A0A087Y353_POEFO Loading...

Protein phosphatase 2 regulatory subunit B''alpha

The B regulatory subunit might modulate substrate selectivity and catalytic activity, and might also direct the localization of the catalytic enzyme to a particular subcellular compartment.

AlphaFold DB , UniProt , Accession A0A087Y353, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,222 aa.

						>A0A087Y353_POEFO|A0A087Y353
MAAAYRVVVSSVSCYNSVVVDRRAHSQAVHYCAGPCGALSQGLDCTVAHRGTCSEFLVDPDATFNDFNSSPMQPRNNGGLERAGSSGNLSLGEDSPTWRGKKTSSGTGSTGNLSCSGSLKDITEEAINLASGKLKEFSFDKLRLSSSSHVTLRKGRKVRPDSFSRRSTDLEIIYGHFSSSLTTNTTTTTKVGNGSTSSLSSIGSLDQSLNTVASLYRTTLGEENLIARLLEKTRAEAGSGGAGGEDIRACLDILLKCSEDLKKCTDIIKQCIRRKAGGGPEDGGTNPDSVYRAVMTRLSSYLKRLPLELEGVGSLGGTEQGGQGTPGSGHSDLAELINTIHSIQQGPFSPIFGNEQPPRYEDVVQSPPISKKFLHSTSSAPSSASPSSTLPKGTSLTNGLQSTHPSLSTQHTLSPPPVTCSPSSSSPTHSPSPLRNSPTSSFTHTPPTSPIEALYIEEEEAEIGKTADHISQPTHMPTRGINMTQNKNGTIMGQQLHLSQSNTANNSSNHLPGSSSYIPTWPSSTSLTVSIPKATSHRNDDIDKLLMDLENLSQSMSHPRTTEPPLPAKTRKMAQHQVQKPTSHLGMNGVNSRVTQSPTPPQGENSEPGTGDEEDGALLLRILESIESFAQELVDSGAGSSGSAERKVGKEKEVMRLLQDTLVTAVEVRSESLPASGAYTPGNLQDCTLEDEPAPAVSVEEPSPVALSATEDAVVADGEPSASRNTGSTLLIQQTPEVIRLQPKLEKKPGTPPPAPPATAASPPPTPRSPSPPPAPVIVTPPPPAVNIPRFYYPRGLPAPGPTANHDATIAAIETAFAEFEEDKADIYEMGKIAKVCGCPLYWKAAMFYAAGGERTGFVSVHSFVATWRKLLHSCHDDSSRFIYLLSKPGLTYLEQEDFIPLLQDIVDTHPGLTFLKDAPEFHSRYITTVIQRIFYVVNRSWTGHVTMTELRRSNFLQTLALLEEEDDINQITDYFSYEHFYVIYCKFWELDTDHDLYIDPKDLSRYNDHASSNRIIDRLFSGAVTRGNAVQREGRMSYAEFVWFLLSEEDKKNPTSIEYWYRCMDVDGDGVLSMFELEYFYEEQCERMERMGIEPLPFQDLLCQMLDLVKPENPGKITLSDLKRCRMAHIFFDTFFNLEKYLDHEQRDPFAVQKDIDSEGPEPSDWDKYAAEEYEILVAEETANEQLHEGTFDDDYESEELQVPREIGNKMEKLVISDLSA
					

Structure Viewer

Loading PAE data...

(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	27.2	Very low	233 Å²	233	143.7 Å²	143.7	100%	1.148	83%	0.829	S	S	*	*				0	89.2	0	-56.5	-178.2	-68.7	0	0	105.8
2	A	23.5	Very low	27.2	Very low	98 Å²	98	142.9 Å²	142.9	81%	0.81	83%	0.828	S	S	*	*			cis	60.4	127.8	21.4	0	0	0	0	0	112.7
3	A	25.7	Very low	27.3	Very low	102 Å²	102	140.3 Å²	140.3	84%	0.843	82%	0.823	S	S	*	*			cis	-156	-175.8	-5.5	0	0	0	0	0	108.3
4	A	30.1	Very low	27.6	Very low	95 Å²	95	137.9 Å²	137.9	79%	0.785	82%	0.816	S	S	*	*			cis	-152.6	158.5	4.2	0	0	0	0	0	110.2
5	Y	26.1	Very low	27.6	Very low	229 Å²	229	143.1 Å²	143.1	90%	0.898	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-83.9	148.5	165.2	-88.2	-107.2	0	0	0	110.8
6	R	29.4	Very low	28	Very low	240 Å²	240	145.4 Å²	145.4	91%	0.906	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-90.5	146.9	157.4	-84.4	-172.1	170.5	-168.7	-2	109.3
7	V	27.8	Very low	28.2	Very low	126 Å²	126	142.3 Å²	142.3	76%	0.764	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-103.8	132	170.5	178.1	0	0	0	0	108	V9	V7-V9 HydrophobicContact CG1-CG2 3.93Å
8	V	26.5	Very low	28.6	Very low	131 Å²	131	141.8 Å²	141.8	79%	0.794	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-95.5	139.1	163.9	177.4	0	0	0	0	107.1
9	V	25.8	Very low	28.7	Very low	119 Å²	119	141.4 Å²	141.4	72%	0.721	82%	0.816	S	S	*	*			trans	-128	113.1	171.1	-177.9	0	0	0	0	107.7	V7	V7-V9 HydrophobicContact CG1-CG2 3.93Å
10	S	25.8	Very low	29	Very low	99 Å²	99	139.6 Å²	139.6	69%	0.692	81%	0.807	S	S	*	*			trans	-113.8	132.3	171.5	41.4	0	0	0	0	108.9
11	S	27	Very low	29.1	Very low	109 Å²	109	138 Å²	138	76%	0.762	80%	0.796	S	S	*	*			trans	62.8	150.2	-173.6	82.1	0	0	0	0	116.4
12	V	26.8	Very low	29.4	Very low	134 Å²	134	137.7 Å²	137.7	81%	0.812	78%	0.781	S	S	*	*			trans	-133.7	108.3	165.1	175	0	0	0	0	107
13	S	28.8	Very low	30	Very low	109 Å²	109	143.8 Å²	143.8	76%	0.762	78%	0.783	S	S	*	*			trans	-81.7	128.4	175.1	47.8	0	0	0	0	110.6	Y15	S13-Y15 PolarHBondContact O-N 3.42Å
14	C	31.4	Very low	30.5	Very low	107 Å²	107	142.5 Å²	142.5	72%	0.723	77%	0.773	S	S	*	*			trans	-91.6	90	-171.5	53.2	0	0	0	0	112.5
15	Y	28.2	Very low	30.9	Very low	215 Å²	215	146.9 Å²	146.9	84%	0.843	78%	0.777	S	S	*	*			trans	-133.1	138.6	168.3	-90.2	-76	0	0	0	112.9	S13 S17	S13-Y15 PolarHBondContact O-N 3.42Å; Y15-S17 PolarHBondContact O-N 3.41Å
16	N	33.3	Very low	31.5	Very low	180 Å²	180	140.4 Å²	140.4	96%	0.963	77%	0.765	S	S	*	*			trans	-75	77.9	-178	-80.2	-46.1	0	0	0	112.4
17	S	31.3	Very low	31.9	Very low	93 Å²	93	138.2 Å²	138.2	65%	0.65	77%	0.765	S	S	*	*			trans	-133.8	129.9	165.6	75.1	0	0	0	0	111.3	Y15	Y15-S17 PolarHBondContact O-N 3.41Å
18	V	35	Very low	32.3	Very low	134 Å²	134	137.1 Å²	137.1	81%	0.812	77%	0.769	S	S	*	*			trans	-106.1	95.3	-177.2	-174.6	0	0	0	0	109.4	V20	V18-V20 HydrophobicContact CG1-CG2 3.85Å; V18-V20 PolarHBondContact O-N 3.36Å
19	V	30.8	Very low	33	Very low	134 Å²	134	136.3 Å²	136.3	81%	0.812	76%	0.764	S	S	*	*			trans	-86.2	100.9	174	-177.3	0	0	0	0	109.4	D21	V19-D21 PolarHBondContact O-N 3.18Å
20	V	36.2	Very low	33.8	Very low	105 Å²	105	134.5 Å²	134.5	64%	0.636	75%	0.748	S	S	*	*			trans	-90.2	100.3	175.5	-173.4	0	0	0	0	110.1	V18 R22	V18-V20 HydrophobicContact CG1-CG2 3.85Å; V18-V20 PolarHBondContact O-N 3.36Å; V20-R22 PolarHBondContact O-N 3.1Å
21	D	31.1	Very low	34.5	Very low	107 Å²	107	140.2 Å²	140.2	57%	0.572	76%	0.756	S	S	*	*			trans	-68.3	127.4	163.9	-175.2	10.2	0	0	0	109.7	V19 R23	V19-D21 PolarHBondContact O-N 3.18Å; D21-R23 WeakPolarHBondContact OD1-CB 3.39Å; D21-R23 WeakPolarHBondContact OD1-CG 3.36Å; D21-R23 PolarHBondContact OD1-N 3.19Å
22	R	36.3	Very low	35.4	Very low	225 Å²	225	138.7 Å²	138.7	85%	0.849	74%	0.744	S	S	*	*	S	Bend	trans	-89.1	4.1	-179.8	-90.4	-177.2	162.1	176.8	-4	114.1	V20	V20-R22 PolarHBondContact O-N 3.1Å
23	R	37.6	Very low	36.1	Very low	226 Å²	226	138 Å²	138	85%	0.853	75%	0.753	S	S	*	*	S	Bend	trans	-93.7	-11.9	-171.4	-63.1	-179.7	-164.9	-108.8	3.8	116.1	D21	D21-R23 WeakPolarHBondContact OD1-CB 3.39Å; D21-R23 WeakPolarHBondContact OD1-CG 3.36Å; D21-R23 PolarHBondContact OD1-N 3.19Å
24	A	35	Very low	37.3	Very low	75 Å²	75	134.8 Å²	134.8	62%	0.62	74%	0.736	S	S	*	*			trans	-124.8	112.4	179.9	0	0	0	0	0	112.9	S26	A24-S26 VanDerWaalsContact C-N 3.3Å; A24-S26 PolarHBondContact O-N 3.3Å; A24-S26 VanDerWaalsContact O-N 3.14Å
25	H	39.2	Very low	38.3	Very low	187 Å²	187	136.1 Å²	136.1	87%	0.866	74%	0.744	S	S	*	*			trans	-86.9	57	178.3	-78.6	65	0	0	0	112.6
26	S	38.1	Very low	39.6	Very low	93 Å²	93	126.5 Å²	126.5	65%	0.65	71%	0.708	S	S	*	*	S	Bend	trans	-164.7	119.1	168	55.4	0	0	0	0	112.7	A24	A24-S26 VanDerWaalsContact C-N 3.3Å; A24-S26 PolarHBondContact O-N 3.3Å; A24-S26 VanDerWaalsContact O-N 3.14Å
27	Q	37.8	Very low	40.6	Very low	194 Å²	194	119.8 Å²	119.8	91%	0.907	68%	0.681	S	S	*	*			trans	55.4	81.6	161.4	-63.7	179	-26.7	0	0	116.9
28	A	37.2	Very low	41.8	Very low	103 Å²	103	116.4 Å²	116.4	85%	0.851	66%	0.659	S	S	*	*			trans	-91.4	124.1	153.4	0	0	0	0	0	109.2
29	V	39.8	Very low	42.5	Very low	114 Å²	114	115.8 Å²	115.8	69%	0.691	65%	0.65	S	S	*	*			trans	-94.3	128	170.5	179.9	0	0	0	0	108	Y31	V29-Y31 HydrophobicContact CG1-CE2 4.24Å
30	H	42.9	Very low	43.4	Very low	81 Å²	81	114.5 Å²	114.5	38%	0.375	65%	0.647	S	S	.	*			trans	-126.7	148.6	172.7	79.8	-77.4	0	0	0	109.6	C36	H30-C36 PolarHBondContact NE2-SG 3.36Å
31	Y	40.3	Very low	44.2	Very low	220 Å²	220	117 Å²	117	86%	0.863	65%	0.652	S	S	*	*			trans	-104.8	141.3	172.2	-73.3	-89.4	0	0	0	109.3	V29	V29-Y31 HydrophobicContact CG1-CE2 4.24Å
32	C	46.4	Very low	44.7	Very low	76 Å²	76	115.2 Å²	115.2	51%	0.514	66%	0.659	S	S	.	*			trans	-145.4	122.7	179.6	-172.7	0	0	0	0	109.4	G34	C32-G34 VanDerWaalsContact C-N 3.29Å; C32-G34 PolarHBondContact O-N 3.36Å
33	A	41.5	Very low	45.5	Very low	121 Å²	121	109.7 Å²	109.7	100%	1	65%	0.646	S	S	*	*	S	Bend	trans	-91.6	54.2	178.5	0	0	0	0	0	111.2
34	G	53.3	Low	45.8	Very low	40 Å²	40	106.2 Å²	106.2	41%	0.412	64%	0.644	S	S	.	*	S	Bend	trans	174.5	-173.3	-176	0	0	0	0	0	113.6	C32 C36	C32-G34 VanDerWaalsContact C-N 3.29Å; C32-G34 PolarHBondContact O-N 3.36Å; G34-C36 PolarHBondContact O-N 3.13Å
35	P	52.4	Low	46.7	Very low	135 Å²	135	104.3 Å²	104.3	88%	0.877	63%	0.626	S	S	*	*	S	Bend	trans	-64.1	108.2	175.5	26.4	-33.3	0	0	0	110.5	G37	P35-G37 PolarHBondContact O-N 3.07Å
36	C	57.1	Low	47.1	Very low	13 Å²	13	102.3 Å²	102.3	9%	0.088	63%	0.627	C	S	.	*			trans	-59.1	119.2	-170.5	178.5	0	0	0	0	113.5	H30 G34 A38 H49	H30-C36 PolarHBondContact NE2-SG 3.36Å; G34-C36 PolarHBondContact O-N 3.13Å; C36-A38 PolarHBondContact O-N 3.45Å; C36-A38 VanDerWaalsContact SG-CB 3.51Å; C36-A38 PolarHBondContact SG-N 2.96Å; C36-H49 WeakPolarHBondContact CB-CE1 3.47Å; C36-H49 WeakPolarHBondContact CB-NE2 3.37Å
37	G	53.9	Low	47.4	Very low	40 Å²	40	101.4 Å²	101.4	41%	0.412	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.7	-6.4	178	0	0	0	0	0	115.8	P35 L39 S40	P35-G37 PolarHBondContact O-N 3.07Å; G37-L39 PolarHBondContact O-N 3.32Å; G37-S40 PolarHBondContact O-N 3.35Å; G37-S40 PolarHBondContact O-OG 3.4Å
38	A	56	Low	47.5	Very low	22 Å²	22	96.7 Å²	96.7	18%	0.182	61%	0.612	C	S	.	*	T	Hydrogen-bonded Turn	trans	-62.4	-34.2	176.5	0	0	0	0	0	112.1	C36 S40 Q41 G42 L43	C36-A38 PolarHBondContact O-N 3.45Å; C36-A38 VanDerWaalsContact SG-CB 3.51Å; C36-A38 PolarHBondContact SG-N 2.96Å; A38-S40 PolarHBondContact O-N 3.04Å; A38-Q41 CarbonylContact O-C 3.51Å; A38-Q41 PolarHBondContact O-N 3.05Å; A38-Q41 VanDerWaalsContact O-N 3.13Å; A38-G42 PolarHBondContact O-N 3.27Å; A38-L43 CarbonylContact C-O 3.57Å; A38-L43 HydrophobicContact CB-CB 4.39Å; A38-L43 PolarHBondContact O-N 3.46Å; A38-L43 VanDerWaalsContact O-N 3.1Å
39	L	50.1	Low	47.8	Very low	120 Å²	120	96.9 Å²	96.9	63%	0.628	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-68.4	-33.2	-178.7	-145.9	77.9	0	0	0	112.3	G37 Q41 G42	G37-L39 PolarHBondContact O-N 3.32Å; L39-Q41 PolarHBondContact O-N 3.26Å; L39-G42 PolarHBondContact O-N 3.28Å
40	S	48.5	Very low	47.6	Very low	107 Å²	107	103.6 Å²	103.6	75%	0.748	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-74.6	-11.1	175.3	67.3	0	0	0	0	113.4	G37 A38	G37-S40 PolarHBondContact O-N 3.35Å; G37-S40 PolarHBondContact O-OG 3.4Å; A38-S40 PolarHBondContact O-N 3.04Å
41	Q	52.8	Low	47.2	Very low	157 Å²	157	102.8 Å²	102.8	73%	0.734	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-102.2	6.3	171.1	-58.2	-168.7	17	0	0	113	A38 L39	A38-Q41 CarbonylContact O-C 3.51Å; A38-Q41 PolarHBondContact O-N 3.05Å; A38-Q41 VanDerWaalsContact O-N 3.13Å; L39-Q41 PolarHBondContact O-N 3.26Å
42	G	42.8	Very low	46.7	Very low	70 Å²	70	99.3 Å²	99.3	72%	0.722	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.9	28.9	176.3	0	0	0	0	0	114.7	A38 L39	A38-G42 PolarHBondContact O-N 3.27Å; L39-G42 PolarHBondContact O-N 3.28Å
43	L	52.2	Low	45.9	Very low	109 Å²	109	102 Å²	102	57%	0.571	64%	0.641	S	S	*	*			trans	-111.6	125.6	175	-62.6	176.3	0	0	0	110.6	A38 C45	A38-L43 CarbonylContact C-O 3.57Å; A38-L43 HydrophobicContact CB-CB 4.39Å; A38-L43 PolarHBondContact O-N 3.46Å; A38-L43 VanDerWaalsContact O-N 3.1Å; L43-C45 PolarHBondContact O-N 3.25Å
44	D	45	Very low	45.4	Very low	153 Å²	153	101.2 Å²	101.2	82%	0.818	63%	0.629	S	S	*	*			trans	-68.8	115.2	176.5	-70.7	-42.4	0	0	0	110.8
45	C	54.4	Low	44.3	Very low	35 Å²	35	106.9 Å²	106.9	24%	0.236	65%	0.645	C	S	.	*			trans	-82.5	122.4	172.6	-168.3	0	0	0	0	110.2	L43 H49	L43-C45 PolarHBondContact O-N 3.25Å; C45-H49 PolarHBondContact SG-NE2 3.14Å
46	T	46.9	Very low	42.9	Very low	145 Å²	145	110.4 Å²	110.4	89%	0.89	65%	0.646	S	S	*	*			trans	-91.1	4.6	176.6	55.1	0	0	0	0	113.8
47	V	44.8	Very low	41.6	Very low	74 Å²	74	116.7 Å²	116.7	45%	0.448	68%	0.678	S	S	.	*	S	Bend	trans	-87.1	134.1	174.7	-176.2	0	0	0	0	109	H49	V47-H49 PolarHBondContact O-CD2 3.19Å; V47-H49 PolarHBondContact O-N 3.44Å
48	A	40.3	Very low	40.4	Very low	96 Å²	96	121.5 Å²	121.5	79%	0.793	70%	0.699	S	S	*	*			trans	-73	98.2	-177.9	0	0	0	0	0	111.8	R50	A48-R50 PolarHBondContact O-N 3.5Å
49	H	43.5	Very low	38.9	Very low	106 Å²	106	127.3 Å²	127.3	49%	0.491	73%	0.727	S	S	.	*			trans	-67.8	123.3	172.1	-51.3	155.1	0	0	0	110.3	C36 C45 V47 G51	C36-H49 WeakPolarHBondContact CB-CE1 3.47Å; C36-H49 WeakPolarHBondContact CB-NE2 3.37Å; C45-H49 PolarHBondContact SG-NE2 3.14Å; V47-H49 PolarHBondContact O-CD2 3.19Å; V47-H49 PolarHBondContact O-N 3.44Å; H49-G51 PolarHBondContact O-N 3.4Å
50	R	35	Very low	38.4	Very low	256 Å²	256	126.6 Å²	126.6	97%	0.966	73%	0.73	S	S	*	*			trans	-79.3	84.2	171.6	-74.5	-168.7	176.3	-160.3	2.6	110.6	A48	A48-R50 PolarHBondContact O-N 3.5Å
51	G	34.5	Very low	37.3	Very low	64 Å²	64	128.3 Å²	128.3	66%	0.66	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-86.2	120.8	167.6	0	0	0	0	0	111.5	H49	H49-G51 PolarHBondContact O-N 3.4Å
52	T	28.6	Very low	36.2	Very low	146 Å²	146	124.8 Å²	124.8	90%	0.896	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-69.3	127	161.1	24.3	0	0	0	0	109.1
53	C	29.6	Very low	35.4	Very low	132 Å²	132	126.9 Å²	126.9	89%	0.892	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-76.4	135	-175.2	-67.6	0	0	0	0	111.9
54	S	31.9	Very low	34.2	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-77.5	142.2	167.2	52.7	0	0	0	0	111.6
55	E	29.6	Very low	33.4	Very low	159 Å²	159	128.7 Å²	128.7	74%	0.743	73%	0.73	S	S	*	*				-179.7	136	122.4	-105.3	-180	-143.7	0	0	111.9
56	F	23.6	Very low	32.1	Very low	209 Å²	209	132.4 Å²	132.4	92%	0.917	75%	0.747	S	S	*	*			trans	-154.2	116.5	137	-117.3	-73.1	0	0	0	109.1
57	L	30.2	Very low	31.2	Very low	145 Å²	145	133.8 Å²	133.8	76%	0.759	74%	0.741	S	S	*	*			trans	-86.2	125.7	178.9	-80.1	159.4	0	0	0	110.9
58	V	27.3	Very low	30.3	Very low	140 Å²	140	137.2 Å²	137.2	85%	0.848	76%	0.757	S	S	*	*			trans	-139.8	123.3	154	-176.2	0	0	0	0	108.7
59	D	24.6	Very low	29.6	Very low	144 Å²	144	136.6 Å²	136.6	77%	0.77	75%	0.747	S	S	*	*			trans	-140.1	144.7	169.1	-155.9	4.7	0	0	0	104.3
60	P	41.6	Very low	28.7	Very low	106 Å²	106	137 Å²	137	69%	0.688	76%	0.762	S	S	*	*				-148.4	165.4	78.7	39.7	-21.7	0	0	0	117.7
61	D	24.5	Very low	29.2	Very low	143 Å²	143	130.2 Å²	130.2	77%	0.765	75%	0.75	S	S	*	*			trans	100.1	116.8	136.6	-94	-33.6	0	0	0	121.3
62	A	29.5	Very low	28.7	Very low	82 Å²	82	134.8 Å²	134.8	68%	0.678	76%	0.757	S	S	*	*			trans	50.5	131.6	141	0	0	0	0	0	119.9
63	T	26.4	Very low	28.4	Very low	114 Å²	114	136.2 Å²	136.2	70%	0.699	75%	0.753	S	S	*	*			cis	-168.5	-175.1	14.1	6	0	0	0	0	108.5
64	F	26.9	Very low	28.9	Very low	171 Å²	171	134.7 Å²	134.7	75%	0.75	74%	0.742	S	S	*	*			cis	-162.7	157	9.7	-121.9	-48.3	0	0	0	108.8
65	N	28.2	Very low	28.6	Very low	129 Å²	129	140.5 Å²	140.5	69%	0.69	75%	0.748	S	S	*	*			trans	60.1	147.2	152.3	-77.1	21.5	0	0	0	120.3
66	D	26.5	Very low	28.4	Very low	113 Å²	113	139.8 Å²	139.8	60%	0.604	75%	0.749	S	S	*	*			cis	-163.7	168.1	-19.8	-141.7	-20.2	0	0	0	111.5
67	F	28	Very low	28.5	Very low	175 Å²	175	137.1 Å²	137.1	77%	0.768	74%	0.744	S	S	*	*			trans	42.9	88.4	162.2	-68.4	-70.6	0	0	0	123.5
68	N	26.9	Very low	28.2	Very low	146 Å²	146	134.2 Å²	134.2	78%	0.781	75%	0.749	S	S	*	*				46.5	119	110.4	-138.9	17	0	0	0	124
69	S	25.1	Very low	28	Very low	83 Å²	83	131 Å²	131	58%	0.58	75%	0.745	S	S	*	*			trans	68.3	106.9	132.3	67.2	0	0	0	0	125.5
70	S	25	Very low	28	Very low	114 Å²	114	131.7 Å²	131.7	80%	0.797	75%	0.747	S	S	*	*				74.6	-175.3	119.2	-47.1	0	0	0	0	120.3
71	P	45.4	Very low	27.2	Very low	113 Å²	113	133.2 Å²	133.2	73%	0.734	75%	0.745	S	S	*	*				-137.5	-175.3	-83.3	44.3	-27.8	0	0	0	116.9
72	M	22.4	Very low	27.3	Very low	160 Å²	160	135.7 Å²	135.7	79%	0.788	74%	0.744	S	S	*	*			trans	67	113.6	151.2	-79.6	-75.9	167.7	0	0	122.7
73	Q	23.5	Very low	27.2	Very low	176 Å²	176	136.7 Å²	136.7	82%	0.822	75%	0.752	S	S	*	*			trans	59.6	-179.3	144.4	-79.2	-165	-4.3	0	0	118.7
74	P	40.7	Very low	27.1	Very low	101 Å²	101	134.5 Å²	134.5	66%	0.656	75%	0.752	S	S	*	*				-132.3	170.8	-57.2	39.2	-25	0	0	0	115
75	R	24.2	Very low	27.3	Very low	228 Å²	228	132 Å²	132	86%	0.86	76%	0.756	S	S	*	*			trans	51	116.8	142.8	-176	-168.2	-167.3	-179.7	7.4	120.4
76	N	25.3	Very low	27.4	Very low	143 Å²	143	131.5 Å²	131.5	77%	0.765	76%	0.762	S	S	*	*				-173.8	177.3	113.1	-136.9	-9.9	0	0	0	115.9
77	N	25.7	Very low	27.4	Very low	154 Å²	154	129.5 Å²	129.5	82%	0.824	77%	0.769	S	S	*	*			trans	-76.1	137.3	-177	-67	-20.3	0	0	0	116.8
78	G	23.8	Very low	27.4	Very low	83 Å²	83	128.4 Å²	128.4	86%	0.856	77%	0.771	S	S	*	*				91.9	130.9	102.8	0	0	0	0	0	122.3
79	G	23.3	Very low	27.5	Very low	74 Å²	74	128 Å²	128	76%	0.763	77%	0.767	S	S	*	*			trans	135.2	157.9	149.6	0	0	0	0	0	117.8
80	L	25.3	Very low	27.5	Very low	157 Å²	157	128.9 Å²	128.9	82%	0.822	77%	0.774	S	S	*	*			trans	64.3	114	172.2	-97.1	50.4	0	0	0	116.3
81	E	24.3	Very low	27.5	Very low	138 Å²	138	130.8 Å²	130.8	65%	0.645	78%	0.775	S	S	*	*				108.6	157.3	70	-94.9	-150.7	156.4	0	0	110.3
82	R	27.4	Very low	26.5	Very low	196 Å²	196	128.1 Å²	128.1	74%	0.74	77%	0.767	S	S	*	*			cis	-165.5	150.6	-10.2	162.6	-171	-75.2	-157.1	3.8	109.1
83	A	26.7	Very low	26.7	Very low	102 Å²	102	128.8 Å²	128.8	84%	0.843	77%	0.768	S	S	*	*			trans	67.7	148.9	166.3	0	0	0	0	0	119.3
84	G	24.7	Very low	26.7	Very low	68 Å²	68	127.5 Å²	127.5	70%	0.701	77%	0.767	S	S	*	*			cis	154.8	165.1	-15.7	0	0	0	0	0	116.2
85	S	31.4	Very low	26	Very low	119 Å²	119	127.6 Å²	127.6	83%	0.832	77%	0.77	S	S	*	*			trans	73.2	146.8	161.3	-157.1	0	0	0	0	118.2
86	S	30	Very low	26.6	Very low	119 Å²	119	121.7 Å²	121.7	83%	0.832	76%	0.762	S	S	*	*			cis	-168.8	161.3	-23.6	-82	0	0	0	0	110.1
87	G	26	Very low	26.6	Very low	71 Å²	71	120.1 Å²	120.1	73%	0.732	76%	0.757	S	S	*	*			trans	134.9	103.8	174.6	0	0	0	0	0	112.2
88	N	28.5	Very low	26.5	Very low	152 Å²	152	124.3 Å²	124.3	81%	0.813	76%	0.762	S	S	*	*			cis	72.5	124.6	35.1	-122.8	26	0	0	0	111.6
89	L	28.2	Very low	26.6	Very low	136 Å²	136	132.2 Å²	132.2	71%	0.712	77%	0.766	S	S	*	*			cis	-149.1	161.7	20.9	-82.6	163	0	0	0	113.7
90	S	25.6	Very low	26.6	Very low	103 Å²	103	131.9 Å²	131.9	72%	0.72	76%	0.762	S	S	*	*			trans	27.7	160.8	142.4	-42.9	0	0	0	0	122.6
91	L	26.3	Very low	26.6	Very low	154 Å²	154	133.8 Å²	133.8	81%	0.806	76%	0.764	S	S	*	*			cis	-158.6	166.3	14.5	-166.8	61.4	0	0	0	107.4
92	G	23.9	Very low	26.7	Very low	56 Å²	56	135.9 Å²	135.9	58%	0.577	77%	0.771	S	S	*	*			cis	140.4	160.1	-5	0	0	0	0	0	111.9
93	E	25.8	Very low	26.4	Very low	174 Å²	174	131.7 Å²	131.7	81%	0.813	77%	0.767	S	S	*	*			trans	66.3	142.6	171.7	-69.2	173.1	146.1	0	0	117.5
94	D	23.8	Very low	26.3	Very low	150 Å²	150	132 Å²	132	80%	0.802	76%	0.763	S	S	*	*			cis	-152.9	-179.4	-8.6	-149.6	-15.2	0	0	0	112.7
95	S	25.2	Very low	26.2	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	77%	0.769	S	S	*	*			trans	-84.5	-170.8	176.6	-127.5	0	0	0	0	112.5
96	P	38.1	Very low	25.8	Very low	105 Å²	105	132 Å²	132	68%	0.682	76%	0.764	S	S	*	*			cis	-150.4	-169.3	26.2	39.8	-14.7	0	0	0	119.1
97	T	25.2	Very low	25.5	Very low	110 Å²	110	133.5 Å²	133.5	68%	0.675	77%	0.768	S	S	*	*			trans	82	102.3	146.1	37.5	0	0	0	0	124.5
98	W	23.1	Very low	25.4	Very low	242 Å²	242	133.7 Å²	133.7	92%	0.917	77%	0.77	S	S	*	*				49.2	145.1	111.6	-72.8	97.8	0	0	0	123.7
99	R	25.3	Very low	25.2	Very low	248 Å²	248	131.7 Å²	131.7	94%	0.936	77%	0.768	S	S	*	*			trans	87.8	141.9	160.2	-154.9	-164	-41.6	-113.8	3.9	115.6
100	G	24.4	Very low	25.3	Very low	67 Å²	67	131.6 Å²	131.6	69%	0.691	77%	0.773	S	S	*	*			cis	169.5	125.2	-15.2	0	0	0	0	0	116.1
101	K	24.5	Very low	25.2	Very low	198 Å²	198	130.2 Å²	130.2	86%	0.861	78%	0.776	S	S	*	*			trans	20.1	143.5	141.8	-157.5	176	-174.3	169	0	121.6
102	K	26.1	Very low	25.5	Very low	181 Å²	181	130.5 Å²	130.5	79%	0.787	78%	0.778	S	S	*	*			trans	96.3	151.3	163.1	-61.9	-165.1	178	-177.3	0	116.1
103	T	22.8	Very low	25.5	Very low	108 Å²	108	135.5 Å²	135.5	66%	0.663	79%	0.79	S	S	*	*			cis	-168.3	157.5	-17	26.6	0	0	0	0	109.4
104	S	23.4	Very low	25.6	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	79%	0.787	S	S	*	*			trans	61.5	154.7	151.2	49.7	0	0	0	0	118.7
105	S	22.9	Very low	25.8	Very low	118 Å²	118	131.6 Å²	131.6	83%	0.825	79%	0.792	S	S	*	*			cis	-174.9	157.6	-11.1	45.2	0	0	0	0	109.6
106	G	23	Very low	26.3	Very low	70 Å²	70	132.4 Å²	132.4	72%	0.722	80%	0.798	S	S	*	*			trans	106.6	111.3	150.6	0	0	0	0	0	118.1
107	T	23.8	Very low	26.3	Very low	150 Å²	150	129.2 Å²	129.2	92%	0.92	79%	0.785	S	S	*	*			trans	-0.2	133.4	143.4	49	0	0	0	0	120.2
108	G	23.6	Very low	27.4	Very low	76 Å²	76	127 Å²	127	78%	0.784	77%	0.774	S	S	*	*			trans	158.9	113.8	146.2	0	0	0	0	0	118.6
109	S	24	Very low	28.4	Very low	110 Å²	110	118 Å²	118	77%	0.769	74%	0.743	S	S	*	*			trans	62.4	123.8	149.4	-127.5	0	0	0	0	123.1
110	T	30.5	Very low	29.6	Very low	133 Å²	133	112.4 Å²	112.4	82%	0.816	73%	0.726	S	S	*	*			trans	24	120	133.3	58.9	0	0	0	0	120.6
111	G	23.7	Very low	30.9	Very low	75 Å²	75	113.3 Å²	113.3	77%	0.773	72%	0.715	S	S	*	*			trans	-176.6	143.9	160.7	0	0	0	0	0	113.7
112	N	31.6	Very low	32.2	Very low	159 Å²	159	106 Å²	106	85%	0.85	69%	0.685	S	S	*	*			trans	-72.1	141.3	174.1	-69.1	-8.3	0	0	0	111.7
113	L	25.6	Very low	33.4	Very low	161 Å²	161	98.2 Å²	98.2	84%	0.843	65%	0.652	S	S	*	*			trans	-149.5	125.8	147.6	-83.9	120.2	0	0	0	106.3
114	S	27.2	Very low	34.8	Very low	107 Å²	107	97.3 Å²	97.3	75%	0.748	64%	0.641	S	S	*	*				66.5	92.1	57.1	-57	0	0	0	0	112.4
115	C	27.2	Very low	36.1	Very low	135 Å²	135	96 Å²	96	91%	0.912	62%	0.623	S	S	*	*			trans	-85.1	129	167.2	-169.7	0	0	0	0	109.9	G117	C115-G117 PolarHBondContact O-N 3.02Å
116	S	35.6	Very low	37.4	Very low	119 Å²	119	90.4 Å²	90.4	83%	0.832	58%	0.583	S	S	*	*			trans	-92.3	84.8	179.6	58.4	0	0	0	0	111.2
117	G	39.8	Very low	38.8	Very low	39 Å²	39	88.2 Å²	88.2	40%	0.402	56%	0.555	S	S	.	*			trans	-63	149.1	167.5	0	0	0	0	0	111.7	C115	C115-G117 PolarHBondContact O-N 3.02Å
118	S	47.1	Very low	40.1	Very low	63 Å²	63	84.5 Å²	84.5	44%	0.441	53%	0.529	S	S	.	.			trans	-68.9	158.3	173.6	-166.9	0	0	0	0	110.8	K120 D121 I122	S118-K120 PolarHBondContact O-N 3.33Å; S118-D121 WeakPolarHBondContact CA-OD2 3.47Å; S118-D121 WeakPolarHBondContact CB-OD1 3.17Å; S118-D121 WeakPolarHBondContact CB-OD2 3.39Å; S118-D121 PolarHBondContact N-OD2 2.92Å; S118-D121 PolarHBondContact O-N 3.25Å; S118-I122 WeakPolarHBondContact O-CG1 3.47Å; S118-I122 PolarHBondContact O-N 3.43Å; S118-I122 VanDerWaalsContact O-N 3.15Å
119	L	44.6	Very low	41.4	Very low	53 Å²	53	84.1 Å²	84.1	28%	0.277	51%	0.509	S	S	.	.	H	α-helix	trans	-56.3	-37.7	171.8	-178.4	60.3	0	0	0	111.6	T123 Y291 R292	L119-T123 WeakPolarHBondContact O-CB 3.17Å; L119-T123 PolarHBondContact O-N 3.24Å; L119-T123 PolarHBondContact O-OG1 2.88Å; L119-Y291 HydrophobicContact CD1-CD1 4.22Å; L119-R292 HydrophobicContact CD1-CG 3.38Å
120	K	51.1	Low	42.3	Very low	130 Å²	130	80.6 Å²	80.6	57%	0.565	49%	0.486	S	S	*	.	H	α-helix	trans	-63.4	-56.7	178.5	-170.9	177.1	-178.4	-77.3	0	110	S118 I122 T123 E124	S118-K120 PolarHBondContact O-N 3.33Å; K120-I122 VanDerWaalsContact C-N 3.35Å; K120-I122 PolarHBondContact O-N 3.16Å; K120-T123 WeakPolarHBondContact O-CA 3.24Å; K120-T123 WeakPolarHBondContact O-CB 3.42Å; K120-T123 PolarHBondContact O-N 3.15Å; K120-E124 IonicContact NZ-OE1 2.78Å; K120-E124 IonicContact NZ-OE2 2.67Å; K120-E124 PolarHBondContact NZ-OE2 3.06Å; K120-E124 WeakPolarHBondContact O-CB 3.41Å; K120-E124 PolarHBondContact O-N 3.45Å
121	D	50	Low	43	Very low	87 Å²	87	76.9 Å²	76.9	47%	0.465	47%	0.466	S	S	.	.	H	α-helix	trans	-56.9	-43.7	-175.7	-32	-24.2	0	0	0	112.5	S118 T123 E124 E125	S118-D121 WeakPolarHBondContact CA-OD2 3.47Å; S118-D121 WeakPolarHBondContact CB-OD1 3.17Å; S118-D121 WeakPolarHBondContact CB-OD2 3.39Å; S118-D121 PolarHBondContact N-OD2 2.92Å; S118-D121 PolarHBondContact O-N 3.25Å; D121-T123 VanDerWaalsContact C-N 3.33Å; D121-T123 PolarHBondContact O-N 2.66Å; D121-E124 PolarHBondContact O-N 2.88Å; D121-E125 VanDerWaalsContact O-CB 3.26Å; D121-E125 WeakPolarHBondContact O-CB 3.35Å; D121-E125 PolarHBondContact O-N 2.82Å
122	I	51.8	Low	44	Very low	44 Å²	44	75.2 Å²	75.2	23%	0.226	45%	0.449	C	S	.	.	H	α-helix	trans	-67.6	-34.9	178.3	-62.5	166.7	0	0	0	111.5	S118 K120 A126	S118-I122 WeakPolarHBondContact O-CG1 3.47Å; S118-I122 PolarHBondContact O-N 3.43Å; S118-I122 VanDerWaalsContact O-N 3.15Å; K120-I122 VanDerWaalsContact C-N 3.35Å; K120-I122 PolarHBondContact O-N 3.16Å; I122-A126 VanDerWaalsContact O-CB 3.29Å; I122-A126 WeakPolarHBondContact O-CB 3.5Å; I122-A126 PolarHBondContact O-N 3.45Å
123	T	51.1	Low	44.4	Very low	17 Å²	17	75.3 Å²	75.3	10%	0.104	44%	0.441	C	S	.	.	H	α-helix	trans	-72.3	-41.8	177	-54.8	0	0	0	0	110.7	L119 K120 D121 I127 Y291 M295	L119-T123 WeakPolarHBondContact O-CB 3.17Å; L119-T123 PolarHBondContact O-N 3.24Å; L119-T123 PolarHBondContact O-OG1 2.88Å; K120-T123 WeakPolarHBondContact O-CA 3.24Å; K120-T123 WeakPolarHBondContact O-CB 3.42Å; K120-T123 PolarHBondContact O-N 3.15Å; D121-T123 VanDerWaalsContact C-N 3.33Å; D121-T123 PolarHBondContact O-N 2.66Å; T123-I127 HydrophobicContact CG2-CD1 3.86Å; T123-I127 WeakPolarHBondContact O-CB 3.5Å; T123-I127 VanDerWaalsContact O-CG1 3.23Å; T123-I127 WeakPolarHBondContact O-CG1 3.38Å; T123-I127 PolarHBondContact O-N 3.05Å; T123-Y291 HydrophobicContact CG2-CE1 4.33Å; T123-Y291 WeakPolarHBondContact CG2-OH 3.32Å; T123-M295 HydrophobicContact CG2-CE 4.31Å
124	E	52.9	Low	45	Very low	90 Å²	90	73.2 Å²	73.2	42%	0.421	43%	0.43	S	S	.	.	H	α-helix	trans	-68.1	-44	179.8	-161.7	163	154.1	0	0	111.3	K120 D121 I127 N128	K120-E124 IonicContact NZ-OE1 2.78Å; K120-E124 IonicContact NZ-OE2 2.67Å; K120-E124 PolarHBondContact NZ-OE2 3.06Å; K120-E124 WeakPolarHBondContact O-CB 3.41Å; K120-E124 PolarHBondContact O-N 3.45Å; D121-E124 PolarHBondContact O-N 2.88Å; E124-I127 PolarHBondContact O-N 2.88Å; E124-N128 WeakPolarHBondContact O-CB 3.42Å; E124-N128 PolarHBondContact O-N 3.47Å; E124-N128 PolarHBondContact O-ND2 3.43Å; E124-N128 PolarHBondContact O-OD1 2.83Å
125	E	51.5	Low	45.1	Very low	81 Å²	81	77 Å²	77	38%	0.379	43%	0.434	S	S	.	.	H	α-helix	trans	-60	-49.1	173	-173.9	-166	-128.5	0	0	111.9	D121 I127 N128 L129 S299 K303	D121-E125 VanDerWaalsContact O-CB 3.26Å; D121-E125 WeakPolarHBondContact O-CB 3.35Å; D121-E125 PolarHBondContact O-N 2.82Å; E125-I127 VanDerWaalsContact C-N 3.3Å; E125-I127 PolarHBondContact O-N 3.27Å; E125-N128 PolarHBondContact O-N 2.92Å; E125-L129 HydrophobicContact CG-CD1 4.06Å; E125-L129 WeakPolarHBondContact O-CB 2.75Å; E125-L129 VanDerWaalsContact O-CG 3.31Å; E125-L129 WeakPolarHBondContact O-CG 3.3Å; E125-L129 PolarHBondContact O-N 2.95Å; E125-S299 PolarHBondContact OE2-OG 3.26Å; E125-K303 IonicContact OE1-NZ 3.89Å; E125-K303 PolarHBondContact OE1-NZ 3.44Å; E125-K303 IonicContact OE2-NZ 2.79Å; E125-K303 PolarHBondContact OE2-NZ 3.12Å
126	A	49.8	Very low	45.4	Very low	0 Å²	0	78.7 Å²	78.7	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-65.2	-32.7	-179.3	0	0	0	0	0	112.9	I122 A130 M295	I122-A126 VanDerWaalsContact O-CB 3.29Å; I122-A126 WeakPolarHBondContact O-CB 3.5Å; I122-A126 PolarHBondContact O-N 3.45Å; A126-A130 VanDerWaalsContact O-CB 3.26Å; A126-A130 WeakPolarHBondContact O-CB 3.33Å; A126-A130 PolarHBondContact O-N 3.22Å; A126-A130 VanDerWaalsContact O-N 3.15Å; A126-M295 HydrophobicContact CB-CE 3.73Å
127	I	52.5	Low	44.7	Very low	23 Å²	23	82.8 Å²	82.8	12%	0.118	43%	0.431	C	S	.	.	H	α-helix	trans	-76	-42.9	176.8	-70.5	172.7	0	0	0	110.6	T123 E124 E125 L129 A130 S131 L254 L261 M295	T123-I127 HydrophobicContact CG2-CD1 3.86Å; T123-I127 WeakPolarHBondContact O-CB 3.5Å; T123-I127 VanDerWaalsContact O-CG1 3.23Å; T123-I127 WeakPolarHBondContact O-CG1 3.38Å; T123-I127 PolarHBondContact O-N 3.05Å; E124-I127 PolarHBondContact O-N 2.88Å; E125-I127 VanDerWaalsContact C-N 3.3Å; E125-I127 PolarHBondContact O-N 3.27Å; I127-L129 VanDerWaalsContact C-N 3.29Å; I127-L129 PolarHBondContact O-N 2.99Å; I127-A130 CarbonylContact O-C 3.6Å; I127-A130 PolarHBondContact O-N 3.26Å; I127-S131 WeakPolarHBondContact O-CB 3.16Å; I127-S131 PolarHBondContact O-N 3.31Å; I127-S131 PolarHBondContact O-OG 3.05Å; I127-L254 HydrophobicContact CD1-CD2 4.24Å; I127-L254 HydrophobicContact CG1-CD2 4.32Å; I127-L261 HydrophobicContact CD1-CD1 3.91Å; I127-L261 HydrophobicContact CG2-CD1 4.08Å; I127-M295 HydrophobicContact CG1-CE 4.33Å
128	N	50.8	Low	44.1	Very low	73 Å²	73	85.2 Å²	85.2	39%	0.39	44%	0.442	S	S	.	.	H	α-helix	trans	-61.8	-37.3	175.9	-65.5	-13.7	0	0	0	111.9	E124 E125	E124-N128 WeakPolarHBondContact O-CB 3.42Å; E124-N128 PolarHBondContact O-N 3.47Å; E124-N128 PolarHBondContact O-ND2 3.43Å; E124-N128 PolarHBondContact O-OD1 2.83Å; E125-N128 PolarHBondContact O-N 2.92Å
129	L	51.1	Low	43	Very low	68 Å²	68	91.3 Å²	91.3	36%	0.356	46%	0.461	S	S	.	.	H	α-helix	trans	-68.8	-28.9	172.4	-72	169.7	0	0	0	113.8	E125 I127 L302 K303	E125-L129 HydrophobicContact CG-CD1 4.06Å; E125-L129 WeakPolarHBondContact O-CB 2.75Å; E125-L129 VanDerWaalsContact O-CG 3.31Å; E125-L129 WeakPolarHBondContact O-CG 3.3Å; E125-L129 PolarHBondContact O-N 2.95Å; I127-L129 VanDerWaalsContact C-N 3.29Å; I127-L129 PolarHBondContact O-N 2.99Å; L129-L302 HydrophobicContact CB-CD1 3.92Å; L129-K303 HydrophobicContact CD1-CG 4.43Å
130	A	42.6	Very low	42.2	Very low	36 Å²	36	96.2 Å²	96.2	30%	0.298	49%	0.487	S	S	.	.	H	α-helix	trans	-93.2	-11.7	-178.4	0	0	0	0	0	114.6	A126 I127 L302	A126-A130 VanDerWaalsContact O-CB 3.26Å; A126-A130 WeakPolarHBondContact O-CB 3.33Å; A126-A130 PolarHBondContact O-N 3.22Å; A126-A130 VanDerWaalsContact O-N 3.15Å; I127-A130 CarbonylContact O-C 3.6Å; I127-A130 PolarHBondContact O-N 3.26Å; A130-L302 HydrophobicContact CB-CD1 4.2Å
131	S	44.9	Very low	41.2	Very low	55 Å²	55	99.3 Å²	99.3	39%	0.385	50%	0.501	S	S	.	.	S	Bend	trans	-116.1	19.8	-174.6	58.8	0	0	0	0	113.7	I127 K133	I127-S131 WeakPolarHBondContact O-CB 3.16Å; I127-S131 PolarHBondContact O-N 3.31Å; I127-S131 PolarHBondContact O-OG 3.05Å; S131-K133 PolarHBondContact O-N 3.29Å
132	G	45.8	Very low	40	Very low	40 Å²	40	102.4 Å²	102.4	41%	0.412	52%	0.517	S	S	.	.	S	Bend	trans	71.5	-27.5	178.9	0	0	0	0	0	115.5	L134	G132-L134 PolarHBondContact O-N 2.87Å
133	K	39	Very low	38.9	Very low	160 Å²	160	108.9 Å²	108.9	70%	0.696	54%	0.538	S	S	*	.			trans	-73.8	65.1	-171	-69.5	178	-177.9	179.3	0	114	S131 K135	S131-K133 PolarHBondContact O-N 3.29Å; K133-K135 PolarHBondContact O-N 2.79Å
134	L	37.8	Very low	37.7	Very low	117 Å²	117	116.3 Å²	116.3	61%	0.613	58%	0.577	S	S	*	*			trans	-63.9	87.4	152.3	-93.8	162	0	0	0	108.8	G132 E136	G132-L134 PolarHBondContact O-N 2.87Å; L134-E136 PolarHBondContact O-N 2.92Å
135	K	30.9	Very low	36.4	Very low	187 Å²	187	117.8 Å²	117.8	81%	0.813	60%	0.597	S	S	*	*			trans	-67.3	125.7	174.6	-152.7	172.6	-168.7	176.5	0	109.3	K133	K133-K135 PolarHBondContact O-N 2.79Å
136	E	32.1	Very low	35.2	Very low	171 Å²	171	120.1 Å²	120.1	80%	0.799	62%	0.622	S	S	*	*			trans	-58.8	140.9	-170.9	-58.5	163.4	94.2	0	0	113	L134	L134-E136 PolarHBondContact O-N 2.92Å
137	F	22.4	Very low	34	Very low	204 Å²	204	125.1 Å²	125.1	90%	0.895	66%	0.657	S	S	*	*			trans	-134.5	64.8	157.1	-88.5	-75.2	0	0	0	109.7
138	S	27.2	Very low	32.8	Very low	90 Å²	90	129 Å²	129	63%	0.629	69%	0.686	S	S	*	*			trans	47.1	124	162.2	-52.7	0	0	0	0	119
139	F	23.2	Very low	31.6	Very low	191 Å²	191	133.6 Å²	133.6	84%	0.838	71%	0.705	S	S	*	*	S	Bend	trans	-109.5	-8.4	142.8	-111.1	-83.2	0	0	0	115	K141	F139-K141 PolarHBondContact O-N 3.33Å
140	D	27.6	Very low	30.4	Very low	156 Å²	156	136.2 Å²	136.2	83%	0.834	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	62.5	169	-69.3	-70.7	0	0	0	114.1
141	K	29.8	Very low	29.6	Very low	195 Å²	195	140.8 Å²	140.8	85%	0.848	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.7	28.4	158.2	-148.9	152.5	-163.5	116.4	0	114.1	F139	F139-K141 PolarHBondContact O-N 3.33Å
142	L	25.6	Very low	28.6	Very low	153 Å²	153	146.6 Å²	146.6	80%	0.801	77%	0.774	S	S	*	*	S	Bend	trans	-146.2	28.2	175.9	-111.2	-179.9	0	0	0	117.2
143	R	28	Very low	27.9	Very low	180 Å²	180	156.7 Å²	156.7	68%	0.679	80%	0.799	S	S	*	*	S	Bend	trans	-126	-2.5	172.5	-121.3	177.7	-171.6	-106.9	-1.5	118.6
144	L	27.2	Very low	27.4	Very low	173 Å²	173	159.3 Å²	159.3	91%	0.906	81%	0.811	S	S	*	*	S	Bend	trans	-122.9	74.6	172.4	-76.8	173.5	0	0	0	112.7
145	S	24.6	Very low	26.8	Very low	120 Å²	120	157.1 Å²	157.1	84%	0.839	82%	0.816	S	S	*	*			trans	176.6	76.5	153	-81.6	0	0	0	0	112.1
146	S	25.4	Very low	26.7	Very low	131 Å²	131	160.7 Å²	160.7	92%	0.916	82%	0.824	S	S	*	*			trans	-107	30.9	165.4	53.2	0	0	0	0	112.9
147	S	25.2	Very low	26.5	Very low	105 Å²	105	162.1 Å²	162.1	73%	0.734	83%	0.828	S	S	*	*	S	Bend	trans	-135.5	76.2	168	-165.4	0	0	0	0	112.7
148	S	27	Very low	26.5	Very low	103 Å²	103	159.1 Å²	159.1	72%	0.72	83%	0.826	S	S	*	*			trans	67.7	148.1	164.4	86.9	0	0	0	0	117.2
149	H	26.2	Very low	26.5	Very low	170 Å²	170	166 Å²	166	79%	0.787	84%	0.838	S	S	*	*			cis	-159.3	145.2	-10.3	-138.8	-120.3	0	0	0	110.5
150	V	25	Very low	27.2	Very low	124 Å²	124	161.5 Å²	161.5	75%	0.752	83%	0.828	S	S	*	*			trans	60.5	137.6	158.3	170.4	0	0	0	0	119.4
151	T	25.9	Very low	27	Very low	132 Å²	132	160.9 Å²	160.9	81%	0.81	83%	0.825	S	S	*	*			trans	-92.9	133.8	-177.8	48.4	0	0	0	0	114.1
152	L	24.9	Very low	26.8	Very low	177 Å²	177	155.7 Å²	155.7	93%	0.927	81%	0.813	S	S	*	*			trans	-139.6	112.3	157.9	-85.4	-179.8	0	0	0	112
153	R	29.8	Very low	26.9	Very low	252 Å²	252	158.1 Å²	158.1	95%	0.951	82%	0.817	S	S	*	*			trans	-74.6	152	172.5	-73.5	176.6	168.6	150.1	-4.5	111.5
154	K	28.7	Very low	26.8	Very low	215 Å²	215	153.7 Å²	153.7	94%	0.935	81%	0.814	S	S	*	*			trans	-125.5	114.7	173.4	-159.8	171	-172.6	174.9	0	112.6
155	G	26.8	Very low	26.9	Very low	70 Å²	70	155.4 Å²	155.4	72%	0.722	81%	0.809	S	S	*	*			trans	108.7	110.2	151.7	0	0	0	0	0	118.7
156	R	27.2	Very low	27	Very low	262 Å²	262	160.2 Å²	160.2	99%	0.989	81%	0.809	S	S	*	*				-152.3	168.6	118.1	-111	174.4	-172.1	-175.5	3.6	110.9
157	K	29.4	Very low	27.1	Very low	202 Å²	202	158.6 Å²	158.6	88%	0.878	80%	0.797	S	S	*	*			trans	-112.1	114.1	-149.7	172.4	-174.3	177.2	-178.6	0	112.2
158	V	22.4	Very low	27.2	Very low	141 Å²	141	159.5 Å²	159.5	86%	0.855	80%	0.798	S	S	*	*			trans	-140.5	133.8	165.4	-174.5	0	0	0	0	111.1
159	R	25.9	Very low	27.1	Very low	234 Å²	234	161.5 Å²	161.5	88%	0.883	80%	0.801	S	S	*	*			trans	-130.9	161.7	156.5	-112.3	-169.3	168.5	155.4	-0.9	105.5
160	P	37.8	Very low	27.1	Very low	97 Å²	97	161.3 Å²	161.3	63%	0.63	81%	0.805	S	S	*	*			cis	-140.6	-177.2	32.1	44.2	-26.4	0	0	0	116.4
161	D	23.3	Very low	27.3	Very low	143 Å²	143	164 Å²	164	77%	0.765	81%	0.809	S	S	*	*			trans	63.1	147.1	147.1	-64	-21.8	0	0	0	121.5
162	S	27.5	Very low	27.3	Very low	85 Å²	85	165.6 Å²	165.6	59%	0.594	81%	0.811	S	S	*	*			cis	-162.6	173.9	-6	-118.9	0	0	0	0	112
163	F	25.7	Very low	27.2	Very low	204 Å²	204	164 Å²	164	90%	0.895	80%	0.802	S	S	*	*			trans	68.5	148.7	175.6	-61.3	-88.4	0	0	0	117
164	S	27.2	Very low	26.9	Very low	88 Å²	88	162.7 Å²	162.7	62%	0.615	80%	0.799	S	S	*	*			cis	-165.3	118.2	-17.9	166.8	0	0	0	0	114.8
165	R	29.8	Very low	26.5	Very low	209 Å²	209	155.1 Å²	155.1	79%	0.789	78%	0.781	S	S	*	*			trans	60.2	129	140.9	-66.1	-178.2	166.7	-161.6	-3.8	123.2
166	R	26.5	Very low	26.3	Very low	221 Å²	221	160.1 Å²	160.1	83%	0.834	79%	0.785	S	S	*	*			trans	69.4	151.7	145.5	-68.2	173.4	173.8	-168.2	-5.6	117.9
167	S	27.6	Very low	26	Very low	97 Å²	97	156 Å²	156	68%	0.678	78%	0.775	S	S	*	*			cis	-172	179.1	-26.6	58.4	0	0	0	0	106.8
168	T	27.4	Very low	25.6	Very low	123 Å²	123	150.8 Å²	150.8	76%	0.755	76%	0.764	S	S	*	*			cis	-158.2	175.1	13.9	-22.7	0	0	0	0	108.8
169	D	24.3	Very low	25.5	Very low	146 Å²	146	149.1 Å²	149.1	78%	0.781	76%	0.759	S	S	*	*			trans	-63.4	154.4	174	-48.3	-84	0	0	0	114.8
170	L	26.6	Very low	25.4	Very low	166 Å²	166	142.7 Å²	142.7	87%	0.869	75%	0.75	S	S	*	*				-162.1	147.2	126.3	-135.1	74.6	0	0	0	112.3
171	E	28.1	Very low	24.8	Very low	180 Å²	180	144.6 Å²	144.6	84%	0.841	75%	0.754	S	S	*	*			trans	-78	159.2	167.3	-55.3	173.3	118.1	0	0	111.4
172	I	26	Very low	24.9	Very low	165 Å²	165	143.2 Å²	143.2	85%	0.846	75%	0.751	S	S	*	*			trans	-166.8	160.9	144	-107.2	156	0	0	0	112.3
173	I	24.3	Very low	24.8	Very low	143 Å²	143	144.7 Å²	144.7	73%	0.733	76%	0.756	S	S	*	*			trans	-111	149.4	-166	-67.2	168.6	0	0	0	111.5
174	Y	21.9	Very low	24.8	Very low	226 Å²	226	141.4 Å²	141.4	89%	0.886	75%	0.748	S	S	*	*			trans	64.1	155.3	175.4	-82.5	-151.2	0	0	0	114
175	G	21.9	Very low	24.6	Very low	55 Å²	55	143.1 Å²	143.1	57%	0.567	76%	0.755	S	S	*	*			cis	146.9	174.3	12.7	0	0	0	0	0	108.1
176	H	22.2	Very low	24.4	Very low	175 Å²	175	139 Å²	139	81%	0.81	75%	0.753	S	S	*	*			trans	66.2	155.3	178.6	-74.6	-100.7	0	0	0	117.7
177	F	20.6	Very low	24.4	Very low	177 Å²	177	134 Å²	134	78%	0.776	75%	0.747	S	S	*	*			cis	-169.5	148.1	-38.3	-136.4	-87.6	0	0	0	108.7
178	S	20.6	Very low	24.3	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	75%	0.747	S	S	*	*			trans	65.5	141.2	156.8	-137.5	0	0	0	0	121.7
179	S	21	Very low	24.2	Very low	106 Å²	106	134.8 Å²	134.8	74%	0.741	75%	0.748	S	S	*	*			trans	66.3	147.5	141	-63	0	0	0	0	119.5
180	S	23.3	Very low	24.3	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	75%	0.751	S	S	*	*			cis	-172.4	179.2	-13	53.9	0	0	0	0	106.8
181	L	25.5	Very low	24.3	Very low	137 Å²	137	135.9 Å²	135.9	72%	0.717	75%	0.75	S	S	*	*			cis	-167.8	134.7	21.9	-167.4	80.5	0	0	0	109.3
182	T	25	Very low	24.1	Very low	114 Å²	114	130.6 Å²	130.6	70%	0.699	74%	0.744	S	S	*	*			trans	58.9	162.7	155.3	52.4	0	0	0	0	119
183	T	25.1	Very low	24.1	Very low	116 Å²	116	131.2 Å²	131.2	71%	0.712	75%	0.749	S	S	*	*			cis	-138	138.7	18.2	49.9	0	0	0	0	114.2
184	N	25.3	Very low	24.1	Very low	135 Å²	135	128 Å²	128	72%	0.722	75%	0.752	S	S	*	*			trans	34.2	137	130.9	-51.6	4.4	0	0	0	120.8
185	T	24.6	Very low	24.5	Very low	123 Å²	123	123.2 Å²	123.2	76%	0.755	75%	0.751	S	S	*	*			cis	-152.2	-137.1	-4.5	19.6	0	0	0	0	108.1
186	T	25.2	Very low	24.7	Very low	122 Å²	122	127.5 Å²	127.5	75%	0.748	77%	0.767	S	S	*	*			cis	-162.9	174.3	6.9	-29.3	0	0	0	0	111.1
187	T	25.2	Very low	24.9	Very low	118 Å²	118	124.4 Å²	124.4	72%	0.724	76%	0.764	S	S	*	*			trans	-82.7	177.8	178	59	0	0	0	0	112.2
188	T	26	Very low	25.2	Very low	110 Å²	110	120.8 Å²	120.8	68%	0.675	76%	0.761	S	S	*	*			cis	-168	141.8	21.8	-14.8	0	0	0	0	112.6
189	T	25.6	Very low	25.5	Very low	126 Å²	126	124.8 Å²	124.8	77%	0.773	78%	0.775	S	S	*	*			trans	41.3	131.9	143.7	60.1	0	0	0	0	125.5
190	K	26.3	Very low	25.8	Very low	194 Å²	194	125.8 Å²	125.8	84%	0.843	78%	0.781	S	S	*	*			trans	95.5	117	132	-143.3	179.6	-175.2	-172.8	0	122.3
191	V	26.6	Very low	26.1	Very low	141 Å²	141	126.2 Å²	126.2	86%	0.855	78%	0.784	S	S	*	*			trans	38.7	127.9	142.2	-177.2	0	0	0	0	121.3
192	G	23.2	Very low	26.5	Very low	69 Å²	69	127 Å²	127	71%	0.711	79%	0.788	S	S	*	*			trans	166.8	135.7	154.2	0	0	0	0	0	114.5
193	N	26.7	Very low	26.9	Very low	177 Å²	177	124.6 Å²	124.6	95%	0.947	79%	0.785	S	S	*	*			trans	-71.7	156	177.4	-70.9	23.3	0	0	0	113
194	G	24.5	Very low	27.4	Very low	77 Å²	77	123.2 Å²	123.2	79%	0.794	78%	0.781	S	S	*	*			trans	-177.9	114.2	164.5	0	0	0	0	0	112.7
195	S	29.8	Very low	27.7	Very low	125 Å²	125	122.6 Å²	122.6	87%	0.874	78%	0.777	S	S	*	*			trans	-86.3	140.2	-175.1	-40.4	0	0	0	0	113.2
196	T	26	Very low	27.9	Very low	145 Å²	145	122.4 Å²	122.4	89%	0.89	77%	0.771	S	S	*	*			trans	-143.8	130.2	156.4	51.7	0	0	0	0	110.2
197	S	26.5	Very low	28.5	Very low	109 Å²	109	120.4 Å²	120.4	76%	0.762	75%	0.753	S	S	*	*			trans	-90.6	-179.1	179.7	58.8	0	0	0	0	113
198	S	27	Very low	28.9	Very low	102 Å²	102	117.6 Å²	117.6	71%	0.713	74%	0.738	S	S	*	*			trans	84.3	108.7	162.7	-45	0	0	0	0	117.6
199	L	27.2	Very low	29.3	Very low	176 Å²	176	117.3 Å²	117.3	92%	0.921	73%	0.732	S	S	*	*				176.3	83.9	106.9	-91.8	171.2	0	0	0	111.4
200	S	26.5	Very low	29.8	Very low	126 Å²	126	116.6 Å²	116.6	88%	0.881	72%	0.724	S	S	*	*			trans	-154.7	35.6	176.3	60.6	0	0	0	0	114.3
201	S	31	Very low	30.3	Very low	108 Å²	108	111.1 Å²	111.1	76%	0.755	71%	0.706	S	S	*	*			trans	-108.8	112	170.6	-171.9	0	0	0	0	110.4
202	I	33.1	Very low	30.7	Very low	154 Å²	154	108 Å²	108	79%	0.79	69%	0.688	S	S	*	*	S	Bend	trans	-177.7	-35.2	165.6	-104.1	157	0	0	0	109.5	S204	I202-S204 VanDerWaalsContact C-N 3.27Å; I202-S204 PolarHBondContact O-N 3.01Å
203	G	32.7	Very low	31.3	Very low	63 Å²	63	107.3 Å²	107.3	65%	0.649	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	6.4	-178.5	0	0	0	0	0	116.5
204	S	35.7	Very low	31.7	Very low	88 Å²	88	102.6 Å²	102.6	62%	0.615	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-29.6	-176.6	-159.3	0	0	0	0	113.3	I202 Q207	I202-S204 VanDerWaalsContact C-N 3.27Å; I202-S204 PolarHBondContact O-N 3.01Å; S204-Q207 WeakPolarHBondContact O-CB 3.31Å; S204-Q207 PolarHBondContact O-N 3.25Å
205	L	32	Very low	32.3	Very low	121 Å²	121	103.9 Å²	103.9	63%	0.634	64%	0.644	S	S	*	*	H	α-helix	trans	-76.3	-36.1	-168.5	-170.6	62.7	0	0	0	113.5	Q207 S208 L209	L205-Q207 PolarHBondContact O-N 3.1Å; L205-S208 PolarHBondContact O-OG 3.46Å; L205-L209 WeakPolarHBondContact O-CG 3.36Å; L205-L209 PolarHBondContact O-N 2.88Å
206	D	30	Very low	32.5	Very low	119 Å²	119	105.7 Å²	105.7	64%	0.636	63%	0.633	S	S	*	*	H	α-helix	trans	-67.9	-19.7	173.2	-70.2	-48.2	0	0	0	112.2	N210	D206-N210 PolarHBondContact O-ND2 3.19Å
207	Q	36.8	Very low	33	Very low	80 Å²	80	106.8 Å²	106.8	37%	0.374	62%	0.621	S	S	.	*	H	α-helix	trans	-77.4	-51	-179.1	-156.5	70.2	46.7	0	0	111.2	S204 L205 L209 N210 T211	S204-Q207 WeakPolarHBondContact O-CB 3.31Å; S204-Q207 PolarHBondContact O-N 3.25Å; L205-Q207 PolarHBondContact O-N 3.1Å; Q207-L209 VanDerWaalsContact C-N 3.33Å; Q207-L209 PolarHBondContact O-N 3.05Å; Q207-N210 PolarHBondContact O-N 2.59Å; Q207-T211 PolarHBondContact O-N 2.81Å; Q207-T211 PolarHBondContact O-OG1 2.61Å
208	S	33.5	Very low	33.6	Very low	59 Å²	59	107.1 Å²	107.1	41%	0.413	62%	0.619	S	S	.	*	H	α-helix	trans	-64.6	-35.6	-179.6	59.1	0	0	0	0	112.7	L205 N210 T211 V212	L205-S208 PolarHBondContact O-OG 3.46Å; S208-N210 VanDerWaalsContact C-N 3.29Å; S208-N210 PolarHBondContact O-N 3.1Å; S208-T211 PolarHBondContact O-N 3.05Å; S208-V212 WeakPolarHBondContact O-CB 3.49Å; S208-V212 WeakPolarHBondContact O-CG2 3.27Å; S208-V212 PolarHBondContact O-N 2.84Å
209	L	34.8	Very low	34.2	Very low	104 Å²	104	106.9 Å²	106.9	55%	0.545	61%	0.613	S	S	.	*	H	α-helix	trans	-62.7	-33.2	175.7	-72.4	172.9	0	0	0	113.1	L205 Q207 A213	L205-L209 WeakPolarHBondContact O-CG 3.36Å; L205-L209 PolarHBondContact O-N 2.88Å; Q207-L209 VanDerWaalsContact C-N 3.33Å; Q207-L209 PolarHBondContact O-N 3.05Å; L209-A213 WeakPolarHBondContact O-CB 3.37Å; L209-A213 PolarHBondContact O-N 3.24Å
210	N	35.6	Very low	34.6	Very low	112 Å²	112	101.3 Å²	101.3	60%	0.599	58%	0.584	S	S	*	*	H	α-helix	trans	-74.3	-40.3	174.7	-79.6	-73.6	0	0	0	111.9	D206 Q207 S208 A213 S214	D206-N210 PolarHBondContact O-ND2 3.19Å; Q207-N210 PolarHBondContact O-N 2.59Å; S208-N210 VanDerWaalsContact C-N 3.29Å; S208-N210 PolarHBondContact O-N 3.1Å; N210-A213 PolarHBondContact O-N 3.13Å; N210-S214 PolarHBondContact O-N 3.18Å
211	T	37.9	Very low	35.4	Very low	78 Å²	78	97.9 Å²	97.9	48%	0.479	57%	0.568	S	S	.	*	H	α-helix	trans	-60.7	-48.2	174.2	-50.7	0	0	0	0	111.3	Q207 S208 A213 S214 L215	Q207-T211 PolarHBondContact O-N 2.81Å; Q207-T211 PolarHBondContact O-OG1 2.61Å; S208-T211 PolarHBondContact O-N 3.05Å; T211-A213 PolarHBondContact O-N 2.96Å; T211-S214 WeakPolarHBondContact O-CB 3.39Å; T211-S214 PolarHBondContact O-N 2.95Å; T211-S214 VanDerWaalsContact O-N 3.14Å; T211-L215 HydrophobicContact CG2-CD1 4.22Å; T211-L215 WeakPolarHBondContact O-CG 3.48Å; T211-L215 PolarHBondContact O-N 3.2Å
212	V	35.2	Very low	35.9	Very low	77 Å²	77	99.7 Å²	99.7	47%	0.467	57%	0.565	S	S	.	*	H	α-helix	trans	-62.7	-40.1	177	172.5	0	0	0	0	111.6	S208 S214 L215 Y216	S208-V212 WeakPolarHBondContact O-CB 3.49Å; S208-V212 WeakPolarHBondContact O-CG2 3.27Å; S208-V212 PolarHBondContact O-N 2.84Å; V212-S214 VanDerWaalsContact C-N 3.29Å; V212-S214 PolarHBondContact O-N 3.02Å; V212-L215 PolarHBondContact O-N 3.22Å; V212-Y216 HydrophobicContact CG1-CD2 4.15Å; V212-Y216 WeakPolarHBondContact O-CB 3.26Å; V212-Y216 PolarHBondContact O-N 3.3Å
213	A	34.7	Very low	36.2	Very low	54 Å²	54	100.4 Å²	100.4	45%	0.446	57%	0.565	S	S	.	*	H	α-helix	trans	-67.6	-27	175.7	0	0	0	0	0	113.6	L209 N210 T211	L209-A213 WeakPolarHBondContact O-CB 3.37Å; L209-A213 PolarHBondContact O-N 3.24Å; N210-A213 PolarHBondContact O-N 3.13Å; T211-A213 PolarHBondContact O-N 2.96Å
214	S	36.1	Very low	37	Very low	77 Å²	77	102 Å²	102	54%	0.538	56%	0.558	S	S	.	*	H	α-helix	trans	-70.5	-53.3	171.7	-162.9	0	0	0	0	110.9	N210 T211 V212 Y216 R217 T218	N210-S214 PolarHBondContact O-N 3.18Å; T211-S214 WeakPolarHBondContact O-CB 3.39Å; T211-S214 PolarHBondContact O-N 2.95Å; T211-S214 VanDerWaalsContact O-N 3.14Å; V212-S214 VanDerWaalsContact C-N 3.29Å; V212-S214 PolarHBondContact O-N 3.02Å; S214-Y216 PolarHBondContact O-N 3.35Å; S214-R217 WeakPolarHBondContact O-CA 3.48Å; S214-R217 WeakPolarHBondContact O-CB 3.41Å; S214-R217 PolarHBondContact O-N 3.17Å; S214-T218 PolarHBondContact O-N 3.38Å; S214-T218 VanDerWaalsContact O-N 3.14Å; S214-T218 PolarHBondContact O-OG1 3.36Å; S214-T218 VanDerWaalsContact O-OG1 3.13Å
215	L	35.5	Very low	37.4	Very low	105 Å²	105	102.2 Å²	102.2	55%	0.55	55%	0.552	S	S	.	*	H	α-helix	trans	-57.5	-35.2	178.2	-67.5	167.8	0	0	0	112.8	T211 V212 R217 T218 T219	T211-L215 HydrophobicContact CG2-CD1 4.22Å; T211-L215 WeakPolarHBondContact O-CG 3.48Å; T211-L215 PolarHBondContact O-N 3.2Å; V212-L215 PolarHBondContact O-N 3.22Å; L215-R217 PolarHBondContact O-N 3.3Å; L215-T218 WeakPolarHBondContact CA-OG1 3.13Å; L215-T218 PolarHBondContact O-N 2.86Å; L215-T219 PolarHBondContact O-N 3.37Å; L215-T219 PolarHBondContact O-OG1 3.43Å
216	Y	34.1	Very low	38.1	Very low	163 Å²	163	99.2 Å²	99.2	64%	0.639	54%	0.536	S	S	*	.	H	α-helix	trans	-68.6	-16.7	173.5	-112.5	-78.3	0	0	0	114.6	V212 S214	V212-Y216 HydrophobicContact CG1-CD2 4.15Å; V212-Y216 WeakPolarHBondContact O-CB 3.26Å; V212-Y216 PolarHBondContact O-N 3.3Å; S214-Y216 PolarHBondContact O-N 3.35Å
217	R	36.6	Very low	39	Very low	167 Å²	167	95.4 Å²	95.4	63%	0.63	52%	0.521	S	S	*	.	H	α-helix	trans	-90	-41.8	171.7	-77.3	-172.6	168.3	-138.3	-2.3	111.9	S214 L215 T219 L220	S214-R217 WeakPolarHBondContact O-CA 3.48Å; S214-R217 WeakPolarHBondContact O-CB 3.41Å; S214-R217 PolarHBondContact O-N 3.17Å; L215-R217 PolarHBondContact O-N 3.3Å; R217-T219 VanDerWaalsContact C-N 3.26Å; R217-T219 PolarHBondContact O-N 3.23Å; R217-L220 PolarHBondContact O-N 3.49Å; R217-L220 VanDerWaalsContact O-N 3.07Å
218	T	39.7	Very low	39.6	Very low	117 Å²	117	99.1 Å²	99.1	72%	0.718	53%	0.532	S	S	*	.	H	α-helix	trans	-62.1	-33.8	177.6	4.6	0	0	0	0	112.4	S214 L215 L220	S214-T218 PolarHBondContact O-N 3.38Å; S214-T218 VanDerWaalsContact O-N 3.14Å; S214-T218 PolarHBondContact O-OG1 3.36Å; S214-T218 VanDerWaalsContact O-OG1 3.13Å; L215-T218 WeakPolarHBondContact CA-OG1 3.13Å; L215-T218 PolarHBondContact O-N 2.86Å; T218-L220 VanDerWaalsContact C-N 3.31Å; T218-L220 PolarHBondContact O-N 2.94Å
219	T	38.7	Very low	40.2	Very low	97 Å²	97	99 Å²	99	60%	0.595	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-2.3	175.2	46.3	0	0	0	0	115.1	L215 R217	L215-T219 PolarHBondContact O-N 3.37Å; L215-T219 PolarHBondContact O-OG1 3.43Å; R217-T219 VanDerWaalsContact C-N 3.26Å; R217-T219 PolarHBondContact O-N 3.23Å
220	L	36.8	Very low	40.8	Very low	59 Å²	59	95.2 Å²	95.2	31%	0.309	51%	0.506	S	S	.	.	S	Bend	trans	-123.6	80.3	179.9	-77.2	176.3	0	0	0	112	R217 T218 E222	R217-L220 PolarHBondContact O-N 3.49Å; R217-L220 VanDerWaalsContact O-N 3.07Å; T218-L220 VanDerWaalsContact C-N 3.31Å; T218-L220 PolarHBondContact O-N 2.94Å; L220-E222 PolarHBondContact O-N 3.14Å
221	G	42	Very low	41.6	Very low	53 Å²	53	94.9 Å²	94.9	55%	0.546	50%	0.501	S	S	.	.			trans	-51.8	136.2	167	0	0	0	0	0	112	E223 N224	G221-E223 PolarHBondContact O-N 2.67Å; G221-N224 PolarHBondContact O-N 2.83Å
222	E	41.8	Very low	42.2	Very low	147 Å²	147	96.7 Å²	96.7	69%	0.687	50%	0.502	S	S	*	.	H	α-helix	trans	-53.7	-34.8	-161.2	-63.4	-164.5	117.3	0	0	114.5	L220 N224 L225	L220-E222 PolarHBondContact O-N 3.14Å; E222-N224 VanDerWaalsContact C-N 3.27Å; E222-N224 PolarHBondContact O-N 2.89Å; E222-L225 PolarHBondContact O-N 2.99Å
223	E	40.1	Very low	42.9	Very low	169 Å²	169	94.8 Å²	94.8	79%	0.79	49%	0.491	S	S	*	.	H	α-helix	trans	-63.4	-30.3	-177.4	-57.9	-157.5	-157.1	0	0	113.3	G221 A227	G221-E223 PolarHBondContact O-N 2.67Å; E223-A227 PolarHBondContact O-N 2.93Å
224	N	49.3	Very low	43.4	Very low	95 Å²	95	99.5 Å²	99.5	51%	0.508	50%	0.497	S	S	.	.	H	α-helix	trans	-78.6	-27.3	-174.3	-127.9	-38.8	0	0	0	113	G221 E222 R228	G221-N224 PolarHBondContact O-N 2.83Å; E222-N224 VanDerWaalsContact C-N 3.27Å; E222-N224 PolarHBondContact O-N 2.89Å; N224-R228 WeakPolarHBondContact O-CG 3.5Å; N224-R228 PolarHBondContact O-N 2.78Å
225	L	45.2	Very low	43.8	Very low	94 Å²	94	99.5 Å²	99.5	49%	0.492	50%	0.502	S	S	.	.	H	α-helix	trans	-68.7	-40	174.8	-176.1	63	0	0	0	111.3	E222 R228 L229	E222-L225 PolarHBondContact O-N 2.99Å; L225-R228 PolarHBondContact O-N 3.02Å; L225-L229 HydrophobicContact CG-CD1 4.37Å; L225-L229 WeakPolarHBondContact O-CG 3.45Å; L225-L229 PolarHBondContact O-N 2.65Å; L225-L229 VanDerWaalsContact O-N 3.1Å
226	I	46.6	Very low	44.2	Very low	57 Å²	57	99.8 Å²	99.8	29%	0.292	50%	0.5	S	S	.	.	H	α-helix	trans	-70.6	-41.3	-178.2	-58.8	167.8	0	0	0	110.8	R228 L229 L230 L255	I226-R228 PolarHBondContact O-N 3.09Å; I226-L229 PolarHBondContact O-N 2.91Å; I226-L230 HydrophobicContact CG2-CD1 4.19Å; I226-L230 PolarHBondContact O-N 3.22Å; I226-L255 HydrophobicContact CD1-CD1 4.43Å; I226-L255 HydrophobicContact CG2-CD1 4.14Å; I226-L255 HydrophobicContact CG2-CD2 3.97Å
227	A	48.4	Very low	44.6	Very low	40 Å²	40	95.1 Å²	95.1	33%	0.331	50%	0.496	S	S	.	.	H	α-helix	trans	-56.2	-48.6	173.2	0	0	0	0	0	111.6	E223 L229 L230 E231	E223-A227 PolarHBondContact O-N 2.93Å; A227-L229 VanDerWaalsContact C-N 3.33Å; A227-L229 PolarHBondContact O-N 2.86Å; A227-L230 PolarHBondContact O-N 2.81Å; A227-E231 PolarHBondContact O-N 3.42Å
228	R	48.2	Very low	44.9	Very low	158 Å²	158	90.8 Å²	90.8	60%	0.596	50%	0.503	S	S	*	.	H	α-helix	trans	-63.1	-33.5	177.7	-71.3	175.3	175.9	-179.1	-1.4	113.3	N224 L225 I226 K232	N224-R228 WeakPolarHBondContact O-CG 3.5Å; N224-R228 PolarHBondContact O-N 2.78Å; L225-R228 PolarHBondContact O-N 3.02Å; I226-R228 PolarHBondContact O-N 3.09Å; R228-K232 WeakPolarHBondContact O-CB 3.44Å; R228-K232 PolarHBondContact O-N 3.27Å
229	L	48	Very low	45.1	Very low	55 Å²	55	90.4 Å²	90.4	29%	0.288	51%	0.505	S	S	.	.	H	α-helix	trans	-68.6	-39.7	173.5	-74.3	165.8	0	0	0	112.7	L225 I226 A227 T233 L305	L225-L229 HydrophobicContact CG-CD1 4.37Å; L225-L229 WeakPolarHBondContact O-CG 3.45Å; L225-L229 PolarHBondContact O-N 2.65Å; L225-L229 VanDerWaalsContact O-N 3.1Å; I226-L229 PolarHBondContact O-N 2.91Å; A227-L229 VanDerWaalsContact C-N 3.33Å; A227-L229 PolarHBondContact O-N 2.86Å; L229-T233 PolarHBondContact O-N 3.3Å; L229-T233 PolarHBondContact O-OG1 3.38Å; L229-L305 HydrophobicContact CD2-CD1 4.11Å; L229-L305 HydrophobicContact CD2-CD2 3.98Å
230	L	47.2	Very low	45.4	Very low	25 Å²	25	89.7 Å²	89.7	13%	0.131	52%	0.517	C	S	.	.	H	α-helix	trans	-69.4	-35.3	175	-71.6	168.4	0	0	0	112.2	I226 A227 T233 R234 R248	I226-L230 HydrophobicContact CG2-CD1 4.19Å; I226-L230 PolarHBondContact O-N 3.22Å; A227-L230 PolarHBondContact O-N 2.81Å; L230-T233 PolarHBondContact O-OG1 3.39Å; L230-T233 VanDerWaalsContact O-OG1 3.14Å; L230-R234 PolarHBondContact O-N 2.98Å; L230-R248 HydrophobicContact CD2-CG 3.93Å
231	E	52.1	Low	45.6	Very low	106 Å²	106	89.5 Å²	89.5	50%	0.495	53%	0.529	S	S	.	.	H	α-helix	trans	-69.1	-42.6	174.6	-154.1	76.7	-92.8	0	0	111.4	A227 T233 R234 A235	A227-E231 PolarHBondContact O-N 3.42Å; E231-T233 PolarHBondContact O-N 2.71Å; E231-R234 WeakPolarHBondContact O-CA 3.39Å; E231-R234 WeakPolarHBondContact O-CB 3.33Å; E231-R234 PolarHBondContact O-N 2.88Å; E231-R234 WeakPolarHBondContact OE1-CD 3.32Å; E231-R234 IonicContact OE1-CZ 2.69Å; E231-R234 IonicContact OE1-NE 2.87Å; E231-R234 IonicContact OE1-NH1 3.71Å; E231-R234 PolarHBondContact OE1-NH1 3.21Å; E231-R234 IonicContact OE2-NH1 3.22Å; E231-A235 PolarHBondContact O-N 2.75Å
232	K	49.1	Very low	45.8	Very low	115 Å²	115	91.9 Å²	91.9	50%	0.5	54%	0.544	S	S	.	.	H	α-helix	trans	-64.3	-39.2	179	-167.4	167.6	-175.2	171.9	0	112.6	R228 R234 A235 E236	R228-K232 WeakPolarHBondContact O-CB 3.44Å; R228-K232 PolarHBondContact O-N 3.27Å; K232-R234 VanDerWaalsContact C-N 3.29Å; K232-R234 PolarHBondContact O-N 3.38Å; K232-A235 PolarHBondContact O-N 2.88Å; K232-E236 PolarHBondContact O-N 3.18Å
233	T	50.8	Low	46.1	Very low	37 Å²	37	86.3 Å²	86.3	23%	0.227	53%	0.526	C	S	.	.	H	α-helix	trans	-71.4	-21.4	173.4	48.6	0	0	0	0	113.5	L229 L230 E231 A237	L229-T233 PolarHBondContact O-N 3.3Å; L229-T233 PolarHBondContact O-OG1 3.38Å; L230-T233 PolarHBondContact O-OG1 3.39Å; L230-T233 VanDerWaalsContact O-OG1 3.14Å; E231-T233 PolarHBondContact O-N 2.71Å; T233-A237 PolarHBondContact O-N 3.36Å
234	R	44.9	Very low	46.7	Very low	153 Å²	153	79.8 Å²	79.8	58%	0.577	50%	0.504	S	S	*	.	H	α-helix	trans	-69.2	-36.7	170.5	-160.7	-173.2	-163.4	163.7	2.1	111.9	L230 E231 K232	L230-R234 PolarHBondContact O-N 2.98Å; E231-R234 WeakPolarHBondContact O-CA 3.39Å; E231-R234 WeakPolarHBondContact O-CB 3.33Å; E231-R234 PolarHBondContact O-N 2.88Å; E231-R234 WeakPolarHBondContact OE1-CD 3.32Å; E231-R234 IonicContact OE1-CZ 2.69Å; E231-R234 IonicContact OE1-NE 2.87Å; E231-R234 IonicContact OE1-NH1 3.71Å; E231-R234 PolarHBondContact OE1-NH1 3.21Å; E231-R234 IonicContact OE2-NH1 3.22Å; K232-R234 VanDerWaalsContact C-N 3.29Å; K232-R234 PolarHBondContact O-N 3.38Å
235	A	45.5	Very low	46.9	Very low	77 Å²	77	82.8 Å²	82.8	64%	0.636	52%	0.515	S	S	*	.	H	α-helix	trans	-70.1	-45.8	178.8	0	0	0	0	0	112.7	E231 K232 A237 G238	E231-A235 PolarHBondContact O-N 2.75Å; K232-A235 PolarHBondContact O-N 2.88Å; A235-A237 PolarHBondContact O-N 2.85Å; A235-G238 PolarHBondContact O-N 2.97Å
236	E	43.7	Very low	47.5	Very low	111 Å²	111	81.3 Å²	81.3	52%	0.519	51%	0.507	S	S	.	.	H	α-helix	trans	-66.7	-22.9	179.1	-67.6	-171.7	150.7	0	0	113.3	K232 G238 S239 Y301	K232-E236 PolarHBondContact O-N 3.18Å; E236-G238 PolarHBondContact O-N 3.48Å; E236-G238 VanDerWaalsContact O-N 3.15Å; E236-S239 PolarHBondContact O-N 2.74Å; E236-Y301 PolarHBondContact OE2-OH 2.72Å
237	A	42.7	Very low	47.9	Very low	66 Å²	66	80.1 Å²	80.1	55%	0.545	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.9	177.2	0	0	0	0	0	114.1	T233 A235 S239	T233-A237 PolarHBondContact O-N 3.36Å; A235-A237 PolarHBondContact O-N 2.85Å; A237-S239 PolarHBondContact O-N 2.99Å; A237-S239 VanDerWaalsContact O-N 3.15Å
238	G	41.3	Very low	48.3	Very low	76 Å²	76	83.4 Å²	83.4	78%	0.784	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-13	177.5	0	0	0	0	0	115.3	A235 E236	A235-G238 PolarHBondContact O-N 2.97Å; E236-G238 PolarHBondContact O-N 3.48Å; E236-G238 VanDerWaalsContact O-N 3.15Å
239	S	44.7	Very low	48.6	Very low	109 Å²	109	78.1 Å²	78.1	76%	0.762	50%	0.495	S	S	*	.	S	Bend	trans	-120.6	60.1	-174.5	-160.4	0	0	0	0	113.9	E236 A237 G241	E236-S239 PolarHBondContact O-N 2.74Å; A237-S239 PolarHBondContact O-N 2.99Å; A237-S239 VanDerWaalsContact O-N 3.15Å; S239-G241 PolarHBondContact O-N 3.49Å
240	G	44.5	Very low	49	Very low	81 Å²	81	76.3 Å²	76.3	84%	0.835	49%	0.487	S	S	*	.			trans	63.7	4	157.6	0	0	0	0	0	118.6	A242	G240-A242 PolarHBondContact O-N 3.05Å
241	G	41.4	Very low	49.4	Very low	55 Å²	55	76.9 Å²	76.9	57%	0.567	49%	0.49	S	S	*	.			trans	-83.9	101.1	-175.1	0	0	0	0	0	113.5	S239 G243	S239-G241 PolarHBondContact O-N 3.49Å; G241-G243 PolarHBondContact O-N 3.31Å
242	A	46.2	Very low	49.4	Very low	104 Å²	104	75.1 Å²	75.1	86%	0.86	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	35.4	-179.6	0	0	0	0	0	115.8	G240	G240-A242 PolarHBondContact O-N 3.05Å
243	G	48.6	Very low	50	Low	30 Å²	30	71.5 Å²	71.5	31%	0.309	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129	-11.6	177.7	0	0	0	0	0	115.3	G241	G241-G243 PolarHBondContact O-N 3.31Å
244	G	52.7	Low	50.2	Low	32 Å²	32	71.6 Å²	71.6	33%	0.33	47%	0.469	S	S	.	.	H	α-helix	trans	-67.7	-41.3	179.9	0	0	0	0	0	113.2	D246 I247 R248	G244-D246 PolarHBondContact O-N 3.42Å; G244-I247 PolarHBondContact O-N 3.49Å; G244-R248 PolarHBondContact O-N 2.88Å
245	E	54.3	Low	50.7	Low	158 Å²	158	68.4 Å²	68.4	74%	0.738	46%	0.462	S	S	*	.	H	α-helix	trans	-63.1	-39.6	-178.6	-60.9	-175.3	140.6	0	0	113.1	R248 A249	E245-R248 PolarHBondContact O-N 3.45Å; E245-A249 WeakPolarHBondContact O-CB 3.39Å; E245-A249 PolarHBondContact O-N 3.43Å
246	D	56.1	Low	50.9	Low	62 Å²	62	70.1 Å²	70.1	33%	0.332	46%	0.456	S	S	.	.	H	α-helix	trans	-71.7	-31.5	-180	-75.9	-42.9	0	0	0	112.3	G244 C250 K275	G244-D246 PolarHBondContact O-N 3.42Å; D246-C250 PolarHBondContact O-N 3.26Å; D246-C250 VanDerWaalsContact O-N 3.11Å; D246-C250 PolarHBondContact O-SG 3.35Å; D246-K275 IonicContact OD1-NZ 3.28Å; D246-K275 PolarHBondContact OD1-NZ 3.17Å; D246-K275 IonicContact OD2-NZ 2.76Å; D246-K275 PolarHBondContact OD2-NZ 3.32Å
247	I	56.3	Low	51.2	Low	33 Å²	33	66.1 Å²	66.1	17%	0.169	44%	0.439	C	S	.	.	H	α-helix	trans	-67.6	-46.3	170.9	-68	171.9	0	0	0	109.8	G244 A249 C250 L251 L298	G244-I247 PolarHBondContact O-N 3.49Å; I247-A249 PolarHBondContact O-N 2.9Å; I247-C250 PolarHBondContact O-N 2.86Å; I247-L251 HydrophobicContact CG2-CD1 4.12Å; I247-L251 PolarHBondContact O-N 3.1Å; I247-L298 HydrophobicContact CG2-CD1 4.09Å
248	R	55.4	Low	51.4	Low	109 Å²	109	68.4 Å²	68.4	41%	0.411	45%	0.451	S	S	.	.	H	α-helix	trans	-59.4	-44.5	177.7	-160.7	178.1	-167.6	-170	4	111.7	L230 G244 E245 C250 L251 D252	L230-R248 HydrophobicContact CD2-CG 3.93Å; G244-R248 PolarHBondContact O-N 2.88Å; E245-R248 PolarHBondContact O-N 3.45Å; R248-C250 PolarHBondContact O-N 3.32Å; R248-L251 PolarHBondContact O-N 3.02Å; R248-D252 WeakPolarHBondContact O-CB 3.44Å; R248-D252 PolarHBondContact O-N 3.19Å
249	A	55.8	Low	51.7	Low	46 Å²	46	73.8 Å²	73.8	38%	0.38	46%	0.456	S	S	.	.	H	α-helix	trans	-65.2	-35.3	176.7	0	0	0	0	0	113.2	E245 I247 I253	E245-A249 WeakPolarHBondContact O-CB 3.39Å; E245-A249 PolarHBondContact O-N 3.43Å; I247-A249 PolarHBondContact O-N 2.9Å; A249-I253 WeakPolarHBondContact O-CD1 3.26Å; A249-I253 VanDerWaalsContact O-CG1 3.24Å; A249-I253 WeakPolarHBondContact O-CG1 3.45Å; A249-I253 PolarHBondContact O-N 3.43Å; A249-I253 VanDerWaalsContact O-N 3.09Å
250	C	55.2	Low	52	Low	17 Å²	17	71.1 Å²	71.1	12%	0.115	43%	0.434	C	S	.	.	H	α-helix	trans	-69.1	-39	174.8	-68.7	0	0	0	0	112.2	D246 I247 R248 L254	D246-C250 PolarHBondContact O-N 3.26Å; D246-C250 VanDerWaalsContact O-N 3.11Å; D246-C250 PolarHBondContact O-SG 3.35Å; I247-C250 PolarHBondContact O-N 2.86Å; R248-C250 PolarHBondContact O-N 3.32Å; C250-L254 WeakPolarHBondContact O-CG 3.2Å; C250-L254 PolarHBondContact O-N 3.13Å
251	L	55.8	Low	52.5	Low	38 Å²	38	72.4 Å²	72.4	20%	0.199	42%	0.42	C	S	.	.	H	α-helix	trans	-64.9	-44.5	173.9	-74	167	0	0	0	111.7	I247 R248 I253 L254 L255 L298	I247-L251 HydrophobicContact CG2-CD1 4.12Å; I247-L251 PolarHBondContact O-N 3.1Å; R248-L251 PolarHBondContact O-N 3.02Å; L251-I253 VanDerWaalsContact C-N 3.32Å; L251-I253 PolarHBondContact O-N 3.19Å; L251-L254 PolarHBondContact O-N 3.47Å; L251-L254 VanDerWaalsContact O-N 3.13Å; L251-L255 PolarHBondContact O-N 3.25Å; L251-L298 HydrophobicContact CD1-CD1 4.48Å; L251-L298 HydrophobicContact CD2-CD1 4.16Å; L251-L298 HydrophobicContact CG-CD1 4.29Å
252	D	52.4	Low	53	Low	69 Å²	69	77.3 Å²	77.3	37%	0.369	43%	0.426	S	S	.	.	H	α-helix	trans	-63.8	-35.8	179.6	-154.1	79.5	0	0	0	112.4	R248 K256	R248-D252 WeakPolarHBondContact O-CB 3.44Å; R248-D252 PolarHBondContact O-N 3.19Å; D252-K256 PolarHBondContact O-N 2.89Å; D252-K256 IonicContact OD1-NZ 3.6Å; D252-K256 IonicContact OD2-NZ 3.88Å; D252-K256 PolarHBondContact OD2-NZ 3.39Å
253	I	61.4	Low	53.4	Low	39 Å²	39	78.7 Å²	78.7	20%	0.2	41%	0.413	C	S	.	.	H	α-helix	trans	-70.3	-39.5	172.3	-67.9	165.4	0	0	0	111.4	A249 L251 K256 C257 I267 I268	A249-I253 WeakPolarHBondContact O-CD1 3.26Å; A249-I253 VanDerWaalsContact O-CG1 3.24Å; A249-I253 WeakPolarHBondContact O-CG1 3.45Å; A249-I253 PolarHBondContact O-N 3.43Å; A249-I253 VanDerWaalsContact O-N 3.09Å; L251-I253 VanDerWaalsContact C-N 3.32Å; L251-I253 PolarHBondContact O-N 3.19Å; I253-K256 PolarHBondContact O-N 3.2Å; I253-C257 WeakPolarHBondContact O-CB 3.38Å; I253-C257 PolarHBondContact O-SG 3.24Å; I253-I267 HydrophobicContact CG2-CG2 4.27Å; I253-I268 HydrophobicContact CB-CG1 4.35Å; I253-I268 HydrophobicContact CD1-CG1 4.36Å; I253-I268 HydrophobicContact CG2-CD1 4.13Å; I253-I268 HydrophobicContact CG2-CG1 3.75Å
254	L	56.5	Low	53.8	Low	39 Å²	39	77.7 Å²	77.7	20%	0.204	40%	0.401	C	S	.	.	H	α-helix	trans	-67.1	-38.1	177.2	-75.5	167.1	0	0	0	112.2	I127 C250 L251 C257 I268	I127-L254 HydrophobicContact CD1-CD2 4.24Å; I127-L254 HydrophobicContact CG1-CD2 4.32Å; C250-L254 WeakPolarHBondContact O-CG 3.2Å; C250-L254 PolarHBondContact O-N 3.13Å; L251-L254 PolarHBondContact O-N 3.47Å; L251-L254 VanDerWaalsContact O-N 3.13Å; L254-C257 WeakPolarHBondContact O-CB 3.35Å; L254-C257 PolarHBondContact O-N 3.26Å; L254-I268 HydrophobicContact CD2-CD1 4.36Å; L254-I268 HydrophobicContact CG-CD1 4.31Å
255	L	53.7	Low	54.1	Low	85 Å²	85	77.8 Å²	77.8	45%	0.445	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-42	175.5	-112.4	78.2	0	0	0	112.5	I226 L251 C257	I226-L255 HydrophobicContact CD1-CD1 4.43Å; I226-L255 HydrophobicContact CG2-CD1 4.14Å; I226-L255 HydrophobicContact CG2-CD2 3.97Å; L251-L255 PolarHBondContact O-N 3.25Å; L255-C257 PolarHBondContact O-N 3.32Å; L255-C257 VanDerWaalsContact O-N 3.07Å
256	K	50	Low	54.2	Low	114 Å²	114	74 Å²	74	50%	0.496	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	20.9	-179.7	-73.7	165.1	-179.6	148.3	0	113.8	D252 I253	D252-K256 PolarHBondContact O-N 2.89Å; D252-K256 IonicContact OD1-NZ 3.6Å; D252-K256 IonicContact OD2-NZ 3.88Å; D252-K256 PolarHBondContact OD2-NZ 3.39Å; I253-K256 PolarHBondContact O-N 3.2Å
257	C	49.8	Very low	54.4	Low	26 Å²	26	74.7 Å²	74.7	18%	0.176	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142.8	34.2	-163.9	-90.1	0	0	0	0	113.9	I253 L254 L255 E259 C264	I253-C257 WeakPolarHBondContact O-CB 3.38Å; I253-C257 PolarHBondContact O-SG 3.24Å; L254-C257 WeakPolarHBondContact O-CB 3.35Å; L254-C257 PolarHBondContact O-N 3.26Å; L255-C257 PolarHBondContact O-N 3.32Å; L255-C257 VanDerWaalsContact O-N 3.07Å; C257-E259 PolarHBondContact O-N 3.28Å; C257-E259 VanDerWaalsContact O-N 3.14Å; C257-C264 HydrophobicContact CB-CB 3.6Å; C257-C264 WeakPolarHBondContact CB-SG 3.21Å; C257-C264 WeakPolarHBondContact SG-CB 3.04Å; C257-C264 CovalentContact SG-SG 2.01Å; C257-C264 PolarHBondContact SG-SG 3.43Å
258	S	46.8	Very low	54.5	Low	114 Å²	114	73.4 Å²	73.4	80%	0.797	38%	0.376	S	S	*	.	S	Bend	trans	-55.5	-28	-178.3	42.9	0	0	0	0	115.2
259	E	47.7	Very low	54.7	Low	189 Å²	189	70.8 Å²	70.8	88%	0.883	37%	0.368	S	S	*	.	S	Bend	trans	-111.2	-21.3	-165.7	-62.1	-175.8	163.4	0	0	116.9	C257	C257-E259 PolarHBondContact O-N 3.28Å; C257-E259 VanDerWaalsContact O-N 3.14Å
