Å
658	G	71.7	Confident	68	Low	57 Å²	57	79.8 Å²	79.8	59%	0.588	46%	0.461	S	S	*	.	S	Bend	trans	67	8.1	-173.6	0	0	0	0	0	114.8	T698	G658-T698 CarbonylContact C-O 3.44Å
659	C	80.3	Confident	70	Confident	60 Å²	60	72.3 Å²	72.3	41%	0.405	44%	0.436	S	S	.	.	S	Bend	trans	-139.9	158.6	174.7	63.9	0	0	0	0	109.7	L657 V661 T698 G699	L657-C659 PolarHBondContact O-N 2.88Å; C659-V661 PolarHBondContact O-N 3.23Å; C659-T698 CarbonylContact C-O 3.14Å; C659-T698 PolarHBondContact N-O 3.12Å; C659-T698 CarbonylContact O-C 3.54Å; C659-T698 VanDerWaalsContact O-C 3.32Å; C659-G699 WeakPolarHBondContact O-CA 3.41Å; C659-G699 PolarHBondContact O-N 3.15Å
660	P	86.8	Confident	72.1	Confident	87 Å²	87	70 Å²	70	57%	0.565	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-55.2	138.4	177.6	-20.7	30.4	0	0	0	111.6	P662 R696 P697	P660-P662 WeakPolarHBondContact O-CD 3.4Å; P660-R696 CarbonylContact C-O 3.52Å; P660-R696 WeakPolarHBondContact CA-O 3.48Å; P660-P697 WeakPolarHBondContact CG-O 3.39Å
661	V	84.8	Confident	74.3	Confident	6 Å²	6	65 Å²	65	4%	0.036	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-63.8	120.5	-179.1	-179.4	0	0	0	0	109.1	L657 C659 F671 V685 R696	L657-V661 HydrophobicContact CD1-CG2 3.93Å; C659-V661 PolarHBondContact O-N 3.23Å; V661-F671 HydrophobicContact CG1-CB 4.41Å; V661-F671 HydrophobicContact CG1-CD1 4.12Å; V661-F671 HydrophobicContact CG1-CD2 4.03Å; V661-F671 HydrophobicContact CG1-CE1 4.37Å; V661-F671 HydrophobicContact CG1-CE2 4.32Å; V661-F671 HydrophobicContact CG1-CG 3.92Å; V661-F671 HydrophobicContact CG1-CZ 4.47Å; V661-V685 HydrophobicContact CB-CG2 4.27Å; V661-V685 HydrophobicContact CG1-CG2 4.25Å; V661-V685 HydrophobicContact CG2-CG2 3.86Å; V661-R696 HydrophobicContact CB-CG 4.32Å; V661-R696 PolarHBondContact N-O 3.3Å
662	P	84.6	Confident	76.4	Confident	42 Å²	42	62.9 Å²	62.9	27%	0.273	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-60.5	137.9	-175.8	-25.7	34.9	0	0	0	113.1	P660 E664 W665 L666	P660-P662 WeakPolarHBondContact O-CD 3.4Å; P662-E664 PolarHBondContact O-N 3.41Å; P662-W665 HydrophobicContact CB-CD2 4.32Å; P662-W665 HydrophobicContact CB-CG 4.06Å; P662-W665 HydrophobicContact CG-CD2 3.96Å; P662-W665 HydrophobicContact CG-CE3 4.37Å; P662-W665 HydrophobicContact CG-CG 4.24Å; P662-W665 HydrophobicContact CG-CZ2 4.39Å; P662-W665 WeakPolarHBondContact O-CB 3.09Å; P662-W665 PolarHBondContact O-N 2.83Å; P662-L666 PolarHBondContact O-N 3.27Å
663	D	83.5	Confident	78	Confident	98 Å²	98	65 Å²	65	52%	0.524	41%	0.405	S	S	.	.	H	α-helix	trans	-63.5	-24.9	176.3	-70.5	-33.1	0	0	0	112.4	W665 L666 T667 R696	D663-W665 VanDerWaalsContact C-N 3.25Å; D663-W665 PolarHBondContact O-N 3.44Å; D663-L666 PolarHBondContact O-N 3.39Å; D663-T667 WeakPolarHBondContact O-CB 3.09Å; D663-T667 PolarHBondContact O-N 2.9Å; D663-T667 PolarHBondContact O-OG1 3.14Å; D663-R696 IonicContact OD1-CZ 2.78Å; D663-R696 IonicContact OD1-NE 2.75Å; D663-R696 IonicContact OD1-NH2 3.7Å; D663-R696 PolarHBondContact OD1-NH2 3.27Å
664	E	83.2	Confident	79.4	Confident	150 Å²	150	62.7 Å²	62.7	70%	0.701	39%	0.39	S	S	*	.	H	α-helix	trans	-59.1	-34.8	169.8	-64	176.7	177	0	0	112.2	P662 T667 S668	P662-E664 PolarHBondContact O-N 3.41Å; E664-T667 PolarHBondContact O-N 2.84Å; E664-S668 WeakPolarHBondContact O-CB 3.4Å; E664-S668 PolarHBondContact O-N 3.31Å; E664-S668 PolarHBondContact O-OG 3.17Å
665	W	84.8	Confident	80.7	Confident	58 Å²	58	60.6 Å²	60.6	22%	0.22	38%	0.382	C	S	.	.	H	α-helix	trans	-80.6	-26.4	-179.5	-63.2	6.1	0	0	0	112.5	L650 L652 L657 P662 D663 S668 G669 A670 F671	L650-W665 HydrophobicContact CD1-CH2 3.92Å; L650-W665 HydrophobicContact CD1-CZ2 3.48Å; L650-W665 VanDerWaalsContact CD1-CZ2 3.48Å; L652-W665 HydrophobicContact CD1-CZ3 3.99Å; L652-W665 HydrophobicContact CD2-CH2 4.02Å; L652-W665 HydrophobicContact CD2-CZ3 4.04Å; L657-W665 HydrophobicContact CD1-CE3 4.38Å; L657-W665 HydrophobicContact CD1-CZ3 3.74Å; L657-W665 HydrophobicContact CD2-CH2 3.58Å; L657-W665 HydrophobicContact CD2-CZ3 3.48Å; L657-W665 VanDerWaalsContact CD2-CZ3 3.48Å; L657-W665 HydrophobicContact CG-CZ3 4.22Å; P662-W665 HydrophobicContact CB-CD2 4.32Å; P662-W665 HydrophobicContact CB-CG 4.06Å; P662-W665 HydrophobicContact CG-CD2 3.96Å; P662-W665 HydrophobicContact CG-CE3 4.37Å; P662-W665 HydrophobicContact CG-CG 4.24Å; P662-W665 HydrophobicContact CG-CZ2 4.39Å; P662-W665 WeakPolarHBondContact O-CB 3.09Å; P662-W665 PolarHBondContact O-N 2.83Å; D663-W665 VanDerWaalsContact C-N 3.25Å; D663-W665 PolarHBondContact O-N 3.44Å; W665-S668 WeakPolarHBondContact CA-OG 3.26Å; W665-S668 PolarHBondContact O-OG 3.47Å; W665-G669 PolarHBondContact O-N 2.74Å; W665-A670 HydrophobicContact CB-CB 4.44Å; W665-A670 PolarHBondContact O-N 2.98Å; W665-A670 VanDerWaalsContact O-N 3.1Å; W665-F671 HydrophobicContact CB-CD2 4.08Å; W665-F671 HydrophobicContact CE3-CD2 4.01Å; W665-F671 AromaticContact CE3-CE2 3.62Å; W665-F671 HydrophobicContact CE3-CE2 3.62Å; W665-F671 HydrophobicContact CZ3-CE2 4.1Å; W665-F671 PolarHBondContact O-N 3.46Å
666	L	83.9	Confident	81.8	Confident	33 Å²	33	60 Å²	60	17%	0.173	37%	0.367	C	S	.	.	H	α-helix	trans	-74.4	-32	167.5	-63.9	167.6	0	0	0	111.3	P662 D663 F671 T673 V685 R696	P662-L666 PolarHBondContact O-N 3.27Å; D663-L666 PolarHBondContact O-N 3.39Å; L666-F671 HydrophobicContact CD2-CB 3.52Å; L666-F671 HydrophobicContact CG-CB 4.33Å; L666-T673 HydrophobicContact CD2-CG2 4.2Å; L666-V685 HydrophobicContact CD2-CB 4.1Å; L666-V685 HydrophobicContact CD2-CG1 3.59Å; L666-R696 VanDerWaalsContact CD1-CZ 3.46Å; L666-R696 VanDerWaalsContact CD1-NE 3.3Å
667	T	81.6	Confident	82.3	Confident	103 Å²	103	68.7 Å²	68.7	63%	0.632	41%	0.405	S	S	*	.	H	α-helix	trans	-78	-35.9	179.6	-53.7	0	0	0	0	112.5	D663 E664 G669	D663-T667 WeakPolarHBondContact O-CB 3.09Å; D663-T667 PolarHBondContact O-N 2.9Å; D663-T667 PolarHBondContact O-OG1 3.14Å; E664-T667 PolarHBondContact O-N 2.84Å; T667-G669 VanDerWaalsContact C-N 3.28Å
668	S	80.3	Confident	82.8	Confident	86 Å²	86	72.7 Å²	72.7	60%	0.601	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-14.1	172.6	53.9	0	0	0	0	113.8	E664 W665 A670	E664-S668 WeakPolarHBondContact O-CB 3.4Å; E664-S668 PolarHBondContact O-N 3.31Å; E664-S668 PolarHBondContact O-OG 3.17Å; W665-S668 WeakPolarHBondContact CA-OG 3.26Å; W665-S668 PolarHBondContact O-OG 3.47Å; S668-A670 VanDerWaalsContact C-N 3.32Å
669	G	82	Confident	82.9	Confident	37 Å²	37	72.4 Å²	72.4	38%	0.381	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	8.1	-177	0	0	0	0	0	114.7	W665 T667 F671 A688	W665-G669 PolarHBondContact O-N 2.74Å; T667-G669 VanDerWaalsContact C-N 3.28Å; G669-F671 PolarHBondContact O-N 2.99Å; G669-A688 VanDerWaalsContact O-CB 3.29Å; G669-A688 WeakPolarHBondContact O-CB 3.38Å
670	A	79.4	Confident	82.7	Confident	36 Å²	36	75.7 Å²	75.7	30%	0.298	43%	0.433	S	S	.	.	S	Bend	trans	-61.1	-29.4	168.4	0	0	0	0	0	111.7	W665 S668 A688	W665-A670 HydrophobicContact CB-CB 4.44Å; W665-A670 PolarHBondContact O-N 2.98Å; W665-A670 VanDerWaalsContact O-N 3.1Å; S668-A670 VanDerWaalsContact C-N 3.32Å; A670-A688 WeakPolarHBondContact O-CB 3.48Å; A670-A688 PolarHBondContact O-N 2.81Å
671	F	87.7	Confident	82.3	Confident	6 Å²	6	76 Å²	76	3%	0.026	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.4	167.9	-79.2	-100	0	0	0	111.3	L652 L657 V661 W665 L666 G669 V685 M686 E687 F694	L652-F671 HydrophobicContact CD1-CE2 3.84Å; L652-F671 HydrophobicContact CD1-CZ 3.58Å; L657-F671 HydrophobicContact CD1-CZ 4.42Å; V661-F671 HydrophobicContact CG1-CB 4.41Å; V661-F671 HydrophobicContact CG1-CD1 4.12Å; V661-F671 HydrophobicContact CG1-CD2 4.03Å; V661-F671 HydrophobicContact CG1-CE1 4.37Å; V661-F671 HydrophobicContact CG1-CE2 4.32Å; V661-F671 HydrophobicContact CG1-CG 3.92Å; V661-F671 HydrophobicContact CG1-CZ 4.47Å; W665-F671 HydrophobicContact CB-CD2 4.08Å; W665-F671 HydrophobicContact CE3-CD2 4.01Å; W665-F671 AromaticContact CE3-CE2 3.62Å; W665-F671 HydrophobicContact CE3-CE2 3.62Å; W665-F671 HydrophobicContact CZ3-CE2 4.1Å; W665-F671 PolarHBondContact O-N 3.46Å; L666-F671 HydrophobicContact CD2-CB 3.52Å; L666-F671 HydrophobicContact CG-CB 4.33Å; G669-F671 PolarHBondContact O-N 2.99Å; F671-V685 HydrophobicContact CB-CB 4.43Å; F671-V685 HydrophobicContact CD1-CB 3.98Å; F671-V685 HydrophobicContact CD1-CG2 3.65Å; F671-V685 HydrophobicContact CE1-CG2 4.19Å; F671-M686 CarbonylContact C-O 3.57Å; F671-M686 VanDerWaalsContact CA-O 3.3Å; F671-M686 WeakPolarHBondContact CA-O 3.45Å; F671-E687 HydrophobicContact CD1-CB 4.36Å; F671-E687 HydrophobicContact CE1-CB 3.87Å; F671-E687 HydrophobicContact CZ-CB 4Å; F671-E687 HydrophobicContact CZ-CG 4.31Å; F671-F694 HydrophobicContact CE1-CB 4.01Å; F671-F694 HydrophobicContact CE1-CD1 4.35Å; F671-F694 AromaticContact CE1-CD2 3.57Å; F671-F694 HydrophobicContact CE1-CD2 3.57Å; F671-F694 HydrophobicContact CE1-CE2 4.02Å; F671-F694 AromaticContact CE1-CG 3.76Å; F671-F694 HydrophobicContact CE1-CG 3.76Å; F671-F694 HydrophobicContact CZ-CD1 4.47Å; F671-F694 HydrophobicContact CZ-CD2 4.16Å; F671-F694 HydrophobicContact CZ-CE1 4.49Å; F671-F694 HydrophobicContact CZ-CE2 4.2Å; F671-F694 HydrophobicContact CZ-CG 4.3Å; F671-F694 HydrophobicContact CZ-CZ 4.36Å
