A0A077Z040_TRITR Loading...

BK channel

AlphaFold DB , UniProt , Accession A0A077Z040, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,155 aa.

						>A0A077Z040_TRITR|A0A077Z040
MMAPMMAGDHPKGSGASWHYPYAYSCNTSTPYDFYPMTDDERKCLEQRYYWCFLLSSIVTFCLSMLCVVTWRIITYICIDPSGLDEPHRIKYDVLNDPDAAQAKEAILNGADQSAAQARRSPVTICGSNGAQERLEGSQVGWMTEAKDWAGELISGQSTTGRILVVLVFVLSIGSLIIYFYDASHPNFQVETCISWSKSPSQQIDLAFNIFFLIYFFIRFVAATDKVWFLLEVYSFVDYFTIPPSFVAIYLERTWLGLRFLRALRLMTVPDILQYLNVLKTSSSIRLAQLVSIFVSVSLTGAGFLHLLENSGDPFQNFQNPQRITYWECVYFLVVTMGTVGYGDICCKTSLGRLFMVFFILGGLAMFASYVPEIADLIGSRQKYGGEYKAENGKRHIVVCGYITYESVSHFLQDFLHEDRDDVDVEVVFVHRVPPDLELEGLFKRHFTKVEFFQGTVMDSIDLSRVKVRIRTTMPPVSTGRPACRCQVHKADACLILANKYSSDPDAEDAANIMRVISLKNYSPDIRVIVQLMQYHNKAYLLNIPSWNWKTGDDVICLAELKLGILAQSCLAPGFSTMMANLFAMRSFKTSPNTPCWLNDYLRGAGMEIYTETLSHSFVGMTFPETVELIFVKLKLLLLAIEVKDDDNLECTIIINPESSAIIKVNTQGFFIAQSADEVKRAFYYCQKCHEDIQDVNMIRKCKCRNLTLFRKGVRHIILANRTAKVLSPAFDMTAEENDGYLSTSRNISIFRDVRTPARASFGSGDKADGNDMKYDSTGMFHWCRSRPIEEVILQREQAATTLLSNHVVICMFADKNSPLIGLRNFVMPLRASNYHYHELKHVVIVGDVEYLRREWKTLQNMPKITVLNGNPLSRADLRAVNVNLCDMCVIISARIPNPNEDPTLTDKEAILASLNIKAMNFDATTALLYHPLGNNSLNSPPMALFESKIKSGTQIPLLTELVNDSNVQFLDQDDEDDPNTELYLTQPFTCGKAFAISVLDSLMSTTYFNDSALTLIRTFVTGGATPELEVILAEGGDLKGAPSTAQLLRKRDRCRIAQYGITEGPFVNFGVQEGWTYGSLFLQALRKHGMLLIGLYRLQEMQPEEVTKRFVITAPPENMKLQMTDLVRMQINLSINVFVLEPFDHGIPYEPAKR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	34.9	Very low	228 Å²	228	142.9 Å²	142.9	100%	1.123	84%	0.836	S	S	*	*				0	123.7	0	-93.6	-179.2	171.5	0	0	108.6
2	M	30.9	Very low	34.7	Very low	196 Å²	196	148.8 Å²	148.8	97%	0.966	84%	0.844	S	S	*	*			trans	63.5	124.6	174.5	-60.1	-179.7	175.1	0	0	116.6
3	A	36.5	Very low	34.6	Very low	92 Å²	92	143.7 Å²	143.7	76%	0.76	84%	0.844	S	S	*	*			cis	-170.9	148	-3.2	0	0	0	0	0	107.2
4	P	39.4	Very low	34.6	Very low	120 Å²	120	142.1 Å²	142.1	78%	0.779	85%	0.845	S	S	*	*			trans	-94	142.8	161.9	34.7	-26.6	0	0	0	109.7
5	M	32.7	Very low	34.4	Very low	173 Å²	173	137.9 Å²	137.9	85%	0.852	84%	0.843	S	S	*	*			trans	147.2	151.8	153.5	-85.6	-174.3	161	0	0	115
6	M	34.7	Very low	34.5	Very low	166 Å²	166	134.2 Å²	134.2	82%	0.818	83%	0.83	S	S	*	*			trans	99.3	95.9	155.9	-50.3	-140.1	170.6	0	0	115.2
7	A	33.7	Very low	34.1	Very low	105 Å²	105	133.2 Å²	133.2	87%	0.868	83%	0.83	S	S	*	*				62.3	108.5	60.2	0	0	0	0	0	112.7
8	G	35.7	Very low	34	Very low	81 Å²	81	137.9 Å²	137.9	84%	0.835	83%	0.83	S	S	*	*			trans	-142.9	120.5	170.4	0	0	0	0	0	108.8
9	D	34.8	Very low	34	Very low	144 Å²	144	140.8 Å²	140.8	77%	0.77	83%	0.833	S	S	*	*			trans	-81.6	167	-161.3	-92.2	-50.7	0	0	0	117.4
10	H	36	Very low	34	Very low	165 Å²	165	143 Å²	143	76%	0.764	83%	0.827	S	S	*	*			trans	96.5	150.3	145.1	-73	-42.4	0	0	0	120.9
11	P	38	Very low	34.2	Very low	102 Å²	102	141.7 Å²	141.7	66%	0.662	82%	0.824	S	S	*	*				-142.7	161.7	-58.9	35	-14.5	0	0	0	115.3
12	K	32.2	Very low	34.5	Very low	214 Å²	214	138.9 Å²	138.9	93%	0.93	80%	0.802	S	S	*	*			trans	41.9	108.8	143.7	-62.8	-179.4	-179.1	178.9	0	120.3
13	G	34	Very low	34.6	Very low	82 Å²	82	133.8 Å²	133.8	85%	0.845	79%	0.791	S	S	*	*			trans	-152.5	128.2	155.5	0	0	0	0	0	110.1
14	S	34.4	Very low	35	Very low	122 Å²	122	139.2 Å²	139.2	85%	0.853	79%	0.793	S	S	*	*			trans	-70.6	142.3	-161	50.8	0	0	0	0	117.6
15	G	30.9	Very low	34.8	Very low	79 Å²	79	138.3 Å²	138.3	81%	0.814	79%	0.79	S	S	*	*				77	97.1	128.3	0	0	0	0	0	119
16	A	36	Very low	35.4	Very low	78 Å²	78	132.2 Å²	132.2	65%	0.645	76%	0.763	S	S	*	*			trans	-177.9	133.6	138.1	0	0	0	0	0	109.5	W18	A16-W18 PolarHBondContact O-N 3.04Å
17	S	28.2	Very low	35.5	Very low	118 Å²	118	130.5 Å²	130.5	83%	0.825	76%	0.758	S	S	*	*			trans	-60.5	122.1	174.6	58.7	0	0	0	0	111.5
18	W	31.9	Very low	35.8	Very low	218 Å²	218	131.3 Å²	131.3	83%	0.826	75%	0.752	S	S	*	*			trans	-135.2	114.2	166.3	-69.5	97.1	0	0	0	109.6	A16 Y20	A16-W18 PolarHBondContact O-N 3.04Å; W18-Y20 PolarHBondContact O-N 3.42Å
19	H	34.6	Very low	36.2	Very low	192 Å²	192	133.1 Å²	133.1	89%	0.889	75%	0.752	S	S	*	*			trans	-48.3	126.1	158.4	-86.8	-97.4	0	0	0	109.1	P21	H19-P21 VanDerWaalsContact O-CD 3.26Å; H19-P21 WeakPolarHBondContact O-CD 3.3Å
20	Y	34.6	Very low	36.7	Very low	184 Å²	184	130.2 Å²	130.2	72%	0.722	74%	0.739	S	S	*	*			trans	-89.9	113.2	170	-86.1	-92.8	0	0	0	109.8	W18 Y22	W18-Y20 PolarHBondContact O-N 3.42Å; Y20-Y22 HydrophobicContact CD1-CD2 4.46Å; Y20-Y22 HydrophobicContact CD1-CE1 4.22Å; Y20-Y22 AromaticContact CD1-CE2 3.8Å; Y20-Y22 HydrophobicContact CD1-CE2 3.8Å; Y20-Y22 AromaticContact CD1-CZ 3.66Å; Y20-Y22 HydrophobicContact CG-CE2 4.04Å
21	P	37.9	Very low	36.9	Very low	116 Å²	116	128.3 Å²	128.3	75%	0.753	74%	0.742	S	S	*	*			trans	-95.4	103.4	155.2	32.6	-22.4	0	0	0	108.1	H19 A23	H19-P21 VanDerWaalsContact O-CD 3.26Å; H19-P21 WeakPolarHBondContact O-CD 3.3Å; P21-A23 VanDerWaalsContact C-N 3.31Å; P21-A23 PolarHBondContact O-N 3.04Å
22	Y	37.2	Very low	37.3	Very low	169 Å²	169	130.9 Å²	130.9	66%	0.663	74%	0.74	S	S	*	*			trans	-72.9	85.9	171.4	-76.6	-80.2	0	0	0	109.8	Y20 Y24	Y20-Y22 HydrophobicContact CD1-CD2 4.46Å; Y20-Y22 HydrophobicContact CD1-CE1 4.22Å; Y20-Y22 AromaticContact CD1-CE2 3.8Å; Y20-Y22 HydrophobicContact CD1-CE2 3.8Å; Y20-Y22 AromaticContact CD1-CZ 3.66Å; Y20-Y22 HydrophobicContact CG-CE2 4.04Å; Y22-Y24 HydrophobicContact CD1-CD2 4.36Å; Y22-Y24 AromaticContact CD1-CE2 3.77Å; Y22-Y24 HydrophobicContact CD1-CE2 3.77Å; Y22-Y24 HydrophobicContact CE1-CE2 4.24Å
23	A	34.2	Very low	37.9	Very low	89 Å²	89	128 Å²	128	74%	0.736	73%	0.734	S	S	*	*			trans	-112.5	85	162.5	0	0	0	0	0	107.9	P21 S25	P21-A23 VanDerWaalsContact C-N 3.31Å; P21-A23 PolarHBondContact O-N 3.04Å; A23-S25 PolarHBondContact O-N 3.25Å; A23-S25 VanDerWaalsContact O-N 3.13Å
24	Y	43.1	Very low	39	Very low	207 Å²	207	126.7 Å²	126.7	81%	0.812	71%	0.705	S	S	*	*			trans	-68.3	108.8	165	-80.4	-79.3	0	0	0	107.4	Y22	Y22-Y24 HydrophobicContact CD1-CD2 4.36Å; Y22-Y24 AromaticContact CD1-CE2 3.77Å; Y22-Y24 HydrophobicContact CD1-CE2 3.77Å; Y22-Y24 HydrophobicContact CE1-CE2 4.24Å
25	S	36.7	Very low	40.1	Very low	100 Å²	100	128.5 Å²	128.5	70%	0.699	69%	0.694	S	S	*	*			trans	-72.3	127.1	176.2	35	0	0	0	0	108.8	A23 N27	A23-S25 PolarHBondContact O-N 3.25Å; A23-S25 VanDerWaalsContact O-N 3.13Å; S25-N27 PolarHBondContact O-N 3.2Å
26	C	44.7	Very low	41.4	Very low	45 Å²	45	130 Å²	130	30%	0.304	69%	0.69	S	S	.	*	S	Bend	trans	-69.5	70.4	172.8	-165	0	0	0	0	108.9	C346	C26-C346 HydrophobicContact CB-CB 4.29Å; C26-C346 WeakPolarHBondContact CB-SG 3.1Å; C26-C346 WeakPolarHBondContact SG-CB 3.34Å; C26-C346 CovalentContact SG-SG 2.05Å; C26-C346 PolarHBondContact SG-SG 3.49Å
27	N	35.8	Very low	42.7	Very low	130 Å²	130	129 Å²	129	70%	0.695	67%	0.672	S	S	*	*			trans	-145.8	72.9	-174.1	-113.3	8.6	0	0	0	110	S25	S25-N27 PolarHBondContact O-N 3.2Å
28	T	41.8	Very low	44.6	Very low	122 Å²	122	126.9 Å²	126.9	75%	0.748	66%	0.655	S	S	*	*			trans	-139.4	105.4	152	40.8	0	0	0	0	108.5	T30	T28-T30 PolarHBondContact O-N 3.21Å
29	S	42.9	Very low	46.2	Very low	120 Å²	120	122 Å²	122	84%	0.839	65%	0.645	S	S	*	*			trans	-61.3	116	164.4	49.6	0	0	0	0	108.9
30	T	46.4	Very low	47.8	Very low	82 Å²	82	118.7 Å²	118.7	50%	0.503	63%	0.634	S	S	.	*			trans	-65.2	137.2	162.8	40.7	0	0	0	0	108.7	T28 Y32 E328	T28-T30 PolarHBondContact O-N 3.21Å; T30-Y32 VanDerWaalsContact C-N 3.25Å; T30-Y32 PolarHBondContact O-N 3.29Å; T30-E328 PolarHBondContact OG1-OE1 3.3Å
31	P	39.4	Very low	49.4	Very low	126 Å²	126	112.7 Å²	112.7	82%	0.818	61%	0.612	S	S	*	*			trans	-84.3	73.1	-178.5	35.1	-31.7	0	0	0	108.8
32	Y	47.2	Very low	50.9	Low	156 Å²	156	115.1 Å²	115.1	61%	0.612	61%	0.607	S	S	*	*			trans	-96.7	108.6	154.2	-72.6	-73.5	0	0	0	106.4	T30 F34	T30-Y32 VanDerWaalsContact C-N 3.25Å; T30-Y32 PolarHBondContact O-N 3.29Å; Y32-F34 WeakPolarHBondContact O-CD2 3.36Å; Y32-F34 PolarHBondContact O-N 2.93Å
33	D	44.2	Very low	52.4	Low	152 Å²	152	113.6 Å²	113.6	81%	0.813	60%	0.603	S	S	*	*			trans	-65.2	82.6	170.6	-80.1	-26.4	0	0	0	108.1	Y35	D33-Y35 PolarHBondContact O-N 3.47Å
34	F	56.5	Low	54.3	Low	55 Å²	55	110.9 Å²	110.9	24%	0.241	58%	0.579	C	S	.	*	P	Polyproline II helix	trans	-61.1	119.6	162.7	-71.7	-82.7	0	0	0	106.8	Y32 P186 R323 T325	Y32-F34 WeakPolarHBondContact O-CD2 3.36Å; Y32-F34 PolarHBondContact O-N 2.93Å; F34-P186 WeakPolarHBondContact CD1-O 3.23Å; F34-R323 HydrophobicContact CD2-CB 4.19Å; F34-R323 HydrophobicContact CE2-CB 3.84Å; F34-R323 HydrophobicContact CZ-CB 4.09Å; F34-T325 HydrophobicContact CZ-CG2 4.27Å
35	Y	57.3	Low	55.7	Low	160 Å²	160	102.4 Å²	102.4	63%	0.627	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-56.7	135.4	176.9	-76.9	-87.7	0	0	0	109.6	D33 M37 N187	D33-Y35 PolarHBondContact O-N 3.47Å; Y35-M37 PolarHBondContact O-N 3.47Å; Y35-N187 WeakPolarHBondContact CB-OD1 3.5Å; Y35-N187 WeakPolarHBondContact CD2-OD1 3.46Å
36	P	59.1	Low	57.2	Low	110 Å²	110	105.2 Å²	105.2	71%	0.714	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-59.7	142	172.5	25	-31.7	0	0	0	108.9	T38	P36-T38 PolarHBondContact O-N 2.9Å
37	M	62.8	Low	58.5	Low	57 Å²	57	109 Å²	109	28%	0.281	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-56.2	129	179.2	-174.4	178.8	-149	0	0	110.1	Y35 E41 R42 L45	Y35-M37 PolarHBondContact O-N 3.47Å; M37-E41 HydrophobicContact CE-CB 3.96Å; M37-E41 WeakPolarHBondContact CE-O 3.2Å; M37-E41 HydrophobicContact CG-CB 3.73Å; M37-R42 HydrophobicContact CE-CB 4.4Å; M37-R42 HydrophobicContact CG-CB 4.19Å; M37-R42 HydrophobicContact SD-CB 3.82Å; M37-R42 HydrophobicContact SD-CG 3.93Å; M37-L45 HydrophobicContact CE-CB 3.88Å; M37-L45 HydrophobicContact CE-CD1 3.09Å; M37-L45 HydrophobicContact CE-CG 3.86Å
38	T	68	Low	60.3	Low	74 Å²	74	108.1 Å²	108.1	45%	0.454	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-66.9	150.7	174.3	59.7	0	0	0	0	110	P36 D40 E41 R42	P36-T38 PolarHBondContact O-N 2.9Å; T38-D40 PolarHBondContact O-N 3.2Å; T38-D40 VanDerWaalsContact O-N 3.17Å; T38-E41 PolarHBondContact N-OE2 3.18Å; T38-E41 WeakPolarHBondContact O-CB 3.45Å; T38-E41 PolarHBondContact O-N 3.05Å; T38-E41 VanDerWaalsContact O-N 3.11Å; T38-E41 WeakPolarHBondContact OG1-CG 3.2Å; T38-E41 PolarHBondContact OG1-N 3.39Å; T38-E41 PolarHBondContact OG1-OE2 3.42Å; T38-R42 PolarHBondContact O-N 2.83Å
39	D	65.1	Low	62.1	Low	117 Å²	117	105.5 Å²	105.5	63%	0.626	53%	0.526	S	S	*	.	H	α-helix	trans	-59.2	-30.4	-179.1	-74.6	-36.9	0	0	0	112.5	R42 K43	D39-R42 PolarHBondContact O-N 3.18Å; D39-K43 WeakPolarHBondContact O-CG 3.49Å; D39-K43 PolarHBondContact O-N 3.43Å
40	D	68.2	Low	63.9	Low	122 Å²	122	104.2 Å²	104.2	65%	0.652	50%	0.504	S	S	*	.	H	α-helix	trans	-69.5	-41.6	176.4	-68.1	-27.9	0	0	0	112.2	T38 R42 K43 C44	T38-D40 PolarHBondContact O-N 3.2Å; T38-D40 VanDerWaalsContact O-N 3.17Å; D40-R42 VanDerWaalsContact C-N 3.3Å; D40-R42 PolarHBondContact O-N 3.42Å; D40-K43 PolarHBondContact O-N 2.99Å; D40-C44 PolarHBondContact O-N 3.07Å
41	E	68.2	Low	65.7	Low	58 Å²	58	107 Å²	107	27%	0.271	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-41.2	172.9	-72.2	165.2	154.9	0	0	110.6	M37 T38 C44 L45	M37-E41 HydrophobicContact CE-CB 3.96Å; M37-E41 WeakPolarHBondContact CE-O 3.2Å; M37-E41 HydrophobicContact CG-CB 3.73Å; T38-E41 PolarHBondContact N-OE2 3.18Å; T38-E41 WeakPolarHBondContact O-CB 3.45Å; T38-E41 PolarHBondContact O-N 3.05Å; T38-E41 VanDerWaalsContact O-N 3.11Å; T38-E41 WeakPolarHBondContact OG1-CG 3.2Å; T38-E41 PolarHBondContact OG1-N 3.39Å; T38-E41 PolarHBondContact OG1-OE2 3.42Å; E41-C44 PolarHBondContact O-N 2.94Å; E41-L45 WeakPolarHBondContact O-CG 3.32Å; E41-L45 PolarHBondContact O-N 3.48Å
42	R	69.3	Low	68	Low	167 Å²	167	102.6 Å²	102.6	63%	0.63	48%	0.477	S	S	*	.	H	α-helix	trans	-62.9	-45.4	-179.4	-160.6	177.7	-165.1	173.3	4.3	111.7	M37 T38 D39 D40 C44 L45 E46	M37-R42 HydrophobicContact CE-CB 4.4Å; M37-R42 HydrophobicContact CG-CB 4.19Å; M37-R42 HydrophobicContact SD-CB 3.82Å; M37-R42 HydrophobicContact SD-CG 3.93Å; T38-R42 PolarHBondContact O-N 2.83Å; D39-R42 PolarHBondContact O-N 3.18Å; D40-R42 VanDerWaalsContact C-N 3.3Å; D40-R42 PolarHBondContact O-N 3.42Å; R42-C44 VanDerWaalsContact C-N 3.31Å; R42-C44 PolarHBondContact O-N 2.83Å; R42-L45 PolarHBondContact O-N 3.46Å; R42-E46 PolarHBondContact O-N 3.38Å
43	K	70.3	Confident	69.8	Low	136 Å²	136	95.3 Å²	95.3	59%	0.591	45%	0.448	S	S	*	.	H	α-helix	trans	-59.9	-41.5	173.3	-76.3	175.1	-175.6	168.3	0	111.8	D39 D40 L45 E46	D39-K43 WeakPolarHBondContact O-CG 3.49Å; D39-K43 PolarHBondContact O-N 3.43Å; D40-K43 PolarHBondContact O-N 2.99Å; K43-L45 VanDerWaalsContact C-N 3.26Å; K43-L45 PolarHBondContact O-N 3.11Å; K43-E46 PolarHBondContact O-N 2.9Å
44	C	73.5	Confident	71.8	Confident	33 Å²	33	91.3 Å²	91.3	22%	0.223	43%	0.427	C	S	.	.	H	α-helix	trans	-65.1	-33.7	179.6	-164.8	0	0	0	0	112.8	D40 E41 R42 C193 R253	D40-C44 PolarHBondContact O-N 3.07Å; E41-C44 PolarHBondContact O-N 2.94Å; R42-C44 VanDerWaalsContact C-N 3.31Å; R42-C44 PolarHBondContact O-N 2.83Å; C44-C193 HydrophobicContact CB-CB 3.66Å; C44-C193 WeakPolarHBondContact CB-SG 3.35Å; C44-C193 WeakPolarHBondContact SG-CB 3.34Å; C44-C193 CovalentContact SG-SG 2Å; C44-C193 PolarHBondContact SG-SG 2.85Å; C44-R253 VanDerWaalsContact O-CZ 3.31Å; C44-R253 PolarHBondContact O-NH1 3.01Å; C44-R253 PolarHBondContact O-NH2 2.84Å; C44-R253 PolarHBondContact SG-NH2 3.18Å
45	L	72.3	Confident	73.5	Confident	29 Å²	29	92.8 Å²	92.8	15%	0.152	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	8.2	-178	-66.2	-179.9	0	0	0	114.9	M37 E41 R42 K43 Q47 E191	M37-L45 HydrophobicContact CE-CB 3.88Å; M37-L45 HydrophobicContact CE-CD1 3.09Å; M37-L45 HydrophobicContact CE-CG 3.86Å; E41-L45 WeakPolarHBondContact O-CG 3.32Å; E41-L45 PolarHBondContact O-N 3.48Å; R42-L45 PolarHBondContact O-N 3.46Å; K43-L45 VanDerWaalsContact C-N 3.26Å; K43-L45 PolarHBondContact O-N 3.11Å; L45-Q47 PolarHBondContact O-N 3.46Å; L45-E191 HydrophobicContact CD2-CB 3.63Å
46	E	68.8	Low	75.1	Confident	158 Å²	158	86.1 Å²	86.1	74%	0.738	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.8	171.4	-77.7	-175.8	175.5	0	0	111.8	R42 K43	R42-E46 PolarHBondContact O-N 3.38Å; K43-E46 PolarHBondContact O-N 2.9Å
47	Q	72.6	Confident	76.6	Confident	125 Å²	125	81 Å²	81	58%	0.584	38%	0.38	S	S	*	.	S	Bend	trans	-112.1	115.6	167.2	-70.8	-172.4	-7.4	0	0	109.7	L45 Y49 R253	L45-Q47 PolarHBondContact O-N 3.46Å; Q47-Y49 HydrophobicContact CB-CE2 4.27Å; Q47-Y49 PolarHBondContact OE1-OH 2.82Å; Q47-R253 PolarHBondContact O-NH1 3.33Å
48	R	72.4	Confident	77.9	Confident	112 Å²	112	82 Å²	82	42%	0.423	39%	0.386	S	S	.	.			trans	-86.6	134.2	175.2	-62.4	-175.4	-179.8	-172.8	-0.7	110.3	Y50 W51	R48-Y50 HydrophobicContact CB-CD1 4.08Å; R48-W51 PolarHBondContact O-NE1 2.98Å
49	Y	80.6	Confident	79	Confident	66 Å²	66	81.5 Å²	81.5	26%	0.259	38%	0.383	S	S	.	.			trans	-113.2	19.2	-178.8	-67	-74.6	0	0	0	113.5	Q47 W51 C52 F53 E191 R253	Q47-Y49 HydrophobicContact CB-CE2 4.27Å; Q47-Y49 PolarHBondContact OE1-OH 2.82Å; Y49-W51 PolarHBondContact O-N 3.13Å; Y49-C52 WeakPolarHBondContact O-CB 3.49Å; Y49-C52 PolarHBondContact O-N 2.98Å; Y49-F53 VanDerWaalsContact O-CD2 3.31Å; Y49-F53 WeakPolarHBondContact O-CD2 3.48Å; Y49-E191 PolarHBondContact N-OE1 3Å; Y49-E191 PolarHBondContact N-OE2 3.47Å; Y49-R253 VanDerWaalsContact CD2-NH1 3.35Å
50	Y	79.6	Confident	80.2	Confident	94 Å²	94	78.4 Å²	78.4	37%	0.369	37%	0.368	S	S	.	.	H	α-helix	trans	-47.2	-38.1	176.1	71	-85.2	0	0	0	113.5	R48 C52 F53 L54 E191 F318	R48-Y50 HydrophobicContact CB-CD1 4.08Å; Y50-C52 VanDerWaalsContact C-N 3.31Å; Y50-C52 PolarHBondContact O-N 3.19Å; Y50-F53 PolarHBondContact O-N 3.34Å; Y50-L54 PolarHBondContact O-N 3.07Å; Y50-L54 VanDerWaalsContact O-N 3.13Å; Y50-E191 VanDerWaalsContact CA-OE1 3.31Å; Y50-E191 WeakPolarHBondContact CA-OE1 3.32Å; Y50-E191 WeakPolarHBondContact CB-OE1 3.38Å; Y50-E191 PolarHBondContact N-OE1 3.36Å; Y50-F318 HydrophobicContact CE1-CE2 4.49Å; Y50-F318 HydrophobicContact CE1-CZ 4.24Å
51	W	84.1	Confident	81.3	Confident	141 Å²	141	75.1 Å²	75.1	53%	0.534	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-30.5	-179.4	63.3	-75.6	0	0	0	112.7	R48 Y49 L55	R48-W51 PolarHBondContact O-NE1 2.98Å; Y49-W51 PolarHBondContact O-N 3.13Å; W51-L55 WeakPolarHBondContact O-CB 3Å; W51-L55 PolarHBondContact O-N 3.07Å
52	C	87.1	Confident	82.4	Confident	33 Å²	33	75.7 Å²	75.7	22%	0.223	36%	0.358	C	S	.	.	H	α-helix	trans	-65.6	-40.5	174.4	-62	0	0	0	0	111.6	Y49 Y50 S56 L251	Y49-C52 WeakPolarHBondContact O-CB 3.49Å; Y49-C52 PolarHBondContact O-N 2.98Å; Y50-C52 VanDerWaalsContact C-N 3.31Å; Y50-C52 PolarHBondContact O-N 3.19Å; C52-S56 PolarHBondContact O-N 3.09Å; C52-S56 VanDerWaalsContact O-N 3.08Å; C52-L251 HydrophobicContact CB-CD1 3.97Å
53	F	86.2	Confident	83.4	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.009	35%	0.353	C	S	.	.	H	α-helix	trans	-66.4	-47	176.7	-64	-84.3	0	0	0	111.6	Y49 Y50 L55 S56 P244 V247 A248 L251 R253 W255	Y49-F53 VanDerWaalsContact O-CD2 3.31Å; Y49-F53 WeakPolarHBondContact O-CD2 3.48Å; Y50-F53 PolarHBondContact O-N 3.34Å; F53-L55 PolarHBondContact O-N 3.12Å; F53-S56 WeakPolarHBondContact O-CB 3.4Å; F53-S56 PolarHBondContact O-N 3.27Å; F53-S56 PolarHBondContact O-OG 3.24Å; F53-P244 HydrophobicContact CB-CB 4.43Å; F53-P244 HydrophobicContact CD1-CB 4.12Å; F53-V247 HydrophobicContact CD1-CB 4.13Å; F53-V247 HydrophobicContact CD1-CG1 3.87Å; F53-V247 HydrophobicContact CE1-CB 4.28Å; F53-V247 HydrophobicContact CE1-CG1 3.93Å; F53-V247 HydrophobicContact CG-CG1 4.46Å; F53-A248 HydrophobicContact CE1-CB 3.95Å; F53-L251 HydrophobicContact CE2-CD1 4.16Å; F53-L251 HydrophobicContact CZ-CD1 4.08Å; F53-R253 HydrophobicContact CZ-CB 4.34Å; F53-R253 WeakPolarHBondContact CZ-O 3.17Å; F53-W255 HydrophobicContact CB-CD2 4.03Å; F53-W255 HydrophobicContact CB-CE3 3.24Å; F53-W255 HydrophobicContact CB-CZ3 3.59Å; F53-W255 HydrophobicContact CD1-CB 4.21Å; F53-W255 HydrophobicContact CD1-CE3 4.41Å; F53-W255 HydrophobicContact CD2-CB 3.74Å; F53-W255 HydrophobicContact CD2-CD2 4.24Å; F53-W255 HydrophobicContact CD2-CE3 4.24Å; F53-W255 HydrophobicContact CD2-CG 4.09Å; F53-W255 HydrophobicContact CE1-CB 4.2Å; F53-W255 HydrophobicContact CE2-CB 3.75Å; F53-W255 HydrophobicContact CE2-CG 4.49Å; F53-W255 HydrophobicContact CG-CB 3.98Å; F53-W255 HydrophobicContact CG-CD2 4.2Å; F53-W255 AromaticContact CG-CE3 3.75Å; F53-W255 HydrophobicContact CG-CE3 3.75Å; F53-W255 HydrophobicContact CG-CG 4.35Å; F53-W255 HydrophobicContact CZ-CB 3.99Å
54	L	86.7	Confident	84.3	Confident	68 Å²	68	67.3 Å²	67.3	36%	0.356	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-43.5	177.6	-165.3	91.9	0	0	0	111.9	Y50 S56 S57 I58 W255 L258	Y50-L54 PolarHBondContact O-N 3.07Å; Y50-L54 VanDerWaalsContact O-N 3.13Å; L54-S56 PolarHBondContact O-N 2.78Å; L54-S57 PolarHBondContact O-N 2.88Å; L54-I58 HydrophobicContact CD2-CD1 3.95Å; L54-I58 HydrophobicContact CG-CD1 4.12Å; L54-I58 WeakPolarHBondContact O-CG1 3.48Å; L54-I58 PolarHBondContact O-N 3.17Å; L54-I58 VanDerWaalsContact O-N 3.14Å; L54-W255 HydrophobicContact CD1-CH2 4.3Å; L54-L258 HydrophobicContact CD1-CD1 4.11Å
55	L	90.6	Very high	84.9	Confident	87 Å²	87	67.2 Å²	67.2	46%	0.455	33%	0.33	S	S	.	.	H	α-helix	trans	-61.7	-35.9	178.8	-171.9	70.1	0	0	0	111.1	W51 F53 S57 I58 V59	W51-L55 WeakPolarHBondContact O-CB 3Å; W51-L55 PolarHBondContact O-N 3.07Å; F53-L55 PolarHBondContact O-N 3.12Å; L55-S57 VanDerWaalsContact C-N 3.32Å; L55-S57 PolarHBondContact O-N 3.44Å; L55-I58 PolarHBondContact O-N 3.36Å; L55-V59 HydrophobicContact CD1-CG2 4.1Å; L55-V59 HydrophobicContact CG-CG2 3.96Å; L55-V59 VanDerWaalsContact O-CB 3.3Å; L55-V59 WeakPolarHBondContact O-CB 3.36Å; L55-V59 VanDerWaalsContact O-CG2 3.23Å; L55-V59 WeakPolarHBondContact O-CG2 3.49Å; L55-V59 PolarHBondContact O-N 3.39Å
56	S	90.8	Very high	85.8	Confident	19 Å²	19	70.8 Å²	70.8	13%	0.133	35%	0.349	C	S	.	.	H	α-helix	trans	-59.3	-41.3	176.7	80	0	0	0	0	112.9	C52 F53 L54 T60	C52-S56 PolarHBondContact O-N 3.09Å; C52-S56 VanDerWaalsContact O-N 3.08Å; F53-S56 WeakPolarHBondContact O-CB 3.4Å; F53-S56 PolarHBondContact O-N 3.27Å; F53-S56 PolarHBondContact O-OG 3.24Å; L54-S56 PolarHBondContact O-N 2.78Å; S56-T60 WeakPolarHBondContact O-CB 3.45Å; S56-T60 VanDerWaalsContact O-CG2 3.27Å; S56-T60 WeakPolarHBondContact O-CG2 3.41Å; S56-T60 PolarHBondContact O-N 2.95Å; S56-T60 PolarHBondContact O-OG1 3.32Å
57	S	90.9	Very high	86.7	Confident	3 Å²	3	66.9 Å²	66.9	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-68.6	-41.5	176.1	-62	0	0	0	0	112.3	L54 L55 T60 F61 Y239 P244	L54-S57 PolarHBondContact O-N 2.88Å; L55-S57 VanDerWaalsContact C-N 3.32Å; L55-S57 PolarHBondContact O-N 3.44Å; S57-T60 WeakPolarHBondContact CA-OG1 3.47Å; S57-T60 PolarHBondContact O-OG1 3.06Å; S57-F61 WeakPolarHBondContact O-CB 3.35Å; S57-F61 PolarHBondContact O-N 3.04Å; S57-Y239 WeakPolarHBondContact CB-O 3.29Å; S57-Y239 PolarHBondContact OG-O 2.87Å; S57-P244 WeakPolarHBondContact OG-CG 3.48Å
58	I	90.7	Very high	87.4	Confident	77 Å²	77	61.3 Å²	61.3	40%	0.395	31%	0.313	S	S	.	.	H	α-helix	trans	-68.1	-44.1	179.3	-64.4	168	0	0	0	110.8	L54 L55 F61 C62	L54-I58 HydrophobicContact CD2-CD1 3.95Å; L54-I58 HydrophobicContact CG-CD1 4.12Å; L54-I58 WeakPolarHBondContact O-CG1 3.48Å; L54-I58 PolarHBondContact O-N 3.17Å; L54-I58 VanDerWaalsContact O-N 3.14Å; L55-I58 PolarHBondContact O-N 3.36Å; I58-F61 PolarHBondContact O-N 2.94Å; I58-C62 WeakPolarHBondContact O-CB 3.12Å; I58-C62 PolarHBondContact O-N 3.17Å; I58-C62 PolarHBondContact O-SG 3.29Å; I58-C62 VanDerWaalsContact O-SG 3.34Å
59	V	91.8	Very high	88	Confident	65 Å²	65	59.1 Å²	59.1	39%	0.394	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-42.6	178.8	170.2	0	0	0	0	110.9	L55 C62 L63	L55-V59 HydrophobicContact CD1-CG2 4.1Å; L55-V59 HydrophobicContact CG-CG2 3.96Å; L55-V59 VanDerWaalsContact O-CB 3.3Å; L55-V59 WeakPolarHBondContact O-CB 3.36Å; L55-V59 VanDerWaalsContact O-CG2 3.23Å; L55-V59 WeakPolarHBondContact O-CG2 3.49Å; L55-V59 PolarHBondContact O-N 3.39Å; V59-C62 PolarHBondContact O-N 3.49Å; V59-L63 HydrophobicContact CG1-CD1 3.64Å; V59-L63 HydrophobicContact CG1-CG 4.18Å; V59-L63 VanDerWaalsContact O-CB 3.3Å; V59-L63 WeakPolarHBondContact O-CB 3.38Å; V59-L63 VanDerWaalsContact O-CG 3.24Å; V59-L63 WeakPolarHBondContact O-CG 3.44Å; V59-L63 PolarHBondContact O-N 3.07Å
60	T	90.1	Very high	88.3	Confident	52 Å²	52	58.8 Å²	58.8	32%	0.319	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-41.4	176.2	46.3	0	0	0	0	112.3	S56 S57 S64 P243	S56-T60 WeakPolarHBondContact O-CB 3.45Å; S56-T60 VanDerWaalsContact O-CG2 3.27Å; S56-T60 WeakPolarHBondContact O-CG2 3.41Å; S56-T60 PolarHBondContact O-N 2.95Å; S56-T60 PolarHBondContact O-OG1 3.32Å; S57-T60 WeakPolarHBondContact CA-OG1 3.47Å; S57-T60 PolarHBondContact O-OG1 3.06Å; T60-S64 WeakPolarHBondContact O-CB 3.38Å; T60-S64 PolarHBondContact O-N 3.29Å; T60-S64 PolarHBondContact O-OG 3.37Å; T60-P243 HydrophobicContact CG2-CB 4.11Å; T60-P243 HydrophobicContact CG2-CG 3.92Å; T60-P243 WeakPolarHBondContact OG1-CG 3.37Å
61	F	90.9	Very high	88.5	Confident	53 Å²	53	60.9 Å²	60.9	23%	0.232	32%	0.324	C	S	.	.	H	α-helix	trans	-59.8	-53.1	172.4	170.8	-103.7	0	0	0	111.9	S57 I58 L63 S64 M65 L231 F236 Y239	S57-F61 WeakPolarHBondContact O-CB 3.35Å; S57-F61 PolarHBondContact O-N 3.04Å; I58-F61 PolarHBondContact O-N 2.94Å; F61-L63 VanDerWaalsContact C-N 3.35Å; F61-L63 PolarHBondContact O-N 3Å; F61-S64 PolarHBondContact O-N 2.83Å; F61-S64 PolarHBondContact O-OG 3.34Å; F61-M65 HydrophobicContact CD2-CG 4.5Å; F61-M65 HydrophobicContact CE1-CG 4.44Å; F61-M65 HydrophobicContact CE2-CE 3.92Å; F61-M65 HydrophobicContact CE2-CG 3.99Å; F61-M65 HydrophobicContact CZ-CE 4.18Å; F61-M65 HydrophobicContact CZ-CG 3.95Å; F61-M65 PolarHBondContact O-N 3.17Å; F61-L231 HydrophobicContact CE2-CD2 4.16Å; F61-L231 HydrophobicContact CZ-CD2 4.11Å; F61-F236 HydrophobicContact CD2-CE1 4.34Å; F61-F236 HydrophobicContact CE2-CE1 4.15Å; F61-F236 HydrophobicContact CE2-CZ 4.2Å; F61-Y239 HydrophobicContact CB-CD2 4.27Å; F61-Y239 AromaticContact CD2-CD2 3.96Å; F61-Y239 HydrophobicContact CD2-CD2 3.96Å; F61-Y239 AromaticContact CD2-CE2 3.63Å; F61-Y239 HydrophobicContact CD2-CE2 3.63Å; F61-Y239 HydrophobicContact CE2-CE2 4.39Å
62	C	91.4	Very high	88.5	Confident	70 Å²	70	60 Å²	60	47%	0.473	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-41.4	-179.2	-71.3	0	0	0	0	112.5	I58 V59 M65 L66	I58-C62 WeakPolarHBondContact O-CB 3.12Å; I58-C62 PolarHBondContact O-N 3.17Å; I58-C62 PolarHBondContact O-SG 3.29Å; I58-C62 VanDerWaalsContact O-SG 3.34Å; V59-C62 PolarHBondContact O-N 3.49Å; C62-M65 PolarHBondContact O-N 3.3Å; C62-L66 VanDerWaalsContact O-CB 3.32Å; C62-L66 WeakPolarHBondContact O-CB 3.17Å; C62-L66 PolarHBondContact O-N 2.84Å
63	L	91	Very high	88.2	Confident	100 Å²	100	62.6 Å²	62.6	52%	0.524	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-44.3	175.2	-74.3	170.8	0	0	0	111.3	V59 F61 M65 L66 C67	V59-L63 HydrophobicContact CG1-CD1 3.64Å; V59-L63 HydrophobicContact CG1-CG 4.18Å; V59-L63 VanDerWaalsContact O-CB 3.3Å; V59-L63 WeakPolarHBondContact O-CB 3.38Å; V59-L63 VanDerWaalsContact O-CG 3.24Å; V59-L63 WeakPolarHBondContact O-CG 3.44Å; V59-L63 PolarHBondContact O-N 3.07Å; F61-L63 VanDerWaalsContact C-N 3.35Å; F61-L63 PolarHBondContact O-N 3Å; L63-M65 VanDerWaalsContact C-N 3.33Å; L63-M65 PolarHBondContact O-N 3.02Å; L63-L66 PolarHBondContact O-N 3.41Å; L63-C67 WeakPolarHBondContact O-CB 3.43Å; L63-C67 PolarHBondContact O-N 3.41Å; L63-C67 PolarHBondContact O-SG 3.1Å
64	S	87.7	Confident	88	Confident	27 Å²	27	66.9 Å²	66.9	19%	0.189	35%	0.353	C	S	.	.	H	α-helix	trans	-60.6	-42.8	178.2	74.3	0	0	0	0	112.1	T60 F61 C67 V68	T60-S64 WeakPolarHBondContact O-CB 3.38Å; T60-S64 PolarHBondContact O-N 3.29Å; T60-S64 PolarHBondContact O-OG 3.37Å; F61-S64 PolarHBondContact O-N 2.83Å; F61-S64 PolarHBondContact O-OG 3.34Å; S64-C67 PolarHBondContact O-N 3.03Å; S64-V68 PolarHBondContact O-N 3.3Å; S64-V68 VanDerWaalsContact O-N 3.13Å
65	M	87.8	Confident	87.5	Confident	30 Å²	30	66 Å²	66	15%	0.148	35%	0.351	C	S	.	.	H	α-helix	trans	-65	-45.4	175.7	-83.7	-63.4	177.8	0	0	112.1	F61 C62 L63 C67 V68 V69 V227 L230 L231	F61-M65 HydrophobicContact CD2-CG 4.5Å; F61-M65 HydrophobicContact CE1-CG 4.44Å; F61-M65 HydrophobicContact CE2-CE 3.92Å; F61-M65 HydrophobicContact CE2-CG 3.99Å; F61-M65 HydrophobicContact CZ-CE 4.18Å; F61-M65 HydrophobicContact CZ-CG 3.95Å; F61-M65 PolarHBondContact O-N 3.17Å; C62-M65 PolarHBondContact O-N 3.3Å; L63-M65 VanDerWaalsContact C-N 3.33Å; L63-M65 PolarHBondContact O-N 3.02Å; M65-C67 VanDerWaalsContact C-N 3.3Å; M65-C67 PolarHBondContact O-N 3.21Å; M65-V68 PolarHBondContact O-N 3.2Å; M65-V69 WeakPolarHBondContact O-CB 3.45Å; M65-V69 VanDerWaalsContact O-CG2 3.31Å; M65-V69 WeakPolarHBondContact O-CG2 3.48Å; M65-V69 PolarHBondContact O-N 3.11Å; M65-V227 HydrophobicContact CE-CG1 4.46Å; M65-V227 HydrophobicContact SD-CG1 4.39Å; M65-L230 HydrophobicContact CE-CB 3.33Å; M65-L230 HydrophobicContact CE-CD1 4.02Å; M65-L230 HydrophobicContact CE-CG 4.35Å; M65-L230 HydrophobicContact CG-CD1 4.25Å; M65-L230 HydrophobicContact SD-CB 4.17Å; M65-L230 HydrophobicContact SD-CD1 3.7Å; M65-L231 HydrophobicContact CE-CD1 4.33Å; M65-L231 HydrophobicContact CE-CD2 3.62Å; M65-L231 HydrophobicContact CE-CG 3.57Å
66	L	90.3	Very high	86.8	Confident	104 Å²	104	71.2 Å²	71.2	55%	0.545	37%	0.366	S	S	.	.	H	α-helix	trans	-60.4	-42.3	178.2	-169.3	150.8	0	0	0	110.9	C62 L63 V69 T70	C62-L66 VanDerWaalsContact O-CB 3.32Å; C62-L66 WeakPolarHBondContact O-CB 3.17Å; C62-L66 PolarHBondContact O-N 2.84Å; L63-L66 PolarHBondContact O-N 3.41Å; L66-V69 PolarHBondContact O-N 3.49Å; L66-T70 HydrophobicContact CD2-CG2 3.91Å; L66-T70 HydrophobicContact CG-CG2 4.49Å; L66-T70 WeakPolarHBondContact O-CB 3.46Å; L66-T70 WeakPolarHBondContact O-CG2 3.44Å; L66-T70 PolarHBondContact O-N 3.16Å; L66-T70 PolarHBondContact O-OG1 3.36Å
67	C	88.6	Confident	86.2	Confident	76 Å²	76	76.4 Å²	76.4	51%	0.514	39%	0.391	S	S	.	.	H	α-helix	trans	-60.6	-43.6	175.7	-71.8	0	0	0	0	112.8	L63 S64 M65 T70 W71	L63-C67 WeakPolarHBondContact O-CB 3.43Å; L63-C67 PolarHBondContact O-N 3.41Å; L63-C67 PolarHBondContact O-SG 3.1Å; S64-C67 PolarHBondContact O-N 3.03Å; M65-C67 VanDerWaalsContact C-N 3.3Å; M65-C67 PolarHBondContact O-N 3.21Å; C67-T70 WeakPolarHBondContact CA-OG1 3.48Å; C67-T70 PolarHBondContact O-OG1 3.11Å; C67-W71 VanDerWaalsContact O-CB 3.32Å; C67-W71 WeakPolarHBondContact O-CB 3.35Å; C67-W71 PolarHBondContact O-N 3.23Å
68	V	85.9	Confident	85.4	Confident	9 Å²	9	81.1 Å²	81.1	6%	0.055	42%	0.423	C	S	.	.	H	α-helix	trans	-71.8	-40.1	179.6	173.2	0	0	0	0	112	S64 M65 W71 R72 F220 K226 V227 L230	S64-V68 PolarHBondContact O-N 3.3Å; S64-V68 VanDerWaalsContact O-N 3.13Å; M65-V68 PolarHBondContact O-N 3.2Å; V68-W71 PolarHBondContact O-N 3.07Å; V68-R72 PolarHBondContact O-N 3.22Å; V68-F220 HydrophobicContact CG2-CE2 3.84Å; V68-F220 HydrophobicContact CG2-CZ 3.84Å; V68-K226 HydrophobicContact CG1-CB 3.7Å; V68-K226 HydrophobicContact CG2-CB 4.27Å; V68-V227 HydrophobicContact CG1-CG2 3.64Å; V68-L230 HydrophobicContact CB-CD1 4.04Å; V68-L230 HydrophobicContact CG2-CD1 3.57Å; V68-L230 HydrophobicContact CG2-CG 4.5Å
69	V	85.9	Confident	83.9	Confident	66 Å²	66	83.5 Å²	83.5	40%	0.4	44%	0.435	S	S	.	.	H	α-helix	trans	-67.4	-44.3	178.1	172.5	0	0	0	0	110.6	M65 L66 W71 R72 I73	M65-V69 WeakPolarHBondContact O-CB 3.45Å; M65-V69 VanDerWaalsContact O-CG2 3.31Å; M65-V69 WeakPolarHBondContact O-CG2 3.48Å; M65-V69 PolarHBondContact O-N 3.11Å; L66-V69 PolarHBondContact O-N 3.49Å; V69-W71 VanDerWaalsContact C-N 3.35Å; V69-W71 PolarHBondContact O-N 2.79Å; V69-R72 PolarHBondContact O-N 2.74Å; V69-I73 HydrophobicContact CG1-CD1 3.74Å; V69-I73 HydrophobicContact CG1-CG1 4.38Å; V69-I73 VanDerWaalsContact O-CG1 3.25Å; V69-I73 WeakPolarHBondContact O-CG1 3.25Å; V69-I73 PolarHBondContact O-N 3.07Å
70	T	86.7	Confident	81.5	Confident	59 Å²	59	87.2 Å²	87.2	36%	0.362	45%	0.452	S	S	.	.	H	α-helix	trans	-61.9	-42.1	174.5	46	0	0	0	0	111.6	L66 C67 R72 I73 I74	L66-T70 HydrophobicContact CD2-CG2 3.91Å; L66-T70 HydrophobicContact CG-CG2 4.49Å; L66-T70 WeakPolarHBondContact O-CB 3.46Å; L66-T70 WeakPolarHBondContact O-CG2 3.44Å; L66-T70 PolarHBondContact O-N 3.16Å; L66-T70 PolarHBondContact O-OG1 3.36Å; C67-T70 WeakPolarHBondContact CA-OG1 3.48Å; C67-T70 PolarHBondContact O-OG1 3.11Å; T70-R72 PolarHBondContact O-N 3.13Å; T70-I73 PolarHBondContact O-N 2.77Å; T70-I74 WeakPolarHBondContact O-CB 3.05Å; T70-I74 WeakPolarHBondContact O-CD1 3.36Å; T70-I74 WeakPolarHBondContact O-CG1 3.36Å; T70-I74 PolarHBondContact O-N 3.1Å
71	W	84.2	Confident	79.2	Confident	138 Å²	138	90.8 Å²	90.8	52%	0.523	48%	0.477	S	S	.	.	H	α-helix	trans	-57.8	-48.4	172.4	176.7	-95.8	0	0	0	112.3	C67 V68 V69 I73 I74 T75 M143	C67-W71 VanDerWaalsContact O-CB 3.32Å; C67-W71 WeakPolarHBondContact O-CB 3.35Å; C67-W71 PolarHBondContact O-N 3.23Å; V68-W71 PolarHBondContact O-N 3.07Å; V69-W71 VanDerWaalsContact C-N 3.35Å; V69-W71 PolarHBondContact O-N 2.79Å; W71-I73 VanDerWaalsContact C-N 3.34Å; W71-I73 PolarHBondContact O-N 2.93Å; W71-I74 PolarHBondContact O-N 3.28Å; W71-T75 HydrophobicContact CD2-CG2 4.37Å; W71-T75 HydrophobicContact CZ2-CG2 4.11Å; W71-T75 WeakPolarHBondContact O-CG2 3.34Å; W71-T75 PolarHBondContact O-N 3.42Å; W71-T75 PolarHBondContact O-OG1 2.93Å; W71-T75 VanDerWaalsContact O-OG1 3.13Å; W71-M143 HydrophobicContact CZ2-SD 4.31Å
72	R	82.8	Confident	77	Confident	121 Å²	121	93.2 Å²	93.2	46%	0.457	50%	0.5	S	S	.	.	H	α-helix	trans	-59.7	-43.4	177.1	-85.4	-163	175.7	-167.8	5.1	112.3	V68 V69 T70 T75 Y76 D225	V68-R72 PolarHBondContact O-N 3.22Å; V69-R72 PolarHBondContact O-N 2.74Å; T70-R72 PolarHBondContact O-N 3.13Å; R72-T75 WeakPolarHBondContact CA-OG1 3.44Å; R72-T75 PolarHBondContact O-N 2.97Å; R72-T75 PolarHBondContact O-OG1 2.96Å; R72-Y76 WeakPolarHBondContact O-CB 3.07Å; R72-Y76 PolarHBondContact O-N 3.26Å; R72-D225 IonicContact CZ-OD1 3.49Å; R72-D225 VanDerWaalsContact NH2-CG 3.27Å; R72-D225 IonicContact NH2-OD1 3.05Å; R72-D225 PolarHBondContact NH2-OD1 2.92Å; R72-D225 IonicContact NH2-OD2 2.79Å; R72-D225 PolarHBondContact NH2-OD2 3.31Å
73	I	81.9	Confident	74.4	Confident	88 Å²	88	93.5 Å²	93.5	45%	0.451	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-45.5	177.4	-68.5	166.5	0	0	0	110.3	V69 T70 W71 T75 Y76 I77	V69-I73 HydrophobicContact CG1-CD1 3.74Å; V69-I73 HydrophobicContact CG1-CG1 4.38Å; V69-I73 VanDerWaalsContact O-CG1 3.25Å; V69-I73 WeakPolarHBondContact O-CG1 3.25Å; V69-I73 PolarHBondContact O-N 3.07Å; T70-I73 PolarHBondContact O-N 2.77Å; W71-I73 VanDerWaalsContact C-N 3.34Å; W71-I73 PolarHBondContact O-N 2.93Å; I73-T75 PolarHBondContact O-N 3.12Å; I73-Y76 PolarHBondContact O-N 3.08Å; I73-I77 HydrophobicContact CG2-CD1 3.58Å; I73-I77 HydrophobicContact CG2-CG1 4.36Å; I73-I77 VanDerWaalsContact O-CG1 3.26Å; I73-I77 WeakPolarHBondContact O-CG1 3.23Å; I73-I77 PolarHBondContact O-N 2.9Å
74	I	82.3	Confident	71.8	Confident	93 Å²	93	97.2 Å²	97.2	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-60.8	-46.4	177.1	-68.4	163.8	0	0	0	110.5	T70 W71 Y76 I77 C78	T70-I74 WeakPolarHBondContact O-CB 3.05Å; T70-I74 WeakPolarHBondContact O-CD1 3.36Å; T70-I74 WeakPolarHBondContact O-CG1 3.36Å; T70-I74 PolarHBondContact O-N 3.1Å; W71-I74 PolarHBondContact O-N 3.28Å; I74-Y76 VanDerWaalsContact C-N 3.29Å; I74-Y76 PolarHBondContact O-N 3.46Å; I74-I77 PolarHBondContact O-N 2.97Å; I74-C78 WeakPolarHBondContact O-CB 3.45Å; I74-C78 PolarHBondContact O-N 3.39Å; I74-C78 PolarHBondContact O-SG 3.16Å; I74-C78 VanDerWaalsContact O-SG 3.34Å
75	T	74.8	Confident	69.2	Low	50 Å²	50	103.5 Å²	103.5	31%	0.307	57%	0.566	S	S	.	*	H	α-helix	trans	-64.6	-33.2	177.8	51.5	0	0	0	0	113	W71 R72 I73 I79	W71-T75 HydrophobicContact CD2-CG2 4.37Å; W71-T75 HydrophobicContact CZ2-CG2 4.11Å; W71-T75 WeakPolarHBondContact O-CG2 3.34Å; W71-T75 PolarHBondContact O-N 3.42Å; W71-T75 PolarHBondContact O-OG1 2.93Å; W71-T75 VanDerWaalsContact O-OG1 3.13Å; R72-T75 WeakPolarHBondContact CA-OG1 3.44Å; R72-T75 PolarHBondContact O-N 2.97Å; R72-T75 PolarHBondContact O-OG1 2.96Å; I73-T75 PolarHBondContact O-N 3.12Å; T75-I79 WeakPolarHBondContact O-CD1 3.48Å; T75-I79 WeakPolarHBondContact O-CG1 3.45Å
76	Y	75.9	Confident	66.5	Low	196 Å²	196	110.7 Å²	110.7	77%	0.769	60%	0.599	S	S	*	*	H	α-helix	trans	-71.2	-37	176.1	-176.8	-99.7	0	0	0	111.9	R72 I73 I74	R72-Y76 WeakPolarHBondContact O-CB 3.07Å; R72-Y76 PolarHBondContact O-N 3.26Å; I73-Y76 PolarHBondContact O-N 3.08Å; I74-Y76 VanDerWaalsContact C-N 3.29Å; I74-Y76 PolarHBondContact O-N 3.46Å
77	I	78.8	Confident	63.6	Low	128 Å²	128	110.5 Å²	110.5	66%	0.656	60%	0.604	S	S	*	*	H	α-helix	trans	-75.8	-32.8	179	-66.9	169.1	0	0	0	111.9	I73 I74	I73-I77 HydrophobicContact CG2-CD1 3.58Å; I73-I77 HydrophobicContact CG2-CG1 4.36Å; I73-I77 VanDerWaalsContact O-CG1 3.26Å; I73-I77 WeakPolarHBondContact O-CG1 3.23Å; I73-I77 PolarHBondContact O-N 2.9Å; I74-I77 PolarHBondContact O-N 2.97Å
78	C	74.3	Confident	60.9	Low	102 Å²	102	115.4 Å²	115.4	69%	0.689	62%	0.619	S	S	*	*	S	Bend	trans	-84.8	-5.6	-176.4	-68.3	0	0	0	0	115	I74	I74-C78 WeakPolarHBondContact O-CB 3.45Å; I74-C78 PolarHBondContact O-N 3.39Å; I74-C78 PolarHBondContact O-SG 3.16Å; I74-C78 VanDerWaalsContact O-SG 3.34Å
79	I	58.2	Low	58	Low	127 Å²	127	123.2 Å²	123.2	65%	0.651	65%	0.648	S	S	*	*	S	Bend	trans	-113.1	99.9	-179.6	-59.8	172.9	0	0	0	108.7	T75	T75-I79 WeakPolarHBondContact O-CD1 3.48Å; T75-I79 WeakPolarHBondContact O-CG1 3.45Å
80	D	43	Very low	55.3	Low	142 Å²	142	126.1 Å²	126.1	76%	0.759	66%	0.66	S	S	*	*			trans	-63.2	132.7	179.1	-114.9	-31	0	0	0	111.5	S82	D80-S82 VanDerWaalsContact C-N 3.3Å; D80-S82 PolarHBondContact O-N 3.5Å
81	P	41.6	Very low	52.4	Low	128 Å²	128	129.5 Å²	129.5	83%	0.831	67%	0.67	S	S	*	*	S	Bend	trans	-86.1	42.2	-165.8	36.3	-38.3	0	0	0	114.6
82	S	43.3	Very low	49.8	Very low	103 Å²	103	133.4 Å²	133.4	72%	0.72	69%	0.686	S	S	*	*			trans	-142.9	94.3	-175.1	47.6	0	0	0	0	112.6	D80	D80-S82 VanDerWaalsContact C-N 3.3Å; D80-S82 PolarHBondContact O-N 3.5Å
83	G	37.3	Very low	47.1	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	69%	0.688	S	S	*	*	S	Bend	trans	161.8	6.5	163.2	0	0	0	0	0	122
84	L	36.4	Very low	44.6	Very low	177 Å²	177	134 Å²	134	93%	0.927	70%	0.703	S	S	*	*			trans	-149.8	80	171.9	-97.8	149.2	0	0	0	110.9
85	D	32.4	Very low	42.2	Very low	159 Å²	159	134.2 Å²	134.2	85%	0.85	71%	0.705	S	S	*	*			trans	-74.9	146	155.9	-83.2	-44.8	0	0	0	109.7
86	E	32.1	Very low	40	Very low	181 Å²	181	140.3 Å²	140.3	85%	0.846	74%	0.735	S	S	*	*	S	Bend	trans	86.6	145.2	160	-88.6	-172.5	162.2	0	0	120.7
87	P	30.3	Very low	37.9	Very low	100 Å²	100	135.6 Å²	135.6	65%	0.649	72%	0.724	S	S	*	*				-126.2	115.9	-108.3	33.7	-16.1	0	0	0	112.3	R89	P87-R89 PolarHBondContact O-N 2.81Å; P87-R89 VanDerWaalsContact O-N 3.13Å
88	H	30.7	Very low	35.9	Very low	180 Å²	180	135.4 Å²	135.4	83%	0.833	73%	0.731	S	S	*	*			trans	-89.3	75.4	159.3	-79.7	-58.5	0	0	0	110.5	I90	H88-I90 PolarHBondContact O-N 3.05Å
89	R	25.8	Very low	34	Very low	172 Å²	172	135.9 Å²	135.9	65%	0.649	73%	0.726	S	S	*	*			trans	-59.6	76.1	149.3	-165	-173.3	-170.8	179	5.4	107.8	P87 K91 D93	P87-R89 PolarHBondContact O-N 2.81Å; P87-R89 VanDerWaalsContact O-N 3.13Å; R89-K91 HydrophobicContact CG-CG 3.88Å; R89-K91 PolarHBondContact O-N 3.4Å; R89-D93 IonicContact CZ-OD2 3.12Å; R89-D93 IonicContact NE-OD2 3.92Å; R89-D93 PolarHBondContact NE-OD2 3.12Å; R89-D93 IonicContact NH2-OD2 4Å; R89-D93 PolarHBondContact NH2-OD2 2.95Å
90	I	29.1	Very low	32.8	Very low	128 Å²	128	130.6 Å²	130.6	66%	0.656	70%	0.702	S	S	*	*			trans	-69.1	92.8	149.4	-60.9	179.4	0	0	0	103.6	H88 Y92	H88-I90 PolarHBondContact O-N 3.05Å; I90-Y92 VanDerWaalsContact C-N 3.28Å; I90-Y92 HydrophobicContact CG2-CD2 4.14Å; I90-Y92 HydrophobicContact CG2-CE2 3.92Å; I90-Y92 PolarHBondContact O-N 3.2Å
91	K	25.9	Very low	32.5	Very low	130 Å²	130	127.7 Å²	127.7	57%	0.565	70%	0.698	S	S	*	*			trans	-51.7	99	164.6	-80.7	-174	170	179.3	0	107.4	R89 D93	R89-K91 HydrophobicContact CG-CG 3.88Å; R89-K91 PolarHBondContact O-N 3.4Å; K91-D93 HydrophobicContact CB-CB 4.07Å; K91-D93 HydrophobicContact CD-CB 4.19Å; K91-D93 HydrophobicContact CG-CB 3.98Å
92	Y	30	Very low	32.2	Very low	219 Å²	219	129 Å²	129	86%	0.859	69%	0.692	S	S	*	*			trans	-88.5	52.1	133.3	-66.8	-77.3	0	0	0	107.6	I90 V94	I90-Y92 VanDerWaalsContact C-N 3.28Å; I90-Y92 HydrophobicContact CG2-CD2 4.14Å; I90-Y92 HydrophobicContact CG2-CE2 3.92Å; I90-Y92 PolarHBondContact O-N 3.2Å; Y92-V94 PolarHBondContact O-N 3.02Å
93	D	25.5	Very low	31.6	Very low	95 Å²	95	126.7 Å²	126.7	51%	0.508	68%	0.68	S	S	.	*			trans	-89.1	83	163	-82.2	-21.6	0	0	0	106.4	R89 K91	R89-D93 IonicContact CZ-OD2 3.12Å; R89-D93 IonicContact NE-OD2 3.92Å; R89-D93 PolarHBondContact NE-OD2 3.12Å; R89-D93 IonicContact NH2-OD2 4Å; R89-D93 PolarHBondContact NH2-OD2 2.95Å; K91-D93 HydrophobicContact CB-CB 4.07Å; K91-D93 HydrophobicContact CD-CB 4.19Å; K91-D93 HydrophobicContact CG-CB 3.98Å
94	V	28.8	Very low	31.5	Very low	128 Å²	128	131.6 Å²	131.6	78%	0.776	68%	0.679	S	S	*	*	S	Bend	trans	-152.3	123.3	145.8	-161.7	0	0	0	0	107.7	Y92	Y92-V94 PolarHBondContact O-N 3.02Å
95	L	32.4	Very low	31.4	Very low	97 Å²	97	130.7 Å²	130.7	51%	0.508	67%	0.67	S	S	.	*	S	Bend	trans	97.2	40.8	174.5	-59.4	142.2	0	0	0	117.8	A100	L95-A100 HydrophobicContact CD2-CB 3.22Å; L95-A100 WeakPolarHBondContact CD2-O 3.38Å; L95-A100 HydrophobicContact CG-CB 3.97Å
96	N	29.1	Very low	31.4	Very low	177 Å²	177	126.2 Å²	126.2	95%	0.947	66%	0.656	S	S	*	*			trans	-114.7	79.8	133.5	-99.4	-11.1	0	0	0	106.6
97	D	31	Very low	31.5	Very low	98 Å²	98	125.1 Å²	125.1	52%	0.524	65%	0.654	S	S	.	*	S	Bend	trans	-140.9	126	166	-161.7	-2.7	0	0	0	105.6	D99 A100	D97-D99 PolarHBondContact O-N 3.49Å; D97-A100 HydrophobicContact CB-CB 4.09Å; D97-A100 PolarHBondContact O-N 3.34Å; D97-A100 VanDerWaalsContact O-N 3.12Å
98	P	37.3	Very low	31.9	Very low	123 Å²	123	128.2 Å²	128.2	80%	0.799	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-9.2	176.1	-23.5	33.9	0	0	0	114.3
99	D	34	Very low	31.9	Very low	112 Å²	112	126 Å²	126	60%	0.599	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-3.9	-178.7	-64.1	-28.9	0	0	0	114.8	D97 Q102	D97-D99 PolarHBondContact O-N 3.49Å; D99-Q102 PolarHBondContact O-N 3.05Å
100	A	32.8	Very low	32.1	Very low	16 Å²	16	121.6 Å²	121.6	13%	0.132	67%	0.666	C	S	.	*	G	3₁₀ helix	trans	-89.3	-2.5	-176.7	0	0	0	0	0	114	L95 D97 Q102	L95-A100 HydrophobicContact CD2-CB 3.22Å; L95-A100 WeakPolarHBondContact CD2-O 3.38Å; L95-A100 HydrophobicContact CG-CB 3.97Å; D97-A100 HydrophobicContact CB-CB 4.09Å; D97-A100 PolarHBondContact O-N 3.34Å; D97-A100 VanDerWaalsContact O-N 3.12Å; A100-Q102 PolarHBondContact O-N 3.46Å
101	A	36.1	Very low	32.2	Very low	82 Å²	82	120.1 Å²	120.1	68%	0.678	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-71.9	-11.2	163.2	0	0	0	0	0	113.3
102	Q	35.2	Very low	32.3	Very low	154 Å²	154	121 Å²	121	72%	0.72	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-97.2	-8.6	174	-71.5	178.8	-3	0	0	113.9	D99 A100	D99-Q102 PolarHBondContact O-N 3.05Å; A100-Q102 PolarHBondContact O-N 3.46Å
103	A	32.1	Very low	32.3	Very low	56 Å²	56	118.3 Å²	118.3	46%	0.463	68%	0.68	S	S	.	*	S	Bend	trans	-98.3	-11.6	-175.9	0	0	0	0	0	114.9
104	K	34.3	Very low	32.4	Very low	179 Å²	179	118.9 Å²	118.9	78%	0.778	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-7.6	174.2	-143.3	172.4	-177.6	178	0	113.2
105	E	34	Very low	32.4	Very low	158 Å²	158	117.2 Å²	117.2	74%	0.738	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	1.2	168.1	-81.9	178.8	148.8	0	0	113.3
106	A	33.7	Very low	32.2	Very low	66 Å²	66	116.4 Å²	116.4	55%	0.545	70%	0.698	S	S	.	*	S	Bend	trans	-106.2	-2.5	-178.1	0	0	0	0	0	115.3
107	I	34.2	Very low	32.2	Very low	158 Å²	158	116.5 Å²	116.5	81%	0.81	69%	0.693	S	S	*	*	S	Bend	trans	-106.4	0.5	-178.8	-62.7	174.7	0	0	0	112.4
108	L	37.1	Very low	32.1	Very low	164 Å²	164	115.8 Å²	115.8	86%	0.859	70%	0.7	S	S	*	*	S	Bend	trans	-96.8	6.7	172.5	-142.8	83.5	0	0	0	113.6
109	N	30.9	Very low	31.7	Very low	135 Å²	135	121 Å²	121	72%	0.722	70%	0.704	S	S	*	*	S	Bend	trans	-123.6	105.4	-179.3	-71.8	-33.1	0	0	0	110.3
110	G	29.7	Very low	31.3	Very low	78 Å²	78	126.7 Å²	126.7	80%	0.804	72%	0.717	S	S	*	*			trans	113.4	124.3	152.6	0	0	0	0	0	117.6
111	A	32.1	Very low	31.2	Very low	97 Å²	97	130.9 Å²	130.9	80%	0.802	75%	0.745	S	S	*	*			trans	85.2	85.5	150.5	0	0	0	0	0	119
112	D	27.6	Very low	31	Very low	150 Å²	150	133.1 Å²	133.1	80%	0.802	75%	0.753	S	S	*	*				59.2	144.2	103.7	-87.2	-22.6	0	0	0	122.4
113	Q	31.1	Very low	30.6	Very low	162 Å²	162	131.6 Å²	131.6	76%	0.757	75%	0.753	S	S	*	*			trans	91.5	89.6	150.6	-73.6	163.9	40.8	0	0	118.9
114	S	26.8	Very low	30.3	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	77%	0.765	S	S	*	*				46.4	126.8	109	62.2	0	0	0	0	119.7
115	A	28.8	Very low	30.1	Very low	94 Å²	94	132.7 Å²	132.7	78%	0.777	76%	0.763	S	S	*	*			trans	137.7	103.2	136.4	0	0	0	0	0	108.9
116	A	28.2	Very low	29.6	Very low	79 Å²	79	131.5 Å²	131.5	65%	0.653	77%	0.77	S	S	*	*				97.6	127	80.4	0	0	0	0	0	111.5
117	Q	29	Very low	29.6	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	78%	0.784	S	S	*	*			trans	76.5	128.9	141.9	-79.3	155.4	-31	0	0	120.3
118	A	28.7	Very low	29.4	Very low	82 Å²	82	129.6 Å²	129.6	68%	0.678	78%	0.78	S	S	*	*			trans	74.3	137.7	137	0	0	0	0	0	115.7
119	R	28.6	Very low	28.9	Very low	233 Å²	233	129.6 Å²	129.6	88%	0.879	78%	0.781	S	S	*	*			cis	-168.5	152.5	8.7	-105.8	159	-157.2	-177.3	6.1	106.6
120	R	26.8	Very low	28.8	Very low	232 Å²	232	127.2 Å²	127.2	88%	0.875	79%	0.788	S	S	*	*			trans	-11	129.6	148.3	-68.8	167.4	174.2	170.4	-2.5	117.2
121	S	31.2	Very low	29	Very low	103 Å²	103	128.7 Å²	128.7	72%	0.72	79%	0.793	S	S	*	*			trans	19.7	147.6	137.3	58.7	0	0	0	0	120
122	P	30.3	Very low	28.8	Very low	129 Å²	129	131.1 Å²	131.1	84%	0.838	79%	0.787	S	S	*	*				-145.5	163.7	107.9	35.7	-19.2	0	0	0	116.2
123	V	26.5	Very low	29	Very low	122 Å²	122	133 Å²	133	74%	0.739	79%	0.792	S	S	*	*			trans	-84.2	153.2	170.8	170.1	0	0	0	0	109.8
124	T	27.4	Very low	28.9	Very low	114 Å²	114	135.4 Å²	135.4	70%	0.699	79%	0.794	S	S	*	*			trans	85.3	127.7	151.4	26	0	0	0	0	124.9
125	I	28.8	Very low	29.1	Very low	145 Å²	145	138.1 Å²	138.1	74%	0.744	80%	0.799	S	S	*	*			trans	95.8	115.8	131.5	-67.4	158.7	0	0	0	120.2
126	C	24.8	Very low	29.2	Very low	132 Å²	132	142.6 Å²	142.6	89%	0.892	80%	0.804	S	S	*	*			trans	38.1	127	146.4	-66.2	0	0	0	0	122.1
127	G	32.5	Very low	29.3	Very low	80 Å²	80	142.8 Å²	142.8	83%	0.825	81%	0.813	S	S	*	*			trans	-175.1	102	154.9	0	0	0	0	0	111
128	S	30.1	Very low	29.7	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	81%	0.811	S	S	*	*			trans	-83.3	149.7	-168.4	45.3	0	0	0	0	115.9
129	N	27.1	Very low	30.2	Very low	164 Å²	164	144.6 Å²	144.6	88%	0.877	82%	0.82	S	S	*	*			trans	86.3	123.3	149.4	-62.7	-13.9	0	0	0	121.1
130	G	29.5	Very low	31.4	Very low	84 Å²	84	139 Å²	139	87%	0.866	81%	0.811	S	S	*	*			trans	100.3	117.3	157.1	0	0	0	0	0	113.1
131	A	33.6	Very low	33.6	Very low	110 Å²	110	129.7 Å²	129.7	91%	0.909	79%	0.788	S	S	*	*			cis	-150.2	162.4	14	0	0	0	0	0	109.8
132	Q	27.6	Very low	36.2	Very low	147 Å²	147	134 Å²	134	69%	0.687	79%	0.789	S	S	*	*			trans	-107.3	109.4	-157	-179.9	174.4	-26.5	0	0	108.7
133	E	31.9	Very low	38.5	Very low	191 Å²	191	133.2 Å²	133.2	89%	0.893	78%	0.775	S	S	*	*			trans	-104.8	106.3	161.3	-82.3	-175	160.4	0	0	108.5
134	R	27.9	Very low	41.2	Very low	212 Å²	212	130.4 Å²	130.4	80%	0.8	76%	0.758	S	S	*	*			trans	-76.3	124.2	170.2	-77.7	174.7	179.5	158.7	-0.1	108.6
135	L	31.8	Very low	44	Very low	162 Å²	162	131.6 Å²	131.6	85%	0.848	76%	0.756	S	S	*	*			trans	-128.2	133.5	154.4	-100.2	131.2	0	0	0	107.9
136	E	31	Very low	46.8	Very low	188 Å²	188	126.2 Å²	126.2	88%	0.879	73%	0.733	S	S	*	*			trans	-75.4	138.9	-150.7	-64.8	165.1	141.4	0	0	114.6	S138	E136-S138 PolarHBondContact O-N 3.43Å
137	G	29.6	Very low	49.9	Very low	83 Å²	83	123.4 Å²	123.4	86%	0.856	71%	0.706	S	S	*	*			trans	-80.5	108.6	164.7	0	0	0	0	0	110.4
138	S	36.9	Very low	52.6	Low	112 Å²	112	124 Å²	124	78%	0.783	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-82.3	128.7	172	-171	0	0	0	0	110.4	E136 V140	E136-S138 PolarHBondContact O-N 3.43Å; S138-V140 PolarHBondContact O-N 2.66Å
139	Q	40.4	Very low	55.4	Low	189 Å²	189	126.5 Å²	126.5	88%	0.883	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-64.1	119.9	177.8	-73	177.7	-26	0	0	110.9
140	V	53.2	Low	58.4	Low	114 Å²	114	118.7 Å²	118.7	69%	0.691	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-70.6	128.1	171.5	-178.1	0	0	0	0	108.7	S138 T144	S138-V140 PolarHBondContact O-N 2.66Å; V140-T144 WeakPolarHBondContact CG1-OG1 3.14Å
141	G	74.2	Confident	61.1	Low	37 Å²	37	116 Å²	116	38%	0.381	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-76.9	160.6	-177	0	0	0	0	0	114.3	M143 T144 E145	G141-M143 PolarHBondContact O-N 2.8Å; G141-T144 WeakPolarHBondContact CA-OG1 3.43Å; G141-T144 PolarHBondContact N-OG1 3.37Å; G141-T144 PolarHBondContact O-N 3.43Å; G141-T144 VanDerWaalsContact O-N 3.09Å; G141-T144 PolarHBondContact O-OG1 3.15Å; G141-E145 PolarHBondContact O-N 3.44Å; G141-E145 VanDerWaalsContact O-N 3.12Å
142	W	84	Confident	63.6	Low	195 Å²	195	115.9 Å²	115.9	74%	0.739	59%	0.594	S	S	*	*	H	α-helix	trans	-57.2	-32.3	176.8	72.2	-85.5	0	0	0	113.2	T144 E145 A146	W142-T144 VanDerWaalsContact C-N 3.35Å; W142-E145 PolarHBondContact O-N 2.92Å; W142-A146 WeakPolarHBondContact O-CB 3.36Å; W142-A146 PolarHBondContact O-N 3.32Å
143	M	78.9	Confident	66.6	Low	111 Å²	111	109.7 Å²	109.7	55%	0.547	57%	0.566	S	S	.	*	H	α-helix	trans	-72.1	-31.7	-179.4	-160.9	167.1	80	0	0	111.8	W71 G141 K147	W71-M143 HydrophobicContact CZ2-SD 4.31Å; G141-M143 PolarHBondContact O-N 2.8Å; M143-K147 WeakPolarHBondContact O-CB 3.25Å; M143-K147 PolarHBondContact O-N 3.25Å
144	T	83.4	Confident	69.1	Low	63 Å²	63	102.4 Å²	102.4	39%	0.387	53%	0.533	S	S	.	.	H	α-helix	trans	-71.2	-43	171.3	30.2	0	0	0	0	111	V140 G141 W142 A146 K147 D148	V140-T144 WeakPolarHBondContact CG1-OG1 3.14Å; G141-T144 WeakPolarHBondContact CA-OG1 3.43Å; G141-T144 PolarHBondContact N-OG1 3.37Å; G141-T144 PolarHBondContact O-N 3.43Å; G141-T144 VanDerWaalsContact O-N 3.09Å; G141-T144 PolarHBondContact O-OG1 3.15Å; W142-T144 VanDerWaalsContact C-N 3.35Å; T144-A146 PolarHBondContact O-N 3.36Å; T144-K147 PolarHBondContact O-N 3.08Å; T144-D148 VanDerWaalsContact O-CG 3.23Å; T144-D148 PolarHBondContact O-N 2.9Å
145	E	87	Confident	71.7	Confident	139 Å²	139	94 Å²	94	65%	0.65	51%	0.507	S	S	*	.	H	α-helix	trans	-61	-44.9	176.2	-171.8	-179.3	-175.9	0	0	112.5	G141 W142 K147 D148 W149	G141-E145 PolarHBondContact O-N 3.44Å; G141-E145 VanDerWaalsContact O-N 3.12Å; W142-E145 PolarHBondContact O-N 2.92Å; E145-K147 VanDerWaalsContact C-N 3.33Å; E145-K147 PolarHBondContact O-N 3.05Å; E145-D148 PolarHBondContact O-N 2.93Å; E145-W149 WeakPolarHBondContact O-CB 3.21Å; E145-W149 PolarHBondContact O-N 3.37Å
146	A	88.3	Confident	73.9	Confident	33 Å²	33	86.5 Å²	86.5	27%	0.273	47%	0.468	S	S	.	.	H	α-helix	trans	-64.3	-37.3	177.7	0	0	0	0	0	112.7	W142 T144 A150 V221	W142-A146 WeakPolarHBondContact O-CB 3.36Å; W142-A146 PolarHBondContact O-N 3.32Å; T144-A146 PolarHBondContact O-N 3.36Å; A146-A150 WeakPolarHBondContact O-CB 3.33Å; A146-A150 PolarHBondContact O-N 3.42Å; A146-V221 HydrophobicContact CB-CG1 4.3Å; A146-V221 WeakPolarHBondContact O-CG1 3.23Å
147	K	89.5	Confident	76.4	Confident	72 Å²	72	84.6 Å²	84.6	31%	0.313	46%	0.459	S	S	.	.	H	α-helix	trans	-66.7	-43.7	176.1	-179.6	-175.2	171.6	-166.1	0	111.2	M143 T144 E145 A150 G151 T224	M143-K147 WeakPolarHBondContact O-CB 3.25Å; M143-K147 PolarHBondContact O-N 3.25Å; T144-K147 PolarHBondContact O-N 3.08Å; E145-K147 VanDerWaalsContact C-N 3.33Å; E145-K147 PolarHBondContact O-N 3.05Å; K147-A150 PolarHBondContact O-N 2.95Å; K147-G151 PolarHBondContact O-N 3.25Å; K147-T224 VanDerWaalsContact NZ-CG2 3.31Å
148	D	87.7	Confident	79.1	Confident	94 Å²	94	81.8 Å²	81.8	50%	0.503	43%	0.427	S	S	.	.	H	α-helix	trans	-66.4	-44.8	179.6	-66.6	-17	0	0	0	110.6	T144 E145 A150 G151 E152	T144-D148 VanDerWaalsContact O-CG 3.23Å; T144-D148 PolarHBondContact O-N 2.9Å; E145-D148 PolarHBondContact O-N 2.93Å; D148-A150 PolarHBondContact O-N 3.41Å; D148-G151 PolarHBondContact O-N 2.98Å; D148-G151 VanDerWaalsContact O-N 3.16Å; D148-E152 PolarHBondContact O-N 3.44Å
149	W	89.5	Confident	81.5	Confident	157 Å²	157	81.6 Å²	81.6	60%	0.595	42%	0.421	S	S	*	.	H	α-helix	trans	-57.5	-47.2	173.4	173.4	77.4	0	0	0	112.8	E145 G151 E152 L153	E145-W149 WeakPolarHBondContact O-CB 3.21Å; E145-W149 PolarHBondContact O-N 3.37Å; W149-G151 VanDerWaalsContact C-N 3.31Å; W149-G151 PolarHBondContact O-N 3.47Å; W149-E152 PolarHBondContact O-N 3.44Å; W149-L153 HydrophobicContact CH2-CD2 4.34Å; W149-L153 HydrophobicContact CZ2-CD2 4.3Å; W149-L153 PolarHBondContact O-N 2.93Å; W149-L153 VanDerWaalsContact O-N 3.17Å
150	A	90	Very high	83.9	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-65.9	-35.9	177.4	0	0	0	0	0	111.7	A146 K147 D148 L153 I154 I218 V221 A222	A146-A150 WeakPolarHBondContact O-CB 3.33Å; A146-A150 PolarHBondContact O-N 3.42Å; K147-A150 PolarHBondContact O-N 2.95Å; D148-A150 PolarHBondContact O-N 3.41Å; A150-L153 PolarHBondContact O-N 3.23Å; A150-I154 WeakPolarHBondContact O-CG1 3.37Å; A150-I154 PolarHBondContact O-N 3.2Å; A150-I154 VanDerWaalsContact O-N 3.08Å; A150-I218 HydrophobicContact CB-CG2 4.42Å; A150-V221 HydrophobicContact CB-CB 4.03Å; A150-V221 HydrophobicContact CB-CG1 3.77Å; A150-A222 HydrophobicContact CB-CB 3.84Å
151	G	86.5	Confident	85.5	Confident	27 Å²	27	71.1 Å²	71.1	28%	0.278	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-43.2	174.6	0	0	0	0	0	113.2	K147 D148 W149 L153 I154 S155	K147-G151 PolarHBondContact O-N 3.25Å; D148-G151 PolarHBondContact O-N 2.98Å; D148-G151 VanDerWaalsContact O-N 3.16Å; W149-G151 VanDerWaalsContact C-N 3.31Å; W149-G151 PolarHBondContact O-N 3.47Å; G151-L153 VanDerWaalsContact C-N 3.25Å; G151-L153 PolarHBondContact O-N 3.45Å; G151-I154 PolarHBondContact O-N 3.19Å; G151-S155 VanDerWaalsContact O-CB 3.27Å; G151-S155 WeakPolarHBondContact O-CB 3.33Å; G151-S155 PolarHBondContact O-N 3.02Å; G151-S155 PolarHBondContact O-OG 2.91Å
152	E	87	Confident	86.1	Confident	107 Å²	107	74.9 Å²	74.9	50%	0.5	37%	0.373	S	S	.	.	H	α-helix	trans	-63.5	-31.5	174.2	-74.7	-172	176.1	0	0	112.8	D148 W149 S155 S158	D148-E152 PolarHBondContact O-N 3.44Å; W149-E152 PolarHBondContact O-N 3.44Å; E152-S155 WeakPolarHBondContact CA-OG 3.4Å; E152-S155 PolarHBondContact O-OG 3.37Å; E152-S158 PolarHBondContact O-OG 2.99Å
153	L	89.3	Confident	86.3	Confident	17 Å²	17	70.8 Å²	70.8	9%	0.089	36%	0.364	C	S	.	.	H	α-helix	trans	-76.2	-40.2	-179.8	-158.2	70.6	0	0	0	112.1	W149 A150 G151 G161 L164 I218	W149-L153 HydrophobicContact CH2-CD2 4.34Å; W149-L153 HydrophobicContact CZ2-CD2 4.3Å; W149-L153 PolarHBondContact O-N 2.93Å; W149-L153 VanDerWaalsContact O-N 3.17Å; A150-L153 PolarHBondContact O-N 3.23Å; G151-L153 VanDerWaalsContact C-N 3.25Å; G151-L153 PolarHBondContact O-N 3.45Å; L153-G161 WeakPolarHBondContact O-CA 3.37Å; L153-L164 HydrophobicContact CD2-CD2 3.72Å; L153-L164 HydrophobicContact CG-CD2 3.68Å; L153-I218 HydrophobicContact CD2-CD1 4.07Å; L153-I218 HydrophobicContact CD2-CG2 4.1Å
154	I	85.8	Confident	86.9	Confident	39 Å²	39	66.6 Å²	66.6	20%	0.2	34%	0.344	C	S	.	.	H	α-helix	trans	-75.8	-38.2	179	-65.1	162.3	0	0	0	111.8	A150 G151 G156 I218 R219 A222	A150-I154 WeakPolarHBondContact O-CG1 3.37Å; A150-I154 PolarHBondContact O-N 3.2Å; A150-I154 VanDerWaalsContact O-N 3.08Å; G151-I154 PolarHBondContact O-N 3.19Å; I154-G156 PolarHBondContact O-N 3.34Å; I154-G156 VanDerWaalsContact O-N 3.16Å; I154-I218 HydrophobicContact CD1-CG2 4.1Å; I154-I218 HydrophobicContact CG1-CG2 3.88Å; I154-R219 HydrophobicContact CD1-CB 4.24Å; I154-R219 HydrophobicContact CD1-CG 3.93Å; I154-R219 HydrophobicContact CG1-CG 4.32Å; I154-A222 HydrophobicContact CD1-CB 3.25Å
155	S	81.6	Confident	87.1	Confident	35 Å²	35	63.8 Å²	63.8	25%	0.245	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-10	-178.7	58.9	0	0	0	0	113.9	G151 E152 Q157	G151-S155 VanDerWaalsContact O-CB 3.27Å; G151-S155 WeakPolarHBondContact O-CB 3.33Å; G151-S155 PolarHBondContact O-N 3.02Å; G151-S155 PolarHBondContact O-OG 2.91Å; E152-S155 WeakPolarHBondContact CA-OG 3.4Å; E152-S155 PolarHBondContact O-OG 3.37Å; S155-Q157 PolarHBondContact O-N 3.03Å; S155-Q157 WeakPolarHBondContact OG-CG 3.41Å
156	G	78.2	Confident	87	Confident	4 Å²	4	59.9 Å²	59.9	4%	0.041	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	17.2	-177.7	0	0	0	0	0	113.9	I154 R162	I154-G156 PolarHBondContact O-N 3.34Å; I154-G156 VanDerWaalsContact O-N 3.16Å; G156-R162 WeakPolarHBondContact O-CG 3.34Å; G156-R162 PolarHBondContact O-NE 3.28Å
157	Q	82.8	Confident	87.1	Confident	148 Å²	148	61.6 Å²	61.6	69%	0.692	32%	0.317	S	S	*	.			trans	-72	-39	176.9	-69.8	-175.9	1.3	0	0	111.3	S155	S155-Q157 PolarHBondContact O-N 3.03Å; S155-Q157 WeakPolarHBondContact OG-CG 3.41Å
158	S	87.6	Confident	87.1	Confident	25 Å²	25	58.5 Å²	58.5	18%	0.175	30%	0.304	C	S	.	.	S	Bend	trans	-78.3	151	172.2	61.2	0	0	0	0	111.8	E152 T160 G161 R162	E152-S158 PolarHBondContact O-OG 2.99Å; S158-T160 VanDerWaalsContact C-N 3.25Å; S158-T160 WeakPolarHBondContact CB-OG1 3.34Å; S158-T160 PolarHBondContact O-N 2.78Å; S158-T160 PolarHBondContact OG-OG1 2.97Å; S158-T160 VanDerWaalsContact OG-OG1 3.13Å; S158-G161 WeakPolarHBondContact O-CA 3.21Å; S158-G161 PolarHBondContact O-N 3.24Å; S158-G161 VanDerWaalsContact O-N 3.08Å; S158-G161 WeakPolarHBondContact OG-CA 3.4Å; S158-G161 PolarHBondContact OG-N 2.7Å; S158-R162 PolarHBondContact O-N 2.95Å
159	T	86.7	Confident	87.2	Confident	108 Å²	108	56.8 Å²	56.8	66%	0.663	29%	0.292	S	S	*	.	H	α-helix	trans	-60.2	-38.7	173.4	49.4	0	0	0	0	111.4	G161 R162 I163	T159-G161 VanDerWaalsContact C-N 3.34Å; T159-R162 PolarHBondContact O-N 3.05Å; T159-I163 WeakPolarHBondContact O-CG1 3.38Å; T159-I163 PolarHBondContact O-N 3.19Å
160	T	90.5	Very high	87.3	Confident	82 Å²	82	53.4 Å²	53.4	50%	0.503	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-41.2	171.9	45.7	0	0	0	0	111.8	S158 I163 L164	S158-T160 VanDerWaalsContact C-N 3.25Å; S158-T160 WeakPolarHBondContact CB-OG1 3.34Å; S158-T160 PolarHBondContact O-N 2.78Å; S158-T160 PolarHBondContact OG-OG1 2.97Å; S158-T160 VanDerWaalsContact OG-OG1 3.13Å; T160-I163 PolarHBondContact O-N 3.09Å; T160-L164 PolarHBondContact O-N 3.04Å
161	G	87.6	Confident	87.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-43.1	175	0	0	0	0	0	112.5	L153 S158 T159 I163 L164 V165	L153-G161 WeakPolarHBondContact O-CA 3.37Å; S158-G161 WeakPolarHBondContact O-CA 3.21Å; S158-G161 PolarHBondContact O-N 3.24Å; S158-G161 VanDerWaalsContact O-N 3.08Å; S158-G161 WeakPolarHBondContact OG-CA 3.4Å; S158-G161 PolarHBondContact OG-N 2.7Å; T159-G161 VanDerWaalsContact C-N 3.34Å; G161-I163 VanDerWaalsContact C-N 3.34Å; G161-I163 PolarHBondContact O-N 2.98Å; G161-L164 WeakPolarHBondContact O-CB 3.48Å; G161-L164 PolarHBondContact O-N 3.27Å; G161-V165 WeakPolarHBondContact O-CB 3.25Å; G161-V165 VanDerWaalsContact O-CG2 3.31Å; G161-V165 WeakPolarHBondContact O-CG2 3.3Å; G161-V165 PolarHBondContact O-N 2.82Å
162	R	86.1	Confident	87.6	Confident	116 Å²	116	53.9 Å²	53.9	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-60.5	-42.7	174.3	-65.6	-176.3	-174.6	172.9	1.1	112.3	G156 S158 T159 L164 V165 V166	G156-R162 WeakPolarHBondContact O-CG 3.34Å; G156-R162 PolarHBondContact O-NE 3.28Å; S158-R162 PolarHBondContact O-N 2.95Å; T159-R162 PolarHBondContact O-N 3.05Å; R162-L164 VanDerWaalsContact C-N 3.34Å; R162-V165 PolarHBondContact O-N 2.95Å; R162-V166 WeakPolarHBondContact O-CG2 3.44Å; R162-V166 PolarHBondContact O-N 2.75Å
163	I	89.4	Confident	87.8	Confident	110 Å²	110	51.6 Å²	51.6	56%	0.564	28%	0.276	S	S	*	.	H	α-helix	trans	-61.8	-45.6	175.9	-67.2	165	0	0	0	110	T159 T160 G161 V165 V166 L167	T159-I163 WeakPolarHBondContact O-CG1 3.38Å; T159-I163 PolarHBondContact O-N 3.19Å; T160-I163 PolarHBondContact O-N 3.09Å; G161-I163 VanDerWaalsContact C-N 3.34Å; G161-I163 PolarHBondContact O-N 2.98Å; I163-V165 VanDerWaalsContact C-N 3.35Å; I163-V165 PolarHBondContact O-N 3.26Å; I163-V166 PolarHBondContact O-N 2.73Å; I163-L167 WeakPolarHBondContact O-CB 3.34Å; I163-L167 PolarHBondContact O-N 3.16Å
164	L	90.7	Very high	88	Confident	22 Å²	22	51.6 Å²	51.6	12%	0.115	28%	0.28	C	S	.	.	H	α-helix	trans	-58.1	-47.7	177	-176.8	70.5	0	0	0	111.1	L153 T160 G161 R162 L167 V168 F211 Y215 I218	L153-L164 HydrophobicContact CD2-CD2 3.72Å; L153-L164 HydrophobicContact CG-CD2 3.68Å; T160-L164 PolarHBondContact O-N 3.04Å; G161-L164 WeakPolarHBondContact O-CB 3.48Å; G161-L164 PolarHBondContact O-N 3.27Å; R162-L164 VanDerWaalsContact C-N 3.34Å; L164-L167 PolarHBondContact O-N 3.43Å; L164-V168 HydrophobicContact CG-CG2 4.43Å; L164-V168 WeakPolarHBondContact O-CG2 3.35Å; L164-V168 PolarHBondContact O-N 3.47Å; L164-F211 HydrophobicContact CD1-CE2 4.07Å; L164-F211 HydrophobicContact CD1-CZ 3.72Å; L164-Y215 HydrophobicContact CD1-CD2 4.48Å; L164-Y215 HydrophobicContact CD2-CD2 4.12Å; L164-Y215 HydrophobicContact CD2-CE2 4.16Å; L164-Y215 HydrophobicContact CG-CD2 4.32Å; L164-Y215 HydrophobicContact CG-CE2 4.41Å; L164-I218 HydrophobicContact CD2-CD1 4.18Å
165	V	86.4	Confident	88.3	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.03	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-45.8	179.7	165.2	0	0	0	0	112.1	G161 R162 I163 L167 V168 F169 I272 Y275	G161-V165 WeakPolarHBondContact O-CB 3.25Å; G161-V165 VanDerWaalsContact O-CG2 3.31Å; G161-V165 WeakPolarHBondContact O-CG2 3.3Å; G161-V165 PolarHBondContact O-N 2.82Å; R162-V165 PolarHBondContact O-N 2.95Å; I163-V165 VanDerWaalsContact C-N 3.35Å; I163-V165 PolarHBondContact O-N 3.26Å; V165-L167 VanDerWaalsContact C-N 3.31Å; V165-L167 PolarHBondContact O-N 2.94Å; V165-V168 PolarHBondContact O-N 3.42Å; V165-F169 PolarHBondContact O-N 2.88Å; V165-I272 HydrophobicContact CG1-CB 4.04Å; V165-I272 HydrophobicContact CG1-CD1 4.48Å; V165-I272 HydrophobicContact CG1-CG1 3.85Å; V165-I272 HydrophobicContact CG1-CG2 3.51Å; V165-Y275 HydrophobicContact CG1-CD2 4.4Å
166	V	86.8	Confident	88.8	Confident	57 Å²	57	48.5 Å²	48.5	35%	0.345	26%	0.261	S	S	.	.	H	α-helix	trans	-62.2	-41.6	175.1	172.5	0	0	0	0	111	R162 I163 F169 V170 L276	R162-V166 WeakPolarHBondContact O-CG2 3.44Å; R162-V166 PolarHBondContact O-N 2.75Å; I163-V166 PolarHBondContact O-N 2.73Å; V166-F169 WeakPolarHBondContact O-CB 3.4Å; V166-F169 PolarHBondContact O-N 3.48Å; V166-V170 HydrophobicContact CG1-CG2 4.43Å; V166-V170 WeakPolarHBondContact O-CG2 3.49Å; V166-V170 PolarHBondContact O-N 2.88Å; V166-L276 HydrophobicContact CG2-CD1 3.93Å; V166-L276 HydrophobicContact CG2-CD2 3.63Å; V166-L276 HydrophobicContact CG2-CG 4.37Å
167	L	90.4	Very high	89.5	Confident	69 Å²	69	53.1 Å²	53.1	36%	0.361	28%	0.283	S	S	.	.	H	α-helix	trans	-68.2	-40.7	-178.3	-163.8	152.3	0	0	0	110.8	I163 L164 V165 F169 V170 L171 F211	I163-L167 WeakPolarHBondContact O-CB 3.34Å; I163-L167 PolarHBondContact O-N 3.16Å; L164-L167 PolarHBondContact O-N 3.43Å; V165-L167 VanDerWaalsContact C-N 3.31Å; V165-L167 PolarHBondContact O-N 2.94Å; L167-F169 VanDerWaalsContact C-N 3.3Å; L167-F169 PolarHBondContact O-N 3.36Å; L167-V170 PolarHBondContact O-N 3.17Å; L167-L171 HydrophobicContact CD2-CD1 3.36Å; L167-L171 HydrophobicContact CD2-CG 3.86Å; L167-L171 HydrophobicContact CG-CD1 4.42Å; L167-L171 HydrophobicContact CG-CG 4.5Å; L167-L171 VanDerWaalsContact O-CB 3.32Å; L167-L171 WeakPolarHBondContact O-CB 3.07Å; L167-L171 VanDerWaalsContact O-CG 3.25Å; L167-L171 WeakPolarHBondContact O-CG 3.35Å; L167-L171 PolarHBondContact O-N 2.55Å; L167-F211 HydrophobicContact CD2-CD1 4.15Å; L167-F211 HydrophobicContact CD2-CD2 3.73Å; L167-F211 HydrophobicContact CD2-CE1 3.65Å; L167-F211 HydrophobicContact CD2-CE2 3.22Å; L167-F211 HydrophobicContact CD2-CG 4.17Å; L167-F211 HydrophobicContact CD2-CZ 3.16Å; L167-F211 HydrophobicContact CG-CZ 4.44Å
168	V	89.3	Confident	89.9	Confident	7 Å²	7	47 Å²	47	4%	0.042	26%	0.255	C	S	.	.	H	α-helix	trans	-57.2	-43.6	171.1	171.3	0	0	0	0	111.1	L164 V165 S172 F211 Y215	L164-V168 HydrophobicContact CG-CG2 4.43Å; L164-V168 WeakPolarHBondContact O-CG2 3.35Å; L164-V168 PolarHBondContact O-N 3.47Å; V165-V168 PolarHBondContact O-N 3.42Å; V168-S172 VanDerWaalsContact O-CB 3.22Å; V168-S172 WeakPolarHBondContact O-CB 3.39Å; V168-S172 PolarHBondContact O-N 3.41Å; V168-S172 PolarHBondContact O-OG 3.06Å; V168-F211 HydrophobicContact CB-CE1 4.47Å; V168-F211 HydrophobicContact CG2-CE1 3.67Å; V168-F211 HydrophobicContact CG2-CZ 3.91Å; V168-Y215 HydrophobicContact CG1-CD1 4.35Å; V168-Y215 HydrophobicContact CG1-CE1 3.93Å; V168-Y215 HydrophobicContact CG2-CD1 4.13Å; V168-Y215 HydrophobicContact CG2-CD2 3.57Å; V168-Y215 HydrophobicContact CG2-CE1 4.09Å; V168-Y215 HydrophobicContact CG2-CE2 3.56Å; V168-Y215 HydrophobicContact CG2-CG 3.86Å
169	F	88	Confident	90.1	Very high	57 Å²	57	45.8 Å²	45.8	25%	0.25	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-53.1	177.4	172.4	-104	0	0	0	112.3	V165 V166 L167 L171 S172 I173 V269 I272	V165-F169 PolarHBondContact O-N 2.88Å; V166-F169 WeakPolarHBondContact O-CB 3.4Å; V166-F169 PolarHBondContact O-N 3.48Å; L167-F169 VanDerWaalsContact C-N 3.3Å; L167-F169 PolarHBondContact O-N 3.36Å; F169-L171 PolarHBondContact O-N 2.9Å; F169-S172 PolarHBondContact O-N 3.12Å; F169-I173 HydrophobicContact CD1-CD1 4.28Å; F169-I173 HydrophobicContact CD2-CD1 4.22Å; F169-I173 HydrophobicContact CE1-CD1 3.7Å; F169-I173 HydrophobicContact CE2-CD1 3.62Å; F169-I173 HydrophobicContact CE2-CG1 4.47Å; F169-I173 HydrophobicContact CZ-CD1 3.34Å; F169-I173 PolarHBondContact O-N 2.97Å; F169-I173 VanDerWaalsContact O-N 3.09Å; F169-V269 HydrophobicContact CD2-CG1 4.47Å; F169-V269 HydrophobicContact CD2-CG2 3.84Å; F169-V269 HydrophobicContact CE2-CB 4.18Å; F169-V269 HydrophobicContact CE2-CG1 3.73Å; F169-V269 HydrophobicContact CE2-CG2 3.54Å; F169-I272 HydrophobicContact CB-CD1 3.9Å; F169-I272 HydrophobicContact CB-CG2 4.14Å; F169-I272 HydrophobicContact CD2-CD1 4.42Å; F169-I272 HydrophobicContact CG-CG2 4.49Å
170	V	91.7	Very high	90.4	Very high	87 Å²	87	42.3 Å²	42.3	53%	0.527	22%	0.223	S	C	.	.	H	α-helix	trans	-61.7	-44.2	-178.9	173.8	0	0	0	0	111.2	V166 L167 S172 I173 G174	V166-V170 HydrophobicContact CG1-CG2 4.43Å; V166-V170 WeakPolarHBondContact O-CG2 3.49Å; V166-V170 PolarHBondContact O-N 2.88Å; L167-V170 PolarHBondContact O-N 3.17Å; V170-S172 VanDerWaalsContact C-N 3.33Å; V170-S172 PolarHBondContact O-N 3.25Å; V170-I173 PolarHBondContact O-N 2.88Å; V170-G174 PolarHBondContact O-N 3.16Å
171	L	92.7	Very high	90.4	Very high	29 Å²	29	44.8 Å²	44.8	15%	0.152	22%	0.224	C	C	.	.	H	α-helix	trans	-68.9	-31.3	178.3	-67.1	-168.5	0	0	0	112.6	L167 F169 G174 S175 F208 F211 F212	L167-L171 HydrophobicContact CD2-CD1 3.36Å; L167-L171 HydrophobicContact CD2-CG 3.86Å; L167-L171 HydrophobicContact CG-CD1 4.42Å; L167-L171 HydrophobicContact CG-CG 4.5Å; L167-L171 VanDerWaalsContact O-CB 3.32Å; L167-L171 WeakPolarHBondContact O-CB 3.07Å; L167-L171 VanDerWaalsContact O-CG 3.25Å; L167-L171 WeakPolarHBondContact O-CG 3.35Å; L167-L171 PolarHBondContact O-N 2.55Å; F169-L171 PolarHBondContact O-N 2.9Å; L171-G174 PolarHBondContact O-N 3.46Å; L171-S175 VanDerWaalsContact O-CB 3.23Å; L171-S175 WeakPolarHBondContact O-CB 3.46Å; L171-S175 PolarHBondContact O-N 2.78Å; L171-F208 HydrophobicContact CD1-CD1 4.49Å; L171-F208 HydrophobicContact CD2-CD1 3.64Å; L171-F208 HydrophobicContact CD2-CE1 3.41Å; L171-F208 VanDerWaalsContact CD2-CE1 3.41Å; L171-F208 HydrophobicContact CD2-CG 4.39Å; L171-F208 HydrophobicContact CD2-CZ 3.98Å; L171-F211 HydrophobicContact CD1-CB 3.86Å; L171-F211 HydrophobicContact CD1-CD1 3.34Å; L171-F211 HydrophobicContact CD1-CD2 4.11Å; L171-F211 HydrophobicContact CD1-CE1 3.88Å; L171-F211 HydrophobicContact CD1-CG 3.46Å; L171-F211 VanDerWaalsContact CD1-CG 3.46Å; L171-F211 HydrophobicContact CD1-CZ 4.49Å; L171-F212 HydrophobicContact CB-CE1 4.46Å; L171-F212 HydrophobicContact CB-CZ 3.89Å
172	S	91.3	Very high	90.3	Very high	8 Å²	8	46 Å²	46	6%	0.056	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-43.9	176.5	-64.9	0	0	0	0	111.1	V168 F169 V170 S175 L176	V168-S172 VanDerWaalsContact O-CB 3.22Å; V168-S172 WeakPolarHBondContact O-CB 3.39Å; V168-S172 PolarHBondContact O-N 3.41Å; V168-S172 PolarHBondContact O-OG 3.06Å; F169-S172 PolarHBondContact O-N 3.12Å; V170-S172 VanDerWaalsContact C-N 3.33Å; V170-S172 PolarHBondContact O-N 3.25Å; S172-S175 PolarHBondContact O-N 2.86Å; S172-L176 PolarHBondContact O-N 2.87Å; S172-L176 VanDerWaalsContact O-N 3.08Å
173	I	91.8	Very high	90.4	Very high	58 Å²	58	40.7 Å²	40.7	30%	0.297	21%	0.211	S	C	.	.	H	α-helix	trans	-63.5	-46.2	173	-66.1	174.3	0	0	0	110.3	F169 V170 S175 L176 I177 L266	F169-I173 HydrophobicContact CD1-CD1 4.28Å; F169-I173 HydrophobicContact CD2-CD1 4.22Å; F169-I173 HydrophobicContact CE1-CD1 3.7Å; F169-I173 HydrophobicContact CE2-CD1 3.62Å; F169-I173 HydrophobicContact CE2-CG1 4.47Å; F169-I173 HydrophobicContact CZ-CD1 3.34Å; F169-I173 PolarHBondContact O-N 2.97Å; F169-I173 VanDerWaalsContact O-N 3.09Å; V170-I173 PolarHBondContact O-N 2.88Å; I173-S175 VanDerWaalsContact C-N 3.34Å; I173-S175 PolarHBondContact O-N 2.78Å; I173-L176 PolarHBondContact O-N 3.5Å; I173-L176 VanDerWaalsContact O-N 3.17Å; I173-I177 HydrophobicContact CG2-CD1 3.79Å; I173-I177 HydrophobicContact CG2-CG1 4.34Å; I173-I177 WeakPolarHBondContact O-CG1 3.06Å; I173-I177 PolarHBondContact O-N 3.2Å; I173-L266 HydrophobicContact CG1-CD2 4.47Å
174	G	92.5	Very high	90.2	Very high	17 Å²	17	38.4 Å²	38.4	18%	0.175	21%	0.205	C	C	.	.	H	α-helix	trans	-58	-43.6	176.9	0	0	0	0	0	112.9	V170 L171 L176 I177 I178	V170-G174 PolarHBondContact O-N 3.16Å; L171-G174 PolarHBondContact O-N 3.46Å; G174-L176 VanDerWaalsContact C-N 3.31Å; G174-L176 PolarHBondContact O-N 3.42Å; G174-I177 PolarHBondContact O-N 2.87Å; G174-I178 WeakPolarHBondContact O-CG1 3.45Å; G174-I178 PolarHBondContact O-N 2.12Å
175	S	92.6	Very high	89.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.5	-32.9	177.6	-171.5	0	0	0	0	112.9	L171 S172 I173 Y179 R262	L171-S175 VanDerWaalsContact O-CB 3.23Å; L171-S175 WeakPolarHBondContact O-CB 3.46Å; L171-S175 PolarHBondContact O-N 2.78Å; S172-S175 PolarHBondContact O-N 2.86Å; I173-S175 VanDerWaalsContact C-N 3.34Å; I173-S175 PolarHBondContact O-N 2.78Å; S175-Y179 PolarHBondContact O-N 3.49Å; S175-R262 PolarHBondContact O-NH1 3.42Å; S175-R262 VanDerWaalsContact O-NH1 3.13Å; S175-R262 VanDerWaalsContact OG-CD 3.29Å; S175-R262 WeakPolarHBondContact OG-CD 3.34Å; S175-R262 PolarHBondContact OG-NE 2.95Å; S175-R262 PolarHBondContact OG-NH1 2.81Å
176	L	92.7	Very high	88.7	Confident	10 Å²	10	44.3 Å²	44.3	5%	0.052	24%	0.238	C	C	.	.	H	α-helix	trans	-73.1	-40.2	173	-177.1	62.5	0	0	0	112.1	S172 I173 G174 I178 Y179 F180 R262 A263 L266	S172-L176 PolarHBondContact O-N 2.87Å; S172-L176 VanDerWaalsContact O-N 3.08Å; I173-L176 PolarHBondContact O-N 3.5Å; I173-L176 VanDerWaalsContact O-N 3.17Å; G174-L176 VanDerWaalsContact C-N 3.31Å; G174-L176 PolarHBondContact O-N 3.42Å; L176-I178 VanDerWaalsContact C-N 3.3Å; L176-I178 PolarHBondContact O-N 3.29Å; L176-Y179 HydrophobicContact CD1-CD1 4.13Å; L176-Y179 WeakPolarHBondContact O-CB 3.43Å; L176-Y179 PolarHBondContact O-N 2.97Å; L176-Y179 VanDerWaalsContact O-N 3.1Å; L176-F180 HydrophobicContact CD1-CE1 3.88Å; L176-F180 HydrophobicContact CD1-CE2 4.23Å; L176-F180 HydrophobicContact CD1-CZ 3.69Å; L176-F180 HydrophobicContact CD2-CE2 3.98Å; L176-F180 HydrophobicContact CD2-CZ 3.87Å; L176-F180 HydrophobicContact CG-CD2 4.34Å; L176-F180 HydrophobicContact CG-CE1 4.24Å; L176-F180 HydrophobicContact CG-CE2 3.67Å; L176-F180 HydrophobicContact CG-CZ 3.61Å; L176-F180 PolarHBondContact O-N 3.48Å; L176-R262 HydrophobicContact CD1-CB 4.45Å; L176-A263 HydrophobicContact CD1-CB 3.91Å; L176-L266 HydrophobicContact CD2-CD1 3.84Å; L176-L266 HydrophobicContact CD2-CD2 4.44Å; L176-L266 HydrophobicContact CD2-CG 4.2Å
177	I	92.7	Very high	87.7	Confident	100 Å²	100	45.4 Å²	45.4	51%	0.513	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-40.7	174.7	-69.9	168.5	0	0	0	110.7	I173 G174 Y179 F180 Y181	I173-I177 HydrophobicContact CG2-CD1 3.79Å; I173-I177 HydrophobicContact CG2-CG1 4.34Å; I173-I177 WeakPolarHBondContact O-CG1 3.06Å; I173-I177 PolarHBondContact O-N 3.2Å; G174-I177 PolarHBondContact O-N 2.87Å; I177-Y179 VanDerWaalsContact C-N 3.29Å; I177-Y179 PolarHBondContact O-N 3.15Å; I177-F180 PolarHBondContact O-N 3.28Å; I177-Y181 WeakPolarHBondContact O-CB 3.32Å; I177-Y181 PolarHBondContact O-N 3.31Å
178	I	91.2	Very high	86.6	Confident	19 Å²	19	43.4 Å²	43.4	10%	0.097	23%	0.231	C	C	.	.	H	α-helix	trans	-60.3	-41.1	174.3	-68.4	168.6	0	0	0	110.8	G174 L176 Y181 D182 I204 D205 F208	G174-I178 WeakPolarHBondContact O-CG1 3.45Å; G174-I178 PolarHBondContact O-N 2.12Å; L176-I178 VanDerWaalsContact C-N 3.3Å; L176-I178 PolarHBondContact O-N 3.29Å; I178-Y181 PolarHBondContact O-N 3.31Å; I178-D182 WeakPolarHBondContact O-CB 3.45Å; I178-D182 PolarHBondContact O-N 3.01Å; I178-I204 HydrophobicContact CD1-CB 4.22Å; I178-I204 HydrophobicContact CD1-CG2 3.69Å; I178-D205 HydrophobicContact CG2-CB 4.32Å; I178-F208 HydrophobicContact CD1-CD2 3.68Å; I178-F208 HydrophobicContact CD1-CE2 3.49Å; I178-F208 VanDerWaalsContact CD1-CE2 3.49Å; I178-F208 HydrophobicContact CD1-CZ 4.49Å
179	Y	91.7	Very high	85.8	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-45.7	174.4	165.4	-102.1	0	0	0	112	S175 L176 I177 Y181 D182 A183 L256 R259 F260 Y326	S175-Y179 PolarHBondContact O-N 3.49Å; L176-Y179 HydrophobicContact CD1-CD1 4.13Å; L176-Y179 WeakPolarHBondContact O-CB 3.43Å; L176-Y179 PolarHBondContact O-N 2.97Å; L176-Y179 VanDerWaalsContact O-N 3.1Å; I177-Y179 VanDerWaalsContact C-N 3.29Å; I177-Y179 PolarHBondContact O-N 3.15Å; Y179-Y181 VanDerWaalsContact C-N 3.34Å; Y179-Y181 PolarHBondContact O-N 2.98Å; Y179-D182 PolarHBondContact O-N 2.97Å; Y179-A183 HydrophobicContact CE2-CB 4.37Å; Y179-A183 WeakPolarHBondContact O-CB 3.41Å; Y179-A183 PolarHBondContact O-N 3.1Å; Y179-L256 HydrophobicContact CD2-CD1 3.69Å; Y179-L256 HydrophobicContact CD2-CG 4.29Å; Y179-L256 HydrophobicContact CE2-CD1 3.7Å; Y179-L256 HydrophobicContact CE2-CD2 3.9Å; Y179-L256 HydrophobicContact CE2-CG 3.84Å; Y179-R259 HydrophobicContact CD2-CB 3.66Å; Y179-R259 HydrophobicContact CE2-CB 4.27Å; Y179-R259 HydrophobicContact CG-CB 4.5Å; Y179-F260 HydrophobicContact CE1-CB 3.95Å; Y179-F260 HydrophobicContact CE2-CB 3.94Å; Y179-F260 WeakPolarHBondContact OH-CB 3.46Å; Y179-Y326 HydrophobicContact CE1-CD2 4.03Å; Y179-Y326 HydrophobicContact CE1-CE1 4.42Å; Y179-Y326 AromaticContact CE1-CE2 3.64Å; Y179-Y326 HydrophobicContact CE1-CE2 3.64Å; Y179-Y326 AromaticContact CE1-CZ 3.87Å; Y179-Y326 AromaticContact CZ-CD2 3.99Å; Y179-Y326 AromaticContact CZ-CE2 3.88Å; Y179-Y326 WeakPolarHBondContact OH-CD2 3.36Å; Y179-Y326 WeakPolarHBondContact OH-CE2 3.5Å
180	F	92.3	Very high	85.3	Confident	35 Å²	35	42.9 Å²	42.9	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-64	-39	176.6	-62.7	-30.4	0	0	0	112.6	L176 I177 A183 S184 L299 Y326 W327	L176-F180 HydrophobicContact CD1-CE1 3.88Å; L176-F180 HydrophobicContact CD1-CE2 4.23Å; L176-F180 HydrophobicContact CD1-CZ 3.69Å; L176-F180 HydrophobicContact CD2-CE2 3.98Å; L176-F180 HydrophobicContact CD2-CZ 3.87Å; L176-F180 HydrophobicContact CG-CD2 4.34Å; L176-F180 HydrophobicContact CG-CE1 4.24Å; L176-F180 HydrophobicContact CG-CE2 3.67Å; L176-F180 HydrophobicContact CG-CZ 3.61Å; L176-F180 PolarHBondContact O-N 3.48Å; I177-F180 PolarHBondContact O-N 3.28Å; F180-A183 PolarHBondContact O-N 3.48Å; F180-S184 VanDerWaalsContact O-CB 3.28Å; F180-S184 WeakPolarHBondContact O-CB 3.5Å; F180-S184 PolarHBondContact O-N 3.36Å; F180-S184 PolarHBondContact O-OG 3.31Å; F180-L299 HydrophobicContact CZ-CD1 4.2Å; F180-L299 HydrophobicContact CZ-CD2 4.21Å; F180-Y326 HydrophobicContact CD1-CD1 4.04Å; F180-Y326 AromaticContact CD1-CE1 3.61Å; F180-Y326 HydrophobicContact CD1-CE1 3.61Å; F180-Y326 HydrophobicContact CE1-CD1 4.22Å; F180-Y326 AromaticContact CE1-CE1 3.34Å; F180-Y326 HydrophobicContact CE1-CE1 3.34Å; F180-Y326 AromaticContact CE1-CZ 3.67Å; F180-Y326 HydrophobicContact CZ-CE1 4.33Å; F180-W327 HydrophobicContact CB-CH2 4.5Å; F180-W327 HydrophobicContact CB-CZ2 4.12Å; F180-W327 HydrophobicContact CD1-CH2 4.2Å; F180-W327 HydrophobicContact CD1-CZ2 4.46Å; F180-W327 HydrophobicContact CD2-CH2 4.08Å; F180-W327 HydrophobicContact CD2-CZ2 4.48Å; F180-W327 HydrophobicContact CE1-CH2 4.45Å; F180-W327 HydrophobicContact CE2-CH2 4.31Å; F180-W327 HydrophobicContact CG-CH2 4.02Å; F180-W327 HydrophobicContact CG-CZ2 4.13Å; F180-W327 HydrophobicContact CZ-CH2 4.49Å
181	Y	89.4	Confident	84.7	Confident	134 Å²	134	39.4 Å²	39.4	53%	0.525	21%	0.209	S	C	.	.	H	α-helix	trans	-59.7	-56.8	174.1	-178.7	-108.3	0	0	0	109.6	I177 I178 Y179 A183 S184 H185	I177-Y181 WeakPolarHBondContact O-CB 3.32Å; I177-Y181 PolarHBondContact O-N 3.31Å; I178-Y181 PolarHBondContact O-N 3.31Å; Y179-Y181 VanDerWaalsContact C-N 3.34Å; Y179-Y181 PolarHBondContact O-N 2.98Å; Y181-A183 VanDerWaalsContact C-N 3.31Å; Y181-A183 PolarHBondContact O-N 3.29Å; Y181-S184 PolarHBondContact O-N 3.06Å; Y181-S184 VanDerWaalsContact O-N 3.16Å; Y181-S184 PolarHBondContact O-OG 2.9Å; Y181-S184 VanDerWaalsContact O-OG 3.06Å; Y181-H185 AromaticContact CD1-CE1 3.43Å; Y181-H185 VanDerWaalsContact CD1-CE1 3.43Å; Y181-H185 WeakPolarHBondContact CD1-CE1 3.41Å; Y181-H185 AromaticContact CE1-CE1 3.17Å; Y181-H185 WeakPolarHBondContact CE1-CE1 3.15Å; Y181-H185 AromaticContact CE1-NE2 3.52Å; Y181-H185 AromaticContact CE2-CE1 3.79Å; Y181-H185 AromaticContact CG-CE1 3.83Å; Y181-H185 AromaticContact CZ-CE1 3.34Å; Y181-H185 AromaticContact CZ-NE2 3.41Å; Y181-H185 PolarHBondContact O-CE1 3.34Å; Y181-H185 PolarHBondContact O-ND1 3.25Å; Y181-H185 PolarHBondContact OH-NE2 2.86Å
182	D	87.1	Confident	84	Confident	26 Å²	26	39.3 Å²	39.3	14%	0.139	21%	0.209	C	C	.	.	H	α-helix	trans	-58.8	-38.7	179.2	-71.6	-14.9	0	0	0	112.4	I178 Y179 S184 S201 L256 R259	I178-D182 WeakPolarHBondContact O-CB 3.45Å; I178-D182 PolarHBondContact O-N 3.01Å; Y179-D182 PolarHBondContact O-N 2.97Å; D182-S184 PolarHBondContact O-N 3.27Å; D182-S201 PolarHBondContact OD1-OG 2.84Å; D182-L256 HydrophobicContact CB-CD1 4.18Å; D182-R259 IonicContact OD2-NH1 2.67Å; D182-R259 PolarHBondContact OD2-NH1 3.08Å
183	A	86.9	Confident	83.4	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.033	22%	0.222	C	C	.	.	H	α-helix	trans	-76.1	-16.6	-179.4	0	0	0	0	0	114.7	Y179 F180 Y181 L256	Y179-A183 HydrophobicContact CE2-CB 4.37Å; Y179-A183 WeakPolarHBondContact O-CB 3.41Å; Y179-A183 PolarHBondContact O-N 3.1Å; F180-A183 PolarHBondContact O-N 3.48Å; Y181-A183 VanDerWaalsContact C-N 3.31Å; Y181-A183 PolarHBondContact O-N 3.29Å; A183-L256 HydrophobicContact CB-CD1 4.49Å; A183-L256 HydrophobicContact CB-CD2 4.13Å
184	S	85.4	Confident	82.7	Confident	61 Å²	61	42 Å²	42	43%	0.427	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	1.5	-179.2	57.9	0	0	0	0	114.2	F180 Y181 D182	F180-S184 VanDerWaalsContact O-CB 3.28Å; F180-S184 WeakPolarHBondContact O-CB 3.5Å; F180-S184 PolarHBondContact O-N 3.36Å; F180-S184 PolarHBondContact O-OG 3.31Å; Y181-S184 PolarHBondContact O-N 3.06Å; Y181-S184 VanDerWaalsContact O-N 3.16Å; Y181-S184 PolarHBondContact O-OG 2.9Å; Y181-S184 VanDerWaalsContact O-OG 3.06Å; D182-S184 PolarHBondContact O-N 3.27Å
185	H	80.6	Confident	82.1	Confident	67 Å²	67	42.6 Å²	42.6	31%	0.31	23%	0.227	S	C	.	.			trans	-64.1	138.4	179.2	-80.1	70.3	0	0	0	111.9	Y181 N187 F188	Y181-H185 AromaticContact CD1-CE1 3.43Å; Y181-H185 VanDerWaalsContact CD1-CE1 3.43Å; Y181-H185 WeakPolarHBondContact CD1-CE1 3.41Å; Y181-H185 AromaticContact CE1-CE1 3.17Å; Y181-H185 WeakPolarHBondContact CE1-CE1 3.15Å; Y181-H185 AromaticContact CE1-NE2 3.52Å; Y181-H185 AromaticContact CE2-CE1 3.79Å; Y181-H185 AromaticContact CG-CE1 3.83Å; Y181-H185 AromaticContact CZ-CE1 3.34Å; Y181-H185 AromaticContact CZ-NE2 3.41Å; Y181-H185 PolarHBondContact O-CE1 3.34Å; Y181-H185 PolarHBondContact O-ND1 3.25Å; Y181-H185 PolarHBondContact OH-NE2 2.86Å; H185-N187 PolarHBondContact O-N 3.14Å; H185-F188 WeakPolarHBondContact O-CB 3.42Å; H185-F188 PolarHBondContact O-N 3.15Å
186	P	65.6	Low	81.5	Confident	84 Å²	84	47.5 Å²	47.5	55%	0.545	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.7	-178.6	23.1	-32.3	0	0	0	113.8	F34 F188	F34-P186 WeakPolarHBondContact CD1-O 3.23Å; P186-F188 VanDerWaalsContact C-N 3.27Å; P186-F188 PolarHBondContact O-N 3.02Å
187	N	65	Low	81	Confident	81 Å²	81	51 Å²	51	43%	0.433	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	27.2	175.3	-63.7	-3.3	0	0	0	112.1	Y35 H185 Q189	Y35-N187 WeakPolarHBondContact CB-OD1 3.5Å; Y35-N187 WeakPolarHBondContact CD2-OD1 3.46Å; H185-N187 PolarHBondContact O-N 3.14Å; N187-Q189 PolarHBondContact O-N 3.47Å
188	F	68.4	Low	80.5	Confident	27 Å²	27	54.1 Å²	54.1	12%	0.118	28%	0.281	C	S	.	.			trans	-56.9	127.7	-173.8	173.3	-106.9	0	0	0	112.1	H185 P186 V190 L256 H306 N310	H185-F188 WeakPolarHBondContact O-CB 3.42Å; H185-F188 PolarHBondContact O-N 3.15Å; P186-F188 VanDerWaalsContact C-N 3.27Å; P186-F188 PolarHBondContact O-N 3.02Å; F188-V190 HydrophobicContact CE1-CG2 4.49Å; F188-V190 HydrophobicContact CZ-CG2 4.34Å; F188-L256 HydrophobicContact CE2-CB 4.23Å; F188-L256 HydrophobicContact CE2-CD2 3.51Å; F188-L256 HydrophobicContact CE2-CG 4.34Å; F188-L256 HydrophobicContact CZ-CD2 3.61Å; F188-H306 AromaticContact CE1-CE1 3.67Å; F188-H306 AromaticContact CE1-NE2 3.88Å; F188-H306 AromaticContact CZ-CE1 3.62Å; F188-N310 HydrophobicContact CE1-CB 4.05Å
189	Q	71.3	Confident	80	Confident	28 Å²	28	53.8 Å²	53.8	13%	0.131	28%	0.28	C	S	.	.			trans	-136	147.2	167.7	-62.5	177.2	3.1	0	0	108.1	N187 E191 T192	N187-Q189 PolarHBondContact O-N 3.47Å; Q189-E191 WeakPolarHBondContact CB-O 3.49Å; Q189-E191 PolarHBondContact O-N 3.42Å; Q189-T192 HydrophobicContact CB-CG2 3.88Å
190	V	77.8	Confident	79.8	Confident	25 Å²	25	58 Å²	58	15%	0.152	31%	0.307	C	S	.	.	S	Bend	trans	-60	-35.9	-178.1	178.8	0	0	0	0	111.6	F188 L256 L307 N310	F188-V190 HydrophobicContact CE1-CG2 4.49Å; F188-V190 HydrophobicContact CZ-CG2 4.34Å; V190-L256 PolarHBondContact O-N 2.84Å; V190-L256 VanDerWaalsContact O-N 3.07Å; V190-L307 HydrophobicContact CG1-CD1 4.11Å; V190-N310 HydrophobicContact CG2-CB 4.02Å
191	E	79.5	Confident	79.5	Confident	14 Å²	14	57.4 Å²	57.4	7%	0.065	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.6	170.8	-71.5	-178.2	-157.4	0	0	109.1	L45 Y49 Y50 Q189 T254 W255	L45-E191 HydrophobicContact CD2-CB 3.63Å; Y49-E191 PolarHBondContact N-OE1 3Å; Y49-E191 PolarHBondContact N-OE2 3.47Å; Y50-E191 VanDerWaalsContact CA-OE1 3.31Å; Y50-E191 WeakPolarHBondContact CA-OE1 3.32Å; Y50-E191 WeakPolarHBondContact CB-OE1 3.38Å; Y50-E191 PolarHBondContact N-OE1 3.36Å; Q189-E191 WeakPolarHBondContact CB-O 3.49Å; Q189-E191 PolarHBondContact O-N 3.42Å; E191-T254 WeakPolarHBondContact CA-O 3.41Å; E191-W255 HydrophobicContact CG-CB 4.46Å; E191-W255 HydrophobicContact CG-CG 4.35Å
192	T	78	Confident	79.3	Confident	27 Å²	27	51.8 Å²	51.8	17%	0.166	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.1	170.9	55.2	0	0	0	0	111.1	Q189 I194 T254	Q189-T192 HydrophobicContact CB-CG2 3.88Å; T192-I194 PolarHBondContact O-N 2.95Å; T192-T254 PolarHBondContact N-O 3.15Å; T192-T254 PolarHBondContact O-N 2.94Å; T192-T254 WeakPolarHBondContact OG1-CG2 3.24Å
193	C	78.7	Confident	79.4	Confident	47 Å²	47	54.3 Å²	54.3	32%	0.318	30%	0.298	S	S	.	.			trans	-99.3	65.7	-176.1	-60.6	0	0	0	0	111.6	C44 R253	C44-C193 HydrophobicContact CB-CB 3.66Å; C44-C193 WeakPolarHBondContact CB-SG 3.35Å; C44-C193 WeakPolarHBondContact SG-CB 3.34Å; C44-C193 CovalentContact SG-SG 2Å; C44-C193 PolarHBondContact SG-SG 2.85Å; C193-R253 HydrophobicContact CB-CG 4.47Å
194	I	77.7	Confident	79.6	Confident	75 Å²	75	58.2 Å²	58.2	39%	0.385	32%	0.317	S	S	.	.			trans	-107.8	123.9	179.8	-56.5	172.3	0	0	0	108.1	T192 K198	T192-I194 PolarHBondContact O-N 2.95Å; I194-K198 HydrophobicContact CG2-CB 4.26Å
195	S	79.3	Confident	79.8	Confident	30 Å²	30	55.4 Å²	55.4	21%	0.21	30%	0.297	C	S	.	.			trans	-60.3	135.8	175.8	63.4	0	0	0	0	110.8	S197 K198 S199	S195-S197 PolarHBondContact O-N 2.86Å; S195-S197 PolarHBondContact OG-OG 3.3Å; S195-K198 PolarHBondContact O-N 3.29Å; S195-K198 WeakPolarHBondContact OG-CD 3.35Å; S195-K198 WeakPolarHBondContact OG-CG 3.43Å; S195-S199 PolarHBondContact O-OG 3.25Å
196	W	80.8	Confident	80.2	Confident	103 Å²	103	53.6 Å²	53.6	39%	0.39	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-52.1	-32.7	-178	172.5	84	0	0	0	114.2	K198 S199 Q203	W196-K198 PolarHBondContact O-N 2.9Å; W196-S199 PolarHBondContact O-OG 3.06Å; W196-Q203 HydrophobicContact CD2-CG 4.37Å; W196-Q203 HydrophobicContact CZ2-CG 3.86Å; W196-Q203 PolarHBondContact O-NE2 2.76Å; W196-Q203 VanDerWaalsContact O-NE2 3.16Å
197	S	81	Confident	81.5	Confident	82 Å²	82	52.2 Å²	52.2	57%	0.573	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-64.8	-22.2	177.8	58	0	0	0	0	114.2	S195	S195-S197 PolarHBondContact O-N 2.86Å; S195-S197 PolarHBondContact OG-OG 3.3Å
198	K	82.3	Confident	82.8	Confident	167 Å²	167	50.3 Å²	50.3	73%	0.726	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-98.8	-14	-175.2	-68.9	-179.1	-177.7	177.7	0	113.5	I194 S195 W196 P200	I194-K198 HydrophobicContact CG2-CB 4.26Å; S195-K198 PolarHBondContact O-N 3.29Å; S195-K198 WeakPolarHBondContact OG-CD 3.35Å; S195-K198 WeakPolarHBondContact OG-CG 3.43Å; W196-K198 PolarHBondContact O-N 2.9Å; K198-P200 WeakPolarHBondContact O-CD 3.39Å
