A0A096N4G4_PAPAN Loading...

Ankyrin repeat and BTB/POZ domain-containing protein 2

May be involved in the initiation of hepatocyte growth.

AlphaFold DB (A0A2K6Q4N1), UniProt , Accession A0A096N4G4, Species PAPAN (Papio anubis, Olive baboon), Gene ABTB2, Length 1,025 aa.

						>A0A096N4G4_PAPAN|A0A096N4G4|ABTB2
MAGTYSSTLKTLEDLTLDSGYGAGDSCRSLSLSSSKSNSQALNSSAQQHRGAAWWCYSGSMNSRHNSWDTVNTVLPEDPEVADLFSRCPRLPELEEFPWTEGDVARVLRKGAGGRRLPQFSAEAVRRLAGLLRRALIRVAREAQRLSVLHAKCTRFEVQSAVRLVHSWALAESCALAAVKALSLYSMSAGDGLRRGKSARCGLTFSVGRFFRWMVDTRISVRIHEYAAISLTACMENLVEEIRARVMASQSPDGGGAGGGEVSAEALEMVINNDAELWGVLQPYEHLICGKNANGVLSLPAYFSPYNGGSLGHDERADAYAQLELRTLEQSLLATCVGSISELSDLVSRAMHHMQGRHPLCPGASPARQARQPPQPITWSPDALHTLYYFLRCPQMESMENPNLDPPRMTLNNERPFMLLPPLMEWMRVAITYAEHRRSLTVDSGDIRQAARLLLPGLDCEPRQLKPEHCFSSFRRLDARAATEKFNQDLGFRMLNCGRTDLINQAIEALGPDGVNTMDDQGMTPLMYACAAGDEAMVQMLIDAGANLDIQVPSNSPRHPSIHPDSRHWTSLTFAVLHGHISVVQLLLDAGAHVEGSAVNGGEDSYAETPLQLASAAGNYELVSLLLSRGADPLLSMLEAHGMGSSLHEDMNCFSHSAAHGHRNVLRKLLTQPQQAKADVLSLEEILAEGVEESDASSQGSGSEGPVRLSRTRTKALQEAMYYSAEHGYVDITMELRALGVPWKLHIWIESLRTSFSQSRYSVVQSLLRDFSSIKEEEYNEELVTEGLQLMFDILKTSKNDSVIQQLAAIFTHCYGSSPIPSIPEVRKTLPARLDPHFLNNKEMSDVTFLVEGKLFYAHKVLLVTASNRFKTLMTNKSEQDGDSSKTIEISDMKYHIFQMMMQYLYYGGTESMEIPTADILELLSAASLFQLDALQRHCEILCSQTLSVESAVNTYKYAKIHNAPELALFCEGFFLKHMKALLEQDAFRQLIYGRSSKVQGLDPLQDLQNTLAERVHSVYITSRV
					

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	26.5	Very low	35.4	Very low	255 Å²	255	114.7 Å²	114.7	100%	1.256	68%	0.676	S	S	*	*				0	120	0	-68.8	-166.4	-112	0	0	107.9
2	A	32.8	Very low	37.2	Very low	111 Å²	111	105.2 Å²	105.2	92%	0.917	62%	0.619	S	S	*	*			trans	-133.5	137.8	176.4	0	0	0	0	0	107.2
3	G	31.4	Very low	38.6	Very low	73 Å²	73	101.2 Å²	101.2	75%	0.753	59%	0.591	S	S	*	*			trans	122.5	86.2	-177.3	0	0	0	0	0	113.4
4	T	25	Very low	39.2	Very low	132 Å²	132	101.8 Å²	101.8	81%	0.81	59%	0.591	S	S	*	*			trans	-171.3	37.9	143.1	50.6	0	0	0	0	110.6
5	Y	29.6	Very low	39.6	Very low	187 Å²	187	98.2 Å²	98.2	73%	0.733	57%	0.568	S	S	*	*			trans	-126.1	71.2	163.9	-79.3	-71.6	0	0	0	108.4
6	S	30.7	Very low	40.2	Very low	94 Å²	94	93.3 Å²	93.3	66%	0.657	54%	0.54	S	S	*	.			trans	-145.2	69.5	162	-169.2	0	0	0	0	106.7	T8	S6-T8 WeakPolarHBondContact OG-CG2 3.31Å
7	S	29.6	Very low	40.2	Very low	93 Å²	93	97.6 Å²	97.6	65%	0.65	56%	0.56	S	S	*	*				-64.3	115.6	127.1	41.4	0	0	0	0	104.7	L9	S7-L9 PolarHBondContact O-N 2.72Å
8	T	36.3	Very low	40.3	Very low	111 Å²	111	93.4 Å²	93.4	68%	0.681	54%	0.535	S	S	*	.			trans	-70.3	81.2	170.5	49	0	0	0	0	107.4	S6 K10	S6-T8 WeakPolarHBondContact OG-CG2 3.31Å; T8-K10 VanDerWaalsContact C-N 3.34Å; T8-K10 PolarHBondContact O-N 2.65Å
9	L	43.9	Very low	40.1	Very low	68 Å²	68	94.4 Å²	94.4	36%	0.356	55%	0.548	S	S	.	.			trans	-54.3	105.3	162	-82	169.5	0	0	0	105.8	S7 T11 E96	S7-L9 PolarHBondContact O-N 2.72Å; L9-T11 PolarHBondContact O-N 2.81Å; L9-T11 VanDerWaalsContact O-N 3.16Å; L9-E96 HydrophobicContact CD2-CG 4.31Å
10	K	45.4	Very low	40.1	Very low	128 Å²	128	92.5 Å²	92.5	56%	0.557	55%	0.55	S	S	*	.			trans	-65.2	117.6	-179.7	-55.2	173.9	-176.5	170.2	0	106.5	T8 D14 L15	T8-K10 VanDerWaalsContact C-N 3.34Å; T8-K10 PolarHBondContact O-N 2.65Å; K10-D14 HydrophobicContact CB-CB 4.28Å; K10-L15 HydrophobicContact CB-CD1 3.82Å; K10-L15 HydrophobicContact CB-CD2 3.83Å; K10-L15 HydrophobicContact CB-CG 3.62Å; K10-L15 HydrophobicContact CD-CD2 3.54Å; K10-L15 HydrophobicContact CD-CG 4.31Å; K10-L15 HydrophobicContact CG-CD2 4.37Å
11	T	58.3	Low	40.2	Very low	10 Å²	10	90.2 Å²	90.2	6%	0.061	53%	0.532	C	S	.	.			trans	-68	168.4	179.9	65.3	0	0	0	0	110.3	L9 E13 D14 L15 R218	L9-T11 PolarHBondContact O-N 2.81Å; L9-T11 VanDerWaalsContact O-N 3.16Å; T11-E13 PolarHBondContact O-N 2.91Å; T11-E13 PolarHBondContact OG1-N 2.92Å; T11-D14 WeakPolarHBondContact CB-OD2 3.36Å; T11-D14 WeakPolarHBondContact CG2-OD2 3.47Å; T11-D14 PolarHBondContact N-OD2 3.14Å; T11-D14 PolarHBondContact O-N 3.22Å; T11-D14 PolarHBondContact OG1-N 3.42Å; T11-D14 VanDerWaalsContact OG1-N 3.08Å; T11-D14 PolarHBondContact OG1-OD2 3.16Å; T11-L15 WeakPolarHBondContact O-CB 3.35Å; T11-L15 WeakPolarHBondContact O-CG 3.48Å; T11-L15 PolarHBondContact O-N 3.17Å; T11-R218 HydrophobicContact CG2-CG 4.13Å
12	L	56.7	Low	40.6	Very low	0 Å²	0	80.9 Å²	80.9	0%	0	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-28.8	171.2	-72.9	168.1	0	0	0	111.3	L15 T16 P92 L94 A140 R141 T217 I219	L12-L15 PolarHBondContact O-N 3.49Å; L12-T16 WeakPolarHBondContact O-CB 3.49Å; L12-T16 VanDerWaalsContact O-CG2 3.31Å; L12-T16 WeakPolarHBondContact O-CG2 3.45Å; L12-T16 PolarHBondContact O-N 2.87Å; L12-T16 PolarHBondContact O-OG1 3.22Å; L12-P92 HydrophobicContact CD2-CG 4.24Å; L12-L94 HydrophobicContact CD2-CD1 4.28Å; L12-A140 HydrophobicContact CD1-CB 4.16Å; L12-R141 HydrophobicContact CD2-CG 4.48Å; L12-T217 PolarHBondContact N-O 3.48Å; L12-I219 HydrophobicContact CD1-CG1 4.23Å
13	E	55.2	Low	40.7	Very low	53 Å²	53	80.7 Å²	80.7	25%	0.248	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-46.7	174.4	-49.8	177.9	141.1	0	0	111	T11 L15 Y21 R218	T11-E13 PolarHBondContact O-N 2.91Å; T11-E13 PolarHBondContact OG1-N 2.92Å; E13-L15 PolarHBondContact O-N 3.16Å; E13-Y21 HydrophobicContact CG-CD1 4.43Å; E13-Y21 HydrophobicContact CG-CG 4.29Å; E13-R218 WeakPolarHBondContact OE2-CD 3.46Å; E13-R218 IonicContact OE2-CZ 3.89Å; E13-R218 IonicContact OE2-NE 2.76Å; E13-R218 IonicContact OE2-NH1 2.67Å; E13-R218 PolarHBondContact OE2-NH1 3.08Å
14	D	47.3	Very low	40.8	Very low	110 Å²	110	80.3 Å²	80.3	59%	0.588	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.3	177.8	-58	-58.7	0	0	0	114.1	K10 T11	K10-D14 HydrophobicContact CB-CB 4.28Å; T11-D14 WeakPolarHBondContact CB-OD2 3.36Å; T11-D14 WeakPolarHBondContact CG2-OD2 3.47Å; T11-D14 PolarHBondContact N-OD2 3.14Å; T11-D14 PolarHBondContact O-N 3.22Å; T11-D14 PolarHBondContact OG1-N 3.42Å; T11-D14 VanDerWaalsContact OG1-N 3.08Å; T11-D14 PolarHBondContact OG1-OD2 3.16Å
15	L	45.4	Very low	40.8	Very low	48 Å²	48	81.8 Å²	81.8	25%	0.251	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-5.2	-171.8	-75.1	175.5	0	0	0	114.5	K10 T11 L12 E13 P92 L94	K10-L15 HydrophobicContact CB-CD1 3.82Å; K10-L15 HydrophobicContact CB-CD2 3.83Å; K10-L15 HydrophobicContact CB-CG 3.62Å; K10-L15 HydrophobicContact CD-CD2 3.54Å; K10-L15 HydrophobicContact CD-CG 4.31Å; K10-L15 HydrophobicContact CG-CD2 4.37Å; T11-L15 WeakPolarHBondContact O-CB 3.35Å; T11-L15 WeakPolarHBondContact O-CG 3.48Å; T11-L15 PolarHBondContact O-N 3.17Å; L12-L15 PolarHBondContact O-N 3.49Å; E13-L15 PolarHBondContact O-N 3.16Å; L15-P92 HydrophobicContact CB-CB 3.71Å; L15-P92 HydrophobicContact CD1-CB 3.96Å; L15-P92 HydrophobicContact CG-CB 4.32Å; L15-L94 HydrophobicContact CD1-CD2 3.57Å; L15-L94 HydrophobicContact CD1-CG 4.45Å
16	T	48.8	Very low	40.7	Very low	19 Å²	19	78 Å²	78	12%	0.117	50%	0.499	C	S	.	.	S	Bend	trans	-114.7	149	-178.7	51.2	0	0	0	0	110.8	L12 D18	L12-T16 WeakPolarHBondContact O-CB 3.49Å; L12-T16 VanDerWaalsContact O-CG2 3.31Å; L12-T16 WeakPolarHBondContact O-CG2 3.45Å; L12-T16 PolarHBondContact O-N 2.87Å; L12-T16 PolarHBondContact O-OG1 3.22Å; T16-D18 PolarHBondContact O-N 2.76Å
17	L	41	Very low	40.5	Very low	168 Å²	168	78.4 Å²	78.4	88%	0.88	50%	0.501	S	S	*	.			trans	-79.9	11.8	174.6	-68.9	169.6	0	0	0	112.5	S19	L17-S19 PolarHBondContact O-N 3.22Å
18	D	41.8	Very low	40.2	Very low	21 Å²	21	85.6 Å²	85.6	11%	0.112	51%	0.514	C	S	.	.			trans	-75.1	89	-178	-86.4	-66.7	0	0	0	110.5	T16 G20 Y21 R141 R145	T16-D18 PolarHBondContact O-N 2.76Å; D18-G20 PolarHBondContact O-N 2.98Å; D18-Y21 HydrophobicContact CB-CD2 3.91Å; D18-Y21 HydrophobicContact CB-CE2 4.01Å; D18-R141 IonicContact OD2-NH2 3.94Å; D18-R141 PolarHBondContact OD2-NH2 3.16Å; D18-R145 IonicContact OD1-CZ 3.84Å; D18-R145 VanDerWaalsContact OD1-CZ 3.3Å; D18-R145 IonicContact OD1-NH1 3.27Å; D18-R145 PolarHBondContact OD1-NH1 2.91Å; D18-R145 IonicContact OD1-NH2 3.54Å; D18-R145 PolarHBondContact OD1-NH2 3.15Å; D18-R145 IonicContact OD2-NH1 2.78Å; D18-R145 PolarHBondContact OD2-NH1 3.12Å
19	S	35.9	Very low	39.6	Very low	113 Å²	113	85.4 Å²	85.4	79%	0.79	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	13.8	-170.6	60.6	0	0	0	0	116.6	L17	L17-S19 PolarHBondContact O-N 3.22Å
20	G	40.6	Very low	38.7	Very low	56 Å²	56	89.7 Å²	89.7	58%	0.577	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-6.7	-176.9	0	0	0	0	0	115.7	D18 G22	D18-G20 PolarHBondContact O-N 2.98Å; G20-G22 PolarHBondContact O-N 3.19Å
21	Y	43.1	Very low	37.6	Very low	44 Å²	44	89.6 Å²	89.6	17%	0.173	56%	0.555	C	S	.	*			trans	-88.7	88	-177.8	-72.7	-82.6	0	0	0	111.8	E13 D18 Q144 R145 V148	E13-Y21 HydrophobicContact CG-CD1 4.43Å; E13-Y21 HydrophobicContact CG-CG 4.29Å; D18-Y21 HydrophobicContact CB-CD2 3.91Å; D18-Y21 HydrophobicContact CB-CE2 4.01Å; Y21-Q144 HydrophobicContact CD1-CG 4.5Å; Y21-Q144 HydrophobicContact CE1-CG 3.69Å; Y21-R145 VanDerWaalsContact OH-CA 3.27Å; Y21-R145 WeakPolarHBondContact OH-CA 3.4Å; Y21-R145 WeakPolarHBondContact OH-CG 3.29Å; Y21-R145 PolarHBondContact OH-N 3.21Å; Y21-V148 HydrophobicContact CE1-CG2 3.68Å
22	G	33.9	Very low	36.1	Very low	59 Å²	59	97.6 Å²	97.6	61%	0.608	60%	0.597	S	S	*	*			trans	-165.6	78.6	-179.2	0	0	0	0	0	114	G20 G24	G20-G22 PolarHBondContact O-N 3.19Å; G22-G24 PolarHBondContact O-N 3.16Å
23	A	35	Very low	34.4	Very low	108 Å²	108	103 Å²	103	89%	0.893	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	73	159.5	0	0	0	0	0	108.8
24	G	33	Very low	32.9	Very low	65 Å²	65	105.5 Å²	105.5	67%	0.67	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	175.3	23.4	-165.5	0	0	0	0	0	117	G22	G22-G24 PolarHBondContact O-N 3.16Å
25	D	25.6	Very low	32	Very low	163 Å²	163	105.1 Å²	105.1	87%	0.872	66%	0.664	S	S	*	*	S	Bend	trans	-156.5	146.9	150.4	-112	-31.2	0	0	0	112.1
26	S	27.9	Very low	30.8	Very low	107 Å²	107	112.5 Å²	112.5	75%	0.748	69%	0.694	S	S	*	*			trans	-53.5	135.4	-167.2	-179.2	0	0	0	0	114.8	R28	S26-R28 PolarHBondContact O-N 3.42Å
27	C	25.4	Very low	30.1	Very low	103 Å²	103	116.9 Å²	116.9	70%	0.696	73%	0.725	S	S	*	*			trans	-52.2	100.2	170.9	-62.3	0	0	0	0	112.1
28	R	23.4	Very low	29.2	Very low	243 Å²	243	116 Å²	116	92%	0.917	72%	0.721	S	S	*	*			trans	-92.5	101	159.9	-76.8	-168.1	174.6	-171.7	0.7	109.6	S26 L30	S26-R28 PolarHBondContact O-N 3.42Å; R28-L30 PolarHBondContact O-N 2.94Å
29	S	24.1	Very low	28.4	Very low	107 Å²	107	119.2 Å²	119.2	75%	0.748	75%	0.745	S	S	*	*			trans	-58.1	122.6	174.5	44.4	0	0	0	0	112.3
30	L	25.9	Very low	27.9	Very low	158 Å²	158	123 Å²	123	83%	0.827	75%	0.751	S	S	*	*			trans	44.6	122.7	141.8	-57.9	173.3	0	0	0	119.9	R28	R28-L30 PolarHBondContact O-N 2.94Å
31	S	21.5	Very low	27	Very low	126 Å²	126	124.2 Å²	124.2	88%	0.881	76%	0.756	S	S	*	*			trans	-157.6	106.7	136.4	-84.1	0	0	0	0	112.3	S33	S31-S33 PolarHBondContact O-N 2.88Å
32	L	26.5	Very low	26.1	Very low	178 Å²	178	130.4 Å²	130.4	93%	0.932	79%	0.791	S	S	*	*			trans	-73.1	99	165	-85.6	160	0	0	0	110
33	S	21.2	Very low	25.5	Very low	115 Å²	115	134.6 Å²	134.6	80%	0.804	80%	0.799	S	S	*	*			trans	178.2	139.5	147	-89.6	0	0	0	0	115	S31	S31-S33 PolarHBondContact O-N 2.88Å
34	S	23.8	Very low	24.9	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	79%	0.792	S	S	*	*			trans	56.6	105.6	142.6	168.9	0	0	0	0	119.9
35	S	27.8	Very low	24.4	Very low	102 Å²	102	137.1 Å²	137.1	71%	0.713	80%	0.8	S	S	*	*				49.5	96	123	-49.8	0	0	0	0	119.8
36	K	21.1	Very low	24.4	Very low	203 Å²	203	133.8 Å²	133.8	88%	0.883	80%	0.795	S	S	*	*			trans	178.6	121	139.5	-92.5	144.1	-169.1	178	0	106.6
37	S	33.8	Very low	24.2	Very low	111 Å²	111	137 Å²	137	78%	0.776	80%	0.799	S	S	*	*				60.8	89.1	56	-152.9	0	0	0	0	113.3
38	N	22.4	Very low	24.1	Very low	149 Å²	149	139.2 Å²	139.2	80%	0.797	80%	0.798	S	S	*	*			trans	-163.3	123.5	150.2	-94.1	-28.7	0	0	0	106
39	S	25.5	Very low	24.2	Very low	89 Å²	89	134.9 Å²	134.9	62%	0.622	79%	0.788	S	S	*	*			cis	85.2	128.9	37.1	99.2	0	0	0	0	113.8
40	Q	23.8	Very low	24.1	Very low	193 Å²	193	140.9 Å²	140.9	90%	0.902	80%	0.795	S	S	*	*			trans	75.2	145	-177.4	-50.1	-171.1	8.6	0	0	117.5
41	A	22.7	Very low	24.2	Very low	82 Å²	82	137 Å²	137	68%	0.678	79%	0.793	S	S	*	*			cis	-172.5	135.2	-28	0	0	0	0	0	108.1
42	L	23.4	Very low	24.2	Very low	174 Å²	174	135.7 Å²	135.7	91%	0.911	79%	0.79	S	S	*	*			trans	-166.4	120.6	153.4	-107.2	155.2	0	0	0	112.7
43	N	21.3	Very low	24	Very low	147 Å²	147	131.5 Å²	131.5	79%	0.786	78%	0.781	S	S	*	*			trans	-29.2	126.1	170.3	-64.5	-14.8	0	0	0	115.5
44	S	23.3	Very low	24.4	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	78%	0.783	S	S	*	*			cis	100.6	103.3	48.6	73.7	0	0	0	0	114.4
45	S	22.2	Very low	24.8	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	77%	0.77	S	S	*	*			trans	-168.9	146.6	140.7	55.4	0	0	0	0	111
46	A	25.1	Very low	24.5	Very low	94 Å²	94	138 Å²	138	78%	0.777	77%	0.772	S	S	*	*			trans	76	76.3	176.4	0	0	0	0	0	118.1
47	Q	23.8	Very low	24.5	Very low	175 Å²	175	139.6 Å²	139.6	82%	0.818	77%	0.774	S	S	*	*			trans	-22.1	141.1	134.7	-74.2	150.8	-53.3	0	0	113.8
48	Q	24.4	Very low	24.1	Very low	148 Å²	148	139.7 Å²	139.7	69%	0.692	78%	0.775	S	S	*	*			cis	-147.2	169.6	20.1	-104.9	144.9	-87	0	0	109.5
49	H	23.7	Very low	24.1	Very low	153 Å²	153	136.2 Å²	136.2	71%	0.708	78%	0.775	S	S	*	*			cis	-137.8	-120.1	15.1	-139.4	-56.1	0	0	0	113.7
50	R	22.9	Very low	24.1	Very low	233 Å²	233	136.6 Å²	136.6	88%	0.879	78%	0.777	S	S	*	*			trans	-139.7	154.3	172.7	-62.4	172.1	178.8	167.2	-3.2	106.8
51	G	27.1	Very low	24.2	Very low	77 Å²	77	134.8 Å²	134.8	79%	0.794	77%	0.77	S	S	*	*			cis	102.7	68.8	17.5	0	0	0	0	0	111.8
52	A	22.2	Very low	24.2	Very low	98 Å²	98	138 Å²	138	81%	0.81	78%	0.776	S	S	*	*			trans	-172.4	155.8	164.6	0	0	0	0	0	111
53	A	23.1	Very low	24.3	Very low	90 Å²	90	134.5 Å²	134.5	74%	0.744	77%	0.767	S	S	*	*			trans	49.7	110.6	156.4	0	0	0	0	0	118.8
54	W	29.1	Very low	24.6	Very low	225 Å²	225	138 Å²	138	85%	0.852	77%	0.769	S	S	*	*	S	Bend	trans	-66.1	162.7	141.9	-65.9	21.7	0	0	0	108.1
55	W	31.1	Very low	24.9	Very low	120 Å²	120	141.7 Å²	141.7	46%	0.455	77%	0.774	S	S	.	*			trans	84.2	134.6	-173.6	-47.1	104	0	0	0	117.2	N412 E414	W55-N412 HydrophobicContact CE3-CB 4.23Å; W55-N412 HydrophobicContact CH2-CB 3.65Å; W55-N412 VanDerWaalsContact CH2-CG 3.45Å; W55-N412 WeakPolarHBondContact CH2-ND2 3.34Å; W55-N412 HydrophobicContact CZ2-CB 4.42Å; W55-N412 WeakPolarHBondContact CZ2-ND2 3.43Å; W55-N412 HydrophobicContact CZ3-CB 3.51Å; W55-E414 VanDerWaalsContact CE3-CD 3.46Å; W55-E414 HydrophobicContact CE3-CG 4.13Å; W55-E414 HydrophobicContact CH2-CB 4.07Å; W55-E414 HydrophobicContact CH2-CG 4.47Å; W55-E414 HydrophobicContact CZ3-CB 3.64Å; W55-E414 HydrophobicContact CZ3-CG 3.6Å
56	C	22.2	Very low	25	Very low	113 Å²	113	144.2 Å²	144.2	76%	0.764	78%	0.778	S	S	*	*			trans	87.7	104.8	163.7	-57.4	0	0	0	0	120.1
57	Y	22.1	Very low	25.2	Very low	236 Å²	236	144.2 Å²	144.2	93%	0.925	77%	0.772	S	S	*	*				-151	163.7	102.2	-135.6	-99.2	0	0	0	112.1
58	S	24.2	Very low	25.5	Very low	112 Å²	112	144.5 Å²	144.5	78%	0.783	77%	0.766	S	S	*	*			trans	-128	153.7	-169.1	-179.4	0	0	0	0	113.1
59	G	23.5	Very low	25.7	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	76%	0.762	S	S	*	*			trans	-154.1	34	-168.2	0	0	0	0	0	118.1
60	S	24.8	Very low	26.5	Very low	96 Å²	96	140.2 Å²	140.2	67%	0.671	76%	0.757	S	S	*	*			trans	28.4	107.5	155.2	-176.8	0	0	0	0	122.6
61	M	25.8	Very low	26.9	Very low	155 Å²	155	132 Å²	132	76%	0.764	73%	0.732	S	S	*	*			trans	56.9	114.5	130.7	-56	176.1	65.5	0	0	122.2
62	N	23.8	Very low	27.2	Very low	149 Å²	149	134.6 Å²	134.6	80%	0.797	73%	0.728	S	S	*	*				169.5	124.9	98.2	-97	-35.8	0	0	0	113.6
63	S	25.2	Very low	28	Very low	102 Å²	102	132.2 Å²	132.2	71%	0.713	70%	0.703	S	S	*	*				169.1	103.2	125	-179.3	0	0	0	0	114.4
64	R	27.6	Very low	28.4	Very low	220 Å²	220	133 Å²	133	83%	0.83	70%	0.699	S	S	*	*			trans	52.1	111.5	137.4	-58	179.1	176.5	-173.9	-1.4	121
65	H	28.6	Very low	28.8	Very low	183 Å²	183	125.9 Å²	125.9	85%	0.847	68%	0.677	S	S	*	*			trans	49.8	104.6	132.7	-63.9	77.9	0	0	0	118.6
66	N	25	Very low	28.9	Very low	173 Å²	173	124.4 Å²	124.4	93%	0.925	68%	0.683	S	S	*	*			trans	-145.2	161.4	144.7	-101.3	-31.9	0	0	0	111.3
67	S	28.3	Very low	29.5	Very low	94 Å²	94	128.7 Å²	128.7	66%	0.657	69%	0.692	S	S	*	*			trans	-70.8	169.6	-164.9	-165.4	0	0	0	0	115.1	D69	S67-D69 PolarHBondContact O-N 3.38Å
68	W	29.8	Very low	30.3	Very low	180 Å²	180	122 Å²	122	68%	0.682	67%	0.672	S	S	*	*	S	Bend	trans	-69.3	45	-178.4	-80.4	83.7	0	0	0	115.3	M399	W68-M399 HydrophobicContact CH2-CE 3.51Å; W68-M399 HydrophobicContact CH2-SD 3.47Å; W68-M399 WeakPolarHBondContact CH2-SD 3.33Å; W68-M399 HydrophobicContact CZ2-CE 3.81Å; W68-M399 HydrophobicContact CZ2-SD 3.55Å; W68-M399 VanDerWaalsContact CZ2-SD 3.55Å; W68-M399 HydrophobicContact CZ3-CE 4.2Å
69	D	30.2	Very low	31.1	Very low	113 Å²	113	121.6 Å²	121.6	60%	0.604	67%	0.667	S	S	*	*			trans	-108.5	93.5	174.9	-71.7	-59.4	0	0	0	110.8	S67 V71	S67-D69 PolarHBondContact O-N 3.38Å; D69-V71 PolarHBondContact O-N 3.38Å
70	T	39.8	Very low	31.9	Very low	98 Å²	98	125.4 Å²	125.4	60%	0.601	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	57.7	-178.9	-45.5	0	0	0	0	112
71	V	31.8	Very low	32.8	Very low	61 Å²	61	123 Å²	123	37%	0.37	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114	-19	176.7	-171.9	0	0	0	0	111.8	D69	D69-V71 PolarHBondContact O-N 3.38Å
72	N	32	Very low	33.7	Very low	132 Å²	132	119.1 Å²	119.1	71%	0.706	64%	0.638	S	S	*	*			trans	-108.3	86.7	-179.2	-77.8	-43.3	0	0	0	112.7	V74	N72-V74 HydrophobicContact CB-CG2 3.98Å; N72-V74 PolarHBondContact O-N 3.37Å; N72-V74 VanDerWaalsContact O-N 3.14Å
73	T	39.7	Very low	34.6	Very low	47 Å²	47	116.8 Å²	116.8	29%	0.288	63%	0.625	S	S	.	*			trans	-80.3	52	150.6	57.2	0	0	0	0	110.1	L75	T73-L75 PolarHBondContact O-N 3.19Å
74	V	32.8	Very low	35.8	Very low	107 Å²	107	116.4 Å²	116.4	65%	0.648	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-71.6	118.1	169.7	174.5	0	0	0	0	106.7	N72	N72-V74 HydrophobicContact CB-CG2 3.98Å; N72-V74 PolarHBondContact O-N 3.37Å; N72-V74 VanDerWaalsContact O-N 3.14Å
75	L	36.5	Very low	37	Very low	76 Å²	76	108.1 Å²	108.1	40%	0.398	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-67.1	135.9	174	-68.3	167.5	0	0	0	109.2	T73 V81 L419	T73-L75 PolarHBondContact O-N 3.19Å; L75-V81 HydrophobicContact CD1-CG1 4.19Å; L75-V81 HydrophobicContact CD2-CG2 4.42Å; L75-L419 HydrophobicContact CD1-CD1 4.37Å
76	P	34.3	Very low	38.1	Very low	89 Å²	89	102.1 Å²	102.1	58%	0.578	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-63.3	147.1	152.4	29	-29.7	0	0	0	108.8	D78	P76-D78 PolarHBondContact O-N 3.39Å
77	E	34.2	Very low	39.7	Very low	203 Å²	203	103.1 Å²	103.1	95%	0.949	55%	0.554	S	S	*	*			trans	-72.4	65.7	178.4	-63.3	-175.7	152.3	0	0	111.7
78	D	39.5	Very low	41.4	Very low	96 Å²	96	99.8 Å²	99.8	51%	0.513	53%	0.531	S	S	.	.			trans	-93.3	128.4	176.2	-102.1	-46.2	0	0	0	111.6	P76 E80 V81	P76-D78 PolarHBondContact O-N 3.39Å; D78-E80 PolarHBondContact O-N 2.77Å; D78-E80 VanDerWaalsContact O-N 3.08Å; D78-V81 PolarHBondContact O-N 3.45Å
79	P	40	Very low	43.4	Very low	103 Å²	103	93.8 Å²	93.8	67%	0.669	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.7	-177.9	25	-33.5	0	0	0	114	V81 A82	P79-V81 VanDerWaalsContact C-N 3.27Å; P79-V81 PolarHBondContact O-N 3.48Å; P79-A82 PolarHBondContact O-N 3.12Å
80	E	40	Very low	45.8	Very low	156 Å²	156	95.5 Å²	95.5	73%	0.729	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.8	175.8	-60.1	-167.6	160.5	0	0	113.2	D78 D83 L84	D78-E80 PolarHBondContact O-N 2.77Å; D78-E80 VanDerWaalsContact O-N 3.08Å; E80-D83 PolarHBondContact O-N 2.9Å; E80-L84 PolarHBondContact O-N 3.24Å
81	V	44.8	Very low	47.8	Very low	45 Å²	45	91.5 Å²	91.5	27%	0.273	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-37	-179.6	-178	0	0	0	0	111.6	L75 D78 P79 D83 L84 F85	L75-V81 HydrophobicContact CD1-CG1 4.19Å; L75-V81 HydrophobicContact CD2-CG2 4.42Å; D78-V81 PolarHBondContact O-N 3.45Å; P79-V81 VanDerWaalsContact C-N 3.27Å; P79-V81 PolarHBondContact O-N 3.48Å; V81-D83 PolarHBondContact O-N 3.2Å; V81-L84 PolarHBondContact O-N 2.95Å; V81-F85 HydrophobicContact CG1-CD2 4.2Å; V81-F85 HydrophobicContact CG1-CE2 4.03Å; V81-F85 WeakPolarHBondContact O-CD2 3.33Å; V81-F85 PolarHBondContact O-N 3.48Å
82	A	44.2	Very low	50	Low	74 Å²	74	89.3 Å²	89.3	61%	0.612	48%	0.475	S	S	*	.	H	α-helix	trans	-63.7	-33.8	174.4	0	0	0	0	0	111.6	P79 L84 S86	P79-A82 PolarHBondContact O-N 3.12Å; A82-L84 VanDerWaalsContact C-N 3.27Å; A82-L84 PolarHBondContact O-N 3.3Å; A82-S86 PolarHBondContact O-N 3.36Å
83	D	42.2	Very low	51.9	Low	100 Å²	100	91.4 Å²	91.4	54%	0.535	48%	0.481	S	S	.	.	H	α-helix	trans	-81.4	-4.6	179.6	-144.2	21	0	0	0	113.7	E80 V81 S86	E80-D83 PolarHBondContact O-N 2.9Å; V81-D83 PolarHBondContact O-N 3.2Å; D83-S86 PolarHBondContact O-OG 3.02Å; D83-S86 PolarHBondContact OD1-OG 3.48Å
84	L	49.8	Very low	53.7	Low	95 Å²	95	90.2 Å²	90.2	50%	0.497	47%	0.472	S	S	.	.	H	α-helix	trans	-90.9	-44.7	169.5	-153.7	80.5	0	0	0	111.5	E80 V81 A82 S86 R87 C88	E80-L84 PolarHBondContact O-N 3.24Å; V81-L84 PolarHBondContact O-N 2.95Å; A82-L84 VanDerWaalsContact C-N 3.27Å; A82-L84 PolarHBondContact O-N 3.3Å; L84-S86 PolarHBondContact O-N 2.89Å; L84-R87 WeakPolarHBondContact O-CB 3.44Å; L84-R87 PolarHBondContact O-N 3.47Å; L84-C88 PolarHBondContact O-N 2.86Å