672	L	87.9	Confident	82.3	Confident	96 Å²	96	76.9 Å²	76.9	50%	0.503	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	140.1	170.6	-60.8	99.6	0	0	0	110.5	V674 V685 M686 A688	L672-V674 PolarHBondContact O-N 2.79Å; L672-V685 CarbonylContact O-C 3.32Å; L672-V685 VanDerWaalsContact O-CA 3.24Å; L672-V685 WeakPolarHBondContact O-CA 3.44Å; L672-M686 PolarHBondContact N-O 3.09Å; L672-M686 PolarHBondContact O-N 3.19Å; L672-A688 HydrophobicContact CD1-CB 3.67Å
673	T	88.8	Confident	82.6	Confident	65 Å²	65	79.7 Å²	79.7	40%	0.399	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	125.1	171.4	41.4	0	0	0	0	111	L666 V685	L666-T673 HydrophobicContact CD2-CG2 4.2Å; T673-V685 HydrophobicContact CG2-CG1 4.44Å
674	V	86.6	Confident	82.9	Confident	40 Å²	40	77.5 Å²	77.5	24%	0.242	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	126.7	173.1	-178.9	0	0	0	0	108.4	L672 S682 L684 M686 L693	L672-V674 PolarHBondContact O-N 2.79Å; V674-S682 WeakPolarHBondContact O-CB 3.43Å; V674-S682 PolarHBondContact O-N 2.98Å; V674-S682 PolarHBondContact O-OG 3.27Å; V674-L684 HydrophobicContact CB-CB 4.07Å; V674-L684 VanDerWaalsContact CB-O 3.31Å; V674-L684 WeakPolarHBondContact CB-O 3.47Å; V674-L684 HydrophobicContact CG2-CB 4.21Å; V674-L684 PolarHBondContact N-O 2.97Å; V674-M686 HydrophobicContact CG2-CB 4.17Å; V674-L693 HydrophobicContact CG2-CD2 3.77Å
675	L	85.6	Confident	83.2	Confident	101 Å²	101	70.4 Å²	70.4	53%	0.529	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	145.4	174.5	-57.6	-177.5	0	0	0	110.5	Q680 T681	L675-Q680 CarbonylContact C-O 3.51Å; L675-Q680 VanDerWaalsContact CA-O 3.28Å; L675-Q680 WeakPolarHBondContact CA-O 3.37Å; L675-T681 HydrophobicContact CD2-CG2 4.01Å
676	T	79.8	Confident	83.4	Confident	49 Å²	49	71.1 Å²	71.1	30%	0.301	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-70.4	166.6	166.2	67.3	0	0	0	0	110.6	N678 G679 Q680	T676-N678 PolarHBondContact O-N 2.9Å; T676-N678 VanDerWaalsContact O-N 3.08Å; T676-N678 PolarHBondContact OG1-N 2.96Å; T676-G679 PolarHBondContact O-N 3.27Å; T676-Q680 PolarHBondContact N-O 2.85Å; T676-Q680 PolarHBondContact OG1-N 3.35Å; T676-Q680 PolarHBondContact OG1-O 2.94Å
677	E	76.7	Confident	83.7	Confident	192 Å²	192	69.9 Å²	69.9	90%	0.897	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-27.7	171.1	65.4	-158.1	130.1	0	0	114	G679	E677-G679 VanDerWaalsContact C-N 3.3Å; E677-G679 PolarHBondContact O-N 2.89Å
678	N	78.3	Confident	83.6	Confident	124 Å²	124	67.6 Å²	67.6	66%	0.663	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	5.8	176.9	-65.4	-52.3	0	0	0	113.6	T676 Q680	T676-N678 PolarHBondContact O-N 2.9Å; T676-N678 VanDerWaalsContact O-N 3.08Å; T676-N678 PolarHBondContact OG1-N 2.96Å; N678-Q680 HydrophobicContact CB-CG 4.43Å; N678-Q680 PolarHBondContact O-N 3.15Å
679	G	73.4	Confident	83.1	Confident	52 Å²	52	65.9 Å²	65.9	54%	0.536	39%	0.39	S	S	.	.	S	Bend	trans	73.4	9.5	-177.8	0	0	0	0	0	115	T676 E677	T676-G679 PolarHBondContact O-N 3.27Å; E677-G679 VanDerWaalsContact C-N 3.3Å; E677-G679 PolarHBondContact O-N 2.89Å
680	Q	76	Confident	83	Confident	129 Å²	129	67 Å²	67	60%	0.603	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-83.7	149.4	176.2	-60.5	176.1	-46.7	0	0	110.1	L675 T676 N678 S682	L675-Q680 CarbonylContact C-O 3.51Å; L675-Q680 VanDerWaalsContact CA-O 3.28Å; L675-Q680 WeakPolarHBondContact CA-O 3.37Å; T676-Q680 PolarHBondContact N-O 2.85Å; T676-Q680 PolarHBondContact OG1-N 3.35Å; T676-Q680 PolarHBondContact OG1-O 2.94Å; N678-Q680 HydrophobicContact CB-CG 4.43Å; N678-Q680 PolarHBondContact O-N 3.15Å; Q680-S682 PolarHBondContact O-N 2.87Å
681	T	79.5	Confident	83.1	Confident	94 Å²	94	67.3 Å²	67.3	58%	0.577	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	124.9	172.1	50.3	0	0	0	0	110.4	L675	L675-T681 HydrophobicContact CD2-CG2 4.01Å
682	S	85.3	Confident	82.9	Confident	23 Å²	23	71.1 Å²	71.1	16%	0.161	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	167.9	169.8	73.6	0	0	0	0	111.5	V674 Q680 L684	V674-S682 WeakPolarHBondContact O-CB 3.43Å; V674-S682 PolarHBondContact O-N 2.98Å; V674-S682 PolarHBondContact O-OG 3.27Å; Q680-S682 PolarHBondContact O-N 2.87Å; S682-L684 PolarHBondContact O-N 3.45Å; S682-L684 PolarHBondContact OG-N 3.29Å; S682-L684 VanDerWaalsContact OG-N 3.14Å; S682-L684 PolarHBondContact OG-O 2.89Å
683	D	89.5	Confident	83	Confident	102 Å²	102	68.4 Å²	68.4	55%	0.545	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	5.5	168.5	-69.2	-48.7	0	0	0	113.2	H695 R696 P697	D683-H695 CarbonylContact O-C 3.5Å; D683-R696 WeakPolarHBondContact O-CB 3.47Å; D683-R696 PolarHBondContact O-N 3.01Å; D683-P697 HydrophobicContact CB-CG 4.24Å
684	L	89.7	Confident	83	Confident	52 Å²	52	65.4 Å²	65.4	27%	0.272	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	140.3	174.7	-57.8	-173.6	0	0	0	111.5	V674 S682 F694 H695 V702	V674-L684 HydrophobicContact CB-CB 4.07Å; V674-L684 VanDerWaalsContact CB-O 3.31Å; V674-L684 WeakPolarHBondContact CB-O 3.47Å; V674-L684 HydrophobicContact CG2-CB 4.21Å; V674-L684 PolarHBondContact N-O 2.97Å; S682-L684 PolarHBondContact O-N 3.45Å; S682-L684 PolarHBondContact OG-N 3.29Å; S682-L684 VanDerWaalsContact OG-N 3.14Å; S682-L684 PolarHBondContact OG-O 2.89Å; L684-F694 WeakPolarHBondContact CA-O 3.47Å; L684-H695 HydrophobicContact CD2-CB 4.36Å; L684-V702 HydrophobicContact CD2-CG2 3.85Å
685	V	90.7	Very high	83.1	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.1	175.7	-68	0	0	0	0	109.5	V661 L666 F671 L672 T673 F694 R696	V661-V685 HydrophobicContact CB-CG2 4.27Å; V661-V685 HydrophobicContact CG1-CG2 4.25Å; V661-V685 HydrophobicContact CG2-CG2 3.86Å; L666-V685 HydrophobicContact CD2-CB 4.1Å; L666-V685 HydrophobicContact CD2-CG1 3.59Å; F671-V685 HydrophobicContact CB-CB 4.43Å; F671-V685 HydrophobicContact CD1-CB 3.98Å; F671-V685 HydrophobicContact CD1-CG2 3.65Å; F671-V685 HydrophobicContact CE1-CG2 4.19Å; L672-V685 CarbonylContact O-C 3.32Å; L672-V685 VanDerWaalsContact O-CA 3.24Å; L672-V685 WeakPolarHBondContact O-CA 3.44Å; T673-V685 HydrophobicContact CG2-CG1 4.44Å; V685-F694 HydrophobicContact CG2-CB 4.17Å; V685-F694 WeakPolarHBondContact CG2-O 3.34Å; V685-F694 PolarHBondContact N-O 2.95Å; V685-F694 PolarHBondContact O-N 2.93Å; V685-R696 HydrophobicContact CG1-CB 3.92Å; V685-R696 HydrophobicContact CG1-CG 4.19Å; V685-R696 HydrophobicContact CG2-CB 4.01Å
686	M	89.2	Confident	83.3	Confident	73 Å²	73	65.3 Å²	65.3	36%	0.36	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.8	-176.4	-178	179.4	-74.1	0	0	110.2	F671 L672 V674 A688 R692 L693	F671-M686 CarbonylContact C-O 3.57Å; F671-M686 VanDerWaalsContact CA-O 3.3Å; F671-M686 WeakPolarHBondContact CA-O 3.45Å; L672-M686 PolarHBondContact N-O 3.09Å; L672-M686 PolarHBondContact O-N 3.19Å; V674-M686 HydrophobicContact CG2-CB 4.17Å; M686-A688 PolarHBondContact O-N 3.09Å; M686-R692 WeakPolarHBondContact CA-O 3.28Å; M686-L693 HydrophobicContact CB-CD2 4.2Å; M686-L693 HydrophobicContact CE-CD2 3.96Å
687	E	88.8	Confident	83.6	Confident	7 Å²	7	65.9 Å²	65.9	3%	0.033	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	116.6	173.9	178.1	-179.5	-143.2	0	0	109.7	F671 A689 T690 G691 R692 F694	F671-E687 HydrophobicContact CD1-CB 4.36Å; F671-E687 HydrophobicContact CE1-CB 3.87Å; F671-E687 HydrophobicContact CZ-CB 4Å; F671-E687 HydrophobicContact CZ-CG 4.31Å; E687-A689 HydrophobicContact CG-CB 4.3Å; E687-A689 PolarHBondContact O-N 3.21Å; E687-A689 VanDerWaalsContact O-N 3.16Å; E687-T690 HydrophobicContact CG-CG2 4.3Å; E687-T690 PolarHBondContact O-N 2.84Å; E687-T690 WeakPolarHBondContact OE2-CB 3.38Å; E687-T690 WeakPolarHBondContact OE2-CG2 3.24Å; E687-T690 PolarHBondContact OE2-OG1 2.94Å; E687-G691 PolarHBondContact O-N 3.14Å; E687-R692 PolarHBondContact N-O 2.89Å; E687-F694 HydrophobicContact CB-CD2 4.12Å; E687-F694 HydrophobicContact CB-CE2 3.59Å; E687-F694 HydrophobicContact CB-CZ 4.47Å; E687-F694 HydrophobicContact CG-CE2 4.34Å; E687-F694 WeakPolarHBondContact OE2-CE2 3.41Å
688	A	81.4	Confident	83.9	Confident	55 Å²	55	59.2 Å²	59.2	46%	0.455	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.1	-172.1	0	0	0	0	0	113.5	G669 A670 L672 M686	G669-A688 VanDerWaalsContact O-CB 3.29Å; G669-A688 WeakPolarHBondContact O-CB 3.38Å; A670-A688 WeakPolarHBondContact O-CB 3.48Å; A670-A688 PolarHBondContact O-N 2.81Å; L672-A688 HydrophobicContact CD1-CB 3.67Å; M686-A688 PolarHBondContact O-N 3.09Å
689	A	69.2	Low	84.2	Confident	50 Å²	50	53.3 Å²	53.3	41%	0.413	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-31.1	-179.4	0	0	0	0	0	114	L649 E687	L649-A689 HydrophobicContact CD1-CB 3.82Å; L649-A689 HydrophobicContact CD2-CB 4.03Å; L649-A689 HydrophobicContact CG-CB 4.39Å; E687-A689 HydrophobicContact CG-CB 4.3Å; E687-A689 PolarHBondContact O-N 3.21Å; E687-A689 VanDerWaalsContact O-N 3.16Å