199	S	81.6	Confident	84	Confident	11 Å²	11	49 Å²	49	8%	0.077	27%	0.268	C	S	.	.			trans	-112.2	99.5	-171	47.7	0	0	0	0	111.5	S195 W196 S201 Q202 Q203	S195-S199 PolarHBondContact O-OG 3.25Å; W196-S199 PolarHBondContact O-OG 3.06Å; S199-S201 PolarHBondContact O-N 2.89Å; S199-Q202 PolarHBondContact O-N 3.11Å; S199-Q202 WeakPolarHBondContact OG-CB 3.33Å; S199-Q202 WeakPolarHBondContact OG-CG 3.36Å; S199-Q202 PolarHBondContact OG-OE1 3.5Å; S199-Q203 PolarHBondContact O-N 2.83Å
200	P	86.6	Confident	85	Confident	89 Å²	89	51.3 Å²	51.3	58%	0.578	28%	0.28	S	S	*	.	H	α-helix	trans	-62.6	-30.1	179.7	24.7	-33.5	0	0	0	112.6	K198 Q202 Q203 I204	K198-P200 WeakPolarHBondContact O-CD 3.39Å; P200-Q202 VanDerWaalsContact C-N 3.35Å; P200-Q202 PolarHBondContact O-N 3.25Å; P200-Q203 PolarHBondContact O-N 3.01Å; P200-I204 WeakPolarHBondContact O-CG1 3.5Å; P200-I204 PolarHBondContact O-N 3.42Å; P200-I204 VanDerWaalsContact O-N 3.13Å
201	S	86.5	Confident	85.8	Confident	24 Å²	24	52 Å²	52	17%	0.168	28%	0.281	C	S	.	.	H	α-helix	trans	-62.6	-40	176.8	62.5	0	0	0	0	112.3	D182 S199 D205	D182-S201 PolarHBondContact OD1-OG 2.84Å; S199-S201 PolarHBondContact O-N 2.89Å; S201-D205 VanDerWaalsContact O-CB 3.26Å; S201-D205 WeakPolarHBondContact O-CB 3.49Å; S201-D205 PolarHBondContact O-N 3.16Å
202	Q	84.3	Confident	86.4	Confident	15 Å²	15	51.4 Å²	51.4	7%	0.07	28%	0.278	C	S	.	.	H	α-helix	trans	-69.4	-34.4	177.8	-65.6	179.2	6.6	0	0	112.4	S199 P200 D205 L206 T254	S199-Q202 PolarHBondContact O-N 3.11Å; S199-Q202 WeakPolarHBondContact OG-CB 3.33Å; S199-Q202 WeakPolarHBondContact OG-CG 3.36Å; S199-Q202 PolarHBondContact OG-OE1 3.5Å; P200-Q202 VanDerWaalsContact C-N 3.35Å; P200-Q202 PolarHBondContact O-N 3.25Å; Q202-D205 PolarHBondContact O-N 2.95Å; Q202-L206 WeakPolarHBondContact O-CB 3.37Å; Q202-L206 PolarHBondContact O-N 2.92Å; Q202-T254 VanDerWaalsContact NE2-CB 3.31Å
203	Q	89.2	Confident	87.2	Confident	80 Å²	80	52.8 Å²	52.8	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-65.3	-45.5	177	-65.5	175.5	8.9	0	0	111.4	W196 S199 P200 A207	W196-Q203 HydrophobicContact CD2-CG 4.37Å; W196-Q203 HydrophobicContact CZ2-CG 3.86Å; W196-Q203 PolarHBondContact O-NE2 2.76Å; W196-Q203 VanDerWaalsContact O-NE2 3.16Å; S199-Q203 PolarHBondContact O-N 2.83Å; P200-Q203 PolarHBondContact O-N 3.01Å; Q203-A207 PolarHBondContact O-N 2.97Å
204	I	91.1	Very high	87.9	Confident	85 Å²	85	55.1 Å²	55.1	44%	0.436	29%	0.293	S	S	.	.	H	α-helix	trans	-68.5	-40.5	177.2	-59.6	168.2	0	0	0	110.4	I178 P200 L206 A207 F208	I178-I204 HydrophobicContact CD1-CB 4.22Å; I178-I204 HydrophobicContact CD1-CG2 3.69Å; P200-I204 WeakPolarHBondContact O-CG1 3.5Å; P200-I204 PolarHBondContact O-N 3.42Å; P200-I204 VanDerWaalsContact O-N 3.13Å; I204-L206 VanDerWaalsContact C-N 3.32Å; I204-L206 PolarHBondContact O-N 3.13Å; I204-A207 WeakPolarHBondContact O-CB 3.27Å; I204-A207 PolarHBondContact O-N 3.3Å; I204-A207 VanDerWaalsContact O-N 3.16Å; I204-F208 HydrophobicContact CG2-CD2 4.43Å; I204-F208 HydrophobicContact CG2-CE1 3.99Å; I204-F208 HydrophobicContact CG2-CE2 3.9Å; I204-F208 HydrophobicContact CG2-CZ 3.67Å; I204-F208 PolarHBondContact O-N 3.21Å; I204-F208 VanDerWaalsContact O-N 3.12Å
205	D	90.3	Very high	88.6	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.011	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-41.7	178.3	-166	50.2	0	0	0	112.3	I178 S201 Q202 A207 F208 N209 R259 R262	I178-D205 HydrophobicContact CG2-CB 4.32Å; S201-D205 VanDerWaalsContact O-CB 3.26Å; S201-D205 WeakPolarHBondContact O-CB 3.49Å; S201-D205 PolarHBondContact O-N 3.16Å; Q202-D205 PolarHBondContact O-N 2.95Å; D205-A207 PolarHBondContact O-N 3.21Å; D205-F208 PolarHBondContact O-N 3.35Å; D205-N209 PolarHBondContact O-N 2.96Å; D205-N209 PolarHBondContact O-ND2 3.2Å; D205-N209 PolarHBondContact OD2-ND2 2.97Å; D205-R259 IonicContact OD2-CZ 3.41Å; D205-R259 IonicContact OD2-NH1 3.67Å; D205-R259 PolarHBondContact OD2-NH1 3.03Å; D205-R259 IonicContact OD2-NH2 3.29Å; D205-R259 PolarHBondContact OD2-NH2 3.37Å; D205-R262 IonicContact OD1-CZ 3.09Å; D205-R262 IonicContact OD1-NH1 2.67Å; D205-R262 PolarHBondContact OD1-NH1 3.33Å; D205-R262 IonicContact OD1-NH2 2.81Å; D205-R262 PolarHBondContact OD1-NH2 3.49Å; D205-R262 IonicContact OD2-CZ 3.79Å; D205-R262 IonicContact OD2-NH1 3.82Å; D205-R262 IonicContact OD2-NH2 2.85Å; D205-R262 PolarHBondContact OD2-NH2 3.01Å
206	L	89.2	Confident	89.2	Confident	29 Å²	29	52.8 Å²	52.8	15%	0.152	28%	0.275	C	S	.	.	H	α-helix	trans	-60.5	-44.8	174.9	-179	63.7	0	0	0	111.7	Q202 I204 F208 N209 I210 F246 I249	Q202-L206 WeakPolarHBondContact O-CB 3.37Å; Q202-L206 PolarHBondContact O-N 2.92Å; I204-L206 VanDerWaalsContact C-N 3.32Å; I204-L206 PolarHBondContact O-N 3.13Å; L206-F208 VanDerWaalsContact C-N 3.28Å; L206-F208 PolarHBondContact O-N 3.19Å; L206-N209 PolarHBondContact O-N 3.14Å; L206-I210 HydrophobicContact CD1-CD1 4.27Å; L206-I210 HydrophobicContact CD1-CG1 4.34Å; L206-I210 HydrophobicContact CG-CD1 3.95Å; L206-I210 HydrophobicContact CG-CG1 4.45Å; L206-I210 WeakPolarHBondContact O-CG1 3.23Å; L206-I210 PolarHBondContact O-N 3.29Å; L206-F246 HydrophobicContact CD1-CD1 4.05Å; L206-F246 HydrophobicContact CD1-CE1 3.83Å; L206-F246 HydrophobicContact CD1-CZ 4.45Å; L206-I249 HydrophobicContact CD1-CD1 3.54Å; L206-I249 HydrophobicContact CD2-CD1 3.45Å; L206-I249 VanDerWaalsContact CD2-CD1 3.45Å; L206-I249 HydrophobicContact CG-CD1 4Å
207	A	92.1	Very high	89.7	Confident	56 Å²	56	53.3 Å²	53.3	46%	0.463	28%	0.28	S	S	.	.	H	α-helix	trans	-59.3	-40.9	178.8	0	0	0	0	0	111.6	Q203 I204 D205 F211	Q203-A207 PolarHBondContact O-N 2.97Å; I204-A207 WeakPolarHBondContact O-CB 3.27Å; I204-A207 PolarHBondContact O-N 3.3Å; I204-A207 VanDerWaalsContact O-N 3.16Å; D205-A207 PolarHBondContact O-N 3.21Å; A207-F211 PolarHBondContact O-N 3Å
208	F	93.8	Very high	90.2	Very high	40 Å²	40	50.5 Å²	50.5	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-42.8	176.2	-65.9	-6.8	0	0	0	112.1	L171 I178 I204 D205 L206 I210 F211 F212	L171-F208 HydrophobicContact CD1-CD1 4.49Å; L171-F208 HydrophobicContact CD2-CD1 3.64Å; L171-F208 HydrophobicContact CD2-CE1 3.41Å; L171-F208 VanDerWaalsContact CD2-CE1 3.41Å; L171-F208 HydrophobicContact CD2-CG 4.39Å; L171-F208 HydrophobicContact CD2-CZ 3.98Å; I178-F208 HydrophobicContact CD1-CD2 3.68Å; I178-F208 HydrophobicContact CD1-CE2 3.49Å; I178-F208 VanDerWaalsContact CD1-CE2 3.49Å; I178-F208 HydrophobicContact CD1-CZ 4.49Å; I204-F208 HydrophobicContact CG2-CD2 4.43Å; I204-F208 HydrophobicContact CG2-CE1 3.99Å; I204-F208 HydrophobicContact CG2-CE2 3.9Å; I204-F208 HydrophobicContact CG2-CZ 3.67Å; I204-F208 PolarHBondContact O-N 3.21Å; I204-F208 VanDerWaalsContact O-N 3.12Å; D205-F208 PolarHBondContact O-N 3.35Å; L206-F208 VanDerWaalsContact C-N 3.28Å; L206-F208 PolarHBondContact O-N 3.19Å; F208-I210 VanDerWaalsContact C-N 3.34Å; F208-I210 PolarHBondContact O-N 3.28Å; F208-F211 WeakPolarHBondContact O-CB 3.41Å; F208-F211 PolarHBondContact O-N 3.33Å; F208-F211 VanDerWaalsContact O-N 3.17Å; F208-F212 HydrophobicContact CB-CD2 4.45Å; F208-F212 HydrophobicContact CB-CE2 4.08Å; F208-F212 WeakPolarHBondContact O-CD2 3.43Å; F208-F212 PolarHBondContact O-N 2.88Å
209	N	92.3	Very high	90.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-32	179	-67.3	-43.9	0	0	0	112.9	D205 L206 F211 F212 L213 I242 S245	D205-N209 PolarHBondContact O-N 2.96Å; D205-N209 PolarHBondContact O-ND2 3.2Å; D205-N209 PolarHBondContact OD2-ND2 2.97Å; L206-N209 PolarHBondContact O-N 3.14Å; N209-F211 VanDerWaalsContact C-N 3.34Å; N209-F212 PolarHBondContact O-N 2.92Å; N209-L213 WeakPolarHBondContact O-CB 3.47Å; N209-L213 PolarHBondContact O-N 3.1Å; N209-I242 HydrophobicContact CB-CG1 4.48Å; N209-S245 WeakPolarHBondContact ND2-CB 3.45Å; N209-S245 PolarHBondContact ND2-OG 3.12Å
210	I	93.3	Very high	91.1	Very high	76 Å²	76	45.7 Å²	45.7	39%	0.39	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-43.6	170.6	-69.9	166.9	0	0	0	110.4	L206 F208 L213 I214 F246	L206-I210 HydrophobicContact CD1-CD1 4.27Å; L206-I210 HydrophobicContact CD1-CG1 4.34Å; L206-I210 HydrophobicContact CG-CD1 3.95Å; L206-I210 HydrophobicContact CG-CG1 4.45Å; L206-I210 WeakPolarHBondContact O-CG1 3.23Å; L206-I210 PolarHBondContact O-N 3.29Å; F208-I210 VanDerWaalsContact C-N 3.34Å; F208-I210 PolarHBondContact O-N 3.28Å; I210-L213 WeakPolarHBondContact O-CB 3.42Å; I210-L213 PolarHBondContact O-N 3.34Å; I210-I214 PolarHBondContact O-N 2.85Å; I210-F246 HydrophobicContact CG1-CE1 4.37Å; I210-F246 HydrophobicContact CG1-CZ 4.13Å
211	F	94	Very high	91.3	Very high	40 Å²	40	44 Å²	44	18%	0.175	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-45.7	175.6	176.8	-90.7	0	0	0	111.9	L164 L167 V168 L171 A207 F208 N209 L213 I214 Y215	L164-F211 HydrophobicContact CD1-CE2 4.07Å; L164-F211 HydrophobicContact CD1-CZ 3.72Å; L167-F211 HydrophobicContact CD2-CD1 4.15Å; L167-F211 HydrophobicContact CD2-CD2 3.73Å; L167-F211 HydrophobicContact CD2-CE1 3.65Å; L167-F211 HydrophobicContact CD2-CE2 3.22Å; L167-F211 HydrophobicContact CD2-CG 4.17Å; L167-F211 HydrophobicContact CD2-CZ 3.16Å; L167-F211 HydrophobicContact CG-CZ 4.44Å; V168-F211 HydrophobicContact CB-CE1 4.47Å; V168-F211 HydrophobicContact CG2-CE1 3.67Å; V168-F211 HydrophobicContact CG2-CZ 3.91Å; L171-F211 HydrophobicContact CD1-CB 3.86Å; L171-F211 HydrophobicContact CD1-CD1 3.34Å; L171-F211 HydrophobicContact CD1-CD2 4.11Å; L171-F211 HydrophobicContact CD1-CE1 3.88Å; L171-F211 HydrophobicContact CD1-CG 3.46Å; L171-F211 VanDerWaalsContact CD1-CG 3.46Å; L171-F211 HydrophobicContact CD1-CZ 4.49Å; A207-F211 PolarHBondContact O-N 3Å; F208-F211 WeakPolarHBondContact O-CB 3.41Å; F208-F211 PolarHBondContact O-N 3.33Å; F208-F211 VanDerWaalsContact O-N 3.17Å; N209-F211 VanDerWaalsContact C-N 3.34Å; F211-L213 VanDerWaalsContact C-N 3.25Å; F211-L213 PolarHBondContact O-N 3.05Å; F211-I214 PolarHBondContact O-N 2.79Å; F211-Y215 PolarHBondContact O-N 3.34Å
212	F	93.4	Very high	91.5	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.009	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-30.9	177.1	-68	-56.5	0	0	0	113	L171 F208 N209 Y215 F216 I242	L171-F212 HydrophobicContact CB-CE1 4.46Å; L171-F212 HydrophobicContact CB-CZ 3.89Å; F208-F212 HydrophobicContact CB-CD2 4.45Å; F208-F212 HydrophobicContact CB-CE2 4.08Å; F208-F212 WeakPolarHBondContact O-CD2 3.43Å; F208-F212 PolarHBondContact O-N 2.88Å; N209-F212 PolarHBondContact O-N 2.92Å; F212-Y215 PolarHBondContact O-N 3.06Å; F212-F216 WeakPolarHBondContact O-CB 3.29Å; F212-F216 PolarHBondContact O-N 3.47Å; F212-I242 HydrophobicContact CB-CD1 3.88Å; F212-I242 HydrophobicContact CB-CG1 4.36Å
213	L	93.2	Very high	91.6	Very high	56 Å²	56	44 Å²	44	29%	0.293	23%	0.227	S	C	.	.	H	α-helix	trans	-64.1	-44.6	173.7	-178.8	65.7	0	0	0	111.5	N209 I210 F211 Y215 F216 F217 I242 F246	N209-L213 WeakPolarHBondContact O-CB 3.47Å; N209-L213 PolarHBondContact O-N 3.1Å; I210-L213 WeakPolarHBondContact O-CB 3.42Å; I210-L213 PolarHBondContact O-N 3.34Å; F211-L213 VanDerWaalsContact C-N 3.25Å; F211-L213 PolarHBondContact O-N 3.05Å; L213-Y215 VanDerWaalsContact C-N 3.33Å; L213-F216 WeakPolarHBondContact O-CB 3.24Å; L213-F216 PolarHBondContact O-N 3.06Å; L213-F217 HydrophobicContact CD1-CD2 4.33Å; L213-F217 HydrophobicContact CD1-CE2 3.66Å; L213-F217 HydrophobicContact CD1-CZ 4.3Å; L213-F217 HydrophobicContact CG-CD2 4.26Å; L213-F217 HydrophobicContact CG-CE2 3.84Å; L213-F217 WeakPolarHBondContact O-CD2 3.38Å; L213-F217 PolarHBondContact O-N 2.78Å; L213-I242 HydrophobicContact CB-CD1 4.4Å; L213-I242 HydrophobicContact CB-CG2 4.22Å; L213-I242 HydrophobicContact CD1-CG2 4.25Å; L213-F246 HydrophobicContact CD2-CE2 4.31Å; L213-F246 HydrophobicContact CD2-CZ 4.26Å
214	I	93.3	Very high	91.5	Very high	96 Å²	96	45.8 Å²	45.8	49%	0.492	24%	0.244	S	C	.	.	H	α-helix	trans	-62.4	-44.8	174.8	-63.7	168.2	0	0	0	109.8	I210 F211 F216 F217 I218	I210-I214 PolarHBondContact O-N 2.85Å; F211-I214 PolarHBondContact O-N 2.79Å; I214-F216 VanDerWaalsContact C-N 3.33Å; I214-F216 PolarHBondContact O-N 3.5Å; I214-F217 PolarHBondContact O-N 3.23Å; I214-I218 HydrophobicContact CG2-CD1 4Å; I214-I218 WeakPolarHBondContact O-CG1 3.5Å; I214-I218 PolarHBondContact O-N 3.14Å
215	Y	92.2	Very high	91.4	Very high	38 Å²	38	44.3 Å²	44.3	15%	0.149	24%	0.237	C	C	.	.	H	α-helix	trans	-61.5	-39.9	178	-174.2	-115	0	0	0	112.7	L164 V168 F211 F212 L213 F217 I218 R219	L164-Y215 HydrophobicContact CD1-CD2 4.48Å; L164-Y215 HydrophobicContact CD2-CD2 4.12Å; L164-Y215 HydrophobicContact CD2-CE2 4.16Å; L164-Y215 HydrophobicContact CG-CD2 4.32Å; L164-Y215 HydrophobicContact CG-CE2 4.41Å; V168-Y215 HydrophobicContact CG1-CD1 4.35Å; V168-Y215 HydrophobicContact CG1-CE1 3.93Å; V168-Y215 HydrophobicContact CG2-CD1 4.13Å; V168-Y215 HydrophobicContact CG2-CD2 3.57Å; V168-Y215 HydrophobicContact CG2-CE1 4.09Å; V168-Y215 HydrophobicContact CG2-CE2 3.56Å; V168-Y215 HydrophobicContact CG2-CG 3.86Å; F211-Y215 PolarHBondContact O-N 3.34Å; F212-Y215 PolarHBondContact O-N 3.06Å; L213-Y215 VanDerWaalsContact C-N 3.33Å; Y215-F217 VanDerWaalsContact C-N 3.35Å; Y215-F217 PolarHBondContact O-N 2.9Å; Y215-I218 PolarHBondContact O-N 3.44Å; Y215-R219 HydrophobicContact CD1-CG 4.49Å; Y215-R219 VanDerWaalsContact CE1-CD 3.5Å; Y215-R219 HydrophobicContact CE1-CG 4.12Å; Y215-R219 HydrophobicContact CE2-CG 4.31Å; Y215-R219 WeakPolarHBondContact O-CG 3.37Å; Y215-R219 PolarHBondContact O-N 3.28Å
216	F	92.2	Very high	91.3	Very high	18 Å²	18	46.7 Å²	46.7	8%	0.079	25%	0.247	C	C	.	.	H	α-helix	trans	-57.6	-45.1	173.5	172.8	-93.7	0	0	0	111.8	F212 L213 I214 R219 F220 F229 L230 D238 Y239	F212-F216 WeakPolarHBondContact O-CB 3.29Å; F212-F216 PolarHBondContact O-N 3.47Å; L213-F216 WeakPolarHBondContact O-CB 3.24Å; L213-F216 PolarHBondContact O-N 3.06Å; I214-F216 VanDerWaalsContact C-N 3.33Å; I214-F216 PolarHBondContact O-N 3.5Å; F216-R219 PolarHBondContact O-N 2.84Å; F216-F220 WeakPolarHBondContact O-CB 3.31Å; F216-F220 PolarHBondContact O-N 3.29Å; F216-F229 HydrophobicContact CD2-CE1 4.3Å; F216-F229 HydrophobicContact CD2-CZ 4.15Å; F216-F229 AromaticContact CE2-CE1 3.77Å; F216-F229 HydrophobicContact CE2-CE1 3.77Å; F216-F229 HydrophobicContact CE2-CZ 4.03Å; F216-F229 HydrophobicContact CZ-CE1 4Å; F216-L230 HydrophobicContact CZ-CD2 4.16Å; F216-D238 HydrophobicContact CD2-CB 4.21Å; F216-Y239 AromaticContact CE2-CE1 3.99Å; F216-Y239 HydrophobicContact CE2-CE1 3.99Å; F216-Y239 AromaticContact CZ-CE1 3.83Å; F216-Y239 HydrophobicContact CZ-CE1 3.83Å
217	F	92.3	Very high	91.2	Very high	113 Å²	113	47 Å²	47	50%	0.496	25%	0.25	S	S	.	.	H	α-helix	trans	-67.7	-37	178	-73.8	-60.2	0	0	0	113.3	L213 I214 Y215 R219 F220 V221	L213-F217 HydrophobicContact CD1-CD2 4.33Å; L213-F217 HydrophobicContact CD1-CE2 3.66Å; L213-F217 HydrophobicContact CD1-CZ 4.3Å; L213-F217 HydrophobicContact CG-CD2 4.26Å; L213-F217 HydrophobicContact CG-CE2 3.84Å; L213-F217 WeakPolarHBondContact O-CD2 3.38Å; L213-F217 PolarHBondContact O-N 2.78Å; I214-F217 PolarHBondContact O-N 3.23Å; Y215-F217 VanDerWaalsContact C-N 3.35Å; Y215-F217 PolarHBondContact O-N 2.9Å; F217-R219 VanDerWaalsContact C-N 3.34Å; F217-F220 WeakPolarHBondContact O-CB 3.45Å; F217-F220 PolarHBondContact O-N 2.98Å; F217-V221 WeakPolarHBondContact O-CG2 3.25Å; F217-V221 PolarHBondContact O-N 2.94Å
218	I	91.8	Very high	91.1	Very high	23 Å²	23	52.4 Å²	52.4	12%	0.118	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-47.2	174	-66	166.2	0	0	0	109.8	A150 L153 I154 L164 I214 Y215 F220 V221 A222	A150-I218 HydrophobicContact CB-CG2 4.42Å; L153-I218 HydrophobicContact CD2-CD1 4.07Å; L153-I218 HydrophobicContact CD2-CG2 4.1Å; I154-I218 HydrophobicContact CD1-CG2 4.1Å; I154-I218 HydrophobicContact CG1-CG2 3.88Å; L164-I218 HydrophobicContact CD2-CD1 4.18Å; I214-I218 HydrophobicContact CG2-CD1 4Å; I214-I218 WeakPolarHBondContact O-CG1 3.5Å; I214-I218 PolarHBondContact O-N 3.14Å; Y215-I218 PolarHBondContact O-N 3.44Å; I218-F220 VanDerWaalsContact C-N 3.34Å; I218-F220 PolarHBondContact O-N 3.31Å; I218-V221 PolarHBondContact O-N 3.32Å; I218-A222 PolarHBondContact O-N 2.94Å; I218-A222 VanDerWaalsContact O-N 3.1Å
219	R	91.2	Very high	90.9	Very high	24 Å²	24	50.7 Å²	50.7	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-61.5	-40.8	175.3	-65.8	-168.1	-67	130	-2.4	112.7	I154 Y215 F216 F217 V221 A222 A223 F229 D238	I154-R219 HydrophobicContact CD1-CB 4.24Å; I154-R219 HydrophobicContact CD1-CG 3.93Å; I154-R219 HydrophobicContact CG1-CG 4.32Å; Y215-R219 HydrophobicContact CD1-CG 4.49Å; Y215-R219 VanDerWaalsContact CE1-CD 3.5Å; Y215-R219 HydrophobicContact CE1-CG 4.12Å; Y215-R219 HydrophobicContact CE2-CG 4.31Å; Y215-R219 WeakPolarHBondContact O-CG 3.37Å; Y215-R219 PolarHBondContact O-N 3.28Å; F216-R219 PolarHBondContact O-N 2.84Å; F217-R219 VanDerWaalsContact C-N 3.34Å; R219-V221 PolarHBondContact O-N 2.98Å; R219-A222 PolarHBondContact O-N 3.1Å; R219-A223 PolarHBondContact O-N 3.41Å; R219-F229 HydrophobicContact CB-CE2 3.52Å; R219-F229 HydrophobicContact CB-CZ 3.66Å; R219-D238 IonicContact CZ-OD2 3.15Å; R219-D238 IonicContact NH2-OD2 3.86Å; R219-D238 PolarHBondContact NH2-OD2 2.73Å
220	F	91.7	Very high	90.7	Very high	53 Å²	53	50.8 Å²	50.8	23%	0.232	25%	0.252	C	S	.	.	H	α-helix	trans	-60.4	-42.3	175.6	-179.7	-98.9	0	0	0	112.2	V68 F216 F217 I218 K226 F229 L230	V68-F220 HydrophobicContact CG2-CE2 3.84Å; V68-F220 HydrophobicContact CG2-CZ 3.84Å; F216-F220 WeakPolarHBondContact O-CB 3.31Å; F216-F220 PolarHBondContact O-N 3.29Å; F217-F220 WeakPolarHBondContact O-CB 3.45Å; F217-F220 PolarHBondContact O-N 2.98Å; I218-F220 VanDerWaalsContact C-N 3.34Å; I218-F220 PolarHBondContact O-N 3.31Å; F220-K226 HydrophobicContact CE2-CB 4.09Å; F220-K226 HydrophobicContact CE2-CD 4.2Å; F220-K226 HydrophobicContact CE2-CG 4.47Å; F220-K226 HydrophobicContact CZ-CB 4.33Å; F220-K226 HydrophobicContact CZ-CD 4.17Å; F220-K226 HydrophobicContact CZ-CG 4.36Å; F220-K226 WeakPolarHBondContact O-CD 3.41Å; F220-K226 PolarHBondContact O-NZ 3.29Å; F220-F229 HydrophobicContact CB-CD1 4.18Å; F220-F229 HydrophobicContact CB-CE1 3.63Å; F220-F229 HydrophobicContact CB-CZ 4.2Å; F220-F229 AromaticContact CD2-CD1 3.63Å; F220-F229 HydrophobicContact CD2-CD1 3.63Å; F220-F229 AromaticContact CD2-CE1 3.78Å; F220-F229 HydrophobicContact CD2-CE1 3.78Å; F220-F229 HydrophobicContact CG-CD1 4.39Å; F220-F229 HydrophobicContact CG-CE1 4.21Å; F220-L230 HydrophobicContact CD2-CD2 4.26Å; F220-L230 HydrophobicContact CE2-CD2 4.22Å
221	V	90.9	Very high	90.5	Very high	55 Å²	55	51 Å²	51	33%	0.333	25%	0.254	S	S	.	.	H	α-helix	trans	-67	-41.7	178.6	173.1	0	0	0	0	111.5	A146 A150 F217 I218 R219 A223 K226	A146-V221 HydrophobicContact CB-CG1 4.3Å; A146-V221 WeakPolarHBondContact O-CG1 3.23Å; A150-V221 HydrophobicContact CB-CB 4.03Å; A150-V221 HydrophobicContact CB-CG1 3.77Å; F217-V221 WeakPolarHBondContact O-CG2 3.25Å; F217-V221 PolarHBondContact O-N 2.94Å; I218-V221 PolarHBondContact O-N 3.32Å; R219-V221 PolarHBondContact O-N 2.98Å; V221-A223 PolarHBondContact O-N 3.24Å; V221-K226 PolarHBondContact O-NZ 3.16Å
222	A	89	Confident	90.3	Very high	19 Å²	19	52.3 Å²	52.3	16%	0.157	26%	0.26	C	S	.	.	H	α-helix	trans	-69.6	-30.3	-179.8	0	0	0	0	0	114.3	A150 I154 I218 R219 T224	A150-A222 HydrophobicContact CB-CB 3.84Å; I154-A222 HydrophobicContact CD1-CB 3.25Å; I218-A222 PolarHBondContact O-N 2.94Å; I218-A222 VanDerWaalsContact O-N 3.1Å; R219-A222 PolarHBondContact O-N 3.1Å; A222-T224 PolarHBondContact O-N 3.37Å
223	A	88	Confident	90.1	Very high	18 Å²	18	56.2 Å²	56.2	15%	0.149	28%	0.284	C	S	.	.			trans	-58	133.6	-176.7	0	0	0	0	0	112.7	R219 V221 K226 F229	R219-A223 PolarHBondContact O-N 3.41Å; V221-A223 PolarHBondContact O-N 3.24Å; A223-K226 HydrophobicContact CB-CD 4.46Å; A223-K226 WeakPolarHBondContact O-CE 3.35Å; A223-K226 PolarHBondContact O-NZ 2.97Å; A223-F229 HydrophobicContact CB-CB 3.65Å; A223-F229 HydrophobicContact CB-CD2 4.02Å; A223-F229 HydrophobicContact CB-CG 3.85Å
224	T	86.8	Confident	89.8	Confident	119 Å²	119	56.8 Å²	56.8	73%	0.73	28%	0.283	S	S	*	.	S	Bend	trans	-70.5	-50.1	173.9	46.2	0	0	0	0	111	K147 A222	K147-T224 VanDerWaalsContact NZ-CG2 3.31Å; A222-T224 PolarHBondContact O-N 3.37Å
225	D	88.3	Confident	89.7	Confident	54 Å²	54	52.2 Å²	52.2	29%	0.289	26%	0.259	S	S	.	.			trans	-101.7	107.4	174.2	-165.7	-25.1	0	0	0	110.9	R72 V227 W228 F229	R72-D225 IonicContact CZ-OD1 3.49Å; R72-D225 VanDerWaalsContact NH2-CG 3.27Å; R72-D225 IonicContact NH2-OD1 3.05Å; R72-D225 PolarHBondContact NH2-OD1 2.92Å; R72-D225 IonicContact NH2-OD2 2.79Å; R72-D225 PolarHBondContact NH2-OD2 3.31Å; D225-V227 VanDerWaalsContact C-N 3.33Å; D225-V227 PolarHBondContact O-N 3.33Å; D225-V227 PolarHBondContact OD1-N 3.44Å; D225-W228 HydrophobicContact CB-CB 3.93Å; D225-W228 PolarHBondContact OD1-N 3.12Å; D225-F229 WeakPolarHBondContact O-CB 3.31Å; D225-F229 PolarHBondContact O-N 3.35Å
226	K	87.7	Confident	89.6	Confident	51 Å²	51	53.8 Å²	53.8	22%	0.222	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-32.3	179.3	-52.9	-53.3	-174.6	-168.4	0	113	V68 F220 V221 A223 L230	V68-K226 HydrophobicContact CG1-CB 3.7Å; V68-K226 HydrophobicContact CG2-CB 4.27Å; F220-K226 HydrophobicContact CE2-CB 4.09Å; F220-K226 HydrophobicContact CE2-CD 4.2Å; F220-K226 HydrophobicContact CE2-CG 4.47Å; F220-K226 HydrophobicContact CZ-CB 4.33Å; F220-K226 HydrophobicContact CZ-CD 4.17Å; F220-K226 HydrophobicContact CZ-CG 4.36Å; F220-K226 WeakPolarHBondContact O-CD 3.41Å; F220-K226 PolarHBondContact O-NZ 3.29Å; V221-K226 PolarHBondContact O-NZ 3.16Å; A223-K226 HydrophobicContact CB-CD 4.46Å; A223-K226 WeakPolarHBondContact O-CE 3.35Å; A223-K226 PolarHBondContact O-NZ 2.97Å; K226-L230 VanDerWaalsContact O-CG 3.32Å; K226-L230 WeakPolarHBondContact O-CG 3.47Å; K226-L230 PolarHBondContact O-N 3.09Å
227	V	87.7	Confident	89.6	Confident	36 Å²	36	53.1 Å²	53.1	22%	0.218	26%	0.264	C	S	.	.	H	α-helix	trans	-74.2	-44	-179	177.9	0	0	0	0	109.8	M65 V68 D225 F229 L230 L231	M65-V227 HydrophobicContact CE-CG1 4.46Å; M65-V227 HydrophobicContact SD-CG1 4.39Å; V68-V227 HydrophobicContact CG1-CG2 3.64Å; D225-V227 VanDerWaalsContact C-N 3.33Å; D225-V227 PolarHBondContact O-N 3.33Å; D225-V227 PolarHBondContact OD1-N 3.44Å; V227-F229 VanDerWaalsContact C-N 3.35Å; V227-L230 PolarHBondContact O-N 3.27Å; V227-L231 PolarHBondContact O-N 2.97Å
228	W	89.1	Confident	89.6	Confident	169 Å²	169	48 Å²	48	64%	0.64	24%	0.242	S	C	*	.	H	α-helix	trans	-63.5	-43.5	178	-132.2	112.2	0	0	0	111.2	D225 L230 L231 E232	D225-W228 HydrophobicContact CB-CB 3.93Å; D225-W228 PolarHBondContact OD1-N 3.12Å; W228-L230 VanDerWaalsContact C-N 3.28Å; W228-L230 PolarHBondContact O-N 2.97Å; W228-L231 CarbonylContact O-C 3.51Å; W228-L231 WeakPolarHBondContact O-CA 3.45Å; W228-L231 PolarHBondContact O-N 2.9Å; W228-E232 HydrophobicContact CE3-CG 4.11Å; W228-E232 HydrophobicContact CZ3-CG 4.27Å; W228-E232 PolarHBondContact O-N 3.36Å; W228-E232 VanDerWaalsContact O-N 3.16Å
229	F	90.2	Very high	89.6	Confident	5 Å²	5	47.5 Å²	47.5	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-55.4	-41.5	175.3	172.5	-97.1	0	0	0	113.1	F216 R219 F220 A223 D225 V227 L231 E232 S235	F216-F229 HydrophobicContact CD2-CE1 4.3Å; F216-F229 HydrophobicContact CD2-CZ 4.15Å; F216-F229 AromaticContact CE2-CE1 3.77Å; F216-F229 HydrophobicContact CE2-CE1 3.77Å; F216-F229 HydrophobicContact CE2-CZ 4.03Å; F216-F229 HydrophobicContact CZ-CE1 4Å; R219-F229 HydrophobicContact CB-CE2 3.52Å; R219-F229 HydrophobicContact CB-CZ 3.66Å; F220-F229 HydrophobicContact CB-CD1 4.18Å; F220-F229 HydrophobicContact CB-CE1 3.63Å; F220-F229 HydrophobicContact CB-CZ 4.2Å; F220-F229 AromaticContact CD2-CD1 3.63Å; F220-F229 HydrophobicContact CD2-CD1 3.63Å; F220-F229 AromaticContact CD2-CE1 3.78Å; F220-F229 HydrophobicContact CD2-CE1 3.78Å; F220-F229 HydrophobicContact CG-CD1 4.39Å; F220-F229 HydrophobicContact CG-CE1 4.21Å; A223-F229 HydrophobicContact CB-CB 3.65Å; A223-F229 HydrophobicContact CB-CD2 4.02Å; A223-F229 HydrophobicContact CB-CG 3.85Å; D225-F229 WeakPolarHBondContact O-CB 3.31Å; D225-F229 PolarHBondContact O-N 3.35Å; V227-F229 VanDerWaalsContact C-N 3.35Å; F229-L231 PolarHBondContact O-N 3.47Å; F229-E232 WeakPolarHBondContact O-CB 3.15Å; F229-E232 PolarHBondContact O-N 2.67Å; F229-S235 WeakPolarHBondContact O-CB 2.88Å; F229-S235 PolarHBondContact O-OG 3.02Å
230	L	88.8	Confident	89.6	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-67.7	-19.1	177.9	-66.4	176.6	0	0	0	112.8	M65 V68 F216 F220 K226 V227 W228 Y239	M65-L230 HydrophobicContact CE-CB 3.33Å; M65-L230 HydrophobicContact CE-CD1 4.02Å; M65-L230 HydrophobicContact CE-CG 4.35Å; M65-L230 HydrophobicContact CG-CD1 4.25Å; M65-L230 HydrophobicContact SD-CB 4.17Å; M65-L230 HydrophobicContact SD-CD1 3.7Å; V68-L230 HydrophobicContact CB-CD1 4.04Å; V68-L230 HydrophobicContact CG2-CD1 3.57Å; V68-L230 HydrophobicContact CG2-CG 4.5Å; F216-L230 HydrophobicContact CZ-CD2 4.16Å; F220-L230 HydrophobicContact CD2-CD2 4.26Å; F220-L230 HydrophobicContact CE2-CD2 4.22Å; K226-L230 VanDerWaalsContact O-CG 3.32Å; K226-L230 WeakPolarHBondContact O-CG 3.47Å; K226-L230 PolarHBondContact O-N 3.09Å; V227-L230 PolarHBondContact O-N 3.27Å; W228-L230 VanDerWaalsContact C-N 3.28Å; W228-L230 PolarHBondContact O-N 2.97Å; L230-Y239 WeakPolarHBondContact CD2-OH 3.28Å; L230-Y239 PolarHBondContact O-OH 2.83Å
231	L	89.6	Confident	89.6	Confident	81 Å²	81	46.5 Å²	46.5	42%	0.424	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	1.3	175.8	-65.6	174.7	0	0	0	113.7	F61 M65 V227 W228 F229 F236	F61-L231 HydrophobicContact CE2-CD2 4.16Å; F61-L231 HydrophobicContact CZ-CD2 4.11Å; M65-L231 HydrophobicContact CE-CD1 4.33Å; M65-L231 HydrophobicContact CE-CD2 3.62Å; M65-L231 HydrophobicContact CE-CG 3.57Å; V227-L231 PolarHBondContact O-N 2.97Å; W228-L231 CarbonylContact O-C 3.51Å; W228-L231 WeakPolarHBondContact O-CA 3.45Å; W228-L231 PolarHBondContact O-N 2.9Å; F229-L231 PolarHBondContact O-N 3.47Å; L231-F236 HydrophobicContact CD2-CZ 4.26Å; L231-F236 WeakPolarHBondContact O-CE2 3.25Å
232	E	89.4	Confident	89.6	Confident	66 Å²	66	44.3 Å²	44.3	31%	0.308	22%	0.222	S	C	.	.	S	Bend	trans	-67.3	146.6	174.4	-74.5	-178.9	-177.3	0	0	111.9	W228 F229 Y234 S235 F236	W228-E232 HydrophobicContact CE3-CG 4.11Å; W228-E232 HydrophobicContact CZ3-CG 4.27Å; W228-E232 PolarHBondContact O-N 3.36Å; W228-E232 VanDerWaalsContact O-N 3.16Å; F229-E232 WeakPolarHBondContact O-CB 3.15Å; F229-E232 PolarHBondContact O-N 2.67Å; E232-Y234 PolarHBondContact O-N 3.11Å; E232-S235 WeakPolarHBondContact O-CB 3.27Å; E232-S235 PolarHBondContact O-N 3.21Å; E232-F236 WeakPolarHBondContact O-CD2 3.32Å; E232-F236 PolarHBondContact O-N 3.26Å; E232-F236 VanDerWaalsContact O-N 3.14Å
233	V	87.9	Confident	89.7	Confident	84 Å²	84	44.3 Å²	44.3	51%	0.509	22%	0.22	S	C	.	.	H	α-helix	trans	-54.9	-40.4	179.1	178.5	0	0	0	0	111.7	S235 F236 V237 L264	V233-S235 VanDerWaalsContact C-N 3.31Å; V233-S235 PolarHBondContact O-N 3.13Å; V233-F236 WeakPolarHBondContact O-CB 3.25Å; V233-F236 PolarHBondContact O-N 3.37Å; V233-V237 WeakPolarHBondContact O-CG2 3.31Å; V233-V237 PolarHBondContact O-N 3.24Å; V233-L264 HydrophobicContact CG1-CD1 4.37Å
234	Y	88.4	Confident	89.8	Confident	69 Å²	69	44.1 Å²	44.1	27%	0.271	22%	0.217	S	C	.	.	H	α-helix	trans	-65.8	-33.9	178.9	-56.1	-58.5	0	0	0	112.9	E232 V237 D238 M267 T268	E232-Y234 PolarHBondContact O-N 3.11Å; Y234-V237 PolarHBondContact O-N 3.43Å; Y234-D238 PolarHBondContact O-N 3.25Å; Y234-M267 HydrophobicContact CE1-CB 4.46Å; Y234-T268 HydrophobicContact CD1-CG2 4.03Å; Y234-T268 HydrophobicContact CE1-CG2 3.41Å; Y234-T268 VanDerWaalsContact CE1-CG2 3.41Å; Y234-T268 HydrophobicContact CE2-CG2 4.4Å
235	S	90.4	Very high	89.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-68.3	-39.1	174.9	-59.7	0	0	0	0	110.7	F229 E232 V233 V237 D238 Y239	F229-S235 WeakPolarHBondContact O-CB 2.88Å; F229-S235 PolarHBondContact O-OG 3.02Å; E232-S235 WeakPolarHBondContact O-CB 3.27Å; E232-S235 PolarHBondContact O-N 3.21Å; V233-S235 VanDerWaalsContact C-N 3.31Å; V233-S235 PolarHBondContact O-N 3.13Å; S235-V237 PolarHBondContact O-N 3.07Å; S235-D238 PolarHBondContact O-N 3.26Å; S235-Y239 WeakPolarHBondContact O-CD2 3.44Å; S235-Y239 WeakPolarHBondContact O-CE2 3.18Å; S235-Y239 VanDerWaalsContact O-CG 3.29Å; S235-Y239 PolarHBondContact O-N 3.06Å
236	F	90.8	Very high	89.8	Confident	70 Å²	70	40 Å²	40	31%	0.307	19%	0.188	S	C	.	.	H	α-helix	trans	-60.7	-42.5	171.7	-78.8	-69.2	0	0	0	113	F61 L231 E232 V233 D238 Y239 F240	F61-F236 HydrophobicContact CD2-CE1 4.34Å; F61-F236 HydrophobicContact CE2-CE1 4.15Å; F61-F236 HydrophobicContact CE2-CZ 4.2Å; L231-F236 HydrophobicContact CD2-CZ 4.26Å; L231-F236 WeakPolarHBondContact O-CE2 3.25Å; E232-F236 WeakPolarHBondContact O-CD2 3.32Å; E232-F236 PolarHBondContact O-N 3.26Å; E232-F236 VanDerWaalsContact O-N 3.14Å; V233-F236 WeakPolarHBondContact O-CB 3.25Å; V233-F236 PolarHBondContact O-N 3.37Å; F236-D238 PolarHBondContact O-N 2.84Å; F236-Y239 HydrophobicContact CD1-CD2 4.15Å; F236-Y239 PolarHBondContact O-N 3.33Å; F236-F240 HydrophobicContact CB-CD2 4.5Å; F236-F240 HydrophobicContact CB-CE2 4.42Å; F236-F240 AromaticContact CD1-CE2 3.97Å; F236-F240 HydrophobicContact CD1-CE2 3.97Å; F236-F240 WeakPolarHBondContact O-CD2 3.29Å; F236-F240 PolarHBondContact O-N 3.37Å; F236-F240 VanDerWaalsContact O-N 3.12Å
237	V	92	Very high	89.8	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.024	19%	0.187	C	C	.	.	H	α-helix	trans	-57.3	-42.4	175	175.5	0	0	0	0	110.7	V233 Y234 S235 F240 T241 L261 L264 R265	V233-V237 WeakPolarHBondContact O-CG2 3.31Å; V233-V237 PolarHBondContact O-N 3.24Å; Y234-V237 PolarHBondContact O-N 3.43Å; S235-V237 PolarHBondContact O-N 3.07Å; V237-F240 PolarHBondContact O-N 2.85Å; V237-T241 HydrophobicContact CG1-CG2 4.33Å; V237-T241 WeakPolarHBondContact O-CB 3.33Å; V237-T241 WeakPolarHBondContact O-CG2 3.22Å; V237-T241 PolarHBondContact O-N 2.95Å; V237-T241 VanDerWaalsContact O-N 3.15Å; V237-T241 PolarHBondContact O-OG1 3.24Å; V237-L261 HydrophobicContact CG1-CB 4.5Å; V237-L261 WeakPolarHBondContact CG1-O 3.31Å; V237-L264 HydrophobicContact CG2-CB 3.85Å; V237-L264 HydrophobicContact CG2-CD1 3.88Å; V237-L264 HydrophobicContact CG2-CG 4.48Å; V237-R265 HydrophobicContact CG1-CG 4.07Å
238	D	92	Very high	89.8	Confident	6 Å²	6	37.7 Å²	37.7	3%	0.032	18%	0.179	C	C	.	.	H	α-helix	trans	-68.6	-39.9	179.3	-71.5	-15.4	0	0	0	112.3	F216 R219 Y234 S235 F236 F240 T241 I242 P243 R265	F216-D238 HydrophobicContact CD2-CB 4.21Å; R219-D238 IonicContact CZ-OD2 3.15Å; R219-D238 IonicContact NH2-OD2 3.86Å; R219-D238 PolarHBondContact NH2-OD2 2.73Å; Y234-D238 PolarHBondContact O-N 3.25Å; S235-D238 PolarHBondContact O-N 3.26Å; F236-D238 PolarHBondContact O-N 2.84Å; D238-F240 VanDerWaalsContact C-N 3.31Å; D238-F240 PolarHBondContact O-N 3.01Å; D238-T241 PolarHBondContact O-N 3.02Å; D238-I242 HydrophobicContact CB-CD1 3.74Å; D238-I242 HydrophobicContact CB-CG1 4.44Å; D238-I242 WeakPolarHBondContact O-CB 3.42Å; D238-I242 WeakPolarHBondContact O-CG1 3.3Å; D238-I242 PolarHBondContact O-N 3.19Å; D238-P243 WeakPolarHBondContact O-CD 3.37Å; D238-R265 IonicContact OD1-CZ 2.76Å; D238-R265 IonicContact OD1-NE 3.17Å; D238-R265 IonicContact OD1-NH2 2.7Å; D238-R265 PolarHBondContact OD1-NH2 2.96Å
239	Y	91.6	Very high	89.6	Confident	13 Å²	13	32.6 Å²	32.6	5%	0.051	16%	0.163	C	C	.	.	H	α-helix	trans	-62.7	-34.2	175.4	-58.8	-39.8	0	0	0	113.7	S57 F61 F216 L230 S235 F236 P243	S57-Y239 WeakPolarHBondContact CB-O 3.29Å; S57-Y239 PolarHBondContact OG-O 2.87Å; F61-Y239 HydrophobicContact CB-CD2 4.27Å; F61-Y239 AromaticContact CD2-CD2 3.96Å; F61-Y239 HydrophobicContact CD2-CD2 3.96Å; F61-Y239 AromaticContact CD2-CE2 3.63Å; F61-Y239 HydrophobicContact CD2-CE2 3.63Å; F61-Y239 HydrophobicContact CE2-CE2 4.39Å; F216-Y239 AromaticContact CE2-CE1 3.99Å; F216-Y239 HydrophobicContact CE2-CE1 3.99Å; F216-Y239 AromaticContact CZ-CE1 3.83Å; F216-Y239 HydrophobicContact CZ-CE1 3.83Å; L230-Y239 WeakPolarHBondContact CD2-OH 3.28Å; L230-Y239 PolarHBondContact O-OH 2.83Å; S235-Y239 WeakPolarHBondContact O-CD2 3.44Å; S235-Y239 WeakPolarHBondContact O-CE2 3.18Å; S235-Y239 VanDerWaalsContact O-CG 3.29Å; S235-Y239 PolarHBondContact O-N 3.06Å; F236-Y239 HydrophobicContact CD1-CD2 4.15Å; F236-Y239 PolarHBondContact O-N 3.33Å; Y239-P243 WeakPolarHBondContact O-CD 3.42Å; Y239-P243 WeakPolarHBondContact O-CG 3.46Å
240	F	91.6	Very high	89.4	Confident	53 Å²	53	41.9 Å²	41.9	23%	0.232	20%	0.2	C	C	.	.	H	α-helix	trans	-90.6	-7.4	-178.6	-68.2	-59.6	0	0	0	114	F236 V237 D238 L258 L261	F236-F240 HydrophobicContact CB-CD2 4.5Å; F236-F240 HydrophobicContact CB-CE2 4.42Å; F236-F240 AromaticContact CD1-CE2 3.97Å; F236-F240 HydrophobicContact CD1-CE2 3.97Å; F236-F240 WeakPolarHBondContact O-CD2 3.29Å; F236-F240 PolarHBondContact O-N 3.37Å; F236-F240 VanDerWaalsContact O-N 3.12Å; V237-F240 PolarHBondContact O-N 2.85Å; D238-F240 VanDerWaalsContact C-N 3.31Å; D238-F240 PolarHBondContact O-N 3.01Å; F240-L258 HydrophobicContact CB-CB 4.12Å; F240-L258 HydrophobicContact CB-CD1 4.06Å; F240-L258 HydrophobicContact CD1-CD1 3.38Å; F240-L258 HydrophobicContact CE1-CD1 3.92Å; F240-L258 HydrophobicContact CG-CD1 3.77Å; F240-L261 HydrophobicContact CB-CD1 3.55Å; F240-L261 HydrophobicContact CD2-CD1 3.71Å; F240-L261 HydrophobicContact CG-CD1 3.88Å
241	T	91	Very high	89.2	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-114.1	-38.5	-178.7	57.9	0	0	0	0	113.2	V237 D238 R262 R265	V237-T241 HydrophobicContact CG1-CG2 4.33Å; V237-T241 WeakPolarHBondContact O-CB 3.33Å; V237-T241 WeakPolarHBondContact O-CG2 3.22Å; V237-T241 PolarHBondContact O-N 2.95Å; V237-T241 VanDerWaalsContact O-N 3.15Å; V237-T241 PolarHBondContact O-OG1 3.24Å; D238-T241 PolarHBondContact O-N 3.02Å; T241-R262 HydrophobicContact CG2-CG 3.7Å; T241-R265 PolarHBondContact OG1-NH2 3.47Å
242	I	91.8	Very high	88.9	Confident	8 Å²	8	46.3 Å²	46.3	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-79.5	-58.8	-173.3	-58.4	172.7	0	0	0	111.9	N209 F212 L213 D238 S245 F246	N209-I242 HydrophobicContact CB-CG1 4.48Å; F212-I242 HydrophobicContact CB-CD1 3.88Å; F212-I242 HydrophobicContact CB-CG1 4.36Å; L213-I242 HydrophobicContact CB-CD1 4.4Å; L213-I242 HydrophobicContact CB-CG2 4.22Å; L213-I242 HydrophobicContact CD1-CG2 4.25Å; D238-I242 HydrophobicContact CB-CD1 3.74Å; D238-I242 HydrophobicContact CB-CG1 4.44Å; D238-I242 WeakPolarHBondContact O-CB 3.42Å; D238-I242 WeakPolarHBondContact O-CG1 3.3Å; D238-I242 PolarHBondContact O-N 3.19Å; I242-S245 WeakPolarHBondContact O-CB 3.39Å; I242-S245 PolarHBondContact O-N 3.25Å; I242-S245 VanDerWaalsContact O-N 3.09Å; I242-S245 PolarHBondContact O-OG 3.04Å; I242-F246 HydrophobicContact CG2-CD2 4.13Å; I242-F246 HydrophobicContact CG2-CE2 3.59Å; I242-F246 WeakPolarHBondContact O-CD2 3.5Å
243	P	91.1	Very high	88.6	Confident	20 Å²	20	44.9 Å²	44.9	13%	0.13	21%	0.211	C	C	.	.	H	α-helix	trans	-56.3	-43.8	-179.8	-19	29	0	0	0	114.7	T60 D238 Y239 S245 F246 V247	T60-P243 HydrophobicContact CG2-CB 4.11Å; T60-P243 HydrophobicContact CG2-CG 3.92Å; T60-P243 WeakPolarHBondContact OG1-CG 3.37Å; D238-P243 WeakPolarHBondContact O-CD 3.37Å; Y239-P243 WeakPolarHBondContact O-CD 3.42Å; Y239-P243 WeakPolarHBondContact O-CG 3.46Å; P243-S245 PolarHBondContact O-N 3.39Å; P243-F246 PolarHBondContact O-N 3.34Å; P243-V247 PolarHBondContact O-N 3Å
244	P	88.9	Confident	88.3	Confident	13 Å²	13	41.7 Å²	41.7	8%	0.084	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-28.6	177.5	-28.4	38.7	0	0	0	113.8	F53 S57 V247 A248	F53-P244 HydrophobicContact CB-CB 4.43Å; F53-P244 HydrophobicContact CD1-CB 4.12Å; S57-P244 WeakPolarHBondContact OG-CG 3.48Å; P244-V247 PolarHBondContact O-N 2.9Å; P244-A248 WeakPolarHBondContact O-CB 3.37Å; P244-A248 PolarHBondContact O-N 3.21Å
245	S	86.8	Confident	88.2	Confident	7 Å²	7	39.5 Å²	39.5	5%	0.049	18%	0.183	C	C	.	.	H	α-helix	trans	-69.2	-34.4	176.3	76.1	0	0	0	0	112.7	N209 I242 P243	N209-S245 WeakPolarHBondContact ND2-CB 3.45Å; N209-S245 PolarHBondContact ND2-OG 3.12Å; I242-S245 WeakPolarHBondContact O-CB 3.39Å; I242-S245 PolarHBondContact O-N 3.25Å; I242-S245 VanDerWaalsContact O-N 3.09Å; I242-S245 PolarHBondContact O-OG 3.04Å; P243-S245 PolarHBondContact O-N 3.39Å
246	F	89.7	Confident	87.9	Confident	81 Å²	81	40.2 Å²	40.2	36%	0.355	19%	0.187	S	C	.	.	H	α-helix	trans	-73.8	-40.1	173.4	-69.5	-71.3	0	0	0	111.8	L206 I210 L213 I242 P243 A248 I249 Y250	L206-F246 HydrophobicContact CD1-CD1 4.05Å; L206-F246 HydrophobicContact CD1-CE1 3.83Å; L206-F246 HydrophobicContact CD1-CZ 4.45Å; I210-F246 HydrophobicContact CG1-CE1 4.37Å; I210-F246 HydrophobicContact CG1-CZ 4.13Å; L213-F246 HydrophobicContact CD2-CE2 4.31Å; L213-F246 HydrophobicContact CD2-CZ 4.26Å; I242-F246 HydrophobicContact CG2-CD2 4.13Å; I242-F246 HydrophobicContact CG2-CE2 3.59Å; I242-F246 WeakPolarHBondContact O-CD2 3.5Å; P243-F246 PolarHBondContact O-N 3.34Å; F246-A248 VanDerWaalsContact C-N 3.27Å; F246-A248 PolarHBondContact O-N 2.86Å; F246-I249 PolarHBondContact O-N 2.69Å; F246-Y250 PolarHBondContact O-N 3.25Å
247	V	88	Confident	87.6	Confident	32 Å²	32	36.9 Å²	36.9	19%	0.194	17%	0.172	C	C	.	.	H	α-helix	trans	-64.7	-33.6	175.8	175	0	0	0	0	111.6	F53 P243 P244 I249 Y250 L251	F53-V247 HydrophobicContact CD1-CB 4.13Å; F53-V247 HydrophobicContact CD1-CG1 3.87Å; F53-V247 HydrophobicContact CE1-CB 4.28Å; F53-V247 HydrophobicContact CE1-CG1 3.93Å; F53-V247 HydrophobicContact CG-CG1 4.46Å; P243-V247 PolarHBondContact O-N 3Å; P244-V247 PolarHBondContact O-N 2.9Å; V247-I249 PolarHBondContact O-N 3.16Å; V247-Y250 PolarHBondContact O-N 2.89Å; V247-Y250 VanDerWaalsContact O-N 3.16Å; V247-L251 HydrophobicContact CG1-CD1 3.54Å; V247-L251 HydrophobicContact CG1-CG 4.02Å; V247-L251 PolarHBondContact O-N 3.29Å
248	A	85.8	Confident	87.5	Confident	6 Å²	6	38 Å²	38	5%	0.05	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-35.4	176.7	0	0	0	0	0	112.8	F53 P244 F246 E252 R253	F53-A248 HydrophobicContact CE1-CB 3.95Å; P244-A248 WeakPolarHBondContact O-CB 3.37Å; P244-A248 PolarHBondContact O-N 3.21Å; F246-A248 VanDerWaalsContact C-N 3.27Å; F246-A248 PolarHBondContact O-N 2.86Å; A248-E252 WeakPolarHBondContact O-CA 3.33Å; A248-E252 PolarHBondContact O-N 2.88Å; A248-E252 VanDerWaalsContact O-N 3.14Å; A248-R253 WeakPolarHBondContact CA-O 3.37Å; A248-R253 VanDerWaalsContact CB-O 3.23Å; A248-R253 WeakPolarHBondContact CB-O 3.15Å; A248-R253 PolarHBondContact O-N 3.19Å; A248-R253 VanDerWaalsContact O-N 3.16Å
249	I	85.8	Confident	87.5	Confident	61 Å²	61	38.5 Å²	38.5	31%	0.313	18%	0.179	S	C	.	.	H	α-helix	trans	-70.6	-45.3	175.6	-60.7	164.7	0	0	0	110	L206 F246 V247 L251 E252	L206-I249 HydrophobicContact CD1-CD1 3.54Å; L206-I249 HydrophobicContact CD2-CD1 3.45Å; L206-I249 VanDerWaalsContact CD2-CD1 3.45Å; L206-I249 HydrophobicContact CG-CD1 4Å; F246-I249 PolarHBondContact O-N 2.69Å; V247-I249 PolarHBondContact O-N 3.16Å; I249-L251 PolarHBondContact O-N 3.36Å; I249-E252 PolarHBondContact O-N 3.05Å
250	Y	85.9	Confident	87.5	Confident	201 Å²	201	38 Å²	38	79%	0.788	18%	0.178	S	C	*	.	H	α-helix	trans	-65.3	-37.5	-178.5	-176.4	-98.1	0	0	0	113	F246 V247	F246-Y250 PolarHBondContact O-N 3.25Å; V247-Y250 PolarHBondContact O-N 2.89Å; V247-Y250 VanDerWaalsContact O-N 3.16Å
251	L	84.5	Confident	87.6	Confident	48 Å²	48	36.8 Å²	36.8	25%	0.251	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.9	179.8	-66.7	177.6	0	0	0	113.7	C52 F53 V247 I249 R253	C52-L251 HydrophobicContact CB-CD1 3.97Å; F53-L251 HydrophobicContact CE2-CD1 4.16Å; F53-L251 HydrophobicContact CZ-CD1 4.08Å; V247-L251 HydrophobicContact CG1-CD1 3.54Å; V247-L251 HydrophobicContact CG1-CG 4.02Å; V247-L251 PolarHBondContact O-N 3.29Å; I249-L251 PolarHBondContact O-N 3.36Å; L251-R253 HydrophobicContact CB-CB 4.34Å; L251-R253 WeakPolarHBondContact O-CG 3.22Å; L251-R253 PolarHBondContact O-N 3.49Å; L251-R253 VanDerWaalsContact O-N 3.16Å
252	E	83.8	Confident	87.7	Confident	128 Å²	128	36.7 Å²	36.7	60%	0.598	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	34.8	-170.3	-60	-170	160.9	0	0	113.5	A248 I249	A248-E252 WeakPolarHBondContact O-CA 3.33Å; A248-E252 PolarHBondContact O-N 2.88Å; A248-E252 VanDerWaalsContact O-N 3.14Å; I249-E252 PolarHBondContact O-N 3.05Å
253	R	82.5	Confident	87.8	Confident	36 Å²	36	36.3 Å²	36.3	14%	0.136	17%	0.171	C	C	.	.			trans	-136.9	137.7	-176.3	-72.3	174.7	-177.8	-132	1.4	109.4	C44 Q47 Y49 F53 C193 A248 L251	C44-R253 VanDerWaalsContact O-CZ 3.31Å; C44-R253 PolarHBondContact O-NH1 3.01Å; C44-R253 PolarHBondContact O-NH2 2.84Å; C44-R253 PolarHBondContact SG-NH2 3.18Å; Q47-R253 PolarHBondContact O-NH1 3.33Å; Y49-R253 VanDerWaalsContact CD2-NH1 3.35Å; F53-R253 HydrophobicContact CZ-CB 4.34Å; F53-R253 WeakPolarHBondContact CZ-O 3.17Å; C193-R253 HydrophobicContact CB-CG 4.47Å; A248-R253 WeakPolarHBondContact CA-O 3.37Å; A248-R253 VanDerWaalsContact CB-O 3.23Å; A248-R253 WeakPolarHBondContact CB-O 3.15Å; A248-R253 PolarHBondContact O-N 3.19Å; A248-R253 VanDerWaalsContact O-N 3.16Å; L251-R253 HydrophobicContact CB-CB 4.34Å; L251-R253 WeakPolarHBondContact O-CG 3.22Å; L251-R253 PolarHBondContact O-N 3.49Å; L251-R253 VanDerWaalsContact O-N 3.16Å
254	T	83	Confident	87.9	Confident	16 Å²	16	36.6 Å²	36.6	10%	0.098	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.6	172	-176.1	0	0	0	0	110.9	E191 T192 Q202	E191-T254 WeakPolarHBondContact CA-O 3.41Å; T192-T254 PolarHBondContact N-O 3.15Å; T192-T254 PolarHBondContact O-N 2.94Å; T192-T254 WeakPolarHBondContact OG1-CG2 3.24Å; Q202-T254 VanDerWaalsContact NE2-CB 3.31Å
255	W	85.3	Confident	88	Confident	24 Å²	24	36.7 Å²	36.7	9%	0.091	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123	175.5	180	56.2	0	0	0	108.4	F53 L54 E191 G257 L258	F53-W255 HydrophobicContact CB-CD2 4.03Å; F53-W255 HydrophobicContact CB-CE3 3.24Å; F53-W255 HydrophobicContact CB-CZ3 3.59Å; F53-W255 HydrophobicContact CD1-CB 4.21Å; F53-W255 HydrophobicContact CD1-CE3 4.41Å; F53-W255 HydrophobicContact CD2-CB 3.74Å; F53-W255 HydrophobicContact CD2-CD2 4.24Å; F53-W255 HydrophobicContact CD2-CE3 4.24Å; F53-W255 HydrophobicContact CD2-CG 4.09Å; F53-W255 HydrophobicContact CE1-CB 4.2Å; F53-W255 HydrophobicContact CE2-CB 3.75Å; F53-W255 HydrophobicContact CE2-CG 4.49Å; F53-W255 HydrophobicContact CG-CB 3.98Å; F53-W255 HydrophobicContact CG-CD2 4.2Å; F53-W255 AromaticContact CG-CE3 3.75Å; F53-W255 HydrophobicContact CG-CE3 3.75Å; F53-W255 HydrophobicContact CG-CG 4.35Å; F53-W255 HydrophobicContact CZ-CB 3.99Å; L54-W255 HydrophobicContact CD1-CH2 4.3Å; E191-W255 HydrophobicContact CG-CB 4.46Å; E191-W255 HydrophobicContact CG-CG 4.35Å; W255-G257 VanDerWaalsContact C-N 3.34Å; W255-G257 VanDerWaalsContact CD2-CA 3.44Å; W255-G257 VanDerWaalsContact CZ2-CA 3.41Å; W255-L258 HydrophobicContact CH2-CG 4.44Å
256	L	84.5	Confident	88.1	Confident	14 Å²	14	37.9 Å²	37.9	7%	0.073	18%	0.175	C	C	.	.			trans	-65.4	-42.9	177.5	-171	75.2	0	0	0	110.2	Y179 D182 A183 F188 V190 L258 R259	Y179-L256 HydrophobicContact CD2-CD1 3.69Å; Y179-L256 HydrophobicContact CD2-CG 4.29Å; Y179-L256 HydrophobicContact CE2-CD1 3.7Å; Y179-L256 HydrophobicContact CE2-CD2 3.9Å; Y179-L256 HydrophobicContact CE2-CG 3.84Å; D182-L256 HydrophobicContact CB-CD1 4.18Å; A183-L256 HydrophobicContact CB-CD1 4.49Å; A183-L256 HydrophobicContact CB-CD2 4.13Å; F188-L256 HydrophobicContact CE2-CB 4.23Å; F188-L256 HydrophobicContact CE2-CD2 3.51Å; F188-L256 HydrophobicContact CE2-CG 4.34Å; F188-L256 HydrophobicContact CZ-CD2 3.61Å; V190-L256 PolarHBondContact O-N 2.84Å; V190-L256 VanDerWaalsContact O-N 3.07Å; L256-L258 PolarHBondContact O-N 3.48Å; L256-R259 WeakPolarHBondContact O-CB 3.23Å; L256-R259 WeakPolarHBondContact O-CG 3.25Å; L256-R259 PolarHBondContact O-N 2.94Å
257	G	84.2	Confident	88.1	Confident	1 Å²	1	36 Å²	36	1%	0.01	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	39.8	-123.4	170.4	0	0	0	0	0	115.1	W255 R259 F260	W255-G257 VanDerWaalsContact C-N 3.34Å; W255-G257 VanDerWaalsContact CD2-CA 3.44Å; W255-G257 VanDerWaalsContact CZ2-CA 3.41Å; G257-R259 VanDerWaalsContact C-N 3.33Å; G257-F260 WeakPolarHBondContact O-CD1 3.5Å; G257-F260 VanDerWaalsContact O-CE1 3.29Å; G257-F260 WeakPolarHBondContact O-CE1 3.16Å
258	L	90.6	Very high	88.1	Confident	27 Å²	27	35.9 Å²	35.9	14%	0.141	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	17.9	-177.6	-60	175.2	0	0	0	113.4	L54 F240 W255 L256 F260 L261 L307	L54-L258 HydrophobicContact CD1-CD1 4.11Å; F240-L258 HydrophobicContact CB-CB 4.12Å; F240-L258 HydrophobicContact CB-CD1 4.06Å; F240-L258 HydrophobicContact CD1-CD1 3.38Å; F240-L258 HydrophobicContact CE1-CD1 3.92Å; F240-L258 HydrophobicContact CG-CD1 3.77Å; W255-L258 HydrophobicContact CH2-CG 4.44Å; L256-L258 PolarHBondContact O-N 3.48Å; L258-F260 HydrophobicContact CD2-CE1 3.81Å; L258-F260 HydrophobicContact CD2-CZ 3.56Å; L258-F260 PolarHBondContact O-N 2.73Å; L258-F260 VanDerWaalsContact O-N 3.14Å; L258-L261 HydrophobicContact CB-CD1 3.9Å; L258-L261 HydrophobicContact CB-CG 4.33Å; L258-L261 HydrophobicContact CD1-CD1 4.5Å; L258-L261 WeakPolarHBondContact O-CB 3.4Å; L258-L261 WeakPolarHBondContact O-CG 3.46Å; L258-L261 PolarHBondContact O-N 2.78Å; L258-L307 HydrophobicContact CD2-CD2 4.14Å
259	R	91.6	Very high	88.2	Confident	16 Å²	16	37 Å²	37	6%	0.06	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-60.3	-23.7	177.6	-72.4	-179.2	179.1	-150.8	-9.3	112.9	Y179 D182 D205 L256 G257 L261 R262	Y179-R259 HydrophobicContact CD2-CB 3.66Å; Y179-R259 HydrophobicContact CE2-CB 4.27Å; Y179-R259 HydrophobicContact CG-CB 4.5Å; D182-R259 IonicContact OD2-NH1 2.67Å; D182-R259 PolarHBondContact OD2-NH1 3.08Å; D205-R259 IonicContact OD2-CZ 3.41Å; D205-R259 IonicContact OD2-NH1 3.67Å; D205-R259 PolarHBondContact OD2-NH1 3.03Å; D205-R259 IonicContact OD2-NH2 3.29Å; D205-R259 PolarHBondContact OD2-NH2 3.37Å; L256-R259 WeakPolarHBondContact O-CB 3.23Å; L256-R259 WeakPolarHBondContact O-CG 3.25Å; L256-R259 PolarHBondContact O-N 2.94Å; G257-R259 VanDerWaalsContact C-N 3.33Å; R259-L261 PolarHBondContact O-N 2.84Å; R259-R262 VanDerWaalsContact O-CB 3.28Å; R259-R262 WeakPolarHBondContact O-CB 3.39Å; R259-R262 VanDerWaalsContact O-CD 3.26Å; R259-R262 WeakPolarHBondContact O-CD 3.41Å; R259-R262 WeakPolarHBondContact O-CG 3.39Å; R259-R262 PolarHBondContact O-N 2.66Å; R259-R262 VanDerWaalsContact O-N 3.11Å
260	F	92.1	Very high	88.4	Confident	3 Å²	3	34.2 Å²	34.2	1%	0.013	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-61.8	-21.7	174.9	61.9	-98.9	0	0	0	113.6	Y179 G257 L258 R262 A263 T300 G303 F304 L307	Y179-F260 HydrophobicContact CE1-CB 3.95Å; Y179-F260 HydrophobicContact CE2-CB 3.94Å; Y179-F260 WeakPolarHBondContact OH-CB 3.46Å; G257-F260 WeakPolarHBondContact O-CD1 3.5Å; G257-F260 VanDerWaalsContact O-CE1 3.29Å; G257-F260 WeakPolarHBondContact O-CE1 3.16Å; L258-F260 HydrophobicContact CD2-CE1 3.81Å; L258-F260 HydrophobicContact CD2-CZ 3.56Å; L258-F260 PolarHBondContact O-N 2.73Å; L258-F260 VanDerWaalsContact O-N 3.14Å; F260-R262 PolarHBondContact O-N 3.32Å; F260-A263 VanDerWaalsContact O-CB 3.29Å; F260-A263 WeakPolarHBondContact O-CB 3.33Å; F260-A263 PolarHBondContact O-N 2.61Å; F260-T300 HydrophobicContact CD2-CG2 3.94Å; F260-T300 WeakPolarHBondContact CD2-O 2.76Å; F260-T300 HydrophobicContact CE2-CG2 4.12Å; F260-G303 VanDerWaalsContact CD1-C 3.46Å; F260-G303 WeakPolarHBondContact CD1-O 3.41Å; F260-F304 HydrophobicContact CE2-CB 3.97Å; F260-F304 HydrophobicContact CE2-CD2 4.1Å; F260-F304 HydrophobicContact CZ-CB 3.97Å; F260-F304 AromaticContact CZ-CD2 3.67Å; F260-F304 HydrophobicContact CZ-CD2 3.67Å; F260-F304 HydrophobicContact CZ-CG 4.27Å; F260-L307 HydrophobicContact CE1-CB 4.2Å; F260-L307 HydrophobicContact CE1-CD2 3.98Å
261	L	93.1	Very high	88.4	Confident	27 Å²	27	27.2 Å²	27.2	14%	0.141	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-61.1	-16.7	174.9	-66.3	177	0	0	0	112.5	V237 F240 L258 R259 A263 L264 T300	V237-L261 HydrophobicContact CG1-CB 4.5Å; V237-L261 WeakPolarHBondContact CG1-O 3.31Å; F240-L261 HydrophobicContact CB-CD1 3.55Å; F240-L261 HydrophobicContact CD2-CD1 3.71Å; F240-L261 HydrophobicContact CG-CD1 3.88Å; L258-L261 HydrophobicContact CB-CD1 3.9Å; L258-L261 HydrophobicContact CB-CG 4.33Å; L258-L261 HydrophobicContact CD1-CD1 4.5Å; L258-L261 WeakPolarHBondContact O-CB 3.4Å; L258-L261 WeakPolarHBondContact O-CG 3.46Å; L258-L261 PolarHBondContact O-N 2.78Å; R259-L261 PolarHBondContact O-N 2.84Å; L261-A263 PolarHBondContact O-N 3.02Å; L261-L264 HydrophobicContact CD2-CD1 3.97Å; L261-L264 WeakPolarHBondContact O-CB 3.41Å; L261-L264 PolarHBondContact O-N 3.05Å; L261-T300 HydrophobicContact CD2-CG2 3.96Å
262	R	93.1	Very high	88.5	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.008	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-56.6	-27.2	169.7	-66.4	168.3	-178.1	-170.1	1	112.5	S175 L176 D205 T241 R259 F260 L264 R265	S175-R262 PolarHBondContact O-NH1 3.42Å; S175-R262 VanDerWaalsContact O-NH1 3.13Å; S175-R262 VanDerWaalsContact OG-CD 3.29Å; S175-R262 WeakPolarHBondContact OG-CD 3.34Å; S175-R262 PolarHBondContact OG-NE 2.95Å; S175-R262 PolarHBondContact OG-NH1 2.81Å; L176-R262 HydrophobicContact CD1-CB 4.45Å; D205-R262 IonicContact OD1-CZ 3.09Å; D205-R262 IonicContact OD1-NH1 2.67Å; D205-R262 PolarHBondContact OD1-NH1 3.33Å; D205-R262 IonicContact OD1-NH2 2.81Å; D205-R262 PolarHBondContact OD1-NH2 3.49Å; D205-R262 IonicContact OD2-CZ 3.79Å; D205-R262 IonicContact OD2-NH1 3.82Å; D205-R262 IonicContact OD2-NH2 2.85Å; D205-R262 PolarHBondContact OD2-NH2 3.01Å; T241-R262 HydrophobicContact CG2-CG 3.7Å; R259-R262 VanDerWaalsContact O-CB 3.28Å; R259-R262 WeakPolarHBondContact O-CB 3.39Å; R259-R262 VanDerWaalsContact O-CD 3.26Å; R259-R262 WeakPolarHBondContact O-CD 3.41Å; R259-R262 WeakPolarHBondContact O-CG 3.39Å; R259-R262 PolarHBondContact O-N 2.66Å; R259-R262 VanDerWaalsContact O-N 3.11Å; F260-R262 PolarHBondContact O-N 3.32Å; R262-L264 PolarHBondContact O-N 3.37Å; R262-R265 WeakPolarHBondContact O-CB 3.39Å; R262-R265 PolarHBondContact O-N 3.02Å; R262-R265 VanDerWaalsContact O-N 3.12Å
263	A	92.9	Very high	88.7	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-63.2	-28.1	176.2	0	0	0	0	0	112.8	L176 F260 L261 R265 L266 S296 L299	L176-A263 HydrophobicContact CD1-CB 3.91Å; F260-A263 VanDerWaalsContact O-CB 3.29Å; F260-A263 WeakPolarHBondContact O-CB 3.33Å; F260-A263 PolarHBondContact O-N 2.61Å; L261-A263 PolarHBondContact O-N 3.02Å; A263-R265 PolarHBondContact O-N 2.91Å; A263-L266 VanDerWaalsContact O-CB 3.32Å; A263-L266 WeakPolarHBondContact O-CB 3.49Å; A263-L266 WeakPolarHBondContact O-CG 3.26Å; A263-L266 PolarHBondContact O-N 3.44Å; A263-L266 VanDerWaalsContact O-N 3.11Å; A263-S296 WeakPolarHBondContact O-CB 3.45Å; A263-L299 HydrophobicContact CB-CB 3.83Å
264	L	93.3	Very high	89	Confident	25 Å²	25	23.9 Å²	23.9	13%	0.131	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-65.3	-20.7	175.4	-65.7	175.2	0	0	0	112.9	V233 V237 L261 R262 L266 M267 T300	V233-L264 HydrophobicContact CG1-CD1 4.37Å; V237-L264 HydrophobicContact CG2-CB 3.85Å; V237-L264 HydrophobicContact CG2-CD1 3.88Å; V237-L264 HydrophobicContact CG2-CG 4.48Å; L261-L264 HydrophobicContact CD2-CD1 3.97Å; L261-L264 WeakPolarHBondContact O-CB 3.41Å; L261-L264 PolarHBondContact O-N 3.05Å; R262-L264 PolarHBondContact O-N 3.37Å; L264-L266 PolarHBondContact O-N 2.97Å; L264-M267 HydrophobicContact CD2-CE 3.66Å; L264-M267 HydrophobicContact CD2-SD 4.29Å; L264-M267 WeakPolarHBondContact O-CB 3.37Å; L264-M267 WeakPolarHBondContact O-CG 3.38Å; L264-M267 PolarHBondContact O-N 2.73Å; L264-M267 VanDerWaalsContact O-N 3.1Å; L264-T300 HydrophobicContact CD1-CG2 4.28Å; L264-T300 HydrophobicContact CD2-CG2 4.16Å; L264-T300 WeakPolarHBondContact CD2-OG1 3.46Å; L264-T300 HydrophobicContact CG-CG2 4.06Å; L264-T300 WeakPolarHBondContact CG-OG1 3.41Å
265	R	91.2	Very high	89	Confident	15 Å²	15	28 Å²	28	6%	0.057	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-63.8	-21	174	-64.2	-176.1	175.5	151.2	-1.7	112.4	V237 D238 T241 R262 A263 M267 T268	V237-R265 HydrophobicContact CG1-CG 4.07Å; D238-R265 IonicContact OD1-CZ 2.76Å; D238-R265 IonicContact OD1-NE 3.17Å; D238-R265 IonicContact OD1-NH2 2.7Å; D238-R265 PolarHBondContact OD1-NH2 2.96Å; T241-R265 PolarHBondContact OG1-NH2 3.47Å; R262-R265 WeakPolarHBondContact O-CB 3.39Å; R262-R265 PolarHBondContact O-N 3.02Å; R262-R265 VanDerWaalsContact O-N 3.12Å; A263-R265 PolarHBondContact O-N 2.91Å; R265-M267 PolarHBondContact O-N 3Å; R265-T268 PolarHBondContact O-N 3.18Å; R265-T268 PolarHBondContact O-OG1 2.73Å
266	L	89.7	Confident	88.8	Confident	32 Å²	32	29.7 Å²	29.7	17%	0.168	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-61.2	-26.9	174.4	-66.1	176	0	0	0	112	I173 L176 A263 L264 T268 V269 S292 V295 L299	I173-L266 HydrophobicContact CG1-CD2 4.47Å; L176-L266 HydrophobicContact CD2-CD1 3.84Å; L176-L266 HydrophobicContact CD2-CD2 4.44Å; L176-L266 HydrophobicContact CD2-CG 4.2Å; A263-L266 VanDerWaalsContact O-CB 3.32Å; A263-L266 WeakPolarHBondContact O-CB 3.49Å; A263-L266 WeakPolarHBondContact O-CG 3.26Å; A263-L266 PolarHBondContact O-N 3.44Å; A263-L266 VanDerWaalsContact O-N 3.11Å; L264-L266 PolarHBondContact O-N 2.97Å; L266-T268 PolarHBondContact O-N 3.38Å; L266-V269 HydrophobicContact CD2-CG2 4.22Å; L266-V269 WeakPolarHBondContact O-CB 3.1Å; L266-V269 WeakPolarHBondContact O-CG2 3.47Å; L266-V269 PolarHBondContact O-N 2.85Å; L266-S292 PolarHBondContact O-OG 2.81Å; L266-V295 HydrophobicContact CD1-CG1 4.25Å; L266-L299 HydrophobicContact CD1-CD1 4.01Å
267	M	89.1	Confident	88.8	Confident	43 Å²	43	34.1 Å²	34.1	21%	0.212	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-58.5	-23.6	177.3	-65.8	-177.6	174.8	0	0	113.5	Y234 L264 R265 V269 P270 I293 S296 V297	Y234-M267 HydrophobicContact CE1-CB 4.46Å; L264-M267 HydrophobicContact CD2-CE 3.66Å; L264-M267 HydrophobicContact CD2-SD 4.29Å; L264-M267 WeakPolarHBondContact O-CB 3.37Å; L264-M267 WeakPolarHBondContact O-CG 3.38Å; L264-M267 PolarHBondContact O-N 2.73Å; L264-M267 VanDerWaalsContact O-N 3.1Å; R265-M267 PolarHBondContact O-N 3Å; M267-V269 VanDerWaalsContact C-N 3.35Å; M267-P270 VanDerWaalsContact O-CD 3.28Å; M267-P270 WeakPolarHBondContact O-CD 3.4Å; M267-I293 HydrophobicContact CE-CG2 4.45Å; M267-S296 WeakPolarHBondContact CE-OG 3.06Å; M267-S296 WeakPolarHBondContact CG-OG 3.21Å; M267-V297 HydrophobicContact CE-CG2 3.54Å
268	T	87.7	Confident	89	Confident	29 Å²	29	38.6 Å²	38.6	18%	0.178	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-79.9	-13.4	176.9	65	0	0	0	0	113.8	Y234 R265 L266 P270 D271 I272	Y234-T268 HydrophobicContact CD1-CG2 4.03Å; Y234-T268 HydrophobicContact CE1-CG2 3.41Å; Y234-T268 VanDerWaalsContact CE1-CG2 3.41Å; Y234-T268 HydrophobicContact CE2-CG2 4.4Å; R265-T268 PolarHBondContact O-N 3.18Å; R265-T268 PolarHBondContact O-OG1 2.73Å; L266-T268 PolarHBondContact O-N 3.38Å; T268-P270 VanDerWaalsContact C-CD 3.47Å; T268-D271 WeakPolarHBondContact O-CB 3.38Å; T268-D271 PolarHBondContact O-N 2.62Å; T268-D271 VanDerWaalsContact O-N 3.15Å; T268-I272 VanDerWaalsContact O-CG1 3.32Å; T268-I272 WeakPolarHBondContact O-CG1 3.24Å; T268-I272 PolarHBondContact O-N 3.16Å
269	V	87.9	Confident	88.9	Confident	28 Å²	28	38.6 Å²	38.6	17%	0.17	20%	0.198	C	C	.	.	H	α-helix	trans	-56	-45.5	-175.6	173.4	0	0	0	0	113.4	F169 L266 M267 D271 I272 L273	F169-V269 HydrophobicContact CD2-CG1 4.47Å; F169-V269 HydrophobicContact CD2-CG2 3.84Å; F169-V269 HydrophobicContact CE2-CB 4.18Å; F169-V269 HydrophobicContact CE2-CG1 3.73Å; F169-V269 HydrophobicContact CE2-CG2 3.54Å; L266-V269 HydrophobicContact CD2-CG2 4.22Å; L266-V269 WeakPolarHBondContact O-CB 3.1Å; L266-V269 WeakPolarHBondContact O-CG2 3.47Å; L266-V269 PolarHBondContact O-N 2.85Å; M267-V269 VanDerWaalsContact C-N 3.35Å; V269-D271 VanDerWaalsContact C-N 3.32Å; V269-D271 PolarHBondContact O-N 2.79Å; V269-I272 PolarHBondContact O-N 3.22Å; V269-L273 HydrophobicContact CG1-CD1 3.84Å; V269-L273 HydrophobicContact CG1-CG 4.22Å; V269-L273 WeakPolarHBondContact O-CB 3.05Å; V269-L273 VanDerWaalsContact O-CG 3.32Å; V269-L273 WeakPolarHBondContact O-CG 3.37Å; V269-L273 PolarHBondContact O-N 3.37Å
270	P	90.1	Very high	88.8	Confident	3 Å²	3	46 Å²	46	2%	0.019	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-41.7	177.4	-19.9	32.5	0	0	0	112.5	M267 T268 L273 Q274 A288 Q289	M267-P270 VanDerWaalsContact O-CD 3.28Å; M267-P270 WeakPolarHBondContact O-CD 3.4Å; T268-P270 VanDerWaalsContact C-CD 3.47Å; P270-L273 PolarHBondContact O-N 3.29Å; P270-Q274 WeakPolarHBondContact O-CB 3.43Å; P270-Q274 PolarHBondContact O-N 3.17Å; P270-A288 HydrophobicContact CB-CB 4.27Å; P270-A288 HydrophobicContact CG-CB 4.43Å; P270-Q289 HydrophobicContact CB-CG 3.61Å; P270-Q289 HydrophobicContact CG-CB 4.41Å; P270-Q289 HydrophobicContact CG-CG 3.94Å
271	D	87	Confident	88.6	Confident	55 Å²	55	49.7 Å²	49.7	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-64.3	-44	179.4	-55.3	-23.2	0	0	0	110.4	T268 V269 L273 Q274 Y275	T268-D271 WeakPolarHBondContact O-CB 3.38Å; T268-D271 PolarHBondContact O-N 2.62Å; T268-D271 VanDerWaalsContact O-N 3.15Å; V269-D271 VanDerWaalsContact C-N 3.32Å; V269-D271 PolarHBondContact O-N 2.79Å; D271-L273 PolarHBondContact O-N 3.24Å; D271-Q274 WeakPolarHBondContact O-CB 3.5Å; D271-Q274 PolarHBondContact O-N 3.35Å; D271-Y275 HydrophobicContact CB-CE2 4.28Å; D271-Y275 WeakPolarHBondContact O-CD2 3.35Å; D271-Y275 VanDerWaalsContact O-CG 3.28Å; D271-Y275 PolarHBondContact O-N 3.39Å
272	I	85.6	Confident	88.4	Confident	12 Å²	12	53 Å²	53	6%	0.062	28%	0.278	C	S	.	.	H	α-helix	trans	-62.1	-45.7	176.6	-64.6	176.5	0	0	0	111.2	V165 F169 T268 V269 Q274 Y275 L276	V165-I272 HydrophobicContact CG1-CB 4.04Å; V165-I272 HydrophobicContact CG1-CD1 4.48Å; V165-I272 HydrophobicContact CG1-CG1 3.85Å; V165-I272 HydrophobicContact CG1-CG2 3.51Å; F169-I272 HydrophobicContact CB-CD1 3.9Å; F169-I272 HydrophobicContact CB-CG2 4.14Å; F169-I272 HydrophobicContact CD2-CD1 4.42Å; F169-I272 HydrophobicContact CG-CG2 4.49Å; T268-I272 VanDerWaalsContact O-CG1 3.32Å; T268-I272 WeakPolarHBondContact O-CG1 3.24Å; T268-I272 PolarHBondContact O-N 3.16Å; V269-I272 PolarHBondContact O-N 3.22Å; I272-Q274 VanDerWaalsContact C-N 3.26Å; I272-Q274 PolarHBondContact O-N 3.07Å; I272-Y275 PolarHBondContact O-N 3.23Å; I272-L276 HydrophobicContact CG2-CD1 4.08Å; I272-L276 WeakPolarHBondContact O-CG 3.38Å; I272-L276 PolarHBondContact O-N 3.26Å
273	L	87.8	Confident	88.2	Confident	45 Å²	45	55.5 Å²	55.5	24%	0.236	30%	0.296	C	S	.	.	H	α-helix	trans	-66.3	-29.6	178.1	-70.9	175.7	0	0	0	112.7	V269 P270 D271 N277 V278 L279	V269-L273 HydrophobicContact CG1-CD1 3.84Å; V269-L273 HydrophobicContact CG1-CG 4.22Å; V269-L273 WeakPolarHBondContact O-CB 3.05Å; V269-L273 VanDerWaalsContact O-CG 3.32Å; V269-L273 WeakPolarHBondContact O-CG 3.37Å; V269-L273 PolarHBondContact O-N 3.37Å; P270-L273 PolarHBondContact O-N 3.29Å; D271-L273 PolarHBondContact O-N 3.24Å; L273-N277 PolarHBondContact O-N 2.93Å; L273-V278 HydrophobicContact CB-CB 4.48Å; L273-V278 HydrophobicContact CD2-CB 4.24Å; L273-V278 HydrophobicContact CD2-CG1 4.34Å; L273-V278 HydrophobicContact CD2-CG2 4.34Å; L273-V278 PolarHBondContact O-N 2.9Å; L273-L279 HydrophobicContact CB-CD1 3.63Å; L273-L279 HydrophobicContact CB-CG 3.85Å; L273-L279 HydrophobicContact CD1-CD1 4.04Å; L273-L279 HydrophobicContact CD1-CG 4.44Å; L273-L279 PolarHBondContact O-N 3.33Å
274	Q	88.5	Confident	88	Confident	84 Å²	84	57.1 Å²	57.1	39%	0.393	31%	0.307	S	S	.	.	H	α-helix	trans	-68.6	-45.2	171.3	-169.9	179.8	17.2	0	0	110.9	P270 D271 I272 L276 N277 I285	P270-Q274 WeakPolarHBondContact O-CB 3.43Å; P270-Q274 PolarHBondContact O-N 3.17Å; D271-Q274 WeakPolarHBondContact O-CB 3.5Å; D271-Q274 PolarHBondContact O-N 3.35Å; I272-Q274 VanDerWaalsContact C-N 3.26Å; I272-Q274 PolarHBondContact O-N 3.07Å; Q274-L276 PolarHBondContact O-N 3.48Å; Q274-N277 PolarHBondContact O-N 3.24Å; Q274-I285 HydrophobicContact CG-CD1 4.47Å
275	Y	83.3	Confident	88	Confident	102 Å²	102	57.1 Å²	57.1	40%	0.4	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-31.1	175.2	-61.9	-38.2	0	0	0	113	V165 D271 I272 N277	V165-Y275 HydrophobicContact CG1-CD2 4.4Å; D271-Y275 HydrophobicContact CB-CE2 4.28Å; D271-Y275 WeakPolarHBondContact O-CD2 3.35Å; D271-Y275 VanDerWaalsContact O-CG 3.28Å; D271-Y275 PolarHBondContact O-N 3.39Å; I272-Y275 PolarHBondContact O-N 3.23Å; Y275-N277 VanDerWaalsContact C-N 3.26Å; Y275-N277 PolarHBondContact O-N 3.36Å
276	L	81.9	Confident	88.1	Confident	61 Å²	61	61.6 Å²	61.6	32%	0.319	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	1.5	174.7	-63.8	173.6	0	0	0	114	V166 I272 Q274 V278	V166-L276 HydrophobicContact CG2-CD1 3.93Å; V166-L276 HydrophobicContact CG2-CD2 3.63Å; V166-L276 HydrophobicContact CG2-CG 4.37Å; I272-L276 HydrophobicContact CG2-CD1 4.08Å; I272-L276 WeakPolarHBondContact O-CG 3.38Å; I272-L276 PolarHBondContact O-N 3.26Å; Q274-L276 PolarHBondContact O-N 3.48Å; L276-V278 HydrophobicContact CB-CG2 3.92Å; L276-V278 PolarHBondContact O-N 3.17Å
277	N	84.6	Confident	88.2	Confident	106 Å²	106	62.4 Å²	62.4	57%	0.567	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	25.7	-175.1	-70.8	-48.9	0	0	0	114.3	L273 Q274 Y275 K280	L273-N277 PolarHBondContact O-N 2.93Å; Q274-N277 PolarHBondContact O-N 3.24Å; Y275-N277 VanDerWaalsContact C-N 3.26Å; Y275-N277 PolarHBondContact O-N 3.36Å; N277-K280 WeakPolarHBondContact O-CE 3.13Å
278	V	87.8	Confident	88.4	Confident	95 Å²	95	61.6 Å²	61.6	58%	0.576	33%	0.329	S	S	*	.			trans	-77.7	-44.4	175.5	178.1	0	0	0	0	109.8	L273 L276	L273-V278 HydrophobicContact CB-CB 4.48Å; L273-V278 HydrophobicContact CD2-CB 4.24Å; L273-V278 HydrophobicContact CD2-CG1 4.34Å; L273-V278 HydrophobicContact CD2-CG2 4.34Å; L273-V278 PolarHBondContact O-N 2.9Å; L276-V278 HydrophobicContact CB-CG2 3.92Å; L276-V278 PolarHBondContact O-N 3.17Å
279	L	89.5	Confident	88.7	Confident	28 Å²	28	63 Å²	63	15%	0.147	33%	0.333	C	S	.	.			trans	-94.1	115.2	175.6	-60.1	173.9	0	0	0	109.6	L273 I285 A288	L273-L279 HydrophobicContact CB-CD1 3.63Å; L273-L279 HydrophobicContact CB-CG 3.85Å; L273-L279 HydrophobicContact CD1-CD1 4.04Å; L273-L279 HydrophobicContact CD1-CG 4.44Å; L273-L279 PolarHBondContact O-N 3.33Å; L279-I285 HydrophobicContact CB-CG1 3.72Å; L279-A288 HydrophobicContact CD1-CB 3.59Å
280	K	88.6	Confident	89	Confident	171 Å²	171	61.8 Å²	61.8	74%	0.743	33%	0.326	S	S	*	.			trans	-112	-30.9	-175.6	-64.5	-176.9	-178.9	178.7	0	114	N277	N277-K280 WeakPolarHBondContact O-CE 3.13Å
281	T	86.9	Confident	89.1	Confident	80 Å²	80	64.8 Å²	64.8	49%	0.491	34%	0.344	S	S	.	.	S	Bend	trans	-96.4	145.1	-175.9	64.3	0	0	0	0	110.6	S283 S284 I285	T281-S283 PolarHBondContact O-N 2.97Å; T281-S284 PolarHBondContact N-OG 3.05Å; T281-S284 PolarHBondContact O-N 2.85Å; T281-S284 VanDerWaalsContact O-N 3.09Å; T281-S284 PolarHBondContact O-OG 2.79Å; T281-S284 WeakPolarHBondContact OG1-CB 3.29Å; T281-S284 PolarHBondContact OG1-N 3.48Å; T281-S284 PolarHBondContact OG1-OG 3.4Å; T281-I285 WeakPolarHBondContact O-CG1 3.41Å; T281-I285 PolarHBondContact O-N 2.92Å
282	S	89.6	Confident	89.4	Confident	97 Å²	97	62.8 Å²	62.8	68%	0.678	33%	0.334	S	S	*	.	H	α-helix	trans	-53.5	-43.3	175.6	50.5	0	0	0	0	111.8	S284 I285 R286	S282-S284 PolarHBondContact O-N 3.39Å; S282-I285 PolarHBondContact O-N 2.86Å; S282-R286 VanDerWaalsContact O-CB 3.27Å; S282-R286 WeakPolarHBondContact O-CB 3.39Å; S282-R286 PolarHBondContact O-N 3.25Å
283	S	88.8	Confident	89.6	Confident	55 Å²	55	64.7 Å²	64.7	39%	0.385	34%	0.344	S	S	.	.	H	α-helix	trans	-61.8	-42.2	177.1	-48	0	0	0	0	112.7	T281 L287	T281-S283 PolarHBondContact O-N 2.97Å; S283-L287 VanDerWaalsContact O-CB 3.23Å; S283-L287 WeakPolarHBondContact O-CB 3.3Å; S283-L287 PolarHBondContact O-N 3.01Å
284	S	90	Very high	89.8	Confident	33 Å²	33	64.7 Å²	64.7	23%	0.231	34%	0.342	C	S	.	.	H	α-helix	trans	-70.1	-38.5	178.6	68.8	0	0	0	0	112.8	T281 S282 A288	T281-S284 PolarHBondContact N-OG 3.05Å; T281-S284 PolarHBondContact O-N 2.85Å; T281-S284 VanDerWaalsContact O-N 3.09Å; T281-S284 PolarHBondContact O-OG 2.79Å; T281-S284 WeakPolarHBondContact OG1-CB 3.29Å; T281-S284 PolarHBondContact OG1-N 3.48Å; T281-S284 PolarHBondContact OG1-OG 3.4Å; S282-S284 PolarHBondContact O-N 3.39Å; S284-A288 WeakPolarHBondContact O-CB 3.5Å; S284-A288 PolarHBondContact O-N 3.07Å
285	I	91.9	Very high	90	Very high	26 Å²	26	63.5 Å²	63.5	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-48.9	175.9	-65.8	166.5	0	0	0	109.3	Q274 L279 T281 S282 L287 A288 Q289	Q274-I285 HydrophobicContact CG-CD1 4.47Å; L279-I285 HydrophobicContact CB-CG1 3.72Å; T281-I285 WeakPolarHBondContact O-CG1 3.41Å; T281-I285 PolarHBondContact O-N 2.92Å; S282-I285 PolarHBondContact O-N 2.86Å; I285-L287 PolarHBondContact O-N 3.49Å; I285-A288 PolarHBondContact O-N 2.97Å; I285-Q289 HydrophobicContact CG2-CG 4.5Å; I285-Q289 WeakPolarHBondContact O-CG 3.46Å; I285-Q289 PolarHBondContact O-N 3.46Å
286	R	93.3	Very high	90.4	Very high	108 Å²	108	58.7 Å²	58.7	41%	0.408	32%	0.322	S	S	.	.	H	α-helix	trans	-61	-45	178.6	-174	63.2	177.3	177.3	3.9	111.9	S282 A288 Q289 L290 E373 L377	S282-R286 VanDerWaalsContact O-CB 3.27Å; S282-R286 WeakPolarHBondContact O-CB 3.39Å; S282-R286 PolarHBondContact O-N 3.25Å; R286-A288 PolarHBondContact O-N 3.08Å; R286-Q289 PolarHBondContact O-N 2.73Å; R286-L290 HydrophobicContact CG-CD1 4.2Å; R286-L290 WeakPolarHBondContact O-CG 3.23Å; R286-L290 PolarHBondContact O-N 2.87Å; R286-E373 IonicContact CZ-OE1 3.65Å; R286-E373 IonicContact NE-OE1 3.75Å; R286-E373 PolarHBondContact NE-OE1 3Å; R286-E373 IonicContact NE-OE2 3.31Å; R286-E373 IonicContact NH2-OE1 2.76Å; R286-E373 PolarHBondContact NH2-OE1 2.84Å; R286-E373 VanDerWaalsContact NH2-OE1 3.08Å; R286-E373 IonicContact NH2-OE2 2.65Å; R286-E373 PolarHBondContact NH2-OE2 3.44Å; R286-E373 VanDerWaalsContact NH2-OE2 3.12Å; R286-L377 HydrophobicContact CB-CD1 4.32Å; R286-L377 HydrophobicContact CG-CD1 4Å
287	L	93	Very high	90.9	Very high	49 Å²	49	57.4 Å²	57.4	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-58.9	-47.5	175.7	-179.5	64.7	0	0	0	111.5	S283 I285 Q289 L290 V291 I374 L377 I378	S283-L287 VanDerWaalsContact O-CB 3.23Å; S283-L287 WeakPolarHBondContact O-CB 3.3Å; S283-L287 PolarHBondContact O-N 3.01Å; I285-L287 PolarHBondContact O-N 3.49Å; L287-Q289 VanDerWaalsContact C-N 3.34Å; L287-Q289 PolarHBondContact O-N 3.41Å; L287-L290 PolarHBondContact O-N 2.84Å; L287-V291 HydrophobicContact CD1-CG2 4.19Å; L287-V291 WeakPolarHBondContact O-CB 3.08Å; L287-V291 VanDerWaalsContact O-CG2 3.26Å; L287-V291 WeakPolarHBondContact O-CG2 3.41Å; L287-V291 PolarHBondContact O-N 2.94Å; L287-I374 HydrophobicContact CD1-CB 4.43Å; L287-I374 HydrophobicContact CD1-CG1 4.3Å; L287-I374 HydrophobicContact CD1-CG2 3.95Å; L287-L377 HydrophobicContact CB-CD1 4.23Å; L287-L377 HydrophobicContact CD1-CB 4.46Å; L287-I378 HydrophobicContact CD1-CD1 4.46Å; L287-I378 HydrophobicContact CD1-CG1 4.26Å; L287-I378 HydrophobicContact CD2-CG1 4.43Å
288	A	92.9	Very high	91.2	Very high	26 Å²	26	52.7 Å²	52.7	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-39.4	178.4	0	0	0	0	0	112.3	P270 L279 S284 I285 R286 S292	P270-A288 HydrophobicContact CB-CB 4.27Å; P270-A288 HydrophobicContact CG-CB 4.43Å; L279-A288 HydrophobicContact CD1-CB 3.59Å; S284-A288 WeakPolarHBondContact O-CB 3.5Å; S284-A288 PolarHBondContact O-N 3.07Å; I285-A288 PolarHBondContact O-N 2.97Å; R286-A288 PolarHBondContact O-N 3.08Å; A288-S292 WeakPolarHBondContact O-CB 3.34Å; A288-S292 PolarHBondContact O-N 2.85Å
289	Q	93.9	Very high	91.5	Very high	58 Å²	58	49.3 Å²	49.3	27%	0.271	27%	0.27	S	S	.	.	H	α-helix	trans	-61.7	-52.1	174.9	-74.4	173.9	-18.5	0	0	112	P270 I285 R286 L287 V291 S292 I293	P270-Q289 HydrophobicContact CB-CG 3.61Å; P270-Q289 HydrophobicContact CG-CB 4.41Å; P270-Q289 HydrophobicContact CG-CG 3.94Å; I285-Q289 HydrophobicContact CG2-CG 4.5Å; I285-Q289 WeakPolarHBondContact O-CG 3.46Å; I285-Q289 PolarHBondContact O-N 3.46Å; R286-Q289 PolarHBondContact O-N 2.73Å; L287-Q289 VanDerWaalsContact C-N 3.34Å; L287-Q289 PolarHBondContact O-N 3.41Å; Q289-V291 PolarHBondContact O-N 3.38Å; Q289-S292 PolarHBondContact O-N 3Å; Q289-I293 VanDerWaalsContact O-CG1 3.26Å; Q289-I293 WeakPolarHBondContact O-CG1 3.44Å; Q289-I293 PolarHBondContact O-N 3.11Å
290	L	93.3	Very high	91.7	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.016	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-46.5	-179.8	-68.7	171.1	0	0	0	111.8	R286 L287 I293 F294 Y370 E373 I374 L377	R286-L290 HydrophobicContact CG-CD1 4.2Å; R286-L290 WeakPolarHBondContact O-CG 3.23Å; R286-L290 PolarHBondContact O-N 2.87Å; L287-L290 PolarHBondContact O-N 2.84Å; L290-I293 PolarHBondContact O-N 3.07Å; L290-F294 VanDerWaalsContact O-CB 3.28Å; L290-F294 WeakPolarHBondContact O-CB 3.49Å; L290-F294 PolarHBondContact O-N 3.09Å; L290-Y370 HydrophobicContact CD2-CD1 3.77Å; L290-Y370 HydrophobicContact CD2-CD2 4.29Å; L290-Y370 HydrophobicContact CD2-CE1 4.02Å; L290-Y370 HydrophobicContact CD2-CG 3.93Å; L290-E373 HydrophobicContact CD1-CB 4.04Å; L290-E373 VanDerWaalsContact CD1-CD 3.49Å; L290-E373 HydrophobicContact CD1-CG 3.7Å; L290-I374 HydrophobicContact CB-CD1 4.08Å; L290-I374 HydrophobicContact CB-CG1 3.89Å; L290-I374 HydrophobicContact CD1-CG1 4.1Å; L290-L377 HydrophobicContact CD1-CD1 4.04Å
291	V	92.8	Very high	91.9	Very high	66 Å²	66	41 Å²	41	40%	0.4	24%	0.236	S	C	.	.	H	α-helix	trans	-63.3	-43.6	178.5	172	0	0	0	0	110.9	L287 Q289 F294 V295 I374	L287-V291 HydrophobicContact CD1-CG2 4.19Å; L287-V291 WeakPolarHBondContact O-CB 3.08Å; L287-V291 VanDerWaalsContact O-CG2 3.26Å; L287-V291 WeakPolarHBondContact O-CG2 3.41Å; L287-V291 PolarHBondContact O-N 2.94Å; Q289-V291 PolarHBondContact O-N 3.38Å; V291-F294 PolarHBondContact O-N 3.31Å; V291-V295 HydrophobicContact CG1-CG2 4.37Å; V291-V295 WeakPolarHBondContact O-CB 3.4Å; V291-V295 VanDerWaalsContact O-CG2 3.27Å; V291-V295 WeakPolarHBondContact O-CG2 3.31Å; V291-V295 PolarHBondContact O-N 3.18Å; V291-I374 HydrophobicContact CG2-CD1 4.14Å
292	S	92.5	Very high	92.2	Very high	14 Å²	14	37.2 Å²	37.2	10%	0.098	21%	0.213	C	C	.	.	H	α-helix	trans	-66	-44	-179.9	-177.2	0	0	0	0	112.7	L266 A288 Q289 S296	L266-S292 PolarHBondContact O-OG 2.81Å; A288-S292 WeakPolarHBondContact O-CB 3.34Å; A288-S292 PolarHBondContact O-N 2.85Å; Q289-S292 PolarHBondContact O-N 3Å; S292-S296 VanDerWaalsContact O-CB 3.23Å; S292-S296 WeakPolarHBondContact O-CB 3.47Å; S292-S296 PolarHBondContact O-N 3.49Å; S292-S296 PolarHBondContact O-OG 3.49Å
293	I	91.7	Very high	92.3	Very high	51 Å²	51	32.6 Å²	32.6	26%	0.262	18%	0.181	S	C	.	.	H	α-helix	trans	-63.3	-46.9	176.5	-64.8	166.7	0	0	0	109.9	M267 Q289 L290 V295 S296 V297 Y370	M267-I293 HydrophobicContact CE-CG2 4.45Å; Q289-I293 VanDerWaalsContact O-CG1 3.26Å; Q289-I293 WeakPolarHBondContact O-CG1 3.44Å; Q289-I293 PolarHBondContact O-N 3.11Å; L290-I293 PolarHBondContact O-N 3.07Å; I293-V295 PolarHBondContact O-N 3.14Å; I293-S296 WeakPolarHBondContact CA-OG 3.33Å; I293-S296 PolarHBondContact O-N 3.27Å; I293-S296 PolarHBondContact O-OG 3.19Å; I293-V297 HydrophobicContact CG2-CG2 4.19Å; I293-V297 WeakPolarHBondContact O-CB 3.49Å; I293-V297 VanDerWaalsContact O-CG2 3.29Å; I293-V297 WeakPolarHBondContact O-CG2 3.47Å; I293-V297 PolarHBondContact O-N 3.21Å; I293-Y370 HydrophobicContact CB-CE2 4.18Å; I293-Y370 HydrophobicContact CG2-CE2 3.7Å
294	F	91.8	Very high	92.6	Very high	45 Å²	45	33.6 Å²	33.6	20%	0.197	18%	0.178	C	C	.	.	H	α-helix	trans	-57.5	-51.8	179.1	-175.1	-97.3	0	0	0	111.6	L290 V291 S298 F367 Y370	L290-F294 VanDerWaalsContact O-CB 3.28Å; L290-F294 WeakPolarHBondContact O-CB 3.49Å; L290-F294 PolarHBondContact O-N 3.09Å; V291-F294 PolarHBondContact O-N 3.31Å; F294-S298 WeakPolarHBondContact O-CB 3.42Å; F294-S298 PolarHBondContact O-N 3.22Å; F294-S298 PolarHBondContact O-OG 3.29Å; F294-F367 HydrophobicContact CE2-CD2 4.21Å; F294-F367 HydrophobicContact CZ-CD2 4.34Å; F294-Y370 HydrophobicContact CB-CD2 4.48Å
295	V	92.2	Very high	92.7	Very high	60 Å²	60	32.1 Å²	32.1	36%	0.364	17%	0.168	S	C	.	.	H	α-helix	trans	-64.1	-45.3	-179.4	172	0	0	0	0	111.7	L266 V291 I293 S298 L299	L266-V295 HydrophobicContact CD1-CG1 4.25Å; V291-V295 HydrophobicContact CG1-CG2 4.37Å; V291-V295 WeakPolarHBondContact O-CB 3.4Å; V291-V295 VanDerWaalsContact O-CG2 3.27Å; V291-V295 WeakPolarHBondContact O-CG2 3.31Å; V291-V295 PolarHBondContact O-N 3.18Å; I293-V295 PolarHBondContact O-N 3.14Å; V295-S298 PolarHBondContact O-N 3.43Å; V295-L299 HydrophobicContact CG1-CD1 3.65Å; V295-L299 HydrophobicContact CG1-CG 4.22Å; V295-L299 WeakPolarHBondContact O-CB 3.46Å; V295-L299 WeakPolarHBondContact O-CG 3.37Å; V295-L299 PolarHBondContact O-N 2.72Å
296	S	92	Very high	92.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.3	-42.3	-178.6	57.5	0	0	0	0	112.8	A263 M267 S292 I293 T300	A263-S296 WeakPolarHBondContact O-CB 3.45Å; M267-S296 WeakPolarHBondContact CE-OG 3.06Å; M267-S296 WeakPolarHBondContact CG-OG 3.21Å; S292-S296 VanDerWaalsContact O-CB 3.23Å; S292-S296 WeakPolarHBondContact O-CB 3.47Å; S292-S296 PolarHBondContact O-N 3.49Å; S292-S296 PolarHBondContact O-OG 3.49Å; I293-S296 WeakPolarHBondContact CA-OG 3.33Å; I293-S296 PolarHBondContact O-N 3.27Å; I293-S296 PolarHBondContact O-OG 3.19Å; S296-T300 VanDerWaalsContact O-CB 3.27Å; S296-T300 WeakPolarHBondContact O-CB 3.12Å; S296-T300 PolarHBondContact O-N 2.84Å; S296-T300 PolarHBondContact O-OG1 3.26Å
297	V	90.9	Very high	92.5	Very high	34 Å²	34	27 Å²	27	21%	0.206	15%	0.149	C	C	.	.	H	α-helix	trans	-69.1	-42.2	178.1	178.3	0	0	0	0	111.2	M267 I293 T300 G301 M366	M267-V297 HydrophobicContact CE-CG2 3.54Å; I293-V297 HydrophobicContact CG2-CG2 4.19Å; I293-V297 WeakPolarHBondContact O-CB 3.49Å; I293-V297 VanDerWaalsContact O-CG2 3.29Å; I293-V297 WeakPolarHBondContact O-CG2 3.47Å; I293-V297 PolarHBondContact O-N 3.21Å; V297-T300 PolarHBondContact O-N 3.42Å; V297-G301 PolarHBondContact O-N 2.73Å; V297-M366 HydrophobicContact CB-CE 4.32Å; V297-M366 HydrophobicContact CB-SD 4.38Å; V297-M366 HydrophobicContact CG1-CE 3.54Å; V297-M366 HydrophobicContact CG1-SD 4Å; V297-M366 HydrophobicContact CG2-SD 4.4Å
298	S	91.7	Very high	92.4	Very high	8 Å²	8	26 Å²	26	6%	0.056	14%	0.144	C	C	.	.	H	α-helix	trans	-62.1	-45.5	176.2	-62.5	0	0	0	0	112.4	F294 V295 G301 A302 M337	F294-S298 WeakPolarHBondContact O-CB 3.42Å; F294-S298 PolarHBondContact O-N 3.22Å; F294-S298 PolarHBondContact O-OG 3.29Å; V295-S298 PolarHBondContact O-N 3.43Å; S298-G301 PolarHBondContact O-N 3.48Å; S298-A302 WeakPolarHBondContact O-CB 3.07Å; S298-A302 PolarHBondContact O-N 3.35Å; S298-M337 PolarHBondContact OG-SD 3.23Å; S298-M337 VanDerWaalsContact OG-SD 3.38Å
299	L	94	Very high	92.3	Very high	23 Å²	23	24.8 Å²	24.8	12%	0.12	13%	0.134	C	C	.	.	H	α-helix	trans	-66.3	-38.8	178	-70.3	174.9	0	0	0	112.5	F180 A263 L266 V295 A302 G303 Y326 V330	F180-L299 HydrophobicContact CZ-CD1 4.2Å; F180-L299 HydrophobicContact CZ-CD2 4.21Å; A263-L299 HydrophobicContact CB-CB 3.83Å; L266-L299 HydrophobicContact CD1-CD1 4.01Å; V295-L299 HydrophobicContact CG1-CD1 3.65Å; V295-L299 HydrophobicContact CG1-CG 4.22Å; V295-L299 WeakPolarHBondContact O-CB 3.46Å; V295-L299 WeakPolarHBondContact O-CG 3.37Å; V295-L299 PolarHBondContact O-N 2.72Å; L299-A302 PolarHBondContact O-N 3.12Å; L299-G303 PolarHBondContact O-N 3.43Å; L299-Y326 WeakPolarHBondContact CA-OH 3.36Å; L299-Y326 WeakPolarHBondContact CB-OH 3.47Å; L299-Y326 HydrophobicContact CD2-CE1 4.36Å; L299-Y326 WeakPolarHBondContact CD2-OH 3.48Å; L299-Y326 PolarHBondContact O-OH 3.45Å; L299-V330 HydrophobicContact CD2-CG2 4.21Å
300	T	93.3	Very high	92	Very high	19 Å²	19	23 Å²	23	12%	0.117	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-44	177	-56.9	0	0	0	0	110.8	F260 L261 L264 S296 V297 A302 G303 F304	F260-T300 HydrophobicContact CD2-CG2 3.94Å; F260-T300 WeakPolarHBondContact CD2-O 2.76Å; F260-T300 HydrophobicContact CE2-CG2 4.12Å; L261-T300 HydrophobicContact CD2-CG2 3.96Å; L264-T300 HydrophobicContact CD1-CG2 4.28Å; L264-T300 HydrophobicContact CD2-CG2 4.16Å; L264-T300 WeakPolarHBondContact CD2-OG1 3.46Å; L264-T300 HydrophobicContact CG-CG2 4.06Å; L264-T300 WeakPolarHBondContact CG-OG1 3.41Å; S296-T300 VanDerWaalsContact O-CB 3.27Å; S296-T300 WeakPolarHBondContact O-CB 3.12Å; S296-T300 PolarHBondContact O-N 2.84Å; S296-T300 PolarHBondContact O-OG1 3.26Å; V297-T300 PolarHBondContact O-N 3.42Å; T300-A302 VanDerWaalsContact C-N 3.31Å; T300-A302 PolarHBondContact O-N 3.37Å; T300-G303 PolarHBondContact O-N 3.21Å; T300-F304 PolarHBondContact O-N 2.84Å
301	G	93.5	Very high	91.5	Very high	6 Å²	6	24 Å²	24	6%	0.062	13%	0.133	C	C	.	.	H	α-helix	trans	-60	-41.6	174.4	0	0	0	0	0	112.1	V297 S298 G303 F304 L305 L333	V297-G301 PolarHBondContact O-N 2.73Å; S298-G301 PolarHBondContact O-N 3.48Å; G301-G303 VanDerWaalsContact C-N 3.32Å; G301-G303 PolarHBondContact O-N 2.86Å; G301-F304 PolarHBondContact O-N 3.08Å; G301-L305 PolarHBondContact O-N 2.82Å; G301-L333 WeakPolarHBondContact O-CD1 3.44Å
302	A	93.4	Very high	91.1	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.5	-39.1	178.4	0	0	0	0	0	111.2	S298 L299 T300 L305 H306 Y326 C329 V330 L333	S298-A302 WeakPolarHBondContact O-CB 3.07Å; S298-A302 PolarHBondContact O-N 3.35Å; L299-A302 PolarHBondContact O-N 3.12Å; T300-A302 VanDerWaalsContact C-N 3.31Å; T300-A302 PolarHBondContact O-N 3.37Å; A302-L305 PolarHBondContact O-N 3.05Å; A302-H306 WeakPolarHBondContact O-CB 3.39Å; A302-H306 PolarHBondContact O-N 2.99Å; A302-Y326 HydrophobicContact CB-CE2 4.08Å; A302-C329 HydrophobicContact CB-CB 4.32Å; A302-V330 HydrophobicContact CB-CB 4.21Å; A302-V330 HydrophobicContact CB-CG2 3.46Å; A302-V330 VanDerWaalsContact CB-CG2 3.46Å; A302-L333 HydrophobicContact CB-CD1 3.98Å
303	G	92.3	Very high	90.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.3	-37.8	175.9	0	0	0	0	0	113.3	F260 L299 T300 G301 H306 L307	F260-G303 VanDerWaalsContact CD1-C 3.46Å; F260-G303 WeakPolarHBondContact CD1-O 3.41Å; L299-G303 PolarHBondContact O-N 3.43Å; T300-G303 PolarHBondContact O-N 3.21Å; G301-G303 VanDerWaalsContact C-N 3.32Å; G301-G303 PolarHBondContact O-N 2.86Å; G303-H306 PolarHBondContact O-N 3.23Å; G303-L307 WeakPolarHBondContact O-CB 3.48Å; G303-L307 PolarHBondContact O-N 2.75Å
304	F	93.3	Very high	90.3	Very high	76 Å²	76	20.5 Å²	20.5	33%	0.333	12%	0.115	S	C	.	.	H	α-helix	trans	-64.4	-46.6	174.2	-166	-90.4	0	0	0	111.2	F260 T300 G301 L307 L308 F355	F260-F304 HydrophobicContact CE2-CB 3.97Å; F260-F304 HydrophobicContact CE2-CD2 4.1Å; F260-F304 HydrophobicContact CZ-CB 3.97Å; F260-F304 AromaticContact CZ-CD2 3.67Å; F260-F304 HydrophobicContact CZ-CD2 3.67Å; F260-F304 HydrophobicContact CZ-CG 4.27Å; T300-F304 PolarHBondContact O-N 2.84Å; G301-F304 PolarHBondContact O-N 3.08Å; F304-L307 WeakPolarHBondContact O-CB 3.3Å; F304-L307 PolarHBondContact O-N 2.97Å; F304-L308 HydrophobicContact CD1-CD1 3.76Å; F304-L308 HydrophobicContact CD1-CG 4.22Å; F304-L308 HydrophobicContact CE1-CD1 3.43Å; F304-L308 VanDerWaalsContact CE1-CD1 3.43Å; F304-L308 HydrophobicContact CE1-CG 4.06Å; F304-L308 HydrophobicContact CZ-CD1 4.35Å; F304-L308 WeakPolarHBondContact O-CG 2.94Å; F304-L308 PolarHBondContact O-N 3.34Å; F304-L308 VanDerWaalsContact O-N 3.08Å; F304-F355 HydrophobicContact CB-CE2 4.21Å; F304-F355 HydrophobicContact CB-CZ 4.1Å; F304-F355 HydrophobicContact CD1-CB 4.32Å; F304-F355 HydrophobicContact CD1-CD1 4.1Å; F304-F355 AromaticContact CD1-CD2 3.22Å; F304-F355 HydrophobicContact CD1-CD2 3.22Å; F304-F355 HydrophobicContact CD1-CE1 4.23Å; F304-F355 AromaticContact CD1-CE2 3.37Å; F304-F355 HydrophobicContact CD1-CE2 3.37Å; F304-F355 AromaticContact CD1-CG 3.6Å; F304-F355 HydrophobicContact CD1-CG 3.6Å; F304-F355 AromaticContact CD1-CZ 3.89Å; F304-F355 HydrophobicContact CD1-CZ 3.89Å; F304-F355 HydrophobicContact CE1-CB 4.12Å; F304-F355 AromaticContact CE1-CD2 3.36Å; F304-F355 HydrophobicContact CE1-CD2 3.36Å; F304-F355 AromaticContact CE1-CE2 3.92Å; F304-F355 HydrophobicContact CE1-CE2 3.92Å; F304-F355 AromaticContact CE1-CG 3.82Å; F304-F355 HydrophobicContact CE1-CG 3.82Å; F304-F355 HydrophobicContact CG-CD2 4.22Å; F304-F355 AromaticContact CG-CE2 3.95Å; F304-F355 HydrophobicContact CG-CE2 3.95Å; F304-F355 HydrophobicContact CG-CZ 4.32Å; F304-F355 HydrophobicContact CZ-CD2 4.49Å
305	L	92.8	Very high	89.9	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-63.8	-43.1	176.1	-176.5	64.8	0	0	0	112	G301 A302 L307 L308 E309 C329 F332 L333 F355 M356	G301-L305 PolarHBondContact O-N 2.82Å; A302-L305 PolarHBondContact O-N 3.05Å; L305-L307 VanDerWaalsContact C-N 3.26Å; L305-L307 PolarHBondContact O-N 3.32Å; L305-L308 PolarHBondContact O-N 2.63Å; L305-L308 VanDerWaalsContact O-N 3.14Å; L305-E309 HydrophobicContact CD1-CG 3.86Å; L305-E309 HydrophobicContact CG-CG 4.21Å; L305-E309 PolarHBondContact O-N 2.98Å; L305-C329 HydrophobicContact CD2-CB 4.43Å; L305-F332 HydrophobicContact CD2-CD1 3.45Å; L305-F332 VanDerWaalsContact CD2-CD1 3.45Å; L305-F332 HydrophobicContact CD2-CE1 3.74Å; L305-L333 HydrophobicContact CD2-CD2 3.93Å; L305-L333 HydrophobicContact CD2-CG 4.17Å; L305-F355 HydrophobicContact CB-CD1 4.27Å; L305-F355 HydrophobicContact CB-CE1 4.07Å; L305-F355 HydrophobicContact CD1-CD1 4.23Å; L305-M356 HydrophobicContact CD1-SD 4.49Å; L305-M356 HydrophobicContact CD2-SD 4.23Å
306	H	91.6	Very high	89.3	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-58.6	-37.8	175.9	-178.6	-113.4	0	0	0	111.9	F188 A302 G303 N310 I324 Y326 C329	F188-H306 AromaticContact CE1-CE1 3.67Å; F188-H306 AromaticContact CE1-NE2 3.88Å; F188-H306 AromaticContact CZ-CE1 3.62Å; A302-H306 WeakPolarHBondContact O-CB 3.39Å; A302-H306 PolarHBondContact O-N 2.99Å; G303-H306 PolarHBondContact O-N 3.23Å; H306-N310 PolarHBondContact CD2-ND2 3.1Å; H306-N310 PolarHBondContact NE2-ND2 2.9Å; H306-N310 VanDerWaalsContact O-CB 3.28Å; H306-N310 WeakPolarHBondContact O-CB 3.32Å; H306-N310 PolarHBondContact O-N 3.1Å; H306-N310 PolarHBondContact O-ND2 2.93Å; H306-I324 PolarHBondContact CD2-O 3.35Å; H306-I324 PolarHBondContact NE2-O 3.36Å; H306-Y326 HydrophobicContact CB-CD2 4.14Å; H306-Y326 VanDerWaalsContact CD2-CA 3.46Å; H306-Y326 WeakPolarHBondContact CD2-CA 3.39Å; H306-Y326 PolarHBondContact CD2-N 2.88Å; H306-Y326 VanDerWaalsContact CD2-N 3.27Å; H306-Y326 PolarHBondContact NE2-N 3.43Å; H306-C329 HydrophobicContact CB-CB 4.34Å
307	L	89.9	Confident	88.6	Confident	27 Å²	27	34.8 Å²	34.8	14%	0.141	18%	0.18	C	C	.	.	H	α-helix	trans	-66.4	-47.4	173.8	177.5	65.7	0	0	0	111.3	V190 L258 F260 G303 F304 L305 S311	V190-L307 HydrophobicContact CG1-CD1 4.11Å; L258-L307 HydrophobicContact CD2-CD2 4.14Å; F260-L307 HydrophobicContact CE1-CB 4.2Å; F260-L307 HydrophobicContact CE1-CD2 3.98Å; G303-L307 WeakPolarHBondContact O-CB 3.48Å; G303-L307 PolarHBondContact O-N 2.75Å; F304-L307 WeakPolarHBondContact O-CB 3.3Å; F304-L307 PolarHBondContact O-N 2.97Å; L305-L307 VanDerWaalsContact C-N 3.26Å; L305-L307 PolarHBondContact O-N 3.32Å; L307-S311 WeakPolarHBondContact O-CB 3.41Å; L307-S311 PolarHBondContact O-N 2.98Å; L307-S311 PolarHBondContact O-OG 2.94Å