260	D	52.3	Low	54.7	Low	54 Å²	54	74.2 Å²	74.2	29%	0.289	38%	0.376	S	S	.	.			trans	-139.3	84.1	179.6	-166.9	-29	0	0	0	113.2	K262 K263 C264	D260-K262 PolarHBondContact O-N 3.39Å; D260-K262 WeakPolarHBondContact OD1-CB 3.41Å; D260-K262 PolarHBondContact OD1-N 3.44Å; D260-K263 HydrophobicContact CB-CB 4.33Å; D260-K263 HydrophobicContact CB-CD 4.07Å; D260-K263 HydrophobicContact CB-CG 4.22Å; D260-K263 PolarHBondContact O-N 2.69Å; D260-K263 PolarHBondContact OD1-N 3.06Å; D260-K263 VanDerWaalsContact OD1-N 3.09Å; D260-K263 WeakPolarHBondContact OD2-CD 3.32Å; D260-K263 VanDerWaalsContact OD2-CE 3.26Å; D260-K263 WeakPolarHBondContact OD2-CE 3.25Å; D260-K263 WeakPolarHBondContact OD2-CG 3.23Å; D260-K263 IonicContact OD2-NZ 3.2Å; D260-K263 PolarHBondContact OD2-NZ 3.46Å; D260-C264 PolarHBondContact O-N 3.02Å; D260-C264 PolarHBondContact O-SG 3.14Å; D260-C264 VanDerWaalsContact O-SG 3.32Å
261	L	54.4	Low	54.6	Low	107 Å²	107	76.5 Å²	76.5	56%	0.56	39%	0.391	S	S	*	.	H	α-helix	trans	-49.2	-31.4	176.5	-166.8	69.9	0	0	0	113.8	I127 T265	I127-L261 HydrophobicContact CD1-CD1 3.91Å; I127-L261 HydrophobicContact CG2-CD1 4.08Å; L261-T265 WeakPolarHBondContact O-CB 3.19Å; L261-T265 PolarHBondContact O-N 3.5Å; L261-T265 VanDerWaalsContact O-N 3.11Å; L261-T265 PolarHBondContact O-OG1 3.13Å
262	K	51.7	Low	54.7	Low	159 Å²	159	76.4 Å²	76.4	69%	0.691	39%	0.391	S	S	*	.	H	α-helix	trans	-78.5	-45.6	-174.9	-169.3	177.7	-179.8	-178.1	0	111.4	D260 C264 T265 D266	D260-K262 PolarHBondContact O-N 3.39Å; D260-K262 WeakPolarHBondContact OD1-CB 3.41Å; D260-K262 PolarHBondContact OD1-N 3.44Å; K262-C264 VanDerWaalsContact C-N 3.28Å; K262-C264 PolarHBondContact O-N 3.02Å; K262-T265 PolarHBondContact O-N 3.49Å; K262-D266 PolarHBondContact O-N 2.97Å
263	K	54.3	Low	54.7	Low	133 Å²	133	80.6 Å²	80.6	58%	0.578	40%	0.402	S	S	*	.	H	α-helix	trans	-55.4	-46.5	173.1	-72.2	-179.7	-172	109	0	110.7	D260 D266 I267	D260-K263 HydrophobicContact CB-CB 4.33Å; D260-K263 HydrophobicContact CB-CD 4.07Å; D260-K263 HydrophobicContact CB-CG 4.22Å; D260-K263 PolarHBondContact O-N 2.69Å; D260-K263 PolarHBondContact OD1-N 3.06Å; D260-K263 VanDerWaalsContact OD1-N 3.09Å; D260-K263 WeakPolarHBondContact OD2-CD 3.32Å; D260-K263 VanDerWaalsContact OD2-CE 3.26Å; D260-K263 WeakPolarHBondContact OD2-CE 3.25Å; D260-K263 WeakPolarHBondContact OD2-CG 3.23Å; D260-K263 IonicContact OD2-NZ 3.2Å; D260-K263 PolarHBondContact OD2-NZ 3.46Å; K263-D266 PolarHBondContact O-N 3.18Å; K263-D266 VanDerWaalsContact O-N 3.13Å; K263-I267 WeakPolarHBondContact O-CG1 3.44Å; K263-I267 PolarHBondContact O-N 3.35Å
264	C	57.6	Low	54.1	Low	9 Å²	9	88.5 Å²	88.5	6%	0.061	43%	0.429	C	S	.	.	H	α-helix	trans	-73.7	-34.3	-172.1	-56	0	0	0	0	112.8	C257 D260 K262 D266 I267 I268	C257-C264 HydrophobicContact CB-CB 3.6Å; C257-C264 WeakPolarHBondContact CB-SG 3.21Å; C257-C264 WeakPolarHBondContact SG-CB 3.04Å; C257-C264 CovalentContact SG-SG 2.01Å; C257-C264 PolarHBondContact SG-SG 3.43Å; D260-C264 PolarHBondContact O-N 3.02Å; D260-C264 PolarHBondContact O-SG 3.14Å; D260-C264 VanDerWaalsContact O-SG 3.32Å; K262-C264 VanDerWaalsContact C-N 3.28Å; K262-C264 PolarHBondContact O-N 3.02Å; C264-D266 VanDerWaalsContact C-N 3.28Å; C264-D266 PolarHBondContact O-N 3.32Å; C264-I267 PolarHBondContact O-N 3.31Å; C264-I268 WeakPolarHBondContact O-CG1 3.22Å; C264-I268 PolarHBondContact O-N 3.28Å
265	T	58.6	Low	53.6	Low	33 Å²	33	92.9 Å²	92.9	20%	0.202	45%	0.446	C	S	.	.	H	α-helix	trans	-56.3	-40.9	167.3	-63.4	0	0	0	0	112.1	L261 K262 K269	L261-T265 WeakPolarHBondContact O-CB 3.19Å; L261-T265 PolarHBondContact O-N 3.5Å; L261-T265 VanDerWaalsContact O-N 3.11Å; L261-T265 PolarHBondContact O-OG1 3.13Å; K262-T265 PolarHBondContact O-N 3.49Å; T265-K269 WeakPolarHBondContact O-CG 3.41Å; T265-K269 PolarHBondContact O-N 3.29Å
266	D	55.8	Low	53.5	Low	80 Å²	80	92.6 Å²	92.6	43%	0.428	46%	0.456	S	S	.	.	H	α-helix	trans	-81.6	-29.7	-179.8	-72.8	-22.8	0	0	0	113.2	K262 K263 C264 K269 Q270	K262-D266 PolarHBondContact O-N 2.97Å; K263-D266 PolarHBondContact O-N 3.18Å; K263-D266 VanDerWaalsContact O-N 3.13Å; C264-D266 VanDerWaalsContact C-N 3.28Å; C264-D266 PolarHBondContact O-N 3.32Å; D266-K269 PolarHBondContact O-N 2.01Å; D266-K269 IonicContact OD1-NZ 3.75Å; D266-K269 PolarHBondContact OD1-NZ 3.03Å; D266-Q270 WeakPolarHBondContact O-CB 3.44Å; D266-Q270 PolarHBondContact O-N 3.11Å
267	I	61.3	Low	53	Low	75 Å²	75	90.9 Å²	90.9	39%	0.385	47%	0.471	S	S	.	.	H	α-helix	trans	-60.7	-48.1	169.3	-70.6	164.7	0	0	0	110.7	I253 K263 C264 K269 Q270 C271	I253-I267 HydrophobicContact CG2-CG2 4.27Å; K263-I267 WeakPolarHBondContact O-CG1 3.44Å; K263-I267 PolarHBondContact O-N 3.35Å; C264-I267 PolarHBondContact O-N 3.31Å; I267-K269 VanDerWaalsContact C-N 3.33Å; I267-K269 PolarHBondContact O-N 2.89Å; I267-Q270 CarbonylContact O-C 3.51Å; I267-Q270 WeakPolarHBondContact O-CA 3.3Å; I267-Q270 WeakPolarHBondContact O-CB 3.3Å; I267-Q270 PolarHBondContact O-N 3.27Å; I267-C271 PolarHBondContact O-N 3.25Å
268	I	59	Low	52.3	Low	6 Å²	6	92.9 Å²	92.9	3%	0.031	50%	0.495	C	S	.	.	H	α-helix	trans	-59.7	-44.5	177.7	-65.8	166.7	0	0	0	110.6	I253 L254 C264 Q270 C271 I272 Y291	I253-I268 HydrophobicContact CB-CG1 4.35Å; I253-I268 HydrophobicContact CD1-CG1 4.36Å; I253-I268 HydrophobicContact CG2-CD1 4.13Å; I253-I268 HydrophobicContact CG2-CG1 3.75Å; L254-I268 HydrophobicContact CD2-CD1 4.36Å; L254-I268 HydrophobicContact CG-CD1 4.31Å; C264-I268 WeakPolarHBondContact O-CG1 3.22Å; C264-I268 PolarHBondContact O-N 3.28Å; I268-Q270 PolarHBondContact O-N 3.37Å; I268-C271 PolarHBondContact O-N 3.39Å; I268-I272 HydrophobicContact CG2-CD1 4.03Å; I268-I272 WeakPolarHBondContact O-CG1 3.47Å; I268-I272 PolarHBondContact O-N 3.13Å; I268-Y291 HydrophobicContact CG2-CD2 4.09Å; I268-Y291 HydrophobicContact CG2-CE2 3.84Å
269	K	58.4	Low	52	Low	55 Å²	55	90.4 Å²	90.4	24%	0.239	49%	0.488	C	S	.	.	H	α-helix	trans	-61.9	-29.4	173	-68	171.3	-159.8	157.7	0	113.1	T265 D266 I267 R273	T265-K269 WeakPolarHBondContact O-CG 3.41Å; T265-K269 PolarHBondContact O-N 3.29Å; D266-K269 PolarHBondContact O-N 2.01Å; D266-K269 IonicContact OD1-NZ 3.75Å; D266-K269 PolarHBondContact OD1-NZ 3.03Å; I267-K269 VanDerWaalsContact C-N 3.33Å; I267-K269 PolarHBondContact O-N 2.89Å; K269-R273 VanDerWaalsContact O-CG 3.27Å; K269-R273 WeakPolarHBondContact O-CG 3.12Å; K269-R273 PolarHBondContact O-N 3.36Å; K269-R273 PolarHBondContact O-NE 2.73Å
270	Q	55.2	Low	52	Low	117 Å²	117	87.4 Å²	87.4	55%	0.547	49%	0.485	S	S	.	.	H	α-helix	trans	-80.4	-36	179.6	-158.9	172.2	44.5	0	0	111.7	D266 I267 I268 R273 R274	D266-Q270 WeakPolarHBondContact O-CB 3.44Å; D266-Q270 PolarHBondContact O-N 3.11Å; I267-Q270 CarbonylContact O-C 3.51Å; I267-Q270 WeakPolarHBondContact O-CA 3.3Å; I267-Q270 WeakPolarHBondContact O-CB 3.3Å; I267-Q270 PolarHBondContact O-N 3.27Å; I268-Q270 PolarHBondContact O-N 3.37Å; Q270-R273 PolarHBondContact O-N 3.33Å; Q270-R274 PolarHBondContact O-N 2.95Å
271	C	54	Low	51.8	Low	65 Å²	65	94 Å²	94	44%	0.439	51%	0.514	S	S	.	.	H	α-helix	trans	-62.5	-46.7	169.9	-70.4	0	0	0	0	111.6	I267 I268 R273 R274 K275	I267-C271 PolarHBondContact O-N 3.25Å; I268-C271 PolarHBondContact O-N 3.39Å; C271-R273 VanDerWaalsContact C-N 3.3Å; C271-R273 PolarHBondContact O-N 3.48Å; C271-R274 PolarHBondContact O-N 3.2Å; C271-R274 VanDerWaalsContact O-N 3.08Å; C271-K275 PolarHBondContact O-N 2.92Å
272	I	57.6	Low	51.1	Low	36 Å²	36	96.8 Å²	96.8	19%	0.185	53%	0.529	C	S	.	.	H	α-helix	trans	-57.1	-43.7	174.3	-68.1	167.3	0	0	0	110.9	I268 R274 K275 A276 P287 V290 Y291	I268-I272 HydrophobicContact CG2-CD1 4.03Å; I268-I272 WeakPolarHBondContact O-CG1 3.47Å; I268-I272 PolarHBondContact O-N 3.13Å; I272-R274 PolarHBondContact O-N 3.39Å; I272-K275 PolarHBondContact O-N 3.39Å; I272-A276 PolarHBondContact O-N 3.3Å; I272-P287 HydrophobicContact CG2-CB 4.42Å; I272-V290 HydrophobicContact CG2-CB 4.49Å; I272-V290 HydrophobicContact CG2-CG1 4.25Å; I272-Y291 HydrophobicContact CD1-CD2 4.04Å
273	R	51.9	Low	51.2	Low	158 Å²	158	93 Å²	93	60%	0.596	54%	0.535	S	S	*	.	H	α-helix	trans	-65.7	-32	175.6	-74.5	177.6	-134.7	-118.8	6.7	113.9	K269 Q270 C271	K269-R273 VanDerWaalsContact O-CG 3.27Å; K269-R273 WeakPolarHBondContact O-CG 3.12Å; K269-R273 PolarHBondContact O-N 3.36Å; K269-R273 PolarHBondContact O-NE 2.73Å; Q270-R273 PolarHBondContact O-N 3.33Å; C271-R273 VanDerWaalsContact C-N 3.3Å; C271-R273 PolarHBondContact O-N 3.48Å
274	R	49.8	Very low	50.5	Low	205 Å²	205	90 Å²	90	77%	0.774	54%	0.542	S	S	*	.	H	α-helix	trans	-76.6	-33.8	176.1	-76.4	-170.4	-179	-159.9	4.5	113	Q270 C271 I272	Q270-R274 PolarHBondContact O-N 2.95Å; C271-R274 PolarHBondContact O-N 3.2Å; C271-R274 VanDerWaalsContact O-N 3.08Å; I272-R274 PolarHBondContact O-N 3.39Å
275	K	46.7	Very low	50	Low	131 Å²	131	94.9 Å²	94.9	57%	0.57	57%	0.572	S	S	*	*	H	α-helix	trans	-75.3	-24.3	179.4	-156	178.3	-173.4	-176.2	0	112.7	D246 C271 I272 G277	D246-K275 IonicContact OD1-NZ 3.28Å; D246-K275 PolarHBondContact OD1-NZ 3.17Å; D246-K275 IonicContact OD2-NZ 2.76Å; D246-K275 PolarHBondContact OD2-NZ 3.32Å; C271-K275 PolarHBondContact O-N 2.92Å; I272-K275 PolarHBondContact O-N 3.39Å; K275-G277 PolarHBondContact O-N 3.02Å
276	A	51	Low	49.8	Very low	79 Å²	79	97.5 Å²	97.5	65%	0.653	59%	0.585	S	S	*	*			trans	-74.7	41.4	173.7	0	0	0	0	0	113.9	I272 G278	I272-A276 PolarHBondContact O-N 3.3Å; A276-G278 PolarHBondContact O-N 3.31Å
277	G	39.3	Very low	49.4	Very low	78 Å²	78	96.1 Å²	96.1	80%	0.804	58%	0.58	S	S	*	*			trans	-75.2	78.1	-171.1	0	0	0	0	0	114.7	K275	K275-G277 PolarHBondContact O-N 3.02Å
278	G	35.5	Very low	48.9	Very low	67 Å²	67	95.6 Å²	95.6	69%	0.691	58%	0.578	S	S	*	*			trans	-125.9	159.1	166.4	0	0	0	0	0	111.4	A276	A276-G278 PolarHBondContact O-N 3.31Å
279	G	39.4	Very low	48.8	Very low	62 Å²	62	97.9 Å²	97.9	64%	0.639	59%	0.594	S	S	*	*			trans	-70.2	171.4	175.1	0	0	0	0	0	113.2
280	P	48.5	Very low	48.5	Very low	126 Å²	126	97.6 Å²	97.6	82%	0.818	60%	0.597	S	S	*	*	S	Bend	trans	-62.6	152.7	166.5	30.6	-35	0	0	0	110.3
281	E	47.8	Very low	48.4	Very low	194 Å²	194	92.4 Å²	92.4	91%	0.907	57%	0.573	S	S	*	*	S	Bend	trans	68.3	81.7	-165.7	-39.2	-90.5	108.7	0	0	110.2
282	D	39.8	Very low	48.7	Very low	165 Å²	165	94.6 Å²	94.6	88%	0.882	57%	0.572	S	S	*	*	S	Bend		-157.1	-178.6	74.7	-160	-5.2	0	0	0	112.3	G284	D282-G284 PolarHBondContact O-N 3.27Å
283	G	54.6	Low	48.5	Very low	78 Å²	78	95.5 Å²	95.5	80%	0.804	58%	0.584	S	S	*	*			trans	-67.8	73.5	-168.8	0	0	0	0	0	117.5
284	G	38	Very low	48.6	Very low	71 Å²	71	89.5 Å²	89.5	73%	0.732	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-71.9	150.5	174.5	0	0	0	0	0	115.5	D282	D282-G284 PolarHBondContact O-N 3.27Å
285	T	47.3	Very low	48.9	Very low	111 Å²	111	80 Å²	80	68%	0.681	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-62.9	137.4	-178.8	48.8	0	0	0	0	113.7
286	N	54	Low	49.4	Very low	89 Å²	89	77.1 Å²	77.1	48%	0.476	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-55.2	127.2	176.9	178	-10.9	0	0	0	111.2	D288 S289 V290	N286-D288 PolarHBondContact O-N 3.15Å; N286-D288 VanDerWaalsContact O-N 3.12Å; N286-D288 PolarHBondContact OD1-N 3.48Å; N286-S289 WeakPolarHBondContact O-CA 3.41Å; N286-S289 WeakPolarHBondContact O-CB 3.26Å; N286-S289 PolarHBondContact O-N 3.12Å; N286-S289 PolarHBondContact O-OG 3.25Å; N286-V290 PolarHBondContact O-N 2.84Å
287	P	48.4	Very low	49.4	Very low	51 Å²	51	81.5 Å²	81.5	33%	0.331	52%	0.523	S	S	.	.	H	α-helix	trans	-55.1	-30.5	178.3	21.4	-34	0	0	0	114.2	I272 S289 V290 Y291	I272-P287 HydrophobicContact CG2-CB 4.42Å; P287-S289 PolarHBondContact O-N 2.86Å; P287-V290 PolarHBondContact O-N 3.37Å; P287-Y291 WeakPolarHBondContact O-CB 3.47Å; P287-Y291 PolarHBondContact O-N 2.73Å
288	D	51.3	Low	50	Low	63 Å²	63	78.1 Å²	78.1	34%	0.337	49%	0.487	S	S	.	.	H	α-helix	trans	-71.1	-14.6	175	-67.4	-30.7	0	0	0	113.4	N286 R292	N286-D288 PolarHBondContact O-N 3.15Å; N286-D288 VanDerWaalsContact O-N 3.12Å; N286-D288 PolarHBondContact OD1-N 3.48Å; D288-R292 WeakPolarHBondContact O-CB 3.45Å; D288-R292 WeakPolarHBondContact O-CG 3.41Å; D288-R292 PolarHBondContact O-N 2.82Å; D288-R292 PolarHBondContact O-NE 2.93Å
289	S	55.5	Low	50.8	Low	54 Å²	54	75.4 Å²	75.4	38%	0.378	46%	0.457	S	S	.	.	H	α-helix	trans	-87.5	-35.5	170.1	67.8	0	0	0	0	111.8	N286 P287 R292 A293	N286-S289 WeakPolarHBondContact O-CA 3.41Å; N286-S289 WeakPolarHBondContact O-CB 3.26Å; N286-S289 PolarHBondContact O-N 3.12Å; N286-S289 PolarHBondContact O-OG 3.25Å; P287-S289 PolarHBondContact O-N 2.86Å; S289-R292 PolarHBondContact O-N 2.7Å; S289-A293 WeakPolarHBondContact O-CB 3.39Å; S289-A293 PolarHBondContact O-N 3.2Å
290	V	52.9	Low	51.4	Low	49 Å²	49	75.4 Å²	75.4	30%	0.297	45%	0.447	S	S	.	.	H	α-helix	trans	-66	-48.5	173.7	-178.3	0	0	0	0	110.2	I272 N286 P287 R292 A293 V294	I272-V290 HydrophobicContact CG2-CB 4.49Å; I272-V290 HydrophobicContact CG2-CG1 4.25Å; N286-V290 PolarHBondContact O-N 2.84Å; P287-V290 PolarHBondContact O-N 3.37Å; V290-R292 VanDerWaalsContact C-N 3.31Å; V290-R292 PolarHBondContact O-N 3.05Å; V290-A293 PolarHBondContact O-N 3.12Å; V290-A293 VanDerWaalsContact O-N 3.13Å; V290-V294 WeakPolarHBondContact O-CG2 3.49Å; V290-V294 PolarHBondContact O-N 2.92Å
291	Y	53.3	Low	51.2	Low	8 Å²	8	75.4 Å²	75.4	3%	0.031	43%	0.431	C	S	.	.	H	α-helix	trans	-58.9	-40.6	174.9	-173.3	-103.7	0	0	0	111.9	L119 T123 I268 I272 P287 V294 M295	L119-Y291 HydrophobicContact CD1-CD1 4.22Å; T123-Y291 HydrophobicContact CG2-CE1 4.33Å; T123-Y291 WeakPolarHBondContact CG2-OH 3.32Å; I268-Y291 HydrophobicContact CG2-CD2 4.09Å; I268-Y291 HydrophobicContact CG2-CE2 3.84Å; I272-Y291 HydrophobicContact CD1-CD2 4.04Å; P287-Y291 WeakPolarHBondContact O-CB 3.47Å; P287-Y291 PolarHBondContact O-N 2.73Å; Y291-V294 PolarHBondContact O-N 3.33Å; Y291-M295 HydrophobicContact CD1-CG 4.27Å; Y291-M295 HydrophobicContact CD2-CG 4.43Å; Y291-M295 HydrophobicContact CE1-CG 3.94Å; Y291-M295 HydrophobicContact CE2-CG 4.11Å; Y291-M295 HydrophobicContact CE2-SD 4.27Å; Y291-M295 WeakPolarHBondContact O-CG 3.18Å; Y291-M295 PolarHBondContact O-N 3.19Å
292	R	59.6	Low	51.1	Low	111 Å²	111	67.9 Å²	67.9	42%	0.419	40%	0.397	S	S	.	.	H	α-helix	trans	-59.5	-48.8	171.2	-89.6	178.7	-98.8	-142.4	-8.1	112.9	L119 D288 S289 V290 V294 M295 T296	L119-R292 HydrophobicContact CD1-CG 3.38Å; D288-R292 WeakPolarHBondContact O-CB 3.45Å; D288-R292 WeakPolarHBondContact O-CG 3.41Å; D288-R292 PolarHBondContact O-N 2.82Å; D288-R292 PolarHBondContact O-NE 2.93Å; S289-R292 PolarHBondContact O-N 2.7Å; V290-R292 VanDerWaalsContact C-N 3.31Å; V290-R292 PolarHBondContact O-N 3.05Å; R292-V294 VanDerWaalsContact C-N 3.3Å; R292-V294 PolarHBondContact O-N 2.88Å; R292-M295 PolarHBondContact O-N 3.09Å; R292-T296 WeakPolarHBondContact O-CB 3.42Å; R292-T296 PolarHBondContact O-N 2.79Å; R292-T296 PolarHBondContact O-OG1 2.81Å
293	A	54.6	Low	51.3	Low	55 Å²	55	65.5 Å²	65.5	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-38.2	-178.9	0	0	0	0	0	111.9	S289 V290 R297	S289-A293 WeakPolarHBondContact O-CB 3.39Å; S289-A293 PolarHBondContact O-N 3.2Å; V290-A293 PolarHBondContact O-N 3.12Å; V290-A293 VanDerWaalsContact O-N 3.13Å; A293-R297 WeakPolarHBondContact O-CB 2.99Å; A293-R297 WeakPolarHBondContact O-CG 3.31Å; A293-R297 PolarHBondContact O-N 3.41Å
294	V	53.4	Low	50.7	Low	33 Å²	33	71.4 Å²	71.4	20%	0.2	38%	0.377	C	S	.	.	H	α-helix	trans	-67.6	-54.9	175.6	174.7	0	0	0	0	111.4	V290 Y291 R292 T296 R297 L298	V290-V294 WeakPolarHBondContact O-CG2 3.49Å; V290-V294 PolarHBondContact O-N 2.92Å; Y291-V294 PolarHBondContact O-N 3.33Å; R292-V294 VanDerWaalsContact C-N 3.3Å; R292-V294 PolarHBondContact O-N 2.88Å; V294-T296 VanDerWaalsContact C-N 3.3Å; V294-T296 PolarHBondContact O-N 2.74Å; V294-R297 PolarHBondContact O-N 2.73Å; V294-R297 VanDerWaalsContact O-N 3.15Å; V294-L298 PolarHBondContact O-N 3.26Å
295	M	56.6	Low	50.7	Low	5 Å²	5	72 Å²	72	3%	0.025	36%	0.363	C	S	.	.	H	α-helix	trans	-64.5	-33.4	-178.8	-62.3	-52.5	-65.3	0	0	112.6	T123 A126 I127 Y291 R292 L298 S299	T123-M295 HydrophobicContact CG2-CE 4.31Å; A126-M295 HydrophobicContact CB-CE 3.73Å; I127-M295 HydrophobicContact CG1-CE 4.33Å; Y291-M295 HydrophobicContact CD1-CG 4.27Å; Y291-M295 HydrophobicContact CD2-CG 4.43Å; Y291-M295 HydrophobicContact CE1-CG 3.94Å; Y291-M295 HydrophobicContact CE2-CG 4.11Å; Y291-M295 HydrophobicContact CE2-SD 4.27Å; Y291-M295 WeakPolarHBondContact O-CG 3.18Å; Y291-M295 PolarHBondContact O-N 3.19Å; R292-M295 PolarHBondContact O-N 3.09Å; M295-L298 HydrophobicContact CE-CD2 4.03Å; M295-L298 PolarHBondContact O-N 3.31Å; M295-L298 HydrophobicContact SD-CD2 4.36Å; M295-S299 PolarHBondContact O-N 3.37Å
296	T	56.5	Low	50.3	Low	70 Å²	70	71.4 Å²	71.4	43%	0.429	36%	0.361	S	S	.	.	H	α-helix	trans	-69.1	-39	174.7	-51.2	0	0	0	0	111.5	R292 V294 S300	R292-T296 WeakPolarHBondContact O-CB 3.42Å; R292-T296 PolarHBondContact O-N 2.79Å; R292-T296 PolarHBondContact O-OG1 2.81Å; V294-T296 VanDerWaalsContact C-N 3.3Å; V294-T296 PolarHBondContact O-N 2.74Å; T296-S300 VanDerWaalsContact O-CB 3.26Å; T296-S300 WeakPolarHBondContact O-CB 3.49Å; T296-S300 PolarHBondContact O-N 2.92Å
297	R	52	Low	49.3	Very low	171 Å²	171	75.1 Å²	75.1	65%	0.645	38%	0.38	S	S	*	.	H	α-helix	trans	-65.8	-39	171.8	-85.7	-177.6	167.6	174.6	-3.9	112.1	A293 V294 S300 Y301	A293-R297 WeakPolarHBondContact O-CB 2.99Å; A293-R297 WeakPolarHBondContact O-CG 3.31Å; A293-R297 PolarHBondContact O-N 3.41Å; V294-R297 PolarHBondContact O-N 2.73Å; V294-R297 VanDerWaalsContact O-N 3.15Å; R297-S300 CarbonylContact O-C 3.57Å; R297-S300 PolarHBondContact O-N 3.45Å; R297-Y301 PolarHBondContact O-N 3.08Å
298	L	50.6	Low	48.4	Very low	8 Å²	8	82 Å²	82	4%	0.042	41%	0.408	C	S	.	.	H	α-helix	trans	-62.6	-51.9	177.3	-167.6	71	0	0	0	111.2	I247 L251 V294 M295 S300 Y301 L302	I247-L298 HydrophobicContact CG2-CD1 4.09Å; L251-L298 HydrophobicContact CD1-CD1 4.48Å; L251-L298 HydrophobicContact CD2-CD1 4.16Å; L251-L298 HydrophobicContact CG-CD1 4.29Å; V294-L298 PolarHBondContact O-N 3.26Å; M295-L298 HydrophobicContact CE-CD2 4.03Å; M295-L298 PolarHBondContact O-N 3.31Å; M295-L298 HydrophobicContact SD-CD2 4.36Å; L298-S300 VanDerWaalsContact C-N 3.28Å; L298-S300 PolarHBondContact O-N 2.8Å; L298-Y301 PolarHBondContact O-N 2.87Å; L298-Y301 VanDerWaalsContact O-N 3.08Å; L298-L302 HydrophobicContact CG-CD1 4.24Å; L298-L302 WeakPolarHBondContact O-CG 3.41Å; L298-L302 PolarHBondContact O-N 3.23Å
299	S	52.5	Low	47.3	Very low	9 Å²	9	87.1 Å²	87.1	6%	0.063	43%	0.434	C	S	.	.	H	α-helix	trans	-56.1	-42.3	172.7	179.6	0	0	0	0	111.3	E125 M295 Y301 K303	E125-S299 PolarHBondContact OE2-OG 3.26Å; M295-S299 PolarHBondContact O-N 3.37Å; S299-Y301 VanDerWaalsContact C-N 3.34Å; S299-Y301 PolarHBondContact O-N 3.18Å; S299-K303 VanDerWaalsContact O-CB 3.27Å; S299-K303 WeakPolarHBondContact O-CB 3.49Å; S299-K303 WeakPolarHBondContact O-CD 3.42Å; S299-K303 VanDerWaalsContact O-CG 3.23Å; S299-K303 WeakPolarHBondContact O-CG 3.28Å; S299-K303 PolarHBondContact O-N 3.05Å; S299-K303 PolarHBondContact OG-NZ 3.37Å
300	S	51.3	Low	45.9	Very low	62 Å²	62	94 Å²	94	43%	0.434	46%	0.46	S	S	.	.	H	α-helix	trans	-70.7	-19.7	177.2	-174.4	0	0	0	0	115.3	T296 R297 L298 R304	T296-S300 VanDerWaalsContact O-CB 3.26Å; T296-S300 WeakPolarHBondContact O-CB 3.49Å; T296-S300 PolarHBondContact O-N 2.92Å; R297-S300 CarbonylContact O-C 3.57Å; R297-S300 PolarHBondContact O-N 3.45Å; L298-S300 VanDerWaalsContact C-N 3.28Å; L298-S300 PolarHBondContact O-N 2.8Å; S300-R304 VanDerWaalsContact O-CG 3.31Å; S300-R304 WeakPolarHBondContact O-CG 3.32Å
301	Y	45.9	Very low	44.7	Very low	126 Å²	126	94.9 Å²	94.9	49%	0.494	48%	0.48	S	S	.	.	H	α-helix	trans	-84.3	-45.7	173.6	-107.9	-92.1	0	0	0	110.6	E236 R297 L298 S299 K303 R304	E236-Y301 PolarHBondContact OE2-OH 2.72Å; R297-Y301 PolarHBondContact O-N 3.08Å; L298-Y301 PolarHBondContact O-N 2.87Å; L298-Y301 VanDerWaalsContact O-N 3.08Å; S299-Y301 VanDerWaalsContact C-N 3.34Å; S299-Y301 PolarHBondContact O-N 3.18Å; Y301-K303 VanDerWaalsContact C-N 3.26Å; Y301-K303 PolarHBondContact O-N 3.45Å; Y301-R304 PolarHBondContact O-N 3.48Å
302	L	45.7	Very low	43.3	Very low	36 Å²	36	102 Å²	102	19%	0.188	52%	0.524	C	S	.	.	H	α-helix	trans	-58.7	-39.9	175	-66.3	166.9	0	0	0	111	L129 A130 L298 R304	L129-L302 HydrophobicContact CB-CD1 3.92Å; A130-L302 HydrophobicContact CB-CD1 4.2Å; L298-L302 HydrophobicContact CG-CD1 4.24Å; L298-L302 WeakPolarHBondContact O-CG 3.41Å; L298-L302 PolarHBondContact O-N 3.23Å; L302-R304 PolarHBondContact O-N 2.9Å
303	K	43.8	Very low	41.6	Very low	115 Å²	115	100.1 Å²	100.1	50%	0.5	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	7.4	173.9	-69.6	171.2	173.2	174.7	0	115.3	E125 L129 S299 Y301	E125-K303 IonicContact OE1-NZ 3.89Å; E125-K303 PolarHBondContact OE1-NZ 3.44Å; E125-K303 IonicContact OE2-NZ 2.79Å; E125-K303 PolarHBondContact OE2-NZ 3.12Å; L129-K303 HydrophobicContact CD1-CG 4.43Å; S299-K303 VanDerWaalsContact O-CB 3.27Å; S299-K303 WeakPolarHBondContact O-CB 3.49Å; S299-K303 WeakPolarHBondContact O-CD 3.42Å; S299-K303 VanDerWaalsContact O-CG 3.23Å; S299-K303 WeakPolarHBondContact O-CG 3.28Å; S299-K303 PolarHBondContact O-N 3.05Å; S299-K303 PolarHBondContact OG-NZ 3.37Å; Y301-K303 VanDerWaalsContact C-N 3.26Å; Y301-K303 PolarHBondContact O-N 3.45Å
304	R	42.4	Very low	40.2	Very low	202 Å²	202	103 Å²	103	76%	0.762	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.4	18.1	177.7	-73	-172.4	70.6	-172.6	0.2	113.6	S300 Y301 L302	S300-R304 VanDerWaalsContact O-CG 3.31Å; S300-R304 WeakPolarHBondContact O-CG 3.32Å; Y301-R304 PolarHBondContact O-N 3.48Å; L302-R304 PolarHBondContact O-N 2.9Å
305	L	36.9	Very low	38.9	Very low	84 Å²	84	110.3 Å²	110.3	44%	0.44	59%	0.593	S	S	.	*	S	Bend	trans	-70.7	126.2	162.1	-69	164	0	0	0	108.2	L229 L307	L229-L305 HydrophobicContact CD2-CD1 4.11Å; L229-L305 HydrophobicContact CD2-CD2 3.98Å; L305-L307 PolarHBondContact O-N 3.06Å
306	P	40.1	Very low	37.5	Very low	98 Å²	98	113.3 Å²	113.3	64%	0.636	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-78.2	125.1	-164.2	-16.8	32.3	0	0	0	114.2
307	L	31.6	Very low	36	Very low	168 Å²	168	113.1 Å²	113.1	88%	0.88	64%	0.637	S	S	*	*	P	Polyproline II helix		-84.6	167.2	120.7	-68.3	169.8	0	0	0	108	L305	L305-L307 PolarHBondContact O-N 3.06Å
308	E	29.8	Very low	34.9	Very low	196 Å²	196	112.3 Å²	112.3	92%	0.916	65%	0.651	S	S	*	*			trans	74.2	129.1	-175.6	-55.8	-175.3	163.8	0	0	116.5
309	L	27.5	Very low	33.8	Very low	170 Å²	170	120.4 Å²	120.4	89%	0.89	69%	0.689	S	S	*	*			trans	-135.7	111.3	173.7	168.4	77.6	0	0	0	107.3
310	E	27.2	Very low	32.6	Very low	197 Å²	197	128.9 Å²	128.9	92%	0.921	73%	0.728	S	S	*	*			trans	-171	162.6	155.1	-120.3	-169.2	156.8	0	0	113.5
311	G	27.1	Very low	31.4	Very low	69 Å²	69	130 Å²	130	71%	0.711	75%	0.749	S	S	*	*			trans	90.6	69.9	141.9	0	0	0	0	0	120.4
312	V	23.9	Very low	30.5	Very low	156 Å²	156	127.8 Å²	127.8	95%	0.945	77%	0.765	S	S	*	*			trans	21.8	118	138.8	-177.1	0	0	0	0	118.5
313	G	24.7	Very low	29.8	Very low	73 Å²	73	136.1 Å²	136.1	75%	0.753	80%	0.803	S	S	*	*			trans	-164.6	47.4	-177.3	0	0	0	0	0	122.2
314	S	24.2	Very low	28.9	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	82%	0.815	S	S	*	*			trans	63.3	115.9	154	-164.6	0	0	0	0	121.3
315	L	27.3	Very low	28.3	Very low	186 Å²	186	131.1 Å²	131.1	97%	0.974	82%	0.819	S	S	*	*			trans	-124.4	120.6	138.9	-105.5	168.2	0	0	0	106.7
316	G	25.8	Very low	28	Very low	69 Å²	69	133.4 Å²	133.4	71%	0.711	84%	0.839	S	S	*	*			trans	-113.5	163.7	-165.9	0	0	0	0	0	115.1
317	G	26.5	Very low	27.4	Very low	65 Å²	65	132.2 Å²	132.2	67%	0.67	84%	0.844	S	S	*	*			trans	169.7	114.9	169.3	0	0	0	0	0	116.3
318	T	28.3	Very low	27.5	Very low	154 Å²	154	130.6 Å²	130.6	95%	0.945	85%	0.847	S	S	*	*			trans	66.1	156.9	155.7	47.5	0	0	0	0	120.4
319	E	27	Very low	27.5	Very low	178 Å²	178	124.6 Å²	124.6	83%	0.832	84%	0.838	S	S	*	*			trans	-94.7	147.6	-173.2	-49.2	163.6	116.3	0	0	111.8
320	Q	28.4	Very low	27.7	Very low	187 Å²	187	124.9 Å²	124.9	87%	0.874	83%	0.834	S	S	*	*				168.5	123.4	115	-92.5	177.4	25.3	0	0	114
321	G	26.1	Very low	28.1	Very low	85 Å²	85	119.3 Å²	119.3	88%	0.876	82%	0.817	S	S	*	*			trans	76.6	140.2	136.2	0	0	0	0	0	120.6
322	G	26.3	Very low	28.5	Very low	81 Å²	81	122.6 Å²	122.6	84%	0.835	82%	0.818	S	S	*	*			trans	116.1	129.5	160.6	0	0	0	0	0	114.9
323	Q	30.5	Very low	29.1	Very low	211 Å²	211	120.4 Å²	120.4	99%	0.986	80%	0.801	S	S	*	*			trans	-85.5	129.5	166.2	-67.6	174.4	-69.1	0	0	109
324	G	25.8	Very low	29.7	Very low	73 Å²	73	119.4 Å²	119.4	75%	0.753	79%	0.786	S	S	*	*			trans	-154.6	139.1	176	0	0	0	0	0	110.4
325	T	29.4	Very low	30.3	Very low	138 Å²	138	120.5 Å²	120.5	85%	0.847	78%	0.778	S	S	*	*			trans	-60.8	136.4	-177.2	44.1	0	0	0	0	113.4
326	P	30.1	Very low	30.7	Very low	133 Å²	133	116.6 Å²	116.6	86%	0.864	76%	0.757	S	S	*	*			trans	-78.4	147.1	161.1	34.2	-32.5	0	0	0	110.5
327	G	27.9	Very low	31.2	Very low	72 Å²	72	117.6 Å²	117.6	74%	0.742	75%	0.746	S	S	*	*			trans	-176.6	137.1	171.6	0	0	0	0	0	112.2
328	S	34.8	Very low	31.5	Very low	135 Å²	135	119.4 Å²	119.4	94%	0.944	74%	0.74	S	S	*	*			trans	52.3	119.6	174.2	-158.9	0	0	0	0	117.9
329	G	28.4	Very low	31.7	Very low	70 Å²	70	115.6 Å²	115.6	72%	0.722	72%	0.717	S	S	*	*			trans	-177.7	52.3	177.5	0	0	0	0	0	114.1
330	H	31.8	Very low	32.2	Very low	175 Å²	175	112.3 Å²	112.3	81%	0.81	70%	0.703	S	S	*	*			trans	-143.2	27	-179.5	-118.5	-95.3	0	0	0	113.8
331	S	34.9	Very low	32.5	Very low	81 Å²	81	109.8 Å²	109.8	57%	0.566	69%	0.691	S	S	*	*			trans	-82.3	-34.8	-177.2	-159.7	0	0	0	0	113.4	L333 A334 E335	S331-L333 VanDerWaalsContact C-N 3.34Å; S331-L333 PolarHBondContact O-N 2.89Å; S331-A334 PolarHBondContact O-N 3.45Å; S331-E335 PolarHBondContact O-N 2.89Å
332	D	35.5	Very low	32.6	Very low	137 Å²	137	109.7 Å²	109.7	73%	0.733	68%	0.677	S	S	*	*	H	α-helix	trans	-80.1	-11.7	-157.1	-53.1	19.6	0	0	0	114.1
333	L	38.1	Very low	32.9	Very low	111 Å²	111	112.6 Å²	112.6	58%	0.581	67%	0.672	S	S	*	*	H	α-helix	trans	-88	-35.7	172.8	-175.3	60.4	0	0	0	111.9	S331 E335 L336 I337	S331-L333 VanDerWaalsContact C-N 3.34Å; S331-L333 PolarHBondContact O-N 2.89Å; L333-E335 VanDerWaalsContact C-N 3.32Å; L333-E335 PolarHBondContact O-N 3.21Å; L333-L336 PolarHBondContact O-N 3.29Å; L333-I337 HydrophobicContact CG-CD1 4.33Å; L333-I337 PolarHBondContact O-N 2.95Å
334	A	36.8	Very low	33	Very low	52 Å²	52	109.9 Å²	109.9	43%	0.43	66%	0.66	S	S	.	*	H	α-helix	trans	-66.1	-35.9	178.3	0	0	0	0	0	111.7	S331 I337 N338	S331-A334 PolarHBondContact O-N 3.45Å; A334-I337 PolarHBondContact O-N 3.27Å; A334-N338 WeakPolarHBondContact O-CB 3.31Å; A334-N338 PolarHBondContact O-N 3.1Å; A334-N338 PolarHBondContact O-ND2 2.94Å
335	E	36.6	Very low	33.1	Very low	137 Å²	137	114 Å²	114	64%	0.64	66%	0.659	S	S	*	*	H	α-helix	trans	-67.5	-35.2	177.9	-160.7	167	-133.4	0	0	112	S331 L333 T339	S331-E335 PolarHBondContact O-N 2.89Å; L333-E335 VanDerWaalsContact C-N 3.32Å; L333-E335 PolarHBondContact O-N 3.21Å; E335-T339 WeakPolarHBondContact O-CB 3.42Å; E335-T339 PolarHBondContact O-N 3.19Å; E335-T339 PolarHBondContact O-OG1 3.19Å
336	L	35.5	Very low	32.9	Very low	104 Å²	104	109.5 Å²	109.5	55%	0.545	64%	0.641	S	S	.	*	H	α-helix	trans	-69.3	-39.9	176.5	-175.7	60.2	0	0	0	112.6	L333 T339 I340	L333-L336 PolarHBondContact O-N 3.29Å; L336-T339 PolarHBondContact O-N 2.99Å; L336-I340 PolarHBondContact O-N 2.88Å
337	I	36.8	Very low	32.8	Very low	91 Å²	91	109.3 Å²	109.3	47%	0.467	64%	0.639	S	S	.	*	H	α-helix	trans	-67.4	-44.9	177.1	-66.3	171.5	0	0	0	110.5	L333 A334 T339 I340 H341	L333-I337 HydrophobicContact CG-CD1 4.33Å; L333-I337 PolarHBondContact O-N 2.95Å; A334-I337 PolarHBondContact O-N 3.27Å; I337-T339 VanDerWaalsContact C-N 3.27Å; I337-T339 PolarHBondContact O-N 2.9Å; I337-I340 PolarHBondContact O-N 2.79Å; I337-H341 PolarHBondContact O-N 3.25Å; I337-H341 VanDerWaalsContact O-N 3.16Å
338	N	32.6	Very low	32.8	Very low	103 Å²	103	114.7 Å²	114.7	55%	0.551	64%	0.643	S	S	*	*	H	α-helix	trans	-61.2	-34.2	174.6	-80.4	-70.8	0	0	0	113	A334 I340 H341 S342	A334-N338 WeakPolarHBondContact O-CB 3.31Å; A334-N338 PolarHBondContact O-N 3.1Å; A334-N338 PolarHBondContact O-ND2 2.94Å; N338-I340 VanDerWaalsContact C-N 3.33Å; N338-I340 PolarHBondContact O-N 2.76Å; N338-H341 PolarHBondContact O-N 3.03Å; N338-S342 PolarHBondContact O-N 3.3Å; N338-S342 PolarHBondContact O-OG 3.49Å
339	T	33.3	Very low	32.3	Very low	74 Å²	74	112.2 Å²	112.2	45%	0.454	63%	0.625	S	S	.	*	H	α-helix	trans	-67	-33	177.4	-57.3	0	0	0	0	112.2	E335 L336 I337	E335-T339 WeakPolarHBondContact O-CB 3.42Å; E335-T339 PolarHBondContact O-N 3.19Å; E335-T339 PolarHBondContact O-OG1 3.19Å; L336-T339 PolarHBondContact O-N 2.99Å; I337-T339 VanDerWaalsContact C-N 3.27Å; I337-T339 PolarHBondContact O-N 2.9Å
340	I	36	Very low	32.5	Very low	108 Å²	108	114.7 Å²	114.7	55%	0.554	63%	0.628	S	S	*	*	H	α-helix	trans	-73.3	-44.3	175.5	-66.2	173.9	0	0	0	110.8	L336 I337 N338 S342 I343	L336-I340 PolarHBondContact O-N 2.88Å; I337-I340 PolarHBondContact O-N 2.79Å; N338-I340 VanDerWaalsContact C-N 3.33Å; N338-I340 PolarHBondContact O-N 2.76Å; I340-S342 PolarHBondContact O-N 3.02Å; I340-I343 PolarHBondContact O-N 3.02Å; I340-I343 VanDerWaalsContact O-N 3.13Å
341	H	35.8	Very low	33	Very low	134 Å²	134	109.5 Å²	109.5	62%	0.62	61%	0.606	S	S	*	*	H	α-helix	trans	-60.3	-14	174.3	-92.5	-86.1	0	0	0	114.7	I337 N338 Q345	I337-H341 PolarHBondContact O-N 3.25Å; I337-H341 VanDerWaalsContact O-N 3.16Å; N338-H341 PolarHBondContact O-N 3.03Å; H341-Q345 PolarHBondContact O-NE2 3.36Å
342	S	27.7	Very low	33.4	Very low	83 Å²	83	109.3 Å²	109.3	58%	0.58	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-11.4	179.1	-57.9	0	0	0	0	114.4	N338 I340	N338-S342 PolarHBondContact O-N 3.3Å; N338-S342 PolarHBondContact O-OG 3.49Å; I340-S342 PolarHBondContact O-N 3.02Å
343	I	33.8	Very low	33.4	Very low	143 Å²	143	105.1 Å²	105.1	73%	0.733	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-14.3	-173.3	-68.2	175.6	0	0	0	112.6	I340 Q345	I340-I343 PolarHBondContact O-N 3.02Å; I340-I343 VanDerWaalsContact O-N 3.13Å; I343-Q345 VanDerWaalsContact C-N 3.31Å
344	Q	32.5	Very low	33.6	Very low	154 Å²	154	107.6 Å²	107.6	72%	0.72	60%	0.598	S	S	*	*	S	Bend	trans	-89.3	6.3	177.1	-147.2	163	-0.5	0	0	113.6	G346	Q344-G346 PolarHBondContact O-N 3.28Å
345	Q	26.9	Very low	34.4	Very low	159 Å²	159	110 Å²	110	74%	0.743	60%	0.601	S	S	*	*			trans	-91.1	72.9	179.6	-65.5	-173.6	30.9	0	0	112.6	H341 I343	H341-Q345 PolarHBondContact O-NE2 3.36Å; I343-Q345 VanDerWaalsContact C-N 3.31Å
346	G	25.4	Very low	35.8	Very low	44 Å²	44	105 Å²	105	45%	0.454	58%	0.577	S	S	.	*	S	Bend		-70.2	150.8	129.6	0	0	0	0	0	108.1	Q344 F348	Q344-G346 PolarHBondContact O-N 3.28Å; G346-F348 PolarHBondContact O-N 3.43Å
347	P	27.5	Very low	37.4	Very low	129 Å²	129	100.2 Å²	100.2	84%	0.838	55%	0.552	S	S	*	*	S	Bend	trans	-79.2	57.6	-164.3	33.6	-38	0	0	0	114.4	S349	P347-S349 PolarHBondContact O-N 3.37Å
348	F	27.6	Very low	39.3	Very low	185 Å²	185	97.5 Å²	97.5	81%	0.811	54%	0.541	S	S	*	.			trans	-65.8	90.4	150.2	-73.5	-71.2	0	0	0	107.8	G346 I351	G346-F348 PolarHBondContact O-N 3.43Å; F348-I351 HydrophobicContact CD1-CD1 3.97Å; F348-I351 HydrophobicContact CD1-CG1 4.44Å
349	S	25.1	Very low	41.4	Very low	83 Å²	83	93.3 Å²	93.3	58%	0.58	52%	0.517	S	S	*	.			trans	-57.3	165.8	163.2	-61.3	0	0	0	0	109.6	P347 I351	P347-S349 PolarHBondContact O-N 3.37Å; S349-I351 WeakPolarHBondContact O-CG1 2.91Å; S349-I351 PolarHBondContact O-N 2.96Å
350	P	31.6	Very low	43.5	Very low	121 Å²	121	90.5 Å²	90.5	79%	0.786	50%	0.498	S	S	*	.			trans	-55.9	107.5	174.7	-21.9	33.5	0	0	0	109.3	F352	P350-F352 PolarHBondContact O-N 3.22Å; P350-F352 VanDerWaalsContact O-N 3.08Å
351	I	43.9	Very low	45.4	Very low	66 Å²	66	88 Å²	88	34%	0.338	48%	0.484	S	S	.	.	S	Bend	trans	-61.5	-30.9	-158.1	-62.5	-176.6	0	0	0	111.5	F348 S349 W989	F348-I351 HydrophobicContact CD1-CD1 3.97Å; F348-I351 HydrophobicContact CD1-CG1 4.44Å; S349-I351 WeakPolarHBondContact O-CG1 2.91Å; S349-I351 PolarHBondContact O-N 2.96Å; I351-W989 HydrophobicContact CG2-CH2 3.65Å; I351-W989 HydrophobicContact CG2-CZ3 3.64Å; I351-W989 VanDerWaalsContact O-CH2 3.24Å; I351-W989 WeakPolarHBondContact O-CH2 3.44Å
352	F	41.6	Very low	47.2	Very low	77 Å²	77	85 Å²	85	34%	0.338	47%	0.473	S	S	.	.			trans	-115.7	78.1	-179.1	-53.8	-49.2	0	0	0	112.3	P350 Q356 E1182	P350-F352 PolarHBondContact O-N 3.22Å; P350-F352 VanDerWaalsContact O-N 3.08Å; F352-Q356 HydrophobicContact CB-CB 4.19Å; F352-Q356 HydrophobicContact CD1-CB 3.58Å; F352-Q356 HydrophobicContact CD1-CG 3.57Å; F352-Q356 HydrophobicContact CE1-CB 4.2Å; F352-Q356 HydrophobicContact CE1-CG 3.7Å; F352-Q356 HydrophobicContact CG-CB 4.04Å; F352-Q356 VanDerWaalsContact CG-CD 3.44Å; F352-Q356 HydrophobicContact CG-CG 4.09Å; F352-Q356 HydrophobicContact CZ-CG 4.34Å; F352-E1182 HydrophobicContact CD2-CG 3.9Å; F352-E1182 HydrophobicContact CE2-CG 3.83Å
353	G	36.8	Very low	49.1	Very low	49 Å²	49	83.7 Å²	83.7	51%	0.505	46%	0.461	S	S	.	.	S	Bend	trans	-94.3	88.1	166	0	0	0	0	0	111.5	E355	G353-E355 PolarHBondContact O-N 2.94Å
354	N	42.5	Very low	50.4	Low	164 Å²	164	80.8 Å²	80.8	88%	0.877	45%	0.45	S	S	*	.	S	Bend	trans	60	-18.2	178.6	-61	-26.4	0	0	0	118.3
355	E	53.6	Low	51.3	Low	103 Å²	103	80.8 Å²	80.8	48%	0.481	45%	0.45	S	S	.	.			trans	-102.9	13.2	-167.2	-66.4	-179.3	-159.3	0	0	114.9	G353 F922	G353-E355 PolarHBondContact O-N 2.94Å; E355-F922 WeakPolarHBondContact O-CE1 3.34Å; E355-F922 WeakPolarHBondContact O-CZ 3.27Å
356	Q	64.4	Low	51.7	Low	31 Å²	31	76.3 Å²	76.3	15%	0.145	44%	0.436	C	S	.	.	S	Bend	trans	-84.4	142.9	167.3	-164.4	-173.8	7.3	0	0	110.7	F352 F922 Y982 E1182	F352-Q356 HydrophobicContact CB-CB 4.19Å; F352-Q356 HydrophobicContact CD1-CB 3.58Å; F352-Q356 HydrophobicContact CD1-CG 3.57Å; F352-Q356 HydrophobicContact CE1-CB 4.2Å; F352-Q356 HydrophobicContact CE1-CG 3.7Å; F352-Q356 HydrophobicContact CG-CB 4.04Å; F352-Q356 VanDerWaalsContact CG-CD 3.44Å; F352-Q356 HydrophobicContact CG-CG 4.09Å; F352-Q356 HydrophobicContact CZ-CG 4.34Å; Q356-F922 VanDerWaalsContact O-CE2 3.27Å; Q356-F922 WeakPolarHBondContact O-CE2 3.41Å; Q356-F922 WeakPolarHBondContact O-CZ 3.39Å; Q356-Y982 PolarHBondContact NE2-OH 2.88Å; Q356-E1182 PolarHBondContact NE2-OE2 3.48Å; Q356-E1182 PolarHBondContact OE1-OE1 2.63Å; Q356-E1182 PolarHBondContact OE1-OE2 3.28Å
357	P	70.3	Confident	52	Low	3 Å²	3	79.2 Å²	79.2	2%	0.019	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-59.5	143.1	169	-16.4	28.2	0	0	0	110.3	R359 F922 Y978 F981 Y982 Y985	P357-R359 PolarHBondContact O-N 3.44Å; P357-F922 HydrophobicContact CB-CD1 3.88Å; P357-F922 HydrophobicContact CB-CD2 4.45Å; P357-F922 HydrophobicContact CB-CE1 4.28Å; P357-F922 HydrophobicContact CB-CG 3.99Å; P357-F922 HydrophobicContact CG-CD1 3.66Å; P357-F922 HydrophobicContact CG-CE1 3.88Å; P357-F922 HydrophobicContact CG-CG 4.29Å; P357-Y978 WeakPolarHBondContact CB-OH 3.46Å; P357-F981 HydrophobicContact CB-CE1 4.4Å; P357-Y982 HydrophobicContact CB-CD2 3.86Å; P357-Y982 HydrophobicContact CB-CE2 3.9Å; P357-Y982 HydrophobicContact CG-CD2 4.36Å; P357-Y982 HydrophobicContact CG-CE2 4.42Å; P357-Y982 WeakPolarHBondContact O-CE2 3.39Å; P357-Y985 HydrophobicContact CG-CD1 3.29Å; P357-Y985 HydrophobicContact CG-CE1 3.78Å; P357-Y985 HydrophobicContact CG-CG 3.96Å
358	P	76.3	Confident	52.3	Low	35 Å²	35	78.8 Å²	78.8	23%	0.227	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-58.1	134.2	171.8	-22.7	32.9	0	0	0	110.5	V363 F915 A919 Y978	P358-V363 HydrophobicContact CB-CG2 3.81Å; P358-F915 HydrophobicContact CB-CD2 4.11Å; P358-F915 HydrophobicContact CB-CE2 4.32Å; P358-F915 HydrophobicContact CG-CD2 4.3Å; P358-A919 HydrophobicContact CG-CB 4.38Å; P358-Y978 VanDerWaalsContact O-CE1 3.3Å; P358-Y978 WeakPolarHBondContact O-CE1 3.31Å; P358-Y978 PolarHBondContact O-OH 2.92Å
359	R	76.6	Confident	52.6	Low	15 Å²	15	77 Å²	77	6%	0.057	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-61.4	150.4	169.4	-47.4	-174.2	-148.8	126.8	0.8	109.4	P357 D362 E1182 E1186	P357-R359 PolarHBondContact O-N 3.44Å; R359-D362 WeakPolarHBondContact CB-OD2 3.37Å; R359-D362 WeakPolarHBondContact CD-OD2 3.33Å; R359-D362 WeakPolarHBondContact CG-OD2 3.37Å; R359-D362 IonicContact CZ-OD2 3.96Å; R359-D362 IonicContact NE-OD2 2.76Å; R359-D362 PolarHBondContact NE-OD2 2.97Å; R359-D362 IonicContact NH1-OD1 2.74Å; R359-D362 PolarHBondContact NH1-OD1 3.16Å; R359-D362 IonicContact NH1-OD2 3.69Å; R359-D362 PolarHBondContact NH1-OD2 2.91Å; R359-E1182 IonicContact CZ-OE1 3.33Å; R359-E1182 IonicContact CZ-OE2 3.35Å; R359-E1182 IonicContact NE-OE1 2.74Å; R359-E1182 PolarHBondContact NE-OE1 3.48Å; R359-E1182 IonicContact NE-OE2 2.7Å; R359-E1182 PolarHBondContact NE-OE2 3.25Å; R359-E1182 IonicContact NH2-OE1 3.63Å; R359-E1182 PolarHBondContact NH2-OE1 3.15Å; R359-E1182 IonicContact NH2-OE2 3.21Å; R359-E1186 IonicContact CZ-OE1 2.61Å; R359-E1186 IonicContact NH1-OE1 2.59Å; R359-E1186 IonicContact NH1-OE2 2.74Å; R359-E1186 IonicContact NH2-OE1 3.78Å; R359-E1186 PolarHBondContact NH2-OE1 3.44Å; R359-E1186 IonicContact NH2-OE2 3.72Å
360	Y	77.4	Confident	52.7	Low	14 Å²	14	77.9 Å²	77.9	6%	0.055	45%	0.448	C	S	.	.	H	α-helix	trans	-66.3	-46.3	-179.3	-169.9	-118.3	0	0	0	111.7	D362 V363 V364 G912 F915 D968 I969 N970 Y978 Y1175	Y360-D362 PolarHBondContact O-N 3.05Å; Y360-V363 PolarHBondContact O-N 3.47Å; Y360-V364 HydrophobicContact CD1-CG2 4.27Å; Y360-V364 HydrophobicContact CD2-CG2 3.93Å; Y360-V364 HydrophobicContact CE1-CG2 4.1Å; Y360-V364 HydrophobicContact CE2-CG2 3.71Å; Y360-V364 HydrophobicContact CG-CG2 4.21Å; Y360-V364 WeakPolarHBondContact O-CB 3.47Å; Y360-V364 VanDerWaalsContact O-CG2 3.28Å; Y360-V364 WeakPolarHBondContact O-CG2 3.34Å; Y360-V364 PolarHBondContact O-N 3.03Å; Y360-G912 WeakPolarHBondContact CE2-O 3.39Å; Y360-F915 AromaticContact CD2-CE1 3.88Å; Y360-F915 HydrophobicContact CD2-CE1 3.88Å; Y360-F915 HydrophobicContact CD2-CZ 4.08Å; Y360-F915 HydrophobicContact CE2-CE1 4.13Å; Y360-D968 VanDerWaalsContact CE1-OD1 3.3Å; Y360-D968 WeakPolarHBondContact CE1-OD1 2.87Å; Y360-D968 VanDerWaalsContact CZ-OD1 3.29Å; Y360-D968 PolarHBondContact OH-OD1 3.38Å; Y360-I969 HydrophobicContact CE2-CG2 3.76Å; Y360-I969 PolarHBondContact OH-N 3.14Å; Y360-N970 WeakPolarHBondContact CD1-ND2 3.24Å; Y360-N970 WeakPolarHBondContact CE1-ND2 3.41Å; Y360-Y978 AromaticContact CD2-CD1 3.97Å; Y360-Y978 HydrophobicContact CD2-CD1 3.97Å; Y360-Y978 HydrophobicContact CD2-CG 4.48Å; Y360-Y978 HydrophobicContact CG-CD1 4.44Å; Y360-Y1175 WeakPolarHBondContact CB-OH 3.38Å; Y360-Y1175 PolarHBondContact N-OH 3.32Å; Y360-Y1175 VanDerWaalsContact N-OH 3.07Å
361	E	76.9	Confident	52.6	Low	55 Å²	55	79.4 Å²	79.4	26%	0.257	44%	0.442	S	S	.	.	H	α-helix	trans	-59.8	-47.8	-174.7	-70.8	59.1	-128.1	0	0	111.5	V363 V364 Q365 Y1175	E361-V363 VanDerWaalsContact C-N 3.3Å; E361-V363 PolarHBondContact O-N 3.07Å; E361-V364 PolarHBondContact O-N 3.21Å; E361-Q365 WeakPolarHBondContact O-CB 3.27Å; E361-Q365 VanDerWaalsContact O-CG 3.24Å; E361-Q365 WeakPolarHBondContact O-CG 3.45Å; E361-Q365 PolarHBondContact O-N 2.68Å; E361-Y1175 WeakPolarHBondContact OE2-CE1 3.4Å; E361-Y1175 PolarHBondContact OE2-OH 2.8Å
362	D	73.6	Confident	51.7	Low	72 Å²	72	85.3 Å²	85.3	39%	0.385	47%	0.465	S	S	.	.	H	α-helix	trans	-63.4	-36.5	-173.2	-64.1	-38	0	0	0	112.2	R359 Y360 S366	R359-D362 WeakPolarHBondContact CB-OD2 3.37Å; R359-D362 WeakPolarHBondContact CD-OD2 3.33Å; R359-D362 WeakPolarHBondContact CG-OD2 3.37Å; R359-D362 IonicContact CZ-OD2 3.96Å; R359-D362 IonicContact NE-OD2 2.76Å; R359-D362 PolarHBondContact NE-OD2 2.97Å; R359-D362 IonicContact NH1-OD1 2.74Å; R359-D362 PolarHBondContact NH1-OD1 3.16Å; R359-D362 IonicContact NH1-OD2 3.69Å; R359-D362 PolarHBondContact NH1-OD2 2.91Å; Y360-D362 PolarHBondContact O-N 3.05Å; D362-S366 WeakPolarHBondContact O-CB 3.4Å; D362-S366 PolarHBondContact O-N 3.07Å; D362-S366 PolarHBondContact O-OG 3.05Å
363	V	67.4	Low	51	Low	56 Å²	56	91.1 Å²	91.1	34%	0.339	49%	0.491	S	S	.	.	H	α-helix	trans	-90.4	-32.5	-179.3	-153.4	0	0	0	0	112.7	P358 Y360 E361 S366 F915	P358-V363 HydrophobicContact CB-CG2 3.81Å; Y360-V363 PolarHBondContact O-N 3.47Å; E361-V363 VanDerWaalsContact C-N 3.3Å; E361-V363 PolarHBondContact O-N 3.07Å; V363-S366 PolarHBondContact O-N 3.35Å; V363-F915 HydrophobicContact CB-CB 3.89Å; V363-F915 HydrophobicContact CB-CD1 4.37Å; V363-F915 HydrophobicContact CB-CG 4.09Å; V363-F915 HydrophobicContact CG1-CB 3.43Å; V363-F915 VanDerWaalsContact CG1-CB 3.43Å; V363-F915 HydrophobicContact CG1-CG 4.19Å; V363-F915 HydrophobicContact CG2-CB 4.25Å; V363-F915 HydrophobicContact CG2-CD2 4.44Å; V363-F915 HydrophobicContact CG2-CG 4.33Å
364	V	60.8	Low	50.4	Low	82 Å²	82	96.1 Å²	96.1	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-70.7	-32.2	174.7	173.8	0	0	0	0	111.8	Y360 E361	Y360-V364 HydrophobicContact CD1-CG2 4.27Å; Y360-V364 HydrophobicContact CD2-CG2 3.93Å; Y360-V364 HydrophobicContact CE1-CG2 4.1Å; Y360-V364 HydrophobicContact CE2-CG2 3.71Å; Y360-V364 HydrophobicContact CG-CG2 4.21Å; Y360-V364 WeakPolarHBondContact O-CB 3.47Å; Y360-V364 VanDerWaalsContact O-CG2 3.28Å; Y360-V364 WeakPolarHBondContact O-CG2 3.34Å; Y360-V364 PolarHBondContact O-N 3.03Å; E361-V364 PolarHBondContact O-N 3.21Å
365	Q	50.6	Low	49.7	Very low	154 Å²	154	96.9 Å²	96.9	72%	0.72	50%	0.503	S	S	*	.	S	Bend	trans	-83.6	-16.5	174.2	-62.8	-177.5	56.7	0	0	113.2	E361 P367	E361-Q365 WeakPolarHBondContact O-CB 3.27Å; E361-Q365 VanDerWaalsContact O-CG 3.24Å; E361-Q365 WeakPolarHBondContact O-CG 3.45Å; E361-Q365 PolarHBondContact O-N 2.68Å; Q365-P367 WeakPolarHBondContact O-CD 3.44Å
366	S	36.1	Very low	48.3	Very low	64 Å²	64	97.4 Å²	97.4	45%	0.448	52%	0.518	S	S	.	.	S	Bend	trans	-75.9	118.8	177.2	-79.9	0	0	0	0	112.5	D362 V363	D362-S366 WeakPolarHBondContact O-CB 3.4Å; D362-S366 PolarHBondContact O-N 3.07Å; D362-S366 PolarHBondContact O-OG 3.05Å; V363-S366 PolarHBondContact O-N 3.35Å
367	P	32	Very low	46.4	Very low	105 Å²	105	102.7 Å²	102.7	68%	0.682	55%	0.553	S	S	*	*			trans	-66.7	140	174.9	28.2	-34.1	0	0	0	110.8	Q365 I369	Q365-P367 WeakPolarHBondContact O-CD 3.44Å; P367-I369 PolarHBondContact O-N 3.37Å; P367-I369 VanDerWaalsContact O-N 3.08Å
368	P	34.1	Very low	44.4	Very low	121 Å²	121	107.9 Å²	107.9	79%	0.786	59%	0.589	S	S	*	*			trans	-59.2	114.9	-167.1	20.1	-32.8	0	0	0	113	S370	P368-S370 PolarHBondContact O-N 3.16Å
369	I	32.2	Very low	42.1	Very low	146 Å²	146	112.1 Å²	112.1	75%	0.749	62%	0.619	S	S	*	*			trans	-65.7	103.4	-174.2	-59.8	177.6	0	0	0	109.9	P367 K371	P367-I369 PolarHBondContact O-N 3.37Å; P367-I369 VanDerWaalsContact O-N 3.08Å; I369-K371 VanDerWaalsContact C-N 3.35Å; I369-K371 PolarHBondContact O-N 2.96Å
370	S	27.7	Very low	39.7	Very low	102 Å²	102	115.8 Å²	115.8	71%	0.713	65%	0.653	S	S	*	*			trans	-68.9	88.4	175.1	-66.5	0	0	0	0	110.6	P368 K372	P368-S370 PolarHBondContact O-N 3.16Å; S370-K372 VanDerWaalsContact C-N 3.29Å; S370-K372 PolarHBondContact O-N 3.43Å
371	K	29.1	Very low	37.8	Very low	154 Å²	154	120.9 Å²	120.9	67%	0.67	69%	0.688	S	S	*	*			trans	-55	80	178	-74.4	170.5	177.8	162.4	0	112	I369 F373 D918	I369-K371 VanDerWaalsContact C-N 3.35Å; I369-K371 PolarHBondContact O-N 2.96Å; K371-F373 PolarHBondContact O-N 2.92Å; K371-D918 IonicContact NZ-OD1 2.85Å; K371-D918 PolarHBondContact NZ-OD1 3.24Å; K371-D918 IonicContact NZ-OD2 3.75Å
372	K	25.3	Very low	35.4	Very low	190 Å²	190	123.7 Å²	123.7	83%	0.826	71%	0.713	S	S	*	*			trans	-82.3	103.6	173.8	-80.4	-177.5	178.5	172.8	0	110.5	S370 L374	S370-K372 VanDerWaalsContact C-N 3.29Å; S370-K372 PolarHBondContact O-N 3.43Å; K372-L374 PolarHBondContact O-N 3.39Å
373	F	26.4	Very low	33.1	Very low	198 Å²	198	125.7 Å²	125.7	87%	0.868	73%	0.733	S	S	*	*			trans	-62.1	121.4	163.7	-89.1	-90.7	0	0	0	110.6	K371	K371-F373 PolarHBondContact O-N 2.92Å
374	L	25	Very low	31.1	Very low	154 Å²	154	128 Å²	128	81%	0.806	76%	0.758	S	S	*	*			trans	-103.5	106.3	172.9	-92.7	165.9	0	0	0	110.2	K372	K372-L374 PolarHBondContact O-N 3.39Å
375	H	27.2	Very low	29.5	Very low	181 Å²	181	129.5 Å²	129.5	84%	0.838	77%	0.772	S	S	*	*			trans	-106.9	119.4	157.2	-89.3	-65.8	0	0	0	109.4	T377	H375-T377 PolarHBondContact O-N 3.02Å
376	S	24.2	Very low	28.9	Very low	113 Å²	113	127.5 Å²	127.5	79%	0.79	77%	0.772	S	S	*	*			trans	-75.8	116.2	-171.6	-54.3	0	0	0	0	113.1
377	T	25.1	Very low	28.4	Very low	143 Å²	143	129 Å²	129	88%	0.877	78%	0.783	S	S	*	*			trans	-143.4	148.8	144.1	28.9	0	0	0	0	110.7	H375	H375-T377 PolarHBondContact O-N 3.02Å
378	S	28.1	Very low	28.2	Very low	112 Å²	112	129 Å²	129	78%	0.783	79%	0.785	S	S	*	*			trans	-64.1	133.8	-167.5	52.3	0	0	0	0	116
379	S	28.8	Very low	27.9	Very low	123 Å²	123	129.7 Å²	129.7	86%	0.86	79%	0.788	S	S	*	*				170	155.9	112.3	48.5	0	0	0	0	113.8
380	A	25.1	Very low	27.6	Very low	92 Å²	92	130.6 Å²	130.6	76%	0.76	79%	0.793	S	S	*	*			trans	-148.8	171.8	171.5	0	0	0	0	0	107.3
381	P	37.5	Very low	28.3	Very low	121 Å²	121	130.4 Å²	130.4	79%	0.786	79%	0.79	S	S	*	*			cis	-105.4	-161.8	-4	31.5	-10.5	0	0	0	109.9
382	S	26.8	Very low	28.2	Very low	114 Å²	114	133 Å²	133	80%	0.797	80%	0.801	S	S	*	*			cis	-150.9	164.7	16.3	-55.7	0	0	0	0	112
383	S	25.4	Very low	28.2	Very low	115 Å²	115	127.8 Å²	127.8	80%	0.804	80%	0.801	S	S	*	*			trans	-102.4	142.4	165.1	53.4	0	0	0	0	111.7
384	A	26.4	Very low	28.2	Very low	104 Å²	104	124.9 Å²	124.9	86%	0.86	80%	0.799	S	S	*	*			trans	-146.9	102.7	169.4	0	0	0	0	0	111.1
385	S	25.9	Very low	28.1	Very low	114 Å²	114	122.1 Å²	122.1	80%	0.797	79%	0.793	S	S	*	*			trans	-70.6	172.8	166.3	-51.6	0	0	0	0	110.3
386	P	38.5	Very low	28.1	Very low	111 Å²	111	120.7 Å²	120.7	72%	0.721	79%	0.791	S	S	*	*			cis	-148.4	170.4	18.1	42.3	-21.2	0	0	0	119.7
387	S	25.5	Very low	28.2	Very low	97 Å²	97	120.6 Å²	120.6	68%	0.678	79%	0.786	S	S	*	*			trans	62.3	117.2	137.3	64.9	0	0	0	0	123.3
388	S	27.4	Very low	28.3	Very low	103 Å²	103	121.1 Å²	121.1	72%	0.72	78%	0.783	S	S	*	*				97.2	156.9	120	78.5	0	0	0	0	122.6
389	T	27.5	Very low	28.2	Very low	136 Å²	136	119.1 Å²	119.1	83%	0.834	78%	0.78	S	S	*	*			trans	88.3	113.7	166.2	63.9	0	0	0	0	120.6
390	L	27	Very low	28.1	Very low	166 Å²	166	121 Å²	121	87%	0.869	78%	0.779	S	S	*	*			trans	-71.6	174.9	150.7	-76.8	158.5	0	0	0	110.6
391	P	42.9	Very low	28.2	Very low	98 Å²	98	124.8 Å²	124.8	64%	0.636	78%	0.782	S	S	*	*			cis	-136	-172.8	-5.2	41.7	-25.1	0	0	0	114.9
392	K	26.2	Very low	27.6	Very low	209 Å²	209	124 Å²	124	91%	0.909	78%	0.779	S	S	*	*			trans	64.5	128.6	154.6	-71.8	174.5	-179.8	178	0	119.6
393	G	25.7	Very low	27.5	Very low	80 Å²	80	125.4 Å²	125.4	83%	0.825	78%	0.783	S	S	*	*			trans	-177.8	134.9	160.6	0	0	0	0	0	113.2
394	T	25.4	Very low	27.6	Very low	136 Å²	136	128.3 Å²	128.3	83%	0.834	78%	0.783	S	S	*	*			trans	-108	158.7	-179.5	49.2	0	0	0	0	113.1
395	S	24.3	Very low	28.1	Very low	97 Å²	97	129 Å²	129	68%	0.678	78%	0.779	S	S	*	*			trans	91.2	112.6	149	-70.2	0	0	0	0	121.9
396	L	26.7	Very low	28.1	Very low	150 Å²	150	128 Å²	128	79%	0.785	77%	0.772	S	S	*	*				76.4	137.4	117.1	-66.7	172.4	0	0	0	123.4
397	T	26.6	Very low	27.5	Very low	111 Å²	111	130.6 Å²	130.6	68%	0.681	78%	0.779	S	S	*	*			trans	102.6	124.5	146.5	67.3	0	0	0	0	120.8
398	N	26.6	Very low	27.5	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	78%	0.778	S	S	*	*			trans	44.2	137.9	132.1	-47.8	-15.1	0	0	0	120.7
399	G	25.8	Very low	27.5	Very low	69 Å²	69	130.4 Å²	130.4	71%	0.711	77%	0.773	S	S	*	*			cis	157.3	168	-8.8	0	0	0	0	0	114.8
400	L	26.7	Very low	27.7	Very low	163 Å²	163	131.3 Å²	131.3	85%	0.853	77%	0.768	S	S	*	*			trans	76.3	147.7	141	-80.7	167	0	0	0	123.4
401	Q	26.8	Very low	27.7	Very low	172 Å²	172	130.4 Å²	130.4	80%	0.804	76%	0.759	S	S	*	*			trans	70.6	121.2	170.5	-60.4	167.7	35.5	0	0	116.2
402	S	25.8	Very low	26.8	Very low	104 Å²	104	131.6 Å²	131.6	73%	0.727	77%	0.765	S	S	*	*			cis	91	114	17.4	88.9	0	0	0	0	117.5
403	T	24.6	Very low	26.9	Very low	143 Å²	143	128 Å²	128	88%	0.877	76%	0.755	S	S	*	*			trans	-163.9	128.3	152.5	8.9	0	0	0	0	113.5
404	H	27.2	Very low	27	Very low	177 Å²	177	129 Å²	129	82%	0.819	75%	0.749	S	S	*	*			trans	-111.2	151.6	152.1	-72.2	-76.8	0	0	0	107.8
405	P	36.7	Very low	27.8	Very low	118 Å²	118	128.3 Å²	128.3	77%	0.766	75%	0.747	S	S	*	*				-136.1	158.9	95.2	16.2	6.3	0	0	0	112.4
406	S	26.7	Very low	29.1	Very low	92 Å²	92	129.3 Å²	129.3	64%	0.643	75%	0.751	S	S	*	*			cis	97.8	96.5	28.8	-59	0	0	0	0	115.7
407	L	26.2	Very low	29.7	Very low	167 Å²	167	127.2 Å²	127.2	87%	0.874	75%	0.746	S	S	*	*			trans	64.5	165.4	151.6	-63.6	135.3	0	0	0	116.4
408	S	25	Very low	29.9	Very low	94 Å²	94	128 Å²	128	66%	0.657	75%	0.751	S	S	*	*			cis	-169.8	166.4	12.7	-132.4	0	0	0	0	108.6
409	T	27.6	Very low	29.7	Very low	102 Å²	102	126.7 Å²	126.7	63%	0.626	75%	0.748	S	S	*	*			cis	-176.4	159.2	-17.7	17.7	0	0	0	0	111.4
410	Q	31.3	Very low	29.6	Very low	154 Å²	154	129.3 Å²	129.3	72%	0.72	76%	0.755	S	S	*	*			trans	71.6	160.7	148.4	-72.1	176.8	10.3	0	0	120.9
411	H	27.8	Very low	29.6	Very low	148 Å²	148	126.9 Å²	126.9	69%	0.685	75%	0.751	S	S	*	*			cis	-160.6	147.4	-12.4	-116.7	-28.3	0	0	0	115.8
412	T	23.5	Very low	30.2	Very low	123 Å²	123	124.9 Å²	124.9	76%	0.755	75%	0.753	S	S	*	*			trans	-166.9	143.9	151.4	-4.6	0	0	0	0	107.6
413	L	27.4	Very low	30.2	Very low	133 Å²	133	125 Å²	125	70%	0.696	75%	0.754	S	S	*	*			cis	95.5	124.2	6.2	-52.6	172.5	0	0	0	115.6
414	S	28.4	Very low	30.3	Very low	101 Å²	101	122.8 Å²	122.8	71%	0.706	74%	0.744	S	S	*	*			cis	-144.6	-111.1	-4.7	-77.4	0	0	0	0	116.9
415	P	41.2	Very low	30.2	Very low	121 Å²	121	120 Å²	120	79%	0.786	74%	0.744	S	S	*	*				-133.7	-161.9	-129.2	50.8	-30.6	0	0	0	116.5
416	P	51.7	Low	29.6	Very low	119 Å²	119	119.6 Å²	119.6	77%	0.773	75%	0.745	S	S	*	*			trans	-123	-132.3	-136	30.4	-0.3	0	0	0	112.2
417	P	40.7	Very low	30.1	Very low	105 Å²	105	120.8 Å²	120.8	68%	0.682	75%	0.75	S	S	*	*			cis	-146.5	178.1	-13.4	39.1	-16	0	0	0	119.8
418	V	29.6	Very low	30.1	Very low	128 Å²	128	117.7 Å²	117.7	78%	0.776	74%	0.738	S	S	*	*			trans	70.8	149.7	159.4	-136.4	0	0	0	0	123.3
419	T	23.2	Very low	30.1	Very low	127 Å²	127	120.9 Å²	120.9	78%	0.779	74%	0.743	S	S	*	*			trans	84.8	142.8	169.1	67.8	0	0	0	0	117.4
420	C	23.7	Very low	30.1	Very low	125 Å²	125	121 Å²	121	85%	0.845	75%	0.747	S	S	*	*			cis	-153.7	173.7	-1.7	-121	0	0	0	0	112.6
421	S	26.7	Very low	30.2	Very low	112 Å²	112	119.6 Å²	119.6	78%	0.783	75%	0.752	S	S	*	*			trans	-92.4	174.1	-177.1	-41.5	0	0	0	0	114.5
422	P	39.6	Very low	30.4	Very low	129 Å²	129	117.8 Å²	117.8	84%	0.838	76%	0.756	S	S	*	*				-154.7	-161.1	79.9	43.6	-22	0	0	0	117.5
423	S	26.1	Very low	31.1	Very low	107 Å²	107	116.9 Å²	116.9	75%	0.748	75%	0.752	S	S	*	*			trans	-96.3	-171.2	-169.9	64.3	0	0	0	0	114.6
424	S	25.9	Very low	31	Very low	96 Å²	96	116.2 Å²	116.2	67%	0.671	75%	0.749	S	S	*	*			cis	-173.1	178.9	3.9	25	0	0	0	0	112.5
425	S	26.1	Very low	31.1	Very low	118 Å²	118	120.3 Å²	120.3	83%	0.825	75%	0.749	S	S	*	*			trans	90.5	154.2	142.4	37.5	0	0	0	0	124.1
426	S	23.8	Very low	30.4	Very low	111 Å²	111	118.6 Å²	118.6	78%	0.776	73%	0.733	S	S	*	*			trans	-92.8	178.1	-167.7	-40	0	0	0	0	115.7
427	P	36.4	Very low	29.3	Very low	116 Å²	116	117.2 Å²	117.2	75%	0.753	73%	0.726	S	S	*	*				-130.8	154.6	85.2	9.6	14.5	0	0	0	113.6
428	T	27.4	Very low	29.2	Very low	102 Å²	102	117.2 Å²	117.2	63%	0.626	73%	0.726	S	S	*	*				69.8	138.4	61.5	72.1	0	0	0	0	115.3
429	H	25.1	Very low	29.1	Very low	161 Å²	161	117.8 Å²	117.8	75%	0.745	73%	0.73	S	S	*	*			cis	-132.4	177.1	16.8	-61.8	-98.2	0	0	0	110.7
430	S	26.1	Very low	29.3	Very low	104 Å²	104	116.7 Å²	116.7	73%	0.727	73%	0.727	S	S	*	*			cis	79.5	147.6	20.6	-35	0	0	0	0	115.8
431	P	34.7	Very low	29.3	Very low	126 Å²	126	115.2 Å²	115.2	82%	0.818	72%	0.719	S	S	*	*			cis	-139	-167.2	14.2	45.1	-26.3	0	0	0	117.6
432	S	31.6	Very low	29.2	Very low	110 Å²	110	118.8 Å²	118.8	77%	0.769	72%	0.72	S	S	*	*			trans	-114	-179.3	166.5	-42.2	0	0	0	0	110.6
433	P	36.8	Very low	28.5	Very low	104 Å²	104	118.1 Å²	118.1	68%	0.675	71%	0.714	S	S	*	*				-159.4	-138.6	88.7	43.5	-20	0	0	0	116.5	L545	P433-L545 HydrophobicContact CG-CD1 4.05Å
434	L	26.6	Very low	28.6	Very low	118 Å²	118	121.1 Å²	121.1	62%	0.618	72%	0.716	S	S	*	*			trans	-146	144.2	-162.2	-74.4	156	0	0	0	116
435	R	31.1	Very low	28.5	Very low	188 Å²	188	122.9 Å²	122.9	71%	0.709	72%	0.723	S	S	*	*			trans	73.1	151.2	146.4	-93.6	-165.4	163.4	-145.7	-2.5	124.4	I542 L546	R435-I542 WeakPolarHBondContact O-CG2 3.38Å; R435-L546 WeakPolarHBondContact O-CD1 3.37Å
436	N	25.1	Very low	28.6	Very low	85 Å²	85	123.1 Å²	123.1	46%	0.455	72%	0.721	S	S	.	*			trans	65.8	92.1	138.4	-72.9	36.2	0	0	0	127.9	L546	N436-L546 WeakPolarHBondContact O-CD1 3.38Å
437	S	28.3	Very low	29	Very low	90 Å²	90	123.8 Å²	123.8	63%	0.629	72%	0.723	S	S	*	*				52.9	146.9	127.3	-46.3	0	0	0	0	123.4
438	P	39.5	Very low	28.5	Very low	104 Å²	104	125.2 Å²	125.2	68%	0.675	73%	0.73	S	S	*	*				-160.2	140.4	82.4	39.6	-17.5	0	0	0	121.4
439	T	28.3	Very low	28.4	Very low	141 Å²	141	124.9 Å²	124.9	87%	0.865	73%	0.732	S	S	*	*			trans	28.6	150.6	144.5	33.8	0	0	0	0	124.4
440	S	25.8	Very low	28.6	Very low	103 Å²	103	122.8 Å²	122.8	72%	0.72	73%	0.732	S	S	*	*			cis	-163.1	162.1	44.3	56.7	0	0	0	0	112.2
441	S	24.4	Very low	28.7	Very low	95 Å²	95	125.7 Å²	125.7	66%	0.664	74%	0.738	S	S	*	*				-171.1	136.3	61.6	-78.7	0	0	0	0	115.7
442	F	24	Very low	28.3	Very low	186 Å²	186	128.1 Å²	128.1	82%	0.816	74%	0.739	S	S	*	*			trans	57	150.8	157.7	-75.9	-79.9	0	0	0	120.1
443	T	25.8	Very low	28.2	Very low	116 Å²	116	127.7 Å²	127.7	71%	0.712	74%	0.742	S	S	*	*			cis	-135	145.8	10.8	35.7	0	0	0	0	114.4
444	H	27.2	Very low	27.8	Very low	169 Å²	169	129.3 Å²	129.3	78%	0.782	74%	0.744	S	S	*	*			trans	38	131.7	150.2	-71.1	-72.9	0	0	0	125.2
445	T	25.4	Very low	27.8	Very low	134 Å²	134	132.7 Å²	132.7	82%	0.822	75%	0.75	S	S	*	*			trans	-140.1	157.7	158.8	53.6	0	0	0	0	112.3
446	P	27.3	Very low	27.8	Very low	122 Å²	122	127.8 Å²	127.8	79%	0.792	74%	0.737	S	S	*	*			trans	-109	165.2	153.5	37.4	-28.5	0	0	0	112
447	P	32.2	Very low	27.8	Very low	125 Å²	125	130.7 Å²	130.7	81%	0.812	75%	0.748	S	S	*	*			trans	-105.4	150.2	-169.7	38.2	-33.3	0	0	0	115.8
448	T	25.2	Very low	27.9	Very low	146 Å²	146	133.3 Å²	133.3	90%	0.896	75%	0.75	S	S	*	*			trans	-138.7	169.1	170.7	41	0	0	0	0	112.8
449	S	25.4	Very low	27.4	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-60.2	157.3	-170.6	-171.5	0	0	0	0	115.4
450	P	29.1	Very low	27.4	Very low	116 Å²	116	139 Å²	139	75%	0.753	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-56.2	151.8	153.9	28.3	-37	0	0	0	111.4
451	I	28.2	Very low	27.5	Very low	166 Å²	166	138.3 Å²	138.3	85%	0.851	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-94.3	137	-178.9	-75.9	171.3	0	0	0	110.2
452	E	26.9	Very low	27.7	Very low	177 Å²	177	141.8 Å²	141.8	83%	0.827	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-85.3	154.9	169.8	-73.3	172.4	113.1	0	0	110.7	L454	E452-L454 PolarHBondContact O-N 3.39Å
453	A	29.3	Very low	28	Very low	101 Å²	101	140.8 Å²	140.8	84%	0.835	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-68	128	169.5	0	0	0	0	0	109.2	Y455	A453-Y455 PolarHBondContact O-N 3.02Å
454	L	28.4	Very low	28	Very low	137 Å²	137	138.4 Å²	138.4	72%	0.717	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-62.7	120.9	-175.9	-68.7	175.8	0	0	0	111.1	E452	E452-L454 PolarHBondContact O-N 3.39Å
455	Y	28.1	Very low	28.1	Very low	190 Å²	190	139.3 Å²	139.3	75%	0.745	77%	0.766	S	S	*	*			trans	-99.3	110.1	-178.8	-179.2	-125.1	0	0	0	108.4	A453 E457	A453-Y455 PolarHBondContact O-N 3.02Å; Y455-E457 HydrophobicContact CD1-CG 3.5Å; Y455-E457 VanDerWaalsContact CD1-CG 3.5Å; Y455-E457 HydrophobicContact CE1-CG 3.45Å; Y455-E457 VanDerWaalsContact CE1-CG 3.45Å; Y455-E457 HydrophobicContact CG-CG 4.49Å; Y455-E457 PolarHBondContact O-N 2.87Å
456	I	30.3	Very low	28.1	Very low	84 Å²	84	139.9 Å²	139.9	43%	0.431	77%	0.77	S	S	.	*			trans	-80	105.9	175.3	-59.9	175.6	0	0	0	107.6	E458	I456-E458 PolarHBondContact O-N 3.35Å
457	E	25.2	Very low	28.1	Very low	146 Å²	146	138.7 Å²	138.7	68%	0.682	77%	0.77	S	S	*	*			trans	-79.2	106.3	176.2	-70.8	-170.9	139	0	0	110.9	Y455 E459	Y455-E457 HydrophobicContact CD1-CG 3.5Å; Y455-E457 VanDerWaalsContact CD1-CG 3.5Å; Y455-E457 HydrophobicContact CE1-CG 3.45Å; Y455-E457 VanDerWaalsContact CE1-CG 3.45Å; Y455-E457 HydrophobicContact CG-CG 4.49Å; Y455-E457 PolarHBondContact O-N 2.87Å; E457-E459 VanDerWaalsContact C-N 3.3Å; E457-E459 PolarHBondContact O-N 2.97Å
458	E	31.1	Very low	27.7	Very low	145 Å²	145	140.7 Å²	140.7	68%	0.678	77%	0.774	S	S	*	*			trans	-71.4	88.5	157.4	-70.7	-172.6	164.4	0	0	107.8	I456 E460 K1124	I456-E458 PolarHBondContact O-N 3.35Å; E458-E460 PolarHBondContact O-N 3.47Å; E458-E460 VanDerWaalsContact O-N 3.1Å; E458-K1124 IonicContact OE1-NZ 2.68Å; E458-K1124 PolarHBondContact OE1-NZ 3.08Å
459	E	27.9	Very low	27.7	Very low	172 Å²	172	142 Å²	142	80%	0.804	77%	0.77	S	S	*	*			trans	-68.1	102.3	-173.3	-169.4	-174.6	-166.6	0	0	113	E457 A461	E457-E459 VanDerWaalsContact C-N 3.3Å; E457-E459 PolarHBondContact O-N 2.97Å; E459-A461 PolarHBondContact O-N 3.36Å
460	E	29.3	Very low	27.5	Very low	193 Å²	193	145.8 Å²	145.8	90%	0.902	78%	0.78	S	S	*	*			trans	-72.6	105.4	161	-73.5	-163.9	146.5	0	0	110	E458 E462	E458-E460 PolarHBondContact O-N 3.47Å; E458-E460 VanDerWaalsContact O-N 3.1Å; E460-E462 PolarHBondContact O-N 2.95Å; E460-E462 VanDerWaalsContact O-N 3.15Å
461	A	26.6	Very low	27.2	Very low	89 Å²	89	145 Å²	145	74%	0.736	78%	0.777	S	S	*	*			trans	-61.4	111.1	-171.6	0	0	0	0	0	115.1	E459	E459-A461 PolarHBondContact O-N 3.36Å
462	E	28.3	Very low	27.2	Very low	168 Å²	168	145.3 Å²	145.3	79%	0.785	78%	0.775	S	S	*	*			trans	-111.5	112.5	165.4	-164.3	-179.4	-125.5	0	0	111.9	E460 G464	E460-E462 PolarHBondContact O-N 2.95Å; E460-E462 VanDerWaalsContact O-N 3.15Å; E462-G464 PolarHBondContact O-N 3.36Å
463	I	30.1	Very low	27.3	Very low	164 Å²	164	142.8 Å²	142.8	84%	0.841	77%	0.774	S	S	*	*			trans	-76.1	112.7	-176.9	-68.9	176.1	0	0	0	112.1
464	G	27.6	Very low	27.2	Very low	67 Å²	67	143.4 Å²	143.4	69%	0.691	77%	0.768	S	S	*	*				60.2	112	127.5	0	0	0	0	0	119	E462	E462-G464 PolarHBondContact O-N 3.36Å
465	K	28.1	Very low	26.9	Very low	188 Å²	188	145.5 Å²	145.5	82%	0.817	77%	0.773	S	S	*	*			trans	-116.3	113.3	161.1	-73.4	178.5	-177.1	104.8	0	110.7
466	T	25.4	Very low	26.9	Very low	146 Å²	146	144 Å²	144	90%	0.896	78%	0.775	S	S	*	*			trans	-68.2	148.5	164.2	42.1	0	0	0	0	110.4
467	A	27.5	Very low	27.1	Very low	97 Å²	97	144.8 Å²	144.8	80%	0.802	79%	0.786	S	S	*	*			trans	-87.2	140.3	176.3	0	0	0	0	0	111.1
468	D	24	Very low	27.3	Very low	166 Å²	166	144.1 Å²	144.1	89%	0.888	79%	0.792	S	S	*	*			trans	-145.4	140.2	161	-131.1	-27.9	0	0	0	110.6
469	H	25	Very low	27.1	Very low	175 Å²	175	147.7 Å²	147.7	81%	0.81	80%	0.799	S	S	*	*			trans	-99.9	145.4	179.6	-95.8	-100.6	0	0	0	110
470	I	22.1	Very low	27.1	Very low	175 Å²	175	142.9 Å²	142.9	90%	0.897	80%	0.795	S	S	*	*			trans	-170.2	162.3	136.6	-101	151.8	0	0	0	112.4
471	S	22.4	Very low	27.3	Very low	99 Å²	99	139.2 Å²	139.2	69%	0.692	78%	0.781	S	S	*	*			trans	-77	156.1	-155.5	55.1	0	0	0	0	119.5
472	Q	28.1	Very low	27.1	Very low	173 Å²	173	142.3 Å²	142.3	81%	0.808	79%	0.785	S	S	*	*			trans	13.6	146.7	130.7	-81.3	-173.2	14.2	0	0	119.9
473	P	29.5	Very low	27.2	Very low	123 Å²	123	141 Å²	141	80%	0.799	78%	0.781	S	S	*	*				-150.7	175.8	56.1	41.7	-21.4	0	0	0	119.5
474	T	25.9	Very low	27	Very low	115 Å²	115	138.3 Å²	138.3	71%	0.706	77%	0.772	S	S	*	*			trans	-69.7	144	176.1	-39.5	0	0	0	0	113.8
475	H	22	Very low	27.2	Very low	180 Å²	180	142.3 Å²	142.3	83%	0.833	77%	0.773	S	S	*	*				-173	133.2	129.1	-108.3	-72.3	0	0	0	115
476	M	28.8	Very low	27.2	Very low	158 Å²	158	139.5 Å²	139.5	78%	0.778	77%	0.767	S	S	*	*			trans	-103.3	157.2	157.9	-85.6	-85.5	104.9	0	0	108.6
477	P	35	Very low	27.6	Very low	102 Å²	102	140.5 Å²	140.5	66%	0.662	76%	0.758	S	S	*	*				-159.5	148	97.3	38.5	-18.1	0	0	0	119.6
478	T	28.1	Very low	27.6	Very low	132 Å²	132	142.7 Å²	142.7	81%	0.81	76%	0.757	S	S	*	*			trans	64.8	162	149.9	58.6	0	0	0	0	118.9
479	R	28	Very low	27.6	Very low	220 Å²	220	137.9 Å²	137.9	83%	0.83	75%	0.747	S	S	*	*			cis	-152.1	150.4	14.1	-140.9	166.6	179.5	170.7	-1.1	106.4	I481	R479-I481 HydrophobicContact CG-CD1 4.16Å
480	G	28	Very low	27.7	Very low	70 Å²	70	136 Å²	136	72%	0.722	75%	0.747	S	S	*	*			cis	119	156.8	43.6	0	0	0	0	0	109
481	I	33.7	Very low	27.8	Very low	116 Å²	116	134.9 Å²	134.9	60%	0.595	74%	0.742	S	S	*	*			cis	-162.9	148.9	6.2	-87.3	141.6	0	0	0	109.2	R479 M483	R479-I481 HydrophobicContact CG-CD1 4.16Å; I481-M483 HydrophobicContact CG2-CG 4.11Å
482	N	22.2	Very low	28	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	75%	0.75	S	S	*	*			trans	-179.3	114.4	136.1	-88.1	-23.1	0	0	0	107.7
483	M	29.3	Very low	27.9	Very low	141 Å²	141	133.4 Å²	133.4	70%	0.695	74%	0.744	S	S	*	*				67.3	132.2	57.5	-74.4	-86.3	94.8	0	0	113.5	I481	I481-M483 HydrophobicContact CG2-CG 4.11Å
484	T	27.3	Very low	27.8	Very low	106 Å²	106	135.2 Å²	135.2	65%	0.65	74%	0.741	S	S	*	*			cis	-145.4	143.1	18.5	44.2	0	0	0	0	115.1
485	Q	31.2	Very low	27.7	Very low	152 Å²	152	136.1 Å²	136.1	71%	0.71	74%	0.738	S	S	*	*			trans	56.1	152.8	137.6	-62.6	-175.4	25.4	0	0	120
486	N	28.9	Very low	27.9	Very low	128 Å²	128	134.4 Å²	134.4	68%	0.684	73%	0.734	S	S	*	*			cis	-168.1	167	1.2	-118.6	-29.7	0	0	0	107
487	K	32.7	Very low	27.6	Very low	167 Å²	167	133.4 Å²	133.4	73%	0.726	73%	0.727	S	S	*	*			cis	-166.6	167.1	-8	-159.9	-168.8	164.9	-172	0	108.8
488	N	26.8	Very low	27	Very low	144 Å²	144	135.2 Å²	135.2	77%	0.77	73%	0.73	S	S	*	*			trans	70.8	134.9	170.9	-55	-9.6	0	0	0	115.9
489	G	25.6	Very low	26.8	Very low	65 Å²	65	131.4 Å²	131.4	67%	0.67	71%	0.709	S	S	*	*			cis	171.9	152.5	-12	0	0	0	0	0	113.7
490	T	25.6	Very low	26.6	Very low	135 Å²	135	126.7 Å²	126.7	83%	0.828	70%	0.697	S	S	*	*			trans	57.3	94.6	155.8	-44.2	0	0	0	0	116.3
491	I	24.5	Very low	26.4	Very low	152 Å²	152	127.3 Å²	127.3	78%	0.779	69%	0.69	S	S	*	*				45.5	101.2	60.5	-46.9	-179.4	0	0	0	114.5
492	M	26.3	Very low	25.9	Very low	174 Å²	174	125.7 Å²	125.7	86%	0.857	68%	0.682	S	S	*	*			trans	161.9	141.2	132.1	-89.8	-169.7	-179.2	0	0	109.5
493	G	26.4	Very low	25.9	Very low	66 Å²	66	124 Å²	124	68%	0.68	68%	0.678	S	S	*	*			cis	154.9	-165.7	-5.9	0	0	0	0	0	111.8
494	Q	27.9	Very low	25.7	Very low	161 Å²	161	121.2 Å²	121.2	75%	0.752	68%	0.677	S	S	*	*			trans	74.9	144.6	160.3	-72.9	-166.6	30.6	0	0	117.4
495	Q	24.4	Very low	25.4	Very low	135 Å²	135	123.1 Å²	123.1	63%	0.631	68%	0.683	S	S	*	*			cis	-172.1	117	-6.8	176.4	81.7	-21.7	0	0	111.4
496	L	24.7	Very low	25	Very low	143 Å²	143	122.3 Å²	122.3	75%	0.749	68%	0.684	S	S	*	*			trans	62.5	172.7	149.1	-62.8	-176.6	0	0	0	117.9
497	H	23	Very low	24.7	Very low	137 Å²	137	120.9 Å²	120.9	63%	0.634	68%	0.684	S	S	*	*			cis	-173.4	124	-28.8	164.4	-92.1	0	0	0	112.1
498	L	22.9	Very low	24.3	Very low	140 Å²	140	117.5 Å²	117.5	73%	0.733	68%	0.682	S	S	*	*			trans	65.1	168.5	148.7	-142.9	77.8	0	0	0	120.8
499	S	24.2	Very low	24.3	Very low	53 Å²	53	117.4 Å²	117.4	37%	0.371	68%	0.681	S	S	.	*			trans	72.4	103.4	158.9	36.9	0	0	0	0	120.3
500	Q	24	Very low	24.2	Very low	121 Å²	121	123 Å²	123	57%	0.565	69%	0.689	S	S	*	*				42.5	99.4	115	-68	177.7	-19.7	0	0	117.3	P752	Q500-P752 HydrophobicContact CB-CB 4.43Å; Q500-P752 HydrophobicContact CB-CG 3.63Å; Q500-P752 VanDerWaalsContact CD-CG 3.45Å; Q500-P752 HydrophobicContact CG-CB 4.34Å; Q500-P752 HydrophobicContact CG-CG 3.64Å