85	F	53.3	Low	55.4	Low	45 Å²	45	93 Å²	93	20%	0.197	48%	0.478	C	S	.	.	H	α-helix	trans	-64.5	-24.4	173.6	-79.3	-75.1	0	0	0	112.8	V81 R87 C88 Y284 I288 L419	V81-F85 HydrophobicContact CG1-CD2 4.2Å; V81-F85 HydrophobicContact CG1-CE2 4.03Å; V81-F85 WeakPolarHBondContact O-CD2 3.33Å; V81-F85 PolarHBondContact O-N 3.48Å; F85-R87 PolarHBondContact O-N 3.09Å; F85-C88 PolarHBondContact O-N 2.86Å; F85-Y284 HydrophobicContact CB-CE1 3.99Å; F85-Y284 HydrophobicContact CD1-CD1 4.43Å; F85-Y284 HydrophobicContact CD1-CD2 4.34Å; F85-Y284 HydrophobicContact CD1-CE1 4.03Å; F85-Y284 AromaticContact CD1-CE2 3.94Å; F85-Y284 HydrophobicContact CD1-CE2 3.94Å; F85-Y284 AromaticContact CD1-CZ 3.78Å; F85-Y284 HydrophobicContact CE1-CE2 4.48Å; F85-Y284 HydrophobicContact CG-CE1 4.47Å; F85-Y284 WeakPolarHBondContact O-CE1 3.37Å; F85-I288 HydrophobicContact CE1-CD1 4.31Å; F85-L419 HydrophobicContact CE2-CD1 4.37Å; F85-L419 HydrophobicContact CZ-CD1 4.2Å
86	S	52.8	Low	57.5	Low	57 Å²	57	95.1 Å²	95.1	40%	0.399	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.6	171	75.7	0	0	0	0	113	A82 D83 L84	A82-S86 PolarHBondContact O-N 3.36Å; D83-S86 PolarHBondContact O-OG 3.02Å; D83-S86 PolarHBondContact OD1-OG 3.48Å; L84-S86 PolarHBondContact O-N 2.89Å
87	R	57.2	Low	60.1	Low	194 Å²	194	92.2 Å²	92.2	73%	0.732	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-8.8	-179.9	-56.6	179.6	-178.5	-166.7	-0.1	114.3	L84 F85	L84-R87 WeakPolarHBondContact O-CB 3.44Å; L84-R87 PolarHBondContact O-N 3.47Å; F85-R87 PolarHBondContact O-N 3.09Å
88	C	65.3	Low	62.9	Low	25 Å²	25	82.8 Å²	82.8	17%	0.169	42%	0.421	C	S	.	.	S	Bend	trans	-70	142.9	177.2	-75.2	0	0	0	0	111.3	L84 F85 R90 Y284	L84-C88 PolarHBondContact O-N 2.86Å; F85-C88 PolarHBondContact O-N 2.86Å; C88-R90 PolarHBondContact O-N 2.89Å; C88-Y284 HydrophobicContact CB-CD1 3.94Å; C88-Y284 HydrophobicContact CB-CE1 4.49Å
89	P	70.8	Confident	65.4	Low	54 Å²	54	79 Å²	79	35%	0.351	40%	0.399	S	S	.	.			trans	-54.5	138.8	171.7	-25.9	34.9	0	0	0	112.1	Y284 E285	P89-Y284 WeakPolarHBondContact O-CA 3.26Å; P89-E285 HydrophobicContact CB-CB 4.23Å; P89-E285 HydrophobicContact CB-CG 3.81Å; P89-E285 WeakPolarHBondContact CB-OE2 3.44Å; P89-E285 PolarHBondContact O-N 3.32Å
90	R	80.4	Confident	67.8	Low	148 Å²	148	77.6 Å²	77.6	56%	0.558	39%	0.389	S	S	*	.	B	Isolated β-bridge	trans	-107.6	150.9	-179.9	-65.1	-174.5	-178	-163.9	0.2	110.9	C88 P283 E285	C88-R90 PolarHBondContact O-N 2.89Å; R90-P283 CarbonylContact C-O 3.16Å; R90-P283 VanDerWaalsContact CA-O 3.31Å; R90-P283 WeakPolarHBondContact CA-O 3.44Å; R90-E285 WeakPolarHBondContact O-CG 3.37Å
91	L	81.5	Confident	70.1	Confident	15 Å²	15	74.2 Å²	74.2	8%	0.079	37%	0.373	C	S	.	.			trans	-56.7	145.8	172.3	-69.4	172.8	0	0	0	110.6	R134 I137 R138 P283	L91-R134 HydrophobicContact CD1-CB 3.93Å; L91-R134 HydrophobicContact CD1-CG 4.32Å; L91-I137 HydrophobicContact CD2-CG2 4.25Å; L91-R138 HydrophobicContact CD1-CG 4.08Å; L91-R138 HydrophobicContact CD2-CG 4.16Å; L91-P283 PolarHBondContact N-O 3.31Å
92	P	77.9	Confident	72.2	Confident	14 Å²	14	74 Å²	74	9%	0.091	38%	0.38	C	S	.	.			trans	-64.5	139.2	178.3	27.8	-36	0	0	0	111.5	L12 L15 I137	L12-P92 HydrophobicContact CD2-CG 4.24Å; L15-P92 HydrophobicContact CB-CB 3.71Å; L15-P92 HydrophobicContact CD1-CB 3.96Å; L15-P92 HydrophobicContact CG-CB 4.32Å; P92-I137 HydrophobicContact CG-CG2 3.91Å; P92-I137 WeakPolarHBondContact O-CD1 3.32Å
93	E	73.3	Confident	74.4	Confident	177 Å²	177	70.5 Å²	70.5	83%	0.827	35%	0.351	S	S	*	.			trans	-90.8	104.8	175.6	-66.2	-172.5	169.8	0	0	109.7
94	L	76.6	Confident	76.8	Confident	21 Å²	21	65.8 Å²	65.8	11%	0.11	33%	0.325	C	S	.	.			trans	-84.1	145.2	169.9	-66.6	172.1	0	0	0	110.4	L12 L15 F97 I137 W213 T217	L12-L94 HydrophobicContact CD2-CD1 4.28Å; L15-L94 HydrophobicContact CD1-CD2 3.57Å; L15-L94 HydrophobicContact CD1-CG 4.45Å; L94-F97 HydrophobicContact CB-CE2 4.11Å; L94-F97 HydrophobicContact CB-CZ 3.86Å; L94-F97 VanDerWaalsContact O-CE2 3.24Å; L94-F97 WeakPolarHBondContact O-CE2 3.18Å; L94-I137 HydrophobicContact CD1-CD1 4.06Å; L94-I137 HydrophobicContact CD1-CG1 4.06Å; L94-I137 HydrophobicContact CG-CD1 4.3Å; L94-W213 HydrophobicContact CD1-CZ2 3.73Å; L94-T217 HydrophobicContact CD1-CG2 4.06Å
95	E	69.9	Low	78.7	Confident	167 Å²	167	62 Å²	62	78%	0.78	31%	0.308	S	S	*	.	S	Bend	trans	-82	-36.5	178.6	-64.3	-178.2	178.3	0	0	111.9
96	E	80.3	Confident	80.4	Confident	119 Å²	119	66 Å²	66	56%	0.556	32%	0.321	S	S	*	.			trans	-114	143.3	-175.1	-63	-169.5	175.5	0	0	113.4	L9 W213	L9-E96 HydrophobicContact CD2-CG 4.31Å; E96-W213 PolarHBondContact O-NE1 3.02Å; E96-W213 VanDerWaalsContact O-NE1 3.14Å
97	F	88.9	Confident	82.2	Confident	29 Å²	29	63.2 Å²	63.2	13%	0.127	30%	0.302	C	S	.	.			trans	-138.4	153.9	-177.9	-73.7	-84.6	0	0	0	110.7	L94 W99 R133 L136 I137	L94-F97 HydrophobicContact CB-CE2 4.11Å; L94-F97 HydrophobicContact CB-CZ 3.86Å; L94-F97 VanDerWaalsContact O-CE2 3.24Å; L94-F97 WeakPolarHBondContact O-CE2 3.18Å; F97-W99 HydrophobicContact CD1-CZ2 4.48Å; F97-W99 PolarHBondContact O-N 2.99Å; F97-W99 VanDerWaalsContact O-N 3.08Å; F97-R133 HydrophobicContact CD1-CB 4.13Å; F97-R133 HydrophobicContact CD1-CG 3.78Å; F97-R133 HydrophobicContact CD2-CG 3.88Å; F97-R133 HydrophobicContact CE1-CB 3.49Å; F97-R133 VanDerWaalsContact CE1-CB 3.49Å; F97-R133 HydrophobicContact CE1-CG 3.59Å; F97-R133 HydrophobicContact CE2-CB 4.15Å; F97-R133 HydrophobicContact CE2-CG 3.69Å; F97-R133 HydrophobicContact CG-CG 3.92Å; F97-R133 HydrophobicContact CZ-CB 3.5Å; F97-R133 VanDerWaalsContact CZ-CB 3.5Å; F97-R133 HydrophobicContact CZ-CG 3.54Å; F97-L136 HydrophobicContact CD1-CD2 4.1Å; F97-I137 HydrophobicContact CE1-CD1 4Å; F97-I137 HydrophobicContact CE1-CG1 4.22Å; F97-I137 HydrophobicContact CZ-CD1 3.9Å
98	P	91.6	Very high	83.7	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.032	27%	0.271	C	S	.	.	S	Bend	trans	-74.2	0.2	-171.6	29.3	-34.5	0	0	0	114.9	L136 R209 F210 W213	P98-L136 HydrophobicContact CG-CD2 3.97Å; P98-R209 HydrophobicContact CB-CB 4.16Å; P98-R209 WeakPolarHBondContact O-CB 3.49Å; P98-R209 VanDerWaalsContact O-CZ 3.32Å; P98-R209 PolarHBondContact O-NE 3.31Å; P98-R209 PolarHBondContact O-NH1 2.7Å; P98-R209 VanDerWaalsContact O-NH1 3.07Å; P98-F210 HydrophobicContact CB-CB 4.42Å; P98-F210 HydrophobicContact CB-CD1 4.34Å; P98-F210 HydrophobicContact CB-CD2 3.65Å; P98-F210 HydrophobicContact CB-CE2 3.95Å; P98-F210 HydrophobicContact CB-CG 3.88Å; P98-F210 HydrophobicContact CB-CZ 4.44Å; P98-F210 HydrophobicContact CG-CD1 3.84Å; P98-F210 HydrophobicContact CG-CD2 3.82Å; P98-F210 HydrophobicContact CG-CE1 3.76Å; P98-F210 HydrophobicContact CG-CE2 3.73Å; P98-F210 HydrophobicContact CG-CG 3.89Å; P98-F210 HydrophobicContact CG-CZ 3.72Å; P98-W213 HydrophobicContact CB-CB 4.02Å; P98-W213 HydrophobicContact CB-CG 4.34Å; P98-W213 HydrophobicContact CG-CB 4.32Å; P98-W213 HydrophobicContact CG-CD2 4.36Å; P98-W213 HydrophobicContact CG-CG 4.18Å
99	W	92.3	Very high	84.5	Confident	16 Å²	16	59.9 Å²	59.9	6%	0.061	29%	0.287	C	S	.	.			trans	-128.1	154.7	179	62.8	75.2	0	0	0	113.1	F97 D103 V104 A129 L132 R133 L136 F205 F210 M235	F97-W99 HydrophobicContact CD1-CZ2 4.48Å; F97-W99 PolarHBondContact O-N 2.99Å; F97-W99 VanDerWaalsContact O-N 3.08Å; W99-D103 HydrophobicContact CB-CB 4.18Å; W99-V104 HydrophobicContact CG-CG2 4.2Å; W99-A129 PolarHBondContact NE1-O 3.32Å; W99-L132 HydrophobicContact CH2-CB 3.94Å; W99-L132 HydrophobicContact CZ2-CB 3.61Å; W99-R133 HydrophobicContact CZ2-CG 4.1Å; W99-L136 HydrophobicContact CH2-CB 3.89Å; W99-L136 HydrophobicContact CH2-CD2 3.76Å; W99-L136 HydrophobicContact CH2-CG 4.42Å; W99-L136 HydrophobicContact CZ3-CB 4.31Å; W99-L136 HydrophobicContact CZ3-CD2 3.64Å; W99-L136 HydrophobicContact CZ3-CG 4.45Å; W99-F205 HydrophobicContact CB-CD1 4.29Å; W99-F205 HydrophobicContact CB-CE1 4.1Å; W99-F210 HydrophobicContact CE3-CE2 4.07Å; W99-F210 AromaticContact CE3-CZ 3.64Å; W99-F210 HydrophobicContact CE3-CZ 3.64Å; W99-F210 HydrophobicContact CZ3-CE1 4.29Å; W99-F210 AromaticContact CZ3-CZ 3.72Å; W99-F210 HydrophobicContact CZ3-CZ 3.72Å; W99-M235 HydrophobicContact CH2-CE 3.89Å; W99-M235 HydrophobicContact CZ3-CE 4.07Å
100	T	90.1	Very high	84.8	Confident	73 Å²	73	60.4 Å²	60.4	45%	0.448	28%	0.284	S	S	.	.			trans	-99.6	164.8	168.3	64.6	0	0	0	0	110.9	G102 D103 V104	T100-G102 PolarHBondContact O-N 3.04Å; T100-G102 PolarHBondContact OG1-N 3.11Å; T100-D103 WeakPolarHBondContact CB-OD2 3.49Å; T100-D103 PolarHBondContact N-OD2 3Å; T100-D103 WeakPolarHBondContact O-CB 3.28Å; T100-D103 PolarHBondContact O-N 3.2Å; T100-D103 VanDerWaalsContact O-N 3.1Å; T100-D103 PolarHBondContact OG1-N 2.9Å; T100-D103 VanDerWaalsContact OG1-N 3.17Å; T100-D103 PolarHBondContact OG1-OD2 3.48Å; T100-V104 PolarHBondContact O-N 3.21Å
101	E	89.6	Confident	83.8	Confident	86 Å²	86	56.6 Å²	56.6	40%	0.402	29%	0.291	S	S	.	.	H	α-helix	trans	-56.1	-36.1	170.3	-66.9	-178	-159.9	0	0	111.6	D103 V104 A105 V125 R126	E101-D103 VanDerWaalsContact C-N 3.34Å; E101-D103 PolarHBondContact O-N 3.07Å; E101-V104 PolarHBondContact O-N 3.45Å; E101-A105 WeakPolarHBondContact O-CB 3.41Å; E101-A105 PolarHBondContact O-N 3.4Å; E101-V125 HydrophobicContact CB-CG1 4.45Å; E101-V125 WeakPolarHBondContact O-CG1 3.43Å; E101-R126 WeakPolarHBondContact OE1-CD 3.38Å; E101-R126 VanDerWaalsContact OE1-CG 3.28Å; E101-R126 WeakPolarHBondContact OE1-CG 3.35Å; E101-R126 IonicContact OE1-NE 2.73Å; E101-R126 PolarHBondContact OE1-NE 3.04Å; E101-R126 VanDerWaalsContact OE1-NE 3.11Å; E101-R126 IonicContact OE2-CZ 3.28Å; E101-R126 IonicContact OE2-NE 2.81Å; E101-R126 PolarHBondContact OE2-NE 3.48Å; E101-R126 IonicContact OE2-NH2 2.8Å
102	G	87.4	Confident	82.4	Confident	40 Å²	40	58.5 Å²	58.5	41%	0.412	31%	0.309	S	S	.	.	H	α-helix	trans	-65.4	-33.1	176.8	0	0	0	0	0	113.8	T100 R106	T100-G102 PolarHBondContact O-N 3.04Å; T100-G102 PolarHBondContact OG1-N 3.11Å; G102-R106 WeakPolarHBondContact O-CG 3.19Å; G102-R106 PolarHBondContact O-N 3.47Å
103	D	90.8	Very high	80.8	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-66.1	-48.7	174.5	-65.2	-53.6	0	0	0	111.3	W99 T100 E101 A105 R106 V107 F205 R209	W99-D103 HydrophobicContact CB-CB 4.18Å; T100-D103 WeakPolarHBondContact CB-OD2 3.49Å; T100-D103 PolarHBondContact N-OD2 3Å; T100-D103 WeakPolarHBondContact O-CB 3.28Å; T100-D103 PolarHBondContact O-N 3.2Å; T100-D103 VanDerWaalsContact O-N 3.1Å; T100-D103 PolarHBondContact OG1-N 2.9Å; T100-D103 VanDerWaalsContact OG1-N 3.17Å; T100-D103 PolarHBondContact OG1-OD2 3.48Å; E101-D103 VanDerWaalsContact C-N 3.34Å; E101-D103 PolarHBondContact O-N 3.07Å; D103-A105 VanDerWaalsContact C-N 3.28Å; D103-A105 PolarHBondContact O-N 3.1Å; D103-R106 WeakPolarHBondContact O-CB 3.42Å; D103-R106 PolarHBondContact O-N 3.06Å; D103-R106 IonicContact OD1-CZ 3.73Å; D103-R106 IonicContact OD1-NE 3.92Å; D103-R106 IonicContact OD1-NH2 3.39Å; D103-R106 PolarHBondContact OD1-NH2 2.95Å; D103-V107 PolarHBondContact O-N 3.11Å; D103-V107 VanDerWaalsContact O-N 3.08Å; D103-F205 HydrophobicContact CB-CD1 3.89Å; D103-F205 HydrophobicContact CB-CE1 3.87Å; D103-R209 VanDerWaalsContact CG-NH2 3.29Å; D103-R209 IonicContact OD1-NH2 2.94Å; D103-R209 PolarHBondContact OD1-NH2 2.75Å; D103-R209 IonicContact OD2-CZ 3.95Å; D103-R209 IonicContact OD2-NH1 3.98Å; D103-R209 PolarHBondContact OD2-NH1 3.21Å; D103-R209 IonicContact OD2-NH2 3.27Å; D103-R209 PolarHBondContact OD2-NH2 2.95Å
104	V	92.4	Very high	79.6	Confident	0 Å²	0	57 Å²	57	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60.7	-40.8	177	-178.6	0	0	0	0	110.3	W99 T100 E101 R106 V107 L108 V125 L128 A129 L132 F205	W99-V104 HydrophobicContact CG-CG2 4.2Å; T100-V104 PolarHBondContact O-N 3.21Å; E101-V104 PolarHBondContact O-N 3.45Å; V104-R106 VanDerWaalsContact C-N 3.29Å; V104-R106 PolarHBondContact O-N 2.99Å; V104-V107 PolarHBondContact O-N 3.2Å; V104-L108 HydrophobicContact CG1-CD1 4.13Å; V104-L108 WeakPolarHBondContact O-CG 3.48Å; V104-L108 PolarHBondContact O-N 3.31Å; V104-V125 HydrophobicContact CB-CG1 4.22Å; V104-V125 HydrophobicContact CG1-CG1 4.29Å; V104-L128 HydrophobicContact CG1-CD2 4.2Å; V104-L128 HydrophobicContact CG1-CG 4.49Å; V104-A129 HydrophobicContact CG2-CB 4Å; V104-L132 HydrophobicContact CG1-CD1 4.39Å; V104-L132 HydrophobicContact CG2-CD1 4.36Å; V104-F205 HydrophobicContact CG2-CE1 4.18Å; V104-F205 HydrophobicContact CG2-CZ 4.16Å
105	A	90.4	Very high	78.4	Confident	15 Å²	15	66 Å²	66	12%	0.124	38%	0.376	C	S	.	.	H	α-helix	trans	-62.9	-31.5	174.2	0	0	0	0	0	113.4	E101 D103 R109 V125	E101-A105 WeakPolarHBondContact O-CB 3.41Å; E101-A105 PolarHBondContact O-N 3.4Å; D103-A105 VanDerWaalsContact C-N 3.28Å; D103-A105 PolarHBondContact O-N 3.1Å; A105-R109 WeakPolarHBondContact O-CG 3.3Å; A105-R109 PolarHBondContact O-N 2.94Å; A105-R109 PolarHBondContact O-NH1 2.87Å; A105-R109 VanDerWaalsContact O-NH1 3.13Å; A105-V125 HydrophobicContact CB-CG1 4.05Å; A105-V125 HydrophobicContact CB-CG2 4.29Å
106	R	89.1	Confident	77.7	Confident	129 Å²	129	70.1 Å²	70.1	49%	0.487	38%	0.384	S	S	.	.	H	α-helix	trans	-69.4	-45.1	173.6	-76.7	-171.1	-73.6	-154.3	3.5	111.5	G102 D103 V104 L108 R109 K110 T204	G102-R106 WeakPolarHBondContact O-CG 3.19Å; G102-R106 PolarHBondContact O-N 3.47Å; D103-R106 WeakPolarHBondContact O-CB 3.42Å; D103-R106 PolarHBondContact O-N 3.06Å; D103-R106 IonicContact OD1-CZ 3.73Å; D103-R106 IonicContact OD1-NE 3.92Å; D103-R106 IonicContact OD1-NH2 3.39Å; D103-R106 PolarHBondContact OD1-NH2 2.95Å; V104-R106 VanDerWaalsContact C-N 3.29Å; V104-R106 PolarHBondContact O-N 2.99Å; R106-L108 VanDerWaalsContact C-N 3.33Å; R106-L108 PolarHBondContact O-N 3.39Å; R106-R109 PolarHBondContact O-N 3.2Å; R106-R109 VanDerWaalsContact O-N 3.14Å; R106-K110 PolarHBondContact O-N 3.41Å; R106-T204 HydrophobicContact CB-CG2 3.63Å
107	V	89.9	Confident	76.9	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-59.8	-44.2	175.8	-179.6	0	0	0	0	110.9	D103 V104 R109 K110 T204 F205 E236 V239 E240	D103-V107 PolarHBondContact O-N 3.11Å; D103-V107 VanDerWaalsContact O-N 3.08Å; V104-V107 PolarHBondContact O-N 3.2Å; V107-R109 PolarHBondContact O-N 3.3Å; V107-R109 VanDerWaalsContact O-N 3.16Å; V107-K110 WeakPolarHBondContact O-CB 3.49Å; V107-K110 PolarHBondContact O-N 2.79Å; V107-T204 HydrophobicContact CG2-CG2 3.9Å; V107-F205 HydrophobicContact CG2-CD1 4.03Å; V107-F205 HydrophobicContact CG2-CE1 3.69Å; V107-F205 HydrophobicContact CG2-CE2 4.41Å; V107-F205 HydrophobicContact CG2-CZ 3.9Å; V107-E236 HydrophobicContact CG1-CG 3.77Å; V107-E236 HydrophobicContact CG2-CG 3.86Å; V107-V239 HydrophobicContact CB-CG1 4.07Å; V107-V239 HydrophobicContact CG1-CB 3.86Å; V107-V239 HydrophobicContact CG1-CG1 3.59Å; V107-E240 HydrophobicContact CG1-CG 4.07Å
108	L	88.2	Confident	75.8	Confident	15 Å²	15	68 Å²	68	8%	0.079	38%	0.379	C	S	.	.	H	α-helix	trans	-63.7	-21	178.3	-70.6	169.7	0	0	0	114.3	V104 R106 F120 V125 L128 V239 R243	V104-L108 HydrophobicContact CG1-CD1 4.13Å; V104-L108 WeakPolarHBondContact O-CG 3.48Å; V104-L108 PolarHBondContact O-N 3.31Å; R106-L108 VanDerWaalsContact C-N 3.33Å; R106-L108 PolarHBondContact O-N 3.39Å; L108-F120 HydrophobicContact CB-CD2 4.26Å; L108-F120 HydrophobicContact CD1-CB 4.1Å; L108-F120 HydrophobicContact CD1-CD1 4.2Å; L108-F120 HydrophobicContact CD1-CD2 4.41Å; L108-F120 HydrophobicContact CD1-CG 3.98Å; L108-F120 HydrophobicContact CD2-CD2 4.28Å; L108-F120 HydrophobicContact CD2-CE1 4.37Å; L108-F120 HydrophobicContact CD2-CE2 4.17Å; L108-F120 HydrophobicContact CD2-CG 4.46Å; L108-F120 HydrophobicContact CD2-CZ 4.21Å; L108-V125 HydrophobicContact CD1-CG2 3.92Å; L108-L128 HydrophobicContact CD1-CD2 4.09Å; L108-L128 HydrophobicContact CD2-CD2 4.04Å; L108-L128 HydrophobicContact CG-CD2 4.45Å; L108-V239 HydrophobicContact CD2-CG1 3.72Å; L108-V239 HydrophobicContact CG-CG1 3.96Å; L108-R243 HydrophobicContact CD2-CB 3.88Å; L108-R243 HydrophobicContact CD2-CG 4.07Å; L108-R243 WeakPolarHBondContact O-CD 3.47Å
109	R	83.9	Confident	75.3	Confident	133 Å²	133	73.7 Å²	73.7	50%	0.502	41%	0.405	S	S	.	.	H	α-helix	trans	-90.2	-11.6	172.9	-69.6	-173.7	-63.3	-93	5.1	113.6	A105 R106 V107 A112	A105-R109 WeakPolarHBondContact O-CG 3.3Å; A105-R109 PolarHBondContact O-N 2.94Å; A105-R109 PolarHBondContact O-NH1 2.87Å; A105-R109 VanDerWaalsContact O-NH1 3.13Å; R106-R109 PolarHBondContact O-N 3.2Å; R106-R109 VanDerWaalsContact O-N 3.14Å; V107-R109 PolarHBondContact O-N 3.3Å; V107-R109 VanDerWaalsContact O-N 3.16Å; R109-A112 WeakPolarHBondContact O-CB 3.34Å; R109-A112 PolarHBondContact O-N 3.46Å
110	K	76.9	Confident	75	Confident	65 Å²	65	73.9 Å²	73.9	28%	0.283	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	137.1	-179.2	-161.8	170.9	-178.8	168	0	109.9	R106 V107 G202 T204 E236	R106-K110 PolarHBondContact O-N 3.41Å; V107-K110 WeakPolarHBondContact O-CB 3.49Å; V107-K110 PolarHBondContact O-N 2.79Å; K110-G202 PolarHBondContact NZ-O 3.33Å; K110-T204 WeakPolarHBondContact CD-OG1 3.46Å; K110-T204 PolarHBondContact NZ-OG1 3.32Å; K110-E236 IonicContact NZ-OE1 3.58Å; K110-E236 PolarHBondContact NZ-OE1 3.23Å
111	G	58.6	Low	75	Confident	68 Å²	68	71 Å²	71	70%	0.701	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	7.7	-178	0	0	0	0	0	116.1	G113	G111-G113 PolarHBondContact O-N 3.06Å
112	A	53.1	Low	75	Confident	56 Å²	56	70.1 Å²	70.1	46%	0.463	40%	0.396	S	S	.	.			trans	-72.4	59.8	172.3	0	0	0	0	0	113.1	R109 G114 L117	R109-A112 WeakPolarHBondContact O-CB 3.34Å; R109-A112 PolarHBondContact O-N 3.46Å; A112-G114 PolarHBondContact O-N 3.04Å; A112-L117 HydrophobicContact CB-CD1 4.1Å
113	G	44.3	Very low	75.1	Confident	70 Å²	70	71.6 Å²	71.6	72%	0.722	39%	0.393	S	S	*	.			trans	-68.9	94.2	177.2	0	0	0	0	0	112.2	G111 R115	G111-G113 PolarHBondContact O-N 3.06Å; G113-R115 PolarHBondContact O-N 3.45Å
114	G	46.9	Very low	75.1	Confident	88 Å²	88	71.5 Å²	71.5	91%	0.907	39%	0.392	S	S	*	.	S	Bend	trans	69.9	-22.8	167.8	0	0	0	0	0	117.3	A112	A112-G114 PolarHBondContact O-N 3.04Å
115	R	51.4	Low	75.2	Confident	211 Å²	211	72 Å²	72	80%	0.796	40%	0.395	S	S	*	.	S	Bend	trans	-87.4	131.4	174	-73	-175.5	170.9	-171.2	-2.8	110.7	G113 L117	G113-R115 PolarHBondContact O-N 3.45Å; R115-L117 VanDerWaalsContact C-N 3.29Å; R115-L117 PolarHBondContact O-N 3.26Å
116	R	56.3	Low	75.3	Confident	254 Å²	254	76 Å²	76	96%	0.958	41%	0.407	S	S	*	.			trans	-64.4	89	165.2	-101.5	-174	173.1	-175.9	-1.8	109.2
117	L	62.1	Low	75.4	Confident	76 Å²	76	75.7 Å²	75.7	40%	0.398	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-72.7	148.5	168.1	-67.3	168.1	0	0	0	109.4	A112 R115 Q119 M247	A112-L117 HydrophobicContact CB-CD1 4.1Å; R115-L117 VanDerWaalsContact C-N 3.29Å; R115-L117 PolarHBondContact O-N 3.26Å; L117-Q119 PolarHBondContact O-N 3.01Å; L117-M247 HydrophobicContact CD2-CE 4.04Å
118	P	67.4	Low	75.6	Confident	27 Å²	27	75.7 Å²	75.7	18%	0.175	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-58.5	133.8	169.9	27.5	-35.5	0	0	0	110	M247 G260 V262	P118-M247 HydrophobicContact CG-CE 3.53Å; P118-M247 HydrophobicContact CG-SD 3.65Å; P118-G260 WeakPolarHBondContact CB-O 3.35Å; P118-V262 HydrophobicContact CB-CG2 4.01Å; P118-V262 HydrophobicContact CG-CG2 4.22Å
119	Q	79.6	Confident	75.8	Confident	124 Å²	124	75.2 Å²	75.2	58%	0.579	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-82.9	145.5	-178.7	-177.7	168.5	-21.9	0	0	109.8	L117 E261 V262	L117-Q119 PolarHBondContact O-N 3.01Å; Q119-E261 CarbonylContact O-C 3.58Å; Q119-E261 VanDerWaalsContact O-CA 3.32Å; Q119-E261 WeakPolarHBondContact O-CA 3.24Å; Q119-E261 WeakPolarHBondContact O-CG 3.31Å; Q119-V262 PolarHBondContact O-N 3.07Å
120	F	86.1	Confident	76.1	Confident	20 Å²	20	70.2 Å²	70.2	9%	0.088	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-79	132.8	173.1	-77.8	-105.2	0	0	0	110.8	L108 A124 V125 R243 V246 V262	L108-F120 HydrophobicContact CB-CD2 4.26Å; L108-F120 HydrophobicContact CD1-CB 4.1Å; L108-F120 HydrophobicContact CD1-CD1 4.2Å; L108-F120 HydrophobicContact CD1-CD2 4.41Å; L108-F120 HydrophobicContact CD1-CG 3.98Å; L108-F120 HydrophobicContact CD2-CD2 4.28Å; L108-F120 HydrophobicContact CD2-CE1 4.37Å; L108-F120 HydrophobicContact CD2-CE2 4.17Å; L108-F120 HydrophobicContact CD2-CG 4.46Å; L108-F120 HydrophobicContact CD2-CZ 4.21Å; F120-A124 HydrophobicContact CD1-CB 4.32Å; F120-V125 HydrophobicContact CB-CG2 4.07Å; F120-R243 HydrophobicContact CE2-CG 3.87Å; F120-R243 HydrophobicContact CZ-CB 4.48Å; F120-R243 HydrophobicContact CZ-CG 4.02Å; F120-V246 HydrophobicContact CE1-CG1 4.15Å; F120-V246 HydrophobicContact CZ-CB 4.45Å; F120-V246 HydrophobicContact CZ-CG1 4.08Å; F120-V262 HydrophobicContact CD1-CB 4.04Å; F120-V262 HydrophobicContact CD1-CG1 4.04Å; F120-V262 HydrophobicContact CD2-CG2 4.4Å; F120-V262 HydrophobicContact CE1-CB 4.22Å; F120-V262 HydrophobicContact CE1-CG1 3.85Å; F120-V262 HydrophobicContact CE2-CG2 4.31Å; F120-V262 HydrophobicContact CG-CB 4.21Å; F120-V262 HydrophobicContact CZ-CG1 4.33Å; F120-V262 HydrophobicContact CZ-CG2 4.42Å
121	S	90.1	Very high	76.8	Confident	13 Å²	13	68.5 Å²	68.5	9%	0.091	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-64.7	150.7	175.5	60.8	0	0	0	0	112.2	E123 A124 V125 E261 V262	S121-E123 PolarHBondContact O-N 2.97Å; S121-A124 PolarHBondContact O-N 3.42Å; S121-A124 VanDerWaalsContact OG-CB 3.28Å; S121-A124 WeakPolarHBondContact OG-CB 3.37Å; S121-A124 PolarHBondContact OG-N 2.86Å; S121-V125 WeakPolarHBondContact O-CG2 3.37Å; S121-V125 PolarHBondContact O-N 3.36Å; S121-E261 VanDerWaalsContact CA-CD 3.5Å; S121-E261 WeakPolarHBondContact CA-OE1 3.44Å; S121-V262 WeakPolarHBondContact CB-O 3.42Å; S121-V262 PolarHBondContact N-O 3.38Å; S121-V262 PolarHBondContact OG-O 2.65Å
122	A	89.1	Confident	78.4	Confident	67 Å²	67	65.3 Å²	65.3	55%	0.554	36%	0.355	S	S	*	.	H	α-helix	trans	-59.2	-30.9	179.2	0	0	0	0	0	112.9	R126	A122-R126 PolarHBondContact O-N 3.08Å; A122-R126 VanDerWaalsContact O-N 3.15Å