308	L	91.1	Very high	87.9	Confident	28 Å²	28	35.3 Å²	35.3	15%	0.147	18%	0.18	C	C	.	.	H	α-helix	trans	-66.3	-49.1	-176.2	-69.4	-177.5	0	0	0	112.7	F304 L305 S311 G312 L351 F355	F304-L308 HydrophobicContact CD1-CD1 3.76Å; F304-L308 HydrophobicContact CD1-CG 4.22Å; F304-L308 HydrophobicContact CE1-CD1 3.43Å; F304-L308 VanDerWaalsContact CE1-CD1 3.43Å; F304-L308 HydrophobicContact CE1-CG 4.06Å; F304-L308 HydrophobicContact CZ-CD1 4.35Å; F304-L308 WeakPolarHBondContact O-CG 2.94Å; F304-L308 PolarHBondContact O-N 3.34Å; F304-L308 VanDerWaalsContact O-N 3.08Å; L305-L308 PolarHBondContact O-N 2.63Å; L305-L308 VanDerWaalsContact O-N 3.14Å; L308-S311 PolarHBondContact O-N 2.67Å; L308-G312 PolarHBondContact O-N 2.83Å; L308-G312 VanDerWaalsContact O-N 3.12Å; L308-L351 HydrophobicContact CD1-CB 4.21Å; L308-L351 HydrophobicContact CD2-CB 4.04Å; L308-L351 HydrophobicContact CD2-CD1 4.25Å; L308-F355 HydrophobicContact CD1-CB 3.86Å; L308-F355 HydrophobicContact CD1-CG 4.41Å
309	E	89.4	Confident	87.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.1	-41.1	-177	-69.7	-63.7	137.7	0	0	111.9	L305 P321 Q322 I324 C347 K348 T349	L305-E309 HydrophobicContact CD1-CG 3.86Å; L305-E309 HydrophobicContact CG-CG 4.21Å; L305-E309 PolarHBondContact O-N 2.98Å; E309-P321 WeakPolarHBondContact O-CA 3.48Å; E309-Q322 CarbonylContact C-O 3.14Å; E309-Q322 HydrophobicContact CB-CB 4.48Å; E309-Q322 PolarHBondContact O-N 3.24Å; E309-Q322 PolarHBondContact OE2-OE1 3.39Å; E309-I324 HydrophobicContact CB-CD1 3.9Å; E309-I324 HydrophobicContact CB-CG1 4.47Å; E309-I324 HydrophobicContact CG-CD1 3.93Å; E309-C347 WeakPolarHBondContact OE1-CA 3.2Å; E309-C347 VanDerWaalsContact OE1-CB 3.23Å; E309-C347 WeakPolarHBondContact OE1-CB 3.38Å; E309-K348 PolarHBondContact OE2-N 2.79Å; E309-K348 VanDerWaalsContact OE2-N 3.14Å; E309-T349 PolarHBondContact OE1-N 2.85Å; E309-T349 PolarHBondContact OE1-OG1 2.97Å; E309-T349 PolarHBondContact OE2-N 2.99Å
310	N	87.5	Confident	86.6	Confident	20 Å²	20	42.8 Å²	42.8	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-77.5	-27	179.6	-71.7	-48.5	0	0	0	113.8	F188 V190 H306 Q322 R323 I324	F188-N310 HydrophobicContact CE1-CB 4.05Å; V190-N310 HydrophobicContact CG2-CB 4.02Å; H306-N310 PolarHBondContact CD2-ND2 3.1Å; H306-N310 PolarHBondContact NE2-ND2 2.9Å; H306-N310 VanDerWaalsContact O-CB 3.28Å; H306-N310 WeakPolarHBondContact O-CB 3.32Å; H306-N310 PolarHBondContact O-N 3.1Å; H306-N310 PolarHBondContact O-ND2 2.93Å; N310-Q322 PolarHBondContact OD1-O 3.06Å; N310-R323 VanDerWaalsContact OD1-CA 3.31Å; N310-R323 WeakPolarHBondContact OD1-CA 3.43Å; N310-I324 PolarHBondContact ND2-O 2.73Å; N310-I324 PolarHBondContact OD1-N 3.43Å; N310-I324 PolarHBondContact OD1-O 3.49Å
311	S	84.5	Confident	86.1	Confident	23 Å²	23	45 Å²	45	16%	0.161	23%	0.229	C	C	.	.	H	α-helix	trans	-75.8	-39	176.7	-59.5	0	0	0	0	111.8	L307 L308 F318	L307-S311 WeakPolarHBondContact O-CB 3.41Å; L307-S311 PolarHBondContact O-N 2.98Å; L307-S311 PolarHBondContact O-OG 2.94Å; L308-S311 PolarHBondContact O-N 2.67Å; S311-F318 WeakPolarHBondContact O-CD1 3.49Å
312	G	83.8	Confident	85.5	Confident	3 Å²	3	46.2 Å²	46.2	3%	0.031	23%	0.233	C	C	.	.			trans	82.9	171.3	-168.3	0	0	0	0	0	112.9	L308 F318	L308-G312 PolarHBondContact O-N 2.83Å; L308-G312 VanDerWaalsContact O-N 3.12Å; G312-F318 WeakPolarHBondContact O-CD1 3.21Å
313	D	85.8	Confident	84.9	Confident	3 Å²	3	52 Å²	52	2%	0.016	26%	0.255	C	S	.	.			trans	-77.7	126.5	-178.8	-69.4	-40.3	0	0	0	111.3	F315 Q316 F318 N320 S350 L351	D313-F315 VanDerWaalsContact C-N 3.26Å; D313-F315 PolarHBondContact O-N 2.89Å; D313-Q316 HydrophobicContact CB-CB 4.43Å; D313-Q316 HydrophobicContact CB-CG 4.43Å; D313-Q316 PolarHBondContact O-N 2.77Å; D313-Q316 VanDerWaalsContact O-N 3.15Å; D313-F318 WeakPolarHBondContact O-CA 3.34Å; D313-F318 PolarHBondContact O-N 2.79Å; D313-N320 PolarHBondContact N-OD1 2.92Å; D313-N320 PolarHBondContact OD2-ND2 3.04Å; D313-S350 PolarHBondContact OD1-N 2.81Å; D313-S350 VanDerWaalsContact OD2-CB 3.27Å; D313-S350 WeakPolarHBondContact OD2-CB 3.27Å; D313-S350 PolarHBondContact OD2-N 3.41Å; D313-S350 PolarHBondContact OD2-OG 3.29Å; D313-L351 WeakPolarHBondContact OD1-CG 3.11Å; D313-L351 PolarHBondContact OD1-N 3.21Å
314	P	81.2	Confident	84.5	Confident	53 Å²	53	52.4 Å²	52.4	34%	0.344	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-59.3	-35.7	176.7	-22.5	31.3	0	0	0	113.1	Q316 N317 F318 L351	P314-Q316 PolarHBondContact O-N 2.84Å; P314-N317 PolarHBondContact O-N 2.82Å; P314-N317 VanDerWaalsContact O-N 3.14Å; P314-F318 HydrophobicContact CB-CE1 4.07Å; P314-F318 HydrophobicContact CB-CZ 3.87Å; P314-F318 HydrophobicContact CG-CE1 3.8Å; P314-F318 HydrophobicContact CG-CZ 3.99Å; P314-L351 HydrophobicContact CG-CD1 4.27Å
315	F	83.7	Confident	84.3	Confident	183 Å²	183	50.5 Å²	50.5	80%	0.803	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-68.8	-16.4	-178.7	-52.8	-72.1	0	0	0	113.5	D313	D313-F315 VanDerWaalsContact C-N 3.26Å; D313-F315 PolarHBondContact O-N 2.89Å
316	Q	79.4	Confident	84.3	Confident	92 Å²	92	50.5 Å²	50.5	43%	0.43	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-107.1	24.5	175.7	-62.2	-174.4	3.2	0	0	111.6	D313 P314 F318 Q319 N320	D313-Q316 HydrophobicContact CB-CB 4.43Å; D313-Q316 HydrophobicContact CB-CG 4.43Å; D313-Q316 PolarHBondContact O-N 2.77Å; D313-Q316 VanDerWaalsContact O-N 3.15Å; P314-Q316 PolarHBondContact O-N 2.84Å; Q316-F318 PolarHBondContact O-N 2.66Å; Q316-F318 VanDerWaalsContact O-N 3.11Å; Q316-Q319 VanDerWaalsContact O-CB 3.32Å; Q316-Q319 WeakPolarHBondContact O-CB 3.29Å; Q316-Q319 WeakPolarHBondContact O-CG 3.19Å; Q316-Q319 PolarHBondContact O-N 2.79Å; Q316-Q319 VanDerWaalsContact O-N 3.09Å; Q316-N320 PolarHBondContact OE1-ND2 2.65Å
317	N	77.1	Confident	84.2	Confident	130 Å²	130	56.6 Å²	56.6	70%	0.695	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	33.7	-174.8	-65.3	-31.7	0	0	0	112.9	P314 Q319	P314-N317 PolarHBondContact O-N 2.82Å; P314-N317 VanDerWaalsContact O-N 3.14Å; N317-Q319 VanDerWaalsContact C-N 3.26Å; N317-Q319 PolarHBondContact O-N 3.25Å
318	F	77.4	Confident	84.3	Confident	44 Å²	44	57 Å²	57	19%	0.193	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	33	-178.7	-52.2	-80.5	0	0	0	114.3	Y50 S311 G312 D313 P314 Q316 P321	Y50-F318 HydrophobicContact CE1-CE2 4.49Å; Y50-F318 HydrophobicContact CE1-CZ 4.24Å; S311-F318 WeakPolarHBondContact O-CD1 3.49Å; G312-F318 WeakPolarHBondContact O-CD1 3.21Å; D313-F318 WeakPolarHBondContact O-CA 3.34Å; D313-F318 PolarHBondContact O-N 2.79Å; P314-F318 HydrophobicContact CB-CE1 4.07Å; P314-F318 HydrophobicContact CB-CZ 3.87Å; P314-F318 HydrophobicContact CG-CE1 3.8Å; P314-F318 HydrophobicContact CG-CZ 3.99Å; Q316-F318 PolarHBondContact O-N 2.66Å; Q316-F318 VanDerWaalsContact O-N 3.11Å; F318-P321 WeakPolarHBondContact O-CD 3.31Å
319	Q	75.2	Confident	84.3	Confident	155 Å²	155	55.7 Å²	55.7	72%	0.724	27%	0.269	S	S	*	.			trans	-79	-15	-179.6	-72.3	-179.4	2.5	0	0	114.5	Q316 N317 P321	Q316-Q319 VanDerWaalsContact O-CB 3.32Å; Q316-Q319 WeakPolarHBondContact O-CB 3.29Å; Q316-Q319 WeakPolarHBondContact O-CG 3.19Å; Q316-Q319 PolarHBondContact O-N 2.79Å; Q316-Q319 VanDerWaalsContact O-N 3.09Å; N317-Q319 VanDerWaalsContact C-N 3.26Å; N317-Q319 PolarHBondContact O-N 3.25Å; Q319-P321 WeakPolarHBondContact O-CD 3.41Å
320	N	82.8	Confident	84.5	Confident	34 Å²	34	57 Å²	57	18%	0.182	28%	0.277	C	S	.	.			trans	-110.8	42.9	-175.7	67.8	-23.2	0	0	0	115.3	D313 Q316 Q322	D313-N320 PolarHBondContact N-OD1 2.92Å; D313-N320 PolarHBondContact OD2-ND2 3.04Å; Q316-N320 PolarHBondContact OE1-ND2 2.65Å; N320-Q322 PolarHBondContact O-N 3.44Å
321	P	81.5	Confident	84.8	Confident	66 Å²	66	60.4 Å²	60.4	43%	0.429	29%	0.289	S	S	.	.			trans	-71.2	133.7	177.2	32.3	-32.8	0	0	0	110.2	E309 F318 Q319	E309-P321 WeakPolarHBondContact O-CA 3.48Å; F318-P321 WeakPolarHBondContact O-CD 3.31Å; Q319-P321 WeakPolarHBondContact O-CD 3.41Å
322	Q	82.3	Confident	85.2	Confident	31 Å²	31	60.6 Å²	60.6	15%	0.145	29%	0.287	C	S	.	.			trans	-104.3	113	168.8	-171.4	178.1	-28	0	0	107.7	E309 N310 N320 I324 C346 K348	E309-Q322 CarbonylContact C-O 3.14Å; E309-Q322 HydrophobicContact CB-CB 4.48Å; E309-Q322 PolarHBondContact O-N 3.24Å; E309-Q322 PolarHBondContact OE2-OE1 3.39Å; N310-Q322 PolarHBondContact OD1-O 3.06Å; N320-Q322 PolarHBondContact O-N 3.44Å; Q322-I324 HydrophobicContact CB-CD1 4.33Å; Q322-I324 HydrophobicContact CB-CG1 4.18Å; Q322-I324 VanDerWaalsContact CD-CD1 3.49Å; Q322-I324 HydrophobicContact CG-CD1 3.83Å; Q322-I324 HydrophobicContact CG-CG1 3.58Å; Q322-I324 VanDerWaalsContact NE2-CD1 3.3Å; Q322-I324 PolarHBondContact O-N 3.44Å; Q322-C346 PolarHBondContact NE2-O 3.12Å; Q322-C346 PolarHBondContact OE1-O 3.01Å; Q322-C346 VanDerWaalsContact OE1-O 3.06Å; Q322-K348 HydrophobicContact CG-CD 4.38Å; Q322-K348 VanDerWaalsContact OE1-CB 3.25Å
323	R	81.2	Confident	85.6	Confident	121 Å²	121	60.5 Å²	60.5	46%	0.457	29%	0.286	S	S	.	.			trans	-72.2	97.2	176.7	-68.8	-169.2	177.4	-170.3	-3.1	109.5	F34 N310	F34-R323 HydrophobicContact CD2-CB 4.19Å; F34-R323 HydrophobicContact CE2-CB 3.84Å; F34-R323 HydrophobicContact CZ-CB 4.09Å; N310-R323 VanDerWaalsContact OD1-CA 3.31Å; N310-R323 WeakPolarHBondContact OD1-CA 3.43Å
324	I	83.8	Confident	85.8	Confident	8 Å²	8	63.7 Å²	63.7	4%	0.041	31%	0.305	C	S	.	.			trans	-119.7	136.4	177.2	-48.4	177.9	0	0	0	107.6	H306 E309 N310 Q322 E328 I345	H306-I324 PolarHBondContact CD2-O 3.35Å; H306-I324 PolarHBondContact NE2-O 3.36Å; E309-I324 HydrophobicContact CB-CD1 3.9Å; E309-I324 HydrophobicContact CB-CG1 4.47Å; E309-I324 HydrophobicContact CG-CD1 3.93Å; N310-I324 PolarHBondContact ND2-O 2.73Å; N310-I324 PolarHBondContact OD1-N 3.43Å; N310-I324 PolarHBondContact OD1-O 3.49Å; Q322-I324 HydrophobicContact CB-CD1 4.33Å; Q322-I324 HydrophobicContact CB-CG1 4.18Å; Q322-I324 VanDerWaalsContact CD-CD1 3.49Å; Q322-I324 HydrophobicContact CG-CD1 3.83Å; Q322-I324 HydrophobicContact CG-CG1 3.58Å; Q322-I324 VanDerWaalsContact NE2-CD1 3.3Å; Q322-I324 PolarHBondContact O-N 3.44Å; I324-E328 HydrophobicContact CG2-CB 3.4Å; I324-E328 VanDerWaalsContact CG2-CB 3.4Å; I324-E328 HydrophobicContact CG2-CG 4.42Å; I324-I345 HydrophobicContact CD1-CG2 4.42Å
325	T	89.2	Confident	86.3	Confident	37 Å²	37	62 Å²	62	23%	0.227	29%	0.294	C	S	.	.			trans	-72.6	154.8	174.1	63.5	0	0	0	0	111.2	F34 W327 E328 C329	F34-T325 HydrophobicContact CZ-CG2 4.27Å; T325-W327 PolarHBondContact O-N 3.34Å; T325-E328 WeakPolarHBondContact CB-OE2 3.36Å; T325-E328 PolarHBondContact N-OE2 3.31Å; T325-E328 PolarHBondContact O-N 2.81Å; T325-E328 WeakPolarHBondContact OG1-CB 3.16Å; T325-E328 VanDerWaalsContact OG1-CD 3.29Å; T325-E328 VanDerWaalsContact OG1-CG 3.22Å; T325-E328 WeakPolarHBondContact OG1-CG 3.37Å; T325-E328 PolarHBondContact OG1-N 3.15Å; T325-E328 PolarHBondContact OG1-OE2 3.07Å; T325-C329 PolarHBondContact O-N 2.93Å; T325-C329 VanDerWaalsContact O-N 3.14Å
326	Y	90.9	Very high	86.7	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-55.1	-39.4	176.3	178	-101.1	0	0	0	112.4	Y179 F180 L299 A302 H306 C329 V330	Y179-Y326 HydrophobicContact CE1-CD2 4.03Å; Y179-Y326 HydrophobicContact CE1-CE1 4.42Å; Y179-Y326 AromaticContact CE1-CE2 3.64Å; Y179-Y326 HydrophobicContact CE1-CE2 3.64Å; Y179-Y326 AromaticContact CE1-CZ 3.87Å; Y179-Y326 AromaticContact CZ-CD2 3.99Å; Y179-Y326 AromaticContact CZ-CE2 3.88Å; Y179-Y326 WeakPolarHBondContact OH-CD2 3.36Å; Y179-Y326 WeakPolarHBondContact OH-CE2 3.5Å; F180-Y326 HydrophobicContact CD1-CD1 4.04Å; F180-Y326 AromaticContact CD1-CE1 3.61Å; F180-Y326 HydrophobicContact CD1-CE1 3.61Å; F180-Y326 HydrophobicContact CE1-CD1 4.22Å; F180-Y326 AromaticContact CE1-CE1 3.34Å; F180-Y326 HydrophobicContact CE1-CE1 3.34Å; F180-Y326 AromaticContact CE1-CZ 3.67Å; F180-Y326 HydrophobicContact CZ-CE1 4.33Å; L299-Y326 WeakPolarHBondContact CA-OH 3.36Å; L299-Y326 WeakPolarHBondContact CB-OH 3.47Å; L299-Y326 HydrophobicContact CD2-CE1 4.36Å; L299-Y326 WeakPolarHBondContact CD2-OH 3.48Å; L299-Y326 PolarHBondContact O-OH 3.45Å; A302-Y326 HydrophobicContact CB-CE2 4.08Å; H306-Y326 HydrophobicContact CB-CD2 4.14Å; H306-Y326 VanDerWaalsContact CD2-CA 3.46Å; H306-Y326 WeakPolarHBondContact CD2-CA 3.39Å; H306-Y326 PolarHBondContact CD2-N 2.88Å; H306-Y326 VanDerWaalsContact CD2-N 3.27Å; H306-Y326 PolarHBondContact NE2-N 3.43Å; Y326-C329 WeakPolarHBondContact O-CB 3.49Å; Y326-C329 PolarHBondContact O-N 2.9Å; Y326-V330 HydrophobicContact CD1-CG2 4.05Å; Y326-V330 HydrophobicContact CE1-CG2 3.57Å; Y326-V330 HydrophobicContact CE2-CG2 4.49Å; Y326-V330 WeakPolarHBondContact O-CG2 3.19Å; Y326-V330 PolarHBondContact O-N 3.27Å
327	W	91.2	Very high	87.2	Confident	129 Å²	129	50.1 Å²	50.1	49%	0.489	24%	0.242	S	C	.	.	H	α-helix	trans	-70	-34.3	-179	-58.7	118.9	0	0	0	113.3	F180 T325 C329 V330 Y331	F180-W327 HydrophobicContact CB-CH2 4.5Å; F180-W327 HydrophobicContact CB-CZ2 4.12Å; F180-W327 HydrophobicContact CD1-CH2 4.2Å; F180-W327 HydrophobicContact CD1-CZ2 4.46Å; F180-W327 HydrophobicContact CD2-CH2 4.08Å; F180-W327 HydrophobicContact CD2-CZ2 4.48Å; F180-W327 HydrophobicContact CE1-CH2 4.45Å; F180-W327 HydrophobicContact CE2-CH2 4.31Å; F180-W327 HydrophobicContact CG-CH2 4.02Å; F180-W327 HydrophobicContact CG-CZ2 4.13Å; F180-W327 HydrophobicContact CZ-CH2 4.49Å; T325-W327 PolarHBondContact O-N 3.34Å; W327-C329 VanDerWaalsContact C-N 3.33Å; W327-V330 HydrophobicContact CE3-CG2 4.31Å; W327-V330 PolarHBondContact O-N 2.93Å; W327-Y331 WeakPolarHBondContact O-CB 3.15Å; W327-Y331 PolarHBondContact O-N 3.27Å
328	E	91.2	Very high	87.8	Confident	34 Å²	34	44.8 Å²	44.8	16%	0.159	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-37.9	170.6	-79.3	167.8	145.7	0	0	111.3	T30 I324 T325 Y331 F332 I345	T30-E328 PolarHBondContact OG1-OE1 3.3Å; I324-E328 HydrophobicContact CG2-CB 3.4Å; I324-E328 VanDerWaalsContact CG2-CB 3.4Å; I324-E328 HydrophobicContact CG2-CG 4.42Å; T325-E328 WeakPolarHBondContact CB-OE2 3.36Å; T325-E328 PolarHBondContact N-OE2 3.31Å; T325-E328 PolarHBondContact O-N 2.81Å; T325-E328 WeakPolarHBondContact OG1-CB 3.16Å; T325-E328 VanDerWaalsContact OG1-CD 3.29Å; T325-E328 VanDerWaalsContact OG1-CG 3.22Å; T325-E328 WeakPolarHBondContact OG1-CG 3.37Å; T325-E328 PolarHBondContact OG1-N 3.15Å; T325-E328 PolarHBondContact OG1-OE2 3.07Å; E328-Y331 PolarHBondContact O-N 3.27Å; E328-F332 VanDerWaalsContact O-CB 3.31Å; E328-F332 WeakPolarHBondContact O-CB 3.5Å; E328-F332 PolarHBondContact O-N 3.39Å; E328-I345 HydrophobicContact CB-CD1 3.91Å; E328-I345 HydrophobicContact CG-CD1 4.1Å
329	C	92	Very high	88.4	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-65.2	-41.4	172.5	-64.1	0	0	0	0	112.2	A302 L305 H306 T325 Y326 W327 F332 L333	A302-C329 HydrophobicContact CB-CB 4.32Å; L305-C329 HydrophobicContact CD2-CB 4.43Å; H306-C329 HydrophobicContact CB-CB 4.34Å; T325-C329 PolarHBondContact O-N 2.93Å; T325-C329 VanDerWaalsContact O-N 3.14Å; Y326-C329 WeakPolarHBondContact O-CB 3.49Å; Y326-C329 PolarHBondContact O-N 2.9Å; W327-C329 VanDerWaalsContact C-N 3.33Å; C329-F332 PolarHBondContact O-N 3.43Å; C329-L333 WeakPolarHBondContact O-CG 3.45Å; C329-L333 PolarHBondContact O-N 2.98Å
330	V	92.9	Very high	89.2	Confident	28 Å²	28	44.3 Å²	44.3	17%	0.17	23%	0.229	C	C	.	.	H	α-helix	trans	-59.5	-49.4	174.4	173	0	0	0	0	110.3	L299 A302 Y326 W327 F332 L333 V334	L299-V330 HydrophobicContact CD2-CG2 4.21Å; A302-V330 HydrophobicContact CB-CB 4.21Å; A302-V330 HydrophobicContact CB-CG2 3.46Å; A302-V330 VanDerWaalsContact CB-CG2 3.46Å; Y326-V330 HydrophobicContact CD1-CG2 4.05Å; Y326-V330 HydrophobicContact CE1-CG2 3.57Å; Y326-V330 HydrophobicContact CE2-CG2 4.49Å; Y326-V330 WeakPolarHBondContact O-CG2 3.19Å; Y326-V330 PolarHBondContact O-N 3.27Å; W327-V330 HydrophobicContact CE3-CG2 4.31Å; W327-V330 PolarHBondContact O-N 2.93Å; V330-F332 PolarHBondContact O-N 3.48Å; V330-L333 PolarHBondContact O-N 3.1Å; V330-V334 HydrophobicContact CG1-CG2 4.39Å; V330-V334 VanDerWaalsContact O-CG2 3.31Å; V330-V334 WeakPolarHBondContact O-CG2 3.48Å; V330-V334 PolarHBondContact O-N 3.48Å
331	Y	93.4	Very high	89.4	Confident	91 Å²	91	45.1 Å²	45.1	36%	0.357	25%	0.245	S	C	.	.	H	α-helix	trans	-56.6	-51.6	176.8	163.2	-101.9	0	0	0	111.5	W327 E328 L333 V334 V335 Y342 D344 I345	W327-Y331 WeakPolarHBondContact O-CB 3.15Å; W327-Y331 PolarHBondContact O-N 3.27Å; E328-Y331 PolarHBondContact O-N 3.27Å; Y331-L333 VanDerWaalsContact C-N 3.33Å; Y331-L333 PolarHBondContact O-N 3.26Å; Y331-V334 PolarHBondContact O-N 3.06Å; Y331-V335 HydrophobicContact CD2-CG2 3.91Å; Y331-V335 HydrophobicContact CE1-CG2 4.46Å; Y331-V335 HydrophobicContact CE2-CG2 3.56Å; Y331-V335 WeakPolarHBondContact O-CB 3.43Å; Y331-V335 VanDerWaalsContact O-CG2 3.3Å; Y331-V335 WeakPolarHBondContact O-CG2 3.37Å; Y331-V335 PolarHBondContact O-N 3.03Å; Y331-Y342 WeakPolarHBondContact OH-CD2 3.28Å; Y331-D344 VanDerWaalsContact CE1-OD2 3.24Å; Y331-D344 WeakPolarHBondContact CE1-OD2 3.24Å; Y331-D344 PolarHBondContact OH-OD2 3.38Å; Y331-I345 HydrophobicContact CD1-CD1 3.89Å; Y331-I345 HydrophobicContact CE1-CD1 4.15Å
332	F	92.6	Very high	89.8	Confident	27 Å²	27	49.4 Å²	49.4	12%	0.118	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-42.7	-179.7	172.5	-109	0	0	0	112.7	L305 E328 C329 V330 T336 I345 C347 M356	L305-F332 HydrophobicContact CD2-CD1 3.45Å; L305-F332 VanDerWaalsContact CD2-CD1 3.45Å; L305-F332 HydrophobicContact CD2-CE1 3.74Å; E328-F332 VanDerWaalsContact O-CB 3.31Å; E328-F332 WeakPolarHBondContact O-CB 3.5Å; E328-F332 PolarHBondContact O-N 3.39Å; C329-F332 PolarHBondContact O-N 3.43Å; V330-F332 PolarHBondContact O-N 3.48Å; F332-T336 WeakPolarHBondContact O-CB 3.25Å; F332-T336 PolarHBondContact O-N 3.43Å; F332-T336 PolarHBondContact O-OG1 2.9Å; F332-I345 HydrophobicContact CB-CB 4.45Å; F332-I345 HydrophobicContact CB-CG2 4.28Å; F332-I345 HydrophobicContact CD2-CB 4.11Å; F332-I345 HydrophobicContact CD2-CG2 4.23Å; F332-I345 WeakPolarHBondContact CD2-O 3.42Å; F332-I345 WeakPolarHBondContact CE2-O 3.37Å; F332-I345 HydrophobicContact CG-CG2 4.27Å; F332-C347 VanDerWaalsContact CE1-SG 3.51Å; F332-M356 HydrophobicContact CD1-CE 4.4Å; F332-M356 HydrophobicContact CD1-SD 4.46Å; F332-M356 HydrophobicContact CE1-CE 3.53Å; F332-M356 HydrophobicContact CE1-CG 4.1Å; F332-M356 HydrophobicContact CE1-SD 3.64Å; F332-M356 HydrophobicContact CZ-CE 3.88Å; F332-M356 HydrophobicContact CZ-SD 4.41Å
333	L	92.6	Very high	89.8	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-70.6	-39.8	178.7	-71.1	-170.3	0	0	0	113.2	G301 A302 L305 C329 V330 Y331 T336 M337 M356 F359	G301-L333 WeakPolarHBondContact O-CD1 3.44Å; A302-L333 HydrophobicContact CB-CD1 3.98Å; L305-L333 HydrophobicContact CD2-CD2 3.93Å; L305-L333 HydrophobicContact CD2-CG 4.17Å; C329-L333 WeakPolarHBondContact O-CG 3.45Å; C329-L333 PolarHBondContact O-N 2.98Å; V330-L333 PolarHBondContact O-N 3.1Å; Y331-L333 VanDerWaalsContact C-N 3.33Å; Y331-L333 PolarHBondContact O-N 3.26Å; L333-T336 PolarHBondContact O-N 3.47Å; L333-M337 WeakPolarHBondContact O-CB 3.28Å; L333-M337 VanDerWaalsContact O-CG 3.31Å; L333-M337 WeakPolarHBondContact O-CG 3.13Å; L333-M337 PolarHBondContact O-N 3.33Å; L333-M356 HydrophobicContact CD2-CE 3.6Å; L333-M356 HydrophobicContact CD2-SD 3.34Å; L333-M356 WeakPolarHBondContact CD2-SD 3.39Å; L333-F359 HydrophobicContact CB-CE1 3.97Å; L333-F359 HydrophobicContact CB-CZ 4.33Å; L333-F359 HydrophobicContact CD1-CE1 3.87Å; L333-F359 HydrophobicContact CD1-CE2 4.32Å; L333-F359 HydrophobicContact CD1-CZ 3.71Å; L333-F359 HydrophobicContact CD2-CD1 3.76Å; L333-F359 HydrophobicContact CD2-CE1 3.63Å; L333-F359 HydrophobicContact CD2-CZ 4.31Å; L333-F359 HydrophobicContact CG-CE1 4.04Å; L333-F359 HydrophobicContact CG-CZ 4.36Å
334	V	90.6	Very high	90.1	Very high	70 Å²	70	47.7 Å²	47.7	42%	0.424	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-43.1	176.5	172	0	0	0	0	110.6	V330 Y331 T336 M337 G338	V330-V334 HydrophobicContact CG1-CG2 4.39Å; V330-V334 VanDerWaalsContact O-CG2 3.31Å; V330-V334 WeakPolarHBondContact O-CG2 3.48Å; V330-V334 PolarHBondContact O-N 3.48Å; Y331-V334 PolarHBondContact O-N 3.06Å; V334-T336 VanDerWaalsContact C-N 3.31Å; V334-T336 PolarHBondContact O-N 3.03Å; V334-M337 PolarHBondContact O-N 3.43Å; V334-G338 PolarHBondContact O-N 3.11Å
335	V	91.6	Very high	90.3	Very high	17 Å²	17	48.6 Å²	48.6	10%	0.103	27%	0.271	C	S	.	.	H	α-helix	trans	-61.5	-39.3	174.7	167.3	0	0	0	0	111.6	Y331 T339 V340 Y342	Y331-V335 HydrophobicContact CD2-CG2 3.91Å; Y331-V335 HydrophobicContact CE1-CG2 4.46Å; Y331-V335 HydrophobicContact CE2-CG2 3.56Å; Y331-V335 WeakPolarHBondContact O-CB 3.43Å; Y331-V335 VanDerWaalsContact O-CG2 3.3Å; Y331-V335 WeakPolarHBondContact O-CG2 3.37Å; Y331-V335 PolarHBondContact O-N 3.03Å; V335-T339 PolarHBondContact O-N 2.91Å; V335-V340 HydrophobicContact CG1-CB 4.08Å; V335-V340 HydrophobicContact CG1-CG1 4.46Å; V335-V340 PolarHBondContact O-N 3.5Å; V335-V340 VanDerWaalsContact O-N 3.08Å; V335-Y342 HydrophobicContact CG1-CD2 3.65Å; V335-Y342 HydrophobicContact CG1-CE2 4.16Å; V335-Y342 HydrophobicContact CG1-CG 4.43Å; V335-Y342 HydrophobicContact CG2-CD2 4.13Å; V335-Y342 HydrophobicContact CG2-CE2 4.15Å
336	T	92.2	Very high	90.1	Very high	21 Å²	21	48.5 Å²	48.5	13%	0.129	27%	0.271	C	S	.	.	H	α-helix	trans	-71.7	-43.2	178.7	-56.7	0	0	0	0	112	F332 L333 V334 G338 T339 M356 I360	F332-T336 WeakPolarHBondContact O-CB 3.25Å; F332-T336 PolarHBondContact O-N 3.43Å; F332-T336 PolarHBondContact O-OG1 2.9Å; L333-T336 PolarHBondContact O-N 3.47Å; V334-T336 VanDerWaalsContact C-N 3.31Å; V334-T336 PolarHBondContact O-N 3.03Å; T336-G338 VanDerWaalsContact C-N 3.27Å; T336-G338 PolarHBondContact O-N 3.04Å; T336-T339 PolarHBondContact O-N 3.04Å; T336-M356 HydrophobicContact CG2-CE 3.6Å; T336-I360 HydrophobicContact CG2-CD1 4.02Å; T336-I360 HydrophobicContact CG2-CG1 3.63Å
337	M	89.7	Confident	90	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.03	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-39.8	174	-77.3	173.3	151.8	0	0	111.8	S298 L333 V334 T339 F359 M366 F367	S298-M337 PolarHBondContact OG-SD 3.23Å; S298-M337 VanDerWaalsContact OG-SD 3.38Å; L333-M337 WeakPolarHBondContact O-CB 3.28Å; L333-M337 VanDerWaalsContact O-CG 3.31Å; L333-M337 WeakPolarHBondContact O-CG 3.13Å; L333-M337 PolarHBondContact O-N 3.33Å; V334-M337 PolarHBondContact O-N 3.43Å; M337-T339 PolarHBondContact O-N 2.86Å; M337-F359 HydrophobicContact CE-CE1 3.57Å; M337-F359 HydrophobicContact CE-CE2 4.11Å; M337-F359 HydrophobicContact CE-CZ 3.24Å; M337-F359 HydrophobicContact CG-CE1 3.93Å; M337-F359 HydrophobicContact SD-CE1 4.18Å; M337-F359 HydrophobicContact SD-CZ 4.23Å; M337-M366 HydrophobicContact CE-CE 3.87Å; M337-F367 HydrophobicContact CB-CD2 4.33Å
338	G	89.1	Confident	89.8	Confident	17 Å²	17	47.6 Å²	47.6	18%	0.175	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	5	175.1	0	0	0	0	0	114.8	V334 T336 V340	V334-G338 PolarHBondContact O-N 3.11Å; T336-G338 VanDerWaalsContact C-N 3.27Å; T336-G338 PolarHBondContact O-N 3.04Å; G338-V340 PolarHBondContact O-N 3.05Å; G338-V340 VanDerWaalsContact O-N 3.11Å
339	T	91.3	Very high	89.7	Confident	107 Å²	107	46 Å²	46	66%	0.656	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	15.3	-177.3	61.6	0	0	0	0	115.7	V335 T336 M337 L364	V335-T339 PolarHBondContact O-N 2.91Å; T336-T339 PolarHBondContact O-N 3.04Å; M337-T339 PolarHBondContact O-N 2.86Å; T339-L364 HydrophobicContact CG2-CD2 3.12Å
340	V	91.2	Very high	89.6	Confident	82 Å²	82	49.1 Å²	49.1	50%	0.497	29%	0.286	S	S	.	.			trans	-77.3	-50	-176.7	-179.9	0	0	0	0	110.9	V335 G338 Y342	V335-V340 HydrophobicContact CG1-CB 4.08Å; V335-V340 HydrophobicContact CG1-CG1 4.46Å; V335-V340 PolarHBondContact O-N 3.5Å; V335-V340 VanDerWaalsContact O-N 3.08Å; G338-V340 PolarHBondContact O-N 3.05Å; G338-V340 VanDerWaalsContact O-N 3.11Å; V340-Y342 HydrophobicContact CG1-CD1 4.02Å; V340-Y342 HydrophobicContact CG1-CD2 4.12Å; V340-Y342 HydrophobicContact CG1-CE1 3.63Å; V340-Y342 HydrophobicContact CG1-CE2 3.74Å; V340-Y342 HydrophobicContact CG1-CG 4.25Å; V340-Y342 VanDerWaalsContact CG1-CZ 3.47Å
341	G	86.5	Confident	89.4	Confident	51 Å²	51	50.1 Å²	50.1	53%	0.526	29%	0.29	S	S	.	.			trans	56.4	56.3	170.6	0	0	0	0	0	115.6	G343	G341-G343 PolarHBondContact O-N 3.47Å; G341-G343 VanDerWaalsContact O-N 3.14Å
342	Y	89.8	Confident	89.4	Confident	156 Å²	156	45.8 Å²	45.8	61%	0.612	27%	0.273	S	S	*	.			trans	-54.3	-33.5	-177.7	-68.5	-62.1	0	0	0	114.8	Y331 V335 V340 D344	Y331-Y342 WeakPolarHBondContact OH-CD2 3.28Å; V335-Y342 HydrophobicContact CG1-CD2 3.65Å; V335-Y342 HydrophobicContact CG1-CE2 4.16Å; V335-Y342 HydrophobicContact CG1-CG 4.43Å; V335-Y342 HydrophobicContact CG2-CD2 4.13Å; V335-Y342 HydrophobicContact CG2-CE2 4.15Å; V340-Y342 HydrophobicContact CG1-CD1 4.02Å; V340-Y342 HydrophobicContact CG1-CD2 4.12Å; V340-Y342 HydrophobicContact CG1-CE1 3.63Å; V340-Y342 HydrophobicContact CG1-CE2 3.74Å; V340-Y342 HydrophobicContact CG1-CG 4.25Å; V340-Y342 VanDerWaalsContact CG1-CZ 3.47Å; Y342-D344 VanDerWaalsContact C-N 3.29Å
343	G	84	Confident	89.3	Confident	46 Å²	46	51.4 Å²	51.4	47%	0.474	29%	0.294	S	S	.	.	S	Bend	trans	78.8	10	-178.7	0	0	0	0	0	114.6	G341	G341-G343 PolarHBondContact O-N 3.47Å; G341-G343 VanDerWaalsContact O-N 3.14Å
344	D	87.3	Confident	89.3	Confident	71 Å²	71	55.9 Å²	55.9	38%	0.38	32%	0.317	S	S	.	.	S	Bend	trans	-66.1	-40.8	171	54	-13.3	0	0	0	112	Y331 Y342	Y331-D344 VanDerWaalsContact CE1-OD2 3.24Å; Y331-D344 WeakPolarHBondContact CE1-OD2 3.24Å; Y331-D344 PolarHBondContact OH-OD2 3.38Å; Y342-D344 VanDerWaalsContact C-N 3.29Å
345	I	86.3	Confident	89.5	Confident	27 Å²	27	54.2 Å²	54.2	14%	0.138	30%	0.304	C	S	.	.	S	Bend	trans	-113.9	131.9	171.7	-56.7	179.1	0	0	0	108.3	I324 E328 Y331 F332	I324-I345 HydrophobicContact CD1-CG2 4.42Å; E328-I345 HydrophobicContact CB-CD1 3.91Å; E328-I345 HydrophobicContact CG-CD1 4.1Å; Y331-I345 HydrophobicContact CD1-CD1 3.89Å; Y331-I345 HydrophobicContact CE1-CD1 4.15Å; F332-I345 HydrophobicContact CB-CB 4.45Å; F332-I345 HydrophobicContact CB-CG2 4.28Å; F332-I345 HydrophobicContact CD2-CB 4.11Å; F332-I345 HydrophobicContact CD2-CG2 4.23Å; F332-I345 WeakPolarHBondContact CD2-O 3.42Å; F332-I345 WeakPolarHBondContact CE2-O 3.37Å; F332-I345 HydrophobicContact CG-CG2 4.27Å
346	C	86.9	Confident	89.5	Confident	34 Å²	34	54 Å²	54	23%	0.23	30%	0.302	C	S	.	.			trans	-135	147.2	177.1	71.6	0	0	0	0	110.5	C26 Q322 K348	C26-C346 HydrophobicContact CB-CB 4.29Å; C26-C346 WeakPolarHBondContact CB-SG 3.1Å; C26-C346 WeakPolarHBondContact SG-CB 3.34Å; C26-C346 CovalentContact SG-SG 2.05Å; C26-C346 PolarHBondContact SG-SG 3.49Å; Q322-C346 PolarHBondContact NE2-O 3.12Å; Q322-C346 PolarHBondContact OE1-O 3.01Å; Q322-C346 VanDerWaalsContact OE1-O 3.06Å; C346-K348 PolarHBondContact O-N 3.33Å
347	C	88.3	Confident	89.6	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.074	32%	0.321	C	S	.	.			trans	-74.1	119.6	174.1	-57.1	0	0	0	0	110.3	E309 F332 R353 M356	E309-C347 WeakPolarHBondContact OE1-CA 3.2Å; E309-C347 VanDerWaalsContact OE1-CB 3.23Å; E309-C347 WeakPolarHBondContact OE1-CB 3.38Å; F332-C347 VanDerWaalsContact CE1-SG 3.51Å; C347-R353 HydrophobicContact CB-CG 4.02Å; C347-R353 PolarHBondContact O-NE 3.02Å; C347-R353 PolarHBondContact O-NH2 3.21Å; C347-M356 VanDerWaalsContact SG-CG 3.54Å
348	K	86.7	Confident	89.7	Confident	102 Å²	102	63.4 Å²	63.4	44%	0.443	35%	0.349	S	S	.	.			trans	-89.8	-28.8	175.7	-73.7	176.9	-175.5	-179.5	0	112.1	E309 Q322 C346	E309-K348 PolarHBondContact OE2-N 2.79Å; E309-K348 VanDerWaalsContact OE2-N 3.14Å; Q322-K348 HydrophobicContact CG-CD 4.38Å; Q322-K348 VanDerWaalsContact OE1-CB 3.25Å; C346-K348 PolarHBondContact O-N 3.33Å
349	T	88.8	Confident	89.9	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	-72.6	146.2	-179.2	69.2	0	0	0	0	112.1	E309 L351 G352 R353	E309-T349 PolarHBondContact OE1-N 2.85Å; E309-T349 PolarHBondContact OE1-OG1 2.97Å; E309-T349 PolarHBondContact OE2-N 2.99Å; T349-L351 VanDerWaalsContact C-N 3.35Å; T349-G352 PolarHBondContact O-N 3.01Å; T349-G352 VanDerWaalsContact OG1-CA 3.28Å; T349-G352 WeakPolarHBondContact OG1-CA 3.4Å; T349-G352 PolarHBondContact OG1-N 2.95Å; T349-R353 WeakPolarHBondContact O-CG 3.32Å; T349-R353 PolarHBondContact O-N 2.84Å
350	S	89.2	Confident	90	Very high	66 Å²	66	61.7 Å²	61.7	46%	0.462	33%	0.33	S	S	.	.	H	α-helix	trans	-67.5	-40.4	177.9	-47.4	0	0	0	0	110.4	D313 L354	D313-S350 PolarHBondContact OD1-N 2.81Å; D313-S350 VanDerWaalsContact OD2-CB 3.27Å; D313-S350 WeakPolarHBondContact OD2-CB 3.27Å; D313-S350 PolarHBondContact OD2-N 3.41Å; D313-S350 PolarHBondContact OD2-OG 3.29Å; S350-L354 PolarHBondContact O-N 2.84Å
351	L	90.4	Very high	90	Very high	50 Å²	50	63.6 Å²	63.6	26%	0.262	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-40.7	175	-69	178.3	0	0	0	112.3	L308 D313 P314 T349 L354 F355	L308-L351 HydrophobicContact CD1-CB 4.21Å; L308-L351 HydrophobicContact CD2-CB 4.04Å; L308-L351 HydrophobicContact CD2-CD1 4.25Å; D313-L351 WeakPolarHBondContact OD1-CG 3.11Å; D313-L351 PolarHBondContact OD1-N 3.21Å; P314-L351 HydrophobicContact CG-CD1 4.27Å; T349-L351 VanDerWaalsContact C-N 3.35Å; L351-L354 PolarHBondContact O-N 3.18Å; L351-F355 PolarHBondContact O-N 3.33Å
352	G	91.7	Very high	90.2	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.9	-41.8	176.2	0	0	0	0	0	112.3	T349 F355 M356	T349-G352 PolarHBondContact O-N 3.01Å; T349-G352 VanDerWaalsContact OG1-CA 3.28Å; T349-G352 WeakPolarHBondContact OG1-CA 3.4Å; T349-G352 PolarHBondContact OG1-N 2.95Å; G352-F355 PolarHBondContact O-N 2.84Å; G352-M356 WeakPolarHBondContact O-CG 3.49Å; G352-M356 PolarHBondContact O-N 3.06Å
353	R	91.7	Very high	90.2	Very high	144 Å²	144	55.4 Å²	55.4	54%	0.543	30%	0.3	S	S	.	.	H	α-helix	trans	-62.4	-42.7	173.1	-71.8	175.2	-174.3	172.4	2	112.6	C347 T349 M356 V357	C347-R353 HydrophobicContact CB-CG 4.02Å; C347-R353 PolarHBondContact O-NE 3.02Å; C347-R353 PolarHBondContact O-NH2 3.21Å; T349-R353 WeakPolarHBondContact O-CG 3.32Å; T349-R353 PolarHBondContact O-N 2.84Å; R353-M356 PolarHBondContact O-N 2.8Å; R353-V357 PolarHBondContact O-N 3.34Å
354	L	93.2	Very high	90.5	Very high	95 Å²	95	56.4 Å²	56.4	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-45	176.2	-178.9	64.7	0	0	0	111.3	S350 L351 M356 V357 F358	S350-L354 PolarHBondContact O-N 2.84Å; L351-L354 PolarHBondContact O-N 3.18Å; L354-M356 VanDerWaalsContact C-N 3.32Å; L354-M356 PolarHBondContact O-N 3.45Å; L354-V357 PolarHBondContact O-N 2.91Å; L354-F358 HydrophobicContact CD1-CD2 4.43Å; L354-F358 HydrophobicContact CD1-CE2 3.78Å; L354-F358 HydrophobicContact CG-CD2 4.44Å; L354-F358 HydrophobicContact CG-CE2 4.07Å; L354-F358 WeakPolarHBondContact O-CD2 3.4Å; L354-F358 PolarHBondContact O-N 3.14Å
355	F	93.8	Very high	90.6	Very high	36 Å²	36	56 Å²	56	16%	0.158	30%	0.3	C	S	.	.	H	α-helix	trans	-58	-44.7	174.8	172	-106	0	0	0	111.7	F304 L305 L308 L351 G352 V357 F358 F359	F304-F355 HydrophobicContact CB-CE2 4.21Å; F304-F355 HydrophobicContact CB-CZ 4.1Å; F304-F355 HydrophobicContact CD1-CB 4.32Å; F304-F355 HydrophobicContact CD1-CD1 4.1Å; F304-F355 AromaticContact CD1-CD2 3.22Å; F304-F355 HydrophobicContact CD1-CD2 3.22Å; F304-F355 HydrophobicContact CD1-CE1 4.23Å; F304-F355 AromaticContact CD1-CE2 3.37Å; F304-F355 HydrophobicContact CD1-CE2 3.37Å; F304-F355 AromaticContact CD1-CG 3.6Å; F304-F355 HydrophobicContact CD1-CG 3.6Å; F304-F355 AromaticContact CD1-CZ 3.89Å; F304-F355 HydrophobicContact CD1-CZ 3.89Å; F304-F355 HydrophobicContact CE1-CB 4.12Å; F304-F355 AromaticContact CE1-CD2 3.36Å; F304-F355 HydrophobicContact CE1-CD2 3.36Å; F304-F355 AromaticContact CE1-CE2 3.92Å; F304-F355 HydrophobicContact CE1-CE2 3.92Å; F304-F355 AromaticContact CE1-CG 3.82Å; F304-F355 HydrophobicContact CE1-CG 3.82Å; F304-F355 HydrophobicContact CG-CD2 4.22Å; F304-F355 AromaticContact CG-CE2 3.95Å; F304-F355 HydrophobicContact CG-CE2 3.95Å; F304-F355 HydrophobicContact CG-CZ 4.32Å; F304-F355 HydrophobicContact CZ-CD2 4.49Å; L305-F355 HydrophobicContact CB-CD1 4.27Å; L305-F355 HydrophobicContact CB-CE1 4.07Å; L305-F355 HydrophobicContact CD1-CD1 4.23Å; L308-F355 HydrophobicContact CD1-CB 3.86Å; L308-F355 HydrophobicContact CD1-CG 4.41Å; L351-F355 PolarHBondContact O-N 3.33Å; G352-F355 PolarHBondContact O-N 2.84Å; F355-V357 VanDerWaalsContact C-N 3.3Å; F355-V357 PolarHBondContact O-N 3.3Å; F355-F358 PolarHBondContact O-N 3.35Å; F355-F359 HydrophobicContact CD1-CB 4.46Å; F355-F359 HydrophobicContact CE1-CB 4.1Å; F355-F359 HydrophobicContact CE1-CD2 4.04Å; F355-F359 HydrophobicContact CE1-CG 4.1Å; F355-F359 HydrophobicContact CE2-CB 4.45Å; F355-F359 HydrophobicContact CE2-CD2 4.17Å; F355-F359 HydrophobicContact CZ-CB 4.09Å; F355-F359 AromaticContact CZ-CD2 3.49Å; F355-F359 HydrophobicContact CZ-CD2 3.49Å; F355-F359 VanDerWaalsContact CZ-CD2 3.49Å; F355-F359 HydrophobicContact CZ-CE2 4.14Å; F355-F359 AromaticContact CZ-CG 3.99Å; F355-F359 HydrophobicContact CZ-CG 3.99Å; F355-F359 VanDerWaalsContact O-CB 3.3Å; F355-F359 WeakPolarHBondContact O-CB 3.36Å; F355-F359 PolarHBondContact O-N 2.82Å
356	M	92.4	Very high	90.8	Very high	13 Å²	13	56.3 Å²	56.3	6%	0.064	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-35.6	179	-72.7	-51.8	-64	0	0	113.4	L305 F332 L333 T336 C347 G352 R353 L354 F358 F359 I360	L305-M356 HydrophobicContact CD1-SD 4.49Å; L305-M356 HydrophobicContact CD2-SD 4.23Å; F332-M356 HydrophobicContact CD1-CE 4.4Å; F332-M356 HydrophobicContact CD1-SD 4.46Å; F332-M356 HydrophobicContact CE1-CE 3.53Å; F332-M356 HydrophobicContact CE1-CG 4.1Å; F332-M356 HydrophobicContact CE1-SD 3.64Å; F332-M356 HydrophobicContact CZ-CE 3.88Å; F332-M356 HydrophobicContact CZ-SD 4.41Å; L333-M356 HydrophobicContact CD2-CE 3.6Å; L333-M356 HydrophobicContact CD2-SD 3.34Å; L333-M356 WeakPolarHBondContact CD2-SD 3.39Å; T336-M356 HydrophobicContact CG2-CE 3.6Å; C347-M356 VanDerWaalsContact SG-CG 3.54Å; G352-M356 WeakPolarHBondContact O-CG 3.49Å; G352-M356 PolarHBondContact O-N 3.06Å; R353-M356 PolarHBondContact O-N 2.8Å; L354-M356 VanDerWaalsContact C-N 3.32Å; L354-M356 PolarHBondContact O-N 3.45Å; M356-F358 PolarHBondContact O-N 2.98Å; M356-F359 PolarHBondContact O-N 3.04Å; M356-I360 HydrophobicContact CE-CG1 4.38Å; M356-I360 WeakPolarHBondContact O-CB 3.31Å; M356-I360 WeakPolarHBondContact O-CD1 3.33Å; M356-I360 WeakPolarHBondContact O-CG1 3.4Å; M356-I360 PolarHBondContact O-N 2.9Å
357	V	92.8	Very high	91	Very high	87 Å²	87	58.1 Å²	58.1	53%	0.527	31%	0.305	S	S	.	.	H	α-helix	trans	-60.1	-48.1	175.9	173.3	0	0	0	0	111.1	R353 L354 F355 L361	R353-V357 PolarHBondContact O-N 3.34Å; L354-V357 PolarHBondContact O-N 2.91Å; F355-V357 VanDerWaalsContact C-N 3.3Å; F355-V357 PolarHBondContact O-N 3.3Å; V357-L361 PolarHBondContact O-N 3.21Å
358	F	93	Very high	91	Very high	137 Å²	137	60.9 Å²	60.9	60%	0.601	33%	0.329	S	S	*	.	H	α-helix	trans	-69.4	-39.5	177.6	-68.9	-68	0	0	0	112.3	L354 F355 M356 I360 L361 G362	L354-F358 HydrophobicContact CD1-CD2 4.43Å; L354-F358 HydrophobicContact CD1-CE2 3.78Å; L354-F358 HydrophobicContact CG-CD2 4.44Å; L354-F358 HydrophobicContact CG-CE2 4.07Å; L354-F358 WeakPolarHBondContact O-CD2 3.4Å; L354-F358 PolarHBondContact O-N 3.14Å; F355-F358 PolarHBondContact O-N 3.35Å; M356-F358 PolarHBondContact O-N 2.98Å; F358-I360 VanDerWaalsContact C-N 3.34Å; F358-I360 PolarHBondContact O-N 3.46Å; F358-L361 PolarHBondContact O-N 3.02Å; F358-G362 PolarHBondContact O-N 3.21Å; F358-G362 VanDerWaalsContact O-N 3.17Å
359	F	92.9	Very high	91.3	Very high	21 Å²	21	58.7 Å²	58.7	9%	0.092	33%	0.327	C	S	.	.	H	α-helix	trans	-66.9	-35.1	-179.9	-167.6	-96.7	0	0	0	112.3	L333 M337 F355 M356 G363	L333-F359 HydrophobicContact CB-CE1 3.97Å; L333-F359 HydrophobicContact CB-CZ 4.33Å; L333-F359 HydrophobicContact CD1-CE1 3.87Å; L333-F359 HydrophobicContact CD1-CE2 4.32Å; L333-F359 HydrophobicContact CD1-CZ 3.71Å; L333-F359 HydrophobicContact CD2-CD1 3.76Å; L333-F359 HydrophobicContact CD2-CE1 3.63Å; L333-F359 HydrophobicContact CD2-CZ 4.31Å; L333-F359 HydrophobicContact CG-CE1 4.04Å; L333-F359 HydrophobicContact CG-CZ 4.36Å; M337-F359 HydrophobicContact CE-CE1 3.57Å; M337-F359 HydrophobicContact CE-CE2 4.11Å; M337-F359 HydrophobicContact CE-CZ 3.24Å; M337-F359 HydrophobicContact CG-CE1 3.93Å; M337-F359 HydrophobicContact SD-CE1 4.18Å; M337-F359 HydrophobicContact SD-CZ 4.23Å; F355-F359 HydrophobicContact CD1-CB 4.46Å; F355-F359 HydrophobicContact CE1-CB 4.1Å; F355-F359 HydrophobicContact CE1-CD2 4.04Å; F355-F359 HydrophobicContact CE1-CG 4.1Å; F355-F359 HydrophobicContact CE2-CB 4.45Å; F355-F359 HydrophobicContact CE2-CD2 4.17Å; F355-F359 HydrophobicContact CZ-CB 4.09Å; F355-F359 AromaticContact CZ-CD2 3.49Å; F355-F359 HydrophobicContact CZ-CD2 3.49Å; F355-F359 VanDerWaalsContact CZ-CD2 3.49Å; F355-F359 HydrophobicContact CZ-CE2 4.14Å; F355-F359 AromaticContact CZ-CG 3.99Å; F355-F359 HydrophobicContact CZ-CG 3.99Å; F355-F359 VanDerWaalsContact O-CB 3.3Å; F355-F359 WeakPolarHBondContact O-CB 3.36Å; F355-F359 PolarHBondContact O-N 2.82Å; M356-F359 PolarHBondContact O-N 3.04Å; F359-G363 VanDerWaalsContact O-CA 3.27Å; F359-G363 WeakPolarHBondContact O-CA 3.29Å; F359-G363 PolarHBondContact O-N 2.86Å
360	I	92.8	Very high	91.4	Very high	67 Å²	67	61.2 Å²	61.2	34%	0.344	34%	0.337	S	S	.	.	H	α-helix	trans	-64.6	-46.8	174.2	-72.5	163.8	0	0	0	110.1	T336 M356 F358 G362 G363 L364	T336-I360 HydrophobicContact CG2-CD1 4.02Å; T336-I360 HydrophobicContact CG2-CG1 3.63Å; M356-I360 HydrophobicContact CE-CG1 4.38Å; M356-I360 WeakPolarHBondContact O-CB 3.31Å; M356-I360 WeakPolarHBondContact O-CD1 3.33Å; M356-I360 WeakPolarHBondContact O-CG1 3.4Å; M356-I360 PolarHBondContact O-N 2.9Å; F358-I360 VanDerWaalsContact C-N 3.34Å; F358-I360 PolarHBondContact O-N 3.46Å; I360-G362 PolarHBondContact O-N 2.79Å; I360-G363 PolarHBondContact O-N 3.41Å; I360-L364 HydrophobicContact CG2-CD1 3.62Å; I360-L364 HydrophobicContact CG2-CG 4.05Å; I360-L364 WeakPolarHBondContact O-CB 3.43Å; I360-L364 WeakPolarHBondContact O-CG 3.32Å; I360-L364 PolarHBondContact O-N 2.99Å
361	L	91.2	Very high	91.5	Very high	121 Å²	121	60.8 Å²	60.8	63%	0.634	33%	0.331	S	S	*	.	H	α-helix	trans	-58.3	-46.5	179.1	-69.8	173.1	0	0	0	112.4	V357 F358	V357-L361 PolarHBondContact O-N 3.21Å; F358-L361 PolarHBondContact O-N 3.02Å
362	G	90.9	Very high	91.6	Very high	35 Å²	35	61.4 Å²	61.4	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-74	-40.7	177.1	0	0	0	0	0	113.5	F358 I360 A365 M366	F358-G362 PolarHBondContact O-N 3.21Å; F358-G362 VanDerWaalsContact O-N 3.17Å; I360-G362 PolarHBondContact O-N 2.79Å; G362-A365 PolarHBondContact O-N 2.78Å; G362-M366 WeakPolarHBondContact O-CG 3.46Å; G362-M366 PolarHBondContact O-N 2.88Å
363	G	88.9	Confident	91.7	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-63.3	-42	-178.7	0	0	0	0	0	112.7	F359 I360 M366 F367	F359-G363 VanDerWaalsContact O-CA 3.27Å; F359-G363 WeakPolarHBondContact O-CA 3.29Å; F359-G363 PolarHBondContact O-N 2.86Å; I360-G363 PolarHBondContact O-N 3.41Å; G363-M366 PolarHBondContact O-N 3.3Å; G363-F367 VanDerWaalsContact O-CB 3.26Å; G363-F367 WeakPolarHBondContact O-CB 3.45Å; G363-F367 PolarHBondContact O-N 3.49Å
364	L	90.5	Very high	91.7	Very high	66 Å²	66	58.8 Å²	58.8	35%	0.346	33%	0.333	S	S	.	.	H	α-helix	trans	-63.9	-43.9	175.4	-68.6	176.4	0	0	0	112	T339 I360 F367 A368	T339-L364 HydrophobicContact CG2-CD2 3.12Å; I360-L364 HydrophobicContact CG2-CD1 3.62Å; I360-L364 HydrophobicContact CG2-CG 4.05Å; I360-L364 WeakPolarHBondContact O-CB 3.43Å; I360-L364 WeakPolarHBondContact O-CG 3.32Å; I360-L364 PolarHBondContact O-N 2.99Å; L364-F367 PolarHBondContact O-N 2.58Å; L364-A368 WeakPolarHBondContact O-CB 3.35Å; L364-A368 PolarHBondContact O-N 3.35Å
365	A	91.3	Very high	91.6	Very high	62 Å²	62	57 Å²	57	51%	0.512	33%	0.332	S	S	.	.	H	α-helix	trans	-63.4	-42.1	178	0	0	0	0	0	112	G362 S369	G362-A365 PolarHBondContact O-N 2.78Å; A365-S369 WeakPolarHBondContact O-CB 3.03Å; A365-S369 PolarHBondContact O-N 2.81Å; A365-S369 PolarHBondContact O-OG 3.4Å
366	M	90.2	Very high	91.5	Very high	35 Å²	35	61 Å²	61	17%	0.172	36%	0.355	C	S	.	.	H	α-helix	trans	-67.5	-45.5	175.5	-71.6	-172.4	-54.8	0	0	112.1	V297 M337 G362 G363 A368 S369 Y370	V297-M366 HydrophobicContact CB-CE 4.32Å; V297-M366 HydrophobicContact CB-SD 4.38Å; V297-M366 HydrophobicContact CG1-CE 3.54Å; V297-M366 HydrophobicContact CG1-SD 4Å; V297-M366 HydrophobicContact CG2-SD 4.4Å; M337-M366 HydrophobicContact CE-CE 3.87Å; G362-M366 WeakPolarHBondContact O-CG 3.46Å; G362-M366 PolarHBondContact O-N 2.88Å; G363-M366 PolarHBondContact O-N 3.3Å; M366-A368 PolarHBondContact O-N 3.19Å; M366-S369 PolarHBondContact O-N 2.99Å; M366-S369 PolarHBondContact O-OG 3.19Å; M366-Y370 WeakPolarHBondContact O-CB 3.43Å; M366-Y370 PolarHBondContact O-N 3.47Å
367	F	89.7	Confident	91.4	Very high	71 Å²	71	62.2 Å²	62.2	31%	0.311	36%	0.361	S	S	.	.	H	α-helix	trans	-63.3	-43.6	-179.2	-170.2	-89	0	0	0	111.4	F294 M337 G363 L364 S369 V371	F294-F367 HydrophobicContact CE2-CD2 4.21Å; F294-F367 HydrophobicContact CZ-CD2 4.34Å; M337-F367 HydrophobicContact CB-CD2 4.33Å; G363-F367 VanDerWaalsContact O-CB 3.26Å; G363-F367 WeakPolarHBondContact O-CB 3.45Å; G363-F367 PolarHBondContact O-N 3.49Å; L364-F367 PolarHBondContact O-N 2.58Å; F367-S369 VanDerWaalsContact C-N 3.29Å; F367-S369 PolarHBondContact O-N 3.03Å; F367-V371 HydrophobicContact CD1-CG2 4.41Å; F367-V371 HydrophobicContact CD2-CG2 3.74Å; F367-V371 HydrophobicContact CE1-CG2 4.42Å; F367-V371 HydrophobicContact CE2-CG2 3.76Å; F367-V371 HydrophobicContact CG-CG2 4.08Å; F367-V371 HydrophobicContact CZ-CG2 4.1Å; F367-V371 WeakPolarHBondContact O-CB 3.31Å; F367-V371 WeakPolarHBondContact O-CG2 3.4Å; F367-V371 PolarHBondContact O-N 2.66Å
368	A	90	Very high	91.2	Very high	70 Å²	70	63.4 Å²	63.4	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-67.9	-23.9	180	0	0	0	0	0	114.1	L364 M366 P372	L364-A368 WeakPolarHBondContact O-CB 3.35Å; L364-A368 PolarHBondContact O-N 3.35Å; M366-A368 PolarHBondContact O-N 3.19Å; A368-P372 WeakPolarHBondContact O-CD 3.34Å; A368-P372 WeakPolarHBondContact O-CG 3.27Å
369	S	92.1	Very high	90.7	Very high	55 Å²	55	59.7 Å²	59.7	39%	0.385	36%	0.363	S	S	.	.	H	α-helix	trans	-97.2	-47.9	179.6	52.5	0	0	0	0	112.6	A365 M366 F367 E373	A365-S369 WeakPolarHBondContact O-CB 3.03Å; A365-S369 PolarHBondContact O-N 2.81Å; A365-S369 PolarHBondContact O-OG 3.4Å; M366-S369 PolarHBondContact O-N 2.99Å; M366-S369 PolarHBondContact O-OG 3.19Å; F367-S369 VanDerWaalsContact C-N 3.29Å; F367-S369 PolarHBondContact O-N 3.03Å; S369-E373 PolarHBondContact O-N 3.25Å
370	Y	91.7	Very high	90	Very high	54 Å²	54	62.6 Å²	62.6	21%	0.212	39%	0.387	C	S	.	.	H	α-helix	trans	-78.6	-37.3	-170.4	-67.8	4	0	0	0	112.5	L290 I293 F294 M366 E373 I374	L290-Y370 HydrophobicContact CD2-CD1 3.77Å; L290-Y370 HydrophobicContact CD2-CD2 4.29Å; L290-Y370 HydrophobicContact CD2-CE1 4.02Å; L290-Y370 HydrophobicContact CD2-CG 3.93Å; I293-Y370 HydrophobicContact CB-CE2 4.18Å; I293-Y370 HydrophobicContact CG2-CE2 3.7Å; F294-Y370 HydrophobicContact CB-CD2 4.48Å; M366-Y370 WeakPolarHBondContact O-CB 3.43Å; M366-Y370 PolarHBondContact O-N 3.47Å; Y370-E373 PolarHBondContact O-N 2.93Å; Y370-I374 WeakPolarHBondContact O-CB 3.26Å; Y370-I374 WeakPolarHBondContact O-CD1 2.98Å; Y370-I374 WeakPolarHBondContact O-CG1 3.39Å; Y370-I374 PolarHBondContact O-N 3.03Å
371	V	90.7	Very high	89.2	Confident	56 Å²	56	70 Å²	70	34%	0.339	41%	0.41	S	S	.	.	H	α-helix	trans	-66.3	-45.9	-176.9	178.4	0	0	0	0	112	F367 I374 A375	F367-V371 HydrophobicContact CD1-CG2 4.41Å; F367-V371 HydrophobicContact CD2-CG2 3.74Å; F367-V371 HydrophobicContact CE1-CG2 4.42Å; F367-V371 HydrophobicContact CE2-CG2 3.76Å; F367-V371 HydrophobicContact CG-CG2 4.08Å; F367-V371 HydrophobicContact CZ-CG2 4.1Å; F367-V371 WeakPolarHBondContact O-CB 3.31Å; F367-V371 WeakPolarHBondContact O-CG2 3.4Å; F367-V371 PolarHBondContact O-N 2.66Å; V371-I374 PolarHBondContact O-N 2.82Å; V371-A375 WeakPolarHBondContact O-CB 3.49Å; V371-A375 PolarHBondContact O-N 2.92Å
372	P	93.1	Very high	88.4	Confident	64 Å²	64	70.5 Å²	70.5	42%	0.416	41%	0.409	S	S	.	.	H	α-helix	trans	-61.2	-42.8	173.5	-25.3	36.8	0	0	0	113	A368 I374 A375 D376	A368-P372 WeakPolarHBondContact O-CD 3.34Å; A368-P372 WeakPolarHBondContact O-CG 3.27Å; P372-I374 PolarHBondContact O-N 2.67Å; P372-A375 WeakPolarHBondContact O-CB 3.33Å; P372-A375 PolarHBondContact O-N 3.28Å; P372-A375 VanDerWaalsContact O-N 3.11Å; P372-D376 PolarHBondContact O-N 3.25Å
373	E	93.6	Very high	88.1	Confident	60 Å²	60	74.7 Å²	74.7	28%	0.28	42%	0.417	S	S	.	.	H	α-helix	trans	-64.1	-41	179.4	-167.8	-180	166.6	0	0	111.8	R286 L290 S369 Y370 A375 D376 L377	R286-E373 IonicContact CZ-OE1 3.65Å; R286-E373 IonicContact NE-OE1 3.75Å; R286-E373 PolarHBondContact NE-OE1 3Å; R286-E373 IonicContact NE-OE2 3.31Å; R286-E373 IonicContact NH2-OE1 2.76Å; R286-E373 PolarHBondContact NH2-OE1 2.84Å; R286-E373 VanDerWaalsContact NH2-OE1 3.08Å; R286-E373 IonicContact NH2-OE2 2.65Å; R286-E373 PolarHBondContact NH2-OE2 3.44Å; R286-E373 VanDerWaalsContact NH2-OE2 3.12Å; L290-E373 HydrophobicContact CD1-CB 4.04Å; L290-E373 VanDerWaalsContact CD1-CD 3.49Å; L290-E373 HydrophobicContact CD1-CG 3.7Å; S369-E373 PolarHBondContact O-N 3.25Å; Y370-E373 PolarHBondContact O-N 2.93Å; E373-A375 VanDerWaalsContact C-N 3.33Å; E373-A375 PolarHBondContact O-N 3.48Å; E373-D376 PolarHBondContact O-N 3.4Å; E373-L377 HydrophobicContact CG-CD1 4.37Å; E373-L377 WeakPolarHBondContact O-CB 3.43Å; E373-L377 VanDerWaalsContact O-CG 3.28Å; E373-L377 WeakPolarHBondContact O-CG 3.18Å; E373-L377 PolarHBondContact O-N 3.26Å
374	I	92	Very high	88.1	Confident	29 Å²	29	76.4 Å²	76.4	15%	0.149	42%	0.424	C	S	.	.	H	α-helix	trans	-61	-42.8	172.7	-71	166.3	0	0	0	110.6	L287 L290 V291 Y370 V371 P372 L377 I378	L287-I374 HydrophobicContact CD1-CB 4.43Å; L287-I374 HydrophobicContact CD1-CG1 4.3Å; L287-I374 HydrophobicContact CD1-CG2 3.95Å; L290-I374 HydrophobicContact CB-CD1 4.08Å; L290-I374 HydrophobicContact CB-CG1 3.89Å; L290-I374 HydrophobicContact CD1-CG1 4.1Å; V291-I374 HydrophobicContact CG2-CD1 4.14Å; Y370-I374 WeakPolarHBondContact O-CB 3.26Å; Y370-I374 WeakPolarHBondContact O-CD1 2.98Å; Y370-I374 WeakPolarHBondContact O-CG1 3.39Å; Y370-I374 PolarHBondContact O-N 3.03Å; V371-I374 PolarHBondContact O-N 2.82Å; P372-I374 PolarHBondContact O-N 2.67Å; I374-L377 PolarHBondContact O-N 2.87Å; I374-I378 HydrophobicContact CG2-CD1 3.74Å; I374-I378 VanDerWaalsContact O-CG1 3.29Å; I374-I378 WeakPolarHBondContact O-CG1 3.36Å; I374-I378 PolarHBondContact O-N 3.42Å; I374-I378 VanDerWaalsContact O-N 3.07Å
375	A	90.9	Very high	87.8	Confident	57 Å²	57	74.4 Å²	74.4	47%	0.471	42%	0.419	S	S	.	.	H	α-helix	trans	-64.1	-42.4	179.5	0	0	0	0	0	112.2	V371 P372 E373 I378 G379	V371-A375 WeakPolarHBondContact O-CB 3.49Å; V371-A375 PolarHBondContact O-N 2.92Å; P372-A375 WeakPolarHBondContact O-CB 3.33Å; P372-A375 PolarHBondContact O-N 3.28Å; P372-A375 VanDerWaalsContact O-N 3.11Å; E373-A375 VanDerWaalsContact C-N 3.33Å; E373-A375 PolarHBondContact O-N 3.48Å; A375-I378 PolarHBondContact O-N 3.47Å; A375-G379 PolarHBondContact O-N 3.02Å
376	D	91.2	Very high	87.6	Confident	120 Å²	120	73.7 Å²	73.7	64%	0.642	42%	0.418	S	S	*	.	H	α-helix	trans	-65.8	-42.8	177.5	-72.4	-18.8	0	0	0	111.8	P372 E373 I378 G379 S380	P372-D376 PolarHBondContact O-N 3.25Å; E373-D376 PolarHBondContact O-N 3.4Å; D376-I378 VanDerWaalsContact C-N 3.35Å; D376-I378 PolarHBondContact O-N 2.97Å; D376-G379 PolarHBondContact O-N 3.42Å; D376-S380 PolarHBondContact O-N 3.43Å
377	L	89.8	Confident	87.5	Confident	39 Å²	39	78.4 Å²	78.4	20%	0.204	44%	0.439	C	S	.	.	H	α-helix	trans	-62.1	-41.4	177.3	-72.9	170.8	0	0	0	111.9	R286 L287 L290 E373 I374 S380	R286-L377 HydrophobicContact CB-CD1 4.32Å; R286-L377 HydrophobicContact CG-CD1 4Å; L287-L377 HydrophobicContact CB-CD1 4.23Å; L287-L377 HydrophobicContact CD1-CB 4.46Å; L290-L377 HydrophobicContact CD1-CD1 4.04Å; E373-L377 HydrophobicContact CG-CD1 4.37Å; E373-L377 WeakPolarHBondContact O-CB 3.43Å; E373-L377 VanDerWaalsContact O-CG 3.28Å; E373-L377 WeakPolarHBondContact O-CG 3.18Å; E373-L377 PolarHBondContact O-N 3.26Å; I374-L377 PolarHBondContact O-N 2.87Å; L377-S380 PolarHBondContact O-OG 3.41Å
378	I	88.6	Confident	87.6	Confident	112 Å²	112	75 Å²	75	57%	0.574	43%	0.425	S	S	*	.	H	α-helix	trans	-71.3	-35.2	175.6	-65.2	169.4	0	0	0	111.2	L287 I374 A375 D376	L287-I378 HydrophobicContact CD1-CD1 4.46Å; L287-I378 HydrophobicContact CD1-CG1 4.26Å; L287-I378 HydrophobicContact CD2-CG1 4.43Å; I374-I378 HydrophobicContact CG2-CD1 3.74Å; I374-I378 VanDerWaalsContact O-CG1 3.29Å; I374-I378 WeakPolarHBondContact O-CG1 3.36Å; I374-I378 PolarHBondContact O-N 3.42Å; I374-I378 VanDerWaalsContact O-N 3.07Å; A375-I378 PolarHBondContact O-N 3.47Å; D376-I378 VanDerWaalsContact C-N 3.35Å; D376-I378 PolarHBondContact O-N 2.97Å
379	G	83.2	Confident	87.4	Confident	58 Å²	58	79.8 Å²	79.8	60%	0.598	43%	0.432	S	S	*	.	H	α-helix	trans	-72.9	-22.5	-178.6	0	0	0	0	0	114.8	A375 D376 R381	A375-G379 PolarHBondContact O-N 3.02Å; D376-G379 PolarHBondContact O-N 3.42Å; G379-R381 PolarHBondContact O-N 3.13Å
380	S	77.4	Confident	86.7	Confident	83 Å²	83	78.2 Å²	78.2	58%	0.58	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	6.8	-178.5	69.7	0	0	0	0	115.9	D376 L377 Q382	D376-S380 PolarHBondContact O-N 3.43Å; L377-S380 PolarHBondContact O-OG 3.41Å; S380-Q382 PolarHBondContact O-N 3.15Å
381	R	76	Confident	86	Confident	222 Å²	222	80.4 Å²	80.4	84%	0.838	44%	0.435	S	S	*	.			trans	-62.6	123.9	177.9	-173.9	176.7	176.9	-177.1	-1.3	110.5	G379 K383	G379-R381 PolarHBondContact O-N 3.13Å; R381-K383 PolarHBondContact O-N 3.31Å
382	Q	75.1	Confident	85.2	Confident	132 Å²	132	84.7 Å²	84.7	62%	0.617	46%	0.456	S	S	*	.			trans	-58.7	108.5	175.2	-69.7	179.5	-16.4	0	0	110.8	S380 Y384 G385	S380-Q382 PolarHBondContact O-N 3.15Å; Q382-Y384 VanDerWaalsContact C-N 3.33Å; Q382-Y384 PolarHBondContact O-N 3.15Å; Q382-G385 PolarHBondContact O-N 3.48Å
383	K	84.7	Confident	84.3	Confident	122 Å²	122	85.1 Å²	85.1	53%	0.53	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-39.7	-179.3	-179.4	-180	173.1	-172.8	0	112.6	R381 E440	R381-K383 PolarHBondContact O-N 3.31Å; K383-E440 IonicContact NZ-OE1 3.55Å; K383-E440 PolarHBondContact NZ-OE1 3.35Å; K383-E440 IonicContact NZ-OE2 3.03Å; K383-E440 PolarHBondContact NZ-OE2 3.01Å
384	Y	88.5	Confident	83.7	Confident	38 Å²	38	85.3 Å²	85.3	15%	0.149	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	27.6	-176.3	-57.2	-69.7	0	0	0	113	Q382 P434 P435 E440 F452 Q454	Q382-Y384 VanDerWaalsContact C-N 3.33Å; Q382-Y384 PolarHBondContact O-N 3.15Å; Y384-P434 HydrophobicContact CD2-CB 4.47Å; Y384-P435 HydrophobicContact CD2-CG 4.23Å; Y384-P435 HydrophobicContact CE1-CG 4.19Å; Y384-P435 VanDerWaalsContact CE2-CD 3.41Å; Y384-P435 HydrophobicContact CE2-CG 3.54Å; Y384-E440 WeakPolarHBondContact OH-CG 3.37Å; Y384-E440 PolarHBondContact OH-OE2 3.49Å; Y384-F452 AromaticContact CD1-CD1 3.69Å; Y384-F452 HydrophobicContact CD1-CD1 3.69Å; Y384-F452 HydrophobicContact CD1-CE1 4.49Å; Y384-F452 HydrophobicContact CD2-CD1 4.27Å; Y384-F452 HydrophobicContact CD2-CE1 4.32Å; Y384-F452 HydrophobicContact CE1-CD1 4.33Å; Y384-F452 AromaticContact CG-CD1 3.65Å; Y384-F452 HydrophobicContact CG-CD1 3.65Å; Y384-F452 HydrophobicContact CG-CE1 4.03Å; Y384-Q454 PolarHBondContact O-N 3.25Å
385	G	84.5	Confident	83.4	Confident	23 Å²	23	90.2 Å²	90.2	24%	0.237	49%	0.488	C	S	.	.			trans	-79.6	-161.8	171	0	0	0	0	0	112.6	Q382	Q382-G385 PolarHBondContact O-N 3.48Å
386	G	87.3	Confident	83.4	Confident	48 Å²	48	87.6 Å²	87.6	50%	0.495	47%	0.467	S	S	.	.	S	Bend	trans	83.9	-167.9	175.9	0	0	0	0	0	114.3	R465	G386-R465 PolarHBondContact O-NE 3.22Å; G386-R465 PolarHBondContact O-NH2 2.96Å
387	E	88.5	Confident	83.5	Confident	133 Å²	133	81.9 Å²	81.9	62%	0.621	44%	0.436	S	S	*	.			trans	-125.8	143.9	-174.4	-63.8	179.9	-178.8	0	0	110.6	K389 R465	E387-K389 PolarHBondContact O-N 2.8Å; E387-R465 WeakPolarHBondContact CA-O 3.4Å; E387-R465 HydrophobicContact CG-CB 4.28Å; E387-R465 HydrophobicContact CG-CG 4.07Å
388	Y	89.9	Confident	83.8	Confident	1 Å²	1	80 Å²	80	0%	0.004	43%	0.426	C	S	.	.			trans	-66	126.1	175.4	174.8	-112.4	0	0	0	110.6	A390 H396 E426 V428 E451 F453 R465 K467	Y388-A390 HydrophobicContact CD1-CB 4.27Å; Y388-A390 HydrophobicContact CE1-CB 3.81Å; Y388-A390 PolarHBondContact O-N 2.95Å; Y388-H396 AromaticContact CD1-CD2 3.86Å; Y388-H396 AromaticContact CD1-NE2 3.78Å; Y388-H396 HydrophobicContact CE1-CB 3.84Å; Y388-H396 AromaticContact CE1-CD2 3.62Å; Y388-H396 AromaticContact CE1-CE1 3.73Å; Y388-H396 AromaticContact CE1-CG 3.38Å; Y388-H396 AromaticContact CE1-ND1 3.49Å; Y388-H396 WeakPolarHBondContact CE1-ND1 3.29Å; Y388-H396 AromaticContact CE1-NE2 3.8Å; Y388-H396 AromaticContact CZ-CG 3.88Å; Y388-H396 WeakPolarHBondContact OH-CB 3.31Å; Y388-E426 WeakPolarHBondContact CE2-OE2 3.3Å; Y388-E426 PolarHBondContact OH-OE2 3.4Å; Y388-V428 HydrophobicContact CD1-CG2 4.47Å; Y388-V428 HydrophobicContact CD2-CG2 3.65Å; Y388-V428 HydrophobicContact CE1-CG2 4.49Å; Y388-V428 HydrophobicContact CE2-CG2 3.69Å; Y388-V428 HydrophobicContact CG-CG2 4.08Å; Y388-E451 WeakPolarHBondContact CD2-OE2 3.39Å; Y388-F453 HydrophobicContact CD2-CE2 4.26Å; Y388-R465 PolarHBondContact N-O 3.35Å; Y388-K467 HydrophobicContact CD1-CB 4.46Å; Y388-K467 HydrophobicContact CD1-CD 4.19Å; Y388-K467 VanDerWaalsContact O-CD 3.25Å; Y388-K467 WeakPolarHBondContact O-CD 3.48Å; Y388-K467 WeakPolarHBondContact O-CE 3.45Å; Y388-K467 PolarHBondContact O-NZ 3.49Å
389	K	86.8	Confident	84.1	Confident	170 Å²	170	74.7 Å²	74.7	74%	0.739	40%	0.399	S	S	*	.			trans	-96.2	78.7	179.6	-71	-174.9	-178	176.2	0	110.8	E387 E391	E387-K389 PolarHBondContact O-N 2.8Å; K389-E391 PolarHBondContact O-N 2.94Å; K389-E391 VanDerWaalsContact O-N 3.15Å
390	A	76.7	Confident	84.7	Confident	21 Å²	21	72 Å²	72	17%	0.174	37%	0.371	C	S	.	.			trans	-45	121	171.6	0	0	0	0	0	112.8	Y388 K467 H489	Y388-A390 HydrophobicContact CD1-CB 4.27Å; Y388-A390 HydrophobicContact CE1-CB 3.81Å; Y388-A390 PolarHBondContact O-N 2.95Å; A390-K467 HydrophobicContact CB-CD 3.78Å; A390-H489 HydrophobicContact CB-CB 3.69Å
391	E	77.5	Confident	85.5	Confident	101 Å²	101	68.3 Å²	68.3	47%	0.472	35%	0.346	S	S	.	.			trans	-85.3	151.3	173.4	-64.1	-169.7	162.1	0	0	111	K389 G393 K394	K389-E391 PolarHBondContact O-N 2.94Å; K389-E391 VanDerWaalsContact O-N 3.15Å; E391-G393 PolarHBondContact O-N 3.37Å; E391-K394 HydrophobicContact CB-CB 4.5Å; E391-K394 HydrophobicContact CB-CD 4.32Å; E391-K394 WeakPolarHBondContact OE2-CD 3.45Å; E391-K394 WeakPolarHBondContact OE2-CE 3.48Å; E391-K394 IonicContact OE2-NZ 3.78Å; E391-K394 PolarHBondContact OE2-NZ 3.1Å
392	N	73.1	Confident	86.3	Confident	145 Å²	145	61.4 Å²	61.4	78%	0.775	32%	0.32	S	S	*	.	S	Bend	trans	-71	119	178.7	-71.8	-13.1	0	0	0	110.8	H489	N392-H489 PolarHBondContact OD1-CE1 3.4Å; N392-H489 PolarHBondContact OD1-NE2 2.55Å; N392-H489 VanDerWaalsContact OD1-NE2 3.15Å
393	G	75.2	Confident	87.2	Confident	74 Å²	74	55.6 Å²	55.6	76%	0.763	29%	0.293	S	S	*	.	S	Bend	trans	99.6	-21.9	174.6	0	0	0	0	0	114.5	E391	E391-G393 PolarHBondContact O-N 3.37Å
394	K	80.3	Confident	87.5	Confident	63 Å²	63	51.3 Å²	51.3	27%	0.274	28%	0.278	S	S	.	.			trans	-83.7	140.3	171.4	-65.2	-172.5	179.7	165	0	110.7	E391 D424 E426	E391-K394 HydrophobicContact CB-CB 4.5Å; E391-K394 HydrophobicContact CB-CD 4.32Å; E391-K394 WeakPolarHBondContact OE2-CD 3.45Å; E391-K394 WeakPolarHBondContact OE2-CE 3.48Å; E391-K394 IonicContact OE2-NZ 3.78Å; E391-K394 PolarHBondContact OE2-NZ 3.1Å; K394-D424 HydrophobicContact CG-CB 4.4Å; K394-E426 HydrophobicContact CD-CG 4.25Å; K394-E426 WeakPolarHBondContact CD-OE1 3.43Å; K394-E426 IonicContact NZ-OE1 2.72Å; K394-E426 PolarHBondContact NZ-OE1 3.38Å
395	R	87	Confident	87.6	Confident	132 Å²	132	53.3 Å²	53.3	50%	0.498	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	156.3	170.6	-69.1	179.5	-70.6	165.8	-1.3	108.3	D424 V425 E426 D492	R395-D424 PolarHBondContact N-O 3.36Å; R395-V425 HydrophobicContact CB-CG2 4.09Å; R395-V425 CarbonylContact O-C 3.27Å; R395-V425 VanDerWaalsContact O-CA 3.3Å; R395-V425 WeakPolarHBondContact O-CA 3.1Å; R395-E426 PolarHBondContact O-N 3.32Å; R395-D492 HydrophobicContact CB-CB 4.46Å; R395-D492 IonicContact NH1-OD2 2.85Å
396	H	90.9	Very high	87.6	Confident	3 Å²	3	57.7 Å²	57.7	1%	0.014	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	148.7	173.6	74.5	-75.5	0	0	0	111.2	Y388 E426 V428 V466 A491 D492	Y388-H396 AromaticContact CD1-CD2 3.86Å; Y388-H396 AromaticContact CD1-NE2 3.78Å; Y388-H396 HydrophobicContact CE1-CB 3.84Å; Y388-H396 AromaticContact CE1-CD2 3.62Å; Y388-H396 AromaticContact CE1-CE1 3.73Å; Y388-H396 AromaticContact CE1-CG 3.38Å; Y388-H396 AromaticContact CE1-ND1 3.49Å; Y388-H396 WeakPolarHBondContact CE1-ND1 3.29Å; Y388-H396 AromaticContact CE1-NE2 3.8Å; Y388-H396 AromaticContact CZ-CG 3.88Å; Y388-H396 WeakPolarHBondContact OH-CB 3.31Å; H396-E426 CarbonylContact C-O 3.58Å; H396-E426 WeakPolarHBondContact CA-O 3.42Å; H396-E426 HydrophobicContact CB-CB 4.25Å; H396-V428 HydrophobicContact CB-CG2 4.27Å; H396-V466 PolarHBondContact NE2-O 3.39Å; H396-A491 PolarHBondContact CE1-N 3.27Å; H396-A491 WeakPolarHBondContact O-CA 3.46Å; H396-D492 PolarHBondContact O-N 3.16Å
397	I	93.4	Very high	87.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	149.2	171.2	60.3	160.8	0	0	0	109.8	V399 F411 F415 V425 E426 V427 V428 A493 L495 Y1008	I397-V399 HydrophobicContact CD1-CG2 3.95Å; I397-V399 HydrophobicContact CG1-CG2 4.43Å; I397-F411 HydrophobicContact CD1-CZ 4.01Å; I397-F415 HydrophobicContact CD1-CD2 4.37Å; I397-F415 HydrophobicContact CD1-CE1 3.97Å; I397-F415 HydrophobicContact CD1-CE2 3.57Å; I397-F415 HydrophobicContact CD1-CZ 3.36Å; I397-F415 HydrophobicContact CG1-CZ 4.16Å; I397-V425 HydrophobicContact CG1-CG1 4.14Å; I397-V425 HydrophobicContact CG2-CG1 3.85Å; I397-E426 PolarHBondContact N-O 2.85Å; I397-V427 HydrophobicContact CD1-CG1 4.16Å; I397-V427 HydrophobicContact CD1-CG2 4.07Å; I397-V427 HydrophobicContact CG1-CB 4.32Å; I397-V427 HydrophobicContact CG1-CG1 4.22Å; I397-V427 HydrophobicContact CG1-CG2 4.11Å; I397-V428 PolarHBondContact O-N 3.06Å; I397-A493 WeakPolarHBondContact CA-O 3.41Å; I397-A493 HydrophobicContact CG2-CB 4.45Å; I397-L495 HydrophobicContact CD1-CD1 3.72Å; I397-L495 HydrophobicContact CD1-CG 4.43Å; I397-Y1008 HydrophobicContact CG2-CD2 4.3Å; I397-Y1008 HydrophobicContact CG2-CE1 4.32Å; I397-Y1008 HydrophobicContact CG2-CE2 3.55Å
398	V	95	Very high	87.8	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.6	175.9	178.8	0	0	0	0	108.9	V428 V430 V466 V468 A491 A493 C494 L495	V398-V428 CarbonylContact C-O 3.28Å; V398-V428 WeakPolarHBondContact CA-O 3.09Å; V398-V430 HydrophobicContact CG1-CG2 3.91Å; V398-V466 HydrophobicContact CG1-CG2 4.26Å; V398-V466 HydrophobicContact CG2-CB 4.35Å; V398-V466 HydrophobicContact CG2-CG2 4.14Å; V398-V468 HydrophobicContact CG2-CG2 4.13Å; V398-A491 HydrophobicContact CG2-CB 3.96Å; V398-A493 PolarHBondContact N-O 2.65Å; V398-C494 CarbonylContact O-C 3.48Å; V398-C494 VanDerWaalsContact O-CA 3.24Å; V398-C494 WeakPolarHBondContact O-CA 3.39Å; V398-C494 PolarHBondContact O-SG 3.22Å; V398-L495 PolarHBondContact O-N 2.83Å
399	V	95.6	Very high	87.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	125.8	177.8	-171.7	0	0	0	0	109.3	I397 I403 F411 V427 V428 F429 V430 L495 L497	I397-V399 HydrophobicContact CD1-CG2 3.95Å; I397-V399 HydrophobicContact CG1-CG2 4.43Å; V399-I403 HydrophobicContact CG1-CD1 4.11Å; V399-F411 HydrophobicContact CG2-CE1 4.02Å; V399-F411 HydrophobicContact CG2-CZ 4.12Å; V399-V427 HydrophobicContact CG2-CG1 3.6Å; V399-V428 PolarHBondContact N-O 3.35Å; V399-F429 HydrophobicContact CB-CD1 3.68Å; V399-F429 HydrophobicContact CB-CE1 3.68Å; V399-F429 HydrophobicContact CB-CG 4.48Å; V399-F429 HydrophobicContact CB-CZ 4.47Å; V399-F429 HydrophobicContact CG1-CD1 3.88Å; V399-F429 HydrophobicContact CG1-CE1 3.59Å; V399-F429 HydrophobicContact CG2-CE1 4.23Å; V399-F429 WeakPolarHBondContact O-CA 3.38Å; V399-V430 PolarHBondContact O-N 3.43Å; V399-L495 WeakPolarHBondContact CA-O 3.18Å; V399-L495 HydrophobicContact CG1-CB 4.39Å; V399-L495 HydrophobicContact CG2-CB 4.23Å; V399-L495 HydrophobicContact CG2-CD1 4.18Å; V399-L495 HydrophobicContact CG2-CG 4.49Å; V399-L497 HydrophobicContact CG1-CD1 3.89Å; V399-L497 HydrophobicContact CG1-CG 4.06Å
400	C	95.4	Very high	87.6	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.007	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	-178.9	-178.6	71.1	0	0	0	0	111.4	V430 V457 L495 I496 L497	C400-V430 HydrophobicContact CB-CB 4.5Å; C400-V457 HydrophobicContact CB-CG1 3.58Å; C400-L495 PolarHBondContact N-O 3.05Å; C400-I496 WeakPolarHBondContact O-CA 3.3Å; C400-L497 PolarHBondContact O-N 2.86Å
401	G	93.4	Very high	88.1	Confident	5 Å²	5	45 Å²	45	5%	0.052	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	100.8	-131.7	-176.4	0	0	0	0	0	111.7	I403 H431 L497	G401-I403 PolarHBondContact O-N 2.99Å; G401-H431 PolarHBondContact O-CE1 3.06Å; G401-H431 PolarHBondContact O-ND1 3.46Å; G401-H431 VanDerWaalsContact O-ND1 3.12Å; G401-L497 WeakPolarHBondContact CA-O 3.14Å
402	Y	93.4	Very high	88.6	Confident	78 Å²	78	40.3 Å²	40.3	31%	0.306	21%	0.209	S	C	.	.	S	Bend	trans	-83.3	102.3	177.9	-169.6	-111.8	0	0	0	110.8	T404 S407 L497 N499	Y402-T404 HydrophobicContact CD1-CG2 4.11Å; Y402-T404 HydrophobicContact CE1-CG2 3.53Å; Y402-T404 HydrophobicContact CE2-CG2 3.97Å; Y402-T404 VanDerWaalsContact CZ-CG2 3.45Å; Y402-S407 PolarHBondContact O-OG 3.48Å; Y402-L497 PolarHBondContact N-O 3.24Å; Y402-N499 HydrophobicContact CD1-CB 3.87Å; Y402-N499 HydrophobicContact CD2-CB 3.66Å; Y402-N499 HydrophobicContact CE1-CB 4.11Å; Y402-N499 HydrophobicContact CE2-CB 3.93Å; Y402-N499 HydrophobicContact CG-CB 3.62Å
403	I	93.9	Very high	89.2	Confident	9 Å²	9	38.5 Å²	38.5	5%	0.046	20%	0.196	C	C	.	.			trans	-110.6	108.7	-177.2	-54.4	-53.2	0	0	0	108.8	V399 G401 V408 F429 H431 L439 L497	V399-I403 HydrophobicContact CG1-CD1 4.11Å; G401-I403 PolarHBondContact O-N 2.99Å; I403-V408 HydrophobicContact CG2-CG2 3.65Å; I403-F429 HydrophobicContact CD1-CD1 3.9Å; I403-F429 HydrophobicContact CD1-CE1 4.32Å; I403-F429 HydrophobicContact CG2-CD1 4.21Å; I403-H431 HydrophobicContact CB-CB 4Å; I403-H431 HydrophobicContact CG1-CB 3.92Å; I403-L439 HydrophobicContact CG2-CD2 4.12Å; I403-L497 HydrophobicContact CD1-CD1 4.07Å
404	T	91.4	Very high	89.5	Confident	33 Å²	33	35.7 Å²	35.7	20%	0.202	16%	0.163	C	C	.	.			trans	-136	168.3	177.5	59.6	0	0	0	0	110.2	Y402 E406 S407 V408	Y402-T404 HydrophobicContact CD1-CG2 4.11Å; Y402-T404 HydrophobicContact CE1-CG2 3.53Å; Y402-T404 HydrophobicContact CE2-CG2 3.97Å; Y402-T404 VanDerWaalsContact CZ-CG2 3.45Å; T404-E406 VanDerWaalsContact C-N 3.35Å; T404-E406 PolarHBondContact O-N 3.26Å; T404-S407 PolarHBondContact N-OG 3.12Å; T404-S407 PolarHBondContact O-OG 3.29Å; T404-S407 VanDerWaalsContact O-OG 3.13Å; T404-S407 PolarHBondContact OG1-N 2.92Å; T404-S407 PolarHBondContact OG1-OG 2.91Å; T404-V408 VanDerWaalsContact O-CB 3.29Å; T404-V408 WeakPolarHBondContact O-CB 3.16Å; T404-V408 WeakPolarHBondContact O-CG2 3.45Å; T404-V408 PolarHBondContact O-N 3.21Å
405	Y	90.9	Very high	89.8	Confident	79 Å²	79	33 Å²	33	31%	0.31	15%	0.152	S	C	.	.	H	α-helix	trans	-54.2	-49	175.7	175.4	-98.1	0	0	0	112.5	S409 E438 L442	Y405-S409 WeakPolarHBondContact O-CB 3.16Å; Y405-S409 PolarHBondContact O-N 3.42Å; Y405-E438 HydrophobicContact CD2-CB 3.88Å; Y405-E438 HydrophobicContact CE2-CB 4.33Å; Y405-E438 HydrophobicContact CG-CB 4.27Å; Y405-L442 HydrophobicContact CD2-CD2 4.37Å; Y405-L442 HydrophobicContact CE2-CB 4.37Å; Y405-L442 HydrophobicContact CE2-CD2 4.4Å
406	E	84.9	Confident	89.8	Confident	116 Å²	116	28.3 Å²	28.3	54%	0.542	14%	0.136	S	C	.	.	H	α-helix	trans	-61.9	-53.6	-178.2	-65.4	171.7	177.1	0	0	112.2	T404 V408 S409 H410	T404-E406 VanDerWaalsContact C-N 3.35Å; T404-E406 PolarHBondContact O-N 3.26Å; E406-V408 VanDerWaalsContact C-N 3.33Å; E406-V408 PolarHBondContact O-N 3.3Å; E406-S409 PolarHBondContact O-N 2.63Å; E406-H410 PolarHBondContact O-CD2 3.42Å; E406-H410 PolarHBondContact O-N 2.88Å
407	S	87.9	Confident	89.4	Confident	20 Å²	20	30 Å²	30	14%	0.14	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-40.7	-178.7	54.4	0	0	0	0	112.3	Y402 T404 F411	Y402-S407 PolarHBondContact O-OG 3.48Å; T404-S407 PolarHBondContact N-OG 3.12Å; T404-S407 PolarHBondContact O-OG 3.29Å; T404-S407 VanDerWaalsContact O-OG 3.13Å; T404-S407 PolarHBondContact OG1-N 2.92Å; T404-S407 PolarHBondContact OG1-OG 2.91Å; S407-F411 VanDerWaalsContact O-CB 3.29Å; S407-F411 WeakPolarHBondContact O-CB 3.48Å; S407-F411 PolarHBondContact O-N 3.5Å; S407-F411 VanDerWaalsContact O-N 3.13Å
408	V	90.6	Very high	88.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-73.6	-37.2	178.6	176.3	0	0	0	0	111.4	I403 T404 E406 F411 L412 F429 L439 L442 F443	I403-V408 HydrophobicContact CG2-CG2 3.65Å; T404-V408 VanDerWaalsContact O-CB 3.29Å; T404-V408 WeakPolarHBondContact O-CB 3.16Å; T404-V408 WeakPolarHBondContact O-CG2 3.45Å; T404-V408 PolarHBondContact O-N 3.21Å; E406-V408 VanDerWaalsContact C-N 3.33Å; E406-V408 PolarHBondContact O-N 3.3Å; V408-F411 PolarHBondContact O-N 2.82Å; V408-L412 HydrophobicContact CG1-CD1 3.61Å; V408-L412 HydrophobicContact CG1-CG 3.92Å; V408-L412 VanDerWaalsContact O-CB 3.31Å; V408-L412 WeakPolarHBondContact O-CB 3.41Å; V408-L412 VanDerWaalsContact O-CG 3.27Å; V408-L412 WeakPolarHBondContact O-CG 3.4Å; V408-L412 PolarHBondContact O-N 2.86Å; V408-F429 HydrophobicContact CG1-CE1 4.11Å; V408-F429 HydrophobicContact CG1-CE2 4.17Å; V408-F429 HydrophobicContact CG1-CZ 3.66Å; V408-F429 HydrophobicContact CG2-CD1 4.33Å; V408-F429 HydrophobicContact CG2-CE1 3.79Å; V408-F429 HydrophobicContact CG2-CZ 4.22Å; V408-L439 HydrophobicContact CB-CD1 3.84Å; V408-L439 HydrophobicContact CG1-CD1 3.88Å; V408-L439 HydrophobicContact CG2-CD1 3.99Å; V408-L442 HydrophobicContact CB-CD2 4.27Å; V408-L442 HydrophobicContact CG1-CD2 3.76Å; V408-F443 HydrophobicContact CG1-CE1 3.95Å
409	S	88.2	Confident	87.4	Confident	18 Å²	18	42.6 Å²	42.6	13%	0.126	21%	0.205	C	C	.	.	H	α-helix	trans	-62.2	-51.2	178.1	-175.3	0	0	0	0	111.1	Y405 E406 F411 L412 Q413	Y405-S409 WeakPolarHBondContact O-CB 3.16Å; Y405-S409 PolarHBondContact O-N 3.42Å; E406-S409 PolarHBondContact O-N 2.63Å; S409-F411 PolarHBondContact O-N 2.93Å; S409-L412 PolarHBondContact O-N 3.4Å; S409-Q413 WeakPolarHBondContact O-CB 3.47Å; S409-Q413 VanDerWaalsContact O-CG 3.25Å; S409-Q413 WeakPolarHBondContact O-CG 3.43Å; S409-Q413 PolarHBondContact O-N 3.02Å
410	H	83.9	Confident	86.4	Confident	64 Å²	64	44.7 Å²	44.7	30%	0.296	21%	0.213	S	C	.	.	H	α-helix	trans	-60.5	-45.1	176.7	-71	-61.8	0	0	0	111.6	E406 L412 D414 D1001	E406-H410 PolarHBondContact O-CD2 3.42Å; E406-H410 PolarHBondContact O-N 2.88Å; H410-L412 PolarHBondContact O-N 3.22Å; H410-D414 PolarHBondContact O-N 2.89Å; H410-D1001 HydrophobicContact CB-CB 4.36Å
411	F	88	Confident	85.1	Confident	3 Å²	3	48.5 Å²	48.5	1%	0.013	23%	0.233	C	C	.	.	H	α-helix	trans	-60.5	-46.3	177.1	174.6	-101.3	0	0	0	112.7	I397 V399 S407 V408 S409 F415 V427 F429 L495 M1004	I397-F411 HydrophobicContact CD1-CZ 4.01Å; V399-F411 HydrophobicContact CG2-CE1 4.02Å; V399-F411 HydrophobicContact CG2-CZ 4.12Å; S407-F411 VanDerWaalsContact O-CB 3.29Å; S407-F411 WeakPolarHBondContact O-CB 3.48Å; S407-F411 PolarHBondContact O-N 3.5Å; S407-F411 VanDerWaalsContact O-N 3.13Å; V408-F411 PolarHBondContact O-N 2.82Å; S409-F411 PolarHBondContact O-N 2.93Å; F411-F415 HydrophobicContact CD1-CB 4.44Å; F411-F415 HydrophobicContact CE1-CB 4.04Å; F411-F415 HydrophobicContact CE1-CD2 4.28Å; F411-F415 HydrophobicContact CE1-CG 4.06Å; F411-F415 HydrophobicContact CE2-CB 4.26Å; F411-F415 AromaticContact CE2-CD2 3.86Å; F411-F415 HydrophobicContact CE2-CD2 3.86Å; F411-F415 HydrophobicContact CE2-CG 4.31Å; F411-F415 HydrophobicContact CZ-CB 3.94Å; F411-F415 HydrophobicContact CZ-CD1 4.47Å; F411-F415 AromaticContact CZ-CD2 3.47Å; F411-F415 HydrophobicContact CZ-CD2 3.47Å; F411-F415 VanDerWaalsContact CZ-CD2 3.47Å; F411-F415 HydrophobicContact CZ-CE2 4.07Å; F411-F415 AromaticContact CZ-CG 3.71Å; F411-F415 HydrophobicContact CZ-CG 3.71Å; F411-F415 WeakPolarHBondContact O-CB 3.39Å; F411-F415 PolarHBondContact O-N 3.06Å; F411-V427 HydrophobicContact CE1-CG1 4.02Å; F411-F429 HydrophobicContact CD1-CZ 4.15Å; F411-F429 HydrophobicContact CE1-CZ 4.36Å; F411-L495 HydrophobicContact CE2-CD1 3.51Å; F411-L495 HydrophobicContact CZ-CD1 3.49Å; F411-L495 VanDerWaalsContact CZ-CD1 3.49Å; F411-M1004 HydrophobicContact CD2-CB 4.41Å; F411-M1004 HydrophobicContact CE2-CB 4.5Å
412	L	88.9	Confident	83.6	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-72.4	-34	-176.9	-71.3	-178.8	0	0	0	113	V408 S409 H410 D414 F415 L416 F429 L442 V450	V408-L412 HydrophobicContact CG1-CD1 3.61Å; V408-L412 HydrophobicContact CG1-CG 3.92Å; V408-L412 VanDerWaalsContact O-CB 3.31Å; V408-L412 WeakPolarHBondContact O-CB 3.41Å; V408-L412 VanDerWaalsContact O-CG 3.27Å; V408-L412 WeakPolarHBondContact O-CG 3.4Å; V408-L412 PolarHBondContact O-N 2.86Å; S409-L412 PolarHBondContact O-N 3.4Å; H410-L412 PolarHBondContact O-N 3.22Å; L412-D414 VanDerWaalsContact C-N 3.29Å; L412-D414 PolarHBondContact O-N 3.5Å; L412-F415 PolarHBondContact O-N 3.49Å; L412-L416 HydrophobicContact CD2-CD1 3.93Å; L412-L416 HydrophobicContact CD2-CG 4.3Å; L412-L416 WeakPolarHBondContact O-CB 3.45Å; L412-L416 PolarHBondContact O-N 3.19Å; L412-F429 HydrophobicContact CD2-CE2 4.3Å; L412-F429 HydrophobicContact CD2-CZ 4.21Å; L412-F429 HydrophobicContact CG-CZ 4.44Å; L412-L442 HydrophobicContact CD1-CD2 4.17Å; L412-L442 HydrophobicContact CD1-CG 4.18Å; L412-V450 HydrophobicContact CD1-CG2 4.22Å; L412-V450 HydrophobicContact CD2-CG2 3.95Å
413	Q	84.1	Confident	82.3	Confident	107 Å²	107	54.5 Å²	54.5	50%	0.5	27%	0.271	S	S	.	.	H	α-helix	trans	-56.9	-44.6	175.5	-80.5	172.8	-16.7	0	0	111.4	S409 H417	S409-Q413 WeakPolarHBondContact O-CB 3.47Å; S409-Q413 VanDerWaalsContact O-CG 3.25Å; S409-Q413 WeakPolarHBondContact O-CG 3.43Å; S409-Q413 PolarHBondContact O-N 3.02Å; Q413-H417 WeakPolarHBondContact O-CB 3.46Å
414	D	82.4	Confident	81.5	Confident	15 Å²	15	59.4 Å²	59.4	8%	0.08	30%	0.298	C	S	.	.	H	α-helix	trans	-78.9	-44.7	176	-70.9	-47.4	0	0	0	111.9	H410 L412 L416 H417 R420 M585 S1002	H410-D414 PolarHBondContact O-N 2.89Å; L412-D414 VanDerWaalsContact C-N 3.29Å; L412-D414 PolarHBondContact O-N 3.5Å; D414-L416 PolarHBondContact O-N 2.97Å; D414-H417 PolarHBondContact O-N 3.33Å; D414-R420 PolarHBondContact O-NH1 2.84Å; D414-M585 HydrophobicContact CB-CE 3.82Å; D414-M585 WeakPolarHBondContact O-CE 3.5Å; D414-S1002 WeakPolarHBondContact OD2-CA 3.45Å; D414-S1002 WeakPolarHBondContact OD2-CB 3.47Å; D414-S1002 PolarHBondContact OD2-OG 3.25Å
415	F	86.5	Confident	81.3	Confident	7 Å²	7	58 Å²	58	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-40.3	-172.5	-166.6	-90.4	0	0	0	112.9	I397 F411 L412 R420 V425 V427 S1005 Y1008 F1009	I397-F415 HydrophobicContact CD1-CD2 4.37Å; I397-F415 HydrophobicContact CD1-CE1 3.97Å; I397-F415 HydrophobicContact CD1-CE2 3.57Å; I397-F415 HydrophobicContact CD1-CZ 3.36Å; I397-F415 HydrophobicContact CG1-CZ 4.16Å; F411-F415 HydrophobicContact CD1-CB 4.44Å; F411-F415 HydrophobicContact CE1-CB 4.04Å; F411-F415 HydrophobicContact CE1-CD2 4.28Å; F411-F415 HydrophobicContact CE1-CG 4.06Å; F411-F415 HydrophobicContact CE2-CB 4.26Å; F411-F415 AromaticContact CE2-CD2 3.86Å; F411-F415 HydrophobicContact CE2-CD2 3.86Å; F411-F415 HydrophobicContact CE2-CG 4.31Å; F411-F415 HydrophobicContact CZ-CB 3.94Å; F411-F415 HydrophobicContact CZ-CD1 4.47Å; F411-F415 AromaticContact CZ-CD2 3.47Å; F411-F415 HydrophobicContact CZ-CD2 3.47Å; F411-F415 VanDerWaalsContact CZ-CD2 3.47Å; F411-F415 HydrophobicContact CZ-CE2 4.07Å; F411-F415 AromaticContact CZ-CG 3.71Å; F411-F415 HydrophobicContact CZ-CG 3.71Å; F411-F415 WeakPolarHBondContact O-CB 3.39Å; F411-F415 PolarHBondContact O-N 3.06Å; L412-F415 PolarHBondContact O-N 3.49Å; F415-R420 PolarHBondContact O-NH1 3.41Å; F415-V425 HydrophobicContact CE1-CG1 4.16Å; F415-V425 HydrophobicContact CZ-CG1 3.94Å; F415-V427 HydrophobicContact CD1-CG2 3.72Å; F415-V427 HydrophobicContact CE1-CG2 3.55Å; F415-V427 HydrophobicContact CZ-CG2 4.41Å; F415-S1005 WeakPolarHBondContact CA-OG 3.48Å; F415-Y1008 AromaticContact CE2-CD1 3.46Å; F415-Y1008 HydrophobicContact CE2-CD1 3.46Å; F415-Y1008 VanDerWaalsContact CE2-CD1 3.46Å; F415-Y1008 AromaticContact CE2-CE1 3.82Å; F415-Y1008 HydrophobicContact CE2-CE1 3.82Å; F415-Y1008 HydrophobicContact CE2-CG 4.22Å; F415-Y1008 AromaticContact CZ-CD1 3.94Å; F415-Y1008 HydrophobicContact CZ-CD1 3.94Å; F415-Y1008 AromaticContact CZ-CE1 3.77Å; F415-Y1008 HydrophobicContact CZ-CE1 3.77Å; F415-F1009 AromaticContact CD2-CE2 3.91Å; F415-F1009 HydrophobicContact CD2-CE2 3.91Å; F415-F1009 HydrophobicContact CE2-CD2 4.5Å; F415-F1009 AromaticContact CE2-CE2 3.59Å; F415-F1009 HydrophobicContact CE2-CE2 3.59Å; F415-F1009 HydrophobicContact CE2-CZ 4.27Å; F415-F1009 AromaticContact CZ-CE2 3.98Å; F415-F1009 HydrophobicContact CZ-CE2 3.98Å; F415-F1009 HydrophobicContact CZ-CZ 4.19Å
416	L	86	Confident	81.3	Confident	32 Å²	32	55.1 Å²	55.1	17%	0.168	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	19.6	-177.3	-59.6	-179	0	0	0	113.2	L412 D414 H446 K449 V450	L412-L416 HydrophobicContact CD2-CD1 3.93Å; L412-L416 HydrophobicContact CD2-CG 4.3Å; L412-L416 WeakPolarHBondContact O-CB 3.45Å; L412-L416 PolarHBondContact O-N 3.19Å; D414-L416 PolarHBondContact O-N 2.97Å; L416-H446 HydrophobicContact CD1-CB 4.42Å; L416-K449 HydrophobicContact CD1-CB 4.29Å; L416-K449 HydrophobicContact CD1-CD 4.27Å; L416-K449 HydrophobicContact CD2-CB 4.44Å; L416-K449 HydrophobicContact CD2-CD 3.71Å; L416-V450 HydrophobicContact CD1-CG2 4.16Å
417	H	82.7	Confident	81.7	Confident	40 Å²	40	49.6 Å²	49.6	19%	0.185	25%	0.253	C	S	.	.			trans	-57.8	144	-179.4	-163.4	-93.4	0	0	0	112.3	Q413 D414 D419 R420 M585	Q413-H417 WeakPolarHBondContact O-CB 3.46Å; D414-H417 PolarHBondContact O-N 3.33Å; H417-D419 VanDerWaalsContact C-N 3.29Å; H417-D419 IonicContact CE1-OD2 2.99Å; H417-D419 PolarHBondContact CE1-OD2 3.45Å; H417-D419 WeakPolarHBondContact ND1-CB 3.39Å; H417-D419 PolarHBondContact ND1-N 2.93Å; H417-D419 VanDerWaalsContact ND1-N 3.19Å; H417-D419 IonicContact ND1-OD2 3.94Å; H417-D419 PolarHBondContact O-N 3.3Å; H417-R420 PolarHBondContact O-N 2.83Å; H417-M585 HydrophobicContact CB-CB 4.19Å; H417-M585 HydrophobicContact CB-SD 4.12Å
418	E	75.6	Confident	82	Confident	182 Å²	182	48.6 Å²	48.6	85%	0.85	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-29.8	-176.2	-63.2	-178.8	172.7	0	0	113.2	R420	E418-R420 PolarHBondContact O-N 3.18Å
419	D	71.9	Confident	82.2	Confident	82 Å²	82	48.6 Å²	48.6	44%	0.439	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-5.3	-179.7	-66.7	-24.7	0	0	0	113.4	H417	H417-D419 VanDerWaalsContact C-N 3.29Å; H417-D419 IonicContact CE1-OD2 2.99Å; H417-D419 PolarHBondContact CE1-OD2 3.45Å; H417-D419 WeakPolarHBondContact ND1-CB 3.39Å; H417-D419 PolarHBondContact ND1-N 2.93Å; H417-D419 VanDerWaalsContact ND1-N 3.19Å; H417-D419 IonicContact ND1-OD2 3.94Å; H417-D419 PolarHBondContact O-N 3.3Å
420	R	74.6	Confident	82.6	Confident	44 Å²	44	48 Å²	48	17%	0.166	24%	0.242	C	C	.	.	S	Bend	trans	-80.8	131.6	171.3	-71.1	-166.4	152.9	160.9	4.2	110.4	D414 F415 H417 E418 D422 M585 S1005 F1009	D414-R420 PolarHBondContact O-NH1 2.84Å; F415-R420 PolarHBondContact O-NH1 3.41Å; H417-R420 PolarHBondContact O-N 2.83Å; E418-R420 PolarHBondContact O-N 3.18Å; R420-D422 PolarHBondContact O-N 2.91Å; R420-M585 VanDerWaalsContact CD-SD 3.51Å; R420-M585 HydrophobicContact CG-SD 3.41Å; R420-M585 WeakPolarHBondContact CG-SD 3.44Å; R420-M585 PolarHBondContact NE-SD 3.41Å; R420-S1005 VanDerWaalsContact CZ-OG 3.23Å; R420-S1005 PolarHBondContact NH1-OG 2.91Å; R420-S1005 PolarHBondContact NH2-OG 3.12Å; R420-F1009 VanDerWaalsContact CZ-CE2 3.41Å
421	D	68.7	Low	83.1	Confident	80 Å²	80	47 Å²	47	43%	0.428	24%	0.237	S	C	.	.			trans	-43.9	137.1	167.3	-77.2	-6.9	0	0	0	109.2	V423 K680	D421-V423 VanDerWaalsContact C-N 3.27Å; D421-V423 WeakPolarHBondContact O-CG2 3.3Å; D421-V423 PolarHBondContact O-N 3.1Å; D421-K680 IonicContact OD2-NZ 3.37Å; D421-K680 PolarHBondContact OD2-NZ 3.11Å
422	D	60.6	Low	83.3	Confident	160 Å²	160	56.3 Å²	56.3	86%	0.856	27%	0.272	S	S	*	.			trans	-51.5	86.3	-176.6	-79.5	-40.5	0	0	0	111.9	R420 D424	R420-D422 PolarHBondContact O-N 2.91Å; D422-D424 PolarHBondContact O-N 3.02Å
423	V	67.3	Low	83.5	Confident	49 Å²	49	60.2 Å²	60.2	30%	0.297	30%	0.296	S	S	.	.			trans	-94.1	106.3	179	179.7	0	0	0	0	106.7	D421 V425 F1009	D421-V423 VanDerWaalsContact C-N 3.27Å; D421-V423 WeakPolarHBondContact O-CG2 3.3Å; D421-V423 PolarHBondContact O-N 3.1Å; V423-V425 HydrophobicContact CG1-CB 3.89Å; V423-V425 HydrophobicContact CG1-CG2 3.32Å; V423-V425 PolarHBondContact O-N 2.94Å; V423-F1009 HydrophobicContact CB-CE1 3.98Å; V423-F1009 HydrophobicContact CB-CZ 4.38Å; V423-F1009 HydrophobicContact CG1-CE1 3.88Å; V423-F1009 HydrophobicContact CG1-CZ 4.27Å; V423-F1009 HydrophobicContact CG2-CE1 3.64Å; V423-F1009 HydrophobicContact CG2-CZ 4.45Å
424	D	76.8	Confident	83.9	Confident	113 Å²	113	58.4 Å²	58.4	60%	0.604	29%	0.293	S	S	*	.			trans	-70	64.4	172.1	-70.4	-35.6	0	0	0	111	K394 R395 D422	K394-D424 HydrophobicContact CG-CB 4.4Å; R395-D424 PolarHBondContact N-O 3.36Å; D422-D424 PolarHBondContact O-N 3.02Å
425	V	86.6	Confident	84.4	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.024	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.6	173.9	171.9	0	0	0	0	109.6	R395 I397 F415 V423	R395-V425 HydrophobicContact CB-CG2 4.09Å; R395-V425 CarbonylContact O-C 3.27Å; R395-V425 VanDerWaalsContact O-CA 3.3Å; R395-V425 WeakPolarHBondContact O-CA 3.1Å; I397-V425 HydrophobicContact CG1-CG1 4.14Å; I397-V425 HydrophobicContact CG2-CG1 3.85Å; F415-V425 HydrophobicContact CE1-CG1 4.16Å; F415-V425 HydrophobicContact CZ-CG1 3.94Å; V423-V425 HydrophobicContact CG1-CB 3.89Å; V423-V425 HydrophobicContact CG1-CG2 3.32Å; V423-V425 PolarHBondContact O-N 2.94Å
426	E	90.6	Very high	84.8	Confident	17 Å²	17	62.1 Å²	62.1	8%	0.079	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	143.8	173.8	-68.3	177.9	-179.8	0	0	110.9	Y388 K394 R395 H396 I397 K449	Y388-E426 WeakPolarHBondContact CE2-OE2 3.3Å; Y388-E426 PolarHBondContact OH-OE2 3.4Å; K394-E426 HydrophobicContact CD-CG 4.25Å; K394-E426 WeakPolarHBondContact CD-OE1 3.43Å; K394-E426 IonicContact NZ-OE1 2.72Å; K394-E426 PolarHBondContact NZ-OE1 3.38Å; R395-E426 PolarHBondContact O-N 3.32Å; H396-E426 CarbonylContact C-O 3.58Å; H396-E426 WeakPolarHBondContact CA-O 3.42Å; H396-E426 HydrophobicContact CB-CB 4.25Å; I397-E426 PolarHBondContact N-O 2.85Å; E426-K449 CarbonylContact C-O 3.55Å; E426-K449 WeakPolarHBondContact CA-O 3.06Å
427	V	93.5	Very high	85.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.9	-179.2	-172.6	0	0	0	0	109.3	I397 V399 F411 F415 F429 K449 V450 E451	I397-V427 HydrophobicContact CD1-CG1 4.16Å; I397-V427 HydrophobicContact CD1-CG2 4.07Å; I397-V427 HydrophobicContact CG1-CB 4.32Å; I397-V427 HydrophobicContact CG1-CG1 4.22Å; I397-V427 HydrophobicContact CG1-CG2 4.11Å; V399-V427 HydrophobicContact CG2-CG1 3.6Å; F411-V427 HydrophobicContact CE1-CG1 4.02Å; F415-V427 HydrophobicContact CD1-CG2 3.72Å; F415-V427 HydrophobicContact CE1-CG2 3.55Å; F415-V427 HydrophobicContact CZ-CG2 4.41Å; V427-F429 HydrophobicContact CB-CE2 4.33Å; V427-F429 HydrophobicContact CG1-CD2 4.09Å; V427-F429 HydrophobicContact CG1-CE1 4.45Å; V427-F429 HydrophobicContact CG1-CE2 3.5Å; V427-F429 HydrophobicContact CG1-CZ 3.71Å; V427-K449 PolarHBondContact N-O 3.04Å; V427-V450 HydrophobicContact CB-CG2 4.33Å; V427-V450 WeakPolarHBondContact O-CA 3.38Å; V427-E451 PolarHBondContact O-N 3.31Å
428	V	94.3	Very high	85.7	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	109.7	179.7	-176.3	0	0	0	0	109.5	Y388 H396 I397 V398 V399 E451 F453 V466	Y388-V428 HydrophobicContact CD1-CG2 4.47Å; Y388-V428 HydrophobicContact CD2-CG2 3.65Å; Y388-V428 HydrophobicContact CE1-CG2 4.49Å; Y388-V428 HydrophobicContact CE2-CG2 3.69Å; Y388-V428 HydrophobicContact CG-CG2 4.08Å; H396-V428 HydrophobicContact CB-CG2 4.27Å; I397-V428 PolarHBondContact O-N 3.06Å; V398-V428 CarbonylContact C-O 3.28Å; V398-V428 WeakPolarHBondContact CA-O 3.09Å; V399-V428 PolarHBondContact N-O 3.35Å; V428-E451 WeakPolarHBondContact CA-O 3.34Å; V428-F453 HydrophobicContact CG1-CD2 3.47Å; V428-F453 VanDerWaalsContact CG1-CD2 3.47Å; V428-F453 HydrophobicContact CG1-CE2 3.68Å; V428-V466 HydrophobicContact CG1-CB 4.26Å; V428-V466 HydrophobicContact CG1-CG1 3.96Å
429	F	96	Very high	86.5	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	135	177.1	-71.4	-82.5	0	0	0	111.6	V399 I403 V408 F411 L412 V427 F443 V450 E451 F452 F453	V399-F429 HydrophobicContact CB-CD1 3.68Å; V399-F429 HydrophobicContact CB-CE1 3.68Å; V399-F429 HydrophobicContact CB-CG 4.48Å; V399-F429 HydrophobicContact CB-CZ 4.47Å; V399-F429 HydrophobicContact CG1-CD1 3.88Å; V399-F429 HydrophobicContact CG1-CE1 3.59Å; V399-F429 HydrophobicContact CG2-CE1 4.23Å; V399-F429 WeakPolarHBondContact O-CA 3.38Å; I403-F429 HydrophobicContact CD1-CD1 3.9Å; I403-F429 HydrophobicContact CD1-CE1 4.32Å; I403-F429 HydrophobicContact CG2-CD1 4.21Å; V408-F429 HydrophobicContact CG1-CE1 4.11Å; V408-F429 HydrophobicContact CG1-CE2 4.17Å; V408-F429 HydrophobicContact CG1-CZ 3.66Å; V408-F429 HydrophobicContact CG2-CD1 4.33Å; V408-F429 HydrophobicContact CG2-CE1 3.79Å; V408-F429 HydrophobicContact CG2-CZ 4.22Å; F411-F429 HydrophobicContact CD1-CZ 4.15Å; F411-F429 HydrophobicContact CE1-CZ 4.36Å; L412-F429 HydrophobicContact CD2-CE2 4.3Å; L412-F429 HydrophobicContact CD2-CZ 4.21Å; L412-F429 HydrophobicContact CG-CZ 4.44Å; V427-F429 HydrophobicContact CB-CE2 4.33Å; V427-F429 HydrophobicContact CG1-CD2 4.09Å; V427-F429 HydrophobicContact CG1-CE1 4.45Å; V427-F429 HydrophobicContact CG1-CE2 3.5Å; V427-F429 HydrophobicContact CG1-CZ 3.71Å; F429-F443 HydrophobicContact CB-CZ 4.41Å; F429-F443 AromaticContact CD2-CE1 3.6Å; F429-F443 HydrophobicContact CD2-CE1 3.6Å; F429-F443 AromaticContact CD2-CZ 3.98Å; F429-F443 HydrophobicContact CD2-CZ 3.98Å; F429-F443 AromaticContact CE2-CE1 3.78Å; F429-F443 HydrophobicContact CE2-CE1 3.78Å; F429-F443 HydrophobicContact CG-CE1 4.23Å; F429-F443 HydrophobicContact CG-CZ 4.17Å; F429-V450 HydrophobicContact CD2-CG1 3.56Å; F429-V450 HydrophobicContact CE2-CG1 3.48Å; F429-V450 VanDerWaalsContact CE2-CG1 3.48Å; F429-E451 PolarHBondContact N-O 3Å; F429-F452 HydrophobicContact CB-CD2 3.7Å; F429-F452 HydrophobicContact CB-CE2 4.42Å; F429-F453 PolarHBondContact O-N 2.95Å
430	V	94.9	Very high	87.5	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.036	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	115.5	174.2	-177.6	0	0	0	0	110	V398 V399 C400 F453 V457 V466	V398-V430 HydrophobicContact CG1-CG2 3.91Å; V399-V430 PolarHBondContact O-N 3.43Å; C400-V430 HydrophobicContact CB-CB 4.5Å; V430-F453 WeakPolarHBondContact CA-O 3.26Å; V430-V457 HydrophobicContact CB-CG1 4.49Å; V430-V457 HydrophobicContact CG1-CG1 4.28Å; V430-V466 HydrophobicContact CG2-CB 4.27Å; V430-V466 HydrophobicContact CG2-CG1 3.47Å; V430-V466 VanDerWaalsContact CG2-CG1 3.47Å; V430-V466 HydrophobicContact CG2-CG2 4.2Å
431	H	94.9	Very high	88.4	Confident	42 Å²	42	60.1 Å²	60.1	19%	0.194	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	150.2	177.7	-165.2	66.8	0	0	0	112.1	G401 I403 V433 F452 F453 Q454 G455	G401-H431 PolarHBondContact O-CE1 3.06Å; G401-H431 PolarHBondContact O-ND1 3.46Å; G401-H431 VanDerWaalsContact O-ND1 3.12Å; I403-H431 HydrophobicContact CB-CB 4Å; I403-H431 HydrophobicContact CG1-CB 3.92Å; H431-V433 PolarHBondContact CD2-N 2.83Å; H431-V433 PolarHBondContact CD2-O 3.45Å; H431-F452 HydrophobicContact CB-CE2 3.86Å; H431-F452 HydrophobicContact CB-CZ 3.96Å; H431-F453 PolarHBondContact N-O 3.1Å; H431-Q454 WeakPolarHBondContact O-CA 3.47Å; H431-G455 CarbonylContact C-O 3.55Å; H431-G455 PolarHBondContact O-N 3.16Å; H431-G455 VanDerWaalsContact O-O 3.13Å