690	T	78.5	Confident	84.7	Confident	62 Å²	62	55.8 Å²	55.8	38%	0.38	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	-17.8	-165.7	66.2	0	0	0	0	113.6	E687 R692	E687-T690 HydrophobicContact CG-CG2 4.3Å; E687-T690 PolarHBondContact O-N 2.84Å; E687-T690 WeakPolarHBondContact OE2-CB 3.38Å; E687-T690 WeakPolarHBondContact OE2-CG2 3.24Å; E687-T690 PolarHBondContact OE2-OG1 2.94Å; T690-R692 PolarHBondContact O-N 3.07Å; T690-R692 VanDerWaalsContact OG1-CB 3.22Å; T690-R692 WeakPolarHBondContact OG1-CB 3.46Å; T690-R692 WeakPolarHBondContact OG1-CG 3.48Å; T690-R692 PolarHBondContact OG1-N 3.47Å
691	G	82.5	Confident	85	Confident	42 Å²	42	51.8 Å²	51.8	43%	0.433	29%	0.294	S	S	.	.			trans	72.5	1.9	-168.8	0	0	0	0	0	114.2	E687	E687-G691 PolarHBondContact O-N 3.14Å
692	R	84.5	Confident	85	Confident	85 Å²	85	49.7 Å²	49.7	32%	0.321	28%	0.281	S	S	.	.			trans	-65.6	138.5	178.8	-74	172.1	168.3	-177.1	-6.8	110.5	E654 M686 E687 T690 F694 L701	E654-R692 IonicContact OE1-NH2 3.79Å; E654-R692 PolarHBondContact OE1-NH2 3.17Å; E654-R692 VanDerWaalsContact OE1-NH2 3.15Å; M686-R692 WeakPolarHBondContact CA-O 3.28Å; E687-R692 PolarHBondContact N-O 2.89Å; T690-R692 PolarHBondContact O-N 3.07Å; T690-R692 VanDerWaalsContact OG1-CB 3.22Å; T690-R692 WeakPolarHBondContact OG1-CB 3.46Å; T690-R692 WeakPolarHBondContact OG1-CG 3.48Å; T690-R692 PolarHBondContact OG1-N 3.47Å; R692-F694 HydrophobicContact CB-CD2 4.27Å; R692-F694 HydrophobicContact CB-CE2 3.66Å; R692-L701 HydrophobicContact CB-CD1 3.65Å; R692-L701 HydrophobicContact CG-CD1 3.95Å
693	L	88.5	Confident	84.1	Confident	39 Å²	39	53 Å²	53	20%	0.204	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	137.5	174.9	-68.9	171.8	0	0	0	110.2	V674 M686 V702	V674-L693 HydrophobicContact CG2-CD2 3.77Å; M686-L693 HydrophobicContact CB-CD2 4.2Å; M686-L693 HydrophobicContact CE-CD2 3.96Å; L693-V702 HydrophobicContact CB-CB 4.02Å; L693-V702 PolarHBondContact O-N 3.43Å
694	F	88.4	Confident	82.4	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.009	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	145.3	176.6	-68.1	-115.4	0	0	0	109.6	L652 F671 L684 V685 E687 R692 R696 G699 H700 L701	L652-F694 HydrophobicContact CB-CZ 4.48Å; L652-F694 HydrophobicContact CD1-CE1 4.14Å; L652-F694 HydrophobicContact CD1-CZ 4.08Å; F671-F694 HydrophobicContact CE1-CB 4.01Å; F671-F694 HydrophobicContact CE1-CD1 4.35Å; F671-F694 AromaticContact CE1-CD2 3.57Å; F671-F694 HydrophobicContact CE1-CD2 3.57Å; F671-F694 HydrophobicContact CE1-CE2 4.02Å; F671-F694 AromaticContact CE1-CG 3.76Å; F671-F694 HydrophobicContact CE1-CG 3.76Å; F671-F694 HydrophobicContact CZ-CD1 4.47Å; F671-F694 HydrophobicContact CZ-CD2 4.16Å; F671-F694 HydrophobicContact CZ-CE1 4.49Å; F671-F694 HydrophobicContact CZ-CE2 4.2Å; F671-F694 HydrophobicContact CZ-CG 4.3Å; F671-F694 HydrophobicContact CZ-CZ 4.36Å; L684-F694 WeakPolarHBondContact CA-O 3.47Å; V685-F694 HydrophobicContact CG2-CB 4.17Å; V685-F694 WeakPolarHBondContact CG2-O 3.34Å; V685-F694 PolarHBondContact N-O 2.95Å; V685-F694 PolarHBondContact O-N 2.93Å; E687-F694 HydrophobicContact CB-CD2 4.12Å; E687-F694 HydrophobicContact CB-CE2 3.59Å; E687-F694 HydrophobicContact CB-CZ 4.47Å; E687-F694 HydrophobicContact CG-CE2 4.34Å; E687-F694 WeakPolarHBondContact OE2-CE2 3.41Å; R692-F694 HydrophobicContact CB-CD2 4.27Å; R692-F694 HydrophobicContact CB-CE2 3.66Å; F694-R696 PolarHBondContact O-N 2.66Å; F694-G699 WeakPolarHBondContact CD1-O 3.47Å; F694-H700 WeakPolarHBondContact CA-O 3.29Å; F694-L701 HydrophobicContact CD2-CD1 4.32Å; F694-L701 HydrophobicContact CE1-CB 4.49Å; F694-L701 HydrophobicContact CE1-CD1 4.48Å; F694-L701 HydrophobicContact CE2-CD1 3.99Å; F694-L701 HydrophobicContact CZ-CD1 4.09Å
695	H	90.1	Very high	79.9	Confident	63 Å²	63	56.1 Å²	56.1	29%	0.292	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	105.5	175.8	177.9	-106.8	0	0	0	109.6	D683 L684 P697 T698 G699 H700 V702	D683-H695 CarbonylContact O-C 3.5Å; L684-H695 HydrophobicContact CD2-CB 4.36Å; H695-P697 VanDerWaalsContact C-CD 3.5Å; H695-T698 PolarHBondContact ND1-OG1 2.82Å; H695-T698 PolarHBondContact O-N 3.44Å; H695-T698 PolarHBondContact O-OG1 3.07Å; H695-G699 WeakPolarHBondContact O-CA 3.46Å; H695-G699 PolarHBondContact O-N 3.11Å; H695-H700 PolarHBondContact N-O 3.18Å; H695-V702 HydrophobicContact CB-CG2 4.07Å
696	R	88.3	Confident	77.1	Confident	76 Å²	76	63.4 Å²	63.4	29%	0.287	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-43.6	-170.5	-178.5	-175.2	-178.8	-177.1	1.9	114	P660 V661 D663 L666 D683 V685 F694 T698	P660-R696 CarbonylContact C-O 3.52Å; P660-R696 WeakPolarHBondContact CA-O 3.48Å; V661-R696 HydrophobicContact CB-CG 4.32Å; V661-R696 PolarHBondContact N-O 3.3Å; D663-R696 IonicContact OD1-CZ 2.78Å; D663-R696 IonicContact OD1-NE 2.75Å; D663-R696 IonicContact OD1-NH2 3.7Å; D663-R696 PolarHBondContact OD1-NH2 3.27Å; L666-R696 VanDerWaalsContact CD1-CZ 3.46Å; L666-R696 VanDerWaalsContact CD1-NE 3.3Å; D683-R696 WeakPolarHBondContact O-CB 3.47Å; D683-R696 PolarHBondContact O-N 3.01Å; V685-R696 HydrophobicContact CG1-CB 3.92Å; V685-R696 HydrophobicContact CG1-CG 4.19Å; V685-R696 HydrophobicContact CG2-CB 4.01Å; F694-R696 PolarHBondContact O-N 2.66Å; R696-T698 VanDerWaalsContact C-N 3.3Å; R696-T698 PolarHBondContact O-N 3.5Å
697	P	86.5	Confident	74.3	Confident	61 Å²	61	65.7 Å²	65.7	40%	0.396	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.3	179.5	-22.4	34.1	0	0	0	115.9	P660 D683 H695	P660-P697 WeakPolarHBondContact CG-O 3.39Å; D683-P697 HydrophobicContact CB-CG 4.24Å; H695-P697 VanDerWaalsContact C-CD 3.5Å
698	T	83.8	Confident	71.6	Confident	53 Å²	53	73 Å²	73	33%	0.325	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123	-15.1	-176.7	60	0	0	0	0	114.1	G658 C659 H695 R696 H700	G658-T698 CarbonylContact C-O 3.44Å; C659-T698 CarbonylContact C-O 3.14Å; C659-T698 PolarHBondContact N-O 3.12Å; C659-T698 CarbonylContact O-C 3.54Å; C659-T698 VanDerWaalsContact O-C 3.32Å; H695-T698 PolarHBondContact ND1-OG1 2.82Å; H695-T698 PolarHBondContact O-N 3.44Å; H695-T698 PolarHBondContact O-OG1 3.07Å; R696-T698 VanDerWaalsContact C-N 3.3Å; R696-T698 PolarHBondContact O-N 3.5Å; T698-H700 PolarHBondContact O-N 2.88Å; T698-H700 VanDerWaalsContact O-N 3.14Å; T698-H700 PolarHBondContact OG1-N 2.86Å
699	G	83.9	Confident	69.4	Low	0 Å²	0	79.4 Å²	79.4	0%	0	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	13.4	-173.6	0	0	0	0	0	114.6	L657 C659 F694 H695	L657-G699 PolarHBondContact N-O 3.27Å; C659-G699 WeakPolarHBondContact O-CA 3.41Å; C659-G699 PolarHBondContact O-N 3.15Å; F694-G699 WeakPolarHBondContact CD1-O 3.47Å; H695-G699 WeakPolarHBondContact O-CA 3.46Å; H695-G699 PolarHBondContact O-N 3.11Å
700	H	83.5	Confident	67.6	Low	104 Å²	104	82.6 Å²	82.6	48%	0.481	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	138.5	173.1	-75	-54.1	0	0	0	110.6	F694 H695 T698 V702	F694-H700 WeakPolarHBondContact CA-O 3.29Å; H695-H700 PolarHBondContact N-O 3.18Å; T698-H700 PolarHBondContact O-N 2.88Å; T698-H700 VanDerWaalsContact O-N 3.14Å; T698-H700 PolarHBondContact OG1-N 2.86Å; H700-V702 PolarHBondContact O-N 3.39Å
701	L	84	Confident	65.3	Low	45 Å²	45	86.8 Å²	86.8	24%	0.236	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	121.5	169.3	179.5	67.6	0	0	0	108.8	E654 R692 F694 S703	E654-L701 VanDerWaalsContact O-CD2 3.29Å; E654-L701 WeakPolarHBondContact O-CD2 3.22Å; R692-L701 HydrophobicContact CB-CD1 3.65Å; R692-L701 HydrophobicContact CG-CD1 3.95Å; F694-L701 HydrophobicContact CD2-CD1 4.32Å; F694-L701 HydrophobicContact CE1-CB 4.49Å; F694-L701 HydrophobicContact CE1-CD1 4.48Å; F694-L701 HydrophobicContact CE2-CD1 3.99Å; F694-L701 HydrophobicContact CZ-CD1 4.09Å; L701-S703 VanDerWaalsContact C-N 3.29Å; L701-S703 PolarHBondContact O-N 3.34Å
702	V	79.7	Confident	63.2	Low	50 Å²	50	93.8 Å²	93.8	30%	0.303	51%	0.505	S	S	.	.			trans	-78.6	87.9	170.1	-179.5	0	0	0	0	107	L684 L693 H695 H700 L704	L684-V702 HydrophobicContact CD2-CG2 3.85Å; L693-V702 HydrophobicContact CB-CB 4.02Å; L693-V702 PolarHBondContact O-N 3.43Å; H695-V702 HydrophobicContact CB-CG2 4.07Å; H700-V702 PolarHBondContact O-N 3.39Å; V702-L704 PolarHBondContact O-N 3.07Å; V702-L704 VanDerWaalsContact O-N 3.14Å
703	S	66	Low	60.9	Low	93 Å²	93	94.4 Å²	94.4	65%	0.65	52%	0.522	S	S	*	.			trans	-61.6	114.1	168.9	-168	0	0	0	0	108.7	L701 A705	L701-S703 VanDerWaalsContact C-N 3.29Å; L701-S703 PolarHBondContact O-N 3.34Å; S703-A705 PolarHBondContact O-N 3.36Å; S703-A705 VanDerWaalsContact O-N 3.13Å
704	L	53.2	Low	58.4	Low	138 Å²	138	101.3 Å²	101.3	72%	0.723	55%	0.553	S	S	*	*			trans	-66	109.8	163.1	-67.3	176.8	0	0	0	106.3	V702 D706	V702-L704 PolarHBondContact O-N 3.07Å; V702-L704 VanDerWaalsContact O-N 3.14Å; L704-D706 PolarHBondContact O-N 2.87Å
705	A	38.2	Very low	56	Low	81 Å²	81	106.9 Å²	106.9	67%	0.669	59%	0.587	S	S	*	*			trans	-71.2	93.3	-173.6	0	0	0	0	0	111.1	S703 S707	S703-A705 PolarHBondContact O-N 3.36Å; S703-A705 VanDerWaalsContact O-N 3.13Å; A705-S707 PolarHBondContact O-N 3.16Å; A705-S707 VanDerWaalsContact O-N 3.12Å; A705-S707 PolarHBondContact O-OG 3.05Å
706	D	31.9	Very low	53.5	Low	152 Å²	152	110.9 Å²	110.9	81%	0.813	61%	0.61	S	S	*	*			trans	-43.8	121.8	154	-79.8	-31.1	0	0	0	107.7	L704 Q708	L704-D706 PolarHBondContact O-N 2.87Å; D706-Q708 PolarHBondContact O-N 2.98Å