123	E	91.4	Very high	80.3	Confident	71 Å²	71	67.4 Å²	67.4	33%	0.332	35%	0.351	S	S	.	.	H	α-helix	trans	-68.2	-47.5	171.7	-172.2	62.3	-155	0	0	111.2	S121 V125 R126 R127 A264	S121-E123 PolarHBondContact O-N 2.97Å; E123-V125 VanDerWaalsContact C-N 3.31Å; E123-V125 PolarHBondContact O-N 3.34Å; E123-R126 PolarHBondContact O-N 3.23Å; E123-R126 VanDerWaalsContact O-N 3.12Å; E123-R126 IonicContact OE2-CZ 3.76Å; E123-R126 IonicContact OE2-NH1 2.77Å; E123-R126 PolarHBondContact OE2-NH1 3.41Å; E123-R127 HydrophobicContact CG-CG 4.33Å; E123-R127 VanDerWaalsContact O-CG 3.25Å; E123-R127 WeakPolarHBondContact O-CG 3.38Å; E123-R127 PolarHBondContact O-N 2.85Å; E123-R127 IonicContact OE1-CZ 3.45Å; E123-R127 IonicContact OE1-NE 3.4Å; E123-R127 PolarHBondContact OE1-NE 3Å; E123-R127 IonicContact OE1-NH2 3.15Å; E123-R127 PolarHBondContact OE1-NH2 3.07Å; E123-A264 HydrophobicContact CB-CB 4.37Å; E123-A264 HydrophobicContact CG-CB 3.85Å
124	A	90.6	Very high	82.6	Confident	0 Å²	0	68 Å²	68	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.3	-40.4	177.1	0	0	0	0	0	112.3	F120 S121 R127 L128 A264 L267	F120-A124 HydrophobicContact CD1-CB 4.32Å; S121-A124 PolarHBondContact O-N 3.42Å; S121-A124 VanDerWaalsContact OG-CB 3.28Å; S121-A124 WeakPolarHBondContact OG-CB 3.37Å; S121-A124 PolarHBondContact OG-N 2.86Å; A124-R127 PolarHBondContact O-N 2.87Å; A124-L128 WeakPolarHBondContact O-CB 3.47Å; A124-L128 PolarHBondContact O-N 3.17Å; A124-A264 HydrophobicContact CB-CB 4.41Å; A124-L267 HydrophobicContact CB-CD2 4.39Å; A124-L267 WeakPolarHBondContact O-CD2 3.36Å
125	V	93.1	Very high	84.7	Confident	10 Å²	10	63.8 Å²	63.8	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-46.7	173.9	175.9	0	0	0	0	111.1	E101 V104 A105 L108 F120 S121 E123 L128 A129	E101-V125 HydrophobicContact CB-CG1 4.45Å; E101-V125 WeakPolarHBondContact O-CG1 3.43Å; V104-V125 HydrophobicContact CB-CG1 4.22Å; V104-V125 HydrophobicContact CG1-CG1 4.29Å; A105-V125 HydrophobicContact CB-CG1 4.05Å; A105-V125 HydrophobicContact CB-CG2 4.29Å; L108-V125 HydrophobicContact CD1-CG2 3.92Å; F120-V125 HydrophobicContact CB-CG2 4.07Å; S121-V125 WeakPolarHBondContact O-CG2 3.37Å; S121-V125 PolarHBondContact O-N 3.36Å; E123-V125 VanDerWaalsContact C-N 3.31Å; E123-V125 PolarHBondContact O-N 3.34Å; V125-L128 PolarHBondContact O-N 3.24Å; V125-A129 VanDerWaalsContact O-CB 3.25Å; V125-A129 WeakPolarHBondContact O-CB 3.37Å; V125-A129 PolarHBondContact O-N 2.63Å
126	R	93.1	Very high	86.8	Confident	100 Å²	100	53.7 Å²	53.7	38%	0.377	25%	0.25	S	C	.	.	H	α-helix	trans	-65.4	-42	179.4	-172.5	174.5	-40.2	98.5	17.4	112.4	E101 A122 E123 A129 G130	E101-R126 WeakPolarHBondContact OE1-CD 3.38Å; E101-R126 VanDerWaalsContact OE1-CG 3.28Å; E101-R126 WeakPolarHBondContact OE1-CG 3.35Å; E101-R126 IonicContact OE1-NE 2.73Å; E101-R126 PolarHBondContact OE1-NE 3.04Å; E101-R126 VanDerWaalsContact OE1-NE 3.11Å; E101-R126 IonicContact OE2-CZ 3.28Å; E101-R126 IonicContact OE2-NE 2.81Å; E101-R126 PolarHBondContact OE2-NE 3.48Å; E101-R126 IonicContact OE2-NH2 2.8Å; A122-R126 PolarHBondContact O-N 3.08Å; A122-R126 VanDerWaalsContact O-N 3.15Å; E123-R126 PolarHBondContact O-N 3.23Å; E123-R126 VanDerWaalsContact O-N 3.12Å; E123-R126 IonicContact OE2-CZ 3.76Å; E123-R126 IonicContact OE2-NH1 2.77Å; E123-R126 PolarHBondContact OE2-NH1 3.41Å; R126-A129 PolarHBondContact O-N 3.06Å; R126-G130 PolarHBondContact O-N 3Å
127	R	91.6	Very high	88.5	Confident	121 Å²	121	41.9 Å²	41.9	46%	0.457	21%	0.206	S	C	.	.	H	α-helix	trans	-60.1	-49.6	175.7	-67.7	-74.3	165.2	156.2	-0.5	110.9	E123 A124 A129 G130 L131 A264 L267 E268	E123-R127 HydrophobicContact CG-CG 4.33Å; E123-R127 VanDerWaalsContact O-CG 3.25Å; E123-R127 WeakPolarHBondContact O-CG 3.38Å; E123-R127 PolarHBondContact O-N 2.85Å; E123-R127 IonicContact OE1-CZ 3.45Å; E123-R127 IonicContact OE1-NE 3.4Å; E123-R127 PolarHBondContact OE1-NE 3Å; E123-R127 IonicContact OE1-NH2 3.15Å; E123-R127 PolarHBondContact OE1-NH2 3.07Å; A124-R127 PolarHBondContact O-N 2.87Å; R127-A129 PolarHBondContact O-N 3.23Å; R127-G130 PolarHBondContact O-N 3.34Å; R127-G130 VanDerWaalsContact O-N 3.14Å; R127-L131 WeakPolarHBondContact O-CG 3.16Å; R127-L131 PolarHBondContact O-N 2.94Å; R127-A264 HydrophobicContact CG-CB 4.14Å; R127-L267 HydrophobicContact CB-CD2 4.49Å; R127-E268 IonicContact NH1-OE1 2.82Å
128	L	92.9	Very high	89.8	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-59.3	-48.5	175.4	-173.1	58.3	0	0	0	111.5	V104 L108 A124 V125 G130 L131 L132 V239 I242 L267	V104-L128 HydrophobicContact CG1-CD2 4.2Å; V104-L128 HydrophobicContact CG1-CG 4.49Å; L108-L128 HydrophobicContact CD1-CD2 4.09Å; L108-L128 HydrophobicContact CD2-CD2 4.04Å; L108-L128 HydrophobicContact CG-CD2 4.45Å; A124-L128 WeakPolarHBondContact O-CB 3.47Å; A124-L128 PolarHBondContact O-N 3.17Å; V125-L128 PolarHBondContact O-N 3.24Å; L128-G130 PolarHBondContact O-N 3.49Å; L128-L131 PolarHBondContact O-N 3Å; L128-L132 HydrophobicContact CD1-CG 4.28Å; L128-L132 HydrophobicContact CG-CD1 4.08Å; L128-L132 HydrophobicContact CG-CG 4.29Å; L128-L132 VanDerWaalsContact O-CG 3.27Å; L128-L132 WeakPolarHBondContact O-CG 3.35Å; L128-L132 PolarHBondContact O-N 3.5Å; L128-V239 HydrophobicContact CD2-CG1 4.17Å; L128-I242 HydrophobicContact CD1-CD1 3.85Å; L128-I242 HydrophobicContact CD1-CG2 3.98Å; L128-L267 HydrophobicContact CB-CD2 3.87Å; L128-L267 HydrophobicContact CD1-CD1 4.48Å
129	A	92.4	Very high	91.1	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.033	18%	0.18	C	C	.	.	H	α-helix	trans	-59.4	-28.1	177.7	0	0	0	0	0	113.2	W99 V104 V125 R126 R127 R133	W99-A129 PolarHBondContact NE1-O 3.32Å; V104-A129 HydrophobicContact CG2-CB 4Å; V125-A129 VanDerWaalsContact O-CB 3.25Å; V125-A129 WeakPolarHBondContact O-CB 3.37Å; V125-A129 PolarHBondContact O-N 2.63Å; R126-A129 PolarHBondContact O-N 3.06Å; R127-A129 PolarHBondContact O-N 3.23Å; A129-R133 WeakPolarHBondContact O-CG 3.31Å
130	G	91.2	Very high	91.7	Very high	29 Å²	29	31.6 Å²	31.6	30%	0.299	15%	0.153	S	C	.	.	H	α-helix	trans	-76.7	-40.6	171.9	0	0	0	0	0	113.7	R126 R127 L128 R133	R126-G130 PolarHBondContact O-N 3Å; R127-G130 PolarHBondContact O-N 3.34Å; R127-G130 VanDerWaalsContact O-N 3.14Å; L128-G130 PolarHBondContact O-N 3.49Å; G130-R133 WeakPolarHBondContact O-CB 3.39Å; G130-R133 PolarHBondContact O-N 3.35Å
131	L	91.6	Very high	91.9	Very high	29 Å²	29	31.8 Å²	31.8	15%	0.152	15%	0.153	C	C	.	.	H	α-helix	trans	-68.6	-41.5	178.1	-67.7	174	0	0	0	112.1	R127 L128 R133 R134 I271 L281	R127-L131 WeakPolarHBondContact O-CG 3.16Å; R127-L131 PolarHBondContact O-N 2.94Å; L128-L131 PolarHBondContact O-N 3Å; L131-R133 PolarHBondContact O-N 3.25Å; L131-R133 VanDerWaalsContact O-N 3.13Å; L131-R134 WeakPolarHBondContact O-CB 3.22Å; L131-R134 PolarHBondContact O-N 3.42Å; L131-I271 HydrophobicContact CD1-CD1 3.68Å; L131-L281 HydrophobicContact CB-CD1 4.39Å; L131-L281 HydrophobicContact CB-CD2 4.23Å; L131-L281 HydrophobicContact CD2-CB 4.49Å
132	L	92.8	Very high	92	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.6	-27.6	178.2	-68.7	167.7	0	0	0	113.4	W99 V104 L128 R134 A135 L136 M235 L238 V239 I242	W99-L132 HydrophobicContact CH2-CB 3.94Å; W99-L132 HydrophobicContact CZ2-CB 3.61Å; V104-L132 HydrophobicContact CG1-CD1 4.39Å; V104-L132 HydrophobicContact CG2-CD1 4.36Å; L128-L132 HydrophobicContact CD1-CG 4.28Å; L128-L132 HydrophobicContact CG-CD1 4.08Å; L128-L132 HydrophobicContact CG-CG 4.29Å; L128-L132 VanDerWaalsContact O-CG 3.27Å; L128-L132 WeakPolarHBondContact O-CG 3.35Å; L128-L132 PolarHBondContact O-N 3.5Å; L132-R134 PolarHBondContact O-N 2.84Å; L132-A135 PolarHBondContact O-N 2.9Å; L132-L136 PolarHBondContact O-N 3.45Å; L132-M235 HydrophobicContact CB-CE 4.1Å; L132-M235 HydrophobicContact CD2-CE 4.11Å; L132-M235 WeakPolarHBondContact O-CE 3.46Å; L132-L238 HydrophobicContact CD2-CD2 3.86Å; L132-L238 HydrophobicContact CD2-CG 4.14Å; L132-V239 HydrophobicContact CD1-CG2 3.41Å; L132-V239 VanDerWaalsContact CD1-CG2 3.41Å; L132-V239 HydrophobicContact CD2-CG2 3.82Å; L132-V239 HydrophobicContact CG-CG2 4.25Å; L132-I242 HydrophobicContact CD2-CD1 4.41Å
133	R	92.4	Very high	92.2	Very high	101 Å²	101	28.4 Å²	28.4	38%	0.381	12%	0.124	S	C	.	.	H	α-helix	trans	-56.5	-40.1	175.5	-63.9	173.7	-178.9	-147.7	-1.8	111.5	F97 W99 A129 G130 L131 L136 I137	F97-R133 HydrophobicContact CD1-CB 4.13Å; F97-R133 HydrophobicContact CD1-CG 3.78Å; F97-R133 HydrophobicContact CD2-CG 3.88Å; F97-R133 HydrophobicContact CE1-CB 3.49Å; F97-R133 VanDerWaalsContact CE1-CB 3.49Å; F97-R133 HydrophobicContact CE1-CG 3.59Å; F97-R133 HydrophobicContact CE2-CB 4.15Å; F97-R133 HydrophobicContact CE2-CG 3.69Å; F97-R133 HydrophobicContact CG-CG 3.92Å; F97-R133 HydrophobicContact CZ-CB 3.5Å; F97-R133 VanDerWaalsContact CZ-CB 3.5Å; F97-R133 HydrophobicContact CZ-CG 3.54Å; W99-R133 HydrophobicContact CZ2-CG 4.1Å; A129-R133 WeakPolarHBondContact O-CG 3.31Å; G130-R133 WeakPolarHBondContact O-CB 3.39Å; G130-R133 PolarHBondContact O-N 3.35Å; L131-R133 PolarHBondContact O-N 3.25Å; L131-R133 VanDerWaalsContact O-N 3.13Å; R133-L136 PolarHBondContact O-N 3.39Å; R133-I137 WeakPolarHBondContact O-CB 3.17Å; R133-I137 VanDerWaalsContact O-CG1 3.28Å; R133-I137 WeakPolarHBondContact O-CG1 3.4Å; R133-I137 PolarHBondContact O-N 3.26Å
134	R	91.8	Very high	92.2	Very high	81 Å²	81	25.2 Å²	25.2	31%	0.306	11%	0.11	S	C	.	.	H	α-helix	trans	-68.3	-44.9	-178.7	-60	171	180	173.6	1.1	110.8	L91 L131 L132 I137 R138 L281	L91-R134 HydrophobicContact CD1-CB 3.93Å; L91-R134 HydrophobicContact CD1-CG 4.32Å; L131-R134 WeakPolarHBondContact O-CB 3.22Å; L131-R134 PolarHBondContact O-N 3.42Å; L132-R134 PolarHBondContact O-N 2.84Å; R134-I137 PolarHBondContact O-N 2.9Å; R134-R138 WeakPolarHBondContact O-CG 3.31Å; R134-R138 PolarHBondContact O-N 3.31Å; R134-L281 WeakPolarHBondContact CD-O 3.42Å; R134-L281 PolarHBondContact NH1-O 3.31Å
135	A	92.4	Very high	92.1	Very high	0 Å²	0	26 Å²	26	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60	-47.6	174.5	0	0	0	0	0	111.6	L132 I137 R138 V139 M235 L238 V280 L281	L132-A135 PolarHBondContact O-N 2.9Å; A135-I137 PolarHBondContact O-N 3.09Å; A135-R138 PolarHBondContact O-N 2.94Å; A135-V139 WeakPolarHBondContact O-CG2 3.43Å; A135-V139 PolarHBondContact O-N 2.92Å; A135-M235 HydrophobicContact CB-CE 4.35Å; A135-L238 HydrophobicContact CB-CD2 3.8Å; A135-V280 HydrophobicContact CB-CG1 3.98Å; A135-L281 HydrophobicContact CB-CD2 4.1Å
136	L	94.4	Very high	91.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59.2	-47.3	177.3	177.4	64.5	0	0	0	112.1	F97 P98 W99 L132 R133 R138 V139 A140 F210 W213 L231 M235	F97-L136 HydrophobicContact CD1-CD2 4.1Å; P98-L136 HydrophobicContact CG-CD2 3.97Å; W99-L136 HydrophobicContact CH2-CB 3.89Å; W99-L136 HydrophobicContact CH2-CD2 3.76Å; W99-L136 HydrophobicContact CH2-CG 4.42Å; W99-L136 HydrophobicContact CZ3-CB 4.31Å; W99-L136 HydrophobicContact CZ3-CD2 3.64Å; W99-L136 HydrophobicContact CZ3-CG 4.45Å; L132-L136 PolarHBondContact O-N 3.45Å; R133-L136 PolarHBondContact O-N 3.39Å; L136-R138 VanDerWaalsContact C-N 3.34Å; L136-R138 PolarHBondContact O-N 2.84Å; L136-V139 PolarHBondContact O-N 3.17Å; L136-A140 VanDerWaalsContact O-CB 3.24Å; L136-A140 WeakPolarHBondContact O-CB 3.24Å; L136-A140 PolarHBondContact O-N 3.46Å; L136-F210 HydrophobicContact CD1-CE1 4Å; L136-W213 HydrophobicContact CD1-CH2 4.03Å; L136-W213 HydrophobicContact CD1-CZ3 3.78Å; L136-W213 HydrophobicContact CD2-CD2 4.25Å; L136-W213 HydrophobicContact CD2-CE3 4.12Å; L136-W213 HydrophobicContact CD2-CH2 3.58Å; L136-W213 HydrophobicContact CD2-CZ2 3.68Å; L136-W213 HydrophobicContact CD2-CZ3 3.79Å; L136-W213 HydrophobicContact CG-CH2 3.51Å; L136-W213 HydrophobicContact CG-CZ2 4.07Å; L136-W213 HydrophobicContact CG-CZ3 3.78Å; L136-L231 HydrophobicContact CD1-CD1 3.95Å; L136-L231 HydrophobicContact CD1-CD2 3.92Å; L136-L231 HydrophobicContact CD1-CG 4.04Å; L136-M235 HydrophobicContact CB-CE 4.04Å; L136-M235 HydrophobicContact CB-SD 4.12Å; L136-M235 HydrophobicContact CD1-CG 4.14Å; L136-M235 HydrophobicContact CD1-SD 4.31Å
137	I	91.6	Very high	91.7	Very high	6 Å²	6	21.8 Å²	21.8	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-63.2	-39.9	-179.4	-71.6	169.5	0	0	0	111.5	L91 P92 L94 F97 R133 R134 A135 A140 R141	L91-I137 HydrophobicContact CD2-CG2 4.25Å; P92-I137 HydrophobicContact CG-CG2 3.91Å; P92-I137 WeakPolarHBondContact O-CD1 3.32Å; L94-I137 HydrophobicContact CD1-CD1 4.06Å; L94-I137 HydrophobicContact CD1-CG1 4.06Å; L94-I137 HydrophobicContact CG-CD1 4.3Å; F97-I137 HydrophobicContact CE1-CD1 4Å; F97-I137 HydrophobicContact CE1-CG1 4.22Å; F97-I137 HydrophobicContact CZ-CD1 3.9Å; R133-I137 WeakPolarHBondContact O-CB 3.17Å; R133-I137 VanDerWaalsContact O-CG1 3.28Å; R133-I137 WeakPolarHBondContact O-CG1 3.4Å; R133-I137 PolarHBondContact O-N 3.26Å; R134-I137 PolarHBondContact O-N 2.9Å; A135-I137 PolarHBondContact O-N 3.09Å; I137-A140 PolarHBondContact O-N 3.18Å; I137-R141 WeakPolarHBondContact O-CG 3.25Å; I137-R141 PolarHBondContact O-N 3.49Å
138	R	91.3	Very high	91.3	Very high	10 Å²	10	18.6 Å²	18.6	4%	0.038	9%	0.091	C	C	.	.	H	α-helix	trans	-59.8	-52.2	174.2	-71.7	177.8	-172.5	-69.6	-1	111.3	L91 R134 A135 L136 A140 R141 E142 V165 V280 Q282 Y284 E285 H286	L91-R138 HydrophobicContact CD1-CG 4.08Å; L91-R138 HydrophobicContact CD2-CG 4.16Å; R134-R138 WeakPolarHBondContact O-CG 3.31Å; R134-R138 PolarHBondContact O-N 3.31Å; A135-R138 PolarHBondContact O-N 2.94Å; L136-R138 VanDerWaalsContact C-N 3.34Å; L136-R138 PolarHBondContact O-N 2.84Å; R138-A140 VanDerWaalsContact C-N 3.29Å; R138-A140 PolarHBondContact O-N 3.11Å; R138-R141 PolarHBondContact O-N 3.12Å; R138-E142 PolarHBondContact O-N 2.79Å; R138-E142 VanDerWaalsContact O-N 3.17Å; R138-V165 HydrophobicContact CB-CB 4.48Å; R138-V165 HydrophobicContact CB-CG1 3.66Å; R138-V165 HydrophobicContact CB-CG2 3.91Å; R138-V165 HydrophobicContact CG-CG1 4.49Å; R138-V280 WeakPolarHBondContact CD-O 3.48Å; R138-V280 PolarHBondContact NE-O 3.16Å; R138-Q282 PolarHBondContact NH2-O 3.14Å; R138-Y284 VanDerWaalsContact CZ-O 3.25Å; R138-Y284 PolarHBondContact NH1-O 3.36Å; R138-Y284 VanDerWaalsContact NH1-O 3.07Å; R138-Y284 PolarHBondContact NH2-O 2.93Å; R138-E285 PolarHBondContact NH1-O 2.88Å; R138-H286 PolarHBondContact NH1-O 3.1Å
139	V	94.1	Very high	90.8	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-62	-39.1	179.2	175.6	0	0	0	0	110.9	A135 L136 E142 A143 A161 V162 V165 L231	A135-V139 WeakPolarHBondContact O-CG2 3.43Å; A135-V139 PolarHBondContact O-N 2.92Å; L136-V139 PolarHBondContact O-N 3.17Å; V139-E142 PolarHBondContact O-N 3.32Å; V139-A143 VanDerWaalsContact O-CB 3.28Å; V139-A143 WeakPolarHBondContact O-CB 3.33Å; V139-A143 PolarHBondContact O-N 3.34Å; V139-A161 HydrophobicContact CG1-CB 4.04Å; V139-A161 WeakPolarHBondContact O-CB 3.46Å; V139-V162 HydrophobicContact CG1-CG2 3.79Å; V139-V162 HydrophobicContact CG2-CG2 4.29Å; V139-V165 HydrophobicContact CG2-CB 3.98Å; V139-V165 HydrophobicContact CG2-CG1 4.02Å; V139-V165 HydrophobicContact CG2-CG2 4.16Å; V139-L231 HydrophobicContact CB-CD1 4.46Å; V139-L231 HydrophobicContact CG1-CD1 3.69Å
140	A	92.8	Very high	90.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.6	-43.9	178	0	0	0	0	0	113	L12 L136 I137 R138 A143 Q144 W213 I219	L12-A140 HydrophobicContact CD1-CB 4.16Å; L136-A140 VanDerWaalsContact O-CB 3.24Å; L136-A140 WeakPolarHBondContact O-CB 3.24Å; L136-A140 PolarHBondContact O-N 3.46Å; I137-A140 PolarHBondContact O-N 3.18Å; R138-A140 VanDerWaalsContact C-N 3.29Å; R138-A140 PolarHBondContact O-N 3.11Å; A140-A143 PolarHBondContact O-N 3.11Å; A140-Q144 VanDerWaalsContact O-CB 3.29Å; A140-Q144 WeakPolarHBondContact O-CB 3.49Å; A140-Q144 PolarHBondContact O-N 3.2Å; A140-W213 HydrophobicContact CB-CH2 3.69Å; A140-W213 HydrophobicContact CB-CZ3 3.96Å; A140-I219 HydrophobicContact CB-CD1 3.63Å; A140-I219 HydrophobicContact CB-CG1 4.22Å
141	R	89.7	Confident	89.8	Confident	24 Å²	24	20.2 Å²	20.2	9%	0.091	9%	0.093	C	C	.	.	H	α-helix	trans	-62.9	-41.7	176.2	-75.8	-178.4	72.2	173.2	7.6	112.4	L12 D18 I137 R138 Q144 R145 E285	L12-R141 HydrophobicContact CD2-CG 4.48Å; D18-R141 IonicContact OD2-NH2 3.94Å; D18-R141 PolarHBondContact OD2-NH2 3.16Å; I137-R141 WeakPolarHBondContact O-CG 3.25Å; I137-R141 PolarHBondContact O-N 3.49Å; R138-R141 PolarHBondContact O-N 3.12Å; R141-Q144 WeakPolarHBondContact O-CB 3.21Å; R141-Q144 PolarHBondContact O-N 2.78Å; R141-R145 PolarHBondContact O-N 3.06Å; R141-E285 IonicContact CZ-OE1 2.7Å; R141-E285 VanDerWaalsContact CZ-OE1 3.3Å; R141-E285 IonicContact NH1-OE1 3.7Å; R141-E285 PolarHBondContact NH1-OE1 2.99Å; R141-E285 IonicContact NH2-OE1 3.81Å; R141-E285 PolarHBondContact NH2-OE1 3.44Å
142	E	91.7	Very high	89.6	Confident	6 Å²	6	20 Å²	20	3%	0.028	9%	0.091	C	C	.	.	H	α-helix	trans	-69.5	-41.7	176.9	-63.3	-53	134	0	0	111.5	R138 V139 Q144 R145 L146 A161 L164 V165 Y433 R452 L453	R138-E142 PolarHBondContact O-N 2.79Å; R138-E142 VanDerWaalsContact O-N 3.17Å; V139-E142 PolarHBondContact O-N 3.32Å; E142-Q144 VanDerWaalsContact C-N 3.27Å; E142-Q144 PolarHBondContact O-N 2.95Å; E142-R145 PolarHBondContact O-N 3.41Å; E142-L146 VanDerWaalsContact O-CG 3.29Å; E142-L146 WeakPolarHBondContact O-CG 3.4Å; E142-L146 PolarHBondContact O-N 3.3Å; E142-A161 HydrophobicContact CB-CB 3.81Å; E142-L164 HydrophobicContact CB-CD1 4.33Å; E142-V165 HydrophobicContact CB-CG2 4.48Å; E142-V165 HydrophobicContact CG-CG2 3.88Å; E142-Y433 PolarHBondContact OE2-OH 3.5Å; E142-R452 IonicContact OE1-CZ 3.14Å; E142-R452 VanDerWaalsContact OE1-CZ 3.27Å; E142-R452 IonicContact OE1-NH1 3.53Å; E142-R452 PolarHBondContact OE1-NH1 3Å; E142-R452 IonicContact OE1-NH2 2.85Å; E142-R452 PolarHBondContact OE1-NH2 3.21Å; E142-R452 IonicContact OE2-CZ 3.11Å; E142-R452 IonicContact OE2-NH2 3.37Å; E142-R452 PolarHBondContact OE2-NH2 3.11Å; E142-L453 HydrophobicContact CG-CD1 4.43Å
143	A	93.3	Very high	89.5	Confident	2 Å²	2	20 Å²	20	2%	0.017	9%	0.091	C	C	.	.	H	α-helix	trans	-61	-36.9	173.3	0	0	0	0	0	111.9	V139 A140 S147 A161 I219	V139-A143 VanDerWaalsContact O-CB 3.28Å; V139-A143 WeakPolarHBondContact O-CB 3.33Å; V139-A143 PolarHBondContact O-N 3.34Å; A140-A143 PolarHBondContact O-N 3.11Å; A143-S147 VanDerWaalsContact O-CB 3.31Å; A143-S147 WeakPolarHBondContact O-CB 3.32Å; A143-S147 PolarHBondContact O-N 3.16Å; A143-A161 HydrophobicContact CB-CB 3.89Å; A143-I219 HydrophobicContact CB-CG2 4.06Å
144	Q	90.8	Very high	89.3	Confident	5 Å²	5	15.4 Å²	15.4	2%	0.023	7%	0.074	C	C	.	.	H	α-helix	trans	-61.8	-53	174.8	-177.1	-179.6	29.6	0	0	110.8	Y21 A140 R141 E142 L146 S147 V148 R218 I219	Y21-Q144 HydrophobicContact CD1-CG 4.5Å; Y21-Q144 HydrophobicContact CE1-CG 3.69Å; A140-Q144 VanDerWaalsContact O-CB 3.29Å; A140-Q144 WeakPolarHBondContact O-CB 3.49Å; A140-Q144 PolarHBondContact O-N 3.2Å; R141-Q144 WeakPolarHBondContact O-CB 3.21Å; R141-Q144 PolarHBondContact O-N 2.78Å; E142-Q144 VanDerWaalsContact C-N 3.27Å; E142-Q144 PolarHBondContact O-N 2.95Å; Q144-L146 VanDerWaalsContact C-N 3.35Å; Q144-L146 PolarHBondContact O-N 3.36Å; Q144-S147 PolarHBondContact O-N 2.97Å; Q144-S147 PolarHBondContact O-OG 3.41Å; Q144-V148 WeakPolarHBondContact O-CG2 3.44Å; Q144-V148 PolarHBondContact O-N 2.99Å; Q144-R218 PolarHBondContact NE2-O 3.4Å; Q144-I219 VanDerWaalsContact CA-O 3.26Å; Q144-I219 WeakPolarHBondContact CA-O 3.38Å; Q144-I219 HydrophobicContact CB-CG2 4.15Å; Q144-I219 WeakPolarHBondContact CB-O 3.46Å; Q144-I219 WeakPolarHBondContact CG-O 3.46Å
145	R	88.4	Confident	89.2	Confident	17 Å²	17	14.5 Å²	14.5	6%	0.064	7%	0.071	C	C	.	.	H	α-helix	trans	-55.4	-44.9	176	-72.4	-168.3	108.9	73.5	-9.5	113.3	D18 Y21 R141 E142 D459 C460 P462	D18-R145 IonicContact OD1-CZ 3.84Å; D18-R145 VanDerWaalsContact OD1-CZ 3.3Å; D18-R145 IonicContact OD1-NH1 3.27Å; D18-R145 PolarHBondContact OD1-NH1 2.91Å; D18-R145 IonicContact OD1-NH2 3.54Å; D18-R145 PolarHBondContact OD1-NH2 3.15Å; D18-R145 IonicContact OD2-NH1 2.78Å; D18-R145 PolarHBondContact OD2-NH1 3.12Å; Y21-R145 VanDerWaalsContact OH-CA 3.27Å; Y21-R145 WeakPolarHBondContact OH-CA 3.4Å; Y21-R145 WeakPolarHBondContact OH-CG 3.29Å; Y21-R145 PolarHBondContact OH-N 3.21Å; R141-R145 PolarHBondContact O-N 3.06Å; E142-R145 PolarHBondContact O-N 3.41Å; R145-D459 IonicContact NH2-OD1 3.46Å; R145-D459 PolarHBondContact NH2-OD1 2.9Å; R145-C460 PolarHBondContact NH2-O 3.4Å; R145-P462 HydrophobicContact CG-CG 4.44Å
146	L	88.9	Confident	89	Confident	16 Å²	16	17.7 Å²	17.7	8%	0.084	9%	0.085	C	C	.	.	H	α-helix	trans	-67.4	-36.6	179.6	-65.2	177.9	0	0	0	111.9	E142 Q144 V148 E157 A161 L164 Y433	E142-L146 VanDerWaalsContact O-CG 3.29Å; E142-L146 WeakPolarHBondContact O-CG 3.4Å; E142-L146 PolarHBondContact O-N 3.3Å; Q144-L146 VanDerWaalsContact C-N 3.35Å; Q144-L146 PolarHBondContact O-N 3.36Å; L146-V148 VanDerWaalsContact C-N 3.29Å; L146-V148 PolarHBondContact O-N 2.93Å; L146-E157 HydrophobicContact CB-CB 4.14Å; L146-E157 HydrophobicContact CB-CG 4.01Å; L146-A161 HydrophobicContact CD1-CB 4.48Å; L146-L164 HydrophobicContact CD1-CD1 4.01Å; L146-Y433 HydrophobicContact CD2-CD1 4.1Å; L146-Y433 HydrophobicContact CD2-CE1 3.95Å
147	S	88.9	Confident	88.9	Confident	4 Å²	4	17.8 Å²	17.8	3%	0.028	9%	0.085	C	C	.	.	H	α-helix	trans	-70.5	-17.9	-178.6	82.2	0	0	0	0	115	A143 Q144 L149 H150 A151 K152 I219 S220	A143-S147 VanDerWaalsContact O-CB 3.31Å; A143-S147 WeakPolarHBondContact O-CB 3.32Å; A143-S147 PolarHBondContact O-N 3.16Å; Q144-S147 PolarHBondContact O-N 2.97Å; Q144-S147 PolarHBondContact O-OG 3.41Å; S147-L149 PolarHBondContact O-N 3.47Å; S147-H150 PolarHBondContact O-N 3.46Å; S147-A151 VanDerWaalsContact O-CA 3.31Å; S147-A151 WeakPolarHBondContact O-CA 3.29Å; S147-A151 PolarHBondContact O-N 3.13Å; S147-K152 WeakPolarHBondContact CB-O 3.47Å; S147-K152 PolarHBondContact O-N 3.45Å; S147-I219 PolarHBondContact OG-O 3.28Å; S147-I219 VanDerWaalsContact OG-O 3.11Å; S147-S220 WeakPolarHBondContact CB-OG 3.26Å; S147-S220 VanDerWaalsContact OG-CB 3.28Å; S147-S220 WeakPolarHBondContact OG-CB 3.28Å; S147-S220 PolarHBondContact OG-OG 3.41Å