432	R	93	Very high	89.6	Confident	199 Å²	199	56.8 Å²	56.8	75%	0.751	30%	0.297	S	S	*	.	S	Bend	trans	-71.6	-39	-175.2	-177.8	-177.7	177.1	-168.7	-0.5	111.9	Q454 G455	R432-Q454 WeakPolarHBondContact O-CG 3.44Å; R432-Q454 PolarHBondContact O-NE2 3.19Å; R432-Q454 VanDerWaalsContact O-NE2 3.14Å; R432-G455 WeakPolarHBondContact CA-O 3.49Å; R432-G455 PolarHBondContact N-O 3.4Å; R432-G455 VanDerWaalsContact N-O 3.11Å
433	V	93.1	Very high	91.2	Very high	86 Å²	86	49.9 Å²	49.9	52%	0.521	26%	0.26	S	S	.	.	S	Bend	trans	-87.2	137.5	-177.7	-172.5	0	0	0	0	108.9	H431 F452	H431-V433 PolarHBondContact CD2-N 2.83Å; H431-V433 PolarHBondContact CD2-O 3.45Å; V433-F452 WeakPolarHBondContact O-CZ 3.34Å
434	P	92.1	Very high	92.3	Very high	69 Å²	69	53.9 Å²	53.9	45%	0.448	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-62	149.7	171.6	28	-35.4	0	0	0	110.9	Y384	Y384-P434 HydrophobicContact CD2-CB 4.47Å
435	P	93.4	Very high	93	Very high	18 Å²	18	57.5 Å²	57.5	12%	0.117	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-65.4	145.4	179	29.6	-35.5	0	0	0	110.5	Y384 L439 F443 F452	Y384-P435 HydrophobicContact CD2-CG 4.23Å; Y384-P435 HydrophobicContact CE1-CG 4.19Å; Y384-P435 VanDerWaalsContact CE2-CD 3.41Å; Y384-P435 HydrophobicContact CE2-CG 3.54Å; P435-L439 HydrophobicContact CB-CB 4.05Å; P435-L439 HydrophobicContact CB-CD2 3.71Å; P435-L439 HydrophobicContact CB-CG 3.87Å; P435-F443 HydrophobicContact CB-CD2 4.46Å; P435-F443 HydrophobicContact CB-CE2 4.02Å; P435-F443 HydrophobicContact CG-CE2 4.39Å; P435-F452 VanDerWaalsContact CD-CE1 3.46Å; P435-F452 HydrophobicContact CG-CD1 4.23Å; P435-F452 HydrophobicContact CG-CE1 4.27Å
436	D	93.6	Very high	93	Very high	82 Å²	82	60.3 Å²	60.3	44%	0.439	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-67.7	173.7	167.7	59.7	27.9	0	0	0	111.1	E438 L439 E440	D436-E438 VanDerWaalsContact C-N 3.26Å; D436-E438 PolarHBondContact O-N 3.17Å; D436-E438 PolarHBondContact OD1-N 3.11Å; D436-L439 WeakPolarHBondContact OD1-CA 3.16Å; D436-L439 WeakPolarHBondContact OD1-CB 3.26Å; D436-L439 PolarHBondContact OD1-N 3.41Å; D436-E440 WeakPolarHBondContact O-CB 3.46Å; D436-E440 PolarHBondContact O-N 3.29Å
437	L	94.2	Very high	92.7	Very high	151 Å²	151	67.2 Å²	67.2	79%	0.791	32%	0.321	S	S	*	.	H	α-helix	trans	-66.4	-30	-176.5	-66.4	175	0	0	0	112.6	G441	L437-G441 PolarHBondContact O-N 2.72Å
438	E	93.2	Very high	92.3	Very high	130 Å²	130	72.5 Å²	72.5	61%	0.607	35%	0.353	S	S	*	.	H	α-helix	trans	-72.7	-46.7	179.9	-64	-176.3	171.8	0	0	110.9	Y405 D436 G441 L442	Y405-E438 HydrophobicContact CD2-CB 3.88Å; Y405-E438 HydrophobicContact CE2-CB 4.33Å; Y405-E438 HydrophobicContact CG-CB 4.27Å; D436-E438 VanDerWaalsContact C-N 3.26Å; D436-E438 PolarHBondContact O-N 3.17Å; D436-E438 PolarHBondContact OD1-N 3.11Å; E438-G441 CarbonylContact O-C 3.43Å; E438-G441 WeakPolarHBondContact O-CA 3.48Å; E438-G441 PolarHBondContact O-N 2.95Å; E438-G441 VanDerWaalsContact O-N 3.11Å; E438-L442 PolarHBondContact O-N 2.8Å
439	L	93.4	Very high	92	Very high	4 Å²	4	76.6 Å²	76.6	2%	0.021	37%	0.371	C	S	.	.	H	α-helix	trans	-65.8	-38.8	173.7	-175.6	59.9	0	0	0	111.5	I403 V408 P435 D436 G441 L442 F443	I403-L439 HydrophobicContact CG2-CD2 4.12Å; V408-L439 HydrophobicContact CB-CD1 3.84Å; V408-L439 HydrophobicContact CG1-CD1 3.88Å; V408-L439 HydrophobicContact CG2-CD1 3.99Å; P435-L439 HydrophobicContact CB-CB 4.05Å; P435-L439 HydrophobicContact CB-CD2 3.71Å; P435-L439 HydrophobicContact CB-CG 3.87Å; D436-L439 WeakPolarHBondContact OD1-CA 3.16Å; D436-L439 WeakPolarHBondContact OD1-CB 3.26Å; D436-L439 PolarHBondContact OD1-N 3.41Å; L439-G441 VanDerWaalsContact C-N 3.27Å; L439-G441 PolarHBondContact O-N 2.84Å; L439-L442 HydrophobicContact CD1-CD2 4.24Å; L439-L442 WeakPolarHBondContact O-CB 3.33Å; L439-L442 PolarHBondContact O-N 2.84Å; L439-F443 HydrophobicContact CD1-CD1 4.44Å; L439-F443 HydrophobicContact CD1-CE1 3.79Å; L439-F443 HydrophobicContact CD1-CE2 4Å; L439-F443 HydrophobicContact CD1-CZ 3.53Å; L439-F443 HydrophobicContact CD2-CE2 4.04Å; L439-F443 HydrophobicContact CD2-CZ 4Å; L439-F443 HydrophobicContact CG-CD2 4.24Å; L439-F443 HydrophobicContact CG-CE1 4.31Å; L439-F443 HydrophobicContact CG-CE2 3.58Å; L439-F443 HydrophobicContact CG-CZ 3.63Å; L439-F443 WeakPolarHBondContact O-CD2 3.46Å; L439-F443 WeakPolarHBondContact O-CG 3.07Å; L439-F443 PolarHBondContact O-N 3.19Å
440	E	93.3	Very high	91.8	Very high	24 Å²	24	76.9 Å²	76.9	11%	0.112	37%	0.373	C	S	.	.	H	α-helix	trans	-61.1	-39	170.1	-176.8	177.2	155.1	0	0	111.2	K383 Y384 D436 F443 K444	K383-E440 IonicContact NZ-OE1 3.55Å; K383-E440 PolarHBondContact NZ-OE1 3.35Å; K383-E440 IonicContact NZ-OE2 3.03Å; K383-E440 PolarHBondContact NZ-OE2 3.01Å; Y384-E440 WeakPolarHBondContact OH-CG 3.37Å; Y384-E440 PolarHBondContact OH-OE2 3.49Å; D436-E440 WeakPolarHBondContact O-CB 3.46Å; D436-E440 PolarHBondContact O-N 3.29Å; E440-F443 PolarHBondContact O-N 3.45Å; E440-K444 HydrophobicContact CG-CD 4.49Å; E440-K444 WeakPolarHBondContact O-CG 3.45Å; E440-K444 PolarHBondContact O-N 2.87Å; E440-K444 WeakPolarHBondContact OE1-CE 3.46Å; E440-K444 IonicContact OE1-NZ 3.47Å; E440-K444 PolarHBondContact OE1-NZ 3.27Å
441	G	93.5	Very high	91.7	Very high	28 Å²	28	80.4 Å²	80.4	29%	0.289	39%	0.389	S	S	.	.	H	α-helix	trans	-59.8	-43.8	172.2	0	0	0	0	0	112.4	L437 E438 L439 K444 R445	L437-G441 PolarHBondContact O-N 2.72Å; E438-G441 CarbonylContact O-C 3.43Å; E438-G441 WeakPolarHBondContact O-CA 3.48Å; E438-G441 PolarHBondContact O-N 2.95Å; E438-G441 VanDerWaalsContact O-N 3.11Å; L439-G441 VanDerWaalsContact C-N 3.27Å; L439-G441 PolarHBondContact O-N 2.84Å; G441-K444 PolarHBondContact O-N 3.3Å; G441-R445 WeakPolarHBondContact O-CG 3.48Å; G441-R445 PolarHBondContact O-N 2.91Å
442	L	93.4	Very high	91.7	Very high	10 Å²	10	79.2 Å²	79.2	5%	0.052	38%	0.383	C	S	.	.	H	α-helix	trans	-64.1	-42.9	177.3	-175.4	61.6	0	0	0	112.2	Y405 V408 L412 E438 L439 R445 H446	Y405-L442 HydrophobicContact CD2-CD2 4.37Å; Y405-L442 HydrophobicContact CE2-CB 4.37Å; Y405-L442 HydrophobicContact CE2-CD2 4.4Å; V408-L442 HydrophobicContact CB-CD2 4.27Å; V408-L442 HydrophobicContact CG1-CD2 3.76Å; L412-L442 HydrophobicContact CD1-CD2 4.17Å; L412-L442 HydrophobicContact CD1-CG 4.18Å; E438-L442 PolarHBondContact O-N 2.8Å; L439-L442 HydrophobicContact CD1-CD2 4.24Å; L439-L442 WeakPolarHBondContact O-CB 3.33Å; L439-L442 PolarHBondContact O-N 2.84Å; L442-R445 WeakPolarHBondContact O-CB 3.43Å; L442-R445 PolarHBondContact O-N 3Å; L442-H446 PolarHBondContact O-N 3.24Å; L442-H446 PolarHBondContact O-ND1 3.49Å
443	F	93.3	Very high	91.8	Very high	16 Å²	16	70.4 Å²	70.4	7%	0.07	35%	0.35	C	S	.	.	H	α-helix	trans	-65.8	-38.2	176.4	-64.6	-29.7	0	0	0	112.6	V408 F429 P435 L439 E440 R445 H446 F447 V450 F452	V408-F443 HydrophobicContact CG1-CE1 3.95Å; F429-F443 HydrophobicContact CB-CZ 4.41Å; F429-F443 AromaticContact CD2-CE1 3.6Å; F429-F443 HydrophobicContact CD2-CE1 3.6Å; F429-F443 AromaticContact CD2-CZ 3.98Å; F429-F443 HydrophobicContact CD2-CZ 3.98Å; F429-F443 AromaticContact CE2-CE1 3.78Å; F429-F443 HydrophobicContact CE2-CE1 3.78Å; F429-F443 HydrophobicContact CG-CE1 4.23Å; F429-F443 HydrophobicContact CG-CZ 4.17Å; P435-F443 HydrophobicContact CB-CD2 4.46Å; P435-F443 HydrophobicContact CB-CE2 4.02Å; P435-F443 HydrophobicContact CG-CE2 4.39Å; L439-F443 HydrophobicContact CD1-CD1 4.44Å; L439-F443 HydrophobicContact CD1-CE1 3.79Å; L439-F443 HydrophobicContact CD1-CE2 4Å; L439-F443 HydrophobicContact CD1-CZ 3.53Å; L439-F443 HydrophobicContact CD2-CE2 4.04Å; L439-F443 HydrophobicContact CD2-CZ 4Å; L439-F443 HydrophobicContact CG-CD2 4.24Å; L439-F443 HydrophobicContact CG-CE1 4.31Å; L439-F443 HydrophobicContact CG-CE2 3.58Å; L439-F443 HydrophobicContact CG-CZ 3.63Å; L439-F443 WeakPolarHBondContact O-CD2 3.46Å; L439-F443 WeakPolarHBondContact O-CG 3.07Å; L439-F443 PolarHBondContact O-N 3.19Å; E440-F443 PolarHBondContact O-N 3.45Å; F443-R445 VanDerWaalsContact C-N 3.3Å; F443-R445 PolarHBondContact O-N 2.94Å; F443-H446 CarbonylContact O-C 3.48Å; F443-H446 VanDerWaalsContact O-C 3.28Å; F443-H446 PolarHBondContact O-N 2.93Å; F443-F447 PolarHBondContact O-N 3.17Å; F443-F447 VanDerWaalsContact O-N 3.13Å; F443-V450 HydrophobicContact CD1-CG1 3.46Å; F443-V450 VanDerWaalsContact CD1-CG1 3.46Å; F443-V450 HydrophobicContact CE1-CG1 3.81Å; F443-V450 HydrophobicContact CG-CG1 4.32Å; F443-F452 HydrophobicContact CD2-CB 3.89Å; F443-F452 HydrophobicContact CD2-CD2 4.48Å; F443-F452 HydrophobicContact CD2-CG 4.35Å; F443-F452 HydrophobicContact CE2-CB 3.62Å; F443-F452 AromaticContact CE2-CD2 3.43Å; F443-F452 HydrophobicContact CE2-CD2 3.43Å; F443-F452 VanDerWaalsContact CE2-CD2 3.43Å; F443-F452 HydrophobicContact CE2-CE2 4.33Å; F443-F452 AromaticContact CE2-CG 3.69Å; F443-F452 HydrophobicContact CE2-CG 3.69Å; F443-F452 HydrophobicContact CZ-CB 4.23Å; F443-F452 AromaticContact CZ-CD2 3.73Å; F443-F452 HydrophobicContact CZ-CD2 3.73Å; F443-F452 HydrophobicContact CZ-CG 4.33Å
444	K	92.2	Very high	91.9	Very high	133 Å²	133	68.8 Å²	68.8	58%	0.578	34%	0.337	S	S	*	.	H	α-helix	trans	-65.2	-32.2	175.1	-76.2	177.1	-175	164	0	113.1	E440 G441 H446	E440-K444 HydrophobicContact CG-CD 4.49Å; E440-K444 WeakPolarHBondContact O-CG 3.45Å; E440-K444 PolarHBondContact O-N 2.87Å; E440-K444 WeakPolarHBondContact OE1-CE 3.46Å; E440-K444 IonicContact OE1-NZ 3.47Å; E440-K444 PolarHBondContact OE1-NZ 3.27Å; G441-K444 PolarHBondContact O-N 3.3Å; K444-H446 VanDerWaalsContact C-N 3.28Å; K444-H446 PolarHBondContact O-N 2.75Å
445	R	91.3	Very high	91.9	Very high	188 Å²	188	66 Å²	66	71%	0.709	32%	0.321	S	S	*	.	H	α-helix	trans	-64.1	-35.5	173.9	-70	172.8	-176	173.9	2.4	111.6	G441 L442 F443	G441-R445 WeakPolarHBondContact O-CG 3.48Å; G441-R445 PolarHBondContact O-N 2.91Å; L442-R445 WeakPolarHBondContact O-CB 3.43Å; L442-R445 PolarHBondContact O-N 3Å; F443-R445 VanDerWaalsContact C-N 3.3Å; F443-R445 PolarHBondContact O-N 2.94Å
446	H	86.8	Confident	91.9	Very high	64 Å²	64	67.8 Å²	67.8	30%	0.296	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	36.1	-179.1	-60.3	94.6	0	0	0	113.2	L416 L442 F443 K444 T448 K449 V450	L416-H446 HydrophobicContact CD1-CB 4.42Å; L442-H446 PolarHBondContact O-N 3.24Å; L442-H446 PolarHBondContact O-ND1 3.49Å; F443-H446 CarbonylContact O-C 3.48Å; F443-H446 VanDerWaalsContact O-C 3.28Å; F443-H446 PolarHBondContact O-N 2.93Å; K444-H446 VanDerWaalsContact C-N 3.28Å; K444-H446 PolarHBondContact O-N 2.75Å; H446-T448 PolarHBondContact O-N 3.17Å; H446-K449 PolarHBondContact O-N 3.45Å; H446-V450 HydrophobicContact CB-CB 4.16Å; H446-V450 HydrophobicContact CB-CG2 3.68Å; H446-V450 PolarHBondContact O-N 2.81Å
447	F	84.2	Confident	91.9	Very high	161 Å²	161	64.1 Å²	64.1	71%	0.706	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.2	-170.5	-178	-101	0	0	0	114.9	F443	F443-F447 PolarHBondContact O-N 3.17Å; F443-F447 VanDerWaalsContact O-N 3.13Å
448	T	85.3	Confident	91.8	Very high	111 Å²	111	61 Å²	61	68%	0.681	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-17.6	-178.9	52.9	0	0	0	0	114.2	H446	H446-T448 PolarHBondContact O-N 3.17Å
449	K	87.3	Confident	91.8	Very high	87 Å²	87	57.7 Å²	57.7	38%	0.378	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-20	-174.9	-62.6	-168.1	-178.8	-176.6	0	113	L416 E426 V427 H446	L416-K449 HydrophobicContact CD1-CB 4.29Å; L416-K449 HydrophobicContact CD1-CD 4.27Å; L416-K449 HydrophobicContact CD2-CB 4.44Å; L416-K449 HydrophobicContact CD2-CD 3.71Å; E426-K449 CarbonylContact C-O 3.55Å; E426-K449 WeakPolarHBondContact CA-O 3.06Å; V427-K449 PolarHBondContact N-O 3.04Å; H446-K449 PolarHBondContact O-N 3.45Å
450	V	92.3	Very high	91.7	Very high	6 Å²	6	60.8 Å²	60.8	4%	0.036	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.6	-171.6	-178.5	0	0	0	0	111.4	L412 L416 V427 F429 F443 H446	L412-V450 HydrophobicContact CD1-CG2 4.22Å; L412-V450 HydrophobicContact CD2-CG2 3.95Å; L416-V450 HydrophobicContact CD1-CG2 4.16Å; V427-V450 HydrophobicContact CB-CG2 4.33Å; V427-V450 WeakPolarHBondContact O-CA 3.38Å; F429-V450 HydrophobicContact CD2-CG1 3.56Å; F429-V450 HydrophobicContact CE2-CG1 3.48Å; F429-V450 VanDerWaalsContact CE2-CG1 3.48Å; F443-V450 HydrophobicContact CD1-CG1 3.46Å; F443-V450 VanDerWaalsContact CD1-CG1 3.46Å; F443-V450 HydrophobicContact CE1-CG1 3.81Å; F443-V450 HydrophobicContact CG-CG1 4.32Å; H446-V450 HydrophobicContact CB-CB 4.16Å; H446-V450 HydrophobicContact CB-CG2 3.68Å; H446-V450 PolarHBondContact O-N 2.81Å
451	E	93	Very high	91.6	Very high	79 Å²	79	64.5 Å²	64.5	37%	0.369	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148.4	171.3	-66.7	-165.9	177.7	0	0	111.1	Y388 V427 V428 F429 F453	Y388-E451 WeakPolarHBondContact CD2-OE2 3.39Å; V427-E451 PolarHBondContact O-N 3.31Å; V428-E451 WeakPolarHBondContact CA-O 3.34Å; F429-E451 PolarHBondContact N-O 3Å; E451-F453 HydrophobicContact CB-CE2 4.02Å; E451-F453 WeakPolarHBondContact OE2-CE2 3.41Å; E451-F453 WeakPolarHBondContact OE2-CZ 3.34Å
452	F	94.8	Very high	91.6	Very high	17 Å²	17	64.1 Å²	64.1	8%	0.075	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	130.7	178.3	179	-83.5	0	0	0	111	Y384 F429 H431 V433 P435 F443 Q454	Y384-F452 AromaticContact CD1-CD1 3.69Å; Y384-F452 HydrophobicContact CD1-CD1 3.69Å; Y384-F452 HydrophobicContact CD1-CE1 4.49Å; Y384-F452 HydrophobicContact CD2-CD1 4.27Å; Y384-F452 HydrophobicContact CD2-CE1 4.32Å; Y384-F452 HydrophobicContact CE1-CD1 4.33Å; Y384-F452 AromaticContact CG-CD1 3.65Å; Y384-F452 HydrophobicContact CG-CD1 3.65Å; Y384-F452 HydrophobicContact CG-CE1 4.03Å; F429-F452 HydrophobicContact CB-CD2 3.7Å; F429-F452 HydrophobicContact CB-CE2 4.42Å; H431-F452 HydrophobicContact CB-CE2 3.86Å; H431-F452 HydrophobicContact CB-CZ 3.96Å; V433-F452 WeakPolarHBondContact O-CZ 3.34Å; P435-F452 VanDerWaalsContact CD-CE1 3.46Å; P435-F452 HydrophobicContact CG-CD1 4.23Å; P435-F452 HydrophobicContact CG-CE1 4.27Å; F443-F452 HydrophobicContact CD2-CB 3.89Å; F443-F452 HydrophobicContact CD2-CD2 4.48Å; F443-F452 HydrophobicContact CD2-CG 4.35Å; F443-F452 HydrophobicContact CE2-CB 3.62Å; F443-F452 AromaticContact CE2-CD2 3.43Å; F443-F452 HydrophobicContact CE2-CD2 3.43Å; F443-F452 VanDerWaalsContact CE2-CD2 3.43Å; F443-F452 HydrophobicContact CE2-CE2 4.33Å; F443-F452 AromaticContact CE2-CG 3.69Å; F443-F452 HydrophobicContact CE2-CG 3.69Å; F443-F452 HydrophobicContact CZ-CB 4.23Å; F443-F452 AromaticContact CZ-CD2 3.73Å; F443-F452 HydrophobicContact CZ-CD2 3.73Å; F443-F452 HydrophobicContact CZ-CG 4.33Å; F452-Q454 HydrophobicContact CE1-CB 4.38Å
453	F	95	Very high	91.5	Very high	14 Å²	14	63.7 Å²	63.7	6%	0.061	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.8	174.1	-67	-85.4	0	0	0	111	Y388 V428 F429 V430 H431 E451 G455 V466	Y388-F453 HydrophobicContact CD2-CE2 4.26Å; V428-F453 HydrophobicContact CG1-CD2 3.47Å; V428-F453 VanDerWaalsContact CG1-CD2 3.47Å; V428-F453 HydrophobicContact CG1-CE2 3.68Å; F429-F453 PolarHBondContact O-N 2.95Å; V430-F453 WeakPolarHBondContact CA-O 3.26Å; H431-F453 PolarHBondContact N-O 3.1Å; E451-F453 HydrophobicContact CB-CE2 4.02Å; E451-F453 WeakPolarHBondContact OE2-CE2 3.41Å; E451-F453 WeakPolarHBondContact OE2-CZ 3.34Å; F453-G455 PolarHBondContact O-N 3.02Å; F453-V466 HydrophobicContact CB-CG1 4.27Å; F453-V466 HydrophobicContact CD2-CG1 4.04Å; F453-V466 HydrophobicContact CG-CG1 4.21Å
454	Q	94	Very high	91.4	Very high	52 Å²	52	65.4 Å²	65.4	24%	0.243	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.1	171	-171	177.2	9.2	0	0	109.7	Y384 H431 R432 F452 R465	Y384-Q454 PolarHBondContact O-N 3.25Å; H431-Q454 WeakPolarHBondContact O-CA 3.47Å; R432-Q454 WeakPolarHBondContact O-CG 3.44Å; R432-Q454 PolarHBondContact O-NE2 3.19Å; R432-Q454 VanDerWaalsContact O-NE2 3.14Å; F452-Q454 HydrophobicContact CE1-CB 4.38Å; Q454-R465 PolarHBondContact O-NH1 3.19Å; Q454-R465 PolarHBondContact O-NH2 3.35Å
455	G	92.8	Very high	91.4	Very high	10 Å²	10	60.7 Å²	60.7	10%	0.103	31%	0.305	C	S	.	.			trans	170	-179.8	-177.8	0	0	0	0	0	113.9	H431 R432 F453 D462	H431-G455 CarbonylContact C-O 3.55Å; H431-G455 PolarHBondContact O-N 3.16Å; H431-G455 VanDerWaalsContact O-O 3.13Å; R432-G455 WeakPolarHBondContact CA-O 3.49Å; R432-G455 PolarHBondContact N-O 3.4Å; R432-G455 VanDerWaalsContact N-O 3.11Å; F453-G455 PolarHBondContact O-N 3.02Å; G455-D462 WeakPolarHBondContact CA-OD2 3.42Å
456	T	94.1	Very high	91.3	Very high	57 Å²	57	51.9 Å²	51.9	35%	0.35	27%	0.272	S	S	.	.			trans	-125.8	138.1	175.7	179.5	0	0	0	0	111.2	M458 D459 D462	T456-M458 HydrophobicContact CG2-CB 4.32Å; T456-M458 PolarHBondContact O-N 3.4Å; T456-M458 VanDerWaalsContact O-N 3.12Å; T456-M458 PolarHBondContact OG1-N 3.46Å; T456-D459 HydrophobicContact CG2-CB 3.95Å; T456-D459 PolarHBondContact O-N 3.4Å; T456-D459 VanDerWaalsContact O-N 3.14Å; T456-D462 PolarHBondContact N-OD2 2.77Å; T456-D462 WeakPolarHBondContact O-CB 3.5Å
457	V	92.8	Very high	91.3	Very high	5 Å²	5	51 Å²	51	3%	0.03	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-7.5	174.8	-64.1	0	0	0	0	113.4	C400 V430 D459 L463 R515 S518	C400-V457 HydrophobicContact CB-CG1 3.58Å; V430-V457 HydrophobicContact CB-CG1 4.49Å; V430-V457 HydrophobicContact CG1-CG1 4.28Å; V457-D459 VanDerWaalsContact C-N 3.34Å; V457-L463 HydrophobicContact CB-CD2 3.99Å; V457-L463 HydrophobicContact CG1-CD2 4.12Å; V457-R515 HydrophobicContact CG2-CB 3.71Å; V457-R515 HydrophobicContact CG2-CG 3.56Å; V457-S518 WeakPolarHBondContact O-CB 3.46Å; V457-S518 PolarHBondContact O-OG 2.67Å
458	M	92.6	Very high	91	Very high	86 Å²	86	43.4 Å²	43.4	42%	0.424	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-21.6	173.2	-58.4	-55.9	-66.8	0	0	112.7	T456 M514 R515 S518	T456-M458 HydrophobicContact CG2-CB 4.32Å; T456-M458 PolarHBondContact O-N 3.4Å; T456-M458 VanDerWaalsContact O-N 3.12Å; T456-M458 PolarHBondContact OG1-N 3.46Å; M458-M514 HydrophobicContact CE-CB 4.03Å; M458-M514 HydrophobicContact CE-CE 4.02Å; M458-M514 HydrophobicContact SD-CB 4.38Å; M458-R515 HydrophobicContact SD-CG 4.3Å; M458-S518 WeakPolarHBondContact CA-OG 3.27Å
459	D	93	Very high	90.3	Very high	59 Å²	59	42 Å²	42	32%	0.316	22%	0.216	S	C	.	.	S	Bend	trans	-96.1	128.1	178.2	-171.7	3.7	0	0	0	110.9	T456 V457 I461 D462 L463	T456-D459 HydrophobicContact CG2-CB 3.95Å; T456-D459 PolarHBondContact O-N 3.4Å; T456-D459 VanDerWaalsContact O-N 3.14Å; V457-D459 VanDerWaalsContact C-N 3.34Å; D459-I461 PolarHBondContact O-N 3.34Å; D459-I461 PolarHBondContact OD1-N 2.76Å; D459-I461 VanDerWaalsContact OD1-N 3.08Å; D459-D462 HydrophobicContact CB-CB 4.43Å; D459-D462 PolarHBondContact O-N 3.06Å; D459-L463 WeakPolarHBondContact O-CG 3.27Å; D459-L463 PolarHBondContact O-N 3.42Å; D459-L463 VanDerWaalsContact O-N 3.13Å
460	S	91.2	Very high	88.7	Confident	69 Å²	69	40.6 Å²	40.6	48%	0.483	21%	0.212	S	C	.	.	H	α-helix	trans	-61.9	-27.4	175.9	67.1	0	0	0	0	113.5	S464	S460-S464 PolarHBondContact O-N 2.88Å; S460-S464 VanDerWaalsContact O-N 3.1Å
461	I	91.9	Very high	86.5	Confident	102 Å²	102	49.4 Å²	49.4	52%	0.523	24%	0.244	S	C	.	.	H	α-helix	trans	-68.4	-46.7	177.5	-59.8	173.6	0	0	0	109.4	D459 L463 S464 R465	D459-I461 PolarHBondContact O-N 3.34Å; D459-I461 PolarHBondContact OD1-N 2.76Å; D459-I461 VanDerWaalsContact OD1-N 3.08Å; I461-L463 PolarHBondContact O-N 2.7Å; I461-S464 WeakPolarHBondContact O-CB 3.31Å; I461-S464 PolarHBondContact O-N 3.26Å; I461-S464 VanDerWaalsContact O-N 3.1Å; I461-S464 PolarHBondContact O-OG 3.4Å; I461-R465 WeakPolarHBondContact O-CG 3.35Å; I461-R465 PolarHBondContact O-N 3.28Å
462	D	92.9	Very high	84	Confident	20 Å²	20	49.8 Å²	49.8	11%	0.107	25%	0.252	C	S	.	.	H	α-helix	trans	-64.8	-40.2	178.2	-72.2	-23.6	0	0	0	111.9	G455 T456 D459 S464 R465 V466	G455-D462 WeakPolarHBondContact CA-OD2 3.42Å; T456-D462 PolarHBondContact N-OD2 2.77Å; T456-D462 WeakPolarHBondContact O-CB 3.5Å; D459-D462 HydrophobicContact CB-CB 4.43Å; D459-D462 PolarHBondContact O-N 3.06Å; D462-S464 PolarHBondContact O-N 3.49Å; D462-R465 WeakPolarHBondContact O-CB 3.44Å; D462-R465 PolarHBondContact O-N 3.25Å; D462-R465 VanDerWaalsContact O-N 3.14Å; D462-R465 IonicContact OD1-CZ 3.04Å; D462-R465 IonicContact OD1-NE 3.04Å; D462-R465 IonicContact OD1-NH1 2.81Å; D462-R465 PolarHBondContact OD1-NH1 3.17Å; D462-V466 WeakPolarHBondContact O-CG2 3.38Å; D462-V466 PolarHBondContact O-N 3.17Å; D462-V466 VanDerWaalsContact O-N 3.14Å
463	L	91.8	Very high	81.2	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-33.5	172.4	-66.1	-179.5	0	0	0	112.9	V457 D459 I461 K467 V468 L519 Y522	V457-L463 HydrophobicContact CB-CD2 3.99Å; V457-L463 HydrophobicContact CG1-CD2 4.12Å; D459-L463 WeakPolarHBondContact O-CG 3.27Å; D459-L463 PolarHBondContact O-N 3.42Å; D459-L463 VanDerWaalsContact O-N 3.13Å; I461-L463 PolarHBondContact O-N 2.7Å; L463-K467 PolarHBondContact O-N 3.16Å; L463-V468 HydrophobicContact CB-CB 4.48Å; L463-V468 HydrophobicContact CB-CG2 4.47Å; L463-V468 HydrophobicContact CD2-CG2 4Å; L463-V468 PolarHBondContact O-N 3.41Å; L463-V468 VanDerWaalsContact O-N 3.15Å; L463-L519 HydrophobicContact CD2-CD2 3.56Å; L463-Y522 HydrophobicContact CB-CD1 4Å; L463-Y522 HydrophobicContact CB-CD2 4.44Å; L463-Y522 HydrophobicContact CB-CE1 3.98Å; L463-Y522 HydrophobicContact CB-CE2 4.42Å; L463-Y522 HydrophobicContact CB-CG 4.23Å; L463-Y522 HydrophobicContact CD1-CD1 4.06Å; L463-Y522 HydrophobicContact CD1-CD2 4.21Å; L463-Y522 HydrophobicContact CD1-CG 3.72Å
464	S	90.8	Very high	78.4	Confident	53 Å²	53	61.6 Å²	61.6	37%	0.371	32%	0.318	S	S	.	.	H	α-helix	trans	-72.5	-39.1	174.8	79.4	0	0	0	0	112.3	S460 I461 D462 V466 K467 Y522	S460-S464 PolarHBondContact O-N 2.88Å; S460-S464 VanDerWaalsContact O-N 3.1Å; I461-S464 WeakPolarHBondContact O-CB 3.31Å; I461-S464 PolarHBondContact O-N 3.26Å; I461-S464 VanDerWaalsContact O-N 3.1Å; I461-S464 PolarHBondContact O-OG 3.4Å; D462-S464 PolarHBondContact O-N 3.49Å; S464-V466 VanDerWaalsContact C-N 3.28Å; S464-V466 PolarHBondContact O-N 2.64Å; S464-K467 PolarHBondContact O-N 3.39Å; S464-Y522 WeakPolarHBondContact CB-OH 3.45Å
465	R	90.8	Very high	76	Confident	34 Å²	34	63.8 Å²	63.8	13%	0.128	34%	0.337	C	S	.	.	H	α-helix	trans	-60	-37.5	177.1	-71.5	170.2	51.2	-156.3	-5.5	111.9	G386 E387 Y388 Q454 I461 D462 K467	G386-R465 PolarHBondContact O-NE 3.22Å; G386-R465 PolarHBondContact O-NH2 2.96Å; E387-R465 WeakPolarHBondContact CA-O 3.4Å; E387-R465 HydrophobicContact CG-CB 4.28Å; E387-R465 HydrophobicContact CG-CG 4.07Å; Y388-R465 PolarHBondContact N-O 3.35Å; Q454-R465 PolarHBondContact O-NH1 3.19Å; Q454-R465 PolarHBondContact O-NH2 3.35Å; I461-R465 WeakPolarHBondContact O-CG 3.35Å; I461-R465 PolarHBondContact O-N 3.28Å; D462-R465 WeakPolarHBondContact O-CB 3.44Å; D462-R465 PolarHBondContact O-N 3.25Å; D462-R465 VanDerWaalsContact O-N 3.14Å; D462-R465 IonicContact OD1-CZ 3.04Å; D462-R465 IonicContact OD1-NE 3.04Å; D462-R465 IonicContact OD1-NH1 2.81Å; D462-R465 PolarHBondContact OD1-NH1 3.17Å; R465-K467 VanDerWaalsContact C-N 3.33Å
466	V	90.4	Very high	73.7	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.018	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	10	176.9	-59.2	0	0	0	0	114.3	H396 V398 V428 V430 F453 D462 S464 V468	H396-V466 PolarHBondContact NE2-O 3.39Å; V398-V466 HydrophobicContact CG1-CG2 4.26Å; V398-V466 HydrophobicContact CG2-CB 4.35Å; V398-V466 HydrophobicContact CG2-CG2 4.14Å; V428-V466 HydrophobicContact CG1-CB 4.26Å; V428-V466 HydrophobicContact CG1-CG1 3.96Å; V430-V466 HydrophobicContact CG2-CB 4.27Å; V430-V466 HydrophobicContact CG2-CG1 3.47Å; V430-V466 VanDerWaalsContact CG2-CG1 3.47Å; V430-V466 HydrophobicContact CG2-CG2 4.2Å; F453-V466 HydrophobicContact CB-CG1 4.27Å; F453-V466 HydrophobicContact CD2-CG1 4.04Å; F453-V466 HydrophobicContact CG-CG1 4.21Å; D462-V466 WeakPolarHBondContact O-CG2 3.38Å; D462-V466 PolarHBondContact O-N 3.17Å; D462-V466 VanDerWaalsContact O-N 3.14Å; S464-V466 VanDerWaalsContact C-N 3.28Å; S464-V466 PolarHBondContact O-N 2.64Å; V466-V468 VanDerWaalsContact C-N 3.3Å; V466-V468 HydrophobicContact CG2-CG2 3.71Å; V466-V468 PolarHBondContact O-N 2.99Å
467	K	86.9	Confident	71.3	Confident	46 Å²	46	72 Å²	72	20%	0.2	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	54	39.5	174.9	-63.2	-179.7	169.8	161.1	0	114.3	Y388 A390 L463 S464 R465 R469 A491	Y388-K467 HydrophobicContact CD1-CB 4.46Å; Y388-K467 HydrophobicContact CD1-CD 4.19Å; Y388-K467 VanDerWaalsContact O-CD 3.25Å; Y388-K467 WeakPolarHBondContact O-CD 3.48Å; Y388-K467 WeakPolarHBondContact O-CE 3.45Å; Y388-K467 PolarHBondContact O-NZ 3.49Å; A390-K467 HydrophobicContact CB-CD 3.78Å; L463-K467 PolarHBondContact O-N 3.16Å; S464-K467 PolarHBondContact O-N 3.39Å; R465-K467 VanDerWaalsContact C-N 3.33Å; K467-R469 PolarHBondContact O-N 3.28Å; K467-A491 PolarHBondContact O-N 3.1Å
468	V	78	Confident	69.2	Low	0 Å²	0	77.6 Å²	77.6	0%	0	43%	0.427	C	S	.	.	S	Bend	trans	-56.2	-41	171.3	166.1	0	0	0	0	110.5	V398 L463 V466 Y522 I526	V398-V468 HydrophobicContact CG2-CG2 4.13Å; L463-V468 HydrophobicContact CB-CB 4.48Å; L463-V468 HydrophobicContact CB-CG2 4.47Å; L463-V468 HydrophobicContact CD2-CG2 4Å; L463-V468 PolarHBondContact O-N 3.41Å; L463-V468 VanDerWaalsContact O-N 3.15Å; V466-V468 VanDerWaalsContact C-N 3.3Å; V466-V468 HydrophobicContact CG2-CG2 3.71Å; V466-V468 PolarHBondContact O-N 2.99Å; V468-Y522 HydrophobicContact CB-CD1 4.24Å; V468-Y522 HydrophobicContact CB-CE1 4.13Å; V468-Y522 HydrophobicContact CG1-CD1 3.81Å; V468-Y522 HydrophobicContact CG1-CE1 4.16Å; V468-I526 HydrophobicContact CG1-CD1 3.75Å
469	R	70.6	Confident	67.1	Low	83 Å²	83	78.3 Å²	78.3	31%	0.313	44%	0.436	S	S	.	.			trans	-144.2	122.6	172.7	-178.2	-177.9	178.6	127.4	-2.3	109.3	K467 R471 Y522	K467-R469 PolarHBondContact O-N 3.28Å; R469-R471 PolarHBondContact O-N 3.25Å; R469-Y522 HydrophobicContact CB-CD1 4.07Å; R469-Y522 HydrophobicContact CB-CE1 3.56Å; R469-Y522 WeakPolarHBondContact CD-O 3.24Å; R469-Y522 PolarHBondContact O-OH 3.36Å
470	I	53.4	Low	64.8	Low	56 Å²	56	79.9 Å²	79.9	29%	0.287	47%	0.466	S	S	.	.			trans	-80.4	114.2	163.8	-64.3	169	0	0	0	107.4	T472 V488 H489	I470-T472 HydrophobicContact CG2-CG2 4.42Å; I470-T472 PolarHBondContact O-N 3.15Å; I470-T472 VanDerWaalsContact O-N 3.1Å; I470-V488 HydrophobicContact CB-CG1 3.52Å; I470-V488 HydrophobicContact CG1-CG1 4.46Å; I470-V488 HydrophobicContact CG2-CG1 4.09Å; I470-V488 WeakPolarHBondContact O-CG1 3.28Å; I470-H489 HydrophobicContact CD1-CB 3.87Å; I470-H489 WeakPolarHBondContact CD1-O 3.3Å; I470-H489 WeakPolarHBondContact CG1-O 3.23Å
471	R	46.6	Very low	62.4	Low	192 Å²	192	87 Å²	87	73%	0.725	48%	0.483	S	S	*	.			trans	-68.2	99.1	160.2	-80	-176.3	175.6	177.2	-0.5	107.1	R469 T473	R469-R471 PolarHBondContact O-N 3.25Å; R471-T473 PolarHBondContact O-N 3.4Å
472	T	40.1	Very low	60.1	Low	87 Å²	87	88.3 Å²	88.3	53%	0.534	50%	0.498	S	S	.	.			trans	-71	85	155.4	35.9	0	0	0	0	107.5	I470 M474 V488	I470-T472 HydrophobicContact CG2-CG2 4.42Å; I470-T472 PolarHBondContact O-N 3.15Å; I470-T472 VanDerWaalsContact O-N 3.1Å; T472-M474 PolarHBondContact O-N 3.3Å; T472-V488 HydrophobicContact CG2-CG2 4.02Å
473	T	35.8	Very low	57.4	Low	123 Å²	123	91.9 Å²	91.9	76%	0.755	53%	0.53	S	S	*	.			trans	-72.7	71	153.5	49	0	0	0	0	107.4	R471	R471-T473 PolarHBondContact O-N 3.4Å
474	M	35.6	Very low	54.6	Low	156 Å²	156	97.4 Å²	97.4	77%	0.768	57%	0.567	S	S	*	*			trans	-96.5	120.8	151.2	-75.5	-156.7	-164.4	0	0	106.5	T472	T472-M474 PolarHBondContact O-N 3.3Å
475	P	43.5	Very low	51.8	Low	98 Å²	98	103.7 Å²	103.7	64%	0.636	58%	0.583	S	S	*	*			trans	-61.1	147.6	167.7	27.2	-31.1	0	0	0	108.6	V477	P475-V477 PolarHBondContact O-N 2.91Å
476	P	44.2	Very low	49	Very low	132 Å²	132	106.4 Å²	106.4	86%	0.857	61%	0.606	S	S	*	*			trans	-65.9	100.4	173.4	27.4	-30.9	0	0	0	108.4
477	V	45.1	Very low	46.5	Very low	107 Å²	107	113.9 Å²	113.9	65%	0.648	64%	0.641	S	S	*	*			trans	-80.4	125	168.9	179.6	0	0	0	0	107.7	P475 T479	P475-V477 PolarHBondContact O-N 2.91Å; V477-T479 PolarHBondContact O-N 2.79Å
478	S	49.2	Very low	44.7	Very low	123 Å²	123	113.9 Å²	113.9	86%	0.86	64%	0.644	S	S	*	*	S	Bend	trans	-66.3	30.8	-167.3	48.8	0	0	0	0	116.6
479	T	48	Very low	43.6	Very low	100 Å²	100	116.2 Å²	116.2	61%	0.613	66%	0.655	S	S	*	*			trans	-104.5	114.1	178.2	57.5	0	0	0	0	110.5	V477 R481	V477-T479 PolarHBondContact O-N 2.79Å; T479-R481 PolarHBondContact O-N 3.35Å
480	G	45.2	Very low	43.7	Very low	93 Å²	93	116.4 Å²	116.4	96%	0.959	66%	0.658	S	S	*	*			trans	-64.6	51.8	-177.9	0	0	0	0	0	116.4
481	R	40.7	Very low	45.3	Very low	219 Å²	219	114.1 Å²	114.1	83%	0.826	65%	0.648	S	S	*	*	S	Bend	trans	-109.6	140	165.3	-74.3	-175.3	-179.1	176.8	1.4	109.1	T479 A483	T479-R481 PolarHBondContact O-N 3.35Å; R481-A483 PolarHBondContact O-N 2.93Å
482	P	42.1	Very low	47.3	Very low	129 Å²	129	107.9 Å²	107.9	84%	0.838	63%	0.629	S	S	*	*			trans	-61.6	113	173.8	26.4	-31.1	0	0	0	108.1	C484	P482-C484 PolarHBondContact O-N 3.05Å
483	A	37.8	Very low	49.8	Very low	95 Å²	95	103.8 Å²	103.8	79%	0.785	60%	0.604	S	S	*	*			trans	-56.5	125.1	171.2	0	0	0	0	0	108	R481 R485	R481-A483 PolarHBondContact O-N 2.93Å; A483-R485 PolarHBondContact O-N 3.15Å; A483-R485 VanDerWaalsContact O-N 3.1Å
484	C	32.2	Very low	52.7	Low	117 Å²	117	97.9 Å²	97.9	79%	0.791	57%	0.568	S	S	*	*			trans	-47.1	123.6	166.3	-96.4	0	0	0	0	107.7	P482 C486	P482-C484 PolarHBondContact O-N 3.05Å; C484-C486 PolarHBondContact O-N 3.37Å; C484-C486 PolarHBondContact O-SG 2.82Å; C484-C486 VanDerWaalsContact O-SG 3.32Å
485	R	30.8	Very low	55.6	Low	184 Å²	184	90.5 Å²	90.5	69%	0.694	53%	0.531	S	S	*	.			trans	-66.6	78.7	174.9	-169.4	-175.8	-142.3	148.5	15.4	107.5	A483 Q487	A483-R485 PolarHBondContact O-N 3.15Å; A483-R485 VanDerWaalsContact O-N 3.1Å; R485-Q487 PolarHBondContact O-N 2.82Å
486	C	32.8	Very low	58.1	Low	92 Å²	92	85.8 Å²	85.8	62%	0.622	50%	0.501	S	S	*	.			trans	-56.8	109.3	164.8	-40.4	0	0	0	0	104.6	C484 V488	C484-C486 PolarHBondContact O-N 3.37Å; C484-C486 PolarHBondContact O-SG 2.82Å; C484-C486 VanDerWaalsContact O-SG 3.32Å; C486-V488 VanDerWaalsContact C-N 3.26Å; C486-V488 PolarHBondContact O-N 2.94Å
487	Q	39	Very low	60.5	Low	159 Å²	159	79.8 Å²	79.8	74%	0.743	46%	0.462	S	S	*	.			trans	-62.4	100.1	172.7	-81.9	167.8	-27.6	0	0	105.9	R485 H489	R485-Q487 PolarHBondContact O-N 2.82Å; Q487-H489 PolarHBondContact O-CD2 2.87Å; Q487-H489 PolarHBondContact O-N 3.46Å
488	V	47.9	Very low	62.8	Low	46 Å²	46	75 Å²	75	28%	0.279	43%	0.433	S	S	.	.			trans	-54.3	105.1	170.8	176.4	0	0	0	0	105	I470 T472 C486 K490	I470-V488 HydrophobicContact CB-CG1 3.52Å; I470-V488 HydrophobicContact CG1-CG1 4.46Å; I470-V488 HydrophobicContact CG2-CG1 4.09Å; I470-V488 WeakPolarHBondContact O-CG1 3.28Å; T472-V488 HydrophobicContact CG2-CG2 4.02Å; C486-V488 VanDerWaalsContact C-N 3.26Å; C486-V488 PolarHBondContact O-N 2.94Å; V488-K490 VanDerWaalsContact C-N 3.29Å; V488-K490 HydrophobicContact CG1-CG 3.93Å; V488-K490 PolarHBondContact O-N 2.68Å
489	H	54.7	Low	64.8	Low	50 Å²	50	70.3 Å²	70.3	23%	0.231	40%	0.399	C	S	.	.			trans	-60.6	95.1	176.7	-64.4	-86.5	0	0	0	108.1	A390 N392 I470 Q487	A390-H489 HydrophobicContact CB-CB 3.69Å; N392-H489 PolarHBondContact OD1-CE1 3.4Å; N392-H489 PolarHBondContact OD1-NE2 2.55Å; N392-H489 VanDerWaalsContact OD1-NE2 3.15Å; I470-H489 HydrophobicContact CD1-CB 3.87Å; I470-H489 WeakPolarHBondContact CD1-O 3.3Å; I470-H489 WeakPolarHBondContact CG1-O 3.23Å; Q487-H489 PolarHBondContact O-CD2 2.87Å; Q487-H489 PolarHBondContact O-N 3.46Å
490	K	73.8	Confident	66.7	Low	86 Å²	86	66.7 Å²	66.7	37%	0.374	37%	0.374	S	S	.	.			trans	-101.3	148.3	172.6	-66.3	-176.8	178.8	-174.1	0	107.2	V488	V488-K490 VanDerWaalsContact C-N 3.29Å; V488-K490 HydrophobicContact CG1-CG 3.93Å; V488-K490 PolarHBondContact O-N 2.68Å
491	A	86.6	Confident	68.4	Low	9 Å²	9	66.5 Å²	66.5	7%	0.074	35%	0.345	C	S	.	.			trans	-57.6	141.3	165.2	0	0	0	0	0	109.6	H396 V398 K467 I526	H396-A491 PolarHBondContact CE1-N 3.27Å; H396-A491 WeakPolarHBondContact O-CA 3.46Å; V398-A491 HydrophobicContact CG2-CB 3.96Å; K467-A491 PolarHBondContact O-N 3.1Å; A491-I526 HydrophobicContact CB-CD1 4.11Å
492	D	89.1	Confident	70.5	Confident	61 Å²	61	57.1 Å²	57.1	33%	0.326	31%	0.313	S	S	.	.	S	Bend	trans	-75	-45.7	-178.7	-165.8	47.3	0	0	0	110.9	R395 H396 Y1008	R395-D492 HydrophobicContact CB-CB 4.46Å; R395-D492 IonicContact NH1-OD2 2.85Å; H396-D492 PolarHBondContact O-N 3.16Å; D492-Y1008 PolarHBondContact OD2-OH 2.62Å
493	A	93	Very high	72.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	159.3	175.1	0	0	0	0	0	111.4	I397 V398 R527 Y1008	I397-A493 WeakPolarHBondContact CA-O 3.41Å; I397-A493 HydrophobicContact CG2-CB 4.45Å; V398-A493 PolarHBondContact N-O 2.65Å; A493-R527 CarbonylContact C-O 3.58Å; A493-R527 VanDerWaalsContact CA-O 3.31Å; A493-R527 WeakPolarHBondContact CA-O 3.44Å; A493-R527 HydrophobicContact CB-CB 4.1Å; A493-R527 HydrophobicContact CB-CG 4.39Å; A493-Y1008 HydrophobicContact CB-CD2 3.78Å; A493-Y1008 HydrophobicContact CB-CE2 3.73Å
494	C	95.3	Very high	74.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	125.6	167.4	-170	0	0	0	0	110.3	V398 L519 I526 R527 V528 I529	V398-C494 CarbonylContact O-C 3.48Å; V398-C494 VanDerWaalsContact O-CA 3.24Å; V398-C494 WeakPolarHBondContact O-CA 3.39Å; V398-C494 PolarHBondContact O-SG 3.22Å; C494-L519 HydrophobicContact CB-CD1 4.09Å; C494-L519 HydrophobicContact CB-CD2 4.44Å; C494-L519 WeakPolarHBondContact SG-CD1 3.48Å; C494-I526 HydrophobicContact CB-CD1 4.13Å; C494-R527 PolarHBondContact N-O 2.63Å; C494-V528 WeakPolarHBondContact O-CA 3.47Å; C494-I529 PolarHBondContact O-N 2.78Å
495	L	96.1	Very high	77.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.8	178.6	-53.5	-176.5	0	0	0	109.1	I397 V398 V399 C400 F411 I529 M1004	I397-L495 HydrophobicContact CD1-CD1 3.72Å; I397-L495 HydrophobicContact CD1-CG 4.43Å; V398-L495 PolarHBondContact O-N 2.83Å; V399-L495 WeakPolarHBondContact CA-O 3.18Å; V399-L495 HydrophobicContact CG1-CB 4.39Å; V399-L495 HydrophobicContact CG2-CB 4.23Å; V399-L495 HydrophobicContact CG2-CD1 4.18Å; V399-L495 HydrophobicContact CG2-CG 4.49Å; C400-L495 PolarHBondContact N-O 3.05Å; F411-L495 HydrophobicContact CE2-CD1 3.51Å; F411-L495 HydrophobicContact CZ-CD1 3.49Å; F411-L495 VanDerWaalsContact CZ-CD1 3.49Å; L495-I529 CarbonylContact C-O 3.47Å; L495-I529 WeakPolarHBondContact CA-O 3.39Å; L495-I529 HydrophobicContact CD2-CB 3.7Å; L495-I529 HydrophobicContact CD2-CD1 3.69Å; L495-I529 HydrophobicContact CD2-CG1 3.95Å; L495-M1004 HydrophobicContact CB-CE 3.79Å; L495-M1004 HydrophobicContact CD2-CE 4.19Å; L495-M1004 HydrophobicContact CG-CE 4.45Å
496	I	96.7	Very high	80.7	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	110.7	179.5	-47	-175.9	0	0	0	109	C400 N512 R515 V516 L519 V528 I529 V530 Q531	C400-I496 WeakPolarHBondContact O-CA 3.3Å; I496-N512 HydrophobicContact CG2-CB 4.33Å; I496-N512 WeakPolarHBondContact CG2-OD1 3.27Å; I496-R515 HydrophobicContact CD1-CB 4.08Å; I496-V516 HydrophobicContact CD1-CB 4.48Å; I496-V516 HydrophobicContact CD1-CG2 3.49Å; I496-V516 VanDerWaalsContact CD1-CG2 3.49Å; I496-L519 HydrophobicContact CD1-CD1 3.88Å; I496-L519 HydrophobicContact CG1-CD1 4.39Å; I496-V528 HydrophobicContact CD1-CG1 3.91Å; I496-V528 HydrophobicContact CG1-CG1 4.29Å; I496-I529 PolarHBondContact N-O 2.84Å; I496-V530 HydrophobicContact CB-CB 4.2Å; I496-V530 HydrophobicContact CB-CG2 4Å; I496-V530 HydrophobicContact CD1-CB 4.37Å; I496-V530 HydrophobicContact CD1-CG2 4.31Å; I496-V530 HydrophobicContact CG2-CG2 4.27Å; I496-Q531 PolarHBondContact O-N 3.32Å
497	L	94.8	Very high	83.6	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	142	177.9	-57.4	179.8	0	0	0	110.9	V399 C400 G401 Y402 I403 M1004	V399-L497 HydrophobicContact CG1-CD1 3.89Å; V399-L497 HydrophobicContact CG1-CG 4.06Å; C400-L497 PolarHBondContact O-N 2.86Å; G401-L497 WeakPolarHBondContact CA-O 3.14Å; Y402-L497 PolarHBondContact N-O 3.24Å; I403-L497 HydrophobicContact CD1-CD1 4.07Å; L497-M1004 HydrophobicContact CD2-CE 4.1Å; L497-M1004 HydrophobicContact CD2-CG 4.09Å
498	A	93.7	Very high	86.3	Confident	6 Å²	6	35 Å²	35	5%	0.05	19%	0.192	C	C	.	.			trans	-107	148.2	179.1	0	0	0	0	0	111.8	K500 N512 Q531 M533	A498-K500 PolarHBondContact O-N 2.96Å; A498-N512 WeakPolarHBondContact CB-ND2 3.32Å; A498-Q531 HydrophobicContact CB-CB 3.76Å; A498-M533 HydrophobicContact CB-SD 4.49Å
499	N	91	Very high	88.6	Confident	25 Å²	25	32.8 Å²	32.8	13%	0.134	18%	0.179	C	C	.	.			trans	-75.3	105.7	168.6	-175	3.5	0	0	0	110.9	Y402 Y501 S502 E508	Y402-N499 HydrophobicContact CD1-CB 3.87Å; Y402-N499 HydrophobicContact CD2-CB 3.66Å; Y402-N499 HydrophobicContact CE1-CB 4.11Å; Y402-N499 HydrophobicContact CE2-CB 3.93Å; Y402-N499 HydrophobicContact CG-CB 3.62Å; N499-Y501 PolarHBondContact O-N 3.39Å; N499-Y501 PolarHBondContact OD1-N 3.03Å; N499-S502 PolarHBondContact O-N 2.85Å; N499-S502 PolarHBondContact O-OG 3.29Å; N499-E508 HydrophobicContact CB-CG 4.19Å; N499-E508 PolarHBondContact N-OE1 3.15Å
500	K	86.7	Confident	90.6	Very high	23 Å²	23	32.8 Å²	32.8	10%	0.1	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22.4	179.5	-59.3	179.7	177.9	-177.1	0	114.3	A498 M533 L558 I997 D1001	A498-K500 PolarHBondContact O-N 2.96Å; K500-M533 WeakPolarHBondContact O-CE 3.38Å; K500-L558 HydrophobicContact CD-CD1 4.28Å; K500-L558 HydrophobicContact CG-CD1 3.82Å; K500-I997 HydrophobicContact CD-CD1 4.5Å; K500-I997 HydrophobicContact CD-CG1 4.26Å; K500-I997 HydrophobicContact CD-CG2 4.18Å; K500-I997 PolarHBondContact NZ-O 2.89Å; K500-D1001 WeakPolarHBondContact CE-OD1 3.47Å; K500-D1001 WeakPolarHBondContact CE-OD2 3.4Å; K500-D1001 IonicContact NZ-OD1 3.64Å; K500-D1001 PolarHBondContact NZ-OD1 3.26Å; K500-D1001 IonicContact NZ-OD2 2.79Å; K500-D1001 PolarHBondContact NZ-OD2 2.86Å
501	Y	82.1	Confident	91.7	Very high	90 Å²	90	30.4 Å²	30.4	35%	0.353	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	17	-173.4	-46.6	-67.8	0	0	0	111.9	N499 V963	N499-Y501 PolarHBondContact O-N 3.39Å; N499-Y501 PolarHBondContact OD1-N 3.03Å; Y501-V963 HydrophobicContact CD1-CG1 3.52Å; Y501-V963 HydrophobicContact CE1-CG1 3.37Å; Y501-V963 PolarHBondContact OH-O 2.86Å
502	S	84.6	Confident	92.2	Very high	22 Å²	22	30 Å²	30	15%	0.154	18%	0.18	C	C	.	.			trans	-60.1	137.1	177	63.5	0	0	0	0	111	N499 D504 P505	N499-S502 PolarHBondContact O-N 2.85Å; N499-S502 PolarHBondContact O-OG 3.29Å; S502-D504 PolarHBondContact O-N 3.42Å; S502-P505 WeakPolarHBondContact OG-CA 3.49Å
503	S	82.4	Confident	92.6	Very high	78 Å²	78	27.8 Å²	27.8	55%	0.545	17%	0.169	S	C	.	.	S	Bend	trans	-65.4	-28.9	173	52.8	0	0	0	0	113.1	I896	S503-I896 WeakPolarHBondContact O-CD1 3.46Å
504	D	89.1	Confident	92.8	Very high	83 Å²	83	32.4 Å²	32.4	44%	0.444	19%	0.191	S	C	.	.			trans	-124.8	96.4	174.9	-174.2	-5.1	0	0	0	109.9	S502 D506 A507 E508	S502-D504 PolarHBondContact O-N 3.42Å; D504-D506 PolarHBondContact O-N 2.91Å; D504-D506 PolarHBondContact OD1-N 3.38Å; D504-D506 VanDerWaalsContact OD1-N 3.12Å; D504-A507 HydrophobicContact CB-CB 4.08Å; D504-A507 PolarHBondContact O-N 3.2Å; D504-A507 PolarHBondContact OD1-N 2.99Å; D504-E508 PolarHBondContact O-N 2.95Å
505	P	91.4	Very high	92.8	Very high	7 Å²	7	34.9 Å²	34.9	5%	0.045	20%	0.201	C	C	.	.	H	α-helix	trans	-66.3	-24.7	-179.6	26.3	-33.6	0	0	0	113.3	S502 D509 M533 Q534 P819	S502-P505 WeakPolarHBondContact OG-CA 3.49Å; P505-D509 WeakPolarHBondContact O-CB 3.47Å; P505-D509 PolarHBondContact O-N 2.87Å; P505-D509 VanDerWaalsContact O-N 3.07Å; P505-M533 HydrophobicContact CB-CB 3.73Å; P505-M533 HydrophobicContact CB-CG 4.12Å; P505-Q534 HydrophobicContact CB-CG 4.24Å; P505-Q534 HydrophobicContact CG-CG 4.4Å; P505-P819 HydrophobicContact CG-CB 3.73Å; P505-P819 HydrophobicContact CG-CG 4.45Å
506	D	93.3	Very high	92.9	Very high	60 Å²	60	34.9 Å²	34.9	32%	0.321	20%	0.201	S	C	.	.	H	α-helix	trans	-73.6	-38	179.5	-73	-40	0	0	0	111.8	D504 A510 H536 N537	D504-D506 PolarHBondContact O-N 2.91Å; D504-D506 PolarHBondContact OD1-N 3.38Å; D504-D506 VanDerWaalsContact OD1-N 3.12Å; D506-A510 WeakPolarHBondContact O-CB 3.11Å; D506-A510 PolarHBondContact O-N 3.1Å; D506-H536 IonicContact OD1-CE1 2.62Å; D506-H536 PolarHBondContact OD1-CE1 2.76Å; D506-H536 IonicContact OD1-NE2 3.88Å; D506-H536 PolarHBondContact OD1-NE2 2.94Å; D506-N537 PolarHBondContact OD1-ND2 2.91Å
507	A	94.7	Very high	92.8	Very high	53 Å²	53	38.2 Å²	38.2	44%	0.438	22%	0.217	S	C	.	.	H	α-helix	trans	-66.1	-39.2	174.7	0	0	0	0	0	112.3	D504 A510 A511	D504-A507 HydrophobicContact CB-CB 4.08Å; D504-A507 PolarHBondContact O-N 3.2Å; D504-A507 PolarHBondContact OD1-N 2.99Å; A507-A510 PolarHBondContact O-N 3.3Å; A507-A511 PolarHBondContact O-N 2.88Å
508	E	94.9	Very high	92.8	Very high	30 Å²	30	38.8 Å²	38.8	14%	0.14	22%	0.222	C	C	.	.	H	α-helix	trans	-66.3	-44.3	176.3	-177.2	59.6	-158.9	0	0	111.4	N499 D504 A510 A511 N512 R515	N499-E508 HydrophobicContact CB-CG 4.19Å; N499-E508 PolarHBondContact N-OE1 3.15Å; D504-E508 PolarHBondContact O-N 2.95Å; E508-A510 PolarHBondContact O-N 3.32Å; E508-A511 WeakPolarHBondContact O-CB 3.39Å; E508-A511 PolarHBondContact O-N 3.2Å; E508-N512 PolarHBondContact O-N 2.9Å; E508-R515 IonicContact OE1-NH1 3.54Å; E508-R515 PolarHBondContact OE1-NH1 2.92Å
509	D	96.7	Very high	92.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-42.6	174.7	-79.4	-9.6	0	0	0	112.1	P505 A511 N512 I513 L532 M533 Q534 N537	P505-D509 WeakPolarHBondContact O-CB 3.47Å; P505-D509 PolarHBondContact O-N 2.87Å; P505-D509 VanDerWaalsContact O-N 3.07Å; D509-A511 VanDerWaalsContact C-N 3.3Å; D509-A511 PolarHBondContact O-N 3.15Å; D509-N512 PolarHBondContact O-N 2.71Å; D509-N512 VanDerWaalsContact O-N 3.17Å; D509-I513 WeakPolarHBondContact O-CD1 3.08Å; D509-I513 VanDerWaalsContact O-CG1 3.26Å; D509-I513 WeakPolarHBondContact O-CG1 3.01Å; D509-I513 PolarHBondContact O-N 2.67Å; D509-L532 HydrophobicContact CB-CD2 4.17Å; D509-L532 VanDerWaalsContact OD1-CA 3.3Å; D509-L532 WeakPolarHBondContact OD1-CA 2.93Å; D509-M533 PolarHBondContact OD1-N 3.37Å; D509-M533 PolarHBondContact OD2-N 3.43Å; D509-Q534 PolarHBondContact OD2-N 3.36Å; D509-N537 HydrophobicContact CB-CB 3.93Å; D509-N537 VanDerWaalsContact CB-ND2 3.33Å; D509-N537 WeakPolarHBondContact CB-ND2 3.2Å; D509-N537 PolarHBondContact OD2-ND2 3.1Å
510	A	97	Very high	93	Very high	50 Å²	50	37.6 Å²	37.6	41%	0.413	22%	0.215	S	C	.	.	H	α-helix	trans	-60.1	-41	175.5	0	0	0	0	0	111.7	D506 A507 E508 I513 M514	D506-A510 WeakPolarHBondContact O-CB 3.11Å; D506-A510 PolarHBondContact O-N 3.1Å; A507-A510 PolarHBondContact O-N 3.3Å; E508-A510 PolarHBondContact O-N 3.32Å; A510-I513 PolarHBondContact O-N 2.89Å; A510-M514 WeakPolarHBondContact O-CG 3.2Å; A510-M514 PolarHBondContact O-N 3.24Å
511	A	96.7	Very high	93.3	Very high	35 Å²	35	43.2 Å²	43.2	29%	0.289	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-43	174.2	0	0	0	0	0	111.7	A507 E508 D509 M514 R515	A507-A511 PolarHBondContact O-N 2.88Å; E508-A511 WeakPolarHBondContact O-CB 3.39Å; E508-A511 PolarHBondContact O-N 3.2Å; D509-A511 VanDerWaalsContact C-N 3.3Å; D509-A511 PolarHBondContact O-N 3.15Å; A511-M514 PolarHBondContact O-N 2.95Å; A511-R515 VanDerWaalsContact O-CG 3.29Å; A511-R515 WeakPolarHBondContact O-CG 3.44Å; A511-R515 PolarHBondContact O-N 2.64Å
512	N	97.1	Very high	93.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-44.3	175.5	-79.4	-26.7	0	0	0	112.8	I496 A498 E508 D509 M514 R515 V516 V530 Q531 L532	I496-N512 HydrophobicContact CG2-CB 4.33Å; I496-N512 WeakPolarHBondContact CG2-OD1 3.27Å; A498-N512 WeakPolarHBondContact CB-ND2 3.32Å; E508-N512 PolarHBondContact O-N 2.9Å; D509-N512 PolarHBondContact O-N 2.71Å; D509-N512 VanDerWaalsContact O-N 3.17Å; N512-M514 VanDerWaalsContact C-N 3.3Å; N512-M514 PolarHBondContact O-N 3.4Å; N512-R515 WeakPolarHBondContact O-CB 3.14Å; N512-R515 PolarHBondContact O-N 3.02Å; N512-R515 VanDerWaalsContact O-N 3.11Å; N512-R515 PolarHBondContact OD1-NH1 3.22Å; N512-V516 WeakPolarHBondContact O-CG2 3.15Å; N512-V516 PolarHBondContact O-N 3.02Å; N512-V530 HydrophobicContact CB-CG2 4.06Å; N512-Q531 PolarHBondContact ND2-O 3.04Å; N512-L532 HydrophobicContact CB-CD2 4.24Å
513	I	97.1	Very high	93.9	Very high	16 Å²	16	40 Å²	40	8%	0.082	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-42.6	175.3	-68.5	160.2	0	0	0	110.4	D509 A510 R515 V516 I517 L532 N537 Y540 L541	D509-I513 WeakPolarHBondContact O-CD1 3.08Å; D509-I513 VanDerWaalsContact O-CG1 3.26Å; D509-I513 WeakPolarHBondContact O-CG1 3.01Å; D509-I513 PolarHBondContact O-N 2.67Å; A510-I513 PolarHBondContact O-N 2.89Å; I513-R515 VanDerWaalsContact C-N 3.33Å; I513-R515 PolarHBondContact O-N 3Å; I513-V516 WeakPolarHBondContact O-CB 3.47Å; I513-V516 PolarHBondContact O-N 2.85Å; I513-I517 HydrophobicContact CG2-CD1 4.07Å; I513-I517 WeakPolarHBondContact O-CG1 3.47Å; I513-I517 PolarHBondContact O-N 3.17Å; I513-L532 HydrophobicContact CG1-CD2 4.28Å; I513-N537 HydrophobicContact CD1-CB 4.19Å; I513-Y540 HydrophobicContact CD1-CD2 3.93Å; I513-Y540 HydrophobicContact CD1-CG 4.44Å; I513-L541 HydrophobicContact CB-CD2 4.42Å; I513-L541 HydrophobicContact CG1-CD2 3.96Å; I513-L541 HydrophobicContact CG1-CG 4.23Å; I513-L541 HydrophobicContact CG2-CD2 4.28Å
514	M	96.9	Very high	94.3	Very high	96 Å²	96	38.7 Å²	38.7	47%	0.473	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-37.4	175.3	-72.9	-58.2	-60	0	0	112.9	M458 A510 A511 N512 I517 S518	M458-M514 HydrophobicContact CE-CB 4.03Å; M458-M514 HydrophobicContact CE-CE 4.02Å; M458-M514 HydrophobicContact SD-CB 4.38Å; A510-M514 WeakPolarHBondContact O-CG 3.2Å; A510-M514 PolarHBondContact O-N 3.24Å; A511-M514 PolarHBondContact O-N 2.95Å; N512-M514 VanDerWaalsContact C-N 3.3Å; N512-M514 PolarHBondContact O-N 3.4Å; M514-I517 PolarHBondContact O-N 3.21Å; M514-I517 HydrophobicContact SD-CD1 4Å; M514-S518 PolarHBondContact O-N 3.26Å
515	R	96.6	Very high	94.2	Very high	53 Å²	53	40.5 Å²	40.5	20%	0.2	23%	0.23	C	C	.	.	H	α-helix	trans	-62.2	-43.7	172.9	-65.8	168.3	-171	142.5	4	111	V457 M458 I496 E508 A511 N512 I513 S518 L519	V457-R515 HydrophobicContact CG2-CB 3.71Å; V457-R515 HydrophobicContact CG2-CG 3.56Å; M458-R515 HydrophobicContact SD-CG 4.3Å; I496-R515 HydrophobicContact CD1-CB 4.08Å; E508-R515 IonicContact OE1-NH1 3.54Å; E508-R515 PolarHBondContact OE1-NH1 2.92Å; A511-R515 VanDerWaalsContact O-CG 3.29Å; A511-R515 WeakPolarHBondContact O-CG 3.44Å; A511-R515 PolarHBondContact O-N 2.64Å; N512-R515 WeakPolarHBondContact O-CB 3.14Å; N512-R515 PolarHBondContact O-N 3.02Å; N512-R515 VanDerWaalsContact O-N 3.11Å; N512-R515 PolarHBondContact OD1-NH1 3.22Å; I513-R515 VanDerWaalsContact C-N 3.33Å; I513-R515 PolarHBondContact O-N 3Å; R515-S518 PolarHBondContact O-N 3.49Å; R515-L519 WeakPolarHBondContact O-CG 3.27Å; R515-L519 PolarHBondContact O-N 3.28Å
516	V	96.4	Very high	94.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-46.4	174.6	178.3	0	0	0	0	111.1	I496 N512 I513 S518 L519 K520 V528 V530 L541 I544 W547	I496-V516 HydrophobicContact CD1-CB 4.48Å; I496-V516 HydrophobicContact CD1-CG2 3.49Å; I496-V516 VanDerWaalsContact CD1-CG2 3.49Å; N512-V516 WeakPolarHBondContact O-CG2 3.15Å; N512-V516 PolarHBondContact O-N 3.02Å; I513-V516 WeakPolarHBondContact O-CB 3.47Å; I513-V516 PolarHBondContact O-N 2.85Å; V516-S518 VanDerWaalsContact C-N 3.32Å; V516-S518 PolarHBondContact O-N 3.45Å; V516-L519 PolarHBondContact O-N 3.29Å; V516-K520 HydrophobicContact CG1-CG 4.05Å; V516-K520 WeakPolarHBondContact O-CB 3.13Å; V516-K520 WeakPolarHBondContact O-CG 3.32Å; V516-K520 PolarHBondContact O-N 3.3Å; V516-V528 HydrophobicContact CG1-CG1 4.41Å; V516-V528 HydrophobicContact CG2-CG1 4.07Å; V516-V530 HydrophobicContact CG2-CB 4.11Å; V516-V530 HydrophobicContact CG2-CG1 4.24Å; V516-V530 HydrophobicContact CG2-CG2 4.1Å; V516-L541 HydrophobicContact CB-CD2 4.03Å; V516-L541 HydrophobicContact CG1-CD2 3.99Å; V516-L541 HydrophobicContact CG2-CD2 3.99Å; V516-I544 HydrophobicContact CG1-CD1 4.03Å; V516-W547 HydrophobicContact CG1-CE3 3.83Å; V516-W547 HydrophobicContact CG1-CZ3 3.76Å
517	I	96.3	Very high	94.2	Very high	69 Å²	69	39 Å²	39	35%	0.354	22%	0.22	S	C	.	.	H	α-helix	trans	-58.4	-45.5	178.6	-68.6	167	0	0	0	110.6	I513 M514 L519 K520 N521 I544	I513-I517 HydrophobicContact CG2-CD1 4.07Å; I513-I517 WeakPolarHBondContact O-CG1 3.47Å; I513-I517 PolarHBondContact O-N 3.17Å; M514-I517 PolarHBondContact O-N 3.21Å; M514-I517 HydrophobicContact SD-CD1 4Å; I517-L519 PolarHBondContact O-N 3.12Å; I517-K520 PolarHBondContact O-N 2.63Å; I517-N521 WeakPolarHBondContact O-CB 3.17Å; I517-N521 PolarHBondContact O-N 3.01Å; I517-I544 HydrophobicContact CG1-CD1 3.66Å; I517-I544 HydrophobicContact CG1-CG1 4.24Å
518	S	95	Very high	94.2	Very high	19 Å²	19	36.5 Å²	36.5	13%	0.133	20%	0.199	C	C	.	.	H	α-helix	trans	-59.6	-47.1	177.3	-174.2	0	0	0	0	112.2	V457 M458 M514 R515 V516 N521 Y522	V457-S518 WeakPolarHBondContact O-CB 3.46Å; V457-S518 PolarHBondContact O-OG 2.67Å; M458-S518 WeakPolarHBondContact CA-OG 3.27Å; M514-S518 PolarHBondContact O-N 3.26Å; R515-S518 PolarHBondContact O-N 3.49Å; V516-S518 VanDerWaalsContact C-N 3.32Å; V516-S518 PolarHBondContact O-N 3.45Å; S518-N521 PolarHBondContact O-N 2.89Å; S518-Y522 WeakPolarHBondContact O-CB 3.34Å; S518-Y522 PolarHBondContact O-N 3.33Å
519	L	93.8	Very high	94.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-48.7	179.1	-73	163.8	0	0	0	112.3	L463 C494 I496 R515 V516 I517 N521 Y522 S523	L463-L519 HydrophobicContact CD2-CD2 3.56Å; C494-L519 HydrophobicContact CB-CD1 4.09Å; C494-L519 HydrophobicContact CB-CD2 4.44Å; C494-L519 WeakPolarHBondContact SG-CD1 3.48Å; I496-L519 HydrophobicContact CD1-CD1 3.88Å; I496-L519 HydrophobicContact CG1-CD1 4.39Å; R515-L519 WeakPolarHBondContact O-CG 3.27Å; R515-L519 PolarHBondContact O-N 3.28Å; V516-L519 PolarHBondContact O-N 3.29Å; I517-L519 PolarHBondContact O-N 3.12Å; L519-N521 VanDerWaalsContact C-N 3.33Å; L519-N521 PolarHBondContact O-N 3.2Å; L519-Y522 PolarHBondContact O-N 2.76Å; L519-S523 PolarHBondContact O-N 2.96Å
520	K	93.6	Very high	94.2	Very high	5 Å²	5	35.1 Å²	35.1	2%	0.022	19%	0.192	C	C	.	.	H	α-helix	trans	-68.9	-30.3	-179.6	-71.2	-62	-168.1	175.1	0	112.8	V516 I517 S523 P524 I526 V528 D553	V516-K520 HydrophobicContact CG1-CG 4.05Å; V516-K520 WeakPolarHBondContact O-CB 3.13Å; V516-K520 WeakPolarHBondContact O-CG 3.32Å; V516-K520 PolarHBondContact O-N 3.3Å; I517-K520 PolarHBondContact O-N 2.63Å; K520-S523 CarbonylContact O-C 3.6Å; K520-P524 PolarHBondContact NZ-O 3.01Å; K520-P524 WeakPolarHBondContact O-CA 3.42Å; K520-I526 PolarHBondContact NZ-O 3.47Å; K520-V528 HydrophobicContact CD-CG2 4.27Å; K520-D553 VanDerWaalsContact CE-OD2 3.31Å; K520-D553 WeakPolarHBondContact CE-OD2 3.32Å; K520-D553 IonicContact NZ-OD1 3.38Å; K520-D553 PolarHBondContact NZ-OD1 2.96Å; K520-D553 IonicContact NZ-OD2 2.6Å; K520-D553 PolarHBondContact NZ-OD2 2.95Å
521	N	92.9	Very high	94.2	Very high	142 Å²	142	32.8 Å²	32.8	76%	0.759	17%	0.173	S	C	*	.	H	α-helix	trans	-69.4	-38.1	171.8	-173.4	32.9	0	0	0	111.7	I517 S518 L519	I517-N521 WeakPolarHBondContact O-CB 3.17Å; I517-N521 PolarHBondContact O-N 3.01Å; S518-N521 PolarHBondContact O-N 2.89Å; L519-N521 VanDerWaalsContact C-N 3.33Å; L519-N521 PolarHBondContact O-N 3.2Å
522	Y	91.2	Very high	94.1	Very high	41 Å²	41	31.1 Å²	31.1	16%	0.161	16%	0.159	C	C	.	.	H	α-helix	trans	-74.5	-43.7	177.1	-173	-101	0	0	0	112.9	L463 S464 V468 R469 S518 L519	L463-Y522 HydrophobicContact CB-CD1 4Å; L463-Y522 HydrophobicContact CB-CD2 4.44Å; L463-Y522 HydrophobicContact CB-CE1 3.98Å; L463-Y522 HydrophobicContact CB-CE2 4.42Å; L463-Y522 HydrophobicContact CB-CG 4.23Å; L463-Y522 HydrophobicContact CD1-CD1 4.06Å; L463-Y522 HydrophobicContact CD1-CD2 4.21Å; L463-Y522 HydrophobicContact CD1-CG 3.72Å; S464-Y522 WeakPolarHBondContact CB-OH 3.45Å; V468-Y522 HydrophobicContact CB-CD1 4.24Å; V468-Y522 HydrophobicContact CB-CE1 4.13Å; V468-Y522 HydrophobicContact CG1-CD1 3.81Å; V468-Y522 HydrophobicContact CG1-CE1 4.16Å; R469-Y522 HydrophobicContact CB-CD1 4.07Å; R469-Y522 HydrophobicContact CB-CE1 3.56Å; R469-Y522 WeakPolarHBondContact CD-O 3.24Å; R469-Y522 PolarHBondContact O-OH 3.36Å; S518-Y522 WeakPolarHBondContact O-CB 3.34Å; S518-Y522 PolarHBondContact O-N 3.33Å; L519-Y522 PolarHBondContact O-N 2.76Å
523	S	89.6	Confident	93.9	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.014	16%	0.164	C	C	.	.			trans	-142.3	101.1	177.8	-170	0	0	0	0	110.9	L519 K520 D525 I526	L519-S523 PolarHBondContact O-N 2.96Å; K520-S523 CarbonylContact O-C 3.6Å; S523-D525 VanDerWaalsContact C-N 3.29Å; S523-D525 PolarHBondContact O-N 3.47Å; S523-I526 WeakPolarHBondContact O-CG2 3.34Å; S523-I526 PolarHBondContact O-N 2.96Å
524	P	89.2	Confident	93.6	Very high	52 Å²	52	32 Å²	32	34%	0.338	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-30.9	-177.9	24.4	-34	0	0	0	113.3	K520 I526	K520-P524 PolarHBondContact NZ-O 3.01Å; K520-P524 WeakPolarHBondContact O-CA 3.42Å; P524-I526 VanDerWaalsContact C-N 3.33Å; P524-I526 PolarHBondContact O-N 3.07Å
525	D	88.3	Confident	93.3	Very high	121 Å²	121	28.8 Å²	28.8	65%	0.647	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.4	-175.4	-46.9	-37.3	0	0	0	114.1	S523	S523-D525 VanDerWaalsContact C-N 3.29Å; S523-D525 PolarHBondContact O-N 3.47Å
526	I	90.6	Very high	92.9	Very high	8 Å²	8	30.1 Å²	30.1	4%	0.041	15%	0.154	C	C	.	.	S	Bend	trans	-74	136.8	-178.2	-168.7	167.5	0	0	0	110.2	V468 A491 C494 K520 S523 P524 V528	V468-I526 HydrophobicContact CG1-CD1 3.75Å; A491-I526 HydrophobicContact CB-CD1 4.11Å; C494-I526 HydrophobicContact CB-CD1 4.13Å; K520-I526 PolarHBondContact NZ-O 3.47Å; S523-I526 WeakPolarHBondContact O-CG2 3.34Å; S523-I526 PolarHBondContact O-N 2.96Å; P524-I526 VanDerWaalsContact C-N 3.33Å; P524-I526 PolarHBondContact O-N 3.07Å; I526-V528 HydrophobicContact CG2-CG2 3.88Å; I526-V528 PolarHBondContact O-N 3.21Å
527	R	93.3	Very high	92.7	Very high	28 Å²	28	30.6 Å²	30.6	11%	0.106	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	125.4	171.2	-172.6	-177.8	175.7	-172.9	2.6	110.2	A493 C494 G552 D554 T1007 Y1008 D1011	A493-R527 CarbonylContact C-O 3.58Å; A493-R527 VanDerWaalsContact CA-O 3.31Å; A493-R527 WeakPolarHBondContact CA-O 3.44Å; A493-R527 HydrophobicContact CB-CB 4.1Å; A493-R527 HydrophobicContact CB-CG 4.39Å; C494-R527 PolarHBondContact N-O 2.63Å; R527-G552 WeakPolarHBondContact CD-O 3.4Å; R527-G552 WeakPolarHBondContact CG-O 3.16Å; R527-G552 PolarHBondContact NE-O 2.98Å; R527-D554 IonicContact NH2-OD2 3.79Å; R527-D554 PolarHBondContact NH2-OD2 3Å; R527-T1007 PolarHBondContact NH2-O 3.45Å; R527-Y1008 PolarHBondContact NH1-O 2.97Å; R527-D1011 VanDerWaalsContact CZ-CG 3.47Å; R527-D1011 IonicContact CZ-OD1 2.57Å; R527-D1011 IonicContact CZ-OD2 2.97Å; R527-D1011 IonicContact NH1-OD1 2.73Å; R527-D1011 PolarHBondContact NH1-OD1 2.93Å; R527-D1011 IonicContact NH1-OD2 2.82Å; R527-D1011 VanDerWaalsContact NH2-CG 3.29Å; R527-D1011 IonicContact NH2-OD1 3.87Å; R527-D1011 PolarHBondContact NH2-OD1 3.27Å; R527-D1011 IonicContact NH2-OD2 2.84Å
528	V	95.3	Very high	92.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.1	177.8	-176.6	0	0	0	0	110.2	C494 I496 V516 K520 I526 W547 D553 D554	C494-V528 WeakPolarHBondContact O-CA 3.47Å; I496-V528 HydrophobicContact CD1-CG1 3.91Å; I496-V528 HydrophobicContact CG1-CG1 4.29Å; V516-V528 HydrophobicContact CG1-CG1 4.41Å; V516-V528 HydrophobicContact CG2-CG1 4.07Å; K520-V528 HydrophobicContact CD-CG2 4.27Å; I526-V528 HydrophobicContact CG2-CG2 3.88Å; I526-V528 PolarHBondContact O-N 3.21Å; V528-W547 HydrophobicContact CB-CZ3 4.23Å; V528-W547 HydrophobicContact CG1-CZ3 4.37Å; V528-D553 PolarHBondContact N-OD1 2.54Å; V528-D553 WeakPolarHBondContact O-CA 3.43Å; V528-D554 PolarHBondContact O-N 3.04Å; V528-D554 VanDerWaalsContact O-N 3.15Å
529	I	95.5	Very high	92.1	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.2	172.2	-51.6	178.4	0	0	0	107.5	C494 L495 I496 D554 I556 M1004 T1007	C494-I529 PolarHBondContact O-N 2.78Å; L495-I529 CarbonylContact C-O 3.47Å; L495-I529 WeakPolarHBondContact CA-O 3.39Å; L495-I529 HydrophobicContact CD2-CB 3.7Å; L495-I529 HydrophobicContact CD2-CD1 3.69Å; L495-I529 HydrophobicContact CD2-CG1 3.95Å; I496-I529 PolarHBondContact N-O 2.84Å; I529-D554 WeakPolarHBondContact CA-O 3.32Å; I529-D554 HydrophobicContact CG1-CB 4.41Å; I529-D554 HydrophobicContact CG2-CB 4.3Å; I529-I556 HydrophobicContact CG2-CD1 4.18Å; I529-I556 HydrophobicContact CG2-CG1 4.25Å; I529-M1004 HydrophobicContact CB-CE 4.27Å; I529-M1004 HydrophobicContact CG2-CE 3.88Å; I529-M1004 HydrophobicContact CG2-SD 3.77Å; I529-T1007 HydrophobicContact CD1-CG2 4Å; I529-T1007 HydrophobicContact CG2-CG2 4.24Å
530	V	96.2	Very high	92	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.5	-174.3	58.8	0	0	0	0	111.1	I496 N512 V516 L532 L541 W547 D554 V555 I556	I496-V530 HydrophobicContact CB-CB 4.2Å; I496-V530 HydrophobicContact CB-CG2 4Å; I496-V530 HydrophobicContact CD1-CB 4.37Å; I496-V530 HydrophobicContact CD1-CG2 4.31Å; I496-V530 HydrophobicContact CG2-CG2 4.27Å; N512-V530 HydrophobicContact CB-CG2 4.06Å; V516-V530 HydrophobicContact CG2-CB 4.11Å; V516-V530 HydrophobicContact CG2-CG1 4.24Å; V516-V530 HydrophobicContact CG2-CG2 4.1Å; V530-L532 HydrophobicContact CG2-CD2 4.14Å; V530-L541 HydrophobicContact CG1-CD1 3.57Å; V530-W547 HydrophobicContact CG1-CH2 3.9Å; V530-W547 HydrophobicContact CG1-CZ3 4.37Å; V530-D554 PolarHBondContact N-O 3.48Å; V530-V555 HydrophobicContact CG1-CB 4.48Å; V530-V555 HydrophobicContact CG1-CG1 4.27Å; V530-V555 HydrophobicContact CG1-CG2 4.18Å; V530-I556 PolarHBondContact O-N 3.33Å
531	Q	95.6	Very high	92	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.009	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	131	166.4	-65.7	-178.1	-35.9	0	0	109.8	I496 A498 N512 I556 D1001 M1004	I496-Q531 PolarHBondContact O-N 3.32Å; A498-Q531 HydrophobicContact CB-CB 3.76Å; N512-Q531 PolarHBondContact ND2-O 3.04Å; Q531-I556 WeakPolarHBondContact CA-O 3.4Å; Q531-I556 HydrophobicContact CG-CB 4.47Å; Q531-D1001 PolarHBondContact NE2-OD1 3.41Å; Q531-M1004 HydrophobicContact CG-CE 4.27Å; Q531-M1004 HydrophobicContact CG-CG 3.86Å; Q531-M1004 HydrophobicContact CG-SD 3.4Å; Q531-M1004 WeakPolarHBondContact CG-SD 3.25Å; Q531-M1004 VanDerWaalsContact NE2-CG 3.28Å
532	L	95.2	Very high	91.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.5	168	-64.3	-174.8	0	0	0	109.9	D509 N512 I513 V530 K538 L541 V555 I556 C557 L558	D509-L532 HydrophobicContact CB-CD2 4.17Å; D509-L532 VanDerWaalsContact OD1-CA 3.3Å; D509-L532 WeakPolarHBondContact OD1-CA 2.93Å; N512-L532 HydrophobicContact CB-CD2 4.24Å; I513-L532 HydrophobicContact CG1-CD2 4.28Å; V530-L532 HydrophobicContact CG2-CD2 4.14Å; L532-K538 HydrophobicContact CD1-CB 4.19Å; L532-L541 HydrophobicContact CD1-CD1 3.75Å; L532-L541 HydrophobicContact CD1-CG 4.5Å; L532-L541 HydrophobicContact CG-CD1 4.35Å; L532-V555 HydrophobicContact CB-CG1 4.3Å; L532-V555 HydrophobicContact CD1-CG1 3.64Å; L532-V555 HydrophobicContact CG-CG1 3.8Å; L532-I556 PolarHBondContact N-O 3.42Å; L532-C557 CarbonylContact O-C 3.47Å; L532-C557 WeakPolarHBondContact O-CA 3.1Å; L532-L558 PolarHBondContact O-N 3.38Å
533	M	92.8	Very high	91.5	Very high	21 Å²	21	33.7 Å²	33.7	10%	0.103	17%	0.169	C	C	.	.	S	Bend	trans	-76.4	-52.5	175.8	-64.3	-57.9	-63.7	0	0	110.7	A498 K500 P505 D509 L558 A559	A498-M533 HydrophobicContact CB-SD 4.49Å; K500-M533 WeakPolarHBondContact O-CE 3.38Å; P505-M533 HydrophobicContact CB-CB 3.73Å; P505-M533 HydrophobicContact CB-CG 4.12Å; D509-M533 PolarHBondContact OD1-N 3.37Å; D509-M533 PolarHBondContact OD2-N 3.43Å; M533-L558 HydrophobicContact SD-CD1 3.71Å; M533-A559 WeakPolarHBondContact O-CB 3.4Å; M533-A559 PolarHBondContact O-N 3.42Å
534	Q	91.6	Very high	91.6	Very high	13 Å²	13	34.6 Å²	34.6	6%	0.061	17%	0.173	C	C	.	.			trans	-105	143.7	-171.8	-63.7	-64.9	-25.7	0	0	113	P505 D509 L820	P505-Q534 HydrophobicContact CB-CG 4.24Å; P505-Q534 HydrophobicContact CG-CG 4.4Å; D509-Q534 PolarHBondContact OD2-N 3.36Å; Q534-L820 PolarHBondContact NE2-O 3.42Å; Q534-L820 PolarHBondContact OE1-O 3.15Å
535	Y	89.9	Confident	91.6	Very high	28 Å²	28	38.4 Å²	38.4	11%	0.11	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-35.1	-179	-179.6	-99.8	0	0	0	113.1	N537 K538 C557 E560 N825 L1033	Y535-N537 VanDerWaalsContact C-N 3.26Å; Y535-N537 PolarHBondContact O-N 3.12Å; Y535-K538 HydrophobicContact CD2-CD 4.19Å; Y535-K538 HydrophobicContact CE2-CD 4.03Å; Y535-K538 WeakPolarHBondContact O-CB 3.4Å; Y535-K538 PolarHBondContact O-N 3.07Å; Y535-C557 VanDerWaalsContact CA-SG 3.52Å; Y535-E560 HydrophobicContact CD2-CB 4.06Å; Y535-E560 HydrophobicContact CD2-CG 4.16Å; Y535-E560 HydrophobicContact CE2-CG 4.36Å; Y535-N825 VanDerWaalsContact CB-ND2 3.32Å; Y535-N825 WeakPolarHBondContact CB-ND2 3.16Å; Y535-L1033 HydrophobicContact CE1-CD1 3.96Å
536	H	88	Confident	91.8	Very high	82 Å²	82	34.8 Å²	34.8	38%	0.38	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-26.7	-179	58.5	86	0	0	0	113	D506 K538 A539	D506-H536 IonicContact OD1-CE1 2.62Å; D506-H536 PolarHBondContact OD1-CE1 2.76Å; D506-H536 IonicContact OD1-NE2 3.88Å; D506-H536 PolarHBondContact OD1-NE2 2.94Å; H536-K538 PolarHBondContact O-N 3.27Å; H536-A539 PolarHBondContact O-N 3.34Å
537	N	92.3	Very high	91.8	Very high	10 Å²	10	35.5 Å²	35.5	5%	0.053	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.5	177.2	-65.4	-26.4	0	0	0	112.6	D506 D509 I513 Y535 A539 Y540	D506-N537 PolarHBondContact OD1-ND2 2.91Å; D509-N537 HydrophobicContact CB-CB 3.93Å; D509-N537 VanDerWaalsContact CB-ND2 3.33Å; D509-N537 WeakPolarHBondContact CB-ND2 3.2Å; D509-N537 PolarHBondContact OD2-ND2 3.1Å; I513-N537 HydrophobicContact CD1-CB 4.19Å; Y535-N537 VanDerWaalsContact C-N 3.26Å; Y535-N537 PolarHBondContact O-N 3.12Å; N537-A539 PolarHBondContact O-N 2.94Å; N537-Y540 HydrophobicContact CB-CD2 4.29Å; N537-Y540 WeakPolarHBondContact O-CD2 3.44Å; N537-Y540 PolarHBondContact O-N 3Å
538	K	91.2	Very high	91.5	Very high	9 Å²	9	37 Å²	37	4%	0.039	20%	0.195	C	C	.	.	H	α-helix	trans	-57.7	-34.4	175.2	-170	177.8	-170.3	-178.4	0	113.1	L532 Y535 H536 Y540 L541 V555 E560 E1030	L532-K538 HydrophobicContact CD1-CB 4.19Å; Y535-K538 HydrophobicContact CD2-CD 4.19Å; Y535-K538 HydrophobicContact CE2-CD 4.03Å; Y535-K538 WeakPolarHBondContact O-CB 3.4Å; Y535-K538 PolarHBondContact O-N 3.07Å; H536-K538 PolarHBondContact O-N 3.27Å; K538-Y540 PolarHBondContact O-N 2.87Å; K538-L541 PolarHBondContact O-N 3.02Å; K538-L541 VanDerWaalsContact O-N 3.17Å; K538-V555 HydrophobicContact CD-CG1 4.48Å; K538-V555 HydrophobicContact CG-CB 4.35Å; K538-V555 HydrophobicContact CG-CG1 4.04Å; K538-V555 HydrophobicContact CG-CG2 4.49Å; K538-E560 IonicContact NZ-OE1 3.83Å; K538-E560 IonicContact NZ-OE2 2.66Å; K538-E560 PolarHBondContact NZ-OE2 3.11Å; K538-E1030 WeakPolarHBondContact CE-OE1 3.14Å; K538-E1030 IonicContact NZ-OE1 3.31Å; K538-E1030 PolarHBondContact NZ-OE1 3.17Å; K538-E1030 IonicContact NZ-OE2 3.73Å
539	A	88.7	Confident	90.9	Very high	24 Å²	24	43 Å²	43	20%	0.198	22%	0.217	C	C	.	.	H	α-helix	trans	-58.7	-32.8	179.3	0	0	0	0	0	112.8	H536 N537 L541 L542 N543 A1034	H536-A539 PolarHBondContact O-N 3.34Å; N537-A539 PolarHBondContact O-N 2.94Å; A539-L541 VanDerWaalsContact C-N 3.28Å; A539-L541 PolarHBondContact O-N 2.77Å; A539-L542 PolarHBondContact O-N 3.19Å; A539-N543 PolarHBondContact O-ND2 2.98Å; A539-A1034 HydrophobicContact CB-CB 3.73Å
540	Y	91.5	Very high	90.2	Very high	134 Å²	134	48.7 Å²	48.7	53%	0.525	24%	0.242	S	C	.	.	H	α-helix	trans	-66.3	-29.3	-179.5	-60.1	-57.1	0	0	0	113.1	I513 N537 K538 N543	I513-Y540 HydrophobicContact CD1-CD2 3.93Å; I513-Y540 HydrophobicContact CD1-CG 4.44Å; N537-Y540 HydrophobicContact CB-CD2 4.29Å; N537-Y540 WeakPolarHBondContact O-CD2 3.44Å; N537-Y540 PolarHBondContact O-N 3Å; K538-Y540 PolarHBondContact O-N 2.87Å; Y540-N543 PolarHBondContact O-N 3.04Å
541	L	92.3	Very high	89.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70.9	-37.1	177.3	-66.5	176	0	0	0	111.9	I513 V516 V530 L532 K538 A539 N543 I544 W547 V555	I513-L541 HydrophobicContact CB-CD2 4.42Å; I513-L541 HydrophobicContact CG1-CD2 3.96Å; I513-L541 HydrophobicContact CG1-CG 4.23Å; I513-L541 HydrophobicContact CG2-CD2 4.28Å; V516-L541 HydrophobicContact CB-CD2 4.03Å; V516-L541 HydrophobicContact CG1-CD2 3.99Å; V516-L541 HydrophobicContact CG2-CD2 3.99Å; V530-L541 HydrophobicContact CG1-CD1 3.57Å; L532-L541 HydrophobicContact CD1-CD1 3.75Å; L532-L541 HydrophobicContact CD1-CG 4.5Å; L532-L541 HydrophobicContact CG-CD1 4.35Å; K538-L541 PolarHBondContact O-N 3.02Å; K538-L541 VanDerWaalsContact O-N 3.17Å; A539-L541 VanDerWaalsContact C-N 3.28Å; A539-L541 PolarHBondContact O-N 2.77Å; L541-N543 PolarHBondContact O-N 3.29Å; L541-I544 HydrophobicContact CD2-CD1 3.87Å; L541-I544 WeakPolarHBondContact O-CB 3.44Å; L541-I544 PolarHBondContact O-N 3.18Å; L541-W547 HydrophobicContact CB-CD2 4.32Å; L541-W547 HydrophobicContact CD1-CH2 4.39Å; L541-W547 WeakPolarHBondContact O-CB 3.32Å; L541-V555 HydrophobicContact CD1-CB 4.37Å; L541-V555 HydrophobicContact CD1-CG1 3.99Å; L541-V555 HydrophobicContact CD1-CG2 3.45Å; L541-V555 VanDerWaalsContact CD1-CG2 3.45Å
542	L	86.4	Confident	88.9	Confident	63 Å²	63	52.6 Å²	52.6	33%	0.33	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-21.3	176.2	-62.6	176.4	0	0	0	112.7	A539 I544 E1030 A1034	A539-L542 PolarHBondContact O-N 3.19Å; L542-I544 VanDerWaalsContact C-N 3.32Å; L542-E1030 HydrophobicContact CD1-CB 4.31Å; L542-A1034 HydrophobicContact CD1-CB 4.25Å
543	N	87.6	Confident	88.7	Confident	111 Å²	111	52.7 Å²	52.7	59%	0.594	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-9.4	176	-64.4	-30.1	0	0	0	113.3	A539 Y540 L541	A539-N543 PolarHBondContact O-ND2 2.98Å; Y540-N543 PolarHBondContact O-N 3.04Å; L541-N543 PolarHBondContact O-N 3.29Å
544	I	91.8	Very high	88.7	Confident	21 Å²	21	52.5 Å²	52.5	11%	0.108	27%	0.267	C	S	.	.	S	Bend	trans	-79.4	121.6	177.4	-60.1	172.8	0	0	0	108.5	V516 I517 L541 L542 S546 W547	V516-I544 HydrophobicContact CG1-CD1 4.03Å; I517-I544 HydrophobicContact CG1-CD1 3.66Å; I517-I544 HydrophobicContact CG1-CG1 4.24Å; L541-I544 HydrophobicContact CD2-CD1 3.87Å; L541-I544 WeakPolarHBondContact O-CB 3.44Å; L541-I544 PolarHBondContact O-N 3.18Å; L542-I544 VanDerWaalsContact C-N 3.32Å; I544-S546 VanDerWaalsContact C-N 3.26Å; I544-S546 PolarHBondContact O-N 3.48Å; I544-W547 HydrophobicContact CB-CB 3.96Å; I544-W547 HydrophobicContact CG2-CB 4.32Å; I544-W547 VanDerWaalsContact O-CB 3.26Å; I544-W547 WeakPolarHBondContact O-CB 3.39Å; I544-W547 PolarHBondContact O-N 3.14Å
545	P	90.5	Very high	88.8	Confident	132 Å²	132	52.4 Å²	52.4	86%	0.857	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-27.4	-172.3	25.2	-35.4	0	0	0	114	W547	P545-W547 VanDerWaalsContact C-N 3.34Å
546	S	90.5	Very high	89	Confident	44 Å²	44	51.1 Å²	51.1	31%	0.308	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.7	177.8	-51.3	0	0	0	0	113.3	I544	I544-S546 VanDerWaalsContact C-N 3.26Å; I544-S546 PolarHBondContact O-N 3.48Å
547	W	90.8	Very high	89.2	Confident	24 Å²	24	47.2 Å²	47.2	9%	0.091	24%	0.244	C	C	.	.			trans	-80	119.7	177.9	-177.6	-90	0	0	0	109.6	V516 V528 V530 L541 I544 P545 D553 V555	V516-W547 HydrophobicContact CG1-CE3 3.83Å; V516-W547 HydrophobicContact CG1-CZ3 3.76Å; V528-W547 HydrophobicContact CB-CZ3 4.23Å; V528-W547 HydrophobicContact CG1-CZ3 4.37Å; V530-W547 HydrophobicContact CG1-CH2 3.9Å; V530-W547 HydrophobicContact CG1-CZ3 4.37Å; L541-W547 HydrophobicContact CB-CD2 4.32Å; L541-W547 HydrophobicContact CD1-CH2 4.39Å; L541-W547 WeakPolarHBondContact O-CB 3.32Å; I544-W547 HydrophobicContact CB-CB 3.96Å; I544-W547 HydrophobicContact CG2-CB 4.32Å; I544-W547 VanDerWaalsContact O-CB 3.26Å; I544-W547 WeakPolarHBondContact O-CB 3.39Å; I544-W547 PolarHBondContact O-N 3.14Å; P545-W547 VanDerWaalsContact C-N 3.34Å; W547-D553 HydrophobicContact CD2-CB 3.92Å; W547-D553 HydrophobicContact CE3-CB 4.06Å; W547-D553 HydrophobicContact CH2-CB 3.78Å; W547-D553 HydrophobicContact CZ2-CB 3.62Å; W547-D553 WeakPolarHBondContact CZ2-O 3.47Å; W547-D553 HydrophobicContact CZ3-CB 4.01Å; W547-V555 HydrophobicContact CH2-CG2 3.83Å; W547-V555 HydrophobicContact CZ2-CG2 3.32Å
548	N	87	Confident	89.3	Confident	60 Å²	60	46.9 Å²	46.9	32%	0.321	24%	0.242	S	C	.	.			trans	-139	105.6	-177.7	-175.8	6.5	0	0	0	111.4	K550 T551 D553	N548-K550 PolarHBondContact O-N 3.43Å; N548-K550 VanDerWaalsContact OD1-CB 3.27Å; N548-K550 WeakPolarHBondContact OD1-CB 3.35Å; N548-K550 PolarHBondContact OD1-N 3.1Å; N548-T551 WeakPolarHBondContact CB-OG1 3.37Å; N548-T551 PolarHBondContact O-N 2.72Å; N548-T551 PolarHBondContact O-OG1 3.43Å; N548-D553 PolarHBondContact N-OD2 3.43Å; N548-D553 WeakPolarHBondContact O-CB 3.45Å; N548-D553 PolarHBondContact O-N 3.15Å
549	W	83	Confident	89.3	Confident	124 Å²	124	46.9 Å²	46.9	47%	0.47	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-61.1	-26.2	175.8	60.6	-90.6	0	0	0	112.6	T551 G552 D553	W549-T551 VanDerWaalsContact C-N 3.26Å; W549-T551 PolarHBondContact O-N 2.82Å; W549-G552 PolarHBondContact O-N 3.08Å; W549-G552 VanDerWaalsContact O-N 3.16Å; W549-D553 WeakPolarHBondContact CA-O 3.47Å
550	K	80.6	Confident	89.5	Confident	121 Å²	121	46 Å²	46	53%	0.526	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-70.1	-21.4	176.2	-55.9	-173.7	179.1	-169.3	0	113.2	N548 G552	N548-K550 PolarHBondContact O-N 3.43Å; N548-K550 VanDerWaalsContact OD1-CB 3.27Å; N548-K550 WeakPolarHBondContact OD1-CB 3.35Å; N548-K550 PolarHBondContact OD1-N 3.1Å; K550-G552 VanDerWaalsContact C-N 3.33Å
551	T	81.1	Confident	89.5	Confident	79 Å²	79	39.7 Å²	39.7	49%	0.485	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-91.8	5.3	174.2	48.2	0	0	0	0	113.1	N548 W549	N548-T551 WeakPolarHBondContact CB-OG1 3.37Å; N548-T551 PolarHBondContact O-N 2.72Å; N548-T551 PolarHBondContact O-OG1 3.43Å; W549-T551 VanDerWaalsContact C-N 3.26Å; W549-T551 PolarHBondContact O-N 2.82Å
552	G	83.9	Confident	89.6	Confident	4 Å²	4	40.6 Å²	40.6	4%	0.041	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	17.6	-178.8	0	0	0	0	0	114.3	R527 W549 K550 D554	R527-G552 WeakPolarHBondContact CD-O 3.4Å; R527-G552 WeakPolarHBondContact CG-O 3.16Å; R527-G552 PolarHBondContact NE-O 2.98Å; W549-G552 PolarHBondContact O-N 3.08Å; W549-G552 VanDerWaalsContact O-N 3.16Å; K550-G552 VanDerWaalsContact C-N 3.33Å; G552-D554 PolarHBondContact O-N 3.06Å
553	D	92.2	Very high	90	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.011	20%	0.199	C	C	.	.			trans	-74.3	108.5	169.9	-65.8	-33.6	0	0	0	109.8	K520 V528 W547 N548 W549	K520-D553 VanDerWaalsContact CE-OD2 3.31Å; K520-D553 WeakPolarHBondContact CE-OD2 3.32Å; K520-D553 IonicContact NZ-OD1 3.38Å; K520-D553 PolarHBondContact NZ-OD1 2.96Å; K520-D553 IonicContact NZ-OD2 2.6Å; K520-D553 PolarHBondContact NZ-OD2 2.95Å; V528-D553 PolarHBondContact N-OD1 2.54Å; V528-D553 WeakPolarHBondContact O-CA 3.43Å; W547-D553 HydrophobicContact CD2-CB 3.92Å; W547-D553 HydrophobicContact CE3-CB 4.06Å; W547-D553 HydrophobicContact CH2-CB 3.78Å; W547-D553 HydrophobicContact CZ2-CB 3.62Å; W547-D553 WeakPolarHBondContact CZ2-O 3.47Å; W547-D553 HydrophobicContact CZ3-CB 4.01Å; N548-D553 PolarHBondContact N-OD2 3.43Å; N548-D553 WeakPolarHBondContact O-CB 3.45Å; N548-D553 PolarHBondContact O-N 3.15Å; W549-D553 WeakPolarHBondContact CA-O 3.47Å
554	D	92.1	Very high	90.2	Very high	17 Å²	17	32.3 Å²	32.3	9%	0.091	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.6	-169.2	-71	-53.6	0	0	0	111.2	R527 V528 I529 V530 G552 T1007 L1014	R527-D554 IonicContact NH2-OD2 3.79Å; R527-D554 PolarHBondContact NH2-OD2 3Å; V528-D554 PolarHBondContact O-N 3.04Å; V528-D554 VanDerWaalsContact O-N 3.15Å; I529-D554 WeakPolarHBondContact CA-O 3.32Å; I529-D554 HydrophobicContact CG1-CB 4.41Å; I529-D554 HydrophobicContact CG2-CB 4.3Å; V530-D554 PolarHBondContact N-O 3.48Å; G552-D554 PolarHBondContact O-N 3.06Å; D554-T1007 HydrophobicContact CB-CG2 3.65Å; D554-T1007 WeakPolarHBondContact OD2-CG2 3.4Å; D554-L1014 HydrophobicContact CB-CD2 3.9Å
555	V	93.2	Very high	90.4	Very high	12 Å²	12	31.4 Å²	31.4	7%	0.073	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.4	174.2	-170.6	0	0	0	0	109.4	V530 L532 K538 L541 W547 C557	V530-V555 HydrophobicContact CG1-CB 4.48Å; V530-V555 HydrophobicContact CG1-CG1 4.27Å; V530-V555 HydrophobicContact CG1-CG2 4.18Å; L532-V555 HydrophobicContact CB-CG1 4.3Å; L532-V555 HydrophobicContact CD1-CG1 3.64Å; L532-V555 HydrophobicContact CG-CG1 3.8Å; K538-V555 HydrophobicContact CD-CG1 4.48Å; K538-V555 HydrophobicContact CG-CB 4.35Å; K538-V555 HydrophobicContact CG-CG1 4.04Å; K538-V555 HydrophobicContact CG-CG2 4.49Å; L541-V555 HydrophobicContact CD1-CB 4.37Å; L541-V555 HydrophobicContact CD1-CG1 3.99Å; L541-V555 HydrophobicContact CD1-CG2 3.45Å; L541-V555 VanDerWaalsContact CD1-CG2 3.45Å; W547-V555 HydrophobicContact CH2-CG2 3.83Å; W547-V555 HydrophobicContact CZ2-CG2 3.32Å; V555-C557 PolarHBondContact O-N 2.78Å
556	I	93.9	Very high	90.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	94.4	172.4	-52.3	-167.7	0	0	0	107.7	I529 V530 Q531 L532 L558 L561 L1003 M1004 L1014	I529-I556 HydrophobicContact CG2-CD1 4.18Å; I529-I556 HydrophobicContact CG2-CG1 4.25Å; V530-I556 PolarHBondContact O-N 3.33Å; Q531-I556 WeakPolarHBondContact CA-O 3.4Å; Q531-I556 HydrophobicContact CG-CB 4.47Å; L532-I556 PolarHBondContact N-O 3.42Å; I556-L558 HydrophobicContact CG2-CD2 4.4Å; I556-L558 PolarHBondContact O-N 2.81Å; I556-L561 HydrophobicContact CG2-CD1 3.77Å; I556-L1003 HydrophobicContact CD1-CB 3.97Å; I556-L1003 HydrophobicContact CG2-CD1 4.47Å; I556-M1004 HydrophobicContact CD1-CG 4.14Å; I556-M1004 HydrophobicContact CD1-SD 3.47Å; I556-M1004 WeakPolarHBondContact CD1-SD 3.26Å; I556-M1004 HydrophobicContact CG1-SD 4.17Å; I556-L1014 HydrophobicContact CG1-CD1 4.49Å; I556-L1014 HydrophobicContact CG1-CD2 4.02Å
557	C	93.2	Very high	90.7	Very high	1 Å²	1	23 Å²	23	1%	0.007	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	110.4	174.1	-178.7	0	0	0	0	109.9	L532 Y535 V555 E560 L561	L532-C557 CarbonylContact O-C 3.47Å; L532-C557 WeakPolarHBondContact O-CA 3.1Å; Y535-C557 VanDerWaalsContact CA-SG 3.52Å; V555-C557 PolarHBondContact O-N 2.78Å; C557-E560 HydrophobicContact CB-CB 3.73Å; C557-E560 PolarHBondContact O-N 3.43Å; C557-L561 WeakPolarHBondContact O-CG 3.44Å; C557-L561 PolarHBondContact O-N 2.96Å; C557-L561 VanDerWaalsContact O-N 3.1Å
558	L	93.2	Very high	90.8	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-65	-42.8	-176.1	-65.7	178.4	0	0	0	111.8	K500 L532 M533 I556 E560 L561 K562 I997 L1000	K500-L558 HydrophobicContact CD-CD1 4.28Å; K500-L558 HydrophobicContact CG-CD1 3.82Å; L532-L558 PolarHBondContact O-N 3.38Å; M533-L558 HydrophobicContact SD-CD1 3.71Å; I556-L558 HydrophobicContact CG2-CD2 4.4Å; I556-L558 PolarHBondContact O-N 2.81Å; L558-E560 PolarHBondContact O-N 3.45Å; L558-L561 PolarHBondContact O-N 3.34Å; L558-K562 WeakPolarHBondContact O-CB 3.37Å; L558-K562 PolarHBondContact O-N 2.96Å; L558-I997 HydrophobicContact CD1-CD1 4.49Å; L558-L1000 HydrophobicContact CD2-CB 3.81Å; L558-L1000 HydrophobicContact CD2-CD1 3.99Å
559	A	92.1	Very high	91.1	Very high	9 Å²	9	19.5 Å²	19.5	7%	0.074	9%	0.093	C	C	.	.	H	α-helix	trans	-63.7	-39.2	175.9	0	0	0	0	0	112.9	M533 L563	M533-A559 WeakPolarHBondContact O-CB 3.4Å; M533-A559 PolarHBondContact O-N 3.42Å; A559-L563 VanDerWaalsContact O-CB 3.24Å; A559-L563 WeakPolarHBondContact O-CB 3.4Å; A559-L563 WeakPolarHBondContact O-CD1 3.45Å; A559-L563 VanDerWaalsContact O-CG 3.25Å; A559-L563 WeakPolarHBondContact O-CG 3.29Å; A559-L563 PolarHBondContact O-N 2.84Å; A559-L563 VanDerWaalsContact O-N 3.11Å
560	E	92.2	Very high	91.6	Very high	5 Å²	5	13.6 Å²	13.6	2%	0.023	7%	0.071	C	C	.	.	H	α-helix	trans	-60.2	-51.6	176.9	-177.7	-174.7	170.2	0	0	110.8	Y535 K538 C557 L558 G564 R1018 T1022	Y535-E560 HydrophobicContact CD2-CB 4.06Å; Y535-E560 HydrophobicContact CD2-CG 4.16Å; Y535-E560 HydrophobicContact CE2-CG 4.36Å; K538-E560 IonicContact NZ-OE1 3.83Å; K538-E560 IonicContact NZ-OE2 2.66Å; K538-E560 PolarHBondContact NZ-OE2 3.11Å; C557-E560 HydrophobicContact CB-CB 3.73Å; C557-E560 PolarHBondContact O-N 3.43Å; L558-E560 PolarHBondContact O-N 3.45Å; E560-G564 PolarHBondContact O-N 2.89Å; E560-R1018 IonicContact OE1-CZ 3.82Å; E560-R1018 IonicContact OE1-NE 3.95Å; E560-R1018 PolarHBondContact OE1-NE 3.32Å; E560-R1018 IonicContact OE1-NH2 3.9Å; E560-R1018 PolarHBondContact OE1-NH2 3.16Å; E560-R1018 IonicContact OE2-NE 2.95Å; E560-R1018 IonicContact OE2-NH2 3.75Å; E560-T1022 HydrophobicContact CG-CG2 4.04Å
561	L	93	Very high	92	Very high	2 Å²	2	9.1 Å²	9.1	1%	0.01	5%	0.053	C	C	.	.	H	α-helix	trans	-72.9	-46.1	-176	-65.8	176	0	0	0	112.2	I556 C557 L558 G564 I565 L1000 L1003 L1014 I1017 R1018	I556-L561 HydrophobicContact CG2-CD1 3.77Å; C557-L561 WeakPolarHBondContact O-CG 3.44Å; C557-L561 PolarHBondContact O-N 2.96Å; C557-L561 VanDerWaalsContact O-N 3.1Å; L558-L561 PolarHBondContact O-N 3.34Å; L561-G564 PolarHBondContact O-N 2.84Å; L561-I565 WeakPolarHBondContact O-CB 3.29Å; L561-I565 WeakPolarHBondContact O-CD1 3.36Å; L561-I565 WeakPolarHBondContact O-CG1 3.35Å; L561-I565 PolarHBondContact O-N 2.78Å; L561-L1000 HydrophobicContact CB-CD1 4.36Å; L561-L1000 HydrophobicContact CB-CD2 4.49Å; L561-L1003 HydrophobicContact CD1-CD1 3.59Å; L561-L1014 HydrophobicContact CD1-CD1 4.19Å; L561-I1017 HydrophobicContact CD2-CG2 4.14Å; L561-R1018 HydrophobicContact CD2-CG 4.02Å
562	K	93.3	Very high	92.5	Very high	19 Å²	19	5.3 Å²	5.3	8%	0.083	3%	0.03	C	C	.	.	H	α-helix	trans	-54.7	-58.7	177.3	177.7	-175.3	79	161	0	110.5	L558 G564 I565 L566 E961 F995 I997 L1000	L558-K562 WeakPolarHBondContact O-CB 3.37Å; L558-K562 PolarHBondContact O-N 2.96Å; K562-G564 VanDerWaalsContact C-N 3.33Å; K562-G564 PolarHBondContact O-N 3.32Å; K562-I565 PolarHBondContact O-N 3.03Å; K562-L566 HydrophobicContact CG-CD1 4.24Å; K562-L566 VanDerWaalsContact O-CG 3.3Å; K562-L566 WeakPolarHBondContact O-CG 3.38Å; K562-L566 PolarHBondContact O-N 2.83Å; K562-E961 HydrophobicContact CD-CG 4.41Å; K562-E961 WeakPolarHBondContact CD-OE1 3.41Å; K562-E961 WeakPolarHBondContact CE-OE2 3.38Å; K562-E961 IonicContact NZ-OE1 2.74Å; K562-E961 PolarHBondContact NZ-OE1 3.05Å; K562-E961 IonicContact NZ-OE2 3.43Å; K562-E961 PolarHBondContact NZ-OE2 3.47Å; K562-F995 HydrophobicContact CB-CE1 4.36Å; K562-F995 HydrophobicContact CG-CD1 4.33Å; K562-F995 HydrophobicContact CG-CE1 3.9Å; K562-I997 HydrophobicContact CD-CD1 4.49Å; K562-L1000 HydrophobicContact CB-CD1 4.14Å
563	L	94.2	Very high	92.8	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-68.7	-34.8	-174.3	-64.6	171.1	0	0	0	112	A559 L566 A567 I821 G822 N825 F826 I892	A559-L563 VanDerWaalsContact O-CB 3.24Å; A559-L563 WeakPolarHBondContact O-CB 3.4Å; A559-L563 WeakPolarHBondContact O-CD1 3.45Å; A559-L563 VanDerWaalsContact O-CG 3.25Å; A559-L563 WeakPolarHBondContact O-CG 3.29Å; A559-L563 PolarHBondContact O-N 2.84Å; A559-L563 VanDerWaalsContact O-N 3.11Å; L563-L566 HydrophobicContact CD2-CD1 4.45Å; L563-L566 PolarHBondContact O-N 3.13Å; L563-A567 VanDerWaalsContact O-CB 3.28Å; L563-A567 WeakPolarHBondContact O-CB 3.18Å; L563-A567 PolarHBondContact O-N 3.47Å; L563-I821 HydrophobicContact CD1-CG2 3.54Å; L563-I821 WeakPolarHBondContact CD1-O 3.49Å; L563-I821 HydrophobicContact CD2-CG2 3.75Å; L563-I821 HydrophobicContact CG-CG2 4.17Å; L563-G822 VanDerWaalsContact CD1-O 3.27Å; L563-G822 WeakPolarHBondContact CD1-O 3.21Å; L563-N825 HydrophobicContact CB-CB 4.04Å; L563-N825 HydrophobicContact CD1-CB 4.05Å; L563-F826 HydrophobicContact CB-CB 4.05Å; L563-F826 HydrophobicContact CD2-CB 4.46Å; L563-F826 HydrophobicContact CD2-CD2 4.47Å; L563-F826 WeakPolarHBondContact O-CD2 3.4Å; L563-I892 HydrophobicContact CD2-CD1 4.07Å
564	G	93.5	Very high	92.7	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-66	-40.7	174.8	0	0	0	0	0	112.4	E560 L561 K562 A567 Q568 V1021	E560-G564 PolarHBondContact O-N 2.89Å; L561-G564 PolarHBondContact O-N 2.84Å; K562-G564 VanDerWaalsContact C-N 3.33Å; K562-G564 PolarHBondContact O-N 3.32Å; G564-A567 WeakPolarHBondContact O-CB 3.39Å; G564-A567 PolarHBondContact O-N 3.2Å; G564-Q568 WeakPolarHBondContact O-CG 3.4Å; G564-Q568 PolarHBondContact O-N 3.44Å; G564-V1021 VanDerWaalsContact CA-CG1 3.41Å
565	I	94.2	Very high	92.7	Very high	2 Å²	2	5.6 Å²	5.6	1%	0.01	3%	0.032	C	C	.	.	H	α-helix	trans	-64.2	-45.4	177.2	-72.2	166.3	0	0	0	109.9	L561 K562 A567 Q568 S569 F995 L1000 V1021	L561-I565 WeakPolarHBondContact O-CB 3.29Å; L561-I565 WeakPolarHBondContact O-CD1 3.36Å; L561-I565 WeakPolarHBondContact O-CG1 3.35Å; L561-I565 PolarHBondContact O-N 2.78Å; K562-I565 PolarHBondContact O-N 3.03Å; I565-A567 VanDerWaalsContact C-N 3.29Å; I565-A567 PolarHBondContact O-N 2.84Å; I565-Q568 PolarHBondContact O-N 3.13Å; I565-S569 PolarHBondContact O-N 3.35Å; I565-S569 PolarHBondContact O-OG 3.14Å; I565-F995 HydrophobicContact CB-CZ 4.46Å; I565-F995 HydrophobicContact CD1-CE2 4.37Å; I565-F995 HydrophobicContact CD1-CZ 4.11Å; I565-F995 HydrophobicContact CG2-CD2 4.26Å; I565-F995 HydrophobicContact CG2-CE2 3.79Å; I565-F995 HydrophobicContact CG2-CZ 4.2Å; I565-L1000 HydrophobicContact CD1-CD2 4.01Å; I565-V1021 HydrophobicContact CG1-CG1 4.1Å; I565-V1021 HydrophobicContact CG1-CG2 3.77Å
566	L	94.8	Very high	92.7	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-59.6	-39.7	174.8	-63.4	176	0	0	0	111.7	K562 L563 S569 C570 F826 V890 I892 L959 F995	K562-L566 HydrophobicContact CG-CD1 4.24Å; K562-L566 VanDerWaalsContact O-CG 3.3Å; K562-L566 WeakPolarHBondContact O-CG 3.38Å; K562-L566 PolarHBondContact O-N 2.83Å; L563-L566 HydrophobicContact CD2-CD1 4.45Å; L563-L566 PolarHBondContact O-N 3.13Å; L566-S569 WeakPolarHBondContact O-CB 3.17Å; L566-S569 PolarHBondContact O-N 2.67Å; L566-C570 PolarHBondContact O-N 2.64Å; L566-C570 PolarHBondContact O-SG 2.84Å; L566-F826 HydrophobicContact CB-CD2 4.12Å; L566-F826 HydrophobicContact CB-CE2 3.78Å; L566-V890 HydrophobicContact CD1-CG1 4.47Å; L566-I892 HydrophobicContact CD1-CD1 4.37Å; L566-I892 HydrophobicContact CD1-CG1 4.48Å; L566-L959 HydrophobicContact CB-CD2 4.28Å; L566-L959 HydrophobicContact CD2-CD1 4.21Å; L566-L959 HydrophobicContact CD2-CD2 3.45Å; L566-L959 VanDerWaalsContact CD2-CD2 3.45Å; L566-L959 HydrophobicContact CD2-CG 3.73Å; L566-L959 HydrophobicContact CG-CD2 4.47Å; L566-F995 HydrophobicContact CD2-CB 3.78Å; L566-F995 HydrophobicContact CD2-CD1 3.98Å; L566-F995 HydrophobicContact CD2-CG 3.97Å; L566-F995 HydrophobicContact CG-CD1 4.43Å
567	A	94.3	Very high	92.7	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-65.7	-45.1	177.4	0	0	0	0	0	112.5	L563 G564 I565 S569 C570 F826 P829 L830	L563-A567 VanDerWaalsContact O-CB 3.28Å; L563-A567 WeakPolarHBondContact O-CB 3.18Å; L563-A567 PolarHBondContact O-N 3.47Å; G564-A567 WeakPolarHBondContact O-CB 3.39Å; G564-A567 PolarHBondContact O-N 3.2Å; I565-A567 VanDerWaalsContact C-N 3.29Å; I565-A567 PolarHBondContact O-N 2.84Å; A567-S569 VanDerWaalsContact C-N 3.3Å; A567-S569 PolarHBondContact O-N 3.18Å; A567-C570 VanDerWaalsContact O-CB 3.24Å; A567-C570 WeakPolarHBondContact O-CB 3.39Å; A567-C570 PolarHBondContact O-N 3.47Å; A567-F826 HydrophobicContact CB-CD2 4.11Å; A567-F826 HydrophobicContact CB-CE2 4.28Å; A567-F826 HydrophobicContact CB-CG 4.25Å; A567-F826 WeakPolarHBondContact CB-O 3.09Å; A567-P829 HydrophobicContact CB-CB 4.14Å; A567-P829 HydrophobicContact CB-CG 4.14Å; A567-L830 HydrophobicContact CB-CG 4.21Å; A567-L830 WeakPolarHBondContact O-CD2 3.19Å