501	S	23.1	Very low	24.1	Very low	82 Å²	82	123.8 Å²	123.8	57%	0.573	69%	0.688	S	S	*	*				93.1	165.1	61.5	72.5	0	0	0	0	114.8	P752	S501-P752 WeakPolarHBondContact OG-CG 3.26Å
502	N	22.5	Very low	24.9	Very low	83 Å²	83	122.6 Å²	122.6	44%	0.444	69%	0.69	S	S	.	*			trans	85.4	114.7	177.9	-99.8	23.9	0	0	0	121.4	T751	N502-T751 VanDerWaalsContact CG-OG1 3.27Å; N502-T751 VanDerWaalsContact ND2-CB 3.32Å; N502-T751 WeakPolarHBondContact ND2-CB 3.49Å; N502-T751 PolarHBondContact ND2-OG1 3.09Å; N502-T751 VanDerWaalsContact OD1-CB 3.23Å; N502-T751 WeakPolarHBondContact OD1-CB 3.44Å; N502-T751 PolarHBondContact OD1-OG1 3.29Å
503	T	23.6	Very low	24.9	Very low	118 Å²	118	117.3 Å²	117.3	72%	0.724	68%	0.68	S	S	*	*			trans	69.8	115.9	135.3	55.1	0	0	0	0	123.2
504	A	23.2	Very low	25	Very low	83 Å²	83	120.2 Å²	120.2	69%	0.686	69%	0.69	S	S	*	*				62	102.3	127.3	0	0	0	0	0	120.7
505	N	22.9	Very low	25	Very low	146 Å²	146	117 Å²	117	78%	0.781	69%	0.686	S	S	*	*				-173.1	129.8	102.9	-92.5	-42.8	0	0	0	108.5
506	N	22.3	Very low	25	Very low	135 Å²	135	115.2 Å²	115.2	72%	0.722	69%	0.688	S	S	*	*				85.7	134.2	64.1	-169.9	8	0	0	0	112.5
507	S	23.1	Very low	25.3	Very low	98 Å²	98	118.2 Å²	118.2	69%	0.685	69%	0.69	S	S	*	*			trans	76.5	113.1	161.7	-66.1	0	0	0	0	121.2
508	S	24.1	Very low	25.5	Very low	97 Å²	97	118.7 Å²	118.7	68%	0.678	70%	0.696	S	S	*	*				80.1	108.1	121.5	-151.9	0	0	0	0	122.1
509	N	25.2	Very low	26.7	Very low	141 Å²	141	116.8 Å²	116.8	75%	0.754	69%	0.692	S	S	*	*				59.3	153.4	124.3	-59.4	-11.6	0	0	0	124.5
510	H	23.9	Very low	26.6	Very low	182 Å²	182	120.5 Å²	120.5	84%	0.843	71%	0.713	S	S	*	*			trans	91.3	116.1	152.1	-93	-75.3	0	0	0	122.6
511	L	23.7	Very low	26.7	Very low	152 Å²	152	126.1 Å²	126.1	80%	0.796	73%	0.729	S	S	*	*			trans	-58	170.6	150.7	-79.4	100	0	0	0	112.2
512	P	42.5	Very low	27.3	Very low	127 Å²	127	127.4 Å²	127.4	83%	0.825	74%	0.735	S	S	*	*			cis	-152	-176.1	32	43.5	-22	0	0	0	119.8
513	G	24.8	Very low	27.6	Very low	64 Å²	64	128.5 Å²	128.5	66%	0.66	75%	0.75	S	S	*	*			trans	114.1	119.5	157.4	0	0	0	0	0	115.2
514	S	28	Very low	27.9	Very low	127 Å²	127	128.2 Å²	128.2	89%	0.888	75%	0.753	S	S	*	*				86.2	139.6	54.1	73.5	0	0	0	0	113.4
515	S	28.7	Very low	28.1	Very low	94 Å²	94	130.7 Å²	130.7	66%	0.657	76%	0.759	S	S	*	*			cis	-167.6	175.6	-11.3	-174	0	0	0	0	111.2
516	S	25	Very low	28.3	Very low	96 Å²	96	128.5 Å²	128.5	67%	0.671	76%	0.755	S	S	*	*			trans	76	154.2	153.7	78.2	0	0	0	0	120.7
517	Y	29.7	Very low	28.7	Very low	206 Å²	206	128.7 Å²	128.7	81%	0.808	76%	0.756	S	S	*	*			cis	177.2	158.6	-21.8	-96.2	-26.5	0	0	0	111.1
518	I	27.6	Very low	28.8	Very low	147 Å²	147	129.6 Å²	129.6	75%	0.754	76%	0.757	S	S	*	*			cis	-140.7	-64.6	-18.3	-12.4	156.8	0	0	0	115.7
519	P	48.2	Very low	29	Very low	100 Å²	100	130.7 Å²	130.7	65%	0.649	76%	0.759	S	S	*	*			trans	-125.3	160.2	-138.1	39.7	-26.2	0	0	0	117.9
520	T	22.5	Very low	29	Very low	131 Å²	131	128.3 Å²	128.3	80%	0.804	75%	0.754	S	S	*	*				-168.7	164.6	71.6	-52.5	0	0	0	0	113.4
521	W	25.2	Very low	29.3	Very low	239 Å²	239	127.1 Å²	127.1	91%	0.905	75%	0.752	S	S	*	*			trans	-72.8	-175.2	-169.2	-63.6	-2.9	0	0	0	118.8
522	P	37.1	Very low	30.3	Very low	109 Å²	109	125.2 Å²	125.2	71%	0.708	75%	0.749	S	S	*	*			cis	-134.4	166.5	-10.5	18.4	7.1	0	0	0	118.4
523	S	28	Very low	29.6	Very low	107 Å²	107	128.7 Å²	128.7	75%	0.748	75%	0.751	S	S	*	*			trans	44.3	128.8	146.6	-56.3	0	0	0	0	122.6
524	S	30.3	Very low	29.8	Very low	112 Å²	112	130 Å²	130	78%	0.783	76%	0.755	S	S	*	*			cis	79.8	142.5	44	-58.4	0	0	0	0	113.7
525	T	27.5	Very low	29.8	Very low	134 Å²	134	131.3 Å²	131.3	82%	0.822	76%	0.759	S	S	*	*			cis	-128.3	163.4	23.2	33.9	0	0	0	0	113.5
526	S	27.8	Very low	30.6	Very low	100 Å²	100	131.9 Å²	131.9	70%	0.699	76%	0.763	S	S	*	*			cis	-152.5	-127.6	-9.7	48.8	0	0	0	0	112
527	L	29.6	Very low	31.3	Very low	140 Å²	140	135.1 Å²	135.1	73%	0.733	77%	0.767	S	S	*	*			trans	-164.5	177.8	-156	-71.8	-179.2	0	0	0	107.7
528	T	26.4	Very low	32.1	Very low	116 Å²	116	133.3 Å²	133.3	71%	0.712	76%	0.758	S	S	*	*			cis	-152.7	144.7	8.3	-11.4	0	0	0	0	105.5
529	V	26.9	Very low	33	Very low	120 Å²	120	131.9 Å²	131.9	73%	0.727	75%	0.752	S	S	*	*			cis	83.8	129.9	28.5	-173.2	0	0	0	0	114.3
530	S	25.5	Very low	32.8	Very low	91 Å²	91	132.7 Å²	132.7	64%	0.636	75%	0.751	S	S	*	*			trans	-55.1	149.6	179.1	51.3	0	0	0	0	118.8
531	I	30	Very low	34.2	Very low	157 Å²	157	131.8 Å²	131.8	81%	0.805	74%	0.741	S	S	*	*				34.2	135.4	122.7	-61.1	168.8	0	0	0	117.5
532	P	45.2	Very low	36	Very low	112 Å²	112	122 Å²	122	73%	0.727	71%	0.707	S	S	*	*			cis	-148.5	179.2	32.1	31.1	-5.6	0	0	0	120.6
533	K	27.3	Very low	37	Very low	200 Å²	200	120.8 Å²	120.8	87%	0.87	69%	0.694	S	S	*	*			trans	76.2	110.4	142.2	-93.3	-175.7	175.5	-178.9	0	125.3
534	A	28.8	Very low	38.7	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	68%	0.683	S	S	*	*				70.9	125.9	122.8	0	0	0	0	0	124.6
535	T	29.6	Very low	40	Very low	156 Å²	156	120 Å²	120	96%	0.957	67%	0.667	S	S	*	*				-167.5	172.5	126	20.8	0	0	0	0	111.8
536	S	43.8	Very low	41.5	Very low	106 Å²	106	116.2 Å²	116.2	74%	0.741	64%	0.641	S	S	*	*			trans	-104.3	140.7	-168.9	52.5	0	0	0	0	115.4
537	H	41.1	Very low	43.2	Very low	164 Å²	164	117.3 Å²	117.3	76%	0.759	64%	0.636	S	S	*	*			trans	-167	74	165.7	-123.1	-66	0	0	0	110.3
538	R	45.5	Very low	44.7	Very low	168 Å²	168	114.7 Å²	114.7	63%	0.634	62%	0.623	S	S	*	*			trans	-156.3	7.3	-170.5	-118.1	-165.4	75.6	171.4	5.5	119.2	I542	R538-I542 VanDerWaalsContact O-CD1 3.25Å; R538-I542 WeakPolarHBondContact O-CD1 3.42Å
539	N	46.4	Very low	46	Very low	116 Å²	116	114 Å²	114	62%	0.62	62%	0.615	S	S	*	*	S	Bend	trans	-105.1	-43.6	-178.9	-65.9	5.4	0	0	0	111.7	D541 I542 D543	N539-D541 PolarHBondContact O-N 3.44Å; N539-D541 VanDerWaalsContact O-N 3.13Å; N539-I542 WeakPolarHBondContact O-CA 3.5Å; N539-I542 VanDerWaalsContact O-CB 3.31Å; N539-I542 WeakPolarHBondContact O-CB 3.03Å; N539-I542 PolarHBondContact O-N 3.35Å; N539-D543 PolarHBondContact O-N 3.4Å
540	D	44.9	Very low	47.6	Very low	118 Å²	118	114.2 Å²	114.2	63%	0.631	61%	0.607	S	S	*	*	H	α-helix	trans	-59.5	-30.6	-174.5	-39.6	-33.8	0	0	0	113.8	I542	D540-I542 VanDerWaalsContact C-N 3.32Å
541	D	51.6	Low	48.8	Very low	112 Å²	112	114.6 Å²	114.6	60%	0.599	60%	0.603	S	S	*	*	H	α-helix	trans	-73.3	-21.4	174.9	-64.6	-53.6	0	0	0	113.4	N539 L545	N539-D541 PolarHBondContact O-N 3.44Å; N539-D541 VanDerWaalsContact O-N 3.13Å; D541-L545 WeakPolarHBondContact O-CB 3.45Å; D541-L545 PolarHBondContact O-N 3.03Å
542	I	63.6	Low	49.4	Very low	34 Å²	34	112.1 Å²	112.1	17%	0.174	59%	0.59	C	S	.	*	H	α-helix	trans	-81.2	-53	-177	-65.8	-179.8	0	0	0	109.9	R435 R538 N539 D540 K544 L545 L546	R435-I542 WeakPolarHBondContact O-CG2 3.38Å; R538-I542 VanDerWaalsContact O-CD1 3.25Å; R538-I542 WeakPolarHBondContact O-CD1 3.42Å; N539-I542 WeakPolarHBondContact O-CA 3.5Å; N539-I542 VanDerWaalsContact O-CB 3.31Å; N539-I542 WeakPolarHBondContact O-CB 3.03Å; N539-I542 PolarHBondContact O-N 3.35Å; D540-I542 VanDerWaalsContact C-N 3.32Å; I542-K544 PolarHBondContact O-N 2.68Å; I542-L545 WeakPolarHBondContact O-CA 3.38Å; I542-L545 WeakPolarHBondContact O-CB 3.48Å; I542-L545 PolarHBondContact O-N 3.39Å; I542-L546 HydrophobicContact CG2-CD1 4.17Å; I542-L546 PolarHBondContact O-N 2.85Å; I542-L546 VanDerWaalsContact O-N 3.13Å
543	D	57.3	Low	49.5	Very low	83 Å²	83	110.8 Å²	110.8	44%	0.444	58%	0.584	S	S	.	*	H	α-helix	trans	-55.8	-38.4	178.1	-58.8	9.9	0	0	0	110.8	N539 L546 M547	N539-D543 PolarHBondContact O-N 3.4Å; D543-L546 PolarHBondContact O-N 3.4Å; D543-M547 PolarHBondContact O-N 2.83Å
544	K	63.8	Low	50	Low	121 Å²	121	107 Å²	107	53%	0.526	57%	0.569	S	S	.	*	H	α-helix	trans	-64.8	-42.6	174.2	-169	-169.6	175.8	-62.7	0	112.8	I542 L546 M547 D548	I542-K544 PolarHBondContact O-N 2.68Å; K544-L546 PolarHBondContact O-N 3.48Å; K544-M547 PolarHBondContact O-N 3.43Å; K544-D548 IonicContact NZ-OD1 3.92Å; K544-D548 IonicContact NZ-OD2 2.73Å; K544-D548 PolarHBondContact NZ-OD2 2.91Å; K544-D548 PolarHBondContact O-N 3.26Å
545	L	56.5	Low	50.6	Low	82 Å²	82	106.9 Å²	106.9	43%	0.429	56%	0.563	S	S	.	*	H	α-helix	trans	-64	-32.5	-179.3	-122.6	157.4	0	0	0	111.9	P433 D541 I542 L549	P433-L545 HydrophobicContact CG-CD1 4.05Å; D541-L545 WeakPolarHBondContact O-CB 3.45Å; D541-L545 PolarHBondContact O-N 3.03Å; I542-L545 WeakPolarHBondContact O-CA 3.38Å; I542-L545 WeakPolarHBondContact O-CB 3.48Å; I542-L545 PolarHBondContact O-N 3.39Å; L545-L549 HydrophobicContact CD2-CD1 4.33Å; L545-L549 WeakPolarHBondContact O-CB 3.31Å; L545-L549 PolarHBondContact O-N 2.94Å
546	L	60.8	Low	51	Low	53 Å²	53	107.1 Å²	107.1	28%	0.277	56%	0.555	S	S	.	*	H	α-helix	trans	-72.9	-43	176.7	-68.6	156.3	0	0	0	112.4	R435 N436 I542 D543 K544 D548 L549 E550	R435-L546 WeakPolarHBondContact O-CD1 3.37Å; N436-L546 WeakPolarHBondContact O-CD1 3.38Å; I542-L546 HydrophobicContact CG2-CD1 4.17Å; I542-L546 PolarHBondContact O-N 2.85Å; I542-L546 VanDerWaalsContact O-N 3.13Å; D543-L546 PolarHBondContact O-N 3.4Å; K544-L546 PolarHBondContact O-N 3.48Å; L546-D548 VanDerWaalsContact C-N 3.29Å; L546-D548 PolarHBondContact O-N 3.37Å; L546-L549 WeakPolarHBondContact O-CB 3.18Å; L546-L549 PolarHBondContact O-N 3.41Å; L546-L549 VanDerWaalsContact O-N 3.15Å; L546-E550 PolarHBondContact O-N 2.95Å
547	M	62.9	Low	50.7	Low	124 Å²	124	105.7 Å²	105.7	61%	0.611	55%	0.545	S	S	*	.	H	α-helix	trans	-59.9	-40	171.7	-78.9	178.7	67	0	0	111.6	D543 K544 L549 N551	D543-M547 PolarHBondContact O-N 2.83Å; K544-M547 PolarHBondContact O-N 3.43Å; M547-L549 VanDerWaalsContact C-N 3.33Å; M547-L549 PolarHBondContact O-N 3.28Å; M547-N551 PolarHBondContact O-N 2.9Å; M547-N551 VanDerWaalsContact O-N 3.14Å; M547-N551 PolarHBondContact O-ND2 2.85Å
548	D	60	Low	50.4	Low	85 Å²	85	105.4 Å²	105.4	46%	0.455	54%	0.544	S	S	.	.	H	α-helix	trans	-67.9	-32	176	-69.2	-29.3	0	0	0	112.1	K544 L546 L552	K544-D548 IonicContact NZ-OD1 3.92Å; K544-D548 IonicContact NZ-OD2 2.73Å; K544-D548 PolarHBondContact NZ-OD2 2.91Å; K544-D548 PolarHBondContact O-N 3.26Å; L546-D548 VanDerWaalsContact C-N 3.29Å; L546-D548 PolarHBondContact O-N 3.37Å; D548-L552 PolarHBondContact O-N 3.24Å
549	L	54	Low	49.7	Very low	102 Å²	102	103.2 Å²	103.2	53%	0.534	55%	0.551	S	S	.	*	H	α-helix	trans	-72.1	-39.8	174.6	-108	144.4	0	0	0	113.3	L545 L546 M547 L552 S553	L545-L549 HydrophobicContact CD2-CD1 4.33Å; L545-L549 WeakPolarHBondContact O-CB 3.31Å; L545-L549 PolarHBondContact O-N 2.94Å; L546-L549 WeakPolarHBondContact O-CB 3.18Å; L546-L549 PolarHBondContact O-N 3.41Å; L546-L549 VanDerWaalsContact O-N 3.15Å; M547-L549 VanDerWaalsContact C-N 3.33Å; M547-L549 PolarHBondContact O-N 3.28Å; L549-L552 PolarHBondContact O-N 3.12Å; L549-L552 VanDerWaalsContact O-N 3.16Å; L549-S553 PolarHBondContact O-N 2.92Å
550	E	60.6	Low	48.9	Very low	123 Å²	123	109.3 Å²	109.3	58%	0.575	57%	0.566	S	S	*	*	H	α-helix	trans	-67.3	-39.2	177.2	-171.7	163.8	-156.1	0	0	111.3	L546 L552 S553 Q554	L546-E550 PolarHBondContact O-N 2.95Å; E550-L552 VanDerWaalsContact C-N 3.3Å; E550-L552 PolarHBondContact O-N 3.31Å; E550-S553 PolarHBondContact O-N 2.83Å; E550-Q554 WeakPolarHBondContact O-CG 3.01Å; E550-Q554 PolarHBondContact O-N 2.62Å
551	N	50.9	Low	48	Very low	100 Å²	100	110.1 Å²	110.1	54%	0.535	58%	0.575	S	S	.	*	H	α-helix	trans	-60.6	-36.3	169.1	-80.4	-75.1	0	0	0	112.6	M547 S555	M547-N551 PolarHBondContact O-N 2.9Å; M547-N551 VanDerWaalsContact O-N 3.14Å; M547-N551 PolarHBondContact O-ND2 2.85Å; N551-S555 WeakPolarHBondContact O-CB 3.39Å; N551-S555 PolarHBondContact O-N 3.37Å; N551-S555 VanDerWaalsContact O-N 3.08Å
552	L	43.2	Very low	46.8	Very low	105 Å²	105	111.2 Å²	111.2	55%	0.55	59%	0.586	S	S	.	*	H	α-helix	trans	-72.6	-34.6	176.7	-173.7	61.9	0	0	0	112.4	D548 L549 E550 S555 M556	D548-L552 PolarHBondContact O-N 3.24Å; L549-L552 PolarHBondContact O-N 3.12Å; L549-L552 VanDerWaalsContact O-N 3.16Å; E550-L552 VanDerWaalsContact C-N 3.3Å; E550-L552 PolarHBondContact O-N 3.31Å; L552-S555 WeakPolarHBondContact O-CB 3.12Å; L552-S555 PolarHBondContact O-N 3.35Å; L552-M556 PolarHBondContact O-N 3.2Å
553	S	46.3	Very low	44.9	Very low	84 Å²	84	117.8 Å²	117.8	59%	0.587	62%	0.616	S	S	*	*	H	α-helix	trans	-62.2	-46.5	172.1	-168.2	0	0	0	0	111.1	L549 E550 S555 M556	L549-S553 PolarHBondContact O-N 2.92Å; E550-S553 PolarHBondContact O-N 2.83Å; S553-S555 PolarHBondContact O-N 2.75Å; S553-M556 PolarHBondContact O-N 3.21Å; S553-M556 VanDerWaalsContact O-N 3.15Å
554	Q	39.2	Very low	44.4	Very low	119 Å²	119	119.2 Å²	119.2	56%	0.556	63%	0.63	S	S	*	*	H	α-helix	trans	-65.9	-20.1	175.4	-65.7	173.8	22.2	0	0	113.1	E550 S557	E550-Q554 WeakPolarHBondContact O-CG 3.01Å; E550-Q554 PolarHBondContact O-N 2.62Å; Q554-S557 PolarHBondContact O-OG 3.31Å
555	S	40.7	Very low	43.5	Very low	89 Å²	89	118.1 Å²	118.1	62%	0.622	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-13.9	174.3	-176.9	0	0	0	0	114.2	N551 L552 S553	N551-S555 WeakPolarHBondContact O-CB 3.39Å; N551-S555 PolarHBondContact O-N 3.37Å; N551-S555 VanDerWaalsContact O-N 3.08Å; L552-S555 WeakPolarHBondContact O-CB 3.12Å; L552-S555 PolarHBondContact O-N 3.35Å; S553-S555 PolarHBondContact O-N 2.75Å
556	M	38.4	Very low	41.9	Very low	162 Å²	162	121.7 Å²	121.7	80%	0.798	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-15.7	-176.6	-71	-94.3	-74.4	0	0	113.2	L552 S553 H558	L552-M556 PolarHBondContact O-N 3.2Å; S553-M556 PolarHBondContact O-N 3.21Å; S553-M556 VanDerWaalsContact O-N 3.15Å; M556-H558 PolarHBondContact O-N 2.96Å
557	S	37.7	Very low	41.3	Very low	75 Å²	75	124.7 Å²	124.7	52%	0.524	68%	0.676	S	S	.	*	S	Bend	trans	-87.9	10.2	-169.6	49.5	0	0	0	0	116	Q554	Q554-S557 PolarHBondContact O-OG 3.31Å
558	H	34.8	Very low	39.8	Very low	159 Å²	159	122.9 Å²	122.9	74%	0.736	68%	0.681	S	S	*	*			trans	-136.1	102.7	179.2	-72.8	-42.2	0	0	0	112.9	M556	M556-H558 PolarHBondContact O-N 2.96Å
559	P	30.4	Very low	38.3	Very low	122 Å²	122	128.2 Å²	128.2	79%	0.792	70%	0.7	S	S	*	*			trans	-75.6	126.1	173.7	30.5	-32.5	0	0	0	110.9
560	R	29.7	Very low	37.3	Very low	244 Å²	244	129 Å²	129	92%	0.921	71%	0.709	S	S	*	*			trans	-102.4	110.3	170.9	-81.1	-168	173.7	-162.5	-1.6	111.8
561	T	25.3	Very low	35.8	Very low	134 Å²	134	134.2 Å²	134.2	82%	0.822	72%	0.724	S	S	*	*			trans	-89.7	100.8	170.8	35.8	0	0	0	0	111.2
562	T	25.8	Very low	34.6	Very low	136 Å²	136	137.7 Å²	137.7	83%	0.834	73%	0.734	S	S	*	*			trans	-157.4	150	156.3	-12.1	0	0	0	0	113.5
563	E	23.8	Very low	33.8	Very low	172 Å²	172	140.4 Å²	140.4	80%	0.804	75%	0.746	S	S	*	*			trans	-43	159.9	-162.5	-64.7	-173.3	96.6	0	0	122.8
564	P	46.6	Very low	32.8	Very low	113 Å²	113	140.5 Å²	140.5	73%	0.734	75%	0.751	S	S	*	*			trans	-85.4	-142.7	152.7	40.3	-32.8	0	0	0	109.4
565	P	45.6	Very low	32.1	Very low	97 Å²	97	142.6 Å²	142.6	63%	0.63	76%	0.761	S	S	*	*			cis	-134.2	-162.2	-18.7	26.8	-0.3	0	0	0	114.3
566	L	23.2	Very low	31.4	Very low	158 Å²	158	145.5 Å²	145.5	83%	0.827	77%	0.765	S	S	*	*			trans	97.6	149.5	151.2	-58.1	-171.7	0	0	0	121.9
567	P	48.8	Very low	30.7	Very low	115 Å²	115	145.6 Å²	145.6	75%	0.747	76%	0.763	S	S	*	*			trans	-146	-177.5	-137.9	44.9	-24.6	0	0	0	119.7
568	A	30.4	Very low	30.2	Very low	86 Å²	86	147.7 Å²	147.7	71%	0.711	77%	0.773	S	S	*	*			trans	77	129.3	142.2	0	0	0	0	0	123.1
569	K	30	Very low	29.7	Very low	197 Å²	197	147.9 Å²	147.9	86%	0.857	77%	0.774	S	S	*	*			trans	-172.6	113.7	135.9	-104.5	154.3	-170.5	163.6	0	117
570	T	31.9	Very low	29.6	Very low	119 Å²	119	150.5 Å²	150.5	73%	0.73	77%	0.773	S	S	*	*			trans	37.8	134.2	136	54.4	0	0	0	0	125.7
571	R	29.9	Very low	30.1	Very low	233 Å²	233	144 Å²	144	88%	0.879	76%	0.762	S	S	*	*			trans	73.7	136.4	142.5	-74.7	174.7	166.6	178.7	-3.5	117.9
572	K	26.1	Very low	30.3	Very low	173 Å²	173	143 Å²	143	75%	0.752	76%	0.756	S	S	*	*			cis	-179.7	158.3	41.6	-136.5	-172.9	175.2	-169.9	0	112.8
573	M	24.8	Very low	30.5	Very low	161 Å²	161	140.9 Å²	140.9	79%	0.793	75%	0.747	S	S	*	*			trans	78.8	125.7	152.2	-68.1	174	90.3	0	0	122.9
574	A	25.1	Very low	30.8	Very low	86 Å²	86	141 Å²	141	71%	0.711	75%	0.747	S	S	*	*			trans	59.8	131.4	160.4	0	0	0	0	0	118.6
575	Q	25.5	Very low	30	Very low	163 Å²	163	142.9 Å²	142.9	76%	0.762	75%	0.75	S	S	*	*			cis	-160.9	-167.6	-5.5	-122.8	157	-97.2	0	0	107.3
576	H	25.6	Very low	29.2	Very low	150 Å²	150	141 Å²	141	69%	0.694	75%	0.748	S	S	*	*			cis	-144.9	-90	13	-150.6	170.8	0	0	0	115.5
577	Q	24.9	Very low	29.6	Very low	164 Å²	164	141.5 Å²	141.5	77%	0.766	75%	0.749	S	S	*	*			trans	-154.5	156.1	-172.7	-62.3	177	-12.8	0	0	107.1
578	V	25.3	Very low	28.7	Very low	119 Å²	119	143 Å²	143	72%	0.721	75%	0.751	S	S	*	*			cis	-142.5	167.5	6	-124.8	0	0	0	0	106.7
579	Q	26	Very low	28.5	Very low	164 Å²	164	141.8 Å²	141.8	77%	0.766	75%	0.746	S	S	*	*			cis	-141.8	-179	3.3	-150	149.6	-81	0	0	105.8
580	K	27.4	Very low	28.5	Very low	177 Å²	177	139.1 Å²	139.1	77%	0.77	75%	0.746	S	S	*	*			cis	62.8	147.1	29.8	-101.4	-160.9	173.2	-169.8	0	115.5
581	P	40.8	Very low	28.3	Very low	107 Å²	107	140.8 Å²	140.8	70%	0.695	75%	0.75	S	S	*	*			cis	-115	-165.5	-5.2	45.7	-32.7	0	0	0	110.8
582	T	29.1	Very low	28.2	Very low	112 Å²	112	134.5 Å²	134.5	69%	0.687	74%	0.742	S	S	*	*			cis	-169.6	154.4	-38	35.3	0	0	0	0	107.6
583	S	29.4	Very low	28.5	Very low	93 Å²	93	138 Å²	138	65%	0.65	75%	0.751	S	S	*	*			cis	176.8	161.1	-18.9	57.6	0	0	0	0	111
584	H	30	Very low	28.8	Very low	173 Å²	173	136.9 Å²	136.9	80%	0.801	75%	0.752	S	S	*	*			trans	75.4	133.9	166	-85.2	-117.7	0	0	0	117.9
585	L	30.1	Very low	29	Very low	153 Å²	153	138.9 Å²	138.9	80%	0.801	76%	0.756	S	S	*	*			cis	-133	178.7	5.2	-87.3	168.6	0	0	0	110.4
586	G	28.3	Very low	29.2	Very low	58 Å²	58	139.8 Å²	139.8	60%	0.598	76%	0.76	S	S	*	*			cis	139.7	127.8	-10.6	0	0	0	0	0	115
587	M	31.8	Very low	29.1	Very low	169 Å²	169	137.7 Å²	137.7	83%	0.833	76%	0.762	S	S	*	*			trans	67.9	160.7	175.7	-66.8	161.5	48.4	0	0	115.8
588	N	29.5	Very low	30.1	Very low	147 Å²	147	134.6 Å²	134.6	79%	0.786	76%	0.757	S	S	*	*			cis	-163.7	167.9	-20.8	-98.9	-4.7	0	0	0	107.8
589	G	27.4	Very low	30	Very low	60 Å²	60	135 Å²	135	62%	0.619	76%	0.759	S	S	*	*			cis	148.6	144.9	-8	0	0	0	0	0	114.1
590	V	29.8	Very low	31	Very low	140 Å²	140	132.7 Å²	132.7	85%	0.848	76%	0.759	S	S	*	*			trans	80.7	134.4	169.2	-171.5	0	0	0	0	115.4
591	N	26.8	Very low	32.2	Very low	154 Å²	154	129.2 Å²	129.2	82%	0.824	75%	0.754	S	S	*	*			cis	-147.2	177.3	24.2	-143.8	-14.3	0	0	0	115.8
592	S	29.5	Very low	31.5	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	77%	0.766	S	S	*	*			trans	-167.4	159.7	176.5	63.9	0	0	0	0	116
593	R	31.6	Very low	31.3	Very low	248 Å²	248	132.3 Å²	132.3	94%	0.936	77%	0.773	S	S	*	*			trans	179.1	173.9	138	-107.3	-178.4	173.7	-173.6	-2.6	118.9
594	V	30.4	Very low	31.3	Very low	136 Å²	136	136.5 Å²	136.5	82%	0.824	78%	0.783	S	S	*	*			trans	-152.5	151.7	-161	170.7	0	0	0	0	114.1
595	T	29.2	Very low	31.3	Very low	128 Å²	128	135.1 Å²	135.1	79%	0.785	78%	0.781	S	S	*	*			trans	-174.9	159.8	165.3	19.2	0	0	0	0	110.6
596	Q	30.2	Very low	31.2	Very low	182 Å²	182	134 Å²	134	85%	0.85	79%	0.786	S	S	*	*			cis	-162.8	-171.5	-14.2	-136.2	178.4	158.7	0	0	110.9
597	S	24.1	Very low	31.7	Very low	106 Å²	106	140 Å²	140	74%	0.741	80%	0.799	S	S	*	*			trans	-157.3	-165.7	-176.8	62	0	0	0	0	111.7
598	P	45.3	Very low	32.5	Very low	100 Å²	100	137.3 Å²	137.3	65%	0.649	79%	0.794	S	S	*	*			cis	-145.5	-176.3	-4.4	44.1	-24.1	0	0	0	118.6
599	T	23.3	Very low	32.5	Very low	127 Å²	127	133.9 Å²	133.9	78%	0.779	79%	0.794	S	S	*	*			trans	61.7	158.2	154.4	51.1	0	0	0	0	123.2
600	P	48	Very low	32.9	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	81%	0.807	S	S	*	*			cis	-132.2	-134.6	-43.8	41.8	-21.7	0	0	0	110.1
601	P	52	Low	33.3	Very low	104 Å²	104	134.8 Å²	134.8	68%	0.675	80%	0.801	S	S	*	*			cis	-133.1	-170.4	-36.2	42.3	-24.4	0	0	0	116.2
602	Q	24.9	Very low	34	Very low	202 Å²	202	134.9 Å²	134.9	94%	0.944	80%	0.802	S	S	*	*			trans	75.3	129.4	155	-88.5	-172	-33.8	0	0	124
603	G	25.7	Very low	34.8	Very low	81 Å²	81	138.9 Å²	138.9	84%	0.835	81%	0.81	S	S	*	*			trans	158.5	149.5	170.1	0	0	0	0	0	112.2
604	E	29	Very low	35.5	Very low	181 Å²	181	135.3 Å²	135.3	85%	0.846	80%	0.803	S	S	*	*			trans	-122.3	146	-169.9	-68.8	-179.6	107	0	0	116.2
605	N	31.5	Very low	36.2	Very low	145 Å²	145	134.7 Å²	134.7	78%	0.775	80%	0.796	S	S	*	*			trans	48.4	115.2	149.9	-58.6	-18.2	0	0	0	123.1
606	S	27.7	Very low	36.9	Very low	129 Å²	129	130.5 Å²	130.5	90%	0.902	78%	0.777	S	S	*	*				-173.8	170.5	118.5	39.7	0	0	0	0	111.5
607	E	38.4	Very low	37.9	Very low	184 Å²	184	124.1 Å²	124.1	86%	0.86	76%	0.756	S	S	*	*			trans	-109.5	-161.9	-163.8	-143.8	-164.5	-151.7	0	0	113.1
608	P	47.6	Very low	39	Very low	112 Å²	112	123.2 Å²	123.2	73%	0.727	74%	0.742	S	S	*	*				-117.6	-176.5	-117.5	42.3	-26.6	0	0	0	115.8
609	G	29.3	Very low	39.2	Very low	76 Å²	76	123.5 Å²	123.5	78%	0.784	74%	0.738	S	S	*	*			trans	-156.8	142.3	165.6	0	0	0	0	0	111.5
610	T	36.1	Very low	40.6	Very low	148 Å²	148	123.1 Å²	123.1	91%	0.908	73%	0.73	S	S	*	*			trans	-119.5	145.5	-169.8	48.9	0	0	0	0	112.9
611	G	38.3	Very low	41.2	Very low	70 Å²	70	125 Å²	125	72%	0.722	72%	0.722	S	S	*	*			trans	159.1	90.3	164.6	0	0	0	0	0	113.7
612	D	41.1	Very low	41.3	Very low	157 Å²	157	123.9 Å²	123.9	84%	0.84	71%	0.71	S	S	*	*			trans	-154.4	10.3	174.4	-96	-41	0	0	0	113.4
613	E	46.9	Very low	42.4	Very low	185 Å²	185	118.7 Å²	118.7	86%	0.864	69%	0.688	S	S	*	*	S	Bend	trans	-101.2	-17	-175.3	-70.2	-171.6	132.2	0	0	115
614	E	47.3	Very low	43.5	Very low	172 Å²	172	121.1 Å²	121.1	80%	0.804	68%	0.678	S	S	*	*	H	α-helix	trans	-77.2	-35.6	-178.3	-67.2	-171.1	110.4	0	0	113.4	G616 A617 L618	E614-G616 VanDerWaalsContact C-N 3.27Å; E614-G616 PolarHBondContact O-N 3.43Å; E614-A617 PolarHBondContact O-N 2.68Å; E614-L618 PolarHBondContact O-N 3.42Å
615	D	43.7	Very low	44.5	Very low	124 Å²	124	116.1 Å²	116.1	66%	0.663	66%	0.663	S	S	*	*	H	α-helix	trans	-63.8	-30.7	-179.8	-85.5	2.4	0	0	0	112.6	L618 L619	D615-L618 PolarHBondContact O-N 3.17Å; D615-L619 WeakPolarHBondContact O-CB 3.4Å; D615-L619 PolarHBondContact O-N 2.96Å
616	G	44.9	Very low	45.5	Very low	39 Å²	39	114 Å²	114	40%	0.402	65%	0.65	S	S	.	*	H	α-helix	trans	-67.6	-41.8	174.6	0	0	0	0	0	112.8	E614 L619 L620	E614-G616 VanDerWaalsContact C-N 3.27Å; E614-G616 PolarHBondContact O-N 3.43Å; G616-L619 PolarHBondContact O-N 3.31Å; G616-L620 PolarHBondContact O-N 3.49Å
617	A	50.6	Low	46.6	Very low	48 Å²	48	114.8 Å²	114.8	40%	0.397	64%	0.64	S	S	.	*	H	α-helix	trans	-70.2	-34.5	175.6	0	0	0	0	0	111.9	E614 R621	E614-A617 PolarHBondContact O-N 2.68Å; A617-R621 WeakPolarHBondContact O-CB 3.46Å; A617-R621 PolarHBondContact O-N 3.13Å; A617-R621 VanDerWaalsContact O-N 3.12Å
618	L	47.6	Very low	47	Very low	88 Å²	88	109.9 Å²	109.9	46%	0.461	63%	0.626	S	S	.	*	H	α-helix	trans	-65.3	-45.2	172.9	-171.9	67.5	0	0	0	111.3	E614 D615 R621 I622	E614-L618 PolarHBondContact O-N 3.42Å; D615-L618 PolarHBondContact O-N 3.17Å; L618-R621 PolarHBondContact O-N 2.87Å; L618-I622 HydrophobicContact CD1-CD1 4.46Å; L618-I622 HydrophobicContact CG-CD1 3.96Å; L618-I622 WeakPolarHBondContact O-CB 3.11Å; L618-I622 VanDerWaalsContact O-CG1 3.27Å; L618-I622 WeakPolarHBondContact O-CG1 3.19Å; L618-I622 PolarHBondContact O-N 3.42Å
619	L	49.6	Very low	46.9	Very low	105 Å²	105	110.3 Å²	110.3	55%	0.55	62%	0.616	S	S	.	*	H	α-helix	trans	-64.9	-40.9	179.4	-174.8	62.8	0	0	0	112.4	D615 G616 I622 L623	D615-L619 WeakPolarHBondContact O-CB 3.4Å; D615-L619 PolarHBondContact O-N 2.96Å; G616-L619 PolarHBondContact O-N 3.31Å; L619-I622 PolarHBondContact O-N 3.08Å; L619-L623 HydrophobicContact CG-CD1 4.33Å; L619-L623 WeakPolarHBondContact O-CG 3.49Å; L619-L623 PolarHBondContact O-N 2.86Å
620	L	52.1	Low	47.6	Very low	120 Å²	120	109 Å²	109	63%	0.628	60%	0.598	S	S	*	*	H	α-helix	trans	-62.4	-45.7	174.2	-78.4	166.5	0	0	0	111.7	G616 I622 L623 E624	G616-L620 PolarHBondContact O-N 3.49Å; L620-I622 VanDerWaalsContact C-N 3.29Å; L620-I622 PolarHBondContact O-N 3.41Å; L620-L623 PolarHBondContact O-N 3.01Å; L620-L623 VanDerWaalsContact O-N 3.14Å; L620-E624 WeakPolarHBondContact O-CB 3.48Å; L620-E624 PolarHBondContact O-N 2.64Å
621	R	60.8	Low	48.3	Very low	154 Å²	154	107 Å²	107	58%	0.581	58%	0.579	S	S	*	*	H	α-helix	trans	-65.2	-31.6	176.9	-166.1	-180	-61.2	128	5.1	112.9	A617 L618 S625	A617-R621 WeakPolarHBondContact O-CB 3.46Å; A617-R621 PolarHBondContact O-N 3.13Å; A617-R621 VanDerWaalsContact O-N 3.12Å; L618-R621 PolarHBondContact O-N 2.87Å; R621-S625 WeakPolarHBondContact O-CB 3.2Å; R621-S625 PolarHBondContact O-N 3.16Å
622	I	55.1	Low	48.7	Very low	81 Å²	81	109.3 Å²	109.3	42%	0.415	57%	0.571	S	S	.	*	H	α-helix	trans	-68.7	-41.7	172.2	-74	167.2	0	0	0	110.7	L618 L619 L620 S625 I626	L618-I622 HydrophobicContact CD1-CD1 4.46Å; L618-I622 HydrophobicContact CG-CD1 3.96Å; L618-I622 WeakPolarHBondContact O-CB 3.11Å; L618-I622 VanDerWaalsContact O-CG1 3.27Å; L618-I622 WeakPolarHBondContact O-CG1 3.19Å; L618-I622 PolarHBondContact O-N 3.42Å; L619-I622 PolarHBondContact O-N 3.08Å; L620-I622 VanDerWaalsContact C-N 3.29Å; L620-I622 PolarHBondContact O-N 3.41Å; I622-S625 PolarHBondContact O-N 2.92Å; I622-I626 HydrophobicContact CG2-CD1 3.74Å; I622-I626 WeakPolarHBondContact O-CB 3.36Å; I622-I626 WeakPolarHBondContact O-CD1 3.29Å; I622-I626 WeakPolarHBondContact O-CG1 3.47Å; I622-I626 PolarHBondContact O-N 3.02Å
623	L	47.3	Very low	48.5	Very low	94 Å²	94	106.5 Å²	106.5	49%	0.492	56%	0.555	S	S	.	*	H	α-helix	trans	-67	-44.6	176.9	-71.7	168	0	0	0	111.8	L619 L620 S625 I626 E627	L619-L623 HydrophobicContact CG-CD1 4.33Å; L619-L623 WeakPolarHBondContact O-CG 3.49Å; L619-L623 PolarHBondContact O-N 2.86Å; L620-L623 PolarHBondContact O-N 3.01Å; L620-L623 VanDerWaalsContact O-N 3.14Å; L623-S625 VanDerWaalsContact C-N 3.33Å; L623-S625 PolarHBondContact O-N 3.4Å; L623-I626 CarbonylContact O-C 3.55Å; L623-I626 PolarHBondContact O-N 2.95Å; L623-I626 VanDerWaalsContact O-N 3.08Å; L623-E627 WeakPolarHBondContact O-CB 3.3Å; L623-E627 PolarHBondContact O-N 3.19Å
624	E	49	Very low	48.5	Very low	131 Å²	131	102.6 Å²	102.6	61%	0.612	54%	0.544	S	S	*	.	H	α-helix	trans	-59.8	-40.8	173.6	-174.8	175.9	-141.3	0	0	111.7	L620 E627 S628	L620-E624 WeakPolarHBondContact O-CB 3.48Å; L620-E624 PolarHBondContact O-N 2.64Å; E624-E627 PolarHBondContact O-N 3.27Å; E624-S628 WeakPolarHBondContact O-CB 3.47Å; E624-S628 PolarHBondContact O-N 2.84Å
625	S	49.1	Very low	48.6	Very low	77 Å²	77	100.1 Å²	100.1	54%	0.538	54%	0.536	S	S	.	.	H	α-helix	trans	-68.9	-29.9	172.9	-177.2	0	0	0	0	113.5	R621 I622 L623 F629	R621-S625 WeakPolarHBondContact O-CB 3.2Å; R621-S625 PolarHBondContact O-N 3.16Å; I622-S625 PolarHBondContact O-N 2.92Å; L623-S625 VanDerWaalsContact C-N 3.33Å; L623-S625 PolarHBondContact O-N 3.4Å; S625-F629 WeakPolarHBondContact O-CB 3.34Å; S625-F629 PolarHBondContact O-N 3.39Å
626	I	53.6	Low	48.8	Very low	99 Å²	99	98.4 Å²	98.4	51%	0.508	53%	0.534	S	S	.	.	H	α-helix	trans	-77	-35.7	175.1	-73.7	165.3	0	0	0	110.5	I622 L623 F629 A630	I622-I626 HydrophobicContact CG2-CD1 3.74Å; I622-I626 WeakPolarHBondContact O-CB 3.36Å; I622-I626 WeakPolarHBondContact O-CD1 3.29Å; I622-I626 WeakPolarHBondContact O-CG1 3.47Å; I622-I626 PolarHBondContact O-N 3.02Å; L623-I626 CarbonylContact O-C 3.55Å; L623-I626 PolarHBondContact O-N 2.95Å; L623-I626 VanDerWaalsContact O-N 3.08Å; I626-F629 PolarHBondContact O-N 2.86Å; I626-A630 VanDerWaalsContact O-CB 3.23Å; I626-A630 WeakPolarHBondContact O-CB 3.42Å; I626-A630 PolarHBondContact O-N 2.65Å
627	E	50.2	Low	48.4	Very low	147 Å²	147	99.1 Å²	99.1	69%	0.687	54%	0.541	S	S	*	.	H	α-helix	trans	-67	-46.6	174.3	-170.9	160.3	-145.4	0	0	110.6	L623 E624 F629 A630 Q631	L623-E627 WeakPolarHBondContact O-CB 3.3Å; L623-E627 PolarHBondContact O-N 3.19Å; E624-E627 PolarHBondContact O-N 3.27Å; E627-F629 VanDerWaalsContact C-N 3.33Å; E627-F629 PolarHBondContact O-N 3.14Å; E627-A630 PolarHBondContact O-N 2.66Å; E627-Q631 WeakPolarHBondContact O-CB 3.29Å; E627-Q631 PolarHBondContact O-N 3.25Å
628	S	47.9	Very low	47.5	Very low	80 Å²	80	101.9 Å²	101.9	56%	0.559	56%	0.564	S	S	*	*	H	α-helix	trans	-61.8	-37.1	172.3	-174.3	0	0	0	0	113.1	E624 E632	E624-S628 WeakPolarHBondContact O-CB 3.47Å; E624-S628 PolarHBondContact O-N 2.84Å; S628-E632 WeakPolarHBondContact O-CB 3.49Å; S628-E632 PolarHBondContact O-N 3.16Å
629	F	43.6	Very low	46.8	Very low	121 Å²	121	100.9 Å²	100.9	53%	0.531	58%	0.575	S	S	.	*	H	α-helix	trans	-75.1	-30.5	176.6	-178.8	-109.9	0	0	0	112.7	S625 I626 E627 L633	S625-F629 WeakPolarHBondContact O-CB 3.34Å; S625-F629 PolarHBondContact O-N 3.39Å; I626-F629 PolarHBondContact O-N 2.86Å; E627-F629 VanDerWaalsContact C-N 3.33Å; E627-F629 PolarHBondContact O-N 3.14Å; F629-L633 HydrophobicContact CD1-CD1 3.93Å; F629-L633 HydrophobicContact CE1-CD1 3.51Å; F629-L633 HydrophobicContact CE1-CG 4.47Å; F629-L633 HydrophobicContact CZ-CD1 3.84Å; F629-L633 HydrophobicContact CZ-CG 4.42Å; F629-L633 WeakPolarHBondContact O-CB 3.4Å; F629-L633 WeakPolarHBondContact O-CG 3.49Å; F629-L633 PolarHBondContact O-N 3.14Å
630	A	45.8	Very low	46.5	Very low	49 Å²	49	101.7 Å²	101.7	41%	0.405	59%	0.59	S	S	.	*	H	α-helix	trans	-69.9	-39.2	171.4	0	0	0	0	0	111.1	I626 E627 L633 V634	I626-A630 VanDerWaalsContact O-CB 3.23Å; I626-A630 WeakPolarHBondContact O-CB 3.42Å; I626-A630 PolarHBondContact O-N 2.65Å; E627-A630 PolarHBondContact O-N 2.66Å; A630-L633 PolarHBondContact O-N 3.14Å; A630-V634 WeakPolarHBondContact O-CG2 3.49Å; A630-V634 PolarHBondContact O-N 2.78Å
631	Q	50.1	Low	45.6	Very low	107 Å²	107	100.5 Å²	100.5	50%	0.5	59%	0.591	S	S	.	*	H	α-helix	trans	-64.9	-48.7	173.5	-166.3	60.2	54.3	0	0	110.9	E627 L633 V634 D635	E627-Q631 WeakPolarHBondContact O-CB 3.29Å; E627-Q631 PolarHBondContact O-N 3.25Å; Q631-L633 PolarHBondContact O-N 3.14Å; Q631-V634 WeakPolarHBondContact O-CB 3.25Å; Q631-V634 PolarHBondContact O-N 2.89Å; Q631-D635 PolarHBondContact NE2-OD1 2.85Å; Q631-D635 PolarHBondContact O-N 3.01Å
632	E	46	Very low	44.3	Very low	117 Å²	117	96.5 Å²	96.5	55%	0.547	60%	0.598	S	S	.	*	H	α-helix	trans	-57.6	-32.9	173.4	-170.5	-177.9	-172	0	0	112	S628 S636	S628-E632 WeakPolarHBondContact O-CB 3.49Å; S628-E632 PolarHBondContact O-N 3.16Å; E632-S636 WeakPolarHBondContact O-CB 3.28Å; E632-S636 PolarHBondContact O-N 3.19Å; E632-S636 PolarHBondContact O-OG 3.2Å
633	L	37.6	Very low	43.5	Very low	98 Å²	98	96.8 Å²	96.8	51%	0.513	61%	0.607	S	S	.	*	H	α-helix	trans	-74.4	-32.2	174.4	-91.3	167.3	0	0	0	114.5	F629 A630 Q631 S636 G637	F629-L633 HydrophobicContact CD1-CD1 3.93Å; F629-L633 HydrophobicContact CE1-CD1 3.51Å; F629-L633 HydrophobicContact CE1-CG 4.47Å; F629-L633 HydrophobicContact CZ-CD1 3.84Å; F629-L633 HydrophobicContact CZ-CG 4.42Å; F629-L633 WeakPolarHBondContact O-CB 3.4Å; F629-L633 WeakPolarHBondContact O-CG 3.49Å; F629-L633 PolarHBondContact O-N 3.14Å; A630-L633 PolarHBondContact O-N 3.14Å; Q631-L633 PolarHBondContact O-N 3.14Å; L633-S636 PolarHBondContact O-N 3.29Å; L633-G637 PolarHBondContact O-N 2.94Å
634	V	47.8	Very low	42.9	Very low	103 Å²	103	95.7 Å²	95.7	62%	0.624	61%	0.612	S	S	*	*	H	α-helix	trans	-67.4	-41.7	170.2	167.2	0	0	0	0	109.7	A630 Q631 S636	A630-V634 WeakPolarHBondContact O-CG2 3.49Å; A630-V634 PolarHBondContact O-N 2.78Å; Q631-V634 WeakPolarHBondContact O-CB 3.25Å; Q631-V634 PolarHBondContact O-N 2.89Å; V634-S636 VanDerWaalsContact C-N 3.25Å; V634-S636 PolarHBondContact O-N 3Å
635	D	47.4	Very low	42.4	Very low	120 Å²	120	97.9 Å²	97.9	64%	0.642	62%	0.622	S	S	*	*	H	α-helix	trans	-74.4	-14.9	178	-54.7	-22	0	0	0	112.5	Q631	Q631-D635 PolarHBondContact NE2-OD1 2.85Å; Q631-D635 PolarHBondContact O-N 3.01Å
636	S	49.7	Very low	41.9	Very low	88 Å²	88	105.4 Å²	105.4	62%	0.615	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	8.9	-176	-59.7	0	0	0	0	115.8	E632 L633 V634	E632-S636 WeakPolarHBondContact O-CB 3.28Å; E632-S636 PolarHBondContact O-N 3.19Å; E632-S636 PolarHBondContact O-OG 3.2Å; L633-S636 PolarHBondContact O-N 3.29Å; V634-S636 VanDerWaalsContact C-N 3.25Å; V634-S636 PolarHBondContact O-N 3Å
637	G	34.7	Very low	41.2	Very low	54 Å²	54	108.8 Å²	108.8	56%	0.557	65%	0.65	S	S	*	*			trans	-144.8	121.8	-176.8	0	0	0	0	0	114.6	L633	L633-G637 PolarHBondContact O-N 2.94Å
638	A	32.6	Very low	40.9	Very low	107 Å²	107	106.7 Å²	106.7	88%	0.884	65%	0.646	S	S	*	*	S	Bend	cis	-160	159.7	-1.4	0	0	0	0	0	110
639	G	32	Very low	40.8	Very low	67 Å²	67	105 Å²	105	69%	0.691	64%	0.641	S	S	*	*			cis	-168.8	155.7	-2	0	0	0	0	0	109.7
640	S	43.6	Very low	40.9	Very low	122 Å²	122	107 Å²	107	85%	0.853	65%	0.65	S	S	*	*			cis	88	90.2	44.2	-174	0	0	0	0	114.8
641	S	33.7	Very low	40.7	Very low	94 Å²	94	111.2 Å²	111.2	66%	0.657	66%	0.661	S	S	*	*			trans	-171.4	117.2	139	61.3	0	0	0	0	111.4
642	G	32.9	Very low	40.5	Very low	70 Å²	70	113.7 Å²	113.7	72%	0.722	67%	0.67	S	S	*	*			cis	130.6	124.8	-8.4	0	0	0	0	0	114.4
643	S	39	Very low	40.7	Very low	88 Å²	88	112.6 Å²	112.6	62%	0.615	67%	0.665	S	S	*	*			trans	-176.4	145.6	170.3	-175.9	0	0	0	0	109.7
644	A	35.4	Very low	41.2	Very low	71 Å²	71	111.9 Å²	111.9	59%	0.587	67%	0.665	S	S	*	*			cis	-160.3	-16.7	-26.9	0	0	0	0	0	112.4
645	E	37.5	Very low	41.1	Very low	177 Å²	177	113.4 Å²	113.4	83%	0.827	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-27.4	-156.9	-61.1	-176.7	126.8	0	0	115.6	K647 V648	E645-K647 PolarHBondContact O-N 3.46Å; E645-V648 PolarHBondContact O-N 3.13Å
646	R	40	Very low	41.3	Very low	234 Å²	234	114.5 Å²	114.5	88%	0.883	66%	0.662	S	S	*	*	H	α-helix	trans	-60.3	-14.8	177.3	-70.7	-177.4	-179.3	154.3	1.2	113.9
647	K	38.4	Very low	41.1	Very low	171 Å²	171	115.4 Å²	115.4	74%	0.743	66%	0.659	S	S	*	*	H	α-helix	trans	-77.9	-29.3	-177.6	-153.8	165.4	-172.2	172.1	0	113.9	E645 E651	E645-K647 PolarHBondContact O-N 3.46Å; K647-E651 PolarHBondContact O-N 2.95Å
648	V	42.2	Very low	41.5	Very low	102 Å²	102	117.8 Å²	117.8	62%	0.618	66%	0.659	S	S	*	*	H	α-helix	trans	-75.9	-28.8	179.5	-179.9	0	0	0	0	112.2	E645	E645-V648 PolarHBondContact O-N 3.13Å
649	G	46.6	Very low	42.3	Very low	44 Å²	44	118.6 Å²	118.6	45%	0.454	64%	0.644	S	S	.	*	H	α-helix	trans	-67.5	-55.8	173.9	0	0	0	0	0	112.1	E651 K652 E653	G649-E651 VanDerWaalsContact C-N 3.3Å; G649-E651 PolarHBondContact O-N 3.44Å; G649-K652 WeakPolarHBondContact O-CB 3Å; G649-K652 PolarHBondContact O-N 3.44Å; G649-K652 VanDerWaalsContact O-N 3.09Å; G649-E653 PolarHBondContact O-N 2.91Å
650	K	46.1	Very low	42.9	Very low	165 Å²	165	119.1 Å²	119.1	72%	0.717	63%	0.631	S	S	*	*	H	α-helix	trans	-62.2	-32.8	-177.3	-68.6	-166.8	174.3	-169.1	0	113.4	K652 E653 V654	K650-K652 VanDerWaalsContact C-N 3.35Å; K650-K652 PolarHBondContact O-N 2.79Å; K650-E653 PolarHBondContact O-N 3.34Å; K650-V654 WeakPolarHBondContact O-CB 3.21Å; K650-V654 WeakPolarHBondContact O-CG2 3.25Å; K650-V654 PolarHBondContact O-N 3.32Å
651	E	41.6	Very low	42.9	Very low	136 Å²	136	117.6 Å²	117.6	64%	0.636	62%	0.617	S	S	*	*	H	α-helix	trans	-67.1	-33.6	175.9	-167.1	168.7	-137.8	0	0	112.5	K647 G649 M655	K647-E651 PolarHBondContact O-N 2.95Å; G649-E651 VanDerWaalsContact C-N 3.3Å; G649-E651 PolarHBondContact O-N 3.44Å; E651-M655 WeakPolarHBondContact O-CB 3.41Å; E651-M655 VanDerWaalsContact O-CG 3.28Å; E651-M655 WeakPolarHBondContact O-CG 3.47Å; E651-M655 PolarHBondContact O-N 3.07Å; E651-M655 VanDerWaalsContact O-N 3.13Å
652	K	45.2	Very low	43.2	Very low	159 Å²	159	118.9 Å²	118.9	69%	0.691	62%	0.616	S	S	*	*	H	α-helix	trans	-72	-39.5	169.5	-87.4	-174.3	172.8	-177.6	0	113.1	G649 K650 M655 R656	G649-K652 WeakPolarHBondContact O-CB 3Å; G649-K652 PolarHBondContact O-N 3.44Å; G649-K652 VanDerWaalsContact O-N 3.09Å; K650-K652 VanDerWaalsContact C-N 3.35Å; K650-K652 PolarHBondContact O-N 2.79Å; K652-M655 PolarHBondContact O-N 2.78Å; K652-R656 WeakPolarHBondContact O-CB 3.16Å; K652-R656 PolarHBondContact O-N 3.06Å
653	E	50.9	Low	43.6	Very low	94 Å²	94	119.4 Å²	119.4	44%	0.439	61%	0.605	S	S	.	*	H	α-helix	trans	-63.3	-45.2	178.8	-153.2	66.8	-113.1	0	0	111	G649 K650 R656 L657	G649-E653 PolarHBondContact O-N 2.91Å; K650-E653 PolarHBondContact O-N 3.34Å; E653-R656 PolarHBondContact O-N 3.35Å; E653-R656 IonicContact OE1-CZ 2.65Å; E653-R656 VanDerWaalsContact OE1-CZ 3.3Å; E653-R656 IonicContact OE1-NE 3.2Å; E653-R656 PolarHBondContact OE1-NE 3.1Å; E653-R656 IonicContact OE1-NH2 3.74Å; E653-R656 PolarHBondContact OE1-NH2 2.88Å; E653-L657 PolarHBondContact O-N 2.77Å
654	V	48.3	Very low	43.7	Very low	84 Å²	84	120.4 Å²	120.4	51%	0.509	61%	0.607	S	S	.	*	H	α-helix	trans	-66.5	-39.6	176.4	171.9	0	0	0	0	111.8	K650 R656 L657 L658	K650-V654 WeakPolarHBondContact O-CB 3.21Å; K650-V654 WeakPolarHBondContact O-CG2 3.25Å; K650-V654 PolarHBondContact O-N 3.32Å; V654-R656 VanDerWaalsContact C-N 3.32Å; V654-R656 PolarHBondContact O-N 3.42Å; V654-L657 PolarHBondContact O-N 2.69Å; V654-L658 HydrophobicContact CG1-CD1 3.96Å; V654-L658 WeakPolarHBondContact O-CB 2.98Å; V654-L658 WeakPolarHBondContact O-CG 3.4Å; V654-L658 PolarHBondContact O-N 2.84Å
655	M	44.8	Very low	43.8	Very low	134 Å²	134	121.1 Å²	121.1	66%	0.66	61%	0.613	S	S	*	*	H	α-helix	trans	-58.6	-42.2	170.4	-83.7	-81	-167.2	0	0	112	E651 K652 Q659	E651-M655 WeakPolarHBondContact O-CB 3.41Å; E651-M655 VanDerWaalsContact O-CG 3.28Å; E651-M655 WeakPolarHBondContact O-CG 3.47Å; E651-M655 PolarHBondContact O-N 3.07Å; E651-M655 VanDerWaalsContact O-N 3.13Å; K652-M655 PolarHBondContact O-N 2.78Å; M655-Q659 WeakPolarHBondContact O-CB 3.35Å; M655-Q659 PolarHBondContact O-N 2.89Å
656	R	52.2	Low	43.8	Very low	144 Å²	144	118 Å²	118	54%	0.543	61%	0.606	S	S	.	*	H	α-helix	trans	-66.9	-46.2	177.4	-173	170.8	73.4	117	-6.5	111.7	K652 E653 V654 L658 Q659 D660	K652-R656 WeakPolarHBondContact O-CB 3.16Å; K652-R656 PolarHBondContact O-N 3.06Å; E653-R656 PolarHBondContact O-N 3.35Å; E653-R656 IonicContact OE1-CZ 2.65Å; E653-R656 VanDerWaalsContact OE1-CZ 3.3Å; E653-R656 IonicContact OE1-NE 3.2Å; E653-R656 PolarHBondContact OE1-NE 3.1Å; E653-R656 IonicContact OE1-NH2 3.74Å; E653-R656 PolarHBondContact OE1-NH2 2.88Å; V654-R656 VanDerWaalsContact C-N 3.32Å; V654-R656 PolarHBondContact O-N 3.42Å; R656-L658 VanDerWaalsContact C-N 3.33Å; R656-L658 PolarHBondContact O-N 2.96Å; R656-Q659 WeakPolarHBondContact O-CB 3.34Å; R656-Q659 PolarHBondContact O-N 2.85Å; R656-Q659 VanDerWaalsContact O-N 3.08Å; R656-D660 PolarHBondContact O-N 3.05Å
657	L	45	Very low	43.4	Very low	107 Å²	107	115 Å²	115	56%	0.56	60%	0.602	S	S	*	*	H	α-helix	trans	-61.7	-40	178.1	-127.5	70.9	0	0	0	112.3	E653 V654 T661	E653-L657 PolarHBondContact O-N 2.77Å; V654-L657 PolarHBondContact O-N 2.69Å; L657-T661 VanDerWaalsContact O-CB 3.26Å; L657-T661 WeakPolarHBondContact O-CB 3.42Å; L657-T661 PolarHBondContact O-N 2.9Å; L657-T661 PolarHBondContact O-OG1 3.2Å
658	L	44	Very low	43.1	Very low	104 Å²	104	113.2 Å²	113.2	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-65.1	-38.5	172.9	-78.1	165.4	0	0	0	112	V654 R656 L662	V654-L658 HydrophobicContact CG1-CD1 3.96Å; V654-L658 WeakPolarHBondContact O-CB 2.98Å; V654-L658 WeakPolarHBondContact O-CG 3.4Å; V654-L658 PolarHBondContact O-N 2.84Å; R656-L658 VanDerWaalsContact C-N 3.33Å; R656-L658 PolarHBondContact O-N 2.96Å; L658-L662 WeakPolarHBondContact O-CB 3.39Å; L658-L662 WeakPolarHBondContact O-CD1 3.23Å; L658-L662 VanDerWaalsContact O-CG 3.28Å; L658-L662 WeakPolarHBondContact O-CG 3.33Å; L658-L662 PolarHBondContact O-N 3.08Å
659	Q	48.7	Very low	42.2	Very low	124 Å²	124	119.4 Å²	119.4	58%	0.579	62%	0.617	S	S	*	*	H	α-helix	trans	-66.5	-47.4	177.3	-162.7	69.3	77.2	0	0	111.6	M655 R656 L662 V663	M655-Q659 WeakPolarHBondContact O-CB 3.35Å; M655-Q659 PolarHBondContact O-N 2.89Å; R656-Q659 WeakPolarHBondContact O-CB 3.34Å; R656-Q659 PolarHBondContact O-N 2.85Å; R656-Q659 VanDerWaalsContact O-N 3.08Å; Q659-L662 PolarHBondContact O-N 3.37Å; Q659-V663 WeakPolarHBondContact O-CG2 3.38Å; Q659-V663 PolarHBondContact O-N 3.25Å; Q659-V663 VanDerWaalsContact O-N 3.13Å
660	D	45.4	Very low	41.3	Very low	78 Å²	78	122.9 Å²	122.9	42%	0.417	63%	0.634	S	S	.	*	H	α-helix	trans	-69.3	-38.2	-178.9	-68.3	-19.7	0	0	0	111.8	R656 L662 V663 T664	R656-D660 PolarHBondContact O-N 3.05Å; D660-L662 PolarHBondContact O-N 3.49Å; D660-V663 PolarHBondContact O-N 3.41Å; D660-T664 WeakPolarHBondContact O-CB 3.42Å; D660-T664 PolarHBondContact O-N 3.24Å; D660-T664 PolarHBondContact O-OG1 3.43Å
661	T	43.2	Very low	40.4	Very low	90 Å²	90	124.2 Å²	124.2	55%	0.552	64%	0.643	S	S	*	*	H	α-helix	trans	-65.6	-37.9	176.2	-54.4	0	0	0	0	111.7	L657 A665	L657-T661 VanDerWaalsContact O-CB 3.26Å; L657-T661 WeakPolarHBondContact O-CB 3.42Å; L657-T661 PolarHBondContact O-N 2.9Å; L657-T661 PolarHBondContact O-OG1 3.2Å; T661-A665 PolarHBondContact O-N 2.9Å
662	L	40.6	Very low	40	Very low	121 Å²	121	123.3 Å²	123.3	63%	0.634	65%	0.652	S	S	*	*	H	α-helix	trans	-73.6	-25.8	176.5	-74.3	171.4	0	0	0	113.6	L658 Q659 D660	L658-L662 WeakPolarHBondContact O-CB 3.39Å; L658-L662 WeakPolarHBondContact O-CD1 3.23Å; L658-L662 VanDerWaalsContact O-CG 3.28Å; L658-L662 WeakPolarHBondContact O-CG 3.33Å; L658-L662 PolarHBondContact O-N 3.08Å; Q659-L662 PolarHBondContact O-N 3.37Å; D660-L662 PolarHBondContact O-N 3.49Å
663	V	40.8	Very low	39.4	Very low	81 Å²	81	123.4 Å²	123.4	49%	0.491	66%	0.659	S	S	.	*	H	α-helix	trans	-75.3	-45.6	172.2	169.6	0	0	0	0	110.7	Q659 D660 A665 V666	Q659-V663 WeakPolarHBondContact O-CG2 3.38Å; Q659-V663 PolarHBondContact O-N 3.25Å; Q659-V663 VanDerWaalsContact O-N 3.13Å; D660-V663 PolarHBondContact O-N 3.41Å; V663-A665 PolarHBondContact O-N 3.12Å; V663-V666 PolarHBondContact O-N 2.86Å
664	T	40.4	Very low	39	Very low	108 Å²	108	124.6 Å²	124.6	66%	0.663	68%	0.675	S	S	*	*	H	α-helix	trans	-65.8	-23.7	-176.2	-49.2	0	0	0	0	112.9	D660 V666	D660-T664 WeakPolarHBondContact O-CB 3.42Å; D660-T664 PolarHBondContact O-N 3.24Å; D660-T664 PolarHBondContact O-OG1 3.43Å; T664-V666 VanDerWaalsContact C-N 3.28Å; T664-V666 PolarHBondContact O-N 2.78Å
665	A	38.5	Very low	38	Very low	86 Å²	86	125 Å²	125	71%	0.711	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-2.3	177.9	0	0	0	0	0	115.2	T661 V663	T661-A665 PolarHBondContact O-N 2.9Å; V663-A665 PolarHBondContact O-N 3.12Å
666	V	37.5	Very low	37.2	Very low	112 Å²	112	124.8 Å²	124.8	68%	0.679	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-27.9	-174.2	-178.9	0	0	0	0	113.4	V663 T664 V668	V663-V666 PolarHBondContact O-N 2.86Å; T664-V666 VanDerWaalsContact C-N 3.28Å; T664-V666 PolarHBondContact O-N 2.78Å; V666-V668 VanDerWaalsContact C-N 3.29Å; V666-V668 PolarHBondContact O-N 3.5Å; V666-V668 VanDerWaalsContact O-N 3.12Å
667	E	32.3	Very low	35.9	Very low	172 Å²	172	121.6 Å²	121.6	80%	0.804	71%	0.711	S	S	*	*	S	Bend	trans	-87.7	38.9	-175.4	-68.4	-164.6	128.8	0	0	115.1
668	V	30.8	Very low	35.2	Very low	132 Å²	132	120.5 Å²	120.5	80%	0.8	72%	0.717	S	S	*	*	S	Bend	trans	-126.4	50.4	163.4	-163.1	0	0	0	0	111.4	V666	V666-V668 VanDerWaalsContact C-N 3.29Å; V666-V668 PolarHBondContact O-N 3.5Å; V666-V668 VanDerWaalsContact O-N 3.12Å
669	R	24.2	Very low	34.4	Very low	232 Å²	232	126.4 Å²	126.4	88%	0.875	73%	0.734	S	S	*	*	S	Bend	trans	-159.4	116.4	152.1	-113	171.3	-165.6	-150	2.2	113.4
670	S	27.4	Very low	33.4	Very low	117 Å²	117	126.6 Å²	126.6	82%	0.818	74%	0.744	S	S	*	*			trans	81.9	108.4	157.5	-48.1	0	0	0	0	119.8
671	E	27.4	Very low	33.4	Very low	193 Å²	193	128.8 Å²	128.8	90%	0.902	76%	0.762	S	S	*	*			trans	-74.6	164.5	141.7	-55.4	-179.6	94.6	0	0	108.9
672	S	32.8	Very low	32.6	Very low	117 Å²	117	128 Å²	128	82%	0.818	77%	0.772	S	S	*	*			cis	-156.3	-174.7	25.6	56.5	0	0	0	0	113.7
673	L	32.7	Very low	32	Very low	162 Å²	162	129.4 Å²	129.4	85%	0.848	78%	0.78	S	S	*	*			trans	-66.2	172.2	-170.6	-69	160.2	0	0	0	115.6
674	P	41.4	Very low	31.3	Very low	118 Å²	118	132.1 Å²	132.1	77%	0.766	79%	0.791	S	S	*	*			cis	-149.3	171.7	24	44.4	-23.9	0	0	0	121.1
675	A	27.4	Very low	30.7	Very low	92 Å²	92	135 Å²	135	76%	0.76	80%	0.797	S	S	*	*			trans	65.2	116.5	142.9	0	0	0	0	0	124.6
676	S	28.2	Very low	30.1	Very low	130 Å²	130	137.7 Å²	137.7	91%	0.909	80%	0.8	S	S	*	*			trans	64.9	117.1	136.1	-176.6	0	0	0	0	122
677	G	26	Very low	29.4	Very low	77 Å²	77	136.8 Å²	136.8	79%	0.794	80%	0.797	S	S	*	*			trans	148.3	118.3	151.6	0	0	0	0	0	116.6
678	A	29.1	Very low	29.1	Very low	85 Å²	85	134.1 Å²	134.1	70%	0.702	79%	0.793	S	S	*	*			trans	-68.3	168.1	-173	0	0	0	0	0	118.2
679	Y	28.2	Very low	29	Very low	228 Å²	228	134.4 Å²	134.4	89%	0.894	79%	0.789	S	S	*	*			trans	91.4	150.8	162.6	-63.9	-75.5	0	0	0	120.5
680	T	28.2	Very low	29.1	Very low	128 Å²	128	131.3 Å²	131.3	79%	0.785	79%	0.785	S	S	*	*			trans	-102.2	179.5	-174.7	50.4	0	0	0	0	111.6
681	P	44.5	Very low	29.1	Very low	123 Å²	123	133 Å²	133	80%	0.799	78%	0.784	S	S	*	*			cis	-134.9	170.2	-22.6	29.2	-9.3	0	0	0	115.4
682	G	25.9	Very low	29.2	Very low	74 Å²	74	131.7 Å²	131.7	76%	0.763	78%	0.778	S	S	*	*			trans	120.4	135	133.5	0	0	0	0	0	121.5
683	N	29	Very low	30	Very low	150 Å²	150	130.5 Å²	130.5	80%	0.802	77%	0.768	S	S	*	*			trans	56.4	116.3	153.6	-85.5	8	0	0	0	124.1
684	L	26.1	Very low	29.6	Very low	138 Å²	138	127.1 Å²	127.1	72%	0.723	76%	0.763	S	S	*	*				56.4	125.6	126.8	-71.6	164.2	0	0	0	123.3
685	Q	28	Very low	30.1	Very low	169 Å²	169	127.1 Å²	127.1	79%	0.79	76%	0.763	S	S	*	*			trans	82.1	101.2	141.2	-73.8	177.3	-66.2	0	0	122.6
686	D	25	Very low	30.2	Very low	143 Å²	143	127.1 Å²	127.1	77%	0.765	76%	0.763	S	S	*	*				106.5	140.7	109.8	-151.7	20.5	0	0	0	122.4
687	C	23.3	Very low	30.1	Very low	92 Å²	92	127.7 Å²	127.7	62%	0.622	76%	0.761	S	S	*	*			trans	63.1	125.6	157	-84.2	0	0	0	0	126.9
688	T	26.2	Very low	30.1	Very low	116 Å²	116	128.6 Å²	128.6	71%	0.712	76%	0.755	S	S	*	*				89.3	117.2	127.8	51.8	0	0	0	0	126.8
689	L	28.3	Very low	30.2	Very low	138 Å²	138	130.6 Å²	130.6	72%	0.723	76%	0.758	S	S	*	*				86.9	127.1	125.2	-65.5	168.7	0	0	0	125.9
690	E	26.8	Very low	30.1	Very low	168 Å²	168	129 Å²	129	79%	0.785	76%	0.759	S	S	*	*			trans	66	154.4	143.2	-65.4	170.7	-175.8	0	0	120.2
691	D	26.3	Very low	30	Very low	151 Å²	151	131.3 Å²	131.3	81%	0.807	76%	0.761	S	S	*	*			cis	-152.7	-177.5	14.6	-155.7	0.7	0	0	0	114.9
692	E	30	Very low	30.2	Very low	167 Å²	167	129.9 Å²	129.9	78%	0.78	75%	0.752	S	S	*	*			trans	-75.6	-168.6	-175.2	-104.2	-145.4	134.6	0	0	117.8
693	P	49	Very low	30.2	Very low	92 Å²	92	131.9 Å²	131.9	60%	0.597	75%	0.754	S	S	*	*			cis	-145.5	167.2	-44.8	40.1	-22.2	0	0	0	119.3
694	A	25.9	Very low	31	Very low	91 Å²	91	130.8 Å²	130.8	75%	0.752	76%	0.755	S	S	*	*			trans	42.7	-175.7	132.5	0	0	0	0	0	123.2
695	P	51.9	Low	31	Very low	118 Å²	118	131.4 Å²	131.4	77%	0.766	76%	0.764	S	S	*	*			cis	-139.2	-174.2	-6.7	44.5	-26.5	0	0	0	118.1
696	A	28.1	Very low	30.9	Very low	92 Å²	92	127.3 Å²	127.3	76%	0.76	76%	0.759	S	S	*	*			trans	77.9	146.3	154.6	0	0	0	0	0	120.1
697	V	27.3	Very low	30.8	Very low	142 Å²	142	128.5 Å²	128.5	86%	0.861	77%	0.765	S	S	*	*			cis	-157.3	164.9	-5.7	121.7	0	0	0	0	110.4
698	S	25.3	Very low	30.9	Very low	96 Å²	96	129.3 Å²	129.3	67%	0.671	77%	0.771	S	S	*	*			trans	-99.3	-168.5	-175.7	50.4	0	0	0	0	114.2
699	V	32.1	Very low	30.8	Very low	127 Å²	127	128 Å²	128	77%	0.77	77%	0.773	S	S	*	*			cis	-162.6	171.2	28.7	-131.4	0	0	0	0	113.9
700	E	25.8	Very low	30.6	Very low	194 Å²	194	126.9 Å²	126.9	91%	0.907	77%	0.771	S	S	*	*			trans	79.2	158.2	153.1	-81.6	-176	143.4	0	0	123.9
701	E	25.3	Very low	30.7	Very low	177 Å²	177	127.8 Å²	127.8	83%	0.827	78%	0.776	S	S	*	*			trans	-131.7	-167.4	-174	-130.9	-155.4	142.6	0	0	108.1
702	P	49.5	Very low	30.6	Very low	93 Å²	93	128.2 Å²	128.2	60%	0.604	78%	0.778	S	S	*	*			cis	-128.2	167.8	-28.9	39.3	-25.6	0	0	0	113.7
703	S	25.6	Very low	30.6	Very low	116 Å²	116	124.4 Å²	124.4	81%	0.811	78%	0.775	S	S	*	*			trans	158.8	138.8	143.1	-77.6	0	0	0	0	113.3
704	P	45.7	Very low	29.5	Very low	126 Å²	126	126.2 Å²	126.2	82%	0.818	78%	0.784	S	S	*	*			trans	-99.3	145.4	180	36.5	-33.2	0	0	0	115
705	V	25.3	Very low	29.6	Very low	151 Å²	151	128.2 Å²	128.2	92%	0.915	79%	0.787	S	S	*	*			trans	-138.3	141.9	163.3	178	0	0	0	0	108.3
706	A	25.7	Very low	28.5	Very low	84 Å²	84	126.5 Å²	126.5	69%	0.694	78%	0.783	S	S	*	*			trans	-79.4	152.3	-178.5	0	0	0	0	0	113.3
707	L	23.6	Very low	28.3	Very low	168 Å²	168	129.9 Å²	129.9	88%	0.88	79%	0.788	S	S	*	*				-174.4	160.8	121.2	-99.5	166.3	0	0	0	114.1
708	S	25.3	Very low	28.2	Very low	108 Å²	108	126.1 Å²	126.1	76%	0.755	78%	0.777	S	S	*	*			trans	-55.4	152.5	-177.4	52.9	0	0	0	0	118.5
709	A	24.7	Very low	28.3	Very low	90 Å²	90	130.7 Å²	130.7	74%	0.744	79%	0.788	S	S	*	*			trans	-146.8	119.4	150	0	0	0	0	0	111.8
710	T	24.3	Very low	29	Very low	113 Å²	113	129.2 Å²	129.2	69%	0.693	78%	0.781	S	S	*	*			trans	28.6	119	133.2	54.7	0	0	0	0	119.2
711	E	28.1	Very low	29	Very low	187 Å²	187	125.3 Å²	125.3	87%	0.874	78%	0.776	S	S	*	*				67.1	125	77.8	-72.6	-172.9	131.7	0	0	114.5
712	D	23.5	Very low	29.1	Very low	161 Å²	161	121 Å²	121	86%	0.861	77%	0.77	S	S	*	*			trans	-150	142.2	148.1	-146.7	-20.5	0	0	0	109.8
713	A	31.2	Very low	28	Very low	86 Å²	86	122 Å²	122	71%	0.711	78%	0.78	S	S	*	*			trans	-158.8	133.5	-169.4	0	0	0	0	0	114.5
714	V	26.1	Very low	28.2	Very low	130 Å²	130	127.7 Å²	127.7	79%	0.788	78%	0.783	S	S	*	*			trans	-145.9	114.2	176.7	-166.8	0	0	0	0	106.5
715	V	27.2	Very low	27.4	Very low	134 Å²	134	128.7 Å²	128.7	81%	0.812	78%	0.782	S	S	*	*				70.3	133.1	62.1	177.7	0	0	0	0	111
716	A	28.6	Very low	27.5	Very low	82 Å²	82	128.7 Å²	128.7	68%	0.678	78%	0.782	S	S	*	*			cis	-132.4	-162.1	4	0	0	0	0	0	109.3
717	D	23.9	Very low	27.5	Very low	163 Å²	163	127.7 Å²	127.7	87%	0.872	78%	0.78	S	S	*	*			cis	-157.5	179.7	2	-144.8	-30.9	0	0	0	109.2
718	G	25.8	Very low	28.1	Very low	62 Å²	62	125.4 Å²	125.4	64%	0.639	78%	0.778	S	S	*	*			trans	-162.5	154.8	177.2	0	0	0	0	0	118.8
719	E	27.8	Very low	28.4	Very low	192 Å²	192	125.4 Å²	125.4	90%	0.897	77%	0.774	S	S	*	*			trans	-154.4	163.2	172.3	-99.5	-99.2	106.5	0	0	110.6
720	P	46.2	Very low	28.8	Very low	96 Å²	96	127.8 Å²	127.8	62%	0.623	77%	0.773	S	S	*	*			trans	-133.1	177	-141.5	45	-33.2	0	0	0	119.6
721	S	25.2	Very low	29.1	Very low	113 Å²	113	128.6 Å²	128.6	79%	0.79	77%	0.772	S	S	*	*			trans	88.8	128.7	145.1	80.2	0	0	0	0	121.4
722	A	28	Very low	29.2	Very low	87 Å²	87	126 Å²	126	72%	0.719	76%	0.763	S	S	*	*				158.3	131.6	107	0	0	0	0	0	115.8
723	S	26.7	Very low	29.6	Very low	114 Å²	114	124.7 Å²	124.7	80%	0.797	75%	0.752	S	S	*	*			trans	74.7	152.1	156.5	89.1	0	0	0	0	118.9
724	R	29.6	Very low	29.5	Very low	235 Å²	235	127.7 Å²	127.7	89%	0.887	75%	0.751	S	S	*	*			cis	-154.5	152.2	-1.7	-140.8	168.8	-175.2	164	0	114.2
725	N	29	Very low	29.7	Very low	147 Å²	147	127.5 Å²	127.5	79%	0.786	75%	0.75	S	S	*	*			trans	-71.2	157.6	-174.3	-44.7	-15.3	0	0	0	116.5
726	T	26.2	Very low	30.8	Very low	151 Å²	151	125.8 Å²	125.8	93%	0.926	74%	0.742	S	S	*	*				-157.3	131.6	118.1	44.6	0	0	0	0	110
727	G	27.1	Very low	31	Very low	62 Å²	62	130.1 Å²	130.1	64%	0.639	75%	0.748	S	S	*	*			cis	169.4	139.2	-17.2	0	0	0	0	0	113.8
728	S	35.7	Very low	31.3	Very low	120 Å²	120	128 Å²	128	84%	0.839	74%	0.741	S	S	*	*			trans	66.3	139.2	152.5	-63.5	0	0	0	0	119.7
729	T	32.2	Very low	31.4	Very low	109 Å²	109	132.1 Å²	132.1	67%	0.669	75%	0.747	S	S	*	*			cis	-170.1	128.8	1.1	-117.3	0	0	0	0	114.5
730	L	32	Very low	31.3	Very low	140 Å²	140	133.5 Å²	133.5	73%	0.733	74%	0.744	S	S	*	*			trans	64.4	152.4	142.6	-50.2	-176.5	0	0	0	121.3
731	L	30.8	Very low	30.3	Very low	129 Å²	129	135.5 Å²	135.5	68%	0.675	75%	0.748	S	S	*	*			cis	-167.9	156.4	-11.8	-104.7	170.8	0	0	0	112.2
732	I	31.3	Very low	30.2	Very low	133 Å²	133	138.1 Å²	138.1	68%	0.682	75%	0.748	S	S	*	*			trans	72.3	147.6	140.7	-73.4	171.4	0	0	0	121.4
733	Q	30.3	Very low	31	Very low	134 Å²	134	138.9 Å²	138.9	63%	0.626	75%	0.746	S	S	*	*			cis	-175.9	141.1	-27.8	-162.3	166.9	-22	0	0	110.9
734	Q	30.1	Very low	31	Very low	148 Å²	148	142.6 Å²	142.6	69%	0.692	75%	0.748	S	S	*	*			trans	42.6	128.5	148.7	-67.3	166.6	-17.6	0	0	121.2
735	T	29.6	Very low	31	Very low	126 Å²	126	138 Å²	138	77%	0.773	74%	0.74	S	S	*	*				64.6	163.4	68.5	72.4	0	0	0	0	113.8
736	P	49.9	Very low	31.4	Very low	99 Å²	99	138.8 Å²	138.8	64%	0.643	74%	0.739	S	S	*	*			cis	-146.1	176.1	17.2	46.1	-26.4	0	0	0	119.9
737	E	32.6	Very low	31.3	Very low	173 Å²	173	141.1 Å²	141.1	81%	0.808	74%	0.736	S	S	*	*			trans	46.6	161.1	139.6	-72.8	177.3	87.1	0	0	123.1
738	V	30.3	Very low	31.2	Very low	118 Å²	118	147.2 Å²	147.2	72%	0.715	75%	0.745	S	S	*	*			cis	-131.4	-150.8	0.6	-128.1	0	0	0	0	109
739	I	28.1	Very low	31.6	Very low	148 Å²	148	147.7 Å²	147.7	76%	0.759	75%	0.745	S	S	*	*			cis	-147.3	125.9	13.6	-59.8	169.3	0	0	0	110.7
740	R	27.1	Very low	31.1	Very low	222 Å²	222	146.4 Å²	146.4	84%	0.838	75%	0.753	S	S	*	*				26	137.5	127.9	-112.1	-179	-178.8	156.7	1.7	119.8
741	L	24.8	Very low	31	Very low	137 Å²	137	144.4 Å²	144.4	72%	0.717	75%	0.747	S	S	*	*			cis	-154.9	150.5	36.5	-84	157.7	0	0	0	113.8
742	Q	23.7	Very low	32.2	Very low	169 Å²	169	140.1 Å²	140.1	79%	0.79	73%	0.727	S	S	*	*			trans	27.8	163.9	138.1	-70.9	-162	22.1	0	0	124.1
743	P	44.1	Very low	32.9	Very low	103 Å²	103	138 Å²	138	67%	0.669	72%	0.722	S	S	*	*			cis	-142.1	177.4	-34.8	40.2	-22.6	0	0	0	115.5
744	K	26.1	Very low	33.2	Very low	192 Å²	192	136.6 Å²	136.6	84%	0.835	72%	0.724	S	S	*	*			trans	55.6	99	151.7	-158	172.4	-173.3	175.4	0	118.6
745	L	29.8	Very low	33.1	Very low	137 Å²	137	132.4 Å²	132.4	72%	0.717	72%	0.715	S	S	*	*				92	114	74.1	-166.1	77.7	0	0	0	115
746	E	36.7	Very low	34.1	Very low	165 Å²	165	132 Å²	132	77%	0.771	72%	0.715	S	S	*	*			trans	49.7	108.9	156.1	-65.4	178.6	130.7	0	0	122.7
747	K	25.3	Very low	33.6	Very low	199 Å²	199	133.7 Å²	133.7	87%	0.865	73%	0.726	S	S	*	*				-172.8	165.1	123.6	-116.4	170.3	-175.9	171.4	0	114.2
748	K	24.4	Very low	33.6	Very low	190 Å²	190	129.7 Å²	129.7	83%	0.826	72%	0.722	S	S	*	*			trans	76.8	141.9	150.4	-82.4	178	175.6	-176.1	0	121
749	P	43.8	Very low	33.7	Very low	131 Å²	131	130.7 Å²	130.7	85%	0.851	73%	0.729	S	S	*	*			trans	-75.9	154.4	148.5	35	-33	0	0	0	110.9
750	G	22.8	Very low	33.9	Very low	81 Å²	81	128.3 Å²	128.3	84%	0.835	73%	0.731	S	S	*	*			trans	-147.2	117.6	-172.3	0	0	0	0	0	115
751	T	30	Very low	34.1	Very low	98 Å²	98	122.8 Å²	122.8	60%	0.601	73%	0.733	S	S	*	*			trans	-76.3	175.9	175.8	14.4	0	0	0	0	113.3	N502	N502-T751 VanDerWaalsContact CG-OG1 3.27Å; N502-T751 VanDerWaalsContact ND2-CB 3.32Å; N502-T751 WeakPolarHBondContact ND2-CB 3.49Å; N502-T751 PolarHBondContact ND2-OG1 3.09Å; N502-T751 VanDerWaalsContact OD1-CB 3.23Å; N502-T751 WeakPolarHBondContact OD1-CB 3.44Å; N502-T751 PolarHBondContact OD1-OG1 3.29Å
752	P	54.4	Low	34.7	Very low	40 Å²	40	121.7 Å²	121.7	26%	0.26	74%	0.737	S	S	.	*			trans	-94	-176.6	-157.9	43.5	-42.9	0	0	0	113.8	Q500 S501	Q500-P752 HydrophobicContact CB-CB 4.43Å; Q500-P752 HydrophobicContact CB-CG 3.63Å; Q500-P752 VanDerWaalsContact CD-CG 3.45Å; Q500-P752 HydrophobicContact CG-CB 4.34Å; Q500-P752 HydrophobicContact CG-CG 3.64Å; S501-P752 WeakPolarHBondContact OG-CG 3.26Å
753	P	46.3	Very low	35.6	Very low	87 Å²	87	119.7 Å²	119.7	57%	0.565	74%	0.739	S	S	*	*				-152	-134.5	84.1	43.6	-22.1	0	0	0	110.6
754	P	36.6	Very low	35.7	Very low	105 Å²	105	120.6 Å²	120.6	68%	0.682	74%	0.744	S	S	*	*			cis	-121.2	-166	-44.3	40.5	-25.7	0	0	0	112.3
755	A	28.6	Very low	36.9	Very low	60 Å²	60	117 Å²	117	50%	0.496	74%	0.74	S	S	.	*			trans	-143.7	166.7	162.3	0	0	0	0	0	110.9
756	P	50.4	Low	37.2	Very low	119 Å²	119	117.1 Å²	117.1	77%	0.773	75%	0.747	S	S	*	*			cis	-118.6	-169.7	-26.4	39.3	-24.2	0	0	0	111.5
757	P	39.4	Very low	37.7	Very low	133 Å²	133	113.9 Å²	113.9	86%	0.864	74%	0.74	S	S	*	*				-138.2	177	105.2	39	-28.5	0	0	0	113.4
758	A	33.6	Very low	38.2	Very low	89 Å²	89	115.9 Å²	115.9	74%	0.736	74%	0.743	S	S	*	*			trans	-118.9	148.8	-172.6	0	0	0	0	0	113.5
759	T	32.3	Very low	38.9	Very low	139 Å²	139	111.7 Å²	111.7	85%	0.853	74%	0.737	S	S	*	*				-175.3	124.4	123.5	27.6	0	0	0	0	114.4
760	A	31.5	Very low	39.1	Very low	99 Å²	99	111.6 Å²	111.6	82%	0.818	74%	0.736	S	S	*	*			trans	43.2	145.4	136.8	0	0	0	0	0	125.6
761	A	31.6	Very low	39.9	Very low	105 Å²	105	113.2 Å²	113.2	87%	0.868	74%	0.735	S	S	*	*			trans	105.2	148.4	145.5	0	0	0	0	0	119.8
762	S	38.4	Very low	40.3	Very low	115 Å²	115	114.3 Å²	114.3	80%	0.804	74%	0.744	S	S	*	*			trans	-123.8	167.1	-163.4	-42.5	0	0	0	0	113.6
763	P	41.1	Very low	40	Very low	127 Å²	127	118.2 Å²	118.2	83%	0.825	77%	0.769	S	S	*	*			trans	-135.5	175.7	132.3	16.9	5.9	0	0	0	114.5
764	P	46.9	Very low	40.1	Very low	121 Å²	121	120.3 Å²	120.3	79%	0.786	78%	0.783	S	S	*	*			trans	-115.6	174.6	-157.3	42.2	-34.3	0	0	0	117.5
765	P	51.9	Low	40.2	Very low	116 Å²	116	119.4 Å²	119.4	75%	0.753	78%	0.784	S	S	*	*			trans	-107.8	167.6	-178.7	40.8	-35.4	0	0	0	115.8
766	T	34.3	Very low	41.2	Very low	140 Å²	140	122.5 Å²	122.5	86%	0.859	80%	0.799	S	S	*	*			trans	175	172.6	160.3	18.1	0	0	0	0	110.8
767	P	48.7	Very low	41	Very low	97 Å²	97	122.8 Å²	122.8	63%	0.63	80%	0.798	S	S	*	*			cis	-142.9	156.4	-31.7	37.1	-18.5	0	0	0	118
768	R	36.1	Very low	41.7	Very low	242 Å²	242	123.9 Å²	123.9	91%	0.913	80%	0.795	S	S	*	*			trans	67.7	161.7	140	-73.2	172.3	-170.8	-131.8	-1.2	120.1
769	S	38.2	Very low	42.4	Very low	102 Å²	102	125.5 Å²	125.5	71%	0.713	80%	0.796	S	S	*	*			cis	-179.8	-177.3	-10.4	51.3	0	0	0	0	109.7
770	P	47.6	Very low	43.6	Very low	128 Å²	128	124.4 Å²	124.4	83%	0.831	79%	0.789	S	S	*	*			cis	-123.7	-165.9	-32.4	39.3	-21.7	0	0	0	112.8
771	S	39.3	Very low	44.8	Very low	115 Å²	115	124.9 Å²	124.9	80%	0.804	78%	0.784	S	S	*	*			trans	-145.4	157.1	-179.6	54.2	0	0	0	0	116.9
772	P	39.1	Very low	46.1	Very low	122 Å²	122	125.4 Å²	125.4	79%	0.792	78%	0.778	S	S	*	*			trans	-100.1	178.8	177.3	41.4	-36.5	0	0	0	114.1
773	P	48.3	Very low	47.2	Very low	122 Å²	122	125.4 Å²	125.4	79%	0.792	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-92.7	166.7	-155.4	36.8	-36.9	0	0	0	117.2
774	P	48.8	Very low	48.2	Very low	130 Å²	130	125.2 Å²	125.2	84%	0.844	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-88.8	162.2	-174.5	36.1	-37.4	0	0	0	115.7
775	A	39	Very low	48.9	Very low	86 Å²	86	124.2 Å²	124.2	71%	0.711	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-103.6	161.3	169.2	0	0	0	0	0	111
776	P	48.5	Very low	50	Low	125 Å²	125	124.7 Å²	124.7	81%	0.812	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-77.5	134.8	-167	30.1	-35	0	0	0	113.8
777	V	47	Very low	52.3	Low	125 Å²	125	125.2 Å²	125.2	76%	0.758	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-83	121.7	170.4	178.5	0	0	0	0	109.5	V779	V777-V779 HydrophobicContact CG1-CG2 4.39Å; V777-V779 PolarHBondContact O-N 3.43Å
778	I	53	Low	54	Low	156 Å²	156	126.6 Å²	126.6	80%	0.8	78%	0.775	S	S	*	*			trans	-78.3	113.3	167.6	-62.1	175	0	0	0	107.5	T780	I778-T780 PolarHBondContact O-N 3.35Å
779	V	49.2	Very low	56.5	Low	124 Å²	124	119.7 Å²	119.7	75%	0.752	76%	0.762	S	S	*	*			trans	-86.6	104	177	-178.5	0	0	0	0	109.2	V777	V777-V779 HydrophobicContact CG1-CG2 4.39Å; V777-V779 PolarHBondContact O-N 3.43Å
780	T	56.3	Low	58.9	Low	115 Å²	115	122.6 Å²	122.6	71%	0.706	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-72.3	138.7	162.3	40.3	0	0	0	0	110.1	I778	I778-T780 PolarHBondContact O-N 3.35Å
781	P	57.6	Low	60.9	Low	110 Å²	110	124.7 Å²	124.7	71%	0.714	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-68.6	153.2	177.3	29.9	-35.1	0	0	0	111.5
782	P	58.4	Low	63.3	Low	115 Å²	115	127.1 Å²	127.1	75%	0.747	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-65.8	155	173.5	29.6	-35.4	0	0	0	111.4
783	P	62	Low	65.8	Low	116 Å²	116	124.9 Å²	124.9	75%	0.753	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-62.4	151.3	174.9	27.8	-35	0	0	0	111.3	A785	P783-A785 PolarHBondContact O-N 2.7Å
784	P	62.5	Low	67.4	Low	123 Å²	123	121.8 Å²	121.8	80%	0.799	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-63.8	133.5	178.9	27.3	-34.4	0	0	0	110.8	V786	P784-V786 PolarHBondContact O-N 3.26Å
785	A	61.2	Low	69.2	Low	99 Å²	99	119.9 Å²	119.9	82%	0.818	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-63.5	125.6	176.8	0	0	0	0	0	110.6	P783 N787	P783-A785 PolarHBondContact O-N 2.7Å; A785-N787 PolarHBondContact O-N 3.05Å; A785-N787 VanDerWaalsContact O-N 3.16Å
786	V	74.3	Confident	71.6	Confident	127 Å²	127	116 Å²	116	77%	0.77	65%	0.647	S	S	*	*			trans	-69.5	111.3	177	-178.6	0	0	0	0	108.7	P784 I788	P784-V786 PolarHBondContact O-N 3.26Å; V786-I788 HydrophobicContact CG1-CG1 4.06Å; V786-I788 PolarHBondContact O-N 3.26Å
787	N	82.9	Confident	73.4	Confident	151 Å²	151	115.6 Å²	115.6	81%	0.807	64%	0.637	S	S	*	*			trans	-78.9	84.5	179.3	-172.7	9.2	0	0	0	110.1	A785 P789	A785-N787 PolarHBondContact O-N 3.05Å; A785-N787 VanDerWaalsContact O-N 3.16Å; N787-P789 WeakPolarHBondContact O-CD 3.47Å
788	I	85.9	Confident	75.1	Confident	125 Å²	125	112.2 Å²	112.2	64%	0.641	62%	0.618	S	S	*	*			trans	-73.2	115.3	173.6	-57.4	177.2	0	0	0	107.9	V786	V786-I788 HydrophobicContact CG1-CG1 4.06Å; V786-I788 PolarHBondContact O-N 3.26Å
789	P	87.6	Confident	76.2	Confident	97 Å²	97	109 Å²	109	63%	0.63	62%	0.615	S	S	*	*			trans	-67.2	155.6	176.3	30.2	-35.1	0	0	0	110.5	N787 F791	N787-P789 WeakPolarHBondContact O-CD 3.47Å; P789-F791 PolarHBondContact O-N 2.8Å
790	R	88.2	Confident	76.7	Confident	163 Å²	163	109.6 Å²	109.6	62%	0.615	62%	0.621	S	S	*	*			trans	-58.1	128.8	170.3	179.3	179	176.2	167.4	3	109.2	Y792 Y793	R790-Y792 PolarHBondContact NE-O 3.37Å; R790-Y792 PolarHBondContact NH2-O 3.45Å; R790-Y793 HydrophobicContact CG-CE1 4.07Å; R790-Y793 HydrophobicContact CG-CE2 4.05Å; R790-Y793 WeakPolarHBondContact O-CE2 3.41Å; R790-Y793 PolarHBondContact O-OH 2.66Å
791	F	89.7	Confident	76.8	Confident	173 Å²	173	106.9 Å²	106.9	76%	0.759	62%	0.615	S	S	*	*			trans	-116.2	-20.9	178	59.8	-89.8	0	0	0	113.2	P789 Y793	P789-F791 PolarHBondContact O-N 2.8Å; F791-Y793 VanDerWaalsContact O-CD2 3.31Å; F791-Y793 WeakPolarHBondContact O-CD2 3.45Å
792	Y	90.8	Very high	76.5	Confident	166 Å²	166	107.4 Å²	107.4	65%	0.651	62%	0.619	S	S	*	*			trans	-93.5	117.4	-177.2	-174.9	-117.6	0	0	0	112.8	R790 P794	R790-Y792 PolarHBondContact NE-O 3.37Å; R790-Y792 PolarHBondContact NH2-O 3.45Å; Y792-P794 HydrophobicContact CD1-CG 4.08Å; Y792-P794 HydrophobicContact CE1-CG 3.48Å; Y792-P794 VanDerWaalsContact CE1-CG 3.48Å; Y792-P794 HydrophobicContact CE2-CG 4.33Å
793	Y	90.5	Very high	76.4	Confident	75 Å²	75	106.7 Å²	106.7	29%	0.294	61%	0.613	S	S	.	*			trans	-138.5	82.4	-173.3	-65.2	-84.1	0	0	0	111.9	R790 F791 R795 G796 L797 P798	R790-Y793 HydrophobicContact CG-CE1 4.07Å; R790-Y793 HydrophobicContact CG-CE2 4.05Å; R790-Y793 WeakPolarHBondContact O-CE2 3.41Å; R790-Y793 PolarHBondContact O-OH 2.66Å; F791-Y793 VanDerWaalsContact O-CD2 3.31Å; F791-Y793 WeakPolarHBondContact O-CD2 3.45Å; Y793-R795 VanDerWaalsContact C-N 3.28Å; Y793-R795 PolarHBondContact O-N 2.98Å; Y793-G796 WeakPolarHBondContact CB-O 3.45Å; Y793-G796 PolarHBondContact O-N 2.9Å; Y793-L797 HydrophobicContact CD1-CD1 4.24Å; Y793-L797 HydrophobicContact CD2-CD1 3.62Å; Y793-L797 HydrophobicContact CE1-CD1 4.04Å; Y793-L797 HydrophobicContact CE2-CD1 3.42Å; Y793-L797 VanDerWaalsContact CE2-CD1 3.42Å; Y793-L797 HydrophobicContact CG-CD1 4.03Å; Y793-P798 VanDerWaalsContact CD1-CD 3.42Å; Y793-P798 HydrophobicContact CD1-CG 4.22Å; Y793-P798 HydrophobicContact CE1-CG 4.2Å