148	V	84.6	Confident	89	Confident	55 Å²	55	17.5 Å²	17.5	33%	0.333	8%	0.084	S	C	.	.	G	3₁₀ helix	trans	-55.4	-39.5	-176.9	178.9	0	0	0	0	111.6	Y21 Q144 L146 H150 A151 P462	Y21-V148 HydrophobicContact CE1-CG2 3.68Å; Q144-V148 WeakPolarHBondContact O-CG2 3.44Å; Q144-V148 PolarHBondContact O-N 2.99Å; L146-V148 VanDerWaalsContact C-N 3.29Å; L146-V148 PolarHBondContact O-N 2.93Å; V148-H150 VanDerWaalsContact C-N 3.28Å; V148-H150 PolarHBondContact O-N 3.4Å; V148-A151 PolarHBondContact O-N 3.12Å; V148-P462 HydrophobicContact CB-CB 4.27Å; V148-P462 HydrophobicContact CG1-CB 4.4Å; V148-P462 HydrophobicContact CG2-CB 4.17Å; V148-P462 HydrophobicContact CG2-CG 4.31Å
149	L	81.3	Confident	89.1	Confident	43 Å²	43	18.5 Å²	18.5	23%	0.225	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-59.2	-35.8	-174.2	-173.5	66.6	0	0	0	113.5	S147 L465	S147-L149 PolarHBondContact O-N 3.47Å; L149-L465 HydrophobicContact CD1-CB 3.7Å; L149-L465 HydrophobicContact CD1-CD1 4.09Å
150	H	79.3	Confident	89	Confident	14 Å²	14	19 Å²	19	7%	0.065	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-118.1	4.2	-177.9	-56.5	117.2	0	0	0	112.9	S147 V148 K152 R222 H563	S147-H150 PolarHBondContact O-N 3.46Å; V148-H150 VanDerWaalsContact C-N 3.28Å; V148-H150 PolarHBondContact O-N 3.4Å; H150-K152 PolarHBondContact O-N 2.99Å; H150-R222 PolarHBondContact O-NH2 3.08Å; H150-H563 AromaticContact CE1-CE1 3.54Å; H150-H563 AromaticContact CE1-CG 3.81Å; H150-H563 AromaticContact CE1-ND1 3.47Å; H150-H563 PolarHBondContact CE1-ND1 2.97Å; H150-H563 AromaticContact CE1-NE2 3.95Å; H150-H563 AromaticContact ND1-CE1 3.98Å; H150-H563 AromaticContact NE2-CG 3.86Å; H150-H563 AromaticContact NE2-ND1 3.62Å
151	A	84.4	Confident	89.1	Confident	11 Å²	11	19 Å²	19	9%	0.091	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	45	33.4	-171	0	0	0	0	0	113.8	S147 V148 R222	S147-A151 VanDerWaalsContact O-CA 3.31Å; S147-A151 WeakPolarHBondContact O-CA 3.29Å; S147-A151 PolarHBondContact O-N 3.13Å; V148-A151 PolarHBondContact O-N 3.12Å; A151-R222 VanDerWaalsContact CB-NH2 3.34Å; A151-R222 PolarHBondContact O-N 2.69Å; A151-R222 PolarHBondContact O-NH2 3.01Å
152	K	86.5	Confident	89.3	Confident	23 Å²	23	18 Å²	18	10%	0.1	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	128.7	-176	-169	178.6	-169.2	172.7	0	109.3	S147 H150 T154 S220 R222 E608	S147-K152 WeakPolarHBondContact CB-O 3.47Å; S147-K152 PolarHBondContact O-N 3.45Å; H150-K152 PolarHBondContact O-N 2.99Å; K152-T154 HydrophobicContact CD-CG2 4.18Å; K152-T154 HydrophobicContact CG-CG2 4.13Å; K152-S220 PolarHBondContact N-OG 3.47Å; K152-R222 CarbonylContact C-O 3.53Å; K152-R222 WeakPolarHBondContact CA-O 3.32Å; K152-R222 HydrophobicContact CB-CB 4.49Å; K152-R222 HydrophobicContact CG-CB 4.27Å; K152-E608 IonicContact NZ-OE1 3.64Å; K152-E608 PolarHBondContact NZ-OE1 3.24Å; K152-E608 IonicContact NZ-OE2 2.66Å; K152-E608 PolarHBondContact NZ-OE2 3.07Å
153	C	90.8	Very high	89.4	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	114.8	170.5	-171.6	0	0	0	0	109.5	R222 I223 H224 A227	C153-R222 PolarHBondContact N-O 2.91Å; C153-I223 HydrophobicContact CB-CG1 4.19Å; C153-H224 PolarHBondContact O-N 2.99Å; C153-A227 WeakPolarHBondContact O-CB 3.36Å
154	T	89.3	Confident	89.3	Confident	5 Å²	5	21.3 Å²	21.3	3%	0.031	10%	0.101	C	C	.	.			trans	-109.1	-177.7	174.5	84.2	0	0	0	0	110.6	K152 F156 E157 V158 A227	K152-T154 HydrophobicContact CD-CG2 4.18Å; K152-T154 HydrophobicContact CG-CG2 4.13Å; T154-F156 PolarHBondContact O-N 3.25Å; T154-F156 WeakPolarHBondContact OG1-CD2 3.46Å; T154-F156 PolarHBondContact OG1-N 3.38Å; T154-E157 VanDerWaalsContact CA-OE2 3.27Å; T154-E157 WeakPolarHBondContact CA-OE2 3.4Å; T154-E157 WeakPolarHBondContact CB-OE2 3.43Å; T154-E157 PolarHBondContact N-OE2 3.06Å; T154-E157 PolarHBondContact OG1-OE2 2.61Å; T154-V158 PolarHBondContact O-N 3.31Å; T154-A227 WeakPolarHBondContact O-CB 3.36Å
155	R	89.1	Confident	89.4	Confident	63 Å²	63	21.1 Å²	21.1	24%	0.238	10%	0.1	C	C	.	.	H	α-helix	trans	-58.7	-26.6	170.8	67.3	177.5	-174.4	168.3	-2.2	113.3	Q159 S230	R155-Q159 WeakPolarHBondContact O-CB 3.45Å; R155-Q159 WeakPolarHBondContact O-CG 3.38Å; R155-Q159 PolarHBondContact O-N 3.47Å; R155-S230 WeakPolarHBondContact CB-OG 3.43Å
156	F	88.5	Confident	89.4	Confident	67 Å²	67	20.5 Å²	20.5	29%	0.294	10%	0.098	S	C	.	.	H	α-helix	trans	-73.1	-44	-176	-61.7	-64.1	0	0	0	111.5	T154 V158 Q159 S160	T154-F156 PolarHBondContact O-N 3.25Å; T154-F156 WeakPolarHBondContact OG1-CD2 3.46Å; T154-F156 PolarHBondContact OG1-N 3.38Å; F156-V158 VanDerWaalsContact C-N 3.32Å; F156-V158 PolarHBondContact O-N 2.74Å; F156-Q159 PolarHBondContact O-N 3.26Å; F156-S160 WeakPolarHBondContact O-CB 3.42Å; F156-S160 PolarHBondContact O-N 3.37Å; F156-S160 PolarHBondContact O-OG 3.33Å
157	E	91.4	Very high	89.3	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-61.7	-42.8	175	-66.9	60.7	-122.1	0	0	110.3	L146 T154 A161 H436	L146-E157 HydrophobicContact CB-CB 4.14Å; L146-E157 HydrophobicContact CB-CG 4.01Å; T154-E157 VanDerWaalsContact CA-OE2 3.27Å; T154-E157 WeakPolarHBondContact CA-OE2 3.4Å; T154-E157 WeakPolarHBondContact CB-OE2 3.43Å; T154-E157 PolarHBondContact N-OE2 3.06Å; T154-E157 PolarHBondContact OG1-OE2 2.61Å; E157-A161 WeakPolarHBondContact O-CB 3.24Å; E157-A161 PolarHBondContact O-N 3.03Å; E157-H436 IonicContact OE1-CE1 3.38Å; E157-H436 PolarHBondContact OE1-CE1 3.15Å
158	V	94.2	Very high	89	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.006	11%	0.107	C	C	.	.	H	α-helix	trans	-64.7	-44.8	176.4	175.5	0	0	0	0	111.8	T154 F156 A161 V162 M214 A227 L231	T154-V158 PolarHBondContact O-N 3.31Å; F156-V158 VanDerWaalsContact C-N 3.32Å; F156-V158 PolarHBondContact O-N 2.74Å; V158-A161 PolarHBondContact O-N 3.36Å; V158-V162 WeakPolarHBondContact O-CB 3.23Å; V158-V162 WeakPolarHBondContact O-CG2 3.13Å; V158-V162 PolarHBondContact O-N 2.81Å; V158-M214 HydrophobicContact CG2-CE 4.44Å; V158-A227 HydrophobicContact CG2-CB 3.89Å; V158-L231 HydrophobicContact CG1-CB 3.94Å; V158-L231 HydrophobicContact CG1-CD1 4.26Å
159	Q	92.6	Very high	89	Confident	30 Å²	30	21.5 Å²	21.5	14%	0.14	10%	0.101	C	C	.	.	H	α-helix	trans	-64.7	-41.6	178	-76.8	175.1	6.7	0	0	112.1	R155 F156 V162 R163	R155-Q159 WeakPolarHBondContact O-CB 3.45Å; R155-Q159 WeakPolarHBondContact O-CG 3.38Å; R155-Q159 PolarHBondContact O-N 3.47Å; F156-Q159 PolarHBondContact O-N 3.26Å; Q159-V162 PolarHBondContact O-N 3.12Å; Q159-R163 WeakPolarHBondContact O-CG 3.43Å; Q159-R163 PolarHBondContact O-N 2.98Å
160	S	92.3	Very high	89.3	Confident	12 Å²	12	19.5 Å²	19.5	8%	0.084	9%	0.091	C	C	.	.	H	α-helix	trans	-63.9	-44.7	173.2	-70	0	0	0	0	111.5	F156 V162 R163 L164 H436	F156-S160 WeakPolarHBondContact O-CB 3.42Å; F156-S160 PolarHBondContact O-N 3.37Å; F156-S160 PolarHBondContact O-OG 3.33Å; S160-V162 PolarHBondContact O-N 3.42Å; S160-R163 CarbonylContact O-C 3.58Å; S160-R163 PolarHBondContact O-N 2.89Å; S160-R163 VanDerWaalsContact O-N 3.12Å; S160-L164 VanDerWaalsContact O-CG 3.28Å; S160-L164 WeakPolarHBondContact O-CG 3.09Å; S160-L164 PolarHBondContact O-N 3.11Å; S160-H436 WeakPolarHBondContact CB-ND1 3.45Å; S160-H436 PolarHBondContact OG-ND1 3.28Å
161	A	95.1	Very high	89.8	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.6	-42.1	175.6	0	0	0	0	0	112.9	V139 E142 A143 L146 E157 V158 L164 V165	V139-A161 HydrophobicContact CG1-CB 4.04Å; V139-A161 WeakPolarHBondContact O-CB 3.46Å; E142-A161 HydrophobicContact CB-CB 3.81Å; A143-A161 HydrophobicContact CB-CB 3.89Å; L146-A161 HydrophobicContact CD1-CB 4.48Å; E157-A161 WeakPolarHBondContact O-CB 3.24Å; E157-A161 PolarHBondContact O-N 3.03Å; V158-A161 PolarHBondContact O-N 3.36Å; A161-L164 PolarHBondContact O-N 3.45Å; A161-V165 WeakPolarHBondContact O-CG2 3.47Å; A161-V165 PolarHBondContact O-N 3.2Å
162	V	94.4	Very high	89.9	Confident	3 Å²	3	21.9 Å²	21.9	2%	0.018	10%	0.101	C	C	.	.	H	α-helix	trans	-61	-43.9	172.9	166.1	0	0	0	0	111	V139 V158 Q159 S160 L164 V165 H166 A171 C174 C234	V139-V162 HydrophobicContact CG1-CG2 3.79Å; V139-V162 HydrophobicContact CG2-CG2 4.29Å; V158-V162 WeakPolarHBondContact O-CB 3.23Å; V158-V162 WeakPolarHBondContact O-CG2 3.13Å; V158-V162 PolarHBondContact O-N 2.81Å; Q159-V162 PolarHBondContact O-N 3.12Å; S160-V162 PolarHBondContact O-N 3.42Å; V162-L164 VanDerWaalsContact C-N 3.32Å; V162-L164 PolarHBondContact O-N 3.29Å; V162-V165 PolarHBondContact O-N 3.08Å; V162-H166 WeakPolarHBondContact O-CB 3.32Å; V162-H166 PolarHBondContact O-CD2 2.83Å; V162-H166 PolarHBondContact O-N 2.88Å; V162-A171 HydrophobicContact CG1-CB 4.34Å; V162-C174 HydrophobicContact CG1-CB 3.83Å; V162-C234 HydrophobicContact CG2-CB 4.11Å
163	R	92.6	Very high	90.2	Very high	76 Å²	76	22.4 Å²	22.4	29%	0.287	11%	0.108	S	C	.	.	H	α-helix	trans	-67.2	-26.7	175.4	-73.3	179.9	-168.4	170.9	8.5	114.3	Q159 S160 A171 R428 T432 E435	Q159-R163 WeakPolarHBondContact O-CG 3.43Å; Q159-R163 PolarHBondContact O-N 2.98Å; S160-R163 CarbonylContact O-C 3.58Å; S160-R163 PolarHBondContact O-N 2.89Å; S160-R163 VanDerWaalsContact O-N 3.12Å; R163-A171 HydrophobicContact CB-CB 4.48Å; R163-A171 HydrophobicContact CG-CB 4.03Å; R163-R428 PolarHBondContact O-NH1 2.89Å; R163-T432 HydrophobicContact CB-CG2 3.62Å; R163-E435 IonicContact NH1-OE2 3.73Å; R163-E435 PolarHBondContact NH1-OE2 3.35Å; R163-E435 VanDerWaalsContact NH1-OE2 3.14Å
164	L	92.4	Very high	90.3	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-75.8	-40	174.6	-70.5	168.6	0	0	0	111.7	E142 L146 S160 A161 V162 L287 R428 V429 T432 Y433 L453	E142-L164 HydrophobicContact CB-CD1 4.33Å; L146-L164 HydrophobicContact CD1-CD1 4.01Å; S160-L164 VanDerWaalsContact O-CG 3.28Å; S160-L164 WeakPolarHBondContact O-CG 3.09Å; S160-L164 PolarHBondContact O-N 3.11Å; A161-L164 PolarHBondContact O-N 3.45Å; V162-L164 VanDerWaalsContact C-N 3.32Å; V162-L164 PolarHBondContact O-N 3.29Å; L164-L287 WeakPolarHBondContact O-CD2 3.49Å; L164-R428 VanDerWaalsContact C-NH1 3.27Å; L164-R428 PolarHBondContact O-NH1 3.33Å; L164-R428 PolarHBondContact O-NH2 3.44Å; L164-V429 HydrophobicContact CD2-CB 4.46Å; L164-V429 HydrophobicContact CD2-CG1 3.79Å; L164-T432 HydrophobicContact CD2-CG2 3.81Å; L164-T432 HydrophobicContact CG-CG2 3.79Å; L164-Y433 HydrophobicContact CD1-CD1 4.21Å; L164-Y433 HydrophobicContact CD1-CE1 3.55Å; L164-Y433 HydrophobicContact CD1-CE2 4.5Å; L164-Y433 HydrophobicContact CD2-CD1 4.23Å; L164-Y433 HydrophobicContact CD2-CD2 3.85Å; L164-Y433 HydrophobicContact CD2-CE1 4Å; L164-Y433 HydrophobicContact CD2-CE2 3.6Å; L164-Y433 HydrophobicContact CD2-CG 4.15Å; L164-Y433 HydrophobicContact CG-CE1 4.46Å; L164-L453 HydrophobicContact CB-CD2 4.06Å
165	V	92.1	Very high	90.3	Very high	1 Å²	1	23 Å²	23	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-87.1	-40.2	-174.5	173.3	0	0	0	0	113.5	R138 V139 E142 A161 V162 V280 L287	R138-V165 HydrophobicContact CB-CB 4.48Å; R138-V165 HydrophobicContact CB-CG1 3.66Å; R138-V165 HydrophobicContact CB-CG2 3.91Å; R138-V165 HydrophobicContact CG-CG1 4.49Å; V139-V165 HydrophobicContact CG2-CB 3.98Å; V139-V165 HydrophobicContact CG2-CG1 4.02Å; V139-V165 HydrophobicContact CG2-CG2 4.16Å; E142-V165 HydrophobicContact CB-CG2 4.48Å; E142-V165 HydrophobicContact CG-CG2 3.88Å; A161-V165 WeakPolarHBondContact O-CG2 3.47Å; A161-V165 PolarHBondContact O-N 3.2Å; V162-V165 PolarHBondContact O-N 3.08Å; V165-V280 HydrophobicContact CG1-CG1 3.98Å; V165-L287 HydrophobicContact CG1-CD1 4.43Å; V165-L287 WeakPolarHBondContact O-CD1 3.43Å
166	H	89.8	Confident	90.4	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.019	13%	0.125	C	C	.	.	S	Bend	trans	-92.9	160.1	-174.7	-67	-81.4	0	0	0	112.8	V162 L170 A171 R428	V162-H166 WeakPolarHBondContact O-CB 3.32Å; V162-H166 PolarHBondContact O-CD2 2.83Å; V162-H166 PolarHBondContact O-N 2.88Å; H166-L170 HydrophobicContact CB-CB 3.93Å; H166-A171 HydrophobicContact CB-CB 4.23Å; H166-R428 PolarHBondContact O-NH1 2.81Å; H166-R428 VanDerWaalsContact O-NH1 3.15Å
167	S	86.4	Confident	90.6	Very high	10 Å²	10	22.3 Å²	22.3	7%	0.07	12%	0.12	C	C	.	.			trans	-60.8	163.8	168.7	77.9	0	0	0	0	111.2	A169 L170 A171 E276	S167-A169 PolarHBondContact O-N 2.96Å; S167-L170 PolarHBondContact O-N 3.37Å; S167-L170 WeakPolarHBondContact OG-CB 3.4Å; S167-L170 WeakPolarHBondContact OG-CG 3.44Å; S167-L170 PolarHBondContact OG-N 3.38Å; S167-A171 VanDerWaalsContact O-CB 3.27Å; S167-A171 WeakPolarHBondContact O-CB 3.45Å; S167-A171 PolarHBondContact O-N 2.88Å; S167-E276 VanDerWaalsContact CB-OE1 3.31Å; S167-E276 WeakPolarHBondContact CB-OE1 3.46Å; S167-E276 PolarHBondContact OG-OE1 3.26Å
168	W	82.5	Confident	90.7	Very high	59 Å²	59	22.2 Å²	22.2	22%	0.223	12%	0.119	C	C	.	.	H	α-helix	trans	-53	-50.3	-180	-166.6	-74.2	0	0	0	113	A171 E172 F303 M354 R428	W168-A171 PolarHBondContact O-N 2.89Å; W168-E172 WeakPolarHBondContact O-CB 3.15Å; W168-E172 PolarHBondContact O-N 3.17Å; W168-F303 HydrophobicContact CB-CE2 4.3Å; W168-F303 HydrophobicContact CD2-CE2 4.13Å; W168-F303 HydrophobicContact CD2-CZ 4.28Å; W168-F303 HydrophobicContact CE3-CE2 4.41Å; W168-F303 HydrophobicContact CE3-CZ 4.48Å; W168-F303 HydrophobicContact CG-CE2 4.07Å; W168-M354 HydrophobicContact CE3-CE 4.35Å; W168-M354 HydrophobicContact CH2-CE 3.81Å; W168-M354 HydrophobicContact CZ3-CE 3.51Å; W168-R428 HydrophobicContact CE3-CG 4.43Å
169	A	83.6	Confident	90.6	Very high	27 Å²	27	25 Å²	25	22%	0.223	14%	0.136	C	C	.	.	H	α-helix	trans	-69.3	-41	-177.2	0	0	0	0	0	112.5	S167 E172 S173	S167-A169 PolarHBondContact O-N 2.96Å; A169-E172 PolarHBondContact O-N 2.95Å; A169-S173 WeakPolarHBondContact O-CB 3.47Å; A169-S173 PolarHBondContact O-N 3.08Å
170	L	88.2	Confident	90.6	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-63.5	-42.6	175.3	-71.6	179.5	0	0	0	111.6	H166 S167 C174 E241 E276 L277	H166-L170 HydrophobicContact CB-CB 3.93Å; S167-L170 PolarHBondContact O-N 3.37Å; S167-L170 WeakPolarHBondContact OG-CB 3.4Å; S167-L170 WeakPolarHBondContact OG-CG 3.44Å; S167-L170 PolarHBondContact OG-N 3.38Å; L170-C174 VanDerWaalsContact O-CB 3.3Å; L170-C174 WeakPolarHBondContact O-CB 3.43Å; L170-C174 PolarHBondContact O-N 3.29Å; L170-C174 PolarHBondContact O-SG 2.87Å; L170-E241 HydrophobicContact CD2-CG 3.61Å; L170-E276 HydrophobicContact CD1-CB 3.78Å; L170-E276 HydrophobicContact CG-CB 4.29Å; L170-L277 HydrophobicContact CD1-CD2 3.96Å; L170-L277 HydrophobicContact CD2-CD2 4.46Å
171	A	89.9	Confident	90.7	Very high	5 Å²	5	30 Å²	30	4%	0.041	16%	0.156	C	C	.	.	H	α-helix	trans	-67.5	-39.4	179.3	0	0	0	0	0	112.5	V162 R163 H166 S167 W168 C174 A175	V162-A171 HydrophobicContact CG1-CB 4.34Å; R163-A171 HydrophobicContact CB-CB 4.48Å; R163-A171 HydrophobicContact CG-CB 4.03Å; H166-A171 HydrophobicContact CB-CB 4.23Å; S167-A171 VanDerWaalsContact O-CB 3.27Å; S167-A171 WeakPolarHBondContact O-CB 3.45Å; S167-A171 PolarHBondContact O-N 2.88Å; W168-A171 PolarHBondContact O-N 2.89Å; A171-C174 PolarHBondContact O-N 3.06Å; A171-A175 WeakPolarHBondContact O-CB 3.47Å; A171-A175 PolarHBondContact O-N 3.01Å
172	E	87.3	Confident	90.4	Very high	70 Å²	70	30.4 Å²	30.4	33%	0.327	16%	0.159	S	C	.	.	H	α-helix	trans	-64.7	-47	174.7	-174.2	170.8	-166.4	0	0	111.5	W168 A169 C174 A175 L176	W168-E172 WeakPolarHBondContact O-CB 3.15Å; W168-E172 PolarHBondContact O-N 3.17Å; A169-E172 PolarHBondContact O-N 2.95Å; E172-C174 PolarHBondContact O-N 3.42Å; E172-A175 PolarHBondContact O-N 3.38Å; E172-L176 WeakPolarHBondContact O-CG 3.41Å; E172-L176 PolarHBondContact O-N 3.05Å
173	S	90.9	Very high	90.2	Very high	33 Å²	33	32.9 Å²	32.9	23%	0.231	18%	0.176	C	C	.	.	H	α-helix	trans	-56.7	-48	174	-179.5	0	0	0	0	111.8	A169 A175 L176 A177 N237	A169-S173 WeakPolarHBondContact O-CB 3.47Å; A169-S173 PolarHBondContact O-N 3.08Å; S173-A175 VanDerWaalsContact C-N 3.35Å; S173-A175 PolarHBondContact O-N 3.48Å; S173-L176 PolarHBondContact O-N 3.45Å; S173-A177 PolarHBondContact O-N 3.23Å; S173-N237 PolarHBondContact OG-ND2 3.22Å
174	C	92.9	Very high	90.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-35.2	177.5	-70.1	0	0	0	0	113.1	V162 L170 A171 E172 A177 A178 C234 N237	V162-C174 HydrophobicContact CG1-CB 3.83Å; L170-C174 VanDerWaalsContact O-CB 3.3Å; L170-C174 WeakPolarHBondContact O-CB 3.43Å; L170-C174 PolarHBondContact O-N 3.29Å; L170-C174 PolarHBondContact O-SG 2.87Å; A171-C174 PolarHBondContact O-N 3.06Å; E172-C174 PolarHBondContact O-N 3.42Å; C174-A177 PolarHBondContact O-N 3.23Å; C174-A178 WeakPolarHBondContact O-CB 3.12Å; C174-A178 PolarHBondContact O-N 3.1Å; C174-C234 HydrophobicContact CB-CB 3.93Å; C174-C234 PolarHBondContact O-SG 3.35Å; C174-C234 VanDerWaalsContact O-SG 3.36Å; C174-N237 PolarHBondContact N-ND2 3.48Å; C174-N237 PolarHBondContact SG-ND2 3.3Å
175	A	89.7	Confident	89.8	Confident	19 Å²	19	32.7 Å²	32.7	16%	0.157	18%	0.18	C	C	.	.	H	α-helix	trans	-68.2	-41.5	176	0	0	0	0	0	111.8	A171 E172 S173 A178 V179	A171-A175 WeakPolarHBondContact O-CB 3.47Å; A171-A175 PolarHBondContact O-N 3.01Å; E172-A175 PolarHBondContact O-N 3.38Å; S173-A175 VanDerWaalsContact C-N 3.35Å; S173-A175 PolarHBondContact O-N 3.48Å; A175-A178 PolarHBondContact O-N 3.24Å; A175-V179 WeakPolarHBondContact O-CG2 3.34Å; A175-V179 PolarHBondContact O-N 3.11Å
176	L	91.8	Very high	89.4	Confident	93 Å²	93	34.1 Å²	34.1	49%	0.487	19%	0.19	S	C	.	.	H	α-helix	trans	-62.7	-41.9	174.3	-69.8	171.3	0	0	0	111.7	E172 S173 V179 K180 P362	E172-L176 WeakPolarHBondContact O-CG 3.41Å; E172-L176 PolarHBondContact O-N 3.05Å; S173-L176 PolarHBondContact O-N 3.45Å; L176-V179 PolarHBondContact O-N 2.97Å; L176-K180 WeakPolarHBondContact O-CB 3.47Å; L176-K180 PolarHBondContact O-N 3.39Å; L176-P362 HydrophobicContact CD2-CG 4.23Å
177	A	93.1	Very high	89.1	Confident	21 Å²	21	41 Å²	41	17%	0.174	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-43.1	174.7	0	0	0	0	0	112.4	S173 C174 K180 A181 N237	S173-A177 PolarHBondContact O-N 3.23Å; C174-A177 PolarHBondContact O-N 3.23Å; A177-K180 PolarHBondContact O-N 3.33Å; A177-A181 PolarHBondContact O-N 3.3Å; A177-N237 HydrophobicContact CB-CB 3.67Å
178	A	93.4	Very high	88.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.8	-43.5	175.5	0	0	0	0	0	112.5	C174 A175 K180 A181 L182 A233	C174-A178 WeakPolarHBondContact O-CB 3.12Å; C174-A178 PolarHBondContact O-N 3.1Å; A175-A178 PolarHBondContact O-N 3.24Å; A178-K180 VanDerWaalsContact C-N 3.32Å; A178-K180 PolarHBondContact O-N 2.84Å; A178-A181 PolarHBondContact O-N 3.36Å; A178-L182 WeakPolarHBondContact O-CB 3.5Å; A178-L182 VanDerWaalsContact O-CG 3.32Å; A178-L182 WeakPolarHBondContact O-CG 3.19Å; A178-L182 PolarHBondContact O-N 3.21Å; A178-A233 HydrophobicContact CB-CB 4.4Å
179	V	91.9	Very high	87.7	Confident	59 Å²	59	41.6 Å²	41.6	36%	0.358	24%	0.241	S	C	.	.	H	α-helix	trans	-61.6	-40.3	175.5	170.1	0	0	0	0	111.4	A175 L176 S183	A175-V179 WeakPolarHBondContact O-CG2 3.34Å; A175-V179 PolarHBondContact O-N 3.11Å; L176-V179 PolarHBondContact O-N 2.97Å; V179-S183 WeakPolarHBondContact O-CB 3.4Å; V179-S183 PolarHBondContact O-N 3.31Å; V179-S183 PolarHBondContact O-OG 3.02Å
180	K	92.8	Very high	86.5	Confident	143 Å²	143	44.1 Å²	44.1	62%	0.622	27%	0.269	S	S	*	.	H	α-helix	trans	-63.5	-45.1	174.9	-179.6	-175	174.2	-171.6	0	112.4	L176 A177 A178 S183 L184	L176-K180 WeakPolarHBondContact O-CB 3.47Å; L176-K180 PolarHBondContact O-N 3.39Å; A177-K180 PolarHBondContact O-N 3.33Å; A178-K180 VanDerWaalsContact C-N 3.32Å; A178-K180 PolarHBondContact O-N 2.84Å; K180-S183 PolarHBondContact O-N 3.42Å; K180-S183 PolarHBondContact O-OG 2.84Å; K180-L184 HydrophobicContact CG-CD1 4.41Å; K180-L184 WeakPolarHBondContact O-CG 3.4Å; K180-L184 PolarHBondContact O-N 3.41Å; K180-L184 VanDerWaalsContact O-N 3.15Å
181	A	92.8	Very high	85.2	Confident	3 Å²	3	46.8 Å²	46.8	3%	0.025	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-43.4	178.3	0	0	0	0	0	111.9	A177 A178 L184 Y185 C201 L203 I229 A233	A177-A181 PolarHBondContact O-N 3.3Å; A178-A181 PolarHBondContact O-N 3.36Å; A181-L184 PolarHBondContact O-N 2.98Å; A181-Y185 PolarHBondContact O-N 2.92Å; A181-Y185 VanDerWaalsContact O-N 3.08Å; A181-C201 HydrophobicContact CB-CB 4.31Å; A181-L203 HydrophobicContact CB-CD1 4.14Å; A181-L203 HydrophobicContact CB-CD2 4.31Å; A181-L203 HydrophobicContact CB-CG 4.33Å; A181-I229 HydrophobicContact CB-CG2 3.94Å; A181-A233 HydrophobicContact CB-CB 3.81Å
182	L	90.3	Very high	83.8	Confident	10 Å²	10	47.5 Å²	47.5	5%	0.052	29%	0.291	C	S	.	.	H	α-helix	trans	-65.1	-40.2	176.3	-69.8	170.9	0	0	0	112.3	A178 L184 Y185 S186 Y226 I229	A178-L182 WeakPolarHBondContact O-CB 3.5Å; A178-L182 VanDerWaalsContact O-CG 3.32Å; A178-L182 WeakPolarHBondContact O-CG 3.19Å; A178-L182 PolarHBondContact O-N 3.21Å; L182-L184 PolarHBondContact O-N 3.1Å; L182-Y185 WeakPolarHBondContact O-CB 3.42Å; L182-Y185 PolarHBondContact O-N 3.12Å; L182-S186 PolarHBondContact O-N 3.17Å; L182-S186 PolarHBondContact O-OG 3.5Å; L182-Y226 HydrophobicContact CD2-CD1 3.71Å; L182-Y226 HydrophobicContact CD2-CD2 4.46Å; L182-Y226 HydrophobicContact CD2-CE1 4.46Å; L182-Y226 HydrophobicContact CD2-CG 3.74Å; L182-I229 HydrophobicContact CD2-CB 4.04Å; L182-I229 HydrophobicContact CD2-CD1 4.29Å; L182-I229 HydrophobicContact CD2-CG2 3.78Å; L182-I229 HydrophobicContact CG-CG2 4.18Å