568	Q	92.5	Very high	92.6	Very high	9 Å²	9	5 Å²	5	4%	0.042	3%	0.028	C	C	.	.	H	α-helix	trans	-64.3	-34.7	175.3	-67.5	-62.1	-23.4	0	0	112	G564 I565 C570 L571 A572 F575 V1021	G564-Q568 WeakPolarHBondContact O-CG 3.4Å; G564-Q568 PolarHBondContact O-N 3.44Å; I565-Q568 PolarHBondContact O-N 3.13Å; Q568-C570 PolarHBondContact O-N 2.97Å; Q568-L571 WeakPolarHBondContact O-CA 3.48Å; Q568-L571 WeakPolarHBondContact O-CB 3.02Å; Q568-L571 PolarHBondContact O-N 2.6Å; Q568-A572 PolarHBondContact O-N 2.95Å; Q568-F575 HydrophobicContact CB-CD1 3.3Å; Q568-F575 HydrophobicContact CB-CE1 3.33Å; Q568-F575 HydrophobicContact CB-CG 4.16Å; Q568-F575 HydrophobicContact CB-CZ 4.23Å; Q568-F575 HydrophobicContact CG-CD1 4.3Å; Q568-F575 HydrophobicContact CG-CE1 3.83Å; Q568-F575 HydrophobicContact CG-CZ 4.48Å; Q568-V1021 WeakPolarHBondContact CG-O 3.44Å; Q568-V1021 PolarHBondContact NE2-O 3.41Å
569	S	93.4	Very high	92.6	Very high	1 Å²	1	5.3 Å²	5.3	1%	0.007	3%	0.029	C	C	.	.	H	α-helix	trans	-62.6	-24.6	171.8	-71.3	0	0	0	0	113.7	I565 L566 A567 L571 A572 P573 S576	I565-S569 PolarHBondContact O-N 3.35Å; I565-S569 PolarHBondContact O-OG 3.14Å; L566-S569 WeakPolarHBondContact O-CB 3.17Å; L566-S569 PolarHBondContact O-N 2.67Å; A567-S569 VanDerWaalsContact C-N 3.3Å; A567-S569 PolarHBondContact O-N 3.18Å; S569-L571 VanDerWaalsContact C-N 3.26Å; S569-L571 PolarHBondContact O-N 2.68Å; S569-A572 CarbonylContact O-C 3.42Å; S569-A572 VanDerWaalsContact O-C 3.27Å; S569-P573 WeakPolarHBondContact O-CA 3.42Å; S569-S576 WeakPolarHBondContact OG-CB 3.32Å; S569-S576 PolarHBondContact OG-N 2.77Å; S569-S576 PolarHBondContact OG-OG 3.31Å
570	C	93	Very high	92.5	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-71.2	-23	172.1	-59.2	0	0	0	0	112.7	L566 A567 Q568 V808 L830 K841 M888 V890	L566-C570 PolarHBondContact O-N 2.64Å; L566-C570 PolarHBondContact O-SG 2.84Å; A567-C570 VanDerWaalsContact O-CB 3.24Å; A567-C570 WeakPolarHBondContact O-CB 3.39Å; A567-C570 PolarHBondContact O-N 3.47Å; Q568-C570 PolarHBondContact O-N 2.97Å; C570-V808 HydrophobicContact CB-CG1 4.41Å; C570-V808 HydrophobicContact CB-CG2 4Å; C570-L830 HydrophobicContact CB-CD2 4.26Å; C570-K841 PolarHBondContact O-NZ 3.43Å; C570-M888 HydrophobicContact CB-CB 4.12Å; C570-M888 HydrophobicContact CB-CG 4.34Å; C570-V890 WeakPolarHBondContact SG-CG2 3.3Å
571	L	89.8	Confident	92.5	Very high	27 Å²	27	4.9 Å²	4.9	14%	0.141	3%	0.026	C	C	.	.	H	α-helix	trans	-86.8	-43.9	175.8	-60.7	167.9	0	0	0	110.4	Q568 S569 L830 Y835 K841 I1057	Q568-L571 WeakPolarHBondContact O-CA 3.48Å; Q568-L571 WeakPolarHBondContact O-CB 3.02Å; Q568-L571 PolarHBondContact O-N 2.6Å; S569-L571 VanDerWaalsContact C-N 3.26Å; S569-L571 PolarHBondContact O-N 2.68Å; L571-L830 HydrophobicContact CD1-CD2 4.01Å; L571-L830 HydrophobicContact CD2-CD2 3.82Å; L571-L830 HydrophobicContact CG-CD2 3.7Å; L571-Y835 HydrophobicContact CD1-CE2 4.01Å; L571-Y835 WeakPolarHBondContact CD1-OH 3.35Å; L571-K841 HydrophobicContact CD2-CD 4.4Å; L571-I1057 HydrophobicContact CB-CG2 4.38Å
572	A	89.8	Confident	92.2	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.027	C	C	.	.	S	Bend	trans	-132.5	96.1	177.8	0	0	0	0	0	111	Q568 S569 G574 F575 I1057 Q1059 F1139	Q568-A572 PolarHBondContact O-N 2.95Å; S569-A572 CarbonylContact O-C 3.42Å; S569-A572 VanDerWaalsContact O-C 3.27Å; A572-G574 PolarHBondContact O-N 3.14Å; A572-F575 HydrophobicContact CB-CB 4.47Å; A572-F575 WeakPolarHBondContact O-CB 3.45Å; A572-F575 PolarHBondContact O-N 3.48Å; A572-I1057 HydrophobicContact CB-CD1 4.37Å; A572-I1057 HydrophobicContact CB-CG1 4.25Å; A572-Q1059 HydrophobicContact CB-CB 4.07Å; A572-F1139 HydrophobicContact CB-CD1 4.03Å; A572-F1139 HydrophobicContact CB-CE1 3.98Å
573	P	90.2	Very high	91.7	Very high	28 Å²	28	4.5 Å²	4.5	18%	0.182	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	133	176.2	-27.1	30.7	0	0	0	112.6	S569 M888 Q1059 Y1097 F1139	S569-P573 WeakPolarHBondContact O-CA 3.42Å; P573-M888 HydrophobicContact CB-CE 3.85Å; P573-M888 HydrophobicContact CG-CE 3.63Å; P573-Q1059 PolarHBondContact O-NE2 2.63Å; P573-Q1059 VanDerWaalsContact O-NE2 3.12Å; P573-Y1097 HydrophobicContact CB-CE1 4.1Å; P573-F1139 VanDerWaalsContact O-CE1 3.31Å; P573-F1139 WeakPolarHBondContact O-CE1 3.17Å; P573-F1139 WeakPolarHBondContact O-CZ 3.36Å
574	G	90.1	Very high	91.1	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-7.8	-174.8	0	0	0	0	0	115.3	A572 S576 T577 M578 V1112	A572-G574 PolarHBondContact O-N 3.14Å; G574-S576 VanDerWaalsContact C-N 3.28Å; G574-S576 PolarHBondContact O-N 2.6Å; G574-T577 PolarHBondContact O-N 2.66Å; G574-M578 PolarHBondContact O-N 3.39Å; G574-M578 VanDerWaalsContact O-N 3.12Å; G574-V1112 WeakPolarHBondContact O-CG2 3.13Å
575	F	92.4	Very high	90.4	Very high	1 Å²	1	5.3 Å²	5.3	0%	0.004	3%	0.03	C	C	.	.	H	α-helix	trans	-58.1	-38.3	178	179.3	-102.3	0	0	0	113.1	Q568 A572 T577 M578 M579 I1057	Q568-F575 HydrophobicContact CB-CD1 3.3Å; Q568-F575 HydrophobicContact CB-CE1 3.33Å; Q568-F575 HydrophobicContact CB-CG 4.16Å; Q568-F575 HydrophobicContact CB-CZ 4.23Å; Q568-F575 HydrophobicContact CG-CD1 4.3Å; Q568-F575 HydrophobicContact CG-CE1 3.83Å; Q568-F575 HydrophobicContact CG-CZ 4.48Å; A572-F575 HydrophobicContact CB-CB 4.47Å; A572-F575 WeakPolarHBondContact O-CB 3.45Å; A572-F575 PolarHBondContact O-N 3.48Å; F575-T577 PolarHBondContact O-N 3.13Å; F575-M578 HydrophobicContact CD2-CE 3.45Å; F575-M578 VanDerWaalsContact CD2-CE 3.45Å; F575-M578 HydrophobicContact CE2-CE 3.85Å; F575-M578 WeakPolarHBondContact O-CB 3.33Å; F575-M578 PolarHBondContact O-N 2.9Å; F575-M579 HydrophobicContact CD1-CG 3.92Å; F575-M579 HydrophobicContact CD2-CG 4Å; F575-M579 HydrophobicContact CD2-SD 4.47Å; F575-M579 HydrophobicContact CE1-CG 3.43Å; F575-M579 VanDerWaalsContact CE1-CG 3.43Å; F575-M579 HydrophobicContact CE1-SD 4.42Å; F575-M579 HydrophobicContact CE2-CG 3.52Å; F575-M579 HydrophobicContact CE2-SD 3.63Å; F575-M579 HydrophobicContact CG-CG 4.21Å; F575-M579 HydrophobicContact CZ-CE 4.05Å; F575-M579 HydrophobicContact CZ-CG 3.24Å; F575-M579 HydrophobicContact CZ-SD 3.63Å; F575-M579 WeakPolarHBondContact O-CG 3.42Å; F575-M579 PolarHBondContact O-N 2.7Å; F575-I1057 HydrophobicContact CD2-CD1 3.08Å; F575-I1057 HydrophobicContact CE2-CD1 3.2Å; F575-I1057 HydrophobicContact CG-CD1 4.02Å; F575-I1057 HydrophobicContact CZ-CD1 4.2Å
576	S	93.2	Very high	89.7	Confident	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-56.6	-47.9	177.7	44.2	0	0	0	0	112.8	S569 G574 M579 A580	S569-S576 WeakPolarHBondContact OG-CB 3.32Å; S569-S576 PolarHBondContact OG-N 2.77Å; S569-S576 PolarHBondContact OG-OG 3.31Å; G574-S576 VanDerWaalsContact C-N 3.28Å; G574-S576 PolarHBondContact O-N 2.6Å; S576-M579 PolarHBondContact O-N 3.23Å; S576-A580 WeakPolarHBondContact O-CB 3.37Å; S576-A580 PolarHBondContact O-N 3.44Å
577	T	93.4	Very high	88.4	Confident	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-65.8	-42.3	176.9	-53	0	0	0	0	111.5	G574 F575 M579 A580 N581 Y601 F989 G992 V1112	G574-T577 PolarHBondContact O-N 2.66Å; F575-T577 PolarHBondContact O-N 3.13Å; T577-M579 PolarHBondContact O-N 3.08Å; T577-A580 PolarHBondContact O-N 2.78Å; T577-N581 WeakPolarHBondContact O-CB 3.43Å; T577-N581 PolarHBondContact O-N 3.46Å; T577-N581 PolarHBondContact O-OD1 3.14Å; T577-Y601 HydrophobicContact CG2-CE2 4.05Å; T577-F989 WeakPolarHBondContact CB-O 2.98Å; T577-F989 HydrophobicContact CG2-CD1 3.86Å; T577-F989 HydrophobicContact CG2-CE1 3.69Å; T577-F989 HydrophobicContact CG2-CZ 4.4Å; T577-F989 WeakPolarHBondContact CG2-O 3.25Å; T577-F989 PolarHBondContact OG1-O 3.48Å; T577-G992 WeakPolarHBondContact OG1-CA 3.18Å; T577-G992 PolarHBondContact OG1-N 3.12Å; T577-V1112 HydrophobicContact CG2-CB 4.42Å; T577-V1112 HydrophobicContact CG2-CG2 4.38Å
578	M	92.6	Very high	87.2	Confident	1 Å²	1	12 Å²	12	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-57.2	-51.3	175.8	173.7	164	73.4	0	0	111.3	G574 F575 N581 L582 I1057 I1094 V1112 T1114 F1139	G574-M578 PolarHBondContact O-N 3.39Å; G574-M578 VanDerWaalsContact O-N 3.12Å; F575-M578 HydrophobicContact CD2-CE 3.45Å; F575-M578 VanDerWaalsContact CD2-CE 3.45Å; F575-M578 HydrophobicContact CE2-CE 3.85Å; F575-M578 WeakPolarHBondContact O-CB 3.33Å; F575-M578 PolarHBondContact O-N 2.9Å; M578-N581 PolarHBondContact O-N 3Å; M578-L582 HydrophobicContact CG-CD1 4.06Å; M578-L582 VanDerWaalsContact O-CG 3.3Å; M578-L582 WeakPolarHBondContact O-CG 3.46Å; M578-L582 PolarHBondContact O-N 2.83Å; M578-L582 VanDerWaalsContact O-N 3.15Å; M578-I1057 HydrophobicContact CE-CD1 4.5Å; M578-I1094 HydrophobicContact CE-CD1 4.26Å; M578-I1094 HydrophobicContact CE-CG2 4.24Å; M578-I1094 HydrophobicContact SD-CB 4.23Å; M578-I1094 HydrophobicContact SD-CG2 3.59Å; M578-I1094 VanDerWaalsContact SD-CG2 3.59Å; M578-V1112 HydrophobicContact CB-CG1 3.85Å; M578-T1114 HydrophobicContact CB-CG2 3.98Å; M578-T1114 HydrophobicContact CG-CG2 3.53Å; M578-T1114 HydrophobicContact SD-CG2 4.22Å; M578-F1139 HydrophobicContact CE-CB 4.49Å; M578-F1139 HydrophobicContact CE-CD1 4.31Å; M578-F1139 HydrophobicContact CE-CG 4.27Å; M578-F1139 HydrophobicContact SD-CD2 4.39Å; M578-F1139 HydrophobicContact SD-CG 4.46Å
579	M	91.6	Very high	86.1	Confident	7 Å²	7	19.1 Å²	19.1	3%	0.034	10%	0.095	C	C	.	.	H	α-helix	trans	-68.7	-41.1	-178.1	-64.9	-54.1	-80.8	0	0	112.2	F575 S576 T577 N581 L582 F583 F1020	F575-M579 HydrophobicContact CD1-CG 3.92Å; F575-M579 HydrophobicContact CD2-CG 4Å; F575-M579 HydrophobicContact CD2-SD 4.47Å; F575-M579 HydrophobicContact CE1-CG 3.43Å; F575-M579 VanDerWaalsContact CE1-CG 3.43Å; F575-M579 HydrophobicContact CE1-SD 4.42Å; F575-M579 HydrophobicContact CE2-CG 3.52Å; F575-M579 HydrophobicContact CE2-SD 3.63Å; F575-M579 HydrophobicContact CG-CG 4.21Å; F575-M579 HydrophobicContact CZ-CE 4.05Å; F575-M579 HydrophobicContact CZ-CG 3.24Å; F575-M579 HydrophobicContact CZ-SD 3.63Å; F575-M579 WeakPolarHBondContact O-CG 3.42Å; F575-M579 PolarHBondContact O-N 2.7Å; S576-M579 PolarHBondContact O-N 3.23Å; T577-M579 PolarHBondContact O-N 3.08Å; M579-N581 PolarHBondContact O-N 3.41Å; M579-L582 PolarHBondContact O-N 2.93Å; M579-L582 VanDerWaalsContact O-N 3.13Å; M579-L582 HydrophobicContact SD-CD1 4.04Å; M579-F583 HydrophobicContact CB-CE2 3.9Å; M579-F583 HydrophobicContact CB-CZ 4.05Å; M579-F583 HydrophobicContact CE-CE1 4.01Å; M579-F583 HydrophobicContact CE-CE2 4.3Å; M579-F583 HydrophobicContact CE-CZ 3.36Å; M579-F583 WeakPolarHBondContact O-CD2 3.29Å; M579-F583 VanDerWaalsContact O-CE2 3.29Å; M579-F583 WeakPolarHBondContact O-CE2 3.26Å; M579-F583 WeakPolarHBondContact O-CG 3.39Å; M579-F583 PolarHBondContact O-N 3.01Å; M579-F583 HydrophobicContact SD-CZ 4.38Å; M579-F1020 HydrophobicContact CE-CB 4.14Å; M579-F1020 HydrophobicContact CE-CG 4.3Å
580	A	91	Very high	85	Confident	3 Å²	3	22.2 Å²	22.2	3%	0.025	11%	0.114	C	C	.	.	H	α-helix	trans	-53.7	-43.1	173.7	0	0	0	0	0	112.5	S576 T577 A584 F989 V999	S576-A580 WeakPolarHBondContact O-CB 3.37Å; S576-A580 PolarHBondContact O-N 3.44Å; T577-A580 PolarHBondContact O-N 2.78Å; A580-A584 PolarHBondContact O-N 3.33Å; A580-F989 HydrophobicContact CB-CE2 4.36Å; A580-F989 HydrophobicContact CB-CZ 3.67Å; A580-V999 HydrophobicContact CB-CG1 3.39Å
581	N	91.2	Very high	84.1	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.011	13%	0.128	C	C	.	.	H	α-helix	trans	-71.8	-31.3	-179.9	-66.3	1.5	0	0	0	112.4	T577 M578 M579 F583 R586 Y601 F989	T577-N581 WeakPolarHBondContact O-CB 3.43Å; T577-N581 PolarHBondContact O-N 3.46Å; T577-N581 PolarHBondContact O-OD1 3.14Å; M578-N581 PolarHBondContact O-N 3Å; M579-N581 PolarHBondContact O-N 3.41Å; N581-F583 VanDerWaalsContact C-N 3.32Å; N581-F583 PolarHBondContact O-N 3.42Å; N581-R586 VanDerWaalsContact OD1-CZ 3.22Å; N581-R586 PolarHBondContact OD1-NH1 3.32Å; N581-R586 PolarHBondContact OD1-NH2 2.98Å; N581-R586 VanDerWaalsContact OD1-NH2 3.1Å; N581-Y601 WeakPolarHBondContact ND2-CE2 3.18Å; N581-Y601 PolarHBondContact ND2-OH 3.5Å; N581-Y601 VanDerWaalsContact ND2-OH 3.16Å; N581-F989 WeakPolarHBondContact OD1-CE1 3.48Å
582	L	88.7	Confident	83.3	Confident	6 Å²	6	29 Å²	29	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-74.3	-17.3	-178.6	-73.1	171.7	0	0	0	114.5	M578 M579 M607 I609 I672	M578-L582 HydrophobicContact CG-CD1 4.06Å; M578-L582 VanDerWaalsContact O-CG 3.3Å; M578-L582 WeakPolarHBondContact O-CG 3.46Å; M578-L582 PolarHBondContact O-N 2.83Å; M578-L582 VanDerWaalsContact O-N 3.15Å; M579-L582 PolarHBondContact O-N 2.93Å; M579-L582 VanDerWaalsContact O-N 3.13Å; M579-L582 HydrophobicContact SD-CD1 4.04Å; L582-M607 HydrophobicContact CD2-CB 4.32Å; L582-I609 HydrophobicContact CB-CD1 3.84Å; L582-I609 HydrophobicContact CB-CG1 4.13Å; L582-I609 HydrophobicContact CD1-CD1 4.19Å; L582-I609 HydrophobicContact CD1-CG1 4.49Å; L582-I609 HydrophobicContact CD2-CG1 4.39Å; L582-I609 PolarHBondContact O-N 3.35Å; L582-I672 HydrophobicContact CD1-CD1 3.89Å; L582-I672 HydrophobicContact CD2-CD1 3.83Å; L582-I672 HydrophobicContact CD2-CG1 3.97Å; L582-I672 HydrophobicContact CD2-CG2 3.76Å
583	F	82.7	Confident	82.9	Confident	8 Å²	8	36.2 Å²	36.2	4%	0.035	20%	0.199	C	C	.	.	H	α-helix	trans	-107.6	-19.7	-178.3	-45.6	-39.8	0	0	0	114.4	M579 N581 I609 L1003 T1006 I1017	M579-F583 HydrophobicContact CB-CE2 3.9Å; M579-F583 HydrophobicContact CB-CZ 4.05Å; M579-F583 HydrophobicContact CE-CE1 4.01Å; M579-F583 HydrophobicContact CE-CE2 4.3Å; M579-F583 HydrophobicContact CE-CZ 3.36Å; M579-F583 WeakPolarHBondContact O-CD2 3.29Å; M579-F583 VanDerWaalsContact O-CE2 3.29Å; M579-F583 WeakPolarHBondContact O-CE2 3.26Å; M579-F583 WeakPolarHBondContact O-CG 3.39Å; M579-F583 PolarHBondContact O-N 3.01Å; M579-F583 HydrophobicContact SD-CZ 4.38Å; N581-F583 VanDerWaalsContact C-N 3.32Å; N581-F583 PolarHBondContact O-N 3.42Å; F583-I609 HydrophobicContact CD1-CD1 3.93Å; F583-I609 HydrophobicContact CE1-CD1 3.47Å; F583-I609 VanDerWaalsContact CE1-CD1 3.47Å; F583-L1003 HydrophobicContact CB-CD2 3.78Å; F583-L1003 HydrophobicContact CD1-CD2 4.48Å; F583-L1003 HydrophobicContact CD2-CD2 3.63Å; F583-L1003 HydrophobicContact CD2-CG 4.46Å; F583-L1003 HydrophobicContact CE2-CD2 4.32Å; F583-L1003 HydrophobicContact CG-CD2 3.72Å; F583-T1006 PolarHBondContact O-OG1 3.27Å; F583-I1017 HydrophobicContact CD1-CD1 3.35Å; F583-I1017 HydrophobicContact CD1-CG1 3.97Å; F583-I1017 HydrophobicContact CD2-CD1 4Å; F583-I1017 HydrophobicContact CE1-CB 4.37Å; F583-I1017 HydrophobicContact CE1-CD1 3.13Å; F583-I1017 HydrophobicContact CE1-CG1 3.19Å; F583-I1017 HydrophobicContact CE1-CG2 4.41Å; F583-I1017 HydrophobicContact CE2-CD1 3.79Å; F583-I1017 HydrophobicContact CE2-CG1 4.06Å; F583-I1017 HydrophobicContact CE2-CG2 3.77Å; F583-I1017 HydrophobicContact CG-CD1 3.79Å; F583-I1017 HydrophobicContact CZ-CB 3.97Å; F583-I1017 HydrophobicContact CZ-CD1 3.35Å; F583-I1017 HydrophobicContact CZ-CG1 3.23Å; F583-I1017 HydrophobicContact CZ-CG2 3.56Å
584	A	81.2	Confident	82.4	Confident	5 Å²	5	36.3 Å²	36.3	4%	0.041	20%	0.199	C	C	.	.	S	Bend	trans	-88.9	136.8	174.7	0	0	0	0	0	108.9	A580 R586	A580-A584 PolarHBondContact O-N 3.33Å; A584-R586 HydrophobicContact CB-CG 4.43Å
585	M	77.5	Confident	82.1	Confident	12 Å²	12	39.5 Å²	39.5	6%	0.059	22%	0.22	C	C	.	.			trans	-81	130	173.2	-78.3	154.1	-77.1	0	0	109.8	D414 H417 R420 E608	D414-M585 HydrophobicContact CB-CE 3.82Å; D414-M585 WeakPolarHBondContact O-CE 3.5Å; H417-M585 HydrophobicContact CB-CB 4.19Å; H417-M585 HydrophobicContact CB-SD 4.12Å; R420-M585 VanDerWaalsContact CD-SD 3.51Å; R420-M585 HydrophobicContact CG-SD 3.41Å; R420-M585 WeakPolarHBondContact CG-SD 3.44Å; R420-M585 PolarHBondContact NE-SD 3.41Å; M585-E608 VanDerWaalsContact CA-OE1 3.26Å; M585-E608 WeakPolarHBondContact CA-OE1 3.44Å; M585-E608 WeakPolarHBondContact CG-OE1 3.22Å
586	R	79.9	Confident	81.7	Confident	24 Å²	24	43.9 Å²	43.9	9%	0.091	25%	0.25	C	C	.	.			trans	-141	122.7	-176.8	-62.5	-170.7	-175.5	159	8.1	111.4	N581 A584 F588	N581-R586 VanDerWaalsContact OD1-CZ 3.22Å; N581-R586 PolarHBondContact OD1-NH1 3.32Å; N581-R586 PolarHBondContact OD1-NH2 2.98Å; N581-R586 VanDerWaalsContact OD1-NH2 3.1Å; A584-R586 HydrophobicContact CB-CG 4.43Å; R586-F588 PolarHBondContact O-N 3.24Å
587	S	68.8	Low	81.4	Confident	46 Å²	46	46 Å²	46	32%	0.322	26%	0.258	S	S	.	.			trans	-68.6	125.7	172.7	77.4	0	0	0	0	110.8	K589	S587-K589 PolarHBondContact O-N 3.48Å
588	F	69.2	Low	81.1	Confident	71 Å²	71	47.6 Å²	47.6	31%	0.311	27%	0.266	S	S	.	.			trans	-84.2	107.7	173	174.9	-108.7	0	0	0	110.4	R586 T590 L602 R603	R586-F588 PolarHBondContact O-N 3.24Å; F588-T590 HydrophobicContact CD2-CG2 4.1Å; F588-T590 HydrophobicContact CE1-CG2 3.68Å; F588-T590 HydrophobicContact CE2-CG2 3.17Å; F588-T590 HydrophobicContact CZ-CG2 2.97Å; F588-L602 HydrophobicContact CD2-CB 3.9Å; F588-L602 VanDerWaalsContact CD2-O 3.23Å; F588-L602 WeakPolarHBondContact CD2-O 3.45Å; F588-L602 VanDerWaalsContact CE2-C 3.49Å; F588-L602 HydrophobicContact CE2-CB 3.91Å; F588-R603 HydrophobicContact CD2-CB 4.4Å; F588-R603 HydrophobicContact CE2-CB 3.55Å; F588-R603 HydrophobicContact CE2-CG 4.29Å; F588-R603 HydrophobicContact CZ-CB 3.83Å; F588-R603 HydrophobicContact CZ-CG 4.18Å
589	K	69.1	Low	80.9	Confident	160 Å²	160	48.9 Å²	48.9	70%	0.696	27%	0.273	S	S	*	.			trans	-118	85	170.9	-66.8	-179.7	-173.8	170	0	110.3	S587	S587-K589 PolarHBondContact O-N 3.48Å
590	T	69.1	Low	80.8	Confident	65 Å²	65	49.6 Å²	49.6	40%	0.399	28%	0.277	S	S	.	.			trans	-71.4	134.8	169.3	43	0	0	0	0	111.2	F588 N599	F588-T590 HydrophobicContact CD2-CG2 4.1Å; F588-T590 HydrophobicContact CE1-CG2 3.68Å; F588-T590 HydrophobicContact CE2-CG2 3.17Å; F588-T590 HydrophobicContact CZ-CG2 2.97Å; T590-N599 HydrophobicContact CG2-CB 4.14Å; T590-N599 WeakPolarHBondContact CG2-OD1 3.21Å
591	S	74	Confident	80.8	Confident	43 Å²	43	49.5 Å²	49.5	30%	0.301	28%	0.276	S	S	.	.			trans	-112.7	145.7	165.5	92.9	0	0	0	0	109.5	N593 T594 N599	S591-N593 PolarHBondContact O-N 3.44Å; S591-N593 PolarHBondContact OG-N 3.08Å; S591-T594 WeakPolarHBondContact O-CB 3.48Å; S591-T594 PolarHBondContact O-N 3.41Å; S591-T594 VanDerWaalsContact O-N 3.14Å; S591-T594 PolarHBondContact O-OG1 3.03Å; S591-T594 PolarHBondContact OG-N 3.01Å; S591-T594 VanDerWaalsContact OG-N 3.15Å; S591-T594 PolarHBondContact OG-OG1 3.48Å; S591-N599 PolarHBondContact O-ND2 3.27Å; S591-N599 VanDerWaalsContact O-ND2 3.1Å; S591-N599 PolarHBondContact O-OD1 3.02Å
592	P	74.6	Confident	80.8	Confident	128 Å²	128	50.2 Å²	50.2	83%	0.831	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.1	173.7	26.3	-33.4	0	0	0	112.8
593	N	80.8	Confident	80.9	Confident	151 Å²	151	54.3 Å²	54.3	81%	0.807	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.9	177.6	-63.9	-8	0	0	0	112.7	S591	S591-N593 PolarHBondContact O-N 3.44Å; S591-N593 PolarHBondContact OG-N 3.08Å
594	T	80.4	Confident	81.3	Confident	30 Å²	30	54 Å²	54	18%	0.184	29%	0.293	C	S	.	.	S	Bend	trans	-74.7	139.5	179.7	-55.6	0	0	0	0	109.8	S591 L598 N599 L602	S591-T594 WeakPolarHBondContact O-CB 3.48Å; S591-T594 PolarHBondContact O-N 3.41Å; S591-T594 VanDerWaalsContact O-N 3.14Å; S591-T594 PolarHBondContact O-OG1 3.03Å; S591-T594 PolarHBondContact OG-N 3.01Å; S591-T594 VanDerWaalsContact OG-N 3.15Å; S591-T594 PolarHBondContact OG-OG1 3.48Å; T594-L598 HydrophobicContact CG2-CB 3.82Å; T594-L598 HydrophobicContact CG2-CD2 3.58Å; T594-L598 HydrophobicContact CG2-CG 3.62Å; T594-N599 VanDerWaalsContact CB-OD1 3.3Å; T594-N599 WeakPolarHBondContact CB-OD1 3.48Å; T594-N599 PolarHBondContact O-ND2 3.35Å; T594-N599 VanDerWaalsContact O-ND2 3.08Å; T594-L602 HydrophobicContact CG2-CD1 4.45Å
595	P	83.5	Confident	81.7	Confident	67 Å²	67	53.8 Å²	53.8	44%	0.435	29%	0.292	S	S	.	.			trans	-51.7	143.9	175.5	-27.6	34.9	0	0	0	112.6	W597 L598 N599	P595-W597 VanDerWaalsContact C-N 3.31Å; P595-W597 HydrophobicContact CB-CG 4.47Å; P595-W597 PolarHBondContact O-N 2.96Å; P595-L598 HydrophobicContact CB-CB 4.41Å; P595-L598 PolarHBondContact O-N 3.46Å; P595-N599 PolarHBondContact O-N 3.28Å
596	C	84.3	Confident	82.2	Confident	92 Å²	92	53.6 Å²	53.6	62%	0.622	29%	0.293	S	S	*	.	H	α-helix	trans	-55.6	-44.2	-175.8	-170.7	0	0	0	0	112.6	L598 N599 D600	C596-L598 VanDerWaalsContact C-N 3.3Å; C596-L598 PolarHBondContact O-N 2.89Å; C596-N599 PolarHBondContact O-N 3.21Å; C596-D600 PolarHBondContact O-N 2.88Å
597	W	85.6	Confident	82.8	Confident	46 Å²	46	53.3 Å²	53.3	17%	0.174	29%	0.293	C	S	.	.	H	α-helix	trans	-59.8	-40.3	178.5	73.6	-96.8	0	0	0	112.1	P595 D600 Y601 T990 Q1100 F1111	P595-W597 VanDerWaalsContact C-N 3.31Å; P595-W597 HydrophobicContact CB-CG 4.47Å; P595-W597 PolarHBondContact O-N 2.96Å; W597-D600 PolarHBondContact O-N 3.38Å; W597-Y601 WeakPolarHBondContact O-CB 3.24Å; W597-Y601 PolarHBondContact O-N 3.41Å; W597-T990 HydrophobicContact CZ3-CG2 4.45Å; W597-Q1100 HydrophobicContact CB-CG 4.47Å; W597-Q1100 HydrophobicContact CD2-CG 4.37Å; W597-Q1100 VanDerWaalsContact CE2-NE2 3.34Å; W597-Q1100 HydrophobicContact CG-CG 4.12Å; W597-F1111 HydrophobicContact CB-CD1 4.37Å; W597-F1111 HydrophobicContact CB-CE1 3.73Å; W597-F1111 HydrophobicContact CB-CE2 4.4Å; W597-F1111 HydrophobicContact CB-CZ 3.74Å; W597-F1111 HydrophobicContact CE3-CG 4.42Å; W597-F1111 VanDerWaalsContact O-CE2 3.3Å; W597-F1111 WeakPolarHBondContact O-CE2 3.48Å
598	L	87.8	Confident	83.7	Confident	33 Å²	33	51.9 Å²	51.9	17%	0.173	28%	0.281	C	S	.	.	H	α-helix	trans	-73.6	-36.8	-179.5	179.9	57.5	0	0	0	110.8	T594 P595 C596 D600 Y601 L602	T594-L598 HydrophobicContact CG2-CB 3.82Å; T594-L598 HydrophobicContact CG2-CD2 3.58Å; T594-L598 HydrophobicContact CG2-CG 3.62Å; P595-L598 HydrophobicContact CB-CB 4.41Å; P595-L598 PolarHBondContact O-N 3.46Å; C596-L598 VanDerWaalsContact C-N 3.3Å; C596-L598 PolarHBondContact O-N 2.89Å; L598-D600 VanDerWaalsContact C-N 3.35Å; L598-D600 PolarHBondContact O-N 3.27Å; L598-Y601 HydrophobicContact CD1-CD1 4Å; L598-Y601 PolarHBondContact O-N 2.75Å; L598-L602 HydrophobicContact CD1-CD1 4.35Å; L598-L602 HydrophobicContact CD1-CG 4.11Å; L598-L602 HydrophobicContact CG-CD1 4.1Å; L598-L602 HydrophobicContact CG-CG 4.34Å; L598-L602 VanDerWaalsContact O-CB 3.28Å; L598-L602 WeakPolarHBondContact O-CB 3.43Å; L598-L602 WeakPolarHBondContact O-CG 3.42Å; L598-L602 PolarHBondContact O-N 2.75Å
599	N	88.6	Confident	84.6	Confident	28 Å²	28	49.3 Å²	49.3	15%	0.15	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-40.3	171.9	-82.7	-28.1	0	0	0	112.5	T590 S591 T594 P595 C596 R603	T590-N599 HydrophobicContact CG2-CB 4.14Å; T590-N599 WeakPolarHBondContact CG2-OD1 3.21Å; S591-N599 PolarHBondContact O-ND2 3.27Å; S591-N599 VanDerWaalsContact O-ND2 3.1Å; S591-N599 PolarHBondContact O-OD1 3.02Å; T594-N599 VanDerWaalsContact CB-OD1 3.3Å; T594-N599 WeakPolarHBondContact CB-OD1 3.48Å; T594-N599 PolarHBondContact O-ND2 3.35Å; T594-N599 VanDerWaalsContact O-ND2 3.08Å; P595-N599 PolarHBondContact O-N 3.28Å; C596-N599 PolarHBondContact O-N 3.21Å; N599-R603 PolarHBondContact O-N 2.89Å; N599-R603 VanDerWaalsContact O-N 3.16Å
600	D	89.3	Confident	85.5	Confident	21 Å²	21	43.4 Å²	43.4	11%	0.112	24%	0.244	C	C	.	.	H	α-helix	trans	-67.3	-42.5	175.3	-83	-8.5	0	0	0	111.7	C596 W597 L598 R603 G604 R1098 F1111 I1113 M1120	C596-D600 PolarHBondContact O-N 2.88Å; W597-D600 PolarHBondContact O-N 3.38Å; L598-D600 VanDerWaalsContact C-N 3.35Å; L598-D600 PolarHBondContact O-N 3.27Å; D600-R603 PolarHBondContact O-N 2.78Å; D600-G604 PolarHBondContact O-N 3.37Å; D600-R1098 IonicContact OD2-NH1 3.83Å; D600-R1098 PolarHBondContact OD2-NH1 3.49Å; D600-F1111 HydrophobicContact CB-CE2 4.13Å; D600-I1113 HydrophobicContact CB-CD1 3.92Å; D600-I1113 HydrophobicContact CB-CG1 4.34Å; D600-M1120 HydrophobicContact CB-CE 4.19Å; D600-M1120 VanDerWaalsContact OD1-CE 3.27Å; D600-M1120 WeakPolarHBondContact OD1-CE 2.82Å; D600-M1120 WeakPolarHBondContact OD2-CE 3.5Å
601	Y	91.5	Very high	86.4	Confident	1 Å²	1	42.2 Å²	42.2	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-60.5	-51.8	173.8	170	-102.5	0	0	0	111.9	T577 N581 W597 L598 R603 G604 A605 Y984 T990 V1112	T577-Y601 HydrophobicContact CG2-CE2 4.05Å; N581-Y601 WeakPolarHBondContact ND2-CE2 3.18Å; N581-Y601 PolarHBondContact ND2-OH 3.5Å; N581-Y601 VanDerWaalsContact ND2-OH 3.16Å; W597-Y601 WeakPolarHBondContact O-CB 3.24Å; W597-Y601 PolarHBondContact O-N 3.41Å; L598-Y601 HydrophobicContact CD1-CD1 4Å; L598-Y601 PolarHBondContact O-N 2.75Å; Y601-R603 PolarHBondContact O-N 3.14Å; Y601-G604 CarbonylContact O-C 3.55Å; Y601-G604 WeakPolarHBondContact O-CA 3.46Å; Y601-G604 PolarHBondContact O-N 2.99Å; Y601-A605 HydrophobicContact CE1-CB 4.19Å; Y601-A605 PolarHBondContact O-N 3.15Å; Y601-Y984 HydrophobicContact CE1-CD2 4.18Å; Y601-Y984 WeakPolarHBondContact CE1-O 3.41Å; Y601-Y984 PolarHBondContact OH-O 2.57Å; Y601-T990 HydrophobicContact CD1-CG2 3.77Å; Y601-T990 HydrophobicContact CD2-CG2 4.03Å; Y601-T990 HydrophobicContact CE1-CG2 3.44Å; Y601-T990 VanDerWaalsContact CE1-CG2 3.44Å; Y601-T990 HydrophobicContact CE2-CG2 3.78Å; Y601-T990 HydrophobicContact CG-CG2 4.04Å; Y601-T990 VanDerWaalsContact CZ-CG2 3.46Å; Y601-V1112 WeakPolarHBondContact CD2-O 3.39Å
602	L	91.1	Very high	87.2	Confident	17 Å²	17	42.6 Å²	42.6	9%	0.089	23%	0.234	C	C	.	.	H	α-helix	trans	-56.1	-35.3	179.9	-76.9	172.4	0	0	0	111.3	F588 T594 L598 G604 A605 G606 Y984 L985	F588-L602 HydrophobicContact CD2-CB 3.9Å; F588-L602 VanDerWaalsContact CD2-O 3.23Å; F588-L602 WeakPolarHBondContact CD2-O 3.45Å; F588-L602 VanDerWaalsContact CE2-C 3.49Å; F588-L602 HydrophobicContact CE2-CB 3.91Å; T594-L602 HydrophobicContact CG2-CD1 4.45Å; L598-L602 HydrophobicContact CD1-CD1 4.35Å; L598-L602 HydrophobicContact CD1-CG 4.11Å; L598-L602 HydrophobicContact CG-CD1 4.1Å; L598-L602 HydrophobicContact CG-CG 4.34Å; L598-L602 VanDerWaalsContact O-CB 3.28Å; L598-L602 WeakPolarHBondContact O-CB 3.43Å; L598-L602 WeakPolarHBondContact O-CG 3.42Å; L598-L602 PolarHBondContact O-N 2.75Å; L602-G604 VanDerWaalsContact C-N 3.33Å; L602-G604 PolarHBondContact O-N 3.33Å; L602-A605 PolarHBondContact O-N 3.01Å; L602-A605 VanDerWaalsContact O-N 3.15Å; L602-G606 PolarHBondContact O-N 3.04Å; L602-Y984 HydrophobicContact CD2-CE2 4.1Å; L602-L985 HydrophobicContact CD2-CD2 3.54Å
603	R	89.3	Confident	88	Confident	92 Å²	92	38.2 Å²	38.2	35%	0.347	21%	0.205	S	C	.	.	H	α-helix	trans	-64.9	-40.1	178.8	-175.9	179.6	-69.8	149.2	2.1	111.5	F588 N599 D600 Y601	F588-R603 HydrophobicContact CD2-CB 4.4Å; F588-R603 HydrophobicContact CE2-CB 3.55Å; F588-R603 HydrophobicContact CE2-CG 4.29Å; F588-R603 HydrophobicContact CZ-CB 3.83Å; F588-R603 HydrophobicContact CZ-CG 4.18Å; N599-R603 PolarHBondContact O-N 2.89Å; N599-R603 VanDerWaalsContact O-N 3.16Å; D600-R603 PolarHBondContact O-N 2.78Å; Y601-R603 PolarHBondContact O-N 3.14Å
604	G	90.8	Very high	88.6	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-71.5	-35.7	171.4	0	0	0	0	0	112.5	D600 Y601 L602 G606 M607 T1114	D600-G604 PolarHBondContact O-N 3.37Å; Y601-G604 CarbonylContact O-C 3.55Å; Y601-G604 WeakPolarHBondContact O-CA 3.46Å; Y601-G604 PolarHBondContact O-N 2.99Å; L602-G604 VanDerWaalsContact C-N 3.33Å; L602-G604 PolarHBondContact O-N 3.33Å; G604-G606 PolarHBondContact O-N 2.69Å; G604-M607 WeakPolarHBondContact O-CB 3.47Å; G604-M607 PolarHBondContact O-N 2.93Å; G604-T1114 WeakPolarHBondContact CA-OG1 3.31Å; G604-T1114 PolarHBondContact O-OG1 3.18Å
605	A	90.3	Very high	89.1	Confident	2 Å²	2	30.4 Å²	30.4	2%	0.017	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-26.5	179.2	0	0	0	0	0	113.5	Y601 L602 M607	Y601-A605 HydrophobicContact CE1-CB 4.19Å; Y601-A605 PolarHBondContact O-N 3.15Å; L602-A605 PolarHBondContact O-N 3.01Å; L602-A605 VanDerWaalsContact O-N 3.15Å; A605-M607 VanDerWaalsContact C-N 3.33Å
606	G	89	Confident	89.4	Confident	7 Å²	7	34.1 Å²	34.1	7%	0.072	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	12.5	173.1	0	0	0	0	0	114.8	L602 G604	L602-G606 PolarHBondContact O-N 3.04Å; G604-G606 PolarHBondContact O-N 2.69Å
607	M	91	Very high	89.7	Confident	18 Å²	18	31.1 Å²	31.1	9%	0.089	15%	0.153	C	C	.	.			trans	-92.9	139.4	171.8	-58.8	-64	-97	0	0	109.6	L582 G604 A605 I672 Q674 A1115	L582-M607 HydrophobicContact CD2-CB 4.32Å; G604-M607 WeakPolarHBondContact O-CB 3.47Å; G604-M607 PolarHBondContact O-N 2.93Å; A605-M607 VanDerWaalsContact C-N 3.33Å; M607-I672 HydrophobicContact CB-CG2 3.68Å; M607-I672 HydrophobicContact CE-CG2 4.23Å; M607-I672 HydrophobicContact CG-CG2 4.39Å; M607-Q674 HydrophobicContact CE-CG 4.46Å; M607-Q674 HydrophobicContact SD-CB 4.41Å; M607-Q674 HydrophobicContact SD-CG 3.31Å; M607-Q674 WeakPolarHBondContact SD-CG 3.4Å; M607-A1115 HydrophobicContact CE-CB 3.43Å; M607-A1115 VanDerWaalsContact CE-CB 3.43Å; M607-A1115 HydrophobicContact CG-CB 4.35Å
608	E	88.3	Confident	90	Very high	17 Å²	17	28.9 Å²	28.9	8%	0.079	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	164.3	-176.2	-65.6	173.6	-170.4	0	0	111.4	M585 Y610 I672 A673	M585-E608 VanDerWaalsContact CA-OE1 3.26Å; M585-E608 WeakPolarHBondContact CA-OE1 3.44Å; M585-E608 WeakPolarHBondContact CG-OE1 3.22Å; E608-Y610 HydrophobicContact CB-CD2 4.38Å; E608-Y610 HydrophobicContact CB-CE2 3.67Å; E608-Y610 VanDerWaalsContact OE2-CZ 3.26Å; E608-Y610 PolarHBondContact OE2-OH 2.94Å; E608-I672 WeakPolarHBondContact O-CA 3.26Å; E608-A673 PolarHBondContact N-O 3.06Å; E608-A673 PolarHBondContact O-N 2.89Å; E608-A673 VanDerWaalsContact O-N 3.08Å
609	I	88.1	Confident	90.2	Very high	16 Å²	16	29.7 Å²	29.7	8%	0.082	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	126.3	175.8	-68.1	159	0	0	0	111.3	L582 F583 F671 I672 L1016	L582-I609 HydrophobicContact CB-CD1 3.84Å; L582-I609 HydrophobicContact CB-CG1 4.13Å; L582-I609 HydrophobicContact CD1-CD1 4.19Å; L582-I609 HydrophobicContact CD1-CG1 4.49Å; L582-I609 HydrophobicContact CD2-CG1 4.39Å; L582-I609 PolarHBondContact O-N 3.35Å; F583-I609 HydrophobicContact CD1-CD1 3.93Å; F583-I609 HydrophobicContact CE1-CD1 3.47Å; F583-I609 VanDerWaalsContact CE1-CD1 3.47Å; I609-F671 WeakPolarHBondContact CA-O 3.42Å; I609-I672 HydrophobicContact CG1-CG1 4.23Å; I609-L1016 HydrophobicContact CD1-CD2 4.42Å; I609-L1016 HydrophobicContact CG2-CD2 3.84Å
610	Y	87.2	Confident	90.3	Very high	36 Å²	36	31 Å²	31	14%	0.141	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	156.5	177.6	-66.9	-75.6	0	0	0	111.9	E608 F670 F671 A673 S675 A676 V679	E608-Y610 HydrophobicContact CB-CD2 4.38Å; E608-Y610 HydrophobicContact CB-CE2 3.67Å; E608-Y610 VanDerWaalsContact OE2-CZ 3.26Å; E608-Y610 PolarHBondContact OE2-OH 2.94Å; Y610-F670 CarbonylContact O-C 3.56Å; Y610-F670 WeakPolarHBondContact O-CA 3.43Å; Y610-F671 PolarHBondContact N-O 3.14Å; Y610-F671 PolarHBondContact O-N 3.32Å; Y610-A673 HydrophobicContact CD2-CB 4.15Å; Y610-S675 VanDerWaalsContact CE2-C 3.5Å; Y610-S675 WeakPolarHBondContact OH-CA 3.48Å; Y610-A676 HydrophobicContact CD1-CB 3.91Å; Y610-A676 HydrophobicContact CE1-CB 3.67Å; Y610-A676 VanDerWaalsContact CZ-N 3.33Å; Y610-A676 PolarHBondContact OH-N 3.45Å; Y610-V679 HydrophobicContact CD2-CG2 3.82Å; Y610-V679 HydrophobicContact CG-CG2 3.93Å
611	T	89	Confident	90.4	Very high	40 Å²	40	32 Å²	32	25%	0.245	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.6	174	46.1	0	0	0	0	109.6	G669 F670 N1010	T611-G669 WeakPolarHBondContact CA-O 3.45Å; T611-F670 HydrophobicContact CG2-CD1 3.3Å; T611-F670 HydrophobicContact CG2-CE1 3.26Å; T611-F670 HydrophobicContact CG2-CG 4.14Å; T611-F670 HydrophobicContact CG2-CZ 4.04Å; T611-N1010 WeakPolarHBondContact CG2-ND2 3.45Å; T611-N1010 PolarHBondContact OG1-ND2 3.34Å; T611-N1010 PolarHBondContact OG1-OD1 2.87Å
612	E	90.6	Very high	90.4	Very high	52 Å²	52	33.8 Å²	33.8	24%	0.243	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	152.3	176.2	-168.3	58.4	-133.4	0	0	110.9	G669 F671 V679 F683	E612-G669 PolarHBondContact N-O 2.79Å; E612-G669 PolarHBondContact O-N 3.25Å; E612-F671 HydrophobicContact CB-CD2 4.38Å; E612-F671 HydrophobicContact CB-CE2 4.06Å; E612-V679 HydrophobicContact CB-CG1 3.5Å; E612-V679 VanDerWaalsContact CB-CG1 3.5Å; E612-V679 HydrophobicContact CG-CG1 4.21Å; E612-F683 HydrophobicContact CG-CB 4.1Å
613	T	91.7	Very high	90.5	Very high	36 Å²	36	33 Å²	33	22%	0.221	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	130	178.2	-55.7	0	0	0	0	110.3	F683	T613-F683 WeakPolarHBondContact O-CD2 3.43Å
614	L	92.5	Very high	90.6	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.047	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-65.5	140.6	176.3	-69.6	171.4	0	0	0	111.2	F618 I630 I641 I663 T667 F671	L614-F618 HydrophobicContact CB-CD2 4.09Å; L614-F618 HydrophobicContact CD2-CD2 4.09Å; L614-F618 HydrophobicContact CD2-CE2 4.37Å; L614-I630 HydrophobicContact CD2-CD1 3.77Å; L614-I641 HydrophobicContact CD1-CG2 4.48Å; L614-I663 HydrophobicContact CD1-CD1 4.09Å; L614-I663 HydrophobicContact CD1-CG1 4.42Å; L614-I663 HydrophobicContact CD1-CG2 3.73Å; L614-T667 HydrophobicContact CD1-CG2 4.25Å; L614-T667 PolarHBondContact N-O 3.03Å; L614-T667 VanDerWaalsContact N-O 3.08Å; L614-F671 HydrophobicContact CD2-CE1 4.42Å; L614-F671 HydrophobicContact CD2-CZ 3.67Å
615	S	91.7	Very high	90.7	Very high	7 Å²	7	34.5 Å²	34.5	5%	0.049	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-59.2	156	173.9	82.6	0	0	0	0	112.3	S617 F618 A682 F683 Y685	S615-S617 PolarHBondContact O-N 3.25Å; S615-S617 WeakPolarHBondContact OG-CB 3.42Å; S615-S617 PolarHBondContact OG-N 3.2Å; S615-S617 PolarHBondContact OG-OG 2.87Å; S615-F618 PolarHBondContact O-N 2.85Å; S615-F618 VanDerWaalsContact O-N 3.12Å; S615-F618 WeakPolarHBondContact OG-CD2 3.28Å; S615-F618 VanDerWaalsContact OG-CE2 3.25Å; S615-F618 WeakPolarHBondContact OG-CE2 3.41Å; S615-A682 WeakPolarHBondContact CB-O 3.09Å; S615-A682 PolarHBondContact N-O 3.44Å; S615-A682 VanDerWaalsContact N-O 3.15Å; S615-F683 WeakPolarHBondContact CB-O 3.32Å; S615-Y685 WeakPolarHBondContact CB-O 3.4Å; S615-Y685 PolarHBondContact OG-O 3Å
616	H	89.7	Confident	90.9	Very high	145 Å²	145	34.4 Å²	34.4	67%	0.671	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-60.8	-16	173.7	-167.3	-65.9	0	0	0	112.9	F618 V619	H616-F618 PolarHBondContact O-N 3.07Å; H616-V619 PolarHBondContact O-N 2.83Å
617	S	90.7	Very high	91.1	Very high	29 Å²	29	34 Å²	34	20%	0.203	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-67.8	-23.1	177.7	-46.4	0	0	0	0	112.8	S615 M621 Y685 C686 Q687	S615-S617 PolarHBondContact O-N 3.25Å; S615-S617 WeakPolarHBondContact OG-CB 3.42Å; S615-S617 PolarHBondContact OG-N 3.2Å; S615-S617 PolarHBondContact OG-OG 2.87Å; S617-M621 WeakPolarHBondContact O-CE 3.37Å; S617-Y685 PolarHBondContact OG-O 2.74Å; S617-Y685 VanDerWaalsContact OG-O 3.05Å; S617-C686 WeakPolarHBondContact OG-CA 3.36Å; S617-Q687 PolarHBondContact OG-N 3.21Å
618	F	91.8	Very high	91.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-88.2	-12.1	-179.7	-59.5	-68.4	0	0	0	113.4	L614 S615 H616 G620 M621 T626 L629 I630 L634 I663 A682 Y685	L614-F618 HydrophobicContact CB-CD2 4.09Å; L614-F618 HydrophobicContact CD2-CD2 4.09Å; L614-F618 HydrophobicContact CD2-CE2 4.37Å; S615-F618 PolarHBondContact O-N 2.85Å; S615-F618 VanDerWaalsContact O-N 3.12Å; S615-F618 WeakPolarHBondContact OG-CD2 3.28Å; S615-F618 VanDerWaalsContact OG-CE2 3.25Å; S615-F618 WeakPolarHBondContact OG-CE2 3.41Å; H616-F618 PolarHBondContact O-N 3.07Å; F618-G620 PolarHBondContact O-N 2.87Å; F618-M621 HydrophobicContact CD1-SD 4.15Å; F618-M621 WeakPolarHBondContact O-CB 3.36Å; F618-M621 PolarHBondContact O-N 3.3Å; F618-M621 VanDerWaalsContact O-N 3.09Å; F618-T626 HydrophobicContact CB-CG2 4.26Å; F618-T626 HydrophobicContact CD1-CG2 3.72Å; F618-T626 HydrophobicContact CE1-CG2 4.27Å; F618-T626 HydrophobicContact CG-CG2 4.11Å; F618-L629 HydrophobicContact CE1-CD2 3.59Å; F618-L629 HydrophobicContact CE1-CG 4.49Å; F618-L629 HydrophobicContact CZ-CD2 4.06Å; F618-I630 HydrophobicContact CE1-CD1 4.09Å; F618-I630 HydrophobicContact CE1-CG1 3.75Å; F618-I630 HydrophobicContact CE2-CD1 4.43Å; F618-I630 HydrophobicContact CZ-CD1 4Å; F618-I630 HydrophobicContact CZ-CG1 3.7Å; F618-L634 HydrophobicContact CZ-CD1 4.34Å; F618-I663 HydrophobicContact CB-CG2 4.34Å; F618-I663 WeakPolarHBondContact O-CB 3.37Å; F618-A682 WeakPolarHBondContact CE2-O 2.98Å; F618-Y685 HydrophobicContact CE1-CD1 4.16Å; F618-Y685 HydrophobicContact CE1-CE1 4.47Å; F618-Y685 HydrophobicContact CE2-CD1 4.1Å; F618-Y685 AromaticContact CZ-CD1 3.62Å; F618-Y685 HydrophobicContact CZ-CD1 3.62Å; F618-Y685 HydrophobicContact CZ-CE1 4.34Å; F618-Y685 HydrophobicContact CZ-CG 4.14Å
619	V	91.1	Very high	91.4	Very high	50 Å²	50	36.7 Å²	36.7	30%	0.303	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	124.9	-176.3	177.3	0	0	0	0	109.9	H616 V665	H616-V619 PolarHBondContact O-N 2.83Å; V619-V665 HydrophobicContact CG1-CG2 3.8Å; V619-V665 HydrophobicContact CG2-CG2 4.08Å
620	G	90.7	Very high	91.7	Very high	54 Å²	54	36 Å²	36	56%	0.557	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.6	-9.2	-177.2	0	0	0	0	0	115.1	F618 I662 I663	F618-G620 PolarHBondContact O-N 2.87Å; G620-I662 VanDerWaalsContact CA-CG2 3.49Å; G620-I663 PolarHBondContact N-O 3.06Å
621	M	92	Very high	92	Very high	44 Å²	44	35 Å²	35	22%	0.217	20%	0.196	C	C	.	.			trans	-78.1	152.7	170.8	-63.7	-179.6	174.7	0	0	110.6	S617 F618 T626 I663	S617-M621 WeakPolarHBondContact O-CE 3.37Å; F618-M621 HydrophobicContact CD1-SD 4.15Å; F618-M621 WeakPolarHBondContact O-CB 3.36Å; F618-M621 PolarHBondContact O-N 3.3Å; F618-M621 VanDerWaalsContact O-N 3.09Å; M621-T626 WeakPolarHBondContact CB-OG1 3.25Å; M621-I663 PolarHBondContact O-N 2.92Å
622	T	92.7	Very high	92.1	Very high	38 Å²	38	35.5 Å²	35.5	23%	0.233	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-72	158.1	170.1	63.4	0	0	0	0	110.6	E625 T626 A661	T622-E625 PolarHBondContact N-OE2 3.41Å; T622-E625 PolarHBondContact O-N 3.47Å; T622-E625 WeakPolarHBondContact OG1-CB 3.43Å; T622-E625 WeakPolarHBondContact OG1-CG 3.26Å; T622-E625 PolarHBondContact OG1-OE2 3.37Å; T622-T626 WeakPolarHBondContact O-CB 3.31Å; T622-T626 PolarHBondContact O-N 3.13Å; T622-T626 PolarHBondContact O-OG1 2.96Å; T622-A661 CarbonylContact C-O 3.58Å; T622-A661 WeakPolarHBondContact CA-O 3.11Å
623	F	91.7	Very high	92.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-47.8	178.2	179.9	-95.9	0	0	0	112.7	E625 T626 V627 L638 I641 N656 P657 A661 I663	F623-E625 PolarHBondContact O-N 2.82Å; F623-T626 WeakPolarHBondContact O-CB 3.45Å; F623-T626 PolarHBondContact O-N 3.43Å; F623-T626 VanDerWaalsContact O-N 3.15Å; F623-V627 HydrophobicContact CD1-CG2 3.93Å; F623-V627 HydrophobicContact CD2-CG2 4.38Å; F623-V627 HydrophobicContact CE1-CG2 3.48Å; F623-V627 VanDerWaalsContact CE1-CG2 3.48Å; F623-V627 HydrophobicContact CE2-CG2 3.99Å; F623-V627 HydrophobicContact CG-CG2 4.35Å; F623-V627 HydrophobicContact CZ-CG2 3.52Å; F623-V627 WeakPolarHBondContact O-CG2 3.45Å; F623-V627 PolarHBondContact O-N 3.16Å; F623-L638 HydrophobicContact CD2-CD2 4.24Å; F623-L638 HydrophobicContact CE2-CD2 3.69Å; F623-L638 HydrophobicContact CE2-CG 3.9Å; F623-L638 HydrophobicContact CZ-CD2 4.38Å; F623-L638 HydrophobicContact CZ-CG 4.26Å; F623-I641 HydrophobicContact CD2-CD1 4.36Å; F623-I641 HydrophobicContact CD2-CG2 4.03Å; F623-I641 HydrophobicContact CE2-CG2 3.9Å; F623-N656 WeakPolarHBondContact CE1-OD1 3.49Å; F623-P657 HydrophobicContact CB-CG 3.77Å; F623-P657 HydrophobicContact CD1-CG 3.77Å; F623-P657 HydrophobicContact CD2-CG 3.61Å; F623-P657 HydrophobicContact CE1-CG 4.26Å; F623-P657 HydrophobicContact CE2-CG 4.12Å; F623-P657 HydrophobicContact CG-CG 3.42Å; F623-P657 VanDerWaalsContact CG-CG 3.42Å; F623-P657 HydrophobicContact CZ-CG 4.42Å; F623-A661 PolarHBondContact N-O 3.37Å; F623-I663 HydrophobicContact CD2-CD1 4.3Å
624	P	92.1	Very high	92.1	Very high	18 Å²	18	35.1 Å²	35.1	12%	0.117	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-40.1	178	-24.2	35.7	0	0	0	113.9	T626 V627 E628 L1086	P624-T626 VanDerWaalsContact C-N 3.29Å; P624-T626 PolarHBondContact O-N 3.12Å; P624-V627 PolarHBondContact O-N 3.24Å; P624-E628 WeakPolarHBondContact O-CB 3.27Å; P624-E628 PolarHBondContact O-N 2.88Å; P624-L1086 HydrophobicContact CB-CD1 4.08Å; P624-L1086 HydrophobicContact CB-CG 4.18Å
625	E	93.1	Very high	92.1	Very high	106 Å²	106	41.2 Å²	41.2	50%	0.495	22%	0.219	S	C	.	.	H	α-helix	trans	-62.2	-39.8	175.2	-72	167	159.1	0	0	111.5	T622 F623 L629	T622-E625 PolarHBondContact N-OE2 3.41Å; T622-E625 PolarHBondContact O-N 3.47Å; T622-E625 WeakPolarHBondContact OG1-CB 3.43Å; T622-E625 WeakPolarHBondContact OG1-CG 3.26Å; T622-E625 PolarHBondContact OG1-OE2 3.37Å; F623-E625 PolarHBondContact O-N 2.82Å; E625-L629 PolarHBondContact O-N 3.04Å
626	T	93.5	Very high	92.2	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.9	-47.1	177.6	-58.4	0	0	0	0	110.9	F618 M621 T622 F623 P624 E628 L629 I630 L638 I663	F618-T626 HydrophobicContact CB-CG2 4.26Å; F618-T626 HydrophobicContact CD1-CG2 3.72Å; F618-T626 HydrophobicContact CE1-CG2 4.27Å; F618-T626 HydrophobicContact CG-CG2 4.11Å; M621-T626 WeakPolarHBondContact CB-OG1 3.25Å; T622-T626 WeakPolarHBondContact O-CB 3.31Å; T622-T626 PolarHBondContact O-N 3.13Å; T622-T626 PolarHBondContact O-OG1 2.96Å; F623-T626 WeakPolarHBondContact O-CB 3.45Å; F623-T626 PolarHBondContact O-N 3.43Å; F623-T626 VanDerWaalsContact O-N 3.15Å; P624-T626 VanDerWaalsContact C-N 3.29Å; P624-T626 PolarHBondContact O-N 3.12Å; T626-E628 PolarHBondContact O-N 3.24Å; T626-L629 PolarHBondContact O-N 3.45Å; T626-I630 HydrophobicContact CG2-CD1 3.64Å; T626-I630 HydrophobicContact CG2-CG1 4.38Å; T626-I630 WeakPolarHBondContact O-CB 3.47Å; T626-I630 WeakPolarHBondContact O-CG1 3.38Å; T626-I630 PolarHBondContact O-N 3.25Å; T626-L638 HydrophobicContact CG2-CD2 3.99Å; T626-I663 HydrophobicContact CG2-CG1 4.3Å
627	V	93.8	Very high	92.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.1	-46.9	176.6	170.7	0	0	0	0	110.8	F623 P624 L629 I630 F631 L638 F1082 L1086 L1092	F623-V627 HydrophobicContact CD1-CG2 3.93Å; F623-V627 HydrophobicContact CD2-CG2 4.38Å; F623-V627 HydrophobicContact CE1-CG2 3.48Å; F623-V627 VanDerWaalsContact CE1-CG2 3.48Å; F623-V627 HydrophobicContact CE2-CG2 3.99Å; F623-V627 HydrophobicContact CG-CG2 4.35Å; F623-V627 HydrophobicContact CZ-CG2 3.52Å; F623-V627 WeakPolarHBondContact O-CG2 3.45Å; F623-V627 PolarHBondContact O-N 3.16Å; P624-V627 PolarHBondContact O-N 3.24Å; V627-L629 PolarHBondContact O-N 3.37Å; V627-I630 PolarHBondContact O-N 3.17Å; V627-F631 VanDerWaalsContact O-CB 3.24Å; V627-F631 WeakPolarHBondContact O-CB 3.25Å; V627-F631 PolarHBondContact O-N 3.27Å; V627-L638 HydrophobicContact CG2-CB 4.17Å; V627-L638 HydrophobicContact CG2-CD2 4Å; V627-L638 HydrophobicContact CG2-CG 4.26Å; V627-F1082 HydrophobicContact CG1-CE1 4.02Å; V627-F1082 HydrophobicContact CG1-CZ 3.71Å; V627-L1086 HydrophobicContact CB-CD2 3.97Å; V627-L1086 HydrophobicContact CG1-CD1 4.41Å; V627-L1086 HydrophobicContact CG1-CD2 3.64Å; V627-L1092 HydrophobicContact CG1-CD1 3.5Å; V627-L1092 VanDerWaalsContact CG1-CD1 3.5Å
628	E	93.8	Very high	92.6	Very high	54 Å²	54	33 Å²	33	25%	0.252	18%	0.177	S	C	.	.	H	α-helix	trans	-57	-49.3	177.6	168.9	171	160.1	0	0	111.4	P624 T626 I630 F631 V632 L1083 L1086 R1087	P624-E628 WeakPolarHBondContact O-CB 3.27Å; P624-E628 PolarHBondContact O-N 2.88Å; T626-E628 PolarHBondContact O-N 3.24Å; E628-I630 PolarHBondContact O-N 3.19Å; E628-F631 PolarHBondContact O-N 3.17Å; E628-V632 WeakPolarHBondContact O-CB 3.2Å; E628-V632 WeakPolarHBondContact O-CG2 3.29Å; E628-V632 PolarHBondContact O-N 3.28Å; E628-L1083 HydrophobicContact CB-CD2 4.25Å; E628-L1083 HydrophobicContact CG-CD2 3.69Å; E628-L1086 HydrophobicContact CB-CD2 4.17Å; E628-R1087 VanDerWaalsContact CD-NH2 3.31Å; E628-R1087 IonicContact OE1-CZ 3.07Å; E628-R1087 IonicContact OE1-NE 2.66Å; E628-R1087 IonicContact OE1-NH2 3.51Å; E628-R1087 PolarHBondContact OE1-NH2 2.89Å; E628-R1087 IonicContact OE2-CZ 3.8Å; E628-R1087 IonicContact OE2-NE 3.43Å; E628-R1087 PolarHBondContact OE2-NE 3.44Å; E628-R1087 IonicContact OE2-NH2 3.52Å; E628-R1087 PolarHBondContact OE2-NH2 2.86Å
629	L	92.4	Very high	92.6	Very high	37 Å²	37	33.1 Å²	33.1	19%	0.194	18%	0.178	C	C	.	.	H	α-helix	trans	-63	-44.5	-179.3	-168.5	149.2	0	0	0	111.2	F618 E625 T626 V627 K633 Y685	F618-L629 HydrophobicContact CE1-CD2 3.59Å; F618-L629 HydrophobicContact CE1-CG 4.49Å; F618-L629 HydrophobicContact CZ-CD2 4.06Å; E625-L629 PolarHBondContact O-N 3.04Å; T626-L629 PolarHBondContact O-N 3.45Å; V627-L629 PolarHBondContact O-N 3.37Å; L629-K633 HydrophobicContact CD2-CB 4.39Å; L629-K633 HydrophobicContact CG-CG 4.48Å; L629-K633 VanDerWaalsContact O-CB 3.23Å; L629-K633 WeakPolarHBondContact O-CB 3.16Å; L629-K633 PolarHBondContact O-N 3.11Å; L629-Y685 HydrophobicContact CD1-CE1 4.36Å; L629-Y685 HydrophobicContact CD2-CD1 4.18Å; L629-Y685 HydrophobicContact CD2-CE1 3.56Å; L629-Y685 HydrophobicContact CD2-CE2 4.34Å
630	I	94	Very high	92.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.164	C	C	.	.	I	π-helix	trans	-66.4	-42.3	-179.2	-69.9	176.9	0	0	0	110.9	L614 F618 T626 V627 E628 L634 K635 L636 L638 F671	L614-I630 HydrophobicContact CD2-CD1 3.77Å; F618-I630 HydrophobicContact CE1-CD1 4.09Å; F618-I630 HydrophobicContact CE1-CG1 3.75Å; F618-I630 HydrophobicContact CE2-CD1 4.43Å; F618-I630 HydrophobicContact CZ-CD1 4Å; F618-I630 HydrophobicContact CZ-CG1 3.7Å; T626-I630 HydrophobicContact CG2-CD1 3.64Å; T626-I630 HydrophobicContact CG2-CG1 4.38Å; T626-I630 WeakPolarHBondContact O-CB 3.47Å; T626-I630 WeakPolarHBondContact O-CG1 3.38Å; T626-I630 PolarHBondContact O-N 3.25Å; V627-I630 PolarHBondContact O-N 3.17Å; E628-I630 PolarHBondContact O-N 3.19Å; I630-L634 HydrophobicContact CG1-CD1 4.15Å; I630-L634 HydrophobicContact CG2-CB 4.41Å; I630-L634 HydrophobicContact CG2-CD1 4.38Å; I630-L634 CarbonylContact O-C 3.6Å; I630-L634 VanDerWaalsContact O-CA 3.29Å; I630-L634 WeakPolarHBondContact O-CA 3.41Å; I630-L634 VanDerWaalsContact O-CB 3.25Å; I630-L634 WeakPolarHBondContact O-CB 3.33Å; I630-L634 PolarHBondContact O-N 2.94Å; I630-K635 PolarHBondContact O-N 3.43Å; I630-K635 VanDerWaalsContact O-N 3.09Å; I630-L636 HydrophobicContact CG2-CB 3.7Å; I630-L636 PolarHBondContact O-N 3.02Å; I630-L638 HydrophobicContact CD1-CB 4.48Å; I630-L638 HydrophobicContact CD1-CD2 4.06Å; I630-F671 HydrophobicContact CD1-CE1 4Å; I630-F671 HydrophobicContact CD1-CZ 4.5Å; I630-F671 HydrophobicContact CG2-CD1 4.42Å; I630-F671 HydrophobicContact CG2-CE1 4.03Å
631	F	93.2	Very high	92.6	Very high	16 Å²	16	28.3 Å²	28.3	7%	0.07	14%	0.138	C	C	.	.	I	π-helix	trans	-64.7	-48.8	179.6	-174.6	-98.2	0	0	0	111.8	V627 E628 K635 L636 L637 Y1078 F1082 E1118	V627-F631 VanDerWaalsContact O-CB 3.24Å; V627-F631 WeakPolarHBondContact O-CB 3.25Å; V627-F631 PolarHBondContact O-N 3.27Å; E628-F631 PolarHBondContact O-N 3.17Å; F631-K635 VanDerWaalsContact O-CA 3.32Å; F631-K635 WeakPolarHBondContact O-CA 3.49Å; F631-K635 PolarHBondContact O-N 3.15Å; F631-L636 WeakPolarHBondContact CA-O 3.31Å; F631-L637 HydrophobicContact CD2-CD1 4.48Å; F631-Y1078 HydrophobicContact CE2-CE1 4.29Å; F631-Y1078 HydrophobicContact CZ-CD1 4.12Å; F631-Y1078 HydrophobicContact CZ-CE1 4Å; F631-F1082 HydrophobicContact CB-CE1 3.85Å; F631-F1082 HydrophobicContact CB-CZ 4.38Å; F631-F1082 AromaticContact CD1-CD1 3.63Å; F631-F1082 HydrophobicContact CD1-CD1 3.63Å; F631-F1082 AromaticContact CD1-CE1 3.83Å; F631-F1082 HydrophobicContact CD1-CE1 3.83Å; F631-F1082 HydrophobicContact CD1-CG 4.32Å; F631-F1082 HydrophobicContact CD2-CD1 4.28Å; F631-F1082 AromaticContact CD2-CE1 3.94Å; F631-F1082 HydrophobicContact CD2-CE1 3.94Å; F631-F1082 HydrophobicContact CD2-CE2 4.36Å; F631-F1082 AromaticContact CD2-CZ 3.99Å; F631-F1082 HydrophobicContact CD2-CZ 3.99Å; F631-F1082 HydrophobicContact CE1-CB 4.27Å; F631-F1082 AromaticContact CE1-CD1 3.81Å; F631-F1082 HydrophobicContact CE1-CD1 3.81Å; F631-F1082 HydrophobicContact CE1-CE1 4.37Å; F631-F1082 HydrophobicContact CE1-CG 4.05Å; F631-F1082 HydrophobicContact CE2-CD1 4.42Å; F631-F1082 HydrophobicContact CE2-CD2 4.35Å; F631-F1082 HydrophobicContact CE2-CE1 4.47Å; F631-F1082 HydrophobicContact CE2-CE2 4.4Å; F631-F1082 HydrophobicContact CE2-CG 4.37Å; F631-F1082 HydrophobicContact CE2-CZ 4.46Å; F631-F1082 AromaticContact CG-CD1 3.88Å; F631-F1082 HydrophobicContact CG-CD1 3.88Å; F631-F1082 AromaticContact CG-CE1 3.59Å; F631-F1082 HydrophobicContact CG-CE1 3.59Å; F631-F1082 HydrophobicContact CG-CZ 4.09Å; F631-F1082 HydrophobicContact CZ-CB 4.36Å; F631-F1082 HydrophobicContact CZ-CD1 4.2Å; F631-F1082 HydrophobicContact CZ-CD2 4.41Å; F631-F1082 HydrophobicContact CZ-CG 4.08Å; F631-E1118 HydrophobicContact CE1-CB 4.23Å; F631-E1118 HydrophobicContact CE1-CG 4.17Å
632	V	91.3	Very high	92.4	Very high	50 Å²	50	27 Å²	27	30%	0.303	13%	0.132	S	C	.	.	I	π-helix	trans	-75.4	-45.4	-176.7	177.5	0	0	0	0	112.2	E628 L1083	E628-V632 WeakPolarHBondContact O-CB 3.2Å; E628-V632 WeakPolarHBondContact O-CG2 3.29Å; E628-V632 PolarHBondContact O-N 3.28Å; V632-L1083 HydrophobicContact CG2-CD1 3.99Å; V632-L1083 HydrophobicContact CG2-CD2 3.88Å; V632-L1083 HydrophobicContact CG2-CG 4.43Å
633	K	90.7	Very high	91.8	Very high	81 Å²	81	27 Å²	27	35%	0.352	13%	0.131	S	C	.	.	I	π-helix	trans	-88.4	-38.8	-173.9	-68.3	-76	-174	166.1	0	113.5	L629 E691	L629-K633 HydrophobicContact CD2-CB 4.39Å; L629-K633 HydrophobicContact CG-CG 4.48Å; L629-K633 VanDerWaalsContact O-CB 3.23Å; L629-K633 WeakPolarHBondContact O-CB 3.16Å; L629-K633 PolarHBondContact O-N 3.11Å; K633-E691 PolarHBondContact NZ-O 3.36Å
634	L	91.7	Very high	90.9	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	I	π-helix	trans	-101	-11.4	-174.4	-51.9	-175.7	0	0	0	113	F618 I630 L636 R681 A682 Y685 I699	F618-L634 HydrophobicContact CZ-CD1 4.34Å; I630-L634 HydrophobicContact CG1-CD1 4.15Å; I630-L634 HydrophobicContact CG2-CB 4.41Å; I630-L634 HydrophobicContact CG2-CD1 4.38Å; I630-L634 CarbonylContact O-C 3.6Å; I630-L634 VanDerWaalsContact O-CA 3.29Å; I630-L634 WeakPolarHBondContact O-CA 3.41Å; I630-L634 VanDerWaalsContact O-CB 3.25Å; I630-L634 WeakPolarHBondContact O-CB 3.33Å; I630-L634 PolarHBondContact O-N 2.94Å; L634-L636 HydrophobicContact CB-CD1 4.01Å; L634-L636 HydrophobicContact CB-CG 4.08Å; L634-L636 HydrophobicContact CD1-CD1 4.43Å; L634-L636 PolarHBondContact O-N 3.33Å; L634-R681 HydrophobicContact CD2-CB 4.38Å; L634-R681 VanDerWaalsContact O-CZ 3.28Å; L634-R681 PolarHBondContact O-NH2 3.39Å; L634-A682 HydrophobicContact CD1-CB 4.17Å; L634-Y685 HydrophobicContact CD2-CD2 3.83Å; L634-Y685 HydrophobicContact CD2-CE2 4.45Å; L634-Y685 HydrophobicContact CD2-CG 4.45Å; L634-I699 HydrophobicContact CD2-CD1 3.43Å; L634-I699 VanDerWaalsContact CD2-CD1 3.43Å; L634-I699 HydrophobicContact CD2-CG2 4.4Å
635	K	92.6	Very high	89.7	Confident	136 Å²	136	34.2 Å²	34.2	59%	0.591	16%	0.164	S	C	*	.			trans	55.3	37.8	-175.5	-56.5	-177.1	-178.9	178.8	0	112.7	I630 F631 V696	I630-K635 PolarHBondContact O-N 3.43Å; I630-K635 VanDerWaalsContact O-N 3.09Å; F631-K635 VanDerWaalsContact O-CA 3.32Å; F631-K635 WeakPolarHBondContact O-CA 3.49Å; F631-K635 PolarHBondContact O-N 3.15Å; K635-V696 HydrophobicContact CD-CG2 3.92Å; K635-V696 HydrophobicContact CG-CG2 4.13Å
636	L	93.8	Very high	88.2	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.176	C	C	.	.			trans	-117.4	149.1	176	-57.2	171	0	0	0	109.1	I630 F631 L634 F671 A673 E678 V679 A682	I630-L636 HydrophobicContact CG2-CB 3.7Å; I630-L636 PolarHBondContact O-N 3.02Å; F631-L636 WeakPolarHBondContact CA-O 3.31Å; L634-L636 HydrophobicContact CB-CD1 4.01Å; L634-L636 HydrophobicContact CB-CG 4.08Å; L634-L636 HydrophobicContact CD1-CD1 4.43Å; L634-L636 PolarHBondContact O-N 3.33Å; L636-F671 HydrophobicContact CB-CD1 4.17Å; L636-F671 HydrophobicContact CD1-CD1 4.47Å; L636-A673 HydrophobicContact CD2-CB 3.6Å; L636-E678 HydrophobicContact CD2-CB 4.17Å; L636-V679 HydrophobicContact CD2-CG2 4.26Å; L636-A682 HydrophobicContact CD1-CB 4.19Å
637	L	94	Very high	86.6	Confident	5 Å²	5	42.7 Å²	42.7	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	107.2	174.6	177.7	62.6	0	0	0	109.9	F631 L639 F671 I672 F1082 L1092 I1094 A1115	F631-L637 HydrophobicContact CD2-CD1 4.48Å; L637-L639 HydrophobicContact CD2-CD2 3.98Å; L637-L639 HydrophobicContact CG-CD2 4.02Å; L637-F671 CarbonylContact O-C 3.35Å; L637-F671 VanDerWaalsContact O-CA 3.22Å; L637-F671 WeakPolarHBondContact O-CA 3.19Å; L637-I672 HydrophobicContact CB-CB 4.27Å; L637-I672 HydrophobicContact CD2-CB 4.42Å; L637-I672 HydrophobicContact CD2-CD1 4.13Å; L637-I672 PolarHBondContact N-O 2.91Å; L637-I672 PolarHBondContact O-N 2.91Å; L637-F1082 HydrophobicContact CD1-CE2 3.62Å; L637-F1082 HydrophobicContact CD1-CZ 3.79Å; L637-L1092 HydrophobicContact CD1-CD1 4.03Å; L637-L1092 HydrophobicContact CD1-CD2 4.47Å; L637-L1092 HydrophobicContact CD1-CG 4.3Å; L637-I1094 HydrophobicContact CD2-CG2 4.45Å; L637-A1115 HydrophobicContact CD2-CB 4.13Å
638	L	94.7	Very high	84.8	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.8	173.5	175.8	68.3	0	0	0	109.9	F623 T626 V627 I630 A640 F671 L1092	F623-L638 HydrophobicContact CD2-CD2 4.24Å; F623-L638 HydrophobicContact CE2-CD2 3.69Å; F623-L638 HydrophobicContact CE2-CG 3.9Å; F623-L638 HydrophobicContact CZ-CD2 4.38Å; F623-L638 HydrophobicContact CZ-CG 4.26Å; T626-L638 HydrophobicContact CG2-CD2 3.99Å; V627-L638 HydrophobicContact CG2-CB 4.17Å; V627-L638 HydrophobicContact CG2-CD2 4Å; V627-L638 HydrophobicContact CG2-CG 4.26Å; I630-L638 HydrophobicContact CD1-CB 4.48Å; I630-L638 HydrophobicContact CD1-CD2 4.06Å; L638-A640 WeakPolarHBondContact CD1-O 3.41Å; L638-F671 HydrophobicContact CB-CD1 4.02Å; L638-F671 HydrophobicContact CB-CE1 3.89Å; L638-F671 HydrophobicContact CD1-CD1 4.06Å; L638-F671 HydrophobicContact CD1-CE1 3.65Å; L638-F671 HydrophobicContact CD1-CE2 4.32Å; L638-F671 HydrophobicContact CD1-CZ 3.81Å; L638-F671 HydrophobicContact CG-CE1 4.28Å; L638-L1092 WeakPolarHBondContact O-CD2 3.15Å
639	L	91.9	Very high	83	Confident	4 Å²	4	52 Å²	52	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-45.6	-177.9	-67.5	-177	0	0	0	114	L637 N656 F670 I672 F1020 L1092 I1094 L1141	L637-L639 HydrophobicContact CD2-CD2 3.98Å; L637-L639 HydrophobicContact CG-CD2 4.02Å; L639-N656 PolarHBondContact O-N 3.42Å; L639-F670 PolarHBondContact N-O 3.34Å; L639-I672 HydrophobicContact CD1-CD1 3.59Å; L639-I672 HydrophobicContact CD1-CG1 3.65Å; L639-I672 HydrophobicContact CD2-CD1 4.12Å; L639-I672 HydrophobicContact CG-CD1 4.1Å; L639-I672 HydrophobicContact CG-CG1 4.09Å; L639-F1020 HydrophobicContact CD1-CE2 4.47Å; L639-F1020 HydrophobicContact CD1-CZ 4.27Å; L639-L1092 HydrophobicContact CD2-CD2 3.72Å; L639-I1094 HydrophobicContact CD2-CG1 4.23Å; L639-L1141 HydrophobicContact CD2-CD1 4.39Å
640	A	90.9	Very high	81.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	161.8	-168.1	0	0	0	0	0	110.8	L638 I653 I654 I655 F670 L1016	L638-A640 WeakPolarHBondContact CD1-O 3.41Å; A640-I653 HydrophobicContact CB-CG2 4.15Å; A640-I654 WeakPolarHBondContact CA-O 3.48Å; A640-I654 WeakPolarHBondContact CB-O 3.39Å; A640-I655 HydrophobicContact CB-CB 4.44Å; A640-I655 HydrophobicContact CB-CG1 4.13Å; A640-F670 HydrophobicContact CB-CB 4.05Å; A640-F670 HydrophobicContact CB-CD2 3.86Å; A640-F670 HydrophobicContact CB-CG 4.22Å; A640-F670 PolarHBondContact O-N 3.37Å; A640-L1016 HydrophobicContact CB-CD1 3.82Å
641	I	91.6	Very high	80.2	Confident	3 Å²	3	57.8 Å²	57.8	2%	0.015	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.8	173.1	54.2	171.3	0	0	0	110.9	L614 F623 V643 I654 P657 I663 T667 Q668	L614-I641 HydrophobicContact CD1-CG2 4.48Å; F623-I641 HydrophobicContact CD2-CD1 4.36Å; F623-I641 HydrophobicContact CD2-CG2 4.03Å; F623-I641 HydrophobicContact CE2-CG2 3.9Å; I641-V643 HydrophobicContact CD1-CG2 4.07Å; I641-V643 HydrophobicContact CG1-CG2 4.26Å; I641-I654 PolarHBondContact N-O 3.33Å; I641-I654 VanDerWaalsContact N-O 3.11Å; I641-I654 PolarHBondContact O-N 3.4Å; I641-P657 HydrophobicContact CD1-CG 3.89Å; I641-P657 HydrophobicContact CG1-CG 4.03Å; I641-I663 HydrophobicContact CD1-CD1 4.09Å; I641-I663 HydrophobicContact CG2-CD1 4.03Å; I641-T667 HydrophobicContact CB-CG2 3.7Å; I641-T667 HydrophobicContact CG2-CG2 3.83Å; I641-Q668 WeakPolarHBondContact CA-O 3.44Å
642	E	87.2	Confident	79.4	Confident	17 Å²	17	60 Å²	60	8%	0.079	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	116.2	168.6	-170	-163.9	-165.4	0	0	109.2	K644 C651 Q668 F670	E642-K644 WeakPolarHBondContact OE2-CE 3.45Å; E642-K644 IonicContact OE2-NZ 2.8Å; E642-C651 HydrophobicContact CG-CB 4.03Å; E642-C651 WeakPolarHBondContact OE1-CB 3.46Å; E642-C651 PolarHBondContact OE1-SG 3.18Å; E642-Q668 HydrophobicContact CB-CB 3.99Å; E642-Q668 PolarHBondContact N-O 3.42Å; E642-Q668 VanDerWaalsContact OE2-CD 3.24Å; E642-Q668 WeakPolarHBondContact OE2-CG 3.36Å; E642-Q668 PolarHBondContact OE2-OE1 3.45Å; E642-F670 HydrophobicContact CB-CE2 4.27Å
643	V	79.2	Confident	79.1	Confident	37 Å²	37	58.8 Å²	58.8	22%	0.224	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	116.2	172.6	-174.6	0	0	0	0	108.2	I641 T652 I654	I641-V643 HydrophobicContact CD1-CG2 4.07Å; I641-V643 HydrophobicContact CG1-CG2 4.26Å; V643-T652 PolarHBondContact N-O 3.02Å; V643-T652 PolarHBondContact O-N 3.09Å; V643-T652 PolarHBondContact O-OG1 2.99Å; V643-I654 HydrophobicContact CB-CD1 4.29Å; V643-I654 HydrophobicContact CG2-CD1 3.86Å; V643-I654 HydrophobicContact CG2-CG1 4.48Å
644	K	74	Confident	78.8	Confident	104 Å²	104	58.2 Å²	58.2	45%	0.452	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	118.3	171.3	-57.8	-168.7	177.9	-176.9	0	108	E642	E642-K644 WeakPolarHBondContact OE2-CE 3.45Å; E642-K644 IonicContact OE2-NZ 2.8Å
645	D	66.8	Low	78.7	Confident	65 Å²	65	59.2 Å²	59.2	35%	0.348	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-79.6	119.8	170.1	-166.7	8.3	0	0	0	108.4	D647 N648 L649 E650	D645-D647 PolarHBondContact O-N 2.85Å; D645-N648 PolarHBondContact OD2-ND2 3.49Å; D645-N648 VanDerWaalsContact OD2-ND2 3.16Å; D645-L649 PolarHBondContact O-N 3.13Å; D645-E650 PolarHBondContact N-O 3.29Å; D645-E650 VanDerWaalsContact N-O 3.17Å
646	D	61.4	Low	78.5	Confident	141 Å²	141	53.1 Å²	53.1	75%	0.754	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-25.6	-176.7	-72.3	-41.7	0	0	0	111.2
647	D	59.5	Low	78.1	Confident	143 Å²	143	53.5 Å²	53.5	77%	0.765	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-41.7	-173.8	-69.7	-28.9	0	0	0	113.3	D645	D645-D647 PolarHBondContact O-N 2.85Å
648	N	57.2	Low	77.4	Confident	101 Å²	101	59.9 Å²	59.9	54%	0.54	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-5.3	-173.2	-70.2	-43.9	0	0	0	114.5	D645 E650	D645-N648 PolarHBondContact OD2-ND2 3.49Å; D645-N648 VanDerWaalsContact OD2-ND2 3.16Å; N648-E650 HydrophobicContact CB-CB 4.19Å; N648-E650 HydrophobicContact CB-CG 4.08Å; N648-E650 PolarHBondContact O-N 3.38Å
649	L	54.8	Low	76.8	Confident	150 Å²	150	62.7 Å²	62.7	79%	0.785	33%	0.333	S	S	*	.			trans	52.6	21.2	-169.4	-67.5	151	0	0	0	112.2	D645	D645-L649 PolarHBondContact O-N 3.13Å
650	E	61.4	Low	76.4	Confident	95 Å²	95	65.9 Å²	65.9	44%	0.444	36%	0.356	S	S	.	.			trans	-93.5	123.4	177.1	-72.7	-173.4	176.4	0	0	108.5	D645 N648	D645-E650 PolarHBondContact N-O 3.29Å; D645-E650 VanDerWaalsContact N-O 3.17Å; N648-E650 HydrophobicContact CB-CB 4.19Å; N648-E650 HydrophobicContact CB-CG 4.08Å; N648-E650 PolarHBondContact O-N 3.38Å
651	C	67	Low	76.2	Confident	63 Å²	63	67.2 Å²	67.2	43%	0.426	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	116.9	169.3	-67.5	0	0	0	0	108	E642	E642-C651 HydrophobicContact CG-CB 4.03Å; E642-C651 WeakPolarHBondContact OE1-CB 3.46Å; E642-C651 PolarHBondContact OE1-SG 3.18Å
652	T	75.9	Confident	76.1	Confident	62 Å²	62	72 Å²	72	38%	0.38	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.4	176.2	56.6	0	0	0	0	109.4	V643	V643-T652 PolarHBondContact N-O 3.02Å; V643-T652 PolarHBondContact O-N 3.09Å; V643-T652 PolarHBondContact O-OG1 2.99Å
653	I	84.8	Confident	76.3	Confident	25 Å²	25	71.2 Å²	71.2	13%	0.128	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	121	173.9	-59.9	175.4	0	0	0	107.2	A640 F670 T1015 L1016	A640-I653 HydrophobicContact CB-CG2 4.15Å; I653-F670 HydrophobicContact CB-CE2 4.47Å; I653-F670 HydrophobicContact CD1-CE1 4.14Å; I653-F670 HydrophobicContact CD1-CE2 4.14Å; I653-F670 HydrophobicContact CD1-CZ 3.49Å; I653-F670 VanDerWaalsContact CD1-CZ 3.49Å; I653-F670 HydrophobicContact CG1-CE2 3.99Å; I653-F670 HydrophobicContact CG1-CZ 3.82Å; I653-F670 HydrophobicContact CG2-CD2 4.23Å; I653-F670 HydrophobicContact CG2-CE2 3.78Å; I653-F670 HydrophobicContact CG2-CZ 4.13Å; I653-T1015 HydrophobicContact CD1-CG2 3.73Å; I653-L1016 HydrophobicContact CD1-CB 4.4Å; I653-L1016 HydrophobicContact CG2-CD1 3.58Å
654	I	85.5	Confident	76.8	Confident	69 Å²	69	74.7 Å²	74.7	35%	0.354	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	115.7	179.4	-49.9	178.1	0	0	0	108.2	A640 I641 V643 P657	A640-I654 WeakPolarHBondContact CA-O 3.48Å; A640-I654 WeakPolarHBondContact CB-O 3.39Å; I641-I654 PolarHBondContact N-O 3.33Å; I641-I654 VanDerWaalsContact N-O 3.11Å; I641-I654 PolarHBondContact O-N 3.4Å; V643-I654 HydrophobicContact CB-CD1 4.29Å; V643-I654 HydrophobicContact CG2-CD1 3.86Å; V643-I654 HydrophobicContact CG2-CG1 4.48Å; I654-P657 HydrophobicContact CB-CB 4.48Å; I654-P657 HydrophobicContact CG2-CB 3.82Å
655	I	88.1	Confident	77.4	Confident	21 Å²	21	73.9 Å²	73.9	11%	0.108	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.2	177.6	-59.3	162.5	0	0	0	108.4	A640 L1016 T1019 F1020 C1055 L1141	A640-I655 HydrophobicContact CB-CB 4.44Å; A640-I655 HydrophobicContact CB-CG1 4.13Å; I655-L1016 HydrophobicContact CD1-CD1 4.42Å; I655-L1016 HydrophobicContact CG1-CD1 4Å; I655-T1019 HydrophobicContact CD1-CG2 3.81Å; I655-F1020 HydrophobicContact CB-CZ 4.37Å; I655-F1020 HydrophobicContact CD1-CB 4.38Å; I655-F1020 HydrophobicContact CD1-CD1 3.96Å; I655-F1020 HydrophobicContact CD1-CD2 3.4Å; I655-F1020 HydrophobicContact CD1-CE1 4.05Å; I655-F1020 HydrophobicContact CD1-CE2 3.51Å; I655-F1020 HydrophobicContact CD1-CG 3.63Å; I655-F1020 HydrophobicContact CD1-CZ 3.84Å; I655-F1020 HydrophobicContact CG1-CD2 4.16Å; I655-F1020 HydrophobicContact CG1-CE2 3.78Å; I655-F1020 HydrophobicContact CG1-CZ 4.02Å; I655-F1020 HydrophobicContact CG2-CE1 3.76Å; I655-F1020 HydrophobicContact CG2-CE2 4.09Å; I655-F1020 HydrophobicContact CG2-CZ 3.43Å; I655-F1020 VanDerWaalsContact CG2-CZ 3.43Å; I655-C1055 HydrophobicContact CG2-CB 4.43Å; I655-C1055 WeakPolarHBondContact O-CB 3.38Å; I655-L1141 HydrophobicContact CG2-CD1 3.86Å
656	N	89.2	Confident	78.3	Confident	8 Å²	8	76.3 Å²	76.3	4%	0.043	42%	0.416	C	S	.	.	S	Bend	trans	39.6	67.9	-175.7	-168.1	29.8	0	0	0	112.5	F623 L639 C1055 G1090 L1141	F623-N656 WeakPolarHBondContact CE1-OD1 3.49Å; L639-N656 PolarHBondContact O-N 3.42Å; N656-C1055 HydrophobicContact CB-CB 4.27Å; N656-G1090 PolarHBondContact ND2-O 3.21Å; N656-L1141 HydrophobicContact CB-CB 4.45Å; N656-L1141 PolarHBondContact ND2-O 3.29Å
657	P	85.5	Confident	79.6	Confident	10 Å²	10	70.1 Å²	70.1	7%	0.065	38%	0.384	C	S	.	.			trans	-58.1	163.5	-178.6	29.7	-39.4	0	0	0	111.7	F623 I641 I654 A661	F623-P657 HydrophobicContact CB-CG 3.77Å; F623-P657 HydrophobicContact CD1-CG 3.77Å; F623-P657 HydrophobicContact CD2-CG 3.61Å; F623-P657 HydrophobicContact CE1-CG 4.26Å; F623-P657 HydrophobicContact CE2-CG 4.12Å; F623-P657 HydrophobicContact CG-CG 3.42Å; F623-P657 VanDerWaalsContact CG-CG 3.42Å; F623-P657 HydrophobicContact CZ-CG 4.42Å; I641-P657 HydrophobicContact CD1-CG 3.89Å; I641-P657 HydrophobicContact CG1-CG 4.03Å; I654-P657 HydrophobicContact CB-CB 4.48Å; I654-P657 HydrophobicContact CG2-CB 3.82Å; P657-A661 HydrophobicContact CB-CB 3.78Å; P657-A661 HydrophobicContact CG-CB 4.13Å
658	E	80	Confident	81.1	Confident	139 Å²	139	65.8 Å²	65.8	65%	0.65	36%	0.359	S	S	*	.			trans	-50.3	144	176.5	-163.8	-167.2	144.9	0	0	111.3	S660 A661	E658-S660 PolarHBondContact O-N 3.17Å; E658-S660 PolarHBondContact OE1-OG 3.45Å; E658-S660 PolarHBondContact OE2-OG 2.94Å; E658-A661 WeakPolarHBondContact O-CB 3.41Å; E658-A661 PolarHBondContact O-N 2.89Å
659	S	81.1	Confident	82.8	Confident	60 Å²	60	61 Å²	61	42%	0.42	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-20.7	-178	-53.3	0	0	0	0	114.3
660	S	83.7	Confident	84.6	Confident	71 Å²	71	53.9 Å²	53.9	50%	0.497	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-9.1	176.1	62.7	0	0	0	0	114.1	E658 I662	E658-S660 PolarHBondContact O-N 3.17Å; E658-S660 PolarHBondContact OE1-OG 3.45Å; E658-S660 PolarHBondContact OE2-OG 2.94Å; S660-I662 PolarHBondContact O-N 2.93Å
661	A	85.6	Confident	86.1	Confident	28 Å²	28	49.3 Å²	49.3	23%	0.231	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-69.3	128.7	-178.3	0	0	0	0	0	111.7	T622 F623 P657 E658	T622-A661 CarbonylContact C-O 3.58Å; T622-A661 WeakPolarHBondContact CA-O 3.11Å; F623-A661 PolarHBondContact N-O 3.37Å; P657-A661 HydrophobicContact CB-CB 3.78Å; P657-A661 HydrophobicContact CG-CB 4.13Å; E658-A661 WeakPolarHBondContact O-CB 3.41Å; E658-A661 PolarHBondContact O-N 2.89Å
662	I	90.2	Very high	87.3	Confident	102 Å²	102	46.4 Å²	46.4	52%	0.523	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-103.6	137.1	-177	-57.7	173.4	0	0	0	109.8	G620 S660 K664	G620-I662 VanDerWaalsContact CA-CG2 3.49Å; S660-I662 PolarHBondContact O-N 2.93Å; I662-K664 PolarHBondContact O-N 3.17Å
663	I	90.8	Very high	88	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-70	122.5	175	-56.2	-57.5	0	0	0	110.4	L614 F618 G620 M621 F623 T626 I641 T667	L614-I663 HydrophobicContact CD1-CD1 4.09Å; L614-I663 HydrophobicContact CD1-CG1 4.42Å; L614-I663 HydrophobicContact CD1-CG2 3.73Å; F618-I663 HydrophobicContact CB-CG2 4.34Å; F618-I663 WeakPolarHBondContact O-CB 3.37Å; G620-I663 PolarHBondContact N-O 3.06Å; M621-I663 PolarHBondContact O-N 2.92Å; F623-I663 HydrophobicContact CD2-CD1 4.3Å; T626-I663 HydrophobicContact CG2-CG1 4.3Å; I641-I663 HydrophobicContact CD1-CD1 4.09Å; I641-I663 HydrophobicContact CG2-CD1 4.03Å; I663-T667 HydrophobicContact CG2-CG2 4.49Å
664	K	89.6	Confident	88.1	Confident	110 Å²	110	46.3 Å²	46.3	48%	0.478	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-88.2	169.8	176.1	-64.9	-176.1	-178.8	-179.6	0	111	I662 T667	I662-K664 PolarHBondContact O-N 3.17Å; K664-T667 PolarHBondContact N-OG1 2.89Å; K664-T667 PolarHBondContact O-N 2.87Å; K664-T667 PolarHBondContact O-OG1 3.43Å; K664-T667 VanDerWaalsContact O-OG1 3.07Å
665	V	88	Confident	88.1	Confident	86 Å²	86	44.9 Å²	44.9	52%	0.521	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	137.5	174.4	-178	0	0	0	0	109.5	V619 T667	V619-V665 HydrophobicContact CG1-CG2 3.8Å; V619-V665 HydrophobicContact CG2-CG2 4.08Å; V665-T667 PolarHBondContact O-N 2.74Å
666	N	84.9	Confident	87.9	Confident	116 Å²	116	45.3 Å²	45.3	62%	0.62	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	24.6	-179.2	-56.7	-26	0	0	0	114.7	Q668	N666-Q668 PolarHBondContact O-N 3.08Å
667	T	89.9	Confident	87.7	Confident	11 Å²	11	49.5 Å²	49.5	7%	0.067	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-63.9	127.6	167.8	-66	0	0	0	0	109.7	L614 I641 I663 K664 V665	L614-T667 HydrophobicContact CD1-CG2 4.25Å; L614-T667 PolarHBondContact N-O 3.03Å; L614-T667 VanDerWaalsContact N-O 3.08Å; I641-T667 HydrophobicContact CB-CG2 3.7Å; I641-T667 HydrophobicContact CG2-CG2 3.83Å; I663-T667 HydrophobicContact CG2-CG2 4.49Å; K664-T667 PolarHBondContact N-OG1 2.89Å; K664-T667 PolarHBondContact O-N 2.87Å; K664-T667 PolarHBondContact O-OG1 3.43Å; K664-T667 VanDerWaalsContact O-OG1 3.07Å; V665-T667 PolarHBondContact O-N 2.74Å
668	Q	90.2	Very high	87.8	Confident	53 Å²	53	51.5 Å²	51.5	25%	0.248	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132.3	170.5	-61.9	-170.5	-5.7	0	0	109.3	I641 E642 N666	I641-Q668 WeakPolarHBondContact CA-O 3.44Å; E642-Q668 HydrophobicContact CB-CB 3.99Å; E642-Q668 PolarHBondContact N-O 3.42Å; E642-Q668 VanDerWaalsContact OE2-CD 3.24Å; E642-Q668 WeakPolarHBondContact OE2-CG 3.36Å; E642-Q668 PolarHBondContact OE2-OE1 3.45Å; N666-Q668 PolarHBondContact O-N 3.08Å
669	G	92.1	Very high	88.3	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	144.1	172.5	0	0	0	0	0	110.7	T611 E612 F671	T611-G669 WeakPolarHBondContact CA-O 3.45Å; E612-G669 PolarHBondContact N-O 2.79Å; E612-G669 PolarHBondContact O-N 3.25Å; G669-F671 WeakPolarHBondContact O-CD2 3.1Å; G669-F671 VanDerWaalsContact O-CE2 3.28Å; G669-F671 WeakPolarHBondContact O-CE2 3.26Å
670	F	92.7	Very high	88.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	121.5	171.2	-65.3	-96.8	0	0	0	109.1	Y610 T611 L639 A640 E642 I653 L1016	Y610-F670 CarbonylContact O-C 3.56Å; Y610-F670 WeakPolarHBondContact O-CA 3.43Å; T611-F670 HydrophobicContact CG2-CD1 3.3Å; T611-F670 HydrophobicContact CG2-CE1 3.26Å; T611-F670 HydrophobicContact CG2-CG 4.14Å; T611-F670 HydrophobicContact CG2-CZ 4.04Å; L639-F670 PolarHBondContact N-O 3.34Å; A640-F670 HydrophobicContact CB-CB 4.05Å; A640-F670 HydrophobicContact CB-CD2 3.86Å; A640-F670 HydrophobicContact CB-CG 4.22Å; A640-F670 PolarHBondContact O-N 3.37Å; E642-F670 HydrophobicContact CB-CE2 4.27Å; I653-F670 HydrophobicContact CB-CE2 4.47Å; I653-F670 HydrophobicContact CD1-CE1 4.14Å; I653-F670 HydrophobicContact CD1-CE2 4.14Å; I653-F670 HydrophobicContact CD1-CZ 3.49Å; I653-F670 VanDerWaalsContact CD1-CZ 3.49Å; I653-F670 HydrophobicContact CG1-CE2 3.99Å; I653-F670 HydrophobicContact CG1-CZ 3.82Å; I653-F670 HydrophobicContact CG2-CD2 4.23Å; I653-F670 HydrophobicContact CG2-CE2 3.78Å; I653-F670 HydrophobicContact CG2-CZ 4.13Å; F670-L1016 HydrophobicContact CB-CD2 4.16Å; F670-L1016 HydrophobicContact CD1-CB 4.27Å; F670-L1016 HydrophobicContact CD1-CD1 4.26Å; F670-L1016 HydrophobicContact CD1-CD2 3.68Å; F670-L1016 HydrophobicContact CD1-CG 4.28Å; F670-L1016 HydrophobicContact CE1-CB 4.15Å; F670-L1016 HydrophobicContact CE1-CD2 4.4Å; F670-L1016 HydrophobicContact CG-CD1 4.23Å; F670-L1016 HydrophobicContact CG-CD2 4.12Å
671	F	93.1	Very high	89.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	146.4	-172.5	-59	-88.5	0	0	0	111.5	I609 Y610 E612 L614 I630 L636 L637 L638 G669 V679 A682	I609-F671 WeakPolarHBondContact CA-O 3.42Å; Y610-F671 PolarHBondContact N-O 3.14Å; Y610-F671 PolarHBondContact O-N 3.32Å; E612-F671 HydrophobicContact CB-CD2 4.38Å; E612-F671 HydrophobicContact CB-CE2 4.06Å; L614-F671 HydrophobicContact CD2-CE1 4.42Å; L614-F671 HydrophobicContact CD2-CZ 3.67Å; I630-F671 HydrophobicContact CD1-CE1 4Å; I630-F671 HydrophobicContact CD1-CZ 4.5Å; I630-F671 HydrophobicContact CG2-CD1 4.42Å; I630-F671 HydrophobicContact CG2-CE1 4.03Å; L636-F671 HydrophobicContact CB-CD1 4.17Å; L636-F671 HydrophobicContact CD1-CD1 4.47Å; L637-F671 CarbonylContact O-C 3.35Å; L637-F671 VanDerWaalsContact O-CA 3.22Å; L637-F671 WeakPolarHBondContact O-CA 3.19Å; L638-F671 HydrophobicContact CB-CD1 4.02Å; L638-F671 HydrophobicContact CB-CE1 3.89Å; L638-F671 HydrophobicContact CD1-CD1 4.06Å; L638-F671 HydrophobicContact CD1-CE1 3.65Å; L638-F671 HydrophobicContact CD1-CE2 4.32Å; L638-F671 HydrophobicContact CD1-CZ 3.81Å; L638-F671 HydrophobicContact CG-CE1 4.28Å; G669-F671 WeakPolarHBondContact O-CD2 3.1Å; G669-F671 VanDerWaalsContact O-CE2 3.28Å; G669-F671 WeakPolarHBondContact O-CE2 3.26Å; F671-V679 HydrophobicContact CB-CG1 4.1Å; F671-V679 HydrophobicContact CB-CG2 4.25Å; F671-V679 HydrophobicContact CD2-CG1 3.49Å; F671-V679 VanDerWaalsContact CD2-CG1 3.49Å; F671-V679 HydrophobicContact CE2-CG1 4.07Å; F671-V679 HydrophobicContact CG-CG1 3.89Å; F671-A682 HydrophobicContact CE1-CB 4.17Å; F671-A682 HydrophobicContact CE2-CB 4.4Å; F671-A682 HydrophobicContact CZ-CB 3.79Å
672	I	92.5	Very high	89.5	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.8	158.2	-63	175.6	0	0	0	108.2	L582 M607 E608 I609 L637 L639 I1094 A1115	L582-I672 HydrophobicContact CD1-CD1 3.89Å; L582-I672 HydrophobicContact CD2-CD1 3.83Å; L582-I672 HydrophobicContact CD2-CG1 3.97Å; L582-I672 HydrophobicContact CD2-CG2 3.76Å; M607-I672 HydrophobicContact CB-CG2 3.68Å; M607-I672 HydrophobicContact CE-CG2 4.23Å; M607-I672 HydrophobicContact CG-CG2 4.39Å; E608-I672 WeakPolarHBondContact O-CA 3.26Å; I609-I672 HydrophobicContact CG1-CG1 4.23Å; L637-I672 HydrophobicContact CB-CB 4.27Å; L637-I672 HydrophobicContact CD2-CB 4.42Å; L637-I672 HydrophobicContact CD2-CD1 4.13Å; L637-I672 PolarHBondContact N-O 2.91Å; L637-I672 PolarHBondContact O-N 2.91Å; L639-I672 HydrophobicContact CD1-CD1 3.59Å; L639-I672 HydrophobicContact CD1-CG1 3.65Å; L639-I672 HydrophobicContact CD2-CD1 4.12Å; L639-I672 HydrophobicContact CG-CD1 4.1Å; L639-I672 HydrophobicContact CG-CG1 4.09Å; I672-I1094 HydrophobicContact CD1-CG2 3.91Å; I672-A1115 HydrophobicContact CB-CB 4.43Å; I672-A1115 HydrophobicContact CG2-CB 3.72Å
673	A	90.6	Very high	89.5	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.008	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	172.2	179.7	0	0	0	0	0	111.2	E608 Y610 L636 V679	E608-A673 PolarHBondContact N-O 3.06Å; E608-A673 PolarHBondContact O-N 2.89Å; E608-A673 VanDerWaalsContact O-N 3.08Å; Y610-A673 HydrophobicContact CD2-CB 4.15Å; L636-A673 HydrophobicContact CD2-CB 3.6Å; A673-V679 HydrophobicContact CB-CG2 3.41Å; A673-V679 VanDerWaalsContact CB-CG2 3.41Å
674	Q	87.4	Confident	89.5	Confident	85 Å²	85	41 Å²	41	40%	0.397	21%	0.209	S	C	.	.	S	Bend	trans	-80.5	-26.7	177.6	-66.8	-175.7	-10	0	0	113.6	M607	M607-Q674 HydrophobicContact CE-CG 4.46Å; M607-Q674 HydrophobicContact SD-CB 4.41Å; M607-Q674 HydrophobicContact SD-CG 3.31Å; M607-Q674 WeakPolarHBondContact SD-CG 3.4Å
675	S	85.4	Confident	89.6	Confident	38 Å²	38	36.4 Å²	36.4	27%	0.266	19%	0.188	S	C	.	.			trans	-155	158.1	-178.8	68.7	0	0	0	0	112.1	Y610 D677 E678 V679	Y610-S675 VanDerWaalsContact CE2-C 3.5Å; Y610-S675 WeakPolarHBondContact OH-CA 3.48Å; S675-D677 VanDerWaalsContact C-N 3.26Å; S675-D677 PolarHBondContact O-N 3.03Å; S675-E678 WeakPolarHBondContact O-CB 3.42Å; S675-E678 PolarHBondContact O-N 2.9Å; S675-E678 WeakPolarHBondContact OG-CG 3.41Å; S675-E678 PolarHBondContact OG-N 3.47Å; S675-V679 WeakPolarHBondContact O-CG2 3.41Å; S675-V679 PolarHBondContact O-N 2.69Å
676	A	83	Confident	89.7	Confident	30 Å²	30	33.2 Å²	33.2	25%	0.248	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-35.4	174.8	0	0	0	0	0	112.5	Y610 E678 V679 K680	Y610-A676 HydrophobicContact CD1-CB 3.91Å; Y610-A676 HydrophobicContact CE1-CB 3.67Å; Y610-A676 VanDerWaalsContact CZ-N 3.33Å; Y610-A676 PolarHBondContact OH-N 3.45Å; A676-E678 VanDerWaalsContact C-N 3.32Å; A676-E678 PolarHBondContact O-N 2.69Å; A676-V679 PolarHBondContact O-N 2.88Å; A676-V679 VanDerWaalsContact O-N 3.12Å; A676-K680 PolarHBondContact O-N 2.82Å; A676-K680 VanDerWaalsContact O-N 3.12Å
677	D	85.5	Confident	89.8	Confident	96 Å²	96	31.6 Å²	31.6	51%	0.513	16%	0.158	S	C	.	.	H	α-helix	trans	-64.3	-35.9	178.9	-92.3	-7.1	0	0	0	112.9	S675 V679 K680	S675-D677 VanDerWaalsContact C-N 3.26Å; S675-D677 PolarHBondContact O-N 3.03Å; D677-V679 VanDerWaalsContact C-N 3.3Å; D677-V679 PolarHBondContact O-N 2.78Å; D677-K680 PolarHBondContact O-N 2.8Å; D677-K680 IonicContact OD1-NZ 3.81Å; D677-K680 PolarHBondContact OD1-NZ 2.93Å
678	E	88.6	Confident	89.6	Confident	53 Å²	53	40.4 Å²	40.4	25%	0.248	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-36.6	172.7	-79.1	-154.3	176.6	0	0	112.4	L636 S675 A676 R681	L636-E678 HydrophobicContact CD2-CB 4.17Å; S675-E678 WeakPolarHBondContact O-CB 3.42Å; S675-E678 PolarHBondContact O-N 2.9Å; S675-E678 WeakPolarHBondContact OG-CG 3.41Å; S675-E678 PolarHBondContact OG-N 3.47Å; A676-E678 VanDerWaalsContact C-N 3.32Å; A676-E678 PolarHBondContact O-N 2.69Å; E678-R681 VanDerWaalsContact O-CB 3.25Å; E678-R681 WeakPolarHBondContact O-CB 3.34Å; E678-R681 WeakPolarHBondContact O-CG 3.46Å; E678-R681 PolarHBondContact O-N 2.99Å; E678-R681 PolarHBondContact O-NE 3.05Å; E678-R681 IonicContact OE1-NH1 3.58Å; E678-R681 IonicContact OE2-CZ 3.9Å; E678-R681 IonicContact OE2-NH1 3.4Å; E678-R681 IonicContact OE2-NH2 3.02Å; E678-R681 PolarHBondContact OE2-NH2 3.34Å
679	V	90.1	Very high	89.5	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-72.5	-30.9	-178.6	-176.9	0	0	0	0	111.3	Y610 E612 L636 F671 A673 S675 A676 D677 R681 A682	Y610-V679 HydrophobicContact CD2-CG2 3.82Å; Y610-V679 HydrophobicContact CG-CG2 3.93Å; E612-V679 HydrophobicContact CB-CG1 3.5Å; E612-V679 VanDerWaalsContact CB-CG1 3.5Å; E612-V679 HydrophobicContact CG-CG1 4.21Å; L636-V679 HydrophobicContact CD2-CG2 4.26Å; F671-V679 HydrophobicContact CB-CG1 4.1Å; F671-V679 HydrophobicContact CB-CG2 4.25Å; F671-V679 HydrophobicContact CD2-CG1 3.49Å; F671-V679 VanDerWaalsContact CD2-CG1 3.49Å; F671-V679 HydrophobicContact CE2-CG1 4.07Å; F671-V679 HydrophobicContact CG-CG1 3.89Å; A673-V679 HydrophobicContact CB-CG2 3.41Å; A673-V679 VanDerWaalsContact CB-CG2 3.41Å; S675-V679 WeakPolarHBondContact O-CG2 3.41Å; S675-V679 PolarHBondContact O-N 2.69Å; A676-V679 PolarHBondContact O-N 2.88Å; A676-V679 VanDerWaalsContact O-N 3.12Å; D677-V679 VanDerWaalsContact C-N 3.3Å; D677-V679 PolarHBondContact O-N 2.78Å; V679-R681 PolarHBondContact O-N 3.28Å; V679-A682 VanDerWaalsContact O-CB 3.32Å; V679-A682 WeakPolarHBondContact O-CB 3.46Å; V679-A682 PolarHBondContact O-N 3.39Å
680	K	90.7	Very high	89.3	Confident	52 Å²	52	41 Å²	41	23%	0.226	20%	0.204	C	C	.	.	H	α-helix	trans	-55.5	-21.7	173.7	-70.3	174.1	-169.7	151.6	0	113	D421 A676 D677 A682 F683 Y684	D421-K680 IonicContact OD2-NZ 3.37Å; D421-K680 PolarHBondContact OD2-NZ 3.11Å; A676-K680 PolarHBondContact O-N 2.82Å; A676-K680 VanDerWaalsContact O-N 3.12Å; D677-K680 PolarHBondContact O-N 2.8Å; D677-K680 IonicContact OD1-NZ 3.81Å; D677-K680 PolarHBondContact OD1-NZ 2.93Å; K680-A682 PolarHBondContact O-N 2.66Å; K680-F683 PolarHBondContact O-N 2.96Å; K680-F683 VanDerWaalsContact O-N 3.14Å; K680-Y684 HydrophobicContact CB-CD2 4.35Å; K680-Y684 HydrophobicContact CB-CE2 3.75Å; K680-Y684 VanDerWaalsContact O-CD2 3.27Å; K680-Y684 WeakPolarHBondContact O-CD2 3.43Å; K680-Y684 PolarHBondContact O-N 3.19Å; K680-Y684 VanDerWaalsContact O-N 3.1Å
681	R	91.8	Very high	89	Confident	19 Å²	19	45.6 Å²	45.6	7%	0.072	23%	0.225	C	C	.	.	H	α-helix	trans	-58.1	-35.1	172.6	-60.7	-178.2	-66.5	-151.6	4.2	112.2	L634 E678 V679 F683 Y684 Y685 V696 I699	L634-R681 HydrophobicContact CD2-CB 4.38Å; L634-R681 VanDerWaalsContact O-CZ 3.28Å; L634-R681 PolarHBondContact O-NH2 3.39Å; E678-R681 VanDerWaalsContact O-CB 3.25Å; E678-R681 WeakPolarHBondContact O-CB 3.34Å; E678-R681 WeakPolarHBondContact O-CG 3.46Å; E678-R681 PolarHBondContact O-N 2.99Å; E678-R681 PolarHBondContact O-NE 3.05Å; E678-R681 IonicContact OE1-NH1 3.58Å; E678-R681 IonicContact OE2-CZ 3.9Å; E678-R681 IonicContact OE2-NH1 3.4Å; E678-R681 IonicContact OE2-NH2 3.02Å; E678-R681 PolarHBondContact OE2-NH2 3.34Å; V679-R681 PolarHBondContact O-N 3.28Å; R681-F683 VanDerWaalsContact C-N 3.29Å; R681-F683 PolarHBondContact O-N 3.37Å; R681-Y684 PolarHBondContact O-N 3Å; R681-Y685 PolarHBondContact O-N 3.45Å; R681-V696 VanDerWaalsContact CD-CG1 3.48Å; R681-V696 VanDerWaalsContact CZ-CG1 3.45Å; R681-I699 HydrophobicContact CB-CG2 4.24Å
682	A	92.2	Very high	88.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-32.2	177.1	0	0	0	0	0	112.6	S615 F618 L634 L636 F671 V679 K680	S615-A682 WeakPolarHBondContact CB-O 3.09Å; S615-A682 PolarHBondContact N-O 3.44Å; S615-A682 VanDerWaalsContact N-O 3.15Å; F618-A682 WeakPolarHBondContact CE2-O 2.98Å; L634-A682 HydrophobicContact CD1-CB 4.17Å; L636-A682 HydrophobicContact CD1-CB 4.19Å; F671-A682 HydrophobicContact CE1-CB 4.17Å; F671-A682 HydrophobicContact CE2-CB 4.4Å; F671-A682 HydrophobicContact CZ-CB 3.79Å; V679-A682 VanDerWaalsContact O-CB 3.32Å; V679-A682 WeakPolarHBondContact O-CB 3.46Å; V679-A682 PolarHBondContact O-N 3.39Å; K680-A682 PolarHBondContact O-N 2.66Å
683	F	91.4	Very high	88.3	Confident	60 Å²	60	55.1 Å²	55.1	26%	0.263	28%	0.276	S	S	.	.	H	α-helix	trans	-78.7	-37.1	174.8	-179.4	-110.9	0	0	0	112.7	E612 T613 S615 K680 R681	E612-F683 HydrophobicContact CG-CB 4.1Å; T613-F683 WeakPolarHBondContact O-CD2 3.43Å; S615-F683 WeakPolarHBondContact CB-O 3.32Å; K680-F683 PolarHBondContact O-N 2.96Å; K680-F683 VanDerWaalsContact O-N 3.14Å; R681-F683 VanDerWaalsContact C-N 3.29Å; R681-F683 PolarHBondContact O-N 3.37Å
684	Y	90.8	Very high	87.9	Confident	50 Å²	50	64 Å²	64	20%	0.196	32%	0.317	C	S	.	.	H	α-helix	trans	-81	-13.3	-179.2	-58.5	-34.9	0	0	0	114.6	K680 R681 C686 H690 K701	K680-Y684 HydrophobicContact CB-CD2 4.35Å; K680-Y684 HydrophobicContact CB-CE2 3.75Å; K680-Y684 VanDerWaalsContact O-CD2 3.27Å; K680-Y684 WeakPolarHBondContact O-CD2 3.43Å; K680-Y684 PolarHBondContact O-N 3.19Å; K680-Y684 VanDerWaalsContact O-N 3.1Å; R681-Y684 PolarHBondContact O-N 3Å; Y684-C686 PolarHBondContact O-N 3.28Å; Y684-H690 PolarHBondContact O-CE1 3.17Å; Y684-H690 VanDerWaalsContact O-CE1 3.25Å; Y684-K701 HydrophobicContact CD1-CB 4.39Å; Y684-K701 HydrophobicContact CD1-CG 3.44Å; Y684-K701 VanDerWaalsContact CD1-CG 3.44Å; Y684-K701 HydrophobicContact CD2-CG 4.26Å; Y684-K701 HydrophobicContact CE1-CD 3.85Å; Y684-K701 HydrophobicContact CE1-CG 3.22Å; Y684-K701 HydrophobicContact CE2-CG 4.09Å; Y684-K701 HydrophobicContact CG-CG 3.99Å; Y684-K701 WeakPolarHBondContact OH-CE 3.33Å
685	Y	91.4	Very high	87.8	Confident	12 Å²	12	64.1 Å²	64.1	5%	0.047	32%	0.32	C	S	.	.			trans	-57.7	126.7	-177.8	-172	-105.9	0	0	0	111.9	S615 S617 F618 L629 L634 R681 H690	S615-Y685 WeakPolarHBondContact CB-O 3.4Å; S615-Y685 PolarHBondContact OG-O 3Å; S617-Y685 PolarHBondContact OG-O 2.74Å; S617-Y685 VanDerWaalsContact OG-O 3.05Å; F618-Y685 HydrophobicContact CE1-CD1 4.16Å; F618-Y685 HydrophobicContact CE1-CE1 4.47Å; F618-Y685 HydrophobicContact CE2-CD1 4.1Å; F618-Y685 AromaticContact CZ-CD1 3.62Å; F618-Y685 HydrophobicContact CZ-CD1 3.62Å; F618-Y685 HydrophobicContact CZ-CE1 4.34Å; F618-Y685 HydrophobicContact CZ-CG 4.14Å; L629-Y685 HydrophobicContact CD1-CE1 4.36Å; L629-Y685 HydrophobicContact CD2-CD1 4.18Å; L629-Y685 HydrophobicContact CD2-CE1 3.56Å; L629-Y685 HydrophobicContact CD2-CE2 4.34Å; L634-Y685 HydrophobicContact CD2-CD2 3.83Å; L634-Y685 HydrophobicContact CD2-CE2 4.45Å; L634-Y685 HydrophobicContact CD2-CG 4.45Å; R681-Y685 PolarHBondContact O-N 3.45Å; Y685-H690 HydrophobicContact CD2-CB 4.23Å; Y685-H690 HydrophobicContact CE2-CB 4.15Å
686	C	90.3	Very high	87.9	Confident	19 Å²	19	62.8 Å²	62.8	13%	0.128	31%	0.31	C	S	.	.			trans	-136.8	114.9	176.9	177.8	0	0	0	0	107.7	S617 Y684 K688 C689 H690 C702 C704	S617-C686 WeakPolarHBondContact OG-CA 3.36Å; Y684-C686 PolarHBondContact O-N 3.28Å; C686-K688 VanDerWaalsContact C-N 3.29Å; C686-K688 PolarHBondContact O-N 2.93Å; C686-C689 HydrophobicContact CB-CB 3.9Å; C686-C689 CarbonylContact O-C 3.57Å; C686-C689 PolarHBondContact O-N 3.08Å; C686-H690 PolarHBondContact O-N 3.32Å; C686-C702 WeakPolarHBondContact CB-SG 3.45Å; C686-C704 VanDerWaalsContact SG-SG 3.62Å
687	Q	86.4	Confident	88	Confident	83 Å²	83	66.5 Å²	66.5	39%	0.388	33%	0.326	S	S	.	.	H	α-helix	trans	-51	-50.5	-176.9	-170.1	175.7	9.2	0	0	111.1	S617 C689 H690 E691	S617-Q687 PolarHBondContact OG-N 3.21Å; Q687-C689 PolarHBondContact O-N 2.93Å; Q687-C689 VanDerWaalsContact O-N 3.12Å; Q687-H690 PolarHBondContact O-N 2.92Å; Q687-E691 WeakPolarHBondContact O-CB 3.13Å; Q687-E691 PolarHBondContact O-N 3.13Å; Q687-E691 VanDerWaalsContact O-N 3.08Å
688	K	86.4	Confident	88	Confident	196 Å²	196	67.5 Å²	67.5	85%	0.852	33%	0.329	S	S	*	.	H	α-helix	trans	-59.6	-29.9	179.1	-60.7	-175.4	179.9	-176.1	0	115.2	C686	C686-K688 VanDerWaalsContact C-N 3.29Å; C686-K688 PolarHBondContact O-N 2.93Å