794	P	82.8	Confident	76	Confident	57 Å²	57	104.8 Å²	104.8	37%	0.37	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.8	-32.3	-173.4	-27.8	35.3	0	0	0	115.6	Y792 R952	Y792-P794 HydrophobicContact CD1-CG 4.08Å; Y792-P794 HydrophobicContact CE1-CG 3.48Å; Y792-P794 VanDerWaalsContact CE1-CG 3.48Å; Y792-P794 HydrophobicContact CE2-CG 4.33Å; P794-R952 PolarHBondContact O-NH1 2.87Å; P794-R952 VanDerWaalsContact O-NH1 3.16Å; P794-R952 PolarHBondContact O-NH2 3.19Å
795	R	86.9	Confident	76.5	Confident	90 Å²	90	104.5 Å²	104.5	34%	0.34	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.8	33.5	-176.2	-56.7	-174.9	179.7	-104.5	-2	112.3	Y793 S874 H876 S880 M948	Y793-R795 VanDerWaalsContact C-N 3.28Å; Y793-R795 PolarHBondContact O-N 2.98Å; R795-S874 WeakPolarHBondContact CB-O 3.42Å; R795-S874 WeakPolarHBondContact CD-O 3.26Å; R795-H876 WeakPolarHBondContact O-CB 3.44Å; R795-H876 PolarHBondContact O-CD2 3.39Å; R795-H876 PolarHBondContact O-N 2.68Å; R795-S880 PolarHBondContact O-OG 2.88Å; R795-M948 HydrophobicContact CG-SD 4.31Å
796	G	87.4	Confident	77.6	Confident	5 Å²	5	102 Å²	102	5%	0.052	57%	0.57	C	S	.	*			trans	82.2	161.2	-175.7	0	0	0	0	0	113.4	Y793 P798 H876 D877 R952	Y793-G796 WeakPolarHBondContact CB-O 3.45Å; Y793-G796 PolarHBondContact O-N 2.9Å; G796-P798 WeakPolarHBondContact O-CD 3.26Å; G796-H876 PolarHBondContact O-CD2 3.49Å; G796-D877 WeakPolarHBondContact CA-OD2 3.21Å; G796-D877 PolarHBondContact N-OD2 3.45Å; G796-R952 VanDerWaalsContact N-NH2 3.19Å
797	L	86.8	Confident	78.2	Confident	115 Å²	115	101.7 Å²	101.7	60%	0.602	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-75.6	121.5	176.7	-178.5	68	0	0	0	109.8	Y793 A799	Y793-L797 HydrophobicContact CD1-CD1 4.24Å; Y793-L797 HydrophobicContact CD2-CD1 3.62Å; Y793-L797 HydrophobicContact CE1-CD1 4.04Å; Y793-L797 HydrophobicContact CE2-CD1 3.42Å; Y793-L797 VanDerWaalsContact CE2-CD1 3.42Å; Y793-L797 HydrophobicContact CG-CD1 4.03Å; L797-A799 PolarHBondContact O-N 3.12Å
798	P	84	Confident	78.5	Confident	55 Å²	55	97.1 Å²	97.1	36%	0.357	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-60.4	135.2	174.5	-19.2	29.8	0	0	0	111	Y793 G796	Y793-P798 VanDerWaalsContact CD1-CD 3.42Å; Y793-P798 HydrophobicContact CD1-CG 4.22Å; Y793-P798 HydrophobicContact CE1-CG 4.2Å; G796-P798 WeakPolarHBondContact O-CD 3.26Å
799	A	74.4	Confident	78.7	Confident	89 Å²	89	92.9 Å²	92.9	74%	0.736	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-59.4	128.9	-178.8	0	0	0	0	0	111.4	L797 G801	L797-A799 PolarHBondContact O-N 3.12Å; A799-G801 PolarHBondContact O-N 3.47Å
800	P	60.4	Low	78.9	Confident	136 Å²	136	88.5 Å²	88.5	88%	0.883	50%	0.498	S	S	*	.	S	Bend	trans	-76.9	88.9	-174.8	29.8	-35	0	0	0	112
801	G	58.5	Low	79.2	Confident	57 Å²	57	83 Å²	83	59%	0.588	49%	0.487	S	S	*	.	S	Bend	trans	179.9	-175.5	175.1	0	0	0	0	0	112.6	A799	A799-G801 PolarHBondContact O-N 3.47Å
802	P	51.7	Low	79.4	Confident	122 Å²	122	76.7 Å²	76.7	79%	0.792	47%	0.468	S	S	*	.	S	Bend	trans	-59.7	160.5	157	30.7	-35	0	0	0	109.9	A804	P802-A804 PolarHBondContact O-N 2.7Å
803	T	55.7	Low	79.6	Confident	100 Å²	100	68.8 Å²	68.8	61%	0.613	44%	0.437	S	S	*	.			trans	-68.4	69.2	-177.1	48	0	0	0	0	112.8
804	A	54.8	Low	79.9	Confident	76 Å²	76	69.4 Å²	69.4	63%	0.628	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	139.4	-179	0	0	0	0	0	110.9	P802 H806	P802-A804 PolarHBondContact O-N 2.7Å; A804-H806 PolarHBondContact O-N 2.75Å
805	N	72.3	Confident	80.5	Confident	117 Å²	117	71.3 Å²	71.3	63%	0.626	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	-4.7	177.6	-68.7	3.3	0	0	0	119	D807 A808 T809	N805-D807 PolarHBondContact O-N 2.99Å; N805-A808 HydrophobicContact CB-CB 4.4Å; N805-A808 PolarHBondContact O-N 3.14Å; N805-A808 VanDerWaalsContact O-N 3.11Å; N805-T809 WeakPolarHBondContact O-CB 3.48Å; N805-T809 PolarHBondContact O-N 2.75Å; N805-T809 PolarHBondContact O-OG1 2.76Å
806	H	84.5	Confident	80.9	Confident	46 Å²	46	67.6 Å²	67.6	21%	0.213	44%	0.442	C	S	.	.	H	α-helix	trans	-54.8	-53.4	176.9	-78.7	-158.8	0	0	0	112.2	A804 A808 I810 L872	A804-H806 PolarHBondContact O-N 2.75Å; H806-A808 VanDerWaalsContact C-N 3.31Å; H806-A808 PolarHBondContact O-N 2.98Å; H806-I810 VanDerWaalsContact O-CG1 3.28Å; H806-I810 WeakPolarHBondContact O-CG1 3.4Å; H806-I810 PolarHBondContact O-N 2.73Å; H806-I810 VanDerWaalsContact O-N 3.1Å; H806-L872 PolarHBondContact CE1-O 3.33Å
807	D	86.9	Confident	81.3	Confident	120 Å²	120	67.4 Å²	67.4	64%	0.642	44%	0.439	S	S	*	.	H	α-helix	trans	-70.7	-26.2	177.9	-59.5	-47.4	0	0	0	112.9	N805 A811	N805-D807 PolarHBondContact O-N 2.99Å; D807-A811 WeakPolarHBondContact O-CB 3.28Å; D807-A811 PolarHBondContact O-N 3.2Å
808	A	89	Confident	81.6	Confident	55 Å²	55	65 Å²	65	46%	0.455	44%	0.436	S	S	.	.	H	α-helix	trans	-74.5	-40.9	178	0	0	0	0	0	112.2	N805 H806 A811 A812	N805-A808 HydrophobicContact CB-CB 4.4Å; N805-A808 PolarHBondContact O-N 3.14Å; N805-A808 VanDerWaalsContact O-N 3.11Å; H806-A808 VanDerWaalsContact C-N 3.31Å; H806-A808 PolarHBondContact O-N 2.98Å; A808-A811 PolarHBondContact O-N 2.81Å; A808-A812 WeakPolarHBondContact O-CB 3.39Å; A808-A812 PolarHBondContact O-N 2.73Å
809	T	89.3	Confident	82.1	Confident	36 Å²	36	69.7 Å²	69.7	22%	0.221	45%	0.453	C	S	.	.	H	α-helix	trans	-64.2	-42	171.9	-65.1	0	0	0	0	110.3	N805 A812 I813	N805-T809 WeakPolarHBondContact O-CB 3.48Å; N805-T809 PolarHBondContact O-N 2.75Å; N805-T809 PolarHBondContact O-OG1 2.76Å; T809-A812 PolarHBondContact O-N 3.5Å; T809-I813 HydrophobicContact CG2-CD1 3.84Å; T809-I813 WeakPolarHBondContact O-CB 3.4Å; T809-I813 WeakPolarHBondContact O-CD1 3.49Å; T809-I813 WeakPolarHBondContact O-CG1 3.39Å; T809-I813 PolarHBondContact O-N 3.08Å
810	I	93	Very high	83	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.031	42%	0.422	C	S	.	.	H	α-helix	trans	-62.8	-44.2	174	-65.9	-68.7	0	0	0	111.6	H806 A812 I813 E814 V865 R869	H806-I810 VanDerWaalsContact O-CG1 3.28Å; H806-I810 WeakPolarHBondContact O-CG1 3.4Å; H806-I810 PolarHBondContact O-N 2.73Å; H806-I810 VanDerWaalsContact O-N 3.1Å; I810-A812 VanDerWaalsContact C-N 3.31Å; I810-A812 PolarHBondContact O-N 3.15Å; I810-I813 HydrophobicContact CD1-CD1 4.29Å; I810-I813 WeakPolarHBondContact O-CB 3.37Å; I810-I813 PolarHBondContact O-N 3.3Å; I810-E814 HydrophobicContact CG2-CG 4.36Å; I810-E814 WeakPolarHBondContact CG2-OE1 3.25Å; I810-E814 WeakPolarHBondContact O-CB 3.33Å; I810-E814 WeakPolarHBondContact O-CG 3.39Å; I810-E814 PolarHBondContact O-N 3.15Å; I810-V865 HydrophobicContact CD1-CG1 4.34Å; I810-V865 HydrophobicContact CG2-CG1 3.92Å; I810-V865 HydrophobicContact CG2-CG2 4.46Å; I810-R869 HydrophobicContact CD1-CB 4.25Å
811	A	93.9	Very high	84.3	Confident	46 Å²	46	68 Å²	68	38%	0.38	42%	0.418	S	S	.	.	H	α-helix	trans	-64.2	-34.4	175.6	0	0	0	0	0	112.9	D807 A808 T815	D807-A811 WeakPolarHBondContact O-CB 3.28Å; D807-A811 PolarHBondContact O-N 3.2Å; A808-A811 PolarHBondContact O-N 2.81Å; A811-T815 WeakPolarHBondContact O-CB 3.47Å; A811-T815 PolarHBondContact O-N 3Å; A811-T815 PolarHBondContact O-OG1 2.6Å
812	A	94.2	Very high	85.8	Confident	42 Å²	42	72 Å²	72	35%	0.347	42%	0.422	S	S	.	.	H	α-helix	trans	-68	-40.4	173.7	0	0	0	0	0	112.1	A808 T809 I810 T815 A816 V836	A808-A812 WeakPolarHBondContact O-CB 3.39Å; A808-A812 PolarHBondContact O-N 2.73Å; T809-A812 PolarHBondContact O-N 3.5Å; I810-A812 VanDerWaalsContact C-N 3.31Å; I810-A812 PolarHBondContact O-N 3.15Å; A812-T815 PolarHBondContact O-N 3.13Å; A812-A816 WeakPolarHBondContact O-CB 3.34Å; A812-A816 PolarHBondContact O-N 2.76Å; A812-V836 HydrophobicContact CB-CG1 3.89Å
813	I	94.9	Very high	87.7	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-60.6	-50.8	171.9	-71	159.2	0	0	0	110.3	T809 I810 T815 A816 F817 V836 F864 V865 W868	T809-I813 HydrophobicContact CG2-CD1 3.84Å; T809-I813 WeakPolarHBondContact O-CB 3.4Å; T809-I813 WeakPolarHBondContact O-CD1 3.49Å; T809-I813 WeakPolarHBondContact O-CG1 3.39Å; T809-I813 PolarHBondContact O-N 3.08Å; I810-I813 HydrophobicContact CD1-CD1 4.29Å; I810-I813 WeakPolarHBondContact O-CB 3.37Å; I810-I813 PolarHBondContact O-N 3.3Å; I813-T815 PolarHBondContact O-N 3.04Å; I813-A816 PolarHBondContact O-N 3.49Å; I813-A816 VanDerWaalsContact O-N 3.08Å; I813-F817 HydrophobicContact CG2-CD2 3.82Å; I813-F817 HydrophobicContact CG2-CE2 3.91Å; I813-F817 WeakPolarHBondContact O-CD2 3.3Å; I813-F817 PolarHBondContact O-N 2.83Å; I813-V836 HydrophobicContact CG1-CG1 4.05Å; I813-F864 HydrophobicContact CD1-CE1 3.93Å; I813-F864 HydrophobicContact CG1-CE1 4.18Å; I813-F864 HydrophobicContact CG2-CD1 3.53Å; I813-F864 HydrophobicContact CG2-CE1 3.67Å; I813-V865 HydrophobicContact CG2-CG2 3.71Å; I813-W868 VanDerWaalsContact CD1-CD1 3.41Å; I813-W868 HydrophobicContact CD1-CG 4.07Å
814	E	95.5	Very high	89.5	Confident	88 Å²	88	67.9 Å²	67.9	41%	0.411	39%	0.387	S	S	.	.	H	α-helix	trans	-59.8	-35.1	178	-71.5	170	178.2	0	0	111.7	I810 A818 V861 V865	I810-E814 HydrophobicContact CG2-CG 4.36Å; I810-E814 WeakPolarHBondContact CG2-OE1 3.25Å; I810-E814 WeakPolarHBondContact O-CB 3.33Å; I810-E814 WeakPolarHBondContact O-CG 3.39Å; I810-E814 PolarHBondContact O-N 3.15Å; E814-A818 PolarHBondContact O-N 2.9Å; E814-V861 HydrophobicContact CG-CG2 4.1Å; E814-V865 HydrophobicContact CG-CG2 3.91Å
815	T	95.9	Very high	91.4	Very high	96 Å²	96	64.3 Å²	64.3	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-68.5	-40.7	173.3	-55.3	0	0	0	0	112.3	A811 A812 I813 A818	A811-T815 WeakPolarHBondContact O-CB 3.47Å; A811-T815 PolarHBondContact O-N 3Å; A811-T815 PolarHBondContact O-OG1 2.6Å; A812-T815 PolarHBondContact O-N 3.13Å; I813-T815 PolarHBondContact O-N 3.04Å; T815-A818 PolarHBondContact O-N 2.78Å
816	A	94.9	Very high	92.5	Very high	13 Å²	13	61.6 Å²	61.6	11%	0.107	34%	0.342	C	S	.	.	H	α-helix	trans	-71.4	-36.6	-179.3	0	0	0	0	0	112.9	A812 I813 A818 E819 I833 V836	A812-A816 WeakPolarHBondContact O-CB 3.34Å; A812-A816 PolarHBondContact O-N 2.76Å; I813-A816 PolarHBondContact O-N 3.49Å; I813-A816 VanDerWaalsContact O-N 3.08Å; A816-A818 PolarHBondContact O-N 2.66Å; A816-E819 WeakPolarHBondContact O-CB 3.25Å; A816-E819 PolarHBondContact O-N 2.94Å; A816-I833 HydrophobicContact CB-CD1 3.71Å; A816-V836 HydrophobicContact CB-CG1 4.4Å; A816-V836 HydrophobicContact CB-CG2 4Å
817	F	96.3	Very high	92.9	Very high	0 Å²	0	61 Å²	61	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-29.1	173.2	-91	-89.2	0	0	0	112.9	I813 E819 F820 A825 M830 I833 V859 V861 F864	I813-F817 HydrophobicContact CG2-CD2 3.82Å; I813-F817 HydrophobicContact CG2-CE2 3.91Å; I813-F817 WeakPolarHBondContact O-CD2 3.3Å; I813-F817 PolarHBondContact O-N 2.83Å; F817-E819 PolarHBondContact O-N 3.4Å; F817-F820 HydrophobicContact CD1-CD2 4Å; F817-F820 HydrophobicContact CD1-CE2 4.28Å; F817-F820 HydrophobicContact CG-CD2 4.38Å; F817-F820 HydrophobicContact CG-CE2 4.43Å; F817-F820 PolarHBondContact O-N 3.09Å; F817-F820 VanDerWaalsContact O-N 3.09Å; F817-A825 HydrophobicContact CD1-CB 4.35Å; F817-A825 HydrophobicContact CE1-CB 3.64Å; F817-A825 HydrophobicContact CZ-CB 4.12Å; F817-M830 HydrophobicContact CZ-SD 4.21Å; F817-I833 HydrophobicContact CD2-CD1 3.58Å; F817-I833 HydrophobicContact CD2-CG1 4.25Å; F817-I833 HydrophobicContact CE2-CD1 3.54Å; F817-I833 HydrophobicContact CE2-CG1 3.73Å; F817-I833 HydrophobicContact CE2-CG2 3.99Å; F817-I833 HydrophobicContact CG-CD1 4.35Å; F817-I833 HydrophobicContact CZ-CD1 4.29Å; F817-I833 HydrophobicContact CZ-CG1 4.06Å; F817-V859 WeakPolarHBondContact CE1-O 3.45Å; F817-V861 HydrophobicContact CB-CB 3.66Å; F817-V861 HydrophobicContact CB-CG2 3.63Å; F817-V861 HydrophobicContact CD1-CB 3.83Å; F817-V861 HydrophobicContact CD1-CG2 4.45Å; F817-V861 HydrophobicContact CD2-CB 4.25Å; F817-V861 HydrophobicContact CD2-CG2 4Å; F817-V861 HydrophobicContact CG-CB 3.64Å; F817-V861 HydrophobicContact CG-CG2 3.77Å; F817-F864 HydrophobicContact CE2-CB 3.98Å; F817-F864 AromaticContact CE2-CD1 3.57Å; F817-F864 HydrophobicContact CE2-CD1 3.57Å; F817-F864 HydrophobicContact CE2-CE1 4.37Å; F817-F864 AromaticContact CE2-CG 3.9Å; F817-F864 HydrophobicContact CE2-CG 3.9Å; F817-F864 HydrophobicContact CZ-CB 3.73Å; F817-F864 HydrophobicContact CZ-CD1 4.09Å; F817-F864 AromaticContact CZ-CG 3.93Å; F817-F864 HydrophobicContact CZ-CG 3.93Å
818	A	94.4	Very high	93.1	Very high	66 Å²	66	62.3 Å²	62.3	55%	0.545	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-0.8	176	0	0	0	0	0	114	E814 T815 A816	E814-A818 PolarHBondContact O-N 2.9Å; T815-A818 PolarHBondContact O-N 2.78Å; A816-A818 PolarHBondContact O-N 2.66Å
819	E	93.4	Very high	93.4	Very high	152 Å²	152	62.3 Å²	62.3	71%	0.71	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-9.7	166.8	-60	-168.1	167.5	0	0	113	A816 F817	A816-E819 WeakPolarHBondContact O-CB 3.25Å; A816-E819 PolarHBondContact O-N 2.94Å; F817-E819 PolarHBondContact O-N 3.4Å
820	F	93.1	Very high	93.7	Very high	16 Å²	16	60.6 Å²	60.6	7%	0.07	32%	0.317	C	S	.	.	S	Bend	trans	-101.6	167.6	-176.5	-48	-35.5	0	0	0	113.1	F817 K824 A825 E829 K832 I833	F817-F820 HydrophobicContact CD1-CD2 4Å; F817-F820 HydrophobicContact CD1-CE2 4.28Å; F817-F820 HydrophobicContact CG-CD2 4.38Å; F817-F820 HydrophobicContact CG-CE2 4.43Å; F817-F820 PolarHBondContact O-N 3.09Å; F817-F820 VanDerWaalsContact O-N 3.09Å; F820-K824 WeakPolarHBondContact CB-O 3.39Å; F820-A825 HydrophobicContact CD2-CB 3.71Å; F820-A825 HydrophobicContact CE2-CB 3.63Å; F820-E829 WeakPolarHBondContact CD1-OE1 3.28Å; F820-E829 HydrophobicContact CE1-CB 4.24Å; F820-E829 HydrophobicContact CE2-CB 4.39Å; F820-E829 HydrophobicContact CZ-CB 4.14Å; F820-K832 HydrophobicContact CE1-CD 3.52Å; F820-K832 HydrophobicContact CZ-CB 4.31Å; F820-K832 HydrophobicContact CZ-CD 3.84Å; F820-I833 HydrophobicContact CE2-CD1 3.8Å; F820-I833 HydrophobicContact CE2-CG1 3.88Å; F820-I833 HydrophobicContact CZ-CD1 4.07Å; F820-I833 HydrophobicContact CZ-CG1 4.18Å
821	E	89	Confident	93.8	Very high	173 Å²	173	60.6 Å²	60.6	81%	0.808	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-73.7	128.6	179	-169.8	159	-153.6	0	0	111.4	D823 K824	E821-D823 VanDerWaalsContact C-N 3.27Å; E821-D823 PolarHBondContact O-N 3.15Å; E821-K824 PolarHBondContact O-N 3.37Å
822	E	88.7	Confident	93.9	Very high	143 Å²	143	63.5 Å²	63.5	67%	0.668	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	54.8	28.8	-177.6	-57	-170.3	150	0	0	116.1	K824	E822-K824 VanDerWaalsContact C-N 3.27Å; E822-K824 HydrophobicContact CB-CD 4.01Å; E822-K824 HydrophobicContact CB-CG 4.48Å; E822-K824 PolarHBondContact O-N 3.05Å; E822-K824 WeakPolarHBondContact OE2-CE 3.45Å; E822-K824 IonicContact OE2-NZ 3.29Å; E822-K824 PolarHBondContact OE2-NZ 3.02Å
823	D	91.6	Very high	94	Very high	81 Å²	81	61.5 Å²	61.5	43%	0.433	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	56.7	35.5	-174.7	-54.5	-41.6	0	0	0	113.5	E821 V861	E821-D823 VanDerWaalsContact C-N 3.27Å; E821-D823 PolarHBondContact O-N 3.15Å; D823-V861 HydrophobicContact CB-CB 4.4Å; D823-V861 HydrophobicContact CB-CG1 3.84Å; D823-V861 PolarHBondContact O-N 3.45Å
824	K	93.8	Very high	94	Very high	54 Å²	54	61.5 Å²	61.5	24%	0.235	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	142	-179.5	-62.9	162.4	-175.9	176.3	0	111.1	F820 E821 E822 F858 V859	F820-K824 WeakPolarHBondContact CB-O 3.39Å; E821-K824 PolarHBondContact O-N 3.37Å; E822-K824 VanDerWaalsContact C-N 3.27Å; E822-K824 HydrophobicContact CB-CD 4.01Å; E822-K824 HydrophobicContact CB-CG 4.48Å; E822-K824 PolarHBondContact O-N 3.05Å; E822-K824 WeakPolarHBondContact OE2-CE 3.45Å; E822-K824 IonicContact OE2-NZ 3.29Å; E822-K824 PolarHBondContact OE2-NZ 3.02Å; K824-F858 HydrophobicContact CB-CB 4.26Å; K824-F858 HydrophobicContact CB-CD2 3.93Å; K824-F858 HydrophobicContact CB-CG 4.29Å; K824-F858 HydrophobicContact CD-CD1 4.41Å; K824-F858 HydrophobicContact CD-CD2 3.5Å; K824-F858 HydrophobicContact CD-CE1 4.48Å; K824-F858 HydrophobicContact CD-CE2 3.59Å; K824-F858 HydrophobicContact CD-CG 3.96Å; K824-F858 HydrophobicContact CD-CZ 4.1Å; K824-F858 HydrophobicContact CG-CD2 3.57Å; K824-F858 HydrophobicContact CG-CE2 3.91Å; K824-F858 HydrophobicContact CG-CG 4.29Å; K824-V859 CarbonylContact C-O 3.58Å; K824-V859 VanDerWaalsContact CA-O 3.27Å; K824-V859 WeakPolarHBondContact CA-O 3.12Å
825	A	94.8	Very high	94	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.7	171.1	0	0	0	0	0	110.5	F817 F820 E829 M830 F858 V859	F817-A825 HydrophobicContact CD1-CB 4.35Å; F817-A825 HydrophobicContact CE1-CB 3.64Å; F817-A825 HydrophobicContact CZ-CB 4.12Å; F820-A825 HydrophobicContact CD2-CB 3.71Å; F820-A825 HydrophobicContact CE2-CB 3.63Å; A825-E829 HydrophobicContact CB-CB 4.07Å; A825-M830 HydrophobicContact CB-CG 4.13Å; A825-M830 HydrophobicContact CB-SD 3.96Å; A825-F858 CarbonylContact O-C 3.6Å; A825-F858 WeakPolarHBondContact O-CA 3.4Å; A825-V859 PolarHBondContact N-O 3Å; A825-V859 PolarHBondContact O-N 2.58Å
826	D	94.4	Very high	93.9	Very high	61 Å²	61	60.4 Å²	60.4	33%	0.326	30%	0.297	S	S	.	.			trans	-81.1	179.5	160.7	82.1	12.3	0	0	0	112.1	Y828 E829 M830	D826-Y828 VanDerWaalsContact C-N 3.28Å; D826-Y828 PolarHBondContact O-N 3.2Å; D826-Y828 WeakPolarHBondContact OD1-CA 3.05Å; D826-Y828 WeakPolarHBondContact OD1-CB 3.3Å; D826-Y828 PolarHBondContact OD1-N 2.99Å; D826-E829 PolarHBondContact N-OE2 3.13Å; D826-E829 PolarHBondContact O-N 3.11Å; D826-E829 PolarHBondContact OD1-N 3.18Å; D826-M830 VanDerWaalsContact O-CG 3.29Å; D826-M830 WeakPolarHBondContact O-CG 3.25Å; D826-M830 PolarHBondContact O-N 2.77Å
827	I	94	Very high	93.8	Very high	32 Å²	32	60.6 Å²	60.6	16%	0.164	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-28.7	-178.4	-167.1	167.8	0	0	0	113.4	F848 Y849	I827-F848 HydrophobicContact CB-CD1 4.23Å; I827-F848 HydrophobicContact CB-CD2 4.14Å; I827-F848 HydrophobicContact CB-CE1 4.22Å; I827-F848 HydrophobicContact CB-CE2 4.13Å; I827-F848 HydrophobicContact CB-CG 4.19Å; I827-F848 HydrophobicContact CB-CZ 4.17Å; I827-F848 HydrophobicContact CD1-CD1 4.11Å; I827-F848 HydrophobicContact CD1-CE1 4.44Å; I827-F848 HydrophobicContact CG1-CB 4.43Å; I827-F848 HydrophobicContact CG1-CD1 4.19Å; I827-F848 HydrophobicContact CG1-CG 4.19Å; I827-Y849 HydrophobicContact CD1-CE2 4.22Å
828	Y	91.9	Very high	93.6	Very high	149 Å²	149	64 Å²	64	58%	0.584	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-40.1	177.4	-54.6	-74	0	0	0	110.8	D826 M830 G831 T909	D826-Y828 VanDerWaalsContact C-N 3.28Å; D826-Y828 PolarHBondContact O-N 3.2Å; D826-Y828 WeakPolarHBondContact OD1-CA 3.05Å; D826-Y828 WeakPolarHBondContact OD1-CB 3.3Å; D826-Y828 PolarHBondContact OD1-N 2.99Å; Y828-M830 VanDerWaalsContact C-N 3.3Å; Y828-M830 PolarHBondContact O-N 3.39Å; Y828-G831 PolarHBondContact O-N 2.73Å; Y828-T909 HydrophobicContact CD1-CG2 4.25Å; Y828-T909 HydrophobicContact CE1-CG2 4.18Å
829	E	94.5	Very high	93.6	Very high	54 Å²	54	61.3 Å²	61.3	25%	0.252	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-29.4	175.6	-68	-172.8	120.6	0	0	113.2	F820 A825 D826 G831 K832	F820-E829 WeakPolarHBondContact CD1-OE1 3.28Å; F820-E829 HydrophobicContact CE1-CB 4.24Å; F820-E829 HydrophobicContact CE2-CB 4.39Å; F820-E829 HydrophobicContact CZ-CB 4.14Å; A825-E829 HydrophobicContact CB-CB 4.07Å; D826-E829 PolarHBondContact N-OE2 3.13Å; D826-E829 PolarHBondContact O-N 3.11Å; D826-E829 PolarHBondContact OD1-N 3.18Å; E829-G831 PolarHBondContact O-N 2.67Å; E829-K832 WeakPolarHBondContact O-CB 3.18Å; E829-K832 PolarHBondContact O-N 2.93Å
830	M	95.9	Very high	93.7	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.5	-19.4	175.4	-79.8	-63.6	-62.4	0	0	114	F817 A825 D826 Y828 K832 I833 A834 K844 M847 F848 F864	F817-M830 HydrophobicContact CZ-SD 4.21Å; A825-M830 HydrophobicContact CB-CG 4.13Å; A825-M830 HydrophobicContact CB-SD 3.96Å; D826-M830 VanDerWaalsContact O-CG 3.29Å; D826-M830 WeakPolarHBondContact O-CG 3.25Å; D826-M830 PolarHBondContact O-N 2.77Å; Y828-M830 VanDerWaalsContact C-N 3.3Å; Y828-M830 PolarHBondContact O-N 3.39Å; M830-K832 VanDerWaalsContact C-N 3.29Å; M830-K832 PolarHBondContact O-N 2.95Å; M830-I833 HydrophobicContact CE-CB 4.17Å; M830-I833 HydrophobicContact CE-CG2 3.93Å; M830-I833 PolarHBondContact O-N 3.15Å; M830-I833 VanDerWaalsContact O-N 3.13Å; M830-I833 HydrophobicContact SD-CB 3.98Å; M830-I833 HydrophobicContact SD-CG1 4.07Å; M830-I833 HydrophobicContact SD-CG2 4.12Å; M830-A834 PolarHBondContact O-N 3.05Å; M830-K844 HydrophobicContact CB-CB 4Å; M830-M847 HydrophobicContact CE-CB 3.54Å; M830-M847 HydrophobicContact CE-CE 4.39Å; M830-F848 HydrophobicContact CG-CB 4.18Å; M830-F848 HydrophobicContact CG-CD2 3.94Å; M830-F864 HydrophobicContact CE-CD2 3.93Å; M830-F864 HydrophobicContact CE-CE2 3.77Å; M830-F864 HydrophobicContact CE-CZ 4.49Å
831	G	94.9	Very high	93.8	Very high	7 Å²	7	56.9 Å²	56.9	7%	0.072	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-35.2	170.1	0	0	0	0	0	113.7	Y828 E829 K835	Y828-G831 PolarHBondContact O-N 2.73Å; E829-G831 PolarHBondContact O-N 2.67Å; G831-K835 PolarHBondContact O-N 2.88Å
832	K	94.9	Very high	94.2	Very high	107 Å²	107	49 Å²	49	47%	0.465	26%	0.255	S	S	.	.	H	α-helix	trans	-66.5	-42.3	172.2	-61.6	165.8	179.3	171.6	0	110.7	F820 E829 M830 K835 V836	F820-K832 HydrophobicContact CE1-CD 3.52Å; F820-K832 HydrophobicContact CZ-CB 4.31Å; F820-K832 HydrophobicContact CZ-CD 3.84Å; E829-K832 WeakPolarHBondContact O-CB 3.18Å; E829-K832 PolarHBondContact O-N 2.93Å; M830-K832 VanDerWaalsContact C-N 3.29Å; M830-K832 PolarHBondContact O-N 2.95Å; K832-K835 PolarHBondContact O-N 3.37Å; K832-V836 WeakPolarHBondContact O-CG2 3.41Å; K832-V836 PolarHBondContact O-N 3.41Å
833	I	96.3	Very high	94.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.5	-38	179.9	-61	-56.1	0	0	0	111.5	A816 F817 F820 M830 K835 V836 C837 M847 F864	A816-I833 HydrophobicContact CB-CD1 3.71Å; F817-I833 HydrophobicContact CD2-CD1 3.58Å; F817-I833 HydrophobicContact CD2-CG1 4.25Å; F817-I833 HydrophobicContact CE2-CD1 3.54Å; F817-I833 HydrophobicContact CE2-CG1 3.73Å; F817-I833 HydrophobicContact CE2-CG2 3.99Å; F817-I833 HydrophobicContact CG-CD1 4.35Å; F817-I833 HydrophobicContact CZ-CD1 4.29Å; F817-I833 HydrophobicContact CZ-CG1 4.06Å; F820-I833 HydrophobicContact CE2-CD1 3.8Å; F820-I833 HydrophobicContact CE2-CG1 3.88Å; F820-I833 HydrophobicContact CZ-CD1 4.07Å; F820-I833 HydrophobicContact CZ-CG1 4.18Å; M830-I833 HydrophobicContact CE-CB 4.17Å; M830-I833 HydrophobicContact CE-CG2 3.93Å; M830-I833 PolarHBondContact O-N 3.15Å; M830-I833 VanDerWaalsContact O-N 3.13Å; M830-I833 HydrophobicContact SD-CB 3.98Å; M830-I833 HydrophobicContact SD-CG1 4.07Å; M830-I833 HydrophobicContact SD-CG2 4.12Å; I833-K835 PolarHBondContact O-N 3.48Å; I833-V836 PolarHBondContact O-N 2.96Å; I833-C837 WeakPolarHBondContact O-CB 3.46Å; I833-C837 PolarHBondContact O-N 3.13Å; I833-C837 PolarHBondContact O-SG 2.66Å; I833-M847 HydrophobicContact CG2-CE 4.17Å; I833-F864 HydrophobicContact CG2-CD1 4.04Å; I833-F864 HydrophobicContact CG2-CE1 3.48Å; I833-F864 VanDerWaalsContact CG2-CE1 3.48Å; I833-F864 HydrophobicContact CG2-CE2 4.2Å; I833-F864 HydrophobicContact CG2-CZ 3.6Å
834	A	95.9	Very high	94.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-55.6	-49.3	172.2	0	0	0	0	0	111.6	M830 V836 C837 G838 C839 M847	M830-A834 PolarHBondContact O-N 3.05Å; A834-V836 PolarHBondContact O-N 2.96Å; A834-C837 CarbonylContact O-C 3.56Å; A834-C837 WeakPolarHBondContact O-CB 3.47Å; A834-C837 PolarHBondContact O-N 3.33Å; A834-C837 VanDerWaalsContact O-N 3.13Å; A834-G838 PolarHBondContact O-N 2.75Å; A834-G838 VanDerWaalsContact O-N 3.13Å; A834-C839 CarbonylContact C-O 3.54Å; A834-C839 PolarHBondContact O-N 3.37Å; A834-M847 HydrophobicContact CB-SD 3.96Å
835	K	94.7	Very high	94.9	Very high	107 Å²	107	36.3 Å²	36.3	47%	0.465	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-40.3	177.3	-63.8	-70.2	177.5	168.5	0	112.9	G831 K832 I833 C837 G838 E964	G831-K835 PolarHBondContact O-N 2.88Å; K832-K835 PolarHBondContact O-N 3.37Å; I833-K835 PolarHBondContact O-N 3.48Å; K835-C837 VanDerWaalsContact C-N 3.28Å; K835-C837 PolarHBondContact O-N 2.86Å; K835-G838 PolarHBondContact O-N 2.99Å; K835-G838 VanDerWaalsContact O-N 3.09Å; K835-E964 VanDerWaalsContact CE-OE2 3.29Å; K835-E964 WeakPolarHBondContact CE-OE2 3.5Å; K835-E964 IonicContact NZ-OE1 2.8Å; K835-E964 PolarHBondContact NZ-OE1 3.05Å; K835-E964 IonicContact NZ-OE2 2.69Å; K835-E964 PolarHBondContact NZ-OE2 3.36Å
836	V	94.7	Very high	94.9	Very high	53 Å²	53	36.6 Å²	36.6	32%	0.321	20%	0.196	S	C	.	.	H	α-helix	trans	-66	-30.6	174.7	173.1	0	0	0	0	112.2	A812 I813 A816 K832 I833 A834 G838	A812-V836 HydrophobicContact CB-CG1 3.89Å; I813-V836 HydrophobicContact CG1-CG1 4.05Å; A816-V836 HydrophobicContact CB-CG1 4.4Å; A816-V836 HydrophobicContact CB-CG2 4Å; K832-V836 WeakPolarHBondContact O-CG2 3.41Å; K832-V836 PolarHBondContact O-N 3.41Å; I833-V836 PolarHBondContact O-N 2.96Å; A834-V836 PolarHBondContact O-N 2.96Å; V836-G838 VanDerWaalsContact C-N 3.28Å
837	C	92.8	Very high	95	Very high	18 Å²	18	33.7 Å²	33.7	12%	0.122	18%	0.181	C	C	.	.	H	α-helix	trans	-77	-11	173.1	-67.4	0	0	0	0	113.9	I833 A834 K835 M847 W868	I833-C837 WeakPolarHBondContact O-CB 3.46Å; I833-C837 PolarHBondContact O-N 3.13Å; I833-C837 PolarHBondContact O-SG 2.66Å; A834-C837 CarbonylContact O-C 3.56Å; A834-C837 WeakPolarHBondContact O-CB 3.47Å; A834-C837 PolarHBondContact O-N 3.33Å; A834-C837 VanDerWaalsContact O-N 3.13Å; K835-C837 VanDerWaalsContact C-N 3.28Å; K835-C837 PolarHBondContact O-N 2.86Å; C837-M847 HydrophobicContact CB-CE 3.85Å; C837-M847 VanDerWaalsContact SG-CE 3.56Å; C837-W868 HydrophobicContact CB-CH2 3.92Å; C837-W868 HydrophobicContact CB-CZ2 3.55Å
838	G	91.7	Very high	95.1	Very high	71 Å²	71	32.7 Å²	32.7	73%	0.732	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.5	23.5	-174.4	0	0	0	0	0	114.1	A834 K835 V836	A834-G838 PolarHBondContact O-N 2.75Å; A834-G838 VanDerWaalsContact O-N 3.13Å; K835-G838 PolarHBondContact O-N 2.99Å; K835-G838 VanDerWaalsContact O-N 3.09Å; V836-G838 VanDerWaalsContact C-N 3.28Å
839	C	94.8	Very high	95.2	Very high	10 Å²	10	29.2 Å²	29.2	7%	0.068	16%	0.162	C	C	.	.			trans	-104.5	155.4	178.9	-63.6	0	0	0	0	111.9	A834 W843 M847	A834-C839 CarbonylContact C-O 3.54Å; A834-C839 PolarHBondContact O-N 3.37Å; C839-W843 HydrophobicContact CB-CB 4.1Å; C839-W843 HydrophobicContact CB-CD2 4.08Å; C839-W843 HydrophobicContact CB-CE3 4.04Å; C839-W843 HydrophobicContact CB-CG 4.13Å; C839-M847 HydrophobicContact CB-SD 4.36Å
840	P	95.6	Very high	95.2	Very high	26 Å²	26	28.1 Å²	28.1	17%	0.169	16%	0.162	C	C	.	.			trans	-58.7	153.1	168	-21.2	32.5	0	0	0	112.5	Y842 W843 A961	P840-Y842 PolarHBondContact O-N 3.2Å; P840-W843 WeakPolarHBondContact O-CB 3.47Å; P840-W843 PolarHBondContact O-N 2.78Å; P840-W843 VanDerWaalsContact O-N 3.1Å; P840-A961 HydrophobicContact CB-CB 4.11Å; P840-A961 HydrophobicContact CG-CB 3.77Å
841	L	96.1	Very high	95.1	Very high	49 Å²	49	28.4 Å²	28.4	26%	0.257	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-48.4	-174.8	176.3	62	0	0	0	112.6	W843 K844 E964	L841-W843 PolarHBondContact O-N 2.96Å; L841-W843 VanDerWaalsContact O-N 3.11Å; L841-K844 HydrophobicContact CD1-CD 4.05Å; L841-K844 HydrophobicContact CG-CD 4.46Å; L841-K844 VanDerWaalsContact O-CB 3.24Å; L841-K844 WeakPolarHBondContact O-CB 3.35Å; L841-K844 WeakPolarHBondContact O-CG 3.36Å; L841-K844 PolarHBondContact O-N 3.44Å; L841-E964 WeakPolarHBondContact CA-OE2 3.34Å; L841-E964 HydrophobicContact CB-CB 4Å; L841-E964 WeakPolarHBondContact CB-OE2 3.5Å; L841-E964 HydrophobicContact CD2-CB 4.47Å; L841-E964 PolarHBondContact N-OE2 3.35Å
842	Y	96.3	Very high	95	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.027	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-0.9	-175.7	-62.8	-82.7	0	0	0	114.3	P840 K844 L902 I906 T909 H910 L963 E964	P840-Y842 PolarHBondContact O-N 3.2Å; Y842-K844 PolarHBondContact O-N 3.46Å; Y842-L902 WeakPolarHBondContact O-CD1 3.45Å; Y842-I906 HydrophobicContact CD1-CB 4.35Å; Y842-I906 HydrophobicContact CD1-CG1 3.49Å; Y842-I906 VanDerWaalsContact CD1-CG1 3.49Å; Y842-I906 HydrophobicContact CE1-CG1 4.16Å; Y842-I906 HydrophobicContact CG-CG1 4.03Å; Y842-T909 WeakPolarHBondContact CE1-OG1 3.49Å; Y842-H910 HydrophobicContact CE1-CB 4.47Å; Y842-H910 AromaticContact CZ-CD2 3.94Å; Y842-H910 WeakPolarHBondContact OH-CA 3.43Å; Y842-H910 PolarHBondContact OH-CD2 3.09Å; Y842-L963 HydrophobicContact CD2-CB 3.67Å; Y842-L963 HydrophobicContact CD2-CD1 4.41Å; Y842-L963 VanDerWaalsContact CE2-C 3.47Å; Y842-L963 HydrophobicContact CE2-CB 3.59Å; Y842-L963 WeakPolarHBondContact CE2-O 3.44Å; Y842-L963 PolarHBondContact OH-O 2.68Å; Y842-E964 HydrophobicContact CE2-CB 4.19Å
843	W	96.9	Very high	94.8	Very high	5 Å²	5	24.4 Å²	24.4	2%	0.019	15%	0.153	C	C	.	.	H	α-helix	trans	-70.4	-11.7	163.2	-71.2	42.1	0	0	0	112	C839 P840 L841 A845 A846 M847 D878 R881 F882 L885 L957	C839-W843 HydrophobicContact CB-CB 4.1Å; C839-W843 HydrophobicContact CB-CD2 4.08Å; C839-W843 HydrophobicContact CB-CE3 4.04Å; C839-W843 HydrophobicContact CB-CG 4.13Å; P840-W843 WeakPolarHBondContact O-CB 3.47Å; P840-W843 PolarHBondContact O-N 2.78Å; P840-W843 VanDerWaalsContact O-N 3.1Å; L841-W843 PolarHBondContact O-N 2.96Å; L841-W843 VanDerWaalsContact O-N 3.11Å; W843-A845 PolarHBondContact O-N 3.43Å; W843-A846 PolarHBondContact O-N 3.47Å; W843-M847 HydrophobicContact CB-CG 4.41Å; W843-M847 HydrophobicContact CB-SD 3.92Å; W843-M847 WeakPolarHBondContact O-CB 3.44Å; W843-M847 WeakPolarHBondContact O-CG 2.96Å; W843-M847 PolarHBondContact O-N 2.95Å; W843-D878 HydrophobicContact CH2-CB 3.91Å; W843-D878 WeakPolarHBondContact CH2-O 3.38Å; W843-D878 HydrophobicContact CZ2-CB 4.26Å; W843-R881 HydrophobicContact CH2-CB 4.22Å; W843-R881 HydrophobicContact CZ3-CB 3.97Å; W843-F882 HydrophobicContact CD2-CD2 4.22Å; W843-F882 AromaticContact CE2-CD2 3.82Å; W843-F882 HydrophobicContact CH2-CB 3.89Å; W843-F882 HydrophobicContact CH2-CD2 4.3Å; W843-F882 HydrophobicContact CZ2-CB 4.12Å; W843-F882 AromaticContact CZ2-CD2 3.88Å; W843-F882 HydrophobicContact CZ2-CD2 3.88Å; W843-F882 HydrophobicContact CZ2-CG 4.44Å; W843-F882 HydrophobicContact CZ3-CB 4.43Å; W843-L885 HydrophobicContact CE3-CD1 3.9Å; W843-L885 HydrophobicContact CZ3-CD1 4.12Å; W843-L957 HydrophobicContact CZ2-CD2 4.32Å
844	K	95.7	Very high	94.6	Very high	7 Å²	7	31.1 Å²	31.1	3%	0.03	18%	0.184	C	C	.	.	H	α-helix	trans	-52.5	-45	-178.4	63.3	-173.7	159.9	56.5	0	113.7	M830 L841 Y842 M847 F848 D905 T909	M830-K844 HydrophobicContact CB-CB 4Å; L841-K844 HydrophobicContact CD1-CD 4.05Å; L841-K844 HydrophobicContact CG-CD 4.46Å; L841-K844 VanDerWaalsContact O-CB 3.24Å; L841-K844 WeakPolarHBondContact O-CB 3.35Å; L841-K844 WeakPolarHBondContact O-CG 3.36Å; L841-K844 PolarHBondContact O-N 3.44Å; Y842-K844 PolarHBondContact O-N 3.46Å; K844-M847 PolarHBondContact O-N 2.91Å; K844-F848 VanDerWaalsContact O-CB 3.28Å; K844-F848 WeakPolarHBondContact O-CB 3.3Å; K844-F848 PolarHBondContact O-N 3.41Å; K844-D905 VanDerWaalsContact CG-OD2 3.31Å; K844-D905 WeakPolarHBondContact CG-OD2 3.46Å; K844-D905 IonicContact NZ-OD1 3.41Å; K844-D905 PolarHBondContact NZ-OD1 2.85Å; K844-D905 IonicContact NZ-OD2 3.31Å; K844-D905 PolarHBondContact NZ-OD2 3.36Å; K844-T909 PolarHBondContact NZ-OG1 3.21Å
845	A	95.6	Very high	94.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-59.4	173.2	0	0	0	0	0	112	W843 M847 F848 Y849 P901 D905	W843-A845 PolarHBondContact O-N 3.43Å; A845-M847 PolarHBondContact O-N 3.45Å; A845-M847 VanDerWaalsContact O-N 3.09Å; A845-F848 CarbonylContact O-C 3.58Å; A845-F848 WeakPolarHBondContact O-CA 3.46Å; A845-F848 WeakPolarHBondContact O-CB 3.5Å; A845-F848 PolarHBondContact O-N 2.84Å; A845-Y849 HydrophobicContact CB-CD2 4.17Å; A845-Y849 HydrophobicContact CB-CE2 4.13Å; A845-Y849 WeakPolarHBondContact O-CD2 3.2Å; A845-Y849 PolarHBondContact O-N 3.11Å; A845-P901 WeakPolarHBondContact CB-O 3.39Å; A845-D905 HydrophobicContact CB-CB 3.49Å; A845-D905 VanDerWaalsContact CB-CB 3.49Å; A845-D905 WeakPolarHBondContact CB-OD2 3.36Å
846	A	95.4	Very high	94.1	Very high	5 Å²	5	40.2 Å²	40.2	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-51.1	-39.7	180	0	0	0	0	0	112.4	W843 A850 L885 L886	W843-A846 PolarHBondContact O-N 3.47Å; A846-A850 WeakPolarHBondContact O-CB 3.44Å; A846-A850 PolarHBondContact O-N 3.36Å; A846-L885 HydrophobicContact CB-CB 4.07Å; A846-L886 HydrophobicContact CB-CD1 3.49Å; A846-L886 VanDerWaalsContact CB-CD1 3.49Å; A846-L886 HydrophobicContact CB-CG 4.2Å
847	M	95.9	Very high	93.9	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-70	-36.9	175.6	-67.4	170.7	69	0	0	113.4	M830 I833 A834 C837 C839 W843 K844 A845 A851 F864 W868 L885	M830-M847 HydrophobicContact CE-CB 3.54Å; M830-M847 HydrophobicContact CE-CE 4.39Å; I833-M847 HydrophobicContact CG2-CE 4.17Å; A834-M847 HydrophobicContact CB-SD 3.96Å; C837-M847 HydrophobicContact CB-CE 3.85Å; C837-M847 VanDerWaalsContact SG-CE 3.56Å; C839-M847 HydrophobicContact CB-SD 4.36Å; W843-M847 HydrophobicContact CB-CG 4.41Å; W843-M847 HydrophobicContact CB-SD 3.92Å; W843-M847 WeakPolarHBondContact O-CB 3.44Å; W843-M847 WeakPolarHBondContact O-CG 2.96Å; W843-M847 PolarHBondContact O-N 2.95Å; K844-M847 PolarHBondContact O-N 2.91Å; A845-M847 PolarHBondContact O-N 3.45Å; A845-M847 VanDerWaalsContact O-N 3.09Å; M847-A851 WeakPolarHBondContact O-CB 3.47Å; M847-A851 PolarHBondContact O-N 2.92Å; M847-F864 HydrophobicContact CB-CE2 4.18Å; M847-F864 HydrophobicContact CE-CE2 3.81Å; M847-F864 HydrophobicContact CE-CZ 3.48Å; M847-F864 VanDerWaalsContact CE-CZ 3.48Å; M847-W868 HydrophobicContact CE-CE3 4.23Å; M847-W868 HydrophobicContact CE-CH2 4.25Å; M847-W868 HydrophobicContact CE-CZ3 3.81Å; M847-W868 HydrophobicContact CG-CZ3 4.23Å; M847-W868 HydrophobicContact SD-CZ3 4.34Å; M847-L885 HydrophobicContact CG-CD1 4Å
848	F	96.6	Very high	94	Very high	11 Å²	11	42.8 Å²	42.8	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-67.9	-51.8	175.7	-179.3	-99.5	0	0	0	111.7	I827 M830 K844 A845 A851 G852 G853 V859	I827-F848 HydrophobicContact CB-CD1 4.23Å; I827-F848 HydrophobicContact CB-CD2 4.14Å; I827-F848 HydrophobicContact CB-CE1 4.22Å; I827-F848 HydrophobicContact CB-CE2 4.13Å; I827-F848 HydrophobicContact CB-CG 4.19Å; I827-F848 HydrophobicContact CB-CZ 4.17Å; I827-F848 HydrophobicContact CD1-CD1 4.11Å; I827-F848 HydrophobicContact CD1-CE1 4.44Å; I827-F848 HydrophobicContact CG1-CB 4.43Å; I827-F848 HydrophobicContact CG1-CD1 4.19Å; I827-F848 HydrophobicContact CG1-CG 4.19Å; M830-F848 HydrophobicContact CG-CB 4.18Å; M830-F848 HydrophobicContact CG-CD2 3.94Å; K844-F848 VanDerWaalsContact O-CB 3.28Å; K844-F848 WeakPolarHBondContact O-CB 3.3Å; K844-F848 PolarHBondContact O-N 3.41Å; A845-F848 CarbonylContact O-C 3.58Å; A845-F848 WeakPolarHBondContact O-CA 3.46Å; A845-F848 WeakPolarHBondContact O-CB 3.5Å; A845-F848 PolarHBondContact O-N 2.84Å; F848-A851 PolarHBondContact O-N 2.96Å; F848-G852 PolarHBondContact O-N 2.89Å; F848-G853 VanDerWaalsContact CZ-C 3.46Å; F848-G853 PolarHBondContact O-N 3.47Å; F848-V859 HydrophobicContact CD2-CB 4.49Å; F848-V859 HydrophobicContact CD2-CG2 3.56Å; F848-V859 HydrophobicContact CE2-CG2 3.93Å; F848-V859 HydrophobicContact CG-CG2 4.19Å
849	Y	94.6	Very high	94.3	Very high	76 Å²	76	39.5 Å²	39.5	30%	0.298	21%	0.21	S	C	.	.	H	α-helix	trans	-62.5	-45.8	178.4	-71.8	-80.9	0	0	0	111.5	I827 A845 A851 G852 E854 P901	I827-Y849 HydrophobicContact CD1-CE2 4.22Å; A845-Y849 HydrophobicContact CB-CD2 4.17Å; A845-Y849 HydrophobicContact CB-CE2 4.13Å; A845-Y849 WeakPolarHBondContact O-CD2 3.2Å; A845-Y849 PolarHBondContact O-N 3.11Å; Y849-A851 PolarHBondContact O-N 3.06Å; Y849-G852 WeakPolarHBondContact O-CA 3.37Å; Y849-G852 PolarHBondContact O-N 2.94Å; Y849-E854 HydrophobicContact CD1-CB 3.71Å; Y849-E854 HydrophobicContact CD1-CG 4.26Å; Y849-E854 HydrophobicContact CE1-CB 3.74Å; Y849-E854 HydrophobicContact CE1-CG 3.97Å; Y849-P901 HydrophobicContact CD1-CB 4.26Å; Y849-P901 HydrophobicContact CD2-CB 3.64Å; Y849-P901 HydrophobicContact CE1-CB 4.11Å; Y849-P901 HydrophobicContact CE2-CB 3.52Å; Y849-P901 HydrophobicContact CG-CB 4.08Å
850	A	93.9	Very high	94.3	Very high	31 Å²	31	41.1 Å²	41.1	26%	0.256	22%	0.221	S	C	.	.	H	α-helix	trans	-62.9	-24.1	176.7	0	0	0	0	0	114.6	A846 T867 L885	A846-A850 WeakPolarHBondContact O-CB 3.44Å; A846-A850 PolarHBondContact O-N 3.36Å; A850-T867 HydrophobicContact CB-CG2 4.31Å; A850-T867 PolarHBondContact O-OG1 2.82Å; A850-L885 HydrophobicContact CB-CB 4.25Å; A850-L885 HydrophobicContact CB-CD2 3.55Å; A850-L885 WeakPolarHBondContact CB-O 3.45Å
851	A	94.8	Very high	94.3	Very high	5 Å²	5	41.3 Å²	41.3	4%	0.041	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	1.8	174.4	0	0	0	0	0	113.5	M847 F848 Y849 V859 S863 F864	M847-A851 WeakPolarHBondContact O-CB 3.47Å; M847-A851 PolarHBondContact O-N 2.92Å; F848-A851 PolarHBondContact O-N 2.96Å; Y849-A851 PolarHBondContact O-N 3.06Å; A851-V859 HydrophobicContact CB-CB 4.4Å; A851-V859 HydrophobicContact CB-CG1 3.5Å; A851-V859 VanDerWaalsContact CB-CG1 3.5Å; A851-V859 HydrophobicContact CB-CG2 3.92Å; A851-S863 PolarHBondContact O-OG 3.45Å; A851-F864 HydrophobicContact CB-CB 4.43Å; A851-F864 HydrophobicContact CB-CD2 4.02Å
852	G	91.6	Very high	94.3	Very high	30 Å²	30	46.2 Å²	46.2	31%	0.309	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	10.1	175.2	0	0	0	0	0	115.5	F848 Y849 E854 R855	F848-G852 PolarHBondContact O-N 2.89Å; Y849-G852 WeakPolarHBondContact O-CA 3.37Å; Y849-G852 PolarHBondContact O-N 2.94Å; G852-E854 VanDerWaalsContact C-N 3.33Å; G852-E854 PolarHBondContact O-N 3.39Å; G852-R855 PolarHBondContact O-N 2.94Å; G852-R855 VanDerWaalsContact O-N 3.09Å
853	G	92.1	Very high	94.2	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-56.8	-38.4	-168.9	0	0	0	0	0	115.1	F848 R855 T856 G857 V859	F848-G853 VanDerWaalsContact CZ-C 3.46Å; F848-G853 PolarHBondContact O-N 3.47Å; G853-R855 PolarHBondContact O-N 3.24Å; G853-R855 VanDerWaalsContact O-N 3.11Å; G853-T856 CarbonylContact O-C 3.6Å; G853-T856 PolarHBondContact O-N 2.93Å; G853-T856 PolarHBondContact O-OG1 3.48Å; G853-G857 WeakPolarHBondContact O-CA 3.32Å; G853-G857 PolarHBondContact O-N 3.49Å; G853-V859 VanDerWaalsContact CA-CG2 3.46Å
854	E	90.6	Very high	94.2	Very high	141 Å²	141	47.8 Å²	47.8	66%	0.659	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-45.2	-42.6	173.5	-178.2	-166.5	-149.8	0	0	113.2	Y849 G852 T856	Y849-E854 HydrophobicContact CD1-CB 3.71Å; Y849-E854 HydrophobicContact CD1-CG 4.26Å; Y849-E854 HydrophobicContact CE1-CB 3.74Å; Y849-E854 HydrophobicContact CE1-CG 3.97Å; G852-E854 VanDerWaalsContact C-N 3.33Å; G852-E854 PolarHBondContact O-N 3.39Å; E854-T856 VanDerWaalsContact C-N 3.28Å; E854-T856 PolarHBondContact O-N 3.02Å
855	R	89	Confident	94.2	Very high	219 Å²	219	47.8 Å²	47.8	83%	0.826	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-79.9	-9.3	-172.9	-65.2	178.6	53.5	163.7	-1.2	113.9	G852 G853	G852-R855 PolarHBondContact O-N 2.94Å; G852-R855 VanDerWaalsContact O-N 3.09Å; G853-R855 PolarHBondContact O-N 3.24Å; G853-R855 VanDerWaalsContact O-N 3.11Å
856	T	90.6	Very high	94.1	Very high	79 Å²	79	49.4 Å²	49.4	49%	0.485	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	-13.3	-173.1	33.1	0	0	0	0	113.6	G853 E854 F858	G853-T856 CarbonylContact O-C 3.6Å; G853-T856 PolarHBondContact O-N 2.93Å; G853-T856 PolarHBondContact O-OG1 3.48Å; E854-T856 VanDerWaalsContact C-N 3.28Å; E854-T856 PolarHBondContact O-N 3.02Å; T856-F858 WeakPolarHBondContact CB-O 3.01Å; T856-F858 HydrophobicContact CG2-CZ 4.47Å; T856-F858 WeakPolarHBondContact O-CD1 3.37Å; T856-F858 VanDerWaalsContact O-CE1 3.27Å; T856-F858 WeakPolarHBondContact O-CE1 3.26Å; T856-F858 PolarHBondContact O-N 3.25Å; T856-F858 PolarHBondContact OG1-O 3.49Å
857	G	92.5	Very high	94	Very high	52 Å²	52	50.1 Å²	50.1	54%	0.536	27%	0.274	S	S	.	.	S	Bend	trans	75.9	-11	-170.3	0	0	0	0	0	114.1	G853	G853-G857 WeakPolarHBondContact O-CA 3.32Å; G853-G857 PolarHBondContact O-N 3.49Å
858	F	94.6	Very high	94	Very high	74 Å²	74	50.2 Å²	50.2	33%	0.325	27%	0.274	S	S	.	.	S	Bend	trans	-148.7	160.1	-178.9	62.2	-96.6	0	0	0	110.4	K824 A825 T856	K824-F858 HydrophobicContact CB-CB 4.26Å; K824-F858 HydrophobicContact CB-CD2 3.93Å; K824-F858 HydrophobicContact CB-CG 4.29Å; K824-F858 HydrophobicContact CD-CD1 4.41Å; K824-F858 HydrophobicContact CD-CD2 3.5Å; K824-F858 HydrophobicContact CD-CE1 4.48Å; K824-F858 HydrophobicContact CD-CE2 3.59Å; K824-F858 HydrophobicContact CD-CG 3.96Å; K824-F858 HydrophobicContact CD-CZ 4.1Å; K824-F858 HydrophobicContact CG-CD2 3.57Å; K824-F858 HydrophobicContact CG-CE2 3.91Å; K824-F858 HydrophobicContact CG-CG 4.29Å; A825-F858 CarbonylContact O-C 3.6Å; A825-F858 WeakPolarHBondContact O-CA 3.4Å; T856-F858 WeakPolarHBondContact CB-O 3.01Å; T856-F858 HydrophobicContact CG2-CZ 4.47Å; T856-F858 WeakPolarHBondContact O-CD1 3.37Å; T856-F858 VanDerWaalsContact O-CE1 3.27Å; T856-F858 WeakPolarHBondContact O-CE1 3.26Å; T856-F858 PolarHBondContact O-N 3.25Å; T856-F858 PolarHBondContact OG1-O 3.49Å
859	V	96.5	Very high	93.8	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.012	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.4	172.1	174.5	0	0	0	0	109	F817 K824 A825 F848 A851 G853 F864	F817-V859 WeakPolarHBondContact CE1-O 3.45Å; K824-V859 CarbonylContact C-O 3.58Å; K824-V859 VanDerWaalsContact CA-O 3.27Å; K824-V859 WeakPolarHBondContact CA-O 3.12Å; A825-V859 PolarHBondContact N-O 3Å; A825-V859 PolarHBondContact O-N 2.58Å; F848-V859 HydrophobicContact CD2-CB 4.49Å; F848-V859 HydrophobicContact CD2-CG2 3.56Å; F848-V859 HydrophobicContact CE2-CG2 3.93Å; F848-V859 HydrophobicContact CG-CG2 4.19Å; A851-V859 HydrophobicContact CB-CB 4.4Å; A851-V859 HydrophobicContact CB-CG1 3.5Å; A851-V859 VanDerWaalsContact CB-CG1 3.5Å; A851-V859 HydrophobicContact CB-CG2 3.92Å; G853-V859 VanDerWaalsContact CA-CG2 3.46Å; V859-F864 HydrophobicContact CG1-CB 3.71Å
860	S	95.9	Very high	93.7	Very high	43 Å²	43	56.4 Å²	56.4	30%	0.301	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	151.1	172.5	65.4	0	0	0	0	112.1	H862 S863 F864	S860-H862 PolarHBondContact O-N 3.24Å; S860-H862 VanDerWaalsContact O-N 3.12Å; S860-S863 PolarHBondContact O-N 2.86Å; S860-F864 PolarHBondContact O-N 3.03Å
861	V	96.1	Very high	93.6	Very high	31 Å²	31	54.9 Å²	54.9	19%	0.188	29%	0.287	C	S	.	.	H	α-helix	trans	-47.2	-44.5	177.7	65.5	0	0	0	0	112.5	E814 F817 D823 S863 F864 V865	E814-V861 HydrophobicContact CG-CG2 4.1Å; F817-V861 HydrophobicContact CB-CB 3.66Å; F817-V861 HydrophobicContact CB-CG2 3.63Å; F817-V861 HydrophobicContact CD1-CB 3.83Å; F817-V861 HydrophobicContact CD1-CG2 4.45Å; F817-V861 HydrophobicContact CD2-CB 4.25Å; F817-V861 HydrophobicContact CD2-CG2 4Å; F817-V861 HydrophobicContact CG-CB 3.64Å; F817-V861 HydrophobicContact CG-CG2 3.77Å; D823-V861 HydrophobicContact CB-CB 4.4Å; D823-V861 HydrophobicContact CB-CG1 3.84Å; D823-V861 PolarHBondContact O-N 3.45Å; V861-S863 PolarHBondContact O-N 2.95Å; V861-F864 PolarHBondContact O-N 2.95Å; V861-V865 HydrophobicContact CG2-CG2 4.07Å; V861-V865 WeakPolarHBondContact O-CB 3.28Å; V861-V865 VanDerWaalsContact O-CG2 3.29Å; V861-V865 WeakPolarHBondContact O-CG2 3.14Å; V861-V865 PolarHBondContact O-N 3.47Å
862	H	94.4	Very high	93.4	Very high	151 Å²	151	55.5 Å²	55.5	70%	0.699	29%	0.29	S	S	*	.	H	α-helix	trans	-65.3	-38.6	179.9	179.7	-81.8	0	0	0	112.9	S860 A866	S860-H862 PolarHBondContact O-N 3.24Å; S860-H862 VanDerWaalsContact O-N 3.12Å; H862-A866 WeakPolarHBondContact O-CB 3.4Å; H862-A866 PolarHBondContact O-N 3.28Å
863	S	94.8	Very high	93.2	Very high	44 Å²	44	59.7 Å²	59.7	31%	0.308	30%	0.301	S	S	.	.	H	α-helix	trans	-66.7	-49.4	176.8	-161.2	0	0	0	0	110.4	A851 S860 V861 A866 T867	A851-S863 PolarHBondContact O-OG 3.45Å; S860-S863 PolarHBondContact O-N 2.86Å; V861-S863 PolarHBondContact O-N 2.95Å; S863-A866 PolarHBondContact O-N 3.47Å; S863-T867 PolarHBondContact O-N 3.49Å
864	F	96.4	Very high	93	Very high	1 Å²	1	61.2 Å²	61.2	0%	0.004	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-50.9	180	-174.9	-103.4	0	0	0	112.1	I813 F817 M830 I833 M847 A851 V859 S860 V861 A866 T867 W868	I813-F864 HydrophobicContact CD1-CE1 3.93Å; I813-F864 HydrophobicContact CG1-CE1 4.18Å; I813-F864 HydrophobicContact CG2-CD1 3.53Å; I813-F864 HydrophobicContact CG2-CE1 3.67Å; F817-F864 HydrophobicContact CE2-CB 3.98Å; F817-F864 AromaticContact CE2-CD1 3.57Å; F817-F864 HydrophobicContact CE2-CD1 3.57Å; F817-F864 HydrophobicContact CE2-CE1 4.37Å; F817-F864 AromaticContact CE2-CG 3.9Å; F817-F864 HydrophobicContact CE2-CG 3.9Å; F817-F864 HydrophobicContact CZ-CB 3.73Å; F817-F864 HydrophobicContact CZ-CD1 4.09Å; F817-F864 AromaticContact CZ-CG 3.93Å; F817-F864 HydrophobicContact CZ-CG 3.93Å; M830-F864 HydrophobicContact CE-CD2 3.93Å; M830-F864 HydrophobicContact CE-CE2 3.77Å; M830-F864 HydrophobicContact CE-CZ 4.49Å; I833-F864 HydrophobicContact CG2-CD1 4.04Å; I833-F864 HydrophobicContact CG2-CE1 3.48Å; I833-F864 VanDerWaalsContact CG2-CE1 3.48Å; I833-F864 HydrophobicContact CG2-CE2 4.2Å; I833-F864 HydrophobicContact CG2-CZ 3.6Å; M847-F864 HydrophobicContact CB-CE2 4.18Å; M847-F864 HydrophobicContact CE-CE2 3.81Å; M847-F864 HydrophobicContact CE-CZ 3.48Å; M847-F864 VanDerWaalsContact CE-CZ 3.48Å; A851-F864 HydrophobicContact CB-CB 4.43Å; A851-F864 HydrophobicContact CB-CD2 4.02Å; V859-F864 HydrophobicContact CG1-CB 3.71Å; S860-F864 PolarHBondContact O-N 3.03Å; V861-F864 PolarHBondContact O-N 2.95Å; F864-A866 VanDerWaalsContact C-N 3.25Å; F864-A866 PolarHBondContact O-N 2.84Å; F864-T867 PolarHBondContact O-N 3.24Å; F864-T867 VanDerWaalsContact O-N 3.08Å; F864-W868 HydrophobicContact CD1-CB 4.49Å; F864-W868 HydrophobicContact CE1-CB 4.04Å; F864-W868 HydrophobicContact CE1-CD2 4.43Å; F864-W868 HydrophobicContact CE1-CG 4.16Å; F864-W868 HydrophobicContact CE2-CE3 4.14Å; F864-W868 HydrophobicContact CZ-CB 4.09Å; F864-W868 AromaticContact CZ-CD2 3.92Å; F864-W868 HydrophobicContact CZ-CD2 3.92Å; F864-W868 AromaticContact CZ-CE3 3.7Å; F864-W868 HydrophobicContact CZ-CE3 3.7Å; F864-W868 HydrophobicContact CZ-CG 4.08Å; F864-W868 HydrophobicContact CZ-CZ3 4.48Å; F864-W868 WeakPolarHBondContact O-CB 3.34Å; F864-W868 PolarHBondContact O-N 2.66Å
865	V	95.8	Very high	93.1	Very high	8 Å²	8	54.6 Å²	54.6	5%	0.048	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-31.3	177.9	162.4	0	0	0	0	112.1	I810 I813 E814 V861 R869	I810-V865 HydrophobicContact CD1-CG1 4.34Å; I810-V865 HydrophobicContact CG2-CG1 3.92Å; I810-V865 HydrophobicContact CG2-CG2 4.46Å; I813-V865 HydrophobicContact CG2-CG2 3.71Å; E814-V865 HydrophobicContact CG-CG2 3.91Å; V861-V865 HydrophobicContact CG2-CG2 4.07Å; V861-V865 WeakPolarHBondContact O-CB 3.28Å; V861-V865 VanDerWaalsContact O-CG2 3.29Å; V861-V865 WeakPolarHBondContact O-CG2 3.14Å; V861-V865 PolarHBondContact O-N 3.47Å; V865-R869 WeakPolarHBondContact O-CB 3.43Å; V865-R869 PolarHBondContact O-N 2.71Å; V865-R869 VanDerWaalsContact O-N 3.07Å; V865-R869 PolarHBondContact O-NH1 3.25Å
866	A	94.7	Very high	93.1	Very high	33 Å²	33	47.3 Å²	47.3	27%	0.273	26%	0.256	S	S	.	.	H	α-helix	trans	-72.4	-35.8	173.5	0	0	0	0	0	113.3	H862 S863 F864 K870	H862-A866 WeakPolarHBondContact O-CB 3.4Å; H862-A866 PolarHBondContact O-N 3.28Å; S863-A866 PolarHBondContact O-N 3.47Å; F864-A866 VanDerWaalsContact C-N 3.25Å; F864-A866 PolarHBondContact O-N 2.84Å; A866-K870 WeakPolarHBondContact O-CD 3.31Å; A866-K870 WeakPolarHBondContact O-CG 3.34Å
867	T	93.7	Very high	93.2	Very high	20 Å²	20	45.3 Å²	45.3	12%	0.123	24%	0.243	C	C	.	.	H	α-helix	trans	-75.2	-49.2	174.1	-73.9	0	0	0	0	111.4	A850 S863 F864 R869 K870 L871	A850-T867 HydrophobicContact CB-CG2 4.31Å; A850-T867 PolarHBondContact O-OG1 2.82Å; S863-T867 PolarHBondContact O-N 3.49Å; F864-T867 PolarHBondContact O-N 3.24Å; F864-T867 VanDerWaalsContact O-N 3.08Å; T867-R869 PolarHBondContact O-N 3.49Å; T867-K870 WeakPolarHBondContact O-CB 3.26Å; T867-K870 PolarHBondContact O-N 3.24Å; T867-L871 PolarHBondContact O-N 2.86Å
868	W	94.8	Very high	93.3	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.015	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-39.5	-179.2	-161.2	-105.7	0	0	0	112.5	I813 C837 M847 F864 K870 L871 L872 L885	I813-W868 VanDerWaalsContact CD1-CD1 3.41Å; I813-W868 HydrophobicContact CD1-CG 4.07Å; C837-W868 HydrophobicContact CB-CH2 3.92Å; C837-W868 HydrophobicContact CB-CZ2 3.55Å; M847-W868 HydrophobicContact CE-CE3 4.23Å; M847-W868 HydrophobicContact CE-CH2 4.25Å; M847-W868 HydrophobicContact CE-CZ3 3.81Å; M847-W868 HydrophobicContact CG-CZ3 4.23Å; M847-W868 HydrophobicContact SD-CZ3 4.34Å; F864-W868 HydrophobicContact CD1-CB 4.49Å; F864-W868 HydrophobicContact CE1-CB 4.04Å; F864-W868 HydrophobicContact CE1-CD2 4.43Å; F864-W868 HydrophobicContact CE1-CG 4.16Å; F864-W868 HydrophobicContact CE2-CE3 4.14Å; F864-W868 HydrophobicContact CZ-CB 4.09Å; F864-W868 AromaticContact CZ-CD2 3.92Å; F864-W868 HydrophobicContact CZ-CD2 3.92Å; F864-W868 AromaticContact CZ-CE3 3.7Å; F864-W868 HydrophobicContact CZ-CE3 3.7Å; F864-W868 HydrophobicContact CZ-CG 4.08Å; F864-W868 HydrophobicContact CZ-CZ3 4.48Å; F864-W868 WeakPolarHBondContact O-CB 3.34Å; F864-W868 PolarHBondContact O-N 2.66Å; W868-K870 VanDerWaalsContact C-N 3.3Å; W868-K870 PolarHBondContact O-N 2.94Å; W868-L871 HydrophobicContact CD2-CD2 4.1Å; W868-L871 HydrophobicContact CE3-CD2 3.5Å; W868-L871 HydrophobicContact CH2-CD2 3.59Å; W868-L871 HydrophobicContact CZ2-CD2 4.17Å; W868-L871 HydrophobicContact CZ3-CD2 3.23Å; W868-L871 WeakPolarHBondContact O-CB 3.24Å; W868-L871 PolarHBondContact O-N 3.44Å; W868-L872 WeakPolarHBondContact O-CG 3.29Å; W868-L872 PolarHBondContact O-N 2.9Å; W868-L885 HydrophobicContact CZ3-CD1 4.43Å
869	R	93.2	Very high	93.3	Very high	97 Å²	97	43.6 Å²	43.6	37%	0.366	23%	0.225	S	C	.	.	H	α-helix	trans	-63.3	-33.2	174.4	-170.5	-178.2	-69.8	105.5	-10.5	112.3	I810 V865 T867 H873	I810-R869 HydrophobicContact CD1-CB 4.25Å; V865-R869 WeakPolarHBondContact O-CB 3.43Å; V865-R869 PolarHBondContact O-N 2.71Å; V865-R869 VanDerWaalsContact O-N 3.07Å; V865-R869 PolarHBondContact O-NH1 3.25Å; T867-R869 PolarHBondContact O-N 3.49Å; R869-H873 PolarHBondContact O-ND1 2.8Å
870	K	91.9	Very high	93.2	Very high	119 Å²	119	43.5 Å²	43.5	52%	0.517	23%	0.225	S	C	.	.	H	α-helix	trans	-66.8	-50.1	171.9	-66.2	163.8	-171	168.1	0	110.2	A866 T867 W868 L872 H873 S874	A866-K870 WeakPolarHBondContact O-CD 3.31Å; A866-K870 WeakPolarHBondContact O-CG 3.34Å; T867-K870 WeakPolarHBondContact O-CB 3.26Å; T867-K870 PolarHBondContact O-N 3.24Å; W868-K870 VanDerWaalsContact C-N 3.3Å; W868-K870 PolarHBondContact O-N 2.94Å; K870-L872 PolarHBondContact O-N 3.17Å; K870-H873 PolarHBondContact O-N 3.11Å; K870-S874 PolarHBondContact O-N 3.42Å; K870-S874 PolarHBondContact O-OG 3.43Å
871	L	92.3	Very high	93.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-51.1	-51.3	-179.4	-168.2	78.9	0	0	0	112	T867 W868 H873 S874 C875 R881 Y884 L885	T867-L871 PolarHBondContact O-N 2.86Å; W868-L871 HydrophobicContact CD2-CD2 4.1Å; W868-L871 HydrophobicContact CE3-CD2 3.5Å; W868-L871 HydrophobicContact CH2-CD2 3.59Å; W868-L871 HydrophobicContact CZ2-CD2 4.17Å; W868-L871 HydrophobicContact CZ3-CD2 3.23Å; W868-L871 WeakPolarHBondContact O-CB 3.24Å; W868-L871 PolarHBondContact O-N 3.44Å; L871-H873 PolarHBondContact O-N 2.7Å; L871-S874 PolarHBondContact O-N 3.08Å; L871-S874 PolarHBondContact O-OG 3.03Å; L871-C875 HydrophobicContact CD1-CB 4.44Å; L871-C875 WeakPolarHBondContact O-CB 3.43Å; L871-C875 PolarHBondContact O-N 3.39Å; L871-R881 HydrophobicContact CD1-CB 4.3Å; L871-R881 HydrophobicContact CD1-CG 4.46Å; L871-R881 HydrophobicContact CD2-CB 4.2Å; L871-R881 HydrophobicContact CD2-CG 4.16Å; L871-R881 HydrophobicContact CG-CB 4.39Å; L871-R881 HydrophobicContact CG-CG 4.14Å; L871-Y884 HydrophobicContact CD1-CD1 3.28Å; L871-Y884 HydrophobicContact CD1-CE1 4.04Å; L871-Y884 HydrophobicContact CD1-CG 3.66Å; L871-L885 HydrophobicContact CD1-CD2 4.39Å; L871-L885 HydrophobicContact CD1-CG 4.29Å; L871-L885 HydrophobicContact CD2-CD1 4.44Å; L871-L885 HydrophobicContact CD2-CD2 4.29Å; L871-L885 HydrophobicContact CD2-CG 4.42Å
872	L	89.6	Confident	93.2	Very high	17 Å²	17	42.8 Å²	42.8	9%	0.089	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-28.5	179.3	-69.3	176.2	0	0	0	113.6	H806 W868 K870	H806-L872 PolarHBondContact CE1-O 3.33Å; W868-L872 WeakPolarHBondContact O-CG 3.29Å; W868-L872 PolarHBondContact O-N 2.9Å; K870-L872 PolarHBondContact O-N 3.17Å
873	H	87.3	Confident	93.2	Very high	118 Å²	118	35.7 Å²	35.7	55%	0.546	18%	0.179	S	C	.	.	H	α-helix	trans	-88	-24.4	177.5	-72.7	85.6	0	0	0	113.3	R869 K870 L871	R869-H873 PolarHBondContact O-ND1 2.8Å; K870-H873 PolarHBondContact O-N 3.11Å; L871-H873 PolarHBondContact O-N 2.7Å
874	S	88.9	Confident	93.2	Very high	33 Å²	33	37 Å²	37	23%	0.231	18%	0.178	C	C	.	.	H	α-helix	trans	-98.4	-28.3	-178.5	59.1	0	0	0	0	114.8	R795 K870 L871	R795-S874 WeakPolarHBondContact CB-O 3.42Å; R795-S874 WeakPolarHBondContact CD-O 3.26Å; K870-S874 PolarHBondContact O-N 3.42Å; K870-S874 PolarHBondContact O-OG 3.43Å; L871-S874 PolarHBondContact O-N 3.08Å; L871-S874 PolarHBondContact O-OG 3.03Å
875	C	91.3	Very high	93.1	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.007	18%	0.18	C	C	.	.			trans	-130.3	117.7	-166.1	-60.6	0	0	0	0	111.2	L871 S880 R881	L871-C875 HydrophobicContact CD1-CB 4.44Å; L871-C875 WeakPolarHBondContact O-CB 3.43Å; L871-C875 PolarHBondContact O-N 3.39Å; C875-S880 WeakPolarHBondContact CB-OG 3.48Å; C875-S880 PolarHBondContact SG-O 2.65Å; C875-R881 HydrophobicContact CB-CG 3.83Å
876	H	90.6	Very high	93.1	Very high	66 Å²	66	38.1 Å²	38.1	31%	0.306	18%	0.184	S	C	.	.			trans	-108.7	-3.3	-168.3	-49.6	-49.6	0	0	0	113.8	R795 G796 S880	R795-H876 WeakPolarHBondContact O-CB 3.44Å; R795-H876 PolarHBondContact O-CD2 3.39Å; R795-H876 PolarHBondContact O-N 2.68Å; G796-H876 PolarHBondContact O-CD2 3.49Å; H876-S880 PolarHBondContact N-OG 3.28Å
877	D	92.3	Very high	93.1	Very high	38 Å²	38	37.5 Å²	37.5	20%	0.203	18%	0.177	C	C	.	.	S	Bend	trans	-137.2	163.8	172.5	59.1	25.2	0	0	0	111.2	G796 S879 S880 R881 R952	G796-D877 WeakPolarHBondContact CA-OD2 3.21Å; G796-D877 PolarHBondContact N-OD2 3.45Å; D877-S879 PolarHBondContact O-N 3.33Å; D877-S880 PolarHBondContact N-OG 3.34Å; D877-S880 PolarHBondContact O-N 3.08Å; D877-S880 PolarHBondContact O-OG 3.31Å; D877-S880 WeakPolarHBondContact OD1-CB 3.49Å; D877-S880 PolarHBondContact OD1-N 3.29Å; D877-S880 PolarHBondContact OD1-OG 3Å; D877-R881 WeakPolarHBondContact O-CG 3.36Å; D877-R881 PolarHBondContact O-N 2.82Å; D877-R952 VanDerWaalsContact CG-NH2 3.34Å; D877-R952 IonicContact OD1-CZ 2.7Å; D877-R952 IonicContact OD1-NE 3.99Å; D877-R952 IonicContact OD1-NH2 3.05Å; D877-R952 PolarHBondContact OD1-NH2 3.32Å; D877-R952 IonicContact OD2-CZ 3.2Å; D877-R952 IonicContact OD2-NE 2.76Å; D877-R952 PolarHBondContact OD2-NE 3.04Å; D877-R952 IonicContact OD2-NH2 2.74Å; D877-R952 PolarHBondContact OD2-NH2 3.39Å
878	D	94.1	Very high	92.9	Very high	76 Å²	76	40.3 Å²	40.3	41%	0.406	19%	0.188	S	C	.	.	H	α-helix	trans	-69.5	-33.9	-170.3	-60.8	-54.7	0	0	0	113	W843 S880 R881 F882 L957	W843-D878 HydrophobicContact CH2-CB 3.91Å; W843-D878 WeakPolarHBondContact CH2-O 3.38Å; W843-D878 HydrophobicContact CZ2-CB 4.26Å; D878-S880 PolarHBondContact O-N 3.08Å; D878-R881 PolarHBondContact O-N 3.48Å; D878-R881 IonicContact OD1-CZ 2.63Å; D878-R881 IonicContact OD1-NH1 3.28Å; D878-R881 PolarHBondContact OD1-NH1 2.97Å; D878-R881 IonicContact OD2-NH1 3.63Å; D878-F882 VanDerWaalsContact O-CB 3.26Å; D878-F882 WeakPolarHBondContact O-CB 3Å; D878-F882 PolarHBondContact O-N 3.22Å; D878-L957 HydrophobicContact CB-CD1 4.48Å
879	S	95.1	Very high	92.5	Very high	13 Å²	13	46.9 Å²	46.9	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-39.6	172.2	-45.5	0	0	0	0	113	D877 I883 L951 R952	D877-S879 PolarHBondContact O-N 3.33Å; S879-I883 WeakPolarHBondContact O-CG1 3.43Å; S879-I883 PolarHBondContact O-N 2.93Å; S879-L951 PolarHBondContact OG-O 2.91Å; S879-R952 VanDerWaalsContact OG-CG 3.25Å; S879-R952 WeakPolarHBondContact OG-CG 3.25Å
880	S	94.4	Very high	92	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-75.9	-26.1	175.1	62.7	0	0	0	0	113.4	R795 C875 H876 D877 D878 Y884 M948	R795-S880 PolarHBondContact O-OG 2.88Å; C875-S880 WeakPolarHBondContact CB-OG 3.48Å; C875-S880 PolarHBondContact SG-O 2.65Å; H876-S880 PolarHBondContact N-OG 3.28Å; D877-S880 PolarHBondContact N-OG 3.34Å; D877-S880 PolarHBondContact O-N 3.08Å; D877-S880 PolarHBondContact O-OG 3.31Å; D877-S880 WeakPolarHBondContact OD1-CB 3.49Å; D877-S880 PolarHBondContact OD1-N 3.29Å; D877-S880 PolarHBondContact OD1-OG 3Å; D878-S880 PolarHBondContact O-N 3.08Å; S880-Y884 WeakPolarHBondContact O-CB 3.33Å; S880-Y884 PolarHBondContact O-N 3.33Å; S880-M948 VanDerWaalsContact CB-SD 3.54Å
881	R	94.5	Very high	91.9	Very high	60 Å²	60	42.8 Å²	42.8	23%	0.226	24%	0.24	C	C	.	.	H	α-helix	trans	-69.2	-52.8	171.2	-69.5	167.6	-173.6	156.2	-1.6	111	W843 L871 C875 D877 D878 I883 Y884 L885	W843-R881 HydrophobicContact CH2-CB 4.22Å; W843-R881 HydrophobicContact CZ3-CB 3.97Å; L871-R881 HydrophobicContact CD1-CB 4.3Å; L871-R881 HydrophobicContact CD1-CG 4.46Å; L871-R881 HydrophobicContact CD2-CB 4.2Å; L871-R881 HydrophobicContact CD2-CG 4.16Å; L871-R881 HydrophobicContact CG-CB 4.39Å; L871-R881 HydrophobicContact CG-CG 4.14Å; C875-R881 HydrophobicContact CB-CG 3.83Å; D877-R881 WeakPolarHBondContact O-CG 3.36Å; D877-R881 PolarHBondContact O-N 2.82Å; D878-R881 PolarHBondContact O-N 3.48Å; D878-R881 IonicContact OD1-CZ 2.63Å; D878-R881 IonicContact OD1-NH1 3.28Å; D878-R881 PolarHBondContact OD1-NH1 2.97Å; D878-R881 IonicContact OD2-NH1 3.63Å; R881-I883 PolarHBondContact O-N 3.33Å; R881-Y884 PolarHBondContact O-N 2.65Å; R881-Y884 VanDerWaalsContact O-N 3.16Å; R881-L885 WeakPolarHBondContact O-CG 3.39Å; R881-L885 PolarHBondContact O-N 3.26Å
882	F	96.3	Very high	91.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.6	-51	-177.7	-172	-96.3	0	0	0	111.6	W843 D878 Y884 L885 L886 L894 F899 L902 L951 F956 L957 L960	W843-F882 HydrophobicContact CD2-CD2 4.22Å; W843-F882 AromaticContact CE2-CD2 3.82Å; W843-F882 HydrophobicContact CH2-CB 3.89Å; W843-F882 HydrophobicContact CH2-CD2 4.3Å; W843-F882 HydrophobicContact CZ2-CB 4.12Å; W843-F882 AromaticContact CZ2-CD2 3.88Å; W843-F882 HydrophobicContact CZ2-CD2 3.88Å; W843-F882 HydrophobicContact CZ2-CG 4.44Å; W843-F882 HydrophobicContact CZ3-CB 4.43Å; D878-F882 VanDerWaalsContact O-CB 3.26Å; D878-F882 WeakPolarHBondContact O-CB 3Å; D878-F882 PolarHBondContact O-N 3.22Å; F882-Y884 VanDerWaalsContact C-N 3.32Å; F882-Y884 PolarHBondContact O-N 3.43Å; F882-L885 PolarHBondContact O-N 2.73Å; F882-L886 HydrophobicContact CD1-CD1 3.9Å; F882-L886 HydrophobicContact CD2-CD1 3.87Å; F882-L886 HydrophobicContact CE1-CD1 3.76Å; F882-L886 HydrophobicContact CE1-CD2 3.77Å; F882-L886 HydrophobicContact CE1-CG 4.42Å; F882-L886 HydrophobicContact CE2-CD1 3.71Å; F882-L886 HydrophobicContact CG-CD1 3.98Å; F882-L886 HydrophobicContact CZ-CD1 3.66Å; F882-L886 HydrophobicContact CZ-CD2 3.75Å; F882-L886 HydrophobicContact CZ-CG 4.42Å; F882-L886 WeakPolarHBondContact O-CD1 3.18Å; F882-L886 PolarHBondContact O-N 2.65Å; F882-L886 VanDerWaalsContact O-N 3.09Å; F882-L894 HydrophobicContact CD1-CD1 4.19Å; F882-L894 HydrophobicContact CE1-CD1 4.04Å; F882-F899 HydrophobicContact CE1-CE1 4.25Å; F882-L902 HydrophobicContact CE2-CD2 4.19Å; F882-L902 HydrophobicContact CZ-CD2 3.68Å; F882-L951 HydrophobicContact CB-CD2 4.29Å; F882-L951 HydrophobicContact CD1-CD2 3.68Å; F882-L951 HydrophobicContact CE1-CD2 4.48Å; F882-L951 HydrophobicContact CG-CD2 4.37Å; F882-F956 AromaticContact CE1-CE1 3.95Å; F882-F956 HydrophobicContact CE1-CE1 3.95Å; F882-F956 AromaticContact CZ-CE1 3.74Å; F882-F956 HydrophobicContact CZ-CE1 3.74Å; F882-F956 HydrophobicContact CZ-CZ 4.48Å; F882-L957 HydrophobicContact CB-CD1 4.38Å; F882-L957 HydrophobicContact CB-CD2 4.12Å; F882-L957 HydrophobicContact CD1-CD2 3.91Å; F882-L957 HydrophobicContact CD2-CD2 3.69Å; F882-L957 HydrophobicContact CE1-CD2 4.18Å; F882-L957 HydrophobicContact CE2-CD2 3.99Å; F882-L957 HydrophobicContact CG-CD2 3.63Å; F882-L957 HydrophobicContact CZ-CD2 4.2Å; F882-L960 HydrophobicContact CD2-CD2 4.34Å; F882-L960 HydrophobicContact CE2-CD2 3.47Å; F882-L960 VanDerWaalsContact CE2-CD2 3.47Å; F882-L960 HydrophobicContact CZ-CD2 3.93Å
883	I	95.4	Very high	92.1	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-41.3	177.1	-67.3	-170.1	0	0	0	111.6	S879 R881 L885 L886 S887 L894 M948 L951	S879-I883 WeakPolarHBondContact O-CG1 3.43Å; S879-I883 PolarHBondContact O-N 2.93Å; R881-I883 PolarHBondContact O-N 3.33Å; I883-L885 PolarHBondContact O-N 3.48Å; I883-L886 PolarHBondContact O-N 3.44Å; I883-S887 WeakPolarHBondContact O-CB 3.29Å; I883-S887 PolarHBondContact O-N 2.87Å; I883-S887 PolarHBondContact O-OG 2.99Å; I883-L894 HydrophobicContact CB-CG 4.45Å; I883-L894 HydrophobicContact CG1-CD1 4.02Å; I883-L894 HydrophobicContact CG1-CG 4Å; I883-L894 HydrophobicContact CG2-CD2 4.15Å; I883-L894 HydrophobicContact CG2-CG 4.27Å; I883-M948 HydrophobicContact CB-CE 4.39Å; I883-M948 HydrophobicContact CB-CG 4.29Å; I883-M948 HydrophobicContact CD1-CB 4.3Å; I883-M948 HydrophobicContact CD1-CG 3.84Å; I883-M948 VanDerWaalsContact CD1-N 3.32Å; I883-M948 HydrophobicContact CG1-CG 4.48Å; I883-M948 HydrophobicContact CG2-CE 4.3Å; I883-M948 HydrophobicContact CG2-CG 4.43Å; I883-L951 HydrophobicContact CD1-CB 4.35Å; I883-L951 HydrophobicContact CD1-CD2 3.91Å; I883-L951 HydrophobicContact CG1-CD2 3.58Å
884	Y	94.3	Very high	92.6	Very high	72 Å²	72	42.8 Å²	42.8	28%	0.282	24%	0.242	S	C	.	.	H	α-helix	trans	-62.2	-30.4	176.7	-178.9	-74.2	0	0	0	112.9	L871 S880 R881 F882	L871-Y884 HydrophobicContact CD1-CD1 3.28Å; L871-Y884 HydrophobicContact CD1-CE1 4.04Å; L871-Y884 HydrophobicContact CD1-CG 3.66Å; S880-Y884 WeakPolarHBondContact O-CB 3.33Å; S880-Y884 PolarHBondContact O-N 3.33Å; R881-Y884 PolarHBondContact O-N 2.65Å; R881-Y884 VanDerWaalsContact O-N 3.16Å; F882-Y884 VanDerWaalsContact C-N 3.32Å; F882-Y884 PolarHBondContact O-N 3.43Å
885	L	95.3	Very high	93	Very high	10 Å²	10	43.3 Å²	43.3	5%	0.052	24%	0.241	C	C	.	.	H	α-helix	trans	-76.5	-40.9	179	-67.8	170	0	0	0	112.5	W843 A846 M847 A850 W868 L871 R881 F882 I883	W843-L885 HydrophobicContact CE3-CD1 3.9Å; W843-L885 HydrophobicContact CZ3-CD1 4.12Å; A846-L885 HydrophobicContact CB-CB 4.07Å; M847-L885 HydrophobicContact CG-CD1 4Å; A850-L885 HydrophobicContact CB-CB 4.25Å; A850-L885 HydrophobicContact CB-CD2 3.55Å; A850-L885 WeakPolarHBondContact CB-O 3.45Å; W868-L885 HydrophobicContact CZ3-CD1 4.43Å; L871-L885 HydrophobicContact CD1-CD2 4.39Å; L871-L885 HydrophobicContact CD1-CG 4.29Å; L871-L885 HydrophobicContact CD2-CD1 4.44Å; L871-L885 HydrophobicContact CD2-CD2 4.29Å; L871-L885 HydrophobicContact CD2-CG 4.42Å; R881-L885 WeakPolarHBondContact O-CG 3.39Å; R881-L885 PolarHBondContact O-N 3.26Å; F882-L885 PolarHBondContact O-N 2.73Å; I883-L885 PolarHBondContact O-N 3.48Å