707	S	29.3	Very low	51.1	Low	121 Å²	121	113.6 Å²	113.6	85%	0.846	63%	0.631	S	S	*	*	S	Bend	trans	-83.5	56	-161.7	-67.9	0	0	0	0	112.2	A705	A705-S707 PolarHBondContact O-N 3.16Å; A705-S707 VanDerWaalsContact O-N 3.12Å; A705-S707 PolarHBondContact O-OG 3.05Å
708	Q	32.5	Very low	48.6	Very low	162 Å²	162	117.9 Å²	117.9	76%	0.757	64%	0.644	S	S	*	*			trans	-136.8	121.4	178.7	-61.6	-163.2	26.7	0	0	112	D706	D706-Q708 PolarHBondContact O-N 2.98Å
709	Q	34.1	Very low	46.4	Very low	188 Å²	188	123.3 Å²	123.3	88%	0.879	67%	0.665	S	S	*	*			trans	82.9	132.6	165.3	-50.7	-176.4	29.2	0	0	117.7
710	T	31.9	Very low	44	Very low	118 Å²	118	127 Å²	127	72%	0.724	70%	0.704	S	S	*	*			trans	-133.4	138.1	-175	52.7	0	0	0	0	112
711	N	31.2	Very low	41.8	Very low	149 Å²	149	130.7 Å²	130.7	80%	0.797	72%	0.721	S	S	*	*			trans	49.4	112.1	145.9	-58.6	-14.2	0	0	0	120.6
712	Q	37.4	Very low	39.6	Very low	190 Å²	190	133.1 Å²	133.1	89%	0.888	74%	0.742	S	S	*	*			trans	-170.2	148.4	140.3	-106.1	156.3	94.8	0	0	109.7
713	S	36.7	Very low	37.6	Very low	97 Å²	97	141.1 Å²	141.1	68%	0.678	77%	0.768	S	S	*	*			cis	-174.9	130.8	-24.9	47.5	0	0	0	0	111
714	E	36.3	Very low	36.3	Very low	184 Å²	184	145.7 Å²	145.7	86%	0.86	78%	0.779	S	S	*	*			trans	-156.9	152.2	169.9	-72.8	-168.1	109.8	0	0	107.8
715	V	38.1	Very low	35.5	Very low	119 Å²	119	148.2 Å²	148.2	72%	0.721	78%	0.78	S	S	*	*			cis	-160.2	158.8	-29	-81.9	0	0	0	0	105.5
716	D	37.7	Very low	35.5	Very low	147 Å²	147	150.7 Å²	150.7	79%	0.786	78%	0.778	S	S	*	*			cis	-156.3	-170.8	-0	-138.3	-45.7	0	0	0	110.9
717	D	36.6	Very low	35.7	Very low	134 Å²	134	147.2 Å²	147.2	72%	0.717	77%	0.766	S	S	*	*			trans	89.7	135.5	143.6	-107.7	-18.9	0	0	0	123.3
718	F	34.7	Very low	36.2	Very low	151 Å²	151	147.7 Å²	147.7	66%	0.662	76%	0.764	S	S	*	*			trans	72.6	90.5	156.8	-94.5	-104.5	0	0	0	125.1
719	Q	37.6	Very low	36.4	Very low	167 Å²	167	147 Å²	147	78%	0.78	77%	0.765	S	S	*	*				57.8	135.1	124.2	-60.9	-178	4.6	0	0	122.7
720	G	33.4	Very low	36.6	Very low	78 Å²	78	143 Å²	143	80%	0.804	75%	0.753	S	S	*	*			trans	179.3	12.2	172.2	0	0	0	0	0	123.8
721	E	37.7	Very low	37	Very low	181 Å²	181	144.5 Å²	144.5	85%	0.846	75%	0.752	S	S	*	*			trans	41.4	118.2	163.5	-57.7	-167.6	140.6	0	0	123.9
722	S	37.7	Very low	37.5	Very low	96 Å²	96	144 Å²	144	67%	0.671	75%	0.745	S	S	*	*			trans	68.6	161.6	144.6	65.1	0	0	0	0	120
723	Y	36.9	Very low	37.6	Very low	218 Å²	218	142.6 Å²	142.6	86%	0.855	74%	0.736	S	S	*	*			cis	-145.7	177	16.2	1.6	-102.9	0	0	0	113.4
724	E	38.7	Very low	37.7	Very low	188 Å²	188	143.3 Å²	143.3	88%	0.879	74%	0.736	S	S	*	*			trans	-93.6	170.1	-165.7	-51.1	162.5	115.6	0	0	116
725	Y	38	Very low	37.8	Very low	191 Å²	191	144.1 Å²	144.1	75%	0.749	74%	0.737	S	S	*	*				170.1	123.1	112.6	-164.6	-114.7	0	0	0	115.7
726	E	36.9	Very low	37.9	Very low	134 Å²	134	142.4 Å²	142.4	63%	0.626	74%	0.735	S	S	*	*			trans	21.1	160.8	144	-68.5	-148.6	74.5	0	0	124.8
727	S	36.8	Very low	37.9	Very low	79 Å²	79	141.8 Å²	141.8	55%	0.552	74%	0.736	S	S	*	*			cis	-177.4	177.5	-12.9	-95.1	0	0	0	0	112.6
728	T	38.5	Very low	37.9	Very low	131 Å²	131	142 Å²	142	80%	0.804	74%	0.742	S	S	*	*			trans	91.7	124.7	159.9	68.7	0	0	0	0	118.5
729	N	37	Very low	38.1	Very low	148 Å²	148	138.9 Å²	138.9	79%	0.791	75%	0.745	S	S	*	*			cis	93.5	142	49.8	-95.7	-4.1	0	0	0	113.7
730	V	39.8	Very low	38.4	Very low	104 Å²	104	136.6 Å²	136.6	63%	0.63	74%	0.744	S	S	*	*			cis	-169	165.2	-7.3	79.4	0	0	0	0	112.5
731	E	39.9	Very low	38.5	Very low	148 Å²	148	143 Å²	143	69%	0.692	75%	0.75	S	S	*	*			trans	58.5	158.5	158.5	-68.6	-168	113.1	0	0	121.3
732	Q	40.2	Very low	38.4	Very low	138 Å²	138	143.1 Å²	143.1	65%	0.645	75%	0.751	S	S	*	*			cis	174.7	156.8	-27.6	-102.9	-178.5	44.9	0	0	107.5
733	K	40.9	Very low	38.6	Very low	162 Å²	162	143.6 Å²	143.6	70%	0.704	75%	0.752	S	S	*	*				123.9	122.1	123.2	-138.7	149.4	-172.1	156.9	0	121.4
734	T	37.8	Very low	38.7	Very low	112 Å²	112	138.2 Å²	138.2	69%	0.687	75%	0.746	S	S	*	*			trans	64.7	125.1	152.3	42.9	0	0	0	0	120.3
735	K	39.7	Very low	38.9	Very low	201 Å²	201	134.8 Å²	134.8	87%	0.874	74%	0.743	S	S	*	*				74.3	138.7	66.5	-72.1	-172.7	-178.4	-178.2	0	114.5
736	A	38.7	Very low	39.1	Very low	83 Å²	83	131.4 Å²	131.4	69%	0.686	74%	0.738	S	S	*	*			cis	-171.3	156.4	-8.2	0	0	0	0	0	114
737	V	37.6	Very low	39.3	Very low	133 Å²	133	132.7 Å²	132.7	81%	0.806	74%	0.741	S	S	*	*			trans	59	120.3	143.3	172.1	0	0	0	0	121.9
738	T	37	Very low	39.4	Very low	138 Å²	138	139 Å²	139	85%	0.847	75%	0.753	S	S	*	*				173.4	158.2	112.7	-54.2	0	0	0	0	111.1
739	A	39.1	Very low	39.4	Very low	87 Å²	87	141.5 Å²	141.5	72%	0.719	75%	0.752	S	S	*	*			trans	-127.5	-155.4	-173.1	0	0	0	0	0	113.3
740	P	43.1	Very low	39.2	Very low	118 Å²	118	140.8 Å²	140.8	77%	0.766	75%	0.753	S	S	*	*				-129.9	175.8	-80.2	38.8	-24.2	0	0	0	115.6
741	K	36.2	Very low	39.1	Very low	212 Å²	212	139.7 Å²	139.7	92%	0.922	76%	0.755	S	S	*	*			trans	-173.5	156.3	147.3	-107.3	158.9	-174.2	175.2	0	114.9
742	Q	34.9	Very low	39	Very low	184 Å²	184	138.4 Å²	138.4	86%	0.86	76%	0.763	S	S	*	*			trans	-111.4	-164.1	173.3	-54.7	-173.4	-29.4	0	0	110.2
743	P	43.9	Very low	39	Very low	106 Å²	106	136.8 Å²	136.8	69%	0.688	77%	0.767	S	S	*	*			cis	-143.6	-176.2	-5.6	41.4	-20.9	0	0	0	118.6
744	S	38.1	Very low	39	Very low	106 Å²	106	138.3 Å²	138.3	74%	0.741	77%	0.773	S	S	*	*			trans	109.6	132.7	133.4	75.6	0	0	0	0	124.6
745	S	42.5	Very low	39.2	Very low	115 Å²	115	138.5 Å²	138.5	80%	0.804	78%	0.779	S	S	*	*			trans	76.1	155.4	156.7	88.4	0	0	0	0	118.4
746	D	41.5	Very low	39.1	Very low	121 Å²	121	138.8 Å²	138.8	65%	0.647	78%	0.78	S	S	*	*			cis	-165	-159.4	-14.4	-143.9	-22.6	0	0	0	107.8
747	K	41.8	Very low	38.9	Very low	161 Å²	161	141.2 Å²	141.2	70%	0.7	79%	0.786	S	S	*	*			cis	-162.4	115.5	5.4	-139.6	166.2	-147.2	78.8	0	114.3
748	R	39.2	Very low	39.1	Very low	212 Å²	212	140.1 Å²	140.1	80%	0.8	78%	0.782	S	S	*	*			trans	41.8	136.8	144.8	-71.6	-179.7	171.6	177.6	-1.2	125.7
749	K	37.8	Very low	39.1	Very low	182 Å²	182	139.2 Å²	139.2	79%	0.791	78%	0.781	S	S	*	*			trans	75.9	158.3	135.8	-77.9	-174	175.9	-167.8	0	121.3
750	V	34.1	Very low	38.8	Very low	134 Å²	134	144.6 Å²	144.6	81%	0.812	79%	0.788	S	S	*	*			cis	-175.9	155.9	-32.7	120.3	0	0	0	0	112.2
751	A	37.5	Very low	38.4	Very low	80 Å²	80	144.6 Å²	144.6	66%	0.661	79%	0.791	S	S	*	*			trans	101	121.6	153.1	0	0	0	0	0	125
752	S	36.4	Very low	38.2	Very low	122 Å²	122	143.7 Å²	143.7	85%	0.853	79%	0.79	S	S	*	*			trans	68.3	151	142.8	77.9	0	0	0	0	120.2
753	S	42.1	Very low	38	Very low	104 Å²	104	141.5 Å²	141.5	73%	0.727	79%	0.79	S	S	*	*			cis	-164.1	153.8	17	64.1	0	0	0	0	116.3
754	K	39.1	Very low	37.3	Very low	194 Å²	194	142.7 Å²	142.7	84%	0.843	79%	0.79	S	S	*	*			trans	59.4	110.8	146.3	-78.9	-177	175.9	177	0	123.7
755	S	42.3	Very low	37	Very low	116 Å²	116	147 Å²	147	81%	0.811	80%	0.799	S	S	*	*				112	145.7	106.8	75.5	0	0	0	0	123.2
756	K	38	Very low	36.5	Very low	206 Å²	206	148.8 Å²	148.8	90%	0.896	79%	0.794	S	S	*	*			trans	85.4	147.1	166.2	-99.4	179.1	176.6	-179	0	120.5
757	V	34.4	Very low	36.2	Very low	134 Å²	134	148 Å²	148	81%	0.812	80%	0.798	S	S	*	*			trans	-169.1	160.8	-153.2	164.3	0	0	0	0	106.5
758	P	41.4	Very low	36	Very low	110 Å²	110	150 Å²	150	71%	0.714	81%	0.81	S	S	*	*			cis	-124.5	173.5	-9.2	37	-21.9	0	0	0	115.1
759	S	37.2	Very low	35.9	Very low	120 Å²	120	145.7 Å²	145.7	84%	0.839	80%	0.802	S	S	*	*				178.8	168.9	116.2	41.6	0	0	0	0	112.8
760	K	33.7	Very low	36	Very low	199 Å²	199	139.7 Å²	139.7	87%	0.865	78%	0.783	S	S	*	*			trans	-53.4	158.3	-171.7	-55.8	176.6	174.9	-177.9	0	113.9
761	S	35.4	Very low	36.6	Very low	118 Å²	118	139 Å²	139	83%	0.825	77%	0.774	S	S	*	*			cis	-145.4	168.8	24.5	-51.7	0	0	0	0	112.6
762	Q	31.2	Very low	37.2	Very low	193 Å²	193	141 Å²	141	90%	0.902	77%	0.774	S	S	*	*			trans	-96.1	131.7	-180	-66.6	165.4	-89.9	0	0	113.3
763	T	31	Very low	38	Very low	138 Å²	138	139 Å²	139	85%	0.847	75%	0.753	S	S	*	*			trans	-151.2	113	147.6	44	0	0	0	0	106.1
764	N	29.7	Very low	38.7	Very low	132 Å²	132	138.3 Å²	138.3	71%	0.706	74%	0.741	S	S	*	*			trans	-102	128	176.9	-109.3	38.2	0	0	0	109.5	E766	N764-E766 PolarHBondContact ND2-OE2 3.43Å
765	E	31.8	Very low	39.5	Very low	197 Å²	197	133.1 Å²	133.1	92%	0.921	72%	0.722	S	S	*	*			trans	-94	107.5	164.9	-61.2	168.9	129.4	0	0	107.3
766	E	31.9	Very low	40.7	Very low	152 Å²	152	130.3 Å²	130.3	71%	0.71	70%	0.702	S	S	*	*			trans	-130.6	85.5	176.1	-77.6	-177	105.4	0	0	110.8	N764	N764-E766 PolarHBondContact ND2-OE2 3.43Å
767	S	34.5	Very low	41.8	Very low	104 Å²	104	126 Å²	126	73%	0.727	69%	0.686	S	S	*	*			trans	26.7	98.7	156.8	58.4	0	0	0	0	117.4	I769	S767-I769 PolarHBondContact O-N 3.34Å; S767-I769 VanDerWaalsContact O-N 3.11Å
768	E	36.9	Very low	43	Very low	203 Å²	203	121 Å²	121	95%	0.949	65%	0.653	S	S	*	*			trans	-62.9	109	165.7	-64	176.7	151.2	0	0	109.9
769	I	38.2	Very low	44.1	Very low	121 Å²	121	122.4 Å²	122.4	62%	0.621	65%	0.65	S	S	*	*			trans	-85.3	125.7	161.2	-63.2	173.5	0	0	0	105.9	S767 N771	S767-I769 PolarHBondContact O-N 3.34Å; S767-I769 VanDerWaalsContact O-N 3.11Å; I769-N771 PolarHBondContact O-N 3.39Å