689	C	87.1	Confident	87.9	Confident	52 Å²	52	65.4 Å²	65.4	35%	0.351	32%	0.319	S	S	.	.	H	α-helix	trans	-100.5	-28.6	-170.5	-90.3	0	0	0	0	110.7	C686 Q687 C702 C704	C686-C689 HydrophobicContact CB-CB 3.9Å; C686-C689 CarbonylContact O-C 3.57Å; C686-C689 PolarHBondContact O-N 3.08Å; Q687-C689 PolarHBondContact O-N 2.93Å; Q687-C689 VanDerWaalsContact O-N 3.12Å; C689-C702 HydrophobicContact CB-CB 3.79Å; C689-C702 VanDerWaalsContact SG-CB 3.56Å; C689-C704 WeakPolarHBondContact CB-SG 3.47Å; C689-C704 WeakPolarHBondContact SG-CB 3.4Å; C689-C704 CovalentContact SG-SG 2.12Å; C689-C704 PolarHBondContact SG-SG 3.39Å
690	H	88.9	Confident	87.6	Confident	13 Å²	13	73.6 Å²	73.6	6%	0.06	35%	0.35	C	S	.	.	H	α-helix	trans	-127.8	4.4	-168.9	-53.5	153.5	0	0	0	115.6	Y684 Y685 C686 Q687 D692 I693 R700	Y684-H690 PolarHBondContact O-CE1 3.17Å; Y684-H690 VanDerWaalsContact O-CE1 3.25Å; Y685-H690 HydrophobicContact CD2-CB 4.23Å; Y685-H690 HydrophobicContact CE2-CB 4.15Å; C686-H690 PolarHBondContact O-N 3.32Å; Q687-H690 PolarHBondContact O-N 2.92Å; H690-D692 VanDerWaalsContact C-N 3.33Å; H690-D692 PolarHBondContact O-N 2.95Å; H690-I693 HydrophobicContact CB-CD1 4.1Å; H690-I693 PolarHBondContact O-N 2.85Å; H690-R700 PolarHBondContact CE1-O 3.25Å; H690-R700 PolarHBondContact NE2-O 3.24Å
691	E	84.8	Confident	87.3	Confident	96 Å²	96	78.6 Å²	78.6	45%	0.449	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-41.7	-177.7	176.9	164.7	-154.5	0	0	113.4	K633 Q687	K633-E691 PolarHBondContact NZ-O 3.36Å; Q687-E691 WeakPolarHBondContact O-CB 3.13Å; Q687-E691 PolarHBondContact O-N 3.13Å; Q687-E691 VanDerWaalsContact O-N 3.08Å
692	D	87.1	Confident	86.9	Confident	152 Å²	152	79.3 Å²	79.3	81%	0.813	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.6	-177.4	-60.8	-37.7	0	0	0	114.4	H690 Q694	H690-D692 VanDerWaalsContact C-N 3.33Å; H690-D692 PolarHBondContact O-N 2.95Å; D692-Q694 PolarHBondContact O-N 2.93Å
693	I	85.6	Confident	86.2	Confident	50 Å²	50	88.3 Å²	88.3	26%	0.256	42%	0.419	S	S	.	.			trans	-79.4	123.9	-177.3	-61.3	-178.8	0	0	0	109.6	H690 D695 M698 I699	H690-I693 HydrophobicContact CB-CD1 4.1Å; H690-I693 PolarHBondContact O-N 2.85Å; I693-D695 WeakPolarHBondContact CG2-O 3.44Å; I693-M698 HydrophobicContact CG2-CB 3.77Å; I693-I699 HydrophobicContact CG2-CG1 4.44Å
694	Q	80.8	Confident	85.2	Confident	188 Å²	188	87.6 Å²	87.6	88%	0.879	42%	0.421	S	S	*	.			trans	-91.8	-37	175.2	-65.4	-174.9	-0.2	0	0	113	D692 V696	D692-Q694 PolarHBondContact O-N 2.93Å; Q694-V696 PolarHBondContact O-N 3Å
695	D	85.6	Confident	83.6	Confident	87 Å²	87	91.8 Å²	91.8	47%	0.465	44%	0.436	S	S	.	.			trans	-80.1	114	177.9	-174.7	6.9	0	0	0	110.5	I693 N697 M698	I693-D695 WeakPolarHBondContact CG2-O 3.44Å; D695-N697 PolarHBondContact O-N 3.45Å; D695-N697 VanDerWaalsContact O-N 3.16Å; D695-N697 PolarHBondContact OD1-N 2.87Å; D695-M698 HydrophobicContact CB-CG 4.19Å; D695-M698 WeakPolarHBondContact O-CB 3.32Å; D695-M698 PolarHBondContact O-N 3.37Å; D695-M698 VanDerWaalsContact O-N 3.1Å
696	V	87	Confident	81.7	Confident	9 Å²	9	96.8 Å²	96.8	6%	0.055	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-61.6	-26.8	-175.5	-168.9	0	0	0	0	111.6	K635 R681 Q694 M698 I699	K635-V696 HydrophobicContact CD-CG2 3.92Å; K635-V696 HydrophobicContact CG-CG2 4.13Å; R681-V696 VanDerWaalsContact CD-CG1 3.48Å; R681-V696 VanDerWaalsContact CZ-CG1 3.45Å; Q694-V696 PolarHBondContact O-N 3Å; V696-M698 PolarHBondContact O-N 3.2Å; V696-I699 HydrophobicContact CG1-CD1 4.35Å; V696-I699 WeakPolarHBondContact O-CB 3.37Å; V696-I699 PolarHBondContact O-N 2.93Å
697	N	85.3	Confident	79.4	Confident	108 Å²	108	102.6 Å²	102.6	58%	0.578	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-70.9	-15.3	179.8	-66.6	-25	0	0	0	113.9	D695 R700	D695-N697 PolarHBondContact O-N 3.45Å; D695-N697 VanDerWaalsContact O-N 3.16Å; D695-N697 PolarHBondContact OD1-N 2.87Å; N697-R700 PolarHBondContact O-NE 3.4Å
698	M	85.9	Confident	77.3	Confident	117 Å²	117	103.8 Å²	103.8	58%	0.576	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-86.2	-8.9	177.6	-65	-68	-77.8	0	0	112.7	I693 D695 V696 R700	I693-M698 HydrophobicContact CG2-CB 3.77Å; D695-M698 HydrophobicContact CB-CG 4.19Å; D695-M698 WeakPolarHBondContact O-CB 3.32Å; D695-M698 PolarHBondContact O-N 3.37Å; D695-M698 VanDerWaalsContact O-N 3.1Å; V696-M698 PolarHBondContact O-N 3.2Å; M698-R700 PolarHBondContact O-N 2.93Å
699	I	87	Confident	75.5	Confident	9 Å²	9	98.3 Å²	98.3	5%	0.046	49%	0.486	C	S	.	.			trans	-75.2	90.7	177.3	-57.8	-179.2	0	0	0	109.1	L634 R681 I693 V696	L634-I699 HydrophobicContact CD2-CD1 3.43Å; L634-I699 VanDerWaalsContact CD2-CD1 3.43Å; L634-I699 HydrophobicContact CD2-CG2 4.4Å; R681-I699 HydrophobicContact CB-CG2 4.24Å; I693-I699 HydrophobicContact CG2-CG1 4.44Å; V696-I699 HydrophobicContact CG1-CD1 4.35Å; V696-I699 WeakPolarHBondContact O-CB 3.37Å; V696-I699 PolarHBondContact O-N 2.93Å
700	R	84.3	Confident	73.1	Confident	174 Å²	174	103.4 Å²	103.4	66%	0.657	50%	0.502	S	S	*	.			trans	-121.8	175.9	-178	-62.2	-175	-177.6	-161	-0.9	111.3	H690 N697 M698 C702	H690-R700 PolarHBondContact CE1-O 3.25Å; H690-R700 PolarHBondContact NE2-O 3.24Å; N697-R700 PolarHBondContact O-NE 3.4Å; M698-R700 PolarHBondContact O-N 2.93Å; R700-C702 PolarHBondContact O-N 3.43Å
701	K	84.6	Confident	70.9	Confident	156 Å²	156	113.9 Å²	113.9	68%	0.678	54%	0.541	S	S	*	.			trans	-52	111.4	175.5	-72.7	177.5	-173.7	176.7	0	111.2	Y684	Y684-K701 HydrophobicContact CD1-CB 4.39Å; Y684-K701 HydrophobicContact CD1-CG 3.44Å; Y684-K701 VanDerWaalsContact CD1-CG 3.44Å; Y684-K701 HydrophobicContact CD2-CG 4.26Å; Y684-K701 HydrophobicContact CE1-CD 3.85Å; Y684-K701 HydrophobicContact CE1-CG 3.22Å; Y684-K701 HydrophobicContact CE2-CG 4.09Å; Y684-K701 HydrophobicContact CG-CG 3.99Å; Y684-K701 WeakPolarHBondContact OH-CE 3.33Å
702	C	82.2	Confident	68.8	Low	35 Å²	35	118.9 Å²	118.9	24%	0.236	56%	0.561	C	S	.	*			trans	-85.2	149.6	177.4	64.4	0	0	0	0	112.1	C686 C689 R700 C704	C686-C702 WeakPolarHBondContact CB-SG 3.45Å; C689-C702 HydrophobicContact CB-CB 3.79Å; C689-C702 VanDerWaalsContact SG-CB 3.56Å; R700-C702 PolarHBondContact O-N 3.43Å; C702-C704 HydrophobicContact CB-CB 4.34Å; C702-C704 PolarHBondContact O-N 3.36Å
703	K	77.3	Confident	66.5	Low	188 Å²	188	112.2 Å²	112.2	82%	0.817	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-8.2	175	-66.4	-177.7	-178.7	176.8	0	113.3	R705 N706	K703-R705 PolarHBondContact O-N 2.97Å; K703-N706 PolarHBondContact O-N 2.92Å; K703-N706 VanDerWaalsContact O-N 3.16Å
704	C	70.7	Confident	64.4	Low	45 Å²	45	113.8 Å²	113.8	30%	0.304	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-27.7	178.2	-80.5	0	0	0	0	111.8	C686 C689 C702	C686-C704 VanDerWaalsContact SG-SG 3.62Å; C689-C704 WeakPolarHBondContact CB-SG 3.47Å; C689-C704 WeakPolarHBondContact SG-CB 3.4Å; C689-C704 CovalentContact SG-SG 2.12Å; C689-C704 PolarHBondContact SG-SG 3.39Å; C702-C704 HydrophobicContact CB-CB 4.34Å; C702-C704 PolarHBondContact O-N 3.36Å
705	R	58.2	Low	62.3	Low	138 Å²	138	115.4 Å²	115.4	52%	0.521	54%	0.538	S	S	.	.	H	α-helix	trans	-74.2	-22.7	-176.8	-157.4	172.9	178.2	172	1.2	115.8	K703 L707 L709	K703-R705 PolarHBondContact O-N 2.97Å; R705-L707 VanDerWaalsContact C-N 3.3Å; R705-L707 PolarHBondContact O-N 3.5Å; R705-L709 HydrophobicContact CG-CD1 4.06Å
706	N	49.6	Very low	60.1	Low	117 Å²	117	118.6 Å²	118.6	63%	0.626	55%	0.55	S	S	*	*	H	α-helix	trans	-71.4	-22.5	-179.4	-89	-7.1	0	0	0	113.3	K703	K703-N706 PolarHBondContact O-N 2.92Å; K703-N706 VanDerWaalsContact O-N 3.16Å
707	L	43.4	Very low	58	Low	142 Å²	142	122.7 Å²	122.7	74%	0.743	57%	0.571	S	S	*	*	H	α-helix	trans	-89	-25	-177.3	-90.1	92.1	0	0	0	114.8	R705	R705-L707 VanDerWaalsContact C-N 3.3Å; R705-L707 PolarHBondContact O-N 3.5Å
708	T	42	Very low	55.8	Low	108 Å²	108	123 Å²	123	66%	0.663	57%	0.571	S	S	*	*	H	α-helix	trans	-90.9	-31.7	-175.8	43.7	0	0	0	0	113.8
709	L	47.9	Very low	53.5	Low	81 Å²	81	122.9 Å²	122.9	42%	0.424	57%	0.572	S	S	.	*	H	α-helix	trans	-80.6	-32	177.6	-93.7	151.5	0	0	0	113.6	R705 R711 G713 I717	R705-L709 HydrophobicContact CG-CD1 4.06Å; L709-R711 VanDerWaalsContact C-N 3.3Å; L709-R711 PolarHBondContact O-N 3.33Å; L709-G713 PolarHBondContact O-N 3.2Å; L709-I717 HydrophobicContact CD2-CD1 4.08Å
710	F	36.6	Very low	51.3	Low	159 Å²	159	125 Å²	125	70%	0.697	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-18.6	-177.6	-109.3	-90.1	0	0	0	114.4	V714	F710-V714 HydrophobicContact CD1-CG2 4.35Å
711	R	43.1	Very low	49	Very low	232 Å²	232	123.1 Å²	123.1	88%	0.875	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-10.6	-176.2	-127.6	174.5	171.4	169	-2.9	114.8	L709	L709-R711 VanDerWaalsContact C-N 3.3Å; L709-R711 PolarHBondContact O-N 3.33Å
712	K	41.1	Very low	46.5	Very low	201 Å²	201	125.3 Å²	125.3	87%	0.874	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.6	-12	179.7	-76.5	-174.1	175.1	180	0	116.4
713	G	38.7	Very low	44.3	Very low	13 Å²	13	126.8 Å²	126.8	13%	0.134	61%	0.606	C	S	.	*	S	Bend	trans	-99.5	-17.1	-171.4	0	0	0	0	0	117.6	L709 R715 H716 I717	L709-G713 PolarHBondContact O-N 3.2Å; G713-R715 PolarHBondContact O-N 3.39Å; G713-R715 VanDerWaalsContact O-N 3.12Å; G713-H716 PolarHBondContact O-N 2.92Å; G713-I717 PolarHBondContact O-N 3.23Å; G713-I717 VanDerWaalsContact O-N 3.17Å
714	V	40.5	Very low	42.3	Very low	82 Å²	82	122.1 Å²	122.1	50%	0.497	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.3	-13.5	-167.6	-176.9	0	0	0	0	113.5	F710 I718	F710-V714 HydrophobicContact CD1-CG2 4.35Å; V714-I718 HydrophobicContact CG1-CD1 4.45Å
715	R	37.2	Very low	40.4	Very low	222 Å²	222	127.1 Å²	127.1	84%	0.838	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-16.9	171	-90.1	-178.8	168.4	163.2	-3.7	115.3	G713 L719	G713-R715 PolarHBondContact O-N 3.39Å; G713-R715 VanDerWaalsContact O-N 3.12Å; R715-L719 WeakPolarHBondContact O-CD1 3.48Å
716	H	40.2	Very low	39	Very low	154 Å²	154	126 Å²	126	71%	0.713	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-25.9	-177.8	-100.3	-89.3	0	0	0	114.4	G713 A720	G713-H716 PolarHBondContact O-N 2.92Å; H716-A720 WeakPolarHBondContact O-CB 3.06Å; H716-A720 PolarHBondContact O-N 3.29Å
717	I	43.1	Very low	38.1	Very low	95 Å²	95	126.7 Å²	126.7	49%	0.487	63%	0.63	S	S	.	*	H	α-helix	trans	-88.8	-23.3	-173.5	-65.4	170.2	0	0	0	113	L709 G713	L709-I717 HydrophobicContact CD2-CD1 4.08Å; G713-I717 PolarHBondContact O-N 3.23Å; G713-I717 VanDerWaalsContact O-N 3.17Å
718	I	38.7	Very low	37.4	Very low	114 Å²	114	125 Å²	125	59%	0.585	63%	0.631	S	S	*	*	H	α-helix	trans	-84.1	-19.8	174.2	-61.3	176	0	0	0	111.8	V714	V714-I718 HydrophobicContact CG1-CD1 4.45Å
719	L	37.3	Very low	36.7	Very low	115 Å²	115	125.2 Å²	125.2	60%	0.602	63%	0.634	S	S	*	*	H	α-helix	trans	-86.9	-38.9	172.9	-89.9	127.4	0	0	0	112.6	R715 N721 R722 T723	R715-L719 WeakPolarHBondContact O-CD1 3.48Å; L719-N721 PolarHBondContact O-N 2.99Å; L719-R722 PolarHBondContact O-N 3.39Å; L719-T723 PolarHBondContact O-N 2.81Å; L719-T723 PolarHBondContact O-OG1 3.09Å
720	A	40.1	Very low	35.7	Very low	53 Å²	53	125.8 Å²	125.8	44%	0.438	65%	0.65	S	S	.	*	H	α-helix	trans	-68.8	-31.5	-179	0	0	0	0	0	114.4	H716 A724	H716-A720 WeakPolarHBondContact O-CB 3.06Å; H716-A720 PolarHBondContact O-N 3.29Å; A720-A724 PolarHBondContact O-N 3.47Å
721	N	35.9	Very low	35.4	Very low	136 Å²	136	126.9 Å²	126.9	73%	0.727	66%	0.655	S	S	*	*	H	α-helix	trans	-84.7	-3.6	177.6	-91	-11.8	0	0	0	114.6	L719	L719-N721 PolarHBondContact O-N 2.99Å
722	R	33.5	Very low	34.4	Very low	202 Å²	202	123.1 Å²	123.1	76%	0.762	65%	0.652	S	S	*	*	H	α-helix	trans	-104.6	-18.1	170.4	-91.6	-177.5	166.8	174.6	-3.2	113.6	L719	L719-R722 PolarHBondContact O-N 3.39Å
723	T	35.3	Very low	33.9	Very low	65 Å²	65	121.3 Å²	121.3	40%	0.399	65%	0.649	S	S	.	*	H	α-helix	trans	-100	-16.2	-179.1	51.2	0	0	0	0	114.8	L719 K725 L727	L719-T723 PolarHBondContact O-N 2.81Å; L719-T723 PolarHBondContact O-OG1 3.09Å; T723-K725 VanDerWaalsContact C-N 3.3Å; T723-K725 PolarHBondContact O-N 2.92Å; T723-L727 HydrophobicContact CG2-CD1 3.82Å
724	A	34.3	Very low	33.5	Very low	90 Å²	90	127 Å²	127	74%	0.744	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-2.8	173.7	0	0	0	0	0	114.6	A720	A720-A724 PolarHBondContact O-N 3.47Å
725	K	31.5	Very low	32.8	Very low	151 Å²	151	127.8 Å²	127.8	66%	0.657	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	3.2	177.1	-114.2	168.7	-175.7	172	0	114.6	T723	T723-K725 VanDerWaalsContact C-N 3.3Å; T723-K725 PolarHBondContact O-N 2.92Å
726	V	29.8	Very low	32.4	Very low	115 Å²	115	125.8 Å²	125.8	70%	0.697	70%	0.696	S	S	*	*	S	Bend	trans	-154	77.3	177.6	-174	0	0	0	0	108.4
727	L	29.5	Very low	31.8	Very low	130 Å²	130	126 Å²	126	68%	0.681	70%	0.698	S	S	*	*			trans	-158.5	65.5	164.2	-101.6	135.2	0	0	0	108.9	T723	T723-L727 HydrophobicContact CG2-CD1 3.82Å
728	S	28.3	Very low	31.1	Very low	107 Å²	107	127.7 Å²	127.7	75%	0.748	71%	0.708	S	S	*	*			trans	-80	115.6	147.8	48.6	0	0	0	0	107	A730	S728-A730 PolarHBondContact O-N 2.89Å
729	P	29.3	Very low	30.7	Very low	113 Å²	113	129.4 Å²	129.4	73%	0.734	72%	0.718	S	S	*	*			trans	-71.9	108.7	162.3	11.9	2.2	0	0	0	106.9	F731	P729-F731 PolarHBondContact O-N 3.16Å
730	A	26.6	Very low	30.2	Very low	93 Å²	93	126.9 Å²	126.9	77%	0.769	72%	0.72	S	S	*	*			trans	-65.1	115.6	158.8	0	0	0	0	0	107.2	S728	S728-A730 PolarHBondContact O-N 2.89Å
731	F	28.7	Very low	29.8	Very low	181 Å²	181	135.6 Å²	135.6	79%	0.794	74%	0.743	S	S	*	*			trans	-107.1	96.3	160	-123	-88.9	0	0	0	106.4	P729	P729-F731 PolarHBondContact O-N 3.16Å
732	D	24	Very low	29.2	Very low	153 Å²	153	137 Å²	137	82%	0.818	75%	0.75	S	S	*	*			trans	-65.6	125.7	155.5	-91.5	-32.5	0	0	0	107.5
733	M	29.8	Very low	28.9	Very low	163 Å²	163	132.7 Å²	132.7	80%	0.803	75%	0.751	S	S	*	*			trans	-147.1	106.9	150.6	-97.6	-169.1	67.9	0	0	109.4
734	T	30.1	Very low	28.4	Very low	134 Å²	134	136 Å²	136	82%	0.822	77%	0.771	S	S	*	*			trans	-51.9	136	165.3	45.7	0	0	0	0	111.6
735	A	25.5	Very low	28.2	Very low	97 Å²	97	136.9 Å²	136.9	80%	0.802	77%	0.772	S	S	*	*			trans	-98.2	120	169.4	0	0	0	0	0	109.6
736	E	29.5	Very low	28	Very low	181 Å²	181	139.7 Å²	139.7	85%	0.846	78%	0.778	S	S	*	*			trans	-142.9	125.5	154.2	-84.9	-169.4	166.6	0	0	110.4
737	E	28.2	Very low	28	Very low	159 Å²	159	142.1 Å²	142.1	74%	0.743	79%	0.787	S	S	*	*			trans	76	108.1	144.6	-66.6	-169.2	165.4	0	0	122.6
738	N	27.8	Very low	27.9	Very low	129 Å²	129	143.5 Å²	143.5	69%	0.69	79%	0.794	S	S	*	*				127.9	124.4	114	-79.6	-15.2	0	0	0	119.2
739	D	30.9	Very low	27.7	Very low	150 Å²	150	142 Å²	142	80%	0.802	78%	0.783	S	S	*	*			trans	76.6	107.8	142.2	-64.6	-20.5	0	0	0	122.9
740	G	26.8	Very low	27.6	Very low	63 Å²	63	144.3 Å²	144.3	65%	0.649	79%	0.788	S	S	*	*				101.2	124.5	114.6	0	0	0	0	0	118.3
741	Y	30.1	Very low	27.8	Very low	235 Å²	235	149.4 Å²	149.4	92%	0.922	79%	0.793	S	S	*	*			trans	91	101.7	157.1	-60	-86.3	0	0	0	119.6
742	L	24.6	Very low	27.7	Very low	167 Å²	167	150.1 Å²	150.1	87%	0.874	79%	0.79	S	S	*	*			trans	30.2	106.6	134.7	-121.7	81.8	0	0	0	118.6
743	S	26.3	Very low	27.7	Very low	110 Å²	110	149.4 Å²	149.4	77%	0.769	79%	0.787	S	S	*	*			trans	148.5	130.3	136.6	60.2	0	0	0	0	113.8
744	T	24.6	Very low	27.8	Very low	136 Å²	136	148.8 Å²	148.8	83%	0.834	79%	0.792	S	S	*	*			trans	-3.7	120.6	158.3	44.8	0	0	0	0	119.3
745	S	29.8	Very low	27.7	Very low	108 Å²	108	152.6 Å²	152.6	76%	0.755	79%	0.791	S	S	*	*			trans	-171.6	117.3	163.5	-85.3	0	0	0	0	112
746	R	27.7	Very low	27.7	Very low	210 Å²	210	154.2 Å²	154.2	79%	0.792	79%	0.791	S	S	*	*				90.7	93	83.4	-83.4	-176.2	177.2	168.2	0.1	114.4
747	N	30.3	Very low	27.7	Very low	166 Å²	166	151.7 Å²	151.7	89%	0.888	79%	0.79	S	S	*	*	S	Bend	trans	-100	123.9	162	-78.4	-29.1	0	0	0	109.5	S749	N747-S749 PolarHBondContact O-N 2.92Å
748	I	26.1	Very low	27.8	Very low	159 Å²	159	148.2 Å²	148.2	82%	0.815	79%	0.789	S	S	*	*			trans	10.5	95.2	170.8	-53.3	175.2	0	0	0	116.7	I750	I748-I750 HydrophobicContact CG2-CG1 4.32Å
749	S	25.1	Very low	27.8	Very low	76 Å²	76	154 Å²	154	53%	0.531	80%	0.801	S	S	.	*			trans	-107	101.8	158.5	59.7	0	0	0	0	108.8	N747 F751	N747-S749 PolarHBondContact O-N 2.92Å; S749-F751 PolarHBondContact O-N 3.08Å
750	I	26.8	Very low	27.7	Very low	161 Å²	161	151.4 Å²	151.4	83%	0.826	80%	0.8	S	S	*	*			trans	-82.4	70.7	158.7	-58.9	177	0	0	0	106.6	I748	I748-I750 HydrophobicContact CG2-CG1 4.32Å
751	F	30.5	Very low	27.8	Very low	199 Å²	199	154.1 Å²	154.1	87%	0.873	81%	0.809	S	S	*	*			trans	-149.2	79.5	158.6	-101.4	-81.1	0	0	0	102.6	S749	S749-F751 PolarHBondContact O-N 3.08Å
752	R	26.5	Very low	27.7	Very low	197 Å²	197	153.2 Å²	153.2	74%	0.743	81%	0.81	S	S	*	*			trans	-117.1	120.4	176.8	-117	178.5	177.6	154.3	-2.3	107.6
753	D	25.5	Very low	27.8	Very low	138 Å²	138	148.6 Å²	148.6	74%	0.738	80%	0.803	S	S	*	*			trans	71	71.5	161	-58.5	-27.8	0	0	0	118.6
754	V	31.3	Very low	27.8	Very low	150 Å²	150	149.4 Å²	149.4	91%	0.909	81%	0.809	S	S	*	*			trans	-111.3	100.2	132.7	-177	0	0	0	0	107.4	T756	V754-T756 PolarHBondContact O-N 3.46Å
755	R	26.9	Very low	27.9	Very low	214 Å²	214	146 Å²	146	81%	0.808	80%	0.8	S	S	*	*			trans	-46.2	123.4	175.7	-69.1	170.4	175.4	176.2	-2.6	110.4	P757	R755-P757 VanDerWaalsContact O-CD 3.3Å; R755-P757 WeakPolarHBondContact O-CD 3.45Å
756	T	25.8	Very low	28	Very low	131 Å²	131	148.8 Å²	148.8	80%	0.804	81%	0.807	S	S	*	*			trans	-49.8	119.5	148.3	9.7	0	0	0	0	108.1	V754 A758	V754-T756 PolarHBondContact O-N 3.46Å; T756-A758 VanDerWaalsContact C-N 3.26Å; T756-A758 PolarHBondContact O-N 3.17Å
757	P	30.1	Very low	28	Very low	128 Å²	128	148.7 Å²	148.7	83%	0.831	81%	0.812	S	S	*	*			trans	-76.4	91.9	158.5	12.1	4.6	0	0	0	106.2	R755 R759	R755-P757 VanDerWaalsContact O-CD 3.3Å; R755-P757 WeakPolarHBondContact O-CD 3.45Å; P757-R759 PolarHBondContact O-N 3.31Å
758	A	31.1	Very low	28.1	Very low	86 Å²	86	145.5 Å²	145.5	71%	0.711	81%	0.809	S	S	*	*			trans	-62.8	115.6	159.3	0	0	0	0	0	108.3	T756	T756-A758 VanDerWaalsContact C-N 3.26Å; T756-A758 PolarHBondContact O-N 3.17Å
759	R	26.3	Very low	28.6	Very low	251 Å²	251	145.6 Å²	145.6	95%	0.947	81%	0.811	S	S	*	*			trans	47.4	80.2	142.7	-155	174.4	-169.2	166.9	2.1	115.6	P757	P757-R759 PolarHBondContact O-N 3.31Å
760	A	29.7	Very low	29.1	Very low	95 Å²	95	145 Å²	145	79%	0.785	82%	0.818	S	S	*	*			trans	-122.5	104.6	159	0	0	0	0	0	109.4
761	S	29.6	Very low	30.3	Very low	119 Å²	119	143.7 Å²	143.7	83%	0.832	81%	0.812	S	S	*	*			trans	47.1	106.7	152.8	-53.7	0	0	0	0	119.5	G763	S761-G763 PolarHBondContact O-N 3.38Å
762	F	26.2	Very low	31.9	Very low	216 Å²	216	139.3 Å²	139.3	95%	0.947	80%	0.798	S	S	*	*			trans	-39.8	106.6	152	-90.3	-104	0	0	0	111.3
763	G	28.6	Very low	34	Very low	70 Å²	70	133.8 Å²	133.8	72%	0.722	78%	0.781	S	S	*	*			trans	-112.1	108.7	157.1	0	0	0	0	0	107.1	S761 G765	S761-G763 PolarHBondContact O-N 3.38Å; G763-G765 PolarHBondContact O-N 3.29Å
764	S	25.4	Very low	36.7	Very low	127 Å²	127	131.7 Å²	131.7	89%	0.888	77%	0.766	S	S	*	*			trans	-56	124.1	179.8	-51.1	0	0	0	0	111.7
765	G	27	Very low	39.5	Very low	64 Å²	64	125.8 Å²	125.8	66%	0.66	73%	0.727	S	S	*	*			trans	162.6	114.8	169.2	0	0	0	0	0	113.3	G763	G763-G765 PolarHBondContact O-N 3.29Å
766	D	30.4	Very low	42.4	Very low	167 Å²	167	115.7 Å²	115.7	89%	0.893	69%	0.689	S	S	*	*			trans	81.5	105.3	159	-58.4	-18.7	0	0	0	120.1	A768	D766-A768 PolarHBondContact O-N 3.4Å
767	K	27.8	Very low	45.3	Very low	209 Å²	209	111.2 Å²	111.2	91%	0.909	66%	0.663	S	S	*	*			trans	-58.2	106.6	163.2	-64.6	172.7	176.1	176.6	0	109.3	D769	K767-D769 PolarHBondContact O-N 3.46Å
768	A	32.8	Very low	47.9	Very low	99 Å²	99	105.1 Å²	105.1	82%	0.818	62%	0.624	S	S	*	*			trans	-82.3	109.4	163.9	0	0	0	0	0	108.8	D766	D766-A768 PolarHBondContact O-N 3.4Å
769	D	36.8	Very low	50.5	Low	160 Å²	160	101.1 Å²	101.1	86%	0.856	59%	0.591	S	S	*	*			trans	-53.8	148.9	169.6	-87.5	-36.3	0	0	0	111.7	K767 N771	K767-D769 PolarHBondContact O-N 3.46Å; D769-N771 PolarHBondContact O-N 2.8Å
770	G	37.1	Very low	53.5	Low	65 Å²	65	89.9 Å²	89.9	67%	0.67	55%	0.549	S	S	*	.			trans	-43.5	118.7	-166.5	0	0	0	0	0	115.4	D772	G770-D772 VanDerWaalsContact C-N 3.27Å; G770-D772 PolarHBondContact O-N 3.01Å
771	N	50.8	Low	56.4	Low	132 Å²	132	85.6 Å²	85.6	71%	0.706	51%	0.513	S	S	*	.			trans	-63.4	85.9	169.5	-143.3	8.8	0	0	0	108.7	D769 M773	D769-N771 PolarHBondContact O-N 2.8Å; N771-M773 PolarHBondContact O-N 3.44Å
772	D	63.6	Low	59.4	Low	107 Å²	107	80.2 Å²	80.2	57%	0.572	48%	0.475	S	S	*	.			trans	-64.8	100.8	-178	-97.9	-12.6	0	0	0	110.1	G770 K774	G770-D772 VanDerWaalsContact C-N 3.27Å; G770-D772 PolarHBondContact O-N 3.01Å; D772-K774 PolarHBondContact O-N 3.02Å; D772-K774 VanDerWaalsContact O-N 3.13Å
773	M	70.8	Confident	62.5	Low	82 Å²	82	71.9 Å²	71.9	40%	0.404	44%	0.437	S	S	.	.			trans	-66.7	107	172.9	-56.9	167.8	100.7	0	0	108.2	N771 W783 G1041	N771-M773 PolarHBondContact O-N 3.44Å; M773-W783 HydrophobicContact CB-CE3 4.04Å; M773-W783 HydrophobicContact CB-CZ3 3.76Å; M773-W783 VanDerWaalsContact O-CE3 3.29Å; M773-G1041 WeakPolarHBondContact CE-O 3.33Å
774	K	83.3	Confident	65.5	Low	93 Å²	93	69.7 Å²	69.7	40%	0.404	41%	0.411	S	S	.	.			trans	-104	-20.9	-177	-68.7	-179.9	-176.8	-178	0	113.9	D772 W783	D772-K774 PolarHBondContact O-N 3.02Å; D772-K774 VanDerWaalsContact O-N 3.13Å; K774-W783 PolarHBondContact O-N 3.43Å
775	Y	88.5	Confident	68.6	Low	27 Å²	27	72.6 Å²	72.6	11%	0.106	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	157.9	-176.3	-59.9	-71.8	0	0	0	110	F781 H782 G1041 A1042 S1044 L1049 R1052	Y775-F781 WeakPolarHBondContact CA-O 3.32Å; Y775-H782 AromaticContact CE1-CE1 3.75Å; Y775-H782 AromaticContact CE1-ND1 3.73Å; Y775-G1041 WeakPolarHBondContact O-CA 3.23Å; Y775-A1042 PolarHBondContact O-N 3.27Å; Y775-S1044 WeakPolarHBondContact CD2-OG 3.35Å; Y775-L1049 HydrophobicContact CD2-CD2 4.37Å; Y775-L1049 HydrophobicContact CE2-CD2 4.03Å; Y775-R1052 VanDerWaalsContact OH-CZ 3.24Å; Y775-R1052 PolarHBondContact OH-NH1 3.31Å; Y775-R1052 PolarHBondContact OH-NH2 2.92Å
776	D	88.7	Confident	71.6	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	172.8	173.6	81.5	-62.9	0	0	0	111.6	T778 G779 M780 F781 W783 L1039 K1040	D776-T778 PolarHBondContact O-N 2.86Å; D776-T778 PolarHBondContact OD1-OG1 2.95Å; D776-T778 VanDerWaalsContact OD2-CB 3.32Å; D776-T778 WeakPolarHBondContact OD2-CB 3.22Å; D776-T778 PolarHBondContact OD2-N 3.45Å; D776-T778 PolarHBondContact OD2-OG1 3.43Å; D776-G779 PolarHBondContact O-N 3.39Å; D776-G779 PolarHBondContact OD1-N 3.12Å; D776-G779 VanDerWaalsContact OD1-N 3.1Å; D776-M780 PolarHBondContact OD1-N 2.93Å; D776-F781 PolarHBondContact N-O 2.89Å; D776-F781 VanDerWaalsContact N-O 3.13Å; D776-F781 PolarHBondContact OD1-N 3.38Å; D776-W783 HydrophobicContact CB-CB 4.47Å; D776-L1039 HydrophobicContact CB-CD2 3.81Å; D776-K1040 CarbonylContact C-O 3.54Å; D776-K1040 VanDerWaalsContact CA-O 3.23Å; D776-K1040 WeakPolarHBondContact CA-O 3.21Å
777	S	86.2	Confident	74.4	Confident	38 Å²	38	67.7 Å²	67.7	27%	0.266	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-26.3	-178.8	54.2	0	0	0	0	113.9	K1040 L1048	S777-K1040 PolarHBondContact N-O 3.16Å; S777-L1048 WeakPolarHBondContact O-CD2 3.29Å
778	T	85.2	Confident	77.6	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-17.4	176.9	73.1	0	0	0	0	112.8	D776 M780 E1028 L1029 I1032 K1051	D776-T778 PolarHBondContact O-N 2.86Å; D776-T778 PolarHBondContact OD1-OG1 2.95Å; D776-T778 VanDerWaalsContact OD2-CB 3.32Å; D776-T778 WeakPolarHBondContact OD2-CB 3.22Å; D776-T778 PolarHBondContact OD2-N 3.45Å; D776-T778 PolarHBondContact OD2-OG1 3.43Å; T778-M780 VanDerWaalsContact C-N 3.27Å; T778-M780 WeakPolarHBondContact OG1-CB 3.33Å; T778-M780 WeakPolarHBondContact OG1-CG 3.43Å; T778-M780 PolarHBondContact OG1-N 3.32Å; T778-E1028 HydrophobicContact CG2-CG 4.47Å; T778-L1029 HydrophobicContact CG2-CB 4.17Å; T778-L1029 HydrophobicContact CG2-CD1 4.16Å; T778-I1032 HydrophobicContact CG2-CD1 3.96Å; T778-K1051 WeakPolarHBondContact O-CD 3.47Å
779	G	86.4	Confident	80.4	Confident	2 Å²	2	56.4 Å²	56.4	2%	0.021	30%	0.3	C	S	.	.	S	Bend	trans	77.9	7	-175.7	0	0	0	0	0	114.2	D776 S833	D776-G779 PolarHBondContact O-N 3.39Å; D776-G779 PolarHBondContact OD1-N 3.12Å; D776-G779 VanDerWaalsContact OD1-N 3.1Å; G779-S833 WeakPolarHBondContact O-CB 3.45Å; G779-S833 PolarHBondContact O-OG 3.24Å
780	M	88	Confident	83.1	Confident	15 Å²	15	54 Å²	54	7%	0.074	28%	0.284	C	S	.	.	S	Bend	trans	-88.4	-20.2	-174.9	-61.2	-50.5	-154.9	0	0	113.6	D776 T778 S833 T1026 K1051 R1054	D776-M780 PolarHBondContact OD1-N 2.93Å; T778-M780 VanDerWaalsContact C-N 3.27Å; T778-M780 WeakPolarHBondContact OG1-CB 3.33Å; T778-M780 WeakPolarHBondContact OG1-CG 3.43Å; T778-M780 PolarHBondContact OG1-N 3.32Å; M780-S833 VanDerWaalsContact C-OG 3.26Å; M780-S833 WeakPolarHBondContact CA-OG 3.28Å; M780-S833 WeakPolarHBondContact O-CB 3.48Å; M780-S833 PolarHBondContact O-N 3.46Å; M780-S833 PolarHBondContact O-OG 3.3Å; M780-S833 VanDerWaalsContact O-OG 3.06Å; M780-T1026 HydrophobicContact CE-CG2 3.42Å; M780-T1026 VanDerWaalsContact CE-CG2 3.42Å; M780-K1051 HydrophobicContact CE-CB 4.24Å; M780-K1051 HydrophobicContact CE-CD 4.23Å; M780-K1051 HydrophobicContact CE-CG 4.49Å; M780-K1051 HydrophobicContact SD-CB 3.88Å; M780-K1051 HydrophobicContact SD-CD 4.45Å; M780-R1054 PolarHBondContact O-NH2 2.96Å; M780-R1054 PolarHBondContact SD-NH1 2.95Å
781	F	91.6	Very high	85.7	Confident	5 Å²	5	57.3 Å²	57.3	2%	0.022	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-135.6	150.7	-174.9	-59.6	-74.7	0	0	0	112.6	Y775 D776 M828 R831 A832 L1029	Y775-F781 WeakPolarHBondContact CA-O 3.32Å; D776-F781 PolarHBondContact N-O 2.89Å; D776-F781 VanDerWaalsContact N-O 3.13Å; D776-F781 PolarHBondContact OD1-N 3.38Å; F781-M828 HydrophobicContact CD1-CG 3.59Å; F781-M828 VanDerWaalsContact CD1-O 3.24Å; F781-M828 WeakPolarHBondContact CD1-O 3.27Å; F781-M828 HydrophobicContact CD2-CG 4.25Å; F781-M828 HydrophobicContact CD2-SD 4.5Å; F781-M828 HydrophobicContact CE1-CB 4.4Å; F781-M828 HydrophobicContact CE1-CG 3.2Å; F781-M828 VanDerWaalsContact CE1-O 3.29Å; F781-M828 WeakPolarHBondContact CE1-O 3.45Å; F781-M828 HydrophobicContact CE1-SD 4.16Å; F781-M828 HydrophobicContact CE2-CG 3.91Å; F781-M828 HydrophobicContact CE2-SD 3.87Å; F781-M828 HydrophobicContact CG-CG 4.11Å; F781-M828 HydrophobicContact CZ-CG 3.37Å; F781-M828 HydrophobicContact CZ-SD 3.68Å; F781-R831 WeakPolarHBondContact CA-O 3.37Å; F781-A832 HydrophobicContact CD1-CB 4.39Å; F781-A832 HydrophobicContact CE1-CB 4.28Å; F781-L1029 HydrophobicContact CD2-CD2 4.02Å; F781-L1029 HydrophobicContact CE2-CD2 3.5Å
782	H	92	Very high	87.7	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.028	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-71	135.3	169.4	-72.7	-101.9	0	0	0	110.1	Y775 R831 A832 Y835 Y837 L840 P863	Y775-H782 AromaticContact CE1-CE1 3.75Å; Y775-H782 AromaticContact CE1-ND1 3.73Å; H782-R831 PolarHBondContact CD2-O 2.88Å; H782-R831 PolarHBondContact N-O 2.9Å; H782-A832 PolarHBondContact CD2-O 3.44Å; H782-Y835 PolarHBondContact CE1-O 2.95Å; H782-Y835 PolarHBondContact NE2-O 3.5Å; H782-Y837 AromaticContact ND1-CD2 3.77Å; H782-L840 HydrophobicContact CB-CD1 4.23Å; H782-P863 HydrophobicContact CB-CG 4.06Å
783	W	92	Very high	89.1	Confident	40 Å²	40	47.9 Å²	47.9	15%	0.152	23%	0.231	C	C	.	.			trans	-125.1	145.2	-174.6	-178.4	90.6	0	0	0	111.3	M773 K774 D776 R785 L1039	M773-W783 HydrophobicContact CB-CE3 4.04Å; M773-W783 HydrophobicContact CB-CZ3 3.76Å; M773-W783 VanDerWaalsContact O-CE3 3.29Å; K774-W783 PolarHBondContact O-N 3.43Å; D776-W783 HydrophobicContact CB-CB 4.47Å; W783-R785 HydrophobicContact CH2-CG 4.03Å; W783-R785 HydrophobicContact CZ3-CG 4.18Å; W783-L1039 PolarHBondContact NE1-O 3.39Å
784	C	90.8	Very high	90	Very high	25 Å²	25	45.3 Å²	45.3	17%	0.169	22%	0.219	C	C	.	.			trans	-132.5	163	168.3	72.2	0	0	0	0	111.6	N861 M862 P863	C784-N861 PolarHBondContact N-O 3.13Å; C784-N861 WeakPolarHBondContact O-CA 3.31Å; C784-N861 PolarHBondContact O-ND2 3.45Å; C784-N861 VanDerWaalsContact O-ND2 3.15Å; C784-M862 VanDerWaalsContact SG-C 3.51Å; C784-P863 HydrophobicContact CB-CB 4.49Å
785	R	90	Very high	90.3	Very high	188 Å²	188	46.5 Å²	46.5	71%	0.709	23%	0.226	S	C	*	.			trans	-58	147.6	170.4	-63.3	-176.8	-176.8	171.4	4.4	109.8	W783 R787	W783-R785 HydrophobicContact CH2-CG 4.03Å; W783-R785 HydrophobicContact CZ3-CG 4.18Å; R785-R787 PolarHBondContact O-N 3.12Å
786	S	89.9	Confident	90.4	Very high	69 Å²	69	50.7 Å²	50.7	48%	0.483	24%	0.242	S	C	.	.			trans	-59.2	124.4	178.2	-54.3	0	0	0	0	110.3	N861	S786-N861 PolarHBondContact N-ND2 2.83Å; S786-N861 PolarHBondContact OG-ND2 3.21Å
787	R	91.1	Very high	90.5	Very high	59 Å²	59	57.6 Å²	57.6	22%	0.223	27%	0.274	C	S	.	.			trans	-106.4	135.4	178.1	-65.5	-179.5	-70.6	153.2	5	110.5	R785 W856 Q860 M862	R785-R787 PolarHBondContact O-N 3.12Å; R787-W856 PolarHBondContact O-NE1 2.6Å; R787-Q860 PolarHBondContact N-O 3.05Å; R787-M862 PolarHBondContact NH2-O 3.31Å
788	P	93.1	Very high	90.7	Very high	60 Å²	60	60 Å²	60	39%	0.39	28%	0.281	S	S	.	.			trans	-62.7	150.5	169.5	29.3	-34.6	0	0	0	110.3	E790 E791	P788-E790 PolarHBondContact O-N 3.02Å; P788-E791 WeakPolarHBondContact CD-OE1 3.42Å; P788-E791 HydrophobicContact CG-CB 4.41Å; P788-E791 HydrophobicContact CG-CG 3.8Å; P788-E791 VanDerWaalsContact CG-OE1 3.31Å; P788-E791 WeakPolarHBondContact CG-OE1 3.06Å; P788-E791 PolarHBondContact O-N 3.09Å
789	I	92.4	Very high	90.8	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.051	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-65.3	-29.3	-175.7	-166	175.9	0	0	0	111.7	E791 V792 I793 L852 R853 W856	I789-E791 PolarHBondContact O-N 2.84Å; I789-V792 HydrophobicContact CG1-CG2 4.18Å; I789-V792 WeakPolarHBondContact O-CG2 3.41Å; I789-V792 PolarHBondContact O-N 2.81Å; I789-V792 VanDerWaalsContact O-N 3.11Å; I789-I793 HydrophobicContact CD1-CD1 4.48Å; I789-I793 HydrophobicContact CG1-CD1 4.03Å; I789-I793 HydrophobicContact CG1-CG1 4.25Å; I789-I793 HydrophobicContact CG2-CD1 4.42Å; I789-I793 WeakPolarHBondContact O-CG1 3.2Å; I789-I793 PolarHBondContact O-N 3.18Å; I789-L852 HydrophobicContact CD1-CB 4.31Å; I789-R853 HydrophobicContact CD1-CB 4.44Å; I789-R853 HydrophobicContact CD1-CG 3.84Å; I789-R853 HydrophobicContact CG2-CG 4.32Å; I789-W856 HydrophobicContact CB-CB 4.49Å; I789-W856 HydrophobicContact CB-CD2 4.19Å; I789-W856 HydrophobicContact CB-CG 3.84Å; I789-W856 HydrophobicContact CD1-CB 3.99Å; I789-W856 HydrophobicContact CD1-CD2 4.42Å; I789-W856 HydrophobicContact CD1-CG 4.09Å; I789-W856 HydrophobicContact CG1-CB 4.37Å; I789-W856 HydrophobicContact CG1-CD2 3.96Å; I789-W856 HydrophobicContact CG1-CE3 4.41Å; I789-W856 HydrophobicContact CG1-CG 3.91Å
790	E	92.6	Very high	90.9	Very high	110 Å²	110	62.9 Å²	62.9	51%	0.514	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-60.3	-29.1	179.6	-68.7	68.7	-151.3	0	0	113	P788 V792 R853	P788-E790 PolarHBondContact O-N 3.02Å; E790-V792 VanDerWaalsContact C-N 3.31Å; E790-V792 PolarHBondContact O-N 3.47Å; E790-R853 IonicContact OE1-CZ 2.75Å; E790-R853 IonicContact OE1-NH1 3.4Å; E790-R853 PolarHBondContact OE1-NH1 3.46Å; E790-R853 IonicContact OE1-NH2 3.5Å; E790-R853 PolarHBondContact OE1-NH2 2.83Å
791	E	92.1	Very high	90.8	Very high	134 Å²	134	67.2 Å²	67.2	63%	0.626	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-74	-21.7	178.8	-77.7	175.3	-162.4	0	0	113.4	P788 I789	P788-E791 WeakPolarHBondContact CD-OE1 3.42Å; P788-E791 HydrophobicContact CG-CB 4.41Å; P788-E791 HydrophobicContact CG-CG 3.8Å; P788-E791 VanDerWaalsContact CG-OE1 3.31Å; P788-E791 WeakPolarHBondContact CG-OE1 3.06Å; P788-E791 PolarHBondContact O-N 3.09Å; I789-E791 PolarHBondContact O-N 2.84Å
792	V	92.4	Very high	90.5	Very high	3 Å²	3	69.6 Å²	69.6	2%	0.018	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-10.2	-176.2	-60.5	0	0	0	0	113.1	I789 E790 L794 W856 T866 V867	I789-V792 HydrophobicContact CG1-CG2 4.18Å; I789-V792 WeakPolarHBondContact O-CG2 3.41Å; I789-V792 PolarHBondContact O-N 2.81Å; I789-V792 VanDerWaalsContact O-N 3.11Å; E790-V792 VanDerWaalsContact C-N 3.31Å; E790-V792 PolarHBondContact O-N 3.47Å; V792-L794 PolarHBondContact O-N 3.13Å; V792-W856 HydrophobicContact CB-CH2 4Å; V792-W856 HydrophobicContact CB-CZ2 4.25Å; V792-W856 HydrophobicContact CG1-CH2 3.73Å; V792-W856 HydrophobicContact CG1-CZ2 3.76Å; V792-W856 HydrophobicContact CG2-CE3 4.42Å; V792-W856 HydrophobicContact CG2-CH2 3.4Å; V792-W856 VanDerWaalsContact CG2-CH2 3.4Å; V792-W856 HydrophobicContact CG2-CZ2 3.53Å; V792-W856 HydrophobicContact CG2-CZ3 3.87Å; V792-T866 WeakPolarHBondContact O-CA 3.36Å; V792-V867 HydrophobicContact CG2-CG2 4.24Å; V792-V867 PolarHBondContact O-N 2.82Å
793	I	93.5	Very high	90.1	Very high	38 Å²	38	73.9 Å²	73.9	20%	0.195	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	121.4	177.8	-68.7	163.5	0	0	0	108.9	I789 V849 V867	I789-I793 HydrophobicContact CD1-CD1 4.48Å; I789-I793 HydrophobicContact CG1-CD1 4.03Å; I789-I793 HydrophobicContact CG1-CG1 4.25Å; I789-I793 HydrophobicContact CG2-CD1 4.42Å; I789-I793 WeakPolarHBondContact O-CG1 3.2Å; I789-I793 PolarHBondContact O-N 3.18Å; I793-V849 HydrophobicContact CD1-CG1 3.68Å; I793-V849 HydrophobicContact CD1-CG2 4.34Å; I793-V849 HydrophobicContact CG1-CG2 4.48Å; I793-V867 CarbonylContact C-O 3.59Å; I793-V867 VanDerWaalsContact CA-O 3.29Å; I793-V867 WeakPolarHBondContact CA-O 3.41Å; I793-V867 HydrophobicContact CG1-CB 4.28Å; I793-V867 HydrophobicContact CG1-CG1 4.33Å
794	L	90.2	Very high	89.6	Confident	28 Å²	28	72.4 Å²	72.4	15%	0.147	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.7	170.7	-60.5	177.3	0	0	0	109.1	V792 Q798 A799 T866 V867 L868	V792-L794 PolarHBondContact O-N 3.13Å; L794-Q798 HydrophobicContact CB-CB 4.49Å; L794-Q798 HydrophobicContact CD2-CB 4.31Å; L794-A799 HydrophobicContact CB-CB 4.34Å; L794-A799 HydrophobicContact CD1-CB 4.48Å; L794-T866 HydrophobicContact CD1-CG2 4.02Å; L794-T866 HydrophobicContact CG-CG2 4.42Å; L794-V867 PolarHBondContact N-O 3.44Å; L794-L868 VanDerWaalsContact O-CD1 3.32Å; L794-L868 WeakPolarHBondContact O-CD1 3.39Å
795	Q	89.8	Confident	89.4	Confident	118 Å²	118	72.9 Å²	72.9	55%	0.551	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-79.8	160.5	162.2	-63.3	-174.7	-7.4	0	0	110	E797 Q798 A799	Q795-E797 VanDerWaalsContact C-N 3.27Å; Q795-E797 PolarHBondContact O-N 2.84Å; Q795-Q798 HydrophobicContact CB-CG 4.35Å; Q795-Q798 WeakPolarHBondContact O-CB 3.37Å; Q795-Q798 PolarHBondContact O-N 3.19Å; Q795-A799 PolarHBondContact O-N 2.91Å
796	R	90.7	Very high	89.3	Confident	116 Å²	116	68.4 Å²	68.4	44%	0.438	36%	0.358	S	S	.	.	H	α-helix	trans	-51.4	-43.8	-178.7	-174.1	-174.6	-68.2	161.8	0.4	113.1	A799 A800 D877 A880	R796-A799 PolarHBondContact O-N 3.4Å; R796-A800 WeakPolarHBondContact O-CB 3.27Å; R796-A800 PolarHBondContact O-N 3.39Å; R796-D877 IonicContact CZ-OD1 3.21Å; R796-D877 IonicContact NE-OD1 3.14Å; R796-D877 PolarHBondContact NE-OD1 3.12Å; R796-D877 IonicContact NH2-OD1 2.78Å; R796-D877 PolarHBondContact NH2-OD1 3.39Å; R796-D877 IonicContact NH2-OD2 2.85Å; R796-D877 PolarHBondContact NH2-OD2 2.97Å; R796-A880 HydrophobicContact CG-CB 3.62Å
797	E	89.9	Confident	89.4	Confident	146 Å²	146	65.1 Å²	65.1	68%	0.682	34%	0.336	S	S	*	.	H	α-helix	trans	-68	-35.4	179.3	-67.7	139.8	-162.4	0	0	112.5	Q795 T801	Q795-E797 VanDerWaalsContact C-N 3.27Å; Q795-E797 PolarHBondContact O-N 2.84Å; E797-T801 WeakPolarHBondContact O-CG2 3.41Å; E797-T801 PolarHBondContact O-N 3.25Å; E797-T801 PolarHBondContact O-OG1 3.48Å; E797-T801 VanDerWaalsContact O-OG1 3.14Å
798	Q	90.1	Very high	89.7	Confident	89 Å²	89	62.3 Å²	62.3	42%	0.416	33%	0.325	S	S	.	.	H	α-helix	trans	-72.1	-38.8	176	-64.1	171.7	-23.7	0	0	111.2	L794 Q795 T801 T802	L794-Q798 HydrophobicContact CB-CB 4.49Å; L794-Q798 HydrophobicContact CD2-CB 4.31Å; Q795-Q798 HydrophobicContact CB-CG 4.35Å; Q795-Q798 WeakPolarHBondContact O-CB 3.37Å; Q795-Q798 PolarHBondContact O-N 3.19Å; Q798-T801 WeakPolarHBondContact CA-OG1 3.46Å; Q798-T801 PolarHBondContact O-N 2.99Å; Q798-T801 PolarHBondContact O-OG1 3.44Å; Q798-T802 WeakPolarHBondContact O-CB 3.44Å; Q798-T802 PolarHBondContact O-N 3.27Å; Q798-T802 VanDerWaalsContact O-N 3.07Å; Q798-T802 PolarHBondContact O-OG1 3Å
799	A	88.7	Confident	89.8	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-45	173.9	0	0	0	0	0	110.9	L794 Q795 R796 T801 T802 L868 A880	L794-A799 HydrophobicContact CB-CB 4.34Å; L794-A799 HydrophobicContact CD1-CB 4.48Å; Q795-A799 PolarHBondContact O-N 2.91Å; R796-A799 PolarHBondContact O-N 3.4Å; A799-T801 VanDerWaalsContact C-N 3.28Å; A799-T801 PolarHBondContact O-N 2.92Å; A799-T802 PolarHBondContact O-N 2.98Å; A799-T802 VanDerWaalsContact O-N 3.09Å; A799-L868 HydrophobicContact CB-CD1 4.24Å; A799-A880 CarbonylContact C-O 3.36Å; A799-A880 HydrophobicContact CB-CB 4.27Å
800	A	87.1	Confident	90	Very high	60 Å²	60	59 Å²	59	50%	0.496	30%	0.304	S	S	.	.	H	α-helix	trans	-65.2	-27.4	179.1	0	0	0	0	0	113.9	R796 A880	R796-A800 WeakPolarHBondContact O-CB 3.27Å; R796-A800 PolarHBondContact O-N 3.39Å; A800-A880 WeakPolarHBondContact CA-O 3.35Å; A800-A880 HydrophobicContact CB-CB 4.29Å; A800-A880 PolarHBondContact N-O 3.33Å
801	T	86.5	Confident	90.2	Very high	107 Å²	107	53.8 Å²	53.8	66%	0.656	28%	0.279	S	S	*	.	H	α-helix	trans	-86	-17.7	174.6	52.5	0	0	0	0	113.1	E797 Q798 A799	E797-T801 WeakPolarHBondContact O-CG2 3.41Å; E797-T801 PolarHBondContact O-N 3.25Å; E797-T801 PolarHBondContact O-OG1 3.48Å; E797-T801 VanDerWaalsContact O-OG1 3.14Å; Q798-T801 WeakPolarHBondContact CA-OG1 3.46Å; Q798-T801 PolarHBondContact O-N 2.99Å; Q798-T801 PolarHBondContact O-OG1 3.44Å; A799-T801 VanDerWaalsContact C-N 3.28Å; A799-T801 PolarHBondContact O-N 2.92Å
802	T	85.2	Confident	90.3	Very high	55 Å²	55	47.5 Å²	47.5	34%	0.337	25%	0.25	S	S	.	.	S	Bend	trans	-81.3	121.9	177.6	-56.2	0	0	0	0	109.7	Q798 A799 L804	Q798-T802 WeakPolarHBondContact O-CB 3.44Å; Q798-T802 PolarHBondContact O-N 3.27Å; Q798-T802 VanDerWaalsContact O-N 3.07Å; Q798-T802 PolarHBondContact O-OG1 3Å; A799-T802 PolarHBondContact O-N 2.98Å; A799-T802 VanDerWaalsContact O-N 3.09Å; T802-L804 VanDerWaalsContact C-N 3.33Å; T802-L804 HydrophobicContact CG2-CD2 3.92Å; T802-L804 HydrophobicContact CG2-CG 3.93Å; T802-L804 PolarHBondContact O-N 3.42Å
803	L	83.8	Confident	90.4	Very high	96 Å²	96	47.6 Å²	47.6	50%	0.503	25%	0.25	S	S	.	.			trans	-72.4	88.2	176.4	-171.2	76.5	0	0	0	110.3	A927	L803-A927 HydrophobicContact CD1-CB 4.4Å
804	L	83	Confident	90.3	Very high	9 Å²	9	46.1 Å²	46.1	5%	0.047	24%	0.244	C	C	.	.			trans	-95.1	110.6	175.1	-63.3	168.9	0	0	0	109.5	T802 H807 V844	T802-L804 VanDerWaalsContact C-N 3.33Å; T802-L804 HydrophobicContact CG2-CD2 3.92Å; T802-L804 HydrophobicContact CG2-CG 3.93Å; T802-L804 PolarHBondContact O-N 3.42Å; L804-H807 VanDerWaalsContact C-ND1 3.35Å; L804-H807 PolarHBondContact O-CE1 3.45Å; L804-H807 PolarHBondContact O-ND1 3.47Å; L804-V844 HydrophobicContact CD1-CG2 3.96Å; L804-V844 HydrophobicContact CD2-CG2 4.23Å
805	S	86.2	Confident	90.2	Very high	35 Å²	35	48.1 Å²	48.1	25%	0.245	26%	0.255	C	S	.	.			trans	-136.1	153.4	172	61.2	0	0	0	0	110.1	H807	S805-H807 PolarHBondContact N-ND1 3.03Å; S805-H807 PolarHBondContact O-N 3.07Å
806	N	86.7	Confident	90.1	Very high	94 Å²	94	48.2 Å²	48.2	50%	0.503	25%	0.253	S	S	.	.	S	Bend	trans	51.6	44.8	-178.8	-53.7	-8.3	0	0	0	112.3	L885 D887	N806-L885 PolarHBondContact N-O 3.44Å; N806-D887 WeakPolarHBondContact CA-OD1 3.43Å
807	H	93.4	Very high	90	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	163.9	-173.8	67.8	-82.4	0	0	0	110.1	L804 S805 V809 H842 V881 C886 D887	L804-H807 VanDerWaalsContact C-ND1 3.35Å; L804-H807 PolarHBondContact O-CE1 3.45Å; L804-H807 PolarHBondContact O-ND1 3.47Å; S805-H807 PolarHBondContact N-ND1 3.03Å; S805-H807 PolarHBondContact O-N 3.07Å; H807-V809 VanDerWaalsContact NE2-CG2 3.31Å; H807-V809 WeakPolarHBondContact NE2-CG2 3.12Å; H807-H842 CarbonylContact C-O 3.45Å; H807-H842 WeakPolarHBondContact CA-O 3.35Å; H807-H842 HydrophobicContact CB-CB 4.12Å; H807-H842 VanDerWaalsContact CB-O 3.29Å; H807-H842 WeakPolarHBondContact CB-O 3.44Å; H807-V881 PolarHBondContact CE1-O 3.43Å; H807-V881 PolarHBondContact NE2-O 2.91Å; H807-C886 CarbonylContact O-C 3.52Å; H807-C886 VanDerWaalsContact O-CA 3.28Å; H807-C886 WeakPolarHBondContact O-CA 3.34Å; H807-C886 WeakPolarHBondContact O-CB 3.22Å; H807-D887 PolarHBondContact O-N 3.32Å
808	V	95.8	Very high	89.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.9	176.9	178.1	0	0	0	0	108.7	C570 I810 F826 K841 H842 V843 V844 M888	C570-V808 HydrophobicContact CB-CG1 4.41Å; C570-V808 HydrophobicContact CB-CG2 4Å; V808-I810 HydrophobicContact CG1-CG1 4.34Å; V808-F826 HydrophobicContact CG1-CE1 4.37Å; V808-F826 HydrophobicContact CG1-CZ 4.4Å; V808-K841 HydrophobicContact CG2-CB 4.09Å; V808-K841 HydrophobicContact CG2-CD 3.95Å; V808-H842 PolarHBondContact N-O 2.93Å; V808-V843 HydrophobicContact CB-CG2 4.4Å; V808-V844 PolarHBondContact O-N 3.48Å; V808-M888 WeakPolarHBondContact CA-O 3.37Å
809	V	96.3	Very high	89.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.3	175.4	-179.8	0	0	0	0	108.7	H807 V844 V846 V881 C886 M888 C889 V890	H807-V809 VanDerWaalsContact NE2-CG2 3.31Å; H807-V809 WeakPolarHBondContact NE2-CG2 3.12Å; V809-V844 CarbonylContact C-O 3.51Å; V809-V844 WeakPolarHBondContact CA-O 3.5Å; V809-V846 HydrophobicContact CG1-CG2 4.05Å; V809-V881 HydrophobicContact CG1-CG2 4.26Å; V809-V881 HydrophobicContact CG2-CG2 4.21Å; V809-C886 HydrophobicContact CG2-CB 3.79Å; V809-M888 PolarHBondContact N-O 3.35Å; V809-C889 HydrophobicContact CB-CB 4.48Å; V809-C889 CarbonylContact O-C 3.58Å; V809-C889 WeakPolarHBondContact O-CA 3.44Å; V809-V890 PolarHBondContact O-N 3.45Å
810	I	96.5	Very high	89.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	107.3	174.5	-54.6	178.4	0	0	0	108	V808 M812 F826 V843 V844 I845 V846 V890 I892	V808-I810 HydrophobicContact CG1-CG1 4.34Å; I810-M812 PolarHBondContact O-N 3.42Å; I810-F826 HydrophobicContact CD1-CD1 3.47Å; I810-F826 VanDerWaalsContact CD1-CD1 3.47Å; I810-F826 HydrophobicContact CD1-CE1 3.3Å; I810-F826 HydrophobicContact CD1-CG 4.34Å; I810-F826 HydrophobicContact CD1-CZ 4.04Å; I810-F826 HydrophobicContact CG1-CD1 4.49Å; I810-F826 HydrophobicContact CG1-CE1 3.89Å; I810-F826 HydrophobicContact CG1-CZ 4.23Å; I810-V843 HydrophobicContact CD1-CG1 3.6Å; I810-V843 HydrophobicContact CG1-CG1 4.14Å; I810-V844 PolarHBondContact N-O 2.84Å; I810-I845 HydrophobicContact CB-CG1 4.37Å; I810-I845 HydrophobicContact CB-CG2 4.47Å; I810-I845 HydrophobicContact CD1-CG1 4.22Å; I810-V846 PolarHBondContact O-N 3.17Å; I810-V890 CarbonylContact C-O 3.37Å; I810-V890 WeakPolarHBondContact CA-O 3.42Å; I810-I892 HydrophobicContact CG2-CD1 4.15Å
811	C	96.6	Very high	90.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	105.4	173	-73.8	0	0	0	0	109.1	P872 C889 V890 I891 I892	C811-P872 HydrophobicContact CB-CB 3.76Å; C811-P872 HydrophobicContact CB-CG 4.07Å; C811-C889 VanDerWaalsContact SG-SG 3.68Å; C811-V890 PolarHBondContact N-O 2.9Å; C811-I891 HydrophobicContact CB-CB 4.46Å; C811-I891 HydrophobicContact CB-CG1 3.98Å; C811-I891 WeakPolarHBondContact O-CA 3.42Å; C811-I892 PolarHBondContact O-N 3.31Å
812	M	94.4	Very high	90.2	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.6	-172.8	-173.1	-179.8	59.5	0	0	111.7	I810 A814 L823 I845 V846 Y851 L852 I892	I810-M812 PolarHBondContact O-N 3.42Å; M812-A814 HydrophobicContact CG-CB 4.35Å; M812-L823 HydrophobicContact SD-CD1 3.92Å; M812-L823 HydrophobicContact SD-CD2 4.5Å; M812-I845 HydrophobicContact CB-CG2 4.48Å; M812-I845 HydrophobicContact CE-CG2 4.14Å; M812-V846 PolarHBondContact N-O 3.3Å; M812-Y851 HydrophobicContact CE-CD1 3.55Å; M812-Y851 HydrophobicContact CE-CE1 3.88Å; M812-Y851 HydrophobicContact SD-CD1 3.8Å; M812-Y851 HydrophobicContact SD-CE1 3.46Å; M812-Y851 WeakPolarHBondContact SD-CE1 3.43Å; M812-L852 HydrophobicContact CE-CD1 3.99Å; M812-L852 HydrophobicContact CE-CD2 3.39Å; M812-L852 HydrophobicContact CE-CG 3.54Å; M812-L852 HydrophobicContact SD-CD2 4.22Å; M812-I892 WeakPolarHBondContact CA-O 3.29Å
813	F	94	Very high	90.6	Very high	6 Å²	6	32.9 Å²	32.9	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	104.6	171.6	-68.5	-75.6	0	0	0	109.9	P872 L873 I891 I892 A894 E909 A913	F813-P872 HydrophobicContact CE1-CB 4.14Å; F813-P872 HydrophobicContact CE1-CG 4.22Å; F813-P872 HydrophobicContact CE2-CB 4.15Å; F813-P872 HydrophobicContact CE2-CG 4.47Å; F813-P872 HydrophobicContact CZ-CB 3.67Å; F813-P872 HydrophobicContact CZ-CG 4.13Å; F813-L873 HydrophobicContact CE1-CD1 4.1Å; F813-L873 HydrophobicContact CE1-CD2 4.4Å; F813-L873 HydrophobicContact CE1-CG 3.82Å; F813-L873 HydrophobicContact CZ-CD2 4.04Å; F813-L873 HydrophobicContact CZ-CG 3.9Å; F813-I891 HydrophobicContact CD2-CG2 4.18Å; F813-I891 HydrophobicContact CE2-CG2 3.88Å; F813-I892 PolarHBondContact N-O 2.76Å; F813-A894 WeakPolarHBondContact O-CB 3.36Å; F813-A894 PolarHBondContact O-N 3.2Å; F813-E909 HydrophobicContact CD1-CB 3.91Å; F813-E909 HydrophobicContact CD2-CB 4.13Å; F813-E909 HydrophobicContact CE1-CB 4.03Å; F813-E909 HydrophobicContact CE2-CB 4.21Å; F813-E909 HydrophobicContact CG-CB 3.97Å; F813-E909 HydrophobicContact CZ-CB 4.16Å; F813-A913 HydrophobicContact CE2-CB 3.69Å; F813-A913 HydrophobicContact CZ-CB 3.69Å
814	A	92	Very high	91	Very high	6 Å²	6	29.7 Å²	29.7	5%	0.05	16%	0.159	C	C	.	.			trans	-148.1	146.2	178.4	0	0	0	0	0	110	M812 Y851 A894	M812-A814 HydrophobicContact CG-CB 4.35Å; A814-Y851 HydrophobicContact CB-CD1 3.66Å; A814-Y851 HydrophobicContact CB-CD2 3.59Å; A814-Y851 HydrophobicContact CB-CE1 3.98Å; A814-Y851 HydrophobicContact CB-CE2 3.9Å; A814-Y851 HydrophobicContact CB-CG 3.45Å; A814-Y851 VanDerWaalsContact CB-CG 3.45Å; A814-A894 HydrophobicContact CB-CB 3.61Å
815	D	87.7	Confident	91.4	Very high	71 Å²	71	29.8 Å²	29.8	38%	0.38	16%	0.16	S	C	.	.			trans	-103.4	164.3	169.3	-55.1	-38.6	0	0	0	109.3	N817 S818 R895	D815-N817 PolarHBondContact O-N 3.22Å; D815-S818 PolarHBondContact N-OG 3.33Å; D815-S818 WeakPolarHBondContact O-CB 3.25Å; D815-S818 PolarHBondContact O-N 3.46Å; D815-S818 PolarHBondContact O-OG 3.01Å; D815-R895 VanDerWaalsContact CG-NE 3.33Å; D815-R895 IonicContact OD1-CZ 3.69Å; D815-R895 IonicContact OD1-NE 2.94Å; D815-R895 PolarHBondContact OD1-NE 2.96Å; D815-R895 IonicContact OD1-NH2 2.82Å; D815-R895 PolarHBondContact OD1-NH2 3.21Å; D815-R895 IonicContact OD2-CZ 2.73Å; D815-R895 IonicContact OD2-NE 2.67Å; D815-R895 PolarHBondContact OD2-NE 2.87Å; D815-R895 VanDerWaalsContact OD2-NE 3.14Å
816	K	88	Confident	91.8	Very high	120 Å²	120	28.1 Å²	28.1	52%	0.522	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-35.2	177.7	-176.7	175.6	-178.1	170.7	0	114.2	E850 R854	K816-E850 HydrophobicContact CB-CB 4.43Å; K816-E850 HydrophobicContact CG-CB 4.29Å; K816-R854 PolarHBondContact O-NH1 3.43Å
817	N	88	Confident	92.2	Very high	139 Å²	139	23.7 Å²	23.7	74%	0.743	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	0.6	-176.4	-63.6	-18	0	0	0	114	D815	D815-N817 PolarHBondContact O-N 3.22Å
818	S	89	Confident	92.1	Very high	4 Å²	4	24 Å²	24	3%	0.028	13%	0.126	C	C	.	.	S	Bend	trans	-60.1	148	177.4	-66	0	0	0	0	111.5	D815 R854 A894	D815-S818 PolarHBondContact N-OG 3.33Å; D815-S818 WeakPolarHBondContact O-CB 3.25Å; D815-S818 PolarHBondContact O-N 3.46Å; D815-S818 PolarHBondContact O-OG 3.01Å; S818-R854 PolarHBondContact O-NH1 3.07Å; S818-R854 PolarHBondContact O-NH2 3.36Å; S818-R854 VanDerWaalsContact O-NH2 3.1Å; S818-A894 WeakPolarHBondContact CB-O 3.41Å
819	P	88.9	Confident	91.9	Very high	32 Å²	32	24.1 Å²	24.1	21%	0.208	13%	0.127	C	C	.	.	P	Polyproline II helix	trans	-61.1	152	173.2	27.8	-36	0	0	0	110.2	P505 Y851 A894 I896	P505-P819 HydrophobicContact CG-CB 3.73Å; P505-P819 HydrophobicContact CG-CG 4.45Å; P819-Y851 WeakPolarHBondContact O-CE2 3.32Å; P819-Y851 PolarHBondContact O-OH 2.92Å; P819-A894 WeakPolarHBondContact CD-O 3Å; P819-I896 HydrophobicContact CG-CG1 4.06Å
820	L	90.1	Very high	91.8	Very high	48 Å²	48	24.3 Å²	24.3	25%	0.251	13%	0.128	S	C	.	.	P	Polyproline II helix	trans	-66.4	140.5	175.3	-61.5	177.4	0	0	0	109.1	Q534 R854 E855	Q534-L820 PolarHBondContact NE2-O 3.42Å; Q534-L820 PolarHBondContact OE1-O 3.15Å; L820-R854 HydrophobicContact CD2-CB 3.86Å; L820-E855 WeakPolarHBondContact CA-OE1 3.41Å; L820-E855 WeakPolarHBondContact CB-OE1 3.46Å; L820-E855 HydrophobicContact CD2-CG 3.94Å
821	I	89.7	Confident	91.7	Very high	12 Å²	12	24.3 Å²	24.3	6%	0.062	13%	0.128	C	C	.	.			trans	-88.5	-30.1	173.3	-70.6	162.1	0	0	0	109.3	L563 Y851 E855 I892 A894	L563-I821 HydrophobicContact CD1-CG2 3.54Å; L563-I821 WeakPolarHBondContact CD1-O 3.49Å; L563-I821 HydrophobicContact CD2-CG2 3.75Å; L563-I821 HydrophobicContact CG-CG2 4.17Å; I821-Y851 WeakPolarHBondContact CG1-OH 3.43Å; I821-Y851 PolarHBondContact N-OH 3.08Å; I821-E855 PolarHBondContact N-OE1 3.31Å; I821-I892 HydrophobicContact CD1-CG2 3.63Å; I821-A894 HydrophobicContact CD1-CB 3.3Å; I821-A894 HydrophobicContact CG1-CB 3.7Å
822	G	90.1	Very high	91.4	Very high	15 Å²	15	24.4 Å²	24.4	16%	0.155	13%	0.128	C	C	.	.			trans	81.6	56.8	-171.5	0	0	0	0	0	111.4	L563 R824 N825 E855	L563-G822 VanDerWaalsContact CD1-O 3.27Å; L563-G822 WeakPolarHBondContact CD1-O 3.21Å; G822-R824 PolarHBondContact O-N 2.92Å; G822-N825 PolarHBondContact O-N 3.26Å; G822-E855 PolarHBondContact N-OE1 3.29Å
823	L	92.7	Very high	91.2	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-21.7	-178	-75.6	178.9	0	0	0	113.4	M812 N825 F826 V827 I845 L852 E855 L859	M812-L823 HydrophobicContact SD-CD1 3.92Å; M812-L823 HydrophobicContact SD-CD2 4.5Å; L823-N825 PolarHBondContact O-N 3.1Å; L823-F826 WeakPolarHBondContact O-CB 3.39Å; L823-F826 PolarHBondContact O-N 3.42Å; L823-V827 PolarHBondContact O-N 3.35Å; L823-I845 HydrophobicContact CD1-CD1 4.25Å; L823-L852 HydrophobicContact CD1-CD2 3.72Å; L823-E855 HydrophobicContact CD1-CB 4.46Å; L823-E855 HydrophobicContact CD1-CG 4.37Å; L823-E855 PolarHBondContact N-OE2 3.27Å; L823-L859 HydrophobicContact CB-CD1 4.08Å; L823-L859 HydrophobicContact CB-CD2 4.37Å; L823-L859 HydrophobicContact CD1-CD1 4.37Å
824	R	91.5	Very high	90.9	Very high	30 Å²	30	24.4 Å²	24.4	11%	0.113	13%	0.129	C	C	.	.	H	α-helix	trans	-48.3	-42.5	169.9	-178.9	-178.5	-179.6	-171.5	-2.4	112.8	G822 F826 V827 M828 L859 M862	G822-R824 PolarHBondContact O-N 2.92Å; R824-F826 PolarHBondContact O-N 2.95Å; R824-V827 PolarHBondContact O-N 3.48Å; R824-M828 HydrophobicContact CG-CE 4.05Å; R824-M828 WeakPolarHBondContact O-CB 3.26Å; R824-M828 PolarHBondContact O-N 3.46Å; R824-L859 HydrophobicContact CB-CD2 4.34Å; R824-M862 HydrophobicContact CG-CE 4.21Å
825	N	92.5	Very high	90.7	Very high	11 Å²	11	25.1 Å²	25.1	6%	0.059	13%	0.13	C	C	.	.	H	α-helix	trans	-70.1	-22.3	-178.1	-63.3	-31.1	0	0	0	112.8	Y535 L563 G822 L823 P829	Y535-N825 VanDerWaalsContact CB-ND2 3.32Å; Y535-N825 WeakPolarHBondContact CB-ND2 3.16Å; L563-N825 HydrophobicContact CB-CB 4.04Å; L563-N825 HydrophobicContact CD1-CB 4.05Å; G822-N825 PolarHBondContact O-N 3.26Å; L823-N825 PolarHBondContact O-N 3.1Å; N825-P829 WeakPolarHBondContact O-CD 3.23Å; N825-P829 WeakPolarHBondContact O-CG 3.43Å
826	F	94.7	Very high	90.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-80.7	-43.9	172.5	-173.2	-84.2	0	0	0	111.6	L563 L566 A567 V808 I810 L823 R824 P829 L830 V890 I892	L563-F826 HydrophobicContact CB-CB 4.05Å; L563-F826 HydrophobicContact CD2-CB 4.46Å; L563-F826 HydrophobicContact CD2-CD2 4.47Å; L563-F826 WeakPolarHBondContact O-CD2 3.4Å; L566-F826 HydrophobicContact CB-CD2 4.12Å; L566-F826 HydrophobicContact CB-CE2 3.78Å; A567-F826 HydrophobicContact CB-CD2 4.11Å; A567-F826 HydrophobicContact CB-CE2 4.28Å; A567-F826 HydrophobicContact CB-CG 4.25Å; A567-F826 WeakPolarHBondContact CB-O 3.09Å; V808-F826 HydrophobicContact CG1-CE1 4.37Å; V808-F826 HydrophobicContact CG1-CZ 4.4Å; I810-F826 HydrophobicContact CD1-CD1 3.47Å; I810-F826 VanDerWaalsContact CD1-CD1 3.47Å; I810-F826 HydrophobicContact CD1-CE1 3.3Å; I810-F826 HydrophobicContact CD1-CG 4.34Å; I810-F826 HydrophobicContact CD1-CZ 4.04Å; I810-F826 HydrophobicContact CG1-CD1 4.49Å; I810-F826 HydrophobicContact CG1-CE1 3.89Å; I810-F826 HydrophobicContact CG1-CZ 4.23Å; L823-F826 WeakPolarHBondContact O-CB 3.39Å; L823-F826 PolarHBondContact O-N 3.42Å; R824-F826 PolarHBondContact O-N 2.95Å; F826-P829 WeakPolarHBondContact O-CD 3.47Å; F826-L830 HydrophobicContact CD1-CD1 4.15Å; F826-L830 HydrophobicContact CE1-CD1 3.67Å; F826-L830 HydrophobicContact CZ-CD1 4.48Å; F826-V890 HydrophobicContact CE2-CB 4.45Å; F826-V890 HydrophobicContact CE2-CG1 4.13Å; F826-V890 HydrophobicContact CE2-CG2 4.23Å; F826-V890 HydrophobicContact CZ-CB 4.33Å; F826-V890 HydrophobicContact CZ-CG1 4.5Å; F826-V890 HydrophobicContact CZ-CG2 3.91Å; F826-I892 HydrophobicContact CD2-CD1 4.33Å; F826-I892 HydrophobicContact CE2-CD1 4.45Å
827	V	94.1	Very high	90.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-78.5	-33.4	-173.8	-179.1	0	0	0	0	112	L823 R824 L830 R831 L859 M862 I865	L823-V827 PolarHBondContact O-N 3.35Å; R824-V827 PolarHBondContact O-N 3.48Å; V827-L830 WeakPolarHBondContact O-CB 3.28Å; V827-L830 PolarHBondContact O-N 2.81Å; V827-L830 VanDerWaalsContact O-N 3.16Å; V827-R831 HydrophobicContact CG1-CG 3.96Å; V827-R831 WeakPolarHBondContact O-CG 3.32Å; V827-R831 PolarHBondContact O-N 3.22Å; V827-L859 HydrophobicContact CB-CD2 4.16Å; V827-L859 HydrophobicContact CG2-CD2 3.99Å; V827-M862 HydrophobicContact CB-CE 4.02Å; V827-M862 HydrophobicContact CB-SD 4.12Å; V827-M862 HydrophobicContact CG1-CB 4.32Å; V827-M862 HydrophobicContact CG1-CE 4Å; V827-M862 HydrophobicContact CG1-SD 3.68Å; V827-I865 HydrophobicContact CG1-CD1 3.77Å; V827-I865 HydrophobicContact CG1-CG1 4.3Å
828	M	91.5	Very high	90.8	Very high	8 Å²	8	22.4 Å²	22.4	4%	0.039	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-47.9	-176.5	176.3	-177.7	-68.7	0	0	113.3	F781 R824 L830 R831 A832 M862 L1029 L1039	F781-M828 HydrophobicContact CD1-CG 3.59Å; F781-M828 VanDerWaalsContact CD1-O 3.24Å; F781-M828 WeakPolarHBondContact CD1-O 3.27Å; F781-M828 HydrophobicContact CD2-CG 4.25Å; F781-M828 HydrophobicContact CD2-SD 4.5Å; F781-M828 HydrophobicContact CE1-CB 4.4Å; F781-M828 HydrophobicContact CE1-CG 3.2Å; F781-M828 VanDerWaalsContact CE1-O 3.29Å; F781-M828 WeakPolarHBondContact CE1-O 3.45Å; F781-M828 HydrophobicContact CE1-SD 4.16Å; F781-M828 HydrophobicContact CE2-CG 3.91Å; F781-M828 HydrophobicContact CE2-SD 3.87Å; F781-M828 HydrophobicContact CG-CG 4.11Å; F781-M828 HydrophobicContact CZ-CG 3.37Å; F781-M828 HydrophobicContact CZ-SD 3.68Å; R824-M828 HydrophobicContact CG-CE 4.05Å; R824-M828 WeakPolarHBondContact O-CB 3.26Å; R824-M828 PolarHBondContact O-N 3.46Å; M828-L830 VanDerWaalsContact C-N 3.31Å; M828-L830 PolarHBondContact O-N 3.49Å; M828-R831 CarbonylContact O-C 3.54Å; M828-R831 PolarHBondContact O-N 2.91Å; M828-A832 PolarHBondContact O-N 3.2Å; M828-M862 HydrophobicContact CB-SD 4.45Å; M828-L1029 HydrophobicContact CE-CD2 4.46Å; M828-L1029 HydrophobicContact SD-CD2 4.34Å; M828-L1039 HydrophobicContact CE-CD1 4.09Å
829	P	92.4	Very high	90.7	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.013	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-60.3	-37.1	175.2	-22.8	32.6	0	0	0	113.6	A567 N825 F826 R831 A832	A567-P829 HydrophobicContact CB-CB 4.14Å; A567-P829 HydrophobicContact CB-CG 4.14Å; N825-P829 WeakPolarHBondContact O-CD 3.23Å; N825-P829 WeakPolarHBondContact O-CG 3.43Å; F826-P829 WeakPolarHBondContact O-CD 3.47Å; P829-R831 PolarHBondContact O-N 3.41Å; P829-A832 WeakPolarHBondContact O-CB 3.48Å; P829-A832 PolarHBondContact O-N 3.44Å
830	L	93.4	Very high	90.8	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-71.5	-6.3	176.1	-61.9	179.7	0	0	0	113.5	A567 C570 L571 F826 V827 M828 L840 V843	A567-L830 HydrophobicContact CB-CG 4.21Å; A567-L830 WeakPolarHBondContact O-CD2 3.19Å; C570-L830 HydrophobicContact CB-CD2 4.26Å; L571-L830 HydrophobicContact CD1-CD2 4.01Å; L571-L830 HydrophobicContact CD2-CD2 3.82Å; L571-L830 HydrophobicContact CG-CD2 3.7Å; F826-L830 HydrophobicContact CD1-CD1 4.15Å; F826-L830 HydrophobicContact CE1-CD1 3.67Å; F826-L830 HydrophobicContact CZ-CD1 4.48Å; V827-L830 WeakPolarHBondContact O-CB 3.28Å; V827-L830 PolarHBondContact O-N 2.81Å; V827-L830 VanDerWaalsContact O-N 3.16Å; M828-L830 VanDerWaalsContact C-N 3.31Å; M828-L830 PolarHBondContact O-N 3.49Å; L830-L840 WeakPolarHBondContact O-CD2 3.35Å; L830-V843 HydrophobicContact CD1-CG2 3.94Å
831	R	93.5	Very high	90.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-119.4	17.3	178.3	-60.9	-63.9	176.7	-93.9	2.9	112	F781 H782 V827 M828 P829 K841 M862 P863 K864	F781-R831 WeakPolarHBondContact CA-O 3.37Å; H782-R831 PolarHBondContact CD2-O 2.88Å; H782-R831 PolarHBondContact N-O 2.9Å; V827-R831 HydrophobicContact CG1-CG 3.96Å; V827-R831 WeakPolarHBondContact O-CG 3.32Å; V827-R831 PolarHBondContact O-N 3.22Å; M828-R831 CarbonylContact O-C 3.54Å; M828-R831 PolarHBondContact O-N 2.91Å; P829-R831 PolarHBondContact O-N 3.41Å; R831-K841 VanDerWaalsContact CZ-O 3.3Å; R831-K841 PolarHBondContact NH1-O 3.39Å; R831-K841 PolarHBondContact NH2-O 3.23Å; R831-M862 HydrophobicContact CG-CB 4.41Å; R831-M862 HydrophobicContact CG-SD 4.34Å; R831-P863 PolarHBondContact NE-O 3.17Å; R831-P863 PolarHBondContact NH2-O 3.48Å; R831-K864 PolarHBondContact NH2-O 2.91Å
832	A	91.3	Very high	91.2	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.008	12%	0.118	C	C	.	.	B	Isolated β-bridge	trans	-60.5	143.5	174.7	0	0	0	0	0	111.6	F781 H782 M828 P829 N834 Y835	F781-A832 HydrophobicContact CD1-CB 4.39Å; F781-A832 HydrophobicContact CE1-CB 4.28Å; H782-A832 PolarHBondContact CD2-O 3.44Å; M828-A832 PolarHBondContact O-N 3.2Å; P829-A832 WeakPolarHBondContact O-CB 3.48Å; P829-A832 PolarHBondContact O-N 3.44Å; A832-N834 WeakPolarHBondContact CB-OD1 3.33Å; A832-N834 PolarHBondContact O-N 2.97Å; A832-Y835 HydrophobicContact CB-CD2 4.45Å; A832-Y835 PolarHBondContact O-N 3.46Å
833	S	89.8	Confident	91.5	Very high	0 Å²	0	25 Å²	25	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7.4	-173.4	62.2	0	0	0	0	114.8	G779 M780 Y835 R1052	G779-S833 WeakPolarHBondContact O-CB 3.45Å; G779-S833 PolarHBondContact O-OG 3.24Å; M780-S833 VanDerWaalsContact C-OG 3.26Å; M780-S833 WeakPolarHBondContact CA-OG 3.28Å; M780-S833 WeakPolarHBondContact O-CB 3.48Å; M780-S833 PolarHBondContact O-N 3.46Å; M780-S833 PolarHBondContact O-OG 3.3Å; M780-S833 VanDerWaalsContact O-OG 3.06Å; S833-Y835 PolarHBondContact O-N 3.46Å; S833-R1052 PolarHBondContact O-NE 3.31Å; S833-R1052 PolarHBondContact O-NH2 3.09Å
834	N	87.9	Confident	91.6	Very high	9 Å²	9	25 Å²	25	5%	0.048	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-7.8	170.6	61.4	-14.4	0	0	0	112.9	A832 C1055 R1056 F1144	A832-N834 WeakPolarHBondContact CB-OD1 3.33Å; A832-N834 PolarHBondContact O-N 2.97Å; N834-C1055 PolarHBondContact ND2-O 3.07Å; N834-C1055 VanDerWaalsContact ND2-O 3.16Å; N834-R1056 HydrophobicContact CB-CB 4.49Å; N834-F1144 HydrophobicContact CB-CD2 4.42Å; N834-F1144 VanDerWaalsContact O-CD2 3.25Å; N834-F1144 WeakPolarHBondContact O-CD2 3.2Å; N834-F1144 WeakPolarHBondContact O-CE2 3.22Å
835	Y	88.4	Confident	91.8	Very high	21 Å²	21	23.5 Å²	23.5	8%	0.082	11%	0.105	C	C	.	.	S	Bend	trans	-101	143.9	165.9	-63.2	-79.2	0	0	0	110.7	L571 H782 A832 S833 R1056 I1057	L571-Y835 HydrophobicContact CD1-CE2 4.01Å; L571-Y835 WeakPolarHBondContact CD1-OH 3.35Å; H782-Y835 PolarHBondContact CE1-O 2.95Å; H782-Y835 PolarHBondContact NE2-O 3.5Å; A832-Y835 HydrophobicContact CB-CD2 4.45Å; A832-Y835 PolarHBondContact O-N 3.46Å; S833-Y835 PolarHBondContact O-N 3.46Å; Y835-R1056 HydrophobicContact CE1-CB 4.1Å; Y835-R1056 HydrophobicContact CE1-CG 4.36Å; Y835-R1056 HydrophobicContact CE2-CB 4.43Å; Y835-I1057 PolarHBondContact OH-O 3.28Å
836	H	88.3	Confident	92	Very high	30 Å²	30	23 Å²	23	14%	0.139	10%	0.102	C	C	.	.			trans	-73.3	153.1	172.3	-65.8	-65.3	0	0	0	110.6	H838 E839 L840 F1144 D1145	H836-H838 VanDerWaalsContact CB-CE1 3.44Å; H836-H838 WeakPolarHBondContact CB-CE1 3.33Å; H836-H838 PolarHBondContact O-N 2.9Å; H836-H838 VanDerWaalsContact O-N 3.12Å; H836-E839 HydrophobicContact CB-CG 4.09Å; H836-E839 IonicContact CD2-OE1 3.6Å; H836-E839 IonicContact CD2-OE2 4Å; H836-E839 IonicContact CG-OE2 2.72Å; H836-E839 PolarHBondContact N-OE2 3Å; H836-E839 WeakPolarHBondContact O-CB 3.45Å; H836-E839 PolarHBondContact O-N 3.41Å; H836-L840 PolarHBondContact O-N 3.11Å; H836-F1144 AromaticContact CE1-CE2 3.85Å; H836-F1144 AromaticContact CE1-CZ 3.48Å; H836-F1144 VanDerWaalsContact CE1-CZ 3.48Å; H836-F1144 WeakPolarHBondContact CE1-CZ 3.32Å; H836-D1145 PolarHBondContact CE1-O 3.36Å; H836-D1145 PolarHBondContact NE2-O 3.29Å; H836-D1145 VanDerWaalsContact NE2-O 3.11Å
837	Y	88.6	Confident	91.9	Very high	121 Å²	121	23.1 Å²	23.1	48%	0.475	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-33	-174.9	-171.5	-94.8	0	0	0	113.2	H782 L840 P863 K864	H782-Y837 AromaticContact ND1-CD2 3.77Å; Y837-L840 HydrophobicContact CD2-CD1 3.91Å; Y837-L840 HydrophobicContact CE2-CD1 4.35Å; Y837-L840 HydrophobicContact CG-CD1 4.48Å; Y837-P863 HydrophobicContact CE2-CB 3.93Å; Y837-P863 HydrophobicContact CE2-CG 4.04Å; Y837-K864 WeakPolarHBondContact O-CE 3.42Å; Y837-K864 PolarHBondContact O-NZ 2.93Å
838	H	88.5	Confident	91.8	Very high	122 Å²	122	25.7 Å²	25.7	57%	0.565	12%	0.117	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-28.9	177.4	61.1	-94.8	0	0	0	112.9	H836 L840	H836-H838 VanDerWaalsContact CB-CE1 3.44Å; H836-H838 WeakPolarHBondContact CB-CE1 3.33Å; H836-H838 PolarHBondContact O-N 2.9Å; H836-H838 VanDerWaalsContact O-N 3.12Å; H838-L840 VanDerWaalsContact C-N 3.32Å
839	E	87.7	Confident	91.9	Very high	69 Å²	69	25.8 Å²	25.8	32%	0.322	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-19	176.2	-61.9	174.9	151.2	0	0	112.8	H836 K841 R1056	H836-E839 HydrophobicContact CB-CG 4.09Å; H836-E839 IonicContact CD2-OE1 3.6Å; H836-E839 IonicContact CD2-OE2 4Å; H836-E839 IonicContact CG-OE2 2.72Å; H836-E839 PolarHBondContact N-OE2 3Å; H836-E839 WeakPolarHBondContact O-CB 3.45Å; H836-E839 PolarHBondContact O-N 3.41Å; E839-K841 PolarHBondContact O-N 3.45Å; E839-K841 VanDerWaalsContact O-N 3.1Å; E839-R1056 IonicContact OE1-CZ 3.95Å; E839-R1056 IonicContact OE1-NH1 3.13Å; E839-R1056 PolarHBondContact OE1-NH1 3.29Å; E839-R1056 IonicContact OE1-NH2 3.58Å; E839-R1056 IonicContact OE2-NH1 2.7Å; E839-R1056 PolarHBondContact OE2-NH1 3.35Å
840	L	91.2	Very high	91.8	Very high	6 Å²	6	29.5 Å²	29.5	3%	0.031	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-58.5	117.8	178.7	-63.6	-179.7	0	0	0	111	H782 L830 H836 Y837 H838 H842 P863 K864	H782-L840 HydrophobicContact CB-CD1 4.23Å; L830-L840 WeakPolarHBondContact O-CD2 3.35Å; H836-L840 PolarHBondContact O-N 3.11Å; Y837-L840 HydrophobicContact CD2-CD1 3.91Å; Y837-L840 HydrophobicContact CE2-CD1 4.35Å; Y837-L840 HydrophobicContact CG-CD1 4.48Å; H838-L840 VanDerWaalsContact C-N 3.32Å; L840-H842 PolarHBondContact O-N 3.37Å; L840-P863 HydrophobicContact CD1-CG 4.32Å; L840-K864 HydrophobicContact CB-CD 3.92Å; L840-K864 WeakPolarHBondContact O-CD 3.38Å; L840-K864 PolarHBondContact O-NZ 3.48Å
841	K	92.4	Very high	91.8	Very high	39 Å²	39	29.3 Å²	29.3	17%	0.17	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-65.3	130.2	174.5	-56.9	-169.2	-177	-163.1	0	110.5	C570 L571 V808 R831 E839 D887	C570-K841 PolarHBondContact O-NZ 3.43Å; L571-K841 HydrophobicContact CD2-CD 4.4Å; V808-K841 HydrophobicContact CG2-CB 4.09Å; V808-K841 HydrophobicContact CG2-CD 3.95Å; R831-K841 VanDerWaalsContact CZ-O 3.3Å; R831-K841 PolarHBondContact NH1-O 3.39Å; R831-K841 PolarHBondContact NH2-O 3.23Å; E839-K841 PolarHBondContact O-N 3.45Å; E839-K841 VanDerWaalsContact O-N 3.1Å; K841-D887 HydrophobicContact CD-CB 4.34Å; K841-D887 WeakPolarHBondContact CD-OD2 3.4Å; K841-D887 WeakPolarHBondContact CE-OD2 3.23Å; K841-D887 IonicContact NZ-OD2 3.74Å; K841-D887 PolarHBondContact NZ-OD2 3.49Å
842	H	94.6	Very high	91.8	Very high	50 Å²	50	29.4 Å²	29.4	23%	0.231	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-69.5	134.2	174.9	-164.3	95.7	0	0	0	109.5	H807 V808 L840 T866	H807-H842 CarbonylContact C-O 3.45Å; H807-H842 WeakPolarHBondContact CA-O 3.35Å; H807-H842 HydrophobicContact CB-CB 4.12Å; H807-H842 VanDerWaalsContact CB-O 3.29Å; H807-H842 WeakPolarHBondContact CB-O 3.44Å; V808-H842 PolarHBondContact N-O 2.93Å; L840-H842 PolarHBondContact O-N 3.37Å; H842-T866 PolarHBondContact CD2-OG1 3.29Å; H842-T866 WeakPolarHBondContact NE2-CG2 3.47Å; H842-T866 PolarHBondContact NE2-OG1 3.13Å
843	V	96.1	Very high	92	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.2	-178	174.6	0	0	0	0	109	V808 I810 L830 I845 K864 I865 T866	V808-V843 HydrophobicContact CB-CG2 4.4Å; I810-V843 HydrophobicContact CD1-CG1 3.6Å; I810-V843 HydrophobicContact CG1-CG1 4.14Å; L830-V843 HydrophobicContact CD1-CG2 3.94Å; V843-I845 HydrophobicContact CG1-CG1 4.16Å; V843-K864 PolarHBondContact N-O 3.33Å; V843-I865 WeakPolarHBondContact O-CA 3.42Å; V843-T866 PolarHBondContact O-N 3.43Å
844	V	95.6	Very high	92.1	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.8	178.8	-172.2	0	0	0	0	108.6	L804 V808 V809 I810 T866 V881	L804-V844 HydrophobicContact CD1-CG2 3.96Å; L804-V844 HydrophobicContact CD2-CG2 4.23Å; V808-V844 PolarHBondContact O-N 3.48Å; V809-V844 CarbonylContact C-O 3.51Å; V809-V844 WeakPolarHBondContact CA-O 3.5Å; I810-V844 PolarHBondContact N-O 2.84Å; V844-T866 WeakPolarHBondContact CA-O 3.46Å; V844-V881 HydrophobicContact CG1-CB 4.3Å; V844-V881 HydrophobicContact CG1-CG1 3.78Å
845	I	95.9	Very high	92.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.4	178.8	-53	168.6	0	0	0	108.8	I810 M812 L823 V843 L852 L859 I865 T866 V867 L868	I810-I845 HydrophobicContact CB-CG1 4.37Å; I810-I845 HydrophobicContact CB-CG2 4.47Å; I810-I845 HydrophobicContact CD1-CG1 4.22Å; M812-I845 HydrophobicContact CB-CG2 4.48Å; M812-I845 HydrophobicContact CE-CG2 4.14Å; L823-I845 HydrophobicContact CD1-CD1 4.25Å; V843-I845 HydrophobicContact CG1-CG1 4.16Å; I845-L852 HydrophobicContact CB-CD1 4.45Å; I845-L852 HydrophobicContact CD1-CD2 4.36Å; I845-L852 HydrophobicContact CG2-CD1 3.92Å; I845-L852 HydrophobicContact CG2-CD2 4.02Å; I845-L859 HydrophobicContact CD1-CD1 4.43Å; I845-I865 HydrophobicContact CD1-CG2 4.14Å; I845-T866 PolarHBondContact N-O 2.96Å; I845-V867 HydrophobicContact CB-CG2 4.49Å; I845-V867 CarbonylContact O-C 3.49Å; I845-V867 WeakPolarHBondContact O-CA 3.26Å; I845-L868 PolarHBondContact O-N 3.18Å
846	V	95.5	Very high	92.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	114.2	175.7	-174.3	0	0	0	0	108.2	V809 I810 M812 L868 P872 V881	V809-V846 HydrophobicContact CG1-CG2 4.05Å; I810-V846 PolarHBondContact O-N 3.17Å; M812-V846 PolarHBondContact N-O 3.3Å; V846-L868 HydrophobicContact CG1-CD2 4.35Å; V846-L868 HydrophobicContact CG2-CB 4.3Å; V846-L868 HydrophobicContact CG2-CD2 4.29Å; V846-P872 HydrophobicContact CG1-CG 4.29Å; V846-P872 WeakPolarHBondContact O-CG 3.23Å; V846-V881 HydrophobicContact CG2-CG1 4.04Å
847	G	93.2	Very high	92.5	Very high	2 Å²	2	43.9 Å²	43.9	2%	0.021	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.8	-170.7	179.7	0	0	0	0	0	113.4	V849 L868 G870	G847-V849 PolarHBondContact O-N 2.93Å; G847-L868 PolarHBondContact N-O 3.18Å; G847-G870 CarbonylContact C-O 3.57Å; G847-G870 WeakPolarHBondContact CA-O 3.22Å; G847-G870 PolarHBondContact N-O 2.67Å
848	D	92.4	Very high	92.5	Very high	55 Å²	55	40.7 Å²	40.7	29%	0.294	19%	0.185	S	C	.	.			trans	-69.6	122.1	178.3	-173.1	-4.6	0	0	0	111.3	E850 Y851 L852	D848-E850 VanDerWaalsContact C-N 3.28Å; D848-E850 PolarHBondContact O-N 2.72Å; D848-E850 WeakPolarHBondContact OD1-CB 3.11Å; D848-E850 PolarHBondContact OD1-N 3.19Å; D848-Y851 PolarHBondContact O-N 3.06Å; D848-L852 PolarHBondContact O-N 2.73Å
849	V	92.5	Very high	92.7	Very high	9 Å²	9	34.9 Å²	34.9	6%	0.055	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-33.5	177.4	172	0	0	0	0	111.9	I793 G847 Y851 L852 R853 V867 N869	I793-V849 HydrophobicContact CD1-CG1 3.68Å; I793-V849 HydrophobicContact CD1-CG2 4.34Å; I793-V849 HydrophobicContact CG1-CG2 4.48Å; G847-V849 PolarHBondContact O-N 2.93Å; V849-Y851 VanDerWaalsContact C-N 3.31Å; V849-Y851 PolarHBondContact O-N 3.24Å; V849-L852 PolarHBondContact O-N 3.12Å; V849-L852 VanDerWaalsContact O-N 3.16Å; V849-R853 HydrophobicContact CG1-CG 4.3Å; V849-R853 WeakPolarHBondContact O-CG 3.28Å; V849-R853 PolarHBondContact O-N 3.05Å; V849-V867 HydrophobicContact CG2-CG1 4.2Å; V849-N869 HydrophobicContact CG2-CB 3.41Å; V849-N869 VanDerWaalsContact CG2-CB 3.41Å
850	E	92.1	Very high	92.9	Very high	81 Å²	81	33.6 Å²	33.6	38%	0.379	15%	0.152	S	C	.	.	H	α-helix	trans	-64.8	-37.2	-178.8	-70.2	-63.3	120.1	0	0	111.9	K816 D848 R853	K816-E850 HydrophobicContact CB-CB 4.43Å; K816-E850 HydrophobicContact CG-CB 4.29Å; D848-E850 VanDerWaalsContact C-N 3.28Å; D848-E850 PolarHBondContact O-N 2.72Å; D848-E850 WeakPolarHBondContact OD1-CB 3.11Å; D848-E850 PolarHBondContact OD1-N 3.19Å; E850-R853 IonicContact OE1-NE 2.73Å; E850-R853 PolarHBondContact OE1-NE 3.19Å
851	Y	93.3	Very high	92.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-67.2	-47.2	170.6	175.5	-90.8	0	0	0	111	M812 A814 P819 I821 D848 V849 R853 R854 E855 A894	M812-Y851 HydrophobicContact CE-CD1 3.55Å; M812-Y851 HydrophobicContact CE-CE1 3.88Å; M812-Y851 HydrophobicContact SD-CD1 3.8Å; M812-Y851 HydrophobicContact SD-CE1 3.46Å; M812-Y851 WeakPolarHBondContact SD-CE1 3.43Å; A814-Y851 HydrophobicContact CB-CD1 3.66Å; A814-Y851 HydrophobicContact CB-CD2 3.59Å; A814-Y851 HydrophobicContact CB-CE1 3.98Å; A814-Y851 HydrophobicContact CB-CE2 3.9Å; A814-Y851 HydrophobicContact CB-CG 3.45Å; A814-Y851 VanDerWaalsContact CB-CG 3.45Å; P819-Y851 WeakPolarHBondContact O-CE2 3.32Å; P819-Y851 PolarHBondContact O-OH 2.92Å; I821-Y851 WeakPolarHBondContact CG1-OH 3.43Å; I821-Y851 PolarHBondContact N-OH 3.08Å; D848-Y851 PolarHBondContact O-N 3.06Å; V849-Y851 VanDerWaalsContact C-N 3.31Å; V849-Y851 PolarHBondContact O-N 3.24Å; Y851-R853 VanDerWaalsContact C-N 3.27Å; Y851-R853 PolarHBondContact O-N 3.1Å; Y851-R854 WeakPolarHBondContact O-CB 3.32Å; Y851-R854 PolarHBondContact O-N 2.61Å; Y851-E855 HydrophobicContact CE1-CG 3.82Å; Y851-E855 PolarHBondContact OH-OE1 2.95Å; Y851-A894 HydrophobicContact CE2-CB 4.16Å
852	L	93.4	Very high	92.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-62.7	-29.9	-178.3	-72.8	171	0	0	0	113.8	I789 M812 L823 I845 D848 V849 R854 E855 W856 V867	I789-L852 HydrophobicContact CD1-CB 4.31Å; M812-L852 HydrophobicContact CE-CD1 3.99Å; M812-L852 HydrophobicContact CE-CD2 3.39Å; M812-L852 HydrophobicContact CE-CG 3.54Å; M812-L852 HydrophobicContact SD-CD2 4.22Å; L823-L852 HydrophobicContact CD1-CD2 3.72Å; I845-L852 HydrophobicContact CB-CD1 4.45Å; I845-L852 HydrophobicContact CD1-CD2 4.36Å; I845-L852 HydrophobicContact CG2-CD1 3.92Å; I845-L852 HydrophobicContact CG2-CD2 4.02Å; D848-L852 PolarHBondContact O-N 2.73Å; V849-L852 PolarHBondContact O-N 3.12Å; V849-L852 VanDerWaalsContact O-N 3.16Å; L852-R854 PolarHBondContact O-N 3.34Å; L852-E855 PolarHBondContact O-N 2.81Å; L852-W856 VanDerWaalsContact O-CB 3.3Å; L852-W856 WeakPolarHBondContact O-CB 3.18Å; L852-W856 PolarHBondContact O-N 3.46Å; L852-V867 HydrophobicContact CD1-CB 4.3Å; L852-V867 HydrophobicContact CD1-CG1 3.3Å; L852-V867 HydrophobicContact CD1-CG2 4.04Å
853	R	94.1	Very high	92.8	Very high	101 Å²	101	30 Å²	30	38%	0.381	14%	0.136	S	C	.	.	H	α-helix	trans	-55.8	-32.5	172.8	-77.4	178.6	-174.6	-71.9	-3.7	112.7	I789 E790 V849 E850 Y851	I789-R853 HydrophobicContact CD1-CB 4.44Å; I789-R853 HydrophobicContact CD1-CG 3.84Å; I789-R853 HydrophobicContact CG2-CG 4.32Å; E790-R853 IonicContact OE1-CZ 2.75Å; E790-R853 IonicContact OE1-NH1 3.4Å; E790-R853 PolarHBondContact OE1-NH1 3.46Å; E790-R853 IonicContact OE1-NH2 3.5Å; E790-R853 PolarHBondContact OE1-NH2 2.83Å; V849-R853 HydrophobicContact CG1-CG 4.3Å; V849-R853 WeakPolarHBondContact O-CG 3.28Å; V849-R853 PolarHBondContact O-N 3.05Å; E850-R853 IonicContact OE1-NE 2.73Å; E850-R853 PolarHBondContact OE1-NE 3.19Å; Y851-R853 VanDerWaalsContact C-N 3.27Å; Y851-R853 PolarHBondContact O-N 3.1Å
854	R	92	Very high	92.6	Very high	97 Å²	97	32.3 Å²	32.3	37%	0.366	15%	0.146	S	C	.	.	H	α-helix	trans	-75.1	-44.1	177.9	-64.1	165.2	55.1	-152.4	-10	111.5	K816 S818 L820 Y851 L852	K816-R854 PolarHBondContact O-NH1 3.43Å; S818-R854 PolarHBondContact O-NH1 3.07Å; S818-R854 PolarHBondContact O-NH2 3.36Å; S818-R854 VanDerWaalsContact O-NH2 3.1Å; L820-R854 HydrophobicContact CD2-CB 3.86Å; Y851-R854 WeakPolarHBondContact O-CB 3.32Å; Y851-R854 PolarHBondContact O-N 2.61Å; L852-R854 PolarHBondContact O-N 3.34Å
855	E	91.6	Very high	92.6	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.019	15%	0.146	C	C	.	.	H	α-helix	trans	-70.4	-31.2	178.1	-73.5	-81	178.5	0	0	112.9	L820 I821 G822 L823 Y851 L852 K857 T858	L820-E855 WeakPolarHBondContact CA-OE1 3.41Å; L820-E855 WeakPolarHBondContact CB-OE1 3.46Å; L820-E855 HydrophobicContact CD2-CG 3.94Å; I821-E855 PolarHBondContact N-OE1 3.31Å; G822-E855 PolarHBondContact N-OE1 3.29Å; L823-E855 HydrophobicContact CD1-CB 4.46Å; L823-E855 HydrophobicContact CD1-CG 4.37Å; L823-E855 PolarHBondContact N-OE2 3.27Å; Y851-E855 HydrophobicContact CE1-CG 3.82Å; Y851-E855 PolarHBondContact OH-OE1 2.95Å; L852-E855 PolarHBondContact O-N 2.81Å; E855-K857 PolarHBondContact O-N 2.86Å; E855-K857 VanDerWaalsContact O-N 3.08Å; E855-T858 PolarHBondContact O-N 3.34Å; E855-T858 PolarHBondContact O-OG1 3.06Å
856	W	93	Very high	92.5	Very high	13 Å²	13	33.2 Å²	33.2	5%	0.049	15%	0.152	C	C	.	.	H	α-helix	trans	-58.2	-30.2	-169.9	-170.1	-106.5	0	0	0	114.4	R787 I789 V792 L852 T858 L859 Q860 I865 V867	R787-W856 PolarHBondContact O-NE1 2.6Å; I789-W856 HydrophobicContact CB-CB 4.49Å; I789-W856 HydrophobicContact CB-CD2 4.19Å; I789-W856 HydrophobicContact CB-CG 3.84Å; I789-W856 HydrophobicContact CD1-CB 3.99Å; I789-W856 HydrophobicContact CD1-CD2 4.42Å; I789-W856 HydrophobicContact CD1-CG 4.09Å; I789-W856 HydrophobicContact CG1-CB 4.37Å; I789-W856 HydrophobicContact CG1-CD2 3.96Å; I789-W856 HydrophobicContact CG1-CE3 4.41Å; I789-W856 HydrophobicContact CG1-CG 3.91Å; V792-W856 HydrophobicContact CB-CH2 4Å; V792-W856 HydrophobicContact CB-CZ2 4.25Å; V792-W856 HydrophobicContact CG1-CH2 3.73Å; V792-W856 HydrophobicContact CG1-CZ2 3.76Å; V792-W856 HydrophobicContact CG2-CE3 4.42Å; V792-W856 HydrophobicContact CG2-CH2 3.4Å; V792-W856 VanDerWaalsContact CG2-CH2 3.4Å; V792-W856 HydrophobicContact CG2-CZ2 3.53Å; V792-W856 HydrophobicContact CG2-CZ3 3.87Å; L852-W856 VanDerWaalsContact O-CB 3.3Å; L852-W856 WeakPolarHBondContact O-CB 3.18Å; L852-W856 PolarHBondContact O-N 3.46Å; W856-T858 PolarHBondContact O-N 3.02Å; W856-T858 VanDerWaalsContact O-N 3.07Å; W856-L859 HydrophobicContact CE3-CB 3.97Å; W856-L859 HydrophobicContact CE3-CD1 4.28Å; W856-L859 HydrophobicContact CZ3-CB 4.12Å; W856-L859 PolarHBondContact O-N 3.44Å; W856-Q860 PolarHBondContact O-N 2.74Å; W856-I865 HydrophobicContact CH2-CB 4.33Å; W856-I865 HydrophobicContact CH2-CG2 4.27Å; W856-I865 HydrophobicContact CZ3-CB 4.47Å; W856-I865 HydrophobicContact CZ3-CG2 3.94Å; W856-V867 HydrophobicContact CZ3-CG2 4.46Å
857	K	89.3	Confident	92.5	Very high	151 Å²	151	33.2 Å²	33.2	66%	0.657	15%	0.152	S	C	*	.	H	α-helix	trans	-51.9	-34.1	175.3	-67.2	-176.2	-179.6	179.1	0	112.2	E855 Q860	E855-K857 PolarHBondContact O-N 2.86Å; E855-K857 VanDerWaalsContact O-N 3.08Å; K857-Q860 PolarHBondContact O-NE2 3.3Å
858	T	88.6	Confident	92.6	Very high	53 Å²	53	33.2 Å²	33.2	33%	0.325	15%	0.151	S	C	.	.	H	α-helix	trans	-88.9	-15.8	-179.5	70.9	0	0	0	0	113.9	E855 W856	E855-T858 PolarHBondContact O-N 3.34Å; E855-T858 PolarHBondContact O-OG1 3.06Å; W856-T858 PolarHBondContact O-N 3.02Å; W856-T858 VanDerWaalsContact O-N 3.07Å
859	L	92	Very high	92.5	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-102.6	-20.2	-175.6	-62.8	179.6	0	0	0	113.8	L823 R824 V827 I845 W856 N861 M862 I865	L823-L859 HydrophobicContact CB-CD1 4.08Å; L823-L859 HydrophobicContact CB-CD2 4.37Å; L823-L859 HydrophobicContact CD1-CD1 4.37Å; R824-L859 HydrophobicContact CB-CD2 4.34Å; V827-L859 HydrophobicContact CB-CD2 4.16Å; V827-L859 HydrophobicContact CG2-CD2 3.99Å; I845-L859 HydrophobicContact CD1-CD1 4.43Å; W856-L859 HydrophobicContact CE3-CB 3.97Å; W856-L859 HydrophobicContact CE3-CD1 4.28Å; W856-L859 HydrophobicContact CZ3-CB 4.12Å; W856-L859 PolarHBondContact O-N 3.44Å; L859-N861 PolarHBondContact O-N 2.7Å; L859-M862 HydrophobicContact CD2-CE 3.45Å; L859-M862 VanDerWaalsContact CD2-CE 3.45Å; L859-M862 PolarHBondContact O-N 3.42Å; L859-I865 HydrophobicContact CB-CD1 4.43Å
860	Q	91.5	Very high	92.3	Very high	42 Å²	42	35.6 Å²	35.6	20%	0.196	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-22.1	-170.6	66	-176.9	-11.6	0	0	115.4	R787 W856 K857	R787-Q860 PolarHBondContact N-O 3.05Å; W856-Q860 PolarHBondContact O-N 2.74Å; K857-Q860 PolarHBondContact O-NE2 3.3Å
861	N	91.4	Very high	92.3	Very high	11 Å²	11	35.6 Å²	35.6	6%	0.059	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	7.5	-178.9	-64.7	107.2	0	0	0	114.4	C784 S786 L859	C784-N861 PolarHBondContact N-O 3.13Å; C784-N861 WeakPolarHBondContact O-CA 3.31Å; C784-N861 PolarHBondContact O-ND2 3.45Å; C784-N861 VanDerWaalsContact O-ND2 3.15Å; S786-N861 PolarHBondContact N-ND2 2.83Å; S786-N861 PolarHBondContact OG-ND2 3.21Å; L859-N861 PolarHBondContact O-N 2.7Å
862	M	92.2	Very high	92.3	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.015	17%	0.172	C	C	.	.	S	Bend	trans	-109.3	136.1	179.1	-71.2	-174.4	-81.7	0	0	111.9	C784 R787 R824 V827 M828 R831 L859 I865	C784-M862 VanDerWaalsContact SG-C 3.51Å; R787-M862 PolarHBondContact NH2-O 3.31Å; R824-M862 HydrophobicContact CG-CE 4.21Å; V827-M862 HydrophobicContact CB-CE 4.02Å; V827-M862 HydrophobicContact CB-SD 4.12Å; V827-M862 HydrophobicContact CG1-CB 4.32Å; V827-M862 HydrophobicContact CG1-CE 4Å; V827-M862 HydrophobicContact CG1-SD 3.68Å; M828-M862 HydrophobicContact CB-SD 4.45Å; R831-M862 HydrophobicContact CG-CB 4.41Å; R831-M862 HydrophobicContact CG-SD 4.34Å; L859-M862 HydrophobicContact CD2-CE 3.45Å; L859-M862 VanDerWaalsContact CD2-CE 3.45Å; L859-M862 PolarHBondContact O-N 3.42Å; M862-I865 HydrophobicContact CB-CD1 3.79Å
863	P	92.7	Very high	92.4	Very high	5 Å²	5	38.5 Å²	38.5	3%	0.032	19%	0.186	C	C	.	.	S	Bend	trans	-79.5	166.4	-175.8	31.6	-35.6	0	0	0	113.1	H782 C784 R831 Y837 L840 I865	H782-P863 HydrophobicContact CB-CG 4.06Å; C784-P863 HydrophobicContact CB-CB 4.49Å; R831-P863 PolarHBondContact NE-O 3.17Å; R831-P863 PolarHBondContact NH2-O 3.48Å; Y837-P863 HydrophobicContact CE2-CB 3.93Å; Y837-P863 HydrophobicContact CE2-CG 4.04Å; L840-P863 HydrophobicContact CD1-CG 4.32Å; P863-I865 PolarHBondContact O-N 2.99Å
864	K	93.3	Very high	92.4	Very high	49 Å²	49	35.3 Å²	35.3	21%	0.213	18%	0.179	C	C	.	.	S	Bend	trans	54.3	48.9	172.5	-64.8	-178.7	167.7	-177.8	0	114.8	R831 Y837 L840 V843	R831-K864 PolarHBondContact NH2-O 2.91Å; Y837-K864 WeakPolarHBondContact O-CE 3.42Å; Y837-K864 PolarHBondContact O-NZ 2.93Å; L840-K864 HydrophobicContact CB-CD 3.92Å; L840-K864 WeakPolarHBondContact O-CD 3.38Å; L840-K864 PolarHBondContact O-NZ 3.48Å; V843-K864 PolarHBondContact N-O 3.33Å
865	I	94.7	Very high	92.5	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.5	174.1	-52.7	169.4	0	0	0	107.4	V827 V843 I845 W856 L859 M862 P863	V827-I865 HydrophobicContact CG1-CD1 3.77Å; V827-I865 HydrophobicContact CG1-CG1 4.3Å; V843-I865 WeakPolarHBondContact O-CA 3.42Å; I845-I865 HydrophobicContact CD1-CG2 4.14Å; W856-I865 HydrophobicContact CH2-CB 4.33Å; W856-I865 HydrophobicContact CH2-CG2 4.27Å; W856-I865 HydrophobicContact CZ3-CB 4.47Å; W856-I865 HydrophobicContact CZ3-CG2 3.94Å; L859-I865 HydrophobicContact CB-CD1 4.43Å; M862-I865 HydrophobicContact CB-CD1 3.79Å; P863-I865 PolarHBondContact O-N 2.99Å
866	T	94.6	Very high	92.6	Very high	19 Å²	19	38 Å²	38	12%	0.117	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	148.3	172.2	46.9	0	0	0	0	109.9	V792 L794 H842 V843 V844 I845	V792-T866 WeakPolarHBondContact O-CA 3.36Å; L794-T866 HydrophobicContact CD1-CG2 4.02Å; L794-T866 HydrophobicContact CG-CG2 4.42Å; H842-T866 PolarHBondContact CD2-OG1 3.29Å; H842-T866 WeakPolarHBondContact NE2-CG2 3.47Å; H842-T866 PolarHBondContact NE2-OG1 3.13Å; V843-T866 PolarHBondContact O-N 3.43Å; V844-T866 WeakPolarHBondContact CA-O 3.46Å; I845-T866 PolarHBondContact N-O 2.96Å
867	V	95	Very high	92.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.3	-179.1	172.5	0	0	0	0	108.4	V792 I793 L794 I845 V849 L852 W856	V792-V867 HydrophobicContact CG2-CG2 4.24Å; V792-V867 PolarHBondContact O-N 2.82Å; I793-V867 CarbonylContact C-O 3.59Å; I793-V867 VanDerWaalsContact CA-O 3.29Å; I793-V867 WeakPolarHBondContact CA-O 3.41Å; I793-V867 HydrophobicContact CG1-CB 4.28Å; I793-V867 HydrophobicContact CG1-CG1 4.33Å; L794-V867 PolarHBondContact N-O 3.44Å; I845-V867 HydrophobicContact CB-CG2 4.49Å; I845-V867 CarbonylContact O-C 3.49Å; I845-V867 WeakPolarHBondContact O-CA 3.26Å; V849-V867 HydrophobicContact CG2-CG1 4.2Å; L852-V867 HydrophobicContact CD1-CB 4.3Å; L852-V867 HydrophobicContact CD1-CG1 3.3Å; L852-V867 HydrophobicContact CD1-CG2 4.04Å; W856-V867 HydrophobicContact CZ3-CG2 4.46Å
868	L	94.3	Very high	92.9	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	120.2	167.7	176.4	62.3	0	0	0	108.6	L794 A799 I845 V846 G847 G870 D877 V881	L794-L868 VanDerWaalsContact O-CD1 3.32Å; L794-L868 WeakPolarHBondContact O-CD1 3.39Å; A799-L868 HydrophobicContact CB-CD1 4.24Å; I845-L868 PolarHBondContact O-N 3.18Å; V846-L868 HydrophobicContact CG1-CD2 4.35Å; V846-L868 HydrophobicContact CG2-CB 4.3Å; V846-L868 HydrophobicContact CG2-CD2 4.29Å; G847-L868 PolarHBondContact N-O 3.18Å; L868-G870 PolarHBondContact O-N 3.28Å; L868-D877 HydrophobicContact CD2-CB 3.94Å; L868-V881 HydrophobicContact CB-CG1 4.39Å; L868-V881 HydrophobicContact CD2-CG1 3.44Å; L868-V881 VanDerWaalsContact CD2-CG1 3.44Å
869	N	90.9	Very high	93.1	Very high	97 Å²	97	33.1 Å²	33.1	52%	0.519	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	96.1	170	-168.9	9.4	0	0	0	109.3	V849	V849-N869 HydrophobicContact CG2-CB 3.41Å; V849-N869 VanDerWaalsContact CG2-CB 3.41Å
870	G	88.2	Confident	93.1	Very high	17 Å²	17	33.4 Å²	33.4	18%	0.175	17%	0.173	C	C	.	.	S	Bend	trans	-166.4	174.2	-173.3	0	0	0	0	0	112.5	G847 L868	G847-G870 CarbonylContact C-O 3.57Å; G847-G870 WeakPolarHBondContact CA-O 3.22Å; G847-G870 PolarHBondContact N-O 2.67Å; L868-G870 PolarHBondContact O-N 3.28Å
871	N	92.1	Very high	93.2	Very high	81 Å²	81	31.4 Å²	31.4	43%	0.433	16%	0.163	S	C	.	.			trans	-105.2	126.1	177.5	-175.4	-25.6	0	0	0	109.1	L873 S874 D877	N871-L873 PolarHBondContact O-N 3.1Å; N871-L873 WeakPolarHBondContact OD1-CB 3.44Å; N871-L873 PolarHBondContact OD1-N 3.08Å; N871-S874 WeakPolarHBondContact O-CB 3.48Å; N871-S874 PolarHBondContact O-N 2.98Å; N871-D877 PolarHBondContact N-OD2 3.43Å
872	P	93.6	Very high	93.2	Very high	4 Å²	4	32.7 Å²	32.7	3%	0.026	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-22.7	176.2	-26.3	34.7	0	0	0	115.3	C811 F813 V846 S874 L878	C811-P872 HydrophobicContact CB-CB 3.76Å; C811-P872 HydrophobicContact CB-CG 4.07Å; F813-P872 HydrophobicContact CE1-CB 4.14Å; F813-P872 HydrophobicContact CE1-CG 4.22Å; F813-P872 HydrophobicContact CE2-CB 4.15Å; F813-P872 HydrophobicContact CE2-CG 4.47Å; F813-P872 HydrophobicContact CZ-CB 3.67Å; F813-P872 HydrophobicContact CZ-CG 4.13Å; V846-P872 HydrophobicContact CG1-CG 4.29Å; V846-P872 WeakPolarHBondContact O-CG 3.23Å; P872-S874 VanDerWaalsContact C-N 3.3Å; P872-L878 VanDerWaalsContact O-CD1 3.29Å; P872-L878 WeakPolarHBondContact O-CD1 3.44Å