886	L	95.4	Very high	93.2	Very high	22 Å²	22	45.4 Å²	45.4	12%	0.115	25%	0.251	C	S	.	.	H	α-helix	trans	-87	-30.7	-178.5	-73.8	79.5	0	0	0	113.1	A846 F882 I883 L894 F899 L902	A846-L886 HydrophobicContact CB-CD1 3.49Å; A846-L886 VanDerWaalsContact CB-CD1 3.49Å; A846-L886 HydrophobicContact CB-CG 4.2Å; F882-L886 HydrophobicContact CD1-CD1 3.9Å; F882-L886 HydrophobicContact CD2-CD1 3.87Å; F882-L886 HydrophobicContact CE1-CD1 3.76Å; F882-L886 HydrophobicContact CE1-CD2 3.77Å; F882-L886 HydrophobicContact CE1-CG 4.42Å; F882-L886 HydrophobicContact CE2-CD1 3.71Å; F882-L886 HydrophobicContact CG-CD1 3.98Å; F882-L886 HydrophobicContact CZ-CD1 3.66Å; F882-L886 HydrophobicContact CZ-CD2 3.75Å; F882-L886 HydrophobicContact CZ-CG 4.42Å; F882-L886 WeakPolarHBondContact O-CD1 3.18Å; F882-L886 PolarHBondContact O-N 2.65Å; F882-L886 VanDerWaalsContact O-N 3.09Å; I883-L886 PolarHBondContact O-N 3.44Å; L886-L894 HydrophobicContact CB-CD1 4.01Å; L886-L894 HydrophobicContact CB-CD2 3.51Å; L886-L894 HydrophobicContact CB-CG 4.42Å; L886-L894 HydrophobicContact CD2-CD1 4.11Å; L886-F899 HydrophobicContact CD2-CD1 4.38Å; L886-L902 HydrophobicContact CD2-CB 4.46Å; L886-L902 HydrophobicContact CD2-CD2 4.27Å
887	S	93.7	Very high	93.5	Very high	20 Å²	20	47.4 Å²	47.4	14%	0.14	26%	0.26	C	S	.	.	S	Bend	trans	-67.8	137.7	-169.7	67.1	0	0	0	0	113.6	I883 Y893 L894	I883-S887 WeakPolarHBondContact O-CB 3.29Å; I883-S887 PolarHBondContact O-N 2.87Å; I883-S887 PolarHBondContact O-OG 2.99Å; S887-Y893 WeakPolarHBondContact CB-O 3.44Å; S887-L894 VanDerWaalsContact N-CD2 3.34Å
888	K	90	Very high	93.7	Very high	79 Å²	79	46.3 Å²	46.3	34%	0.343	26%	0.255	S	S	.	.			trans	-54.2	141.4	171.3	-53.1	-179.9	175.7	77	0	111	G890 L891 E895 E897 D898	K888-G890 PolarHBondContact O-N 3.08Å; K888-L891 HydrophobicContact CB-CD1 3.84Å; K888-L891 HydrophobicContact CB-CG 4.27Å; K888-L891 HydrophobicContact CD-CD1 4.38Å; K888-L891 HydrophobicContact CG-CD1 4.35Å; K888-L891 PolarHBondContact O-N 3.34Å; K888-E895 WeakPolarHBondContact CE-OE2 3.49Å; K888-E895 IonicContact NZ-OE2 2.71Å; K888-E895 PolarHBondContact NZ-OE2 3.29Å; K888-E897 IonicContact NZ-OE2 3.79Å; K888-D898 WeakPolarHBondContact CE-OD1 3.47Å; K888-D898 WeakPolarHBondContact CG-OD1 3.19Å; K888-D898 IonicContact NZ-OD1 2.78Å; K888-D898 PolarHBondContact NZ-OD1 3Å; K888-D898 IonicContact NZ-OD2 2.79Å
889	P	86.6	Confident	93.9	Very high	143 Å²	143	42.7 Å²	42.7	93%	0.929	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	109.7	-169	-29.2	36.2	0	0	0	115.3
890	G	82.9	Confident	93.9	Very high	76 Å²	76	45.6 Å²	45.6	78%	0.784	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	110.9	-12.5	178.2	0	0	0	0	0	114.5	K888	K888-G890 PolarHBondContact O-N 3.08Å
891	L	90.2	Very high	93.9	Very high	53 Å²	53	47.6 Å²	47.6	28%	0.277	26%	0.262	S	S	.	.			trans	-77.8	169.1	172.3	-54.2	-173.6	0	0	0	111.4	K888 Y893	K888-L891 HydrophobicContact CB-CD1 3.84Å; K888-L891 HydrophobicContact CB-CG 4.27Å; K888-L891 HydrophobicContact CD-CD1 4.38Å; K888-L891 HydrophobicContact CG-CD1 4.35Å; K888-L891 PolarHBondContact O-N 3.34Å; L891-Y893 HydrophobicContact CB-CE1 4.48Å; L891-Y893 HydrophobicContact CB-CE2 4.47Å; L891-Y893 HydrophobicContact CD1-CD2 4.49Å; L891-Y893 HydrophobicContact CD1-CE2 3.75Å; L891-Y893 HydrophobicContact CD2-CE1 4.29Å; L891-Y893 HydrophobicContact CG-CE2 4.49Å
892	T	91.3	Very high	94	Very high	74 Å²	74	44.9 Å²	44.9	45%	0.454	25%	0.252	S	S	.	.	S	Bend	trans	-136	22	176.7	60.7	0	0	0	0	112.8
893	Y	95.4	Very high	94.1	Very high	61 Å²	61	44.9 Å²	44.9	24%	0.239	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	172.2	-179.7	56.5	-105.4	0	0	0	108	S887 L891 E895 H945 V946	S887-Y893 WeakPolarHBondContact CB-O 3.44Å; L891-Y893 HydrophobicContact CB-CE1 4.48Å; L891-Y893 HydrophobicContact CB-CE2 4.47Å; L891-Y893 HydrophobicContact CD1-CD2 4.49Å; L891-Y893 HydrophobicContact CD1-CE2 3.75Å; L891-Y893 HydrophobicContact CD2-CE1 4.29Å; L891-Y893 HydrophobicContact CG-CE2 4.49Å; Y893-E895 HydrophobicContact CD2-CG 4.25Å; Y893-E895 HydrophobicContact CE2-CG 3.79Å; Y893-E895 WeakPolarHBondContact CE2-OE1 3.32Å; Y893-E895 PolarHBondContact OH-OE1 2.97Å; Y893-H945 HydrophobicContact CD1-CB 4.41Å; Y893-H945 HydrophobicContact CD2-CB 3.72Å; Y893-H945 AromaticContact CD2-CD2 3.47Å; Y893-H945 VanDerWaalsContact CD2-CD2 3.47Å; Y893-H945 WeakPolarHBondContact CD2-CD2 3.39Å; Y893-H945 AromaticContact CD2-CG 3.85Å; Y893-H945 HydrophobicContact CE2-CB 4.26Å; Y893-H945 AromaticContact CE2-CD2 3.15Å; Y893-H945 WeakPolarHBondContact CE2-CD2 3.33Å; Y893-H945 AromaticContact CE2-CG 3.87Å; Y893-H945 AromaticContact CE2-NE2 3.9Å; Y893-H945 HydrophobicContact CG-CB 3.79Å; Y893-H945 AromaticContact CZ-CD2 3.74Å; Y893-V946 CarbonylContact C-O 3.47Å; Y893-V946 WeakPolarHBondContact CA-O 3.44Å; Y893-V946 WeakPolarHBondContact CB-O 3.39Å
894	L	97.4	Very high	94	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.2	173.6	-56.4	179.2	0	0	0	111.2	F882 I883 L886 S887 D898 F899 H945 V946	F882-L894 HydrophobicContact CD1-CD1 4.19Å; F882-L894 HydrophobicContact CE1-CD1 4.04Å; I883-L894 HydrophobicContact CB-CG 4.45Å; I883-L894 HydrophobicContact CG1-CD1 4.02Å; I883-L894 HydrophobicContact CG1-CG 4Å; I883-L894 HydrophobicContact CG2-CD2 4.15Å; I883-L894 HydrophobicContact CG2-CG 4.27Å; L886-L894 HydrophobicContact CB-CD1 4.01Å; L886-L894 HydrophobicContact CB-CD2 3.51Å; L886-L894 HydrophobicContact CB-CG 4.42Å; L886-L894 HydrophobicContact CD2-CD1 4.11Å; S887-L894 VanDerWaalsContact N-CD2 3.34Å; L894-D898 WeakPolarHBondContact CA-OD2 3.32Å; L894-D898 HydrophobicContact CB-CB 4.27Å; L894-D898 HydrophobicContact CD2-CB 4.15Å; L894-F899 HydrophobicContact CB-CD2 4.41Å; L894-F899 HydrophobicContact CB-CE2 3.66Å; L894-F899 HydrophobicContact CB-CZ 4.26Å; L894-F899 HydrophobicContact CD1-CE1 4.33Å; L894-F899 HydrophobicContact CD1-CE2 3.83Å; L894-F899 HydrophobicContact CD1-CZ 3.65Å; L894-F899 HydrophobicContact CG-CE2 4.4Å; L894-H945 WeakPolarHBondContact O-CA 3.49Å; L894-V946 HydrophobicContact CB-CB 4.34Å; L894-V946 PolarHBondContact N-O 3.22Å; L894-V946 PolarHBondContact O-N 3.01Å
895	E	96.3	Very high	94	Very high	44 Å²	44	44.8 Å²	44.8	21%	0.206	25%	0.254	C	S	.	.			trans	-88.2	172	169.2	-67.9	161.8	177.5	0	0	109.5	K888 Y893 E897 D898	K888-E895 WeakPolarHBondContact CE-OE2 3.49Å; K888-E895 IonicContact NZ-OE2 2.71Å; K888-E895 PolarHBondContact NZ-OE2 3.29Å; Y893-E895 HydrophobicContact CD2-CG 4.25Å; Y893-E895 HydrophobicContact CE2-CG 3.79Å; Y893-E895 WeakPolarHBondContact CE2-OE1 3.32Å; Y893-E895 PolarHBondContact OH-OE1 2.97Å; E895-E897 VanDerWaalsContact C-N 3.31Å; E895-E897 WeakPolarHBondContact CB-OE2 3.35Å; E895-E897 PolarHBondContact O-N 2.88Å; E895-D898 PolarHBondContact N-OD2 3.4Å; E895-D898 PolarHBondContact O-N 3.5Å
896	Q	96	Very high	94.1	Very high	45 Å²	45	44.3 Å²	44.3	21%	0.21	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-63.2	-37.8	-176.4	-77.8	-161.8	-7.7	0	0	112.4	D898 F899 I931 F935	Q896-D898 VanDerWaalsContact C-N 3.25Å; Q896-D898 PolarHBondContact O-N 3.17Å; Q896-F899 PolarHBondContact O-N 3.22Å; Q896-I931 HydrophobicContact CB-CG2 3.77Å; Q896-I931 HydrophobicContact CG-CG2 3.7Å; Q896-F935 HydrophobicContact CB-CE2 4.36Å; Q896-F935 HydrophobicContact CB-CZ 4.42Å; Q896-F935 HydrophobicContact CG-CD1 4.22Å; Q896-F935 HydrophobicContact CG-CD2 3.9Å; Q896-F935 HydrophobicContact CG-CE1 4Å; Q896-F935 HydrophobicContact CG-CE2 3.68Å; Q896-F935 HydrophobicContact CG-CG 4.17Å; Q896-F935 HydrophobicContact CG-CZ 3.73Å
897	E	96	Very high	94	Very high	108 Å²	108	43.3 Å²	43.3	51%	0.505	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-69.8	-23.3	-177.5	-50.5	74.6	-163.2	0	0	112.4	K888 E895 F899 I900	K888-E897 IonicContact NZ-OE2 3.79Å; E895-E897 VanDerWaalsContact C-N 3.31Å; E895-E897 WeakPolarHBondContact CB-OE2 3.35Å; E895-E897 PolarHBondContact O-N 2.88Å; E897-F899 PolarHBondContact O-N 2.93Å; E897-I900 HydrophobicContact CB-CD1 4.15Å; E897-I900 WeakPolarHBondContact O-CB 3.4Å; E897-I900 PolarHBondContact O-N 3.04Å; E897-I900 VanDerWaalsContact O-N 3.16Å
898	D	96.9	Very high	94	Very high	15 Å²	15	44.6 Å²	44.6	8%	0.08	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-66.7	-20.9	179.8	-64.3	-22.2	0	0	0	112.1	K888 L894 E895 Q896	K888-D898 WeakPolarHBondContact CE-OD1 3.47Å; K888-D898 WeakPolarHBondContact CG-OD1 3.19Å; K888-D898 IonicContact NZ-OD1 2.78Å; K888-D898 PolarHBondContact NZ-OD1 3Å; K888-D898 IonicContact NZ-OD2 2.79Å; L894-D898 WeakPolarHBondContact CA-OD2 3.32Å; L894-D898 HydrophobicContact CB-CB 4.27Å; L894-D898 HydrophobicContact CD2-CB 4.15Å; E895-D898 PolarHBondContact N-OD2 3.4Å; E895-D898 PolarHBondContact O-N 3.5Å; Q896-D898 VanDerWaalsContact C-N 3.25Å; Q896-D898 PolarHBondContact O-N 3.17Å
899	F	97.6	Very high	94.2	Very high	1 Å²	1	42.9 Å²	42.9	0%	0.004	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-85.3	-18.1	176.2	-72.4	-95.2	0	0	0	113.8	F882 L886 L894 Q896 E897 L902 L903 I931 I934 F935 F956	F882-F899 HydrophobicContact CE1-CE1 4.25Å; L886-F899 HydrophobicContact CD2-CD1 4.38Å; L894-F899 HydrophobicContact CB-CD2 4.41Å; L894-F899 HydrophobicContact CB-CE2 3.66Å; L894-F899 HydrophobicContact CB-CZ 4.26Å; L894-F899 HydrophobicContact CD1-CE1 4.33Å; L894-F899 HydrophobicContact CD1-CE2 3.83Å; L894-F899 HydrophobicContact CD1-CZ 3.65Å; L894-F899 HydrophobicContact CG-CE2 4.4Å; Q896-F899 PolarHBondContact O-N 3.22Å; E897-F899 PolarHBondContact O-N 2.93Å; F899-L902 HydrophobicContact CD1-CD2 4.49Å; F899-L902 WeakPolarHBondContact O-CB 3.43Å; F899-L902 PolarHBondContact O-N 3.12Å; F899-L902 VanDerWaalsContact O-N 3.15Å; F899-L903 HydrophobicContact CB-CD1 4.2Å; F899-L903 PolarHBondContact O-N 2.85Å; F899-I931 HydrophobicContact CB-CD1 4.45Å; F899-I931 HydrophobicContact CB-CG1 4.1Å; F899-I934 HydrophobicContact CD1-CD1 4.02Å; F899-I934 HydrophobicContact CD1-CG2 4.46Å; F899-I934 HydrophobicContact CE1-CD1 4.33Å; F899-I934 HydrophobicContact CE1-CG2 3.91Å; F899-I934 HydrophobicContact CZ-CG2 3.96Å; F899-F935 AromaticContact CD2-CE2 3.8Å; F899-F935 HydrophobicContact CD2-CE2 3.8Å; F899-F935 HydrophobicContact CD2-CZ 4.38Å; F899-F935 AromaticContact CE2-CE2 3.62Å; F899-F935 HydrophobicContact CE2-CE2 3.62Å; F899-F935 HydrophobicContact CE2-CZ 4.01Å; F899-F956 HydrophobicContact CD1-CZ 4.42Å; F899-F956 HydrophobicContact CE1-CE1 4.08Å; F899-F956 HydrophobicContact CE1-CZ 4.06Å
900	I	96.1	Very high	94.6	Very high	74 Å²	74	36 Å²	36	38%	0.379	20%	0.204	S	C	.	.	H	α-helix	trans	-57.2	-46.7	-176.9	-61.9	171.2	0	0	0	112	E897 L902 L903 Q904 I927 I931	E897-I900 HydrophobicContact CB-CD1 4.15Å; E897-I900 WeakPolarHBondContact O-CB 3.4Å; E897-I900 PolarHBondContact O-N 3.04Å; E897-I900 VanDerWaalsContact O-N 3.16Å; I900-L902 PolarHBondContact O-N 2.84Å; I900-L903 PolarHBondContact O-N 3.48Å; I900-Q904 VanDerWaalsContact O-CB 3.29Å; I900-Q904 WeakPolarHBondContact O-CB 3.32Å; I900-Q904 PolarHBondContact O-N 2.75Å; I900-I927 HydrophobicContact CG1-CG2 4.43Å; I900-I931 HydrophobicContact CG1-CD1 3.71Å
901	P	94.9	Very high	95.1	Very high	41 Å²	41	35.1 Å²	35.1	27%	0.266	18%	0.184	S	C	.	.	H	α-helix	trans	-66.9	-21.8	-178.7	-19.2	33	0	0	0	114.2	A845 Y849	A845-P901 WeakPolarHBondContact CB-O 3.39Å; Y849-P901 HydrophobicContact CD1-CB 4.26Å; Y849-P901 HydrophobicContact CD2-CB 3.64Å; Y849-P901 HydrophobicContact CE1-CB 4.11Å; Y849-P901 HydrophobicContact CE2-CB 3.52Å; Y849-P901 HydrophobicContact CG-CB 4.08Å
902	L	96.7	Very high	95.3	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-78.1	-47.2	173.5	172.9	68.5	0	0	0	111	Y842 F882 L886 F899 I900 D905 I906 F956 L960	Y842-L902 WeakPolarHBondContact O-CD1 3.45Å; F882-L902 HydrophobicContact CE2-CD2 4.19Å; F882-L902 HydrophobicContact CZ-CD2 3.68Å; L886-L902 HydrophobicContact CD2-CB 4.46Å; L886-L902 HydrophobicContact CD2-CD2 4.27Å; F899-L902 HydrophobicContact CD1-CD2 4.49Å; F899-L902 WeakPolarHBondContact O-CB 3.43Å; F899-L902 PolarHBondContact O-N 3.12Å; F899-L902 VanDerWaalsContact O-N 3.15Å; I900-L902 PolarHBondContact O-N 2.84Å; L902-D905 PolarHBondContact O-N 2.97Å; L902-I906 HydrophobicContact CD1-CD1 4.21Å; L902-I906 HydrophobicContact CG-CD1 4Å; L902-I906 WeakPolarHBondContact O-CG1 3.12Å; L902-I906 PolarHBondContact O-N 3.18Å; L902-F956 HydrophobicContact CD2-CZ 4.36Å; L902-L960 HydrophobicContact CD1-CD1 4.39Å; L902-L960 HydrophobicContact CD2-CD1 4.16Å; L902-L960 HydrophobicContact CD2-CD2 4.39Å
903	L	96.9	Very high	95.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-72.2	-34.7	-176.2	-67.1	169.1	0	0	0	111.9	F899 I900 D905 I906 V907 I927 V930 I931 I934 F976	F899-L903 HydrophobicContact CB-CD1 4.2Å; F899-L903 PolarHBondContact O-N 2.85Å; I900-L903 PolarHBondContact O-N 3.48Å; L903-D905 VanDerWaalsContact C-N 3.33Å; L903-D905 PolarHBondContact O-N 2.99Å; L903-I906 HydrophobicContact CD2-CD1 4.13Å; L903-I906 PolarHBondContact O-N 3.24Å; L903-V907 WeakPolarHBondContact O-CG2 3.37Å; L903-V907 PolarHBondContact O-N 3.34Å; L903-I927 HydrophobicContact CB-CB 4.5Å; L903-I927 HydrophobicContact CB-CG1 4.06Å; L903-I927 HydrophobicContact CB-CG2 4.02Å; L903-I927 HydrophobicContact CD1-CG2 4.15Å; L903-V930 HydrophobicContact CD1-CB 4.27Å; L903-V930 HydrophobicContact CD1-CG1 4.15Å; L903-V930 HydrophobicContact CD2-CB 4.2Å; L903-V930 HydrophobicContact CD2-CG1 3.52Å; L903-I931 HydrophobicContact CD1-CD1 4.04Å; L903-I931 HydrophobicContact CD1-CG1 3.37Å; L903-I934 HydrophobicContact CD1-CD1 4.46Å; L903-F976 HydrophobicContact CD2-CD1 4.39Å; L903-F976 HydrophobicContact CD2-CE1 3.83Å
904	Q	94.4	Very high	95.1	Very high	65 Å²	65	30 Å²	30	30%	0.304	16%	0.162	S	C	.	.	H	α-helix	trans	-52.2	-51.8	168	-175.2	64	58.5	0	0	111.1	I900 I906 V907 D908 H923 I927	I900-Q904 VanDerWaalsContact O-CB 3.29Å; I900-Q904 WeakPolarHBondContact O-CB 3.32Å; I900-Q904 PolarHBondContact O-N 2.75Å; Q904-I906 VanDerWaalsContact C-N 3.32Å; Q904-I906 PolarHBondContact O-N 3.34Å; Q904-V907 PolarHBondContact O-N 3.36Å; Q904-D908 PolarHBondContact NE2-OD2 3.15Å; Q904-D908 VanDerWaalsContact O-CB 3.25Å; Q904-D908 WeakPolarHBondContact O-CB 3.42Å; Q904-D908 PolarHBondContact O-N 2.95Å; Q904-H923 PolarHBondContact NE2-CE1 3.12Å; Q904-H923 PolarHBondContact NE2-NE2 2.68Å; Q904-I927 HydrophobicContact CB-CD1 4.45Å
905	D	95	Very high	94.6	Very high	7 Å²	7	30.7 Å²	30.7	4%	0.037	17%	0.165	C	C	.	.	H	α-helix	trans	-67.4	-28	179.9	177.6	64.8	0	0	0	113.4	K844 A845 L902 L903 T909	K844-D905 VanDerWaalsContact CG-OD2 3.31Å; K844-D905 WeakPolarHBondContact CG-OD2 3.46Å; K844-D905 IonicContact NZ-OD1 3.41Å; K844-D905 PolarHBondContact NZ-OD1 2.85Å; K844-D905 IonicContact NZ-OD2 3.31Å; K844-D905 PolarHBondContact NZ-OD2 3.36Å; A845-D905 HydrophobicContact CB-CB 3.49Å; A845-D905 VanDerWaalsContact CB-CB 3.49Å; A845-D905 WeakPolarHBondContact CB-OD2 3.36Å; L902-D905 PolarHBondContact O-N 2.97Å; L903-D905 VanDerWaalsContact C-N 3.33Å; L903-D905 PolarHBondContact O-N 2.99Å; D905-T909 PolarHBondContact O-N 3.39Å; D905-T909 VanDerWaalsContact O-N 3.1Å; D905-T909 PolarHBondContact O-OG1 2.99Å
906	I	95.8	Very high	94.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.8	-53.1	171.4	-72.2	161.7	0	0	0	110.4	Y842 L902 L903 Q904 D908 T909 H910 L913 L960 L963 F976	Y842-I906 HydrophobicContact CD1-CB 4.35Å; Y842-I906 HydrophobicContact CD1-CG1 3.49Å; Y842-I906 VanDerWaalsContact CD1-CG1 3.49Å; Y842-I906 HydrophobicContact CE1-CG1 4.16Å; Y842-I906 HydrophobicContact CG-CG1 4.03Å; L902-I906 HydrophobicContact CD1-CD1 4.21Å; L902-I906 HydrophobicContact CG-CD1 4Å; L902-I906 WeakPolarHBondContact O-CG1 3.12Å; L902-I906 PolarHBondContact O-N 3.18Å; L903-I906 HydrophobicContact CD2-CD1 4.13Å; L903-I906 PolarHBondContact O-N 3.24Å; Q904-I906 VanDerWaalsContact C-N 3.32Å; Q904-I906 PolarHBondContact O-N 3.34Å; I906-D908 PolarHBondContact O-N 2.84Å; I906-T909 PolarHBondContact O-N 3.27Å; I906-T909 VanDerWaalsContact O-N 3.12Å; I906-H910 HydrophobicContact CG2-CB 4.35Å; I906-H910 VanDerWaalsContact O-CB 3.22Å; I906-H910 WeakPolarHBondContact O-CB 3.46Å; I906-H910 PolarHBondContact O-N 3.16Å; I906-L913 HydrophobicContact CG2-CD1 3.8Å; I906-L960 HydrophobicContact CD1-CD1 3.86Å; I906-L963 HydrophobicContact CD1-CD1 3.9Å; I906-L963 HydrophobicContact CG1-CD1 4.26Å; I906-L963 HydrophobicContact CG2-CD1 4.38Å; I906-F976 HydrophobicContact CD1-CE1 4.01Å
907	V	94.9	Very high	93.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-34.3	174.5	-177	0	0	0	0	110.8	L903 Q904 T909 L913 L916 H923 Y926 I927	L903-V907 WeakPolarHBondContact O-CG2 3.37Å; L903-V907 PolarHBondContact O-N 3.34Å; Q904-V907 PolarHBondContact O-N 3.36Å; V907-T909 VanDerWaalsContact C-N 3.35Å; V907-T909 PolarHBondContact O-N 2.93Å; V907-L913 HydrophobicContact CG1-CB 4.47Å; V907-L913 HydrophobicContact CG2-CD1 4.32Å; V907-L916 HydrophobicContact CG1-CB 3.71Å; V907-L916 HydrophobicContact CG1-CD1 4.31Å; V907-H923 WeakPolarHBondContact CG1-CE1 3.4Å; V907-Y926 HydrophobicContact CG2-CD1 3.56Å; V907-Y926 HydrophobicContact CG2-CE1 3.64Å; V907-I927 HydrophobicContact CG2-CG1 4.27Å
908	D	92.1	Very high	93	Very high	48 Å²	48	31.3 Å²	31.3	26%	0.257	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-10.6	179.4	-88.2	-48.5	0	0	0	115.6	Q904 I906 K917	Q904-D908 PolarHBondContact NE2-OD2 3.15Å; Q904-D908 VanDerWaalsContact O-CB 3.25Å; Q904-D908 WeakPolarHBondContact O-CB 3.42Å; Q904-D908 PolarHBondContact O-N 2.95Å; I906-D908 PolarHBondContact O-N 2.84Å; D908-K917 VanDerWaalsContact C-NZ 3.31Å; D908-K917 WeakPolarHBondContact O-CE 3.49Å; D908-K917 PolarHBondContact O-NZ 3.1Å; D908-K917 IonicContact OD1-NZ 2.67Å; D908-K917 PolarHBondContact OD1-NZ 3.45Å
909	T	93.8	Very high	92.4	Very high	42 Å²	42	31.4 Å²	31.4	26%	0.258	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140.2	-12.8	-177.5	59.8	0	0	0	0	116.9	Y828 Y842 K844 D905 I906 V907	Y828-T909 HydrophobicContact CD1-CG2 4.25Å; Y828-T909 HydrophobicContact CE1-CG2 4.18Å; Y842-T909 WeakPolarHBondContact CE1-OG1 3.49Å; K844-T909 PolarHBondContact NZ-OG1 3.21Å; D905-T909 PolarHBondContact O-N 3.39Å; D905-T909 VanDerWaalsContact O-N 3.1Å; D905-T909 PolarHBondContact O-OG1 2.99Å; I906-T909 PolarHBondContact O-N 3.27Å; I906-T909 VanDerWaalsContact O-N 3.12Å; V907-T909 VanDerWaalsContact C-N 3.35Å; V907-T909 PolarHBondContact O-N 2.93Å
910	H	95.6	Very high	91.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.			trans	-75.2	130.2	175.7	-164.2	-78.9	0	0	0	110.7	Y842 I906 G912 L913 T914 L963 E966 D967	Y842-H910 HydrophobicContact CE1-CB 4.47Å; Y842-H910 AromaticContact CZ-CD2 3.94Å; Y842-H910 WeakPolarHBondContact OH-CA 3.43Å; Y842-H910 PolarHBondContact OH-CD2 3.09Å; I906-H910 HydrophobicContact CG2-CB 4.35Å; I906-H910 VanDerWaalsContact O-CB 3.22Å; I906-H910 WeakPolarHBondContact O-CB 3.46Å; I906-H910 PolarHBondContact O-N 3.16Å; H910-G912 PolarHBondContact ND1-N 3.06Å; H910-G912 PolarHBondContact O-N 3.48Å; H910-L913 HydrophobicContact CB-CB 4.3Å; H910-L913 HydrophobicContact CB-CD1 4.11Å; H910-L913 HydrophobicContact CB-CG 4.36Å; H910-L913 PolarHBondContact O-N 3.19Å; H910-T914 WeakPolarHBondContact O-CG2 3.2Å; H910-T914 PolarHBondContact O-N 2.81Å; H910-L963 PolarHBondContact CD2-O 2.95Å; H910-L963 PolarHBondContact NE2-O 3.23Å; H910-E966 PolarHBondContact NE2-O 2.95Å; H910-D967 PolarHBondContact CE1-O 3.23Å
911	P	94.4	Very high	90.8	Very high	56 Å²	56	38.2 Å²	38.2	36%	0.364	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-56.7	-52.8	-176.1	18.7	-29	0	0	0	112.2	L913 T914 D967	P911-L913 PolarHBondContact O-N 3.18Å; P911-T914 WeakPolarHBondContact O-CG2 3.17Å; P911-T914 PolarHBondContact O-N 3.06Å; P911-T914 VanDerWaalsContact O-N 3.14Å; P911-T914 PolarHBondContact O-OG1 2.95Å; P911-D967 HydrophobicContact CG-CB 4Å; P911-D967 WeakPolarHBondContact CG-OD1 3.43Å
912	G	93.3	Very high	90.5	Very high	6 Å²	6	36.7 Å²	36.7	6%	0.062	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-64.1	5	175.2	0	0	0	0	0	116.9	Y360 H910 F915 D967	Y360-G912 WeakPolarHBondContact CE2-O 3.39Å; H910-G912 PolarHBondContact ND1-N 3.06Å; H910-G912 PolarHBondContact O-N 3.48Å; G912-F915 WeakPolarHBondContact O-CE1 3.26Å; G912-D967 PolarHBondContact N-O 3.32Å
913	L	94.2	Very high	90.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-124.2	1.3	172.9	-63.9	171.9	0	0	0	113.2	I906 V907 H910 P911 F915 L916 Y926 I969 Y978	I906-L913 HydrophobicContact CG2-CD1 3.8Å; V907-L913 HydrophobicContact CG1-CB 4.47Å; V907-L913 HydrophobicContact CG2-CD1 4.32Å; H910-L913 HydrophobicContact CB-CB 4.3Å; H910-L913 HydrophobicContact CB-CD1 4.11Å; H910-L913 HydrophobicContact CB-CG 4.36Å; H910-L913 PolarHBondContact O-N 3.19Å; P911-L913 PolarHBondContact O-N 3.18Å; L913-F915 PolarHBondContact O-N 3.31Å; L913-L916 HydrophobicContact CD2-CD1 4.12Å; L913-L916 PolarHBondContact O-N 3.27Å; L913-L916 VanDerWaalsContact O-N 3.11Å; L913-Y926 HydrophobicContact CD1-CE1 3.86Å; L913-Y926 WeakPolarHBondContact CD1-OH 3.37Å; L913-Y926 HydrophobicContact CD2-CE1 4.2Å; L913-Y926 HydrophobicContact CD2-CE2 4.05Å; L913-I969 HydrophobicContact CD1-CD1 4.09Å; L913-I969 HydrophobicContact CD1-CG1 4.16Å; L913-I969 HydrophobicContact CD2-CG1 4.14Å; L913-I969 HydrophobicContact CD2-CG2 4.11Å; L913-I969 HydrophobicContact CG-CB 4.45Å; L913-I969 HydrophobicContact CG-CD1 4.4Å; L913-I969 HydrophobicContact CG-CG1 4.08Å; L913-I969 HydrophobicContact CG-CG2 4.49Å; L913-Y978 HydrophobicContact CD2-CD2 4.38Å
914	T	88.3	Confident	89.9	Confident	74 Å²	74	41 Å²	41	45%	0.454	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-58.7	-22.2	-174.2	48.7	0	0	0	0	114.6	H910 P911 K917	H910-T914 WeakPolarHBondContact O-CG2 3.2Å; H910-T914 PolarHBondContact O-N 2.81Å; P911-T914 WeakPolarHBondContact O-CG2 3.17Å; P911-T914 PolarHBondContact O-N 3.06Å; P911-T914 VanDerWaalsContact O-N 3.14Å; P911-T914 PolarHBondContact O-OG1 2.95Å; T914-K917 WeakPolarHBondContact O-CD 3.26Å; T914-K917 WeakPolarHBondContact O-CG 3.44Å
915	F	87.9	Confident	89.9	Confident	16 Å²	16	40.3 Å²	40.3	7%	0.07	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-74.7	-30.2	178.5	62.7	-93	0	0	0	114.3	P358 Y360 V363 G912 L913 K917 D918 Y978	P358-F915 HydrophobicContact CB-CD2 4.11Å; P358-F915 HydrophobicContact CB-CE2 4.32Å; P358-F915 HydrophobicContact CG-CD2 4.3Å; Y360-F915 AromaticContact CD2-CE1 3.88Å; Y360-F915 HydrophobicContact CD2-CE1 3.88Å; Y360-F915 HydrophobicContact CD2-CZ 4.08Å; Y360-F915 HydrophobicContact CE2-CE1 4.13Å; V363-F915 HydrophobicContact CB-CB 3.89Å; V363-F915 HydrophobicContact CB-CD1 4.37Å; V363-F915 HydrophobicContact CB-CG 4.09Å; V363-F915 HydrophobicContact CG1-CB 3.43Å; V363-F915 VanDerWaalsContact CG1-CB 3.43Å; V363-F915 HydrophobicContact CG1-CG 4.19Å; V363-F915 HydrophobicContact CG2-CB 4.25Å; V363-F915 HydrophobicContact CG2-CD2 4.44Å; V363-F915 HydrophobicContact CG2-CG 4.33Å; G912-F915 WeakPolarHBondContact O-CE1 3.26Å; L913-F915 PolarHBondContact O-N 3.31Å; F915-K917 PolarHBondContact O-N 3Å; F915-D918 PolarHBondContact O-N 2.91Å; F915-D918 VanDerWaalsContact O-N 3.12Å; F915-Y978 HydrophobicContact CE2-CD2 4.41Å; F915-Y978 AromaticContact CE2-CE1 3.93Å; F915-Y978 HydrophobicContact CE2-CE1 3.93Å; F915-Y978 AromaticContact CE2-CE2 3.81Å; F915-Y978 HydrophobicContact CE2-CE2 3.81Å; F915-Y978 AromaticContact CE2-CZ 3.54Å; F915-Y978 AromaticContact CZ-CD1 3.88Å; F915-Y978 HydrophobicContact CZ-CD1 3.88Å; F915-Y978 AromaticContact CZ-CD2 4Å; F915-Y978 HydrophobicContact CZ-CD2 4Å; F915-Y978 AromaticContact CZ-CE1 3.71Å; F915-Y978 HydrophobicContact CZ-CE1 3.71Å; F915-Y978 AromaticContact CZ-CE2 3.85Å; F915-Y978 HydrophobicContact CZ-CE2 3.85Å; F915-Y978 HydrophobicContact CZ-CG 4.02Å; F915-Y978 AromaticContact CZ-CZ 3.7Å
916	L	89.6	Confident	90	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-64.1	-8	177.9	-77.7	178.2	0	0	0	113.6	V907 L913 F922 H923 Y926 Y978	V907-L916 HydrophobicContact CG1-CB 3.71Å; V907-L916 HydrophobicContact CG1-CD1 4.31Å; L913-L916 HydrophobicContact CD2-CD1 4.12Å; L913-L916 PolarHBondContact O-N 3.27Å; L913-L916 VanDerWaalsContact O-N 3.11Å; L916-F922 HydrophobicContact CD2-CB 3.77Å; L916-H923 PolarHBondContact O-ND1 2.99Å; L916-Y926 HydrophobicContact CD1-CD1 4.1Å; L916-Y926 HydrophobicContact CD1-CD2 4.28Å; L916-Y926 HydrophobicContact CD1-CG 3.83Å; L916-Y978 HydrophobicContact CD1-CD2 4.12Å; L916-Y978 HydrophobicContact CD1-CE2 3.93Å; L916-Y978 HydrophobicContact CD2-CE2 3.97Å; L916-Y978 HydrophobicContact CG-CE2 4.14Å
917	K	82.3	Confident	90.1	Very high	84 Å²	84	40.4 Å²	40.4	37%	0.365	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-71.6	-36.1	172.9	-61.5	170.7	175.4	-91.3	0	113.3	D908 T914 F915 A919	D908-K917 VanDerWaalsContact C-NZ 3.31Å; D908-K917 WeakPolarHBondContact O-CE 3.49Å; D908-K917 PolarHBondContact O-NZ 3.1Å; D908-K917 IonicContact OD1-NZ 2.67Å; D908-K917 PolarHBondContact OD1-NZ 3.45Å; T914-K917 WeakPolarHBondContact O-CD 3.26Å; T914-K917 WeakPolarHBondContact O-CG 3.44Å; F915-K917 PolarHBondContact O-N 3Å; K917-A919 VanDerWaalsContact C-N 3.27Å
918	D	81.7	Confident	90.2	Very high	125 Å²	125	42.3 Å²	42.3	67%	0.668	24%	0.236	S	C	*	.	S	Bend	trans	-82	-7	178.1	-83.9	-70.4	0	0	0	111.3	K371 F915	K371-D918 IonicContact NZ-OD1 2.85Å; K371-D918 PolarHBondContact NZ-OD1 3.24Å; K371-D918 IonicContact NZ-OD2 3.75Å; F915-D918 PolarHBondContact O-N 2.91Å; F915-D918 VanDerWaalsContact O-N 3.12Å
919	A	84	Confident	90.5	Very high	18 Å²	18	40.1 Å²	40.1	15%	0.149	22%	0.224	C	C	.	.			trans	-129.2	80.9	-177.1	0	0	0	0	0	112.9	P358 K917 E921 F922 H923	P358-A919 HydrophobicContact CG-CB 4.38Å; K917-A919 VanDerWaalsContact C-N 3.27Å; A919-E921 VanDerWaalsContact C-N 3.33Å; A919-E921 PolarHBondContact O-N 2.68Å; A919-F922 HydrophobicContact CB-CD2 3.81Å; A919-F922 HydrophobicContact CB-CE2 4.29Å; A919-H923 PolarHBondContact O-N 3.03Å
920	P	80.7	Confident	90.7	Very high	91 Å²	91	38.2 Å²	38.2	59%	0.591	21%	0.213	S	C	*	.	H	α-helix	trans	-70.4	-19.3	-165.8	28	-36.4	0	0	0	115.6	H923 S924	P920-H923 WeakPolarHBondContact O-CB 3.42Å; P920-S924 PolarHBondContact O-N 2.88Å
921	E	80.6	Confident	90.8	Very high	126 Å²	126	38.5 Å²	38.5	59%	0.589	21%	0.214	S	C	*	.	H	α-helix	trans	-71.4	-50	178.9	-76.2	144.5	-157.8	0	0	111	A919 H923 S924 R925	A919-E921 VanDerWaalsContact C-N 3.33Å; A919-E921 PolarHBondContact O-N 2.68Å; E921-H923 VanDerWaalsContact C-N 3.29Å; E921-H923 PolarHBondContact O-N 3.02Å; E921-S924 PolarHBondContact O-N 3.39Å; E921-R925 WeakPolarHBondContact O-CG 3.12Å; E921-R925 PolarHBondContact O-N 3.5Å
922	F	87.6	Confident	91	Very high	9 Å²	9	36.2 Å²	36.2	4%	0.039	20%	0.199	C	C	.	.	H	α-helix	trans	-68.1	-28.7	174.3	-44.2	-61.6	0	0	0	112.5	E355 Q356 P357 L916 A919 S924 R925 Y926 F981 Y985	E355-F922 WeakPolarHBondContact O-CE1 3.34Å; E355-F922 WeakPolarHBondContact O-CZ 3.27Å; Q356-F922 VanDerWaalsContact O-CE2 3.27Å; Q356-F922 WeakPolarHBondContact O-CE2 3.41Å; Q356-F922 WeakPolarHBondContact O-CZ 3.39Å; P357-F922 HydrophobicContact CB-CD1 3.88Å; P357-F922 HydrophobicContact CB-CD2 4.45Å; P357-F922 HydrophobicContact CB-CE1 4.28Å; P357-F922 HydrophobicContact CB-CG 3.99Å; P357-F922 HydrophobicContact CG-CD1 3.66Å; P357-F922 HydrophobicContact CG-CE1 3.88Å; P357-F922 HydrophobicContact CG-CG 4.29Å; L916-F922 HydrophobicContact CD2-CB 3.77Å; A919-F922 HydrophobicContact CB-CD2 3.81Å; A919-F922 HydrophobicContact CB-CE2 4.29Å; F922-S924 VanDerWaalsContact C-N 3.34Å; F922-S924 PolarHBondContact O-N 3.38Å; F922-R925 PolarHBondContact O-N 2.88Å; F922-Y926 WeakPolarHBondContact O-CB 3.37Å; F922-Y926 PolarHBondContact O-N 3.19Å; F922-F981 HydrophobicContact CB-CE1 4.46Å; F922-F981 HydrophobicContact CB-CZ 4.21Å; F922-Y985 HydrophobicContact CD1-CE1 4.14Å; F922-Y985 AromaticContact CE1-CE1 3.86Å; F922-Y985 HydrophobicContact CE1-CE1 3.86Å; F922-Y985 AromaticContact CE1-CZ 3.91Å
923	H	90.1	Very high	91.3	Very high	21 Å²	21	36.8 Å²	36.8	10%	0.097	20%	0.199	C	C	.	.	H	α-helix	trans	-53.7	-49.1	174.4	-163.8	123.8	0	0	0	111.9	Q904 V907 L916 A919 P920 E921 I927	Q904-H923 PolarHBondContact NE2-CE1 3.12Å; Q904-H923 PolarHBondContact NE2-NE2 2.68Å; V907-H923 WeakPolarHBondContact CG1-CE1 3.4Å; L916-H923 PolarHBondContact O-ND1 2.99Å; A919-H923 PolarHBondContact O-N 3.03Å; P920-H923 WeakPolarHBondContact O-CB 3.42Å; E921-H923 VanDerWaalsContact C-N 3.29Å; E921-H923 PolarHBondContact O-N 3.02Å; H923-I927 WeakPolarHBondContact O-CG1 3.4Å; H923-I927 PolarHBondContact O-N 3.3Å
924	S	91.4	Very high	91.5	Very high	74 Å²	74	36.8 Å²	36.8	52%	0.517	20%	0.199	S	C	.	.	H	α-helix	trans	-69	-35.7	178.6	-167.3	0	0	0	0	112.2	P920 E921 F922 T928	P920-S924 PolarHBondContact O-N 2.88Å; E921-S924 PolarHBondContact O-N 3.39Å; F922-S924 VanDerWaalsContact C-N 3.34Å; F922-S924 PolarHBondContact O-N 3.38Å; S924-T928 WeakPolarHBondContact O-CB 3.39Å; S924-T928 PolarHBondContact O-N 3.3Å; S924-T928 PolarHBondContact O-OG1 3.21Å
925	R	94.6	Very high	92	Very high	49 Å²	49	33.3 Å²	33.3	19%	0.185	18%	0.178	C	C	.	.	H	α-helix	trans	-68.2	-45.8	177.8	-63.4	-77.5	164.5	-175.4	-9.5	112	E921 F922 T928 T929 F981 Y985 L997 Y1039	E921-R925 WeakPolarHBondContact O-CG 3.12Å; E921-R925 PolarHBondContact O-N 3.5Å; F922-R925 PolarHBondContact O-N 2.88Å; R925-T928 WeakPolarHBondContact O-CB 3.41Å; R925-T928 PolarHBondContact O-N 3.1Å; R925-T929 PolarHBondContact O-N 3.06Å; R925-T929 PolarHBondContact O-OG1 3.03Å; R925-F981 HydrophobicContact CB-CE2 3.65Å; R925-F981 HydrophobicContact CB-CZ 3.97Å; R925-Y985 HydrophobicContact CB-CD2 4.1Å; R925-Y985 HydrophobicContact CB-CE2 4.24Å; R925-Y985 HydrophobicContact CG-CD2 4.07Å; R925-Y985 HydrophobicContact CG-CE2 3.71Å; R925-L997 VanDerWaalsContact NH2-CD2 3.33Å; R925-Y1039 HydrophobicContact CB-CE1 4.12Å; R925-Y1039 VanDerWaalsContact NH1-CG 3.33Å
926	Y	97.3	Very high	92.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-57.1	-50.8	174.5	174.6	-95	0	0	0	111	V907 L913 L916 F922 T928 T929 V930 F976 Y978 F981	V907-Y926 HydrophobicContact CG2-CD1 3.56Å; V907-Y926 HydrophobicContact CG2-CE1 3.64Å; L913-Y926 HydrophobicContact CD1-CE1 3.86Å; L913-Y926 WeakPolarHBondContact CD1-OH 3.37Å; L913-Y926 HydrophobicContact CD2-CE1 4.2Å; L913-Y926 HydrophobicContact CD2-CE2 4.05Å; L916-Y926 HydrophobicContact CD1-CD1 4.1Å; L916-Y926 HydrophobicContact CD1-CD2 4.28Å; L916-Y926 HydrophobicContact CD1-CG 3.83Å; F922-Y926 WeakPolarHBondContact O-CB 3.37Å; F922-Y926 PolarHBondContact O-N 3.19Å; Y926-T928 VanDerWaalsContact C-N 3.31Å; Y926-T928 PolarHBondContact O-N 3.28Å; Y926-T929 PolarHBondContact O-N 3.17Å; Y926-V930 HydrophobicContact CD1-CG2 4.28Å; Y926-V930 HydrophobicContact CD2-CG2 4.29Å; Y926-V930 HydrophobicContact CE1-CG2 3.83Å; Y926-V930 HydrophobicContact CE2-CG2 3.83Å; Y926-V930 HydrophobicContact CG-CG2 4.48Å; Y926-V930 WeakPolarHBondContact O-CG2 3.4Å; Y926-V930 PolarHBondContact O-N 2.84Å; Y926-F976 WeakPolarHBondContact CE2-O 3.47Å; Y926-F976 PolarHBondContact OH-O 2.95Å; Y926-Y978 HydrophobicContact CD2-CD2 4.04Å; Y926-Y978 HydrophobicContact CE2-CD2 4.33Å; Y926-F981 HydrophobicContact CD2-CB 3.83Å; Y926-F981 AromaticContact CD2-CD1 3.89Å; Y926-F981 HydrophobicContact CD2-CD1 3.89Å; Y926-F981 HydrophobicContact CD2-CD2 4.44Å; Y926-F981 AromaticContact CD2-CG 3.75Å; Y926-F981 HydrophobicContact CD2-CG 3.75Å; Y926-F981 HydrophobicContact CE2-CB 4.38Å; Y926-F981 HydrophobicContact CG-CG 4.47Å
927	I	97.1	Very high	92.8	Very high	9 Å²	9	35.4 Å²	35.4	5%	0.046	19%	0.191	C	C	.	.	H	α-helix	trans	-56.6	-45.9	175.7	-68.9	178.1	0	0	0	110.9	I900 L903 Q904 V907 H923 T929 V930 I931	I900-I927 HydrophobicContact CG1-CG2 4.43Å; L903-I927 HydrophobicContact CB-CB 4.5Å; L903-I927 HydrophobicContact CB-CG1 4.06Å; L903-I927 HydrophobicContact CB-CG2 4.02Å; L903-I927 HydrophobicContact CD1-CG2 4.15Å; Q904-I927 HydrophobicContact CB-CD1 4.45Å; V907-I927 HydrophobicContact CG2-CG1 4.27Å; H923-I927 WeakPolarHBondContact O-CG1 3.4Å; H923-I927 PolarHBondContact O-N 3.3Å; I927-T929 PolarHBondContact O-N 3.41Å; I927-V930 PolarHBondContact O-N 3.15Å; I927-I931 HydrophobicContact CG2-CD1 3.86Å; I927-I931 VanDerWaalsContact O-CG1 3.27Å; I927-I931 WeakPolarHBondContact O-CG1 3.27Å; I927-I931 PolarHBondContact O-N 2.77Å
928	T	97.1	Very high	93.6	Very high	41 Å²	41	31.6 Å²	31.6	25%	0.252	17%	0.174	S	C	.	.	H	α-helix	trans	-59	-46.4	178.1	-58.4	0	0	0	0	111.8	S924 R925 Y926 I931 Q932 Y1039 A1040	S924-T928 WeakPolarHBondContact O-CB 3.39Å; S924-T928 PolarHBondContact O-N 3.3Å; S924-T928 PolarHBondContact O-OG1 3.21Å; R925-T928 WeakPolarHBondContact O-CB 3.41Å; R925-T928 PolarHBondContact O-N 3.1Å; Y926-T928 VanDerWaalsContact C-N 3.31Å; Y926-T928 PolarHBondContact O-N 3.28Å; T928-I931 WeakPolarHBondContact O-CB 3.23Å; T928-I931 PolarHBondContact O-N 3.33Å; T928-Q932 WeakPolarHBondContact O-CG 3.3Å; T928-Q932 PolarHBondContact O-N 3.03Å; T928-Y1039 HydrophobicContact CG2-CD1 4.2Å; T928-A1040 HydrophobicContact CG2-CB 4.45Å
929	T	98.3	Very high	94.3	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-67.9	-41.8	-179	-65.5	0	0	0	0	112.2	R925 Y926 I927 I931 Q932 R933 F981 I984 Y1039 V1043	R925-T929 PolarHBondContact O-N 3.06Å; R925-T929 PolarHBondContact O-OG1 3.03Å; Y926-T929 PolarHBondContact O-N 3.17Å; I927-T929 PolarHBondContact O-N 3.41Å; T929-I931 VanDerWaalsContact C-N 3.32Å; T929-I931 PolarHBondContact O-N 3.03Å; T929-Q932 PolarHBondContact O-N 2.85Å; T929-R933 HydrophobicContact CG2-CG 4.5Å; T929-R933 WeakPolarHBondContact O-CG 3.5Å; T929-R933 PolarHBondContact O-N 3.47Å; T929-F981 HydrophobicContact CG2-CB 4.37Å; T929-F981 HydrophobicContact CG2-CD2 4.27Å; T929-I984 HydrophobicContact CG2-CD1 3.76Å; T929-I984 HydrophobicContact CG2-CG2 4.33Å; T929-Y1039 WeakPolarHBondContact OG1-CE1 3.44Å; T929-Y1039 VanDerWaalsContact OG1-CZ 3.26Å; T929-Y1039 PolarHBondContact OG1-OH 3.18Å; T929-V1043 HydrophobicContact CG2-CG1 4.25Å; T929-V1043 HydrophobicContact CG2-CG2 4.47Å
930	V	98.6	Very high	94.9	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-40.2	173.5	180	0	0	0	0	110.7	L903 Y926 I927 Q932 R933 I934 F976	L903-V930 HydrophobicContact CD1-CB 4.27Å; L903-V930 HydrophobicContact CD1-CG1 4.15Å; L903-V930 HydrophobicContact CD2-CB 4.2Å; L903-V930 HydrophobicContact CD2-CG1 3.52Å; Y926-V930 HydrophobicContact CD1-CG2 4.28Å; Y926-V930 HydrophobicContact CD2-CG2 4.29Å; Y926-V930 HydrophobicContact CE1-CG2 3.83Å; Y926-V930 HydrophobicContact CE2-CG2 3.83Å; Y926-V930 HydrophobicContact CG-CG2 4.48Å; Y926-V930 WeakPolarHBondContact O-CG2 3.4Å; Y926-V930 PolarHBondContact O-N 2.84Å; I927-V930 PolarHBondContact O-N 3.15Å; V930-Q932 PolarHBondContact O-N 3.47Å; V930-R933 PolarHBondContact O-N 3.28Å; V930-I934 HydrophobicContact CG1-CD1 3.89Å; V930-I934 HydrophobicContact CG1-CG1 4.37Å; V930-I934 WeakPolarHBondContact O-CB 3.48Å; V930-I934 WeakPolarHBondContact O-CD1 3.47Å; V930-I934 WeakPolarHBondContact O-CG1 3.15Å; V930-I934 PolarHBondContact O-N 3.32Å; V930-F976 HydrophobicContact CG1-CD1 3.82Å; V930-F976 HydrophobicContact CG1-CE1 3.95Å
931	I	98.6	Very high	95.6	Very high	7 Å²	7	26.8 Å²	26.8	4%	0.036	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-45.8	173	-68.2	168.4	0	0	0	111.2	Q896 F899 I900 L903 I927 T928 T929 I934 F935	Q896-I931 HydrophobicContact CB-CG2 3.77Å; Q896-I931 HydrophobicContact CG-CG2 3.7Å; F899-I931 HydrophobicContact CB-CD1 4.45Å; F899-I931 HydrophobicContact CB-CG1 4.1Å; I900-I931 HydrophobicContact CG1-CD1 3.71Å; L903-I931 HydrophobicContact CD1-CD1 4.04Å; L903-I931 HydrophobicContact CD1-CG1 3.37Å; I927-I931 HydrophobicContact CG2-CD1 3.86Å; I927-I931 VanDerWaalsContact O-CG1 3.27Å; I927-I931 WeakPolarHBondContact O-CG1 3.27Å; I927-I931 PolarHBondContact O-N 2.77Å; T928-I931 WeakPolarHBondContact O-CB 3.23Å; T928-I931 PolarHBondContact O-N 3.33Å; T929-I931 VanDerWaalsContact C-N 3.32Å; T929-I931 PolarHBondContact O-N 3.03Å; I931-I934 PolarHBondContact O-N 2.76Å; I931-F935 HydrophobicContact CG2-CD2 4.06Å; I931-F935 HydrophobicContact CG2-CE2 4.24Å; I931-F935 WeakPolarHBondContact O-CD2 3.39Å; I931-F935 PolarHBondContact O-N 3.1Å
932	Q	98.4	Very high	96.3	Very high	7 Å²	7	22.5 Å²	22.5	3%	0.033	12%	0.119	C	C	.	.	H	α-helix	trans	-64.2	-43.5	178.4	-61.1	-34.5	-48.1	0	0	111.6	T928 T929 V930 I934 F935 Y936 A1040 V1043	T928-Q932 WeakPolarHBondContact O-CG 3.3Å; T928-Q932 PolarHBondContact O-N 3.03Å; T929-Q932 PolarHBondContact O-N 2.85Å; V930-Q932 PolarHBondContact O-N 3.47Å; Q932-I934 VanDerWaalsContact C-N 3.32Å; Q932-I934 PolarHBondContact O-N 3.5Å; Q932-F935 PolarHBondContact O-N 3.34Å; Q932-Y936 VanDerWaalsContact O-CB 3.26Å; Q932-Y936 WeakPolarHBondContact O-CB 3.41Å; Q932-Y936 PolarHBondContact O-N 2.75Å; Q932-A1040 HydrophobicContact CG-CB 4.33Å; Q932-V1043 HydrophobicContact CB-CB 4.04Å; Q932-V1043 HydrophobicContact CB-CG1 3.62Å; Q932-V1043 HydrophobicContact CG-CB 4.19Å; Q932-V1043 HydrophobicContact CG-CG1 4.3Å
933	R	98.5	Very high	96.6	Very high	18 Å²	18	25.7 Å²	25.7	7%	0.068	14%	0.139	C	C	.	.	H	α-helix	trans	-60	-39.1	174.2	-67.1	-177	83.4	-142.3	-4.3	112.1	T929 V930 V937 T973 Y975 H980 L1047	T929-R933 HydrophobicContact CG2-CG 4.5Å; T929-R933 WeakPolarHBondContact O-CG 3.5Å; T929-R933 PolarHBondContact O-N 3.47Å; V930-R933 PolarHBondContact O-N 3.28Å; R933-V937 PolarHBondContact O-N 3.08Å; R933-T973 VanDerWaalsContact CZ-O 3.26Å; R933-T973 PolarHBondContact NH1-O 3Å; R933-T973 PolarHBondContact NH2-O 3.3Å; R933-Y975 PolarHBondContact NH1-O 3.23Å; R933-H980 PolarHBondContact NH2-ND1 3.41Å; R933-L1047 HydrophobicContact CG-CD1 3.93Å
934	I	98.5	Very high	96.8	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-60.7	-50.6	172.8	-69.9	164.4	0	0	0	110.8	F899 L903 V930 I931 Q932 Y936 V937 V938 F956 Y975	F899-I934 HydrophobicContact CD1-CD1 4.02Å; F899-I934 HydrophobicContact CD1-CG2 4.46Å; F899-I934 HydrophobicContact CE1-CD1 4.33Å; F899-I934 HydrophobicContact CE1-CG2 3.91Å; F899-I934 HydrophobicContact CZ-CG2 3.96Å; L903-I934 HydrophobicContact CD1-CD1 4.46Å; V930-I934 HydrophobicContact CG1-CD1 3.89Å; V930-I934 HydrophobicContact CG1-CG1 4.37Å; V930-I934 WeakPolarHBondContact O-CB 3.48Å; V930-I934 WeakPolarHBondContact O-CD1 3.47Å; V930-I934 WeakPolarHBondContact O-CG1 3.15Å; V930-I934 PolarHBondContact O-N 3.32Å; I931-I934 PolarHBondContact O-N 2.76Å; Q932-I934 VanDerWaalsContact C-N 3.32Å; Q932-I934 PolarHBondContact O-N 3.5Å; I934-Y936 PolarHBondContact O-N 2.97Å; I934-V937 PolarHBondContact O-N 3.5Å; I934-V938 HydrophobicContact CG2-CG2 4.17Å; I934-V938 WeakPolarHBondContact O-CB 3.45Å; I934-V938 WeakPolarHBondContact O-CG2 3.06Å; I934-V938 PolarHBondContact O-N 3.4Å; I934-F956 HydrophobicContact CD1-CD2 4.25Å; I934-F956 HydrophobicContact CD1-CE2 3.44Å; I934-F956 VanDerWaalsContact CD1-CE2 3.44Å; I934-F956 HydrophobicContact CD1-CZ 3.96Å; I934-F956 HydrophobicContact CG1-CD2 3.89Å; I934-F956 HydrophobicContact CG1-CE2 3.59Å; I934-F956 HydrophobicContact CG1-CZ 4.48Å; I934-Y975 HydrophobicContact CB-CD1 4.21Å; I934-Y975 HydrophobicContact CG1-CD1 3.59Å; I934-Y975 HydrophobicContact CG1-CE1 4.27Å; I934-Y975 HydrophobicContact CG1-CG 4.19Å
935	F	98.4	Very high	97.1	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-70.2	-33.2	-178.4	-83.6	-107.2	0	0	0	112.8	Q896 F899 I931 Q932 V937 N939 G944 V946 W1044	Q896-F935 HydrophobicContact CB-CE2 4.36Å; Q896-F935 HydrophobicContact CB-CZ 4.42Å; Q896-F935 HydrophobicContact CG-CD1 4.22Å; Q896-F935 HydrophobicContact CG-CD2 3.9Å; Q896-F935 HydrophobicContact CG-CE1 4Å; Q896-F935 HydrophobicContact CG-CE2 3.68Å; Q896-F935 HydrophobicContact CG-CG 4.17Å; Q896-F935 HydrophobicContact CG-CZ 3.73Å; F899-F935 AromaticContact CD2-CE2 3.8Å; F899-F935 HydrophobicContact CD2-CE2 3.8Å; F899-F935 HydrophobicContact CD2-CZ 4.38Å; F899-F935 AromaticContact CE2-CE2 3.62Å; F899-F935 HydrophobicContact CE2-CE2 3.62Å; F899-F935 HydrophobicContact CE2-CZ 4.01Å; I931-F935 HydrophobicContact CG2-CD2 4.06Å; I931-F935 HydrophobicContact CG2-CE2 4.24Å; I931-F935 WeakPolarHBondContact O-CD2 3.39Å; I931-F935 PolarHBondContact O-N 3.1Å; Q932-F935 PolarHBondContact O-N 3.34Å; F935-V937 PolarHBondContact O-N 3.46Å; F935-N939 HydrophobicContact CB-CB 4.29Å; F935-N939 HydrophobicContact CD1-CB 3.67Å; F935-N939 HydrophobicContact CE1-CB 4.37Å; F935-N939 HydrophobicContact CG-CB 4.27Å; F935-N939 WeakPolarHBondContact O-CA 3.46Å; F935-N939 WeakPolarHBondContact O-CB 3.48Å; F935-N939 PolarHBondContact O-N 3.16Å; F935-G944 WeakPolarHBondContact CE1-O 3.4Å; F935-V946 HydrophobicContact CD1-CG2 4.08Å; F935-V946 HydrophobicContact CD2-CG2 4.48Å; F935-V946 HydrophobicContact CE1-CG2 3.73Å; F935-V946 HydrophobicContact CE2-CG2 4.15Å; F935-V946 HydrophobicContact CG-CG2 4.46Å; F935-V946 HydrophobicContact CZ-CG2 3.76Å; F935-W1044 HydrophobicContact CB-CZ2 3.83Å
936	Y	98.1	Very high	97.2	Very high	8 Å²	8	22.7 Å²	22.7	3%	0.031	12%	0.122	C	C	.	.	H	α-helix	trans	-59.8	-42.2	176.1	-172	-103.2	0	0	0	112.5	Q932 I934 W1044 L1047 S1048 T1056 S1057	Q932-Y936 VanDerWaalsContact O-CB 3.26Å; Q932-Y936 WeakPolarHBondContact O-CB 3.41Å; Q932-Y936 PolarHBondContact O-N 2.75Å; I934-Y936 PolarHBondContact O-N 2.97Å; Y936-W1044 AromaticContact CD2-CD2 3.99Å; Y936-W1044 HydrophobicContact CD2-CD2 3.99Å; Y936-W1044 AromaticContact CD2-CE3 3.63Å; Y936-W1044 HydrophobicContact CD2-CE3 3.63Å; Y936-W1044 HydrophobicContact CD2-CH2 4.48Å; Y936-W1044 AromaticContact CD2-CZ3 3.9Å; Y936-W1044 HydrophobicContact CD2-CZ3 3.9Å; Y936-W1044 HydrophobicContact CE2-CE3 4.26Å; Y936-L1047 HydrophobicContact CD1-CB 4.36Å; Y936-L1047 HydrophobicContact CD1-CD1 4.21Å; Y936-L1047 HydrophobicContact CD2-CB 4.42Å; Y936-L1047 HydrophobicContact CD2-CD1 4.46Å; Y936-L1047 HydrophobicContact CE1-CB 3.96Å; Y936-L1047 HydrophobicContact CE2-CB 4.07Å; Y936-L1047 HydrophobicContact CG-CD1 4.12Å; Y936-L1047 PolarHBondContact OH-O 3.33Å; Y936-S1048 PolarHBondContact OH-OG 3.12Å; Y936-T1056 HydrophobicContact CD2-CG2 3.47Å; Y936-T1056 VanDerWaalsContact CD2-CG2 3.47Å; Y936-T1056 HydrophobicContact CE1-CG2 4.5Å; Y936-T1056 HydrophobicContact CE2-CG2 3.4Å; Y936-T1056 VanDerWaalsContact CE2-CG2 3.4Å; Y936-T1056 HydrophobicContact CG-CG2 4.04Å; Y936-T1056 WeakPolarHBondContact O-CG2 3.39Å; Y936-T1056 PolarHBondContact O-OG1 3.05Å; Y936-S1057 WeakPolarHBondContact OH-CB 3.26Å; Y936-S1057 PolarHBondContact OH-N 3.09Å
937	V	97.4	Very high	97.2	Very high	53 Å²	53	25 Å²	25	32%	0.321	14%	0.136	S	C	.	.	H	α-helix	trans	-91.9	-36	-179.4	-178.1	0	0	0	0	112.8	R933 I934 F935 R940 Y975	R933-V937 PolarHBondContact O-N 3.08Å; I934-V937 PolarHBondContact O-N 3.5Å; F935-V937 PolarHBondContact O-N 3.46Å; V937-R940 WeakPolarHBondContact O-CD 3.48Å; V937-R940 WeakPolarHBondContact O-CG 3.39Å; V937-Y975 HydrophobicContact CB-CE1 3.92Å; V937-Y975 HydrophobicContact CG1-CE1 4.34Å; V937-Y975 WeakPolarHBondContact CG1-OH 3.39Å; V937-Y975 HydrophobicContact CG2-CE1 4.36Å
938	V	98.1	Very high	97	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-91.5	-46.2	-173.4	-173.1	0	0	0	0	112.5	I934 R940 V946 E950 L951 F956 Y975	I934-V938 HydrophobicContact CG2-CG2 4.17Å; I934-V938 WeakPolarHBondContact O-CB 3.45Å; I934-V938 WeakPolarHBondContact O-CG2 3.06Å; I934-V938 PolarHBondContact O-N 3.4Å; V938-R940 PolarHBondContact O-N 2.91Å; V938-V946 HydrophobicContact CG1-CG1 3.73Å; V938-V946 HydrophobicContact CG1-CG2 4.22Å; V938-E950 HydrophobicContact CG1-CB 4.19Å; V938-E950 WeakPolarHBondContact O-CB 3.5Å; V938-E950 WeakPolarHBondContact O-CG 3.2Å; V938-L951 HydrophobicContact CG1-CD1 4.47Å; V938-F956 HydrophobicContact CG2-CB 4Å; V938-Y975 HydrophobicContact CG2-CE1 4.08Å
939	N	97.3	Very high	96.9	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.011	15%	0.151	C	C	.	.			trans	-83.6	56.8	-173.6	-174.9	-142.1	0	0	0	112.1	F935 S941 W942 T943 G944 H945 V946 E950 R1027	F935-N939 HydrophobicContact CB-CB 4.29Å; F935-N939 HydrophobicContact CD1-CB 3.67Å; F935-N939 HydrophobicContact CE1-CB 4.37Å; F935-N939 HydrophobicContact CG-CB 4.27Å; F935-N939 WeakPolarHBondContact O-CA 3.46Å; F935-N939 WeakPolarHBondContact O-CB 3.48Å; F935-N939 PolarHBondContact O-N 3.16Å; N939-S941 PolarHBondContact ND2-OG 3.01Å; N939-S941 VanDerWaalsContact ND2-OG 3.14Å; N939-S941 PolarHBondContact O-N 3.03Å; N939-W942 PolarHBondContact O-N 3.3Å; N939-T943 PolarHBondContact ND2-OG1 3.35Å; N939-G944 WeakPolarHBondContact OD1-CA 3.48Å; N939-G944 PolarHBondContact OD1-N 3.13Å; N939-H945 PolarHBondContact ND2-O 2.84Å; N939-V946 HydrophobicContact CB-CG2 3.93Å; N939-E950 WeakPolarHBondContact CA-OE1 3.47Å; N939-E950 PolarHBondContact ND2-OE1 3.26Å; N939-R1027 PolarHBondContact OD1-NH2 3.42Å
940	R	96.1	Very high	96.9	Very high	75 Å²	75	28.4 Å²	28.4	28%	0.283	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-12.1	-178	-57.2	-62	-61.2	98.3	21	114.2	V937 V938 W942 E950 P1055 T1056 E1059	V937-R940 WeakPolarHBondContact O-CD 3.48Å; V937-R940 WeakPolarHBondContact O-CG 3.39Å; V938-R940 PolarHBondContact O-N 2.91Å; R940-W942 VanDerWaalsContact C-N 3.34Å; R940-E950 PolarHBondContact N-OE1 3.23Å; R940-P1055 PolarHBondContact NH2-O 3.31Å; R940-T1056 VanDerWaalsContact CZ-OG1 3.26Å; R940-T1056 PolarHBondContact NE-OG1 3.02Å; R940-T1056 PolarHBondContact NH1-OG1 3.29Å; R940-E1059 IonicContact CZ-OE1 3.33Å; R940-E1059 IonicContact CZ-OE2 2.73Å; R940-E1059 VanDerWaalsContact CZ-OE2 3.22Å; R940-E1059 IonicContact NH1-OE2 2.66Å; R940-E1059 PolarHBondContact NH1-OE2 2.77Å; R940-E1059 IonicContact NH2-OE1 2.75Å; R940-E1059 PolarHBondContact NH2-OE1 3.15Å; R940-E1059 IonicContact NH2-OE2 2.85Å; R940-E1059 PolarHBondContact NH2-OE2 3.43Å
941	S	95.6	Very high	96.8	Very high	57 Å²	57	28.5 Å²	28.5	40%	0.399	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-4.2	169.3	66.5	0	0	0	0	115	N939 T943 E950	N939-S941 PolarHBondContact ND2-OG 3.01Å; N939-S941 VanDerWaalsContact ND2-OG 3.14Å; N939-S941 PolarHBondContact O-N 3.03Å; S941-T943 PolarHBondContact O-N 3.29Å; S941-T943 WeakPolarHBondContact OG-CG2 3.26Å; S941-T943 PolarHBondContact OG-OG1 3.46Å; S941-E950 WeakPolarHBondContact CB-OE1 3.35Å; S941-E950 PolarHBondContact N-OE1 2.95Å; S941-E950 VanDerWaalsContact N-OE1 3.14Å; S941-E950 PolarHBondContact OG-OE1 3.35Å
942	W	95.4	Very high	96.6	Very high	36 Å²	36	32.2 Å²	32.2	14%	0.136	17%	0.169	C	C	.	.			trans	60.7	-8.5	-174.2	-67.3	71.5	0	0	0	116.5	N939 R940 G944 R1027 W1044 T1056 E1059 Y1060	N939-W942 PolarHBondContact O-N 3.3Å; R940-W942 VanDerWaalsContact C-N 3.34Å; W942-G944 PolarHBondContact O-N 3.14Å; W942-R1027 PolarHBondContact O-NH2 3.17Å; W942-W1044 HydrophobicContact CE3-CZ3 4.1Å; W942-W1044 HydrophobicContact CH2-CE3 4.17Å; W942-W1044 AromaticContact CH2-CZ3 3.95Å; W942-W1044 HydrophobicContact CH2-CZ3 3.95Å; W942-W1044 HydrophobicContact CZ2-CZ3 4.34Å; W942-W1044 HydrophobicContact CZ3-CE3 4.06Å; W942-W1044 AromaticContact CZ3-CZ3 3.81Å; W942-W1044 HydrophobicContact CZ3-CZ3 3.81Å; W942-T1056 HydrophobicContact CH2-CG2 4.43Å; W942-T1056 HydrophobicContact CZ2-CG2 3.84Å; W942-E1059 HydrophobicContact CZ2-CB 3.64Å; W942-E1059 PolarHBondContact NE1-OE2 3.32Å; W942-Y1060 AromaticContact CH2-CD2 3.91Å; W942-Y1060 HydrophobicContact CH2-CD2 3.91Å; W942-Y1060 HydrophobicContact CH2-CG 4.38Å; W942-Y1060 HydrophobicContact CZ3-CD2 4.44Å
943	T	94.6	Very high	96.5	Very high	75 Å²	75	42.4 Å²	42.4	46%	0.46	21%	0.208	S	C	.	.	S	Bend	trans	-54.9	-17.4	-170.1	51.4	0	0	0	0	117.4	N939 S941 H945	N939-T943 PolarHBondContact ND2-OG1 3.35Å; S941-T943 PolarHBondContact O-N 3.29Å; S941-T943 WeakPolarHBondContact OG-CG2 3.26Å; S941-T943 PolarHBondContact OG-OG1 3.46Å; T943-H945 VanDerWaalsContact C-N 3.28Å; T943-H945 PolarHBondContact O-CE1 3.19Å; T943-H945 PolarHBondContact O-ND1 3.44Å; T943-H945 PolarHBondContact OG1-N 3.47Å; T943-H945 PolarHBondContact OG1-O 3.36Å
944	G	94.4	Very high	96.5	Very high	13 Å²	13	42.7 Å²	42.7	13%	0.134	21%	0.212	C	C	.	.	S	Bend	trans	83	3.1	-169.6	0	0	0	0	0	114.2	F935 N939 W942	F935-G944 WeakPolarHBondContact CE1-O 3.4Å; N939-G944 WeakPolarHBondContact OD1-CA 3.48Å; N939-G944 PolarHBondContact OD1-N 3.13Å; W942-G944 PolarHBondContact O-N 3.14Å
945	H	96.3	Very high	96.4	Very high	68 Å²	68	45.4 Å²	45.4	32%	0.315	23%	0.227	S	C	.	.			trans	-132.2	98.2	-170.2	-57	115	0	0	0	110.5	Y893 L894 N939 T943 T947	Y893-H945 HydrophobicContact CD1-CB 4.41Å; Y893-H945 HydrophobicContact CD2-CB 3.72Å; Y893-H945 AromaticContact CD2-CD2 3.47Å; Y893-H945 VanDerWaalsContact CD2-CD2 3.47Å; Y893-H945 WeakPolarHBondContact CD2-CD2 3.39Å; Y893-H945 AromaticContact CD2-CG 3.85Å; Y893-H945 HydrophobicContact CE2-CB 4.26Å; Y893-H945 AromaticContact CE2-CD2 3.15Å; Y893-H945 WeakPolarHBondContact CE2-CD2 3.33Å; Y893-H945 AromaticContact CE2-CG 3.87Å; Y893-H945 AromaticContact CE2-NE2 3.9Å; Y893-H945 HydrophobicContact CG-CB 3.79Å; Y893-H945 AromaticContact CZ-CD2 3.74Å; L894-H945 WeakPolarHBondContact O-CA 3.49Å; N939-H945 PolarHBondContact ND2-O 2.84Å; T943-H945 VanDerWaalsContact C-N 3.28Å; T943-H945 PolarHBondContact O-CE1 3.19Å; T943-H945 PolarHBondContact O-ND1 3.44Å; T943-H945 PolarHBondContact OG1-N 3.47Å; T943-H945 PolarHBondContact OG1-O 3.36Å; H945-T947 PolarHBondContact O-N 3.07Å; H945-T947 VanDerWaalsContact O-N 3.11Å
946	V	97.6	Very high	96.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	112.3	178.2	168.8	0	0	0	0	109.5	Y893 L894 F935 V938 N939 L951	Y893-V946 CarbonylContact C-O 3.47Å; Y893-V946 WeakPolarHBondContact CA-O 3.44Å; Y893-V946 WeakPolarHBondContact CB-O 3.39Å; L894-V946 HydrophobicContact CB-CB 4.34Å; L894-V946 PolarHBondContact N-O 3.22Å; L894-V946 PolarHBondContact O-N 3.01Å; F935-V946 HydrophobicContact CD1-CG2 4.08Å; F935-V946 HydrophobicContact CD2-CG2 4.48Å; F935-V946 HydrophobicContact CE1-CG2 3.73Å; F935-V946 HydrophobicContact CE2-CG2 4.15Å; F935-V946 HydrophobicContact CG-CG2 4.46Å; F935-V946 HydrophobicContact CZ-CG2 3.76Å; V938-V946 HydrophobicContact CG1-CG1 3.73Å; V938-V946 HydrophobicContact CG1-CG2 4.22Å; N939-V946 HydrophobicContact CB-CG2 3.93Å; V946-L951 HydrophobicContact CG1-CB 4.27Å
947	T	96.1	Very high	96.4	Very high	48 Å²	48	46.3 Å²	46.3	29%	0.294	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	163.4	-178.7	66.4	0	0	0	0	113.3	H945 T949 E950 L951	H945-T947 PolarHBondContact O-N 3.07Å; H945-T947 VanDerWaalsContact O-N 3.11Å; T947-T949 PolarHBondContact O-N 3.22Å; T947-T949 PolarHBondContact OG1-N 3.45Å; T947-E950 VanDerWaalsContact CB-OE2 3.29Å; T947-E950 WeakPolarHBondContact CB-OE2 3.18Å; T947-E950 WeakPolarHBondContact CG2-OE2 3.14Å; T947-E950 PolarHBondContact N-OE2 3.43Å; T947-E950 PolarHBondContact O-N 3.19Å; T947-E950 PolarHBondContact OG1-N 3.1Å; T947-E950 PolarHBondContact OG1-OE2 3.37Å; T947-L951 WeakPolarHBondContact O-CB 3.44Å; T947-L951 PolarHBondContact O-N 3.03Å
948	M	94.8	Very high	96.4	Very high	17 Å²	17	50.5 Å²	50.5	8%	0.084	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-15.2	171.4	-64.6	-176	177.5	0	0	113.5	R795 S880 I883 R952	R795-M948 HydrophobicContact CG-SD 4.31Å; S880-M948 VanDerWaalsContact CB-SD 3.54Å; I883-M948 HydrophobicContact CB-CE 4.39Å; I883-M948 HydrophobicContact CB-CG 4.29Å; I883-M948 HydrophobicContact CD1-CB 4.3Å; I883-M948 HydrophobicContact CD1-CG 3.84Å; I883-M948 VanDerWaalsContact CD1-N 3.32Å; I883-M948 HydrophobicContact CG1-CG 4.48Å; I883-M948 HydrophobicContact CG2-CE 4.3Å; I883-M948 HydrophobicContact CG2-CG 4.43Å; M948-R952 VanDerWaalsContact O-CD 3.3Å; M948-R952 WeakPolarHBondContact O-CD 3.5Å; M948-R952 WeakPolarHBondContact O-CG 3.49Å; M948-R952 PolarHBondContact O-NH1 2.99Å
949	T	94.9	Very high	96.3	Very high	86 Å²	86	50.6 Å²	50.6	53%	0.528	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-42.2	179.5	-57.3	0	0	0	0	111	T947 R952 R953	T947-T949 PolarHBondContact O-N 3.22Å; T947-T949 PolarHBondContact OG1-N 3.45Å; T949-R952 PolarHBondContact O-N 3.44Å; T949-R953 WeakPolarHBondContact O-CG 3.27Å; T949-R953 PolarHBondContact O-N 3.01Å
950	E	96.9	Very high	96.4	Very high	21 Å²	21	50.5 Å²	50.5	10%	0.098	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-49.3	171.4	-77.4	156.5	129.7	0	0	110.9	V938 N939 R940 S941 T947 R952 R953 S954	V938-E950 HydrophobicContact CG1-CB 4.19Å; V938-E950 WeakPolarHBondContact O-CB 3.5Å; V938-E950 WeakPolarHBondContact O-CG 3.2Å; N939-E950 WeakPolarHBondContact CA-OE1 3.47Å; N939-E950 PolarHBondContact ND2-OE1 3.26Å; R940-E950 PolarHBondContact N-OE1 3.23Å; S941-E950 WeakPolarHBondContact CB-OE1 3.35Å; S941-E950 PolarHBondContact N-OE1 2.95Å; S941-E950 VanDerWaalsContact N-OE1 3.14Å; S941-E950 PolarHBondContact OG-OE1 3.35Å; T947-E950 VanDerWaalsContact CB-OE2 3.29Å; T947-E950 WeakPolarHBondContact CB-OE2 3.18Å; T947-E950 WeakPolarHBondContact CG2-OE2 3.14Å; T947-E950 PolarHBondContact N-OE2 3.43Å; T947-E950 PolarHBondContact O-N 3.19Å; T947-E950 PolarHBondContact OG1-N 3.1Å; T947-E950 PolarHBondContact OG1-OE2 3.37Å; E950-R952 PolarHBondContact O-N 3.46Å; E950-R952 VanDerWaalsContact O-N 3.1Å; E950-R953 WeakPolarHBondContact O-CA 3.49Å; E950-R953 PolarHBondContact O-N 3.35Å; E950-S954 PolarHBondContact O-N 3.14Å; E950-S954 PolarHBondContact O-OG 3.44Å
951	L	96.7	Very high	96.4	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-16.1	179.5	-168.8	65.8	0	0	0	114.1	S879 F882 I883 V938 V946 T947 S954 F956 L957	S879-L951 PolarHBondContact OG-O 2.91Å; F882-L951 HydrophobicContact CB-CD2 4.29Å; F882-L951 HydrophobicContact CD1-CD2 3.68Å; F882-L951 HydrophobicContact CE1-CD2 4.48Å; F882-L951 HydrophobicContact CG-CD2 4.37Å; I883-L951 HydrophobicContact CD1-CB 4.35Å; I883-L951 HydrophobicContact CD1-CD2 3.91Å; I883-L951 HydrophobicContact CG1-CD2 3.58Å; V938-L951 HydrophobicContact CG1-CD1 4.47Å; V946-L951 HydrophobicContact CG1-CB 4.27Å; T947-L951 WeakPolarHBondContact O-CB 3.44Å; T947-L951 PolarHBondContact O-N 3.03Å; L951-S954 PolarHBondContact O-OG 3.18Å; L951-F956 HydrophobicContact CD1-CB 4.39Å; L951-F956 HydrophobicContact CD1-CD1 3.84Å; L951-L957 HydrophobicContact CD1-CD1 4.45Å; L951-L957 HydrophobicContact CD1-CD2 4.34Å; L951-L957 HydrophobicContact CD1-CG 4.03Å; L951-L957 HydrophobicContact CD2-CD1 4.09Å; L951-L957 HydrophobicContact CD2-CG 4.43Å; L951-L957 HydrophobicContact CG-CD1 4Å; L951-L957 HydrophobicContact CG-CG 4.14Å
952	R	95.2	Very high	96.4	Very high	85 Å²	85	48.8 Å²	48.8	32%	0.321	24%	0.244	S	C	.	.	H	α-helix	trans	-86.9	-17.9	170.4	-77.5	175.5	-171.6	115.8	-2.2	113.5	P794 G796 D877 S879 M948 T949 E950	P794-R952 PolarHBondContact O-NH1 2.87Å; P794-R952 VanDerWaalsContact O-NH1 3.16Å; P794-R952 PolarHBondContact O-NH2 3.19Å; G796-R952 VanDerWaalsContact N-NH2 3.19Å; D877-R952 VanDerWaalsContact CG-NH2 3.34Å; D877-R952 IonicContact OD1-CZ 2.7Å; D877-R952 IonicContact OD1-NE 3.99Å; D877-R952 IonicContact OD1-NH2 3.05Å; D877-R952 PolarHBondContact OD1-NH2 3.32Å; D877-R952 IonicContact OD2-CZ 3.2Å; D877-R952 IonicContact OD2-NE 2.76Å; D877-R952 PolarHBondContact OD2-NE 3.04Å; D877-R952 IonicContact OD2-NH2 2.74Å; D877-R952 PolarHBondContact OD2-NH2 3.39Å; S879-R952 VanDerWaalsContact OG-CG 3.25Å; S879-R952 WeakPolarHBondContact OG-CG 3.25Å; M948-R952 VanDerWaalsContact O-CD 3.3Å; M948-R952 WeakPolarHBondContact O-CD 3.5Å; M948-R952 WeakPolarHBondContact O-CG 3.49Å; M948-R952 PolarHBondContact O-NH1 2.99Å; T949-R952 PolarHBondContact O-N 3.44Å; E950-R952 PolarHBondContact O-N 3.46Å; E950-R952 VanDerWaalsContact O-N 3.1Å
953	R	96.3	Very high	96.5	Very high	222 Å²	222	47.2 Å²	47.2	84%	0.838	24%	0.238	S	C	*	.	H	α-helix	trans	-101.7	-22.5	-177.1	-69.9	179	66.6	153.4	-1.4	112.4	T949 E950	T949-R953 WeakPolarHBondContact O-CG 3.27Å; T949-R953 PolarHBondContact O-N 3.01Å; E950-R953 WeakPolarHBondContact O-CA 3.49Å; E950-R953 PolarHBondContact O-N 3.35Å
954	S	97.3	Very high	96.5	Very high	24 Å²	24	46.7 Å²	46.7	17%	0.168	23%	0.23	C	C	.	.	S	Bend	trans	-78.8	158.3	168.5	61.5	0	0	0	0	112.9	E950 L951	E950-S954 PolarHBondContact O-N 3.14Å; E950-S954 PolarHBondContact O-OG 3.44Å; L951-S954 PolarHBondContact O-OG 3.18Å
955	N	96.9	Very high	96.6	Very high	58 Å²	58	53.3 Å²	53.3	31%	0.31	26%	0.257	S	S	.	.	S	Bend	trans	-82	-6.7	168.7	62.3	-8.4	0	0	0	114.5	L957 Q958 T959 D974 Y975	N955-L957 VanDerWaalsContact C-N 3.31Å; N955-L957 PolarHBondContact O-N 3.4Å; N955-Q958 WeakPolarHBondContact O-CA 3.31Å; N955-Q958 VanDerWaalsContact O-CB 3.27Å; N955-Q958 WeakPolarHBondContact O-CB 3.49Å; N955-Q958 PolarHBondContact O-N 3.21Å; N955-T959 PolarHBondContact O-N 3.19Å; N955-T959 VanDerWaalsContact O-N 3.08Å; N955-T959 PolarHBondContact O-OG1 2.77Å; N955-D974 PolarHBondContact ND2-OD2 3.37Å; N955-Y975 WeakPolarHBondContact OD1-CE2 3.4Å; N955-Y975 PolarHBondContact OD1-OH 2.74Å
956	F	98.4	Very high	96.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-45.4	-44.1	-171.1	176.7	-98.8	0	0	0	115.8	F882 F899 L902 I934 V938 L951 Q958 T959 L960 Y975 F976	F882-F956 AromaticContact CE1-CE1 3.95Å; F882-F956 HydrophobicContact CE1-CE1 3.95Å; F882-F956 AromaticContact CZ-CE1 3.74Å; F882-F956 HydrophobicContact CZ-CE1 3.74Å; F882-F956 HydrophobicContact CZ-CZ 4.48Å; F899-F956 HydrophobicContact CD1-CZ 4.42Å; F899-F956 HydrophobicContact CE1-CE1 4.08Å; F899-F956 HydrophobicContact CE1-CZ 4.06Å; L902-F956 HydrophobicContact CD2-CZ 4.36Å; I934-F956 HydrophobicContact CD1-CD2 4.25Å; I934-F956 HydrophobicContact CD1-CE2 3.44Å; I934-F956 VanDerWaalsContact CD1-CE2 3.44Å; I934-F956 HydrophobicContact CD1-CZ 3.96Å; I934-F956 HydrophobicContact CG1-CD2 3.89Å; I934-F956 HydrophobicContact CG1-CE2 3.59Å; I934-F956 HydrophobicContact CG1-CZ 4.48Å; V938-F956 HydrophobicContact CG2-CB 4Å; L951-F956 HydrophobicContact CD1-CB 4.39Å; L951-F956 HydrophobicContact CD1-CD1 3.84Å; F956-Q958 VanDerWaalsContact C-N 3.3Å; F956-Q958 PolarHBondContact O-N 2.98Å; F956-T959 PolarHBondContact O-N 3.36Å; F956-L960 HydrophobicContact CE1-CD2 4.09Å; F956-L960 HydrophobicContact CZ-CD1 4.31Å; F956-L960 HydrophobicContact CZ-CD2 4.38Å; F956-L960 VanDerWaalsContact O-CB 3.26Å; F956-L960 WeakPolarHBondContact O-CB 3.26Å; F956-L960 PolarHBondContact O-N 2.76Å; F956-Y975 HydrophobicContact CB-CE1 4.49Å; F956-Y975 HydrophobicContact CB-CE2 4.08Å; F956-Y975 HydrophobicContact CD2-CD1 4.14Å; F956-Y975 AromaticContact CD2-CD2 3.98Å; F956-Y975 HydrophobicContact CD2-CD2 3.98Å; F956-Y975 HydrophobicContact CD2-CE1 4.14Å; F956-Y975 HydrophobicContact CD2-CE2 4.05Å; F956-Y975 HydrophobicContact CD2-CG 4.06Å; F956-F976 HydrophobicContact CD2-CZ 4.49Å; F956-F976 HydrophobicContact CE2-CE2 4.28Å; F956-F976 AromaticContact CE2-CZ 3.67Å; F956-F976 HydrophobicContact CE2-CZ 3.67Å; F956-F976 HydrophobicContact CZ-CZ 4.26Å
957	L	97.6	Very high	96.4	Very high	26 Å²	26	60.1 Å²	60.1	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-72	-21.6	179.3	-65.6	-178.2	0	0	0	114.2	W843 D878 F882 L951 N955 L960	W843-L957 HydrophobicContact CZ2-CD2 4.32Å; D878-L957 HydrophobicContact CB-CD1 4.48Å; F882-L957 HydrophobicContact CB-CD1 4.38Å; F882-L957 HydrophobicContact CB-CD2 4.12Å; F882-L957 HydrophobicContact CD1-CD2 3.91Å; F882-L957 HydrophobicContact CD2-CD2 3.69Å; F882-L957 HydrophobicContact CE1-CD2 4.18Å; F882-L957 HydrophobicContact CE2-CD2 3.99Å; F882-L957 HydrophobicContact CG-CD2 3.63Å; F882-L957 HydrophobicContact CZ-CD2 4.2Å; L951-L957 HydrophobicContact CD1-CD1 4.45Å; L951-L957 HydrophobicContact CD1-CD2 4.34Å; L951-L957 HydrophobicContact CD1-CG 4.03Å; L951-L957 HydrophobicContact CD2-CD1 4.09Å; L951-L957 HydrophobicContact CD2-CG 4.43Å; L951-L957 HydrophobicContact CG-CD1 4Å; L951-L957 HydrophobicContact CG-CG 4.14Å; N955-L957 VanDerWaalsContact C-N 3.31Å; N955-L957 PolarHBondContact O-N 3.4Å; L957-L960 HydrophobicContact CD2-CD2 4.22Å
958	Q	97.1	Very high	96.4	Very high	141 Å²	141	60 Å²	60	66%	0.659	29%	0.291	S	S	*	.	H	α-helix	trans	-75.7	-46.4	168.8	-179.3	-178.4	-26.5	0	0	109.6	N955 F956 L960 A961 L962	N955-Q958 WeakPolarHBondContact O-CA 3.31Å; N955-Q958 VanDerWaalsContact O-CB 3.27Å; N955-Q958 WeakPolarHBondContact O-CB 3.49Å; N955-Q958 PolarHBondContact O-N 3.21Å; F956-Q958 VanDerWaalsContact C-N 3.3Å; F956-Q958 PolarHBondContact O-N 2.98Å; Q958-L960 PolarHBondContact O-N 3.34Å; Q958-A961 WeakPolarHBondContact O-CA 3.21Å; Q958-A961 WeakPolarHBondContact O-CB 3.14Å; Q958-A961 PolarHBondContact O-N 3.32Å; Q958-L962 PolarHBondContact O-N 3.44Å
959	T	97.8	Very high	96.4	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-42	178.6	-41.6	0	0	0	0	112.2	N955 F956 A961 L962 I972 D974 Y975 F976	N955-T959 PolarHBondContact O-N 3.19Å; N955-T959 VanDerWaalsContact O-N 3.08Å; N955-T959 PolarHBondContact O-OG1 2.77Å; F956-T959 PolarHBondContact O-N 3.36Å; T959-A961 PolarHBondContact O-N 3.26Å; T959-A961 VanDerWaalsContact O-N 3.17Å; T959-L962 PolarHBondContact O-N 3.01Å; T959-I972 HydrophobicContact CG2-CG2 3.36Å; T959-D974 HydrophobicContact CG2-CB 3.74Å; T959-Y975 HydrophobicContact CG2-CD2 4.06Å; T959-F976 HydrophobicContact CG2-CD2 4.04Å; T959-F976 HydrophobicContact CG2-CE2 4.1Å
960	L	97.6	Very high	96.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-23.3	173	-174.3	72.6	0	0	0	113.1	F882 L902 I906 F956 L957 Q958 L963 F976	F882-L960 HydrophobicContact CD2-CD2 4.34Å; F882-L960 HydrophobicContact CE2-CD2 3.47Å; F882-L960 VanDerWaalsContact CE2-CD2 3.47Å; F882-L960 HydrophobicContact CZ-CD2 3.93Å; L902-L960 HydrophobicContact CD1-CD1 4.39Å; L902-L960 HydrophobicContact CD2-CD1 4.16Å; L902-L960 HydrophobicContact CD2-CD2 4.39Å; I906-L960 HydrophobicContact CD1-CD1 3.86Å; F956-L960 HydrophobicContact CE1-CD2 4.09Å; F956-L960 HydrophobicContact CZ-CD1 4.31Å; F956-L960 HydrophobicContact CZ-CD2 4.38Å; F956-L960 VanDerWaalsContact O-CB 3.26Å; F956-L960 WeakPolarHBondContact O-CB 3.26Å; F956-L960 PolarHBondContact O-N 2.76Å; L957-L960 HydrophobicContact CD2-CD2 4.22Å; Q958-L960 PolarHBondContact O-N 3.34Å; L960-L963 HydrophobicContact CD1-CD1 3.99Å; L960-F976 HydrophobicContact CD1-CZ 3.94Å
961	A	96.7	Very high	96.2	Very high	27 Å²	27	60.2 Å²	60.2	22%	0.223	29%	0.286	C	S	.	.	H	α-helix	trans	-82.1	-30.4	173.6	0	0	0	0	0	112.5	P840 Q958 T959 L963 E964	P840-A961 HydrophobicContact CB-CB 4.11Å; P840-A961 HydrophobicContact CG-CB 3.77Å; Q958-A961 WeakPolarHBondContact O-CA 3.21Å; Q958-A961 WeakPolarHBondContact O-CB 3.14Å; Q958-A961 PolarHBondContact O-N 3.32Å; T959-A961 PolarHBondContact O-N 3.26Å; T959-A961 VanDerWaalsContact O-N 3.17Å; A961-L963 VanDerWaalsContact C-N 3.28Å; A961-L963 PolarHBondContact O-N 2.67Å; A961-E964 WeakPolarHBondContact O-CG 3.35Å; A961-E964 PolarHBondContact O-N 3.03Å
962	L	96.9	Very high	96.1	Very high	70 Å²	70	60.6 Å²	60.6	37%	0.366	29%	0.288	S	S	.	.	H	α-helix	trans	-67.6	-26.2	179.3	-64.3	174.5	0	0	0	113.2	Q958 T959 E964 E965 E966 I972	Q958-L962 PolarHBondContact O-N 3.44Å; T959-L962 PolarHBondContact O-N 3.01Å; L962-E964 PolarHBondContact O-N 3.2Å; L962-E965 PolarHBondContact O-N 3.39Å; L962-E966 PolarHBondContact O-N 3.3Å; L962-E966 VanDerWaalsContact O-N 3.14Å; L962-I972 HydrophobicContact CB-CD1 3.94Å