770	S	40.4	Very low	45.5	Very low	56 Å²	56	122.4 Å²	122.4	39%	0.392	64%	0.637	S	S	.	*			trans	-55.5	130.4	-176.3	-5.8	0	0	0	0	111.2	D772 D773	S770-D772 PolarHBondContact O-N 3.08Å; S770-D773 VanDerWaalsContact CB-OD2 3.25Å; S770-D773 WeakPolarHBondContact CB-OD2 3.23Å; S770-D773 WeakPolarHBondContact O-CB 3.33Å; S770-D773 PolarHBondContact O-N 3.34Å; S770-D773 VanDerWaalsContact O-N 3.08Å; S770-D773 PolarHBondContact OG-OD2 3.46Å
771	N	45.3	Very low	46.9	Very low	120 Å²	120	117 Å²	117	64%	0.642	62%	0.617	S	S	*	*	H	α-helix	trans	-60.7	-26.7	175.6	-68.8	-56.5	0	0	0	111.7	I769 D773 I774 L775	I769-N771 PolarHBondContact O-N 3.39Å; N771-D773 PolarHBondContact O-N 3.4Å; N771-I774 WeakPolarHBondContact O-CB 3.48Å; N771-I774 PolarHBondContact O-N 3.24Å; N771-I774 VanDerWaalsContact O-N 3.14Å; N771-L775 PolarHBondContact O-N 2.75Å
772	D	50.5	Low	48.2	Very low	122 Å²	122	113.3 Å²	113.3	65%	0.652	59%	0.588	S	S	*	*	H	α-helix	trans	-62.8	-37.5	175.2	-45.9	-75.7	0	0	0	112.7	S770 I774 L775 S776	S770-D772 PolarHBondContact O-N 3.08Å; D772-I774 VanDerWaalsContact C-N 3.28Å; D772-I774 PolarHBondContact O-N 2.8Å; D772-L775 PolarHBondContact O-N 2.86Å; D772-S776 WeakPolarHBondContact O-CB 3.46Å; D772-S776 PolarHBondContact O-N 2.8Å
773	D	54.1	Low	49.8	Very low	79 Å²	79	107.1 Å²	107.1	42%	0.422	57%	0.569	S	S	.	*	H	α-helix	trans	-66.1	-33.1	174.3	-71.4	-66	0	0	0	111.4	S770 N771 Q777	S770-D773 VanDerWaalsContact CB-OD2 3.25Å; S770-D773 WeakPolarHBondContact CB-OD2 3.23Å; S770-D773 WeakPolarHBondContact O-CB 3.33Å; S770-D773 PolarHBondContact O-N 3.34Å; S770-D773 VanDerWaalsContact O-N 3.08Å; S770-D773 PolarHBondContact OG-OD2 3.46Å; N771-D773 PolarHBondContact O-N 3.4Å; D773-Q777 WeakPolarHBondContact O-CB 3.33Å; D773-Q777 VanDerWaalsContact O-CG 3.28Å; D773-Q777 WeakPolarHBondContact O-CG 3.41Å; D773-Q777 PolarHBondContact O-N 2.9Å; D773-Q777 VanDerWaalsContact O-N 3.17Å; D773-Q777 PolarHBondContact O-NE2 3.15Å
774	I	54.9	Low	51.2	Low	90 Å²	90	106.2 Å²	106.2	46%	0.462	56%	0.556	S	S	.	*	H	α-helix	trans	-73	-44.6	178.7	-56.8	176.4	0	0	0	109.9	N771 D772 Q777 Q778	N771-I774 WeakPolarHBondContact O-CB 3.48Å; N771-I774 PolarHBondContact O-N 3.24Å; N771-I774 VanDerWaalsContact O-N 3.14Å; D772-I774 VanDerWaalsContact C-N 3.28Å; D772-I774 PolarHBondContact O-N 2.8Å; I774-Q777 PolarHBondContact O-N 3.23Å; I774-Q778 WeakPolarHBondContact O-CB 3.28Å; I774-Q778 PolarHBondContact O-N 2.78Å
775	L	56.7	Low	52.5	Low	86 Å²	86	102.2 Å²	102.2	45%	0.45	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-45.4	176.4	-72.6	169	0	0	0	111.8	N771 D772 Q777 Q778 E779	N771-L775 PolarHBondContact O-N 2.75Å; D772-L775 PolarHBondContact O-N 2.86Å; L775-Q777 VanDerWaalsContact C-N 3.32Å; L775-Q777 PolarHBondContact O-N 3.06Å; L775-Q778 WeakPolarHBondContact O-CB 3.34Å; L775-Q778 PolarHBondContact O-N 3.27Å; L775-Q778 VanDerWaalsContact O-N 3.13Å; L775-E779 WeakPolarHBondContact O-CB 3.28Å; L775-E779 PolarHBondContact O-N 2.82Å
776	S	66.7	Low	53.5	Low	57 Å²	57	96.8 Å²	96.8	40%	0.399	52%	0.523	S	S	.	.	H	α-helix	trans	-63.2	-37.1	177.7	-169.8	0	0	0	0	112.6	D772 Q780	D772-S776 WeakPolarHBondContact O-CB 3.46Å; D772-S776 PolarHBondContact O-N 2.8Å; S776-Q780 WeakPolarHBondContact O-CG 3.44Å; S776-Q780 PolarHBondContact O-N 2.97Å; S776-Q780 VanDerWaalsContact O-N 3.09Å
777	Q	62.2	Low	54.5	Low	116 Å²	116	97.7 Å²	97.7	54%	0.542	53%	0.527	S	S	.	.	H	α-helix	trans	-67.8	-40.2	172	-77	170.4	83.4	0	0	112.3	D773 I774 L775 E779 Q780 I781	D773-Q777 WeakPolarHBondContact O-CB 3.33Å; D773-Q777 VanDerWaalsContact O-CG 3.28Å; D773-Q777 WeakPolarHBondContact O-CG 3.41Å; D773-Q777 PolarHBondContact O-N 2.9Å; D773-Q777 VanDerWaalsContact O-N 3.17Å; D773-Q777 PolarHBondContact O-NE2 3.15Å; I774-Q777 PolarHBondContact O-N 3.23Å; L775-Q777 VanDerWaalsContact C-N 3.32Å; L775-Q777 PolarHBondContact O-N 3.06Å; Q777-E779 VanDerWaalsContact C-N 3.34Å; Q777-Q780 PolarHBondContact O-N 2.72Å; Q777-I781 WeakPolarHBondContact O-CB 3.32Å; Q777-I781 WeakPolarHBondContact O-CD1 3.37Å; Q777-I781 VanDerWaalsContact O-CG1 3.25Å; Q777-I781 WeakPolarHBondContact O-CG1 3.28Å; Q777-I781 PolarHBondContact O-N 3.35Å
778	Q	58.8	Low	55.3	Low	28 Å²	28	98.4 Å²	98.4	13%	0.131	52%	0.523	C	S	.	.	H	α-helix	trans	-62.8	-41.3	176.6	-167	-174.3	57.3	0	0	111.4	I774 L775 I781 L782 L797	I774-Q778 WeakPolarHBondContact O-CB 3.28Å; I774-Q778 PolarHBondContact O-N 2.78Å; L775-Q778 WeakPolarHBondContact O-CB 3.34Å; L775-Q778 PolarHBondContact O-N 3.27Å; L775-Q778 VanDerWaalsContact O-N 3.13Å; Q778-I781 PolarHBondContact O-N 3.28Å; Q778-L782 HydrophobicContact CG-CD1 4.29Å; Q778-L782 WeakPolarHBondContact O-CB 3.47Å; Q778-L782 WeakPolarHBondContact O-CG 3.46Å; Q778-L782 PolarHBondContact O-N 3.24Å; Q778-L797 HydrophobicContact CG-CD2 4.38Å; Q778-L797 PolarHBondContact NE2-O 2.87Å
779	E	65	Low	55.3	Low	139 Å²	139	92 Å²	92	65%	0.65	51%	0.511	S	S	*	.	H	α-helix	trans	-65.3	-43.3	176.7	-169.5	176.7	-154.9	0	0	112.1	L775 Q777 I781 L782 A783	L775-E779 WeakPolarHBondContact O-CB 3.28Å; L775-E779 PolarHBondContact O-N 2.82Å; Q777-E779 VanDerWaalsContact C-N 3.34Å; E779-I781 VanDerWaalsContact C-N 3.34Å; E779-I781 PolarHBondContact O-N 3.39Å; E779-L782 PolarHBondContact O-N 3.43Å; E779-A783 PolarHBondContact O-N 2.87Å
780	Q	67.1	Low	55.6	Low	121 Å²	121	91.8 Å²	91.8	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-63.5	-36.8	173.3	-74.3	-172.7	12.9	0	0	113	S776 Q777 Q784	S776-Q780 WeakPolarHBondContact O-CG 3.44Å; S776-Q780 PolarHBondContact O-N 2.97Å; S776-Q780 VanDerWaalsContact O-N 3.09Å; Q777-Q780 PolarHBondContact O-N 2.72Å; Q780-Q784 WeakPolarHBondContact O-CG 3.4Å; Q780-Q784 PolarHBondContact O-N 2.79Å; Q780-Q784 VanDerWaalsContact O-N 3.07Å
781	I	63.1	Low	56	Low	86 Å²	86	96 Å²	96	44%	0.441	53%	0.534	S	S	.	.	H	α-helix	trans	-67.5	-42.9	175.4	-71.1	164.9	0	0	0	110.5	Q777 Q778 E779 Q784 L785	Q777-I781 WeakPolarHBondContact O-CB 3.32Å; Q777-I781 WeakPolarHBondContact O-CD1 3.37Å; Q777-I781 VanDerWaalsContact O-CG1 3.25Å; Q777-I781 WeakPolarHBondContact O-CG1 3.28Å; Q777-I781 PolarHBondContact O-N 3.35Å; Q778-I781 PolarHBondContact O-N 3.28Å; E779-I781 VanDerWaalsContact C-N 3.34Å; E779-I781 PolarHBondContact O-N 3.39Å; I781-Q784 PolarHBondContact O-N 3.24Å; I781-L785 HydrophobicContact CG2-CD1 3.76Å; I781-L785 HydrophobicContact CG2-CG 4.36Å; I781-L785 WeakPolarHBondContact O-CB 3.43Å; I781-L785 VanDerWaalsContact O-CG 3.29Å; I781-L785 WeakPolarHBondContact O-CG 3.28Å; I781-L785 PolarHBondContact O-N 3.32Å
782	L	62.8	Low	56.6	Low	40 Å²	40	93.1 Å²	93.1	21%	0.209	52%	0.521	C	S	.	.	H	α-helix	trans	-60.5	-44.1	175.1	-79.1	162.5	0	0	0	112	Q778 E779 L785 A786 L797 L832	Q778-L782 HydrophobicContact CG-CD1 4.29Å; Q778-L782 WeakPolarHBondContact O-CB 3.47Å; Q778-L782 WeakPolarHBondContact O-CG 3.46Å; Q778-L782 PolarHBondContact O-N 3.24Å; E779-L782 PolarHBondContact O-N 3.43Å; L782-L785 PolarHBondContact O-N 3.16Å; L782-A786 WeakPolarHBondContact O-CB 3.48Å; L782-A786 PolarHBondContact O-N 3.06Å; L782-L797 HydrophobicContact CD1-CD2 4.47Å; L782-L797 HydrophobicContact CD2-CD1 3.94Å; L782-L797 HydrophobicContact CD2-CD2 3.73Å; L782-L797 HydrophobicContact CG-CD2 3.89Å; L782-L832 HydrophobicContact CD1-CD2 3.9Å; L782-L832 HydrophobicContact CD2-CD2 3.73Å; L782-L832 HydrophobicContact CG-CD2 4.49Å
783	A	64.9	Low	57	Low	63 Å²	63	91.2 Å²	91.2	52%	0.521	51%	0.51	S	S	.	.	H	α-helix	trans	-60.7	-45.3	175.7	0	0	0	0	0	112.3	E779 A786 E787	E779-A783 PolarHBondContact O-N 2.87Å; A783-A786 PolarHBondContact O-N 2.97Å; A783-E787 PolarHBondContact O-N 3.33Å
784	Q	60.4	Low	57.5	Low	119 Å²	119	91.8 Å²	91.8	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-66.9	-35.2	177.5	-72.1	177.5	24.7	0	0	112.9	Q780 I781 N788	Q780-Q784 WeakPolarHBondContact O-CG 3.4Å; Q780-Q784 PolarHBondContact O-N 2.79Å; Q780-Q784 VanDerWaalsContact O-N 3.07Å; I781-Q784 PolarHBondContact O-N 3.24Å; Q784-N788 PolarHBondContact O-N 3.26Å; Q784-N788 PolarHBondContact O-ND2 3.42Å
785	L	55.9	Low	57.8	Low	47 Å²	47	92.8 Å²	92.8	25%	0.246	52%	0.519	C	S	.	.	H	α-helix	trans	-72.9	-36.5	176.8	-70.3	171.7	0	0	0	112.1	I781 L782 E787 N788 G789 V792	I781-L785 HydrophobicContact CG2-CD1 3.76Å; I781-L785 HydrophobicContact CG2-CG 4.36Å; I781-L785 WeakPolarHBondContact O-CB 3.43Å; I781-L785 VanDerWaalsContact O-CG 3.29Å; I781-L785 WeakPolarHBondContact O-CG 3.28Å; I781-L785 PolarHBondContact O-N 3.32Å; L782-L785 PolarHBondContact O-N 3.16Å; L785-E787 VanDerWaalsContact C-N 3.32Å; L785-E787 PolarHBondContact O-N 2.9Å; L785-N788 PolarHBondContact O-N 3.42Å; L785-G789 PolarHBondContact O-N 3.23Å; L785-V792 HydrophobicContact CB-CG2 4.34Å; L785-V792 HydrophobicContact CD1-CG1 4.12Å; L785-V792 HydrophobicContact CD1-CG2 4.2Å
786	A	53.6	Low	58.3	Low	84 Å²	84	93.2 Å²	93.2	69%	0.694	53%	0.526	S	S	*	.	H	α-helix	trans	-62.2	-37.8	174.4	0	0	0	0	0	112.5	L782 A783 N788	L782-A786 WeakPolarHBondContact O-CB 3.48Å; L782-A786 PolarHBondContact O-N 3.06Å; A783-A786 PolarHBondContact O-N 2.97Å; A786-N788 VanDerWaalsContact C-N 3.33Å; A786-N788 PolarHBondContact O-N 3.3Å