183	S	89.9	Confident	82.9	Confident	54 Å²	54	46.7 Å²	46.7	38%	0.378	29%	0.289	S	S	.	.	H	α-helix	trans	-67	-37.7	179.2	69.2	0	0	0	0	112.6	V179 K180 M187	V179-S183 WeakPolarHBondContact O-CB 3.4Å; V179-S183 PolarHBondContact O-N 3.31Å; V179-S183 PolarHBondContact O-OG 3.02Å; K180-S183 PolarHBondContact O-N 3.42Å; K180-S183 PolarHBondContact O-OG 2.84Å; S183-M187 WeakPolarHBondContact O-CG 3.49Å; S183-M187 PolarHBondContact O-N 2.84Å
184	L	89.6	Confident	82.1	Confident	62 Å²	62	53 Å²	53	33%	0.325	31%	0.308	S	S	.	.	H	α-helix	trans	-62.2	-43.2	171.2	-69.4	170	0	0	0	111.5	K180 A181 L182 M187 S188 R200 C201	K180-L184 HydrophobicContact CG-CD1 4.41Å; K180-L184 WeakPolarHBondContact O-CG 3.4Å; K180-L184 PolarHBondContact O-N 3.41Å; K180-L184 VanDerWaalsContact O-N 3.15Å; A181-L184 PolarHBondContact O-N 2.98Å; L182-L184 PolarHBondContact O-N 3.1Å; L184-M187 HydrophobicContact CD2-CE 3.93Å; L184-M187 PolarHBondContact O-N 3.25Å; L184-S188 WeakPolarHBondContact O-CB 3.34Å; L184-S188 PolarHBondContact O-N 3.38Å; L184-S188 VanDerWaalsContact O-N 3.09Å; L184-R200 CarbonylContact C-O 3.42Å; L184-C201 WeakPolarHBondContact CD1-O 3.45Å
185	Y	87.6	Confident	81.6	Confident	11 Å²	11	57.8 Å²	57.8	4%	0.043	33%	0.326	C	S	.	.	H	α-helix	trans	-60	-48.2	177.2	-173.6	-102.2	0	0	0	112.9	A181 L182 S188 K197 R200 E225 Y226 I229	A181-Y185 PolarHBondContact O-N 2.92Å; A181-Y185 VanDerWaalsContact O-N 3.08Å; L182-Y185 WeakPolarHBondContact O-CB 3.42Å; L182-Y185 PolarHBondContact O-N 3.12Å; Y185-S188 CarbonylContact O-C 3.47Å; Y185-S188 PolarHBondContact O-N 3.24Å; Y185-S188 VanDerWaalsContact O-N 3.11Å; Y185-K197 HydrophobicContact CE2-CB 4.46Å; Y185-K197 HydrophobicContact CE2-CG 4.26Å; Y185-R200 HydrophobicContact CD2-CB 3.99Å; Y185-R200 HydrophobicContact CE2-CB 4.46Å; Y185-R200 PolarHBondContact O-NH2 3.17Å; Y185-R200 PolarHBondContact OH-NH1 3.31Å; Y185-R200 VanDerWaalsContact OH-NH1 3.16Å; Y185-E225 WeakPolarHBondContact CE1-OE1 3.42Å; Y185-E225 PolarHBondContact OH-OE1 2.91Å; Y185-E225 PolarHBondContact OH-OE2 3.23Å; Y185-Y226 AromaticContact CD1-CE1 3.92Å; Y185-Y226 HydrophobicContact CD1-CE1 3.92Å; Y185-Y226 AromaticContact CE1-CE1 3.89Å; Y185-Y226 HydrophobicContact CE1-CE1 3.89Å; Y185-I229 HydrophobicContact CD1-CD1 4.03Å; Y185-I229 HydrophobicContact CD2-CD1 3.94Å; Y185-I229 HydrophobicContact CE1-CD1 4.29Å; Y185-I229 HydrophobicContact CE2-CD1 4.2Å; Y185-I229 HydrophobicContact CG-CD1 3.85Å
186	S	83.8	Confident	81.3	Confident	31 Å²	31	57.2 Å²	57.2	22%	0.217	32%	0.321	C	S	.	.	H	α-helix	trans	-66	-35.6	178	-60.5	0	0	0	0	112.7	L182 S188 S646	L182-S186 PolarHBondContact O-N 3.17Å; L182-S186 PolarHBondContact O-OG 3.5Å; S186-S188 PolarHBondContact O-N 3.36Å; S186-S646 PolarHBondContact OG-O 3.28Å
187	M	82.1	Confident	81.1	Confident	149 Å²	149	52.8 Å²	52.8	73%	0.734	30%	0.298	S	S	*	.	H	α-helix	trans	-69	-21.6	172.8	-71.9	-169.8	-58.7	0	0	113	S183 L184	S183-M187 WeakPolarHBondContact O-CG 3.49Å; S183-M187 PolarHBondContact O-N 2.84Å; L184-M187 HydrophobicContact CD2-CE 3.93Å; L184-M187 PolarHBondContact O-N 3.25Å
188	S	77.4	Confident	80.9	Confident	17 Å²	17	52.8 Å²	52.8	12%	0.119	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	21.3	-179.5	-169.9	0	0	0	0	113.1	L184 Y185 S186 G190 D191 R200	L184-S188 WeakPolarHBondContact O-CB 3.34Å; L184-S188 PolarHBondContact O-N 3.38Å; L184-S188 VanDerWaalsContact O-N 3.09Å; Y185-S188 CarbonylContact O-C 3.47Å; Y185-S188 PolarHBondContact O-N 3.24Å; Y185-S188 VanDerWaalsContact O-N 3.11Å; S186-S188 PolarHBondContact O-N 3.36Å; S188-G190 VanDerWaalsContact C-N 3.34Å; S188-G190 PolarHBondContact O-N 3.23Å; S188-D191 PolarHBondContact O-N 3.41Å; S188-R200 PolarHBondContact O-NE 3.28Å; S188-R200 VanDerWaalsContact O-NE 3.08Å; S188-R200 PolarHBondContact O-NH2 3.45Å; S188-R200 WeakPolarHBondContact OG-CG 3.28Å
189	A	62	Low	80.6	Confident	64 Å²	64	54.9 Å²	54.9	53%	0.529	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-57.7	-40.3	-178.1	0	0	0	0	0	113.6	D191 G192	A189-D191 PolarHBondContact O-N 2.74Å; A189-G192 PolarHBondContact O-N 3.18Å
190	G	58.7	Low	80.4	Confident	80 Å²	80	52.9 Å²	52.9	83%	0.825	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-67.4	-14.9	-180	0	0	0	0	0	115.7	S188	S188-G190 VanDerWaalsContact C-N 3.34Å; S188-G190 PolarHBondContact O-N 3.23Å
191	D	61.4	Low	80.2	Confident	59 Å²	59	46.2 Å²	46.2	32%	0.316	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-95	7.2	177.4	-88	-23.9	0	0	0	112.9	S188 A189 L193 R194	S188-D191 PolarHBondContact O-N 3.41Å; A189-D191 PolarHBondContact O-N 2.74Å; D191-L193 VanDerWaalsContact C-N 3.31Å; D191-L193 PolarHBondContact O-N 3.19Å; D191-R194 PolarHBondContact O-N 3.08Å
192	G	61.3	Low	80.1	Confident	19 Å²	19	48.1 Å²	48.1	20%	0.196	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.5	-38.6	-160.7	0	0	0	0	0	117.1	A189 Y722	A189-G192 PolarHBondContact O-N 3.18Å; G192-Y722 WeakPolarHBondContact O-CE2 3.47Å; G192-Y722 PolarHBondContact O-OH 3.24Å; G192-Y722 VanDerWaalsContact O-OH 3.14Å
193	L	67.9	Low	80.2	Confident	53 Å²	53	48.9 Å²	48.9	28%	0.277	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	0.3	-179.3	-58.9	175.3	0	0	0	114.1	D191 Q718 Y722	D191-L193 VanDerWaalsContact C-N 3.31Å; D191-L193 PolarHBondContact O-N 3.19Å; L193-Q718 HydrophobicContact CD1-CG 4.44Å; L193-Y722 HydrophobicContact CD2-CD1 4.25Å; L193-Y722 HydrophobicContact CD2-CD2 4.08Å; L193-Y722 HydrophobicContact CD2-CG 3.73Å
194	R	74.7	Confident	80.2	Confident	167 Å²	167	48.2 Å²	48.2	63%	0.63	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-12.1	-173.4	-67.1	-178	172.5	-170.6	-4.3	114.1	D191 N780	D191-R194 PolarHBondContact O-N 3.08Å; R194-N780 PolarHBondContact O-ND2 3.3Å
195	R	80.5	Confident	80.4	Confident	100 Å²	100	45.3 Å²	45.3	38%	0.377	27%	0.274	S	S	.	.	S	Bend	trans	-148.6	148.7	-176.3	-57	-178.5	73.2	-172.4	2.9	111	R200 Y722	R195-R200 HydrophobicContact CB-CG 4.15Å; R195-Y722 PolarHBondContact O-OH 3Å
196	G	84.1	Confident	80.6	Confident	6 Å²	6	45.8 Å²	45.8	6%	0.062	28%	0.279	C	S	.	.			trans	-67.2	152.9	175.3	0	0	0	0	0	113.8	S198 A199 R200 H746	G196-S198 VanDerWaalsContact C-N 3.29Å; G196-S198 PolarHBondContact O-N 3.35Å; G196-A199 PolarHBondContact O-N 2.66Å; G196-A199 VanDerWaalsContact O-N 3.1Å; G196-R200 PolarHBondContact O-N 3.2Å; G196-R200 VanDerWaalsContact O-N 3.1Å; G196-H746 WeakPolarHBondContact CA-CE1 3.37Å; G196-H746 WeakPolarHBondContact CA-NE2 3.3Å; G196-H746 PolarHBondContact N-CE1 2.97Å; G196-H746 PolarHBondContact N-ND1 3.36Å
197	K	87.3	Confident	81.1	Confident	1 Å²	1	44.4 Å²	44.4	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-56.4	-41.1	-177	-67	-176.6	-178.7	-165.1	0	112.1	Y185 A199 R200 C201 V207 E225 Y722 Y723 E726 H727	Y185-K197 HydrophobicContact CE2-CB 4.46Å; Y185-K197 HydrophobicContact CE2-CG 4.26Å; K197-A199 PolarHBondContact O-N 2.88Å; K197-R200 PolarHBondContact O-N 3.37Å; K197-C201 PolarHBondContact O-N 3.37Å; K197-C201 PolarHBondContact O-SG 3.47Å; K197-V207 HydrophobicContact CB-CB 4.11Å; K197-V207 HydrophobicContact CB-CG1 4.15Å; K197-V207 HydrophobicContact CD-CG1 4.31Å; K197-E225 WeakPolarHBondContact CE-OE2 3.43Å; K197-E225 IonicContact NZ-OE2 2.81Å; K197-E225 PolarHBondContact NZ-OE2 2.8Å; K197-Y722 HydrophobicContact CG-CE1 4.44Å; K197-Y723 VanDerWaalsContact NZ-CD1 3.31Å; K197-Y723 VanDerWaalsContact NZ-CE1 3.31Å; K197-E726 VanDerWaalsContact CB-OE2 3.3Å; K197-E726 WeakPolarHBondContact CB-OE2 3.35Å; K197-E726 VanDerWaalsContact CG-OE2 3.3Å; K197-E726 WeakPolarHBondContact CG-OE2 3.46Å; K197-E726 PolarHBondContact N-OE2 3.22Å; K197-H727 PolarHBondContact NZ-NE2 3.35Å
198	S	90	Very high	81.6	Confident	20 Å²	20	37.3 Å²	37.3	14%	0.14	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-44.5	176.4	-70.3	0	0	0	0	113.1	G196 R200 C201 G202 L203 F205 S206 V207	G196-S198 VanDerWaalsContact C-N 3.29Å; G196-S198 PolarHBondContact O-N 3.35Å; S198-R200 VanDerWaalsContact C-N 3.34Å; S198-R200 PolarHBondContact O-N 3.03Å; S198-C201 CarbonylContact O-C 3.58Å; S198-C201 PolarHBondContact O-N 3.14Å; S198-G202 PolarHBondContact O-N 3.14Å; S198-L203 PolarHBondContact O-N 2.99Å; S198-F205 WeakPolarHBondContact CB-O 3.36Å; S198-F205 PolarHBondContact OG-O 3.38Å; S198-S206 VanDerWaalsContact OG-CA 3.27Å; S198-S206 WeakPolarHBondContact OG-CA 3.33Å; S198-V207 PolarHBondContact OG-N 3.08Å
199	A	87.3	Confident	82.3	Confident	44 Å²	44	40.4 Å²	40.4	36%	0.364	24%	0.243	S	C	.	.	H	α-helix	trans	-65.7	-38.6	178.5	0	0	0	0	0	111.5	G196 K197 C201 G202	G196-A199 PolarHBondContact O-N 2.66Å; G196-A199 VanDerWaalsContact O-N 3.1Å; K197-A199 PolarHBondContact O-N 2.88Å; A199-C201 VanDerWaalsContact C-N 3.3Å; A199-C201 PolarHBondContact O-N 3.01Å; A199-G202 PolarHBondContact O-N 3.2Å
200	R	87.8	Confident	83.9	Confident	18 Å²	18	37.4 Å²	37.4	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-31.9	173.5	-64.4	177.6	58.4	-143.2	-14.5	112.6	L184 Y185 S188 R195 G196 K197 S198	L184-R200 CarbonylContact C-O 3.42Å; Y185-R200 HydrophobicContact CD2-CB 3.99Å; Y185-R200 HydrophobicContact CE2-CB 4.46Å; Y185-R200 PolarHBondContact O-NH2 3.17Å; Y185-R200 PolarHBondContact OH-NH1 3.31Å; Y185-R200 VanDerWaalsContact OH-NH1 3.16Å; S188-R200 PolarHBondContact O-NE 3.28Å; S188-R200 VanDerWaalsContact O-NE 3.08Å; S188-R200 PolarHBondContact O-NH2 3.45Å; S188-R200 WeakPolarHBondContact OG-CG 3.28Å; R195-R200 HydrophobicContact CB-CG 4.15Å; G196-R200 PolarHBondContact O-N 3.2Å; G196-R200 VanDerWaalsContact O-N 3.1Å; K197-R200 PolarHBondContact O-N 3.37Å; S198-R200 VanDerWaalsContact C-N 3.34Å; S198-R200 PolarHBondContact O-N 3.03Å
201	C	88.6	Confident	85.6	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.014	18%	0.179	C	C	.	.	H	α-helix	trans	-86.1	-10.6	176.3	-60.9	0	0	0	0	114.7	A181 L184 K197 S198 A199 L203	A181-C201 HydrophobicContact CB-CB 4.31Å; L184-C201 WeakPolarHBondContact CD1-O 3.45Å; K197-C201 PolarHBondContact O-N 3.37Å; K197-C201 PolarHBondContact O-SG 3.47Å; S198-C201 CarbonylContact O-C 3.58Å; S198-C201 PolarHBondContact O-N 3.14Å; A199-C201 VanDerWaalsContact C-N 3.3Å; A199-C201 PolarHBondContact O-N 3.01Å; C201-L203 VanDerWaalsContact C-N 3.25Å; C201-L203 HydrophobicContact CB-CB 4.31Å; C201-L203 HydrophobicContact CB-CD1 3.71Å; C201-L203 HydrophobicContact CB-CG 3.72Å; C201-L203 PolarHBondContact O-N 2.92Å
202	G	89.3	Confident	87.1	Confident	44 Å²	44	34 Å²	34	45%	0.454	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	18.5	-170.1	0	0	0	0	0	114.8	K110 S198 A199	K110-G202 PolarHBondContact NZ-O 3.33Å; S198-G202 PolarHBondContact O-N 3.14Å; A199-G202 PolarHBondContact O-N 3.2Å
203	L	92.1	Very high	88.6	Confident	25 Å²	25	33.8 Å²	33.8	13%	0.131	17%	0.169	C	C	.	.			trans	-91.1	147.9	-178.5	-64.5	174.1	0	0	0	111.2	A181 S198 C201 V207 I229 T232 A233	A181-L203 HydrophobicContact CB-CD1 4.14Å; A181-L203 HydrophobicContact CB-CD2 4.31Å; A181-L203 HydrophobicContact CB-CG 4.33Å; S198-L203 PolarHBondContact O-N 2.99Å; C201-L203 VanDerWaalsContact C-N 3.25Å; C201-L203 HydrophobicContact CB-CB 4.31Å; C201-L203 HydrophobicContact CB-CD1 3.71Å; C201-L203 HydrophobicContact CB-CG 3.72Å; C201-L203 PolarHBondContact O-N 2.92Å; L203-V207 HydrophobicContact CD1-CG2 3.87Å; L203-I229 HydrophobicContact CD1-CG2 4.49Å; L203-T232 HydrophobicContact CD1-CG2 3.9Å; L203-A233 HydrophobicContact CD1-CB 4.24Å; L203-A233 HydrophobicContact CD2-CB 4.01Å
204	T	91.4	Very high	89.8	Confident	40 Å²	40	31.3 Å²	31.3	25%	0.245	16%	0.156	C	C	.	.	S	Bend	trans	-94.5	-31.1	178.4	-58.6	0	0	0	0	111.7	R106 V107 K110 E236	R106-T204 HydrophobicContact CB-CG2 3.63Å; V107-T204 HydrophobicContact CG2-CG2 3.9Å; K110-T204 WeakPolarHBondContact CD-OG1 3.46Å; K110-T204 PolarHBondContact NZ-OG1 3.32Å; T204-E236 WeakPolarHBondContact CA-OE2 3.24Å; T204-E236 PolarHBondContact N-OE1 2.81Å; T204-E236 VanDerWaalsContact N-OE1 3.12Å; T204-E236 PolarHBondContact N-OE2 3.33Å; T204-E236 PolarHBondContact OG1-OE1 2.82Å
205	F	93.7	Very high	90.5	Very high	1 Å²	1	24.2 Å²	24.2	0%	0.004	13%	0.132	C	C	.	.	S	Bend	trans	-73	148.5	167.7	-70.1	-27.3	0	0	0	111.9	W99 D103 V104 V107 S198 V207 F210 T232 M235 E236 V239	W99-F205 HydrophobicContact CB-CD1 4.29Å; W99-F205 HydrophobicContact CB-CE1 4.1Å; D103-F205 HydrophobicContact CB-CD1 3.89Å; D103-F205 HydrophobicContact CB-CE1 3.87Å; V104-F205 HydrophobicContact CG2-CE1 4.18Å; V104-F205 HydrophobicContact CG2-CZ 4.16Å; V107-F205 HydrophobicContact CG2-CD1 4.03Å; V107-F205 HydrophobicContact CG2-CE1 3.69Å; V107-F205 HydrophobicContact CG2-CE2 4.41Å; V107-F205 HydrophobicContact CG2-CZ 3.9Å; S198-F205 WeakPolarHBondContact CB-O 3.36Å; S198-F205 PolarHBondContact OG-O 3.38Å; F205-V207 PolarHBondContact O-N 3.17Å; F205-F210 HydrophobicContact CB-CD2 4.5Å; F205-F210 HydrophobicContact CB-CE2 3.96Å; F205-F210 HydrophobicContact CD2-CE2 4.14Å; F205-F210 HydrophobicContact CD2-CZ 4.38Å; F205-F210 HydrophobicContact CG-CE2 4.21Å; F205-T232 HydrophobicContact CB-CG2 3.51Å; F205-M235 HydrophobicContact CE2-CB 4.42Å; F205-E236 HydrophobicContact CD2-CB 3.84Å; F205-E236 HydrophobicContact CD2-CG 4.34Å; F205-E236 HydrophobicContact CE2-CB 4.13Å; F205-E236 PolarHBondContact N-OE2 2.68Å; F205-V239 HydrophobicContact CZ-CG2 4.34Å
206	S	91.8	Very high	90.9	Very high	22 Å²	22	21.9 Å²	21.9	15%	0.154	13%	0.126	C	C	.	.			trans	-79.7	107.9	-179.2	171.5	0	0	0	0	110.7	S198 G208 R209 F210	S198-S206 VanDerWaalsContact OG-CA 3.27Å; S198-S206 WeakPolarHBondContact OG-CA 3.33Å; S206-G208 PolarHBondContact O-N 2.95Å; S206-R209 PolarHBondContact O-N 2.94Å; S206-R209 PolarHBondContact OG-N 2.77Å; S206-R209 VanDerWaalsContact OG-N 3.16Å; S206-F210 WeakPolarHBondContact O-CD2 3.46Å; S206-F210 PolarHBondContact O-N 3.17Å
207	V	94.3	Very high	91.1	Very high	1 Å²	1	22 Å²	22	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-58.8	-38.5	176.3	172.9	0	0	0	0	110.3	K197 S198 L203 F205 F210 F211 A228 I229 T232	K197-V207 HydrophobicContact CB-CB 4.11Å; K197-V207 HydrophobicContact CB-CG1 4.15Å; K197-V207 HydrophobicContact CD-CG1 4.31Å; S198-V207 PolarHBondContact OG-N 3.08Å; L203-V207 HydrophobicContact CD1-CG2 3.87Å; F205-V207 PolarHBondContact O-N 3.17Å; V207-F210 PolarHBondContact O-N 2.84Å; V207-F211 PolarHBondContact O-N 3.06Å; V207-A228 HydrophobicContact CG1-CB 4.27Å; V207-I229 HydrophobicContact CG1-CG1 3.63Å; V207-I229 HydrophobicContact CG2-CG1 4.3Å; V207-T232 HydrophobicContact CG2-CG2 4.07Å
208	G	91.7	Very high	91.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-41.7	176.5	0	0	0	0	0	113.9	S206 F211 R212 E726	S206-G208 PolarHBondContact O-N 2.95Å; G208-F211 PolarHBondContact O-N 3.49Å; G208-R212 WeakPolarHBondContact O-CB 3.32Å; G208-R212 PolarHBondContact O-N 2.89Å; G208-E726 VanDerWaalsContact CA-O 3.25Å; G208-E726 WeakPolarHBondContact CA-O 3.29Å
209	R	92.8	Very high	91	Very high	83 Å²	83	27.5 Å²	27.5	31%	0.313	14%	0.144	S	C	.	.	H	α-helix	trans	-65.4	-38.4	171.5	-78.9	-171.7	-76.8	155.9	-3.8	112.5	P98 D103 S206 W213	P98-R209 HydrophobicContact CB-CB 4.16Å; P98-R209 WeakPolarHBondContact O-CB 3.49Å; P98-R209 VanDerWaalsContact O-CZ 3.32Å; P98-R209 PolarHBondContact O-NE 3.31Å; P98-R209 PolarHBondContact O-NH1 2.7Å; P98-R209 VanDerWaalsContact O-NH1 3.07Å; D103-R209 VanDerWaalsContact CG-NH2 3.29Å; D103-R209 IonicContact OD1-NH2 2.94Å; D103-R209 PolarHBondContact OD1-NH2 2.75Å; D103-R209 IonicContact OD2-CZ 3.95Å; D103-R209 IonicContact OD2-NH1 3.98Å; D103-R209 PolarHBondContact OD2-NH1 3.21Å; D103-R209 IonicContact OD2-NH2 3.27Å; D103-R209 PolarHBondContact OD2-NH2 2.95Å; S206-R209 PolarHBondContact O-N 2.94Å; S206-R209 PolarHBondContact OG-N 2.77Å; S206-R209 VanDerWaalsContact OG-N 3.16Å; R209-W213 VanDerWaalsContact O-CB 3.25Å; R209-W213 WeakPolarHBondContact O-CB 3.21Å; R209-W213 PolarHBondContact O-N 2.88Å
210	F	95	Very high	91.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.5	-49.7	172.9	-93	-96.3	0	0	0	111.2	P98 W99 L136 F205 S206 V207 R212 W213 M214 L231 T232 M235	P98-F210 HydrophobicContact CB-CB 4.42Å; P98-F210 HydrophobicContact CB-CD1 4.34Å; P98-F210 HydrophobicContact CB-CD2 3.65Å; P98-F210 HydrophobicContact CB-CE2 3.95Å; P98-F210 HydrophobicContact CB-CG 3.88Å; P98-F210 HydrophobicContact CB-CZ 4.44Å; P98-F210 HydrophobicContact CG-CD1 3.84Å; P98-F210 HydrophobicContact CG-CD2 3.82Å; P98-F210 HydrophobicContact CG-CE1 3.76Å; P98-F210 HydrophobicContact CG-CE2 3.73Å; P98-F210 HydrophobicContact CG-CG 3.89Å; P98-F210 HydrophobicContact CG-CZ 3.72Å; W99-F210 HydrophobicContact CE3-CE2 4.07Å; W99-F210 AromaticContact CE3-CZ 3.64Å; W99-F210 HydrophobicContact CE3-CZ 3.64Å; W99-F210 HydrophobicContact CZ3-CE1 4.29Å; W99-F210 AromaticContact CZ3-CZ 3.72Å; W99-F210 HydrophobicContact CZ3-CZ 3.72Å; L136-F210 HydrophobicContact CD1-CE1 4Å; F205-F210 HydrophobicContact CB-CD2 4.5Å; F205-F210 HydrophobicContact CB-CE2 3.96Å; F205-F210 HydrophobicContact CD2-CE2 4.14Å; F205-F210 HydrophobicContact CD2-CZ 4.38Å; F205-F210 HydrophobicContact CG-CE2 4.21Å; S206-F210 WeakPolarHBondContact O-CD2 3.46Å; S206-F210 PolarHBondContact O-N 3.17Å; V207-F210 PolarHBondContact O-N 2.84Å; F210-R212 VanDerWaalsContact C-N 3.34Å; F210-R212 PolarHBondContact O-N 3.49Å; F210-W213 PolarHBondContact O-N 3.43Å; F210-M214 VanDerWaalsContact O-CG 3.26Å; F210-M214 WeakPolarHBondContact O-CG 3.31Å; F210-M214 PolarHBondContact O-N 3.33Å; F210-L231 HydrophobicContact CD1-CD2 4.12Å; F210-L231 HydrophobicContact CD1-CG 4.02Å; F210-L231 HydrophobicContact CE1-CG 4.15Å; F210-T232 VanDerWaalsContact CB-OG1 3.28Å; F210-T232 WeakPolarHBondContact CB-OG1 3.39Å; F210-T232 HydrophobicContact CD2-CG2 3.9Å; F210-T232 HydrophobicContact CE2-CG2 4.08Å; F210-T232 HydrophobicContact CG-CG2 4.43Å; F210-T232 VanDerWaalsContact CG-OG1 3.26Å; F210-T232 WeakPolarHBondContact CG-OG1 3.38Å; F210-M235 HydrophobicContact CE1-CB 4.24Å; F210-M235 HydrophobicContact CE1-CG 3.89Å; F210-M235 HydrophobicContact CZ-CB 3.94Å; F210-M235 HydrophobicContact CZ-CG 4.06Å
211	F	94.7	Very high	91.1	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-54.8	-50.5	176.2	-171.2	-74.7	0	0	0	111	V207 G208 W213 M214 V215 I223 A228 A659 H660 H727	V207-F211 PolarHBondContact O-N 3.06Å; G208-F211 PolarHBondContact O-N 3.49Å; F211-W213 PolarHBondContact O-N 2.99Å; F211-M214 PolarHBondContact O-N 2.9Å; F211-V215 HydrophobicContact CD1-CG2 3.92Å; F211-V215 HydrophobicContact CE1-CG2 3.64Å; F211-V215 WeakPolarHBondContact O-CG2 3.4Å; F211-V215 PolarHBondContact O-N 3.41Å; F211-V215 VanDerWaalsContact O-N 3.09Å; F211-I223 HydrophobicContact CD2-CG2 4.06Å; F211-I223 HydrophobicContact CE2-CB 4.29Å; F211-I223 HydrophobicContact CE2-CG2 3.86Å; F211-I223 VanDerWaalsContact CE2-O 3.22Å; F211-I223 WeakPolarHBondContact CE2-O 3.33Å; F211-I223 HydrophobicContact CZ-CB 4.26Å; F211-I223 HydrophobicContact CZ-CG2 4.29Å; F211-I223 VanDerWaalsContact CZ-O 3.29Å; F211-I223 WeakPolarHBondContact CZ-O 3.46Å; F211-A228 HydrophobicContact CB-CB 3.78Å; F211-A228 HydrophobicContact CD2-CB 3.87Å; F211-A228 HydrophobicContact CG-CB 4.3Å; F211-A659 WeakPolarHBondContact CE1-O 3.28Å; F211-A659 HydrophobicContact CZ-CB 4.5Å; F211-H660 AromaticContact CZ-CE1 3.88Å; F211-H660 AromaticContact CZ-NE2 3.88Å; F211-H727 AromaticContact CD1-CE1 3.28Å; F211-H727 WeakPolarHBondContact CD1-CE1 3.45Å; F211-H727 AromaticContact CD1-CG 3.77Å; F211-H727 AromaticContact CD1-ND1 3.13Å; F211-H727 WeakPolarHBondContact CD1-ND1 3.38Å; F211-H727 AromaticContact CD1-NE2 3.97Å; F211-H727 AromaticContact CD2-CE1 3.7Å; F211-H727 AromaticContact CE1-CE1 3.43Å; F211-H727 VanDerWaalsContact CE1-CE1 3.43Å; F211-H727 WeakPolarHBondContact CE1-CE1 3.04Å; F211-H727 AromaticContact CE1-ND1 3.34Å; F211-H727 VanDerWaalsContact CE1-ND1 3.34Å; F211-H727 WeakPolarHBondContact CE1-ND1 3.23Å; F211-H727 AromaticContact CE2-CE1 3.82Å; F211-H727 AromaticContact CG-CE1 3.44Å; F211-H727 VanDerWaalsContact CG-CE1 3.44Å; F211-H727 WeakPolarHBondContact CG-CE1 3.33Å; F211-H727 AromaticContact CG-ND1 3.74Å; F211-H727 AromaticContact CG-NE2 3.74Å; F211-H727 AromaticContact CZ-CE1 3.7Å
212	R	92.4	Very high	91.1	Very high	67 Å²	67	29.1 Å²	29.1	25%	0.253	15%	0.151	S	C	.	.	H	α-helix	trans	-56.7	-48.4	177.3	-167.9	-158.7	167.3	67.3	27.4	111.6	G208 F210 M214 V215 D216 H727 Y729	G208-R212 WeakPolarHBondContact O-CB 3.32Å; G208-R212 PolarHBondContact O-N 2.89Å; F210-R212 VanDerWaalsContact C-N 3.34Å; F210-R212 PolarHBondContact O-N 3.49Å; R212-M214 VanDerWaalsContact C-N 3.32Å; R212-M214 PolarHBondContact O-N 2.93Å; R212-V215 WeakPolarHBondContact O-CB 3.47Å; R212-V215 PolarHBondContact O-N 2.93Å; R212-V215 VanDerWaalsContact O-N 3.11Å; R212-D216 IonicContact CZ-OD2 3.34Å; R212-D216 VanDerWaalsContact CZ-OD2 3.27Å; R212-D216 IonicContact NE-OD2 3.59Å; R212-D216 PolarHBondContact NE-OD2 3.12Å; R212-D216 IonicContact NH2-OD1 3.73Å; R212-D216 PolarHBondContact NH2-OD1 3.26Å; R212-D216 IonicContact NH2-OD2 3.28Å; R212-D216 PolarHBondContact NH2-OD2 3.2Å; R212-D216 WeakPolarHBondContact O-CB 3.46Å; R212-D216 PolarHBondContact O-N 2.84Å; R212-H727 WeakPolarHBondContact CD-O 3.29Å; R212-H727 WeakPolarHBondContact CG-O 3.36Å; R212-H727 PolarHBondContact NH1-O 2.73Å; R212-Y729 VanDerWaalsContact NH1-CD1 3.26Å