963	L	96.8	Very high	96	Very high	2 Å²	2	59 Å²	59	1%	0.01	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-15.3	174.6	-65.7	175.5	0	0	0	114.7	Y842 I906 H910 L960 A961 I969 I972 F976	Y842-L963 HydrophobicContact CD2-CB 3.67Å; Y842-L963 HydrophobicContact CD2-CD1 4.41Å; Y842-L963 VanDerWaalsContact CE2-C 3.47Å; Y842-L963 HydrophobicContact CE2-CB 3.59Å; Y842-L963 WeakPolarHBondContact CE2-O 3.44Å; Y842-L963 PolarHBondContact OH-O 2.68Å; I906-L963 HydrophobicContact CD1-CD1 3.9Å; I906-L963 HydrophobicContact CG1-CD1 4.26Å; I906-L963 HydrophobicContact CG2-CD1 4.38Å; H910-L963 PolarHBondContact CD2-O 2.95Å; H910-L963 PolarHBondContact NE2-O 3.23Å; L960-L963 HydrophobicContact CD1-CD1 3.99Å; A961-L963 VanDerWaalsContact C-N 3.28Å; A961-L963 PolarHBondContact O-N 2.67Å; L963-I969 HydrophobicContact CD2-CD1 3.47Å; L963-I969 VanDerWaalsContact CD2-CD1 3.47Å; L963-I972 HydrophobicContact CD2-CD1 3.84Å; L963-I972 HydrophobicContact CG-CD1 4.4Å; L963-F976 HydrophobicContact CD1-CD1 4.27Å; L963-F976 HydrophobicContact CD1-CD2 4.26Å; L963-F976 HydrophobicContact CD1-CE1 4.05Å; L963-F976 HydrophobicContact CD1-CE2 4.03Å; L963-F976 HydrophobicContact CD1-CG 4.38Å; L963-F976 HydrophobicContact CD1-CZ 3.92Å; L963-F976 HydrophobicContact CD2-CB 4.19Å; L963-F976 HydrophobicContact CD2-CD2 4.06Å; L963-F976 HydrophobicContact CD2-CG 4.03Å; L963-F976 HydrophobicContact CG-CD2 4.35Å; L963-F976 HydrophobicContact CG-CE2 4.42Å
964	E	95	Very high	96	Very high	64 Å²	64	51.3 Å²	51.3	30%	0.299	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-7.2	176.1	86.9	-177.6	-169.8	0	0	114.3	K835 L841 Y842 A961 L962	K835-E964 VanDerWaalsContact CE-OE2 3.29Å; K835-E964 WeakPolarHBondContact CE-OE2 3.5Å; K835-E964 IonicContact NZ-OE1 2.8Å; K835-E964 PolarHBondContact NZ-OE1 3.05Å; K835-E964 IonicContact NZ-OE2 2.69Å; K835-E964 PolarHBondContact NZ-OE2 3.36Å; L841-E964 WeakPolarHBondContact CA-OE2 3.34Å; L841-E964 HydrophobicContact CB-CB 4Å; L841-E964 WeakPolarHBondContact CB-OE2 3.5Å; L841-E964 HydrophobicContact CD2-CB 4.47Å; L841-E964 PolarHBondContact N-OE2 3.35Å; Y842-E964 HydrophobicContact CE2-CB 4.19Å; A961-E964 WeakPolarHBondContact O-CG 3.35Å; A961-E964 PolarHBondContact O-N 3.03Å; L962-E964 PolarHBondContact O-N 3.2Å
965	E	95.4	Very high	96.1	Very high	152 Å²	152	50.3 Å²	50.3	71%	0.71	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-23.6	-178.1	-57.7	-165.8	152.9	0	0	112.3	L962	L962-E965 PolarHBondContact O-N 3.39Å
966	E	96.2	Very high	96.1	Very high	89 Å²	89	47.6 Å²	47.6	42%	0.416	24%	0.241	S	C	.	.			trans	-117.8	122.8	-177.5	-165.4	60	-97.9	0	0	111	H910 L962 Q971 I972	H910-E966 PolarHBondContact NE2-O 2.95Å; L962-E966 PolarHBondContact O-N 3.3Å; L962-E966 VanDerWaalsContact O-N 3.14Å; E966-Q971 HydrophobicContact CG-CB 3.96Å; E966-Q971 HydrophobicContact CG-CG 4.23Å; E966-I972 HydrophobicContact CB-CD1 4.09Å
967	D	94.4	Very high	96.1	Very high	122 Å²	122	47.6 Å²	47.6	65%	0.652	24%	0.241	S	C	*	.	S	Bend	trans	-79.9	-26.5	-178.4	-75.3	-39.7	0	0	0	112.2	H910 P911 G912	H910-D967 PolarHBondContact CE1-O 3.23Å; P911-D967 HydrophobicContact CG-CB 4Å; P911-D967 WeakPolarHBondContact CG-OD1 3.43Å; G912-D967 PolarHBondContact N-O 3.32Å
968	D	94.8	Very high	96	Very high	45 Å²	45	46.4 Å²	46.4	24%	0.241	24%	0.235	C	C	.	.			trans	-90.9	109.9	-178.9	178.2	9.9	0	0	0	110.9	Y360 N970 Q971	Y360-D968 VanDerWaalsContact CE1-OD1 3.3Å; Y360-D968 WeakPolarHBondContact CE1-OD1 2.87Å; Y360-D968 VanDerWaalsContact CZ-OD1 3.29Å; Y360-D968 PolarHBondContact OH-OD1 3.38Å; D968-N970 PolarHBondContact O-N 2.94Å; D968-N970 PolarHBondContact OD1-N 2.93Å; D968-Q971 HydrophobicContact CB-CG 3.95Å; D968-Q971 PolarHBondContact O-N 2.67Å; D968-Q971 WeakPolarHBondContact OD2-CG 3.3Å; D968-Q971 PolarHBondContact OD2-NE2 3.39Å
969	I	95.3	Very high	95.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-66.5	-22.8	-172.8	-163.5	69.3	0	0	0	112.8	Y360 L913 L963 I972 F976	Y360-I969 HydrophobicContact CE2-CG2 3.76Å; Y360-I969 PolarHBondContact OH-N 3.14Å; L913-I969 HydrophobicContact CD1-CD1 4.09Å; L913-I969 HydrophobicContact CD1-CG1 4.16Å; L913-I969 HydrophobicContact CD2-CG1 4.14Å; L913-I969 HydrophobicContact CD2-CG2 4.11Å; L913-I969 HydrophobicContact CG-CB 4.45Å; L913-I969 HydrophobicContact CG-CD1 4.4Å; L913-I969 HydrophobicContact CG-CG1 4.08Å; L913-I969 HydrophobicContact CG-CG2 4.49Å; L963-I969 HydrophobicContact CD2-CD1 3.47Å; L963-I969 VanDerWaalsContact CD2-CD1 3.47Å; I969-I972 PolarHBondContact O-N 2.57Å; I969-F976 HydrophobicContact CD1-CB 3.96Å; I969-F976 HydrophobicContact CG1-CB 4.33Å; I969-F976 WeakPolarHBondContact CG1-O 3.44Å
970	N	94.5	Very high	95.9	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.027	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-81.2	-24.7	-174.3	-63.8	-19	0	0	0	113.2	Y360 D968 I972 T973 Y978 E979	Y360-N970 WeakPolarHBondContact CD1-ND2 3.24Å; Y360-N970 WeakPolarHBondContact CE1-ND2 3.41Å; D968-N970 PolarHBondContact O-N 2.94Å; D968-N970 PolarHBondContact OD1-N 2.93Å; N970-I972 PolarHBondContact O-N 3.03Å; N970-I972 VanDerWaalsContact O-N 3.12Å; N970-T973 PolarHBondContact O-N 3.33Å; N970-Y978 WeakPolarHBondContact OD1-CA 3.37Å; N970-Y978 WeakPolarHBondContact OD1-CB 3.45Å; N970-Y978 PolarHBondContact OD1-N 3.43Å; N970-E979 HydrophobicContact CB-CG 4.33Å; N970-E979 VanDerWaalsContact CB-OE1 3.29Å; N970-E979 WeakPolarHBondContact CB-OE1 3.32Å; N970-E979 VanDerWaalsContact CG-CD 3.46Å; N970-E979 VanDerWaalsContact CG-OE1 3.28Å; N970-E979 VanDerWaalsContact ND2-CG 3.31Å; N970-E979 WeakPolarHBondContact ND2-CG 3.41Å; N970-E979 PolarHBondContact ND2-OE1 2.78Å; N970-E979 PolarHBondContact OD1-N 3.1Å
971	Q	93.8	Very high	95.9	Very high	125 Å²	125	41.8 Å²	41.8	58%	0.584	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-59.6	-22	168	-53.4	-54.3	-45	0	0	111.9	E966 D968 T973	E966-Q971 HydrophobicContact CG-CB 3.96Å; E966-Q971 HydrophobicContact CG-CG 4.23Å; D968-Q971 HydrophobicContact CB-CG 3.95Å; D968-Q971 PolarHBondContact O-N 2.67Å; D968-Q971 WeakPolarHBondContact OD2-CG 3.3Å; D968-Q971 PolarHBondContact OD2-NE2 3.39Å; Q971-T973 PolarHBondContact O-N 3.09Å
972	I	93.8	Very high	95.9	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.051	20%	0.203	C	C	.	.			trans	-95.2	69.8	175	-57.5	176.5	0	0	0	108.5	T959 L962 L963 E966 I969 N970 D974 F976 S977	T959-I972 HydrophobicContact CG2-CG2 3.36Å; L962-I972 HydrophobicContact CB-CD1 3.94Å; L963-I972 HydrophobicContact CD2-CD1 3.84Å; L963-I972 HydrophobicContact CG-CD1 4.4Å; E966-I972 HydrophobicContact CB-CD1 4.09Å; I969-I972 PolarHBondContact O-N 2.57Å; N970-I972 PolarHBondContact O-N 3.03Å; N970-I972 VanDerWaalsContact O-N 3.12Å; I972-D974 VanDerWaalsContact C-N 3.25Å; I972-D974 PolarHBondContact O-N 2.86Å; I972-F976 HydrophobicContact CG2-CB 4.32Å; I972-F976 HydrophobicContact CG2-CD2 3.96Å; I972-S977 WeakPolarHBondContact O-CB 3.5Å; I972-S977 PolarHBondContact O-N 3.09Å
973	T	94.6	Very high	95.9	Very high	53 Å²	53	37.2 Å²	37.2	33%	0.325	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-41.6	178.6	58.1	0	0	0	0	112	R933 N970 Q971 Y975 H980	R933-T973 VanDerWaalsContact CZ-O 3.26Å; R933-T973 PolarHBondContact NH1-O 3Å; R933-T973 PolarHBondContact NH2-O 3.3Å; N970-T973 PolarHBondContact O-N 3.33Å; Q971-T973 PolarHBondContact O-N 3.09Å; T973-Y975 PolarHBondContact O-N 2.9Å; T973-H980 PolarHBondContact O-ND1 2.99Å
974	D	96.1	Very high	96	Very high	60 Å²	60	37.1 Å²	37.1	32%	0.321	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	119	173.7	-95.9	-29.3	0	0	0	112	N955 T959 I972 F976	N955-D974 PolarHBondContact ND2-OD2 3.37Å; T959-D974 HydrophobicContact CG2-CB 3.74Å; I972-D974 VanDerWaalsContact C-N 3.25Å; I972-D974 PolarHBondContact O-N 2.86Å; D974-F976 WeakPolarHBondContact O-CD2 3.39Å; D974-F976 PolarHBondContact O-N 2.76Å
975	Y	97.8	Very high	96	Very high	3 Å²	3	35.1 Å²	35.1	1%	0.012	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	-52.4	179.2	-42.7	-81.4	0	0	0	116.2	R933 I934 V937 V938 N955 F956 T959 T973	R933-Y975 PolarHBondContact NH1-O 3.23Å; I934-Y975 HydrophobicContact CB-CD1 4.21Å; I934-Y975 HydrophobicContact CG1-CD1 3.59Å; I934-Y975 HydrophobicContact CG1-CE1 4.27Å; I934-Y975 HydrophobicContact CG1-CG 4.19Å; V937-Y975 HydrophobicContact CB-CE1 3.92Å; V937-Y975 HydrophobicContact CG1-CE1 4.34Å; V937-Y975 WeakPolarHBondContact CG1-OH 3.39Å; V937-Y975 HydrophobicContact CG2-CE1 4.36Å; V938-Y975 HydrophobicContact CG2-CE1 4.08Å; N955-Y975 WeakPolarHBondContact OD1-CE2 3.4Å; N955-Y975 PolarHBondContact OD1-OH 2.74Å; F956-Y975 HydrophobicContact CB-CE1 4.49Å; F956-Y975 HydrophobicContact CB-CE2 4.08Å; F956-Y975 HydrophobicContact CD2-CD1 4.14Å; F956-Y975 AromaticContact CD2-CD2 3.98Å; F956-Y975 HydrophobicContact CD2-CD2 3.98Å; F956-Y975 HydrophobicContact CD2-CE1 4.14Å; F956-Y975 HydrophobicContact CD2-CE2 4.05Å; F956-Y975 HydrophobicContact CD2-CG 4.06Å; T959-Y975 HydrophobicContact CG2-CD2 4.06Å; T973-Y975 PolarHBondContact O-N 2.9Å
976	F	97.9	Very high	96	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-20.2	-156.4	-59.1	-76.6	0	0	0	116.5	L903 I906 Y926 V930 F956 T959 L960 L963 I969 I972 D974 Y978	L903-F976 HydrophobicContact CD2-CD1 4.39Å; L903-F976 HydrophobicContact CD2-CE1 3.83Å; I906-F976 HydrophobicContact CD1-CE1 4.01Å; Y926-F976 WeakPolarHBondContact CE2-O 3.47Å; Y926-F976 PolarHBondContact OH-O 2.95Å; V930-F976 HydrophobicContact CG1-CD1 3.82Å; V930-F976 HydrophobicContact CG1-CE1 3.95Å; F956-F976 HydrophobicContact CD2-CZ 4.49Å; F956-F976 HydrophobicContact CE2-CE2 4.28Å; F956-F976 AromaticContact CE2-CZ 3.67Å; F956-F976 HydrophobicContact CE2-CZ 3.67Å; F956-F976 HydrophobicContact CZ-CZ 4.26Å; T959-F976 HydrophobicContact CG2-CD2 4.04Å; T959-F976 HydrophobicContact CG2-CE2 4.1Å; L960-F976 HydrophobicContact CD1-CZ 3.94Å; L963-F976 HydrophobicContact CD1-CD1 4.27Å; L963-F976 HydrophobicContact CD1-CD2 4.26Å; L963-F976 HydrophobicContact CD1-CE1 4.05Å; L963-F976 HydrophobicContact CD1-CE2 4.03Å; L963-F976 HydrophobicContact CD1-CG 4.38Å; L963-F976 HydrophobicContact CD1-CZ 3.92Å; L963-F976 HydrophobicContact CD2-CB 4.19Å; L963-F976 HydrophobicContact CD2-CD2 4.06Å; L963-F976 HydrophobicContact CD2-CG 4.03Å; L963-F976 HydrophobicContact CG-CD2 4.35Å; L963-F976 HydrophobicContact CG-CE2 4.42Å; I969-F976 HydrophobicContact CD1-CB 3.96Å; I969-F976 HydrophobicContact CG1-CB 4.33Å; I969-F976 WeakPolarHBondContact CG1-O 3.44Å; I972-F976 HydrophobicContact CG2-CB 4.32Å; I972-F976 HydrophobicContact CG2-CD2 3.96Å; D974-F976 WeakPolarHBondContact O-CD2 3.39Å; D974-F976 PolarHBondContact O-N 2.76Å; F976-Y978 PolarHBondContact O-N 3.11Å
977	S	97.3	Very high	96	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.007	13%	0.128	C	C	.	.			trans	-45	131.1	178.6	162.3	0	0	0	0	113.1	I972 E979 H980 F981	I972-S977 WeakPolarHBondContact O-CB 3.5Å; I972-S977 PolarHBondContact O-N 3.09Å; S977-E979 PolarHBondContact OG-N 3.19Å; S977-H980 PolarHBondContact OG-CD2 2.99Å; S977-H980 PolarHBondContact OG-N 2.9Å; S977-F981 PolarHBondContact O-N 3.3Å
978	Y	96.6	Very high	96.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-78.7	-38.5	179.2	-179.7	-98	0	0	0	111.7	P357 P358 Y360 L913 F915 L916 Y926 N970 F976 H980 F981 Y982	P357-Y978 WeakPolarHBondContact CB-OH 3.46Å; P358-Y978 VanDerWaalsContact O-CE1 3.3Å; P358-Y978 WeakPolarHBondContact O-CE1 3.31Å; P358-Y978 PolarHBondContact O-OH 2.92Å; Y360-Y978 AromaticContact CD2-CD1 3.97Å; Y360-Y978 HydrophobicContact CD2-CD1 3.97Å; Y360-Y978 HydrophobicContact CD2-CG 4.48Å; Y360-Y978 HydrophobicContact CG-CD1 4.44Å; L913-Y978 HydrophobicContact CD2-CD2 4.38Å; F915-Y978 HydrophobicContact CE2-CD2 4.41Å; F915-Y978 AromaticContact CE2-CE1 3.93Å; F915-Y978 HydrophobicContact CE2-CE1 3.93Å; F915-Y978 AromaticContact CE2-CE2 3.81Å; F915-Y978 HydrophobicContact CE2-CE2 3.81Å; F915-Y978 AromaticContact CE2-CZ 3.54Å; F915-Y978 AromaticContact CZ-CD1 3.88Å; F915-Y978 HydrophobicContact CZ-CD1 3.88Å; F915-Y978 AromaticContact CZ-CD2 4Å; F915-Y978 HydrophobicContact CZ-CD2 4Å; F915-Y978 AromaticContact CZ-CE1 3.71Å; F915-Y978 HydrophobicContact CZ-CE1 3.71Å; F915-Y978 AromaticContact CZ-CE2 3.85Å; F915-Y978 HydrophobicContact CZ-CE2 3.85Å; F915-Y978 HydrophobicContact CZ-CG 4.02Å; F915-Y978 AromaticContact CZ-CZ 3.7Å; L916-Y978 HydrophobicContact CD1-CD2 4.12Å; L916-Y978 HydrophobicContact CD1-CE2 3.93Å; L916-Y978 HydrophobicContact CD2-CE2 3.97Å; L916-Y978 HydrophobicContact CG-CE2 4.14Å; Y926-Y978 HydrophobicContact CD2-CD2 4.04Å; Y926-Y978 HydrophobicContact CE2-CD2 4.33Å; N970-Y978 WeakPolarHBondContact OD1-CA 3.37Å; N970-Y978 WeakPolarHBondContact OD1-CB 3.45Å; N970-Y978 PolarHBondContact OD1-N 3.43Å; F976-Y978 PolarHBondContact O-N 3.11Å; Y978-H980 VanDerWaalsContact C-N 3.26Å; Y978-H980 PolarHBondContact O-N 3.39Å; Y978-F981 AromaticContact CD2-CD1 3.66Å; Y978-F981 HydrophobicContact CD2-CD1 3.66Å; Y978-F981 HydrophobicContact CD2-CE1 4.25Å; Y978-F981 AromaticContact CE2-CD1 3.43Å; Y978-F981 HydrophobicContact CE2-CD1 3.43Å; Y978-F981 VanDerWaalsContact CE2-CD1 3.43Å; Y978-F981 AromaticContact CE2-CE1 3.56Å; Y978-F981 HydrophobicContact CE2-CE1 3.56Å; Y978-F981 WeakPolarHBondContact O-CA 3.1Å; Y978-F981 WeakPolarHBondContact O-CB 3.34Å; Y978-F981 PolarHBondContact O-N 3.45Å; Y978-Y982 AromaticContact CE1-CD2 3.97Å; Y978-Y982 HydrophobicContact CE1-CD2 3.97Å; Y978-Y982 WeakPolarHBondContact O-CB 3.2Å; Y978-Y982 PolarHBondContact O-N 3.11Å
979	E	95.8	Very high	96	Very high	44 Å²	44	19.9 Å²	19.9	21%	0.206	10%	0.096	C	C	.	.	H	α-helix	trans	-50.3	-46.8	169.5	-79	155.5	-155.3	0	0	111.4	N970 S977 F981 Y982 V983 Y1175	N970-E979 HydrophobicContact CB-CG 4.33Å; N970-E979 VanDerWaalsContact CB-OE1 3.29Å; N970-E979 WeakPolarHBondContact CB-OE1 3.32Å; N970-E979 VanDerWaalsContact CG-CD 3.46Å; N970-E979 VanDerWaalsContact CG-OE1 3.28Å; N970-E979 VanDerWaalsContact ND2-CG 3.31Å; N970-E979 WeakPolarHBondContact ND2-CG 3.41Å; N970-E979 PolarHBondContact ND2-OE1 2.78Å; N970-E979 PolarHBondContact OD1-N 3.1Å; S977-E979 PolarHBondContact OG-N 3.19Å; E979-F981 VanDerWaalsContact C-N 3.34Å; E979-F981 PolarHBondContact O-N 3.45Å; E979-Y982 WeakPolarHBondContact O-CB 3.45Å; E979-Y982 PolarHBondContact O-N 3.2Å; E979-Y982 VanDerWaalsContact O-N 3.15Å; E979-V983 PolarHBondContact O-N 2.86Å; E979-Y1175 HydrophobicContact CB-CD2 4.15Å; E979-Y1175 HydrophobicContact CB-CE2 4.47Å; E979-Y1175 HydrophobicContact CB-CG 4.25Å; E979-Y1175 HydrophobicContact CG-CD1 3.81Å; E979-Y1175 HydrophobicContact CG-CD2 3.97Å; E979-Y1175 HydrophobicContact CG-CE1 3.82Å; E979-Y1175 HydrophobicContact CG-CE2 3.99Å; E979-Y1175 HydrophobicContact CG-CG 3.89Å
980	H	97.6	Very high	95.9	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.019	12%	0.115	C	C	.	.	H	α-helix	trans	-65.1	-38.1	179.1	-68.8	-163.8	0	0	0	112	R933 T973 S977 Y978 I984 W1167 D1168	R933-H980 PolarHBondContact NH2-ND1 3.41Å; T973-H980 PolarHBondContact O-ND1 2.99Å; S977-H980 PolarHBondContact OG-CD2 2.99Å; S977-H980 PolarHBondContact OG-N 2.9Å; Y978-H980 VanDerWaalsContact C-N 3.26Å; Y978-H980 PolarHBondContact O-N 3.39Å; H980-I984 WeakPolarHBondContact O-CD1 3.27Å; H980-I984 WeakPolarHBondContact O-CG1 3.42Å; H980-I984 PolarHBondContact O-N 3.22Å; H980-W1167 HydrophobicContact CB-CZ2 4.29Å; H980-W1167 AromaticContact CE1-CD1 3.9Å; H980-W1167 AromaticContact CE1-NE1 3.53Å; H980-W1167 AromaticContact CG-NE1 3.62Å; H980-W1167 AromaticContact ND1-CD1 3.83Å; H980-W1167 AromaticContact ND1-NE1 3.1Å; H980-W1167 PolarHBondContact ND1-NE1 3.44Å; H980-W1167 VanDerWaalsContact ND1-NE1 3.1Å; H980-D1168 IonicContact CE1-OD1 3.75Å; H980-D1168 PolarHBondContact CE1-OD1 3.36Å; H980-D1168 VanDerWaalsContact CE1-OD1 3.29Å
981	F	97.8	Very high	96	Very high	2 Å²	2	24 Å²	24	1%	0.009	12%	0.116	C	C	.	.	H	α-helix	trans	-65	-41.9	172.5	153.7	-102.1	0	0	0	111.7	P357 F922 R925 Y926 T929 S977 Y978 E979 I984 Y985 Y1039	P357-F981 HydrophobicContact CB-CE1 4.4Å; F922-F981 HydrophobicContact CB-CE1 4.46Å; F922-F981 HydrophobicContact CB-CZ 4.21Å; R925-F981 HydrophobicContact CB-CE2 3.65Å; R925-F981 HydrophobicContact CB-CZ 3.97Å; Y926-F981 HydrophobicContact CD2-CB 3.83Å; Y926-F981 AromaticContact CD2-CD1 3.89Å; Y926-F981 HydrophobicContact CD2-CD1 3.89Å; Y926-F981 HydrophobicContact CD2-CD2 4.44Å; Y926-F981 AromaticContact CD2-CG 3.75Å; Y926-F981 HydrophobicContact CD2-CG 3.75Å; Y926-F981 HydrophobicContact CE2-CB 4.38Å; Y926-F981 HydrophobicContact CG-CG 4.47Å; T929-F981 HydrophobicContact CG2-CB 4.37Å; T929-F981 HydrophobicContact CG2-CD2 4.27Å; S977-F981 PolarHBondContact O-N 3.3Å; Y978-F981 AromaticContact CD2-CD1 3.66Å; Y978-F981 HydrophobicContact CD2-CD1 3.66Å; Y978-F981 HydrophobicContact CD2-CE1 4.25Å; Y978-F981 AromaticContact CE2-CD1 3.43Å; Y978-F981 HydrophobicContact CE2-CD1 3.43Å; Y978-F981 VanDerWaalsContact CE2-CD1 3.43Å; Y978-F981 AromaticContact CE2-CE1 3.56Å; Y978-F981 HydrophobicContact CE2-CE1 3.56Å; Y978-F981 WeakPolarHBondContact O-CA 3.1Å; Y978-F981 WeakPolarHBondContact O-CB 3.34Å; Y978-F981 PolarHBondContact O-N 3.45Å; E979-F981 VanDerWaalsContact C-N 3.34Å; E979-F981 PolarHBondContact O-N 3.45Å; F981-I984 PolarHBondContact O-N 3.03Å; F981-Y985 HydrophobicContact CE2-CD2 4.31Å; F981-Y985 HydrophobicContact CE2-CG 4.43Å; F981-Y985 HydrophobicContact CZ-CD2 4.4Å; F981-Y985 HydrophobicContact CZ-CG 4.33Å; F981-Y985 PolarHBondContact O-N 2.9Å; F981-Y1039 WeakPolarHBondContact CE2-OH 3.41Å
982	Y	96.1	Very high	96.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59.8	-52.4	-177.1	-170.2	-80.2	0	0	0	111	Q356 P357 Y978 E979 I984 Y985 C986 Y1175 L1178	Q356-Y982 PolarHBondContact NE2-OH 2.88Å; P357-Y982 HydrophobicContact CB-CD2 3.86Å; P357-Y982 HydrophobicContact CB-CE2 3.9Å; P357-Y982 HydrophobicContact CG-CD2 4.36Å; P357-Y982 HydrophobicContact CG-CE2 4.42Å; P357-Y982 WeakPolarHBondContact O-CE2 3.39Å; Y978-Y982 AromaticContact CE1-CD2 3.97Å; Y978-Y982 HydrophobicContact CE1-CD2 3.97Å; Y978-Y982 WeakPolarHBondContact O-CB 3.2Å; Y978-Y982 PolarHBondContact O-N 3.11Å; E979-Y982 WeakPolarHBondContact O-CB 3.45Å; E979-Y982 PolarHBondContact O-N 3.2Å; E979-Y982 VanDerWaalsContact O-N 3.15Å; Y982-I984 VanDerWaalsContact C-N 3.35Å; Y982-I984 PolarHBondContact O-N 3.21Å; Y982-Y985 PolarHBondContact O-N 2.95Å; Y982-Y985 VanDerWaalsContact O-N 3.09Å; Y982-C986 VanDerWaalsContact CE1-SG 3.54Å; Y982-C986 PolarHBondContact O-N 2.88Å; Y982-Y1175 AromaticContact CD1-CD2 3.77Å; Y982-Y1175 HydrophobicContact CD1-CD2 3.77Å; Y982-Y1175 AromaticContact CD1-CE2 3.7Å; Y982-Y1175 HydrophobicContact CD1-CE2 3.7Å; Y982-Y1175 HydrophobicContact CD2-CE2 4.22Å; Y982-Y1175 HydrophobicContact CE1-CD2 4.42Å; Y982-Y1175 HydrophobicContact CE1-CE2 4.19Å; Y982-Y1175 HydrophobicContact CG-CD2 4.11Å; Y982-Y1175 AromaticContact CG-CE2 3.72Å; Y982-Y1175 HydrophobicContact CG-CE2 3.72Å; Y982-L1178 HydrophobicContact CD1-CD1 4.24Å; Y982-L1178 HydrophobicContact CE1-CB 4.39Å; Y982-L1178 HydrophobicContact CE1-CD1 4.16Å
983	V	96.9	Very high	96.1	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58	-45.5	175.8	175.2	0	0	0	0	111.4	E979 Y985 C986 K987 Y1170 A1171 E1174 Y1175 L1178	E979-V983 PolarHBondContact O-N 2.86Å; V983-Y985 VanDerWaalsContact C-N 3.27Å; V983-Y985 PolarHBondContact O-N 3.45Å; V983-C986 PolarHBondContact O-N 2.95Å; V983-K987 HydrophobicContact CG1-CG 4.34Å; V983-K987 WeakPolarHBondContact O-CG 3.45Å; V983-K987 PolarHBondContact O-N 2.69Å; V983-Y1170 HydrophobicContact CG1-CE1 4.16Å; V983-A1171 WeakPolarHBondContact CG2-O 3.5Å; V983-E1174 HydrophobicContact CG1-CB 3.73Å; V983-E1174 HydrophobicContact CG1-CG 4.27Å; V983-E1174 HydrophobicContact CG2-CB 3.98Å; V983-Y1175 HydrophobicContact CG2-CD2 4.45Å; V983-L1178 HydrophobicContact CG2-CD1 4.3Å
984	I	97.8	Very high	96	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.8	-34.4	177.7	-65.3	165.3	0	0	0	111.9	T929 H980 F981 Y982 F988 Y1039 V1043 L1046 L1047 W1167	T929-I984 HydrophobicContact CG2-CD1 3.76Å; T929-I984 HydrophobicContact CG2-CG2 4.33Å; H980-I984 WeakPolarHBondContact O-CD1 3.27Å; H980-I984 WeakPolarHBondContact O-CG1 3.42Å; H980-I984 PolarHBondContact O-N 3.22Å; F981-I984 PolarHBondContact O-N 3.03Å; Y982-I984 VanDerWaalsContact C-N 3.35Å; Y982-I984 PolarHBondContact O-N 3.21Å; I984-F988 WeakPolarHBondContact O-CB 3.32Å; I984-F988 PolarHBondContact O-N 3.13Å; I984-Y1039 HydrophobicContact CG2-CE2 4.19Å; I984-V1043 HydrophobicContact CD1-CG1 4.43Å; I984-V1043 HydrophobicContact CG2-CB 4.32Å; I984-V1043 HydrophobicContact CG2-CG1 4.38Å; I984-V1043 HydrophobicContact CG2-CG2 3.67Å; I984-L1046 HydrophobicContact CB-CD2 4.24Å; I984-L1046 HydrophobicContact CG1-CD2 3.98Å; I984-L1046 HydrophobicContact CG2-CD2 4.34Å; I984-L1047 HydrophobicContact CD1-CD2 4.37Å; I984-W1167 HydrophobicContact CD1-CH2 3.87Å; I984-W1167 HydrophobicContact CD1-CZ2 3.74Å; I984-W1167 HydrophobicContact CG1-CH2 3.52Å; I984-W1167 HydrophobicContact CG1-CZ2 3.83Å
985	Y	96.4	Very high	95.9	Very high	22 Å²	22	25.7 Å²	25.7	9%	0.086	13%	0.127	C	C	.	.	H	α-helix	trans	-75.4	-44.9	177	-172.3	-91.1	0	0	0	112.4	P357 F922 R925 F981 Y982 V983 F988 W989 Y1039	P357-Y985 HydrophobicContact CG-CD1 3.29Å; P357-Y985 HydrophobicContact CG-CE1 3.78Å; P357-Y985 HydrophobicContact CG-CG 3.96Å; F922-Y985 HydrophobicContact CD1-CE1 4.14Å; F922-Y985 AromaticContact CE1-CE1 3.86Å; F922-Y985 HydrophobicContact CE1-CE1 3.86Å; F922-Y985 AromaticContact CE1-CZ 3.91Å; R925-Y985 HydrophobicContact CB-CD2 4.1Å; R925-Y985 HydrophobicContact CB-CE2 4.24Å; R925-Y985 HydrophobicContact CG-CD2 4.07Å; R925-Y985 HydrophobicContact CG-CE2 3.71Å; F981-Y985 HydrophobicContact CE2-CD2 4.31Å; F981-Y985 HydrophobicContact CE2-CG 4.43Å; F981-Y985 HydrophobicContact CZ-CD2 4.4Å; F981-Y985 HydrophobicContact CZ-CG 4.33Å; F981-Y985 PolarHBondContact O-N 2.9Å; Y982-Y985 PolarHBondContact O-N 2.95Å; Y982-Y985 VanDerWaalsContact O-N 3.09Å; V983-Y985 VanDerWaalsContact C-N 3.27Å; V983-Y985 PolarHBondContact O-N 3.45Å; Y985-F988 WeakPolarHBondContact O-CB 3.33Å; Y985-F988 PolarHBondContact O-N 3.43Å; Y985-W989 HydrophobicContact CE1-CB 4.32Å; Y985-W989 WeakPolarHBondContact O-CB 3.45Å; Y985-W989 PolarHBondContact O-N 2.91Å; Y985-Y1039 HydrophobicContact CD2-CE2 4.22Å
986	C	94.7	Very high	95.6	Very high	8 Å²	8	28 Å²	28	5%	0.054	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-50.1	176.8	-70.9	0	0	0	0	111.5	Y982 V983 F988 W989 E990 L1178	Y982-C986 VanDerWaalsContact CE1-SG 3.54Å; Y982-C986 PolarHBondContact O-N 2.88Å; V983-C986 PolarHBondContact O-N 2.95Å; C986-F988 PolarHBondContact O-N 2.92Å; C986-F988 VanDerWaalsContact O-N 3.15Å; C986-W989 PolarHBondContact O-N 3.37Å; C986-E990 WeakPolarHBondContact O-CB 3.38Å; C986-E990 VanDerWaalsContact O-CG 3.29Å; C986-E990 WeakPolarHBondContact O-CG 3.2Å; C986-E990 PolarHBondContact O-N 3.45Å; C986-L1178 HydrophobicContact CB-CD1 3.85Å; C986-L1178 HydrophobicContact CB-CD2 4.31Å
987	K	95.8	Very high	95.4	Very high	23 Å²	23	31.4 Å²	31.4	10%	0.1	16%	0.157	C	C	.	.	H	α-helix	trans	-63.1	-21.6	176.4	-63.1	-46.3	-177.1	-163.3	0	114.4	V983 E990 L991 Y1007 F1042 L1046 E1174	V983-K987 HydrophobicContact CG1-CG 4.34Å; V983-K987 WeakPolarHBondContact O-CG 3.45Å; V983-K987 PolarHBondContact O-N 2.69Å; K987-E990 WeakPolarHBondContact CD-OE1 3.27Å; K987-E990 WeakPolarHBondContact CD-OE2 3.49Å; K987-E990 IonicContact NZ-OE1 3.19Å; K987-E990 IonicContact NZ-OE2 2.68Å; K987-E990 PolarHBondContact NZ-OE2 3.09Å; K987-L991 WeakPolarHBondContact O-CD1 3.14Å; K987-L991 WeakPolarHBondContact O-CG 3.39Å; K987-Y1007 HydrophobicContact CB-CE2 4.45Å; K987-F1042 HydrophobicContact CB-CE1 4.37Å; K987-F1042 HydrophobicContact CB-CZ 4.15Å; K987-F1042 WeakPolarHBondContact O-CZ 3.36Å; K987-L1046 HydrophobicContact CB-CD2 4.01Å; K987-L1046 HydrophobicContact CG-CD2 4.43Å; K987-E1174 WeakPolarHBondContact CE-OE2 3.36Å; K987-E1174 IonicContact NZ-OE2 3.19Å; K987-E1174 PolarHBondContact NZ-OE2 2.73Å
988	F	96.4	Very high	95.3	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.009	17%	0.174	C	C	.	.	H	α-helix	trans	-78	-47.9	170.2	178.8	-96.9	0	0	0	111.4	I984 Y985 C986 E990 L991 D992 I999 Y1039 F1042	I984-F988 WeakPolarHBondContact O-CB 3.32Å; I984-F988 PolarHBondContact O-N 3.13Å; Y985-F988 WeakPolarHBondContact O-CB 3.33Å; Y985-F988 PolarHBondContact O-N 3.43Å; C986-F988 PolarHBondContact O-N 2.92Å; C986-F988 VanDerWaalsContact O-N 3.15Å; F988-E990 VanDerWaalsContact C-N 3.33Å; F988-E990 PolarHBondContact O-N 3.13Å; F988-L991 PolarHBondContact O-N 2.71Å; F988-D992 HydrophobicContact CD1-CB 4.2Å; F988-D992 HydrophobicContact CE1-CB 3.72Å; F988-D992 VanDerWaalsContact CE1-OD2 3.24Å; F988-D992 WeakPolarHBondContact CE1-OD2 3.28Å; F988-D992 HydrophobicContact CZ-CB 4.01Å; F988-D992 PolarHBondContact O-N 3.46Å; F988-I999 HydrophobicContact CD2-CD1 3.36Å; F988-I999 HydrophobicContact CD2-CG1 4.1Å; F988-I999 HydrophobicContact CE2-CD1 3.46Å; F988-I999 VanDerWaalsContact CE2-CD1 3.46Å; F988-I999 HydrophobicContact CE2-CG1 3.68Å; F988-I999 HydrophobicContact CG-CD1 4.31Å; F988-I999 HydrophobicContact CZ-CD1 4.46Å; F988-I999 HydrophobicContact CZ-CG1 4.33Å; F988-Y1039 HydrophobicContact CB-CD2 3.83Å; F988-Y1039 HydrophobicContact CB-CE2 3.87Å; F988-Y1039 AromaticContact CD1-CD2 3.77Å; F988-Y1039 HydrophobicContact CD1-CD2 3.77Å; F988-Y1039 HydrophobicContact CD1-CE2 4.36Å; F988-Y1039 AromaticContact CD2-CD2 3.67Å; F988-Y1039 HydrophobicContact CD2-CD2 3.67Å; F988-Y1039 HydrophobicContact CE1-CD2 4.27Å; F988-Y1039 HydrophobicContact CE2-CD2 4.16Å; F988-Y1039 AromaticContact CG-CD2 3.46Å; F988-Y1039 HydrophobicContact CG-CD2 3.46Å; F988-Y1039 VanDerWaalsContact CG-CD2 3.46Å; F988-Y1039 HydrophobicContact CG-CE2 4.01Å; F988-Y1039 HydrophobicContact CZ-CD2 4.45Å; F988-F1042 HydrophobicContact CB-CD1 3.76Å; F988-F1042 HydrophobicContact CB-CE1 3.69Å; F988-F1042 HydrophobicContact CB-CZ 4.45Å; F988-F1042 HydrophobicContact CD2-CB 3.85Å; F988-F1042 AromaticContact CD2-CD1 3.68Å; F988-F1042 HydrophobicContact CD2-CD1 3.68Å; F988-F1042 HydrophobicContact CD2-CD2 4.37Å; F988-F1042 HydrophobicContact CD2-CE1 4.32Å; F988-F1042 AromaticContact CD2-CG 3.7Å; F988-F1042 HydrophobicContact CD2-CG 3.7Å; F988-F1042 HydrophobicContact CE2-CB 4.24Å; F988-F1042 HydrophobicContact CE2-CG 4.49Å; F988-F1042 HydrophobicContact CG-CD1 4.2Å
989	W	93.4	Very high	95.2	Very high	56 Å²	56	35.7 Å²	35.7	21%	0.212	17%	0.174	C	C	.	.	H	α-helix	trans	-66.4	-32.4	-177.1	-175.3	90.8	0	0	0	112.8	I351 Y985 C986 L991 H995	I351-W989 HydrophobicContact CG2-CH2 3.65Å; I351-W989 HydrophobicContact CG2-CZ3 3.64Å; I351-W989 VanDerWaalsContact O-CH2 3.24Å; I351-W989 WeakPolarHBondContact O-CH2 3.44Å; Y985-W989 HydrophobicContact CE1-CB 4.32Å; Y985-W989 WeakPolarHBondContact O-CB 3.45Å; Y985-W989 PolarHBondContact O-N 2.91Å; C986-W989 PolarHBondContact O-N 3.37Å; W989-L991 PolarHBondContact O-N 3.1Å; W989-H995 AromaticContact CE2-CE1 3.68Å; W989-H995 AromaticContact CZ2-CE1 3.86Å; W989-H995 AromaticContact NE1-CE1 3.43Å; W989-H995 PolarHBondContact NE1-CE1 3.18Å; W989-H995 AromaticContact NE1-ND1 3.88Å; W989-H995 AromaticContact NE1-NE2 3.9Å
990	E	94	Very high	95.2	Very high	83 Å²	83	35 Å²	35	39%	0.388	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.7	169.5	-74.5	163.1	-141.4	0	0	113.1	C986 K987 F988	C986-E990 WeakPolarHBondContact O-CB 3.38Å; C986-E990 VanDerWaalsContact O-CG 3.29Å; C986-E990 WeakPolarHBondContact O-CG 3.2Å; C986-E990 PolarHBondContact O-N 3.45Å; K987-E990 WeakPolarHBondContact CD-OE1 3.27Å; K987-E990 WeakPolarHBondContact CD-OE2 3.49Å; K987-E990 IonicContact NZ-OE1 3.19Å; K987-E990 IonicContact NZ-OE2 2.68Å; K987-E990 PolarHBondContact NZ-OE2 3.09Å; F988-E990 VanDerWaalsContact C-N 3.33Å; F988-E990 PolarHBondContact O-N 3.13Å
991	L	95.2	Very high	95.1	Very high	9 Å²	9	36.5 Å²	36.5	5%	0.047	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-39.7	-177.5	-56	177.8	0	0	0	112.8	K987 F988 W989 T993 I999 R1006 Y1007 F1042	K987-L991 WeakPolarHBondContact O-CD1 3.14Å; K987-L991 WeakPolarHBondContact O-CG 3.39Å; F988-L991 PolarHBondContact O-N 2.71Å; W989-L991 PolarHBondContact O-N 3.1Å; L991-T993 PolarHBondContact O-N 3.31Å; L991-I999 HydrophobicContact CB-CD1 3.8Å; L991-I999 HydrophobicContact CB-CG1 4.21Å; L991-I999 HydrophobicContact CD1-CD1 3.97Å; L991-R1006 HydrophobicContact CD2-CB 4.16Å; L991-R1006 PolarHBondContact O-NH2 3.32Å; L991-Y1007 HydrophobicContact CD1-CD2 4.19Å; L991-F1042 HydrophobicContact CD1-CE2 3.75Å; L991-F1042 HydrophobicContact CD1-CZ 4.18Å
992	D	95.6	Very high	94.9	Very high	2 Å²	2	43 Å²	43	1%	0.011	21%	0.21	C	C	.	.			trans	-73.1	64.4	177	-179.1	14.8	0	0	0	111.7	F988 D994 H995 D996 L997	F988-D992 HydrophobicContact CD1-CB 4.2Å; F988-D992 HydrophobicContact CE1-CB 3.72Å; F988-D992 VanDerWaalsContact CE1-OD2 3.24Å; F988-D992 WeakPolarHBondContact CE1-OD2 3.28Å; F988-D992 HydrophobicContact CZ-CB 4.01Å; F988-D992 PolarHBondContact O-N 3.46Å; D992-D994 VanDerWaalsContact C-N 3.3Å; D992-D994 PolarHBondContact O-N 3.29Å; D992-H995 PolarHBondContact O-N 3.33Å; D992-H995 VanDerWaalsContact O-N 3.11Å; D992-H995 PolarHBondContact O-ND1 3.4Å; D992-H995 VanDerWaalsContact OD1-CA 3.22Å; D992-H995 WeakPolarHBondContact OD1-CA 3.17Å; D992-H995 PolarHBondContact OD1-N 2.89Å; D992-H995 VanDerWaalsContact OD1-N 3.08Å; D992-D996 PolarHBondContact OD1-N 3.36Å; D992-L997 PolarHBondContact OD1-N 3.32Å; D992-L997 WeakPolarHBondContact OD2-CA 3.44Å; D992-L997 PolarHBondContact OD2-N 3.09Å
993	T	93.8	Very high	94.9	Very high	90 Å²	90	44 Å²	44	55%	0.552	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-15.3	-171.6	56	0	0	0	0	115.2	L991	L991-T993 PolarHBondContact O-N 3.31Å
994	D	94.3	Very high	94.8	Very high	99 Å²	99	44.1 Å²	44.1	53%	0.529	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	2.5	170.6	60.2	-38.4	0	0	0	113.5	D992 D996	D992-D994 VanDerWaalsContact C-N 3.3Å; D992-D994 PolarHBondContact O-N 3.29Å; D994-D996 PolarHBondContact O-N 3.15Å
995	H	92.2	Very high	94.6	Very high	91 Å²	91	45 Å²	45	42%	0.421	22%	0.222	S	C	.	.			trans	54.7	36.5	176.1	-53.9	-23.8	0	0	0	112.8	W989 D992	W989-H995 AromaticContact CE2-CE1 3.68Å; W989-H995 AromaticContact CZ2-CE1 3.86Å; W989-H995 AromaticContact NE1-CE1 3.43Å; W989-H995 PolarHBondContact NE1-CE1 3.18Å; W989-H995 AromaticContact NE1-ND1 3.88Å; W989-H995 AromaticContact NE1-NE2 3.9Å; D992-H995 PolarHBondContact O-N 3.33Å; D992-H995 VanDerWaalsContact O-N 3.11Å; D992-H995 PolarHBondContact O-ND1 3.4Å; D992-H995 VanDerWaalsContact OD1-CA 3.22Å; D992-H995 WeakPolarHBondContact OD1-CA 3.17Å; D992-H995 PolarHBondContact OD1-N 2.89Å; D992-H995 VanDerWaalsContact OD1-N 3.08Å
996	D	93	Very high	94.4	Very high	52 Å²	52	48.4 Å²	48.4	28%	0.278	24%	0.235	S	C	.	.	S	Bend	trans	-87.2	-12.7	-176.9	151.9	-76.2	0	0	0	111.7	D992 D994 Y998 R1036	D992-D996 PolarHBondContact OD1-N 3.36Å; D994-D996 PolarHBondContact O-N 3.15Å; D996-Y998 VanDerWaalsContact C-N 3.31Å; D996-Y998 WeakPolarHBondContact O-CD2 3.4Å; D996-Y998 WeakPolarHBondContact OD1-CB 3.36Å; D996-Y998 VanDerWaalsContact OD1-CD2 3.26Å; D996-Y998 WeakPolarHBondContact OD1-CD2 3.39Å; D996-Y998 PolarHBondContact OD1-N 2.98Å; D996-R1036 VanDerWaalsContact CG-NH2 3.31Å; D996-R1036 IonicContact OD1-CZ 2.73Å; D996-R1036 IonicContact OD1-NH1 3.57Å; D996-R1036 PolarHBondContact OD1-NH1 3.36Å; D996-R1036 IonicContact OD1-NH2 2.73Å; D996-R1036 PolarHBondContact OD1-NH2 3.15Å; D996-R1036 VanDerWaalsContact OD1-NH2 3.09Å; D996-R1036 IonicContact OD2-CZ 2.81Å; D996-R1036 VanDerWaalsContact OD2-CZ 3.28Å; D996-R1036 IonicContact OD2-NH1 3.61Å; D996-R1036 PolarHBondContact OD2-NH1 2.88Å; D996-R1036 IonicContact OD2-NH2 2.75Å; D996-R1036 PolarHBondContact OD2-NH2 2.85Å
997	L	92.3	Very high	94.3	Very high	71 Å²	71	48.7 Å²	48.7	37%	0.372	24%	0.235	S	C	.	.	S	Bend	trans	74.8	17.7	175.8	-49	166.1	0	0	0	114.2	R925 D992	R925-L997 VanDerWaalsContact NH2-CD2 3.33Å; D992-L997 PolarHBondContact OD1-N 3.32Å; D992-L997 WeakPolarHBondContact OD2-CA 3.44Å; D992-L997 PolarHBondContact OD2-N 3.09Å
998	Y	95	Very high	93.9	Very high	92 Å²	92	49.9 Å²	49.9	36%	0.361	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	168.5	166.2	-56.8	-102.6	0	0	0	110.7	D996 M1037	D996-Y998 VanDerWaalsContact C-N 3.31Å; D996-Y998 WeakPolarHBondContact O-CD2 3.4Å; D996-Y998 WeakPolarHBondContact OD1-CB 3.36Å; D996-Y998 VanDerWaalsContact OD1-CD2 3.26Å; D996-Y998 WeakPolarHBondContact OD1-CD2 3.39Å; D996-Y998 PolarHBondContact OD1-N 2.98Å; Y998-M1037 CarbonylContact C-O 3.26Å; Y998-M1037 WeakPolarHBondContact CA-O 3.4Å; Y998-M1037 WeakPolarHBondContact CB-O 3.4Å
999	I	95.8	Very high	93.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.4	176.3	-77.9	175.4	0	0	0	107.8	F988 L991 D1003 L1004 F1021 R1036 M1037 F1042	F988-I999 HydrophobicContact CD2-CD1 3.36Å; F988-I999 HydrophobicContact CD2-CG1 4.1Å; F988-I999 HydrophobicContact CE2-CD1 3.46Å; F988-I999 VanDerWaalsContact CE2-CD1 3.46Å; F988-I999 HydrophobicContact CE2-CG1 3.68Å; F988-I999 HydrophobicContact CG-CD1 4.31Å; F988-I999 HydrophobicContact CZ-CD1 4.46Å; F988-I999 HydrophobicContact CZ-CG1 4.33Å; L991-I999 HydrophobicContact CB-CD1 3.8Å; L991-I999 HydrophobicContact CB-CG1 4.21Å; L991-I999 HydrophobicContact CD1-CD1 3.97Å; I999-D1003 HydrophobicContact CB-CB 4.44Å; I999-D1003 HydrophobicContact CG2-CB 3.86Å; I999-L1004 HydrophobicContact CG2-CB 3.75Å; I999-L1004 HydrophobicContact CG2-CD1 4.2Å; I999-F1021 WeakPolarHBondContact O-CE1 3.37Å; I999-R1036 CarbonylContact O-C 3.53Å; I999-R1036 WeakPolarHBondContact O-CA 3.32Å; I999-R1036 WeakPolarHBondContact O-CB 3.46Å; I999-M1037 HydrophobicContact CB-CG 4.08Å; I999-M1037 HydrophobicContact CG2-CG 4.33Å; I999-M1037 HydrophobicContact CG2-SD 4.37Å; I999-M1037 PolarHBondContact N-O 3.12Å; I999-M1037 PolarHBondContact O-N 3.25Å; I999-F1042 HydrophobicContact CD1-CD2 3.59Å; I999-F1042 HydrophobicContact CD1-CE2 3.95Å; I999-F1042 HydrophobicContact CD1-CG 4.08Å
1000	D	95.1	Very high	93	Very high	28 Å²	28	59.9 Å²	59.9	15%	0.15	30%	0.296	C	S	.	.			trans	-90.3	169.3	171.4	112.7	-15.4	0	0	0	112.1	K1002 D1003 L1004 R1036	D1000-K1002 PolarHBondContact O-N 2.66Å; D1000-K1002 VanDerWaalsContact OD1-CA 3.27Å; D1000-K1002 WeakPolarHBondContact OD1-CA 3.46Å; D1000-K1002 WeakPolarHBondContact OD1-CB 3.16Å; D1000-K1002 WeakPolarHBondContact OD1-CG 3.46Å; D1000-K1002 PolarHBondContact OD1-N 3.39Å; D1000-K1002 IonicContact OD1-NZ 3.06Å; D1000-K1002 IonicContact OD2-NZ 3.09Å; D1000-K1002 PolarHBondContact OD2-NZ 3.06Å; D1000-D1003 WeakPolarHBondContact CB-OD2 3.42Å; D1000-D1003 PolarHBondContact N-OD2 3.38Å; D1000-D1003 WeakPolarHBondContact O-CB 3.36Å; D1000-D1003 PolarHBondContact O-N 2.87Å; D1000-D1003 PolarHBondContact OD1-N 3.35Å; D1000-D1003 VanDerWaalsContact OD1-N 3.11Å; D1000-L1004 PolarHBondContact O-N 3.36Å; D1000-R1036 HydrophobicContact CB-CG 3.73Å
1001	P	95.4	Very high	92.5	Very high	37 Å²	37	56.2 Å²	56.2	24%	0.24	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-27.7	-178.7	-24.8	33.9	0	0	0	115.1	S1005 I1017 F1021 G1035	P1001-S1005 WeakPolarHBondContact O-CB 3.36Å; P1001-S1005 PolarHBondContact O-N 2.66Å; P1001-I1017 HydrophobicContact CB-CG2 4.05Å; P1001-F1021 HydrophobicContact CB-CD2 4.1Å; P1001-F1021 HydrophobicContact CB-CE2 3.96Å; P1001-F1021 HydrophobicContact CG-CD1 4.23Å; P1001-F1021 HydrophobicContact CG-CD2 3.73Å; P1001-F1021 HydrophobicContact CG-CE1 4.31Å; P1001-F1021 HydrophobicContact CG-CE2 3.85Å; P1001-F1021 HydrophobicContact CG-CG 3.96Å; P1001-F1021 HydrophobicContact CG-CZ 4.15Å; P1001-G1035 WeakPolarHBondContact CD-O 3.43Å
1002	K	94.1	Very high	92.3	Very high	138 Å²	138	56.4 Å²	56.4	60%	0.6	28%	0.282	S	S	*	.	H	α-helix	trans	-81.7	-24.5	174.3	-40.5	-177.3	-144.9	80.4	0	112.2	D1000 S1005 R1006	D1000-K1002 PolarHBondContact O-N 2.66Å; D1000-K1002 VanDerWaalsContact OD1-CA 3.27Å; D1000-K1002 WeakPolarHBondContact OD1-CA 3.46Å; D1000-K1002 WeakPolarHBondContact OD1-CB 3.16Å; D1000-K1002 WeakPolarHBondContact OD1-CG 3.46Å; D1000-K1002 PolarHBondContact OD1-N 3.39Å; D1000-K1002 IonicContact OD1-NZ 3.06Å; D1000-K1002 IonicContact OD2-NZ 3.09Å; D1000-K1002 PolarHBondContact OD2-NZ 3.06Å; K1002-S1005 PolarHBondContact O-OG 3.07Å; K1002-R1006 WeakPolarHBondContact O-CG 3.03Å; K1002-R1006 PolarHBondContact O-NH1 2.96Å
1003	D	95.6	Very high	92.2	Very high	20 Å²	20	56.3 Å²	56.3	11%	0.107	28%	0.282	C	S	.	.	H	α-helix	trans	-72.8	-50.9	171.1	-54	-44.2	0	0	0	109.2	I999 D1000 S1005 R1006	I999-D1003 HydrophobicContact CB-CB 4.44Å; I999-D1003 HydrophobicContact CG2-CB 3.86Å; D1000-D1003 WeakPolarHBondContact CB-OD2 3.42Å; D1000-D1003 PolarHBondContact N-OD2 3.38Å; D1000-D1003 WeakPolarHBondContact O-CB 3.36Å; D1000-D1003 PolarHBondContact O-N 2.87Å; D1000-D1003 PolarHBondContact OD1-N 3.35Å; D1000-D1003 VanDerWaalsContact OD1-N 3.11Å; D1003-S1005 VanDerWaalsContact C-N 3.25Å; D1003-S1005 PolarHBondContact O-N 3.26Å; D1003-R1006 WeakPolarHBondContact O-CB 3.4Å; D1003-R1006 PolarHBondContact O-N 3.43Å; D1003-R1006 VanDerWaalsContact O-N 3.1Å; D1003-R1006 IonicContact OD1-CZ 3.01Å; D1003-R1006 IonicContact OD1-NH1 2.68Å; D1003-R1006 PolarHBondContact OD1-NH1 3.41Å; D1003-R1006 IonicContact OD1-NH2 2.99Å; D1003-R1006 PolarHBondContact OD1-NH2 3.47Å
1004	L	95.3	Very high	92.2	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-31.6	175.7	-162.8	65.5	0	0	0	112.7	I999 D1000 R1006 Y1007 I1017 L1020 F1021 M1037 F1042 F1045	I999-L1004 HydrophobicContact CG2-CB 3.75Å; I999-L1004 HydrophobicContact CG2-CD1 4.2Å; D1000-L1004 PolarHBondContact O-N 3.36Å; L1004-R1006 PolarHBondContact O-N 3.43Å; L1004-Y1007 VanDerWaalsContact O-CB 3.25Å; L1004-Y1007 WeakPolarHBondContact O-CB 3.45Å; L1004-Y1007 PolarHBondContact O-N 3.28Å; L1004-Y1007 VanDerWaalsContact O-N 3.15Å; L1004-I1017 HydrophobicContact CD2-CG2 4.47Å; L1004-L1020 HydrophobicContact CD2-CD1 3.45Å; L1004-L1020 VanDerWaalsContact CD2-CD1 3.45Å; L1004-F1021 HydrophobicContact CB-CE2 4.34Å; L1004-F1021 HydrophobicContact CB-CZ 4.34Å; L1004-F1021 HydrophobicContact CD2-CE2 3.83Å; L1004-F1021 HydrophobicContact CD2-CZ 4.17Å; L1004-M1037 HydrophobicContact CD1-SD 4.43Å; L1004-M1037 HydrophobicContact CD2-SD 3.91Å; L1004-F1042 HydrophobicContact CD1-CD2 4.2Å; L1004-F1042 HydrophobicContact CD1-CE2 4.16Å; L1004-F1045 HydrophobicContact CD1-CD1 3.86Å; L1004-F1045 HydrophobicContact CD1-CE1 3.63Å; L1004-F1045 HydrophobicContact CD1-CE2 4.31Å; L1004-F1045 HydrophobicContact CD1-CG 4.31Å; L1004-F1045 HydrophobicContact CD1-CZ 3.87Å; L1004-F1045 HydrophobicContact CD2-CD2 4.4Å; L1004-F1045 HydrophobicContact CD2-CE2 4.31Å; L1004-F1045 HydrophobicContact CG-CZ 4.36Å
1005	S	93.6	Very high	92.4	Very high	18 Å²	18	53.5 Å²	53.5	13%	0.126	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.6	177.2	80.2	0	0	0	0	113.6	P1001 K1002 D1003 Y1007 H1010	P1001-S1005 WeakPolarHBondContact O-CB 3.36Å; P1001-S1005 PolarHBondContact O-N 2.66Å; K1002-S1005 PolarHBondContact O-OG 3.07Å; D1003-S1005 VanDerWaalsContact C-N 3.25Å; D1003-S1005 PolarHBondContact O-N 3.26Å; S1005-Y1007 PolarHBondContact O-N 3.5Å; S1005-H1010 VanDerWaalsContact O-CA 3.31Å; S1005-H1010 WeakPolarHBondContact O-CA 3.47Å; S1005-H1010 PolarHBondContact O-ND1 3.14Å
1006	R	92.9	Very high	92.6	Very high	94 Å²	94	49.2 Å²	49.2	36%	0.355	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-15.5	174.4	-63.7	-172.1	-62.3	-89.9	12	113.2	L991 K1002 D1003 L1004 N1008	L991-R1006 HydrophobicContact CD2-CB 4.16Å; L991-R1006 PolarHBondContact O-NH2 3.32Å; K1002-R1006 WeakPolarHBondContact O-CG 3.03Å; K1002-R1006 PolarHBondContact O-NH1 2.96Å; D1003-R1006 WeakPolarHBondContact O-CB 3.4Å; D1003-R1006 PolarHBondContact O-N 3.43Å; D1003-R1006 VanDerWaalsContact O-N 3.1Å; D1003-R1006 IonicContact OD1-CZ 3.01Å; D1003-R1006 IonicContact OD1-NH1 2.68Å; D1003-R1006 PolarHBondContact OD1-NH1 3.41Å; D1003-R1006 IonicContact OD1-NH2 2.99Å; D1003-R1006 PolarHBondContact OD1-NH2 3.47Å; L1004-R1006 PolarHBondContact O-N 3.43Å; R1006-N1008 PolarHBondContact O-N 2.81Å
1007	Y	91.9	Very high	92.8	Very high	14 Å²	14	47 Å²	47	6%	0.055	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-63.1	132.5	-179.6	-175.2	-107.8	0	0	0	111.5	K987 L991 L1004 S1005 D1009 H1010 F1045 L1046 E1049 E1050 Y1170	K987-Y1007 HydrophobicContact CB-CE2 4.45Å; L991-Y1007 HydrophobicContact CD1-CD2 4.19Å; L1004-Y1007 VanDerWaalsContact O-CB 3.25Å; L1004-Y1007 WeakPolarHBondContact O-CB 3.45Å; L1004-Y1007 PolarHBondContact O-N 3.28Å; L1004-Y1007 VanDerWaalsContact O-N 3.15Å; S1005-Y1007 PolarHBondContact O-N 3.5Å; Y1007-D1009 PolarHBondContact O-N 3.15Å; Y1007-H1010 PolarHBondContact O-N 3.25Å; Y1007-F1045 AromaticContact CD1-CE1 3.75Å; Y1007-F1045 HydrophobicContact CD1-CE1 3.75Å; Y1007-F1045 AromaticContact CD1-CZ 3.71Å; Y1007-F1045 HydrophobicContact CD1-CZ 3.71Å; Y1007-F1045 AromaticContact CE1-CE1 3.95Å; Y1007-F1045 HydrophobicContact CE1-CE1 3.95Å; Y1007-F1045 HydrophobicContact CE1-CZ 4.08Å; Y1007-F1045 HydrophobicContact CG-CE1 4.22Å; Y1007-F1045 HydrophobicContact CG-CZ 4.45Å; Y1007-L1046 HydrophobicContact CE2-CD1 4.22Å; Y1007-L1046 WeakPolarHBondContact OH-CD1 3.43Å; Y1007-E1049 HydrophobicContact CE1-CG 4.15Å; Y1007-E1050 PolarHBondContact OH-OE1 2.71Å; Y1007-Y1170 PolarHBondContact OH-OH 2.82Å; Y1007-Y1170 VanDerWaalsContact OH-OH 3.08Å
1008	N	86.6	Confident	92.9	Very high	48 Å²	48	48.2 Å²	48.2	26%	0.257	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	43.1	59.9	-174.8	-59.7	-2.1	0	0	0	112.7	R1006 H1010 A1011 E1050	R1006-N1008 PolarHBondContact O-N 2.81Å; N1008-H1010 PolarHBondContact O-N 3.06Å; N1008-A1011 HydrophobicContact CB-CB 3.98Å; N1008-A1011 WeakPolarHBondContact O-CB 3.5Å; N1008-A1011 PolarHBondContact O-N 2.9Å; N1008-E1050 PolarHBondContact ND2-OE1 3.09Å
1009	D	84.6	Confident	93	Very high	157 Å²	157	45.7 Å²	45.7	84%	0.84	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	47.9	39	175.4	-76.8	-25	0	0	0	115.2	Y1007	Y1007-D1009 PolarHBondContact O-N 3.15Å
1010	H	85.9	Confident	93	Very high	110 Å²	110	45.8 Å²	45.8	51%	0.509	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	63.8	36.7	-174.3	-48.8	-79.2	0	0	0	114.2	S1005 Y1007 N1008 S1012 R1088	S1005-H1010 VanDerWaalsContact O-CA 3.31Å; S1005-H1010 WeakPolarHBondContact O-CA 3.47Å; S1005-H1010 PolarHBondContact O-ND1 3.14Å; Y1007-H1010 PolarHBondContact O-N 3.25Å; N1008-H1010 PolarHBondContact O-N 3.06Å; H1010-S1012 PolarHBondContact O-N 3.45Å; H1010-R1088 PolarHBondContact O-NH2 2.86Å
1011	A	84.8	Confident	93	Very high	6 Å²	6	45.3 Å²	45.3	5%	0.05	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-33.1	179.3	0	0	0	0	0	114.2	N1008 R1088 L1139 E1140	N1008-A1011 HydrophobicContact CB-CB 3.98Å; N1008-A1011 WeakPolarHBondContact O-CB 3.5Å; N1008-A1011 PolarHBondContact O-N 2.9Å; A1011-R1088 PolarHBondContact O-NH1 3.13Å; A1011-R1088 VanDerWaalsContact O-NH1 3.12Å; A1011-R1088 PolarHBondContact O-NH2 3.4Å; A1011-L1139 PolarHBondContact O-N 3.46Å; A1011-E1140 HydrophobicContact CB-CB 4.06Å
1012	S	90.3	Very high	92.9	Very high	13 Å²	13	45.6 Å²	45.6	9%	0.091	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-79.7	146.8	173.4	-73	0	0	0	0	112.6	H1010 F1137	H1010-S1012 PolarHBondContact O-N 3.45Å; S1012-F1137 CarbonylContact C-O 3.23Å
1013	S	93.7	Very high	92.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.			trans	-73.6	151.4	175.4	72.5	0	0	0	0	112.4	R1015 I1016 I1017 E1084 F1137	S1013-R1015 VanDerWaalsContact C-N 3.29Å; S1013-R1015 PolarHBondContact O-N 3.19Å; S1013-I1016 WeakPolarHBondContact O-CG2 3.12Å; S1013-I1016 PolarHBondContact O-N 2.71Å; S1013-I1016 PolarHBondContact OG-N 3.45Å; S1013-I1017 WeakPolarHBondContact O-CG1 3.48Å; S1013-I1017 PolarHBondContact O-N 3.06Å; S1013-I1017 VanDerWaalsContact O-N 3.08Å; S1013-E1084 WeakPolarHBondContact CB-OE2 3.29Å; S1013-F1137 PolarHBondContact N-O 3.31Å; S1013-F1137 WeakPolarHBondContact OG-CB 3.11Å
1014	N	95	Very high	92.5	Very high	90 Å²	90	39.7 Å²	39.7	48%	0.481	21%	0.207	S	C	.	.	H	α-helix	trans	-65.4	-37.3	178.1	-62.3	-89.5	0	0	0	110.5	I1016 I1017 D1018 E1084	N1014-I1016 VanDerWaalsContact C-N 3.32Å; N1014-I1016 PolarHBondContact O-N 2.91Å; N1014-I1017 PolarHBondContact O-N 3.43Å; N1014-D1018 PolarHBondContact O-N 3.4Å; N1014-E1084 WeakPolarHBondContact CB-OE1 3.24Å; N1014-E1084 PolarHBondContact N-OE1 3.23Å; N1014-E1084 PolarHBondContact N-OE2 3.21Å; N1014-E1084 VanDerWaalsContact N-OE2 3.12Å; N1014-E1084 PolarHBondContact ND2-OE1 2.84Å
1015	R	97.1	Very high	92.4	Very high	41 Å²	41	40.3 Å²	40.3	16%	0.155	21%	0.211	C	C	.	.	H	α-helix	trans	-59.7	-36.3	174.7	-68.5	174.7	-162.1	-149.1	5.5	112.9	S1013 R1019 Y1080 F1081 E1083 E1084	S1013-R1015 VanDerWaalsContact C-N 3.29Å; S1013-R1015 PolarHBondContact O-N 3.19Å; R1015-R1019 VanDerWaalsContact O-CG 3.3Å; R1015-R1019 WeakPolarHBondContact O-CG 3.5Å; R1015-Y1080 HydrophobicContact CB-CE1 4Å; R1015-Y1080 WeakPolarHBondContact CD-O 3.43Å; R1015-Y1080 HydrophobicContact CG-CE1 4.17Å; R1015-Y1080 HydrophobicContact CG-CE2 4.23Å; R1015-Y1080 VanDerWaalsContact NH1-CD2 3.34Å; R1015-Y1080 PolarHBondContact NH1-O 3.47Å; R1015-F1081 HydrophobicContact CB-CD1 4.03Å; R1015-F1081 HydrophobicContact CB-CE1 4.16Å; R1015-E1083 IonicContact CZ-OE2 2.65Å; R1015-E1083 IonicContact NH1-OE2 3.69Å; R1015-E1083 PolarHBondContact NH1-OE2 3.34Å; R1015-E1083 IonicContact NH2-OE2 2.73Å; R1015-E1083 PolarHBondContact NH2-OE2 3.07Å; R1015-E1084 WeakPolarHBondContact CB-OE2 3.29Å; R1015-E1084 VanDerWaalsContact CG-OE2 3.25Å; R1015-E1084 WeakPolarHBondContact CG-OE2 3.39Å; R1015-E1084 PolarHBondContact N-OE2 2.56Å; R1015-E1084 IonicContact NE-OE2 2.74Å
1016	I	97.4	Very high	92.2	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-77.9	-35.2	175.1	-152.9	71.1	0	0	0	111.9	S1013 N1014 R1019 L1020 W1061 C1064 M1065 F1081 F1137	S1013-I1016 WeakPolarHBondContact O-CG2 3.12Å; S1013-I1016 PolarHBondContact O-N 2.71Å; S1013-I1016 PolarHBondContact OG-N 3.45Å; N1014-I1016 VanDerWaalsContact C-N 3.32Å; N1014-I1016 PolarHBondContact O-N 2.91Å; I1016-R1019 WeakPolarHBondContact O-CB 3.44Å; I1016-R1019 PolarHBondContact O-N 2.73Å; I1016-R1019 VanDerWaalsContact O-N 3.14Å; I1016-L1020 PolarHBondContact O-N 3.08Å; I1016-W1061 HydrophobicContact CD1-CE3 4.48Å; I1016-W1061 HydrophobicContact CG1-CE3 4.03Å; I1016-W1061 HydrophobicContact CG1-CZ3 3.81Å; I1016-C1064 HydrophobicContact CD1-CB 3.67Å; I1016-C1064 HydrophobicContact CG1-CB 4.32Å; I1016-M1065 HydrophobicContact CD1-CG 4.19Å; I1016-F1081 HydrophobicContact CD1-CD1 4.18Å; I1016-F1081 HydrophobicContact CD1-CE1 3.7Å; I1016-F1081 HydrophobicContact CD1-CZ 4.18Å; I1016-F1137 HydrophobicContact CB-CB 3.76Å; I1016-F1137 HydrophobicContact CB-CD1 4.44Å; I1016-F1137 HydrophobicContact CB-CD2 4.23Å; I1016-F1137 HydrophobicContact CB-CG 3.92Å; I1016-F1137 HydrophobicContact CD1-CD1 3.76Å; I1016-F1137 HydrophobicContact CD1-CE1 4.03Å; I1016-F1137 HydrophobicContact CD1-CG 4.13Å; I1016-F1137 HydrophobicContact CG1-CB 4.17Å; I1016-F1137 HydrophobicContact CG1-CD1 3.91Å; I1016-F1137 HydrophobicContact CG1-CD2 3.97Å; I1016-F1137 HydrophobicContact CG1-CE1 4.22Å; I1016-F1137 HydrophobicContact CG1-CE2 4.28Å; I1016-F1137 HydrophobicContact CG1-CG 3.77Å; I1016-F1137 HydrophobicContact CG1-CZ 4.4Å; I1016-F1137 HydrophobicContact CG2-CB 3.78Å; I1016-F1137 HydrophobicContact CG2-CD2 3.82Å; I1016-F1137 HydrophobicContact CG2-CG 3.95Å
1017	I	96.1	Very high	91.4	Very high	6 Å²	6	40.6 Å²	40.6	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-60	-50	175.4	-69.8	166	0	0	0	110.4	P1001 L1004 S1013 N1014 R1019 L1020 F1021	P1001-I1017 HydrophobicContact CB-CG2 4.05Å; L1004-I1017 HydrophobicContact CD2-CG2 4.47Å; S1013-I1017 WeakPolarHBondContact O-CG1 3.48Å; S1013-I1017 PolarHBondContact O-N 3.06Å; S1013-I1017 VanDerWaalsContact O-N 3.08Å; N1014-I1017 PolarHBondContact O-N 3.43Å; I1017-R1019 PolarHBondContact O-N 2.78Å; I1017-R1019 VanDerWaalsContact O-N 3.14Å; I1017-L1020 WeakPolarHBondContact O-CB 3.49Å; I1017-L1020 PolarHBondContact O-N 2.9Å; I1017-F1021 HydrophobicContact CG2-CD2 4.28Å; I1017-F1021 HydrophobicContact CG2-CE2 3.99Å; I1017-F1021 VanDerWaalsContact O-CD2 3.32Å; I1017-F1021 WeakPolarHBondContact O-CD2 3.41Å; I1017-F1021 PolarHBondContact O-N 2.8Å
1018	D	95.5	Very high	90.6	Very high	96 Å²	96	42 Å²	42	51%	0.513	23%	0.231	S	C	.	.	H	α-helix	trans	-54.9	-34.5	175.7	-79.3	-21.1	0	0	0	112.4	N1014 L1020 F1021 S1022	N1014-D1018 PolarHBondContact O-N 3.4Å; D1018-L1020 PolarHBondContact O-N 3.05Å; D1018-F1021 PolarHBondContact O-N 2.99Å; D1018-S1022 WeakPolarHBondContact O-CB 3.18Å; D1018-S1022 PolarHBondContact O-N 3.3Å
1019	R	96.6	Very high	89.8	Confident	38 Å²	38	44.5 Å²	44.5	14%	0.143	24%	0.244	C	C	.	.	H	α-helix	trans	-70.1	-26.9	177.1	-71.4	-68.9	-57.7	168.1	1.5	113.5	R1015 I1016 I1017 S1022 R1063 C1064 D1066 V1067 F1081	R1015-R1019 VanDerWaalsContact O-CG 3.3Å; R1015-R1019 WeakPolarHBondContact O-CG 3.5Å; I1016-R1019 WeakPolarHBondContact O-CB 3.44Å; I1016-R1019 PolarHBondContact O-N 2.73Å; I1016-R1019 VanDerWaalsContact O-N 3.14Å; I1017-R1019 PolarHBondContact O-N 2.78Å; I1017-R1019 VanDerWaalsContact O-N 3.14Å; R1019-S1022 WeakPolarHBondContact O-CB 3.5Å; R1019-S1022 PolarHBondContact O-N 2.91Å; R1019-S1022 PolarHBondContact O-OG 3.14Å; R1019-R1063 PolarHBondContact NH2-O 2.92Å; R1019-C1064 HydrophobicContact CB-CB 4.17Å; R1019-C1064 WeakPolarHBondContact CG-O 3.42Å; R1019-C1064 PolarHBondContact NE-O 2.89Å; R1019-D1066 PolarHBondContact NH2-O 3.3Å; R1019-V1067 PolarHBondContact NH1-O 3.19Å; R1019-F1081 HydrophobicContact CG-CE1 4.19Å; R1019-F1081 HydrophobicContact CG-CZ 4.05Å
1020	L	95.4	Very high	89.5	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-47	172.1	-58.3	173	0	0	0	110.8	L1004 I1016 I1017 D1018 S1022 V1025 F1045 Y1060 W1061	L1004-L1020 HydrophobicContact CD2-CD1 3.45Å; L1004-L1020 VanDerWaalsContact CD2-CD1 3.45Å; I1016-L1020 PolarHBondContact O-N 3.08Å; I1017-L1020 WeakPolarHBondContact O-CB 3.49Å; I1017-L1020 PolarHBondContact O-N 2.9Å; D1018-L1020 PolarHBondContact O-N 3.05Å; L1020-S1022 VanDerWaalsContact C-N 3.3Å; L1020-S1022 PolarHBondContact O-N 3.19Å; L1020-V1025 HydrophobicContact CD2-CG2 4.1Å; L1020-F1045 HydrophobicContact CD1-CD2 3.65Å; L1020-F1045 HydrophobicContact CD1-CE2 3.85Å; L1020-Y1060 HydrophobicContact CD2-CE1 3.49Å; L1020-Y1060 VanDerWaalsContact CD2-CE1 3.49Å; L1020-Y1060 WeakPolarHBondContact CD2-OH 3.37Å; L1020-W1061 HydrophobicContact CD2-CH2 4.24Å; L1020-W1061 HydrophobicContact CD2-CZ3 3.91Å
1021	F	95	Very high	89.2	Confident	17 Å²	17	33.6 Å²	33.6	8%	0.075	19%	0.194	C	C	.	.	H	α-helix	trans	-75.2	-18	178.5	-62.7	-88.1	0	0	0	113.4	I999 P1001 L1004 I1017 D1018 G1023 V1031 M1037	I999-F1021 WeakPolarHBondContact O-CE1 3.37Å; P1001-F1021 HydrophobicContact CB-CD2 4.1Å; P1001-F1021 HydrophobicContact CB-CE2 3.96Å; P1001-F1021 HydrophobicContact CG-CD1 4.23Å; P1001-F1021 HydrophobicContact CG-CD2 3.73Å; P1001-F1021 HydrophobicContact CG-CE1 4.31Å; P1001-F1021 HydrophobicContact CG-CE2 3.85Å; P1001-F1021 HydrophobicContact CG-CG 3.96Å; P1001-F1021 HydrophobicContact CG-CZ 4.15Å; L1004-F1021 HydrophobicContact CB-CE2 4.34Å; L1004-F1021 HydrophobicContact CB-CZ 4.34Å; L1004-F1021 HydrophobicContact CD2-CE2 3.83Å; L1004-F1021 HydrophobicContact CD2-CZ 4.17Å; I1017-F1021 HydrophobicContact CG2-CD2 4.28Å; I1017-F1021 HydrophobicContact CG2-CE2 3.99Å; I1017-F1021 VanDerWaalsContact O-CD2 3.32Å; I1017-F1021 WeakPolarHBondContact O-CD2 3.41Å; I1017-F1021 PolarHBondContact O-N 2.8Å; D1018-F1021 PolarHBondContact O-N 2.99Å; F1021-G1023 PolarHBondContact O-N 2.9Å; F1021-G1023 VanDerWaalsContact O-N 3.09Å; F1021-V1031 HydrophobicContact CB-CG1 4.22Å; F1021-V1031 HydrophobicContact CD1-CG1 3.63Å; F1021-V1031 HydrophobicContact CE1-CG1 4.44Å; F1021-V1031 HydrophobicContact CG-CG1 4.31Å; F1021-M1037 HydrophobicContact CD1-CB 4.47Å; F1021-M1037 HydrophobicContact CE1-CB 3.84Å; F1021-M1037 HydrophobicContact CE1-CG 3.94Å; F1021-M1037 HydrophobicContact CE1-SD 4.03Å; F1021-M1037 HydrophobicContact CE2-SD 4.41Å; F1021-M1037 HydrophobicContact CZ-CB 4.47Å; F1021-M1037 HydrophobicContact CZ-CG 4.11Å; F1021-M1037 HydrophobicContact CZ-SD 3.67Å
1022	S	93.2	Very high	89	Confident	43 Å²	43	38 Å²	38	30%	0.301	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-12.8	175.6	81.7	0	0	0	0	115	D1018 R1019 L1020 Q1032	D1018-S1022 WeakPolarHBondContact O-CB 3.18Å; D1018-S1022 PolarHBondContact O-N 3.3Å; R1019-S1022 WeakPolarHBondContact O-CB 3.5Å; R1019-S1022 PolarHBondContact O-N 2.91Å; R1019-S1022 PolarHBondContact O-OG 3.14Å; L1020-S1022 VanDerWaalsContact C-N 3.3Å; L1020-S1022 PolarHBondContact O-N 3.19Å; S1022-Q1032 WeakPolarHBondContact O-CG 3.21Å; S1022-Q1032 PolarHBondContact O-NE2 3.46Å
1023	G	89.7	Confident	88.4	Confident	19 Å²	19	45.5 Å²	45.5	20%	0.196	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	11.7	-178.7	0	0	0	0	0	115.3	F1021 V1025 T1026	F1021-G1023 PolarHBondContact O-N 2.9Å; F1021-G1023 VanDerWaalsContact O-N 3.09Å; G1023-V1025 PolarHBondContact O-N 3.43Å; G1023-T1026 WeakPolarHBondContact CA-OG1 3.3Å
1024	A	92.9	Very high	88	Confident	16 Å²	16	50.2 Å²	50.2	13%	0.132	26%	0.262	C	S	.	.	S	Bend	trans	-59.9	-33.3	175	0	0	0	0	0	113.5	R1063	A1024-R1063 HydrophobicContact CB-CB 4.32Å; A1024-R1063 WeakPolarHBondContact CB-O 3.19Å; A1024-R1063 PolarHBondContact O-NH1 2.72Å
1025	V	93.3	Very high	87.6	Confident	16 Å²	16	47.8 Å²	47.8	10%	0.097	26%	0.258	C	S	.	.	S	Bend	trans	-120.8	-5	-173.7	-69.1	0	0	0	0	114.3	L1020 G1023 Y1060 R1063	L1020-V1025 HydrophobicContact CD2-CG2 4.1Å; G1023-V1025 PolarHBondContact O-N 3.43Å; V1025-Y1060 HydrophobicContact CB-CD2 3.89Å; V1025-Y1060 HydrophobicContact CB-CE2 3.67Å; V1025-Y1060 HydrophobicContact CB-CG 4.43Å; V1025-Y1060 HydrophobicContact CG1-CD1 4.13Å; V1025-Y1060 HydrophobicContact CG1-CD2 3.79Å; V1025-Y1060 HydrophobicContact CG1-CE1 4.34Å; V1025-Y1060 HydrophobicContact CG1-CE2 4Å; V1025-Y1060 HydrophobicContact CG1-CG 3.84Å; V1025-Y1060 WeakPolarHBondContact CG1-O 3.29Å; V1025-Y1060 HydrophobicContact CG2-CD2 4.48Å; V1025-Y1060 HydrophobicContact CG2-CE1 4.31Å; V1025-Y1060 HydrophobicContact CG2-CE2 3.83Å; V1025-R1063 HydrophobicContact CG1-CB 3.94Å
1026	T	87.5	Confident	87.4	Confident	18 Å²	18	49.4 Å²	49.4	11%	0.11	26%	0.264	C	S	.	.	S	Bend	trans	-100.7	155.5	-175.5	72.3	0	0	0	0	112	G1023 G1028 V1031 E1041	G1023-T1026 WeakPolarHBondContact CA-OG1 3.3Å; T1026-G1028 PolarHBondContact O-N 2.98Å; T1026-V1031 HydrophobicContact CG2-CB 4.15Å; T1026-V1031 HydrophobicContact CG2-CG1 4.35Å; T1026-V1031 HydrophobicContact CG2-CG2 3.88Å; T1026-E1041 HydrophobicContact CG2-CG 3.9Å
1027	R	76.8	Confident	87.3	Confident	100 Å²	100	49.4 Å²	49.4	38%	0.377	26%	0.264	S	S	.	.	S	Bend	trans	-86.9	97	-173.3	-75.4	-177.2	168.1	167.8	-2.8	112.5	N939 W942	N939-R1027 PolarHBondContact OD1-NH2 3.42Å; W942-R1027 PolarHBondContact O-NH2 3.17Å
1028	G	74.6	Confident	87.2	Confident	45 Å²	45	50.5 Å²	50.5	46%	0.464	27%	0.272	S	S	.	.	S	Bend	trans	74.6	-171.1	-178.5	0	0	0	0	0	112.6	T1026 A1030	T1026-G1028 PolarHBondContact O-N 2.98Å; G1028-A1030 VanDerWaalsContact C-N 3.31Å; G1028-A1030 PolarHBondContact O-N 3.07Å
1029	N	71.4	Confident	87.2	Confident	100 Å²	100	46.1 Å²	46.1	54%	0.535	25%	0.248	S	C	.	.	S	Bend	trans	-90.7	35.7	-164.6	-43.9	77.4	0	0	0	113.7	Q1032 R1033	N1029-Q1032 PolarHBondContact ND2-OE1 3.35Å; N1029-R1033 VanDerWaalsContact O-CB 3.3Å; N1029-R1033 WeakPolarHBondContact O-CB 3.31Å; N1029-R1033 PolarHBondContact O-NH2 3.3Å
1030	A	76.6	Confident	87.2	Confident	35 Å²	35	45.4 Å²	45.4	29%	0.289	25%	0.251	S	S	.	.	S	Bend	trans	-75.6	-67	176.5	0	0	0	0	0	110.6	G1028 Q1032 R1033 E1034	G1028-A1030 VanDerWaalsContact C-N 3.31Å; G1028-A1030 PolarHBondContact O-N 3.07Å; A1030-Q1032 VanDerWaalsContact C-N 3.29Å; A1030-Q1032 PolarHBondContact O-N 3.37Å; A1030-R1033 WeakPolarHBondContact O-CA 3.09Å; A1030-R1033 WeakPolarHBondContact O-CB 3.47Å; A1030-R1033 PolarHBondContact O-N 3.15Å; A1030-E1034 PolarHBondContact O-N 3.46Å
1031	V	80.8	Confident	87.2	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-52.9	-43.4	178.7	-178.4	0	0	0	0	112.4	F1021 T1026 R1033 E1034 G1035 M1037 E1041	F1021-V1031 HydrophobicContact CB-CG1 4.22Å; F1021-V1031 HydrophobicContact CD1-CG1 3.63Å; F1021-V1031 HydrophobicContact CE1-CG1 4.44Å; F1021-V1031 HydrophobicContact CG-CG1 4.31Å; T1026-V1031 HydrophobicContact CG2-CB 4.15Å; T1026-V1031 HydrophobicContact CG2-CG1 4.35Å; T1026-V1031 HydrophobicContact CG2-CG2 3.88Å; V1031-R1033 PolarHBondContact O-N 3.27Å; V1031-R1033 VanDerWaalsContact O-N 3.12Å; V1031-E1034 PolarHBondContact O-N 3.48Å; V1031-G1035 WeakPolarHBondContact O-CA 3.26Å; V1031-G1035 PolarHBondContact O-N 3.38Å; V1031-M1037 HydrophobicContact CG1-CB 4.26Å; V1031-M1037 HydrophobicContact CG2-CB 4.29Å; V1031-E1041 HydrophobicContact CG2-CG 4.19Å
1032	Q	80.9	Confident	87.3	Confident	98 Å²	98	46.3 Å²	46.3	46%	0.458	26%	0.255	S	S	.	.	H	α-helix	trans	-56.1	-26.5	174.2	-72.3	-178.6	-19.5	0	0	115.2	S1022 N1029 A1030	S1022-Q1032 WeakPolarHBondContact O-CG 3.21Å; S1022-Q1032 PolarHBondContact O-NE2 3.46Å; N1029-Q1032 PolarHBondContact ND2-OE1 3.35Å; A1030-Q1032 VanDerWaalsContact C-N 3.29Å; A1030-Q1032 PolarHBondContact O-N 3.37Å
1033	R	77.8	Confident	87.5	Confident	171 Å²	171	44.3 Å²	44.3	65%	0.645	24%	0.241	S	C	*	.	H	α-helix	trans	-104.5	-31.2	-172.5	-167	-157.5	-51.1	114.9	2.7	112.2	N1029 A1030 V1031	N1029-R1033 VanDerWaalsContact O-CB 3.3Å; N1029-R1033 WeakPolarHBondContact O-CB 3.31Å; N1029-R1033 PolarHBondContact O-NH2 3.3Å; A1030-R1033 WeakPolarHBondContact O-CA 3.09Å; A1030-R1033 WeakPolarHBondContact O-CB 3.47Å; A1030-R1033 PolarHBondContact O-N 3.15Å; V1031-R1033 PolarHBondContact O-N 3.27Å; V1031-R1033 VanDerWaalsContact O-N 3.12Å
1034	E	83.4	Confident	87.9	Confident	99 Å²	99	44.3 Å²	44.3	46%	0.463	24%	0.235	S	C	.	.	H	α-helix	trans	-96.1	-13.9	-179.7	-75.6	129.5	-127.8	0	0	112.7	A1030 V1031 R1036	A1030-E1034 PolarHBondContact O-N 3.46Å; V1031-E1034 PolarHBondContact O-N 3.48Å; E1034-R1036 PolarHBondContact O-N 3.47Å
1035	G	88.6	Confident	88.2	Confident	38 Å²	38	43.7 Å²	43.7	39%	0.392	23%	0.229	S	C	.	.	S	Bend	trans	71.7	5.9	176	0	0	0	0	0	114.6	P1001 V1031	P1001-G1035 WeakPolarHBondContact CD-O 3.43Å; V1031-G1035 WeakPolarHBondContact O-CA 3.26Å; V1031-G1035 PolarHBondContact O-N 3.38Å
1036	R	92.6	Very high	88.4	Confident	75 Å²	75	42.9 Å²	42.9	28%	0.283	23%	0.225	S	C	.	.			trans	-140	153.1	-175.1	-57.2	-166.1	-64	170.5	10.5	110.3	D996 I999 D1000 E1034	D996-R1036 VanDerWaalsContact CG-NH2 3.31Å; D996-R1036 IonicContact OD1-CZ 2.73Å; D996-R1036 IonicContact OD1-NH1 3.57Å; D996-R1036 PolarHBondContact OD1-NH1 3.36Å; D996-R1036 IonicContact OD1-NH2 2.73Å; D996-R1036 PolarHBondContact OD1-NH2 3.15Å; D996-R1036 VanDerWaalsContact OD1-NH2 3.09Å; D996-R1036 IonicContact OD2-CZ 2.81Å; D996-R1036 VanDerWaalsContact OD2-CZ 3.28Å; D996-R1036 IonicContact OD2-NH1 3.61Å; D996-R1036 PolarHBondContact OD2-NH1 2.88Å; D996-R1036 IonicContact OD2-NH2 2.75Å; D996-R1036 PolarHBondContact OD2-NH2 2.85Å; I999-R1036 CarbonylContact O-C 3.53Å; I999-R1036 WeakPolarHBondContact O-CA 3.32Å; I999-R1036 WeakPolarHBondContact O-CB 3.46Å; D1000-R1036 HydrophobicContact CB-CG 3.73Å; E1034-R1036 PolarHBondContact O-N 3.47Å
1037	M	94.3	Very high	88.9	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	143.3	-178.2	75.5	-166.6	-59.5	0	0	110	Y998 I999 L1004 F1021 V1031 E1041 F1045	Y998-M1037 CarbonylContact C-O 3.26Å; Y998-M1037 WeakPolarHBondContact CA-O 3.4Å; Y998-M1037 WeakPolarHBondContact CB-O 3.4Å; I999-M1037 HydrophobicContact CB-CG 4.08Å; I999-M1037 HydrophobicContact CG2-CG 4.33Å; I999-M1037 HydrophobicContact CG2-SD 4.37Å; I999-M1037 PolarHBondContact N-O 3.12Å; I999-M1037 PolarHBondContact O-N 3.25Å; L1004-M1037 HydrophobicContact CD1-SD 4.43Å; L1004-M1037 HydrophobicContact CD2-SD 3.91Å; F1021-M1037 HydrophobicContact CD1-CB 4.47Å; F1021-M1037 HydrophobicContact CE1-CB 3.84Å; F1021-M1037 HydrophobicContact CE1-CG 3.94Å; F1021-M1037 HydrophobicContact CE1-SD 4.03Å; F1021-M1037 HydrophobicContact CE2-SD 4.41Å; F1021-M1037 HydrophobicContact CZ-CB 4.47Å; F1021-M1037 HydrophobicContact CZ-CG 4.11Å; F1021-M1037 HydrophobicContact CZ-SD 3.67Å; V1031-M1037 HydrophobicContact CG1-CB 4.26Å; V1031-M1037 HydrophobicContact CG2-CB 4.29Å; M1037-E1041 HydrophobicContact CB-CB 3.98Å; M1037-E1041 HydrophobicContact CE-CB 3.72Å; M1037-F1045 HydrophobicContact CE-CB 4.15Å
1038	S	94.7	Very high	89.9	Confident	29 Å²	29	37.6 Å²	37.6	20%	0.203	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	170.5	178.7	82.6	0	0	0	0	111.3	A1040 E1041 F1042	S1038-A1040 PolarHBondContact O-N 3.39Å; S1038-A1040 VanDerWaalsContact O-N 3.09Å; S1038-A1040 PolarHBondContact OG-N 2.95Å; S1038-A1040 VanDerWaalsContact OG-N 3.14Å; S1038-E1041 WeakPolarHBondContact CA-OE2 3.03Å; S1038-E1041 VanDerWaalsContact CB-OE2 3.27Å; S1038-E1041 WeakPolarHBondContact CB-OE2 3.15Å; S1038-E1041 PolarHBondContact N-OE2 3.45Å; S1038-E1041 PolarHBondContact O-N 3.34Å; S1038-E1041 PolarHBondContact OG-OE2 3.48Å; S1038-F1042 PolarHBondContact O-N 3.44Å
1039	Y	95.8	Very high	91	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-46.9	-35.2	167.8	-176.6	-118.5	0	0	0	113.8	R925 T928 T929 F981 I984 Y985 F988 F1042 V1043	R925-Y1039 HydrophobicContact CB-CE1 4.12Å; R925-Y1039 VanDerWaalsContact NH1-CG 3.33Å; T928-Y1039 HydrophobicContact CG2-CD1 4.2Å; T929-Y1039 WeakPolarHBondContact OG1-CE1 3.44Å; T929-Y1039 VanDerWaalsContact OG1-CZ 3.26Å; T929-Y1039 PolarHBondContact OG1-OH 3.18Å; F981-Y1039 WeakPolarHBondContact CE2-OH 3.41Å; I984-Y1039 HydrophobicContact CG2-CE2 4.19Å; Y985-Y1039 HydrophobicContact CD2-CE2 4.22Å; F988-Y1039 HydrophobicContact CB-CD2 3.83Å; F988-Y1039 HydrophobicContact CB-CE2 3.87Å; F988-Y1039 AromaticContact CD1-CD2 3.77Å; F988-Y1039 HydrophobicContact CD1-CD2 3.77Å; F988-Y1039 HydrophobicContact CD1-CE2 4.36Å; F988-Y1039 AromaticContact CD2-CD2 3.67Å; F988-Y1039 HydrophobicContact CD2-CD2 3.67Å; F988-Y1039 HydrophobicContact CE1-CD2 4.27Å; F988-Y1039 HydrophobicContact CE2-CD2 4.16Å; F988-Y1039 AromaticContact CG-CD2 3.46Å; F988-Y1039 HydrophobicContact CG-CD2 3.46Å; F988-Y1039 VanDerWaalsContact CG-CD2 3.46Å; F988-Y1039 HydrophobicContact CG-CE2 4.01Å; F988-Y1039 HydrophobicContact CZ-CD2 4.45Å; Y1039-F1042 PolarHBondContact O-N 3.42Å; Y1039-V1043 HydrophobicContact CD1-CG2 4.43Å; Y1039-V1043 HydrophobicContact CD2-CG2 4.49Å; Y1039-V1043 HydrophobicContact CE1-CG2 4.22Å; Y1039-V1043 HydrophobicContact CE2-CG2 4.29Å; Y1039-V1043 WeakPolarHBondContact O-CG2 3.24Å; Y1039-V1043 PolarHBondContact O-N 3.3Å