787	E	52.8	Low	58.3	Low	171 Å²	171	91.4 Å²	91.4	80%	0.799	51%	0.511	S	S	*	.	H	α-helix	trans	-69.5	-27.5	177.1	-166.7	173.9	-143.7	0	0	113.1	A783 L785	A783-E787 PolarHBondContact O-N 3.33Å; L785-E787 VanDerWaalsContact C-N 3.32Å; L785-E787 PolarHBondContact O-N 2.9Å
788	N	51.3	Low	58.9	Low	119 Å²	119	86.8 Å²	86.8	64%	0.636	49%	0.49	S	S	*	.	H	α-helix	trans	-95.7	-14.7	-178.4	-73.8	-83.6	0	0	0	114.4	Q784 L785 A786 D790	Q784-N788 PolarHBondContact O-N 3.26Å; Q784-N788 PolarHBondContact O-ND2 3.42Å; L785-N788 PolarHBondContact O-N 3.42Å; A786-N788 VanDerWaalsContact C-N 3.33Å; A786-N788 PolarHBondContact O-N 3.3Å; N788-D790 VanDerWaalsContact C-N 3.28Å; N788-D790 PolarHBondContact O-N 2.81Å
789	G	36.1	Very low	59.7	Low	68 Å²	68	90.3 Å²	90.3	70%	0.701	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	17.3	176.2	0	0	0	0	0	115.2	L785	L785-G789 PolarHBondContact O-N 3.23Å
790	D	45.4	Very low	60.2	Low	116 Å²	116	86.3 Å²	86.3	62%	0.62	51%	0.511	S	S	*	.			trans	-77.3	151.6	-179.4	-98.3	-41.4	0	0	0	112.8	N788 V792	N788-D790 VanDerWaalsContact C-N 3.28Å; N788-D790 PolarHBondContact O-N 2.81Å; D790-V792 PolarHBondContact O-N 3.01Å
791	V	48.9	Very low	60.9	Low	145 Å²	145	81.3 Å²	81.3	88%	0.879	49%	0.488	S	S	*	.			trans	-76.4	108.5	179.4	-179.4	0	0	0	0	109.8	D793	V791-D793 PolarHBondContact O-N 3.35Å
792	V	56.9	Low	61.8	Low	59 Å²	59	80 Å²	80	36%	0.358	49%	0.487	S	S	.	.			trans	-67.2	125.2	-177.1	-168.4	0	0	0	0	111.6	L785 D790 L797	L785-V792 HydrophobicContact CB-CG2 4.34Å; L785-V792 HydrophobicContact CD1-CG1 4.12Å; L785-V792 HydrophobicContact CD1-CG2 4.2Å; D790-V792 PolarHBondContact O-N 3.01Å; V792-L797 HydrophobicContact CG1-CD1 3.66Å; V792-L797 HydrophobicContact CG1-CD2 4.14Å; V792-L797 HydrophobicContact CG1-CG 3.64Å
793	D	60.4	Low	62.9	Low	82 Å²	82	80.6 Å²	80.6	44%	0.439	49%	0.492	S	S	.	.			trans	-82.6	117.6	172.3	-175.6	-9.9	0	0	0	109.6	V791 N795 T796 L797	V791-D793 PolarHBondContact O-N 3.35Å; D793-N795 PolarHBondContact O-N 2.88Å; D793-N795 VanDerWaalsContact O-N 3.09Å; D793-N795 WeakPolarHBondContact OD1-CB 3.46Å; D793-N795 PolarHBondContact OD1-N 2.99Å; D793-N795 PolarHBondContact OD1-ND2 3.15Å; D793-T796 HydrophobicContact CB-CG2 4.08Å; D793-T796 WeakPolarHBondContact O-CB 3.47Å; D793-T796 PolarHBondContact O-N 2.89Å; D793-T796 PolarHBondContact O-OG1 3.44Å; D793-L797 PolarHBondContact O-N 2.87Å
794	L	63.9	Low	63.8	Low	92 Å²	92	81 Å²	81	48%	0.482	49%	0.489	S	S	.	.	H	α-helix	trans	-51.8	-31.9	177.7	-79.7	153.9	0	0	0	113	T796 L797 F798 L835	L794-T796 PolarHBondContact O-N 3.4Å; L794-L797 PolarHBondContact O-N 2.88Å; L794-F798 PolarHBondContact O-N 3.36Å; L794-L835 HydrophobicContact CD2-CD2 4.21Å
795	N	62	Low	64.8	Low	110 Å²	110	81.8 Å²	81.8	59%	0.588	49%	0.492	S	S	*	.	H	α-helix	trans	-66.5	-20.4	177.5	-60	-83.5	0	0	0	113.1	D793	D793-N795 PolarHBondContact O-N 2.88Å; D793-N795 VanDerWaalsContact O-N 3.09Å; D793-N795 WeakPolarHBondContact OD1-CB 3.46Å; D793-N795 PolarHBondContact OD1-N 2.99Å; D793-N795 PolarHBondContact OD1-ND2 3.15Å
796	T	65.5	Low	66.2	Low	96 Å²	96	84 Å²	84	59%	0.589	51%	0.507	S	S	*	.	H	α-helix	trans	-90.6	-28.6	178.4	65.4	0	0	0	0	113.1	D793 L794	D793-T796 HydrophobicContact CB-CG2 4.08Å; D793-T796 WeakPolarHBondContact O-CB 3.47Å; D793-T796 PolarHBondContact O-N 2.89Å; D793-T796 PolarHBondContact O-OG1 3.44Å; L794-T796 PolarHBondContact O-N 3.4Å
797	L	67.6	Low	67.3	Low	18 Å²	18	82.4 Å²	82.4	9%	0.094	49%	0.491	C	S	.	.	H	α-helix	trans	-79.6	-47.3	172	-67	-178.3	0	0	0	111.9	Q778 L782 V792 D793 L794 L832	Q778-L797 HydrophobicContact CG-CD2 4.38Å; Q778-L797 PolarHBondContact NE2-O 2.87Å; L782-L797 HydrophobicContact CD1-CD2 4.47Å; L782-L797 HydrophobicContact CD2-CD1 3.94Å; L782-L797 HydrophobicContact CD2-CD2 3.73Å; L782-L797 HydrophobicContact CG-CD2 3.89Å; V792-L797 HydrophobicContact CG1-CD1 3.66Å; V792-L797 HydrophobicContact CG1-CD2 4.14Å; V792-L797 HydrophobicContact CG1-CG 3.64Å; D793-L797 PolarHBondContact O-N 2.87Å; L794-L797 PolarHBondContact O-N 2.88Å; L797-L832 HydrophobicContact CD1-CD1 3.94Å
798	F	75.3	Confident	68.3	Low	19 Å²	19	79.6 Å²	79.6	8%	0.083	49%	0.488	C	S	.	.	S	Bend	trans	-130.6	77.6	-169.1	-56.2	-77.6	0	0	0	111.4	L794 G800 V801 L832 L835 Q836 L839	L794-F798 PolarHBondContact O-N 3.36Å; F798-G800 PolarHBondContact O-N 2.86Å; F798-V801 HydrophobicContact CB-CB 3.85Å; F798-V801 HydrophobicContact CB-CG2 3.68Å; F798-V801 PolarHBondContact O-N 2.89Å; F798-V801 VanDerWaalsContact O-N 3.09Å; F798-L832 HydrophobicContact CE2-CD1 3.5Å; F798-L832 HydrophobicContact CZ-CD1 3.69Å; F798-L835 HydrophobicContact CD2-CD2 3.35Å; F798-L835 HydrophobicContact CE2-CD2 3.5Å; F798-L835 HydrophobicContact CG-CD2 3.93Å; F798-L835 HydrophobicContact CZ-CD2 4.18Å; F798-Q836 HydrophobicContact CE1-CG 4.01Å; F798-Q836 HydrophobicContact CZ-CG 3.71Å; F798-L839 HydrophobicContact CB-CD1 4.48Å; F798-L839 HydrophobicContact CD1-CD1 3.38Å; F798-L839 HydrophobicContact CE1-CD1 3.69Å; F798-L839 HydrophobicContact CG-CD1 3.98Å
799	P	74.7	Confident	69.6	Low	103 Å²	103	74.4 Å²	74.4	67%	0.669	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	123.1	-178.5	24.3	-34	0	0	0	111.4
800	G	75.2	Confident	71.9	Confident	54 Å²	54	72.4 Å²	72.4	56%	0.557	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	-4.8	-179.1	0	0	0	0	0	115.5	F798	F798-G800 PolarHBondContact O-N 2.86Å
801	V	82.8	Confident	73.8	Confident	16 Å²	16	67.5 Å²	67.5	10%	0.097	41%	0.411	C	S	.	.			trans	-83.8	134	169.2	-179.9	0	0	0	0	109.8	F798 V803 V813 T814 L835 L839	F798-V801 HydrophobicContact CB-CB 3.85Å; F798-V801 HydrophobicContact CB-CG2 3.68Å; F798-V801 PolarHBondContact O-N 2.89Å; F798-V801 VanDerWaalsContact O-N 3.09Å; V801-V803 HydrophobicContact CG1-CG2 4.49Å; V801-V813 HydrophobicContact CG1-CG1 4.04Å; V801-T814 WeakPolarHBondContact CA-O 3.45Å; V801-L835 HydrophobicContact CG1-CD1 4.45Å; V801-L835 HydrophobicContact CG1-CD2 4.46Å; V801-L839 HydrophobicContact CG2-CD1 4.08Å; V801-L839 HydrophobicContact CG2-CD2 3.47Å; V801-L839 VanDerWaalsContact CG2-CD2 3.47Å; V801-L839 HydrophobicContact CG2-CG 4.38Å
802	S	82.8	Confident	75.7	Confident	58 Å²	58	62.2 Å²	62.2	41%	0.406	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	122.5	173.3	67.3	0	0	0	0	111.7	T814	S802-T814 PolarHBondContact N-O 3.35Å; S802-T814 PolarHBondContact O-N 3.48Å
803	V	85.6	Confident	77.2	Confident	54 Å²	54	59.4 Å²	59.4	33%	0.327	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.5	176.6	-172.4	0	0	0	0	109.3	V801 C811 L812 V813 I830 L835	V801-V803 HydrophobicContact CG1-CG2 4.49Å; V803-C811 HydrophobicContact CG1-CB 4.02Å; V803-L812 WeakPolarHBondContact CA-O 3.41Å; V803-V813 HydrophobicContact CG1-CG2 4.39Å; V803-V813 HydrophobicContact CG2-CG2 4.28Å; V803-I830 HydrophobicContact CG1-CD1 3.87Å; V803-L835 HydrophobicContact CG2-CD1 3.62Å
804	T	83.7	Confident	78.4	Confident	72 Å²	72	56.4 Å²	56.4	44%	0.442	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	119	-177.1	-45.7	0	0	0	0	110.5	V806 C811 L812	T804-V806 PolarHBondContact O-N 2.95Å; T804-C811 CarbonylContact O-C 3.54Å; T804-C811 WeakPolarHBondContact O-CA 3.46Å; T804-L812 PolarHBondContact N-O 3.43Å; T804-L812 PolarHBondContact O-N 3.24Å
805	E	81.3	Confident	79.5	Confident	134 Å²	134	52.6 Å²	52.6	63%	0.626	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	118.3	173.6	-170	-178.7	179.2	0	0	109.8
806	V	84.3	Confident	80.4	Confident	94 Å²	94	51.6 Å²	51.6	57%	0.57	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	-38.8	179.8	179.3	0	0	0	0	110.6	T804 V810 L812	T804-V806 PolarHBondContact O-N 2.95Å; V806-V810 PolarHBondContact N-O 3.41Å; V806-L812 HydrophobicContact CG2-CB 3.58Å
807	S	76.2	Confident	81.1	Confident	50 Å²	50	52.1 Å²	52.1	35%	0.35	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	165.6	170.8	78.4	0	0	0	0	110.5	G809 V810	S807-G809 PolarHBondContact O-N 3.2Å; S807-V810 PolarHBondContact N-O 2.8Å; S807-V810 VanDerWaalsContact N-O 3.15Å; S807-V810 PolarHBondContact O-N 2.92Å; S807-V810 VanDerWaalsContact O-O 3.08Å; S807-V810 WeakPolarHBondContact OG-CG2 3.21Å
808	P	75.2	Confident	81.7	Confident	113 Å²	113	53.3 Å²	53.3	73%	0.734	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	95.2	-178.2	-20.7	34.2	0	0	0	111.7
809	G	78.3	Confident	82.1	Confident	10 Å²	10	55.1 Å²	55.1	10%	0.103	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	113.2	-2.7	-172.8	0	0	0	0	0	115.3	S807 E824 H825	S807-G809 PolarHBondContact O-N 3.2Å; G809-E824 CarbonylContact O-C 3.55Å; G809-E824 WeakPolarHBondContact O-CA 3.5Å; G809-H825 VanDerWaalsContact C-CD2 3.43Å; G809-H825 VanDerWaalsContact C-NE2 3.35Å; G809-H825 PolarHBondContact O-CD2 2.9Å; G809-H825 VanDerWaalsContact O-CD2 3.3Å; G809-H825 PolarHBondContact O-N 3.47Å
810	V	84.4	Confident	82.7	Confident	25 Å²	25	58.8 Å²	58.8	15%	0.152	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.2	175	-171.8	0	0	0	0	110.8	V806 S807 V823 E824	V806-V810 PolarHBondContact N-O 3.41Å; S807-V810 PolarHBondContact N-O 2.8Å; S807-V810 VanDerWaalsContact N-O 3.15Å; S807-V810 PolarHBondContact O-N 2.92Å; S807-V810 VanDerWaalsContact O-O 3.08Å; S807-V810 WeakPolarHBondContact OG-CG2 3.21Å; V810-V823 WeakPolarHBondContact CA-O 3.45Å; V810-E824 HydrophobicContact CG1-CG 4.46Å; V810-E824 HydrophobicContact CG2-CG 3.98Å