873	L	94.8	Very high	93.2	Very high	59 Å²	59	32.6 Å²	32.6	31%	0.309	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-17.5	174.4	-62.8	171.1	0	0	0	113.1	F813 N871 R875 L912 A913 N916	F813-L873 HydrophobicContact CE1-CD1 4.1Å; F813-L873 HydrophobicContact CE1-CD2 4.4Å; F813-L873 HydrophobicContact CE1-CG 3.82Å; F813-L873 HydrophobicContact CZ-CD2 4.04Å; F813-L873 HydrophobicContact CZ-CG 3.9Å; N871-L873 PolarHBondContact O-N 3.1Å; N871-L873 WeakPolarHBondContact OD1-CB 3.44Å; N871-L873 PolarHBondContact OD1-N 3.08Å; L873-R875 PolarHBondContact O-N 2.92Å; L873-L912 HydrophobicContact CD2-CB 4.05Å; L873-A913 HydrophobicContact CD2-CB 4.04Å; L873-N916 PolarHBondContact O-ND2 3.24Å
874	S	95.5	Very high	93	Very high	33 Å²	33	33.2 Å²	33.2	23%	0.231	17%	0.173	C	C	.	.			trans	-77.3	108.5	178.2	175	0	0	0	0	110.3	N871 P872 A876 D877 L878	N871-S874 WeakPolarHBondContact O-CB 3.48Å; N871-S874 PolarHBondContact O-N 2.98Å; P872-S874 VanDerWaalsContact C-N 3.3Å; S874-A876 PolarHBondContact O-N 3.49Å; S874-A876 VanDerWaalsContact O-N 3.11Å; S874-D877 WeakPolarHBondContact CB-OD2 3.46Å; S874-D877 PolarHBondContact O-N 3.16Å; S874-D877 PolarHBondContact OG-OD2 2.96Å; S874-L878 PolarHBondContact O-N 3.34Å
875	R	94.1	Very high	92.9	Very high	114 Å²	114	32.8 Å²	32.8	43%	0.43	17%	0.173	S	C	.	.	H	α-helix	trans	-56.1	-28.8	174.3	-67.6	-177	177.5	-170.9	-5.4	112.7	L873 R879 N916 M920	L873-R875 PolarHBondContact O-N 2.92Å; R875-R879 WeakPolarHBondContact O-CB 3.39Å; R875-R879 VanDerWaalsContact O-CG 3.31Å; R875-R879 WeakPolarHBondContact O-CG 3.38Å; R875-R879 PolarHBondContact O-N 3.4Å; R875-N916 WeakPolarHBondContact CG-OD1 3.33Å; R875-N916 PolarHBondContact NE-OD1 2.94Å; R875-N916 PolarHBondContact NH2-OD1 3.22Å; R875-M920 HydrophobicContact CB-CE 4.34Å; R875-M920 HydrophobicContact CG-CG 4.2Å; R875-M920 HydrophobicContact CG-SD 4.23Å
876	A	93.5	Very high	92.7	Very high	44 Å²	44	33 Å²	33	36%	0.364	18%	0.175	S	C	.	.	H	α-helix	trans	-67.2	-38.4	177.6	0	0	0	0	0	112	S874 A880	S874-A876 PolarHBondContact O-N 3.49Å; S874-A876 VanDerWaalsContact O-N 3.11Å; A876-A880 WeakPolarHBondContact O-CB 3.38Å; A876-A880 PolarHBondContact O-N 3.12Å
877	D	94.5	Very high	92.5	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.027	18%	0.181	C	C	.	.	H	α-helix	trans	-71.3	-42.4	177.2	-64.3	-34.8	0	0	0	110.7	R796 L868 N871 S874 R879 A880 V881	R796-D877 IonicContact CZ-OD1 3.21Å; R796-D877 IonicContact NE-OD1 3.14Å; R796-D877 PolarHBondContact NE-OD1 3.12Å; R796-D877 IonicContact NH2-OD1 2.78Å; R796-D877 PolarHBondContact NH2-OD1 3.39Å; R796-D877 IonicContact NH2-OD2 2.85Å; R796-D877 PolarHBondContact NH2-OD2 2.97Å; L868-D877 HydrophobicContact CD2-CB 3.94Å; N871-D877 PolarHBondContact N-OD2 3.43Å; S874-D877 WeakPolarHBondContact CB-OD2 3.46Å; S874-D877 PolarHBondContact O-N 3.16Å; S874-D877 PolarHBondContact OG-OD2 2.96Å; D877-R879 PolarHBondContact O-N 3.36Å; D877-A880 PolarHBondContact O-N 3.3Å; D877-V881 PolarHBondContact O-N 3.11Å; D877-V881 VanDerWaalsContact O-N 3.14Å
878	L	94	Very high	92.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.5	-36.9	175.7	-66.2	175.5	0	0	0	113.4	P872 S874 V881 V883 I917 M920	P872-L878 VanDerWaalsContact O-CD1 3.29Å; P872-L878 WeakPolarHBondContact O-CD1 3.44Å; S874-L878 PolarHBondContact O-N 3.34Å; L878-V881 VanDerWaalsContact O-CG2 3.27Å; L878-V881 WeakPolarHBondContact O-CG2 3.35Å; L878-V883 HydrophobicContact CB-CG1 4.17Å; L878-V883 WeakPolarHBondContact O-CB 3.27Å; L878-V883 WeakPolarHBondContact O-CG1 3.32Å; L878-V883 PolarHBondContact O-N 3.46Å; L878-I917 HydrophobicContact CD1-CD1 4.35Å; L878-I917 HydrophobicContact CD1-CG1 3.65Å; L878-M920 HydrophobicContact CB-CE 3.97Å; L878-M920 HydrophobicContact CB-SD 4.06Å; L878-M920 HydrophobicContact CD1-SD 3.8Å
879	R	92.8	Very high	92.5	Very high	109 Å²	109	34.7 Å²	34.7	41%	0.411	18%	0.183	S	C	.	.	H	α-helix	trans	-68.8	-39.6	172	-74.3	-174.2	-170.9	-73	3.1	111.8	R875 D877 V881 N882 M920 N921 F922	R875-R879 WeakPolarHBondContact O-CB 3.39Å; R875-R879 VanDerWaalsContact O-CG 3.31Å; R875-R879 WeakPolarHBondContact O-CG 3.38Å; R875-R879 PolarHBondContact O-N 3.4Å; D877-R879 PolarHBondContact O-N 3.36Å; R879-V881 VanDerWaalsContact C-N 3.27Å; R879-V881 PolarHBondContact O-N 3.25Å; R879-N882 PolarHBondContact O-N 2.91Å; R879-N882 PolarHBondContact O-OD1 2.97Å; R879-M920 HydrophobicContact CG-CE 3.56Å; R879-N921 VanDerWaalsContact CZ-O 3.28Å; R879-N921 PolarHBondContact NH1-O 3.25Å; R879-N921 PolarHBondContact NH2-O 3.19Å; R879-F922 HydrophobicContact CG-CE1 4.42Å
880	A	92.2	Very high	92.8	Very high	7 Å²	7	30.1 Å²	30.1	6%	0.058	16%	0.158	C	C	.	.	H	α-helix	trans	-64.1	-30.6	-179.5	0	0	0	0	0	113.1	R796 A799 A800 A876 D877 N882	R796-A880 HydrophobicContact CG-CB 3.62Å; A799-A880 CarbonylContact C-O 3.36Å; A799-A880 HydrophobicContact CB-CB 4.27Å; A800-A880 WeakPolarHBondContact CA-O 3.35Å; A800-A880 HydrophobicContact CB-CB 4.29Å; A800-A880 PolarHBondContact N-O 3.33Å; A876-A880 WeakPolarHBondContact O-CB 3.38Å; A876-A880 PolarHBondContact O-N 3.12Å; D877-A880 PolarHBondContact O-N 3.3Å; A880-N882 VanDerWaalsContact C-N 3.3Å
881	V	92.5	Very high	93.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-0.2	173.7	-57.8	0	0	0	0	113.8	H807 V809 V844 V846 L868 D877 L878 R879 V883	H807-V881 PolarHBondContact CE1-O 3.43Å; H807-V881 PolarHBondContact NE2-O 2.91Å; V809-V881 HydrophobicContact CG1-CG2 4.26Å; V809-V881 HydrophobicContact CG2-CG2 4.21Å; V844-V881 HydrophobicContact CG1-CB 4.3Å; V844-V881 HydrophobicContact CG1-CG1 3.78Å; V846-V881 HydrophobicContact CG2-CG1 4.04Å; L868-V881 HydrophobicContact CB-CG1 4.39Å; L868-V881 HydrophobicContact CD2-CG1 3.44Å; L868-V881 VanDerWaalsContact CD2-CG1 3.44Å; D877-V881 PolarHBondContact O-N 3.11Å; D877-V881 VanDerWaalsContact O-N 3.14Å; L878-V881 VanDerWaalsContact O-CG2 3.27Å; L878-V881 WeakPolarHBondContact O-CG2 3.35Å; R879-V881 VanDerWaalsContact C-N 3.27Å; R879-V881 PolarHBondContact O-N 3.25Å; V881-V883 HydrophobicContact CG2-CB 4.41Å
882	N	91.7	Very high	93.2	Very high	39 Å²	39	25.5 Å²	25.5	21%	0.209	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	54.7	-173.6	-56.5	-50.8	0	0	0	112.8	R879 A880 N884 L885	R879-N882 PolarHBondContact O-N 2.91Å; R879-N882 PolarHBondContact O-OD1 2.97Å; A880-N882 VanDerWaalsContact C-N 3.3Å; N882-N884 PolarHBondContact O-N 3.42Å; N882-L885 HydrophobicContact CB-CB 4.26Å; N882-L885 HydrophobicContact CB-CD1 4.16Å; N882-L885 HydrophobicContact CB-CG 4.38Å; N882-L885 WeakPolarHBondContact O-CA 3.29Å; N882-L885 PolarHBondContact O-N 2.75Å
883	V	91.8	Very high	93.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-56.4	-24.7	179.3	70.9	0	0	0	0	113.5	L878 V881 L885 C886 C889 M920 F922 I956	L878-V883 HydrophobicContact CB-CG1 4.17Å; L878-V883 WeakPolarHBondContact O-CB 3.27Å; L878-V883 WeakPolarHBondContact O-CG1 3.32Å; L878-V883 PolarHBondContact O-N 3.46Å; V881-V883 HydrophobicContact CG2-CB 4.41Å; V883-L885 PolarHBondContact O-N 3.46Å; V883-C886 PolarHBondContact O-N 3.03Å; V883-C886 PolarHBondContact O-SG 3.05Å; V883-C889 HydrophobicContact CG2-CB 4.24Å; V883-M920 HydrophobicContact CG1-CE 4.36Å; V883-F922 HydrophobicContact CG1-CE1 4.06Å; V883-F922 HydrophobicContact CG1-CZ 3.62Å; V883-I956 HydrophobicContact CG1-CD1 4.08Å; V883-I956 HydrophobicContact CG2-CD1 4.42Å; V883-I956 HydrophobicContact CG2-CG2 4.38Å
884	N	89.9	Confident	92.7	Very high	19 Å²	19	24 Å²	24	10%	0.102	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-70.2	-10.8	173.1	61	-47	0	0	0	114.5	N882 F922 S948 I950	N882-N884 PolarHBondContact O-N 3.42Å; N884-F922 HydrophobicContact CB-CB 4.39Å; N884-F922 HydrophobicContact CB-CD1 3.59Å; N884-F922 HydrophobicContact CB-CD2 3.8Å; N884-F922 HydrophobicContact CB-CE1 3.71Å; N884-F922 HydrophobicContact CB-CE2 3.93Å; N884-F922 HydrophobicContact CB-CG 3.64Å; N884-F922 HydrophobicContact CB-CZ 3.88Å; N884-F922 VanDerWaalsContact CG-CD1 3.5Å; N884-S948 PolarHBondContact ND2-OG 3.49Å; N884-I950 HydrophobicContact CB-CG2 4.49Å
885	L	90	Very high	92.1	Very high	39 Å²	39	26.9 Å²	26.9	20%	0.204	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-114.9	10	177.5	-61.6	-179.5	0	0	0	112.3	N806 N882 V883 S948	N806-L885 PolarHBondContact N-O 3.44Å; N882-L885 HydrophobicContact CB-CB 4.26Å; N882-L885 HydrophobicContact CB-CD1 4.16Å; N882-L885 HydrophobicContact CB-CG 4.38Å; N882-L885 WeakPolarHBondContact O-CA 3.29Å; N882-L885 PolarHBondContact O-N 2.75Å; V883-L885 PolarHBondContact O-N 3.46Å; L885-S948 VanDerWaalsContact CD2-CB 3.45Å
886	C	91.8	Very high	91.1	Very high	7 Å²	7	24.7 Å²	24.7	5%	0.047	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	148.8	175	80.9	0	0	0	0	110.9	H807 V809 V883	H807-C886 CarbonylContact O-C 3.52Å; H807-C886 VanDerWaalsContact O-CA 3.28Å; H807-C886 WeakPolarHBondContact O-CA 3.34Å; H807-C886 WeakPolarHBondContact O-CB 3.22Å; V809-C886 HydrophobicContact CG2-CB 3.79Å; V883-C886 PolarHBondContact O-N 3.03Å; V883-C886 PolarHBondContact O-SG 3.05Å
887	D	90	Very high	90	Very high	49 Å²	49	24.8 Å²	24.8	26%	0.262	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	-32.2	172.6	-80.9	-0.6	0	0	0	111.4	N806 H807 K841 P957	N806-D887 WeakPolarHBondContact CA-OD1 3.43Å; H807-D887 PolarHBondContact O-N 3.32Å; K841-D887 HydrophobicContact CD-CB 4.34Å; K841-D887 WeakPolarHBondContact CD-OD2 3.4Å; K841-D887 WeakPolarHBondContact CE-OD2 3.23Å; K841-D887 IonicContact NZ-OD2 3.74Å; K841-D887 PolarHBondContact NZ-OD2 3.49Å; D887-P957 WeakPolarHBondContact O-CB 3.49Å
888	M	92.6	Very high	89	Confident	6 Å²	6	29 Å²	29	3%	0.03	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	134.6	178.2	-171.3	59.6	62.8	0	0	109.7	C570 P573 V808 V809 V890 P957 L959	C570-M888 HydrophobicContact CB-CB 4.12Å; C570-M888 HydrophobicContact CB-CG 4.34Å; P573-M888 HydrophobicContact CB-CE 3.85Å; P573-M888 HydrophobicContact CG-CE 3.63Å; V808-M888 WeakPolarHBondContact CA-O 3.37Å; V809-M888 PolarHBondContact N-O 3.35Å; M888-V890 HydrophobicContact CG-CG2 3.85Å; M888-P957 HydrophobicContact CE-CB 3.71Å; M888-P957 VanDerWaalsContact SD-C 3.58Å; M888-P957 HydrophobicContact SD-CB 3.88Å; M888-L959 HydrophobicContact SD-CB 4.03Å
889	C	95.7	Very high	87.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	117.2	167.5	180	0	0	0	0	109	V809 C811 V883 I956 P957 L958 L959	V809-C889 HydrophobicContact CB-CB 4.48Å; V809-C889 CarbonylContact O-C 3.58Å; V809-C889 WeakPolarHBondContact O-CA 3.44Å; C811-C889 VanDerWaalsContact SG-SG 3.68Å; V883-C889 HydrophobicContact CG2-CB 4.24Å; C889-I956 HydrophobicContact CB-CG2 4.43Å; C889-P957 PolarHBondContact N-O 2.81Å; C889-L958 HydrophobicContact CB-CD1 4.04Å; C889-L958 WeakPolarHBondContact O-CA 3.41Å; C889-L959 PolarHBondContact O-N 3.11Å
890	V	96.8	Very high	86.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.4	-179.7	-171.3	0	0	0	0	109.5	L566 C570 V809 I810 C811 F826 M888 I892 L959	L566-V890 HydrophobicContact CD1-CG1 4.47Å; C570-V890 WeakPolarHBondContact SG-CG2 3.3Å; V809-V890 PolarHBondContact O-N 3.45Å; I810-V890 CarbonylContact C-O 3.37Å; I810-V890 WeakPolarHBondContact CA-O 3.42Å; C811-V890 PolarHBondContact N-O 2.9Å; F826-V890 HydrophobicContact CE2-CB 4.45Å; F826-V890 HydrophobicContact CE2-CG1 4.13Å; F826-V890 HydrophobicContact CE2-CG2 4.23Å; F826-V890 HydrophobicContact CZ-CB 4.33Å; F826-V890 HydrophobicContact CZ-CG1 4.5Å; F826-V890 HydrophobicContact CZ-CG2 3.91Å; M888-V890 HydrophobicContact CG-CG2 3.85Å; V890-I892 HydrophobicContact CG1-CD1 4.01Å; V890-I892 HydrophobicContact CG1-CG1 3.84Å; V890-L959 CarbonylContact C-O 3.58Å; V890-L959 WeakPolarHBondContact CA-O 3.31Å; V890-L959 HydrophobicContact CG2-CB 4.46Å
891	I	96.5	Very high	86.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.3	177.1	-57.3	171.2	0	0	0	109	C811 F813 A910 A913 I917 L958 L959 T960 E961	C811-I891 HydrophobicContact CB-CB 4.46Å; C811-I891 HydrophobicContact CB-CG1 3.98Å; C811-I891 WeakPolarHBondContact O-CA 3.42Å; F813-I891 HydrophobicContact CD2-CG2 4.18Å; F813-I891 HydrophobicContact CE2-CG2 3.88Å; I891-A910 HydrophobicContact CG2-CB 3.95Å; I891-A913 HydrophobicContact CD1-CB 3.87Å; I891-A913 HydrophobicContact CG2-CB 4.36Å; I891-I917 HydrophobicContact CD1-CD1 4.3Å; I891-L958 HydrophobicContact CD1-CD1 3.9Å; I891-L958 HydrophobicContact CD1-CD2 3.96Å; I891-L958 HydrophobicContact CD1-CG 4.2Å; I891-L958 HydrophobicContact CG1-CD1 4.36Å; I891-L959 PolarHBondContact N-O 3.07Å; I891-T960 HydrophobicContact CB-CG2 4.34Å; I891-E961 WeakPolarHBondContact O-CB 3.26Å; I891-E961 PolarHBondContact O-N 3.19Å
892	I	93.9	Very high	85.5	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	136.9	-176.8	-59.1	178.2	0	0	0	109.1	L563 L566 I810 C811 M812 F813 I821 F826 V890 E961	L563-I892 HydrophobicContact CD2-CD1 4.07Å; L566-I892 HydrophobicContact CD1-CD1 4.37Å; L566-I892 HydrophobicContact CD1-CG1 4.48Å; I810-I892 HydrophobicContact CG2-CD1 4.15Å; C811-I892 PolarHBondContact O-N 3.31Å; M812-I892 WeakPolarHBondContact CA-O 3.29Å; F813-I892 PolarHBondContact N-O 2.76Å; I821-I892 HydrophobicContact CD1-CG2 3.63Å; F826-I892 HydrophobicContact CD2-CD1 4.33Å; F826-I892 HydrophobicContact CE2-CD1 4.45Å; V890-I892 HydrophobicContact CG1-CD1 4.01Å; V890-I892 HydrophobicContact CG1-CG1 3.84Å; I892-E961 WeakPolarHBondContact CG2-OE2 3.36Å
893	S	90	Very high	84.8	Confident	26 Å²	26	46.5 Å²	46.5	18%	0.182	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.1	173	-172.7	0	0	0	0	111.1	R895	S893-R895 PolarHBondContact OG-N 3.05Å
894	A	87	Confident	84.4	Confident	7 Å²	7	49.4 Å²	49.4	6%	0.058	27%	0.273	C	S	.	.			trans	-98.9	-4.8	171.7	0	0	0	0	0	112.2	F813 A814 S818 P819 I821 Y851	F813-A894 WeakPolarHBondContact O-CB 3.36Å; F813-A894 PolarHBondContact O-N 3.2Å; A814-A894 HydrophobicContact CB-CB 3.61Å; S818-A894 WeakPolarHBondContact CB-O 3.41Å; P819-A894 WeakPolarHBondContact CD-O 3Å; I821-A894 HydrophobicContact CD1-CB 3.3Å; I821-A894 HydrophobicContact CG1-CB 3.7Å; Y851-A894 HydrophobicContact CE2-CB 4.16Å
895	R	83.8	Confident	84.2	Confident	92 Å²	92	52.4 Å²	52.4	35%	0.347	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-71.7	141.2	-170.1	-72.5	-164.3	175.9	164.3	-0.5	111.4	D815 S893 P897 E909	D815-R895 VanDerWaalsContact CG-NE 3.33Å; D815-R895 IonicContact OD1-CZ 3.69Å; D815-R895 IonicContact OD1-NE 2.94Å; D815-R895 PolarHBondContact OD1-NE 2.96Å; D815-R895 IonicContact OD1-NH2 2.82Å; D815-R895 PolarHBondContact OD1-NH2 3.21Å; D815-R895 IonicContact OD2-CZ 2.73Å; D815-R895 IonicContact OD2-NE 2.67Å; D815-R895 PolarHBondContact OD2-NE 2.87Å; D815-R895 VanDerWaalsContact OD2-NE 3.14Å; S893-R895 PolarHBondContact OG-N 3.05Å; R895-P897 WeakPolarHBondContact O-CD 3.45Å; R895-E909 VanDerWaalsContact CD-OE2 3.26Å; R895-E909 WeakPolarHBondContact CD-OE2 3.38Å; R895-E909 IonicContact CZ-OE1 3.35Å; R895-E909 IonicContact CZ-OE2 3.53Å; R895-E909 VanDerWaalsContact CZ-OE2 3.31Å; R895-E909 IonicContact NE-OE2 3.47Å; R895-E909 PolarHBondContact NE-OE2 3.35Å; R895-E909 IonicContact NH1-OE1 2.73Å; R895-E909 PolarHBondContact NH1-OE1 2.91Å; R895-E909 IonicContact NH1-OE2 2.81Å; R895-E909 PolarHBondContact NH1-OE2 2.89Å; R895-E909 IonicContact NH2-OE1 3.08Å
896	I	72.6	Confident	83.9	Confident	69 Å²	69	52.3 Å²	52.3	35%	0.354	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-73.2	124.3	176.1	-58.7	169.5	0	0	0	107.4	S503 P819 N898	S503-I896 WeakPolarHBondContact O-CD1 3.46Å; P819-I896 HydrophobicContact CG-CG1 4.06Å; I896-N898 PolarHBondContact O-N 3.34Å
897	P	71	Confident	83.8	Confident	46 Å²	46	52.2 Å²	52.2	30%	0.299	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-56.5	127.8	168.5	-23.5	34.5	0	0	0	109.5	R895 P899 T906	R895-P897 WeakPolarHBondContact O-CD 3.45Å; P897-P899 WeakPolarHBondContact O-CD 3.36Å; P897-T906 HydrophobicContact CB-CG2 3.93Å; P897-T906 HydrophobicContact CG-CG2 4.32Å
898	N	71.5	Confident	83.9	Confident	92 Å²	92	54 Å²	54	49%	0.492	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-66.8	123.2	170.9	-81.2	-26.7	0	0	0	107.8	I896 N900 E901	I896-N898 PolarHBondContact O-N 3.34Å; N898-N900 PolarHBondContact O-N 2.74Å; N898-E901 HydrophobicContact CB-CB 3.96Å; N898-E901 HydrophobicContact CB-CG 3.68Å; N898-E901 PolarHBondContact ND2-OE1 3.19Å; N898-E901 PolarHBondContact O-N 3.29Å
899	P	69.2	Low	83.9	Confident	119 Å²	119	55.1 Å²	55.1	77%	0.773	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.6	-176.9	24.9	-34.1	0	0	0	113.4	P897	P897-P899 WeakPolarHBondContact O-CD 3.36Å
900	N	74.6	Confident	83.8	Confident	163 Å²	163	55.2 Å²	55.2	87%	0.872	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-7.8	175.4	-61.2	-17.2	0	0	0	113.1	N898	N898-N900 PolarHBondContact O-N 2.74Å
901	E	75.4	Confident	83.6	Confident	73 Å²	73	56 Å²	56	34%	0.341	30%	0.304	S	S	.	.	S	Bend	trans	-84	151	174.4	-78.3	-178.7	-153.1	0	0	110	N898 K908	N898-E901 HydrophobicContact CB-CB 3.96Å; N898-E901 HydrophobicContact CB-CG 3.68Å; N898-E901 PolarHBondContact ND2-OE1 3.19Å; N898-E901 PolarHBondContact O-N 3.29Å; E901-K908 IonicContact OE1-NZ 2.98Å; E901-K908 IonicContact OE2-NZ 3.45Å; E901-K908 PolarHBondContact OE2-NZ 3.27Å
902	D	79.8	Confident	83.5	Confident	82 Å²	82	60.7 Å²	60.7	44%	0.439	33%	0.329	S	S	.	.			trans	-59.5	131.7	173.7	-171.5	-39.4	0	0	0	109.6	T904 L905	D902-T904 PolarHBondContact O-N 3.19Å; D902-T904 WeakPolarHBondContact OD1-CB 3.41Å; D902-T904 WeakPolarHBondContact OD1-CG2 3.29Å; D902-T904 PolarHBondContact OD1-N 3.21Å; D902-T904 PolarHBondContact OD1-OG1 2.73Å; D902-T904 PolarHBondContact OD2-OG1 3Å; D902-L905 HydrophobicContact CB-CD1 4.1Å; D902-L905 HydrophobicContact CB-CG 4.16Å; D902-L905 WeakPolarHBondContact O-CB 3.15Å; D902-L905 PolarHBondContact O-N 2.65Å
903	P	76.9	Confident	83.6	Confident	87 Å²	87	60.6 Å²	60.6	57%	0.565	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-58.3	-18.8	177.7	24.6	-36	0	0	0	113.7	L905 T906 N964	P903-L905 VanDerWaalsContact C-N 3.29Å; P903-T906 WeakPolarHBondContact O-CG2 3.21Å; P903-T906 PolarHBondContact O-OG1 3.41Å; P903-N964 PolarHBondContact O-ND2 2.96Å; P903-N964 VanDerWaalsContact O-ND2 3.15Å
904	T	82.5	Confident	83.8	Confident	60 Å²	60	59.4 Å²	59.4	37%	0.368	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-71.9	-22.8	172.6	60	0	0	0	0	112.9	D902 N967	D902-T904 PolarHBondContact O-N 3.19Å; D902-T904 WeakPolarHBondContact OD1-CB 3.41Å; D902-T904 WeakPolarHBondContact OD1-CG2 3.29Å; D902-T904 PolarHBondContact OD1-N 3.21Å; D902-T904 PolarHBondContact OD1-OG1 2.73Å; D902-T904 PolarHBondContact OD2-OG1 3Å; T904-N967 PolarHBondContact O-ND2 3.38Å; T904-N967 PolarHBondContact O-OD1 3.43Å
905	L	86.6	Confident	84.1	Confident	83 Å²	83	61.5 Å²	61.5	44%	0.435	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-88.6	-2.4	-177.5	-65.3	176.6	0	0	0	114.2	D902 P903 D907 K908	D902-L905 HydrophobicContact CB-CD1 4.1Å; D902-L905 HydrophobicContact CB-CG 4.16Å; D902-L905 WeakPolarHBondContact O-CB 3.15Å; D902-L905 PolarHBondContact O-N 2.65Å; P903-L905 VanDerWaalsContact C-N 3.29Å; L905-D907 VanDerWaalsContact C-N 3.28Å; L905-D907 PolarHBondContact O-N 3.2Å; L905-K908 WeakPolarHBondContact O-CB 3.46Å; L905-K908 WeakPolarHBondContact O-CD 3.5Å; L905-K908 WeakPolarHBondContact O-CG 3.32Å; L905-K908 PolarHBondContact O-N 3.16Å
906	T	84.4	Confident	84.7	Confident	37 Å²	37	58.2 Å²	58.2	23%	0.227	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-37.2	-177.1	54	0	0	0	0	112.7	P897 P903	P897-T906 HydrophobicContact CB-CG2 3.93Å; P897-T906 HydrophobicContact CG-CG2 4.32Å; P903-T906 WeakPolarHBondContact O-CG2 3.21Å; P903-T906 PolarHBondContact O-OG1 3.41Å
907	D	89.9	Confident	85.7	Confident	4 Å²	4	55 Å²	55	2%	0.021	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	10	-174.2	-58.1	-55.3	0	0	0	113.7	L905 E909 A910 I911 L962 V963 N964 N967	L905-D907 VanDerWaalsContact C-N 3.28Å; L905-D907 PolarHBondContact O-N 3.2Å; D907-E909 PolarHBondContact O-N 3.31Å; D907-E909 VanDerWaalsContact O-N 3.09Å; D907-A910 PolarHBondContact O-N 3.46Å; D907-A910 VanDerWaalsContact O-N 3.08Å; D907-I911 HydrophobicContact CB-CD1 3.97Å; D907-I911 HydrophobicContact CB-CG1 4.28Å; D907-I911 WeakPolarHBondContact O-CG1 3.46Å; D907-I911 PolarHBondContact O-N 3.26Å; D907-L962 HydrophobicContact CB-CD2 4.11Å; D907-V963 VanDerWaalsContact OD1-CB 3.28Å; D907-V963 WeakPolarHBondContact OD1-CB 3.12Å; D907-V963 WeakPolarHBondContact OD1-CG2 3.28Å; D907-V963 PolarHBondContact OD1-N 2.67Å; D907-V963 PolarHBondContact OD2-N 3Å; D907-N964 PolarHBondContact OD2-N 3.43Å; D907-N967 HydrophobicContact CB-CB 4.43Å; D907-N967 PolarHBondContact OD2-ND2 2.86Å
908	K	91.5	Very high	86.6	Confident	86 Å²	86	54.2 Å²	54.2	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-51.3	-41	-172.1	67.6	-167.1	172.2	-157.8	0	113.3	E901 L905 L912	E901-K908 IonicContact OE1-NZ 2.98Å; E901-K908 IonicContact OE2-NZ 3.45Å; E901-K908 PolarHBondContact OE2-NZ 3.27Å; L905-K908 WeakPolarHBondContact O-CB 3.46Å; L905-K908 WeakPolarHBondContact O-CD 3.5Å; L905-K908 WeakPolarHBondContact O-CG 3.32Å; L905-K908 PolarHBondContact O-N 3.16Å; K908-L912 VanDerWaalsContact O-CB 3.26Å; K908-L912 WeakPolarHBondContact O-CB 3.16Å; K908-L912 WeakPolarHBondContact O-CD1 3.39Å; K908-L912 WeakPolarHBondContact O-CG 3.48Å; K908-L912 PolarHBondContact O-N 3.28Å
909	E	91.7	Very high	87.6	Confident	31 Å²	31	52.5 Å²	52.5	15%	0.145	29%	0.293	C	S	.	.	H	α-helix	trans	-76.1	-37.7	-177.5	-59.1	-169.7	116.1	0	0	113	F813 R895 D907 L912 A913	F813-E909 HydrophobicContact CD1-CB 3.91Å; F813-E909 HydrophobicContact CD2-CB 4.13Å; F813-E909 HydrophobicContact CE1-CB 4.03Å; F813-E909 HydrophobicContact CE2-CB 4.21Å; F813-E909 HydrophobicContact CG-CB 3.97Å; F813-E909 HydrophobicContact CZ-CB 4.16Å; R895-E909 VanDerWaalsContact CD-OE2 3.26Å; R895-E909 WeakPolarHBondContact CD-OE2 3.38Å; R895-E909 IonicContact CZ-OE1 3.35Å; R895-E909 IonicContact CZ-OE2 3.53Å; R895-E909 VanDerWaalsContact CZ-OE2 3.31Å; R895-E909 IonicContact NE-OE2 3.47Å; R895-E909 PolarHBondContact NE-OE2 3.35Å; R895-E909 IonicContact NH1-OE1 2.73Å; R895-E909 PolarHBondContact NH1-OE1 2.91Å; R895-E909 IonicContact NH1-OE2 2.81Å; R895-E909 PolarHBondContact NH1-OE2 2.89Å; R895-E909 IonicContact NH2-OE1 3.08Å; D907-E909 PolarHBondContact O-N 3.31Å; D907-E909 VanDerWaalsContact O-N 3.09Å; E909-L912 PolarHBondContact O-N 3.27Å; E909-A913 VanDerWaalsContact O-CB 3.25Å; E909-A913 WeakPolarHBondContact O-CB 3.37Å; E909-A913 PolarHBondContact O-N 3.05Å
910	A	93.5	Very high	88.7	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-65.2	-44.1	178	0	0	0	0	0	110.7	I891 D907 A913 S914 T960	I891-A910 HydrophobicContact CG2-CB 3.95Å; D907-A910 PolarHBondContact O-N 3.46Å; D907-A910 VanDerWaalsContact O-N 3.08Å; A910-A913 PolarHBondContact O-N 3.31Å; A910-S914 WeakPolarHBondContact O-CB 3.42Å; A910-S914 PolarHBondContact O-N 2.79Å; A910-T960 HydrophobicContact CB-CG2 3.82Å
911	I	93.9	Very high	89.4	Confident	16 Å²	16	44.1 Å²	44.1	8%	0.082	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-49.2	175.3	-61.8	164.7	0	0	0	110.6	D907 A913 S914 L915 L962 N967 F970 L971	D907-I911 HydrophobicContact CB-CD1 3.97Å; D907-I911 HydrophobicContact CB-CG1 4.28Å; D907-I911 WeakPolarHBondContact O-CG1 3.46Å; D907-I911 PolarHBondContact O-N 3.26Å; I911-A913 VanDerWaalsContact C-N 3.3Å; I911-A913 PolarHBondContact O-N 3.13Å; I911-S914 WeakPolarHBondContact O-CB 3.48Å; I911-S914 PolarHBondContact O-N 3.23Å; I911-L915 HydrophobicContact CG2-CD1 3.93Å; I911-L915 HydrophobicContact CG2-CG 4.35Å; I911-L915 WeakPolarHBondContact O-CG 3.47Å; I911-L915 PolarHBondContact O-N 3.49Å; I911-L962 HydrophobicContact CG1-CD2 4.45Å; I911-N967 HydrophobicContact CD1-CB 4.05Å; I911-F970 HydrophobicContact CD1-CB 4.28Å; I911-F970 HydrophobicContact CD1-CD2 4.1Å; I911-F970 HydrophobicContact CG2-CB 3.9Å; I911-L971 HydrophobicContact CG1-CD2 4.5Å
912	L	94.8	Very high	89.9	Confident	99 Å²	99	41.3 Å²	41.3	52%	0.518	23%	0.229	S	C	.	.	H	α-helix	trans	-60.7	-38.9	179.2	-75.4	171.6	0	0	0	112.3	L873 K908 E909 N916	L873-L912 HydrophobicContact CD2-CB 4.05Å; K908-L912 VanDerWaalsContact O-CB 3.26Å; K908-L912 WeakPolarHBondContact O-CB 3.16Å; K908-L912 WeakPolarHBondContact O-CD1 3.39Å; K908-L912 WeakPolarHBondContact O-CG 3.48Å; K908-L912 PolarHBondContact O-N 3.28Å; E909-L912 PolarHBondContact O-N 3.27Å; L912-N916 WeakPolarHBondContact O-CB 3.39Å; L912-N916 PolarHBondContact O-N 3.43Å
913	A	95.2	Very high	89.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.8	-44.1	175.3	0	0	0	0	0	112.5	F813 L873 I891 E909 A910 I911 N916 I917	F813-A913 HydrophobicContact CE2-CB 3.69Å; F813-A913 HydrophobicContact CZ-CB 3.69Å; L873-A913 HydrophobicContact CD2-CB 4.04Å; I891-A913 HydrophobicContact CD1-CB 3.87Å; I891-A913 HydrophobicContact CG2-CB 4.36Å; E909-A913 VanDerWaalsContact O-CB 3.25Å; E909-A913 WeakPolarHBondContact O-CB 3.37Å; E909-A913 PolarHBondContact O-N 3.05Å; A910-A913 PolarHBondContact O-N 3.31Å; I911-A913 VanDerWaalsContact C-N 3.3Å; I911-A913 PolarHBondContact O-N 3.13Å; A913-N916 PolarHBondContact O-N 2.89Å; A913-I917 WeakPolarHBondContact O-CG1 3.34Å; A913-I917 PolarHBondContact O-N 3.38Å
914	S	94.2	Very high	88.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57	-52.7	175.1	172.3	0	0	0	0	111.3	A910 I911 N916 I917 K918 L958	A910-S914 WeakPolarHBondContact O-CB 3.42Å; A910-S914 PolarHBondContact O-N 2.79Å; I911-S914 WeakPolarHBondContact O-CB 3.48Å; I911-S914 PolarHBondContact O-N 3.23Å; S914-N916 VanDerWaalsContact C-N 3.31Å; S914-N916 PolarHBondContact O-N 2.91Å; S914-I917 PolarHBondContact O-N 2.81Å; S914-K918 WeakPolarHBondContact O-CG 3.28Å; S914-K918 PolarHBondContact O-N 3.37Å; S914-L958 WeakPolarHBondContact OG-CD2 3.22Å
915	L	93.7	Very high	87.4	Confident	51 Å²	51	44.5 Å²	44.5	27%	0.267	25%	0.25	S	C	.	.	H	α-helix	trans	-63.1	-38	178	-66.5	176.3	0	0	0	111.9	I911 K918 A919	I911-L915 HydrophobicContact CG2-CD1 3.93Å; I911-L915 HydrophobicContact CG2-CG 4.35Å; I911-L915 WeakPolarHBondContact O-CG 3.47Å; I911-L915 PolarHBondContact O-N 3.49Å; L915-K918 PolarHBondContact O-N 2.74Å; L915-A919 VanDerWaalsContact O-CB 3.31Å; L915-A919 WeakPolarHBondContact O-CB 3.33Å; L915-A919 PolarHBondContact O-N 3.16Å
916	N	94.9	Very high	85.3	Confident	24 Å²	24	42.8 Å²	42.8	13%	0.128	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-45.7	177.7	-174	35.4	0	0	0	111.9	L873 R875 L912 A913 S914 A919 M920	L873-N916 PolarHBondContact O-ND2 3.24Å; R875-N916 WeakPolarHBondContact CG-OD1 3.33Å; R875-N916 PolarHBondContact NE-OD1 2.94Å; R875-N916 PolarHBondContact NH2-OD1 3.22Å; L912-N916 WeakPolarHBondContact O-CB 3.39Å; L912-N916 PolarHBondContact O-N 3.43Å; A913-N916 PolarHBondContact O-N 2.89Å; S914-N916 VanDerWaalsContact C-N 3.31Å; S914-N916 PolarHBondContact O-N 2.91Å; N916-A919 PolarHBondContact O-N 3.36Å; N916-M920 WeakPolarHBondContact O-CG 3.45Å; N916-M920 PolarHBondContact O-N 3.39Å
917	I	93.7	Very high	83.3	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-47.2	176.4	-69.5	163.8	0	0	0	110.3	L878 I891 A913 S914 A919 M920 G953 I956 L958	L878-I917 HydrophobicContact CD1-CD1 4.35Å; L878-I917 HydrophobicContact CD1-CG1 3.65Å; I891-I917 HydrophobicContact CD1-CD1 4.3Å; A913-I917 WeakPolarHBondContact O-CG1 3.34Å; A913-I917 PolarHBondContact O-N 3.38Å; S914-I917 PolarHBondContact O-N 2.81Å; I917-A919 PolarHBondContact O-N 3.19Å; I917-M920 WeakPolarHBondContact O-CB 3.4Å; I917-M920 PolarHBondContact O-N 3.34Å; I917-G953 WeakPolarHBondContact O-CA 3.49Å; I917-I956 HydrophobicContact CG2-CB 4.3Å; I917-I956 HydrophobicContact CG2-CD1 3.79Å; I917-I956 HydrophobicContact CG2-CG2 4.25Å; I917-L958 HydrophobicContact CB-CD1 4.31Å; I917-L958 HydrophobicContact CD1-CD1 3.6Å; I917-L958 HydrophobicContact CG2-CD1 4.11Å
918	K	91	Very high	80.9	Confident	30 Å²	30	49.8 Å²	49.8	13%	0.13	29%	0.287	C	S	.	.	H	α-helix	trans	-58	-34.7	177.6	-72.1	178.7	-174.4	-179.9	0	112.6	S914 L915 M920 G953 T954 L971 D972	S914-K918 WeakPolarHBondContact O-CG 3.28Å; S914-K918 PolarHBondContact O-N 3.37Å; L915-K918 PolarHBondContact O-N 2.74Å; K918-M920 VanDerWaalsContact C-N 3.34Å; K918-M920 PolarHBondContact O-N 3.06Å; K918-G953 CarbonylContact O-C 2.96Å; K918-T954 HydrophobicContact CB-CG2 4.43Å; K918-T954 PolarHBondContact O-N 3.42Å; K918-L971 PolarHBondContact NZ-O 3.15Å; K918-D972 IonicContact NZ-OD1 2.66Å; K918-D972 PolarHBondContact NZ-OD1 3.32Å
919	A	91.9	Very high	78.6	Confident	56 Å²	56	51.2 Å²	51.2	46%	0.463	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	0.5	178.7	0	0	0	0	0	115	L915 N916 I917	L915-A919 VanDerWaalsContact O-CB 3.31Å; L915-A919 WeakPolarHBondContact O-CB 3.33Å; L915-A919 PolarHBondContact O-N 3.16Å; N916-A919 PolarHBondContact O-N 3.36Å; I917-A919 PolarHBondContact O-N 3.19Å
920	M	92.2	Very high	75.9	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.005	33%	0.333	C	S	.	.			trans	-80.4	139	176.3	-70.5	174.1	70.4	0	0	111.4	R875 L878 R879 V883 N916 I917 K918 F922 G953	R875-M920 HydrophobicContact CB-CE 4.34Å; R875-M920 HydrophobicContact CG-CG 4.2Å; R875-M920 HydrophobicContact CG-SD 4.23Å; L878-M920 HydrophobicContact CB-CE 3.97Å; L878-M920 HydrophobicContact CB-SD 4.06Å; L878-M920 HydrophobicContact CD1-SD 3.8Å; R879-M920 HydrophobicContact CG-CE 3.56Å; V883-M920 HydrophobicContact CG1-CE 4.36Å; N916-M920 WeakPolarHBondContact O-CG 3.45Å; N916-M920 PolarHBondContact O-N 3.39Å; I917-M920 WeakPolarHBondContact O-CB 3.4Å; I917-M920 PolarHBondContact O-N 3.34Å; K918-M920 VanDerWaalsContact C-N 3.34Å; K918-M920 PolarHBondContact O-N 3.06Å; M920-F922 HydrophobicContact CB-CE2 3.8Å; M920-F922 HydrophobicContact CB-CZ 3.88Å; M920-F922 HydrophobicContact CE-CE1 3.96Å; M920-F922 HydrophobicContact CE-CZ 3.72Å; M920-F922 HydrophobicContact SD-CZ 4.37Å; M920-G953 WeakPolarHBondContact O-CA 3.26Å; M920-G953 PolarHBondContact O-N 3.02Å
921	N	90	Very high	73.1	Confident	104 Å²	104	68.7 Å²	68.7	56%	0.556	37%	0.372	S	S	*	.	B	Isolated β-bridge	trans	-109.9	144.9	169.2	-67.5	-30.2	0	0	0	110.2	R879	R879-N921 VanDerWaalsContact CZ-O 3.28Å; R879-N921 PolarHBondContact NH1-O 3.25Å; R879-N921 PolarHBondContact NH2-O 3.19Å
922	F	85.2	Confident	70.4	Confident	15 Å²	15	73.6 Å²	73.6	7%	0.066	40%	0.404	C	S	.	.			trans	-122.2	128.2	179.9	-58.9	-90	0	0	0	109	R879 V883 N884 M920 K951 I956	R879-F922 HydrophobicContact CG-CE1 4.42Å; V883-F922 HydrophobicContact CG1-CE1 4.06Å; V883-F922 HydrophobicContact CG1-CZ 3.62Å; N884-F922 HydrophobicContact CB-CB 4.39Å; N884-F922 HydrophobicContact CB-CD1 3.59Å; N884-F922 HydrophobicContact CB-CD2 3.8Å; N884-F922 HydrophobicContact CB-CE1 3.71Å; N884-F922 HydrophobicContact CB-CE2 3.93Å; N884-F922 HydrophobicContact CB-CG 3.64Å; N884-F922 HydrophobicContact CB-CZ 3.88Å; N884-F922 VanDerWaalsContact CG-CD1 3.5Å; M920-F922 HydrophobicContact CB-CE2 3.8Å; M920-F922 HydrophobicContact CB-CZ 3.88Å; M920-F922 HydrophobicContact CE-CE1 3.96Å; M920-F922 HydrophobicContact CE-CZ 3.72Å; M920-F922 HydrophobicContact SD-CZ 4.37Å; F922-K951 PolarHBondContact N-O 2.83Å; F922-I956 HydrophobicContact CE2-CD1 3.71Å; F922-I956 HydrophobicContact CZ-CD1 3.99Å
923	D	77.8	Confident	67.3	Low	135 Å²	135	77.8 Å²	77.8	72%	0.722	43%	0.427	S	S	*	.			trans	-71.1	141.2	172.2	-60.7	-37.4	0	0	0	108.5	T925	D923-T925 WeakPolarHBondContact CB-OG1 3.17Å; D923-T925 PolarHBondContact O-N 3.22Å
924	A	58.1	Low	64.4	Low	51 Å²	51	81.2 Å²	81.2	42%	0.421	46%	0.461	S	S	.	.			trans	-70.7	26.3	-178.3	0	0	0	0	0	113.6
925	T	52	Low	61.6	Low	109 Å²	109	88.2 Å²	88.2	67%	0.669	50%	0.499	S	S	*	.			trans	-92.8	117.2	-164.7	-32.1	0	0	0	0	111.4	D923	D923-T925 WeakPolarHBondContact CB-OG1 3.17Å; D923-T925 PolarHBondContact O-N 3.22Å
926	T	42.6	Very low	58.7	Low	48 Å²	48	92.7 Å²	92.7	29%	0.294	52%	0.523	S	S	.	.			trans	-34.2	126.5	170.9	-41.9	0	0	0	0	114.2	L928 L945	T926-L928 VanDerWaalsContact C-N 3.3Å; T926-L928 HydrophobicContact CG2-CG 4.38Å; T926-L928 PolarHBondContact O-N 2.88Å; T926-L945 HydrophobicContact CG2-CD2 3.38Å; T926-L945 HydrophobicContact CG2-CG 4.08Å
927	A	42.5	Very low	55.9	Low	66 Å²	66	96.9 Å²	96.9	55%	0.545	55%	0.554	S	S	.	*			trans	-62	92.2	162.2	0	0	0	0	0	109.5	L803 L929	L803-A927 HydrophobicContact CD1-CB 4.4Å; A927-L929 PolarHBondContact O-N 3.41Å
928	L	39.5	Very low	53.1	Low	121 Å²	121	104.6 Å²	104.6	63%	0.634	60%	0.595	S	S	*	*			trans	-83.6	100.8	173.8	-79	165.5	0	0	0	109	T926 Y930	T926-L928 VanDerWaalsContact C-N 3.3Å; T926-L928 HydrophobicContact CG2-CG 4.38Å; T926-L928 PolarHBondContact O-N 2.88Å; L928-Y930 PolarHBondContact O-N 2.7Å
929	L	42.5	Very low	50.5	Low	116 Å²	116	110.9 Å²	110.9	61%	0.607	63%	0.63	S	S	*	*			trans	-74	108.9	169.2	-72.4	170.8	0	0	0	109.7	A927	A927-L929 PolarHBondContact O-N 3.41Å
930	Y	33.7	Very low	47.7	Very low	223 Å²	223	113.3 Å²	113.3	88%	0.875	64%	0.643	S	S	*	*			trans	-73	119.3	167.6	-95.5	-95.5	0	0	0	109.9	L928	L928-Y930 PolarHBondContact O-N 2.7Å
931	H	36	Very low	44.9	Very low	177 Å²	177	118.2 Å²	118.2	82%	0.819	68%	0.675	S	S	*	*			trans	-115.7	133.9	158.3	-120.2	-74	0	0	0	109.1
932	P	36.1	Very low	42.2	Very low	118 Å²	118	119.3 Å²	119.3	77%	0.766	69%	0.688	S	S	*	*			trans	-70.4	138.1	-177.3	-8.2	23.8	0	0	0	111.3	G934	P932-G934 PolarHBondContact O-N 3.16Å
933	L	30.9	Very low	39.6	Very low	188 Å²	188	125.2 Å²	125.2	98%	0.984	72%	0.718	S	S	*	*			trans	-52.4	118.8	177	-76.2	146.8	0	0	0	112.5
934	G	34.9	Very low	37.6	Very low	71 Å²	71	122.8 Å²	122.8	73%	0.732	72%	0.716	S	S	*	*			trans	-154.9	93.8	172.8	0	0	0	0	0	111.4	P932	P932-G934 PolarHBondContact O-N 3.16Å
935	N	33.5	Very low	36.3	Very low	147 Å²	147	126.3 Å²	126.3	79%	0.786	73%	0.727	S	S	*	*			trans	26.7	124.4	160.8	-94	-7.3	0	0	0	121.6
936	N	32.9	Very low	35.8	Very low	146 Å²	146	125.8 Å²	125.8	78%	0.781	72%	0.716	S	S	*	*			trans	64.1	85.3	141.4	-63.1	-13.1	0	0	0	118.4
937	S	36.8	Very low	35.8	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	74%	0.735	S	S	*	*			trans	-166.5	114.7	131.3	-163.2	0	0	0	0	110.5	N939	S937-N939 PolarHBondContact O-N 3.28Å
938	L	34.9	Very low	36.1	Very low	163 Å²	163	128.3 Å²	128.3	85%	0.853	72%	0.715	S	S	*	*			trans	-60.6	109.1	160	-104.8	69.3	0	0	0	107
939	N	36.5	Very low	37.1	Very low	163 Å²	163	130.2 Å²	130.2	87%	0.872	72%	0.718	S	S	*	*			trans	153.6	59.6	153.8	-76.7	-19.2	0	0	0	112.5	S937	S937-N939 PolarHBondContact O-N 3.28Å
940	S	34.1	Very low	38.4	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	70%	0.698	S	S	*	*			trans	-112.9	136.6	163.4	46.7	0	0	0	0	110.3
941	P	33.4	Very low	40.2	Very low	104 Å²	104	122.2 Å²	122.2	68%	0.675	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-64.9	151.5	-179.4	26.7	-32.1	0	0	0	110.9
942	P	32.3	Very low	42.5	Very low	128 Å²	128	115.5 Å²	115.5	83%	0.831	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-64.6	138.5	-175	28.4	-34.7	0	0	0	111	A944	P942-A944 PolarHBondContact O-N 3.35Å
943	M	30.1	Very low	44.8	Very low	139 Å²	139	110 Å²	110	69%	0.685	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-53.6	133.8	173.6	-78.8	-142	-64.6	0	0	111.8	L945	M943-L945 PolarHBondContact O-N 3.48Å
944	A	35.8	Very low	47.3	Very low	83 Å²	83	104.6 Å²	104.6	69%	0.686	60%	0.597	S	S	*	*			trans	-81.5	107.3	166	0	0	0	0	0	109.2	P942 F946	P942-A944 PolarHBondContact O-N 3.35Å; A944-F946 PolarHBondContact O-N 3.05Å
945	L	32	Very low	49.6	Very low	125 Å²	125	105 Å²	105	65%	0.654	58%	0.58	S	S	*	*			trans	-60.7	113.7	163.1	-93.9	125.9	0	0	0	108.5	T926 M943	T926-L945 HydrophobicContact CG2-CD2 3.38Å; T926-L945 HydrophobicContact CG2-CG 4.08Å; M943-L945 PolarHBondContact O-N 3.48Å
946	F	41.3	Very low	52.2	Low	98 Å²	98	98.6 Å²	98.6	43%	0.43	55%	0.545	S	S	.	.			trans	-89.8	101.2	163.9	-95.1	-91.4	0	0	0	108.2	A944	A944-F946 PolarHBondContact O-N 3.05Å
947	E	41.5	Very low	54.9	Low	149 Å²	149	93.8 Å²	93.8	70%	0.696	52%	0.522	S	S	*	.			trans	-80.3	117.1	163.6	-91.8	-176.5	150.8	0	0	108.7	K949	E947-K949 PolarHBondContact O-N 3.49Å
948	S	50.6	Low	57.6	Low	19 Å²	19	89 Å²	89	13%	0.133	49%	0.487	C	S	.	.			trans	-70.7	113.2	167.7	75	0	0	0	0	108.5	N884 L885 I950	N884-S948 PolarHBondContact ND2-OG 3.49Å; L885-S948 VanDerWaalsContact CD2-CB 3.45Å; S948-I950 PolarHBondContact O-N 3.03Å
949	K	58.5	Low	60.4	Low	161 Å²	161	81.3 Å²	81.3	70%	0.7	45%	0.447	S	S	*	.			trans	-66.4	-22.5	174.8	-67.7	-179.5	-178.8	175.9	0	112.4	E947 K951	E947-K949 PolarHBondContact O-N 3.49Å; K949-K951 PolarHBondContact O-N 3.05Å
950	I	70.6	Confident	63.3	Low	35 Å²	35	73.6 Å²	73.6	18%	0.179	41%	0.406	C	S	.	.			trans	-79.8	110.7	-178.6	-62.7	179.3	0	0	0	109.8	N884 S948 S952 Q955 I956	N884-I950 HydrophobicContact CB-CG2 4.49Å; S948-I950 PolarHBondContact O-N 3.03Å; I950-S952 VanDerWaalsContact CG2-O 3.26Å; I950-S952 WeakPolarHBondContact CG2-O 3.43Å; I950-Q955 HydrophobicContact CG1-CB 4.41Å; I950-Q955 HydrophobicContact CG2-CB 4.16Å; I950-I956 HydrophobicContact CG2-CG1 4.08Å
951	K	72.7	Confident	66.1	Low	136 Å²	136	69.2 Å²	69.2	59%	0.591	37%	0.374	S	S	*	.			trans	-98.2	-28	176.2	-64.8	-176.4	-179.3	-179.4	0	112.6	F922 K949	F922-K951 PolarHBondContact N-O 2.83Å; K949-K951 PolarHBondContact O-N 3.05Å
952	S	83.1	Confident	68.9	Low	36 Å²	36	64.2 Å²	64.2	25%	0.252	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-120.6	140.4	-178.9	-174.1	0	0	0	0	110.6	I950 T954 Q955	I950-S952 VanDerWaalsContact CG2-O 3.26Å; I950-S952 WeakPolarHBondContact CG2-O 3.43Å; S952-T954 PolarHBondContact O-N 3.44Å; S952-T954 PolarHBondContact OG-OG1 3.25Å; S952-Q955 PolarHBondContact O-N 3.3Å
953	G	84.4	Confident	71.5	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.01	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-62.8	-19.7	179.5	0	0	0	0	0	114.1	I917 K918 M920 Q955 I956	I917-G953 WeakPolarHBondContact O-CA 3.49Å; K918-G953 CarbonylContact O-C 2.96Å; M920-G953 WeakPolarHBondContact O-CA 3.26Å; M920-G953 PolarHBondContact O-N 3.02Å; G953-Q955 PolarHBondContact O-N 3.29Å; G953-I956 WeakPolarHBondContact O-CB 3.47Å; G953-I956 PolarHBondContact O-N 2.85Å; G953-I956 VanDerWaalsContact O-N 3.1Å
954	T	84.2	Confident	74.2	Confident	76 Å²	76	54.9 Å²	54.9	47%	0.466	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-61.6	-22.9	174.4	56.2	0	0	0	0	113.3	K918 S952	K918-T954 HydrophobicContact CB-CG2 4.43Å; K918-T954 PolarHBondContact O-N 3.42Å; S952-T954 PolarHBondContact O-N 3.44Å; S952-T954 PolarHBondContact OG-OG1 3.25Å
955	Q	83.2	Confident	76.6	Confident	80 Å²	80	52.6 Å²	52.6	37%	0.374	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-89.6	-5.2	179.4	-43	-176.9	-62.7	0	0	112.9	I950 S952 G953 P957 T1108	I950-Q955 HydrophobicContact CG1-CB 4.41Å; I950-Q955 HydrophobicContact CG2-CB 4.16Å; S952-Q955 PolarHBondContact O-N 3.3Å; G953-Q955 PolarHBondContact O-N 3.29Å; Q955-P957 WeakPolarHBondContact O-CD 3.45Å; Q955-T1108 HydrophobicContact CG-CG2 4.12Å
956	I	88.3	Confident	79.2	Confident	11 Å²	11	49 Å²	49	6%	0.056	25%	0.25	C	C	.	.	S	Bend	trans	-71.3	126.4	178.4	-64.6	174	0	0	0	108.7	V883 C889 I917 F922 I950 G953 L958	V883-I956 HydrophobicContact CG1-CD1 4.08Å; V883-I956 HydrophobicContact CG2-CD1 4.42Å; V883-I956 HydrophobicContact CG2-CG2 4.38Å; C889-I956 HydrophobicContact CB-CG2 4.43Å; I917-I956 HydrophobicContact CG2-CB 4.3Å; I917-I956 HydrophobicContact CG2-CD1 3.79Å; I917-I956 HydrophobicContact CG2-CG2 4.25Å; F922-I956 HydrophobicContact CE2-CD1 3.71Å; F922-I956 HydrophobicContact CZ-CD1 3.99Å; I950-I956 HydrophobicContact CG2-CG1 4.08Å; G953-I956 WeakPolarHBondContact O-CB 3.47Å; G953-I956 PolarHBondContact O-N 2.85Å; G953-I956 VanDerWaalsContact O-N 3.1Å; I956-L958 PolarHBondContact O-N 2.67Å; I956-L958 VanDerWaalsContact O-N 3.12Å
957	P	89.4	Confident	81.6	Confident	46 Å²	46	44.4 Å²	44.4	30%	0.299	23%	0.23	S	C	.	.			trans	-63.7	114.1	172.6	-19.1	32.1	0	0	0	110	D887 M888 C889 Q955	D887-P957 WeakPolarHBondContact O-CB 3.49Å; M888-P957 HydrophobicContact CE-CB 3.71Å; M888-P957 VanDerWaalsContact SD-C 3.58Å; M888-P957 HydrophobicContact SD-CB 3.88Å; C889-P957 PolarHBondContact N-O 2.81Å; Q955-P957 WeakPolarHBondContact O-CD 3.45Å
958	L	92.4	Very high	83.9	Confident	10 Å²	10	37.5 Å²	37.5	5%	0.052	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136	-175.6	-165	97.4	0	0	0	109.8	C889 I891 S914 I917 I956 T960 K993	C889-L958 HydrophobicContact CB-CD1 4.04Å; C889-L958 WeakPolarHBondContact O-CA 3.41Å; I891-L958 HydrophobicContact CD1-CD1 3.9Å; I891-L958 HydrophobicContact CD1-CD2 3.96Å; I891-L958 HydrophobicContact CD1-CG 4.2Å; I891-L958 HydrophobicContact CG1-CD1 4.36Å; S914-L958 WeakPolarHBondContact OG-CD2 3.22Å; I917-L958 HydrophobicContact CB-CD1 4.31Å; I917-L958 HydrophobicContact CD1-CD1 3.6Å; I917-L958 HydrophobicContact CG2-CD1 4.11Å; I956-L958 PolarHBondContact O-N 2.67Å; I956-L958 VanDerWaalsContact O-N 3.12Å; L958-T960 VanDerWaalsContact CD2-OG1 3.32Å; L958-T960 WeakPolarHBondContact CD2-OG1 3.24Å; L958-K993 WeakPolarHBondContact O-CA 3.01Å
959	L	95.1	Very high	85.6	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	113.7	172.1	179.4	58.3	0	0	0	109.8	L566 M888 C889 V890 I891 K993 F995	L566-L959 HydrophobicContact CB-CD2 4.28Å; L566-L959 HydrophobicContact CD2-CD1 4.21Å; L566-L959 HydrophobicContact CD2-CD2 3.45Å; L566-L959 VanDerWaalsContact CD2-CD2 3.45Å; L566-L959 HydrophobicContact CD2-CG 3.73Å; L566-L959 HydrophobicContact CG-CD2 4.47Å; M888-L959 HydrophobicContact SD-CB 4.03Å; C889-L959 PolarHBondContact O-N 3.11Å; V890-L959 CarbonylContact C-O 3.58Å; V890-L959 WeakPolarHBondContact CA-O 3.31Å; V890-L959 HydrophobicContact CG2-CB 4.46Å; I891-L959 PolarHBondContact N-O 3.07Å; L959-K993 CarbonylContact C-O 3.53Å; L959-K993 WeakPolarHBondContact CA-O 3.47Å; L959-F995 HydrophobicContact CD1-CB 4.22Å
960	T	95.5	Very high	87.1	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	123.6	-177.6	-53.6	0	0	0	0	110.2	I891 A910 L958 L962 L971 K993 F995	I891-T960 HydrophobicContact CB-CG2 4.34Å; A910-T960 HydrophobicContact CB-CG2 3.82Å; L958-T960 VanDerWaalsContact CD2-OG1 3.32Å; L958-T960 WeakPolarHBondContact CD2-OG1 3.24Å; T960-L962 HydrophobicContact CG2-CD2 4.15Å; T960-L971 HydrophobicContact CG2-CD2 4.19Å; T960-K993 PolarHBondContact N-O 2.92Å; T960-F995 PolarHBondContact O-N 3.42Å
961	E	94.2	Very high	88	Confident	14 Å²	14	34.3 Å²	34.3	7%	0.065	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	133.6	166.2	-176	-175.5	156.4	0	0	110.1	K562 I891 I892 F995	K562-E961 HydrophobicContact CD-CG 4.41Å; K562-E961 WeakPolarHBondContact CD-OE1 3.41Å; K562-E961 WeakPolarHBondContact CE-OE2 3.38Å; K562-E961 IonicContact NZ-OE1 2.74Å; K562-E961 PolarHBondContact NZ-OE1 3.05Å; K562-E961 IonicContact NZ-OE2 3.43Å; K562-E961 PolarHBondContact NZ-OE2 3.47Å; I891-E961 WeakPolarHBondContact O-CB 3.26Å; I891-E961 PolarHBondContact O-N 3.19Å; I892-E961 WeakPolarHBondContact CG2-OE2 3.36Å; E961-F995 WeakPolarHBondContact CA-O 3.43Å
962	L	91.5	Very high	88.6	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.5	173.9	-62	175.9	0	0	0	110.9	D907 I911 T960 V968 L971 A994 F995 A996	D907-L962 HydrophobicContact CB-CD2 4.11Å; I911-L962 HydrophobicContact CG1-CD2 4.45Å; T960-L962 HydrophobicContact CG2-CD2 4.15Å; L962-V968 HydrophobicContact CD1-CB 3.77Å; L962-V968 HydrophobicContact CD1-CG2 4.04Å; L962-L971 HydrophobicContact CD1-CD1 4.01Å; L962-A994 HydrophobicContact CD1-CB 4.17Å; L962-F995 PolarHBondContact N-O 2.88Å; L962-A996 HydrophobicContact CB-CB 4.49Å; L962-A996 WeakPolarHBondContact O-CA 3.32Å
963	V	87.4	Confident	88.3	Confident	31 Å²	31	34.6 Å²	34.6	19%	0.188	18%	0.181	C	C	.	.	S	Bend	trans	-88.6	-40.8	173.8	179.2	0	0	0	0	110.4	Y501 D907	Y501-V963 HydrophobicContact CD1-CG1 3.52Å; Y501-V963 HydrophobicContact CE1-CG1 3.37Å; Y501-V963 PolarHBondContact OH-O 2.86Å; D907-V963 VanDerWaalsContact OD1-CB 3.28Å; D907-V963 WeakPolarHBondContact OD1-CB 3.12Å; D907-V963 WeakPolarHBondContact OD1-CG2 3.28Å; D907-V963 PolarHBondContact OD1-N 2.67Å; D907-V963 PolarHBondContact OD2-N 3Å
964	N	85.7	Confident	88	Confident	39 Å²	39	38.2 Å²	38.2	21%	0.209	20%	0.2	C	C	.	.	S	Bend	trans	-109.5	127.2	-179.9	-173.2	-6.2	0	0	0	111.5	P903 D907 S966 N967	P903-N964 PolarHBondContact O-ND2 2.96Å; P903-N964 VanDerWaalsContact O-ND2 3.15Å; D907-N964 PolarHBondContact OD2-N 3.43Å; N964-S966 VanDerWaalsContact C-N 3.32Å; N964-S966 PolarHBondContact ND2-OG 3.44Å; N964-S966 PolarHBondContact O-N 2.97Å; N964-S966 PolarHBondContact OD1-N 3.19Å; N964-S966 PolarHBondContact OD1-OG 3.41Å; N964-S966 VanDerWaalsContact OD1-OG 3.12Å; N964-N967 WeakPolarHBondContact O-CB 3.4Å; N964-N967 PolarHBondContact O-N 2.85Å
965	D	87.4	Confident	87.5	Confident	36 Å²	36	35.7 Å²	35.7	19%	0.193	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-63.4	-36.2	-176.3	-68.1	3.7	0	0	0	112.2	N967 V968 L983 A996 S998	D965-N967 PolarHBondContact O-N 2.99Å; D965-N967 VanDerWaalsContact O-N 3.16Å; D965-V968 WeakPolarHBondContact O-CB 3.29Å; D965-V968 WeakPolarHBondContact O-CG1 3.26Å; D965-V968 PolarHBondContact O-N 3.45Å; D965-L983 HydrophobicContact CB-CB 4.4Å; D965-A996 WeakPolarHBondContact OD1-CB 3.32Å; D965-S998 WeakPolarHBondContact OD1-CB 3.37Å; D965-S998 PolarHBondContact OD1-OG 3.04Å; D965-S998 VanDerWaalsContact OD2-CB 3.26Å; D965-S998 WeakPolarHBondContact OD2-CB 3.31Å; D965-S998 PolarHBondContact OD2-OG 3.23Å
966	S	87.3	Confident	86.9	Confident	49 Å²	49	41.3 Å²	41.3	34%	0.343	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-66.4	-18.5	-178.6	65.4	0	0	0	0	113.4	N964 V968 Q969	N964-S966 VanDerWaalsContact C-N 3.32Å; N964-S966 PolarHBondContact ND2-OG 3.44Å; N964-S966 PolarHBondContact O-N 2.97Å; N964-S966 PolarHBondContact OD1-N 3.19Å; N964-S966 PolarHBondContact OD1-OG 3.41Å; N964-S966 VanDerWaalsContact OD1-OG 3.12Å; S966-V968 VanDerWaalsContact C-N 3.26Å; S966-V968 PolarHBondContact O-N 2.93Å; S966-Q969 WeakPolarHBondContact O-CG 3.48Å; S966-Q969 PolarHBondContact O-NE2 2.93Å
967	N	90.1	Very high	85.8	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-79.8	-8.8	-178	-75.9	-14.1	0	0	0	113.2	T904 D907 I911 N964 D965 Q969 F970	T904-N967 PolarHBondContact O-ND2 3.38Å; T904-N967 PolarHBondContact O-OD1 3.43Å; D907-N967 HydrophobicContact CB-CB 4.43Å; D907-N967 PolarHBondContact OD2-ND2 2.86Å; I911-N967 HydrophobicContact CD1-CB 4.05Å; N964-N967 WeakPolarHBondContact O-CB 3.4Å; N964-N967 PolarHBondContact O-N 2.85Å; D965-N967 PolarHBondContact O-N 2.99Å; D965-N967 VanDerWaalsContact O-N 3.16Å; N967-Q969 PolarHBondContact O-N 2.63Å; N967-F970 HydrophobicContact CB-CD2 4.28Å; N967-F970 WeakPolarHBondContact O-CD2 3.27Å; N967-F970 PolarHBondContact O-N 3.09Å
968	V	90	Very high	85.3	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.03	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-59.6	-32.9	180	71.5	0	0	0	0	112.9	L962 D965 S966 F970 L971 L983 T986 P988 A994	L962-V968 HydrophobicContact CD1-CB 3.77Å; L962-V968 HydrophobicContact CD1-CG2 4.04Å; D965-V968 WeakPolarHBondContact O-CB 3.29Å; D965-V968 WeakPolarHBondContact O-CG1 3.26Å; D965-V968 PolarHBondContact O-N 3.45Å; S966-V968 VanDerWaalsContact C-N 3.26Å; S966-V968 PolarHBondContact O-N 2.93Å; V968-F970 PolarHBondContact O-N 2.91Å; V968-L971 HydrophobicContact CG2-CD1 4.41Å; V968-L971 WeakPolarHBondContact O-CB 3.39Å; V968-L971 PolarHBondContact O-N 3.48Å; V968-L983 HydrophobicContact CB-CD1 3.87Å; V968-L983 HydrophobicContact CG1-CD1 3.91Å; V968-L983 HydrophobicContact CG2-CD1 3.91Å; V968-T986 HydrophobicContact CG1-CG2 3.67Å; V968-P988 HydrophobicContact CG2-CB 3.92Å; V968-P988 HydrophobicContact CG2-CG 4.1Å; V968-A994 HydrophobicContact CG2-CB 3.8Å
969	Q	87.4	Confident	84.5	Confident	43 Å²	43	50.4 Å²	50.4	20%	0.201	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-59.2	-26.5	179.1	69.8	-169.8	-40.7	0	0	112.9	S966 N967 L971 D977	S966-Q969 WeakPolarHBondContact O-CG 3.48Å; S966-Q969 PolarHBondContact O-NE2 2.93Å; N967-Q969 PolarHBondContact O-N 2.63Å; Q969-L971 VanDerWaalsContact C-N 3.25Å; Q969-L971 PolarHBondContact O-N 2.68Å; Q969-D977 HydrophobicContact CB-CB 4.4Å
970	F	90	Very high	83.7	Confident	102 Å²	102	56.9 Å²	56.9	45%	0.447	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-80.5	-2.2	-177.8	-55.2	-55.2	0	0	0	114.1	I911 N967 V968	I911-F970 HydrophobicContact CD1-CB 4.28Å; I911-F970 HydrophobicContact CD1-CD2 4.1Å; I911-F970 HydrophobicContact CG2-CB 3.9Å; N967-F970 HydrophobicContact CB-CD2 4.28Å; N967-F970 WeakPolarHBondContact O-CD2 3.27Å; N967-F970 PolarHBondContact O-N 3.09Å; V968-F970 PolarHBondContact O-N 2.91Å
971	L	89.8	Confident	83.1	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.016	31%	0.311	C	S	.	.	S	Bend	trans	-81.8	-46.1	-176.1	-69.4	177.1	0	0	0	113	I911 K918 T960 L962 V968 Q969 P988 A994	I911-L971 HydrophobicContact CG1-CD2 4.5Å; K918-L971 PolarHBondContact NZ-O 3.15Å; T960-L971 HydrophobicContact CG2-CD2 4.19Å; L962-L971 HydrophobicContact CD1-CD1 4.01Å; V968-L971 HydrophobicContact CG2-CD1 4.41Å; V968-L971 WeakPolarHBondContact O-CB 3.39Å; V968-L971 PolarHBondContact O-N 3.48Å; Q969-L971 VanDerWaalsContact C-N 3.25Å; Q969-L971 PolarHBondContact O-N 2.68Å; L971-P988 HydrophobicContact CB-CB 4.21Å; L971-P988 HydrophobicContact CB-CG 4.21Å; L971-P988 HydrophobicContact CD1-CB 4.16Å; L971-A994 HydrophobicContact CD1-CB 3.64Å
972	D	84.5	Confident	82.6	Confident	8 Å²	8	64.1 Å²	64.1	4%	0.043	33%	0.333	C	S	.	.			trans	-113.4	137.3	178.4	-79.9	-1	0	0	0	107.9	K918 D975 P988 K993 K1109	K918-D972 IonicContact NZ-OD1 2.66Å; K918-D972 PolarHBondContact NZ-OD1 3.32Å; D972-D975 WeakPolarHBondContact CB-OD2 3.44Å; D972-P988 HydrophobicContact CB-CG 4.18Å; D972-K993 IonicContact OD1-NZ 3.73Å; D972-K993 PolarHBondContact OD1-NZ 3.48Å; D972-K993 IonicContact OD2-NZ 2.69Å; D972-K993 PolarHBondContact OD2-NZ 3.45Å; D972-K1109 WeakPolarHBondContact OD2-CE 3.44Å; D972-K1109 IonicContact OD2-NZ 2.8Å; D972-K1109 PolarHBondContact OD2-NZ 3.01Å
973	Q	77.4	Confident	82.5	Confident	169 Å²	169	65 Å²	65	79%	0.79	34%	0.338	S	S	*	.	S	Bend	trans	-95.7	-8.8	-170.8	-66.4	-179.1	-6.5	0	0	113.4
974	D	76.8	Confident	82.5	Confident	77 Å²	77	65.1 Å²	65.1	41%	0.412	34%	0.335	S	S	.	.	S	Bend	trans	-100.8	1.1	-174.3	55.1	-57.9	0	0	0	112.9	Q987 K1109	D974-Q987 PolarHBondContact OD2-NE2 3.13Å; D974-K1109 IonicContact OD1-NZ 3.83Å; D974-K1109 PolarHBondContact OD1-NZ 2.82Å; D974-K1109 VanDerWaalsContact OD2-CE 3.24Å; D974-K1109 WeakPolarHBondContact OD2-CE 3.38Å; D974-K1109 IonicContact OD2-NZ 3.91Å; D974-K1109 PolarHBondContact OD2-NZ 3.45Å
975	D	74.7	Confident	82.7	Confident	23 Å²	23	65.7 Å²	65.7	12%	0.123	34%	0.338	C	S	.	.	S	Bend	trans	-82.9	141.9	180	-57.6	-10.3	0	0	0	109.8	D972 D977 Q987 P988 K1109	D972-D975 WeakPolarHBondContact CB-OD2 3.44Å; D975-D977 PolarHBondContact O-N 3.26Å; D975-Q987 PolarHBondContact OD1-NE2 3.43Å; D975-Q987 WeakPolarHBondContact OD2-CB 3.46Å; D975-P988 WeakPolarHBondContact OD2-CD 3.13Å; D975-P988 WeakPolarHBondContact OD2-CG 3.21Å; D975-K1109 IonicContact OD1-NZ 3.21Å
976	E	70.4	Confident	82.8	Confident	199 Å²	199	64.9 Å²	64.9	93%	0.93	34%	0.335	S	S	*	.			trans	-76.8	91.1	172	-70.2	-170.7	172.4	0	0	109.2	D978	E976-D978 PolarHBondContact O-N 3.34Å
977	D	65.7	Low	82.8	Confident	85 Å²	85	63.7 Å²	63.7	46%	0.455	32%	0.323	S	S	.	.			trans	-70.8	94.3	-172.9	-60.8	-39.6	0	0	0	113	Q969 D975	Q969-D977 HydrophobicContact CB-CB 4.4Å; D975-D977 PolarHBondContact O-N 3.26Å
978	D	77.8	Confident	82.9	Confident	81 Å²	81	63.7 Å²	63.7	43%	0.433	32%	0.323	S	S	.	.			trans	-95.6	116.7	158.1	-178.5	-3	0	0	0	109.2	E976 N980 T981	E976-D978 PolarHBondContact O-N 3.34Å; D978-N980 PolarHBondContact O-N 3.34Å; D978-N980 VanDerWaalsContact O-N 3.08Å; D978-N980 WeakPolarHBondContact OD1-CB 3.21Å; D978-N980 PolarHBondContact OD1-N 2.98Å; D978-N980 PolarHBondContact OD1-ND2 3.36Å; D978-T981 WeakPolarHBondContact O-CB 3.35Å; D978-T981 PolarHBondContact O-N 3.18Å; D978-T981 PolarHBondContact O-OG1 3.48Å
979	P	75.4	Confident	83	Confident	92 Å²	92	63.5 Å²	63.5	60%	0.597	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.1	179.2	26	-36.1	0	0	0	114	T981	P979-T981 VanDerWaalsContact C-N 3.27Å
980	N	79.1	Confident	83.2	Confident	136 Å²	136	61.4 Å²	61.4	73%	0.727	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-4.5	175	-54.8	-63.6	0	0	0	113.2	D978 E982	D978-N980 PolarHBondContact O-N 3.34Å; D978-N980 VanDerWaalsContact O-N 3.08Å; D978-N980 WeakPolarHBondContact OD1-CB 3.21Å; D978-N980 PolarHBondContact OD1-N 2.98Å; D978-N980 PolarHBondContact OD1-ND2 3.36Å; N980-E982 PolarHBondContact O-N 3.05Å
981	T	83.3	Confident	83.2	Confident	53 Å²	53	56.6 Å²	56.6	33%	0.325	29%	0.292	S	S	.	.	S	Bend	trans	-69.2	122.3	178.1	-56	0	0	0	0	109.6	D978 P979 L985 T986	D978-T981 WeakPolarHBondContact O-CB 3.35Å; D978-T981 PolarHBondContact O-N 3.18Å; D978-T981 PolarHBondContact O-OG1 3.48Å; P979-T981 VanDerWaalsContact C-N 3.27Å; T981-L985 HydrophobicContact CG2-CB 3.56Å; T981-L985 HydrophobicContact CG2-CD1 4.5Å; T981-T986 HydrophobicContact CG2-CG2 3.98Å
982	E	84	Confident	83.2	Confident	114 Å²	114	56.8 Å²	56.8	53%	0.533	29%	0.294	S	S	.	.			trans	-59.8	143.6	175.5	-64.1	-175.6	-148.6	0	0	110.7	N980 Y984 L985	N980-E982 PolarHBondContact O-N 3.05Å; E982-Y984 HydrophobicContact CB-CD1 3.87Å; E982-Y984 HydrophobicContact CB-CE1 3.86Å; E982-Y984 PolarHBondContact O-N 3.12Å; E982-Y984 WeakPolarHBondContact OE2-CE1 3.34Å; E982-L985 HydrophobicContact CB-CD1 4.48Å; E982-L985 PolarHBondContact O-N 3.42Å
983	L	87.7	Confident	83.6	Confident	19 Å²	19	58.3 Å²	58.3	10%	0.099	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-45.5	-41.5	-174.9	175	64.6	0	0	0	112.7	D965 V968 L985 T986 F989 A996 V999	D965-L983 HydrophobicContact CB-CB 4.4Å; V968-L983 HydrophobicContact CB-CD1 3.87Å; V968-L983 HydrophobicContact CG1-CD1 3.91Å; V968-L983 HydrophobicContact CG2-CD1 3.91Å; L983-L985 VanDerWaalsContact C-N 3.28Å; L983-L985 PolarHBondContact O-N 3.49Å; L983-T986 WeakPolarHBondContact O-CB 3.43Å; L983-T986 PolarHBondContact O-N 3.14Å; L983-T986 PolarHBondContact O-OG1 3.22Å; L983-F989 HydrophobicContact CD1-CB 4.45Å; L983-F989 HydrophobicContact CD1-CD2 4.24Å; L983-F989 HydrophobicContact CD2-CD2 4.23Å; L983-F989 HydrophobicContact CD2-CE2 4.27Å; L983-F989 HydrophobicContact CG-CD2 3.92Å; L983-F989 HydrophobicContact CG-CE2 4.35Å; L983-F989 HydrophobicContact CG-CG 4.34Å; L983-F989 VanDerWaalsContact O-CB 3.26Å; L983-F989 WeakPolarHBondContact O-CB 3.43Å; L983-A996 HydrophobicContact CD2-CB 3.45Å; L983-A996 VanDerWaalsContact CD2-CB 3.45Å; L983-V999 HydrophobicContact CD2-CG2 3.77Å
984	Y	88.6	Confident	84.4	Confident	33 Å²	33	50.3 Å²	50.3	13%	0.129	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-73.1	-17.3	-174.7	82.9	-90.7	0	0	0	115.6	Y601 L602 E982 F989	Y601-Y984 HydrophobicContact CE1-CD2 4.18Å; Y601-Y984 WeakPolarHBondContact CE1-O 3.41Å; Y601-Y984 PolarHBondContact OH-O 2.57Å; L602-Y984 HydrophobicContact CD2-CE2 4.1Å; E982-Y984 HydrophobicContact CB-CD1 3.87Å; E982-Y984 HydrophobicContact CB-CE1 3.86Å; E982-Y984 PolarHBondContact O-N 3.12Å; E982-Y984 WeakPolarHBondContact OE2-CE1 3.34Å; Y984-F989 VanDerWaalsContact CA-CD1 3.45Å
985	L	88.8	Confident	85.2	Confident	52 Å²	52	46.7 Å²	46.7	27%	0.272	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-87.8	-15.9	176	-65.2	173.3	0	0	0	111.5	L602 T981 E982 L983	L602-L985 HydrophobicContact CD2-CD2 3.54Å; T981-L985 HydrophobicContact CG2-CB 3.56Å; T981-L985 HydrophobicContact CG2-CD1 4.5Å; E982-L985 HydrophobicContact CB-CD1 4.48Å; E982-L985 PolarHBondContact O-N 3.42Å; L983-L985 VanDerWaalsContact C-N 3.28Å; L983-L985 PolarHBondContact O-N 3.49Å
986	T	89.5	Confident	86	Confident	19 Å²	19	45.6 Å²	45.6	12%	0.117	24%	0.238	C	C	.	.	S	Bend	trans	-69	138.8	-179.8	71.6	0	0	0	0	111.2	V968 T981 L983 P988 F989 T990	V968-T986 HydrophobicContact CG1-CG2 3.67Å; T981-T986 HydrophobicContact CG2-CG2 3.98Å; L983-T986 WeakPolarHBondContact O-CB 3.43Å; L983-T986 PolarHBondContact O-N 3.14Å; L983-T986 PolarHBondContact O-OG1 3.22Å; T986-P988 VanDerWaalsContact C-CD 3.44Å; T986-F989 WeakPolarHBondContact O-CB 3.34Å; T986-F989 PolarHBondContact O-N 3.48Å; T986-F989 WeakPolarHBondContact OG1-CB 3.46Å; T986-T990 VanDerWaalsContact O-CG2 3.27Å; T986-T990 WeakPolarHBondContact O-CG2 3.09Å; T986-T990 PolarHBondContact O-N 3.39Å
987	Q	88.2	Confident	86.8	Confident	23 Å²	23	37 Å²	37	11%	0.107	20%	0.198	C	C	.	.	H	α-helix	trans	-62.8	-35.5	-175.6	173.6	169.4	-64.1	0	0	114.4	D974 D975 F989 T990 C991 Q1100	D974-Q987 PolarHBondContact OD2-NE2 3.13Å; D975-Q987 PolarHBondContact OD1-NE2 3.43Å; D975-Q987 WeakPolarHBondContact OD2-CB 3.46Å; Q987-F989 PolarHBondContact O-N 2.69Å; Q987-T990 WeakPolarHBondContact CA-OG1 3.44Å; Q987-T990 PolarHBondContact O-N 3.23Å; Q987-T990 PolarHBondContact O-OG1 2.98Å; Q987-T990 VanDerWaalsContact O-OG1 3.05Å; Q987-C991 WeakPolarHBondContact O-CB 3.49Å; Q987-C991 PolarHBondContact O-N 3.02Å; Q987-C991 PolarHBondContact O-SG 3.48Å; Q987-Q1100 VanDerWaalsContact OE1-NE2 3.09Å
988	P	91.2	Very high	87.7	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-65.1	-32.4	176.6	-21.4	35.9	0	0	0	111.8	V968 L971 D972 D975 T986 G992 K993 A994	V968-P988 HydrophobicContact CG2-CB 3.92Å; V968-P988 HydrophobicContact CG2-CG 4.1Å; L971-P988 HydrophobicContact CB-CB 4.21Å; L971-P988 HydrophobicContact CB-CG 4.21Å; L971-P988 HydrophobicContact CD1-CB 4.16Å; D972-P988 HydrophobicContact CB-CG 4.18Å; D975-P988 WeakPolarHBondContact OD2-CD 3.13Å; D975-P988 WeakPolarHBondContact OD2-CG 3.21Å; T986-P988 VanDerWaalsContact C-CD 3.44Å; P988-G992 PolarHBondContact O-N 3.5Å; P988-K993 PolarHBondContact O-N 2.98Å; P988-A994 HydrophobicContact CB-CB 4.09Å; P988-A994 PolarHBondContact O-N 3.42Å
989	F	92.4	Very high	88.1	Confident	1 Å²	1	30.2 Å²	30.2	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-75.2	-46.2	174.7	-175.5	-87.7	0	0	0	111.8	T577 A580 N581 L983 Y984 T986 Q987 C991 G992 V999	T577-F989 WeakPolarHBondContact CB-O 2.98Å; T577-F989 HydrophobicContact CG2-CD1 3.86Å; T577-F989 HydrophobicContact CG2-CE1 3.69Å; T577-F989 HydrophobicContact CG2-CZ 4.4Å; T577-F989 WeakPolarHBondContact CG2-O 3.25Å; T577-F989 PolarHBondContact OG1-O 3.48Å; A580-F989 HydrophobicContact CB-CE2 4.36Å; A580-F989 HydrophobicContact CB-CZ 3.67Å; N581-F989 WeakPolarHBondContact OD1-CE1 3.48Å; L983-F989 HydrophobicContact CD1-CB 4.45Å; L983-F989 HydrophobicContact CD1-CD2 4.24Å; L983-F989 HydrophobicContact CD2-CD2 4.23Å; L983-F989 HydrophobicContact CD2-CE2 4.27Å; L983-F989 HydrophobicContact CG-CD2 3.92Å; L983-F989 HydrophobicContact CG-CE2 4.35Å; L983-F989 HydrophobicContact CG-CG 4.34Å; L983-F989 VanDerWaalsContact O-CB 3.26Å; L983-F989 WeakPolarHBondContact O-CB 3.43Å; Y984-F989 VanDerWaalsContact CA-CD1 3.45Å; T986-F989 WeakPolarHBondContact O-CB 3.34Å; T986-F989 PolarHBondContact O-N 3.48Å; T986-F989 WeakPolarHBondContact OG1-CB 3.46Å; Q987-F989 PolarHBondContact O-N 2.69Å; F989-C991 PolarHBondContact O-N 3.4Å; F989-G992 PolarHBondContact O-N 3.24Å; F989-V999 HydrophobicContact CE2-CG2 4.11Å; F989-V999 HydrophobicContact CZ-CG2 4.44Å
990	T	91.2	Very high	88.7	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-30.3	178.3	69.3	0	0	0	0	112.3	W597 Y601 T986 Q987 G992 F1111 V1112	W597-T990 HydrophobicContact CZ3-CG2 4.45Å; Y601-T990 HydrophobicContact CD1-CG2 3.77Å; Y601-T990 HydrophobicContact CD2-CG2 4.03Å; Y601-T990 HydrophobicContact CE1-CG2 3.44Å; Y601-T990 VanDerWaalsContact CE1-CG2 3.44Å; Y601-T990 HydrophobicContact CE2-CG2 3.78Å; Y601-T990 HydrophobicContact CG-CG2 4.04Å; Y601-T990 VanDerWaalsContact CZ-CG2 3.46Å; T986-T990 VanDerWaalsContact O-CG2 3.27Å; T986-T990 WeakPolarHBondContact O-CG2 3.09Å; T986-T990 PolarHBondContact O-N 3.39Å; Q987-T990 WeakPolarHBondContact CA-OG1 3.44Å; Q987-T990 PolarHBondContact O-N 3.23Å; Q987-T990 PolarHBondContact O-OG1 2.98Å; Q987-T990 VanDerWaalsContact O-OG1 3.05Å; T990-G992 VanDerWaalsContact C-N 3.35Å; T990-F1111 WeakPolarHBondContact O-CA 3.3Å; T990-V1112 PolarHBondContact O-N 2.92Å
991	C	89.7	Confident	88.9	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.007	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-6.2	174.9	-61.7	0	0	0	0	114.5	Q987 F989 K993 Y1097 R1110	Q987-C991 WeakPolarHBondContact O-CB 3.49Å; Q987-C991 PolarHBondContact O-N 3.02Å; Q987-C991 PolarHBondContact O-SG 3.48Å; F989-C991 PolarHBondContact O-N 3.4Å; C991-K993 VanDerWaalsContact C-N 3.31Å; C991-K993 HydrophobicContact CB-CG 4.19Å; C991-K993 PolarHBondContact O-N 2.91Å; C991-Y1097 PolarHBondContact O-OH 3.03Å; C991-R1110 WeakPolarHBondContact CA-O 3.31Å; C991-R1110 VanDerWaalsContact CB-O 3.27Å; C991-R1110 WeakPolarHBondContact CB-O 3.46Å; C991-R1110 PolarHBondContact SG-O 2.65Å; C991-R1110 VanDerWaalsContact SG-O 3.32Å
992	G	91.6	Very high	88.9	Confident	7 Å²	7	18.3 Å²	18.3	7%	0.072	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	29.9	-177.3	0	0	0	0	0	114.6	T577 P988 F989 T990	T577-G992 WeakPolarHBondContact OG1-CA 3.18Å; T577-G992 PolarHBondContact OG1-N 3.12Å; P988-G992 PolarHBondContact O-N 3.5Å; F989-G992 PolarHBondContact O-N 3.24Å; T990-G992 VanDerWaalsContact C-N 3.35Å
993	K	92.3	Very high	89.1	Confident	39 Å²	39	12.9 Å²	12.9	17%	0.17	7%	0.068	C	C	.	.	S	Bend	trans	-94.2	-18.1	172.3	-61.3	-178.7	-171.8	165.9	0	113.2	L958 L959 T960 D972 P988 C991	L958-K993 WeakPolarHBondContact O-CA 3.01Å; L959-K993 CarbonylContact C-O 3.53Å; L959-K993 WeakPolarHBondContact CA-O 3.47Å; T960-K993 PolarHBondContact N-O 2.92Å; D972-K993 IonicContact OD1-NZ 3.73Å; D972-K993 PolarHBondContact OD1-NZ 3.48Å; D972-K993 IonicContact OD2-NZ 2.69Å; D972-K993 PolarHBondContact OD2-NZ 3.45Å; P988-K993 PolarHBondContact O-N 2.98Å; C991-K993 VanDerWaalsContact C-N 3.31Å; C991-K993 HydrophobicContact CB-CG 4.19Å; C991-K993 PolarHBondContact O-N 2.91Å
994	A	93.5	Very high	89.3	Confident	1 Å²	1	12 Å²	12	1%	0.008	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.2	178.9	0	0	0	0	0	110.7	L962 V968 L971 P988	L962-A994 HydrophobicContact CD1-CB 4.17Å; V968-A994 HydrophobicContact CG2-CB 3.8Å; L971-A994 HydrophobicContact CD1-CB 3.64Å; P988-A994 HydrophobicContact CB-CB 4.09Å; P988-A994 PolarHBondContact O-N 3.42Å
995	F	94.2	Very high	89.2	Confident	1 Å²	1	10.5 Å²	10.5	0%	0.004	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	120.8	171.2	-176.8	-96.1	0	0	0	109.9	K562 I565 L566 L959 T960 E961 L962 L1000	K562-F995 HydrophobicContact CB-CE1 4.36Å; K562-F995 HydrophobicContact CG-CD1 4.33Å; K562-F995 HydrophobicContact CG-CE1 3.9Å; I565-F995 HydrophobicContact CB-CZ 4.46Å; I565-F995 HydrophobicContact CD1-CE2 4.37Å; I565-F995 HydrophobicContact CD1-CZ 4.11Å; I565-F995 HydrophobicContact CG2-CD2 4.26Å; I565-F995 HydrophobicContact CG2-CE2 3.79Å; I565-F995 HydrophobicContact CG2-CZ 4.2Å; L566-F995 HydrophobicContact CD2-CB 3.78Å; L566-F995 HydrophobicContact CD2-CD1 3.98Å; L566-F995 HydrophobicContact CD2-CG 3.97Å; L566-F995 HydrophobicContact CG-CD1 4.43Å; L959-F995 HydrophobicContact CD1-CB 4.22Å; T960-F995 PolarHBondContact O-N 3.42Å; E961-F995 WeakPolarHBondContact CA-O 3.43Å; L962-F995 PolarHBondContact N-O 2.88Å; F995-L1000 HydrophobicContact CZ-CD2 4.22Å; F995-L1000 HydrophobicContact CZ-CG 4.38Å
996	A	90.8	Very high	89.2	Confident	1 Å²	1	9 Å²	9	1%	0.008	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	150.6	176.2	0	0	0	0	0	111.8	L962 D965 L983 S998	L962-A996 HydrophobicContact CB-CB 4.49Å; L962-A996 WeakPolarHBondContact O-CA 3.32Å; D965-A996 WeakPolarHBondContact OD1-CB 3.32Å; L983-A996 HydrophobicContact CD2-CB 3.45Å; L983-A996 VanDerWaalsContact CD2-CB 3.45Å; A996-S998 VanDerWaalsContact C-N 3.32Å; A996-S998 PolarHBondContact O-N 3.32Å
997	I	87.7	Confident	89.2	Confident	17 Å²	17	8.1 Å²	8.1	9%	0.087	5%	0.045	C	C	.	.	S	Bend	trans	-75.1	-18.7	-179.6	-162.6	168.5	0	0	0	113.5	K500 L558 K562 V999 L1000	K500-I997 HydrophobicContact CD-CD1 4.5Å; K500-I997 HydrophobicContact CD-CG1 4.26Å; K500-I997 HydrophobicContact CD-CG2 4.18Å; K500-I997 PolarHBondContact NZ-O 2.89Å; L558-I997 HydrophobicContact CD1-CD1 4.49Å; K562-I997 HydrophobicContact CD-CD1 4.49Å; I997-V999 VanDerWaalsContact C-N 3.29Å; I997-V999 PolarHBondContact O-N 2.93Å; I997-L1000 HydrophobicContact CG1-CD1 4.4Å; I997-L1000 PolarHBondContact O-N 3.28Å
998	S	84.6	Confident	89.3	Confident	8 Å²	8	7.6 Å²	7.6	6%	0.056	4%	0.042	C	C	.	.	G	3₁₀ helix	trans	-59	-39.1	178.5	58.1	0	0	0	0	112.2	D965 A996 L1000 D1001	D965-S998 WeakPolarHBondContact OD1-CB 3.37Å; D965-S998 PolarHBondContact OD1-OG 3.04Å; D965-S998 VanDerWaalsContact OD2-CB 3.26Å; D965-S998 WeakPolarHBondContact OD2-CB 3.31Å; D965-S998 PolarHBondContact OD2-OG 3.23Å; A996-S998 VanDerWaalsContact C-N 3.32Å; A996-S998 PolarHBondContact O-N 3.32Å; S998-L1000 PolarHBondContact O-N 2.69Å; S998-D1001 WeakPolarHBondContact O-CB 3.45Å; S998-D1001 PolarHBondContact O-N 2.91Å
999	V	86.5	Confident	89	Confident	17 Å²	17	11 Å²	11	10%	0.103	6%	0.057	C	C	.	.	G	3₁₀ helix	trans	-53.5	-27.7	178	177.8	0	0	0	0	113.2	A580 L983 F989 I997 D1001	A580-V999 HydrophobicContact CB-CG1 3.39Å; L983-V999 HydrophobicContact CD2-CG2 3.77Å; F989-V999 HydrophobicContact CE2-CG2 4.11Å; F989-V999 HydrophobicContact CZ-CG2 4.44Å; I997-V999 VanDerWaalsContact C-N 3.29Å; I997-V999 PolarHBondContact O-N 2.93Å; V999-D1001 VanDerWaalsContact C-N 3.27Å; V999-D1001 PolarHBondContact O-N 2.82Å
1000	L	87.8	Confident	88.6	Confident	2 Å²	2	12 Å²	12	1%	0.01	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-76.6	-10.2	179.1	-59.4	-179.4	0	0	0	113.3	L558 L561 K562 I565 F995 I997 S998 S1002 L1003	L558-L1000 HydrophobicContact CD2-CB 3.81Å; L558-L1000 HydrophobicContact CD2-CD1 3.99Å; L561-L1000 HydrophobicContact CB-CD1 4.36Å; L561-L1000 HydrophobicContact CB-CD2 4.49Å; K562-L1000 HydrophobicContact CB-CD1 4.14Å; I565-L1000 HydrophobicContact CD1-CD2 4.01Å; F995-L1000 HydrophobicContact CZ-CD2 4.22Å; F995-L1000 HydrophobicContact CZ-CG 4.38Å; I997-L1000 HydrophobicContact CG1-CD1 4.4Å; I997-L1000 PolarHBondContact O-N 3.28Å; S998-L1000 PolarHBondContact O-N 2.69Å; L1000-S1002 VanDerWaalsContact C-N 3.32Å; L1000-L1003 HydrophobicContact CB-CD1 4.24Å; L1000-L1003 HydrophobicContact CD2-CD1 3.72Å; L1000-L1003 VanDerWaalsContact O-CB 3.29Å; L1000-L1003 WeakPolarHBondContact O-CB 3.47Å; L1000-L1003 PolarHBondContact O-N 3.49Å
1001	D	83.5	Confident	88	Confident	17 Å²	17	15.3 Å²	15.3	9%	0.091	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-66.7	-34.5	175.2	-76.1	-29.7	0	0	0	112.6	H410 K500 Q531 S998 V999 L1003 M1004	H410-D1001 HydrophobicContact CB-CB 4.36Å; K500-D1001 WeakPolarHBondContact CE-OD1 3.47Å; K500-D1001 WeakPolarHBondContact CE-OD2 3.4Å; K500-D1001 IonicContact NZ-OD1 3.64Å; K500-D1001 PolarHBondContact NZ-OD1 3.26Å; K500-D1001 IonicContact NZ-OD2 2.79Å; K500-D1001 PolarHBondContact NZ-OD2 2.86Å; Q531-D1001 PolarHBondContact NE2-OD1 3.41Å; S998-D1001 WeakPolarHBondContact O-CB 3.45Å; S998-D1001 PolarHBondContact O-N 2.91Å; V999-D1001 VanDerWaalsContact C-N 3.27Å; V999-D1001 PolarHBondContact O-N 2.82Å; D1001-L1003 PolarHBondContact O-N 2.92Å; D1001-M1004 WeakPolarHBondContact O-CB 3.21Å; D1001-M1004 PolarHBondContact O-N 3.48Å
1002	S	83.7	Confident	87.7	Confident	11 Å²	11	16.6 Å²	16.6	8%	0.077	9%	0.089	C	C	.	.	H	α-helix	trans	-56.7	-25.9	175.4	-48.8	0	0	0	0	112.2	D414 L1000 M1004 S1005 T1006	D414-S1002 WeakPolarHBondContact OD2-CA 3.45Å; D414-S1002 WeakPolarHBondContact OD2-CB 3.47Å; D414-S1002 PolarHBondContact OD2-OG 3.25Å; L1000-S1002 VanDerWaalsContact C-N 3.32Å; S1002-M1004 VanDerWaalsContact C-N 3.29Å; S1002-M1004 PolarHBondContact O-N 2.87Å; S1002-S1005 WeakPolarHBondContact O-CB 3.14Å; S1002-S1005 PolarHBondContact O-N 3.05Å; S1002-T1006 PolarHBondContact O-N 3.21Å; S1002-T1006 PolarHBondContact O-OG1 3.14Å
1003	L	88.7	Confident	87.4	Confident	1 Å²	1	16.4 Å²	16.4	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-65.3	-28.9	177.2	-67.4	171.8	0	0	0	113.5	I556 L561 F583 L1000 D1001 S1005 T1006 T1007 I1017	I556-L1003 HydrophobicContact CD1-CB 3.97Å; I556-L1003 HydrophobicContact CG2-CD1 4.47Å; L561-L1003 HydrophobicContact CD1-CD1 3.59Å; F583-L1003 HydrophobicContact CB-CD2 3.78Å; F583-L1003 HydrophobicContact CD1-CD2 4.48Å; F583-L1003 HydrophobicContact CD2-CD2 3.63Å; F583-L1003 HydrophobicContact CD2-CG 4.46Å; F583-L1003 HydrophobicContact CE2-CD2 4.32Å; F583-L1003 HydrophobicContact CG-CD2 3.72Å; L1000-L1003 HydrophobicContact CB-CD1 4.24Å; L1000-L1003 HydrophobicContact CD2-CD1 3.72Å; L1000-L1003 VanDerWaalsContact O-CB 3.29Å; L1000-L1003 WeakPolarHBondContact O-CB 3.47Å; L1000-L1003 PolarHBondContact O-N 3.49Å; D1001-L1003 PolarHBondContact O-N 2.92Å; L1003-S1005 VanDerWaalsContact C-N 3.27Å; L1003-S1005 PolarHBondContact O-N 3.48Å; L1003-T1006 PolarHBondContact O-N 3.27Å; L1003-T1007 WeakPolarHBondContact O-CB 3.22Å; L1003-T1007 PolarHBondContact O-N 3.18Å; L1003-T1007 PolarHBondContact O-OG1 2.93Å; L1003-I1017 HydrophobicContact CD2-CD1 3.52Å
1004	M	90	Very high	87.1	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-61	-44.8	175.1	-74.8	-63	-72.5	0	0	110.5	F411 L495 L497 I529 Q531 I556 D1001 S1002 Y1008	F411-M1004 HydrophobicContact CD2-CB 4.41Å; F411-M1004 HydrophobicContact CE2-CB 4.5Å; L495-M1004 HydrophobicContact CB-CE 3.79Å; L495-M1004 HydrophobicContact CD2-CE 4.19Å; L495-M1004 HydrophobicContact CG-CE 4.45Å; L497-M1004 HydrophobicContact CD2-CE 4.1Å; L497-M1004 HydrophobicContact CD2-CG 4.09Å; I529-M1004 HydrophobicContact CB-CE 4.27Å; I529-M1004 HydrophobicContact CG2-CE 3.88Å; I529-M1004 HydrophobicContact CG2-SD 3.77Å; Q531-M1004 HydrophobicContact CG-CE 4.27Å; Q531-M1004 HydrophobicContact CG-CG 3.86Å; Q531-M1004 HydrophobicContact CG-SD 3.4Å; Q531-M1004 WeakPolarHBondContact CG-SD 3.25Å; Q531-M1004 VanDerWaalsContact NE2-CG 3.28Å; I556-M1004 HydrophobicContact CD1-CG 4.14Å; I556-M1004 HydrophobicContact CD1-SD 3.47Å; I556-M1004 WeakPolarHBondContact CD1-SD 3.26Å; I556-M1004 HydrophobicContact CG1-SD 4.17Å; D1001-M1004 WeakPolarHBondContact O-CB 3.21Å; D1001-M1004 PolarHBondContact O-N 3.48Å; S1002-M1004 VanDerWaalsContact C-N 3.29Å; S1002-M1004 PolarHBondContact O-N 2.87Å; M1004-Y1008 PolarHBondContact O-N 2.89Å
1005	S	88.1	Confident	86.8	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-64.5	-51.6	176.6	-172.5	0	0	0	0	110.7	F415 R420 S1002 L1003 T1007 Y1008 F1009	F415-S1005 WeakPolarHBondContact CA-OG 3.48Å; R420-S1005 VanDerWaalsContact CZ-OG 3.23Å; R420-S1005 PolarHBondContact NH1-OG 2.91Å; R420-S1005 PolarHBondContact NH2-OG 3.12Å; S1002-S1005 WeakPolarHBondContact O-CB 3.14Å; S1002-S1005 PolarHBondContact O-N 3.05Å; L1003-S1005 VanDerWaalsContact C-N 3.27Å; L1003-S1005 PolarHBondContact O-N 3.48Å; S1005-T1007 PolarHBondContact O-N 3.22Å; S1005-Y1008 PolarHBondContact O-N 2.96Å; S1005-F1009 WeakPolarHBondContact O-CD2 3.5Å; S1005-F1009 PolarHBondContact O-N 3.33Å
1006	T	87.4	Confident	86.4	Confident	20 Å²	20	17.7 Å²	17.7	12%	0.123	10%	0.098	C	C	.	.	H	α-helix	trans	-63.8	-37.4	-178.5	-61.6	0	0	0	0	113	F583 S1002 L1003 F1009 N1010 A1013	F583-T1006 PolarHBondContact O-OG1 3.27Å; S1002-T1006 PolarHBondContact O-N 3.21Å; S1002-T1006 PolarHBondContact O-OG1 3.14Å; L1003-T1006 PolarHBondContact O-N 3.27Å; T1006-F1009 PolarHBondContact O-N 3.5Å; T1006-N1010 PolarHBondContact O-N 3.43Å; T1006-A1013 HydrophobicContact CG2-CB 3.96Å
1007	T	89.5	Confident	86.3	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.006	10%	0.098	C	C	.	.	H	α-helix	trans	-67.6	-38	177.2	-53.7	0	0	0	0	111.5	R527 I529 D554 L1003 S1005 N1010 L1014	R527-T1007 PolarHBondContact NH2-O 3.45Å; I529-T1007 HydrophobicContact CD1-CG2 4Å; I529-T1007 HydrophobicContact CG2-CG2 4.24Å; D554-T1007 HydrophobicContact CB-CG2 3.65Å; D554-T1007 WeakPolarHBondContact OD2-CG2 3.4Å; L1003-T1007 WeakPolarHBondContact O-CB 3.22Å; L1003-T1007 PolarHBondContact O-N 3.18Å; L1003-T1007 PolarHBondContact O-OG1 2.93Å; S1005-T1007 PolarHBondContact O-N 3.22Å; T1007-N1010 CarbonylContact O-C 3.58Å; T1007-L1014 HydrophobicContact CG2-CB 4.05Å; T1007-L1014 HydrophobicContact CG2-CD2 3.99Å
1008	Y	90.2	Very high	86.4	Confident	12 Å²	12	18.9 Å²	18.9	5%	0.047	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-43.5	176.7	170.6	-103.9	0	0	0	112.5	I397 F415 D492 A493 R527 M1004 S1005	I397-Y1008 HydrophobicContact CG2-CD2 4.3Å; I397-Y1008 HydrophobicContact CG2-CE1 4.32Å; I397-Y1008 HydrophobicContact CG2-CE2 3.55Å; F415-Y1008 AromaticContact CE2-CD1 3.46Å; F415-Y1008 HydrophobicContact CE2-CD1 3.46Å; F415-Y1008 VanDerWaalsContact CE2-CD1 3.46Å; F415-Y1008 AromaticContact CE2-CE1 3.82Å; F415-Y1008 HydrophobicContact CE2-CE1 3.82Å; F415-Y1008 HydrophobicContact CE2-CG 4.22Å; F415-Y1008 AromaticContact CZ-CD1 3.94Å; F415-Y1008 HydrophobicContact CZ-CD1 3.94Å; F415-Y1008 AromaticContact CZ-CE1 3.77Å; F415-Y1008 HydrophobicContact CZ-CE1 3.77Å; D492-Y1008 PolarHBondContact OD2-OH 2.62Å; A493-Y1008 HydrophobicContact CB-CD2 3.78Å; A493-Y1008 HydrophobicContact CB-CE2 3.73Å; R527-Y1008 PolarHBondContact NH1-O 2.97Å; M1004-Y1008 PolarHBondContact O-N 2.89Å; S1005-Y1008 PolarHBondContact O-N 2.96Å
1009	F	86.4	Confident	86.4	Confident	73 Å²	73	20.5 Å²	20.5	32%	0.32	11%	0.111	S	C	.	.	H	α-helix	trans	-79	-28.8	179.5	-76.7	-86.6	0	0	0	113.3	F415 R420 V423 S1005 T1006	F415-F1009 AromaticContact CD2-CE2 3.91Å; F415-F1009 HydrophobicContact CD2-CE2 3.91Å; F415-F1009 HydrophobicContact CE2-CD2 4.5Å; F415-F1009 AromaticContact CE2-CE2 3.59Å; F415-F1009 HydrophobicContact CE2-CE2 3.59Å; F415-F1009 HydrophobicContact CE2-CZ 4.27Å; F415-F1009 AromaticContact CZ-CE2 3.98Å; F415-F1009 HydrophobicContact CZ-CE2 3.98Å; F415-F1009 HydrophobicContact CZ-CZ 4.19Å; R420-F1009 VanDerWaalsContact CZ-CE2 3.41Å; V423-F1009 HydrophobicContact CB-CE1 3.98Å; V423-F1009 HydrophobicContact CB-CZ 4.38Å; V423-F1009 HydrophobicContact CG1-CE1 3.88Å; V423-F1009 HydrophobicContact CG1-CZ 4.27Å; V423-F1009 HydrophobicContact CG2-CE1 3.64Å; V423-F1009 HydrophobicContact CG2-CZ 4.45Å; S1005-F1009 WeakPolarHBondContact O-CD2 3.5Å; S1005-F1009 PolarHBondContact O-N 3.33Å; T1006-F1009 PolarHBondContact O-N 3.5Å
1010	N	82.7	Confident	86.4	Confident	22 Å²	22	20.7 Å²	20.7	12%	0.118	11%	0.111	C	C	.	.			trans	-139.4	96.1	-178.1	-170	-7.8	0	0	0	112.2	T611 T1006 T1007 S1012 A1013	T611-N1010 WeakPolarHBondContact CG2-ND2 3.45Å; T611-N1010 PolarHBondContact OG1-ND2 3.34Å; T611-N1010 PolarHBondContact OG1-OD1 2.87Å; T1006-N1010 PolarHBondContact O-N 3.43Å; T1007-N1010 CarbonylContact O-C 3.58Å; N1010-S1012 PolarHBondContact O-N 3.34Å; N1010-S1012 PolarHBondContact OD1-N 2.96Å; N1010-A1013 HydrophobicContact CB-CB 3.89Å; N1010-A1013 WeakPolarHBondContact O-CB 3.24Å; N1010-A1013 PolarHBondContact O-N 2.99Å; N1010-A1013 PolarHBondContact OD1-N 3Å
1011	D	80.2	Confident	86.4	Confident	69 Å²	69	20.6 Å²	20.6	37%	0.369	11%	0.11	S	C	.	.	H	α-helix	trans	-57.8	-33	-179.6	-52.7	13.2	0	0	0	112.1	R527	R527-D1011 VanDerWaalsContact CZ-CG 3.47Å; R527-D1011 IonicContact CZ-OD1 2.57Å; R527-D1011 IonicContact CZ-OD2 2.97Å; R527-D1011 IonicContact NH1-OD1 2.73Å; R527-D1011 PolarHBondContact NH1-OD1 2.93Å; R527-D1011 IonicContact NH1-OD2 2.82Å; R527-D1011 VanDerWaalsContact NH2-CG 3.29Å; R527-D1011 IonicContact NH2-OD1 3.87Å; R527-D1011 PolarHBondContact NH2-OD1 3.27Å; R527-D1011 IonicContact NH2-OD2 2.84Å
1012	S	83	Confident	86.6	Confident	28 Å²	28	20.3 Å²	20.3	20%	0.196	11%	0.109	C	C	.	.	H	α-helix	trans	-81.2	-17.8	-178.9	-54.5	0	0	0	0	113.3	N1010 T1015 L1016	N1010-S1012 PolarHBondContact O-N 3.34Å; N1010-S1012 PolarHBondContact OD1-N 2.96Å; S1012-T1015 PolarHBondContact O-N 2.82Å; S1012-L1016 PolarHBondContact O-N 3.44Å
1013	A	84.5	Confident	86.1	Confident	3 Å²	3	20.2 Å²	20.2	3%	0.025	11%	0.11	C	C	.	.	H	α-helix	trans	-62	-50.7	-179.3	0	0	0	0	0	110.6	T1006 N1010 T1015 L1016 I1017	T1006-A1013 HydrophobicContact CG2-CB 3.96Å; N1010-A1013 HydrophobicContact CB-CB 3.89Å; N1010-A1013 WeakPolarHBondContact O-CB 3.24Å; N1010-A1013 PolarHBondContact O-N 2.99Å; N1010-A1013 PolarHBondContact OD1-N 3Å; A1013-T1015 VanDerWaalsContact C-N 3.26Å; A1013-T1015 PolarHBondContact O-N 2.73Å; A1013-L1016 WeakPolarHBondContact O-CB 3.42Å; A1013-L1016 PolarHBondContact O-N 3.39Å; A1013-L1016 VanDerWaalsContact O-N 3.08Å; A1013-I1017 WeakPolarHBondContact O-CG1 3.37Å; A1013-I1017 PolarHBondContact O-N 3.11Å
1014	L	87.2	Confident	85.3	Confident	3 Å²	3	20.5 Å²	20.5	2%	0.016	11%	0.113	C	C	.	.	H	α-helix	trans	-58.2	-40.2	179.2	-176.6	63.6	0	0	0	111.9	D554 I556 L561 T1007 L1016 I1017 R1018	D554-L1014 HydrophobicContact CB-CD2 3.9Å; I556-L1014 HydrophobicContact CG1-CD1 4.49Å; I556-L1014 HydrophobicContact CG1-CD2 4.02Å; L561-L1014 HydrophobicContact CD1-CD1 4.19Å; T1007-L1014 HydrophobicContact CG2-CB 4.05Å; T1007-L1014 HydrophobicContact CG2-CD2 3.99Å; L1014-L1016 PolarHBondContact O-N 2.82Å; L1014-I1017 PolarHBondContact O-N 3.27Å; L1014-R1018 HydrophobicContact CD1-CG 4.24Å; L1014-R1018 HydrophobicContact CG-CG 4.34Å; L1014-R1018 WeakPolarHBondContact O-CB 3.41Å; L1014-R1018 WeakPolarHBondContact O-CG 3.42Å; L1014-R1018 PolarHBondContact O-N 3.37Å
1015	T	85.7	Confident	84.6	Confident	65 Å²	65	21.1 Å²	21.1	40%	0.399	12%	0.119	S	C	.	.	H	α-helix	trans	-64.3	-41	177.7	-56.1	0	0	0	0	111.7	I653 S1012 A1013 T1019	I653-T1015 HydrophobicContact CD1-CG2 3.73Å; S1012-T1015 PolarHBondContact O-N 2.82Å; A1013-T1015 VanDerWaalsContact C-N 3.26Å; A1013-T1015 PolarHBondContact O-N 2.73Å; T1015-T1019 WeakPolarHBondContact O-CB 3.47Å; T1015-T1019 PolarHBondContact O-N 2.97Å; T1015-T1019 PolarHBondContact O-OG1 3.14Å
1016	L	87.2	Confident	84.2	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-60.3	-48.6	173.8	-179.3	74.4	0	0	0	110.8	I609 A640 I653 I655 F670 S1012 A1013 L1014 R1018 T1019 F1020	I609-L1016 HydrophobicContact CD1-CD2 4.42Å; I609-L1016 HydrophobicContact CG2-CD2 3.84Å; A640-L1016 HydrophobicContact CB-CD1 3.82Å; I653-L1016 HydrophobicContact CD1-CB 4.4Å; I653-L1016 HydrophobicContact CG2-CD1 3.58Å; I655-L1016 HydrophobicContact CD1-CD1 4.42Å; I655-L1016 HydrophobicContact CG1-CD1 4Å; F670-L1016 HydrophobicContact CB-CD2 4.16Å; F670-L1016 HydrophobicContact CD1-CB 4.27Å; F670-L1016 HydrophobicContact CD1-CD1 4.26Å; F670-L1016 HydrophobicContact CD1-CD2 3.68Å; F670-L1016 HydrophobicContact CD1-CG 4.28Å; F670-L1016 HydrophobicContact CE1-CB 4.15Å; F670-L1016 HydrophobicContact CE1-CD2 4.4Å; F670-L1016 HydrophobicContact CG-CD1 4.23Å; F670-L1016 HydrophobicContact CG-CD2 4.12Å; S1012-L1016 PolarHBondContact O-N 3.44Å; A1013-L1016 WeakPolarHBondContact O-CB 3.42Å; A1013-L1016 PolarHBondContact O-N 3.39Å; A1013-L1016 VanDerWaalsContact O-N 3.08Å; L1014-L1016 PolarHBondContact O-N 2.82Å; L1016-R1018 PolarHBondContact O-N 3.01Å; L1016-T1019 WeakPolarHBondContact O-CB 3.3Å; L1016-T1019 PolarHBondContact O-N 3.08Å; L1016-T1019 VanDerWaalsContact O-N 3.15Å; L1016-F1020 HydrophobicContact CD1-CD2 4.02Å; L1016-F1020 HydrophobicContact CD1-CE2 3.71Å; L1016-F1020 HydrophobicContact CD2-CE2 4.22Å; L1016-F1020 HydrophobicContact CG-CD2 3.85Å; L1016-F1020 HydrophobicContact CG-CE2 3.83Å; L1016-F1020 WeakPolarHBondContact O-CD2 3.49Å; L1016-F1020 PolarHBondContact O-N 3.46Å
1017	I	88.9	Confident	83.8	Confident	2 Å²	2	25 Å²	25	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-60.3	-49.3	-178.4	-62.6	171.4	0	0	0	110.6	L561 F583 L1003 A1013 L1014 T1019 F1020 V1021	L561-I1017 HydrophobicContact CD2-CG2 4.14Å; F583-I1017 HydrophobicContact CD1-CD1 3.35Å; F583-I1017 HydrophobicContact CD1-CG1 3.97Å; F583-I1017 HydrophobicContact CD2-CD1 4Å; F583-I1017 HydrophobicContact CE1-CB 4.37Å; F583-I1017 HydrophobicContact CE1-CD1 3.13Å; F583-I1017 HydrophobicContact CE1-CG1 3.19Å; F583-I1017 HydrophobicContact CE1-CG2 4.41Å; F583-I1017 HydrophobicContact CE2-CD1 3.79Å; F583-I1017 HydrophobicContact CE2-CG1 4.06Å; F583-I1017 HydrophobicContact CE2-CG2 3.77Å; F583-I1017 HydrophobicContact CG-CD1 3.79Å; F583-I1017 HydrophobicContact CZ-CB 3.97Å; F583-I1017 HydrophobicContact CZ-CD1 3.35Å; F583-I1017 HydrophobicContact CZ-CG1 3.23Å; F583-I1017 HydrophobicContact CZ-CG2 3.56Å; L1003-I1017 HydrophobicContact CD2-CD1 3.52Å; A1013-I1017 WeakPolarHBondContact O-CG1 3.37Å; A1013-I1017 PolarHBondContact O-N 3.11Å; L1014-I1017 PolarHBondContact O-N 3.27Å; I1017-T1019 PolarHBondContact O-N 3.22Å; I1017-F1020 WeakPolarHBondContact O-CB 3.21Å; I1017-F1020 PolarHBondContact O-N 3.16Å; I1017-V1021 HydrophobicContact CG2-CG2 4.01Å; I1017-V1021 VanDerWaalsContact O-CB 3.25Å; I1017-V1021 WeakPolarHBondContact O-CB 3.4Å; I1017-V1021 VanDerWaalsContact O-CG2 3.23Å; I1017-V1021 WeakPolarHBondContact O-CG2 3.45Å; I1017-V1021 PolarHBondContact O-N 3.27Å
1018	R	88.5	Confident	83.3	Confident	40 Å²	40	29.7 Å²	29.7	15%	0.151	17%	0.165	C	C	.	.	H	α-helix	trans	-58.9	-39.8	177.4	-70.4	180	69.3	-146.9	-17.1	111.2	E560 L561 L1014 L1016 V1021 T1022 E1030	E560-R1018 IonicContact OE1-CZ 3.82Å; E560-R1018 IonicContact OE1-NE 3.95Å; E560-R1018 PolarHBondContact OE1-NE 3.32Å; E560-R1018 IonicContact OE1-NH2 3.9Å; E560-R1018 PolarHBondContact OE1-NH2 3.16Å; E560-R1018 IonicContact OE2-NE 2.95Å; E560-R1018 IonicContact OE2-NH2 3.75Å; L561-R1018 HydrophobicContact CD2-CG 4.02Å; L1014-R1018 HydrophobicContact CD1-CG 4.24Å; L1014-R1018 HydrophobicContact CG-CG 4.34Å; L1014-R1018 WeakPolarHBondContact O-CB 3.41Å; L1014-R1018 WeakPolarHBondContact O-CG 3.42Å; L1014-R1018 PolarHBondContact O-N 3.37Å; L1016-R1018 PolarHBondContact O-N 3.01Å; R1018-V1021 PolarHBondContact O-N 3.35Å; R1018-T1022 WeakPolarHBondContact O-CB 3.46Å; R1018-T1022 WeakPolarHBondContact O-CG2 3.31Å; R1018-T1022 PolarHBondContact O-N 3.47Å; R1018-T1022 PolarHBondContact O-OG1 2.92Å; R1018-E1030 IonicContact CZ-OE1 3.28Å; R1018-E1030 IonicContact CZ-OE2 2.75Å; R1018-E1030 IonicContact NH1-OE1 2.82Å; R1018-E1030 IonicContact NH1-OE2 3.83Å; R1018-E1030 PolarHBondContact NH1-OE2 3.25Å; R1018-E1030 IonicContact NH2-OE1 2.6Å; R1018-E1030 PolarHBondContact NH2-OE1 3.39Å; R1018-E1030 IonicContact NH2-OE2 2.68Å; R1018-E1030 PolarHBondContact NH2-OE2 3.21Å
1019	T	85.9	Confident	83	Confident	42 Å²	42	29.2 Å²	29.2	26%	0.258	16%	0.164	S	C	.	.	H	α-helix	trans	-64.3	-44.3	176.8	-54.3	0	0	0	0	111.9	I655 T1015 L1016 I1017 G1024	I655-T1019 HydrophobicContact CD1-CG2 3.81Å; T1015-T1019 WeakPolarHBondContact O-CB 3.47Å; T1015-T1019 PolarHBondContact O-N 2.97Å; T1015-T1019 PolarHBondContact O-OG1 3.14Å; L1016-T1019 WeakPolarHBondContact O-CB 3.3Å; L1016-T1019 PolarHBondContact O-N 3.08Å; L1016-T1019 VanDerWaalsContact O-N 3.15Å; I1017-T1019 PolarHBondContact O-N 3.22Å; T1019-G1024 PolarHBondContact O-N 3.14Å
1020	F	85	Confident	82.9	Confident	22 Å²	22	26.6 Å²	26.6	10%	0.096	15%	0.152	C	C	.	.	H	α-helix	trans	-62.4	-45.1	174.6	-93.7	-76.9	0	0	0	112.9	M579 L639 I655 L1016 I1017 L1141	M579-F1020 HydrophobicContact CE-CB 4.14Å; M579-F1020 HydrophobicContact CE-CG 4.3Å; L639-F1020 HydrophobicContact CD1-CE2 4.47Å; L639-F1020 HydrophobicContact CD1-CZ 4.27Å; I655-F1020 HydrophobicContact CB-CZ 4.37Å; I655-F1020 HydrophobicContact CD1-CB 4.38Å; I655-F1020 HydrophobicContact CD1-CD1 3.96Å; I655-F1020 HydrophobicContact CD1-CD2 3.4Å; I655-F1020 HydrophobicContact CD1-CE1 4.05Å; I655-F1020 HydrophobicContact CD1-CE2 3.51Å; I655-F1020 HydrophobicContact CD1-CG 3.63Å; I655-F1020 HydrophobicContact CD1-CZ 3.84Å; I655-F1020 HydrophobicContact CG1-CD2 4.16Å; I655-F1020 HydrophobicContact CG1-CE2 3.78Å; I655-F1020 HydrophobicContact CG1-CZ 4.02Å; I655-F1020 HydrophobicContact CG2-CE1 3.76Å; I655-F1020 HydrophobicContact CG2-CE2 4.09Å; I655-F1020 HydrophobicContact CG2-CZ 3.43Å; I655-F1020 VanDerWaalsContact CG2-CZ 3.43Å; L1016-F1020 HydrophobicContact CD1-CD2 4.02Å; L1016-F1020 HydrophobicContact CD1-CE2 3.71Å; L1016-F1020 HydrophobicContact CD2-CE2 4.22Å; L1016-F1020 HydrophobicContact CG-CD2 3.85Å; L1016-F1020 HydrophobicContact CG-CE2 3.83Å; L1016-F1020 WeakPolarHBondContact O-CD2 3.49Å; L1016-F1020 PolarHBondContact O-N 3.46Å; I1017-F1020 WeakPolarHBondContact O-CB 3.21Å; I1017-F1020 PolarHBondContact O-N 3.16Å; F1020-L1141 HydrophobicContact CE1-CD1 3.97Å; F1020-L1141 HydrophobicContact CE1-CD2 3.81Å; F1020-L1141 HydrophobicContact CZ-CD1 4.1Å