1040	A	95.5	Very high	92.1	Very high	23 Å²	23	32.1 Å²	32.1	19%	0.19	16%	0.162	C	C	.	.	H	α-helix	trans	-67.2	-41.5	179.7	0	0	0	0	0	112.2	T928 Q932 S1038 W1044	T928-A1040 HydrophobicContact CG2-CB 4.45Å; Q932-A1040 HydrophobicContact CG-CB 4.33Å; S1038-A1040 PolarHBondContact O-N 3.39Å; S1038-A1040 VanDerWaalsContact O-N 3.09Å; S1038-A1040 PolarHBondContact OG-N 2.95Å; S1038-A1040 VanDerWaalsContact OG-N 3.14Å; A1040-W1044 VanDerWaalsContact O-CD1 3.3Å
1041	E	96	Very high	93.1	Very high	40 Å²	40	31 Å²	31	19%	0.187	15%	0.151	C	C	.	.	H	α-helix	trans	-70	-36	171.4	-71.7	84.3	-172.9	0	0	112.2	T1026 V1031 M1037 S1038 V1043 W1044 F1045	T1026-E1041 HydrophobicContact CG2-CG 3.9Å; V1031-E1041 HydrophobicContact CG2-CG 4.19Å; M1037-E1041 HydrophobicContact CB-CB 3.98Å; M1037-E1041 HydrophobicContact CE-CB 3.72Å; S1038-E1041 WeakPolarHBondContact CA-OE2 3.03Å; S1038-E1041 VanDerWaalsContact CB-OE2 3.27Å; S1038-E1041 WeakPolarHBondContact CB-OE2 3.15Å; S1038-E1041 PolarHBondContact N-OE2 3.45Å; S1038-E1041 PolarHBondContact O-N 3.34Å; S1038-E1041 PolarHBondContact OG-OE2 3.48Å; E1041-V1043 VanDerWaalsContact C-N 3.34Å; E1041-V1043 PolarHBondContact O-N 2.91Å; E1041-W1044 WeakPolarHBondContact O-CB 3.43Å; E1041-W1044 PolarHBondContact O-N 3.35Å; E1041-W1044 VanDerWaalsContact O-N 3.1Å; E1041-F1045 PolarHBondContact O-N 2.96Å
1042	F	97.3	Very high	93.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.4	-39	177.9	179.3	-97.7	0	0	0	112.3	K987 F988 L991 I999 L1004 S1038 Y1039 W1044 F1045 L1046	K987-F1042 HydrophobicContact CB-CE1 4.37Å; K987-F1042 HydrophobicContact CB-CZ 4.15Å; K987-F1042 WeakPolarHBondContact O-CZ 3.36Å; F988-F1042 HydrophobicContact CB-CD1 3.76Å; F988-F1042 HydrophobicContact CB-CE1 3.69Å; F988-F1042 HydrophobicContact CB-CZ 4.45Å; F988-F1042 HydrophobicContact CD2-CB 3.85Å; F988-F1042 AromaticContact CD2-CD1 3.68Å; F988-F1042 HydrophobicContact CD2-CD1 3.68Å; F988-F1042 HydrophobicContact CD2-CD2 4.37Å; F988-F1042 HydrophobicContact CD2-CE1 4.32Å; F988-F1042 AromaticContact CD2-CG 3.7Å; F988-F1042 HydrophobicContact CD2-CG 3.7Å; F988-F1042 HydrophobicContact CE2-CB 4.24Å; F988-F1042 HydrophobicContact CE2-CG 4.49Å; F988-F1042 HydrophobicContact CG-CD1 4.2Å; L991-F1042 HydrophobicContact CD1-CE2 3.75Å; L991-F1042 HydrophobicContact CD1-CZ 4.18Å; I999-F1042 HydrophobicContact CD1-CD2 3.59Å; I999-F1042 HydrophobicContact CD1-CE2 3.95Å; I999-F1042 HydrophobicContact CD1-CG 4.08Å; L1004-F1042 HydrophobicContact CD1-CD2 4.2Å; L1004-F1042 HydrophobicContact CD1-CE2 4.16Å; S1038-F1042 PolarHBondContact O-N 3.44Å; Y1039-F1042 PolarHBondContact O-N 3.42Å; F1042-W1044 PolarHBondContact O-N 2.89Å; F1042-F1045 AromaticContact CD2-CD1 3.91Å; F1042-F1045 HydrophobicContact CD2-CD1 3.91Å; F1042-F1045 AromaticContact CE2-CD1 3.79Å; F1042-F1045 HydrophobicContact CE2-CD1 3.79Å; F1042-F1045 HydrophobicContact CE2-CE1 4.09Å; F1042-F1045 WeakPolarHBondContact O-CB 3.38Å; F1042-F1045 PolarHBondContact O-N 2.91Å; F1042-F1045 VanDerWaalsContact O-N 3.11Å; F1042-L1046 HydrophobicContact CE1-CB 4.25Å; F1042-L1046 HydrophobicContact CE1-CD2 3.78Å; F1042-L1046 HydrophobicContact CZ-CB 4.38Å; F1042-L1046 HydrophobicContact CZ-CD2 4.11Å; F1042-L1046 PolarHBondContact O-N 3.33Å
1043	V	98.1	Very high	94.5	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.6	-39	173.6	178.1	0	0	0	0	110.9	T929 Q932 I984 Y1039 E1041 L1047	T929-V1043 HydrophobicContact CG2-CG1 4.25Å; T929-V1043 HydrophobicContact CG2-CG2 4.47Å; Q932-V1043 HydrophobicContact CB-CB 4.04Å; Q932-V1043 HydrophobicContact CB-CG1 3.62Å; Q932-V1043 HydrophobicContact CG-CB 4.19Å; Q932-V1043 HydrophobicContact CG-CG1 4.3Å; I984-V1043 HydrophobicContact CD1-CG1 4.43Å; I984-V1043 HydrophobicContact CG2-CB 4.32Å; I984-V1043 HydrophobicContact CG2-CG1 4.38Å; I984-V1043 HydrophobicContact CG2-CG2 3.67Å; Y1039-V1043 HydrophobicContact CD1-CG2 4.43Å; Y1039-V1043 HydrophobicContact CD2-CG2 4.49Å; Y1039-V1043 HydrophobicContact CE1-CG2 4.22Å; Y1039-V1043 HydrophobicContact CE2-CG2 4.29Å; Y1039-V1043 WeakPolarHBondContact O-CG2 3.24Å; Y1039-V1043 PolarHBondContact O-N 3.3Å; E1041-V1043 VanDerWaalsContact C-N 3.34Å; E1041-V1043 PolarHBondContact O-N 2.91Å; V1043-L1047 HydrophobicContact CG1-CD1 3.74Å; V1043-L1047 HydrophobicContact CG1-CG 4.37Å; V1043-L1047 WeakPolarHBondContact O-CB 3.48Å; V1043-L1047 WeakPolarHBondContact O-CD1 3.44Å; V1043-L1047 WeakPolarHBondContact O-CG 3.5Å; V1043-L1047 PolarHBondContact O-N 3.03Å; V1043-L1047 VanDerWaalsContact O-N 3.17Å
1044	W	98.1	Very high	95.3	Very high	20 Å²	20	24.6 Å²	24.6	8%	0.076	13%	0.128	C	C	.	.	H	α-helix	trans	-71.7	-35.6	175.9	-76.8	67.8	0	0	0	112.9	F935 Y936 W942 A1040 E1041 F1042 S1048 T1056 Y1060	F935-W1044 HydrophobicContact CB-CZ2 3.83Å; Y936-W1044 AromaticContact CD2-CD2 3.99Å; Y936-W1044 HydrophobicContact CD2-CD2 3.99Å; Y936-W1044 AromaticContact CD2-CE3 3.63Å; Y936-W1044 HydrophobicContact CD2-CE3 3.63Å; Y936-W1044 HydrophobicContact CD2-CH2 4.48Å; Y936-W1044 AromaticContact CD2-CZ3 3.9Å; Y936-W1044 HydrophobicContact CD2-CZ3 3.9Å; Y936-W1044 HydrophobicContact CE2-CE3 4.26Å; W942-W1044 HydrophobicContact CE3-CZ3 4.1Å; W942-W1044 HydrophobicContact CH2-CE3 4.17Å; W942-W1044 AromaticContact CH2-CZ3 3.95Å; W942-W1044 HydrophobicContact CH2-CZ3 3.95Å; W942-W1044 HydrophobicContact CZ2-CZ3 4.34Å; W942-W1044 HydrophobicContact CZ3-CE3 4.06Å; W942-W1044 AromaticContact CZ3-CZ3 3.81Å; W942-W1044 HydrophobicContact CZ3-CZ3 3.81Å; A1040-W1044 VanDerWaalsContact O-CD1 3.3Å; E1041-W1044 WeakPolarHBondContact O-CB 3.43Å; E1041-W1044 PolarHBondContact O-N 3.35Å; E1041-W1044 VanDerWaalsContact O-N 3.1Å; F1042-W1044 PolarHBondContact O-N 2.89Å; W1044-S1048 VanDerWaalsContact O-CB 3.3Å; W1044-S1048 WeakPolarHBondContact O-CB 3.27Å; W1044-S1048 PolarHBondContact O-N 3.25Å; W1044-S1048 PolarHBondContact O-OG 3.07Å; W1044-T1056 HydrophobicContact CE3-CG2 4.49Å; W1044-T1056 HydrophobicContact CZ3-CG2 3.91Å; W1044-Y1060 HydrophobicContact CB-CE2 3.99Å
1045	F	97.8	Very high	96	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-59.9	-56.1	172.5	163.1	-98.6	0	0	0	111.1	L1004 Y1007 L1020 M1037 E1041 F1042 L1047 S1048 E1049 Y1060 W1061	L1004-F1045 HydrophobicContact CD1-CD1 3.86Å; L1004-F1045 HydrophobicContact CD1-CE1 3.63Å; L1004-F1045 HydrophobicContact CD1-CE2 4.31Å; L1004-F1045 HydrophobicContact CD1-CG 4.31Å; L1004-F1045 HydrophobicContact CD1-CZ 3.87Å; L1004-F1045 HydrophobicContact CD2-CD2 4.4Å; L1004-F1045 HydrophobicContact CD2-CE2 4.31Å; L1004-F1045 HydrophobicContact CG-CZ 4.36Å; Y1007-F1045 AromaticContact CD1-CE1 3.75Å; Y1007-F1045 HydrophobicContact CD1-CE1 3.75Å; Y1007-F1045 AromaticContact CD1-CZ 3.71Å; Y1007-F1045 HydrophobicContact CD1-CZ 3.71Å; Y1007-F1045 AromaticContact CE1-CE1 3.95Å; Y1007-F1045 HydrophobicContact CE1-CE1 3.95Å; Y1007-F1045 HydrophobicContact CE1-CZ 4.08Å; Y1007-F1045 HydrophobicContact CG-CE1 4.22Å; Y1007-F1045 HydrophobicContact CG-CZ 4.45Å; L1020-F1045 HydrophobicContact CD1-CD2 3.65Å; L1020-F1045 HydrophobicContact CD1-CE2 3.85Å; M1037-F1045 HydrophobicContact CE-CB 4.15Å; E1041-F1045 PolarHBondContact O-N 2.96Å; F1042-F1045 AromaticContact CD2-CD1 3.91Å; F1042-F1045 HydrophobicContact CD2-CD1 3.91Å; F1042-F1045 AromaticContact CE2-CD1 3.79Å; F1042-F1045 HydrophobicContact CE2-CD1 3.79Å; F1042-F1045 HydrophobicContact CE2-CE1 4.09Å; F1042-F1045 WeakPolarHBondContact O-CB 3.38Å; F1042-F1045 PolarHBondContact O-N 2.91Å; F1042-F1045 VanDerWaalsContact O-N 3.11Å; F1045-L1047 PolarHBondContact O-N 3.08Å; F1045-S1048 CarbonylContact O-C 3.55Å; F1045-S1048 WeakPolarHBondContact O-CA 3.42Å; F1045-S1048 WeakPolarHBondContact O-CB 3.46Å; F1045-S1048 PolarHBondContact O-N 3.06Å; F1045-E1049 HydrophobicContact CE2-CB 4.35Å; F1045-E1049 HydrophobicContact CZ-CB 4.29Å; F1045-E1049 HydrophobicContact CZ-CG 4.29Å; F1045-E1049 PolarHBondContact O-N 3.41Å; F1045-Y1060 VanDerWaalsContact CA-OH 3.26Å; F1045-Y1060 WeakPolarHBondContact CA-OH 3.12Å; F1045-Y1060 WeakPolarHBondContact CB-OH 3.33Å; F1045-W1061 HydrophobicContact CD2-CH2 4.09Å; F1045-W1061 HydrophobicContact CE2-CH2 4.02Å
1046	L	98.1	Very high	96.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.7	-41.7	-173.4	-177.1	56.9	0	0	0	112.2	I984 K987 Y1007 F1042 S1048 E1049 E1050 W1167 Y1170	I984-L1046 HydrophobicContact CB-CD2 4.24Å; I984-L1046 HydrophobicContact CG1-CD2 3.98Å; I984-L1046 HydrophobicContact CG2-CD2 4.34Å; K987-L1046 HydrophobicContact CB-CD2 4.01Å; K987-L1046 HydrophobicContact CG-CD2 4.43Å; Y1007-L1046 HydrophobicContact CE2-CD1 4.22Å; Y1007-L1046 WeakPolarHBondContact OH-CD1 3.43Å; F1042-L1046 HydrophobicContact CE1-CB 4.25Å; F1042-L1046 HydrophobicContact CE1-CD2 3.78Å; F1042-L1046 HydrophobicContact CZ-CB 4.38Å; F1042-L1046 HydrophobicContact CZ-CD2 4.11Å; F1042-L1046 PolarHBondContact O-N 3.33Å; L1046-S1048 PolarHBondContact O-N 3.27Å; L1046-E1049 PolarHBondContact O-N 3.2Å; L1046-E1050 HydrophobicContact CD1-CG 4.21Å; L1046-E1050 PolarHBondContact O-N 3.24Å; L1046-W1167 HydrophobicContact CG-CH2 4.38Å; L1046-W1167 HydrophobicContact CG-CZ3 4.05Å; L1046-Y1170 HydrophobicContact CD1-CE1 4.26Å
1047	L	98.1	Very high	96.7	Very high	7 Å²	7	17.9 Å²	17.9	4%	0.037	10%	0.096	C	C	.	.	H	α-helix	trans	-64.3	-20.1	172.4	-68.3	171.1	0	0	0	113.6	R933 Y936 I984 V1043 F1045 W1167	R933-L1047 HydrophobicContact CG-CD1 3.93Å; Y936-L1047 HydrophobicContact CD1-CB 4.36Å; Y936-L1047 HydrophobicContact CD1-CD1 4.21Å; Y936-L1047 HydrophobicContact CD2-CB 4.42Å; Y936-L1047 HydrophobicContact CD2-CD1 4.46Å; Y936-L1047 HydrophobicContact CE1-CB 3.96Å; Y936-L1047 HydrophobicContact CE2-CB 4.07Å; Y936-L1047 HydrophobicContact CG-CD1 4.12Å; Y936-L1047 PolarHBondContact OH-O 3.33Å; I984-L1047 HydrophobicContact CD1-CD2 4.37Å; V1043-L1047 HydrophobicContact CG1-CD1 3.74Å; V1043-L1047 HydrophobicContact CG1-CG 4.37Å; V1043-L1047 WeakPolarHBondContact O-CB 3.48Å; V1043-L1047 WeakPolarHBondContact O-CD1 3.44Å; V1043-L1047 WeakPolarHBondContact O-CG 3.5Å; V1043-L1047 PolarHBondContact O-N 3.03Å; V1043-L1047 VanDerWaalsContact O-N 3.17Å; F1045-L1047 PolarHBondContact O-N 3.08Å; L1047-W1167 HydrophobicContact CD2-CD2 3.66Å; L1047-W1167 HydrophobicContact CD2-CE3 3.83Å; L1047-W1167 HydrophobicContact CD2-CG 4.28Å; L1047-W1167 HydrophobicContact CD2-CH2 4.22Å; L1047-W1167 HydrophobicContact CD2-CZ2 4.05Å; L1047-W1167 HydrophobicContact CD2-CZ3 4.1Å
1048	S	98.1	Very high	96.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-93.4	-35.9	178.1	-57.3	0	0	0	0	112.5	Y936 W1044 F1045 L1046 K1052 S1057 Y1060 W1061	Y936-S1048 PolarHBondContact OH-OG 3.12Å; W1044-S1048 VanDerWaalsContact O-CB 3.3Å; W1044-S1048 WeakPolarHBondContact O-CB 3.27Å; W1044-S1048 PolarHBondContact O-N 3.25Å; W1044-S1048 PolarHBondContact O-OG 3.07Å; F1045-S1048 CarbonylContact O-C 3.55Å; F1045-S1048 WeakPolarHBondContact O-CA 3.42Å; F1045-S1048 WeakPolarHBondContact O-CB 3.46Å; F1045-S1048 PolarHBondContact O-N 3.06Å; L1046-S1048 PolarHBondContact O-N 3.27Å; S1048-K1052 WeakPolarHBondContact O-CG 3.38Å; S1048-S1057 PolarHBondContact O-OG 3.48Å; S1048-Y1060 WeakPolarHBondContact OG-CD2 3.39Å; S1048-Y1060 VanDerWaalsContact OG-CG 3.3Å; S1048-W1061 PolarHBondContact O-NE1 3.22Å
1049	E	96.4	Very high	97.1	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.009	9%	0.091	C	C	.	.	H	α-helix	trans	-70.9	-35.7	-177	-178.5	38.5	-135.7	0	0	112.6	Y1007 F1045 L1046 K1052 W1061 N1138 K1141	Y1007-E1049 HydrophobicContact CE1-CG 4.15Å; F1045-E1049 HydrophobicContact CE2-CB 4.35Å; F1045-E1049 HydrophobicContact CZ-CB 4.29Å; F1045-E1049 HydrophobicContact CZ-CG 4.29Å; F1045-E1049 PolarHBondContact O-N 3.41Å; L1046-E1049 PolarHBondContact O-N 3.2Å; E1049-K1052 PolarHBondContact O-NZ 3.24Å; E1049-K1052 IonicContact OE1-NZ 3.23Å; E1049-K1052 PolarHBondContact OE1-NZ 3.01Å; E1049-K1052 WeakPolarHBondContact OE2-CE 3.41Å; E1049-K1052 IonicContact OE2-NZ 2.66Å; E1049-K1052 PolarHBondContact OE2-NZ 3.16Å; E1049-W1061 HydrophobicContact CB-CZ2 3.96Å; E1049-W1061 WeakPolarHBondContact OE2-CZ2 3.41Å; E1049-N1138 PolarHBondContact OE1-ND2 3.03Å; E1049-K1141 PolarHBondContact O-NZ 3.28Å; E1049-K1141 VanDerWaalsContact O-NZ 3.14Å; E1049-K1141 IonicContact OE1-NZ 2.8Å; E1049-K1141 PolarHBondContact OE1-NZ 2.74Å
1050	E	95.6	Very high	97.2	Very high	28 Å²	28	17.5 Å²	17.5	13%	0.131	9%	0.091	C	C	.	.	S	Bend	trans	-92.4	-29	-176.4	-58.5	-50.7	137	0	0	114.7	Y1007 N1008 L1046 K1141 W1167 Y1170	Y1007-E1050 PolarHBondContact OH-OE1 2.71Å; N1008-E1050 PolarHBondContact ND2-OE1 3.09Å; L1046-E1050 HydrophobicContact CD1-CG 4.21Å; L1046-E1050 PolarHBondContact O-N 3.24Å; E1050-K1141 IonicContact OE1-NZ 3.84Å; E1050-K1141 PolarHBondContact OE1-NZ 2.94Å; E1050-K1141 IonicContact OE2-NZ 2.87Å; E1050-K1141 PolarHBondContact OE2-NZ 3.01Å; E1050-W1167 HydrophobicContact CB-CE3 4.38Å; E1050-Y1170 HydrophobicContact CB-CD1 4.16Å; E1050-Y1170 HydrophobicContact CB-CG 4.14Å; E1050-Y1170 HydrophobicContact CG-CD1 3.85Å; E1050-Y1170 HydrophobicContact CG-CD2 4.09Å; E1050-Y1170 HydrophobicContact CG-CE1 3.81Å; E1050-Y1170 HydrophobicContact CG-CE2 4.07Å; E1050-Y1170 HydrophobicContact CG-CG 3.99Å
1051	D	96.4	Very high	97.4	Very high	11 Å²	11	16.4 Å²	16.4	6%	0.059	8%	0.082	C	C	.	.			trans	-113.7	75.3	168.5	-177.2	6.8	0	0	0	111.8	K1053 N1054 S1057 W1167	D1051-K1053 PolarHBondContact O-N 3.34Å; D1051-K1053 WeakPolarHBondContact OD1-CA 3.2Å; D1051-K1053 WeakPolarHBondContact OD1-CB 3.42Å; D1051-K1053 PolarHBondContact OD1-N 2.99Å; D1051-N1054 HydrophobicContact CB-CB 4.31Å; D1051-N1054 VanDerWaalsContact O-CB 3.26Å; D1051-N1054 WeakPolarHBondContact O-CB 3.17Å; D1051-N1054 PolarHBondContact O-N 3.24Å; D1051-N1054 PolarHBondContact OD1-N 3.4Å; D1051-N1054 WeakPolarHBondContact OD2-CB 3.5Å; D1051-N1054 PolarHBondContact OD2-ND2 2.81Å; D1051-S1057 WeakPolarHBondContact O-CB 3.35Å; D1051-S1057 PolarHBondContact O-OG 2.89Å; D1051-W1167 HydrophobicContact CB-CB 4.13Å
1052	K	96.7	Very high	97.5	Very high	7 Å²	7	14.7 Å²	14.7	3%	0.03	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	4.8	170.4	-60.1	-162.4	-169.8	74.3	0	114.6	S1048 E1049 S1057 H1130 F1133 D1134	S1048-K1052 WeakPolarHBondContact O-CG 3.38Å; E1049-K1052 PolarHBondContact O-NZ 3.24Å; E1049-K1052 IonicContact OE1-NZ 3.23Å; E1049-K1052 PolarHBondContact OE1-NZ 3.01Å; E1049-K1052 WeakPolarHBondContact OE2-CE 3.41Å; E1049-K1052 IonicContact OE2-NZ 2.66Å; E1049-K1052 PolarHBondContact OE2-NZ 3.16Å; K1052-S1057 WeakPolarHBondContact CA-OG 3.37Å; K1052-H1130 HydrophobicContact CB-CB 3.62Å; K1052-F1133 HydrophobicContact CD-CB 3.78Å; K1052-F1133 HydrophobicContact CD-CD2 4.36Å; K1052-F1133 HydrophobicContact CD-CG 4.5Å; K1052-D1134 WeakPolarHBondContact CD-OD1 3.21Å; K1052-D1134 VanDerWaalsContact CE-OD1 3.32Å; K1052-D1134 WeakPolarHBondContact CE-OD1 3.46Å; K1052-D1134 IonicContact NZ-OD1 3.82Å; K1052-D1134 PolarHBondContact NZ-OD1 2.85Å
1053	K	95.3	Very high	97.5	Very high	95 Å²	95	18.3 Å²	18.3	41%	0.413	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-19.9	169.1	-61.6	171.3	-170.3	158.1	0	111.3	D1051 H1130 D1166	D1051-K1053 PolarHBondContact O-N 3.34Å; D1051-K1053 WeakPolarHBondContact OD1-CA 3.2Å; D1051-K1053 WeakPolarHBondContact OD1-CB 3.42Å; D1051-K1053 PolarHBondContact OD1-N 2.99Å; K1053-H1130 HydrophobicContact CG-CB 4.33Å; K1053-H1130 WeakPolarHBondContact CG-ND1 3.29Å; K1053-D1166 WeakPolarHBondContact CD-OD2 3.35Å; K1053-D1166 WeakPolarHBondContact CE-OD2 3.46Å; K1053-D1166 IonicContact NZ-OD1 3.3Å; K1053-D1166 PolarHBondContact NZ-OD1 2.85Å; K1053-D1166 IonicContact NZ-OD2 2.67Å; K1053-D1166 PolarHBondContact NZ-OD2 3.11Å
1054	N	95.5	Very high	97.5	Very high	36 Å²	36	18.3 Å²	18.3	19%	0.193	9%	0.088	C	C	.	.	S	Bend	trans	-60.6	132.1	179.4	-154.6	-67.1	0	0	0	112.3	D1051 T1056 S1057 I1058	D1051-N1054 HydrophobicContact CB-CB 4.31Å; D1051-N1054 VanDerWaalsContact O-CB 3.26Å; D1051-N1054 WeakPolarHBondContact O-CB 3.17Å; D1051-N1054 PolarHBondContact O-N 3.24Å; D1051-N1054 PolarHBondContact OD1-N 3.4Å; D1051-N1054 WeakPolarHBondContact OD2-CB 3.5Å; D1051-N1054 PolarHBondContact OD2-ND2 2.81Å; N1054-T1056 PolarHBondContact O-N 3.43Å; N1054-T1056 VanDerWaalsContact O-N 3.12Å; N1054-T1056 PolarHBondContact OD1-N 2.77Å; N1054-S1057 PolarHBondContact O-N 3.06Å; N1054-I1058 WeakPolarHBondContact O-CG1 3.45Å; N1054-I1058 PolarHBondContact O-N 2.87Å
1055	P	96.4	Very high	97.5	Very high	69 Å²	69	17.4 Å²	17.4	45%	0.448	8%	0.084	S	C	.	.	H	α-helix	trans	-56.8	-26.5	173.9	-27.9	36.6	0	0	0	115	R940 E1059	R940-P1055 PolarHBondContact NH2-O 3.31Å; P1055-E1059 VanDerWaalsContact O-CD 3.3Å; P1055-E1059 WeakPolarHBondContact O-CG 3.23Å; P1055-E1059 PolarHBondContact O-N 3.24Å
1056	T	98.1	Very high	97.5	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-76.6	-41.8	173	-53.3	0	0	0	0	111.7	Y936 R940 W942 W1044 N1054 I1058 E1059 Y1060	Y936-T1056 HydrophobicContact CD2-CG2 3.47Å; Y936-T1056 VanDerWaalsContact CD2-CG2 3.47Å; Y936-T1056 HydrophobicContact CE1-CG2 4.5Å; Y936-T1056 HydrophobicContact CE2-CG2 3.4Å; Y936-T1056 VanDerWaalsContact CE2-CG2 3.4Å; Y936-T1056 HydrophobicContact CG-CG2 4.04Å; Y936-T1056 WeakPolarHBondContact O-CG2 3.39Å; Y936-T1056 PolarHBondContact O-OG1 3.05Å; R940-T1056 VanDerWaalsContact CZ-OG1 3.26Å; R940-T1056 PolarHBondContact NE-OG1 3.02Å; R940-T1056 PolarHBondContact NH1-OG1 3.29Å; W942-T1056 HydrophobicContact CH2-CG2 4.43Å; W942-T1056 HydrophobicContact CZ2-CG2 3.84Å; W1044-T1056 HydrophobicContact CE3-CG2 4.49Å; W1044-T1056 HydrophobicContact CZ3-CG2 3.91Å; N1054-T1056 PolarHBondContact O-N 3.43Å; N1054-T1056 VanDerWaalsContact O-N 3.12Å; N1054-T1056 PolarHBondContact OD1-N 2.77Å; T1056-I1058 PolarHBondContact O-N 2.85Å; T1056-E1059 WeakPolarHBondContact O-CB 3.2Å; T1056-E1059 PolarHBondContact O-N 3.22Å; T1056-Y1060 PolarHBondContact O-N 2.97Å
1057	S	98.4	Very high	97.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.9	-41.7	174.1	177.7	0	0	0	0	112.2	Y936 S1048 D1051 K1052 N1054 E1059 Y1060 W1061	Y936-S1057 WeakPolarHBondContact OH-CB 3.26Å; Y936-S1057 PolarHBondContact OH-N 3.09Å; S1048-S1057 PolarHBondContact O-OG 3.48Å; D1051-S1057 WeakPolarHBondContact O-CB 3.35Å; D1051-S1057 PolarHBondContact O-OG 2.89Å; K1052-S1057 WeakPolarHBondContact CA-OG 3.37Å; N1054-S1057 PolarHBondContact O-N 3.06Å; S1057-E1059 PolarHBondContact O-N 3.05Å; S1057-Y1060 WeakPolarHBondContact O-CB 3.18Å; S1057-Y1060 PolarHBondContact O-N 2.86Å; S1057-W1061 VanDerWaalsContact O-CD1 3.3Å; S1057-W1061 PolarHBondContact O-N 3.08Å; S1057-W1061 PolarHBondContact OG-NE1 2.87Å
1058	I	98.6	Very high	97.4	Very high	9 Å²	9	25.9 Å²	25.9	5%	0.046	13%	0.132	C	C	.	.	H	α-helix	trans	-59.1	-37.5	176.2	-63.3	169	0	0	0	110.6	N1054 T1056 Y1062 L1120 L1123 K1124 A1129 F1133	N1054-I1058 WeakPolarHBondContact O-CG1 3.45Å; N1054-I1058 PolarHBondContact O-N 2.87Å; T1056-I1058 PolarHBondContact O-N 2.85Å; I1058-Y1062 WeakPolarHBondContact O-CB 3.17Å; I1058-Y1062 PolarHBondContact O-N 2.9Å; I1058-Y1062 VanDerWaalsContact O-N 3.08Å; I1058-L1120 HydrophobicContact CG2-CD1 4.03Å; I1058-L1123 HydrophobicContact CG2-CB 4.11Å; I1058-K1124 HydrophobicContact CG2-CG 4.15Å; I1058-A1129 HydrophobicContact CD1-CB 3.99Å; I1058-A1129 HydrophobicContact CG1-CB 3.94Å; I1058-A1129 HydrophobicContact CG2-CB 4.37Å; I1058-F1133 HydrophobicContact CB-CE2 4.27Å; I1058-F1133 HydrophobicContact CG1-CE2 4.19Å; I1058-F1133 HydrophobicContact CG2-CE2 4.18Å; I1058-F1133 HydrophobicContact CG2-CZ 4.22Å
1059	E	98.5	Very high	97.3	Very high	15 Å²	15	27.6 Å²	27.6	7%	0.07	15%	0.149	C	C	.	.	H	α-helix	trans	-73	-35.4	174.1	-73.9	161.2	-173.8	0	0	113.4	R940 W942 P1055 T1056 S1057 R1063 L1120 K1124	R940-E1059 IonicContact CZ-OE1 3.33Å; R940-E1059 IonicContact CZ-OE2 2.73Å; R940-E1059 VanDerWaalsContact CZ-OE2 3.22Å; R940-E1059 IonicContact NH1-OE2 2.66Å; R940-E1059 PolarHBondContact NH1-OE2 2.77Å; R940-E1059 IonicContact NH2-OE1 2.75Å; R940-E1059 PolarHBondContact NH2-OE1 3.15Å; R940-E1059 IonicContact NH2-OE2 2.85Å; R940-E1059 PolarHBondContact NH2-OE2 3.43Å; W942-E1059 HydrophobicContact CZ2-CB 3.64Å; W942-E1059 PolarHBondContact NE1-OE2 3.32Å; P1055-E1059 VanDerWaalsContact O-CD 3.3Å; P1055-E1059 WeakPolarHBondContact O-CG 3.23Å; P1055-E1059 PolarHBondContact O-N 3.24Å; T1056-E1059 WeakPolarHBondContact O-CB 3.2Å; T1056-E1059 PolarHBondContact O-N 3.22Å; S1057-E1059 PolarHBondContact O-N 3.05Å; E1059-R1063 WeakPolarHBondContact O-CD 3.49Å; E1059-R1063 VanDerWaalsContact O-CG 3.25Å; E1059-R1063 WeakPolarHBondContact O-CG 3.22Å; E1059-R1063 PolarHBondContact O-N 3.28Å; E1059-R1063 VanDerWaalsContact O-N 3.09Å; E1059-L1120 HydrophobicContact CG-CD1 3.79Å; E1059-L1120 HydrophobicContact CG-CD2 3.89Å; E1059-L1120 HydrophobicContact CG-CG 4.39Å; E1059-K1124 WeakPolarHBondContact OE1-CE 3.43Å; E1059-K1124 IonicContact OE1-NZ 2.72Å; E1059-K1124 PolarHBondContact OE1-NZ 2.64Å
1060	Y	98.6	Very high	97.3	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.012	17%	0.174	C	C	.	.	H	α-helix	trans	-61.2	-57.2	176.1	-170.6	-84.5	0	0	0	110.6	W942 L1020 V1025 W1044 F1045 S1048 T1056 S1057 Y1062 R1063 C1064	W942-Y1060 AromaticContact CH2-CD2 3.91Å; W942-Y1060 HydrophobicContact CH2-CD2 3.91Å; W942-Y1060 HydrophobicContact CH2-CG 4.38Å; W942-Y1060 HydrophobicContact CZ3-CD2 4.44Å; L1020-Y1060 HydrophobicContact CD2-CE1 3.49Å; L1020-Y1060 VanDerWaalsContact CD2-CE1 3.49Å; L1020-Y1060 WeakPolarHBondContact CD2-OH 3.37Å; V1025-Y1060 HydrophobicContact CB-CD2 3.89Å; V1025-Y1060 HydrophobicContact CB-CE2 3.67Å; V1025-Y1060 HydrophobicContact CB-CG 4.43Å; V1025-Y1060 HydrophobicContact CG1-CD1 4.13Å; V1025-Y1060 HydrophobicContact CG1-CD2 3.79Å; V1025-Y1060 HydrophobicContact CG1-CE1 4.34Å; V1025-Y1060 HydrophobicContact CG1-CE2 4Å; V1025-Y1060 HydrophobicContact CG1-CG 3.84Å; V1025-Y1060 WeakPolarHBondContact CG1-O 3.29Å; V1025-Y1060 HydrophobicContact CG2-CD2 4.48Å; V1025-Y1060 HydrophobicContact CG2-CE1 4.31Å; V1025-Y1060 HydrophobicContact CG2-CE2 3.83Å; W1044-Y1060 HydrophobicContact CB-CE2 3.99Å; F1045-Y1060 VanDerWaalsContact CA-OH 3.26Å; F1045-Y1060 WeakPolarHBondContact CA-OH 3.12Å; F1045-Y1060 WeakPolarHBondContact CB-OH 3.33Å; S1048-Y1060 WeakPolarHBondContact OG-CD2 3.39Å; S1048-Y1060 VanDerWaalsContact OG-CG 3.3Å; T1056-Y1060 PolarHBondContact O-N 2.97Å; S1057-Y1060 WeakPolarHBondContact O-CB 3.18Å; S1057-Y1060 PolarHBondContact O-N 2.86Å; Y1060-Y1062 VanDerWaalsContact C-N 3.35Å; Y1060-Y1062 PolarHBondContact O-N 2.92Å; Y1060-R1063 WeakPolarHBondContact O-CB 3.44Å; Y1060-R1063 PolarHBondContact O-N 2.99Å; Y1060-C1064 PolarHBondContact O-N 2.94Å; Y1060-C1064 VanDerWaalsContact O-N 3.16Å; Y1060-C1064 PolarHBondContact O-SG 3.41Å; Y1060-C1064 VanDerWaalsContact O-SG 3.41Å
1061	W	98.6	Very high	97.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.6	-31.2	-179.7	-63.6	119.7	0	0	0	113.2	I1016 L1020 F1045 S1048 E1049 S1057 C1064 M1065 F1133 F1137	I1016-W1061 HydrophobicContact CD1-CE3 4.48Å; I1016-W1061 HydrophobicContact CG1-CE3 4.03Å; I1016-W1061 HydrophobicContact CG1-CZ3 3.81Å; L1020-W1061 HydrophobicContact CD2-CH2 4.24Å; L1020-W1061 HydrophobicContact CD2-CZ3 3.91Å; F1045-W1061 HydrophobicContact CD2-CH2 4.09Å; F1045-W1061 HydrophobicContact CE2-CH2 4.02Å; S1048-W1061 PolarHBondContact O-NE1 3.22Å; E1049-W1061 HydrophobicContact CB-CZ2 3.96Å; E1049-W1061 WeakPolarHBondContact OE2-CZ2 3.41Å; S1057-W1061 VanDerWaalsContact O-CD1 3.3Å; S1057-W1061 PolarHBondContact O-N 3.08Å; S1057-W1061 PolarHBondContact OG-NE1 2.87Å; W1061-C1064 HydrophobicContact CE3-CB 4.23Å; W1061-C1064 PolarHBondContact O-N 3.24Å; W1061-M1065 WeakPolarHBondContact O-CG 3.37Å; W1061-M1065 PolarHBondContact O-N 3.29Å; W1061-F1133 HydrophobicContact CB-CD1 3.73Å; W1061-F1133 HydrophobicContact CB-CD2 4.06Å; W1061-F1133 HydrophobicContact CB-CE1 3.64Å; W1061-F1133 HydrophobicContact CB-CE2 3.98Å; W1061-F1133 HydrophobicContact CB-CG 3.96Å; W1061-F1133 HydrophobicContact CB-CZ 3.77Å; W1061-F1133 HydrophobicContact CG-CD2 4.49Å; W1061-F1133 HydrophobicContact CG-CG 4.48Å; W1061-F1137 HydrophobicContact CB-CE1 4.39Å; W1061-F1137 HydrophobicContact CB-CZ 3.99Å; W1061-F1137 HydrophobicContact CD2-CE1 4.45Å; W1061-F1137 AromaticContact CD2-CE2 3.87Å; W1061-F1137 HydrophobicContact CD2-CE2 3.87Å; W1061-F1137 AromaticContact CD2-CZ 3.43Å; W1061-F1137 HydrophobicContact CD2-CZ 3.43Å; W1061-F1137 VanDerWaalsContact CD2-CZ 3.43Å; W1061-F1137 HydrophobicContact CE3-CE1 4.19Å; W1061-F1137 AromaticContact CE3-CE2 3.68Å; W1061-F1137 HydrophobicContact CE3-CE2 3.68Å; W1061-F1137 AromaticContact CE3-CZ 3.39Å; W1061-F1137 HydrophobicContact CE3-CZ 3.39Å; W1061-F1137 HydrophobicContact CG-CE2 4.5Å; W1061-F1137 AromaticContact CG-CZ 3.69Å; W1061-F1137 HydrophobicContact CG-CZ 3.69Å; W1061-F1137 HydrophobicContact CH2-CE2 4.29Å; W1061-F1137 HydrophobicContact CZ2-CE2 4.46Å; W1061-F1137 AromaticContact CZ3-CE2 3.9Å; W1061-F1137 HydrophobicContact CZ3-CE2 3.9Å; W1061-F1137 HydrophobicContact CZ3-CZ 4.09Å
1062	Y	98.6	Very high	97.4	Very high	3 Å²	3	32.5 Å²	32.5	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-59.6	-47.9	171.2	-165.9	-89.1	0	0	0	111.7	I1058 Y1060 C1064 M1065 D1066 G1071 V1072 L1073 I1118 T1119 L1120 L1123	I1058-Y1062 WeakPolarHBondContact O-CB 3.17Å; I1058-Y1062 PolarHBondContact O-N 2.9Å; I1058-Y1062 VanDerWaalsContact O-N 3.08Å; Y1060-Y1062 VanDerWaalsContact C-N 3.35Å; Y1060-Y1062 PolarHBondContact O-N 2.92Å; Y1062-C1064 PolarHBondContact O-N 2.89Å; Y1062-M1065 PolarHBondContact O-N 2.85Å; Y1062-M1065 VanDerWaalsContact O-N 3.12Å; Y1062-D1066 HydrophobicContact CD1-CB 4.16Å; Y1062-D1066 HydrophobicContact CE1-CB 4.02Å; Y1062-D1066 WeakPolarHBondContact CE1-OD2 3.29Å; Y1062-D1066 WeakPolarHBondContact O-CB 3.48Å; Y1062-D1066 PolarHBondContact O-N 3.12Å; Y1062-G1071 PolarHBondContact OH-O 3.06Å; Y1062-V1072 VanDerWaalsContact OH-CA 3.27Å; Y1062-V1072 WeakPolarHBondContact OH-CA 3.21Å; Y1062-V1072 PolarHBondContact OH-N 3.35Å; Y1062-L1073 HydrophobicContact CD2-CD1 4.07Å; Y1062-L1073 HydrophobicContact CD2-CD2 4.42Å; Y1062-L1073 HydrophobicContact CD2-CG 4.17Å; Y1062-L1073 HydrophobicContact CE2-CD1 3.85Å; Y1062-L1073 HydrophobicContact CE2-CD2 4.07Å; Y1062-L1073 HydrophobicContact CE2-CG 3.56Å; Y1062-L1073 PolarHBondContact OH-N 3.02Å; Y1062-I1118 PolarHBondContact OH-O 3.49Å; Y1062-I1118 VanDerWaalsContact OH-O 3.1Å; Y1062-T1119 WeakPolarHBondContact OH-CA 3.37Å; Y1062-L1120 HydrophobicContact CD1-CB 4.01Å; Y1062-L1120 HydrophobicContact CD1-CD1 4.45Å; Y1062-L1120 HydrophobicContact CD2-CB 4.02Å; Y1062-L1120 HydrophobicContact CD2-CD1 4.2Å; Y1062-L1120 HydrophobicContact CE1-CB 4.01Å; Y1062-L1120 HydrophobicContact CE2-CB 4.01Å; Y1062-L1120 HydrophobicContact CG-CB 4.01Å; Y1062-L1120 HydrophobicContact CG-CD1 3.9Å; Y1062-L1120 HydrophobicContact CG-CG 4.5Å; Y1062-L1120 VanDerWaalsContact CZ-N 3.29Å; Y1062-L1120 PolarHBondContact OH-N 3.18Å; Y1062-L1123 HydrophobicContact CD2-CD1 3.66Å; Y1062-L1123 HydrophobicContact CE2-CD1 3.91Å
1063	R	98.1	Very high	97.4	Very high	77 Å²	77	32.2 Å²	32.2	29%	0.291	18%	0.181	S	C	.	.	H	α-helix	trans	-59.2	-35.4	175	-74	164.6	158.2	-80.9	-9.7	112.4	R1019 A1024 V1025 E1059 Y1060	R1019-R1063 PolarHBondContact NH2-O 2.92Å; A1024-R1063 HydrophobicContact CB-CB 4.32Å; A1024-R1063 WeakPolarHBondContact CB-O 3.19Å; A1024-R1063 PolarHBondContact O-NH1 2.72Å; V1025-R1063 HydrophobicContact CG1-CB 3.94Å; E1059-R1063 WeakPolarHBondContact O-CD 3.49Å; E1059-R1063 VanDerWaalsContact O-CG 3.25Å; E1059-R1063 WeakPolarHBondContact O-CG 3.22Å; E1059-R1063 PolarHBondContact O-N 3.28Å; E1059-R1063 VanDerWaalsContact O-N 3.09Å; Y1060-R1063 WeakPolarHBondContact O-CB 3.44Å; Y1060-R1063 PolarHBondContact O-N 2.99Å
1064	C	98.1	Very high	97.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-69.9	-37.5	175.5	-65.4	0	0	0	0	112.5	I1016 R1019 Y1060 W1061 Y1062	I1016-C1064 HydrophobicContact CD1-CB 3.67Å; I1016-C1064 HydrophobicContact CG1-CB 4.32Å; R1019-C1064 HydrophobicContact CB-CB 4.17Å; R1019-C1064 WeakPolarHBondContact CG-O 3.42Å; R1019-C1064 PolarHBondContact NE-O 2.89Å; Y1060-C1064 PolarHBondContact O-N 2.94Å; Y1060-C1064 VanDerWaalsContact O-N 3.16Å; Y1060-C1064 PolarHBondContact O-SG 3.41Å; Y1060-C1064 VanDerWaalsContact O-SG 3.41Å; W1061-C1064 HydrophobicContact CE3-CB 4.23Å; W1061-C1064 PolarHBondContact O-N 3.24Å; Y1062-C1064 PolarHBondContact O-N 2.89Å
1065	M	98.3	Very high	97.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-83	-26.2	179.5	-68.7	-169.9	75.6	0	0	114.8	I1016 W1061 Y1062 V1067 L1073 L1078 F1081 F1132 F1133 F1136 F1137	I1016-M1065 HydrophobicContact CD1-CG 4.19Å; W1061-M1065 WeakPolarHBondContact O-CG 3.37Å; W1061-M1065 PolarHBondContact O-N 3.29Å; Y1062-M1065 PolarHBondContact O-N 2.85Å; Y1062-M1065 VanDerWaalsContact O-N 3.12Å; M1065-V1067 PolarHBondContact O-N 3.34Å; M1065-L1073 VanDerWaalsContact C-CD2 3.45Å; M1065-L1073 HydrophobicContact CB-CD1 4.17Å; M1065-L1073 HydrophobicContact CB-CD2 3.65Å; M1065-L1073 HydrophobicContact SD-CD1 4.4Å; M1065-L1078 HydrophobicContact CE-CD2 3.7Å; M1065-F1081 HydrophobicContact CB-CD2 4.5Å; M1065-F1081 HydrophobicContact CB-CE2 4.08Å; M1065-F1081 HydrophobicContact CE-CD2 3.89Å; M1065-F1081 HydrophobicContact CE-CG 4.42Å; M1065-F1081 HydrophobicContact CG-CD2 4.27Å; M1065-F1081 HydrophobicContact CG-CE2 4.15Å; M1065-F1132 HydrophobicContact CE-CE1 4.29Å; M1065-F1132 HydrophobicContact SD-CE1 4.11Å; M1065-F1133 HydrophobicContact SD-CD1 3.65Å; M1065-F1133 HydrophobicContact SD-CE1 3.97Å; M1065-F1136 HydrophobicContact CE-CB 3.58Å; M1065-F1136 HydrophobicContact CE-CD1 4.36Å; M1065-F1136 HydrophobicContact CE-CD2 3.82Å; M1065-F1136 HydrophobicContact CE-CG 3.65Å; M1065-F1136 HydrophobicContact SD-CB 4.38Å; M1065-F1137 HydrophobicContact CG-CD1 4.46Å; M1065-F1137 HydrophobicContact CG-CE1 4.22Å; M1065-F1137 HydrophobicContact SD-CD1 4.26Å; M1065-F1137 HydrophobicContact SD-CE1 3.97Å
1066	D	97.9	Very high	97.3	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.053	19%	0.191	C	C	.	.			trans	-78.6	90.1	173.9	-174.5	-13.7	0	0	0	108.3	R1019 Y1062 G1069 D1070 G1071 L1073	R1019-D1066 PolarHBondContact NH2-O 3.3Å; Y1062-D1066 HydrophobicContact CD1-CB 4.16Å; Y1062-D1066 HydrophobicContact CE1-CB 4.02Å; Y1062-D1066 WeakPolarHBondContact CE1-OD2 3.29Å; Y1062-D1066 WeakPolarHBondContact O-CB 3.48Å; Y1062-D1066 PolarHBondContact O-N 3.12Å; D1066-G1069 WeakPolarHBondContact OD1-CA 3.32Å; D1066-G1069 PolarHBondContact OD1-N 2.96Å; D1066-D1070 PolarHBondContact OD1-N 3.46Å; D1066-G1071 VanDerWaalsContact OD2-CA 3.25Å; D1066-G1071 WeakPolarHBondContact OD2-CA 3.35Å; D1066-G1071 PolarHBondContact OD2-N 3.2Å; D1066-L1073 HydrophobicContact CB-CD2 3.98Å
1067	V	96.6	Very high	97.3	Very high	60 Å²	60	35.1 Å²	35.1	36%	0.364	19%	0.192	S	C	.	.	S	Bend	trans	-77.2	-40	-166.8	-179.7	0	0	0	0	111.5	R1019 M1065 E1077 F1081	R1019-V1067 PolarHBondContact NH1-O 3.19Å; M1065-V1067 PolarHBondContact O-N 3.34Å; V1067-E1077 HydrophobicContact CB-CG 4.1Å; V1067-E1077 HydrophobicContact CG2-CG 3.96Å; V1067-E1077 PolarHBondContact N-OE1 2.9Å; V1067-F1081 HydrophobicContact CG2-CE2 3.95Å; V1067-F1081 HydrophobicContact CG2-CZ 4.01Å
1068	D	95.8	Very high	97.3	Very high	118 Å²	118	35.2 Å²	35.2	63%	0.631	19%	0.193	S	C	*	.	S	Bend	trans	-93.7	-18.6	-179.6	74.9	15.8	0	0	0	114.5	D1070	D1068-D1070 WeakPolarHBondContact OD1-CB 3.41Å; D1068-D1070 PolarHBondContact OD1-N 2.95Å
1069	G	96.1	Very high	97.2	Very high	36 Å²	36	39.7 Å²	39.7	37%	0.371	21%	0.213	S	C	.	.			trans	87.6	16.4	176.4	0	0	0	0	0	114.9	D1066 G1071	D1066-G1069 WeakPolarHBondContact OD1-CA 3.32Å; D1066-G1069 PolarHBondContact OD1-N 2.96Å; G1069-G1071 PolarHBondContact O-N 3.31Å
1070	D	96.4	Very high	97.2	Very high	100 Å²	100	42.9 Å²	42.9	54%	0.535	23%	0.225	S	C	.	.	S	Bend	trans	-70.3	-14.6	177.5	114.5	-32	0	0	0	113.9	D1066 D1068 V1072	D1066-D1070 PolarHBondContact OD1-N 3.46Å; D1068-D1070 WeakPolarHBondContact OD1-CB 3.41Å; D1068-D1070 PolarHBondContact OD1-N 2.95Å; D1070-V1072 WeakPolarHBondContact OD1-CA 3.49Å; D1070-V1072 WeakPolarHBondContact OD1-CB 3.44Å; D1070-V1072 PolarHBondContact OD1-N 3.18Å
1071	G	96.8	Very high	97.2	Very high	22 Å²	22	42.7 Å²	42.7	23%	0.227	23%	0.225	C	C	.	.	S	Bend	trans	91	10.1	-179.4	0	0	0	0	0	114.4	Y1062 D1066 G1069	Y1062-G1071 PolarHBondContact OH-O 3.06Å; D1066-G1071 VanDerWaalsContact OD2-CA 3.25Å; D1066-G1071 WeakPolarHBondContact OD2-CA 3.35Å; D1066-G1071 PolarHBondContact OD2-N 3.2Å; G1069-G1071 PolarHBondContact O-N 3.31Å
1072	V	97.6	Very high	97.1	Very high	21 Å²	21	42.8 Å²	42.8	13%	0.127	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	119.9	179.2	-173.1	0	0	0	0	111.5	Y1062 D1070 S1074 K1117 T1119	Y1062-V1072 VanDerWaalsContact OH-CA 3.27Å; Y1062-V1072 WeakPolarHBondContact OH-CA 3.21Å; Y1062-V1072 PolarHBondContact OH-N 3.35Å; D1070-V1072 WeakPolarHBondContact OD1-CA 3.49Å; D1070-V1072 WeakPolarHBondContact OD1-CB 3.44Å; D1070-V1072 PolarHBondContact OD1-N 3.18Å; V1072-S1074 PolarHBondContact O-N 2.99Å; V1072-K1117 HydrophobicContact CG1-CB 3.48Å; V1072-K1117 VanDerWaalsContact CG1-CB 3.48Å; V1072-K1117 HydrophobicContact CG1-CD 4.17Å; V1072-K1117 HydrophobicContact CG1-CG 3.73Å; V1072-T1119 HydrophobicContact CG2-CG2 4.37Å
1073	L	97.9	Very high	97.1	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	112.9	171.2	-54.8	-177.4	0	0	0	110.2	Y1062 M1065 D1066 L1078 I1118 L1123 F1132	Y1062-L1073 HydrophobicContact CD2-CD1 4.07Å; Y1062-L1073 HydrophobicContact CD2-CD2 4.42Å; Y1062-L1073 HydrophobicContact CD2-CG 4.17Å; Y1062-L1073 HydrophobicContact CE2-CD1 3.85Å; Y1062-L1073 HydrophobicContact CE2-CD2 4.07Å; Y1062-L1073 HydrophobicContact CE2-CG 3.56Å; Y1062-L1073 PolarHBondContact OH-N 3.02Å; M1065-L1073 VanDerWaalsContact C-CD2 3.45Å; M1065-L1073 HydrophobicContact CB-CD1 4.17Å; M1065-L1073 HydrophobicContact CB-CD2 3.65Å; M1065-L1073 HydrophobicContact SD-CD1 4.4Å; D1066-L1073 HydrophobicContact CB-CD2 3.98Å; L1073-L1078 HydrophobicContact CB-CD2 4.21Å; L1073-L1078 HydrophobicContact CD1-CD2 4.32Å; L1073-I1118 HydrophobicContact CB-CB 4.28Å; L1073-I1118 HydrophobicContact CB-CG2 4.49Å; L1073-I1118 HydrophobicContact CD1-CG2 4.28Å; L1073-I1118 PolarHBondContact N-O 3.39Å; L1073-L1123 HydrophobicContact CD1-CD1 4.07Å; L1073-F1132 HydrophobicContact CD1-CE1 3.82Å; L1073-F1132 HydrophobicContact CD1-CZ 3.94Å
1074	S	94.9	Very high	97.1	Very high	41 Å²	41	44.6 Å²	44.6	29%	0.287	24%	0.237	S	C	.	.			trans	-87.6	162	179.7	77.1	0	0	0	0	112	V1072 F1076 E1077 L1078	V1072-S1074 PolarHBondContact O-N 2.99Å; S1074-F1076 PolarHBondContact O-N 2.78Å; S1074-E1077 WeakPolarHBondContact CA-OE2 3.48Å; S1074-E1077 WeakPolarHBondContact CB-OE2 3.2Å; S1074-E1077 PolarHBondContact N-OE2 3.19Å; S1074-E1077 PolarHBondContact O-N 3.17Å; S1074-E1077 PolarHBondContact OG-N 2.78Å; S1074-E1077 PolarHBondContact OG-OE2 3.11Å; S1074-L1078 WeakPolarHBondContact O-CG 3.39Å; S1074-L1078 PolarHBondContact O-N 3.38Å; S1074-L1078 VanDerWaalsContact O-N 3.13Å
1075	M	94.4	Very high	96.9	Very high	63 Å²	63	44.6 Å²	44.6	31%	0.31	24%	0.237	S	C	.	.	H	α-helix	trans	-60.5	-29.9	177.8	-54.6	-49.4	178.7	0	0	112.9	L1078 E1079 F1099 L1103 L1107 G1116	M1075-L1078 HydrophobicContact SD-CD1 4.43Å; M1075-E1079 VanDerWaalsContact O-CB 3.26Å; M1075-E1079 WeakPolarHBondContact O-CB 3.47Å; M1075-E1079 PolarHBondContact O-N 3.34Å; M1075-F1099 WeakPolarHBondContact O-CZ 3.09Å; M1075-L1103 HydrophobicContact CE-CD1 4.06Å; M1075-L1103 HydrophobicContact CE-CD2 4.09Å; M1075-L1103 HydrophobicContact CG-CD2 4.36Å; M1075-L1103 HydrophobicContact SD-CD1 3.47Å; M1075-L1103 WeakPolarHBondContact SD-CD1 3.43Å; M1075-L1103 HydrophobicContact SD-CD2 3.52Å; M1075-L1103 VanDerWaalsContact SD-CD2 3.52Å; M1075-L1103 HydrophobicContact SD-CG 4.11Å; M1075-L1107 HydrophobicContact CE-CD1 4.39Å; M1075-G1116 VanDerWaalsContact CE-CA 3.5Å
1076	F	95.9	Very high	96.8	Very high	152 Å²	152	45.9 Å²	45.9	67%	0.667	25%	0.246	S	C	*	.	H	α-helix	trans	-68.5	-39.6	178.5	173.7	-103.2	0	0	0	111.9	S1074 Y1080	S1074-F1076 PolarHBondContact O-N 2.78Å; F1076-Y1080 VanDerWaalsContact O-CB 3.22Å; F1076-Y1080 WeakPolarHBondContact O-CB 3.4Å; F1076-Y1080 PolarHBondContact O-N 3.29Å
1077	E	97.6	Very high	96.7	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.028	26%	0.263	C	S	.	.	H	α-helix	trans	-72.6	-40.9	178.2	-66.1	154.8	118	0	0	111.2	V1067 S1074 E1079 Y1080 F1081	V1067-E1077 HydrophobicContact CB-CG 4.1Å; V1067-E1077 HydrophobicContact CG2-CG 3.96Å; V1067-E1077 PolarHBondContact N-OE1 2.9Å; S1074-E1077 WeakPolarHBondContact CA-OE2 3.48Å; S1074-E1077 WeakPolarHBondContact CB-OE2 3.2Å; S1074-E1077 PolarHBondContact N-OE2 3.19Å; S1074-E1077 PolarHBondContact O-N 3.17Å; S1074-E1077 PolarHBondContact OG-N 2.78Å; S1074-E1077 PolarHBondContact OG-OE2 3.11Å; E1077-E1079 VanDerWaalsContact C-N 3.34Å; E1077-E1079 PolarHBondContact O-N 3.24Å; E1077-Y1080 WeakPolarHBondContact O-CB 3.42Å; E1077-Y1080 PolarHBondContact O-N 3.04Å; E1077-F1081 WeakPolarHBondContact O-CD2 3.42Å; E1077-F1081 PolarHBondContact O-N 2.94Å
1078	L	97.6	Very high	96.6	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-62	-41.6	174.4	-60.5	-179	0	0	0	111.7	M1065 L1073 S1074 M1075 Y1082 F1099 L1103 I1118 F1132 F1136	M1065-L1078 HydrophobicContact CE-CD2 3.7Å; L1073-L1078 HydrophobicContact CB-CD2 4.21Å; L1073-L1078 HydrophobicContact CD1-CD2 4.32Å; S1074-L1078 WeakPolarHBondContact O-CG 3.39Å; S1074-L1078 PolarHBondContact O-N 3.38Å; S1074-L1078 VanDerWaalsContact O-N 3.13Å; M1075-L1078 HydrophobicContact SD-CD1 4.43Å; L1078-Y1082 VanDerWaalsContact O-CB 3.26Å; L1078-Y1082 WeakPolarHBondContact O-CB 3.36Å; L1078-Y1082 PolarHBondContact O-N 2.86Å; L1078-F1099 HydrophobicContact CB-CE2 3.95Å; L1078-F1099 HydrophobicContact CB-CZ 3.96Å; L1078-L1103 HydrophobicContact CD1-CD1 4.17Å; L1078-I1118 HydrophobicContact CD1-CD1 4.23Å; L1078-F1132 HydrophobicContact CD2-CE1 4.49Å; L1078-F1132 HydrophobicContact CD2-CZ 3.76Å; L1078-F1136 HydrophobicContact CB-CE1 3.78Å; L1078-F1136 HydrophobicContact CB-CZ 3.96Å; L1078-F1136 HydrophobicContact CD1-CZ 4.39Å; L1078-F1136 HydrophobicContact CD2-CD2 4.27Å; L1078-F1136 HydrophobicContact CD2-CE1 4.18Å; L1078-F1136 HydrophobicContact CD2-CE2 3.92Å; L1078-F1136 HydrophobicContact CD2-CZ 3.88Å; L1078-F1136 HydrophobicContact CG-CE1 4.49Å; L1078-F1136 HydrophobicContact CG-CZ 4.28Å; L1078-F1136 WeakPolarHBondContact O-CD1 3.49Å; L1078-F1136 VanDerWaalsContact O-CE1 3.3Å; L1078-F1136 WeakPolarHBondContact O-CE1 3.38Å
1079	E	97.4	Very high	96.6	Very high	103 Å²	103	42.6 Å²	42.6	48%	0.481	22%	0.221	S	C	.	.	H	α-helix	trans	-65.5	-41.1	173.5	-165.4	162.8	-136.5	0	0	111.2	M1075 E1077 F1081 Y1082 E1083 F1099	M1075-E1079 VanDerWaalsContact O-CB 3.26Å; M1075-E1079 WeakPolarHBondContact O-CB 3.47Å; M1075-E1079 PolarHBondContact O-N 3.34Å; E1077-E1079 VanDerWaalsContact C-N 3.34Å; E1077-E1079 PolarHBondContact O-N 3.24Å; E1079-F1081 PolarHBondContact O-N 3.31Å; E1079-Y1082 PolarHBondContact O-N 3.11Å; E1079-E1083 WeakPolarHBondContact O-CB 3.4Å; E1079-E1083 PolarHBondContact O-N 3.43Å; E1079-F1099 HydrophobicContact CB-CD1 3.98Å; E1079-F1099 HydrophobicContact CB-CE1 3.62Å; E1079-F1099 HydrophobicContact CB-CE2 4.18Å; E1079-F1099 HydrophobicContact CB-CG 4.43Å; E1079-F1099 HydrophobicContact CB-CZ 3.74Å; E1079-F1099 HydrophobicContact CG-CD1 3.8Å; E1079-F1099 HydrophobicContact CG-CE1 3.96Å; E1079-F1099 HydrophobicContact CG-CG 4.2Å; E1079-F1099 HydrophobicContact CG-CZ 4.46Å; E1079-F1099 WeakPolarHBondContact OE1-CD1 3.44Å
1080	Y	97.8	Very high	96.5	Very high	82 Å²	82	47.1 Å²	47.1	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-61.2	-42.4	177.5	168.3	-99	0	0	0	113.5	R1015 F1076 E1077	R1015-Y1080 HydrophobicContact CB-CE1 4Å; R1015-Y1080 WeakPolarHBondContact CD-O 3.43Å; R1015-Y1080 HydrophobicContact CG-CE1 4.17Å; R1015-Y1080 HydrophobicContact CG-CE2 4.23Å; R1015-Y1080 VanDerWaalsContact NH1-CD2 3.34Å; R1015-Y1080 PolarHBondContact NH1-O 3.47Å; F1076-Y1080 VanDerWaalsContact O-CB 3.22Å; F1076-Y1080 WeakPolarHBondContact O-CB 3.4Å; F1076-Y1080 PolarHBondContact O-N 3.29Å; E1077-Y1080 WeakPolarHBondContact O-CB 3.42Å; E1077-Y1080 PolarHBondContact O-N 3.04Å
1081	F	98.1	Very high	96.4	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-74	-39.2	174.5	-69	-71.2	0	0	0	111.7	R1015 I1016 R1019 M1065 V1067 E1077 E1079 E1083 E1084 F1136	R1015-F1081 HydrophobicContact CB-CD1 4.03Å; R1015-F1081 HydrophobicContact CB-CE1 4.16Å; I1016-F1081 HydrophobicContact CD1-CD1 4.18Å; I1016-F1081 HydrophobicContact CD1-CE1 3.7Å; I1016-F1081 HydrophobicContact CD1-CZ 4.18Å; R1019-F1081 HydrophobicContact CG-CE1 4.19Å; R1019-F1081 HydrophobicContact CG-CZ 4.05Å; M1065-F1081 HydrophobicContact CB-CD2 4.5Å; M1065-F1081 HydrophobicContact CB-CE2 4.08Å; M1065-F1081 HydrophobicContact CE-CD2 3.89Å; M1065-F1081 HydrophobicContact CE-CG 4.42Å; M1065-F1081 HydrophobicContact CG-CD2 4.27Å; M1065-F1081 HydrophobicContact CG-CE2 4.15Å; V1067-F1081 HydrophobicContact CG2-CE2 3.95Å; V1067-F1081 HydrophobicContact CG2-CZ 4.01Å; E1077-F1081 WeakPolarHBondContact O-CD2 3.42Å; E1077-F1081 PolarHBondContact O-N 2.94Å; E1079-F1081 PolarHBondContact O-N 3.31Å; F1081-E1083 PolarHBondContact O-N 3.41Å; F1081-E1084 PolarHBondContact O-N 3.37Å; F1081-F1136 HydrophobicContact CB-CB 4.14Å; F1081-F1136 HydrophobicContact CB-CD1 4.42Å
1082	Y	97.9	Very high	96.2	Very high	2 Å²	2	54 Å²	54	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-70.5	-28.4	-177.4	-166.3	-119.1	0	0	0	114.2	L1078 E1079 E1084 Q1085 C1086 L1097 F1099 L1102	L1078-Y1082 VanDerWaalsContact O-CB 3.26Å; L1078-Y1082 WeakPolarHBondContact O-CB 3.36Å; L1078-Y1082 PolarHBondContact O-N 2.86Å; E1079-Y1082 PolarHBondContact O-N 3.11Å; Y1082-E1084 VanDerWaalsContact C-N 3.3Å; Y1082-E1084 PolarHBondContact O-N 2.68Å; Y1082-Q1085 HydrophobicContact CD2-CB 3.8Å; Y1082-Q1085 HydrophobicContact CD2-CG 4.33Å; Y1082-Q1085 HydrophobicContact CE2-CB 4.03Å; Y1082-Q1085 WeakPolarHBondContact O-CA 3.38Å; Y1082-Q1085 WeakPolarHBondContact O-CB 3.24Å; Y1082-Q1085 PolarHBondContact O-N 3.4Å; Y1082-C1086 WeakPolarHBondContact CE1-SG 3.46Å; Y1082-C1086 PolarHBondContact O-N 2.66Å; Y1082-C1086 PolarHBondContact O-SG 2.92Å; Y1082-L1097 WeakPolarHBondContact CE1-O 3.3Å; Y1082-L1097 PolarHBondContact OH-N 3.33Å; Y1082-L1097 PolarHBondContact OH-O 3.26Å; Y1082-F1099 HydrophobicContact CD1-CB 4.15Å; Y1082-F1099 AromaticContact CD1-CD2 3.94Å; Y1082-F1099 HydrophobicContact CD1-CD2 3.94Å; Y1082-F1099 HydrophobicContact CG-CD2 4.41Å; Y1082-L1102 HydrophobicContact CD1-CD2 3.7Å; Y1082-L1102 HydrophobicContact CD2-CD2 3.4Å; Y1082-L1102 VanDerWaalsContact CD2-CD2 3.4Å; Y1082-L1102 HydrophobicContact CE1-CB 4.5Å; Y1082-L1102 HydrophobicContact CE1-CD2 3.63Å; Y1082-L1102 HydrophobicContact CE2-CD2 3.38Å; Y1082-L1102 HydrophobicContact CG-CD2 3.59Å; Y1082-L1102 VanDerWaalsContact CZ-CD2 3.5Å
1083	E	97.8	Very high	96.1	Very high	107 Å²	107	56.3 Å²	56.3	50%	0.5	28%	0.279	S	S	.	.	H	α-helix	trans	-55.6	-42.4	176.2	-174.4	-177.4	-131.1	0	0	112.1	R1015 E1079 F1081 C1086 E1087	R1015-E1083 IonicContact CZ-OE2 2.65Å; R1015-E1083 IonicContact NH1-OE2 3.69Å; R1015-E1083 PolarHBondContact NH1-OE2 3.34Å; R1015-E1083 IonicContact NH2-OE2 2.73Å; R1015-E1083 PolarHBondContact NH2-OE2 3.07Å; E1079-E1083 WeakPolarHBondContact O-CB 3.4Å; E1079-E1083 PolarHBondContact O-N 3.43Å; F1081-E1083 PolarHBondContact O-N 3.41Å; E1083-C1086 WeakPolarHBondContact O-CB 3.16Å; E1083-C1086 PolarHBondContact O-N 3.34Å; E1083-E1087 PolarHBondContact O-N 2.68Å; E1083-E1087 VanDerWaalsContact O-N 3.17Å
1084	E	97.1	Very high	95.9	Very high	10 Å²	10	59.3 Å²	59.3	5%	0.047	29%	0.294	C	S	.	.	H	α-helix	trans	-69.4	-35.8	175	-167.4	-177.2	163.8	0	0	112	S1013 N1014 R1015 F1081 Y1082 C1086 E1087 R1088	S1013-E1084 WeakPolarHBondContact CB-OE2 3.29Å; N1014-E1084 WeakPolarHBondContact CB-OE1 3.24Å; N1014-E1084 PolarHBondContact N-OE1 3.23Å; N1014-E1084 PolarHBondContact N-OE2 3.21Å; N1014-E1084 VanDerWaalsContact N-OE2 3.12Å; N1014-E1084 PolarHBondContact ND2-OE1 2.84Å; R1015-E1084 WeakPolarHBondContact CB-OE2 3.29Å; R1015-E1084 VanDerWaalsContact CG-OE2 3.25Å; R1015-E1084 WeakPolarHBondContact CG-OE2 3.39Å; R1015-E1084 PolarHBondContact N-OE2 2.56Å; R1015-E1084 IonicContact NE-OE2 2.74Å; F1081-E1084 PolarHBondContact O-N 3.37Å; Y1082-E1084 VanDerWaalsContact C-N 3.3Å; Y1082-E1084 PolarHBondContact O-N 2.68Å; E1084-C1086 VanDerWaalsContact C-N 3.33Å; E1084-C1086 PolarHBondContact O-N 2.69Å; E1084-E1087 PolarHBondContact O-N 2.6Å; E1084-R1088 HydrophobicContact CG-CG 4.32Å; E1084-R1088 WeakPolarHBondContact O-CG 3.31Å; E1084-R1088 PolarHBondContact O-N 3.35Å
1085	Q	95.4	Very high	95.9	Very high	1 Å²	1	66 Å²	66	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-41.2	175.8	-62	-73.5	85.5	0	0	111	Y1082 R1088 M1089 D1134 T1135 F1136	Y1082-Q1085 HydrophobicContact CD2-CB 3.8Å; Y1082-Q1085 HydrophobicContact CD2-CG 4.33Å; Y1082-Q1085 HydrophobicContact CE2-CB 4.03Å; Y1082-Q1085 WeakPolarHBondContact O-CA 3.38Å; Y1082-Q1085 WeakPolarHBondContact O-CB 3.24Å; Y1082-Q1085 PolarHBondContact O-N 3.4Å; Q1085-R1088 PolarHBondContact O-N 3.15Å; Q1085-M1089 WeakPolarHBondContact O-CB 3.49Å; Q1085-M1089 VanDerWaalsContact O-CG 3.3Å; Q1085-M1089 WeakPolarHBondContact O-CG 3.47Å; Q1085-M1089 PolarHBondContact O-N 3.48Å; Q1085-D1134 PolarHBondContact NE2-O 3.49Å; Q1085-T1135 PolarHBondContact NE2-O 2.84Å; Q1085-T1135 VanDerWaalsContact NE2-O 3.13Å; Q1085-F1136 WeakPolarHBondContact CG-O 3.24Å
1086	C	96.4	Very high	95.9	Very high	27 Å²	27	64.1 Å²	64.1	18%	0.182	31%	0.313	C	S	.	.	H	α-helix	trans	-56.5	-53.3	171.3	-67.8	0	0	0	0	111.5	Y1082 E1083 E1084 R1088 M1089 E1090 P1096	Y1082-C1086 WeakPolarHBondContact CE1-SG 3.46Å; Y1082-C1086 PolarHBondContact O-N 2.66Å; Y1082-C1086 PolarHBondContact O-SG 2.92Å; E1083-C1086 WeakPolarHBondContact O-CB 3.16Å; E1083-C1086 PolarHBondContact O-N 3.34Å; E1084-C1086 VanDerWaalsContact C-N 3.33Å; E1084-C1086 PolarHBondContact O-N 2.69Å; C1086-R1088 PolarHBondContact O-N 3.09Å; C1086-M1089 PolarHBondContact O-N 3.22Å; C1086-E1090 WeakPolarHBondContact O-CG 3.41Å; C1086-E1090 PolarHBondContact O-N 3.08Å; C1086-P1096 HydrophobicContact CB-CB 4.11Å; C1086-P1096 HydrophobicContact CB-CG 4Å
1087	E	96.1	Very high	95.8	Very high	89 Å²	89	59.4 Å²	59.4	42%	0.416	29%	0.294	S	S	.	.	H	α-helix	trans	-57.9	-36.8	178.7	-68.5	-179.9	-166.9	0	0	112.9	E1083 E1084 R1091	E1083-E1087 PolarHBondContact O-N 2.68Å; E1083-E1087 VanDerWaalsContact O-N 3.17Å; E1084-E1087 PolarHBondContact O-N 2.6Å; E1087-R1091 WeakPolarHBondContact O-CB 3.42Å; E1087-R1091 VanDerWaalsContact O-CG 3.29Å; E1087-R1091 WeakPolarHBondContact O-CG 3.35Å; E1087-R1091 PolarHBondContact O-N 3.26Å; E1087-R1091 VanDerWaalsContact O-N 3.1Å; E1087-R1091 PolarHBondContact O-NE 3.03Å; E1087-R1091 IonicContact OE2-NH2 3.5Å; E1087-R1091 PolarHBondContact OE2-NH2 3.29Å
1088	R	94.1	Very high	95.7	Very high	22 Å²	22	62.9 Å²	62.9	8%	0.083	32%	0.318	C	S	.	.	H	α-helix	trans	-73	-40.1	179.2	-66	168.4	73.5	-162.6	5.8	111.4	H1010 A1011 E1084 Q1085 C1086 R1091 M1092 F1137 L1139	H1010-R1088 PolarHBondContact O-NH2 2.86Å; A1011-R1088 PolarHBondContact O-NH1 3.13Å; A1011-R1088 VanDerWaalsContact O-NH1 3.12Å; A1011-R1088 PolarHBondContact O-NH2 3.4Å; E1084-R1088 HydrophobicContact CG-CG 4.32Å; E1084-R1088 WeakPolarHBondContact O-CG 3.31Å; E1084-R1088 PolarHBondContact O-N 3.35Å; Q1085-R1088 PolarHBondContact O-N 3.15Å; C1086-R1088 PolarHBondContact O-N 3.09Å; R1088-R1091 PolarHBondContact O-N 3.36Å; R1088-M1092 PolarHBondContact O-N 3.15Å; R1088-F1137 PolarHBondContact NH1-O 2.7Å; R1088-L1139 HydrophobicContact CB-CD2 3.38Å; R1088-L1139 HydrophobicContact CG-CD2 4.39Å
1089	M	94.5	Very high	95.7	Very high	8 Å²	8	64.4 Å²	64.4	4%	0.039	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-47.3	172.8	-72.8	178.2	75.6	0	0	111.5	Q1085 C1086 R1091 M1092 G1093 I1094 P1096 L1139 Y1142	Q1085-M1089 WeakPolarHBondContact O-CB 3.49Å; Q1085-M1089 VanDerWaalsContact O-CG 3.3Å; Q1085-M1089 WeakPolarHBondContact O-CG 3.47Å; Q1085-M1089 PolarHBondContact O-N 3.48Å; C1086-M1089 PolarHBondContact O-N 3.22Å; M1089-R1091 VanDerWaalsContact C-N 3.31Å; M1089-R1091 PolarHBondContact O-N 2.88Å; M1089-M1092 CarbonylContact O-C 3.56Å; M1089-M1092 PolarHBondContact O-N 3.42Å; M1089-G1093 PolarHBondContact O-N 3.48Å; M1089-I1094 CarbonylContact C-O 3.57Å; M1089-I1094 VanDerWaalsContact C-O 3.23Å; M1089-I1094 HydrophobicContact CB-CB 4.22Å; M1089-I1094 HydrophobicContact CE-CB 4.37Å; M1089-I1094 HydrophobicContact CE-CG2 3.61Å; M1089-I1094 PolarHBondContact O-N 3.25Å; M1089-P1096 HydrophobicContact CB-CB 4.31Å; M1089-P1096 HydrophobicContact CE-CB 4.4Å; M1089-P1096 HydrophobicContact SD-CB 4.04Å; M1089-L1139 HydrophobicContact CG-CD1 3.58Å; M1089-L1139 HydrophobicContact SD-CD1 4.37Å; M1089-Y1142 HydrophobicContact CE-CE1 4.12Å; M1089-Y1142 HydrophobicContact SD-CE1 4.04Å
1090	E	95.7	Very high	95.7	Very high	131 Å²	131	66.8 Å²	66.8	61%	0.612	34%	0.335	S	S	*	.	H	α-helix	trans	-60	-39.5	177.3	-74	-176	-178.8	0	0	112.1	C1086 M1092 G1093 I1094 P1096	C1086-E1090 WeakPolarHBondContact O-CG 3.41Å; C1086-E1090 PolarHBondContact O-N 3.08Å; E1090-M1092 PolarHBondContact O-N 3.41Å; E1090-G1093 PolarHBondContact O-N 3.04Å; E1090-I1094 PolarHBondContact N-O 3.27Å; E1090-P1096 HydrophobicContact CG-CG 4.1Å
1091	R	94	Very high	95.6	Very high	160 Å²	160	67 Å²	67	60%	0.604	34%	0.342	S	S	*	.	H	α-helix	trans	-61.1	-27	174.4	-84.2	175.5	-89.1	154.1	-19.5	113.6	E1087 R1088 M1089	E1087-R1091 WeakPolarHBondContact O-CB 3.42Å; E1087-R1091 VanDerWaalsContact O-CG 3.29Å; E1087-R1091 WeakPolarHBondContact O-CG 3.35Å; E1087-R1091 PolarHBondContact O-N 3.26Å; E1087-R1091 VanDerWaalsContact O-N 3.1Å; E1087-R1091 PolarHBondContact O-NE 3.03Å; E1087-R1091 IonicContact OE2-NH2 3.5Å; E1087-R1091 PolarHBondContact OE2-NH2 3.29Å; R1088-R1091 PolarHBondContact O-N 3.36Å; M1089-R1091 VanDerWaalsContact C-N 3.31Å; M1089-R1091 PolarHBondContact O-N 2.88Å
1092	M	92.4	Very high	95.5	Very high	106 Å²	106	67 Å²	67	52%	0.522	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	2.1	173.2	-61.3	-172.1	-57.5	0	0	113.3	R1088 M1089 E1090 I1094 L1139 L1143	R1088-M1092 PolarHBondContact O-N 3.15Å; M1089-M1092 CarbonylContact O-C 3.56Å; M1089-M1092 PolarHBondContact O-N 3.42Å; E1090-M1092 PolarHBondContact O-N 3.41Å; M1092-I1094 VanDerWaalsContact C-N 3.32Å; M1092-I1094 HydrophobicContact CB-CD1 4.42Å; M1092-I1094 HydrophobicContact CB-CG1 4.24Å; M1092-I1094 HydrophobicContact CE-CD1 4.01Å; M1092-L1139 HydrophobicContact CE-CD1 4.32Å; M1092-L1139 HydrophobicContact CE-CD2 3.55Å; M1092-L1139 HydrophobicContact CE-CG 3.98Å; M1092-L1143 HydrophobicContact CE-CD1 3.61Å
1093	G	94.3	Very high	95.4	Very high	70 Å²	70	68.1 Å²	68.1	72%	0.722	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	18.5	-177.2	0	0	0	0	0	114.3	M1089 E1090	M1089-G1093 PolarHBondContact O-N 3.48Å; E1090-G1093 PolarHBondContact O-N 3.04Å
1094	I	94.1	Very high	95.2	Very high	63 Å²	63	66.3 Å²	66.3	32%	0.323	35%	0.347	S	S	.	.			trans	-94	126.3	174	-49.8	-179.4	0	0	0	107.9	M1089 E1090 M1092 P1096 L1143	M1089-I1094 CarbonylContact C-O 3.57Å; M1089-I1094 VanDerWaalsContact C-O 3.23Å; M1089-I1094 HydrophobicContact CB-CB 4.22Å; M1089-I1094 HydrophobicContact CE-CB 4.37Å; M1089-I1094 HydrophobicContact CE-CG2 3.61Å; M1089-I1094 PolarHBondContact O-N 3.25Å; E1090-I1094 PolarHBondContact N-O 3.27Å; M1092-I1094 VanDerWaalsContact C-N 3.32Å; M1092-I1094 HydrophobicContact CB-CD1 4.42Å; M1092-I1094 HydrophobicContact CB-CG1 4.24Å; M1092-I1094 HydrophobicContact CE-CD1 4.01Å; I1094-P1096 VanDerWaalsContact O-CD 3.32Å; I1094-P1096 WeakPolarHBondContact O-CD 3.5Å; I1094-L1143 HydrophobicContact CD1-CD1 3.87Å; I1094-L1143 HydrophobicContact CD1-CD2 3.79Å
1095	E	94.6	Very high	95.1	Very high	181 Å²	181	70.4 Å²	70.4	85%	0.846	37%	0.366	S	S	*	.			trans	-73.6	115.3	175.1	-172.8	172.3	-174.3	0	0	109.1
1096	P	94.8	Very high	95.1	Very high	24 Å²	24	70.8 Å²	70.8	16%	0.156	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-73.1	154.2	-180	30.7	-34.8	0	0	0	111.4	C1086 M1089 E1090 I1094	C1086-P1096 HydrophobicContact CB-CB 4.11Å; C1086-P1096 HydrophobicContact CB-CG 4Å; M1089-P1096 HydrophobicContact CB-CB 4.31Å; M1089-P1096 HydrophobicContact CE-CB 4.4Å; M1089-P1096 HydrophobicContact SD-CB 4.04Å; E1090-P1096 HydrophobicContact CG-CG 4.1Å; I1094-P1096 VanDerWaalsContact O-CD 3.32Å; I1094-P1096 WeakPolarHBondContact O-CD 3.5Å
1097	L	94.3	Very high	95.1	Very high	53 Å²	53	71.6 Å²	71.6	28%	0.277	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-73.3	139	175.4	-173.2	69.4	0	0	0	109.5	Y1082 F1099 D1101 L1102 Q1105	Y1082-L1097 WeakPolarHBondContact CE1-O 3.3Å; Y1082-L1097 PolarHBondContact OH-N 3.33Å; Y1082-L1097 PolarHBondContact OH-O 3.26Å; L1097-F1099 PolarHBondContact O-N 3.07Å; L1097-D1101 HydrophobicContact CD1-CB 4.07Å; L1097-D1101 HydrophobicContact CD2-CB 4.22Å; L1097-D1101 HydrophobicContact CG-CB 4.02Å; L1097-L1102 HydrophobicContact CD2-CB 4Å; L1097-Q1105 VanDerWaalsContact CD2-NE2 3.28Å
1098	P	96.5	Very high	95	Very high	79 Å²	79	73 Å²	73	51%	0.513	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-57.9	134.9	174.5	-25.3	35.7	0	0	0	111.4	Q1100 D1101 L1102	P1098-Q1100 PolarHBondContact O-N 2.87Å; P1098-D1101 PolarHBondContact O-N 2.94Å; P1098-L1102 PolarHBondContact O-N 2.81Å
1099	F	97.2	Very high	95.1	Very high	35 Å²	35	73.7 Å²	73.7	15%	0.154	39%	0.385	C	S	.	.	H	α-helix	trans	-52.6	-35.4	-175.1	174.3	-114.7	0	0	0	113.5	M1075 L1078 E1079 Y1082 L1097 D1101 L1102 L1103 F1136	M1075-F1099 WeakPolarHBondContact O-CZ 3.09Å; L1078-F1099 HydrophobicContact CB-CE2 3.95Å; L1078-F1099 HydrophobicContact CB-CZ 3.96Å; E1079-F1099 HydrophobicContact CB-CD1 3.98Å; E1079-F1099 HydrophobicContact CB-CE1 3.62Å; E1079-F1099 HydrophobicContact CB-CE2 4.18Å; E1079-F1099 HydrophobicContact CB-CG 4.43Å; E1079-F1099 HydrophobicContact CB-CZ 3.74Å; E1079-F1099 HydrophobicContact CG-CD1 3.8Å; E1079-F1099 HydrophobicContact CG-CE1 3.96Å; E1079-F1099 HydrophobicContact CG-CG 4.2Å; E1079-F1099 HydrophobicContact CG-CZ 4.46Å; E1079-F1099 WeakPolarHBondContact OE1-CD1 3.44Å; Y1082-F1099 HydrophobicContact CD1-CB 4.15Å; Y1082-F1099 AromaticContact CD1-CD2 3.94Å; Y1082-F1099 HydrophobicContact CD1-CD2 3.94Å; Y1082-F1099 HydrophobicContact CG-CD2 4.41Å; L1097-F1099 PolarHBondContact O-N 3.07Å; F1099-D1101 PolarHBondContact O-N 3.46Å; F1099-L1102 PolarHBondContact O-N 2.91Å; F1099-L1103 HydrophobicContact CE1-CD2 4.36Å; F1099-L1103 HydrophobicContact CE2-CB 4.47Å; F1099-L1103 HydrophobicContact CZ-CB 4.44Å; F1099-L1103 HydrophobicContact CZ-CD2 4.36Å; F1099-L1103 WeakPolarHBondContact O-CB 3.38Å; F1099-L1103 PolarHBondContact O-N 3.14Å; F1099-F1136 HydrophobicContact CE2-CE1 4.38Å
1100	Q	96.1	Very high	95.2	Very high	152 Å²	152	73.4 Å²	73.4	71%	0.71	38%	0.384	S	S	*	.	H	α-helix	trans	-62.8	-38.5	176	-176.8	173.8	3.6	0	0	113.2	P1098 C1104	P1098-Q1100 PolarHBondContact O-N 2.87Å; Q1100-C1104 PolarHBondContact O-N 3.08Å; Q1100-C1104 PolarHBondContact O-SG 2.78Å
1101	D	96.6	Very high	95.2	Very high	87 Å²	87	73.9 Å²	73.9	47%	0.465	38%	0.384	S	S	.	.	H	α-helix	trans	-76.6	-39.9	178.7	-68.9	-42.5	0	0	0	110.7	L1097 P1098 F1099 C1104 Q1105	L1097-D1101 HydrophobicContact CD1-CB 4.07Å; L1097-D1101 HydrophobicContact CD2-CB 4.22Å; L1097-D1101 HydrophobicContact CG-CB 4.02Å; P1098-D1101 PolarHBondContact O-N 2.94Å; F1099-D1101 PolarHBondContact O-N 3.46Å; D1101-C1104 WeakPolarHBondContact O-CB 3.45Å; D1101-C1104 PolarHBondContact O-N 3.47Å; D1101-Q1105 PolarHBondContact O-N 2.92Å
1102	L	95.8	Very high	95.3	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-57.8	-48.4	170.7	172.8	62.2	0	0	0	111.3	Y1082 L1097 P1098 F1099 C1104 Q1105 M1106 T1135 F1136	Y1082-L1102 HydrophobicContact CD1-CD2 3.7Å; Y1082-L1102 HydrophobicContact CD2-CD2 3.4Å; Y1082-L1102 VanDerWaalsContact CD2-CD2 3.4Å; Y1082-L1102 HydrophobicContact CE1-CB 4.5Å; Y1082-L1102 HydrophobicContact CE1-CD2 3.63Å; Y1082-L1102 HydrophobicContact CE2-CD2 3.38Å; Y1082-L1102 HydrophobicContact CG-CD2 3.59Å; Y1082-L1102 VanDerWaalsContact CZ-CD2 3.5Å; L1097-L1102 HydrophobicContact CD2-CB 4Å; P1098-L1102 PolarHBondContact O-N 2.81Å; F1099-L1102 PolarHBondContact O-N 2.91Å; L1102-C1104 PolarHBondContact O-N 2.94Å; L1102-Q1105 CarbonylContact O-C 3.54Å; L1102-Q1105 WeakPolarHBondContact O-CA 3.34Å; L1102-Q1105 WeakPolarHBondContact O-CB 3.34Å; L1102-Q1105 PolarHBondContact O-N 2.93Å; L1102-M1106 HydrophobicContact CD1-CE 3.85Å; L1102-M1106 HydrophobicContact CD1-CG 3.73Å; L1102-M1106 HydrophobicContact CD1-SD 4.4Å; L1102-M1106 HydrophobicContact CG-CG 4.04Å; L1102-M1106 WeakPolarHBondContact O-CG 3.44Å; L1102-M1106 PolarHBondContact O-N 3.27Å; L1102-T1135 HydrophobicContact CD1-CG2 3.65Å; L1102-T1135 HydrophobicContact CD2-CG2 3.96Å; L1102-T1135 HydrophobicContact CG-CG2 4.44Å; L1102-F1136 HydrophobicContact CD2-CE1 4.22Å; L1102-F1136 HydrophobicContact CD2-CZ 4.39Å
1103	L	95.5	Very high	95.4	Very high	24 Å²	24	69.3 Å²	69.3	13%	0.126	37%	0.37	C	S	.	.	H	α-helix	trans	-58.6	-37	-178.8	175.1	61.3	0	0	0	111.4	M1075 L1078 F1099 M1106 L1107	M1075-L1103 HydrophobicContact CE-CD1 4.06Å; M1075-L1103 HydrophobicContact CE-CD2 4.09Å; M1075-L1103 HydrophobicContact CG-CD2 4.36Å; M1075-L1103 HydrophobicContact SD-CD1 3.47Å; M1075-L1103 WeakPolarHBondContact SD-CD1 3.43Å; M1075-L1103 HydrophobicContact SD-CD2 3.52Å; M1075-L1103 VanDerWaalsContact SD-CD2 3.52Å; M1075-L1103 HydrophobicContact SD-CG 4.11Å; L1078-L1103 HydrophobicContact CD1-CD1 4.17Å; F1099-L1103 HydrophobicContact CE1-CD2 4.36Å; F1099-L1103 HydrophobicContact CE2-CB 4.47Å; F1099-L1103 HydrophobicContact CZ-CB 4.44Å; F1099-L1103 HydrophobicContact CZ-CD2 4.36Å; F1099-L1103 WeakPolarHBondContact O-CB 3.38Å; F1099-L1103 PolarHBondContact O-N 3.14Å; L1103-M1106 PolarHBondContact O-N 3.42Å; L1103-L1107 HydrophobicContact CD1-CD1 3.95Å; L1103-L1107 HydrophobicContact CD1-CG 3.99Å; L1103-L1107 HydrophobicContact CG-CD1 3.95Å; L1103-L1107 HydrophobicContact CG-CG 4.43Å; L1103-L1107 WeakPolarHBondContact O-CB 3.26Å; L1103-L1107 VanDerWaalsContact O-CG 3.24Å; L1103-L1107 WeakPolarHBondContact O-CG 3.48Å; L1103-L1107 PolarHBondContact O-N 3.12Å
1104	C	94.9	Very high	95.4	Very high	70 Å²	70	70.6 Å²	70.6	47%	0.473	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-45.3	172.4	-65.7	0	0	0	0	111.5	Q1100 D1101 L1102 L1107 D1108	Q1100-C1104 PolarHBondContact O-N 3.08Å; Q1100-C1104 PolarHBondContact O-SG 2.78Å; D1101-C1104 WeakPolarHBondContact O-CB 3.45Å; D1101-C1104 PolarHBondContact O-N 3.47Å; L1102-C1104 PolarHBondContact O-N 2.94Å; C1104-L1107 PolarHBondContact O-N 2.9Å; C1104-D1108 WeakPolarHBondContact O-CB 3.32Å; C1104-D1108 PolarHBondContact O-N 3.27Å
1105	Q	94.6	Very high	95.1	Very high	96 Å²	96	73.6 Å²	73.6	45%	0.449	38%	0.384	S	S	.	.	H	α-helix	trans	-62.9	-43.5	175.9	-60.8	-176.9	20.3	0	0	112.3	L1097 D1101 L1102 D1108 L1109	L1097-Q1105 VanDerWaalsContact CD2-NE2 3.28Å; D1101-Q1105 PolarHBondContact O-N 2.92Å; L1102-Q1105 CarbonylContact O-C 3.54Å; L1102-Q1105 WeakPolarHBondContact O-CA 3.34Å; L1102-Q1105 WeakPolarHBondContact O-CB 3.34Å; L1102-Q1105 PolarHBondContact O-N 2.93Å; Q1105-D1108 CarbonylContact O-C 3.6Å; Q1105-D1108 PolarHBondContact O-N 3.31Å; Q1105-L1109 VanDerWaalsContact O-CB 3.3Å; Q1105-L1109 WeakPolarHBondContact O-CB 3.37Å; Q1105-L1109 PolarHBondContact O-N 3.35Å
1106	M	95.6	Very high	94.5	Very high	9 Å²	9	66.5 Å²	66.5	4%	0.044	36%	0.36	C	S	.	.	H	α-helix	trans	-68.2	-35.3	179.9	-68	-62.4	113.2	0	0	112.5	L1102 L1103 L1109 V1110 F1132 T1135 F1136	L1102-M1106 HydrophobicContact CD1-CE 3.85Å; L1102-M1106 HydrophobicContact CD1-CG 3.73Å; L1102-M1106 HydrophobicContact CD1-SD 4.4Å; L1102-M1106 HydrophobicContact CG-CG 4.04Å; L1102-M1106 WeakPolarHBondContact O-CG 3.44Å; L1102-M1106 PolarHBondContact O-N 3.27Å; L1103-M1106 PolarHBondContact O-N 3.42Å; M1106-L1109 HydrophobicContact CE-CD2 3.9Å; M1106-L1109 PolarHBondContact O-N 3.05Å; M1106-L1109 HydrophobicContact SD-CD2 3.88Å; M1106-V1110 WeakPolarHBondContact O-CB 3.31Å; M1106-V1110 WeakPolarHBondContact O-CG2 2.9Å; M1106-V1110 PolarHBondContact O-N 3.42Å; M1106-F1132 HydrophobicContact CB-CD2 4.2Å; M1106-F1132 HydrophobicContact CB-CE2 4.23Å; M1106-F1132 HydrophobicContact CG-CD2 4.35Å; M1106-F1132 HydrophobicContact SD-CB 4.39Å; M1106-F1132 HydrophobicContact SD-CD2 3.74Å; M1106-F1132 HydrophobicContact SD-CG 4.4Å; M1106-T1135 HydrophobicContact CE-CG2 4.3Å; M1106-T1135 HydrophobicContact SD-CG2 4.41Å; M1106-F1136 HydrophobicContact CG-CE2 3.92Å; M1106-F1136 HydrophobicContact CG-CZ 4Å; M1106-F1136 HydrophobicContact SD-CE2 4.19Å
1107	L	95.6	Very high	94.4	Very high	43 Å²	43	70 Å²	70	23%	0.225	37%	0.372	C	S	.	.	H	α-helix	trans	-68.7	-38.2	171.8	-71.8	169.8	0	0	0	112.1	M1075 L1103 C1104 L1109 K1111 P1112 I1118	M1075-L1107 HydrophobicContact CE-CD1 4.39Å; L1103-L1107 HydrophobicContact CD1-CD1 3.95Å; L1103-L1107 HydrophobicContact CD1-CG 3.99Å; L1103-L1107 HydrophobicContact CG-CD1 3.95Å; L1103-L1107 HydrophobicContact CG-CG 4.43Å; L1103-L1107 WeakPolarHBondContact O-CB 3.26Å; L1103-L1107 VanDerWaalsContact O-CG 3.24Å; L1103-L1107 WeakPolarHBondContact O-CG 3.48Å; L1103-L1107 PolarHBondContact O-N 3.12Å; C1104-L1107 PolarHBondContact O-N 2.9Å; L1107-L1109 VanDerWaalsContact C-N 3.33Å; L1107-K1111 VanDerWaalsContact O-CA 3.32Å; L1107-K1111 WeakPolarHBondContact O-CA 2.98Å; L1107-K1111 PolarHBondContact O-N 3.08Å; L1107-P1112 HydrophobicContact CD2-CG 3.81Å; L1107-I1118 HydrophobicContact CD2-CD1 4.18Å; L1107-I1118 HydrophobicContact CD2-CG1 4.23Å
1108	D	94.9	Very high	94.6	Very high	120 Å²	120	67.6 Å²	67.6	64%	0.642	36%	0.36	S	S	*	.	H	α-helix	trans	-73.3	-21.1	172.5	-95.6	-23.7	0	0	0	113.3	C1104 Q1105 K1111	C1104-D1108 WeakPolarHBondContact O-CB 3.32Å; C1104-D1108 PolarHBondContact O-N 3.27Å; Q1105-D1108 CarbonylContact O-C 3.6Å; Q1105-D1108 PolarHBondContact O-N 3.31Å; D1108-K1111 WeakPolarHBondContact O-CE 3.49Å; D1108-K1111 WeakPolarHBondContact O-CG 3.42Å
1109	L	94.9	Very high	94.7	Very high	35 Å²	35	65.5 Å²	65.5	18%	0.183	35%	0.345	C	S	.	.	H	α-helix	trans	-76.8	-52.8	173	-176.4	71.3	0	0	0	111	Q1105 M1106 L1107 M1128 I1131 F1132	Q1105-L1109 VanDerWaalsContact O-CB 3.3Å; Q1105-L1109 WeakPolarHBondContact O-CB 3.37Å; Q1105-L1109 PolarHBondContact O-N 3.35Å; M1106-L1109 HydrophobicContact CE-CD2 3.9Å; M1106-L1109 PolarHBondContact O-N 3.05Å; M1106-L1109 HydrophobicContact SD-CD2 3.88Å; L1107-L1109 VanDerWaalsContact C-N 3.33Å; L1109-M1128 HydrophobicContact CD1-CB 3.73Å; L1109-M1128 HydrophobicContact CD1-CE 3.64Å; L1109-M1128 HydrophobicContact CD1-CG 4.28Å; L1109-M1128 HydrophobicContact CD1-SD 3.63Å; L1109-M1128 HydrophobicContact CG-CB 4.09Å; L1109-I1131 HydrophobicContact CD2-CB 4.4Å; L1109-I1131 HydrophobicContact CD2-CG2 4.04Å; L1109-F1132 HydrophobicContact CD2-CB 4.12Å