811	C	84.9	Confident	83.2	Confident	14 Å²	14	58 Å²	58	10%	0.095	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	133.9	177.6	-79.5	0	0	0	0	111	V803 T804 V823 H825 I830	V803-C811 HydrophobicContact CG1-CB 4.02Å; T804-C811 CarbonylContact O-C 3.54Å; T804-C811 WeakPolarHBondContact O-CA 3.46Å; C811-V823 PolarHBondContact N-O 2.87Å; C811-V823 WeakPolarHBondContact O-CB 3.26Å; C811-V823 PolarHBondContact O-N 3.33Å; C811-H825 PolarHBondContact SG-NE2 2.73Å; C811-I830 HydrophobicContact CB-CD1 3.59Å; C811-I830 HydrophobicContact CB-CG1 4.02Å
812	L	88.2	Confident	83.4	Confident	33 Å²	33	63 Å²	63	17%	0.173	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	112.5	171.8	176.5	69.6	0	0	0	109.2	V803 T804 V806 R820 F821	V803-L812 WeakPolarHBondContact CA-O 3.41Å; T804-L812 PolarHBondContact N-O 3.43Å; T804-L812 PolarHBondContact O-N 3.24Å; V806-L812 HydrophobicContact CG2-CB 3.58Å; L812-R820 HydrophobicContact CD1-CB 3.91Å; L812-R820 HydrophobicContact CD1-CG 4.13Å; L812-F821 WeakPolarHBondContact CA-O 3.02Å
813	V	88.1	Confident	83.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	116.7	169.4	-179.4	0	0	0	0	108	V801 V803 R820 F821 V823 I830 L835 I838	V801-V813 HydrophobicContact CG1-CG1 4.04Å; V803-V813 HydrophobicContact CG1-CG2 4.39Å; V803-V813 HydrophobicContact CG2-CG2 4.28Å; V813-R820 WeakPolarHBondContact O-CA 3.4Å; V813-F821 HydrophobicContact CB-CB 4.47Å; V813-F821 PolarHBondContact N-O 3.11Å; V813-F821 PolarHBondContact O-N 2.61Å; V813-V823 HydrophobicContact CB-CG2 4.3Å; V813-V823 HydrophobicContact CG2-CG2 3.64Å; V813-I830 HydrophobicContact CG2-CD1 3.34Å; V813-L835 HydrophobicContact CG1-CD1 4.03Å; V813-L835 HydrophobicContact CG2-CD1 3.97Å; V813-I838 HydrophobicContact CB-CG2 4.44Å; V813-I838 HydrophobicContact CG1-CG2 4.05Å; V813-I838 HydrophobicContact CG2-CD1 4.17Å
814	T	85.7	Confident	83.5	Confident	20 Å²	20	66.3 Å²	66.3	12%	0.123	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123.7	169.3	-50.6	0	0	0	0	109.1	V801 S802 D819 R820	V801-T814 WeakPolarHBondContact CA-O 3.45Å; S802-T814 PolarHBondContact N-O 3.35Å; S802-T814 PolarHBondContact O-N 3.48Å; T814-D819 CarbonylContact C-O 3.56Å; T814-D819 VanDerWaalsContact CA-O 3.28Å; T814-D819 WeakPolarHBondContact CA-O 3.49Å; T814-R820 HydrophobicContact CG2-CG 4.02Å
815	K	86.9	Confident	83.4	Confident	11 Å²	11	64.3 Å²	64.3	5%	0.048	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-75.8	160.3	176.7	-73.3	-172.5	-177.7	168.2	0	111.8	N817 G818 D819 F821 I838 L839 M841	K815-N817 WeakPolarHBondContact CB-OD1 3.4Å; K815-N817 PolarHBondContact O-N 3.01Å; K815-G818 PolarHBondContact O-N 3.15Å; K815-D819 HydrophobicContact CB-CB 4.45Å; K815-D819 HydrophobicContact CD-CB 4.24Å; K815-D819 PolarHBondContact N-O 3.32Å; K815-F821 HydrophobicContact CD-CD2 4.33Å; K815-F821 HydrophobicContact CD-CE2 3.74Å; K815-F821 HydrophobicContact CG-CD2 4.33Å; K815-F821 HydrophobicContact CG-CE2 4.21Å; K815-F821 VanDerWaalsContact NZ-CE2 3.27Å; K815-I838 WeakPolarHBondContact CE-O 2.82Å; K815-I838 PolarHBondContact NZ-O 3.21Å; K815-L839 HydrophobicContact CG-CD2 4.1Å; K815-M841 PolarHBondContact NZ-O 2.75Å
816	P	81.3	Confident	82.9	Confident	90 Å²	90	61.5 Å²	61.5	58%	0.584	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-21.4	175.8	27.1	-37.2	0	0	0	114	G818	P816-G818 VanDerWaalsContact C-N 3.31Å
817	N	81.6	Confident	82.2	Confident	106 Å²	106	58.8 Å²	58.8	57%	0.567	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-13.5	173.5	68.5	-5.1	0	0	0	113.3	K815 D819	K815-N817 WeakPolarHBondContact CB-OD1 3.4Å; K815-N817 PolarHBondContact O-N 3.01Å; N817-D819 VanDerWaalsContact CG-OD2 3.25Å; N817-D819 PolarHBondContact ND2-OD2 3.34Å; N817-D819 PolarHBondContact OD1-N 3.08Å; N817-D819 PolarHBondContact OD1-OD2 3.36Å
818	G	80.3	Confident	82	Confident	43 Å²	43	62.9 Å²	62.9	44%	0.443	36%	0.362	S	S	.	.	S	Bend	trans	110.1	-12.8	179.8	0	0	0	0	0	115.2	K815 P816	K815-G818 PolarHBondContact O-N 3.15Å; P816-G818 VanDerWaalsContact C-N 3.31Å
819	D	83.4	Confident	82	Confident	57 Å²	57	59 Å²	59	31%	0.305	34%	0.344	S	S	.	.			trans	-70.9	155.6	-175	-58.4	-28.8	0	0	0	112.6	T814 K815 N817 F821 A843	T814-D819 CarbonylContact C-O 3.56Å; T814-D819 VanDerWaalsContact CA-O 3.28Å; T814-D819 WeakPolarHBondContact CA-O 3.49Å; K815-D819 HydrophobicContact CB-CB 4.45Å; K815-D819 HydrophobicContact CD-CB 4.24Å; K815-D819 PolarHBondContact N-O 3.32Å; N817-D819 VanDerWaalsContact CG-OD2 3.25Å; N817-D819 PolarHBondContact ND2-OD2 3.34Å; N817-D819 PolarHBondContact OD1-N 3.08Å; N817-D819 PolarHBondContact OD1-OD2 3.36Å; D819-F821 HydrophobicContact CB-CE2 3.79Å; D819-A843 HydrophobicContact CB-CB 3.86Å; D819-A843 VanDerWaalsContact OD2-CB 3.23Å; D819-A843 WeakPolarHBondContact OD2-CB 3.45Å
820	R	86.6	Confident	82.1	Confident	181 Å²	181	60.5 Å²	60.5	68%	0.683	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	112.9	-164	-81.6	-178.1	178.2	168.8	3.9	112.9	L812 V813 T814	L812-R820 HydrophobicContact CD1-CB 3.91Å; L812-R820 HydrophobicContact CD1-CG 4.13Å; V813-R820 WeakPolarHBondContact O-CA 3.4Å; T814-R820 HydrophobicContact CG2-CG 4.02Å
821	F	85.6	Confident	82	Confident	37 Å²	37	62.2 Å²	62.2	16%	0.162	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.1	-177.5	-66.3	-98.8	0	0	0	109.4	L812 V813 K815 D819 V823 I838 A843	L812-F821 WeakPolarHBondContact CA-O 3.02Å; V813-F821 HydrophobicContact CB-CB 4.47Å; V813-F821 PolarHBondContact N-O 3.11Å; V813-F821 PolarHBondContact O-N 2.61Å; K815-F821 HydrophobicContact CD-CD2 4.33Å; K815-F821 HydrophobicContact CD-CE2 3.74Å; K815-F821 HydrophobicContact CG-CD2 4.33Å; K815-F821 HydrophobicContact CG-CE2 4.21Å; K815-F821 VanDerWaalsContact NZ-CE2 3.27Å; D819-F821 HydrophobicContact CB-CE2 3.79Å; F821-V823 HydrophobicContact CB-CG2 4.43Å; F821-I838 HydrophobicContact CB-CG2 3.97Å; F821-I838 HydrophobicContact CD1-CG2 4.25Å; F821-I838 HydrophobicContact CD2-CG2 3.89Å; F821-I838 HydrophobicContact CG-CG2 3.74Å; F821-A843 HydrophobicContact CE2-CB 4.24Å; F821-A843 HydrophobicContact CZ-CB 3.77Å
822	N	87.1	Confident	82	Confident	122 Å²	122	64.7 Å²	64.7	65%	0.652	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	115.1	170.3	-72.4	-28.4	0	0	0	108.3
823	V	85.2	Confident	81.7	Confident	17 Å²	17	69.9 Å²	69.9	10%	0.103	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	108.9	-173.7	-168.3	0	0	0	0	109.3	V810 C811 V813 F821 I830 T834 I838	V810-V823 WeakPolarHBondContact CA-O 3.45Å; C811-V823 PolarHBondContact N-O 2.87Å; C811-V823 WeakPolarHBondContact O-CB 3.26Å; C811-V823 PolarHBondContact O-N 3.33Å; V813-V823 HydrophobicContact CB-CG2 4.3Å; V813-V823 HydrophobicContact CG2-CG2 3.64Å; F821-V823 HydrophobicContact CB-CG2 4.43Å; V823-I830 HydrophobicContact CB-CD1 3.78Å; V823-I830 HydrophobicContact CB-CG1 4.24Å; V823-I830 HydrophobicContact CG1-CD1 3.97Å; V823-I830 HydrophobicContact CG1-CG1 3.99Å; V823-I830 HydrophobicContact CG2-CD1 3.92Å; V823-T834 HydrophobicContact CG1-CG2 3.98Å; V823-I838 HydrophobicContact CB-CD1 4.42Å; V823-I838 HydrophobicContact CG1-CD1 4.18Å; V823-I838 HydrophobicContact CG2-CD1 3.34Å
824	E	85.4	Confident	81.4	Confident	163 Å²	163	72.5 Å²	72.5	76%	0.762	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	120	171.1	-52.1	-148.1	152	0	0	109.2	G809 V810	G809-E824 CarbonylContact O-C 3.55Å; G809-E824 WeakPolarHBondContact O-CA 3.5Å; V810-E824 HydrophobicContact CG1-CG 4.46Å; V810-E824 HydrophobicContact CG2-CG 3.98Å
825	H	80.9	Confident	81.4	Confident	31 Å²	31	71.9 Å²	71.9	14%	0.144	41%	0.407	C	S	.	.			trans	-126.5	24.4	-166.7	68.7	77.7	0	0	0	113.3	G809 C811 G827 E828 G829 I830	G809-H825 VanDerWaalsContact C-CD2 3.43Å; G809-H825 VanDerWaalsContact C-NE2 3.35Å; G809-H825 PolarHBondContact O-CD2 2.9Å; G809-H825 VanDerWaalsContact O-CD2 3.3Å; G809-H825 PolarHBondContact O-N 3.47Å; C811-H825 PolarHBondContact SG-NE2 2.73Å; H825-G827 PolarHBondContact O-N 2.85Å; H825-E828 PolarHBondContact O-N 3.23Å; H825-G829 VanDerWaalsContact ND1-CA 3.35Å; H825-G829 WeakPolarHBondContact ND1-CA 3.34Å; H825-G829 PolarHBondContact ND1-N 3.09Å; H825-G829 VanDerWaalsContact ND1-N 3.15Å; H825-I830 HydrophobicContact CB-CG1 4.37Å
826	G	70.7	Confident	81.3	Confident	75 Å²	75	74 Å²	74	77%	0.773	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	-0.8	174.9	0	0	0	0	0	116.8
827	G	71.2	Confident	81.5	Confident	36 Å²	36	72 Å²	72	37%	0.371	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	10.1	-167.4	0	0	0	0	0	114.9	H825	H825-G827 PolarHBondContact O-N 2.85Å
828	E	71.9	Confident	81.6	Confident	136 Å²	136	67.5 Å²	67.5	64%	0.636	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-47.6	175.6	-54.5	-146.5	120.8	0	0	111.4	Y377 M378 H825	Y377-E828 WeakPolarHBondContact CE1-OE1 3.32Å; M378-E828 WeakPolarHBondContact CE-OE1 3.47Å; H825-E828 PolarHBondContact O-N 3.23Å