213	W	93.4	Very high	91.1	Very high	15 Å²	15	27.3 Å²	27.3	6%	0.057	13%	0.131	C	C	.	.	H	α-helix	trans	-60.9	-39	178.4	-179.9	87	0	0	0	112.3	L94 E96 P98 L136 A140 R209 F210 F211 V215 T217 I219	L94-W213 HydrophobicContact CD1-CZ2 3.73Å; E96-W213 PolarHBondContact O-NE1 3.02Å; E96-W213 VanDerWaalsContact O-NE1 3.14Å; P98-W213 HydrophobicContact CB-CB 4.02Å; P98-W213 HydrophobicContact CB-CG 4.34Å; P98-W213 HydrophobicContact CG-CB 4.32Å; P98-W213 HydrophobicContact CG-CD2 4.36Å; P98-W213 HydrophobicContact CG-CG 4.18Å; L136-W213 HydrophobicContact CD1-CH2 4.03Å; L136-W213 HydrophobicContact CD1-CZ3 3.78Å; L136-W213 HydrophobicContact CD2-CD2 4.25Å; L136-W213 HydrophobicContact CD2-CE3 4.12Å; L136-W213 HydrophobicContact CD2-CH2 3.58Å; L136-W213 HydrophobicContact CD2-CZ2 3.68Å; L136-W213 HydrophobicContact CD2-CZ3 3.79Å; L136-W213 HydrophobicContact CG-CH2 3.51Å; L136-W213 HydrophobicContact CG-CZ2 4.07Å; L136-W213 HydrophobicContact CG-CZ3 3.78Å; A140-W213 HydrophobicContact CB-CH2 3.69Å; A140-W213 HydrophobicContact CB-CZ3 3.96Å; R209-W213 VanDerWaalsContact O-CB 3.25Å; R209-W213 WeakPolarHBondContact O-CB 3.21Å; R209-W213 PolarHBondContact O-N 2.88Å; F210-W213 PolarHBondContact O-N 3.43Å; F211-W213 PolarHBondContact O-N 2.99Å; W213-V215 VanDerWaalsContact C-N 3.31Å; W213-V215 PolarHBondContact O-N 3.4Å; W213-T217 HydrophobicContact CD2-CG2 4.1Å; W213-T217 HydrophobicContact CG-CG2 4.38Å; W213-T217 HydrophobicContact CZ2-CG2 3.95Å; W213-T217 WeakPolarHBondContact O-CB 3.43Å; W213-T217 WeakPolarHBondContact O-CG2 3.33Å; W213-T217 PolarHBondContact O-N 2.92Å; W213-T217 PolarHBondContact O-OG1 3.32Å; W213-I219 HydrophobicContact CE3-CD1 4.47Å; W213-I219 HydrophobicContact CZ3-CD1 3.85Å
214	M	93	Very high	91	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.2	-36	174.8	-63.3	177.5	68.1	0	0	112.2	V158 F210 F211 R212 T217 R218 I219 I223 A227 A228 L231	V158-M214 HydrophobicContact CG2-CE 4.44Å; F210-M214 VanDerWaalsContact O-CG 3.26Å; F210-M214 WeakPolarHBondContact O-CG 3.31Å; F210-M214 PolarHBondContact O-N 3.33Å; F211-M214 PolarHBondContact O-N 2.9Å; R212-M214 VanDerWaalsContact C-N 3.32Å; R212-M214 PolarHBondContact O-N 2.93Å; M214-T217 PolarHBondContact O-OG1 3.44Å; M214-R218 PolarHBondContact O-N 2.87Å; M214-I219 HydrophobicContact CB-CD1 3.87Å; M214-I219 HydrophobicContact CB-CG1 4.37Å; M214-I219 HydrophobicContact CE-CD1 4.13Å; M214-I219 HydrophobicContact CE-CG2 4.48Å; M214-I219 HydrophobicContact CG-CD1 3.68Å; M214-I219 PolarHBondContact O-N 3.41Å; M214-I223 HydrophobicContact CB-CD1 3.64Å; M214-I223 HydrophobicContact CB-CG1 4.45Å; M214-I223 HydrophobicContact CB-CG2 4.45Å; M214-I223 HydrophobicContact CE-CG2 3.91Å; M214-I223 WeakPolarHBondContact O-CD1 3.12Å; M214-I223 HydrophobicContact SD-CG2 4.17Å; M214-A227 HydrophobicContact CE-CB 4.06Å; M214-A228 HydrophobicContact SD-CB 4.05Å; M214-L231 HydrophobicContact CE-CD2 4.29Å; M214-L231 HydrophobicContact CG-CD2 3.95Å; M214-L231 HydrophobicContact SD-CD2 3.73Å
215	V	90.3	Very high	90.8	Very high	19 Å²	19	25.5 Å²	25.5	12%	0.115	12%	0.119	C	C	.	.	H	α-helix	trans	-71.8	-52.8	175.1	176.8	0	0	0	0	111	F211 R212 W213 T217 R218 I223 H660	F211-V215 HydrophobicContact CD1-CG2 3.92Å; F211-V215 HydrophobicContact CE1-CG2 3.64Å; F211-V215 WeakPolarHBondContact O-CG2 3.4Å; F211-V215 PolarHBondContact O-N 3.41Å; F211-V215 VanDerWaalsContact O-N 3.09Å; R212-V215 WeakPolarHBondContact O-CB 3.47Å; R212-V215 PolarHBondContact O-N 2.93Å; R212-V215 VanDerWaalsContact O-N 3.11Å; W213-V215 VanDerWaalsContact C-N 3.31Å; W213-V215 PolarHBondContact O-N 3.4Å; V215-T217 PolarHBondContact O-N 3.36Å; V215-R218 PolarHBondContact O-N 3.49Å; V215-I223 HydrophobicContact CB-CD1 4.31Å; V215-I223 HydrophobicContact CG2-CD1 3.64Å; V215-H660 WeakPolarHBondContact CG2-ND1 3.44Å
216	D	88.4	Confident	90.6	Very high	50 Å²	50	26.2 Å²	26.2	27%	0.267	12%	0.121	S	C	.	.	H	α-helix	trans	-62.2	-31.7	-177.5	-74.2	-20.5	0	0	0	111.6	R212	R212-D216 IonicContact CZ-OD2 3.34Å; R212-D216 VanDerWaalsContact CZ-OD2 3.27Å; R212-D216 IonicContact NE-OD2 3.59Å; R212-D216 PolarHBondContact NE-OD2 3.12Å; R212-D216 IonicContact NH2-OD1 3.73Å; R212-D216 PolarHBondContact NH2-OD1 3.26Å; R212-D216 IonicContact NH2-OD2 3.28Å; R212-D216 PolarHBondContact NH2-OD2 3.2Å; R212-D216 WeakPolarHBondContact O-CB 3.46Å; R212-D216 PolarHBondContact O-N 2.84Å
217	T	87.4	Confident	90.7	Very high	10 Å²	10	25.1 Å²	25.1	6%	0.061	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-6.9	174.4	56.7	0	0	0	0	115.1	L12 L94 W213 M214 V215	L12-T217 PolarHBondContact N-O 3.48Å; L94-T217 HydrophobicContact CD1-CG2 4.06Å; W213-T217 HydrophobicContact CD2-CG2 4.1Å; W213-T217 HydrophobicContact CG-CG2 4.38Å; W213-T217 HydrophobicContact CZ2-CG2 3.95Å; W213-T217 WeakPolarHBondContact O-CB 3.43Å; W213-T217 WeakPolarHBondContact O-CG2 3.33Å; W213-T217 PolarHBondContact O-N 2.92Å; W213-T217 PolarHBondContact O-OG1 3.32Å; M214-T217 PolarHBondContact O-OG1 3.44Å; V215-T217 PolarHBondContact O-N 3.36Å
218	R	87.7	Confident	90.7	Very high	135 Å²	135	25.1 Å²	25.1	51%	0.509	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	49.9	-176.8	-59	-177.1	179.7	178.1	2	115.2	T11 E13 Q144 M214 V215 S220	T11-R218 HydrophobicContact CG2-CG 4.13Å; E13-R218 WeakPolarHBondContact OE2-CD 3.46Å; E13-R218 IonicContact OE2-CZ 3.89Å; E13-R218 IonicContact OE2-NE 2.76Å; E13-R218 IonicContact OE2-NH1 2.67Å; E13-R218 PolarHBondContact OE2-NH1 3.08Å; Q144-R218 PolarHBondContact NE2-O 3.4Å; M214-R218 PolarHBondContact O-N 2.87Å; V215-R218 PolarHBondContact O-N 3.49Å; R218-S220 PolarHBondContact O-N 2.93Å
219	I	88.5	Confident	90.8	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	11%	0.114	C	C	.	.	S	Bend	trans	-59.9	-36.3	169.8	-60.9	-176	0	0	0	110.8	L12 A140 A143 Q144 S147 W213 M214	L12-I219 HydrophobicContact CD1-CG1 4.23Å; A140-I219 HydrophobicContact CB-CD1 3.63Å; A140-I219 HydrophobicContact CB-CG1 4.22Å; A143-I219 HydrophobicContact CB-CG2 4.06Å; Q144-I219 VanDerWaalsContact CA-O 3.26Å; Q144-I219 WeakPolarHBondContact CA-O 3.38Å; Q144-I219 HydrophobicContact CB-CG2 4.15Å; Q144-I219 WeakPolarHBondContact CB-O 3.46Å; Q144-I219 WeakPolarHBondContact CG-O 3.46Å; S147-I219 PolarHBondContact OG-O 3.28Å; S147-I219 VanDerWaalsContact OG-O 3.11Å; W213-I219 HydrophobicContact CE3-CD1 4.47Å; W213-I219 HydrophobicContact CZ3-CD1 3.85Å; M214-I219 HydrophobicContact CB-CD1 3.87Å; M214-I219 HydrophobicContact CB-CG1 4.37Å; M214-I219 HydrophobicContact CE-CD1 4.13Å; M214-I219 HydrophobicContact CE-CG2 4.48Å; M214-I219 HydrophobicContact CG-CD1 3.68Å; M214-I219 PolarHBondContact O-N 3.41Å
220	S	89.1	Confident	91	Very high	15 Å²	15	21.1 Å²	21.1	11%	0.105	10%	0.099	C	C	.	.			trans	-159	159.9	171.1	-154.2	0	0	0	0	110.8	S147 K152 R218 R222	S147-S220 WeakPolarHBondContact CB-OG 3.26Å; S147-S220 VanDerWaalsContact OG-CB 3.28Å; S147-S220 WeakPolarHBondContact OG-CB 3.28Å; S147-S220 PolarHBondContact OG-OG 3.41Å; K152-S220 PolarHBondContact N-OG 3.47Å; R218-S220 PolarHBondContact O-N 2.93Å; S220-R222 WeakPolarHBondContact CB-O 3.49Å; S220-R222 PolarHBondContact O-N 3.3Å
221	V	86.6	Confident	91	Very high	75 Å²	75	21.3 Å²	21.3	46%	0.455	10%	0.1	S	C	.	.	S	Bend	trans	-61.7	-34.4	177.1	178.1	0	0	0	0	111.2	A617	V221-A617 HydrophobicContact CG1-CB 3.47Å; V221-A617 VanDerWaalsContact CG1-CB 3.47Å
222	R	88.7	Confident	91.1	Very high	7 Å²	7	21.2 Å²	21.2	3%	0.026	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.9	173.5	-64.4	177.6	-66.9	-85.5	-14.4	110.2	H150 A151 K152 C153 S220 L577 A616 A617	H150-R222 PolarHBondContact O-NH2 3.08Å; A151-R222 VanDerWaalsContact CB-NH2 3.34Å; A151-R222 PolarHBondContact O-N 2.69Å; A151-R222 PolarHBondContact O-NH2 3.01Å; K152-R222 CarbonylContact C-O 3.53Å; K152-R222 WeakPolarHBondContact CA-O 3.32Å; K152-R222 HydrophobicContact CB-CB 4.49Å; K152-R222 HydrophobicContact CG-CB 4.27Å; C153-R222 PolarHBondContact N-O 2.91Å; S220-R222 WeakPolarHBondContact CB-O 3.49Å; S220-R222 PolarHBondContact O-N 3.3Å; R222-L577 PolarHBondContact NH1-O 2.67Å; R222-L577 VanDerWaalsContact NH2-CG 3.29Å; R222-L577 PolarHBondContact NH2-O 3.3Å; R222-A616 HydrophobicContact CG-CB 3.77Å; R222-A617 HydrophobicContact CG-CB 4.36Å
223	I	91.1	Very high	91.3	Very high	6 Å²	6	18.1 Å²	18.1	3%	0.031	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	121.6	-178.2	-68.4	151	0	0	0	107.4	C153 F211 M214 V215 A227 H660	C153-I223 HydrophobicContact CB-CG1 4.19Å; F211-I223 HydrophobicContact CD2-CG2 4.06Å; F211-I223 HydrophobicContact CE2-CB 4.29Å; F211-I223 HydrophobicContact CE2-CG2 3.86Å; F211-I223 VanDerWaalsContact CE2-O 3.22Å; F211-I223 WeakPolarHBondContact CE2-O 3.33Å; F211-I223 HydrophobicContact CZ-CB 4.26Å; F211-I223 HydrophobicContact CZ-CG2 4.29Å; F211-I223 VanDerWaalsContact CZ-O 3.29Å; F211-I223 WeakPolarHBondContact CZ-O 3.46Å; M214-I223 HydrophobicContact CB-CD1 3.64Å; M214-I223 HydrophobicContact CB-CG1 4.45Å; M214-I223 HydrophobicContact CB-CG2 4.45Å; M214-I223 HydrophobicContact CE-CG2 3.91Å; M214-I223 WeakPolarHBondContact O-CD1 3.12Å; M214-I223 HydrophobicContact SD-CG2 4.17Å; V215-I223 HydrophobicContact CB-CD1 4.31Å; V215-I223 HydrophobicContact CG2-CD1 3.64Å; I223-A227 HydrophobicContact CG2-CB 4.38Å; I223-H660 PolarHBondContact N-CE1 3.45Å; I223-H660 VanDerWaalsContact N-CE1 3.28Å
224	H	88.7	Confident	91.4	Very high	21 Å²	21	17.6 Å²	17.6	10%	0.097	9%	0.087	C	C	.	.			trans	-82	141.5	176.8	-174.8	-18.4	0	0	0	109.1	C153 Y226 A227 E649	C153-H224 PolarHBondContact O-N 2.99Å; H224-Y226 AromaticContact CE1-CD2 3.47Å; H224-Y226 VanDerWaalsContact CE1-CD2 3.47Å; H224-Y226 WeakPolarHBondContact CE1-CD2 3.43Å; H224-Y226 AromaticContact CE1-CE2 3.85Å; H224-Y226 AromaticContact CE1-CG 3.57Å; H224-Y226 PolarHBondContact ND1-N 2.87Å; H224-Y226 AromaticContact NE2-CD2 3.71Å; H224-Y226 PolarHBondContact O-N 3.11Å; H224-Y226 VanDerWaalsContact O-N 3.09Å; H224-A227 WeakPolarHBondContact O-CB 3.47Å; H224-A227 PolarHBondContact O-N 3.47Å; H224-E649 WeakPolarHBondContact CA-OE2 3.31Å; H224-E649 IonicContact CE1-OE2 3.49Å; H224-E649 PolarHBondContact CE1-OE2 3.5Å; H224-E649 IonicContact CG-OE2 2.67Å; H224-E649 IonicContact ND1-OE2 3.65Å; H224-E649 PolarHBondContact ND1-OE2 3.18Å
225	E	87.8	Confident	91.5	Very high	7 Å²	7	17.8 Å²	17.8	3%	0.033	9%	0.088	C	C	.	.	H	α-helix	trans	-58.1	-29.1	-178.1	71.9	-179.1	-178.3	0	0	114.2	Y185 K197 A227 A228 I229 E649	Y185-E225 WeakPolarHBondContact CE1-OE1 3.42Å; Y185-E225 PolarHBondContact OH-OE1 2.91Å; Y185-E225 PolarHBondContact OH-OE2 3.23Å; K197-E225 WeakPolarHBondContact CE-OE2 3.43Å; K197-E225 IonicContact NZ-OE2 2.81Å; K197-E225 PolarHBondContact NZ-OE2 2.8Å; E225-A227 PolarHBondContact O-N 3.08Å; E225-A228 PolarHBondContact O-N 2.74Å; E225-A228 VanDerWaalsContact O-N 3.16Å; E225-I229 WeakPolarHBondContact O-CG1 3.4Å; E225-I229 PolarHBondContact O-N 3.03Å; E225-E649 WeakPolarHBondContact CB-OE1 3.26Å; E225-E649 HydrophobicContact CG-CG 4.46Å; E225-E649 WeakPolarHBondContact CG-OE1 3.36Å; E225-E649 PolarHBondContact N-OE2 3.3Å
226	Y	90.4	Very high	91.8	Very high	15 Å²	15	17.1 Å²	17.1	6%	0.059	8%	0.083	C	C	.	.	H	α-helix	trans	-67.1	-24.4	176.2	-64.5	-7.1	0	0	0	113.1	L182 Y185 H224 I229 S230 S646 L647	L182-Y226 HydrophobicContact CD2-CD1 3.71Å; L182-Y226 HydrophobicContact CD2-CD2 4.46Å; L182-Y226 HydrophobicContact CD2-CE1 4.46Å; L182-Y226 HydrophobicContact CD2-CG 3.74Å; Y185-Y226 AromaticContact CD1-CE1 3.92Å; Y185-Y226 HydrophobicContact CD1-CE1 3.92Å; Y185-Y226 AromaticContact CE1-CE1 3.89Å; Y185-Y226 HydrophobicContact CE1-CE1 3.89Å; H224-Y226 AromaticContact CE1-CD2 3.47Å; H224-Y226 VanDerWaalsContact CE1-CD2 3.47Å; H224-Y226 WeakPolarHBondContact CE1-CD2 3.43Å; H224-Y226 AromaticContact CE1-CE2 3.85Å; H224-Y226 AromaticContact CE1-CG 3.57Å; H224-Y226 PolarHBondContact ND1-N 2.87Å; H224-Y226 AromaticContact NE2-CD2 3.71Å; H224-Y226 PolarHBondContact O-N 3.11Å; H224-Y226 VanDerWaalsContact O-N 3.09Å; Y226-I229 HydrophobicContact CD1-CD1 4.24Å; Y226-S230 VanDerWaalsContact O-CB 3.25Å; Y226-S230 WeakPolarHBondContact O-CB 3.49Å; Y226-S230 PolarHBondContact O-N 3.02Å; Y226-S230 PolarHBondContact O-OG 3.39Å; Y226-S646 PolarHBondContact OH-O 2.72Å; Y226-L647 WeakPolarHBondContact CE2-O 3.49Å
227	A	92.8	Very high	92.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.4	-48.6	170.8	0	0	0	0	0	110.2	C153 T154 V158 M214 I223 H224 E225 S230 L231	C153-A227 WeakPolarHBondContact O-CB 3.36Å; T154-A227 WeakPolarHBondContact O-CB 3.36Å; V158-A227 HydrophobicContact CG2-CB 3.89Å; M214-A227 HydrophobicContact CE-CB 4.06Å; I223-A227 HydrophobicContact CG2-CB 4.38Å; H224-A227 WeakPolarHBondContact O-CB 3.47Å; H224-A227 PolarHBondContact O-N 3.47Å; E225-A227 PolarHBondContact O-N 3.08Å; A227-S230 PolarHBondContact O-N 2.77Å; A227-L231 WeakPolarHBondContact O-CB 3.46Å; A227-L231 PolarHBondContact O-N 3.24Å
228	A	94.7	Very high	92.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-64.5	-42.9	178.1	0	0	0	0	0	112.4	V207 F211 M214 E225 L231 T232	V207-A228 HydrophobicContact CG1-CB 4.27Å; F211-A228 HydrophobicContact CB-CB 3.78Å; F211-A228 HydrophobicContact CD2-CB 3.87Å; F211-A228 HydrophobicContact CG-CB 4.3Å; M214-A228 HydrophobicContact SD-CB 4.05Å; E225-A228 PolarHBondContact O-N 2.74Å; E225-A228 VanDerWaalsContact O-N 3.16Å; A228-L231 PolarHBondContact O-N 3.08Å; A228-T232 VanDerWaalsContact O-CB 3.3Å; A228-T232 WeakPolarHBondContact O-CB 3.22Å; A228-T232 PolarHBondContact O-N 2.87Å; A228-T232 PolarHBondContact O-OG1 3.3Å
229	I	94.5	Very high	92.7	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-60.4	-47	174.4	-66.5	167.3	0	0	0	110.4	A181 L182 Y185 L203 V207 E225 Y226 T232 A233	A181-I229 HydrophobicContact CB-CG2 3.94Å; L182-I229 HydrophobicContact CD2-CB 4.04Å; L182-I229 HydrophobicContact CD2-CD1 4.29Å; L182-I229 HydrophobicContact CD2-CG2 3.78Å; L182-I229 HydrophobicContact CG-CG2 4.18Å; Y185-I229 HydrophobicContact CD1-CD1 4.03Å; Y185-I229 HydrophobicContact CD2-CD1 3.94Å; Y185-I229 HydrophobicContact CE1-CD1 4.29Å; Y185-I229 HydrophobicContact CE2-CD1 4.2Å; Y185-I229 HydrophobicContact CG-CD1 3.85Å; L203-I229 HydrophobicContact CD1-CG2 4.49Å; V207-I229 HydrophobicContact CG1-CG1 3.63Å; V207-I229 HydrophobicContact CG2-CG1 4.3Å; E225-I229 WeakPolarHBondContact O-CG1 3.4Å; E225-I229 PolarHBondContact O-N 3.03Å; Y226-I229 HydrophobicContact CD1-CD1 4.24Å; I229-T232 PolarHBondContact O-N 2.92Å; I229-A233 WeakPolarHBondContact O-CB 3.24Å; I229-A233 PolarHBondContact O-N 3.05Å
230	S	95.2	Very high	92.9	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-61.5	-48.2	179.4	-59.3	0	0	0	0	111.4	R155 Y226 A227 T232 A233 C234	R155-S230 WeakPolarHBondContact CB-OG 3.43Å; Y226-S230 VanDerWaalsContact O-CB 3.25Å; Y226-S230 WeakPolarHBondContact O-CB 3.49Å; Y226-S230 PolarHBondContact O-N 3.02Å; Y226-S230 PolarHBondContact O-OG 3.39Å; A227-S230 PolarHBondContact O-N 2.77Å; S230-T232 PolarHBondContact O-N 2.77Å; S230-A233 PolarHBondContact O-N 2.76Å; S230-C234 PolarHBondContact O-N 3.05Å; S230-C234 PolarHBondContact O-SG 3.44Å
231	L	96.4	Very high	93	Very high	3 Å²	3	13.7 Å²	13.7	2%	0.016	7%	0.07	C	C	.	.	H	α-helix	trans	-62.4	-43.3	179.9	-174.3	59.8	0	0	0	111.6	L136 V139 V158 F210 M214 A227 A228 C234 M235	L136-L231 HydrophobicContact CD1-CD1 3.95Å; L136-L231 HydrophobicContact CD1-CD2 3.92Å; L136-L231 HydrophobicContact CD1-CG 4.04Å; V139-L231 HydrophobicContact CB-CD1 4.46Å; V139-L231 HydrophobicContact CG1-CD1 3.69Å; V158-L231 HydrophobicContact CG1-CB 3.94Å; V158-L231 HydrophobicContact CG1-CD1 4.26Å; F210-L231 HydrophobicContact CD1-CD2 4.12Å; F210-L231 HydrophobicContact CD1-CG 4.02Å; F210-L231 HydrophobicContact CE1-CG 4.15Å; M214-L231 HydrophobicContact CE-CD2 4.29Å; M214-L231 HydrophobicContact CG-CD2 3.95Å; M214-L231 HydrophobicContact SD-CD2 3.73Å; A227-L231 WeakPolarHBondContact O-CB 3.46Å; A227-L231 PolarHBondContact O-N 3.24Å; A228-L231 PolarHBondContact O-N 3.08Å; L231-C234 PolarHBondContact O-N 2.59Å; L231-M235 WeakPolarHBondContact O-CG 3.41Å; L231-M235 PolarHBondContact O-N 3.08Å
232	T	96.8	Very high	93.2	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-60.2	-46.9	176.1	-53.1	0	0	0	0	111	L203 F205 V207 F210 A228 I229 S230 M235 E236	L203-T232 HydrophobicContact CD1-CG2 3.9Å; F205-T232 HydrophobicContact CB-CG2 3.51Å; V207-T232 HydrophobicContact CG2-CG2 4.07Å; F210-T232 VanDerWaalsContact CB-OG1 3.28Å; F210-T232 WeakPolarHBondContact CB-OG1 3.39Å; F210-T232 HydrophobicContact CD2-CG2 3.9Å; F210-T232 HydrophobicContact CE2-CG2 4.08Å; F210-T232 HydrophobicContact CG-CG2 4.43Å; F210-T232 VanDerWaalsContact CG-OG1 3.26Å; F210-T232 WeakPolarHBondContact CG-OG1 3.38Å; A228-T232 VanDerWaalsContact O-CB 3.3Å; A228-T232 WeakPolarHBondContact O-CB 3.22Å; A228-T232 PolarHBondContact O-N 2.87Å; A228-T232 PolarHBondContact O-OG1 3.3Å; I229-T232 PolarHBondContact O-N 2.92Å; S230-T232 PolarHBondContact O-N 2.77Å; T232-M235 PolarHBondContact O-N 3.34Å; T232-E236 WeakPolarHBondContact O-CB 3.18Å; T232-E236 PolarHBondContact O-N 3.37Å
233	A	96.4	Very high	93.3	Very high	2 Å²	2	12.1 Å²	12.1	2%	0.017	6%	0.056	C	C	.	.	H	α-helix	trans	-65	-41.5	179.4	0	0	0	0	0	112.6	A178 A181 L203 I229 S230 E236 N237	A178-A233 HydrophobicContact CB-CB 4.4Å; A181-A233 HydrophobicContact CB-CB 3.81Å; L203-A233 HydrophobicContact CD1-CB 4.24Å; L203-A233 HydrophobicContact CD2-CB 4.01Å; I229-A233 WeakPolarHBondContact O-CB 3.24Å; I229-A233 PolarHBondContact O-N 3.05Å; S230-A233 PolarHBondContact O-N 2.76Å; A233-E236 PolarHBondContact O-N 2.86Å; A233-N237 VanDerWaalsContact O-CB 3.23Å; A233-N237 WeakPolarHBondContact O-CB 3.45Å; A233-N237 PolarHBondContact O-N 3.02Å
234	C	95.6	Very high	93.2	Very high	4 Å²	4	13.8 Å²	13.8	3%	0.027	7%	0.071	C	C	.	.	H	α-helix	trans	-64.4	-42	176	-62	0	0	0	0	111.8	V162 C174 S230 L231 N237 L238	V162-C234 HydrophobicContact CG2-CB 4.11Å; C174-C234 HydrophobicContact CB-CB 3.93Å; C174-C234 PolarHBondContact O-SG 3.35Å; C174-C234 VanDerWaalsContact O-SG 3.36Å; S230-C234 PolarHBondContact O-N 3.05Å; S230-C234 PolarHBondContact O-SG 3.44Å; L231-C234 PolarHBondContact O-N 2.59Å; C234-N237 PolarHBondContact O-N 2.97Å; C234-L238 WeakPolarHBondContact O-CB 3.47Å; C234-L238 PolarHBondContact O-N 3.19Å
235	M	95.4	Very high	93.2	Very high	4 Å²	4	15 Å²	15	2%	0.02	7%	0.074	C	C	.	.	H	α-helix	trans	-68.6	-36.3	177.1	-68.7	-54.3	-55.2	0	0	112.9	W99 L132 A135 L136 F205 F210 L231 T232 L238 V239	W99-M235 HydrophobicContact CH2-CE 3.89Å; W99-M235 HydrophobicContact CZ3-CE 4.07Å; L132-M235 HydrophobicContact CB-CE 4.1Å; L132-M235 HydrophobicContact CD2-CE 4.11Å; L132-M235 WeakPolarHBondContact O-CE 3.46Å; A135-M235 HydrophobicContact CB-CE 4.35Å; L136-M235 HydrophobicContact CB-CE 4.04Å; L136-M235 HydrophobicContact CB-SD 4.12Å; L136-M235 HydrophobicContact CD1-CG 4.14Å; L136-M235 HydrophobicContact CD1-SD 4.31Å; F205-M235 HydrophobicContact CE2-CB 4.42Å; F210-M235 HydrophobicContact CE1-CB 4.24Å; F210-M235 HydrophobicContact CE1-CG 3.89Å; F210-M235 HydrophobicContact CZ-CB 3.94Å; F210-M235 HydrophobicContact CZ-CG 4.06Å; L231-M235 WeakPolarHBondContact O-CG 3.41Å; L231-M235 PolarHBondContact O-N 3.08Å; T232-M235 PolarHBondContact O-N 3.34Å; M235-L238 HydrophobicContact CE-CD2 4.23Å; M235-V239 PolarHBondContact O-N 3.47Å
236	E	95.2	Very high	93.2	Very high	5 Å²	5	14.6 Å²	14.6	2%	0.023	7%	0.073	C	C	.	.	H	α-helix	trans	-67.5	-43.3	174	-166.6	164.1	132.6	0	0	111.3	V107 K110 T204 F205 T232 A233 L238 V239 E240	V107-E236 HydrophobicContact CG1-CG 3.77Å; V107-E236 HydrophobicContact CG2-CG 3.86Å; K110-E236 IonicContact NZ-OE1 3.58Å; K110-E236 PolarHBondContact NZ-OE1 3.23Å; T204-E236 WeakPolarHBondContact CA-OE2 3.24Å; T204-E236 PolarHBondContact N-OE1 2.81Å; T204-E236 VanDerWaalsContact N-OE1 3.12Å; T204-E236 PolarHBondContact N-OE2 3.33Å; T204-E236 PolarHBondContact OG1-OE1 2.82Å; F205-E236 HydrophobicContact CD2-CB 3.84Å; F205-E236 HydrophobicContact CD2-CG 4.34Å; F205-E236 HydrophobicContact CE2-CB 4.13Å; F205-E236 PolarHBondContact N-OE2 2.68Å; T232-E236 WeakPolarHBondContact O-CB 3.18Å; T232-E236 PolarHBondContact O-N 3.37Å; A233-E236 PolarHBondContact O-N 2.86Å; E236-L238 VanDerWaalsContact C-N 3.34Å; E236-L238 PolarHBondContact O-N 3.37Å; E236-V239 WeakPolarHBondContact O-CB 3.45Å; E236-V239 PolarHBondContact O-N 3.03Å; E236-V239 VanDerWaalsContact O-N 3.12Å; E236-E240 PolarHBondContact O-N 3.19Å
237	N	94.9	Very high	92.9	Very high	23 Å²	23	15.8 Å²	15.8	12%	0.123	8%	0.079	C	C	.	.	H	α-helix	trans	-62.1	-38	175.9	-171.2	77.5	0	0	0	112.6	S173 C174 A177 A233 C234 V239 E240 E241	S173-N237 PolarHBondContact OG-ND2 3.22Å; C174-N237 PolarHBondContact N-ND2 3.48Å; C174-N237 PolarHBondContact SG-ND2 3.3Å; A177-N237 HydrophobicContact CB-CB 3.67Å; A233-N237 VanDerWaalsContact O-CB 3.23Å; A233-N237 WeakPolarHBondContact O-CB 3.45Å; A233-N237 PolarHBondContact O-N 3.02Å; C234-N237 PolarHBondContact O-N 2.97Å; N237-V239 VanDerWaalsContact C-N 3.27Å; N237-V239 PolarHBondContact O-N 2.98Å; N237-E240 PolarHBondContact O-N 3.4Å; N237-E240 VanDerWaalsContact O-N 3.17Å; N237-E241 WeakPolarHBondContact O-CB 3.29Å; N237-E241 PolarHBondContact O-N 2.92Å
238	L	94	Very high	92.4	Very high	4 Å²	4	18.8 Å²	18.8	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-36.6	174.4	-176.9	63.4	0	0	0	112	L132 A135 C234 M235 E236 I242 L277	L132-L238 HydrophobicContact CD2-CD2 3.86Å; L132-L238 HydrophobicContact CD2-CG 4.14Å; A135-L238 HydrophobicContact CB-CD2 3.8Å; C234-L238 WeakPolarHBondContact O-CB 3.47Å; C234-L238 PolarHBondContact O-N 3.19Å; M235-L238 HydrophobicContact CE-CD2 4.23Å; E236-L238 VanDerWaalsContact C-N 3.34Å; E236-L238 PolarHBondContact O-N 3.37Å; L238-I242 HydrophobicContact CD1-CD1 4.23Å; L238-I242 HydrophobicContact CD1-CG1 4.5Å; L238-I242 HydrophobicContact CG-CD1 4.05Å; L238-I242 WeakPolarHBondContact O-CB 3.49Å; L238-I242 WeakPolarHBondContact O-CD1 3.11Å; L238-I242 WeakPolarHBondContact O-CG1 3.31Å; L238-I242 PolarHBondContact O-N 2.97Å; L238-L277 HydrophobicContact CD1-CD2 4.09Å