1110	V	96.4	Very high	94.7	Very high	3 Å²	3	64.8 Å²	64.8	2%	0.018	34%	0.343	C	S	.	.	H	α-helix	trans	-80.3	-36.8	-173.7	176.8	0	0	0	0	112.3	M1106 I1118 D1122 L1123 C1126 F1132	M1106-V1110 WeakPolarHBondContact O-CB 3.31Å; M1106-V1110 WeakPolarHBondContact O-CG2 2.9Å; M1106-V1110 PolarHBondContact O-N 3.42Å; V1110-I1118 HydrophobicContact CB-CD1 4.47Å; V1110-I1118 HydrophobicContact CG1-CG1 4.43Å; V1110-I1118 HydrophobicContact CG1-CG2 4.12Å; V1110-I1118 HydrophobicContact CG2-CD1 4.43Å; V1110-D1122 HydrophobicContact CG1-CB 3.73Å; V1110-L1123 HydrophobicContact CG1-CD2 4.27Å; V1110-L1123 HydrophobicContact CG1-CG 4.35Å; V1110-L1123 HydrophobicContact CG2-CD2 3.73Å; V1110-C1126 WeakPolarHBondContact O-CB 3.49Å; V1110-F1132 HydrophobicContact CG2-CD2 3.54Å; V1110-F1132 HydrophobicContact CG2-CE2 3.93Å; V1110-F1132 HydrophobicContact CG2-CG 4.2Å
1111	K	96	Very high	94.8	Very high	140 Å²	140	60.7 Å²	60.7	61%	0.609	33%	0.331	S	S	*	.			trans	49.4	64.9	-174.5	-55.4	-171.5	-172.9	-175.3	0	111.8	L1107 D1108 R1125	L1107-K1111 VanDerWaalsContact O-CA 3.32Å; L1107-K1111 WeakPolarHBondContact O-CA 2.98Å; L1107-K1111 PolarHBondContact O-N 3.08Å; D1108-K1111 WeakPolarHBondContact O-CE 3.49Å; D1108-K1111 WeakPolarHBondContact O-CG 3.42Å; K1111-R1125 PolarHBondContact O-NH2 3.25Å
1112	P	96.3	Very high	94.9	Very high	21 Å²	21	56.6 Å²	56.6	14%	0.136	31%	0.309	C	S	.	.			trans	-61.3	147.9	179.8	26.3	-34.4	0	0	0	111.9	L1107 N1114 K1117 I1118 D1122	L1107-P1112 HydrophobicContact CD2-CG 3.81Å; P1112-N1114 VanDerWaalsContact C-N 3.28Å; P1112-N1114 PolarHBondContact O-N 2.94Å; P1112-K1117 WeakPolarHBondContact CB-O 3.34Å; P1112-I1118 HydrophobicContact CB-CG1 4.31Å; P1112-I1118 HydrophobicContact CG-CG1 4.19Å; P1112-D1122 VanDerWaalsContact CA-CG 3.49Å; P1112-D1122 WeakPolarHBondContact CA-OD1 3.37Å; P1112-D1122 HydrophobicContact CB-CB 4.25Å
1113	E	95.4	Very high	95	Very high	150 Å²	150	56.5 Å²	56.5	70%	0.701	31%	0.309	S	S	*	.	S	Bend	trans	-67.7	-32.5	-179.5	-175.1	165.2	177.9	0	0	111.8	D1122 R1125	E1113-D1122 PolarHBondContact N-OD1 2.95Å; E1113-R1125 IonicContact OE2-NH1 3.78Å
1114	N	92.5	Very high	95	Very high	97 Å²	97	58.2 Å²	58.2	52%	0.519	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-107.5	116.2	173.4	-71.1	-73.8	0	0	0	109.9	P1112 G1116 K1117	P1112-N1114 VanDerWaalsContact C-N 3.28Å; P1112-N1114 PolarHBondContact O-N 2.94Å; N1114-G1116 PolarHBondContact O-N 3.45Å; N1114-K1117 HydrophobicContact CB-CB 4.08Å; N1114-K1117 PolarHBondContact O-N 2.81Å
1115	P	88.4	Confident	95.1	Very high	126 Å²	126	60.1 Å²	60.1	82%	0.818	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	126.6	-179.6	-28	35.7	0	0	0	112.6
1116	G	82.6	Confident	95.1	Very high	32 Å²	32	56.9 Å²	56.9	33%	0.33	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	13.5	-179.2	0	0	0	0	0	115.6	M1075 N1114	M1075-G1116 VanDerWaalsContact CE-CA 3.5Å; N1114-G1116 PolarHBondContact O-N 3.45Å
1117	K	92.6	Very high	95	Very high	97 Å²	97	65.8 Å²	65.8	42%	0.422	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-132	106.9	172.7	-76.2	-166.9	159.7	-103.5	0	109.5	V1072 P1112 N1114	V1072-K1117 HydrophobicContact CG1-CB 3.48Å; V1072-K1117 VanDerWaalsContact CG1-CB 3.48Å; V1072-K1117 HydrophobicContact CG1-CD 4.17Å; V1072-K1117 HydrophobicContact CG1-CG 3.73Å; P1112-K1117 WeakPolarHBondContact CB-O 3.34Å; N1114-K1117 HydrophobicContact CB-CB 4.08Å; N1114-K1117 PolarHBondContact O-N 2.81Å
1118	I	97.9	Very high	94.9	Very high	3 Å²	3	67.6 Å²	67.6	2%	0.015	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	114.6	176.1	-68.3	178.5	0	0	0	108.8	Y1062 L1073 L1078 L1107 V1110 P1112 L1123 F1132	Y1062-I1118 PolarHBondContact OH-O 3.49Å; Y1062-I1118 VanDerWaalsContact OH-O 3.1Å; L1073-I1118 HydrophobicContact CB-CB 4.28Å; L1073-I1118 HydrophobicContact CB-CG2 4.49Å; L1073-I1118 HydrophobicContact CD1-CG2 4.28Å; L1073-I1118 PolarHBondContact N-O 3.39Å; L1078-I1118 HydrophobicContact CD1-CD1 4.23Å; L1107-I1118 HydrophobicContact CD2-CD1 4.18Å; L1107-I1118 HydrophobicContact CD2-CG1 4.23Å; V1110-I1118 HydrophobicContact CB-CD1 4.47Å; V1110-I1118 HydrophobicContact CG1-CG1 4.43Å; V1110-I1118 HydrophobicContact CG1-CG2 4.12Å; V1110-I1118 HydrophobicContact CG2-CD1 4.43Å; P1112-I1118 HydrophobicContact CB-CG1 4.31Å; P1112-I1118 HydrophobicContact CG-CG1 4.19Å; I1118-L1123 HydrophobicContact CG2-CD1 3.81Å; I1118-L1123 HydrophobicContact CG2-CG 3.93Å; I1118-F1132 HydrophobicContact CD1-CE2 3.65Å; I1118-F1132 HydrophobicContact CD1-CZ 4.02Å; I1118-F1132 HydrophobicContact CG2-CZ 4.27Å
1119	T	98.3	Very high	95	Very high	34 Å²	34	61.9 Å²	61.9	21%	0.209	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	162	176	73	0	0	0	0	112.1	Y1062 V1072 S1121 D1122 L1123	Y1062-T1119 WeakPolarHBondContact OH-CA 3.37Å; V1072-T1119 HydrophobicContact CG2-CG2 4.37Å; T1119-S1121 PolarHBondContact O-N 3.41Å; T1119-S1121 PolarHBondContact OG1-N 3.43Å; T1119-D1122 WeakPolarHBondContact CA-OD2 3.35Å; T1119-D1122 VanDerWaalsContact CB-OD2 3.31Å; T1119-D1122 WeakPolarHBondContact CB-OD2 3.42Å; T1119-D1122 PolarHBondContact N-OD2 3.35Å; T1119-D1122 WeakPolarHBondContact O-CB 3.28Å; T1119-D1122 PolarHBondContact O-N 3.44Å; T1119-D1122 PolarHBondContact OG1-N 3.05Å; T1119-D1122 PolarHBondContact OG1-OD2 2.8Å; T1119-L1123 PolarHBondContact O-N 3.42Å
1120	L	98.1	Very high	95	Very high	20 Å²	20	61.9 Å²	61.9	11%	0.105	31%	0.31	C	S	.	.	H	α-helix	trans	-52.7	-37.1	169.8	174.7	63	0	0	0	112.5	I1058 E1059 Y1062 L1123 K1124	I1058-L1120 HydrophobicContact CG2-CD1 4.03Å; E1059-L1120 HydrophobicContact CG-CD1 3.79Å; E1059-L1120 HydrophobicContact CG-CD2 3.89Å; E1059-L1120 HydrophobicContact CG-CG 4.39Å; Y1062-L1120 HydrophobicContact CD1-CB 4.01Å; Y1062-L1120 HydrophobicContact CD1-CD1 4.45Å; Y1062-L1120 HydrophobicContact CD2-CB 4.02Å; Y1062-L1120 HydrophobicContact CD2-CD1 4.2Å; Y1062-L1120 HydrophobicContact CE1-CB 4.01Å; Y1062-L1120 HydrophobicContact CE2-CB 4.01Å; Y1062-L1120 HydrophobicContact CG-CB 4.01Å; Y1062-L1120 HydrophobicContact CG-CD1 3.9Å; Y1062-L1120 HydrophobicContact CG-CG 4.5Å; Y1062-L1120 VanDerWaalsContact CZ-N 3.29Å; Y1062-L1120 PolarHBondContact OH-N 3.18Å; L1120-L1123 PolarHBondContact O-N 3.13Å; L1120-K1124 HydrophobicContact CD1-CD 4.38Å; L1120-K1124 HydrophobicContact CD1-CG 4.39Å; L1120-K1124 HydrophobicContact CG-CD 4.14Å; L1120-K1124 WeakPolarHBondContact O-CB 3.48Å; L1120-K1124 VanDerWaalsContact O-CG 3.3Å; L1120-K1124 WeakPolarHBondContact O-CG 3.29Å; L1120-K1124 PolarHBondContact O-N 3.4Å
1121	S	97.8	Very high	95	Very high	66 Å²	66	63.5 Å²	63.5	46%	0.462	32%	0.318	S	S	.	.	H	α-helix	trans	-66.2	-38.2	177.5	-172.3	0	0	0	0	111.8	T1119 R1125	T1119-S1121 PolarHBondContact O-N 3.41Å; T1119-S1121 PolarHBondContact OG1-N 3.43Å; S1121-R1125 WeakPolarHBondContact O-CB 3.35Å; S1121-R1125 PolarHBondContact O-N 2.95Å
1122	D	97.9	Very high	95	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-42.7	177.7	-55.5	-60.2	0	0	0	111.5	V1110 P1112 E1113 T1119 R1125 C1126	V1110-D1122 HydrophobicContact CG1-CB 3.73Å; P1112-D1122 VanDerWaalsContact CA-CG 3.49Å; P1112-D1122 WeakPolarHBondContact CA-OD1 3.37Å; P1112-D1122 HydrophobicContact CB-CB 4.25Å; E1113-D1122 PolarHBondContact N-OD1 2.95Å; T1119-D1122 WeakPolarHBondContact CA-OD2 3.35Å; T1119-D1122 VanDerWaalsContact CB-OD2 3.31Å; T1119-D1122 WeakPolarHBondContact CB-OD2 3.42Å; T1119-D1122 PolarHBondContact N-OD2 3.35Å; T1119-D1122 WeakPolarHBondContact O-CB 3.28Å; T1119-D1122 PolarHBondContact O-N 3.44Å; T1119-D1122 PolarHBondContact OG1-N 3.05Å; T1119-D1122 PolarHBondContact OG1-OD2 2.8Å; D1122-R1125 PolarHBondContact O-N 2.69Å; D1122-R1125 VanDerWaalsContact O-N 3.17Å; D1122-R1125 IonicContact OD1-CZ 2.65Å; D1122-R1125 IonicContact OD1-NH1 2.88Å; D1122-R1125 PolarHBondContact OD1-NH1 3.1Å; D1122-R1125 IonicContact OD1-NH2 2.66Å; D1122-R1125 PolarHBondContact OD1-NH2 2.82Å; D1122-C1126 WeakPolarHBondContact O-CB 3.29Å; D1122-C1126 PolarHBondContact O-N 3.35Å
1123	L	98	Very high	95.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-67.6	-43.3	177.1	-74.8	161.7	0	0	0	112.5	I1058 Y1062 L1073 V1110 I1118 T1119 L1120 R1125 C1126 A1129 F1132 F1133	I1058-L1123 HydrophobicContact CG2-CB 4.11Å; Y1062-L1123 HydrophobicContact CD2-CD1 3.66Å; Y1062-L1123 HydrophobicContact CE2-CD1 3.91Å; L1073-L1123 HydrophobicContact CD1-CD1 4.07Å; V1110-L1123 HydrophobicContact CG1-CD2 4.27Å; V1110-L1123 HydrophobicContact CG1-CG 4.35Å; V1110-L1123 HydrophobicContact CG2-CD2 3.73Å; I1118-L1123 HydrophobicContact CG2-CD1 3.81Å; I1118-L1123 HydrophobicContact CG2-CG 3.93Å; T1119-L1123 PolarHBondContact O-N 3.42Å; L1120-L1123 PolarHBondContact O-N 3.13Å; L1123-R1125 PolarHBondContact O-N 3.44Å; L1123-C1126 PolarHBondContact O-SG 3.02Å; L1123-A1129 HydrophobicContact CB-CB 4.18Å; L1123-A1129 HydrophobicContact CD2-CB 4.06Å; L1123-F1132 HydrophobicContact CD1-CD1 4.34Å; L1123-F1132 HydrophobicContact CD1-CE1 4.02Å; L1123-F1132 HydrophobicContact CD2-CB 4.13Å; L1123-F1132 HydrophobicContact CD2-CD1 3.56Å; L1123-F1132 HydrophobicContact CD2-CD2 4.19Å; L1123-F1132 HydrophobicContact CD2-CE1 3.93Å; L1123-F1132 HydrophobicContact CD2-CE2 4.49Å; L1123-F1132 HydrophobicContact CD2-CG 3.71Å; L1123-F1132 HydrophobicContact CD2-CZ 4.37Å; L1123-F1133 HydrophobicContact CD1-CE1 4.39Å; L1123-F1133 HydrophobicContact CD1-CZ 4.27Å
1124	K	96.9	Very high	95.2	Very high	59 Å²	59	49 Å²	49	26%	0.257	25%	0.251	S	S	.	.	H	α-helix	trans	-56.8	-35.8	169.2	-74.5	171.2	175.6	177.8	0	111.8	E458 I1058 E1059 L1120	E458-K1124 IonicContact OE1-NZ 2.68Å; E458-K1124 PolarHBondContact OE1-NZ 3.08Å; I1058-K1124 HydrophobicContact CG2-CG 4.15Å; E1059-K1124 WeakPolarHBondContact OE1-CE 3.43Å; E1059-K1124 IonicContact OE1-NZ 2.72Å; E1059-K1124 PolarHBondContact OE1-NZ 2.64Å; L1120-K1124 HydrophobicContact CD1-CD 4.38Å; L1120-K1124 HydrophobicContact CD1-CG 4.39Å; L1120-K1124 HydrophobicContact CG-CD 4.14Å; L1120-K1124 WeakPolarHBondContact O-CB 3.48Å; L1120-K1124 VanDerWaalsContact O-CG 3.3Å; L1120-K1124 WeakPolarHBondContact O-CG 3.29Å; L1120-K1124 PolarHBondContact O-N 3.4Å
1125	R	96.8	Very high	95.3	Very high	111 Å²	111	44.4 Å²	44.4	42%	0.419	23%	0.227	S	C	.	.	H	α-helix	trans	-81.7	-34.2	-175.8	-171.4	177.6	71.8	-120.8	-4.7	113.6	K1111 E1113 S1121 D1122 L1123 R1127	K1111-R1125 PolarHBondContact O-NH2 3.25Å; E1113-R1125 IonicContact OE2-NH1 3.78Å; S1121-R1125 WeakPolarHBondContact O-CB 3.35Å; S1121-R1125 PolarHBondContact O-N 2.95Å; D1122-R1125 PolarHBondContact O-N 2.69Å; D1122-R1125 VanDerWaalsContact O-N 3.17Å; D1122-R1125 IonicContact OD1-CZ 2.65Å; D1122-R1125 IonicContact OD1-NH1 2.88Å; D1122-R1125 PolarHBondContact OD1-NH1 3.1Å; D1122-R1125 IonicContact OD1-NH2 2.66Å; D1122-R1125 PolarHBondContact OD1-NH2 2.82Å; L1123-R1125 PolarHBondContact O-N 3.44Å; R1125-R1127 VanDerWaalsContact C-N 3.34Å; R1125-R1127 PolarHBondContact O-N 3.12Å
1126	C	94.8	Very high	95.8	Very high	27 Å²	27	38.4 Å²	38.4	18%	0.182	19%	0.188	C	C	.	.	H	α-helix	trans	-72.7	-25	-176.6	78.6	0	0	0	0	113.6	V1110 D1122 L1123 M1128	V1110-C1126 WeakPolarHBondContact O-CB 3.49Å; D1122-C1126 WeakPolarHBondContact O-CB 3.29Å; D1122-C1126 PolarHBondContact O-N 3.35Å; L1123-C1126 PolarHBondContact O-SG 3.02Å; C1126-M1128 PolarHBondContact O-N 2.82Å; C1126-M1128 VanDerWaalsContact O-N 3.14Å; C1126-M1128 PolarHBondContact SG-N 3.29Å; C1126-M1128 VanDerWaalsContact SG-N 3.38Å
1127	R	93.6	Very high	96.5	Very high	197 Å²	197	36.9 Å²	36.9	74%	0.743	17%	0.172	S	C	*	.	S	Bend	trans	63.4	2.9	-175.9	-50.5	-177.7	178.5	-157.3	-3.7	115.7	R1125 H1130	R1125-R1127 VanDerWaalsContact C-N 3.34Å; R1125-R1127 PolarHBondContact O-N 3.12Å; R1127-H1130 PolarHBondContact O-CE1 2.9Å
1128	M	93.7	Very high	96.6	Very high	80 Å²	80	32.3 Å²	32.3	39%	0.394	15%	0.152	S	C	.	.			trans	-112.2	21.6	178.3	-57.6	-176.1	75.7	0	0	111.9	L1109 C1126 H1130 I1131 F1132	L1109-M1128 HydrophobicContact CD1-CB 3.73Å; L1109-M1128 HydrophobicContact CD1-CE 3.64Å; L1109-M1128 HydrophobicContact CD1-CG 4.28Å; L1109-M1128 HydrophobicContact CD1-SD 3.63Å; L1109-M1128 HydrophobicContact CG-CB 4.09Å; C1126-M1128 PolarHBondContact O-N 2.82Å; C1126-M1128 VanDerWaalsContact O-N 3.14Å; C1126-M1128 PolarHBondContact SG-N 3.29Å; C1126-M1128 VanDerWaalsContact SG-N 3.38Å; M1128-H1130 VanDerWaalsContact C-N 3.25Å; M1128-H1130 PolarHBondContact O-N 3.06Å; M1128-I1131 HydrophobicContact CE-CD1 3.67Å; M1128-I1131 PolarHBondContact O-N 3.14Å; M1128-F1132 PolarHBondContact O-N 3.11Å
1129	A	96.3	Very high	96.3	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-32.6	-179.3	0	0	0	0	0	113.3	I1058 L1123 F1132 F1133	I1058-A1129 HydrophobicContact CD1-CB 3.99Å; I1058-A1129 HydrophobicContact CG1-CB 3.94Å; I1058-A1129 HydrophobicContact CG2-CB 4.37Å; L1123-A1129 HydrophobicContact CB-CB 4.18Å; L1123-A1129 HydrophobicContact CD2-CB 4.06Å; A1129-F1132 WeakPolarHBondContact O-CB 3.12Å; A1129-F1132 PolarHBondContact O-N 3.44Å; A1129-F1133 HydrophobicContact CB-CD2 4.24Å; A1129-F1133 HydrophobicContact CB-CE2 3.84Å; A1129-F1133 WeakPolarHBondContact O-CB 3.38Å; A1129-F1133 WeakPolarHBondContact O-CD2 3.25Å; A1129-F1133 VanDerWaalsContact O-CG 3.31Å; A1129-F1133 WeakPolarHBondContact O-CG 3.46Å; A1129-F1133 PolarHBondContact O-N 3.34Å
1130	H	95.2	Very high	95.9	Very high	34 Å²	34	35.7 Å²	35.7	16%	0.157	17%	0.166	C	C	.	.	H	α-helix	trans	-55.3	-54.7	173.3	53.8	-75.9	0	0	0	112.2	K1052 K1053 R1127 M1128 F1132 F1133 D1134	K1052-H1130 HydrophobicContact CB-CB 3.62Å; K1053-H1130 HydrophobicContact CG-CB 4.33Å; K1053-H1130 WeakPolarHBondContact CG-ND1 3.29Å; R1127-H1130 PolarHBondContact O-CE1 2.9Å; M1128-H1130 VanDerWaalsContact C-N 3.25Å; M1128-H1130 PolarHBondContact O-N 3.06Å; H1130-F1132 VanDerWaalsContact C-N 3.29Å; H1130-F1132 PolarHBondContact O-N 2.98Å; H1130-F1133 PolarHBondContact O-N 3.46Å; H1130-D1134 WeakPolarHBondContact O-CB 3.22Å; H1130-D1134 VanDerWaalsContact O-CG 3.23Å; H1130-D1134 PolarHBondContact O-N 3.01Å; H1130-D1134 VanDerWaalsContact O-OD2 3.12Å
1131	I	95.2	Very high	95.6	Very high	38 Å²	38	36.5 Å²	36.5	20%	0.195	17%	0.168	C	C	.	.	H	α-helix	trans	-57.7	-42.7	176.3	-67.8	157.2	0	0	0	111.2	L1109 M1128 T1135	L1109-I1131 HydrophobicContact CD2-CB 4.4Å; L1109-I1131 HydrophobicContact CD2-CG2 4.04Å; M1128-I1131 HydrophobicContact CE-CD1 3.67Å; M1128-I1131 PolarHBondContact O-N 3.14Å; I1131-T1135 WeakPolarHBondContact O-CB 3.27Å; I1131-T1135 PolarHBondContact O-N 3.24Å; I1131-T1135 PolarHBondContact O-OG1 2.98Å
1132	F	97.4	Very high	95.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.7	-51.5	176.4	175.8	-87.3	0	0	0	111.5	M1065 L1073 L1078 M1106 L1109 V1110 I1118 L1123 M1128 A1129 H1130 T1135 F1136	M1065-F1132 HydrophobicContact CE-CE1 4.29Å; M1065-F1132 HydrophobicContact SD-CE1 4.11Å; L1073-F1132 HydrophobicContact CD1-CE1 3.82Å; L1073-F1132 HydrophobicContact CD1-CZ 3.94Å; L1078-F1132 HydrophobicContact CD2-CE1 4.49Å; L1078-F1132 HydrophobicContact CD2-CZ 3.76Å; M1106-F1132 HydrophobicContact CB-CD2 4.2Å; M1106-F1132 HydrophobicContact CB-CE2 4.23Å; M1106-F1132 HydrophobicContact CG-CD2 4.35Å; M1106-F1132 HydrophobicContact SD-CB 4.39Å; M1106-F1132 HydrophobicContact SD-CD2 3.74Å; M1106-F1132 HydrophobicContact SD-CG 4.4Å; L1109-F1132 HydrophobicContact CD2-CB 4.12Å; V1110-F1132 HydrophobicContact CG2-CD2 3.54Å; V1110-F1132 HydrophobicContact CG2-CE2 3.93Å; V1110-F1132 HydrophobicContact CG2-CG 4.2Å; I1118-F1132 HydrophobicContact CD1-CE2 3.65Å; I1118-F1132 HydrophobicContact CD1-CZ 4.02Å; I1118-F1132 HydrophobicContact CG2-CZ 4.27Å; L1123-F1132 HydrophobicContact CD1-CD1 4.34Å; L1123-F1132 HydrophobicContact CD1-CE1 4.02Å; L1123-F1132 HydrophobicContact CD2-CB 4.13Å; L1123-F1132 HydrophobicContact CD2-CD1 3.56Å; L1123-F1132 HydrophobicContact CD2-CD2 4.19Å; L1123-F1132 HydrophobicContact CD2-CE1 3.93Å; L1123-F1132 HydrophobicContact CD2-CE2 4.49Å; L1123-F1132 HydrophobicContact CD2-CG 3.71Å; L1123-F1132 HydrophobicContact CD2-CZ 4.37Å; M1128-F1132 PolarHBondContact O-N 3.11Å; A1129-F1132 WeakPolarHBondContact O-CB 3.12Å; A1129-F1132 PolarHBondContact O-N 3.44Å; H1130-F1132 VanDerWaalsContact C-N 3.29Å; H1130-F1132 PolarHBondContact O-N 2.98Å; F1132-T1135 WeakPolarHBondContact O-CB 3.33Å; F1132-T1135 PolarHBondContact O-N 3.38Å; F1132-F1136 HydrophobicContact CD1-CD2 4.24Å; F1132-F1136 HydrophobicContact CD1-CE2 4.49Å; F1132-F1136 HydrophobicContact CD2-CD2 4.39Å; F1132-F1136 AromaticContact CD2-CE2 3.89Å; F1132-F1136 HydrophobicContact CD2-CE2 3.89Å; F1132-F1136 HydrophobicContact CE1-CD2 4.07Å; F1132-F1136 HydrophobicContact CE1-CE2 4.21Å; F1132-F1136 HydrophobicContact CE2-CD2 4.24Å; F1132-F1136 AromaticContact CE2-CE2 3.58Å; F1132-F1136 HydrophobicContact CE2-CE2 3.58Å; F1132-F1136 HydrophobicContact CG-CD2 4.4Å; F1132-F1136 HydrophobicContact CG-CE2 4.35Å; F1132-F1136 HydrophobicContact CZ-CD2 4.08Å; F1132-F1136 AromaticContact CZ-CE2 3.76Å; F1132-F1136 HydrophobicContact CZ-CE2 3.76Å; F1132-F1136 WeakPolarHBondContact O-CD2 3.49Å; F1132-F1136 PolarHBondContact O-N 3.42Å
1133	F	98	Very high	94.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.6	-46.8	179.6	-69.2	-47.4	0	0	0	112.6	K1052 I1058 W1061 M1065 L1123 A1129 H1130 T1135 F1136 F1137	K1052-F1133 HydrophobicContact CD-CB 3.78Å; K1052-F1133 HydrophobicContact CD-CD2 4.36Å; K1052-F1133 HydrophobicContact CD-CG 4.5Å; I1058-F1133 HydrophobicContact CB-CE2 4.27Å; I1058-F1133 HydrophobicContact CG1-CE2 4.19Å; I1058-F1133 HydrophobicContact CG2-CE2 4.18Å; I1058-F1133 HydrophobicContact CG2-CZ 4.22Å; W1061-F1133 HydrophobicContact CB-CD1 3.73Å; W1061-F1133 HydrophobicContact CB-CD2 4.06Å; W1061-F1133 HydrophobicContact CB-CE1 3.64Å; W1061-F1133 HydrophobicContact CB-CE2 3.98Å; W1061-F1133 HydrophobicContact CB-CG 3.96Å; W1061-F1133 HydrophobicContact CB-CZ 3.77Å; W1061-F1133 HydrophobicContact CG-CD2 4.49Å; W1061-F1133 HydrophobicContact CG-CG 4.48Å; M1065-F1133 HydrophobicContact SD-CD1 3.65Å; M1065-F1133 HydrophobicContact SD-CE1 3.97Å; L1123-F1133 HydrophobicContact CD1-CE1 4.39Å; L1123-F1133 HydrophobicContact CD1-CZ 4.27Å; A1129-F1133 HydrophobicContact CB-CD2 4.24Å; A1129-F1133 HydrophobicContact CB-CE2 3.84Å; A1129-F1133 WeakPolarHBondContact O-CB 3.38Å; A1129-F1133 WeakPolarHBondContact O-CD2 3.25Å; A1129-F1133 VanDerWaalsContact O-CG 3.31Å; A1129-F1133 WeakPolarHBondContact O-CG 3.46Å; A1129-F1133 PolarHBondContact O-N 3.34Å; H1130-F1133 PolarHBondContact O-N 3.46Å; F1133-T1135 VanDerWaalsContact C-N 3.3Å; F1133-T1135 PolarHBondContact O-N 3.24Å; F1133-F1136 PolarHBondContact O-N 3.43Å; F1133-F1136 VanDerWaalsContact O-N 3.1Å; F1133-F1137 HydrophobicContact CB-CE1 3.76Å; F1133-F1137 HydrophobicContact CB-CZ 3.66Å; F1133-F1137 AromaticContact CD1-CE1 3.93Å; F1133-F1137 HydrophobicContact CD1-CE1 3.93Å; F1133-F1137 HydrophobicContact CD1-CZ 4.32Å; F1133-F1137 HydrophobicContact CG-CE1 4.2Å; F1133-F1137 HydrophobicContact CG-CZ 4.21Å; F1133-F1137 VanDerWaalsContact O-CD1 3.29Å; F1133-F1137 WeakPolarHBondContact O-CD1 3.28Å; F1133-F1137 WeakPolarHBondContact O-CE1 3.35Å; F1133-F1137 PolarHBondContact O-N 3.08Å
1134	D	96.5	Very high	94.4	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.027	18%	0.182	C	C	.	.	H	α-helix	trans	-58	-45.5	178.8	-64.4	-34.6	0	0	0	110.2	K1052 Q1085 H1130 F1136 F1137 N1138 K1141 H1145	K1052-D1134 WeakPolarHBondContact CD-OD1 3.21Å; K1052-D1134 VanDerWaalsContact CE-OD1 3.32Å; K1052-D1134 WeakPolarHBondContact CE-OD1 3.46Å; K1052-D1134 IonicContact NZ-OD1 3.82Å; K1052-D1134 PolarHBondContact NZ-OD1 2.85Å; Q1085-D1134 PolarHBondContact NE2-O 3.49Å; H1130-D1134 WeakPolarHBondContact O-CB 3.22Å; H1130-D1134 VanDerWaalsContact O-CG 3.23Å; H1130-D1134 PolarHBondContact O-N 3.01Å; H1130-D1134 VanDerWaalsContact O-OD2 3.12Å; D1134-F1136 VanDerWaalsContact C-N 3.27Å; D1134-F1136 PolarHBondContact O-N 2.8Å; D1134-F1137 PolarHBondContact O-N 2.74Å; D1134-N1138 CarbonylContact C-O 3.47Å; D1134-N1138 HydrophobicContact CB-CB 4.37Å; D1134-N1138 CarbonylContact O-C 3.57Å; D1134-N1138 VanDerWaalsContact O-C 3.26Å; D1134-N1138 PolarHBondContact O-N 3.35Å; D1134-K1141 HydrophobicContact CB-CB 4.09Å; D1134-H1145 IonicContact OD2-CD2 2.68Å; D1134-H1145 IonicContact OD2-CE1 3.74Å; D1134-H1145 IonicContact OD2-NE2 2.67Å; D1134-H1145 PolarHBondContact OD2-NE2 2.78Å
1135	T	96.6	Very high	93.8	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-52.4	-42.5	175.7	-55.1	0	0	0	0	112.8	Q1085 L1102 M1106 I1131 F1132 F1133 Y1142	Q1085-T1135 PolarHBondContact NE2-O 2.84Å; Q1085-T1135 VanDerWaalsContact NE2-O 3.13Å; L1102-T1135 HydrophobicContact CD1-CG2 3.65Å; L1102-T1135 HydrophobicContact CD2-CG2 3.96Å; L1102-T1135 HydrophobicContact CG-CG2 4.44Å; M1106-T1135 HydrophobicContact CE-CG2 4.3Å; M1106-T1135 HydrophobicContact SD-CG2 4.41Å; I1131-T1135 WeakPolarHBondContact O-CB 3.27Å; I1131-T1135 PolarHBondContact O-N 3.24Å; I1131-T1135 PolarHBondContact O-OG1 2.98Å; F1132-T1135 WeakPolarHBondContact O-CB 3.33Å; F1132-T1135 PolarHBondContact O-N 3.38Å; F1133-T1135 VanDerWaalsContact C-N 3.3Å; F1133-T1135 PolarHBondContact O-N 3.24Å; T1135-Y1142 HydrophobicContact CG2-CD2 3.93Å; T1135-Y1142 HydrophobicContact CG2-CE2 3.66Å; T1135-Y1142 VanDerWaalsContact OG1-CD2 3.28Å; T1135-Y1142 WeakPolarHBondContact OG1-CD2 3.33Å
1136	F	97.8	Very high	93.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-83.3	-22.3	-177.5	-74	-69	0	0	0	114.9	M1065 L1078 F1081 Q1085 F1099 L1102 M1106 F1132 F1133 D1134	M1065-F1136 HydrophobicContact CE-CB 3.58Å; M1065-F1136 HydrophobicContact CE-CD1 4.36Å; M1065-F1136 HydrophobicContact CE-CD2 3.82Å; M1065-F1136 HydrophobicContact CE-CG 3.65Å; M1065-F1136 HydrophobicContact SD-CB 4.38Å; L1078-F1136 HydrophobicContact CB-CE1 3.78Å; L1078-F1136 HydrophobicContact CB-CZ 3.96Å; L1078-F1136 HydrophobicContact CD1-CZ 4.39Å; L1078-F1136 HydrophobicContact CD2-CD2 4.27Å; L1078-F1136 HydrophobicContact CD2-CE1 4.18Å; L1078-F1136 HydrophobicContact CD2-CE2 3.92Å; L1078-F1136 HydrophobicContact CD2-CZ 3.88Å; L1078-F1136 HydrophobicContact CG-CE1 4.49Å; L1078-F1136 HydrophobicContact CG-CZ 4.28Å; L1078-F1136 WeakPolarHBondContact O-CD1 3.49Å; L1078-F1136 VanDerWaalsContact O-CE1 3.3Å; L1078-F1136 WeakPolarHBondContact O-CE1 3.38Å; F1081-F1136 HydrophobicContact CB-CB 4.14Å; F1081-F1136 HydrophobicContact CB-CD1 4.42Å; Q1085-F1136 WeakPolarHBondContact CG-O 3.24Å; F1099-F1136 HydrophobicContact CE2-CE1 4.38Å; L1102-F1136 HydrophobicContact CD2-CE1 4.22Å; L1102-F1136 HydrophobicContact CD2-CZ 4.39Å; M1106-F1136 HydrophobicContact CG-CE2 3.92Å; M1106-F1136 HydrophobicContact CG-CZ 4Å; M1106-F1136 HydrophobicContact SD-CE2 4.19Å; F1132-F1136 HydrophobicContact CD1-CD2 4.24Å; F1132-F1136 HydrophobicContact CD1-CE2 4.49Å; F1132-F1136 HydrophobicContact CD2-CD2 4.39Å; F1132-F1136 AromaticContact CD2-CE2 3.89Å; F1132-F1136 HydrophobicContact CD2-CE2 3.89Å; F1132-F1136 HydrophobicContact CE1-CD2 4.07Å; F1132-F1136 HydrophobicContact CE1-CE2 4.21Å; F1132-F1136 HydrophobicContact CE2-CD2 4.24Å; F1132-F1136 AromaticContact CE2-CE2 3.58Å; F1132-F1136 HydrophobicContact CE2-CE2 3.58Å; F1132-F1136 HydrophobicContact CG-CD2 4.4Å; F1132-F1136 HydrophobicContact CG-CE2 4.35Å; F1132-F1136 HydrophobicContact CZ-CD2 4.08Å; F1132-F1136 AromaticContact CZ-CE2 3.76Å; F1132-F1136 HydrophobicContact CZ-CE2 3.76Å; F1132-F1136 WeakPolarHBondContact O-CD2 3.49Å; F1132-F1136 PolarHBondContact O-N 3.42Å; F1133-F1136 PolarHBondContact O-N 3.43Å; F1133-F1136 VanDerWaalsContact O-N 3.1Å; D1134-F1136 VanDerWaalsContact C-N 3.27Å; D1134-F1136 PolarHBondContact O-N 2.8Å
1137	F	97.1	Very high	92.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-150.6	-19.1	-179.1	59.4	-101.6	0	0	0	118.9	S1012 S1013 I1016 W1061 M1065 R1088 F1133 D1134	S1012-F1137 CarbonylContact C-O 3.23Å; S1013-F1137 PolarHBondContact N-O 3.31Å; S1013-F1137 WeakPolarHBondContact OG-CB 3.11Å; I1016-F1137 HydrophobicContact CB-CB 3.76Å; I1016-F1137 HydrophobicContact CB-CD1 4.44Å; I1016-F1137 HydrophobicContact CB-CD2 4.23Å; I1016-F1137 HydrophobicContact CB-CG 3.92Å; I1016-F1137 HydrophobicContact CD1-CD1 3.76Å; I1016-F1137 HydrophobicContact CD1-CE1 4.03Å; I1016-F1137 HydrophobicContact CD1-CG 4.13Å; I1016-F1137 HydrophobicContact CG1-CB 4.17Å; I1016-F1137 HydrophobicContact CG1-CD1 3.91Å; I1016-F1137 HydrophobicContact CG1-CD2 3.97Å; I1016-F1137 HydrophobicContact CG1-CE1 4.22Å; I1016-F1137 HydrophobicContact CG1-CE2 4.28Å; I1016-F1137 HydrophobicContact CG1-CG 3.77Å; I1016-F1137 HydrophobicContact CG1-CZ 4.4Å; I1016-F1137 HydrophobicContact CG2-CB 3.78Å; I1016-F1137 HydrophobicContact CG2-CD2 3.82Å; I1016-F1137 HydrophobicContact CG2-CG 3.95Å; W1061-F1137 HydrophobicContact CB-CE1 4.39Å; W1061-F1137 HydrophobicContact CB-CZ 3.99Å; W1061-F1137 HydrophobicContact CD2-CE1 4.45Å; W1061-F1137 AromaticContact CD2-CE2 3.87Å; W1061-F1137 HydrophobicContact CD2-CE2 3.87Å; W1061-F1137 AromaticContact CD2-CZ 3.43Å; W1061-F1137 HydrophobicContact CD2-CZ 3.43Å; W1061-F1137 VanDerWaalsContact CD2-CZ 3.43Å; W1061-F1137 HydrophobicContact CE3-CE1 4.19Å; W1061-F1137 AromaticContact CE3-CE2 3.68Å; W1061-F1137 HydrophobicContact CE3-CE2 3.68Å; W1061-F1137 AromaticContact CE3-CZ 3.39Å; W1061-F1137 HydrophobicContact CE3-CZ 3.39Å; W1061-F1137 HydrophobicContact CG-CE2 4.5Å; W1061-F1137 AromaticContact CG-CZ 3.69Å; W1061-F1137 HydrophobicContact CG-CZ 3.69Å; W1061-F1137 HydrophobicContact CH2-CE2 4.29Å; W1061-F1137 HydrophobicContact CZ2-CE2 4.46Å; W1061-F1137 AromaticContact CZ3-CE2 3.9Å; W1061-F1137 HydrophobicContact CZ3-CE2 3.9Å; W1061-F1137 HydrophobicContact CZ3-CZ 4.09Å; M1065-F1137 HydrophobicContact CG-CD1 4.46Å; M1065-F1137 HydrophobicContact CG-CE1 4.22Å; M1065-F1137 HydrophobicContact SD-CD1 4.26Å; M1065-F1137 HydrophobicContact SD-CE1 3.97Å; R1088-F1137 PolarHBondContact NH1-O 2.7Å; F1133-F1137 HydrophobicContact CB-CE1 3.76Å; F1133-F1137 HydrophobicContact CB-CZ 3.66Å; F1133-F1137 AromaticContact CD1-CE1 3.93Å; F1133-F1137 HydrophobicContact CD1-CE1 3.93Å; F1133-F1137 HydrophobicContact CD1-CZ 4.32Å; F1133-F1137 HydrophobicContact CG-CE1 4.2Å; F1133-F1137 HydrophobicContact CG-CZ 4.21Å; F1133-F1137 VanDerWaalsContact O-CD1 3.29Å; F1133-F1137 WeakPolarHBondContact O-CD1 3.28Å; F1133-F1137 WeakPolarHBondContact O-CE1 3.35Å; F1133-F1137 PolarHBondContact O-N 3.08Å; D1134-F1137 PolarHBondContact O-N 2.74Å
1138	N	95.3	Very high	91.7	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-104.2	97.1	171.6	-171.2	-39	0	0	0	110.5	E1049 D1134 E1140 K1141 Y1142	E1049-N1138 PolarHBondContact OE1-ND2 3.03Å; D1134-N1138 CarbonylContact C-O 3.47Å; D1134-N1138 HydrophobicContact CB-CB 4.37Å; D1134-N1138 CarbonylContact O-C 3.57Å; D1134-N1138 VanDerWaalsContact O-C 3.26Å; D1134-N1138 PolarHBondContact O-N 3.35Å; N1138-E1140 PolarHBondContact O-N 3.13Å; N1138-E1140 PolarHBondContact OD1-N 2.74Å; N1138-E1140 VanDerWaalsContact OD1-N 3.15Å; N1138-K1141 HydrophobicContact CB-CB 4.42Å; N1138-K1141 WeakPolarHBondContact ND2-CD 3.12Å; N1138-K1141 PolarHBondContact OD1-N 2.89Å; N1138-Y1142 VanDerWaalsContact O-CB 3.25Å; N1138-Y1142 WeakPolarHBondContact O-CB 3.24Å; N1138-Y1142 PolarHBondContact O-N 3.26Å
1139	L	91.3	Very high	90.3	Very high	10 Å²	10	45 Å²	45	5%	0.052	21%	0.211	C	C	.	.	H	α-helix	trans	-68.6	-33.5	-174.6	178.8	59.2	0	0	0	113.9	A1011 R1088 M1089 M1092 Y1142 L1143	A1011-L1139 PolarHBondContact O-N 3.46Å; R1088-L1139 HydrophobicContact CB-CD2 3.38Å; R1088-L1139 HydrophobicContact CG-CD2 4.39Å; M1089-L1139 HydrophobicContact CG-CD1 3.58Å; M1089-L1139 HydrophobicContact SD-CD1 4.37Å; M1092-L1139 HydrophobicContact CE-CD1 4.32Å; M1092-L1139 HydrophobicContact CE-CD2 3.55Å; M1092-L1139 HydrophobicContact CE-CG 3.98Å; L1139-Y1142 HydrophobicContact CD1-CD1 4.29Å; L1139-L1143 HydrophobicContact CD1-CD1 4.08Å; L1139-L1143 HydrophobicContact CD1-CG 4.14Å; L1139-L1143 HydrophobicContact CG-CD1 4.2Å; L1139-L1143 WeakPolarHBondContact O-CB 3.35Å; L1139-L1143 VanDerWaalsContact O-CG 3.28Å; L1139-L1143 WeakPolarHBondContact O-CG 3.35Å; L1139-L1143 PolarHBondContact O-N 3.33Å
1140	E	90.7	Very high	88.5	Confident	97 Å²	97	50 Å²	50	45%	0.453	24%	0.243	S	C	.	.	H	α-helix	trans	-67.4	-56.8	179.4	179.3	179	-140.1	0	0	110.1	A1011 N1138 Y1142 L1143 D1144	A1011-E1140 HydrophobicContact CB-CB 4.06Å; N1138-E1140 PolarHBondContact O-N 3.13Å; N1138-E1140 PolarHBondContact OD1-N 2.74Å; N1138-E1140 VanDerWaalsContact OD1-N 3.15Å; E1140-Y1142 PolarHBondContact O-N 3.28Å; E1140-L1143 PolarHBondContact O-N 3.49Å; E1140-D1144 PolarHBondContact O-N 3.47Å
1141	K	91.4	Very high	86.7	Confident	38 Å²	38	56.2 Å²	56.2	17%	0.165	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-34.4	178.3	-64.3	178.4	-174.7	166.2	0	111.4	E1049 E1050 D1134 N1138 D1144 H1145	E1049-K1141 PolarHBondContact O-NZ 3.28Å; E1049-K1141 VanDerWaalsContact O-NZ 3.14Å; E1049-K1141 IonicContact OE1-NZ 2.8Å; E1049-K1141 PolarHBondContact OE1-NZ 2.74Å; E1050-K1141 IonicContact OE1-NZ 3.84Å; E1050-K1141 PolarHBondContact OE1-NZ 2.94Å; E1050-K1141 IonicContact OE2-NZ 2.87Å; E1050-K1141 PolarHBondContact OE2-NZ 3.01Å; D1134-K1141 HydrophobicContact CB-CB 4.09Å; N1138-K1141 HydrophobicContact CB-CB 4.42Å; N1138-K1141 WeakPolarHBondContact ND2-CD 3.12Å; N1138-K1141 PolarHBondContact OD1-N 2.89Å; K1141-D1144 PolarHBondContact O-N 3.33Å; K1141-H1145 PolarHBondContact O-CD2 2.76Å; K1141-H1145 VanDerWaalsContact O-CG 3.26Å; K1141-H1145 PolarHBondContact O-N 3.01Å; K1141-H1145 PolarHBondContact O-NE2 3.13Å
1142	Y	90.8	Very high	85	Confident	16 Å²	16	56.1 Å²	56.1	6%	0.063	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-48.3	171.6	171.9	-110.3	0	0	0	113.5	M1089 T1135 N1138 L1139 E1140 D1144 H1145 E1146	M1089-Y1142 HydrophobicContact CE-CE1 4.12Å; M1089-Y1142 HydrophobicContact SD-CE1 4.04Å; T1135-Y1142 HydrophobicContact CG2-CD2 3.93Å; T1135-Y1142 HydrophobicContact CG2-CE2 3.66Å; T1135-Y1142 VanDerWaalsContact OG1-CD2 3.28Å; T1135-Y1142 WeakPolarHBondContact OG1-CD2 3.33Å; N1138-Y1142 VanDerWaalsContact O-CB 3.25Å; N1138-Y1142 WeakPolarHBondContact O-CB 3.24Å; N1138-Y1142 PolarHBondContact O-N 3.26Å; L1139-Y1142 HydrophobicContact CD1-CD1 4.29Å; E1140-Y1142 PolarHBondContact O-N 3.28Å; Y1142-D1144 VanDerWaalsContact C-N 3.26Å; Y1142-D1144 PolarHBondContact O-N 3.47Å; Y1142-H1145 PolarHBondContact O-N 3.36Å; Y1142-E1146 HydrophobicContact CE1-CG 4.36Å; Y1142-E1146 HydrophobicContact CE2-CG 3.97Å; Y1142-E1146 PolarHBondContact O-N 2.95Å
1143	L	89.7	Confident	82.9	Confident	35 Å²	35	60.1 Å²	60.1	18%	0.183	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-29.9	179.4	-72.8	173	0	0	0	112.2	M1092 I1094 L1139 E1140 Q1147	M1092-L1143 HydrophobicContact CE-CD1 3.61Å; I1094-L1143 HydrophobicContact CD1-CD1 3.87Å; I1094-L1143 HydrophobicContact CD1-CD2 3.79Å; L1139-L1143 HydrophobicContact CD1-CD1 4.08Å; L1139-L1143 HydrophobicContact CD1-CG 4.14Å; L1139-L1143 HydrophobicContact CG-CD1 4.2Å; L1139-L1143 WeakPolarHBondContact O-CB 3.35Å; L1139-L1143 VanDerWaalsContact O-CG 3.28Å; L1139-L1143 WeakPolarHBondContact O-CG 3.35Å; L1139-L1143 PolarHBondContact O-N 3.33Å; E1140-L1143 PolarHBondContact O-N 3.49Å; L1143-Q1147 WeakPolarHBondContact O-CB 3.22Å; L1143-Q1147 VanDerWaalsContact O-CG 3.25Å; L1143-Q1147 WeakPolarHBondContact O-CG 3.41Å; L1143-Q1147 PolarHBondContact O-N 3.44Å; L1143-Q1147 VanDerWaalsContact O-N 3.16Å; L1143-Q1147 PolarHBondContact O-NE2 3.16Å
1144	D	87.3	Confident	80.8	Confident	96 Å²	96	66.2 Å²	66.2	51%	0.513	33%	0.328	S	S	.	.	H	α-helix	trans	-67.7	-43	170.6	-88.2	-3.8	0	0	0	112.4	E1140 K1141 Y1142 E1146 Q1147 R1148	E1140-D1144 PolarHBondContact O-N 3.47Å; K1141-D1144 PolarHBondContact O-N 3.33Å; Y1142-D1144 VanDerWaalsContact C-N 3.26Å; Y1142-D1144 PolarHBondContact O-N 3.47Å; D1144-E1146 PolarHBondContact O-N 3.36Å; D1144-Q1147 PolarHBondContact O-N 3.18Å; D1144-R1148 WeakPolarHBondContact O-CB 3.47Å; D1144-R1148 PolarHBondContact O-N 3.31Å
1145	H	84.3	Confident	78.4	Confident	55 Å²	55	73.9 Å²	73.9	26%	0.255	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-43.3	176.1	-64.3	-45.5	0	0	0	111.9	D1134 K1141 Y1142 Q1147 R1148	D1134-H1145 IonicContact OD2-CD2 2.68Å; D1134-H1145 IonicContact OD2-CE1 3.74Å; D1134-H1145 IonicContact OD2-NE2 2.67Å; D1134-H1145 PolarHBondContact OD2-NE2 2.78Å; K1141-H1145 PolarHBondContact O-CD2 2.76Å; K1141-H1145 VanDerWaalsContact O-CG 3.26Å; K1141-H1145 PolarHBondContact O-N 3.01Å; K1141-H1145 PolarHBondContact O-NE2 3.13Å; Y1142-H1145 PolarHBondContact O-N 3.36Å; H1145-Q1147 VanDerWaalsContact C-N 3.33Å; H1145-Q1147 PolarHBondContact O-N 3.32Å; H1145-R1148 PolarHBondContact O-N 3.21Å
1146	E	83.3	Confident	76.3	Confident	127 Å²	127	78.1 Å²	78.1	59%	0.593	38%	0.384	S	S	*	.	H	α-helix	trans	-64.6	-32.6	176.5	-85.9	-72.8	104.9	0	0	113.2	Y1142 D1144	Y1142-E1146 HydrophobicContact CE1-CG 4.36Å; Y1142-E1146 HydrophobicContact CE2-CG 3.97Å; Y1142-E1146 PolarHBondContact O-N 2.95Å; D1144-E1146 PolarHBondContact O-N 3.36Å
1147	Q	82	Confident	74.2	Confident	150 Å²	150	84 Å²	84	70%	0.701	41%	0.414	S	S	*	.	H	α-helix	trans	-84.7	-15.5	178.5	-72.4	175.4	93.9	0	0	113.7	L1143 D1144 H1145 D1149	L1143-Q1147 WeakPolarHBondContact O-CB 3.22Å; L1143-Q1147 VanDerWaalsContact O-CG 3.25Å; L1143-Q1147 WeakPolarHBondContact O-CG 3.41Å; L1143-Q1147 PolarHBondContact O-N 3.44Å; L1143-Q1147 VanDerWaalsContact O-N 3.16Å; L1143-Q1147 PolarHBondContact O-NE2 3.16Å; D1144-Q1147 PolarHBondContact O-N 3.18Å; H1145-Q1147 VanDerWaalsContact C-N 3.33Å; H1145-Q1147 PolarHBondContact O-N 3.32Å; Q1147-D1149 PolarHBondContact O-N 3.38Å
1148	R	76.8	Confident	71.9	Confident	149 Å²	149	90.9 Å²	90.9	56%	0.562	45%	0.45	S	S	*	.	S	Bend	trans	-70.8	124.4	-175.1	-153.6	170.6	-173.7	110.9	-5	111	D1144 H1145 P1150	D1144-R1148 WeakPolarHBondContact O-CB 3.47Å; D1144-R1148 PolarHBondContact O-N 3.31Å; H1145-R1148 PolarHBondContact O-N 3.21Å; R1148-P1150 VanDerWaalsContact O-CD 3.31Å; R1148-P1150 WeakPolarHBondContact O-CD 3.41Å
1149	D	63	Low	69.5	Low	91 Å²	91	95.3 Å²	95.3	49%	0.487	48%	0.481	S	S	.	.			trans	-54.4	120.7	177.5	-178.7	-10.1	0	0	0	110.6	Q1147 F1151 A1152	Q1147-D1149 PolarHBondContact O-N 3.38Å; D1149-F1151 PolarHBondContact O-N 3.03Å; D1149-F1151 WeakPolarHBondContact OD1-CB 3.38Å; D1149-F1151 WeakPolarHBondContact OD1-CD2 3.5Å; D1149-F1151 PolarHBondContact OD1-N 3.05Å; D1149-A1152 HydrophobicContact CB-CB 4.38Å; D1149-A1152 WeakPolarHBondContact O-CB 3.25Å; D1149-A1152 PolarHBondContact O-N 3.5Å
1150	P	59.8	Low	67.5	Low	106 Å²	106	104.9 Å²	104.9	69%	0.688	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.9	178	-28.3	36.6	0	0	0	114.6	R1148	R1148-P1150 VanDerWaalsContact O-CD 3.31Å; R1148-P1150 WeakPolarHBondContact O-CD 3.41Å
1151	F	57.4	Low	65.9	Low	165 Å²	165	102.6 Å²	102.6	72%	0.724	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-8.7	174.4	-61.5	-72	0	0	0	114.2	D1149	D1149-F1151 PolarHBondContact O-N 3.03Å; D1149-F1151 WeakPolarHBondContact OD1-CB 3.38Å; D1149-F1151 WeakPolarHBondContact OD1-CD2 3.5Å; D1149-F1151 PolarHBondContact OD1-N 3.05Å
1152	A	59.1	Low	64.7	Low	36 Å²	36	107.1 Å²	107.1	30%	0.298	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.6	-47	177.1	0	0	0	0	0	111.9	D1149 Q1154 K1155	D1149-A1152 HydrophobicContact CB-CB 4.38Å; D1149-A1152 WeakPolarHBondContact O-CB 3.25Å; D1149-A1152 PolarHBondContact O-N 3.5Å; A1152-Q1154 PolarHBondContact O-N 3.19Å; A1152-K1155 PolarHBondContact O-N 3.14Å
1153	V	53.6	Low	63.9	Low	83 Å²	83	112.2 Å²	112.2	50%	0.503	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.7	-18.6	-179.5	-174	0	0	0	0	113	K1155	V1153-K1155 VanDerWaalsContact C-N 3.34Å
1154	Q	52.4	Low	63.6	Low	128 Å²	128	113.9 Å²	113.9	60%	0.598	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-9.2	178	-131	77.9	98.5	0	0	114.8	A1152	A1152-Q1154 PolarHBondContact O-N 3.19Å
1155	K	47.9	Very low	63.7	Low	166 Å²	166	111.2 Å²	111.2	72%	0.722	59%	0.588	S	S	*	*	S	Bend	trans	-86.7	-31.2	178.5	-79.8	-176.8	172	179.5	0	114.3	A1152 V1153 I1157 D1158	A1152-K1155 PolarHBondContact O-N 3.14Å; V1153-K1155 VanDerWaalsContact C-N 3.34Å; K1155-I1157 PolarHBondContact O-N 3.16Å; K1155-I1157 VanDerWaalsContact O-N 3.13Å; K1155-D1158 PolarHBondContact O-N 3.08Å
1156	D	51.2	Low	64.1	Low	92 Å²	92	110.5 Å²	110.5	49%	0.492	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-70.5	-15.3	-168.7	-49.7	-39.5	0	0	0	111.9	D1158	D1156-D1158 PolarHBondContact O-N 2.93Å
1157	I	54.2	Low	64.7	Low	124 Å²	124	104.9 Å²	104.9	64%	0.636	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-73	-21.9	179.6	-57.8	174	0	0	0	113.2	K1155	K1155-I1157 PolarHBondContact O-N 3.16Å; K1155-I1157 VanDerWaalsContact O-N 3.13Å
1158	D	48.5	Very low	65.3	Low	143 Å²	143	99.3 Å²	99.3	77%	0.765	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-89	3.1	-172.1	-81.7	-17.7	0	0	0	114.5	K1155 D1156	K1155-D1158 PolarHBondContact O-N 3.08Å; D1156-D1158 PolarHBondContact O-N 2.93Å
1159	S	45.8	Very low	66.2	Low	94 Å²	94	95.5 Å²	95.5	66%	0.657	52%	0.522	S	S	*	.			trans	-87.4	111.3	176.4	-75	0	0	0	0	112.1	G1161	S1159-G1161 PolarHBondContact O-N 3.47Å
1160	E	47.5	Very low	67.7	Low	212 Å²	212	92.5 Å²	92.5	99%	0.991	50%	0.504	S	S	*	.			trans	-73.9	14.4	177.2	-71.4	-159.2	144	0	0	115.1
1161	G	58.5	Low	69.5	Low	49 Å²	49	87.5 Å²	87.5	51%	0.505	47%	0.471	S	S	.	.	S	Bend	trans	-96.9	157.5	172.1	0	0	0	0	0	111.9	S1159 E1163	S1159-G1161 PolarHBondContact O-N 3.47Å; G1161-E1163 PolarHBondContact O-N 3.19Å
1162	P	65.6	Low	71.2	Confident	132 Å²	132	82.1 Å²	82.1	86%	0.857	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-59.2	119.7	157.8	-14.3	29.3	0	0	0	108.1
1163	E	74.2	Confident	72.9	Confident	124 Å²	124	86.7 Å²	86.7	58%	0.579	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-66.8	132.9	172	-162.6	-172.6	157.7	0	0	108.5	G1161 K1169	G1161-E1163 PolarHBondContact O-N 3.19Å; E1163-K1169 IonicContact OE1-NZ 3.82Å; E1163-K1169 PolarHBondContact OE1-NZ 3.15Å
1164	P	82.9	Confident	74.9	Confident	70 Å²	70	84.5 Å²	84.5	46%	0.455	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-58.5	151.8	171	24.2	-32.5	0	0	0	110.1	D1168 K1169	P1164-D1168 HydrophobicContact CB-CB 4.05Å; P1164-K1169 HydrophobicContact CB-CG 4.35Å; P1164-K1169 HydrophobicContact CG-CG 3.99Å; P1164-K1169 WeakPolarHBondContact O-CE 3.5Å
1165	S	90.4	Very high	76.9	Confident	40 Å²	40	79.1 Å²	79.1	28%	0.28	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-66.1	161	175.5	71	0	0	0	0	110.6	W1167 D1168 K1169	S1165-W1167 PolarHBondContact O-N 3.25Å; S1165-D1168 VanDerWaalsContact CB-OD2 3.28Å; S1165-D1168 WeakPolarHBondContact CB-OD2 3.44Å; S1165-D1168 PolarHBondContact N-OD2 3.39Å; S1165-D1168 PolarHBondContact O-N 3.27Å; S1165-D1168 VanDerWaalsContact O-N 3.08Å; S1165-D1168 PolarHBondContact OG-N 3.41Å; S1165-D1168 VanDerWaalsContact OG-N 3.15Å; S1165-D1168 PolarHBondContact OG-OD1 3.44Å; S1165-D1168 PolarHBondContact OG-OD2 2.68Å; S1165-K1169 WeakPolarHBondContact O-CG 3.49Å; S1165-K1169 PolarHBondContact O-N 3.27Å; S1165-K1169 VanDerWaalsContact O-N 3.08Å
1166	D	92.2	Very high	79	Confident	39 Å²	39	78.4 Å²	78.4	21%	0.209	43%	0.43	C	S	.	.	H	α-helix	trans	-63.1	-30.8	176.8	-65	-15.8	0	0	0	111.3	K1053 K1169 Y1170	K1053-D1166 WeakPolarHBondContact CD-OD2 3.35Å; K1053-D1166 WeakPolarHBondContact CE-OD2 3.46Å; K1053-D1166 IonicContact NZ-OD1 3.3Å; K1053-D1166 PolarHBondContact NZ-OD1 2.85Å; K1053-D1166 IonicContact NZ-OD2 2.67Å; K1053-D1166 PolarHBondContact NZ-OD2 3.11Å; D1166-K1169 PolarHBondContact O-N 3.03Å; D1166-K1169 IonicContact OD1-NZ 2.73Å; D1166-K1169 PolarHBondContact OD1-NZ 3.09Å; D1166-Y1170 WeakPolarHBondContact O-CB 3.5Å; D1166-Y1170 PolarHBondContact O-N 3.37Å
1167	W	95.8	Very high	81	Confident	10 Å²	10	77.3 Å²	77.3	4%	0.038	42%	0.424	C	S	.	.	H	α-helix	trans	-59.8	-49.4	168.1	171.4	-92.7	0	0	0	112.7	H980 I984 L1046 L1047 E1050 D1051 S1165 K1169 Y1170 A1171	H980-W1167 HydrophobicContact CB-CZ2 4.29Å; H980-W1167 AromaticContact CE1-CD1 3.9Å; H980-W1167 AromaticContact CE1-NE1 3.53Å; H980-W1167 AromaticContact CG-NE1 3.62Å; H980-W1167 AromaticContact ND1-CD1 3.83Å; H980-W1167 AromaticContact ND1-NE1 3.1Å; H980-W1167 PolarHBondContact ND1-NE1 3.44Å; H980-W1167 VanDerWaalsContact ND1-NE1 3.1Å; I984-W1167 HydrophobicContact CD1-CH2 3.87Å; I984-W1167 HydrophobicContact CD1-CZ2 3.74Å; I984-W1167 HydrophobicContact CG1-CH2 3.52Å; I984-W1167 HydrophobicContact CG1-CZ2 3.83Å; L1046-W1167 HydrophobicContact CG-CH2 4.38Å; L1046-W1167 HydrophobicContact CG-CZ3 4.05Å; L1047-W1167 HydrophobicContact CD2-CD2 3.66Å; L1047-W1167 HydrophobicContact CD2-CE3 3.83Å; L1047-W1167 HydrophobicContact CD2-CG 4.28Å; L1047-W1167 HydrophobicContact CD2-CH2 4.22Å; L1047-W1167 HydrophobicContact CD2-CZ2 4.05Å; L1047-W1167 HydrophobicContact CD2-CZ3 4.1Å; E1050-W1167 HydrophobicContact CB-CE3 4.38Å; D1051-W1167 HydrophobicContact CB-CB 4.13Å; S1165-W1167 PolarHBondContact O-N 3.25Å; W1167-K1169 VanDerWaalsContact C-N 3.25Å; W1167-K1169 PolarHBondContact O-N 2.97Å; W1167-Y1170 HydrophobicContact CE3-CD1 4.31Å; W1167-Y1170 HydrophobicContact CH2-CD1 4.39Å; W1167-Y1170 AromaticContact CZ3-CD1 3.88Å; W1167-Y1170 HydrophobicContact CZ3-CD1 3.88Å; W1167-Y1170 HydrophobicContact CZ3-CE1 4.22Å; W1167-Y1170 PolarHBondContact O-N 2.85Å; W1167-A1171 HydrophobicContact CZ2-CB 3.85Å; W1167-A1171 WeakPolarHBondContact O-CB 3.27Å; W1167-A1171 PolarHBondContact O-N 2.83Å
1168	D	95.2	Very high	82.7	Confident	33 Å²	33	72.4 Å²	72.4	18%	0.176	40%	0.399	C	S	.	.	H	α-helix	trans	-64.9	-32.7	-177.2	-52.6	-49.9	0	0	0	111.4	H980 P1164 S1165 A1172	H980-D1168 IonicContact CE1-OD1 3.75Å; H980-D1168 PolarHBondContact CE1-OD1 3.36Å; H980-D1168 VanDerWaalsContact CE1-OD1 3.29Å; P1164-D1168 HydrophobicContact CB-CB 4.05Å; S1165-D1168 VanDerWaalsContact CB-OD2 3.28Å; S1165-D1168 WeakPolarHBondContact CB-OD2 3.44Å; S1165-D1168 PolarHBondContact N-OD2 3.39Å; S1165-D1168 PolarHBondContact O-N 3.27Å; S1165-D1168 VanDerWaalsContact O-N 3.08Å; S1165-D1168 PolarHBondContact OG-N 3.41Å; S1165-D1168 VanDerWaalsContact OG-N 3.15Å; S1165-D1168 PolarHBondContact OG-OD1 3.44Å; S1165-D1168 PolarHBondContact OG-OD2 2.68Å; D1168-A1172 WeakPolarHBondContact O-CB 3.49Å; D1168-A1172 PolarHBondContact O-N 2.79Å
1169	K	94.6	Very high	84.6	Confident	69 Å²	69	67.1 Å²	67.1	30%	0.3	37%	0.371	S	S	.	.	H	α-helix	trans	-66.6	-52.6	173.1	-62.3	167	-160.2	161.1	0	111	E1163 P1164 S1165 D1166 W1167 A1171 A1172 E1173	E1163-K1169 IonicContact OE1-NZ 3.82Å; E1163-K1169 PolarHBondContact OE1-NZ 3.15Å; P1164-K1169 HydrophobicContact CB-CG 4.35Å; P1164-K1169 HydrophobicContact CG-CG 3.99Å; P1164-K1169 WeakPolarHBondContact O-CE 3.5Å; S1165-K1169 WeakPolarHBondContact O-CG 3.49Å; S1165-K1169 PolarHBondContact O-N 3.27Å; S1165-K1169 VanDerWaalsContact O-N 3.08Å; D1166-K1169 PolarHBondContact O-N 3.03Å; D1166-K1169 IonicContact OD1-NZ 2.73Å; D1166-K1169 PolarHBondContact OD1-NZ 3.09Å; W1167-K1169 VanDerWaalsContact C-N 3.25Å; W1167-K1169 PolarHBondContact O-N 2.97Å; K1169-A1171 PolarHBondContact O-N 3.23Å; K1169-A1172 PolarHBondContact O-N 3.19Å; K1169-E1173 WeakPolarHBondContact O-CB 3.36Å; K1169-E1173 PolarHBondContact O-N 3.09Å
1170	Y	95.4	Very high	86.6	Confident	28 Å²	28	65.4 Å²	65.4	11%	0.11	36%	0.363	C	S	.	.	H	α-helix	trans	-57.3	-47.9	179.7	175.2	-99.7	0	0	0	111.6	V983 Y1007 L1046 E1050 D1166 W1167 A1172 E1173 E1174	V983-Y1170 HydrophobicContact CG1-CE1 4.16Å; Y1007-Y1170 PolarHBondContact OH-OH 2.82Å; Y1007-Y1170 VanDerWaalsContact OH-OH 3.08Å; L1046-Y1170 HydrophobicContact CD1-CE1 4.26Å; E1050-Y1170 HydrophobicContact CB-CD1 4.16Å; E1050-Y1170 HydrophobicContact CB-CG 4.14Å; E1050-Y1170 HydrophobicContact CG-CD1 3.85Å; E1050-Y1170 HydrophobicContact CG-CD2 4.09Å; E1050-Y1170 HydrophobicContact CG-CE1 3.81Å; E1050-Y1170 HydrophobicContact CG-CE2 4.07Å; E1050-Y1170 HydrophobicContact CG-CG 3.99Å; D1166-Y1170 WeakPolarHBondContact O-CB 3.5Å; D1166-Y1170 PolarHBondContact O-N 3.37Å; W1167-Y1170 HydrophobicContact CE3-CD1 4.31Å; W1167-Y1170 HydrophobicContact CH2-CD1 4.39Å; W1167-Y1170 AromaticContact CZ3-CD1 3.88Å; W1167-Y1170 HydrophobicContact CZ3-CD1 3.88Å; W1167-Y1170 HydrophobicContact CZ3-CE1 4.22Å; W1167-Y1170 PolarHBondContact O-N 2.85Å; Y1170-A1172 VanDerWaalsContact C-N 3.33Å; Y1170-A1172 PolarHBondContact O-N 3.37Å; Y1170-E1173 PolarHBondContact O-N 3.27Å; Y1170-E1174 HydrophobicContact CD1-CG 4.34Å; Y1170-E1174 HydrophobicContact CD2-CG 4.02Å; Y1170-E1174 HydrophobicContact CE1-CG 3.94Å; Y1170-E1174 HydrophobicContact CE2-CG 3.58Å; Y1170-E1174 HydrophobicContact CG-CG 4.38Å; Y1170-E1174 WeakPolarHBondContact O-CB 3.22Å; Y1170-E1174 WeakPolarHBondContact O-CG 3.49Å; Y1170-E1174 PolarHBondContact O-N 2.82Å
1171	A	96.3	Very high	88.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-64.7	-35.1	-179.9	0	0	0	0	0	112.9	V983 W1167 K1169 Y1175	V983-A1171 WeakPolarHBondContact CG2-O 3.5Å; W1167-A1171 HydrophobicContact CZ2-CB 3.85Å; W1167-A1171 WeakPolarHBondContact O-CB 3.27Å; W1167-A1171 PolarHBondContact O-N 2.83Å; K1169-A1171 PolarHBondContact O-N 3.23Å; A1171-Y1175 VanDerWaalsContact O-CB 3.24Å; A1171-Y1175 WeakPolarHBondContact O-CB 3.02Å; A1171-Y1175 PolarHBondContact O-N 3.25Å; A1171-Y1175 VanDerWaalsContact O-N 3.16Å
1172	A	94.3	Very high	89.3	Confident	52 Å²	52	60.4 Å²	60.4	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-71.2	-41.6	174.8	0	0	0	0	0	112.5	D1168 K1169 Y1170 Y1175 E1176	D1168-A1172 WeakPolarHBondContact O-CB 3.49Å; D1168-A1172 PolarHBondContact O-N 2.79Å; K1169-A1172 PolarHBondContact O-N 3.19Å; Y1170-A1172 VanDerWaalsContact C-N 3.33Å; Y1170-A1172 PolarHBondContact O-N 3.37Å; A1172-Y1175 PolarHBondContact O-N 3.37Å; A1172-E1176 PolarHBondContact O-N 3.05Å; A1172-E1176 VanDerWaalsContact O-N 3.08Å
1173	E	94.8	Very high	89.9	Confident	133 Å²	133	56.5 Å²	56.5	62%	0.621	30%	0.3	S	S	*	.	H	α-helix	trans	-68.3	-47.2	-179.9	-173.5	159.7	-157.6	0	0	111.7	K1169 Y1170 Y1175 E1176 I1177	K1169-E1173 WeakPolarHBondContact O-CB 3.36Å; K1169-E1173 PolarHBondContact O-N 3.09Å; Y1170-E1173 PolarHBondContact O-N 3.27Å; E1173-Y1175 VanDerWaalsContact C-N 3.33Å; E1173-Y1175 PolarHBondContact O-N 2.98Å; E1173-E1176 PolarHBondContact O-N 3.19Å; E1173-I1177 HydrophobicContact CG-CD1 4.23Å; E1173-I1177 VanDerWaalsContact O-CG1 3.3Å; E1173-I1177 WeakPolarHBondContact O-CG1 3.4Å; E1173-I1177 PolarHBondContact O-N 2.86Å
1174	E	94.5	Very high	90.1	Very high	36 Å²	36	53 Å²	53	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-63.6	-35.1	174.7	-71.8	-69.2	147.8	0	0	112.7	V983 K987 Y1170 I1177 L1178	V983-E1174 HydrophobicContact CG1-CB 3.73Å; V983-E1174 HydrophobicContact CG1-CG 4.27Å; V983-E1174 HydrophobicContact CG2-CB 3.98Å; K987-E1174 WeakPolarHBondContact CE-OE2 3.36Å; K987-E1174 IonicContact NZ-OE2 3.19Å; K987-E1174 PolarHBondContact NZ-OE2 2.73Å; Y1170-E1174 HydrophobicContact CD1-CG 4.34Å; Y1170-E1174 HydrophobicContact CD2-CG 4.02Å; Y1170-E1174 HydrophobicContact CE1-CG 3.94Å; Y1170-E1174 HydrophobicContact CE2-CG 3.58Å; Y1170-E1174 HydrophobicContact CG-CG 4.38Å; Y1170-E1174 WeakPolarHBondContact O-CB 3.22Å; Y1170-E1174 WeakPolarHBondContact O-CG 3.49Å; Y1170-E1174 PolarHBondContact O-N 2.82Å; E1174-I1177 PolarHBondContact O-N 2.74Å; E1174-L1178 WeakPolarHBondContact O-CB 3.22Å; E1174-L1178 VanDerWaalsContact O-CG 3.26Å; E1174-L1178 WeakPolarHBondContact O-CG 3.42Å; E1174-L1178 PolarHBondContact O-N 3.31Å
1175	Y	94.4	Very high	89.7	Confident	15 Å²	15	53.4 Å²	53.4	6%	0.059	29%	0.291	C	S	.	.	H	α-helix	trans	-67.7	-41.9	175.5	-169	-96	0	0	0	111.8	Y360 E361 E979 Y982 V983 A1171 A1172 E1173 I1177 L1178 V1179	Y360-Y1175 WeakPolarHBondContact CB-OH 3.38Å; Y360-Y1175 PolarHBondContact N-OH 3.32Å; Y360-Y1175 VanDerWaalsContact N-OH 3.07Å; E361-Y1175 WeakPolarHBondContact OE2-CE1 3.4Å; E361-Y1175 PolarHBondContact OE2-OH 2.8Å; E979-Y1175 HydrophobicContact CB-CD2 4.15Å; E979-Y1175 HydrophobicContact CB-CE2 4.47Å; E979-Y1175 HydrophobicContact CB-CG 4.25Å; E979-Y1175 HydrophobicContact CG-CD1 3.81Å; E979-Y1175 HydrophobicContact CG-CD2 3.97Å; E979-Y1175 HydrophobicContact CG-CE1 3.82Å; E979-Y1175 HydrophobicContact CG-CE2 3.99Å; E979-Y1175 HydrophobicContact CG-CG 3.89Å; Y982-Y1175 AromaticContact CD1-CD2 3.77Å; Y982-Y1175 HydrophobicContact CD1-CD2 3.77Å; Y982-Y1175 AromaticContact CD1-CE2 3.7Å; Y982-Y1175 HydrophobicContact CD1-CE2 3.7Å; Y982-Y1175 HydrophobicContact CD2-CE2 4.22Å; Y982-Y1175 HydrophobicContact CE1-CD2 4.42Å; Y982-Y1175 HydrophobicContact CE1-CE2 4.19Å; Y982-Y1175 HydrophobicContact CG-CD2 4.11Å; Y982-Y1175 AromaticContact CG-CE2 3.72Å; Y982-Y1175 HydrophobicContact CG-CE2 3.72Å; V983-Y1175 HydrophobicContact CG2-CD2 4.45Å; A1171-Y1175 VanDerWaalsContact O-CB 3.24Å; A1171-Y1175 WeakPolarHBondContact O-CB 3.02Å; A1171-Y1175 PolarHBondContact O-N 3.25Å; A1171-Y1175 VanDerWaalsContact O-N 3.16Å; A1172-Y1175 PolarHBondContact O-N 3.37Å; E1173-Y1175 VanDerWaalsContact C-N 3.33Å; E1173-Y1175 PolarHBondContact O-N 2.98Å; Y1175-I1177 VanDerWaalsContact C-N 3.3Å; Y1175-I1177 PolarHBondContact O-N 2.86Å; Y1175-L1178 PolarHBondContact O-N 2.98Å; Y1175-V1179 HydrophobicContact CD1-CG2 4.03Å; Y1175-V1179 HydrophobicContact CE1-CG2 3.66Å; Y1175-V1179 HydrophobicContact CE2-CG2 4.38Å; Y1175-V1179 WeakPolarHBondContact O-CB 3.38Å; Y1175-V1179 VanDerWaalsContact O-CG2 3.32Å; Y1175-V1179 WeakPolarHBondContact O-CG2 3.35Å; Y1175-V1179 PolarHBondContact O-N 3.12Å
1176	E	93.1	Very high	88.6	Confident	152 Å²	152	56.3 Å²	56.3	71%	0.71	30%	0.3	S	S	*	.	H	α-helix	trans	-62	-38.1	174	-171.4	173.2	-179.7	0	0	111.5	A1172 E1173 A1180	A1172-E1176 PolarHBondContact O-N 3.05Å; A1172-E1176 VanDerWaalsContact O-N 3.08Å; E1173-E1176 PolarHBondContact O-N 3.19Å; E1176-A1180 VanDerWaalsContact O-CB 3.24Å; E1176-A1180 WeakPolarHBondContact O-CB 3.32Å; E1176-A1180 PolarHBondContact O-N 3.23Å; E1176-A1180 VanDerWaalsContact O-N 3.08Å
1177	I	93	Very high	87.1	Confident	69 Å²	69	60.8 Å²	60.8	35%	0.354	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-54.5	175	-67.9	164.1	0	0	0	111.2	E1173 E1174 Y1175 V1179 A1180 E1181	E1173-I1177 HydrophobicContact CG-CD1 4.23Å; E1173-I1177 VanDerWaalsContact O-CG1 3.3Å; E1173-I1177 WeakPolarHBondContact O-CG1 3.4Å; E1173-I1177 PolarHBondContact O-N 2.86Å; E1174-I1177 PolarHBondContact O-N 2.74Å; Y1175-I1177 VanDerWaalsContact C-N 3.3Å; Y1175-I1177 PolarHBondContact O-N 2.86Å; I1177-V1179 VanDerWaalsContact C-N 3.33Å; I1177-V1179 PolarHBondContact O-N 3.38Å; I1177-A1180 PolarHBondContact O-N 2.65Å; I1177-E1181 HydrophobicContact CG2-CG 4.35Å; I1177-E1181 PolarHBondContact O-N 3.36Å
1178	L	90.4	Very high	85.3	Confident	20 Å²	20	66.2 Å²	66.2	11%	0.105	35%	0.349	C	S	.	.	H	α-helix	trans	-57.8	-44.2	-177.9	-73.3	166	0	0	0	111.9	Y982 V983 C986 E1174 Y1175 A1180 E1181 E1182	Y982-L1178 HydrophobicContact CD1-CD1 4.24Å; Y982-L1178 HydrophobicContact CE1-CB 4.39Å; Y982-L1178 HydrophobicContact CE1-CD1 4.16Å; V983-L1178 HydrophobicContact CG2-CD1 4.3Å; C986-L1178 HydrophobicContact CB-CD1 3.85Å; C986-L1178 HydrophobicContact CB-CD2 4.31Å; E1174-L1178 WeakPolarHBondContact O-CB 3.22Å; E1174-L1178 VanDerWaalsContact O-CG 3.26Å; E1174-L1178 WeakPolarHBondContact O-CG 3.42Å; E1174-L1178 PolarHBondContact O-N 3.31Å; Y1175-L1178 PolarHBondContact O-N 2.98Å; L1178-A1180 VanDerWaalsContact C-N 3.35Å; L1178-A1180 PolarHBondContact O-N 3.07Å; L1178-E1181 PolarHBondContact O-N 3.34Å; L1178-E1182 PolarHBondContact O-N 2.72Å; L1178-E1182 VanDerWaalsContact O-N 3.15Å
1179	V	87.7	Confident	83.2	Confident	32 Å²	32	72.4 Å²	72.4	19%	0.194	38%	0.376	C	S	.	.	H	α-helix	trans	-64.4	-38.7	176.1	172.4	0	0	0	0	111.5	Y1175 I1177 T1183	Y1175-V1179 HydrophobicContact CD1-CG2 4.03Å; Y1175-V1179 HydrophobicContact CE1-CG2 3.66Å; Y1175-V1179 HydrophobicContact CE2-CG2 4.38Å; Y1175-V1179 WeakPolarHBondContact O-CB 3.38Å; Y1175-V1179 VanDerWaalsContact O-CG2 3.32Å; Y1175-V1179 WeakPolarHBondContact O-CG2 3.35Å; Y1175-V1179 PolarHBondContact O-N 3.12Å; I1177-V1179 VanDerWaalsContact C-N 3.33Å; I1177-V1179 PolarHBondContact O-N 3.38Å; V1179-T1183 VanDerWaalsContact O-CB 3.26Å; V1179-T1183 WeakPolarHBondContact O-CB 3.5Å; V1179-T1183 PolarHBondContact O-N 3.02Å; V1179-T1183 VanDerWaalsContact O-N 3.09Å; V1179-T1183 PolarHBondContact O-OG1 3.35Å
1180	A	87.2	Confident	80.9	Confident	58 Å²	58	77.2 Å²	77.2	48%	0.479	40%	0.4	S	S	.	.	H	α-helix	trans	-70	-39.2	178.6	0	0	0	0	0	113.2	E1176 I1177 L1178 A1184	E1176-A1180 VanDerWaalsContact O-CB 3.24Å; E1176-A1180 WeakPolarHBondContact O-CB 3.32Å; E1176-A1180 PolarHBondContact O-N 3.23Å; E1176-A1180 VanDerWaalsContact O-N 3.08Å; I1177-A1180 PolarHBondContact O-N 2.65Å; L1178-A1180 VanDerWaalsContact C-N 3.35Å; L1178-A1180 PolarHBondContact O-N 3.07Å; A1180-A1184 PolarHBondContact O-N 3.48Å; A1180-A1184 VanDerWaalsContact O-N 3.08Å
1181	E	85.7	Confident	78.5	Confident	131 Å²	131	79.1 Å²	79.1	61%	0.612	43%	0.428	S	S	*	.	H	α-helix	trans	-66.2	-44.4	177.2	-71	-166.6	160.7	0	0	111.9	I1177 L1178 A1184 N1185	I1177-E1181 HydrophobicContact CG2-CG 4.35Å; I1177-E1181 PolarHBondContact O-N 3.36Å; L1178-E1181 PolarHBondContact O-N 3.34Å; E1181-A1184 WeakPolarHBondContact O-CB 3.45Å; E1181-A1184 PolarHBondContact O-N 2.61Å; E1181-N1185 PolarHBondContact O-N 3.03Å
1182	E	77	Confident	76	Confident	25 Å²	25	84.6 Å²	84.6	12%	0.117	46%	0.462	C	S	.	.	H	α-helix	trans	-66.9	-41.8	178.3	-154.9	-170.8	147.4	0	0	111.7	F352 Q356 R359 L1178 A1184 N1185 E1186	F352-E1182 HydrophobicContact CD2-CG 3.9Å; F352-E1182 HydrophobicContact CE2-CG 3.83Å; Q356-E1182 PolarHBondContact NE2-OE2 3.48Å; Q356-E1182 PolarHBondContact OE1-OE1 2.63Å; Q356-E1182 PolarHBondContact OE1-OE2 3.28Å; R359-E1182 IonicContact CZ-OE1 3.33Å; R359-E1182 IonicContact CZ-OE2 3.35Å; R359-E1182 IonicContact NE-OE1 2.74Å; R359-E1182 PolarHBondContact NE-OE1 3.48Å; R359-E1182 IonicContact NE-OE2 2.7Å; R359-E1182 PolarHBondContact NE-OE2 3.25Å; R359-E1182 IonicContact NH2-OE1 3.63Å; R359-E1182 PolarHBondContact NH2-OE1 3.15Å; R359-E1182 IonicContact NH2-OE2 3.21Å; L1178-E1182 PolarHBondContact O-N 2.72Å; L1178-E1182 VanDerWaalsContact O-N 3.15Å; E1182-A1184 PolarHBondContact O-N 2.59Å; E1182-N1185 WeakPolarHBondContact O-CB 3.45Å; E1182-N1185 PolarHBondContact O-N 3.36Å; E1182-E1186 PolarHBondContact O-N 2.81Å
1183	T	79.5	Confident	73.5	Confident	50 Å²	50	91.3 Å²	91.3	31%	0.307	48%	0.481	S	S	.	.	H	α-helix	trans	-58.4	-33	173.3	-61.8	0	0	0	0	112.5	V1179 Q1187	V1179-T1183 VanDerWaalsContact O-CB 3.26Å; V1179-T1183 WeakPolarHBondContact O-CB 3.5Å; V1179-T1183 PolarHBondContact O-N 3.02Å; V1179-T1183 VanDerWaalsContact O-N 3.09Å; V1179-T1183 PolarHBondContact O-OG1 3.35Å; T1183-Q1187 WeakPolarHBondContact O-CG 3.27Å; T1183-Q1187 PolarHBondContact O-NE2 3.3Å
1184	A	78.7	Confident	71.1	Confident	51 Å²	51	92.8 Å²	92.8	42%	0.421	49%	0.494	S	S	.	.	H	α-helix	trans	-74.4	-35.8	174.3	0	0	0	0	0	112.2	A1180 E1181 E1182 Q1187 L1188	A1180-A1184 PolarHBondContact O-N 3.48Å; A1180-A1184 VanDerWaalsContact O-N 3.08Å; E1181-A1184 WeakPolarHBondContact O-CB 3.45Å; E1181-A1184 PolarHBondContact O-N 2.61Å; E1182-A1184 PolarHBondContact O-N 2.59Å; A1184-Q1187 PolarHBondContact O-N 3.39Å; A1184-L1188 WeakPolarHBondContact O-CG 3.47Å; A1184-L1188 PolarHBondContact O-N 3.22Å
1185	N	72.8	Confident	68.7	Low	79 Å²	79	98.6 Å²	98.6	42%	0.422	53%	0.526	S	S	.	.	H	α-helix	trans	-69.3	-39.8	178.5	-157.7	15.7	0	0	0	112.1	E1181 E1182 Q1187 L1188 H1189	E1181-N1185 PolarHBondContact O-N 3.03Å; E1182-N1185 WeakPolarHBondContact O-CB 3.45Å; E1182-N1185 PolarHBondContact O-N 3.36Å; N1185-Q1187 PolarHBondContact O-N 2.85Å; N1185-L1188 PolarHBondContact O-N 3.08Å; N1185-H1189 PolarHBondContact O-N 2.96Å
1186	E	67.4	Low	66.4	Low	100 Å²	100	105.2 Å²	105.2	47%	0.467	56%	0.562	S	S	.	*	H	α-helix	trans	-58	-45.7	172.8	-72.9	-178.9	154.3	0	0	112.2	R359 E1182 L1188 H1189 E1190	R359-E1186 IonicContact CZ-OE1 2.61Å; R359-E1186 IonicContact NH1-OE1 2.59Å; R359-E1186 IonicContact NH1-OE2 2.74Å; R359-E1186 IonicContact NH2-OE1 3.78Å; R359-E1186 PolarHBondContact NH2-OE1 3.44Å; R359-E1186 IonicContact NH2-OE2 3.72Å; E1182-E1186 PolarHBondContact O-N 2.81Å; E1186-L1188 VanDerWaalsContact C-N 3.26Å; E1186-L1188 PolarHBondContact O-N 3.28Å; E1186-H1189 WeakPolarHBondContact O-CA 3.09Å; E1186-H1189 WeakPolarHBondContact O-CB 3.49Å; E1186-H1189 PolarHBondContact O-N 3.43Å; E1186-E1190 PolarHBondContact O-N 3.05Å
1187	Q	61.1	Low	64	Low	133 Å²	133	108.8 Å²	108.8	62%	0.621	57%	0.571	S	S	*	*	H	α-helix	trans	-64	-29.7	-179.9	-73.7	171	54.5	0	0	113.1	T1183 A1184 N1185 H1189 G1191	T1183-Q1187 WeakPolarHBondContact O-CG 3.27Å; T1183-Q1187 PolarHBondContact O-NE2 3.3Å; A1184-Q1187 PolarHBondContact O-N 3.39Å; N1185-Q1187 PolarHBondContact O-N 2.85Å; Q1187-H1189 VanDerWaalsContact C-N 3.34Å; Q1187-G1191 PolarHBondContact O-N 3.28Å
1188	L	57.5	Low	61.7	Low	125 Å²	125	113.9 Å²	113.9	65%	0.654	59%	0.593	S	S	*	*	H	α-helix	trans	-72.4	-29.2	172.5	-66.6	171.1	0	0	0	112.1	A1184 N1185 E1186 T1192	A1184-L1188 WeakPolarHBondContact O-CG 3.47Å; A1184-L1188 PolarHBondContact O-N 3.22Å; N1185-L1188 PolarHBondContact O-N 3.08Å; E1186-L1188 VanDerWaalsContact C-N 3.26Å; E1186-L1188 PolarHBondContact O-N 3.28Å; L1188-T1192 PolarHBondContact O-OG1 2.86Å
1189	H	51.3	Low	59.2	Low	162 Å²	162	117.8 Å²	117.8	75%	0.75	62%	0.622	S	S	*	*	H	α-helix	trans	-77.2	-44.3	179	-138	80	0	0	0	112.2	N1185 E1186 Q1187 G1191	N1185-H1189 PolarHBondContact O-N 2.96Å; E1186-H1189 WeakPolarHBondContact O-CA 3.09Å; E1186-H1189 WeakPolarHBondContact O-CB 3.49Å; E1186-H1189 PolarHBondContact O-N 3.43Å; Q1187-H1189 VanDerWaalsContact C-N 3.34Å; H1189-G1191 VanDerWaalsContact C-N 3.35Å; H1189-G1191 PolarHBondContact O-N 2.73Å
1190	E	47.3	Very low	57	Low	170 Å²	170	124.1 Å²	124.1	79%	0.794	65%	0.65	S	S	*	*	H	α-helix	trans	-70	-30.3	-179.8	-163.7	170.9	-135.9	0	0	112.4	E1186 T1192	E1186-E1190 PolarHBondContact O-N 3.05Å; E1190-T1192 PolarHBondContact O-N 3.4Å
1191	G	44	Very low	54.4	Low	68 Å²	68	130.9 Å²	130.9	70%	0.701	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	5.4	-179.9	0	0	0	0	0	117	Q1187 H1189	Q1187-G1191 PolarHBondContact O-N 3.28Å; H1189-G1191 VanDerWaalsContact C-N 3.35Å; H1189-G1191 PolarHBondContact O-N 2.73Å
1192	T	44.1	Very low	52	Low	115 Å²	115	130.6 Å²	130.6	71%	0.706	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	1.5	-167.7	-57.5	0	0	0	0	114.6	L1188 E1190	L1188-T1192 PolarHBondContact O-OG1 2.86Å; E1190-T1192 PolarHBondContact O-N 3.4Å
1193	F	42.5	Very low	49.6	Very low	193 Å²	193	137.3 Å²	137.3	85%	0.846	71%	0.705	S	S	*	*	S	Bend	trans	-139.1	28.2	-169.3	-146.9	-98.4	0	0	0	118
1194	D	44.4	Very low	47.2	Very low	165 Å²	165	140.8 Å²	140.8	88%	0.882	73%	0.726	S	S	*	*	S	Bend	trans	-142	30	178.2	-130.9	-3.6	0	0	0	115.3
1195	D	44.6	Very low	45.4	Very low	158 Å²	158	143.4 Å²	143.4	85%	0.845	74%	0.739	S	S	*	*	S	Bend	trans	-126.2	154.2	164.6	-105.2	-41.2	0	0	0	110.3
1196	D	44.5	Very low	43.2	Very low	153 Å²	153	149.3 Å²	149.3	82%	0.818	76%	0.755	S	S	*	*	S	Bend	trans	62.4	64.4	178.1	-74.9	-17.1	0	0	0	118.6
1197	Y	43.2	Very low	41.3	Very low	227 Å²	227	150.4 Å²	150.4	89%	0.89	76%	0.76	S	S	*	*			trans	-148.1	42.7	147.5	-118.8	-64.7	0	0	0	116.9
1198	E	44.7	Very low	39.9	Very low	177 Å²	177	150.8 Å²	150.8	83%	0.827	77%	0.765	S	S	*	*			trans	-94.1	129.1	159.7	-104.6	-73.4	177.7	0	0	110.1
1199	S	38.8	Very low	38.7	Very low	102 Å²	102	147.5 Å²	147.5	71%	0.713	76%	0.761	S	S	*	*			trans	-158.3	74.9	-178.9	-80.3	0	0	0	0	112.6
1200	E	40.6	Very low	37.8	Very low	165 Å²	165	146.4 Å²	146.4	77%	0.771	76%	0.761	S	S	*	*			trans	46.1	93.8	149.6	-58	-163.3	121.2	0	0	118.9
1201	E	33.8	Very low	36.9	Very low	199 Å²	199	146.4 Å²	146.4	93%	0.93	76%	0.758	S	S	*	*			trans	-114	88.3	142.3	-166.5	170.1	-146	0	0	111.1
1202	L	34.9	Very low	36.1	Very low	126 Å²	126	151.5 Å²	151.5	66%	0.66	77%	0.766	S	S	*	*			trans	-67.7	138.4	160.8	-64.7	167.8	0	0	0	107.6
1203	Q	26.6	Very low	35.9	Very low	165 Å²	165	155 Å²	155	77%	0.771	77%	0.774	S	S	*	*				179.1	162.5	60.5	-150.4	164.4	74.6	0	0	112.9
1204	V	28.2	Very low	35.4	Very low	123 Å²	123	155.7 Å²	155.7	75%	0.745	78%	0.777	S	S	*	*			trans	79.5	124.6	165	-169.8	0	0	0	0	117.7
1205	P	40.6	Very low	34.8	Very low	107 Å²	107	154.7 Å²	154.7	70%	0.695	77%	0.771	S	S	*	*			trans	-99.3	-167.6	178.9	40.3	-36.8	0	0	0	113.7
1206	R	26.7	Very low	34.1	Very low	203 Å²	203	154 Å²	154	77%	0.766	77%	0.772	S	S	*	*			trans	84.2	143.4	164.8	-72.9	-173	135.9	175	-11.6	117.3
1207	E	28.6	Very low	33.5	Very low	122 Å²	122	153.3 Å²	153.3	57%	0.57	77%	0.767	S	S	*	*			cis	-167.6	175	-14.1	-131.1	167.3	-150.9	0	0	109.5
1208	I	30.6	Very low	33	Very low	142 Å²	142	147.2 Å²	147.2	73%	0.728	76%	0.757	S	S	*	*			trans	63.2	105.5	151.5	-65.1	159.1	0	0	0	117.5
1209	G	32.2	Very low	32.2	Very low	56 Å²	56	145.1 Å²	145.1	58%	0.577	75%	0.752	S	S	*	*			trans	-79.7	-161.1	154.4	0	0	0	0	0	112.6
1210	N	32.3	Very low	31.9	Very low	138 Å²	138	147.6 Å²	147.6	74%	0.738	76%	0.756	S	S	*	*			trans	91.5	140.8	-165.9	-62.4	-91.6	0	0	0	112.6
1211	K	30.1	Very low	31.8	Very low	170 Å²	170	145 Å²	145	74%	0.739	76%	0.756	S	S	*	*			cis	-159.3	167.6	3.7	-130.7	161.8	-171	153.4	0	113.8
1212	M	27.1	Very low	32.2	Very low	175 Å²	175	144.1 Å²	144.1	86%	0.862	78%	0.783	S	S	*	*			trans	62.5	115.6	147.4	76.2	-166.1	177.9	0	0	119.5
1213	E	40	Very low	32.1	Very low	190 Å²	190	145.1 Å²	145.1	89%	0.888	79%	0.789	S	S	*	*			trans	-65.3	159.6	163.9	-56.4	146.2	109.1	0	0	111.5
1214	K	30.3	Very low	32.4	Very low	207 Å²	207	144 Å²	144	90%	0.9	79%	0.79	S	S	*	*			trans	-144	112.9	158	-167.1	175.6	-178.8	-178.2	0	111.3
1215	L	32.4	Very low	32.6	Very low	143 Å²	143	145.2 Å²	145.2	75%	0.749	79%	0.793	S	S	*	*			trans	-64.7	144.9	-179.2	-70	151.6	0	0	0	113.2
1216	V	30.9	Very low	32.2	Very low	143 Å²	143	147.4 Å²	147.4	87%	0.867	80%	0.799	S	S	*	*			trans	-129.4	138	142.8	179.1	0	0	0	0	106.6
1217	I	31.6	Very low	32.5	Very low	140 Å²	140	143.9 Å²	143.9	72%	0.718	80%	0.801	S	S	*	*			trans	-106.4	143.2	-174.7	-63.2	165.8	0	0	0	108.9
1218	S	32.9	Very low	32.8	Very low	98 Å²	98	145.4 Å²	145.4	69%	0.685	82%	0.816	S	S	*	*			trans	152	137.2	150.9	-93.2	0	0	0	0	109.7
1219	D	27.8	Very low	32.9	Very low	134 Å²	134	145.6 Å²	145.6	72%	0.717	82%	0.822	S	S	*	*			cis	-145.8	156.4	8.5	-91.9	-35.2	0	0	0	113.2
1220	L	31.8	Very low	33	Very low	154 Å²	154	152.5 Å²	152.5	81%	0.806	84%	0.841	S	S	*	*			trans	49.2	96.6	152.7	-61.2	165.9	0	0	0	117.8
1221	S	39.2	Very low	33	Very low	109 Å²	109	153.8 Å²	153.8	76%	0.762	85%	0.85	S	S	*	*			cis	88.3	93.2	37.4	90.2	0	0	0	0	116.6
1222	A	42.3	Very low	33.3	Very low	182 Å²	182	152.3 Å²	152.3	100%	1.504	86%	0.86	S	S	*	*			trans	-163.5	0	140.5	0	0	0	0	0	108.9

Retrieved 1,222 of 1,222 residues in 5318.9 ms (Link to these results)

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