829	G	74	Confident	81.7	Confident	33 Å²	33	67.9 Å²	67.9	34%	0.34	38%	0.375	S	S	.	.			trans	142.3	161.2	174.9	0	0	0	0	0	110.2	H825 T831	H825-G829 VanDerWaalsContact ND1-CA 3.35Å; H825-G829 WeakPolarHBondContact ND1-CA 3.34Å; H825-G829 PolarHBondContact ND1-N 3.09Å; H825-G829 VanDerWaalsContact ND1-N 3.15Å; G829-T831 PolarHBondContact O-N 2.87Å
830	I	79.9	Confident	81.7	Confident	40 Å²	40	72.3 Å²	72.3	21%	0.205	39%	0.394	C	S	.	.			trans	-69.7	125.3	167.6	-58.2	-173.8	0	0	0	107.8	V803 C811 V813 V823 H825 T834 L835	V803-I830 HydrophobicContact CG1-CD1 3.87Å; C811-I830 HydrophobicContact CB-CD1 3.59Å; C811-I830 HydrophobicContact CB-CG1 4.02Å; V813-I830 HydrophobicContact CG2-CD1 3.34Å; V823-I830 HydrophobicContact CB-CD1 3.78Å; V823-I830 HydrophobicContact CB-CG1 4.24Å; V823-I830 HydrophobicContact CG1-CD1 3.97Å; V823-I830 HydrophobicContact CG1-CG1 3.99Å; V823-I830 HydrophobicContact CG2-CD1 3.92Å; H825-I830 HydrophobicContact CB-CG1 4.37Å; I830-T834 HydrophobicContact CG2-CG2 3.99Å; I830-L835 HydrophobicContact CG2-CB 4.16Å; I830-L835 HydrophobicContact CG2-CD1 4.17Å
831	T	84.3	Confident	81.2	Confident	62 Å²	62	69 Å²	69	38%	0.38	39%	0.388	S	S	.	.			trans	-74.9	159.2	173.6	75	0	0	0	0	111	G829 E833 T834 L835	G829-T831 PolarHBondContact O-N 2.87Å; T831-E833 VanDerWaalsContact C-N 3.26Å; T831-E833 PolarHBondContact O-N 3.11Å; T831-E833 PolarHBondContact OG1-OE2 3.49Å; T831-T834 PolarHBondContact O-N 3.16Å; T831-T834 PolarHBondContact OG1-N 2.96Å; T831-T834 VanDerWaalsContact OG1-N 3.09Å; T831-T834 PolarHBondContact OG1-OG1 3.01Å; T831-L835 PolarHBondContact O-N 2.78Å
832	L	83	Confident	80.7	Confident	66 Å²	66	74.6 Å²	74.6	35%	0.346	42%	0.42	S	S	.	.	H	α-helix	trans	-57.1	-42.8	175.6	-179.4	60.1	0	0	0	111.4	L782 L797 F798 L835 Q836	L782-L832 HydrophobicContact CD1-CD2 3.9Å; L782-L832 HydrophobicContact CD2-CD2 3.73Å; L782-L832 HydrophobicContact CG-CD2 4.49Å; L797-L832 HydrophobicContact CD1-CD1 3.94Å; F798-L832 HydrophobicContact CE2-CD1 3.5Å; F798-L832 HydrophobicContact CZ-CD1 3.69Å; L832-L835 PolarHBondContact O-N 3.25Å; L832-Q836 WeakPolarHBondContact O-CG 3.41Å; L832-Q836 PolarHBondContact O-N 2.95Å
833	E	81.8	Confident	79.3	Confident	141 Å²	141	74.5 Å²	74.5	66%	0.659	44%	0.436	S	S	*	.	H	α-helix	trans	-61.6	-44.2	177.2	-58	136.3	174.1	0	0	111.4	T831 L835 Q836 A837	T831-E833 VanDerWaalsContact C-N 3.26Å; T831-E833 PolarHBondContact O-N 3.11Å; T831-E833 PolarHBondContact OG1-OE2 3.49Å; E833-L835 VanDerWaalsContact C-N 3.3Å; E833-L835 PolarHBondContact O-N 3.04Å; E833-Q836 PolarHBondContact O-N 3.15Å; E833-A837 WeakPolarHBondContact O-CB 3.33Å; E833-A837 PolarHBondContact O-N 3.24Å
834	T	83.6	Confident	79	Confident	56 Å²	56	77.4 Å²	77.4	34%	0.344	45%	0.452	S	S	.	.	H	α-helix	trans	-62.9	-39.7	177.9	-56.5	0	0	0	0	110.7	V823 I830 T831 I838	V823-T834 HydrophobicContact CG1-CG2 3.98Å; I830-T834 HydrophobicContact CG2-CG2 3.99Å; T831-T834 PolarHBondContact O-N 3.16Å; T831-T834 PolarHBondContact OG1-N 2.96Å; T831-T834 VanDerWaalsContact OG1-N 3.09Å; T831-T834 PolarHBondContact OG1-OG1 3.01Å; T834-I838 HydrophobicContact CG2-CD1 4.01Å; T834-I838 WeakPolarHBondContact O-CB 3.13Å; T834-I838 VanDerWaalsContact O-CD1 3.31Å; T834-I838 WeakPolarHBondContact O-CD1 3.32Å; T834-I838 WeakPolarHBondContact O-CG1 3.27Å; T834-I838 PolarHBondContact O-N 3.31Å
835	L	85	Confident	78.6	Confident	7 Å²	7	72.9 Å²	72.9	4%	0.037	44%	0.436	C	S	.	.	H	α-helix	trans	-66.6	-41.8	175.7	-160.1	92.8	0	0	0	111.7	L794 F798 V801 V803 V813 I830 T831 L832 E833 I838 L839	L794-L835 HydrophobicContact CD2-CD2 4.21Å; F798-L835 HydrophobicContact CD2-CD2 3.35Å; F798-L835 HydrophobicContact CE2-CD2 3.5Å; F798-L835 HydrophobicContact CG-CD2 3.93Å; F798-L835 HydrophobicContact CZ-CD2 4.18Å; V801-L835 HydrophobicContact CG1-CD1 4.45Å; V801-L835 HydrophobicContact CG1-CD2 4.46Å; V803-L835 HydrophobicContact CG2-CD1 3.62Å; V813-L835 HydrophobicContact CG1-CD1 4.03Å; V813-L835 HydrophobicContact CG2-CD1 3.97Å; I830-L835 HydrophobicContact CG2-CB 4.16Å; I830-L835 HydrophobicContact CG2-CD1 4.17Å; T831-L835 PolarHBondContact O-N 2.78Å; L832-L835 PolarHBondContact O-N 3.25Å; E833-L835 VanDerWaalsContact C-N 3.3Å; E833-L835 PolarHBondContact O-N 3.04Å; L835-I838 PolarHBondContact O-N 2.92Å; L835-L839 HydrophobicContact CD2-CD1 4.28Å; L835-L839 HydrophobicContact CG-CD1 4.33Å; L835-L839 WeakPolarHBondContact O-CD1 3.35Å; L835-L839 VanDerWaalsContact O-CG 3.22Å; L835-L839 WeakPolarHBondContact O-CG 3.2Å; L835-L839 PolarHBondContact O-N 2.65Å; L835-L839 VanDerWaalsContact O-N 3.07Å
836	Q	84.6	Confident	78.5	Confident	54 Å²	54	75.2 Å²	75.2	25%	0.252	45%	0.452	S	S	.	.	H	α-helix	trans	-63.7	-45.6	175.8	-75	173.3	-46	0	0	111.8	F798 L832 E833 I838 L839 Q840	F798-Q836 HydrophobicContact CE1-CG 4.01Å; F798-Q836 HydrophobicContact CZ-CG 3.71Å; L832-Q836 WeakPolarHBondContact O-CG 3.41Å; L832-Q836 PolarHBondContact O-N 2.95Å; E833-Q836 PolarHBondContact O-N 3.15Å; Q836-I838 PolarHBondContact O-N 2.91Å; Q836-L839 WeakPolarHBondContact O-CB 3.3Å; Q836-L839 PolarHBondContact O-N 3.47Å; Q836-L839 VanDerWaalsContact O-N 3.11Å; Q836-Q840 WeakPolarHBondContact O-CG 3.21Å; Q836-Q840 PolarHBondContact O-N 2.69Å
837	A	85.3	Confident	79	Confident	48 Å²	48	75.2 Å²	75.2	40%	0.397	43%	0.433	S	S	.	.	H	α-helix	trans	-59.2	-47	176.2	0	0	0	0	0	111.4	E833 L839 Q840 M841	E833-A837 WeakPolarHBondContact O-CB 3.33Å; E833-A837 PolarHBondContact O-N 3.24Å; A837-L839 VanDerWaalsContact C-N 3.26Å; A837-L839 PolarHBondContact O-N 3.17Å; A837-Q840 PolarHBondContact O-N 3.3Å; A837-M841 WeakPolarHBondContact O-CG 3.23Å; A837-M841 PolarHBondContact O-N 2.84Å
838	I	84.7	Confident	79.5	Confident	12 Å²	12	77.7 Å²	77.7	6%	0.062	44%	0.437	C	S	.	.	H	α-helix	trans	-56	-43.6	174.3	-71	161	0	0	0	110.8	V813 K815 F821 V823 T834 L835 Q836 Q840 M841	V813-I838 HydrophobicContact CB-CG2 4.44Å; V813-I838 HydrophobicContact CG1-CG2 4.05Å; V813-I838 HydrophobicContact CG2-CD1 4.17Å; K815-I838 WeakPolarHBondContact CE-O 2.82Å; K815-I838 PolarHBondContact NZ-O 3.21Å; F821-I838 HydrophobicContact CB-CG2 3.97Å; F821-I838 HydrophobicContact CD1-CG2 4.25Å; F821-I838 HydrophobicContact CD2-CG2 3.89Å; F821-I838 HydrophobicContact CG-CG2 3.74Å; V823-I838 HydrophobicContact CB-CD1 4.42Å; V823-I838 HydrophobicContact CG1-CD1 4.18Å; V823-I838 HydrophobicContact CG2-CD1 3.34Å; T834-I838 HydrophobicContact CG2-CD1 4.01Å; T834-I838 WeakPolarHBondContact O-CB 3.13Å; T834-I838 VanDerWaalsContact O-CD1 3.31Å; T834-I838 WeakPolarHBondContact O-CD1 3.32Å; T834-I838 WeakPolarHBondContact O-CG1 3.27Å; T834-I838 PolarHBondContact O-N 3.31Å; L835-I838 PolarHBondContact O-N 2.92Å; Q836-I838 PolarHBondContact O-N 2.91Å; I838-Q840 VanDerWaalsContact C-N 3.25Å; I838-Q840 PolarHBondContact O-N 2.88Å; I838-M841 PolarHBondContact O-N 2.81Å
839	L	82.8	Confident	80	Confident	51 Å²	51	73.8 Å²	73.8	27%	0.267	42%	0.424	S	S	.	.	H	α-helix	trans	-67.9	-21.4	179.6	-70	164	0	0	0	113.9	F798 V801 K815 L835 Q836 A837	F798-L839 HydrophobicContact CB-CD1 4.48Å; F798-L839 HydrophobicContact CD1-CD1 3.38Å; F798-L839 HydrophobicContact CE1-CD1 3.69Å; F798-L839 HydrophobicContact CG-CD1 3.98Å; V801-L839 HydrophobicContact CG2-CD1 4.08Å; V801-L839 HydrophobicContact CG2-CD2 3.47Å; V801-L839 VanDerWaalsContact CG2-CD2 3.47Å; V801-L839 HydrophobicContact CG2-CG 4.38Å; K815-L839 HydrophobicContact CG-CD2 4.1Å; L835-L839 HydrophobicContact CD2-CD1 4.28Å; L835-L839 HydrophobicContact CG-CD1 4.33Å; L835-L839 WeakPolarHBondContact O-CD1 3.35Å; L835-L839 VanDerWaalsContact O-CG 3.22Å; L835-L839 WeakPolarHBondContact O-CG 3.2Å; L835-L839 PolarHBondContact O-N 2.65Å; L835-L839 VanDerWaalsContact O-N 3.07Å; Q836-L839 WeakPolarHBondContact O-CB 3.3Å; Q836-L839 PolarHBondContact O-N 3.47Å; Q836-L839 VanDerWaalsContact O-N 3.11Å; A837-L839 VanDerWaalsContact C-N 3.26Å; A837-L839 PolarHBondContact O-N 3.17Å
840	Q	82.6	Confident	80.4	Confident	151 Å²	151	76.7 Å²	76.7	71%	0.706	43%	0.43	S	S	*	.	H	α-helix	trans	-90.1	-20.5	175.9	-70.4	172.4	-6.1	0	0	113.8	Q836 A837 I838	Q836-Q840 WeakPolarHBondContact O-CG 3.21Å; Q836-Q840 PolarHBondContact O-N 2.69Å; A837-Q840 PolarHBondContact O-N 3.3Å; I838-Q840 VanDerWaalsContact C-N 3.25Å; I838-Q840 PolarHBondContact O-N 2.88Å
841	M	76.2	Confident	80.4	Confident	110 Å²	110	79.5 Å²	79.5	54%	0.542	45%	0.447	S	S	.	.	S	Bend	trans	-69.2	149.5	173.2	-66.4	172.7	68.7	0	0	111.3	K815 A837 I838	K815-M841 PolarHBondContact NZ-O 2.75Å; A837-M841 WeakPolarHBondContact O-CG 3.23Å; A837-M841 PolarHBondContact O-N 2.84Å; I838-M841 PolarHBondContact O-N 2.81Å
842	D	74.7	Confident	80.1	Confident	156 Å²	156	81 Å²	81	83%	0.834	45%	0.453	S	S	*	.			trans	-77.8	-179.2	156.5	-73.2	-48.6	0	0	0	110.6
843	A	57.2	Low	79.9	Confident	120 Å²	120	82.4 Å²	82.4	99%	0.992	46%	0.463	S	S	*	.			trans	-127.6	0	-171.1	0	0	0	0	0	113.5	D819 F821	D819-A843 HydrophobicContact CB-CB 3.86Å; D819-A843 VanDerWaalsContact OD2-CB 3.23Å; D819-A843 WeakPolarHBondContact OD2-CB 3.45Å; F821-A843 HydrophobicContact CE2-CB 4.24Å; F821-A843 HydrophobicContact CZ-CB 3.77Å

Retrieved 843 of 843 residues in 1020 ms (Link to these results)

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