239	V	94.3	Very high	91.8	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-68.9	-42.1	173.6	177.3	0	0	0	0	111.4	V107 L108 L128 L132 F205 M235 E236 N237 E241 R243	V107-V239 HydrophobicContact CB-CG1 4.07Å; V107-V239 HydrophobicContact CG1-CB 3.86Å; V107-V239 HydrophobicContact CG1-CG1 3.59Å; L108-V239 HydrophobicContact CD2-CG1 3.72Å; L108-V239 HydrophobicContact CG-CG1 3.96Å; L128-V239 HydrophobicContact CD2-CG1 4.17Å; L132-V239 HydrophobicContact CD1-CG2 3.41Å; L132-V239 VanDerWaalsContact CD1-CG2 3.41Å; L132-V239 HydrophobicContact CD2-CG2 3.82Å; L132-V239 HydrophobicContact CG-CG2 4.25Å; F205-V239 HydrophobicContact CZ-CG2 4.34Å; M235-V239 PolarHBondContact O-N 3.47Å; E236-V239 WeakPolarHBondContact O-CB 3.45Å; E236-V239 PolarHBondContact O-N 3.03Å; E236-V239 VanDerWaalsContact O-N 3.12Å; N237-V239 VanDerWaalsContact C-N 3.27Å; N237-V239 PolarHBondContact O-N 2.98Å; V239-E241 VanDerWaalsContact C-N 3.33Å; V239-E241 PolarHBondContact O-N 3.28Å; V239-R243 VanDerWaalsContact O-CB 3.23Å; V239-R243 WeakPolarHBondContact O-CB 3.25Å; V239-R243 PolarHBondContact O-N 3.32Å
240	E	92.3	Very high	90.8	Very high	60 Å²	60	26.3 Å²	26.3	28%	0.28	15%	0.146	S	C	.	.	H	α-helix	trans	-64	-37	177.1	-68.4	-170.3	173.6	0	0	112.5	V107 E236 N237 R243 A244	V107-E240 HydrophobicContact CG1-CG 4.07Å; E236-E240 PolarHBondContact O-N 3.19Å; N237-E240 PolarHBondContact O-N 3.4Å; N237-E240 VanDerWaalsContact O-N 3.17Å; E240-R243 WeakPolarHBondContact O-CB 3.13Å; E240-A244 WeakPolarHBondContact O-CB 3.3Å; E240-A244 PolarHBondContact O-N 3.13Å
241	E	91.1	Very high	89.2	Confident	51 Å²	51	30.5 Å²	30.5	24%	0.238	18%	0.176	C	C	.	.	H	α-helix	trans	-72.6	-46.4	178.1	-175.5	62.5	-157.7	0	0	112.1	L170 N237 V239 R243 A244 R245	L170-E241 HydrophobicContact CD2-CG 3.61Å; N237-E241 WeakPolarHBondContact O-CB 3.29Å; N237-E241 PolarHBondContact O-N 2.92Å; V239-E241 VanDerWaalsContact C-N 3.33Å; V239-E241 PolarHBondContact O-N 3.28Å; E241-R243 VanDerWaalsContact C-N 3.26Å; E241-R243 PolarHBondContact O-N 2.86Å; E241-A244 WeakPolarHBondContact O-CB 3.32Å; E241-A244 PolarHBondContact O-N 3.32Å; E241-A244 VanDerWaalsContact O-N 3.1Å; E241-R245 WeakPolarHBondContact O-CG 3.4Å; E241-R245 PolarHBondContact O-N 3.11Å; E241-R245 IonicContact OE1-CZ 3.02Å; E241-R245 IonicContact OE1-NE 2.75Å; E241-R245 PolarHBondContact OE1-NE 3.37Å; E241-R245 IonicContact OE1-NH2 3.34Å; E241-R245 PolarHBondContact OE1-NH2 3.26Å
242	I	91.6	Very high	87.1	Confident	1 Å²	1	36 Å²	36	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-57.6	-43.7	172.6	-68.5	166.7	0	0	0	109.9	L128 L132 L238 A244 R245 V246 L267 L277 L281	L128-I242 HydrophobicContact CD1-CD1 3.85Å; L128-I242 HydrophobicContact CD1-CG2 3.98Å; L132-I242 HydrophobicContact CD2-CD1 4.41Å; L238-I242 HydrophobicContact CD1-CD1 4.23Å; L238-I242 HydrophobicContact CD1-CG1 4.5Å; L238-I242 HydrophobicContact CG-CD1 4.05Å; L238-I242 WeakPolarHBondContact O-CB 3.49Å; L238-I242 WeakPolarHBondContact O-CD1 3.11Å; L238-I242 WeakPolarHBondContact O-CG1 3.31Å; L238-I242 PolarHBondContact O-N 2.97Å; I242-A244 PolarHBondContact O-N 3.4Å; I242-R245 PolarHBondContact O-N 3.21Å; I242-V246 HydrophobicContact CG2-CG2 4.39Å; I242-V246 VanDerWaalsContact O-CG2 3.27Å; I242-V246 WeakPolarHBondContact O-CG2 3.27Å; I242-V246 PolarHBondContact O-N 3.38Å; I242-L267 HydrophobicContact CG2-CD1 3.73Å; I242-L277 HydrophobicContact CD1-CD2 4.27Å; I242-L277 HydrophobicContact CG1-CD1 3.84Å; I242-L277 HydrophobicContact CG1-CD2 3.76Å; I242-L277 HydrophobicContact CG1-CG 4.47Å; I242-L281 HydrophobicContact CD1-CD1 4.39Å
243	R	90.1	Very high	84.6	Confident	48 Å²	48	43.9 Å²	43.9	18%	0.181	25%	0.254	C	S	.	.	H	α-helix	trans	-58.8	-47.1	174.1	-176.7	-171.7	65.6	77.1	6	111.4	L108 F120 V239 E240 E241 R245 V246 M247	L108-R243 HydrophobicContact CD2-CB 3.88Å; L108-R243 HydrophobicContact CD2-CG 4.07Å; L108-R243 WeakPolarHBondContact O-CD 3.47Å; F120-R243 HydrophobicContact CE2-CG 3.87Å; F120-R243 HydrophobicContact CZ-CB 4.48Å; F120-R243 HydrophobicContact CZ-CG 4.02Å; V239-R243 VanDerWaalsContact O-CB 3.23Å; V239-R243 WeakPolarHBondContact O-CB 3.25Å; V239-R243 PolarHBondContact O-N 3.32Å; E240-R243 WeakPolarHBondContact O-CB 3.13Å; E241-R243 VanDerWaalsContact C-N 3.26Å; E241-R243 PolarHBondContact O-N 2.86Å; R243-R245 VanDerWaalsContact C-N 3.34Å; R243-R245 PolarHBondContact O-N 3.29Å; R243-V246 PolarHBondContact O-N 3Å; R243-M247 HydrophobicContact CG-CG 4.39Å; R243-M247 WeakPolarHBondContact O-CB 3.43Å; R243-M247 WeakPolarHBondContact O-CG 3.46Å; R243-M247 PolarHBondContact O-N 3.18Å
244	A	88.8	Confident	81.8	Confident	42 Å²	42	47.3 Å²	47.3	35%	0.347	29%	0.289	S	S	.	.	H	α-helix	trans	-59.4	-43.7	-179.8	0	0	0	0	0	112.2	E240 E241 I242 M247 A248	E240-A244 WeakPolarHBondContact O-CB 3.3Å; E240-A244 PolarHBondContact O-N 3.13Å; E241-A244 WeakPolarHBondContact O-CB 3.32Å; E241-A244 PolarHBondContact O-N 3.32Å; E241-A244 VanDerWaalsContact O-N 3.1Å; I242-A244 PolarHBondContact O-N 3.4Å; A244-M247 PolarHBondContact O-N 3.02Å; A244-A248 PolarHBondContact O-N 3.25Å
245	R	88.1	Confident	79.4	Confident	45 Å²	45	51.7 Å²	51.7	17%	0.17	34%	0.335	C	S	.	.	H	α-helix	trans	-67.3	-42.9	178.8	-63.5	178.4	-167.1	-159.7	-5.9	112.5	E241 I242 R243 M247 A248 S249 V270 D274 E276	E241-R245 WeakPolarHBondContact O-CG 3.4Å; E241-R245 PolarHBondContact O-N 3.11Å; E241-R245 IonicContact OE1-CZ 3.02Å; E241-R245 IonicContact OE1-NE 2.75Å; E241-R245 PolarHBondContact OE1-NE 3.37Å; E241-R245 IonicContact OE1-NH2 3.34Å; E241-R245 PolarHBondContact OE1-NH2 3.26Å; I242-R245 PolarHBondContact O-N 3.21Å; R243-R245 VanDerWaalsContact C-N 3.34Å; R243-R245 PolarHBondContact O-N 3.29Å; R245-M247 VanDerWaalsContact C-N 3.3Å; R245-M247 PolarHBondContact O-N 2.83Å; R245-A248 PolarHBondContact O-N 3.3Å; R245-S249 PolarHBondContact O-N 2.99Å; R245-S249 VanDerWaalsContact O-N 3.09Å; R245-V270 HydrophobicContact CB-CG1 4.15Å; R245-D274 WeakPolarHBondContact CD-OD2 3.37Å; R245-D274 IonicContact CZ-OD2 3.96Å; R245-D274 IonicContact NE-OD2 3.42Å; R245-D274 IonicContact NH1-OD1 3.18Å; R245-D274 PolarHBondContact NH1-OD1 3.46Å; R245-D274 IonicContact NH1-OD2 3.21Å; R245-D274 PolarHBondContact NH1-OD2 2.98Å; R245-E276 IonicContact CZ-OE2 2.8Å; R245-E276 VanDerWaalsContact CZ-OE2 3.28Å; R245-E276 IonicContact NH1-OE2 3.62Å; R245-E276 PolarHBondContact NH1-OE2 3.23Å; R245-E276 IonicContact NH2-OE2 2.62Å; R245-E276 PolarHBondContact NH2-OE2 3.16Å
246	V	88.6	Confident	76.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-63.8	-34.9	174.8	172.7	0	0	0	0	112.3	F120 I242 R243 S249 Q250 V262 L267 V270	F120-V246 HydrophobicContact CE1-CG1 4.15Å; F120-V246 HydrophobicContact CZ-CB 4.45Å; F120-V246 HydrophobicContact CZ-CG1 4.08Å; I242-V246 HydrophobicContact CG2-CG2 4.39Å; I242-V246 VanDerWaalsContact O-CG2 3.27Å; I242-V246 WeakPolarHBondContact O-CG2 3.27Å; I242-V246 PolarHBondContact O-N 3.38Å; R243-V246 PolarHBondContact O-N 3Å; V246-S249 PolarHBondContact O-OG 3.46Å; V246-Q250 WeakPolarHBondContact O-CG 3.46Å; V246-Q250 PolarHBondContact O-NE2 3.03Å; V246-V262 HydrophobicContact CG1-CG1 3.75Å; V246-L267 HydrophobicContact CG2-CD1 3.79Å; V246-V270 HydrophobicContact CG2-CB 3.9Å; V246-V270 HydrophobicContact CG2-CG1 3.87Å; V246-V270 HydrophobicContact CG2-CG2 4.11Å
247	M	83.9	Confident	74	Confident	40 Å²	40	60 Å²	60	20%	0.197	41%	0.413	C	S	.	.	H	α-helix	trans	-70.2	-39.7	174.6	-72.8	-58	-47.3	0	0	112.1	L117 P118 R243 A244 R245 Q250	L117-M247 HydrophobicContact CD2-CE 4.04Å; P118-M247 HydrophobicContact CG-CE 3.53Å; P118-M247 HydrophobicContact CG-SD 3.65Å; R243-M247 HydrophobicContact CG-CG 4.39Å; R243-M247 WeakPolarHBondContact O-CB 3.43Å; R243-M247 WeakPolarHBondContact O-CG 3.46Å; R243-M247 PolarHBondContact O-N 3.18Å; A244-M247 PolarHBondContact O-N 3.02Å; R245-M247 VanDerWaalsContact C-N 3.3Å; R245-M247 PolarHBondContact O-N 2.83Å; M247-Q250 PolarHBondContact O-N 3.01Å
248	A	83.1	Confident	71.5	Confident	63 Å²	63	62.2 Å²	62.2	52%	0.521	44%	0.441	S	S	.	.	H	α-helix	trans	-65.4	-38.6	178.4	0	0	0	0	0	112.7	A244 R245 Q250 S251	A244-A248 PolarHBondContact O-N 3.25Å; R245-A248 PolarHBondContact O-N 3.3Å; A248-Q250 PolarHBondContact O-N 2.88Å; A248-S251 PolarHBondContact O-N 3.17Å; A248-S251 PolarHBondContact O-OG 3.15Å
249	S	81.3	Confident	69.6	Low	67 Å²	67	65.8 Å²	65.8	47%	0.469	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.5	178.6	63.1	0	0	0	0	114.3	R245 V246 V270	R245-S249 PolarHBondContact O-N 2.99Å; R245-S249 VanDerWaalsContact O-N 3.09Å; V246-S249 PolarHBondContact O-OG 3.46Å; S249-V270 WeakPolarHBondContact OG-CG2 3.41Å
250	Q	73.4	Confident	68.1	Low	90 Å²	90	68 Å²	68	42%	0.421	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.6	-179.9	-69.5	176.3	36.7	0	0	113.7	V246 M247 A248	V246-Q250 WeakPolarHBondContact O-CG 3.46Å; V246-Q250 PolarHBondContact O-NE2 3.03Å; M247-Q250 PolarHBondContact O-N 3.01Å; A248-Q250 PolarHBondContact O-N 2.88Å
251	S	62.3	Low	67.4	Low	89 Å²	89	71.1 Å²	71.1	62%	0.622	52%	0.516	S	S	*	.			trans	-133.7	91.2	-178.8	60.7	0	0	0	0	112.6	A248	A248-S251 PolarHBondContact O-N 3.17Å; A248-S251 PolarHBondContact O-OG 3.15Å
252	P	52.5	Low	67	Low	117 Å²	117	68.9 Å²	68.9	76%	0.76	51%	0.505	S	S	*	.	S	Bend	trans	-131.1	-38.8	133.8	4.8	16.8	0	0	0	116
253	D	44	Very low	66.9	Low	166 Å²	166	71 Å²	71	89%	0.888	52%	0.52	S	S	*	.	S	Bend	trans	-140.6	136.9	-166.3	-91.9	-50.2	0	0	0	114.3
254	G	37.8	Very low	66.8	Low	74 Å²	74	69 Å²	69	76%	0.763	51%	0.514	S	S	*	.			trans	122.5	96.2	168.6	0	0	0	0	0	114.7	G256	G254-G256 PolarHBondContact O-N 2.82Å; G254-G256 VanDerWaalsContact O-N 3.16Å
255	G	44.7	Very low	66.8	Low	96 Å²	96	73 Å²	73	99%	0.99	53%	0.526	S	S	*	.			trans	-67.7	109.2	172.5	0	0	0	0	0	112.2
256	G	35.7	Very low	66.8	Low	69 Å²	69	72.5 Å²	72.5	71%	0.711	53%	0.531	S	S	*	.			trans	-160.5	136.4	174.3	0	0	0	0	0	110.1	G254	G254-G256 PolarHBondContact O-N 2.82Å; G254-G256 VanDerWaalsContact O-N 3.16Å
257	A	41.4	Very low	66.8	Low	116 Å²	116	72.5 Å²	72.5	96%	0.959	53%	0.531	S	S	*	.			trans	-73.6	134.9	-173.8	0	0	0	0	0	112.4
258	G	43	Very low	67.1	Low	69 Å²	69	74 Å²	74	71%	0.711	54%	0.538	S	S	*	.			trans	154.1	123.2	161.8	0	0	0	0	0	114.5	G260	G258-G260 PolarHBondContact O-N 3.07Å
259	G	53.2	Low	67.4	Low	79 Å²	79	76.5 Å²	76.5	81%	0.814	54%	0.54	S	S	*	.			trans	-74.1	73.5	156.4	0	0	0	0	0	109.1
260	G	63.1	Low	67.8	Low	47 Å²	47	74.5 Å²	74.5	49%	0.485	53%	0.525	S	S	.	.			trans	-67.6	153.8	-179.7	0	0	0	0	0	112.2	P118 G258	P118-G260 WeakPolarHBondContact CB-O 3.35Å; G258-G260 PolarHBondContact O-N 3.07Å
261	E	77.6	Confident	68.5	Low	125 Å²	125	70.4 Å²	70.4	58%	0.584	51%	0.506	S	S	*	.			trans	-79.4	137.7	174.8	-162.2	178.2	-145.9	0	0	110	Q119 S121 S263	Q119-E261 CarbonylContact O-C 3.58Å; Q119-E261 VanDerWaalsContact O-CA 3.32Å; Q119-E261 WeakPolarHBondContact O-CA 3.24Å; Q119-E261 WeakPolarHBondContact O-CG 3.31Å; S121-E261 VanDerWaalsContact CA-CD 3.5Å; S121-E261 WeakPolarHBondContact CA-OE1 3.44Å; E261-S263 PolarHBondContact O-N 2.95Å
262	V	83.4	Confident	69.7	Low	3 Å²	3	68.9 Å²	68.9	2%	0.018	49%	0.491	C	S	.	.	B	Isolated β-bridge	trans	-73.3	115.3	177	-173.5	0	0	0	0	109.1	P118 Q119 F120 S121 V246 A266	P118-V262 HydrophobicContact CB-CG2 4.01Å; P118-V262 HydrophobicContact CG-CG2 4.22Å; Q119-V262 PolarHBondContact O-N 3.07Å; F120-V262 HydrophobicContact CD1-CB 4.04Å; F120-V262 HydrophobicContact CD1-CG1 4.04Å; F120-V262 HydrophobicContact CD2-CG2 4.4Å; F120-V262 HydrophobicContact CE1-CB 4.22Å; F120-V262 HydrophobicContact CE1-CG1 3.85Å; F120-V262 HydrophobicContact CE2-CG2 4.31Å; F120-V262 HydrophobicContact CG-CB 4.21Å; F120-V262 HydrophobicContact CZ-CG1 4.33Å; F120-V262 HydrophobicContact CZ-CG2 4.42Å; S121-V262 WeakPolarHBondContact CB-O 3.42Å; S121-V262 PolarHBondContact N-O 3.38Å; S121-V262 PolarHBondContact OG-O 2.65Å; V246-V262 HydrophobicContact CG1-CG1 3.75Å; V262-A266 HydrophobicContact CG1-CB 4.36Å
263	S	89	Confident	71.3	Confident	45 Å²	45	67.3 Å²	67.3	32%	0.315	48%	0.476	S	S	.	.			trans	-78.2	164.8	-179.6	90.2	0	0	0	0	112.3	E261 E265 A266 L267	E261-S263 PolarHBondContact O-N 2.95Å; S263-E265 VanDerWaalsContact C-N 3.32Å; S263-E265 WeakPolarHBondContact CB-OE2 3.5Å; S263-E265 PolarHBondContact OG-N 2.87Å; S263-E265 PolarHBondContact OG-OE2 3.42Å; S263-A266 PolarHBondContact OG-N 2.98Å; S263-L267 PolarHBondContact O-N 2.98Å
264	A	88.9	Confident	73.3	Confident	7 Å²	7	60.8 Å²	60.8	6%	0.058	44%	0.441	C	S	.	.	H	α-helix	trans	-67.7	-34.9	177.8	0	0	0	0	0	112.1	E123 A124 R127 L267 E268	E123-A264 HydrophobicContact CB-CB 4.37Å; E123-A264 HydrophobicContact CG-CB 3.85Å; A124-A264 HydrophobicContact CB-CB 4.41Å; R127-A264 HydrophobicContact CG-CB 4.14Å; A264-L267 WeakPolarHBondContact O-CB 3.37Å; A264-L267 PolarHBondContact O-N 3.4Å; A264-E268 WeakPolarHBondContact O-CG 3.3Å; A264-E268 PolarHBondContact O-N 3.35Å
265	E	87.9	Confident	75.4	Confident	125 Å²	125	57.7 Å²	57.7	58%	0.584	41%	0.409	S	S	*	.	H	α-helix	trans	-66.6	-39.3	178.7	-52.7	74.5	-163.9	0	0	111	S263 L267 E268 M269	S263-E265 VanDerWaalsContact C-N 3.32Å; S263-E265 WeakPolarHBondContact CB-OE2 3.5Å; S263-E265 PolarHBondContact OG-N 2.87Å; S263-E265 PolarHBondContact OG-OE2 3.42Å; E265-L267 VanDerWaalsContact C-N 3.33Å; E265-L267 PolarHBondContact O-N 2.76Å; E265-E268 PolarHBondContact O-N 3.47Å; E265-M269 VanDerWaalsContact O-CB 3.31Å; E265-M269 WeakPolarHBondContact O-CB 3.22Å; E265-M269 VanDerWaalsContact O-CG 3.24Å; E265-M269 WeakPolarHBondContact O-CG 3.44Å; E265-M269 PolarHBondContact O-N 3Å
266	A	87.1	Confident	77.3	Confident	35 Å²	35	54.3 Å²	54.3	29%	0.289	37%	0.367	S	S	.	.	H	α-helix	trans	-63.3	-39.2	175	0	0	0	0	0	112.1	V262 S263 V270	V262-A266 HydrophobicContact CG1-CB 4.36Å; S263-A266 PolarHBondContact OG-N 2.98Å; A266-V270 WeakPolarHBondContact O-CG2 3.34Å; A266-V270 PolarHBondContact O-N 2.77Å
267	L	90.2	Very high	79.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-49.8	173.6	172.1	68	0	0	0	111.7	A124 R127 L128 I242 V246 S263 A264 E265 M269 V270 I271	A124-L267 HydrophobicContact CB-CD2 4.39Å; A124-L267 WeakPolarHBondContact O-CD2 3.36Å; R127-L267 HydrophobicContact CB-CD2 4.49Å; L128-L267 HydrophobicContact CB-CD2 3.87Å; L128-L267 HydrophobicContact CD1-CD1 4.48Å; I242-L267 HydrophobicContact CG2-CD1 3.73Å; V246-L267 HydrophobicContact CG2-CD1 3.79Å; S263-L267 PolarHBondContact O-N 2.98Å; A264-L267 WeakPolarHBondContact O-CB 3.37Å; A264-L267 PolarHBondContact O-N 3.4Å; E265-L267 VanDerWaalsContact C-N 3.33Å; E265-L267 PolarHBondContact O-N 2.76Å; L267-M269 PolarHBondContact O-N 2.91Å; L267-V270 PolarHBondContact O-N 3.37Å; L267-I271 HydrophobicContact CD1-CD1 3.82Å; L267-I271 HydrophobicContact CD1-CG1 4.43Å; L267-I271 HydrophobicContact CG-CD1 3.98Å; L267-I271 WeakPolarHBondContact O-CG1 3.34Å; L267-I271 PolarHBondContact O-N 3.3Å; L267-I271 VanDerWaalsContact O-N 3.1Å
268	E	89.1	Confident	82	Confident	73 Å²	73	47.2 Å²	47.2	34%	0.341	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-38.1	-179.2	-72.2	-177.1	-179.1	0	0	111.9	R127 A264 E265 V270 I271 N272	R127-E268 IonicContact NH1-OE1 2.82Å; A264-E268 WeakPolarHBondContact O-CG 3.3Å; A264-E268 PolarHBondContact O-N 3.35Å; E265-E268 PolarHBondContact O-N 3.47Å; E268-V270 VanDerWaalsContact C-N 3.34Å; E268-V270 PolarHBondContact O-N 3.19Å; E268-I271 PolarHBondContact O-N 3.29Å; E268-N272 VanDerWaalsContact O-CB 3.29Å; E268-N272 WeakPolarHBondContact O-CB 3.25Å; E268-N272 PolarHBondContact O-N 3.05Å; E268-N272 PolarHBondContact O-ND2 2.78Å
269	M	88.9	Confident	83.9	Confident	115 Å²	115	44 Å²	44	57%	0.567	26%	0.261	S	S	*	.	H	α-helix	trans	-60	-40.2	174.6	-80.1	-65.3	-66.4	0	0	113	E265 L267 N273	E265-M269 VanDerWaalsContact O-CB 3.31Å; E265-M269 WeakPolarHBondContact O-CB 3.22Å; E265-M269 VanDerWaalsContact O-CG 3.24Å; E265-M269 WeakPolarHBondContact O-CG 3.44Å; E265-M269 PolarHBondContact O-N 3Å; L267-M269 PolarHBondContact O-N 2.91Å; M269-N273 PolarHBondContact O-N 3.14Å; M269-N273 PolarHBondContact O-ND2 3.01Å
270	V	89.9	Confident	85.6	Confident	24 Å²	24	40.6 Å²	40.6	15%	0.145	22%	0.224	C	C	.	.	H	α-helix	trans	-69.2	-46.8	177.2	172.7	0	0	0	0	110.5	R245 V246 S249 A266 L267 E268 N272 N273 D274	R245-V270 HydrophobicContact CB-CG1 4.15Å; V246-V270 HydrophobicContact CG2-CB 3.9Å; V246-V270 HydrophobicContact CG2-CG1 3.87Å; V246-V270 HydrophobicContact CG2-CG2 4.11Å; S249-V270 WeakPolarHBondContact OG-CG2 3.41Å; A266-V270 WeakPolarHBondContact O-CG2 3.34Å; A266-V270 PolarHBondContact O-N 2.77Å; L267-V270 PolarHBondContact O-N 3.37Å; E268-V270 VanDerWaalsContact C-N 3.34Å; E268-V270 PolarHBondContact O-N 3.19Å; V270-N272 VanDerWaalsContact C-N 3.3Å; V270-N272 PolarHBondContact O-N 3.49Å; V270-N273 PolarHBondContact O-N 3.42Å; V270-D274 WeakPolarHBondContact O-CB 3.31Å; V270-D274 PolarHBondContact O-N 2.95Å; V270-D274 VanDerWaalsContact O-N 3.14Å
271	I	89.2	Confident	86.9	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-38.9	178.2	-68.8	170.9	0	0	0	111.6	L131 L267 E268 W278 L281	L131-I271 HydrophobicContact CD1-CD1 3.68Å; L267-I271 HydrophobicContact CD1-CD1 3.82Å; L267-I271 HydrophobicContact CD1-CG1 4.43Å; L267-I271 HydrophobicContact CG-CD1 3.98Å; L267-I271 WeakPolarHBondContact O-CG1 3.34Å; L267-I271 PolarHBondContact O-N 3.3Å; L267-I271 VanDerWaalsContact O-N 3.1Å; E268-I271 PolarHBondContact O-N 3.29Å; I271-W278 VanDerWaalsContact O-CB 3.31Å; I271-W278 WeakPolarHBondContact O-CB 3.43Å; I271-L281 HydrophobicContact CD1-CD1 4.02Å; I271-L281 HydrophobicContact CG1-CD1 4.34Å; I271-L281 HydrophobicContact CG2-CD1 3.83Å
272	N	87.8	Confident	87.3	Confident	57 Å²	57	34 Å²	34	31%	0.305	18%	0.181	S	C	.	.	H	α-helix	trans	-71.3	-29.2	-178.8	-74.4	-26.6	0	0	0	113.8	E268 V270 A293	E268-N272 VanDerWaalsContact O-CB 3.29Å; E268-N272 WeakPolarHBondContact O-CB 3.25Å; E268-N272 PolarHBondContact O-N 3.05Å; E268-N272 PolarHBondContact O-ND2 2.78Å; V270-N272 VanDerWaalsContact C-N 3.3Å; V270-N272 PolarHBondContact O-N 3.49Å; N272-A293 HydrophobicContact CB-CB 3.86Å; N272-A293 WeakPolarHBondContact O-CB 3.43Å; N272-A293 PolarHBondContact O-N 3.36Å
273	N	86.2	Confident	87.4	Confident	84 Å²	84	35.2 Å²	35.2	45%	0.449	19%	0.189	S	C	.	.	H	α-helix	trans	-88.8	-17.5	178.7	-72.7	-66.4	0	0	0	113.3	M269 V270 N292	M269-N273 PolarHBondContact O-N 3.14Å; M269-N273 PolarHBondContact O-ND2 3.01Å; V270-N273 PolarHBondContact O-N 3.42Å; N273-N292 WeakPolarHBondContact O-CB 3.14Å
274	D	85.7	Confident	87.1	Confident	29 Å²	29	35 Å²	35	16%	0.155	18%	0.181	C	C	.	.			trans	-88.3	113.5	-179.9	-174.2	-31.8	0	0	0	112.1	R245 V270 E276 L277 W278	R245-D274 WeakPolarHBondContact CD-OD2 3.37Å; R245-D274 IonicContact CZ-OD2 3.96Å; R245-D274 IonicContact NE-OD2 3.42Å; R245-D274 IonicContact NH1-OD1 3.18Å; R245-D274 PolarHBondContact NH1-OD1 3.46Å; R245-D274 IonicContact NH1-OD2 3.21Å; R245-D274 PolarHBondContact NH1-OD2 2.98Å; V270-D274 WeakPolarHBondContact O-CB 3.31Å; V270-D274 PolarHBondContact O-N 2.95Å; V270-D274 VanDerWaalsContact O-N 3.14Å; D274-E276 VanDerWaalsContact C-N 3.29Å; D274-E276 PolarHBondContact O-N 3.08Å; D274-E276 WeakPolarHBondContact OD1-CA 3.33Å; D274-E276 WeakPolarHBondContact OD1-CB 3.27Å; D274-E276 PolarHBondContact OD1-N 3.47Å; D274-L277 HydrophobicContact CB-CB 4.16Å; D274-L277 HydrophobicContact CB-CD1 4.26Å; D274-L277 HydrophobicContact CB-CG 4.38Å; D274-L277 PolarHBondContact O-N 2.87Å; D274-L277 PolarHBondContact OD1-N 2.73Å; D274-L277 WeakPolarHBondContact OD2-CD1 3.46Å; D274-W278 VanDerWaalsContact O-CB 3.24Å; D274-W278 WeakPolarHBondContact O-CB 3.47Å; D274-W278 PolarHBondContact O-N 3.25Å
275	A	81.4	Confident	86.6	Confident	9 Å²	9	37.2 Å²	37.2	7%	0.074	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-14.5	-178.8	0	0	0	0	0	115.2	K291 N292 S298	A275-K291 WeakPolarHBondContact CA-O 3.42Å; A275-N292 HydrophobicContact CB-CB 4.46Å; A275-S298 WeakPolarHBondContact CB-OG 3.39Å
276	E	84.8	Confident	86.3	Confident	25 Å²	25	32.1 Å²	32.1	12%	0.117	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-34.3	174	-54.1	-164	116.5	0	0	111.9	S167 L170 R245 D274	S167-E276 VanDerWaalsContact CB-OE1 3.31Å; S167-E276 WeakPolarHBondContact CB-OE1 3.46Å; S167-E276 PolarHBondContact OG-OE1 3.26Å; L170-E276 HydrophobicContact CD1-CB 3.78Å; L170-E276 HydrophobicContact CG-CB 4.29Å; R245-E276 IonicContact CZ-OE2 2.8Å; R245-E276 VanDerWaalsContact CZ-OE2 3.28Å; R245-E276 IonicContact NH1-OE2 3.62Å; R245-E276 PolarHBondContact NH1-OE2 3.23Å; R245-E276 IonicContact NH2-OE2 2.62Å; R245-E276 PolarHBondContact NH2-OE2 3.16Å; D274-E276 VanDerWaalsContact C-N 3.29Å; D274-E276 PolarHBondContact O-N 3.08Å; D274-E276 WeakPolarHBondContact OD1-CA 3.33Å; D274-E276 WeakPolarHBondContact OD1-CB 3.27Å; D274-E276 PolarHBondContact OD1-N 3.47Å
277	L	88.7	Confident	86.2	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.01	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-44.4	-177.9	-67	177.5	0	0	0	113.1	L170 L238 I242 D274 G279 V280 L281	L170-L277 HydrophobicContact CD1-CD2 3.96Å; L170-L277 HydrophobicContact CD2-CD2 4.46Å; L238-L277 HydrophobicContact CD1-CD2 4.09Å; I242-L277 HydrophobicContact CD1-CD2 4.27Å; I242-L277 HydrophobicContact CG1-CD1 3.84Å; I242-L277 HydrophobicContact CG1-CD2 3.76Å; I242-L277 HydrophobicContact CG1-CG 4.47Å; D274-L277 HydrophobicContact CB-CB 4.16Å; D274-L277 HydrophobicContact CB-CD1 4.26Å; D274-L277 HydrophobicContact CB-CG 4.38Å; D274-L277 PolarHBondContact O-N 2.87Å; D274-L277 PolarHBondContact OD1-N 2.73Å; D274-L277 WeakPolarHBondContact OD2-CD1 3.46Å; L277-G279 PolarHBondContact O-N 3.05Å; L277-V280 PolarHBondContact O-N 2.89Å; L277-L281 WeakPolarHBondContact O-CG 3.32Å; L277-L281 PolarHBondContact O-N 3.25Å