1021	V	89	Confident	82.8	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-81	-47.4	-168.4	169.4	0	0	0	0	111.7	G564 I565 Q568 I1017 R1018 G1023	G564-V1021 VanDerWaalsContact CA-CG1 3.41Å; I565-V1021 HydrophobicContact CG1-CG1 4.1Å; I565-V1021 HydrophobicContact CG1-CG2 3.77Å; Q568-V1021 WeakPolarHBondContact CG-O 3.44Å; Q568-V1021 PolarHBondContact NE2-O 3.41Å; I1017-V1021 HydrophobicContact CG2-CG2 4.01Å; I1017-V1021 VanDerWaalsContact O-CB 3.25Å; I1017-V1021 WeakPolarHBondContact O-CB 3.4Å; I1017-V1021 VanDerWaalsContact O-CG2 3.23Å; I1017-V1021 WeakPolarHBondContact O-CG2 3.45Å; I1017-V1021 PolarHBondContact O-N 3.27Å; R1018-V1021 PolarHBondContact O-N 3.35Å; V1021-G1023 VanDerWaalsContact C-N 3.3Å; V1021-G1023 PolarHBondContact O-N 3.32Å
1022	T	86.6	Confident	83	Confident	10 Å²	10	27.3 Å²	27.3	6%	0.061	16%	0.158	C	C	.	.	H	α-helix	trans	-81.2	-7.5	-172.2	64.2	0	0	0	0	114.1	E560 R1018 G1024 A1025	E560-T1022 HydrophobicContact CG-CG2 4.04Å; R1018-T1022 WeakPolarHBondContact O-CB 3.46Å; R1018-T1022 WeakPolarHBondContact O-CG2 3.31Å; R1018-T1022 PolarHBondContact O-N 3.47Å; R1018-T1022 PolarHBondContact O-OG1 2.92Å; T1022-G1024 VanDerWaalsContact C-N 3.32Å; T1022-G1024 PolarHBondContact OG1-N 2.93Å; T1022-A1025 HydrophobicContact CG2-CB 4.32Å; T1022-A1025 WeakPolarHBondContact OG1-CB 3.46Å; T1022-A1025 PolarHBondContact OG1-N 3Å
1023	G	74.3	Confident	83	Confident	9 Å²	9	27 Å²	27	9%	0.093	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	34.5	-169.7	0	0	0	0	0	111.9	V1021 R1054	V1021-G1023 VanDerWaalsContact C-N 3.3Å; V1021-G1023 PolarHBondContact O-N 3.32Å; G1023-R1054 PolarHBondContact O-NH1 2.97Å; G1023-R1054 PolarHBondContact O-NH2 2.89Å; G1023-R1054 VanDerWaalsContact O-NH2 3.09Å
1024	G	70.8	Confident	82.6	Confident	7 Å²	7	28.1 Å²	28.1	7%	0.072	16%	0.163	C	C	.	.			trans	72.2	57.3	177.4	0	0	0	0	0	115.3	T1019 T1022 T1026 R1054	T1019-G1024 PolarHBondContact O-N 3.14Å; T1022-G1024 VanDerWaalsContact C-N 3.32Å; T1022-G1024 PolarHBondContact OG1-N 2.93Å; G1024-T1026 PolarHBondContact O-N 3.29Å; G1024-T1026 VanDerWaalsContact O-N 3.14Å; G1024-R1054 PolarHBondContact O-NH1 3.14Å
1025	A	75	Confident	82.2	Confident	15 Å²	15	35.5 Å²	35.5	12%	0.124	20%	0.198	C	C	.	.			trans	-64.6	103.9	160.4	0	0	0	0	0	109.5	T1022	T1022-A1025 HydrophobicContact CG2-CB 4.32Å; T1022-A1025 WeakPolarHBondContact OG1-CB 3.46Å; T1022-A1025 PolarHBondContact OG1-N 3Å
1026	T	79.5	Confident	81.5	Confident	31 Å²	31	35.6 Å²	35.6	19%	0.19	21%	0.212	C	C	.	.			trans	-76.2	155.2	179.1	54.9	0	0	0	0	111	M780 G1024 E1028 L1029 E1030	M780-T1026 HydrophobicContact CE-CG2 3.42Å; M780-T1026 VanDerWaalsContact CE-CG2 3.42Å; G1024-T1026 PolarHBondContact O-N 3.29Å; G1024-T1026 VanDerWaalsContact O-N 3.14Å; T1026-E1028 PolarHBondContact O-N 2.94Å; T1026-L1029 WeakPolarHBondContact O-CB 3.21Å; T1026-L1029 PolarHBondContact O-N 3.06Å; T1026-L1029 PolarHBondContact OG1-N 3.18Å; T1026-E1030 PolarHBondContact O-N 3.25Å
1027	P	78.9	Confident	80.5	Confident	70 Å²	70	36.2 Å²	36.2	46%	0.455	22%	0.218	S	C	.	.	H	α-helix	trans	-53.5	-33.7	169.6	-26.1	34.8	0	0	0	112.7	L1029 E1030 V1031	P1027-L1029 VanDerWaalsContact C-N 3.33Å; P1027-L1029 PolarHBondContact O-N 2.91Å; P1027-E1030 PolarHBondContact O-N 3.47Å; P1027-E1030 VanDerWaalsContact O-N 3.13Å; P1027-V1031 WeakPolarHBondContact O-CG2 3.18Å; P1027-V1031 PolarHBondContact O-N 3.44Å
1028	E	79.8	Confident	79.9	Confident	100 Å²	100	40.4 Å²	40.4	47%	0.467	24%	0.24	S	C	.	.	H	α-helix	trans	-55.2	-45.6	172.5	-178.2	-175.7	-167.9	0	0	111.8	T778 T1026 V1031 I1032 K1051	T778-E1028 HydrophobicContact CG2-CG 4.47Å; T1026-E1028 PolarHBondContact O-N 2.94Å; E1028-V1031 PolarHBondContact O-N 3.48Å; E1028-I1032 HydrophobicContact CG-CD1 4.44Å; E1028-I1032 WeakPolarHBondContact O-CG1 3.34Å; E1028-I1032 PolarHBondContact O-N 2.92Å; E1028-K1051 IonicContact OE2-NZ 3.45Å; E1028-K1051 PolarHBondContact OE2-NZ 3.03Å
1029	L	84.4	Confident	79.6	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-64.7	-42.6	175.9	-177.3	60.5	0	0	0	110.8	T778 F781 M828 T1026 P1027 V1031 I1032 L1033 L1039	T778-L1029 HydrophobicContact CG2-CB 4.17Å; T778-L1029 HydrophobicContact CG2-CD1 4.16Å; F781-L1029 HydrophobicContact CD2-CD2 4.02Å; F781-L1029 HydrophobicContact CE2-CD2 3.5Å; M828-L1029 HydrophobicContact CE-CD2 4.46Å; M828-L1029 HydrophobicContact SD-CD2 4.34Å; T1026-L1029 WeakPolarHBondContact O-CB 3.21Å; T1026-L1029 PolarHBondContact O-N 3.06Å; T1026-L1029 PolarHBondContact OG1-N 3.18Å; P1027-L1029 VanDerWaalsContact C-N 3.33Å; P1027-L1029 PolarHBondContact O-N 2.91Å; L1029-V1031 VanDerWaalsContact C-N 3.29Å; L1029-V1031 PolarHBondContact O-N 2.63Å; L1029-I1032 WeakPolarHBondContact O-CB 3.39Å; L1029-I1032 PolarHBondContact O-N 2.93Å; L1029-I1032 VanDerWaalsContact O-N 3.16Å; L1029-L1033 HydrophobicContact CD1-CD1 4.37Å; L1029-L1033 HydrophobicContact CD1-CD2 4.41Å; L1029-L1033 HydrophobicContact CD1-CG 4.29Å; L1029-L1033 HydrophobicContact CG-CD1 4.05Å; L1029-L1033 HydrophobicContact CG-CG 4.38Å; L1029-L1033 VanDerWaalsContact O-CG 3.25Å; L1029-L1033 WeakPolarHBondContact O-CG 3.31Å; L1029-L1033 PolarHBondContact O-N 3.38Å; L1029-L1039 HydrophobicContact CD1-CD2 4.2Å
1030	E	83	Confident	79.5	Confident	18 Å²	18	43.5 Å²	43.5	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-59.8	-39.9	179.8	-54.9	-157.6	115.8	0	0	112.5	K538 L542 R1018 T1026 P1027 L1033 A1034	K538-E1030 WeakPolarHBondContact CE-OE1 3.14Å; K538-E1030 IonicContact NZ-OE1 3.31Å; K538-E1030 PolarHBondContact NZ-OE1 3.17Å; K538-E1030 IonicContact NZ-OE2 3.73Å; L542-E1030 HydrophobicContact CD1-CB 4.31Å; R1018-E1030 IonicContact CZ-OE1 3.28Å; R1018-E1030 IonicContact CZ-OE2 2.75Å; R1018-E1030 IonicContact NH1-OE1 2.82Å; R1018-E1030 IonicContact NH1-OE2 3.83Å; R1018-E1030 PolarHBondContact NH1-OE2 3.25Å; R1018-E1030 IonicContact NH2-OE1 2.6Å; R1018-E1030 PolarHBondContact NH2-OE1 3.39Å; R1018-E1030 IonicContact NH2-OE2 2.68Å; R1018-E1030 PolarHBondContact NH2-OE2 3.21Å; T1026-E1030 PolarHBondContact O-N 3.25Å; P1027-E1030 PolarHBondContact O-N 3.47Å; P1027-E1030 VanDerWaalsContact O-N 3.13Å; E1030-L1033 PolarHBondContact O-N 2.72Å; E1030-A1034 VanDerWaalsContact O-CB 3.31Å; E1030-A1034 WeakPolarHBondContact O-CB 3.43Å; E1030-A1034 PolarHBondContact O-N 3.4Å
1031	V	82.2	Confident	79.4	Confident	71 Å²	71	43 Å²	43	43%	0.43	25%	0.254	S	S	.	.	H	α-helix	trans	-63.7	-44.9	175.6	175.2	0	0	0	0	110.9	P1027 E1028 L1029 L1033 A1034 E1035	P1027-V1031 WeakPolarHBondContact O-CG2 3.18Å; P1027-V1031 PolarHBondContact O-N 3.44Å; E1028-V1031 PolarHBondContact O-N 3.48Å; L1029-V1031 VanDerWaalsContact C-N 3.29Å; L1029-V1031 PolarHBondContact O-N 2.63Å; V1031-L1033 PolarHBondContact O-N 2.77Å; V1031-A1034 PolarHBondContact O-N 3.03Å; V1031-A1034 VanDerWaalsContact O-N 3.12Å; V1031-E1035 WeakPolarHBondContact O-CG 3.4Å; V1031-E1035 PolarHBondContact O-N 2.67Å
1032	I	84.1	Confident	79.1	Confident	34 Å²	34	43.8 Å²	43.8	17%	0.174	26%	0.26	C	S	.	.	H	α-helix	trans	-57.9	-40.3	177.4	-67.3	166.1	0	0	0	111	T778 E1028 L1029 G1037	T778-I1032 HydrophobicContact CG2-CD1 3.96Å; E1028-I1032 HydrophobicContact CG-CD1 4.44Å; E1028-I1032 WeakPolarHBondContact O-CG1 3.34Å; E1028-I1032 PolarHBondContact O-N 2.92Å; L1029-I1032 WeakPolarHBondContact O-CB 3.39Å; L1029-I1032 PolarHBondContact O-N 2.93Å; L1029-I1032 VanDerWaalsContact O-N 3.16Å; I1032-G1037 WeakPolarHBondContact O-CA 3.35Å; I1032-G1037 PolarHBondContact O-N 3.06Å
1033	L	82.2	Confident	78.8	Confident	23 Å²	23	46 Å²	46	12%	0.12	28%	0.275	C	S	.	.	H	α-helix	trans	-74.2	-35	178.9	-57.3	175.3	0	0	0	112.1	Y535 L1029 E1030 V1031 E1035 G1036 G1037	Y535-L1033 HydrophobicContact CE1-CD1 3.96Å; L1029-L1033 HydrophobicContact CD1-CD1 4.37Å; L1029-L1033 HydrophobicContact CD1-CD2 4.41Å; L1029-L1033 HydrophobicContact CD1-CG 4.29Å; L1029-L1033 HydrophobicContact CG-CD1 4.05Å; L1029-L1033 HydrophobicContact CG-CG 4.38Å; L1029-L1033 VanDerWaalsContact O-CG 3.25Å; L1029-L1033 WeakPolarHBondContact O-CG 3.31Å; L1029-L1033 PolarHBondContact O-N 3.38Å; E1030-L1033 PolarHBondContact O-N 2.72Å; V1031-L1033 PolarHBondContact O-N 2.77Å; L1033-E1035 VanDerWaalsContact C-N 3.29Å; L1033-E1035 PolarHBondContact O-N 3.39Å; L1033-G1036 PolarHBondContact O-N 2.87Å; L1033-G1037 VanDerWaalsContact CD2-O 3.23Å; L1033-G1037 WeakPolarHBondContact CD2-O 3.46Å
1034	A	76.7	Confident	79.2	Confident	25 Å²	25	48.2 Å²	48.2	21%	0.207	29%	0.288	C	S	.	.	H	α-helix	trans	-66.6	-31	176.1	0	0	0	0	0	112.6	A539 L542 E1030 V1031 G1036	A539-A1034 HydrophobicContact CB-CB 3.73Å; L542-A1034 HydrophobicContact CD1-CB 4.25Å; E1030-A1034 VanDerWaalsContact O-CB 3.31Å; E1030-A1034 WeakPolarHBondContact O-CB 3.43Å; E1030-A1034 PolarHBondContact O-N 3.4Å; V1031-A1034 PolarHBondContact O-N 3.03Å; V1031-A1034 VanDerWaalsContact O-N 3.12Å; A1034-G1036 PolarHBondContact O-N 3.38Å; A1034-G1036 VanDerWaalsContact O-N 3.14Å
1035	E	77.8	Confident	79.8	Confident	159 Å²	159	51.1 Å²	51.1	74%	0.743	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	0.3	171.6	-70.1	179.8	-179.9	0	0	113.3	V1031 L1033 G1037	V1031-E1035 WeakPolarHBondContact O-CG 3.4Å; V1031-E1035 PolarHBondContact O-N 2.67Å; L1033-E1035 VanDerWaalsContact C-N 3.29Å; L1033-E1035 PolarHBondContact O-N 3.39Å; E1035-G1037 VanDerWaalsContact C-N 3.27Å
1036	G	71.4	Confident	80.2	Confident	67 Å²	67	53.9 Å²	53.9	69%	0.691	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	14.7	-174.5	0	0	0	0	0	113	L1033 A1034	L1033-G1036 PolarHBondContact O-N 2.87Å; A1034-G1036 PolarHBondContact O-N 3.38Å; A1034-G1036 VanDerWaalsContact O-N 3.14Å
1037	G	66.4	Low	80.4	Confident	14 Å²	14	59.6 Å²	59.6	14%	0.144	35%	0.352	C	S	.	.			trans	-73.5	131.8	173.2	0	0	0	0	0	111.4	I1032 L1033 E1035	I1032-G1037 WeakPolarHBondContact O-CA 3.35Å; I1032-G1037 PolarHBondContact O-N 3.06Å; L1033-G1037 VanDerWaalsContact CD2-O 3.23Å; L1033-G1037 WeakPolarHBondContact CD2-O 3.46Å; E1035-G1037 VanDerWaalsContact C-N 3.27Å
1038	D	77	Confident	80.6	Confident	89 Å²	89	57.6 Å²	57.6	48%	0.476	34%	0.338	S	S	.	.			trans	-69.6	167.8	161	-70.5	-39	0	0	0	110.6	K1040	D1038-K1040 PolarHBondContact O-N 3.18Å
1039	L	81.4	Confident	80.7	Confident	16 Å²	16	56 Å²	56	8%	0.084	33%	0.332	C	S	.	.			trans	-58.2	106.5	167	-84.6	146.7	0	0	0	109.3	D776 W783 M828 L1029	D776-L1039 HydrophobicContact CB-CD2 3.81Å; W783-L1039 PolarHBondContact NE1-O 3.39Å; M828-L1039 HydrophobicContact CE-CD1 4.09Å; L1029-L1039 HydrophobicContact CD1-CD2 4.2Å
1040	K	83.8	Confident	80.7	Confident	131 Å²	131	65 Å²	65	57%	0.57	37%	0.365	S	S	*	.			trans	-90	136.8	177.4	-68.6	175.6	-173.8	170.4	0	109.5	D776 S777 D1038	D776-K1040 CarbonylContact C-O 3.54Å; D776-K1040 VanDerWaalsContact CA-O 3.23Å; D776-K1040 WeakPolarHBondContact CA-O 3.21Å; S777-K1040 PolarHBondContact N-O 3.16Å; D1038-K1040 PolarHBondContact O-N 3.18Å
1041	G	83.1	Confident	80.7	Confident	13 Å²	13	67.1 Å²	67.1	13%	0.134	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	153.7	170.2	0	0	0	0	0	111.3	M773 Y775	M773-G1041 WeakPolarHBondContact CE-O 3.33Å; Y775-G1041 WeakPolarHBondContact O-CA 3.23Å
1042	A	82	Confident	80.7	Confident	15 Å²	15	64.9 Å²	64.9	12%	0.124	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	154.8	167.1	0	0	0	0	0	111.6	Y775 L1048	Y775-A1042 PolarHBondContact O-N 3.27Å; A1042-L1048 HydrophobicContact CB-CD1 4.1Å
1043	P	82	Confident	80.6	Confident	58 Å²	58	66.5 Å²	66.5	38%	0.377	37%	0.368	S	S	.	.			trans	-63	142.2	169.5	27.5	-33.6	0	0	0	110.2	T1045 L1048	P1043-T1045 PolarHBondContact O-N 3.27Å; P1043-L1048 WeakPolarHBondContact O-CD1 3.19Å
1044	S	81.6	Confident	80.8	Confident	54 Å²	54	67.8 Å²	67.8	38%	0.378	37%	0.371	S	S	.	.			trans	-73.6	89.6	-175.3	-58.4	0	0	0	0	111.2	Y775	Y775-S1044 WeakPolarHBondContact CD2-OG 3.35Å
1045	T	84.4	Confident	81.2	Confident	68 Å²	68	67.6 Å²	67.6	42%	0.417	37%	0.368	S	S	.	.			trans	-80.7	155	172.3	65.7	0	0	0	0	110.8	P1043 Q1047 L1048 L1049	P1043-T1045 PolarHBondContact O-N 3.27Å; T1045-Q1047 PolarHBondContact O-N 2.93Å; T1045-L1048 PolarHBondContact O-N 2.86Å; T1045-L1048 VanDerWaalsContact O-N 3.11Å; T1045-L1048 WeakPolarHBondContact OG1-CG 3.18Å; T1045-L1048 PolarHBondContact OG1-N 2.91Å; T1045-L1049 WeakPolarHBondContact O-CG 3.13Å; T1045-L1049 PolarHBondContact O-N 3.2Å
1046	A	83.3	Confident	81.6	Confident	73 Å²	73	61 Å²	61	60%	0.603	34%	0.336	S	S	*	.	H	α-helix	trans	-58.2	-32.9	178.6	0	0	0	0	0	112.9	L1049 R1050	A1046-L1049 PolarHBondContact O-N 3.39Å; A1046-R1050 WeakPolarHBondContact O-CG 3.44Å; A1046-R1050 PolarHBondContact O-N 3.45Å
1047	Q	82.6	Confident	82.4	Confident	152 Å²	152	58.3 Å²	58.3	71%	0.71	31%	0.306	S	S	*	.	H	α-helix	trans	-68.4	-41.1	176.2	-173.7	177.2	-1.7	0	0	112.2	T1045 L1049 R1050	T1045-Q1047 PolarHBondContact O-N 2.93Å; Q1047-L1049 VanDerWaalsContact C-N 3.34Å; Q1047-R1050 PolarHBondContact O-N 2.63Å
1048	L	82.5	Confident	83.3	Confident	28 Å²	28	58.2 Å²	58.2	15%	0.147	30%	0.304	C	S	.	.	H	α-helix	trans	-66.4	-38.2	175.1	-71.9	172.2	0	0	0	111.5	S777 A1042 P1043 T1045 R1050 K1051	S777-L1048 WeakPolarHBondContact O-CD2 3.29Å; A1042-L1048 HydrophobicContact CB-CD1 4.1Å; P1043-L1048 WeakPolarHBondContact O-CD1 3.19Å; T1045-L1048 PolarHBondContact O-N 2.86Å; T1045-L1048 VanDerWaalsContact O-N 3.11Å; T1045-L1048 WeakPolarHBondContact OG1-CG 3.18Å; T1045-L1048 PolarHBondContact OG1-N 2.91Å; L1048-R1050 VanDerWaalsContact C-N 3.32Å; L1048-R1050 PolarHBondContact O-N 3.26Å; L1048-K1051 WeakPolarHBondContact O-CB 3.42Å; L1048-K1051 PolarHBondContact O-N 2.83Å
1049	L	83.5	Confident	83.7	Confident	66 Å²	66	55.7 Å²	55.7	35%	0.346	29%	0.289	S	S	.	.	H	α-helix	trans	-65.7	-32.6	178	-70.1	172.8	0	0	0	112.7	Y775 T1045 A1046 Q1047 K1051 R1052	Y775-L1049 HydrophobicContact CD2-CD2 4.37Å; Y775-L1049 HydrophobicContact CE2-CD2 4.03Å; T1045-L1049 WeakPolarHBondContact O-CG 3.13Å; T1045-L1049 PolarHBondContact O-N 3.2Å; A1046-L1049 PolarHBondContact O-N 3.39Å; Q1047-L1049 VanDerWaalsContact C-N 3.34Å; L1049-K1051 VanDerWaalsContact C-N 3.29Å; L1049-K1051 PolarHBondContact O-N 2.98Å; L1049-R1052 WeakPolarHBondContact O-CB 3.33Å; L1049-R1052 WeakPolarHBondContact O-CD 3.49Å; L1049-R1052 WeakPolarHBondContact O-CG 3.38Å; L1049-R1052 PolarHBondContact O-N 3.4Å
1050	R	83.4	Confident	83.6	Confident	190 Å²	190	57.2 Å²	57.2	72%	0.717	29%	0.294	S	S	*	.	H	α-helix	trans	-66.5	-26.6	174	-73.8	178.1	-176.2	-179.1	0	113.7	A1046 Q1047 L1048 R1052 D1053	A1046-R1050 WeakPolarHBondContact O-CG 3.44Å; A1046-R1050 PolarHBondContact O-N 3.45Å; Q1047-R1050 PolarHBondContact O-N 2.63Å; L1048-R1050 VanDerWaalsContact C-N 3.32Å; L1048-R1050 PolarHBondContact O-N 3.26Å; R1050-R1052 PolarHBondContact O-N 2.92Å; R1050-R1052 VanDerWaalsContact O-N 3.11Å; R1050-D1053 WeakPolarHBondContact O-CB 3.41Å; R1050-D1053 PolarHBondContact O-N 3.19Å
1051	K	82.2	Confident	83.3	Confident	63 Å²	63	51.1 Å²	51.1	27%	0.274	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-10.6	175.3	-70.7	-177	169.3	-172.9	0	112.5	T778 M780 E1028 L1048 L1049 D1053 R1054	T778-K1051 WeakPolarHBondContact O-CD 3.47Å; M780-K1051 HydrophobicContact CE-CB 4.24Å; M780-K1051 HydrophobicContact CE-CD 4.23Å; M780-K1051 HydrophobicContact CE-CG 4.49Å; M780-K1051 HydrophobicContact SD-CB 3.88Å; M780-K1051 HydrophobicContact SD-CD 4.45Å; E1028-K1051 IonicContact OE2-NZ 3.45Å; E1028-K1051 PolarHBondContact OE2-NZ 3.03Å; L1048-K1051 WeakPolarHBondContact O-CB 3.42Å; L1048-K1051 PolarHBondContact O-N 2.83Å; L1049-K1051 VanDerWaalsContact C-N 3.29Å; L1049-K1051 PolarHBondContact O-N 2.98Å; K1051-D1053 VanDerWaalsContact C-N 3.33Å; K1051-R1054 WeakPolarHBondContact O-CG 3.16Å; K1051-R1054 PolarHBondContact O-NE 3.37Å
1052	R	83.6	Confident	82.9	Confident	25 Å²	25	50.7 Å²	50.7	9%	0.094	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-16	177.4	-55.9	176.7	57	-178.8	-5.7	113.3	Y775 S833 L1049 R1050 R1054	Y775-R1052 VanDerWaalsContact OH-CZ 3.24Å; Y775-R1052 PolarHBondContact OH-NH1 3.31Å; Y775-R1052 PolarHBondContact OH-NH2 2.92Å; S833-R1052 PolarHBondContact O-NE 3.31Å; S833-R1052 PolarHBondContact O-NH2 3.09Å; L1049-R1052 WeakPolarHBondContact O-CB 3.33Å; L1049-R1052 WeakPolarHBondContact O-CD 3.49Å; L1049-R1052 WeakPolarHBondContact O-CG 3.38Å; L1049-R1052 PolarHBondContact O-N 3.4Å; R1050-R1052 PolarHBondContact O-N 2.92Å; R1050-R1052 VanDerWaalsContact O-N 3.11Å; R1052-R1054 PolarHBondContact O-N 3Å
1053	D	82.4	Confident	82.2	Confident	68 Å²	68	53 Å²	53	36%	0.364	28%	0.275	S	S	.	.			trans	-75.2	34.2	-173.5	-55.1	-20.2	0	0	0	112.4	R1050 K1051 F1144 H1146	R1050-D1053 WeakPolarHBondContact O-CB 3.41Å; R1050-D1053 PolarHBondContact O-N 3.19Å; K1051-D1053 VanDerWaalsContact C-N 3.33Å; D1053-F1144 WeakPolarHBondContact OD1-CD1 3.26Å; D1053-H1146 IonicContact OD1-CE1 3.7Å; D1053-H1146 PolarHBondContact OD1-CE1 3.33Å; D1053-H1146 IonicContact OD1-ND1 3.05Å; D1053-H1146 IonicContact OD1-NE2 3.75Å; D1053-H1146 IonicContact OD2-CE1 2.64Å
1054	R	85.6	Confident	81.6	Confident	49 Å²	49	54.2 Å²	54.2	19%	0.185	28%	0.276	C	S	.	.			trans	-90.5	147.1	177.9	-62.7	176.5	-63.6	170.1	9.4	109	M780 G1023 G1024 K1051 R1052	M780-R1054 PolarHBondContact O-NH2 2.96Å; M780-R1054 PolarHBondContact SD-NH1 2.95Å; G1023-R1054 PolarHBondContact O-NH1 2.97Å; G1023-R1054 PolarHBondContact O-NH2 2.89Å; G1023-R1054 VanDerWaalsContact O-NH2 3.09Å; G1024-R1054 PolarHBondContact O-NH1 3.14Å; K1051-R1054 WeakPolarHBondContact O-CG 3.16Å; K1051-R1054 PolarHBondContact O-NE 3.37Å; R1052-R1054 PolarHBondContact O-N 3Å
1055	C	85.2	Confident	81	Confident	22 Å²	22	53.8 Å²	53.8	15%	0.149	28%	0.28	C	S	.	.			trans	-56.8	142.7	173.2	-168.6	0	0	0	0	111.1	I655 N656 N834 L1141 E1142	I655-C1055 HydrophobicContact CG2-CB 4.43Å; I655-C1055 WeakPolarHBondContact O-CB 3.38Å; N656-C1055 HydrophobicContact CB-CB 4.27Å; N834-C1055 PolarHBondContact ND2-O 3.07Å; N834-C1055 VanDerWaalsContact ND2-O 3.16Å; C1055-L1141 WeakPolarHBondContact SG-CA 3.41Å; C1055-L1141 WeakPolarHBondContact SG-CB 3.27Å; C1055-E1142 WeakPolarHBondContact CA-O 3.35Å; C1055-E1142 PolarHBondContact SG-N 3.49Å; C1055-E1142 VanDerWaalsContact SG-N 3.42Å; C1055-E1142 PolarHBondContact SG-O 2.96Å
1056	R	86.8	Confident	80.6	Confident	21 Å²	21	51.8 Å²	51.8	8%	0.079	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	151.5	168.5	66.9	-176	-176.9	-178.4	-0.5	109.9	N834 Y835 E839 E1142	N834-R1056 HydrophobicContact CB-CB 4.49Å; Y835-R1056 HydrophobicContact CE1-CB 4.1Å; Y835-R1056 HydrophobicContact CE1-CG 4.36Å; Y835-R1056 HydrophobicContact CE2-CB 4.43Å; E839-R1056 IonicContact OE1-CZ 3.95Å; E839-R1056 IonicContact OE1-NH1 3.13Å; E839-R1056 PolarHBondContact OE1-NH1 3.29Å; E839-R1056 IonicContact OE1-NH2 3.58Å; E839-R1056 IonicContact OE2-NH1 2.7Å; E839-R1056 PolarHBondContact OE2-NH1 3.35Å; R1056-E1142 HydrophobicContact CG-CB 4.14Å; R1056-E1142 IonicContact CZ-OE2 2.63Å; R1056-E1142 PolarHBondContact N-O 3.46Å; R1056-E1142 IonicContact NE-OE2 3.47Å; R1056-E1142 PolarHBondContact NE-OE2 3.21Å; R1056-E1142 VanDerWaalsContact NH2-CD 3.33Å; R1056-E1142 IonicContact NH2-OE1 3.29Å; R1056-E1142 PolarHBondContact NH2-OE1 3Å; R1056-E1142 IonicContact NH2-OE2 2.97Å; R1056-E1142 PolarHBondContact NH2-OE2 2.81Å; R1056-E1142 PolarHBondContact O-N 2.91Å
1057	I	87.4	Confident	80.3	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.051	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	135	169.8	-163	165.8	0	0	0	109.3	L571 A572 F575 M578 Y835 L1141	L571-I1057 HydrophobicContact CB-CG2 4.38Å; A572-I1057 HydrophobicContact CB-CD1 4.37Å; A572-I1057 HydrophobicContact CB-CG1 4.25Å; F575-I1057 HydrophobicContact CD2-CD1 3.08Å; F575-I1057 HydrophobicContact CE2-CD1 3.2Å; F575-I1057 HydrophobicContact CG-CD1 4.02Å; F575-I1057 HydrophobicContact CZ-CD1 4.2Å; M578-I1057 HydrophobicContact CE-CD1 4.5Å; Y835-I1057 PolarHBondContact OH-O 3.28Å; I1057-L1141 HydrophobicContact CB-CD2 4.48Å
1058	A	85.4	Confident	79.8	Confident	12 Å²	12	45.1 Å²	45.1	10%	0.099	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	162.2	177.3	0	0	0	0	0	110	Y1060 V1140	A1058-Y1060 HydrophobicContact CB-CD2 4.32Å; A1058-Y1060 HydrophobicContact CB-CE2 3.56Å; A1058-V1140 PolarHBondContact N-O 3.36Å; A1058-V1140 PolarHBondContact O-N 3.36Å
1059	Q	84.5	Confident	79.4	Confident	36 Å²	36	50 Å²	50	17%	0.168	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.2	174.9	-169.1	178.7	63.7	0	0	108.4	A572 P573 N1137 V1138	A572-Q1059 HydrophobicContact CB-CB 4.07Å; P573-Q1059 PolarHBondContact O-NE2 2.63Å; P573-Q1059 VanDerWaalsContact O-NE2 3.12Å; Q1059-N1137 VanDerWaalsContact CD-CB 3.42Å; Q1059-N1137 HydrophobicContact CG-CB 3.48Å; Q1059-N1137 VanDerWaalsContact CG-CB 3.48Å; Q1059-N1137 PolarHBondContact OE1-ND2 2.96Å; Q1059-V1138 WeakPolarHBondContact CA-O 3.1Å
1060	Y	81.3	Confident	79.1	Confident	47 Å²	47	47.6 Å²	47.6	18%	0.184	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.7	-178.6	-63	-74.5	0	0	0	111.5	A1058 P1066 N1137 V1138 V1140 E1142	A1058-Y1060 HydrophobicContact CB-CD2 4.32Å; A1058-Y1060 HydrophobicContact CB-CE2 3.56Å; Y1060-P1066 HydrophobicContact CD2-CG 4.37Å; Y1060-P1066 HydrophobicContact CE2-CG 4.48Å; Y1060-P1066 HydrophobicContact CG-CG 4.48Å; Y1060-N1137 CarbonylContact O-C 3.45Å; Y1060-N1137 WeakPolarHBondContact O-CA 3.27Å; Y1060-V1138 PolarHBondContact N-O 3.4Å; Y1060-V1138 PolarHBondContact O-N 3.05Å; Y1060-V1140 HydrophobicContact CD2-CB 4.17Å; Y1060-V1140 HydrophobicContact CD2-CG2 3.83Å; Y1060-V1140 HydrophobicContact CE2-CB 4.33Å; Y1060-V1140 HydrophobicContact CE2-CG2 4.46Å; Y1060-E1142 PolarHBondContact OH-OE2 2.9Å
1061	G	77.4	Confident	78.6	Confident	3 Å²	3	40.6 Å²	40.6	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	140.4	165.6	0	0	0	0	0	110.8	T1063 E1064 I1136	G1061-T1063 PolarHBondContact O-N 3.33Å; G1061-E1064 CarbonylContact O-C 3.4Å; G1061-E1064 PolarHBondContact O-N 3.48Å; G1061-I1136 CarbonylContact C-O 3.6Å; G1061-I1136 WeakPolarHBondContact CA-O 3.33Å
1062	I	74.3	Confident	78.2	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.026	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-32.9	173.5	-67.7	176.9	0	0	0	112.1	E1064 V1072 L1122 D1126 L1127 I1136 V1138	I1062-E1064 VanDerWaalsContact C-N 3.33Å; I1062-V1072 HydrophobicContact CG2-CB 4.03Å; I1062-V1072 HydrophobicContact CG2-CG1 4.06Å; I1062-V1072 HydrophobicContact CG2-CG2 4.09Å; I1062-L1122 HydrophobicContact CD1-CD1 4.15Å; I1062-L1122 HydrophobicContact CD1-CD2 4.36Å; I1062-D1126 HydrophobicContact CD1-CB 4.13Å; I1062-L1127 HydrophobicContact CG2-CD2 3.98Å; I1062-I1136 HydrophobicContact CD1-CB 3.7Å; I1062-I1136 HydrophobicContact CD1-CD1 3.84Å; I1062-I1136 HydrophobicContact CD1-CG1 4.28Å; I1062-I1136 HydrophobicContact CD1-CG2 4.43Å; I1062-I1136 HydrophobicContact CG1-CB 4.04Å; I1062-I1136 PolarHBondContact N-O 3.03Å; I1062-V1138 HydrophobicContact CG1-CG2 4.08Å
1063	T	67.4	Low	77.6	Confident	62 Å²	62	44.2 Å²	44.2	38%	0.38	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	1.7	178.3	62.1	0	0	0	0	113.7	G1061 V1068 S1135	G1061-T1063 PolarHBondContact O-N 3.33Å; T1063-V1068 VanDerWaalsContact O-CG2 3.23Å; T1063-V1068 WeakPolarHBondContact O-CG2 3.47Å; T1063-S1135 WeakPolarHBondContact OG1-CB 3.35Å; T1063-S1135 PolarHBondContact OG1-OG 3.25Å
1064	E	68.4	Low	76.8	Confident	85 Å²	85	48 Å²	48	40%	0.397	27%	0.266	S	S	.	.	S	Bend	trans	-128.8	164	-176.9	-62.3	-173.7	176	0	0	110.3	G1061 I1062 N1133	G1061-E1064 CarbonylContact O-C 3.4Å; G1061-E1064 PolarHBondContact O-N 3.48Å; I1062-E1064 VanDerWaalsContact C-N 3.33Å; E1064-N1133 VanDerWaalsContact OE1-CG 3.32Å; E1064-N1133 PolarHBondContact OE1-ND2 2.92Å
1065	G	70.3	Confident	76.3	Confident	45 Å²	45	47.9 Å²	47.9	46%	0.464	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	63.1	-146.6	176	0	0	0	0	0	114.7	F1067 V1068	G1065-F1067 PolarHBondContact O-N 2.9Å; G1065-V1068 WeakPolarHBondContact O-CG2 3.34Å; G1065-V1068 PolarHBondContact O-N 3.16Å
1066	P	74.2	Confident	76.3	Confident	26 Å²	26	49.7 Å²	49.7	17%	0.169	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-69	-20.7	-169.2	26.9	-34	0	0	0	113.8	Y1060 V1068 M1091	Y1060-P1066 HydrophobicContact CD2-CG 4.37Å; Y1060-P1066 HydrophobicContact CE2-CG 4.48Å; Y1060-P1066 HydrophobicContact CG-CG 4.48Å; P1066-V1068 VanDerWaalsContact C-N 3.33Å; P1066-V1068 PolarHBondContact O-N 3.14Å; P1066-M1091 HydrophobicContact CB-CE 3.65Å; P1066-M1091 HydrophobicContact CG-CE 3.46Å; P1066-M1091 VanDerWaalsContact CG-CE 3.46Å; P1066-M1091 HydrophobicContact CG-SD 3.91Å
1067	F	77.2	Confident	76.5	Confident	1 Å²	1	50.6 Å²	50.6	0%	0.004	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-76.2	-18.3	-175.5	-55.8	-41.3	0	0	0	114	G1065 N1069 F1070 L1081 A1085 M1091 L1093 V1138 V1140	G1065-F1067 PolarHBondContact O-N 2.9Å; F1067-N1069 PolarHBondContact O-N 3.08Å; F1067-F1070 HydrophobicContact CB-CD2 4.34Å; F1067-F1070 AromaticContact CD1-CD2 3.77Å; F1067-F1070 HydrophobicContact CD1-CD2 3.77Å; F1067-F1070 AromaticContact CD1-CE2 3.48Å; F1067-F1070 HydrophobicContact CD1-CE2 3.48Å; F1067-F1070 VanDerWaalsContact CD1-CE2 3.48Å; F1067-F1070 HydrophobicContact CD1-CZ 4.36Å; F1067-F1070 HydrophobicContact CE1-CE2 4.04Å; F1067-F1070 VanDerWaalsContact O-CB 3.3Å; F1067-F1070 WeakPolarHBondContact O-CB 3.34Å; F1067-F1070 PolarHBondContact O-N 3.37Å; F1067-L1081 HydrophobicContact CD1-CD1 4.02Å; F1067-L1081 HydrophobicContact CE1-CD1 4.37Å; F1067-L1081 HydrophobicContact CG-CD1 4.36Å; F1067-A1085 HydrophobicContact CE1-CB 4.02Å; F1067-M1091 HydrophobicContact CE1-CE 3.94Å; F1067-L1093 HydrophobicContact CE1-CD2 4.24Å; F1067-L1093 HydrophobicContact CZ-CD2 3.82Å; F1067-V1138 HydrophobicContact CE2-CB 3.99Å; F1067-V1138 HydrophobicContact CE2-CG2 4.11Å; F1067-V1138 HydrophobicContact CZ-CB 4.43Å; F1067-V1140 HydrophobicContact CE2-CG2 4.29Å; F1067-V1140 HydrophobicContact CZ-CG2 3.83Å
1068	V	72.6	Confident	76.6	Confident	83 Å²	83	50.1 Å²	50.1	50%	0.503	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-55.7	-39.2	178	179.9	0	0	0	0	111.3	T1063 G1065 P1066 F1070 G1071	T1063-V1068 VanDerWaalsContact O-CG2 3.23Å; T1063-V1068 WeakPolarHBondContact O-CG2 3.47Å; G1065-V1068 WeakPolarHBondContact O-CG2 3.34Å; G1065-V1068 PolarHBondContact O-N 3.16Å; P1066-V1068 VanDerWaalsContact C-N 3.33Å; P1066-V1068 PolarHBondContact O-N 3.14Å; V1068-F1070 PolarHBondContact O-N 3.5Å; V1068-G1071 PolarHBondContact O-N 2.83Å
1069	N	73.8	Confident	76.8	Confident	130 Å²	130	49.6 Å²	49.6	70%	0.695	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-74.6	-5.4	-179.2	-66.7	-27.1	0	0	0	113.6	F1067	F1067-N1069 PolarHBondContact O-N 3.08Å
1070	F	77.6	Confident	77.1	Confident	16 Å²	16	49.9 Å²	49.9	7%	0.07	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-86.1	-17.2	179.6	-62.1	-10.4	0	0	0	112.7	F1067 V1068 V1072 W1076 L1081 Q1084 A1085 K1088 H1089	F1067-F1070 HydrophobicContact CB-CD2 4.34Å; F1067-F1070 AromaticContact CD1-CD2 3.77Å; F1067-F1070 HydrophobicContact CD1-CD2 3.77Å; F1067-F1070 AromaticContact CD1-CE2 3.48Å; F1067-F1070 HydrophobicContact CD1-CE2 3.48Å; F1067-F1070 VanDerWaalsContact CD1-CE2 3.48Å; F1067-F1070 HydrophobicContact CD1-CZ 4.36Å; F1067-F1070 HydrophobicContact CE1-CE2 4.04Å; F1067-F1070 VanDerWaalsContact O-CB 3.3Å; F1067-F1070 WeakPolarHBondContact O-CB 3.34Å; F1067-F1070 PolarHBondContact O-N 3.37Å; V1068-F1070 PolarHBondContact O-N 3.5Å; F1070-V1072 HydrophobicContact CB-CG2 4.12Å; F1070-W1076 HydrophobicContact CB-CH2 4.48Å; F1070-L1081 HydrophobicContact CD2-CD1 3.86Å; F1070-L1081 HydrophobicContact CE2-CD1 4.3Å; F1070-Q1084 HydrophobicContact CB-CG 4.39Å; F1070-Q1084 HydrophobicContact CD1-CG 3.88Å; F1070-Q1084 HydrophobicContact CD2-CB 4.33Å; F1070-Q1084 HydrophobicContact CD2-CG 3.84Å; F1070-Q1084 HydrophobicContact CE1-CG 4.01Å; F1070-Q1084 HydrophobicContact CE2-CB 4.25Å; F1070-Q1084 HydrophobicContact CE2-CG 3.91Å; F1070-Q1084 HydrophobicContact CG-CG 3.79Å; F1070-Q1084 HydrophobicContact CZ-CG 3.98Å; F1070-A1085 HydrophobicContact CE2-CB 4.11Å; F1070-K1088 HydrophobicContact CD1-CD 4.04Å; F1070-K1088 HydrophobicContact CE1-CB 4.24Å; F1070-K1088 HydrophobicContact CE1-CD 3.49Å; F1070-K1088 VanDerWaalsContact CE1-CD 3.49Å; F1070-K1088 HydrophobicContact CE1-CG 4.44Å; F1070-K1088 HydrophobicContact CZ-CB 4.38Å; F1070-K1088 HydrophobicContact CZ-CD 4.29Å; F1070-H1089 AromaticContact CE1-CD2 3.89Å; F1070-H1089 AromaticContact CE1-NE2 3.74Å; F1070-H1089 AromaticContact CZ-CD2 3.6Å; F1070-H1089 AromaticContact CZ-NE2 3.92Å
1071	G	73.5	Confident	77.5	Confident	43 Å²	43	47.6 Å²	47.6	44%	0.443	28%	0.282	S	S	.	.			trans	62.7	44.9	-179.1	0	0	0	0	0	112	V1068 Q1073	V1068-G1071 PolarHBondContact O-N 2.83Å; G1071-Q1073 PolarHBondContact O-N 3.27Å
1072	V	73.9	Confident	78.1	Confident	26 Å²	26	47.5 Å²	47.5	16%	0.158	28%	0.281	C	S	.	.			trans	-59.1	125	179.3	-172.1	0	0	0	0	109.3	I1062 F1070 W1076 L1081 L1122 L1127	I1062-V1072 HydrophobicContact CG2-CB 4.03Å; I1062-V1072 HydrophobicContact CG2-CG1 4.06Å; I1062-V1072 HydrophobicContact CG2-CG2 4.09Å; F1070-V1072 HydrophobicContact CB-CG2 4.12Å; V1072-W1076 HydrophobicContact CB-CD2 4.42Å; V1072-W1076 HydrophobicContact CG1-CB 3.83Å; V1072-W1076 HydrophobicContact CG1-CD2 3.98Å; V1072-W1076 HydrophobicContact CG1-CE3 4.24Å; V1072-W1076 HydrophobicContact CG1-CG 3.81Å; V1072-W1076 HydrophobicContact CG2-CE3 4.3Å; V1072-W1076 HydrophobicContact CG2-CZ3 4.43Å; V1072-L1081 HydrophobicContact CG2-CD1 4.26Å; V1072-L1122 HydrophobicContact CG1-CD1 4.35Å; V1072-L1127 HydrophobicContact CB-CD2 4.25Å; V1072-L1127 HydrophobicContact CG1-CD2 3.93Å
1073	Q	70	Confident	78.9	Confident	138 Å²	138	48.5 Å²	48.5	65%	0.645	29%	0.286	S	S	*	.			trans	-116.5	171.3	-178.6	-71	177.4	3.1	0	0	110.9	G1071 G1075 W1076	G1071-Q1073 PolarHBondContact O-N 3.27Å; Q1073-G1075 PolarHBondContact O-N 2.97Å; Q1073-W1076 PolarHBondContact O-N 3.44Å
1074	E	66.6	Low	80	Confident	147 Å²	147	48 Å²	48	69%	0.687	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	131.8	170.8	-153.2	161.2	-176.2	0	0	111.2	M1124	E1074-M1124 HydrophobicContact CB-CE 3.22Å; E1074-M1124 HydrophobicContact CG-CE 3.29Å; E1074-M1124 HydrophobicContact CG-CG 3.88Å; E1074-M1124 HydrophobicContact CG-SD 4.43Å; E1074-M1124 VanDerWaalsContact OE1-CG 3.31Å; E1074-M1124 WeakPolarHBondContact OE1-CG 3.27Å; E1074-M1124 WeakPolarHBondContact OE2-CE 3.41Å
1075	G	75.1	Confident	80.9	Confident	47 Å²	47	43.9 Å²	43.9	49%	0.485	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-1.3	179.1	0	0	0	0	0	115.4	Q1073	Q1073-G1075 PolarHBondContact O-N 2.97Å
1076	W	85	Confident	81.8	Confident	60 Å²	60	41.9 Å²	41.9	23%	0.227	24%	0.239	C	C	.	.			trans	-59.3	143.1	167.4	-82.2	55.4	0	0	0	111	F1070 V1072 Q1073 L1122	F1070-W1076 HydrophobicContact CB-CH2 4.48Å; V1072-W1076 HydrophobicContact CB-CD2 4.42Å; V1072-W1076 HydrophobicContact CG1-CB 3.83Å; V1072-W1076 HydrophobicContact CG1-CD2 3.98Å; V1072-W1076 HydrophobicContact CG1-CE3 4.24Å; V1072-W1076 HydrophobicContact CG1-CG 3.81Å; V1072-W1076 HydrophobicContact CG2-CE3 4.3Å; V1072-W1076 HydrophobicContact CG2-CZ3 4.43Å; Q1073-W1076 PolarHBondContact O-N 3.44Å; W1076-L1122 HydrophobicContact CB-CD1 4.21Å; W1076-L1122 PolarHBondContact O-N 3.24Å
1077	T	89.9	Confident	82.6	Confident	40 Å²	40	47.7 Å²	47.7	25%	0.245	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-104.5	156.1	178.1	57.6	0	0	0	0	110.2	G1079 S1080 L1081 E1118 M1120	T1077-G1079 PolarHBondContact O-N 2.83Å; T1077-S1080 PolarHBondContact N-OG 3.28Å; T1077-S1080 VanDerWaalsContact N-OG 3.13Å; T1077-S1080 PolarHBondContact O-N 3.5Å; T1077-S1080 VanDerWaalsContact O-N 3.11Å; T1077-S1080 PolarHBondContact O-OG 3.08Å; T1077-S1080 PolarHBondContact OG1-N 3.32Å; T1077-S1080 PolarHBondContact OG1-OG 3.35Å; T1077-L1081 PolarHBondContact O-N 3.13Å; T1077-E1118 VanDerWaalsContact CB-O 3.31Å; T1077-E1118 WeakPolarHBondContact CB-O 3.38Å; T1077-M1120 CarbonylContact C-O 3.56Å; T1077-M1120 VanDerWaalsContact CA-O 3.29Å; T1077-M1120 WeakPolarHBondContact CA-O 3.14Å
1078	Y	90	Very high	83	Confident	1 Å²	1	53.1 Å²	53.1	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-53.1	-41.1	174.1	178.2	-106	0	0	0	112	F631 S1080 L1081 F1082 L1093 L1096 P1116 M1120	F631-Y1078 HydrophobicContact CE2-CE1 4.29Å; F631-Y1078 HydrophobicContact CZ-CD1 4.12Å; F631-Y1078 HydrophobicContact CZ-CE1 4Å; Y1078-S1080 PolarHBondContact O-N 3.37Å; Y1078-L1081 PolarHBondContact O-N 2.82Å; Y1078-F1082 HydrophobicContact CE1-CD2 4.45Å; Y1078-F1082 WeakPolarHBondContact O-CB 3.3Å; Y1078-F1082 PolarHBondContact O-N 3.26Å; Y1078-L1093 HydrophobicContact CE2-CB 4.16Å; Y1078-L1093 HydrophobicContact CE2-CD1 4.32Å; Y1078-L1093 WeakPolarHBondContact OH-CB 3.49Å; Y1078-L1093 PolarHBondContact OH-O 2.05Å; Y1078-L1096 HydrophobicContact CD2-CD1 4.17Å; Y1078-L1096 HydrophobicContact CD2-CD2 3.83Å; Y1078-L1096 HydrophobicContact CD2-CG 4.09Å; Y1078-L1096 HydrophobicContact CE2-CD2 3.93Å; Y1078-L1096 HydrophobicContact CE2-CG 4.2Å; Y1078-P1116 HydrophobicContact CD1-CB 3.88Å; Y1078-P1116 HydrophobicContact CD1-CG 4.15Å; Y1078-P1116 VanDerWaalsContact CD1-O 3.3Å; Y1078-P1116 WeakPolarHBondContact CD1-O 3.36Å; Y1078-P1116 HydrophobicContact CD2-CB 4.42Å; Y1078-P1116 HydrophobicContact CD2-CG 4.09Å; Y1078-P1116 HydrophobicContact CE1-CB 4.2Å; Y1078-P1116 HydrophobicContact CE1-CG 4.08Å; Y1078-P1116 WeakPolarHBondContact CE1-O 3.34Å; Y1078-P1116 HydrophobicContact CE2-CG 4.01Å; Y1078-P1116 HydrophobicContact CG-CB 3.99Å; Y1078-P1116 HydrophobicContact CG-CG 4.14Å; Y1078-M1120 PolarHBondContact N-O 3.04Å
1079	G	90.8	Very high	83.5	Confident	1 Å²	1	53 Å²	53	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-40.5	177.6	0	0	0	0	0	113.9	T1077 L1081 F1082 L1083 E1118	T1077-G1079 PolarHBondContact O-N 2.83Å; G1079-L1081 VanDerWaalsContact C-N 3.34Å; G1079-L1081 PolarHBondContact O-N 3.34Å; G1079-F1082 PolarHBondContact O-N 3.49Å; G1079-L1083 WeakPolarHBondContact O-CG 3.49Å; G1079-L1083 PolarHBondContact O-N 3.21Å; G1079-E1118 PolarHBondContact N-O 2.91Å
1080	S	90.3	Very high	84	Confident	41 Å²	41	47 Å²	47	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-64.6	-38.9	176.6	66	0	0	0	0	112.6	T1077 Y1078 Q1084	T1077-S1080 PolarHBondContact N-OG 3.28Å; T1077-S1080 VanDerWaalsContact N-OG 3.13Å; T1077-S1080 PolarHBondContact O-N 3.5Å; T1077-S1080 VanDerWaalsContact O-N 3.11Å; T1077-S1080 PolarHBondContact O-OG 3.08Å; T1077-S1080 PolarHBondContact OG1-N 3.32Å; T1077-S1080 PolarHBondContact OG1-OG 3.35Å; Y1078-S1080 PolarHBondContact O-N 3.37Å; S1080-Q1084 WeakPolarHBondContact O-CB 3.32Å; S1080-Q1084 PolarHBondContact O-N 2.88Å
1081	L	88.7	Confident	84.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-68.4	-43.8	175.5	-178.3	62.6	0	0	0	111.3	F1067 F1070 V1072 T1077 Y1078 G1079 Q1084 A1085 L1093 L1122 V1138	F1067-L1081 HydrophobicContact CD1-CD1 4.02Å; F1067-L1081 HydrophobicContact CE1-CD1 4.37Å; F1067-L1081 HydrophobicContact CG-CD1 4.36Å; F1070-L1081 HydrophobicContact CD2-CD1 3.86Å; F1070-L1081 HydrophobicContact CE2-CD1 4.3Å; V1072-L1081 HydrophobicContact CG2-CD1 4.26Å; T1077-L1081 PolarHBondContact O-N 3.13Å; Y1078-L1081 PolarHBondContact O-N 2.82Å; G1079-L1081 VanDerWaalsContact C-N 3.34Å; G1079-L1081 PolarHBondContact O-N 3.34Å; L1081-Q1084 PolarHBondContact O-N 3.14Å; L1081-A1085 WeakPolarHBondContact O-CB 3.24Å; L1081-A1085 PolarHBondContact O-N 2.93Å; L1081-L1093 HydrophobicContact CB-CD1 4.44Å; L1081-L1093 HydrophobicContact CD2-CD1 4.2Å; L1081-L1093 HydrophobicContact CG-CD1 3.85Å; L1081-L1122 HydrophobicContact CB-CD1 4.34Å; L1081-L1122 HydrophobicContact CD2-CD1 4.04Å; L1081-V1138 HydrophobicContact CD2-CG2 4.14Å
1082	F	90.7	Very high	85.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56.6	-53.3	177.6	-179.3	-86.7	0	0	0	111.9	V627 F631 L637 Y1078 G1079 Q1084 A1085 L1086 L1092 L1093	V627-F1082 HydrophobicContact CG1-CE1 4.02Å; V627-F1082 HydrophobicContact CG1-CZ 3.71Å; F631-F1082 HydrophobicContact CB-CE1 3.85Å; F631-F1082 HydrophobicContact CB-CZ 4.38Å; F631-F1082 AromaticContact CD1-CD1 3.63Å; F631-F1082 HydrophobicContact CD1-CD1 3.63Å; F631-F1082 AromaticContact CD1-CE1 3.83Å; F631-F1082 HydrophobicContact CD1-CE1 3.83Å; F631-F1082 HydrophobicContact CD1-CG 4.32Å; F631-F1082 HydrophobicContact CD2-CD1 4.28Å; F631-F1082 AromaticContact CD2-CE1 3.94Å; F631-F1082 HydrophobicContact CD2-CE1 3.94Å; F631-F1082 HydrophobicContact CD2-CE2 4.36Å; F631-F1082 AromaticContact CD2-CZ 3.99Å; F631-F1082 HydrophobicContact CD2-CZ 3.99Å; F631-F1082 HydrophobicContact CE1-CB 4.27Å; F631-F1082 AromaticContact CE1-CD1 3.81Å; F631-F1082 HydrophobicContact CE1-CD1 3.81Å; F631-F1082 HydrophobicContact CE1-CE1 4.37Å; F631-F1082 HydrophobicContact CE1-CG 4.05Å; F631-F1082 HydrophobicContact CE2-CD1 4.42Å; F631-F1082 HydrophobicContact CE2-CD2 4.35Å; F631-F1082 HydrophobicContact CE2-CE1 4.47Å; F631-F1082 HydrophobicContact CE2-CE2 4.4Å; F631-F1082 HydrophobicContact CE2-CG 4.37Å; F631-F1082 HydrophobicContact CE2-CZ 4.46Å; F631-F1082 AromaticContact CG-CD1 3.88Å; F631-F1082 HydrophobicContact CG-CD1 3.88Å; F631-F1082 AromaticContact CG-CE1 3.59Å; F631-F1082 HydrophobicContact CG-CE1 3.59Å; F631-F1082 HydrophobicContact CG-CZ 4.09Å; F631-F1082 HydrophobicContact CZ-CB 4.36Å; F631-F1082 HydrophobicContact CZ-CD1 4.2Å; F631-F1082 HydrophobicContact CZ-CD2 4.41Å; F631-F1082 HydrophobicContact CZ-CG 4.08Å; L637-F1082 HydrophobicContact CD1-CE2 3.62Å; L637-F1082 HydrophobicContact CD1-CZ 3.79Å; Y1078-F1082 HydrophobicContact CE1-CD2 4.45Å; Y1078-F1082 WeakPolarHBondContact O-CB 3.3Å; Y1078-F1082 PolarHBondContact O-N 3.26Å; G1079-F1082 PolarHBondContact O-N 3.49Å; F1082-Q1084 VanDerWaalsContact C-N 3.31Å; F1082-Q1084 PolarHBondContact O-N 3.34Å; F1082-A1085 PolarHBondContact O-N 3.35Å; F1082-L1086 HydrophobicContact CE1-CD2 4.04Å; F1082-L1086 WeakPolarHBondContact O-CB 3.22Å; F1082-L1086 PolarHBondContact O-N 3.49Å; F1082-L1092 HydrophobicContact CE2-CD1 3.76Å; F1082-L1092 HydrophobicContact CE2-CG 4.39Å; F1082-L1092 HydrophobicContact CZ-CD1 3.54Å; F1082-L1093 HydrophobicContact CB-CD1 4.12Å; F1082-L1093 HydrophobicContact CD2-CB 3.9Å; F1082-L1093 HydrophobicContact CD2-CD1 4.48Å; F1082-L1093 HydrophobicContact CD2-CG 4.15Å; F1082-L1093 WeakPolarHBondContact CE2-O 3.47Å
1083	L	91.7	Very high	86.2	Confident	26 Å²	26	43.1 Å²	43.1	14%	0.136	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-39	-179.4	-68.7	176	0	0	0	112.2	E628 V632 G1079 R1087	E628-L1083 HydrophobicContact CB-CD2 4.25Å; E628-L1083 HydrophobicContact CG-CD2 3.69Å; V632-L1083 HydrophobicContact CG2-CD1 3.99Å; V632-L1083 HydrophobicContact CG2-CD2 3.88Å; V632-L1083 HydrophobicContact CG2-CG 4.43Å; G1079-L1083 WeakPolarHBondContact O-CG 3.49Å; G1079-L1083 PolarHBondContact O-N 3.21Å; L1083-R1087 WeakPolarHBondContact O-CB 3.46Å; L1083-R1087 WeakPolarHBondContact O-CG 3.48Å; L1083-R1087 PolarHBondContact O-N 3.34Å
1084	Q	89.6	Confident	87.2	Confident	51 Å²	51	36.8 Å²	36.8	24%	0.238	18%	0.183	C	C	.	.	H	α-helix	trans	-69.3	-41.6	179	-170.5	73	-20	0	0	112.1	F1070 S1080 L1081 F1082 K1088	F1070-Q1084 HydrophobicContact CB-CG 4.39Å; F1070-Q1084 HydrophobicContact CD1-CG 3.88Å; F1070-Q1084 HydrophobicContact CD2-CB 4.33Å; F1070-Q1084 HydrophobicContact CD2-CG 3.84Å; F1070-Q1084 HydrophobicContact CE1-CG 4.01Å; F1070-Q1084 HydrophobicContact CE2-CB 4.25Å; F1070-Q1084 HydrophobicContact CE2-CG 3.91Å; F1070-Q1084 HydrophobicContact CG-CG 3.79Å; F1070-Q1084 HydrophobicContact CZ-CG 3.98Å; S1080-Q1084 WeakPolarHBondContact O-CB 3.32Å; S1080-Q1084 PolarHBondContact O-N 2.88Å; L1081-Q1084 PolarHBondContact O-N 3.14Å; F1082-Q1084 VanDerWaalsContact C-N 3.31Å; F1082-Q1084 PolarHBondContact O-N 3.34Å; Q1084-K1088 HydrophobicContact CG-CD 4.25Å; Q1084-K1088 VanDerWaalsContact NE2-NZ 3.19Å; Q1084-K1088 WeakPolarHBondContact O-CB 3.35Å; Q1084-K1088 PolarHBondContact O-N 3.49Å; Q1084-K1088 VanDerWaalsContact O-N 3.1Å
1085	A	88.3	Confident	88.4	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.3	-45.2	177.1	0	0	0	0	0	111.9	F1067 F1070 L1081 F1082 H1089 G1090 M1091 L1093	F1067-A1085 HydrophobicContact CE1-CB 4.02Å; F1070-A1085 HydrophobicContact CE2-CB 4.11Å; L1081-A1085 WeakPolarHBondContact O-CB 3.24Å; L1081-A1085 PolarHBondContact O-N 2.93Å; F1082-A1085 PolarHBondContact O-N 3.35Å; A1085-H1089 PolarHBondContact O-N 3.01Å; A1085-G1090 PolarHBondContact O-N 3.03Å; A1085-M1091 HydrophobicContact CB-CB 4.3Å; A1085-M1091 HydrophobicContact CB-CE 4.42Å; A1085-M1091 PolarHBondContact O-N 3.06Å; A1085-L1093 HydrophobicContact CB-CD1 4.26Å; A1085-L1093 HydrophobicContact CB-CD2 3.95Å; A1085-L1093 HydrophobicContact CB-CG 4.21Å
1086	L	89.2	Confident	89.1	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.016	13%	0.128	C	C	.	.	H	α-helix	trans	-62.9	-48.8	178.9	-176	64.4	0	0	0	111.5	P624 V627 E628 F1082 G1090 M1091 L1092	P624-L1086 HydrophobicContact CB-CD1 4.08Å; P624-L1086 HydrophobicContact CB-CG 4.18Å; V627-L1086 HydrophobicContact CB-CD2 3.97Å; V627-L1086 HydrophobicContact CG1-CD1 4.41Å; V627-L1086 HydrophobicContact CG1-CD2 3.64Å; E628-L1086 HydrophobicContact CB-CD2 4.17Å; F1082-L1086 HydrophobicContact CE1-CD2 4.04Å; F1082-L1086 WeakPolarHBondContact O-CB 3.22Å; F1082-L1086 PolarHBondContact O-N 3.49Å; L1086-G1090 VanDerWaalsContact O-CA 3.25Å; L1086-G1090 WeakPolarHBondContact O-CA 3.35Å; L1086-G1090 PolarHBondContact O-N 2.98Å; L1086-M1091 WeakPolarHBondContact CA-O 3.33Å; L1086-M1091 PolarHBondContact N-O 2.76Å; L1086-L1092 HydrophobicContact CD1-CD1 4.48Å
1087	R	89.5	Confident	89.3	Confident	148 Å²	148	25.9 Å²	25.9	56%	0.558	12%	0.121	S	C	*	.	H	α-helix	trans	-69.2	-37.9	-177.4	-70.4	172.9	-176.4	165.7	-0.8	113.8	E628 L1083	E628-R1087 VanDerWaalsContact CD-NH2 3.31Å; E628-R1087 IonicContact OE1-CZ 3.07Å; E628-R1087 IonicContact OE1-NE 2.66Å; E628-R1087 IonicContact OE1-NH2 3.51Å; E628-R1087 PolarHBondContact OE1-NH2 2.89Å; E628-R1087 IonicContact OE2-CZ 3.8Å; E628-R1087 IonicContact OE2-NE 3.43Å; E628-R1087 PolarHBondContact OE2-NE 3.44Å; E628-R1087 IonicContact OE2-NH2 3.52Å; E628-R1087 PolarHBondContact OE2-NH2 2.86Å; L1083-R1087 WeakPolarHBondContact O-CB 3.46Å; L1083-R1087 WeakPolarHBondContact O-CG 3.48Å; L1083-R1087 PolarHBondContact O-N 3.34Å
1088	K	86	Confident	89.1	Confident	115 Å²	115	24.3 Å²	24.3	50%	0.5	11%	0.111	S	C	.	.	H	α-helix	trans	-86.8	-36.6	-175	-76	-173.2	167.6	-176.7	0	114.1	F1070 Q1084	F1070-K1088 HydrophobicContact CD1-CD 4.04Å; F1070-K1088 HydrophobicContact CE1-CB 4.24Å; F1070-K1088 HydrophobicContact CE1-CD 3.49Å; F1070-K1088 VanDerWaalsContact CE1-CD 3.49Å; F1070-K1088 HydrophobicContact CE1-CG 4.44Å; F1070-K1088 HydrophobicContact CZ-CB 4.38Å; F1070-K1088 HydrophobicContact CZ-CD 4.29Å; Q1084-K1088 HydrophobicContact CG-CD 4.25Å; Q1084-K1088 VanDerWaalsContact NE2-NZ 3.19Å; Q1084-K1088 WeakPolarHBondContact O-CB 3.35Å; Q1084-K1088 PolarHBondContact O-N 3.49Å; Q1084-K1088 VanDerWaalsContact O-N 3.1Å
1089	H	83	Confident	88.7	Confident	81 Å²	81	24.8 Å²	24.8	38%	0.375	11%	0.113	S	C	.	.	H	α-helix	trans	-125.5	-1.6	-171.2	-63	-67.6	0	0	0	113.7	F1070 A1085 M1091 P1143	F1070-H1089 AromaticContact CE1-CD2 3.89Å; F1070-H1089 AromaticContact CE1-NE2 3.74Å; F1070-H1089 AromaticContact CZ-CD2 3.6Å; F1070-H1089 AromaticContact CZ-NE2 3.92Å; A1085-H1089 PolarHBondContact O-N 3.01Å; H1089-M1091 HydrophobicContact CB-CB 4.36Å; H1089-M1091 HydrophobicContact CB-CE 3.46Å; H1089-M1091 VanDerWaalsContact CB-CE 3.46Å; H1089-M1091 HydrophobicContact CB-CG 3.73Å; H1089-M1091 HydrophobicContact CB-SD 4.17Å; H1089-M1091 VanDerWaalsContact CD2-CE 3.44Å; H1089-M1091 WeakPolarHBondContact CD2-CE 3.32Å; H1089-M1091 PolarHBondContact O-N 3.17Å; H1089-P1143 WeakPolarHBondContact O-CG 2.89Å
1090	G	84.8	Confident	88	Confident	4 Å²	4	25.4 Å²	25.4	4%	0.041	12%	0.116	C	C	.	.			trans	64.9	19.9	-173.4	0	0	0	0	0	113.1	N656 A1085 L1086	N656-G1090 PolarHBondContact ND2-O 3.21Å; A1085-G1090 PolarHBondContact O-N 3.03Å; L1086-G1090 VanDerWaalsContact O-CA 3.25Å; L1086-G1090 WeakPolarHBondContact O-CA 3.35Å; L1086-G1090 PolarHBondContact O-N 2.98Å
1091	M	88	Confident	86.7	Confident	3 Å²	3	29 Å²	29	2%	0.015	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-86.5	127.9	-177.1	-74	-169.6	-67	0	0	110.7	P1066 F1067 A1085 L1086 H1089 V1140 L1141 E1142	P1066-M1091 HydrophobicContact CB-CE 3.65Å; P1066-M1091 HydrophobicContact CG-CE 3.46Å; P1066-M1091 VanDerWaalsContact CG-CE 3.46Å; P1066-M1091 HydrophobicContact CG-SD 3.91Å; F1067-M1091 HydrophobicContact CE1-CE 3.94Å; A1085-M1091 HydrophobicContact CB-CB 4.3Å; A1085-M1091 HydrophobicContact CB-CE 4.42Å; A1085-M1091 PolarHBondContact O-N 3.06Å; L1086-M1091 WeakPolarHBondContact CA-O 3.33Å; L1086-M1091 PolarHBondContact N-O 2.76Å; H1089-M1091 HydrophobicContact CB-CB 4.36Å; H1089-M1091 HydrophobicContact CB-CE 3.46Å; H1089-M1091 VanDerWaalsContact CB-CE 3.46Å; H1089-M1091 HydrophobicContact CB-CG 3.73Å; H1089-M1091 HydrophobicContact CB-SD 4.17Å; H1089-M1091 VanDerWaalsContact CD2-CE 3.44Å; H1089-M1091 WeakPolarHBondContact CD2-CE 3.32Å; H1089-M1091 PolarHBondContact O-N 3.17Å; M1091-V1140 HydrophobicContact CB-CG1 3.66Å; M1091-V1140 HydrophobicContact CG-CG1 3.84Å; M1091-V1140 HydrophobicContact SD-CG1 3.68Å; M1091-L1141 WeakPolarHBondContact CA-O 3.28Å; M1091-E1142 HydrophobicContact CG-CG 4.23Å; M1091-E1142 HydrophobicContact SD-CG 4.32Å
1092	L	90.2	Very high	85.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.7	175.6	-170.1	77.1	0	0	0	109.8	V627 L637 L638 L639 F1082 L1086 L1141	V627-L1092 HydrophobicContact CG1-CD1 3.5Å; V627-L1092 VanDerWaalsContact CG1-CD1 3.5Å; L637-L1092 HydrophobicContact CD1-CD1 4.03Å; L637-L1092 HydrophobicContact CD1-CD2 4.47Å; L637-L1092 HydrophobicContact CD1-CG 4.3Å; L638-L1092 WeakPolarHBondContact O-CD2 3.15Å; L639-L1092 HydrophobicContact CD2-CD2 3.72Å; F1082-L1092 HydrophobicContact CE2-CD1 3.76Å; F1082-L1092 HydrophobicContact CE2-CG 4.39Å; F1082-L1092 HydrophobicContact CZ-CD1 3.54Å; L1086-L1092 HydrophobicContact CD1-CD1 4.48Å; L1092-L1141 HydrophobicContact CB-CB 4.1Å; L1092-L1141 HydrophobicContact CD2-CD1 4.14Å; L1092-L1141 PolarHBondContact N-O 3.47Å; L1092-L1141 PolarHBondContact O-N 2.85Å
1093	L	92.2	Very high	83.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128	176.8	-40.1	179	0	0	0	109	F1067 Y1078 L1081 F1082 A1085 V1138 F1139 V1140	F1067-L1093 HydrophobicContact CE1-CD2 4.24Å; F1067-L1093 HydrophobicContact CZ-CD2 3.82Å; Y1078-L1093 HydrophobicContact CE2-CB 4.16Å; Y1078-L1093 HydrophobicContact CE2-CD1 4.32Å; Y1078-L1093 WeakPolarHBondContact OH-CB 3.49Å; Y1078-L1093 PolarHBondContact OH-O 2.05Å; L1081-L1093 HydrophobicContact CB-CD1 4.44Å; L1081-L1093 HydrophobicContact CD2-CD1 4.2Å; L1081-L1093 HydrophobicContact CG-CD1 3.85Å; F1082-L1093 HydrophobicContact CB-CD1 4.12Å; F1082-L1093 HydrophobicContact CD2-CB 3.9Å; F1082-L1093 HydrophobicContact CD2-CD1 4.48Å; F1082-L1093 HydrophobicContact CD2-CG 4.15Å; F1082-L1093 WeakPolarHBondContact CE2-O 3.47Å; A1085-L1093 HydrophobicContact CB-CD1 4.26Å; A1085-L1093 HydrophobicContact CB-CD2 3.95Å; A1085-L1093 HydrophobicContact CB-CG 4.21Å; L1093-V1138 HydrophobicContact CB-CG1 4.02Å; L1093-V1138 HydrophobicContact CD1-CG1 4.07Å; L1093-V1138 HydrophobicContact CD2-CG1 3.89Å; L1093-V1138 HydrophobicContact CG-CG1 4.22Å; L1093-F1139 WeakPolarHBondContact CA-O 3.42Å; L1093-V1140 HydrophobicContact CD2-CB 4.39Å; L1093-V1140 HydrophobicContact CD2-CG1 4.13Å; L1093-V1140 HydrophobicContact CD2-CG2 3.65Å
1094	I	91	Very high	81.4	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.026	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-32.6	-179.8	-53.7	162	0	0	0	111.5	M578 L637 L639 I672 A1115 F1139 L1141	M578-I1094 HydrophobicContact CE-CD1 4.26Å; M578-I1094 HydrophobicContact CE-CG2 4.24Å; M578-I1094 HydrophobicContact SD-CB 4.23Å; M578-I1094 HydrophobicContact SD-CG2 3.59Å; M578-I1094 VanDerWaalsContact SD-CG2 3.59Å; L637-I1094 HydrophobicContact CD2-CG2 4.45Å; L639-I1094 HydrophobicContact CD2-CG1 4.23Å; I672-I1094 HydrophobicContact CD1-CG2 3.91Å; I1094-A1115 WeakPolarHBondContact O-CA 3.13Å; I1094-A1115 PolarHBondContact O-N 3.04Å; I1094-F1139 HydrophobicContact CB-CB 4.4Å; I1094-F1139 PolarHBondContact N-O 3.46Å; I1094-L1141 HydrophobicContact CD1-CD1 3.64Å; I1094-L1141 HydrophobicContact CD1-CD2 3.86Å; I1094-L1141 HydrophobicContact CD1-CG 3.44Å; I1094-L1141 VanDerWaalsContact CD1-CG 3.44Å; I1094-L1141 HydrophobicContact CG1-CD1 3.89Å; I1094-L1141 HydrophobicContact CG1-CG 3.91Å
1095	G	91.8	Very high	79.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	-175.3	-172.3	0	0	0	0	0	114.1	I1113 V1138 F1139	G1095-I1113 CarbonylContact C-O 3.43Å; G1095-I1113 WeakPolarHBondContact CA-O 3.46Å; G1095-V1138 WeakPolarHBondContact O-CG1 3.47Å; G1095-F1139 PolarHBondContact O-N 2.89Å
1096	L	90.7	Very high	77.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	147	-179.7	-56.9	172.8	0	0	0	110.3	Y1078 I1113 P1116 M1120 L1122 I1136 V1138	Y1078-L1096 HydrophobicContact CD2-CD1 4.17Å; Y1078-L1096 HydrophobicContact CD2-CD2 3.83Å; Y1078-L1096 HydrophobicContact CD2-CG 4.09Å; Y1078-L1096 HydrophobicContact CE2-CD2 3.93Å; Y1078-L1096 HydrophobicContact CE2-CG 4.2Å; L1096-I1113 HydrophobicContact CB-CB 4.39Å; L1096-I1113 PolarHBondContact N-O 3.06Å; L1096-I1113 PolarHBondContact O-N 3.29Å; L1096-P1116 HydrophobicContact CD1-CB 4.4Å; L1096-P1116 HydrophobicContact CD1-CG 3.85Å; L1096-P1116 HydrophobicContact CG-CG 3.82Å; L1096-M1120 HydrophobicContact CD1-SD 4.09Å; L1096-L1122 HydrophobicContact CD1-CD2 4.18Å; L1096-L1122 HydrophobicContact CD2-CD2 4.38Å; L1096-I1136 HydrophobicContact CB-CG2 4.31Å; L1096-I1136 HydrophobicContact CD2-CG2 3.96Å; L1096-V1138 HydrophobicContact CD2-CB 4.49Å; L1096-V1138 HydrophobicContact CD2-CG1 4.24Å; L1096-V1138 HydrophobicContact CD2-CG2 3.94Å
1097	Y	89.1	Confident	76.3	Confident	24 Å²	24	59.1 Å²	59.1	9%	0.094	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	81.6	169.8	-168.5	-131.5	0	0	0	108.7	P573 C991 R1110 F1111 V1112 N1137 F1139	P573-Y1097 HydrophobicContact CB-CE1 4.1Å; C991-Y1097 PolarHBondContact O-OH 3.03Å; Y1097-R1110 HydrophobicContact CD1-CB 3.79Å; Y1097-R1110 VanDerWaalsContact CD1-CD 3.47Å; Y1097-R1110 HydrophobicContact CD1-CG 4.28Å; Y1097-R1110 HydrophobicContact CD2-CB 3.94Å; Y1097-R1110 HydrophobicContact CE1-CB 3.5Å; Y1097-R1110 VanDerWaalsContact CE1-CD 3.47Å; Y1097-R1110 HydrophobicContact CE1-CG 4.13Å; Y1097-R1110 HydrophobicContact CE2-CB 3.65Å; Y1097-R1110 WeakPolarHBondContact CE2-O 3.23Å; Y1097-R1110 HydrophobicContact CG-CB 3.99Å; Y1097-R1110 VanDerWaalsContact CZ-CB 3.42Å; Y1097-R1110 PolarHBondContact O-NH1 2Å; Y1097-F1111 CarbonylContact C-O 3.56Å; Y1097-F1111 WeakPolarHBondContact CA-O 3.45Å; Y1097-V1112 HydrophobicContact CD2-CG2 3.89Å; Y1097-V1112 HydrophobicContact CE2-CG2 4.1Å; Y1097-N1137 WeakPolarHBondContact CB-O 3.49Å; Y1097-N1137 HydrophobicContact CD1-CB 4.18Å; Y1097-N1137 PolarHBondContact N-O 2.87Å; Y1097-F1139 HydrophobicContact CD2-CZ 4.36Å; Y1097-F1139 HydrophobicContact CG-CE2 4.44Å; Y1097-F1139 HydrophobicContact CG-CZ 4.28Å
1098	R	86.1	Confident	75.2	Confident	8 Å²	8	54.9 Å²	54.9	3%	0.03	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	140.9	-166.7	173.6	169.2	-75.9	167.2	-4	110.7	D600 R1110 F1111 I1113 K1121	D600-R1098 IonicContact OD2-NH1 3.83Å; D600-R1098 PolarHBondContact OD2-NH1 3.49Å; R1098-R1110 CarbonylContact O-C 3.59Å; R1098-R1110 WeakPolarHBondContact O-CA 3.13Å; R1098-R1110 WeakPolarHBondContact O-CB 3.33Å; R1098-F1111 HydrophobicContact CB-CE1 4Å; R1098-F1111 HydrophobicContact CB-CE2 4.49Å; R1098-F1111 HydrophobicContact CB-CZ 3.98Å; R1098-F1111 HydrophobicContact CG-CE1 3.8Å; R1098-F1111 HydrophobicContact CG-CZ 3.86Å; R1098-F1111 PolarHBondContact N-O 3.45Å; R1098-F1111 VanDerWaalsContact O-CD1 3.27Å; R1098-F1111 WeakPolarHBondContact O-CD1 3.48Å; R1098-F1111 PolarHBondContact O-N 2.92Å; R1098-I1113 HydrophobicContact CB-CD1 4.05Å; R1098-K1121 PolarHBondContact NH2-O 3.17Å
1099	L	80.6	Confident	74.8	Confident	10 Å²	10	50.6 Å²	50.6	5%	0.052	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	136.8	174.2	-165.6	77.3	0	0	0	110.5	E1101 V1107 K1109 R1110 L1134	L1099-E1101 PolarHBondContact O-N 3.12Å; L1099-V1107 HydrophobicContact CD2-CG1 3.86Å; L1099-K1109 WeakPolarHBondContact CD1-O 3.3Å; L1099-R1110 HydrophobicContact CB-CG 4.43Å; L1099-R1110 HydrophobicContact CD1-CG 3.81Å; L1099-L1134 HydrophobicContact CD1-CD2 4.09Å; L1099-L1134 HydrophobicContact CD2-CD2 4.06Å
1100	Q	76.6	Confident	74.9	Confident	14 Å²	14	48.2 Å²	48.2	7%	0.065	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-75.4	119.1	172.5	-166.9	178.4	6.9	0	0	108.8	W597 Q987 M1102 K1109 F1111	W597-Q1100 HydrophobicContact CB-CG 4.47Å; W597-Q1100 HydrophobicContact CD2-CG 4.37Å; W597-Q1100 VanDerWaalsContact CE2-NE2 3.34Å; W597-Q1100 HydrophobicContact CG-CG 4.12Å; Q987-Q1100 VanDerWaalsContact OE1-NE2 3.09Å; Q1100-M1102 HydrophobicContact CG-CG 4.28Å; Q1100-M1102 PolarHBondContact O-N 3.46Å; Q1100-K1109 PolarHBondContact N-O 3.2Å; Q1100-F1111 HydrophobicContact CB-CD1 4.26Å
1101	E	63.7	Low	75.2	Confident	117 Å²	117	48.2 Å²	48.2	55%	0.547	24%	0.242	S	C	.	.			trans	-73.7	90.9	175.7	-71.4	179.6	162.7	0	0	109.6	L1099 Q1123 T1125	L1099-E1101 PolarHBondContact O-N 3.12Å; E1101-Q1123 PolarHBondContact OE1-NE2 2.99Å; E1101-Q1123 PolarHBondContact OE2-NE2 3.11Å; E1101-T1125 HydrophobicContact CG-CG2 4.41Å
1102	M	56.5	Low	75.4	Confident	113 Å²	113	48.1 Å²	48.1	56%	0.557	24%	0.242	S	C	*	.			trans	-126.6	175.7	167.8	-74.8	-131	175.4	0	0	110.5	Q1100	Q1100-M1102 HydrophobicContact CG-CG 4.28Å; Q1100-M1102 PolarHBondContact O-N 3.46Å
1103	Q	52.4	Low	75.5	Confident	145 Å²	145	48.2 Å²	48.2	68%	0.678	24%	0.242	S	C	*	.			trans	-43.9	147.5	-167.6	-62	-179.6	24.6	0	0	113.6	E1105 E1106	Q1103-E1105 PolarHBondContact O-N 3.4Å; Q1103-E1106 PolarHBondContact O-N 3.14Å
1104	P	50.5	Low	75.5	Confident	121 Å²	121	48.4 Å²	48.4	79%	0.786	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-3.6	-169.9	20.9	-32.7	0	0	0	116.5	V1107	P1104-V1107 WeakPolarHBondContact O-CG2 3.34Å
1105	E	49.9	Very low	75.6	Confident	190 Å²	190	48.8 Å²	48.8	89%	0.888	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-10.3	178.6	-58.6	-168	172.4	0	0	113.5	Q1103	Q1103-E1105 PolarHBondContact O-N 3.4Å
1106	E	53.7	Low	75.5	Confident	93 Å²	93	49 Å²	49	44%	0.435	25%	0.249	S	C	.	.			trans	-116.1	19.7	-171.1	-67.1	177.9	164.1	0	0	114.4	Q1103 T1108	Q1103-E1106 PolarHBondContact O-N 3.14Å; E1106-T1108 PolarHBondContact O-N 2.64Å
1107	V	56.9	Low	75.5	Confident	50 Å²	50	51.1 Å²	51.1	30%	0.303	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	42.7	-161.7	-161.1	0	0	0	0	116.2	L1099 P1104 L1134	L1099-V1107 HydrophobicContact CD2-CG1 3.86Å; P1104-V1107 WeakPolarHBondContact O-CG2 3.34Å; V1107-L1134 HydrophobicContact CG1-CD1 3.75Å; V1107-L1134 HydrophobicContact CG1-CD2 4.34Å
1108	T	66.5	Low	75.5	Confident	60 Å²	60	53.5 Å²	53.5	37%	0.368	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-17.6	-175.1	61.1	0	0	0	0	116.1	Q955 E1106 R1110	Q955-T1108 HydrophobicContact CG-CG2 4.12Å; E1106-T1108 PolarHBondContact O-N 2.64Å; T1108-R1110 PolarHBondContact O-N 2.86Å
1109	K	76.9	Confident	75.6	Confident	25 Å²	25	59 Å²	59	11%	0.109	30%	0.304	C	S	.	.			trans	-76.3	129.2	-178.1	-60.6	-168.4	-175.5	-165	0	111	D972 D974 D975 L1099 Q1100	D972-K1109 WeakPolarHBondContact OD2-CE 3.44Å; D972-K1109 IonicContact OD2-NZ 2.8Å; D972-K1109 PolarHBondContact OD2-NZ 3.01Å; D974-K1109 IonicContact OD1-NZ 3.83Å; D974-K1109 PolarHBondContact OD1-NZ 2.82Å; D974-K1109 VanDerWaalsContact OD2-CE 3.24Å; D974-K1109 WeakPolarHBondContact OD2-CE 3.38Å; D974-K1109 IonicContact OD2-NZ 3.91Å; D974-K1109 PolarHBondContact OD2-NZ 3.45Å; D975-K1109 IonicContact OD1-NZ 3.21Å; L1099-K1109 WeakPolarHBondContact CD1-O 3.3Å; Q1100-K1109 PolarHBondContact N-O 3.2Å
1110	R	85.6	Confident	76	Confident	30 Å²	30	59.3 Å²	59.3	11%	0.113	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.4	178.2	-67.8	175	-179.8	-101.8	5.9	109	C991 Y1097 R1098 L1099 T1108 S1135	C991-R1110 WeakPolarHBondContact CA-O 3.31Å; C991-R1110 VanDerWaalsContact CB-O 3.27Å; C991-R1110 WeakPolarHBondContact CB-O 3.46Å; C991-R1110 PolarHBondContact SG-O 2.65Å; C991-R1110 VanDerWaalsContact SG-O 3.32Å; Y1097-R1110 HydrophobicContact CD1-CB 3.79Å; Y1097-R1110 VanDerWaalsContact CD1-CD 3.47Å; Y1097-R1110 HydrophobicContact CD1-CG 4.28Å; Y1097-R1110 HydrophobicContact CD2-CB 3.94Å; Y1097-R1110 HydrophobicContact CE1-CB 3.5Å; Y1097-R1110 VanDerWaalsContact CE1-CD 3.47Å; Y1097-R1110 HydrophobicContact CE1-CG 4.13Å; Y1097-R1110 HydrophobicContact CE2-CB 3.65Å; Y1097-R1110 WeakPolarHBondContact CE2-O 3.23Å; Y1097-R1110 HydrophobicContact CG-CB 3.99Å; Y1097-R1110 VanDerWaalsContact CZ-CB 3.42Å; Y1097-R1110 PolarHBondContact O-NH1 2Å; R1098-R1110 CarbonylContact O-C 3.59Å; R1098-R1110 WeakPolarHBondContact O-CA 3.13Å; R1098-R1110 WeakPolarHBondContact O-CB 3.33Å; L1099-R1110 HydrophobicContact CB-CG 4.43Å; L1099-R1110 HydrophobicContact CD1-CG 3.81Å; T1108-R1110 PolarHBondContact O-N 2.86Å; R1110-S1135 VanDerWaalsContact CZ-O 3.28Å; R1110-S1135 PolarHBondContact NH1-O 3.49Å; R1110-S1135 PolarHBondContact NH2-O 3.21Å
1111	F	90.2	Very high	76.4	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.018	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	157.6	179.3	67.7	-84.3	0	0	0	111.3	W597 D600 T990 Y1097 R1098 Q1100 I1113	W597-F1111 HydrophobicContact CB-CD1 4.37Å; W597-F1111 HydrophobicContact CB-CE1 3.73Å; W597-F1111 HydrophobicContact CB-CE2 4.4Å; W597-F1111 HydrophobicContact CB-CZ 3.74Å; W597-F1111 HydrophobicContact CE3-CG 4.42Å; W597-F1111 VanDerWaalsContact O-CE2 3.3Å; W597-F1111 WeakPolarHBondContact O-CE2 3.48Å; D600-F1111 HydrophobicContact CB-CE2 4.13Å; T990-F1111 WeakPolarHBondContact O-CA 3.3Å; Y1097-F1111 CarbonylContact C-O 3.56Å; Y1097-F1111 WeakPolarHBondContact CA-O 3.45Å; R1098-F1111 HydrophobicContact CB-CE1 4Å; R1098-F1111 HydrophobicContact CB-CE2 4.49Å; R1098-F1111 HydrophobicContact CB-CZ 3.98Å; R1098-F1111 HydrophobicContact CG-CE1 3.8Å; R1098-F1111 HydrophobicContact CG-CZ 3.86Å; R1098-F1111 PolarHBondContact N-O 3.45Å; R1098-F1111 VanDerWaalsContact O-CD1 3.27Å; R1098-F1111 WeakPolarHBondContact O-CD1 3.48Å; R1098-F1111 PolarHBondContact O-N 2.92Å; Q1100-F1111 HydrophobicContact CB-CD1 4.26Å; F1111-I1113 HydrophobicContact CD2-CD1 4.5Å; F1111-I1113 HydrophobicContact CD2-CG1 3.98Å; F1111-I1113 HydrophobicContact CE2-CD1 3.64Å; F1111-I1113 HydrophobicContact CE2-CG1 3.54Å; F1111-I1113 HydrophobicContact CZ-CD1 4.1Å; F1111-I1113 HydrophobicContact CZ-CG1 4.45Å
1112	V	92.1	Very high	77.3	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	134.7	-174.3	177.7	0	0	0	0	111.5	G574 T577 M578 Y601 T990 Y1097 T1114 F1139	G574-V1112 WeakPolarHBondContact O-CG2 3.13Å; T577-V1112 HydrophobicContact CG2-CB 4.42Å; T577-V1112 HydrophobicContact CG2-CG2 4.38Å; M578-V1112 HydrophobicContact CB-CG1 3.85Å; Y601-V1112 WeakPolarHBondContact CD2-O 3.39Å; T990-V1112 PolarHBondContact O-N 2.92Å; Y1097-V1112 HydrophobicContact CD2-CG2 3.89Å; Y1097-V1112 HydrophobicContact CE2-CG2 4.1Å; V1112-T1114 HydrophobicContact CG1-CG2 3.85Å; V1112-F1139 HydrophobicContact CG1-CE2 4.3Å; V1112-F1139 HydrophobicContact CG2-CE2 4.48Å; V1112-F1139 HydrophobicContact CG2-CZ 4.46Å
1113	I	92.9	Very high	77.9	Confident	3 Å²	3	58 Å²	58	2%	0.015	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	111.6	168.7	-53.3	170.7	0	0	0	107.6	D600 G1095 L1096 R1098 F1111 P1116 M1120	D600-I1113 HydrophobicContact CB-CD1 3.92Å; D600-I1113 HydrophobicContact CB-CG1 4.34Å; G1095-I1113 CarbonylContact C-O 3.43Å; G1095-I1113 WeakPolarHBondContact CA-O 3.46Å; L1096-I1113 HydrophobicContact CB-CB 4.39Å; L1096-I1113 PolarHBondContact N-O 3.06Å; L1096-I1113 PolarHBondContact O-N 3.29Å; R1098-I1113 HydrophobicContact CB-CD1 4.05Å; F1111-I1113 HydrophobicContact CD2-CD1 4.5Å; F1111-I1113 HydrophobicContact CD2-CG1 3.98Å; F1111-I1113 HydrophobicContact CE2-CD1 3.64Å; F1111-I1113 HydrophobicContact CE2-CG1 3.54Å; F1111-I1113 HydrophobicContact CZ-CD1 4.1Å; F1111-I1113 HydrophobicContact CZ-CG1 4.45Å; I1113-P1116 HydrophobicContact CG2-CB 4.26Å; I1113-P1116 HydrophobicContact CG2-CG 3.93Å; I1113-M1120 HydrophobicContact CD1-CE 4.31Å; I1113-M1120 HydrophobicContact CD1-SD 4.37Å; I1113-M1120 HydrophobicContact CG2-CE 4.48Å
1114	T	92.7	Very high	77.8	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	141.4	179.6	68.4	0	0	0	0	110.1	M578 G604 V1112	M578-T1114 HydrophobicContact CB-CG2 3.98Å; M578-T1114 HydrophobicContact CG-CG2 3.53Å; M578-T1114 HydrophobicContact SD-CG2 4.22Å; G604-T1114 WeakPolarHBondContact CA-OG1 3.31Å; G604-T1114 PolarHBondContact O-OG1 3.18Å; V1112-T1114 HydrophobicContact CG1-CG2 3.85Å
1115	A	91.6	Very high	77.9	Confident	14 Å²	14	50.6 Å²	50.6	12%	0.116	26%	0.255	C	S	.	.	S	Bend	trans	36.6	60.9	-179.4	0	0	0	0	0	115.2	M607 L637 I672 I1094	M607-A1115 HydrophobicContact CE-CB 3.43Å; M607-A1115 VanDerWaalsContact CE-CB 3.43Å; M607-A1115 HydrophobicContact CG-CB 4.35Å; L637-A1115 HydrophobicContact CD2-CB 4.13Å; I672-A1115 HydrophobicContact CB-CB 4.43Å; I672-A1115 HydrophobicContact CG2-CB 3.72Å; I1094-A1115 WeakPolarHBondContact O-CA 3.13Å; I1094-A1115 PolarHBondContact O-N 3.04Å
1116	P	91.5	Very high	77.9	Confident	4 Å²	4	41.6 Å²	41.6	3%	0.026	21%	0.213	C	C	.	.			trans	-57.2	149.3	178.2	-13.2	20.1	0	0	0	112.4	Y1078 L1096 I1113 M1120	Y1078-P1116 HydrophobicContact CD1-CB 3.88Å; Y1078-P1116 HydrophobicContact CD1-CG 4.15Å; Y1078-P1116 VanDerWaalsContact CD1-O 3.3Å; Y1078-P1116 WeakPolarHBondContact CD1-O 3.36Å; Y1078-P1116 HydrophobicContact CD2-CB 4.42Å; Y1078-P1116 HydrophobicContact CD2-CG 4.09Å; Y1078-P1116 HydrophobicContact CE1-CB 4.2Å; Y1078-P1116 HydrophobicContact CE1-CG 4.08Å; Y1078-P1116 WeakPolarHBondContact CE1-O 3.34Å; Y1078-P1116 HydrophobicContact CE2-CG 4.01Å; Y1078-P1116 HydrophobicContact CG-CB 3.99Å; Y1078-P1116 HydrophobicContact CG-CG 4.14Å; L1096-P1116 HydrophobicContact CD1-CB 4.4Å; L1096-P1116 HydrophobicContact CD1-CG 3.85Å; L1096-P1116 HydrophobicContact CG-CG 3.82Å; I1113-P1116 HydrophobicContact CG2-CB 4.26Å; I1113-P1116 HydrophobicContact CG2-CG 3.93Å; P1116-M1120 HydrophobicContact CB-CB 4.37Å; P1116-M1120 HydrophobicContact CB-SD 3.74Å
1117	P	89.7	Confident	77.3	Confident	44 Å²	44	38.6 Å²	38.6	29%	0.286	20%	0.2	S	C	.	.			trans	-68.2	152.9	178.3	29.7	-34.7	0	0	0	111.2	N1119 M1120	P1117-N1119 WeakPolarHBondContact CB-OD1 3.02Å; P1117-N1119 PolarHBondContact O-N 3.41Å; P1117-M1120 HydrophobicContact CG-CB 4.09Å; P1117-M1120 WeakPolarHBondContact O-CB 3.11Å; P1117-M1120 PolarHBondContact O-N 3.35Å
1118	E	88.6	Confident	76.2	Confident	75 Å²	75	39.8 Å²	39.8	35%	0.35	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-38.6	-178.3	-172	-168.7	168.7	0	0	113	F631 T1077 G1079	F631-E1118 HydrophobicContact CE1-CB 4.23Å; F631-E1118 HydrophobicContact CE1-CG 4.17Å; T1077-E1118 VanDerWaalsContact CB-O 3.31Å; T1077-E1118 WeakPolarHBondContact CB-O 3.38Å; G1079-E1118 PolarHBondContact N-O 2.91Å
1119	N	89.4	Confident	74.5	Confident	123 Å²	123	48.8 Å²	48.8	66%	0.658	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-0.8	-175.5	67.4	-16.6	0	0	0	114.8	P1117 K1121	P1117-N1119 WeakPolarHBondContact CB-OD1 3.02Å; P1117-N1119 PolarHBondContact O-N 3.41Å; N1119-K1121 PolarHBondContact O-N 3.27Å
1120	M	88.7	Confident	72.5	Confident	16 Å²	16	54.9 Å²	54.9	8%	0.079	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-63.2	122.2	178.2	-179	174.6	-101.1	0	0	109.6	D600 T1077 Y1078 L1096 I1113 P1116 P1117	D600-M1120 HydrophobicContact CB-CE 4.19Å; D600-M1120 VanDerWaalsContact OD1-CE 3.27Å; D600-M1120 WeakPolarHBondContact OD1-CE 2.82Å; D600-M1120 WeakPolarHBondContact OD2-CE 3.5Å; T1077-M1120 CarbonylContact C-O 3.56Å; T1077-M1120 VanDerWaalsContact CA-O 3.29Å; T1077-M1120 WeakPolarHBondContact CA-O 3.14Å; Y1078-M1120 PolarHBondContact N-O 3.04Å; L1096-M1120 HydrophobicContact CD1-SD 4.09Å; I1113-M1120 HydrophobicContact CD1-CE 4.31Å; I1113-M1120 HydrophobicContact CD1-SD 4.37Å; I1113-M1120 HydrophobicContact CG2-CE 4.48Å; P1116-M1120 HydrophobicContact CB-CB 4.37Å; P1116-M1120 HydrophobicContact CB-SD 3.74Å; P1117-M1120 HydrophobicContact CG-CB 4.09Å; P1117-M1120 WeakPolarHBondContact O-CB 3.11Å; P1117-M1120 PolarHBondContact O-N 3.35Å
1121	K	85.1	Confident	69.9	Low	152 Å²	152	63.4 Å²	63.4	66%	0.661	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-71.4	138.5	176.2	-66.7	-175.7	179.5	-178.7	0	110.2	R1098 N1119	R1098-K1121 PolarHBondContact NH2-O 3.17Å; N1119-K1121 PolarHBondContact O-N 3.27Å
1122	L	81.5	Confident	67.5	Low	8 Å²	8	68.4 Å²	68.4	4%	0.042	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-78.1	129.2	163.7	-55.6	172.3	0	0	0	106.9	I1062 V1072 W1076 L1081 L1096 I1136	I1062-L1122 HydrophobicContact CD1-CD1 4.15Å; I1062-L1122 HydrophobicContact CD1-CD2 4.36Å; V1072-L1122 HydrophobicContact CG1-CD1 4.35Å; W1076-L1122 HydrophobicContact CB-CD1 4.21Å; W1076-L1122 PolarHBondContact O-N 3.24Å; L1081-L1122 HydrophobicContact CB-CD1 4.34Å; L1081-L1122 HydrophobicContact CD2-CD1 4.04Å; L1096-L1122 HydrophobicContact CD1-CD2 4.18Å; L1096-L1122 HydrophobicContact CD2-CD2 4.38Å; L1122-I1136 HydrophobicContact CD2-CD1 4.04Å
1123	Q	68.8	Low	64.9	Low	57 Å²	57	72.8 Å²	72.8	27%	0.266	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-80.1	162.8	-179	-68.4	-176.1	-62	0	0	111.9	E1101 D1126	E1101-Q1123 PolarHBondContact OE1-NE2 2.99Å; E1101-Q1123 PolarHBondContact OE2-NE2 3.11Å; Q1123-D1126 WeakPolarHBondContact CA-OD2 3.23Å; Q1123-D1126 WeakPolarHBondContact CB-OD2 3.44Å; Q1123-D1126 PolarHBondContact N-OD2 3.01Å; Q1123-D1126 WeakPolarHBondContact O-CB 3.31Å; Q1123-D1126 PolarHBondContact O-N 3.41Å
1124	M	51.3	Low	62.8	Low	67 Å²	67	74.5 Å²	74.5	33%	0.33	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-74	-29.8	-178.1	-101.3	-69.7	155.6	0	0	113.2	E1074 D1126 L1127 V1128	E1074-M1124 HydrophobicContact CB-CE 3.22Å; E1074-M1124 HydrophobicContact CG-CE 3.29Å; E1074-M1124 HydrophobicContact CG-CG 3.88Å; E1074-M1124 HydrophobicContact CG-SD 4.43Å; E1074-M1124 VanDerWaalsContact OE1-CG 3.31Å; E1074-M1124 WeakPolarHBondContact OE1-CG 3.27Å; E1074-M1124 WeakPolarHBondContact OE2-CE 3.41Å; M1124-D1126 PolarHBondContact O-N 3.13Å; M1124-L1127 HydrophobicContact CE-CB 4.11Å; M1124-L1127 HydrophobicContact CE-CD1 3.59Å; M1124-L1127 CarbonylContact O-C 3.53Å; M1124-L1127 WeakPolarHBondContact O-CA 3.28Å; M1124-L1127 PolarHBondContact O-N 2.94Å; M1124-L1127 HydrophobicContact SD-CB 3.8Å; M1124-L1127 HydrophobicContact SD-CD1 4.13Å; M1124-V1128 HydrophobicContact CB-CG2 4.48Å; M1124-V1128 WeakPolarHBondContact O-CG2 3.2Å; M1124-V1128 PolarHBondContact O-N 2.77Å
1125	T	53.1	Low	60.7	Low	44 Å²	44	74.6 Å²	74.6	27%	0.27	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-51.2	-24.5	168.2	39.3	0	0	0	0	112	E1101 L1134	E1101-T1125 HydrophobicContact CG-CG2 4.41Å; T1125-L1134 VanDerWaalsContact O-O 3.05Å
1126	D	49.5	Very low	59	Low	1 Å²	1	74 Å²	74	1%	0.005	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-82.9	-14.3	178.8	-39.6	-34.7	0	0	0	113.6	I1062 Q1123 M1124 S1135 I1136	I1062-D1126 HydrophobicContact CD1-CB 4.13Å; Q1123-D1126 WeakPolarHBondContact CA-OD2 3.23Å; Q1123-D1126 WeakPolarHBondContact CB-OD2 3.44Å; Q1123-D1126 PolarHBondContact N-OD2 3.01Å; Q1123-D1126 WeakPolarHBondContact O-CB 3.31Å; Q1123-D1126 PolarHBondContact O-N 3.41Å; M1124-D1126 PolarHBondContact O-N 3.13Å; D1126-S1135 WeakPolarHBondContact O-CA 3.15Å; D1126-I1136 HydrophobicContact CB-CB 4.06Å; D1126-I1136 HydrophobicContact CB-CD1 3.46Å; D1126-I1136 VanDerWaalsContact CB-CD1 3.46Å; D1126-I1136 HydrophobicContact CB-CG1 3.44Å; D1126-I1136 VanDerWaalsContact CB-CG1 3.44Å; D1126-I1136 WeakPolarHBondContact OD1-CD1 3.5Å; D1126-I1136 WeakPolarHBondContact OD1-CG1 3.11Å; D1126-I1136 WeakPolarHBondContact OD2-CD1 3.43Å; D1126-I1136 WeakPolarHBondContact OD2-CG1 3.4Å
1127	L	40.7	Very low	58.2	Low	30 Å²	30	75.5 Å²	75.5	16%	0.157	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-12	-171	-66.5	167	0	0	0	113.3	I1062 V1072 M1124 R1129	I1062-L1127 HydrophobicContact CG2-CD2 3.98Å; V1072-L1127 HydrophobicContact CB-CD2 4.25Å; V1072-L1127 HydrophobicContact CG1-CD2 3.93Å; M1124-L1127 HydrophobicContact CE-CB 4.11Å; M1124-L1127 HydrophobicContact CE-CD1 3.59Å; M1124-L1127 CarbonylContact O-C 3.53Å; M1124-L1127 WeakPolarHBondContact O-CA 3.28Å; M1124-L1127 PolarHBondContact O-N 2.94Å; M1124-L1127 HydrophobicContact SD-CB 3.8Å; M1124-L1127 HydrophobicContact SD-CD1 4.13Å; L1127-R1129 PolarHBondContact O-N 3.04Å
1128	V	33.9	Very low	57.6	Low	75 Å²	75	73.4 Å²	73.4	46%	0.455	35%	0.354	S	S	.	.			trans	-72	119.5	-167.7	-171.6	0	0	0	0	113.3	M1124 M1130	M1124-V1128 HydrophobicContact CB-CG2 4.48Å; M1124-V1128 WeakPolarHBondContact O-CG2 3.2Å; M1124-V1128 PolarHBondContact O-N 2.77Å; V1128-M1130 VanDerWaalsContact C-N 3.27Å; V1128-M1130 HydrophobicContact CG1-CB 3.9Å; V1128-M1130 HydrophobicContact CG1-CG 4.22Å; V1128-M1130 PolarHBondContact O-N 3.47Å; V1128-M1130 VanDerWaalsContact O-N 3.1Å
1129	R	31.3	Very low	57.4	Low	249 Å²	249	69.9 Å²	69.9	94%	0.94	34%	0.338	S	S	*	.			trans	-79.4	58.2	169.1	-162.9	177.1	-172.8	156.9	1.3	111.7	L1127	L1127-R1129 PolarHBondContact O-N 3.04Å
1130	M	34	Very low	57.2	Low	153 Å²	153	64 Å²	64	75%	0.754	31%	0.306	S	S	*	.	S	Bend	trans	-126	92.1	169.1	-91.1	-164.2	169.6	0	0	109.7	V1128 I1132	V1128-M1130 VanDerWaalsContact C-N 3.27Å; V1128-M1130 HydrophobicContact CG1-CB 3.9Å; V1128-M1130 HydrophobicContact CG1-CG 4.22Å; V1128-M1130 PolarHBondContact O-N 3.47Å; V1128-M1130 VanDerWaalsContact O-N 3.1Å; M1130-I1132 PolarHBondContact O-N 3.19Å
1131	Q	32.2	Very low	56.9	Low	209 Å²	209	63.4 Å²	63.4	98%	0.977	30%	0.303	S	S	*	.	S	Bend	trans	46.2	3.4	161.1	-124.1	159.6	-17.1	0	0	120.1
1132	I	40	Very low	56.9	Low	109 Å²	109	57.5 Å²	57.5	56%	0.559	28%	0.278	S	S	*	.	S	Bend	trans	-136.4	118.7	180	-42.7	175.8	0	0	0	105.8	M1130 L1134	M1130-I1132 PolarHBondContact O-N 3.19Å; I1132-L1134 HydrophobicContact CB-CD1 3.76Å; I1132-L1134 HydrophobicContact CB-CG 4.13Å; I1132-L1134 HydrophobicContact CD1-CD1 4.17Å; I1132-L1134 HydrophobicContact CG2-CD1 3.54Å; I1132-L1134 HydrophobicContact CG2-CG 3.61Å; I1132-L1134 PolarHBondContact O-N 3.5Å
1133	N	37.4	Very low	56.8	Low	93 Å²	93	59 Å²	59	50%	0.497	29%	0.288	S	S	.	.			trans	-69.9	75.8	175.1	-73.6	-1	0	0	0	109.1	E1064	E1064-N1133 VanDerWaalsContact OE1-CG 3.32Å; E1064-N1133 PolarHBondContact OE1-ND2 2.92Å
1134	L	46.9	Very low	57.3	Low	38 Å²	38	57.4 Å²	57.4	20%	0.199	28%	0.28	C	S	.	.			trans	-100.2	30.2	-179.9	-82.3	160.7	0	0	0	112.3	L1099 V1107 T1125 I1132	L1099-L1134 HydrophobicContact CD1-CD2 4.09Å; L1099-L1134 HydrophobicContact CD2-CD2 4.06Å; V1107-L1134 HydrophobicContact CG1-CD1 3.75Å; V1107-L1134 HydrophobicContact CG1-CD2 4.34Å; T1125-L1134 VanDerWaalsContact O-O 3.05Å; I1132-L1134 HydrophobicContact CB-CD1 3.76Å; I1132-L1134 HydrophobicContact CB-CG 4.13Å; I1132-L1134 HydrophobicContact CD1-CD1 4.17Å; I1132-L1134 HydrophobicContact CG2-CD1 3.54Å; I1132-L1134 HydrophobicContact CG2-CG 3.61Å; I1132-L1134 PolarHBondContact O-N 3.5Å
1135	S	50.1	Low	58.3	Low	6 Å²	6	58.3 Å²	58.3	4%	0.042	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-60.2	148.8	178.2	13.4	0	0	0	0	112.4	T1063 R1110 D1126 N1137	T1063-S1135 WeakPolarHBondContact OG1-CB 3.35Å; T1063-S1135 PolarHBondContact OG1-OG 3.25Å; R1110-S1135 VanDerWaalsContact CZ-O 3.28Å; R1110-S1135 PolarHBondContact NH1-O 3.49Å; R1110-S1135 PolarHBondContact NH2-O 3.21Å; D1126-S1135 WeakPolarHBondContact O-CA 3.15Å; S1135-N1137 PolarHBondContact O-N 3.49Å
1136	I	55.8	Low	59.1	Low	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-58	133.6	166.6	-78.9	162.3	0	0	0	107.6	G1061 I1062 L1096 L1122 D1126 V1138	G1061-I1136 CarbonylContact C-O 3.6Å; G1061-I1136 WeakPolarHBondContact CA-O 3.33Å; I1062-I1136 HydrophobicContact CD1-CB 3.7Å; I1062-I1136 HydrophobicContact CD1-CD1 3.84Å; I1062-I1136 HydrophobicContact CD1-CG1 4.28Å; I1062-I1136 HydrophobicContact CD1-CG2 4.43Å; I1062-I1136 HydrophobicContact CG1-CB 4.04Å; I1062-I1136 PolarHBondContact N-O 3.03Å; L1096-I1136 HydrophobicContact CB-CG2 4.31Å; L1096-I1136 HydrophobicContact CD2-CG2 3.96Å; L1122-I1136 HydrophobicContact CD2-CD1 4.04Å; D1126-I1136 HydrophobicContact CB-CB 4.06Å; D1126-I1136 HydrophobicContact CB-CD1 3.46Å; D1126-I1136 VanDerWaalsContact CB-CD1 3.46Å; D1126-I1136 HydrophobicContact CB-CG1 3.44Å; D1126-I1136 VanDerWaalsContact CB-CG1 3.44Å; D1126-I1136 WeakPolarHBondContact OD1-CD1 3.5Å; D1126-I1136 WeakPolarHBondContact OD1-CG1 3.11Å; D1126-I1136 WeakPolarHBondContact OD2-CD1 3.43Å; D1126-I1136 WeakPolarHBondContact OD2-CG1 3.4Å; I1136-V1138 HydrophobicContact CG2-CG2 3.96Å
1137	N	73.7	Confident	59.2	Low	37 Å²	37	64.9 Å²	64.9	20%	0.198	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	116.1	164.8	-83.5	9.4	0	0	0	109.9	Q1059 Y1060 Y1097 S1135	Q1059-N1137 VanDerWaalsContact CD-CB 3.42Å; Q1059-N1137 HydrophobicContact CG-CB 3.48Å; Q1059-N1137 VanDerWaalsContact CG-CB 3.48Å; Q1059-N1137 PolarHBondContact OE1-ND2 2.96Å; Y1060-N1137 CarbonylContact O-C 3.45Å; Y1060-N1137 WeakPolarHBondContact O-CA 3.27Å; Y1097-N1137 WeakPolarHBondContact CB-O 3.49Å; Y1097-N1137 HydrophobicContact CD1-CB 4.18Å; Y1097-N1137 PolarHBondContact N-O 2.87Å; S1135-N1137 PolarHBondContact O-N 3.49Å
1138	V	78.3	Confident	59.4	Low	0 Å²	0	69 Å²	69	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133.3	177.3	-174.1	0	0	0	0	108.6	Q1059 Y1060 I1062 F1067 L1081 L1093 G1095 L1096 I1136 V1140	Q1059-V1138 WeakPolarHBondContact CA-O 3.1Å; Y1060-V1138 PolarHBondContact N-O 3.4Å; Y1060-V1138 PolarHBondContact O-N 3.05Å; I1062-V1138 HydrophobicContact CG1-CG2 4.08Å; F1067-V1138 HydrophobicContact CE2-CB 3.99Å; F1067-V1138 HydrophobicContact CE2-CG2 4.11Å; F1067-V1138 HydrophobicContact CZ-CB 4.43Å; L1081-V1138 HydrophobicContact CD2-CG2 4.14Å; L1093-V1138 HydrophobicContact CB-CG1 4.02Å; L1093-V1138 HydrophobicContact CD1-CG1 4.07Å; L1093-V1138 HydrophobicContact CD2-CG1 3.89Å; L1093-V1138 HydrophobicContact CG-CG1 4.22Å; G1095-V1138 WeakPolarHBondContact O-CG1 3.47Å; L1096-V1138 HydrophobicContact CD2-CB 4.49Å; L1096-V1138 HydrophobicContact CD2-CG1 4.24Å; L1096-V1138 HydrophobicContact CD2-CG2 3.94Å; I1136-V1138 HydrophobicContact CG2-CG2 3.96Å; V1138-V1140 HydrophobicContact CB-CG2 4.35Å; V1138-V1140 HydrophobicContact CG1-CG2 4.18Å
1139	F	84.4	Confident	59.7	Low	0 Å²	0	70.7 Å²	70.7	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.9	172.4	-67.8	-76.4	0	0	0	109.6	A572 P573 M578 L1093 I1094 G1095 Y1097 V1112	A572-F1139 HydrophobicContact CB-CD1 4.03Å; A572-F1139 HydrophobicContact CB-CE1 3.98Å; P573-F1139 VanDerWaalsContact O-CE1 3.31Å; P573-F1139 WeakPolarHBondContact O-CE1 3.17Å; P573-F1139 WeakPolarHBondContact O-CZ 3.36Å; M578-F1139 HydrophobicContact CE-CB 4.49Å; M578-F1139 HydrophobicContact CE-CD1 4.31Å; M578-F1139 HydrophobicContact CE-CG 4.27Å; M578-F1139 HydrophobicContact SD-CD2 4.39Å; M578-F1139 HydrophobicContact SD-CG 4.46Å; L1093-F1139 WeakPolarHBondContact CA-O 3.42Å; I1094-F1139 HydrophobicContact CB-CB 4.4Å; I1094-F1139 PolarHBondContact N-O 3.46Å; G1095-F1139 PolarHBondContact O-N 2.89Å; Y1097-F1139 HydrophobicContact CD2-CZ 4.36Å; Y1097-F1139 HydrophobicContact CG-CE2 4.44Å; Y1097-F1139 HydrophobicContact CG-CZ 4.28Å; V1112-F1139 HydrophobicContact CG1-CE2 4.3Å; V1112-F1139 HydrophobicContact CG2-CE2 4.48Å; V1112-F1139 HydrophobicContact CG2-CZ 4.46Å
1140	V	83.6	Confident	59.9	Low	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.2	-173.5	-171.6	0	0	0	0	111	A1058 Y1060 F1067 M1091 L1093 V1138	A1058-V1140 PolarHBondContact N-O 3.36Å; A1058-V1140 PolarHBondContact O-N 3.36Å; Y1060-V1140 HydrophobicContact CD2-CB 4.17Å; Y1060-V1140 HydrophobicContact CD2-CG2 3.83Å; Y1060-V1140 HydrophobicContact CE2-CB 4.33Å; Y1060-V1140 HydrophobicContact CE2-CG2 4.46Å; F1067-V1140 HydrophobicContact CE2-CG2 4.29Å; F1067-V1140 HydrophobicContact CZ-CG2 3.83Å; M1091-V1140 HydrophobicContact CB-CG1 3.66Å; M1091-V1140 HydrophobicContact CG-CG1 3.84Å; M1091-V1140 HydrophobicContact SD-CG1 3.68Å; L1093-V1140 HydrophobicContact CD2-CB 4.39Å; L1093-V1140 HydrophobicContact CD2-CG1 4.13Å; L1093-V1140 HydrophobicContact CD2-CG2 3.65Å; V1138-V1140 HydrophobicContact CB-CG2 4.35Å; V1138-V1140 HydrophobicContact CG1-CG2 4.18Å
1141	L	84	Confident	59.7	Low	3 Å²	3	67.6 Å²	67.6	2%	0.016	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	103.2	163.5	-72.5	-179.9	0	0	0	108.4	L639 I655 N656 F1020 C1055 I1057 M1091 L1092 I1094	L639-L1141 HydrophobicContact CD2-CD1 4.39Å; I655-L1141 HydrophobicContact CG2-CD1 3.86Å; N656-L1141 HydrophobicContact CB-CB 4.45Å; N656-L1141 PolarHBondContact ND2-O 3.29Å; F1020-L1141 HydrophobicContact CE1-CD1 3.97Å; F1020-L1141 HydrophobicContact CE1-CD2 3.81Å; F1020-L1141 HydrophobicContact CZ-CD1 4.1Å; C1055-L1141 WeakPolarHBondContact SG-CA 3.41Å; C1055-L1141 WeakPolarHBondContact SG-CB 3.27Å; I1057-L1141 HydrophobicContact CB-CD2 4.48Å; M1091-L1141 WeakPolarHBondContact CA-O 3.28Å; L1092-L1141 HydrophobicContact CB-CB 4.1Å; L1092-L1141 HydrophobicContact CD2-CD1 4.14Å; L1092-L1141 PolarHBondContact N-O 3.47Å; L1092-L1141 PolarHBondContact O-N 2.85Å; I1094-L1141 HydrophobicContact CD1-CD1 3.64Å; I1094-L1141 HydrophobicContact CD1-CD2 3.86Å; I1094-L1141 HydrophobicContact CD1-CG 3.44Å; I1094-L1141 VanDerWaalsContact CD1-CG 3.44Å; I1094-L1141 HydrophobicContact CG1-CD1 3.89Å; I1094-L1141 HydrophobicContact CG1-CG 3.91Å
1142	E	83.9	Confident	59.8	Low	29 Å²	29	62 Å²	62	14%	0.136	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.8	-176.5	-165.4	-168.8	-173.5	0	0	110.3	C1055 R1056 Y1060 M1091	C1055-E1142 WeakPolarHBondContact CA-O 3.35Å; C1055-E1142 PolarHBondContact SG-N 3.49Å; C1055-E1142 VanDerWaalsContact SG-N 3.42Å; C1055-E1142 PolarHBondContact SG-O 2.96Å; R1056-E1142 HydrophobicContact CG-CB 4.14Å; R1056-E1142 IonicContact CZ-OE2 2.63Å; R1056-E1142 PolarHBondContact N-O 3.46Å; R1056-E1142 IonicContact NE-OE2 3.47Å; R1056-E1142 PolarHBondContact NE-OE2 3.21Å; R1056-E1142 VanDerWaalsContact NH2-CD 3.33Å; R1056-E1142 IonicContact NH2-OE1 3.29Å; R1056-E1142 PolarHBondContact NH2-OE1 3Å; R1056-E1142 IonicContact NH2-OE2 2.97Å; R1056-E1142 PolarHBondContact NH2-OE2 2.81Å; R1056-E1142 PolarHBondContact O-N 2.91Å; Y1060-E1142 PolarHBondContact OH-OE2 2.9Å; M1091-E1142 HydrophobicContact CG-CG 4.23Å; M1091-E1142 HydrophobicContact SD-CG 4.32Å
1143	P	80.6	Confident	59.5	Low	38 Å²	38	60.8 Å²	60.8	25%	0.247	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-64.3	154.6	169.3	28.5	-33.1	0	0	0	110.6	H1089 D1145	H1089-P1143 WeakPolarHBondContact O-CG 2.89Å; P1143-D1145 PolarHBondContact O-N 3.37Å
1144	F	79.1	Confident	58.9	Low	25 Å²	25	66.5 Å²	66.5	11%	0.11	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-65.9	128.1	179.6	-176.4	-108.4	0	0	0	111.2	N834 H836 D1053 H1146	N834-F1144 HydrophobicContact CB-CD2 4.42Å; N834-F1144 VanDerWaalsContact O-CD2 3.25Å; N834-F1144 WeakPolarHBondContact O-CD2 3.2Å; N834-F1144 WeakPolarHBondContact O-CE2 3.22Å; H836-F1144 AromaticContact CE1-CE2 3.85Å; H836-F1144 AromaticContact CE1-CZ 3.48Å; H836-F1144 VanDerWaalsContact CE1-CZ 3.48Å; H836-F1144 WeakPolarHBondContact CE1-CZ 3.32Å; D1053-F1144 WeakPolarHBondContact OD1-CD1 3.26Å; F1144-H1146 AromaticContact CD1-CE1 4Å; F1144-H1146 AromaticContact CD1-ND1 3.95Å; F1144-H1146 AromaticContact CE1-ND1 3.89Å
1145	D	72.8	Confident	58.1	Low	86 Å²	86	79.1 Å²	79.1	46%	0.46	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-91.1	118	175.8	-173.3	10.5	0	0	0	111.3	H836 P1143 G1147	H836-D1145 PolarHBondContact CE1-O 3.36Å; H836-D1145 PolarHBondContact NE2-O 3.29Å; H836-D1145 VanDerWaalsContact NE2-O 3.11Å; P1143-D1145 PolarHBondContact O-N 3.37Å; D1145-G1147 PolarHBondContact O-N 2.78Å; D1145-G1147 WeakPolarHBondContact OD1-CA 3.48Å; D1145-G1147 PolarHBondContact OD1-N 3.11Å
1146	H	68.3	Low	58.5	Low	132 Å²	132	82.8 Å²	82.8	61%	0.611	42%	0.421	S	S	*	.			trans	-75	-6.7	173.5	-63.5	-73.3	0	0	0	113.4	D1053 F1144 I1148	D1053-H1146 IonicContact OD1-CE1 3.7Å; D1053-H1146 PolarHBondContact OD1-CE1 3.33Å; D1053-H1146 IonicContact OD1-ND1 3.05Å; D1053-H1146 IonicContact OD1-NE2 3.75Å; D1053-H1146 IonicContact OD2-CE1 2.64Å; F1144-H1146 AromaticContact CD1-CE1 4Å; F1144-H1146 AromaticContact CD1-ND1 3.95Å; F1144-H1146 AromaticContact CE1-ND1 3.89Å; H1146-I1148 PolarHBondContact O-N 3.09Å
1147	G	52.1	Low	58.6	Low	51 Å²	51	87.1 Å²	87.1	53%	0.526	44%	0.443	S	S	.	.			trans	-77.7	13.9	-155.8	0	0	0	0	0	120.6	D1145	D1145-G1147 PolarHBondContact O-N 2.78Å; D1145-G1147 WeakPolarHBondContact OD1-CA 3.48Å; D1145-G1147 PolarHBondContact OD1-N 3.11Å
1148	I	45.7	Very low	57.8	Low	115 Å²	115	89.9 Å²	89.9	59%	0.59	46%	0.457	S	S	*	.			trans	-136.2	107.3	168.3	-50.5	177.2	0	0	0	110.4	H1146 Y1150	H1146-I1148 PolarHBondContact O-N 3.09Å; I1148-Y1150 PolarHBondContact O-N 3.02Å
1149	P	40.1	Very low	56.6	Low	112 Å²	112	95.2 Å²	95.2	73%	0.727	48%	0.484	S	S	*	.			trans	-61.4	134.4	168.1	-3.5	13.7	0	0	0	109.7	E1151	P1149-E1151 PolarHBondContact O-N 3.14Å
1150	Y	35.4	Very low	54.9	Low	165 Å²	165	101.1 Å²	101.1	65%	0.647	51%	0.514	S	S	*	.			trans	-61.3	98.7	173.4	-179.9	-97.2	0	0	0	110.1	I1148 P1152	I1148-Y1150 PolarHBondContact O-N 3.02Å; Y1150-P1152 HydrophobicContact CD1-CG 4.47Å; Y1150-P1152 HydrophobicContact CE1-CB 3.71Å; Y1150-P1152 HydrophobicContact CE1-CG 3.99Å
1151	E	30.3	Very low	52.9	Low	172 Å²	172	107.9 Å²	107.9	80%	0.804	55%	0.548	S	S	*	.			trans	-87.9	115.3	155.6	-76.3	-168.8	162.7	0	0	107.4	P1149 A1153	P1149-E1151 PolarHBondContact O-N 3.14Å; E1151-A1153 VanDerWaalsContact C-N 3.28Å; E1151-A1153 PolarHBondContact O-N 3.28Å
1152	P	33.2	Very low	50.7	Low	90 Å²	90	115.4 Å²	115.4	58%	0.584	59%	0.586	S	S	*	*			trans	-64.8	97.9	167.4	25.6	-28	0	0	0	106.9	Y1150 K1154	Y1150-P1152 HydrophobicContact CD1-CG 4.47Å; Y1150-P1152 HydrophobicContact CE1-CB 3.71Å; Y1150-P1152 HydrophobicContact CE1-CG 3.99Å; P1152-K1154 PolarHBondContact O-N 3.24Å
1153	A	33.6	Very low	48.2	Very low	84 Å²	84	122 Å²	122	69%	0.694	62%	0.621	S	S	*	*			trans	-59.6	113.8	171.2	0	0	0	0	0	107.8	E1151 R1155	E1151-A1153 VanDerWaalsContact C-N 3.28Å; E1151-A1153 PolarHBondContact O-N 3.28Å; A1153-R1155 PolarHBondContact O-N 3.15Å
1154	K	26.2	Very low	45.5	Very low	213 Å²	213	129 Å²	129	93%	0.926	65%	0.652	S	S	*	*			trans	-42.5	106.4	149.7	-70.5	172.8	175.8	174.9	0	107.6	P1152	P1152-K1154 PolarHBondContact O-N 3.24Å
1155	R	29	Very low	42.4	Very low	303 Å²	303	138.5 Å²	138.5	100%	1.143	70%	0.701	S	S	*	*			trans	-126.5	0	155.2	-92.1	-168.3	176.8	-175.6	0.4	107.7	A1153	A1153-R1155 PolarHBondContact O-N 3.15Å

Retrieved 1,155 of 1,155 residues in 259.7 ms (Link to these results)

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