278	W	87	Confident	85.6	Confident	34 Å²	34	31 Å²	31	13%	0.129	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-51.5	-167.9	179.6	70.2	0	0	0	112.5	I271 D274 L281 Q282 I288 K291 A293	I271-W278 VanDerWaalsContact O-CB 3.31Å; I271-W278 WeakPolarHBondContact O-CB 3.43Å; D274-W278 VanDerWaalsContact O-CB 3.24Å; D274-W278 WeakPolarHBondContact O-CB 3.47Å; D274-W278 PolarHBondContact O-N 3.25Å; W278-L281 PolarHBondContact O-N 2.7Å; W278-Q282 HydrophobicContact CD2-CG 4.29Å; W278-Q282 HydrophobicContact CH2-CG 4.44Å; W278-Q282 HydrophobicContact CZ2-CG 4.14Å; W278-Q282 VanDerWaalsContact NE1-NE2 3.14Å; W278-Q282 WeakPolarHBondContact O-CG 3.44Å; W278-Q282 PolarHBondContact O-N 2.81Å; W278-Q282 PolarHBondContact O-NE2 2.7Å; W278-I288 HydrophobicContact CE3-CG2 4.06Å; W278-I288 HydrophobicContact CZ3-CG2 3.59Å; W278-K291 HydrophobicContact CE3-CG 4.34Å; W278-K291 HydrophobicContact CZ3-CD 4.47Å; W278-K291 HydrophobicContact CZ3-CG 3.96Å; W278-A293 HydrophobicContact CD2-CB 4.34Å; W278-A293 HydrophobicContact CG-CB 4.38Å; W278-A293 HydrophobicContact CZ2-CB 4.32Å
279	G	82.7	Confident	84.9	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.01	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-38.2	-172.8	0	0	0	0	0	114.4	L277 L281 Q282 I288	L277-G279 PolarHBondContact O-N 3.05Å; G279-L281 VanDerWaalsContact C-N 3.26Å; G279-L281 PolarHBondContact O-N 3.39Å; G279-Q282 PolarHBondContact O-N 3.06Å; G279-I288 CarbonylContact C-O 3.55Å; G279-I288 WeakPolarHBondContact CA-O 3.45Å
280	V	88.7	Confident	84.1	Confident	7 Å²	7	23.4 Å²	23.4	4%	0.042	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-36.6	174.9	-179.4	0	0	0	0	110.9	A135 R138 V165 L277 Q282 L287	A135-V280 HydrophobicContact CB-CG1 3.98Å; R138-V280 WeakPolarHBondContact CD-O 3.48Å; R138-V280 PolarHBondContact NE-O 3.16Å; V165-V280 HydrophobicContact CG1-CG1 3.98Å; L277-V280 PolarHBondContact O-N 2.89Å; V280-Q282 VanDerWaalsContact C-N 3.33Å; V280-Q282 PolarHBondContact O-N 3.07Å; V280-L287 HydrophobicContact CG2-CD1 4.35Å
281	L	89.7	Confident	83.4	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.016	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	4.5	-177.2	-58.5	178	0	0	0	113.8	L131 R134 A135 I242 I271 L277 W278 G279	L131-L281 HydrophobicContact CB-CD1 4.39Å; L131-L281 HydrophobicContact CB-CD2 4.23Å; L131-L281 HydrophobicContact CD2-CB 4.49Å; R134-L281 WeakPolarHBondContact CD-O 3.42Å; R134-L281 PolarHBondContact NH1-O 3.31Å; A135-L281 HydrophobicContact CB-CD2 4.1Å; I242-L281 HydrophobicContact CD1-CD1 4.39Å; I271-L281 HydrophobicContact CD1-CD1 4.02Å; I271-L281 HydrophobicContact CG1-CD1 4.34Å; I271-L281 HydrophobicContact CG2-CD1 3.83Å; L277-L281 WeakPolarHBondContact O-CG 3.32Å; L277-L281 PolarHBondContact O-N 3.25Å; W278-L281 PolarHBondContact O-N 2.7Å; G279-L281 VanDerWaalsContact C-N 3.26Å; G279-L281 PolarHBondContact O-N 3.39Å
282	Q	87.9	Confident	83	Confident	31 Å²	31	24.3 Å²	24.3	15%	0.145	13%	0.126	C	C	.	.	S	Bend	trans	-75.5	155	173.1	-68	-41.2	-61.4	0	0	113.1	R138 W278 G279 V280 Y284 I288	R138-Q282 PolarHBondContact NH2-O 3.14Å; W278-Q282 HydrophobicContact CD2-CG 4.29Å; W278-Q282 HydrophobicContact CH2-CG 4.44Å; W278-Q282 HydrophobicContact CZ2-CG 4.14Å; W278-Q282 VanDerWaalsContact NE1-NE2 3.14Å; W278-Q282 WeakPolarHBondContact O-CG 3.44Å; W278-Q282 PolarHBondContact O-N 2.81Å; W278-Q282 PolarHBondContact O-NE2 2.7Å; G279-Q282 PolarHBondContact O-N 3.06Å; V280-Q282 VanDerWaalsContact C-N 3.33Å; V280-Q282 PolarHBondContact O-N 3.07Å; Q282-Y284 HydrophobicContact CB-CD2 3.86Å; Q282-Y284 HydrophobicContact CB-CE2 4.14Å; Q282-Y284 PolarHBondContact O-N 2.93Å; Q282-I288 HydrophobicContact CB-CD1 4.35Å; Q282-I288 HydrophobicContact CG-CD1 4.24Å
283	P	84.4	Confident	82.6	Confident	29 Å²	29	23.5 Å²	23.5	19%	0.188	13%	0.127	C	C	.	.	S	Bend	trans	-82.8	-1.7	-175.3	34.1	-37.3	0	0	0	115.2	R90 L91	R90-P283 CarbonylContact C-O 3.16Å; R90-P283 VanDerWaalsContact CA-O 3.31Å; R90-P283 WeakPolarHBondContact CA-O 3.44Å; L91-P283 PolarHBondContact N-O 3.31Å
284	Y	83.2	Confident	82.1	Confident	39 Å²	39	25.3 Å²	25.3	15%	0.153	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-80.8	150.9	-175.5	-47.4	-69.4	0	0	0	112.7	F85 C88 P89 R138 Q282 H286 I288	F85-Y284 HydrophobicContact CB-CE1 3.99Å; F85-Y284 HydrophobicContact CD1-CD1 4.43Å; F85-Y284 HydrophobicContact CD1-CD2 4.34Å; F85-Y284 HydrophobicContact CD1-CE1 4.03Å; F85-Y284 AromaticContact CD1-CE2 3.94Å; F85-Y284 HydrophobicContact CD1-CE2 3.94Å; F85-Y284 AromaticContact CD1-CZ 3.78Å; F85-Y284 HydrophobicContact CE1-CE2 4.48Å; F85-Y284 HydrophobicContact CG-CE1 4.47Å; F85-Y284 WeakPolarHBondContact O-CE1 3.37Å; C88-Y284 HydrophobicContact CB-CD1 3.94Å; C88-Y284 HydrophobicContact CB-CE1 4.49Å; P89-Y284 WeakPolarHBondContact O-CA 3.26Å; R138-Y284 VanDerWaalsContact CZ-O 3.25Å; R138-Y284 PolarHBondContact NH1-O 3.36Å; R138-Y284 VanDerWaalsContact NH1-O 3.07Å; R138-Y284 PolarHBondContact NH2-O 2.93Å; Q282-Y284 HydrophobicContact CB-CD2 3.86Å; Q282-Y284 HydrophobicContact CB-CE2 4.14Å; Q282-Y284 PolarHBondContact O-N 2.93Å; Y284-H286 VanDerWaalsContact CB-CE1 3.48Å; Y284-H286 WeakPolarHBondContact CB-CE1 3.44Å; Y284-H286 AromaticContact CG-CE1 3.9Å; Y284-I288 HydrophobicContact CD2-CD1 3.63Å; Y284-I288 HydrophobicContact CE2-CD1 4.08Å
285	E	78.3	Confident	81.3	Confident	54 Å²	54	25.1 Å²	25.1	25%	0.252	14%	0.141	S	C	.	.	S	Bend	trans	-62	-50.7	178	-68.8	-163	112	0	0	112.7	P89 R90 R138 R141	P89-E285 HydrophobicContact CB-CB 4.23Å; P89-E285 HydrophobicContact CB-CG 3.81Å; P89-E285 WeakPolarHBondContact CB-OE2 3.44Å; P89-E285 PolarHBondContact O-N 3.32Å; R90-E285 WeakPolarHBondContact O-CG 3.37Å; R138-E285 PolarHBondContact NH1-O 2.88Å; R141-E285 IonicContact CZ-OE1 2.7Å; R141-E285 VanDerWaalsContact CZ-OE1 3.3Å; R141-E285 IonicContact NH1-OE1 3.7Å; R141-E285 PolarHBondContact NH1-OE1 2.99Å; R141-E285 IonicContact NH2-OE1 3.81Å; R141-E285 PolarHBondContact NH2-OE1 3.44Å
286	H	80.6	Confident	81	Confident	18 Å²	18	28.5 Å²	28.5	8%	0.083	16%	0.161	C	C	.	.	S	Bend	trans	-58.5	145.3	175.1	66.2	-81.9	0	0	0	110.9	R138 Y284	R138-H286 PolarHBondContact NH1-O 3.1Å; Y284-H286 VanDerWaalsContact CB-CE1 3.48Å; Y284-H286 WeakPolarHBondContact CB-CE1 3.44Å; Y284-H286 AromaticContact CG-CE1 3.9Å
287	L	84.8	Confident	80.6	Confident	3 Å²	3	29.1 Å²	29.1	2%	0.016	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-77.6	122.3	174.9	-176.3	66.2	0	0	0	109.1	L164 V165 V280 C289 L453 L454	L164-L287 WeakPolarHBondContact O-CD2 3.49Å; V165-L287 HydrophobicContact CG1-CD1 4.43Å; V165-L287 WeakPolarHBondContact O-CD1 3.43Å; V280-L287 HydrophobicContact CG2-CD1 4.35Å; L287-C289 HydrophobicContact CD2-CB 4.4Å; L287-C289 HydrophobicContact CG-CB 4.29Å; L287-L453 HydrophobicContact CB-CD1 3.94Å; L287-L453 HydrophobicContact CB-CG 4.01Å; L287-L453 WeakPolarHBondContact CB-O 3.29Å; L287-L453 HydrophobicContact CD2-CD2 4.28Å; L287-L453 HydrophobicContact CD2-CG 4.3Å; L287-L453 PolarHBondContact N-O 2.9Å; L287-L454 HydrophobicContact CD2-CD2 4.42Å
288	I	79.3	Confident	79.9	Confident	10 Å²	10	31.4 Å²	31.4	5%	0.051	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-93.1	130.2	165.4	-61.6	176.6	0	0	0	107	F85 W278 G279 Q282 Y284 K291	F85-I288 HydrophobicContact CE1-CD1 4.31Å; W278-I288 HydrophobicContact CE3-CG2 4.06Å; W278-I288 HydrophobicContact CZ3-CG2 3.59Å; G279-I288 CarbonylContact C-O 3.55Å; G279-I288 WeakPolarHBondContact CA-O 3.45Å; Q282-I288 HydrophobicContact CB-CD1 4.35Å; Q282-I288 HydrophobicContact CG-CD1 4.24Å; Y284-I288 HydrophobicContact CD2-CD1 3.63Å; Y284-I288 HydrophobicContact CE2-CD1 4.08Å; I288-K291 HydrophobicContact CG2-CD 4.37Å; I288-K291 HydrophobicContact CG2-CG 4.1Å
289	C	73.6	Confident	79.1	Confident	19 Å²	19	30.6 Å²	30.6	13%	0.128	18%	0.179	C	C	.	.			trans	-152.2	156.1	-176.3	40.3	0	0	0	0	111.3	L287 K291 E425 L454	L287-C289 HydrophobicContact CD2-CB 4.4Å; L287-C289 HydrophobicContact CG-CB 4.29Å; C289-K291 VanDerWaalsContact C-N 3.29Å; C289-K291 PolarHBondContact O-N 3.3Å; C289-E425 HydrophobicContact CB-CG 4.11Å; C289-E425 PolarHBondContact SG-OE2 2.78Å; C289-L454 WeakPolarHBondContact SG-CD2 3.35Å
290	G	72.5	Confident	78.5	Confident	8 Å²	8	31 Å²	31	8%	0.082	18%	0.182	C	C	.	.	S	Bend	trans	73.7	8.6	178.2	0	0	0	0	0	115.8	L297 S298	G290-L297 VanDerWaalsContact O-CA 3.3Å; G290-L297 WeakPolarHBondContact O-CA 3.28Å; G290-S298 PolarHBondContact O-N 3.41Å
291	K	75.6	Confident	77.3	Confident	28 Å²	28	33.2 Å²	33.2	12%	0.122	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-142.7	151.9	178	74.7	-173.2	-173.2	-173.7	0	113.7	A275 W278 I288 C289 V296 L297	A275-K291 WeakPolarHBondContact CA-O 3.42Å; W278-K291 HydrophobicContact CE3-CG 4.34Å; W278-K291 HydrophobicContact CZ3-CD 4.47Å; W278-K291 HydrophobicContact CZ3-CG 3.96Å; I288-K291 HydrophobicContact CG2-CD 4.37Å; I288-K291 HydrophobicContact CG2-CG 4.1Å; C289-K291 VanDerWaalsContact C-N 3.29Å; C289-K291 PolarHBondContact O-N 3.3Å; K291-V296 VanDerWaalsContact CA-O 3.24Å; K291-V296 WeakPolarHBondContact CA-O 3.41Å; K291-V296 WeakPolarHBondContact CB-O 3.44Å; K291-L297 HydrophobicContact CB-CD2 4.18Å
292	N	80.9	Confident	76	Confident	21 Å²	21	36.4 Å²	36.4	11%	0.112	21%	0.213	C	C	.	.			trans	-89.2	-179.2	173.1	70.6	11.5	0	0	0	112.5	N273 A275 N294 G295 V296	N273-N292 WeakPolarHBondContact O-CB 3.14Å; A275-N292 HydrophobicContact CB-CB 4.46Å; N292-N294 PolarHBondContact O-N 3.36Å; N292-N294 PolarHBondContact OD1-N 3.19Å; N292-N294 VanDerWaalsContact OD1-N 3.1Å; N292-G295 PolarHBondContact O-N 2.87Å; N292-G295 PolarHBondContact OD1-N 3.48Å; N292-V296 PolarHBondContact N-O 3.01Å; N292-V296 PolarHBondContact OD1-N 3.03Å
293	A	79.4	Confident	74.7	Confident	40 Å²	40	36.5 Å²	36.5	33%	0.331	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-28.4	180	0	0	0	0	0	114	N272 W278 G295	N272-A293 HydrophobicContact CB-CB 3.86Å; N272-A293 WeakPolarHBondContact O-CB 3.43Å; N272-A293 PolarHBondContact O-N 3.36Å; W278-A293 HydrophobicContact CD2-CB 4.34Å; W278-A293 HydrophobicContact CG-CB 4.38Å; W278-A293 HydrophobicContact CZ2-CB 4.32Å; A293-G295 PolarHBondContact O-N 2.9Å
294	N	74.1	Confident	73.6	Confident	121 Å²	121	36.9 Å²	36.9	65%	0.647	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	3.5	178.6	-55.3	-24.1	0	0	0	112.4	N292 V296	N292-N294 PolarHBondContact O-N 3.36Å; N292-N294 PolarHBondContact OD1-N 3.19Å; N292-N294 VanDerWaalsContact OD1-N 3.1Å; N294-V296 VanDerWaalsContact C-N 3.26Å; N294-V296 HydrophobicContact CB-CG2 4.33Å; N294-V296 PolarHBondContact O-N 2.99Å
295	G	69.4	Low	72	Confident	25 Å²	25	37 Å²	37	26%	0.258	22%	0.222	S	C	.	.			trans	76.5	5.5	-179.7	0	0	0	0	0	115	N292 A293 L297	N292-G295 PolarHBondContact O-N 2.87Å; N292-G295 PolarHBondContact OD1-N 3.48Å; A293-G295 PolarHBondContact O-N 2.9Å; G295-L297 PolarHBondContact O-N 3.49Å
296	V	74.6	Confident	70.7	Confident	81 Å²	81	42.4 Å²	42.4	49%	0.491	24%	0.241	S	C	.	.			trans	-71.6	122.8	178.3	-177.8	0	0	0	0	109.1	K291 N292 N294	K291-V296 VanDerWaalsContact CA-O 3.24Å; K291-V296 WeakPolarHBondContact CA-O 3.41Å; K291-V296 WeakPolarHBondContact CB-O 3.44Å; N292-V296 PolarHBondContact N-O 3.01Å; N292-V296 PolarHBondContact OD1-N 3.03Å; N294-V296 VanDerWaalsContact C-N 3.26Å; N294-V296 HydrophobicContact CB-CG2 4.33Å; N294-V296 PolarHBondContact O-N 2.99Å
297	L	76.8	Confident	69	Low	37 Å²	37	47.2 Å²	47.2	19%	0.194	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-73.1	138.4	172.5	-68.3	170.4	0	0	0	110.2	G290 K291 G295 L333 T335 P422	G290-L297 VanDerWaalsContact O-CA 3.3Å; G290-L297 WeakPolarHBondContact O-CA 3.28Å; K291-L297 HydrophobicContact CB-CD2 4.18Å; G295-L297 PolarHBondContact O-N 3.49Å; L297-L333 HydrophobicContact CB-CD2 4.27Å; L297-T335 HydrophobicContact CD1-CG2 4.1Å; L297-P422 HydrophobicContact CD2-CG 4.15Å
298	S	73.5	Confident	66.8	Low	50 Å²	50	50.3 Å²	50.3	35%	0.35	30%	0.3	S	S	.	.			trans	-149.6	139.6	174.9	66.4	0	0	0	0	112.1	A275 G290	A275-S298 WeakPolarHBondContact CB-OG 3.39Å; G290-S298 PolarHBondContact O-N 3.41Å
299	L	71.6	Confident	64.8	Low	18 Å²	18	53 Å²	53	9%	0.094	33%	0.33	C	S	.	.			trans	-68.2	145.6	170.8	-63.9	177.7	0	0	0	111.5	F303 E329 L332 L333 M424	L299-F303 HydrophobicContact CB-CB 4.23Å; L299-F303 HydrophobicContact CD1-CB 4.3Å; L299-E329 HydrophobicContact CD1-CB 3.8Å; L299-E329 HydrophobicContact CD1-CG 3.69Å; L299-E329 HydrophobicContact CG-CG 4.42Å; L299-L332 HydrophobicContact CD2-CB 3.84Å; L299-L332 HydrophobicContact CD2-CD1 4.18Å; L299-L333 HydrophobicContact CD2-CD2 3.72Å; L299-L333 HydrophobicContact CD2-CG 4Å; L299-L333 HydrophobicContact CG-CD1 4.48Å; L299-L333 HydrophobicContact CG-CD2 4.11Å; L299-L333 HydrophobicContact CG-CG 4.24Å; L299-M424 HydrophobicContact CD2-SD 3.5Å; L299-M424 VanDerWaalsContact CD2-SD 3.5Å
300	P	68.8	Low	63	Low	9 Å²	9	58.1 Å²	58.1	6%	0.058	37%	0.366	C	S	.	.			trans	-51.8	149.4	166.6	-27.3	35.3	0	0	0	111.8	Y302 F303 S304 M424	P300-Y302 PolarHBondContact O-N 3.48Å; P300-F303 HydrophobicContact CB-CD2 4.39Å; P300-F303 HydrophobicContact CG-CD2 4.37Å; P300-F303 PolarHBondContact O-N 2.84Å; P300-S304 PolarHBondContact O-N 3.25Å; P300-M424 HydrophobicContact CG-CE 3.65Å
301	A	64.6	Low	61.3	Low	53 Å²	53	65.4 Å²	65.4	44%	0.438	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.3	-179.2	0	0	0	0	0	114
302	Y	61.3	Low	59.6	Low	70 Å²	70	67.4 Å²	67.4	28%	0.275	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-33.7	173.3	-176.9	-87.4	0	0	0	113.9	P300 R357	P300-Y302 PolarHBondContact O-N 3.48Å; Y302-R357 PolarHBondContact OH-O 2.82Å; Y302-R357 VanDerWaalsContact OH-O 3.08Å
303	F	61.7	Low	57.8	Low	33 Å²	33	74.5 Å²	74.5	15%	0.145	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-9.1	178.1	-64.6	-71.8	0	0	0	113	W168 L299 P300 P305 M354	W168-F303 HydrophobicContact CB-CE2 4.3Å; W168-F303 HydrophobicContact CD2-CE2 4.13Å; W168-F303 HydrophobicContact CD2-CZ 4.28Å; W168-F303 HydrophobicContact CE3-CE2 4.41Å; W168-F303 HydrophobicContact CE3-CZ 4.48Å; W168-F303 HydrophobicContact CG-CE2 4.07Å; L299-F303 HydrophobicContact CB-CB 4.23Å; L299-F303 HydrophobicContact CD1-CB 4.3Å; P300-F303 HydrophobicContact CB-CD2 4.39Å; P300-F303 HydrophobicContact CG-CD2 4.37Å; P300-F303 PolarHBondContact O-N 2.84Å; F303-P305 WeakPolarHBondContact O-CD 3.27Å; F303-M354 HydrophobicContact CE1-CG 4.12Å; F303-M354 HydrophobicContact CZ-CG 4.37Å
304	S	60.3	Low	56	Low	38 Å²	38	77.8 Å²	77.8	27%	0.266	48%	0.475	S	S	.	.			trans	-67	120.9	177.8	-179.9	0	0	0	0	111.2	P300 Y306 N307	P300-S304 PolarHBondContact O-N 3.25Å; S304-Y306 PolarHBondContact O-N 3.01Å; S304-Y306 VanDerWaalsContact O-N 3.09Å; S304-N307 PolarHBondContact O-N 3.01Å
305	P	50.9	Low	54.8	Low	42 Å²	42	79.2 Å²	79.2	27%	0.273	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-8.1	-176.5	27.8	-33.9	0	0	0	113.8	F303 L325	F303-P305 WeakPolarHBondContact O-CD 3.27Å; P305-L325 HydrophobicContact CB-CB 4.04Å; P305-L325 HydrophobicContact CB-CD1 4.02Å; P305-L325 HydrophobicContact CB-CG 4.45Å
306	Y	50.8	Low	53.8	Low	167 Å²	167	88.1 Å²	88.1	66%	0.655	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-9	-174.5	-60.9	-76	0	0	0	114.6	S304	S304-Y306 PolarHBondContact O-N 3.01Å; S304-Y306 VanDerWaalsContact O-N 3.09Å
307	N	45.5	Very low	52.5	Low	119 Å²	119	87 Å²	87	64%	0.636	50%	0.503	S	S	*	.			trans	-98.8	0.9	-172	-140.7	32	0	0	0	114	S304	S304-N307 PolarHBondContact O-N 3.01Å
308	G	37.4	Very low	51.5	Low	67 Å²	67	88.4 Å²	88.4	69%	0.691	51%	0.51	S	S	*	.	S	Bend	trans	-79.7	115.9	172.6	0	0	0	0	0	111.1
309	G	37.4	Very low	50.8	Low	67 Å²	67	88.6 Å²	88.6	69%	0.691	52%	0.515	S	S	*	.			trans	-58.3	139.9	178	0	0	0	0	0	112.9	L311	G309-L311 PolarHBondContact O-N 3.01Å; G309-L311 VanDerWaalsContact O-N 3.14Å
310	S	36.4	Very low	50.3	Low	126 Å²	126	95.9 Å²	95.9	88%	0.881	54%	0.543	S	S	*	.			trans	-42.6	112	-177.4	-173.7	0	0	0	0	113.9
311	L	36.7	Very low	50.1	Low	162 Å²	162	97.6 Å²	97.6	85%	0.848	56%	0.557	S	S	*	*			trans	-105.4	135.2	161.4	-77.9	165.4	0	0	0	107.6	G309	G309-L311 PolarHBondContact O-N 3.01Å; G309-L311 VanDerWaalsContact O-N 3.14Å
312	G	38.9	Very low	50.1	Low	70 Å²	70	100.3 Å²	100.3	72%	0.722	56%	0.561	S	S	*	*			trans	-78.9	132.9	-156.8	0	0	0	0	0	116.1
313	H	43.5	Very low	50.4	Low	170 Å²	170	101.9 Å²	101.9	79%	0.787	57%	0.574	S	S	*	*			trans	38.6	91.2	152	-82.7	-74.4	0	0	0	118.3
314	D	41.6	Very low	50.8	Low	108 Å²	108	105.5 Å²	105.5	58%	0.578	59%	0.591	S	S	*	*			trans	-145.4	88.8	137	-162.3	-5.9	0	0	0	111.1	R316 A317 D318	D314-R316 PolarHBondContact O-N 3.39Å; D314-A317 HydrophobicContact CB-CB 4.44Å; D314-A317 PolarHBondContact O-N 3.24Å; D314-D318 PolarHBondContact N-OD2 3.12Å; D314-D318 PolarHBondContact O-N 3.31Å; D314-D318 VanDerWaalsContact O-N 3.14Å
315	E	50.1	Low	51.2	Low	151 Å²	151	106.1 Å²	106.1	71%	0.706	59%	0.591	S	S	*	*	H	α-helix	trans	-54.1	-20.3	-162.4	-62.8	-178	156.4	0	0	115.9
316	R	48.4	Very low	52.1	Low	213 Å²	213	110.7 Å²	110.7	80%	0.804	60%	0.603	S	S	*	*	H	α-helix	trans	-94.7	-32.4	178.6	-75.5	-177.7	176.8	159	1	114.1	D314 Y320	D314-R316 PolarHBondContact O-N 3.39Å; R316-Y320 WeakPolarHBondContact O-CD2 3.23Å
317	A	46.4	Very low	53.1	Low	57 Å²	57	105.5 Å²	105.5	47%	0.471	59%	0.589	S	S	.	*	H	α-helix	trans	-70.1	-41.1	172.9	0	0	0	0	0	109.9	D314 A319 Y320 A321	D314-A317 HydrophobicContact CB-CB 4.44Å; D314-A317 PolarHBondContact O-N 3.24Å; A317-A319 VanDerWaalsContact C-N 3.3Å; A317-A319 PolarHBondContact O-N 3.43Å; A317-Y320 PolarHBondContact O-N 3.44Å; A317-A321 PolarHBondContact O-N 2.93Å; A317-A321 VanDerWaalsContact O-N 3.13Å
318	D	56.2	Low	54.5	Low	66 Å²	66	100.7 Å²	100.7	35%	0.353	56%	0.563	S	S	.	*	H	α-helix	trans	-59.4	-38.1	176.7	-66.9	-35.1	0	0	0	112.4	D314 A321 Q322	D314-D318 PolarHBondContact N-OD2 3.12Å; D314-D318 PolarHBondContact O-N 3.31Å; D314-D318 VanDerWaalsContact O-N 3.14Å; D318-A321 PolarHBondContact O-N 2.63Å; D318-Q322 VanDerWaalsContact O-CB 3.3Å; D318-Q322 WeakPolarHBondContact O-CB 3.47Å; D318-Q322 WeakPolarHBondContact O-CG 3.35Å; D318-Q322 PolarHBondContact O-N 2.67Å
319	A	57.6	Low	56.3	Low	54 Å²	54	99.8 Å²	99.8	45%	0.446	54%	0.541	S	S	.	.	H	α-helix	trans	-66.4	-40	-179.5	0	0	0	0	0	113.6	A317 L323	A317-A319 VanDerWaalsContact C-N 3.3Å; A317-A319 PolarHBondContact O-N 3.43Å; A319-L323 PolarHBondContact O-N 3.4Å; A319-L323 VanDerWaalsContact O-N 3.13Å
320	Y	62.1	Low	58.1	Low	171 Å²	171	101.5 Å²	101.5	67%	0.671	53%	0.531	S	S	*	.	H	α-helix	trans	-70.3	-43.5	174.9	-81.7	-79.9	0	0	0	111.3	R316 A317 Q322 L323 E324	R316-Y320 WeakPolarHBondContact O-CD2 3.23Å; A317-Y320 PolarHBondContact O-N 3.44Å; Y320-Q322 VanDerWaalsContact C-N 3.32Å; Y320-Q322 PolarHBondContact O-N 2.93Å; Y320-L323 PolarHBondContact O-N 3.05Å; Y320-L323 VanDerWaalsContact O-N 3.11Å; Y320-E324 PolarHBondContact O-N 2.66Å
321	A	63.7	Low	60.2	Low	45 Å²	45	95.7 Å²	95.7	37%	0.372	49%	0.49	S	S	.	.	H	α-helix	trans	-60.4	-40.6	175.8	0	0	0	0	0	112.1	A317 D318 L323 E324 L325	A317-A321 PolarHBondContact O-N 2.93Å; A317-A321 VanDerWaalsContact O-N 3.13Å; D318-A321 PolarHBondContact O-N 2.63Å; A321-L323 VanDerWaalsContact C-N 3.34Å; A321-L323 PolarHBondContact O-N 3.01Å; A321-E324 PolarHBondContact O-N 3.31Å; A321-L325 WeakPolarHBondContact O-CB 3.48Å; A321-L325 WeakPolarHBondContact O-CD1 3.41Å; A321-L325 WeakPolarHBondContact O-CG 3.23Å; A321-L325 PolarHBondContact O-N 3.28Å
322	Q	65.4	Low	62.3	Low	111 Å²	111	88.2 Å²	88.2	52%	0.519	45%	0.451	S	S	.	.	H	α-helix	trans	-65.7	-33.3	174.5	-74	171	24.4	0	0	112.9	D318 Y320 R326	D318-Q322 VanDerWaalsContact O-CB 3.3Å; D318-Q322 WeakPolarHBondContact O-CB 3.47Å; D318-Q322 WeakPolarHBondContact O-CG 3.35Å; D318-Q322 PolarHBondContact O-N 2.67Å; Y320-Q322 VanDerWaalsContact C-N 3.32Å; Y320-Q322 PolarHBondContact O-N 2.93Å; Q322-R326 WeakPolarHBondContact O-CG 3.33Å; Q322-R326 PolarHBondContact O-N 3.1Å
323	L	67.9	Low	64.4	Low	102 Å²	102	85.7 Å²	85.7	53%	0.534	42%	0.421	S	S	.	.	H	α-helix	trans	-72.5	-42	176	-174.2	65	0	0	0	111.9	A319 Y320 A321 L325 R326 T327	A319-L323 PolarHBondContact O-N 3.4Å; A319-L323 VanDerWaalsContact O-N 3.13Å; Y320-L323 PolarHBondContact O-N 3.05Å; Y320-L323 VanDerWaalsContact O-N 3.11Å; A321-L323 VanDerWaalsContact C-N 3.34Å; A321-L323 PolarHBondContact O-N 3.01Å; L323-L325 VanDerWaalsContact C-N 3.32Å; L323-L325 PolarHBondContact O-N 3.43Å; L323-R326 PolarHBondContact O-N 2.96Å; L323-T327 WeakPolarHBondContact O-CG2 3.31Å; L323-T327 PolarHBondContact O-N 3.46Å; L323-T327 PolarHBondContact O-OG1 3.05Å
324	E	68.6	Low	66.3	Low	109 Å²	109	78.3 Å²	78.3	51%	0.509	39%	0.39	S	S	.	.	H	α-helix	trans	-60.2	-42.7	171.7	-72.4	-175.6	175.7	0	0	111.1	Y320 A321 T327 L328	Y320-E324 PolarHBondContact O-N 2.66Å; A321-E324 PolarHBondContact O-N 3.31Å; E324-T327 WeakPolarHBondContact CA-OG1 3.29Å; E324-T327 PolarHBondContact O-N 3.16Å; E324-T327 PolarHBondContact O-OG1 3.16Å; E324-L328 VanDerWaalsContact O-CB 3.29Å; E324-L328 WeakPolarHBondContact O-CB 3.41Å; E324-L328 PolarHBondContact O-N 2.89Å
325	L	69.2	Low	68.1	Low	51 Å²	51	73.5 Å²	73.5	27%	0.267	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-41.2	176.3	-73.5	167.2	0	0	0	113.1	P305 A321 L323 L328 E329	P305-L325 HydrophobicContact CB-CB 4.04Å; P305-L325 HydrophobicContact CB-CD1 4.02Å; P305-L325 HydrophobicContact CB-CG 4.45Å; A321-L325 WeakPolarHBondContact O-CB 3.48Å; A321-L325 WeakPolarHBondContact O-CD1 3.41Å; A321-L325 WeakPolarHBondContact O-CG 3.23Å; A321-L325 PolarHBondContact O-N 3.28Å; L323-L325 VanDerWaalsContact C-N 3.32Å; L323-L325 PolarHBondContact O-N 3.43Å; L325-L328 PolarHBondContact O-N 3.29Å; L325-E329 WeakPolarHBondContact O-CB 3.35Å; L325-E329 PolarHBondContact O-N 3.38Å
326	R	70.4	Confident	69.3	Low	138 Å²	138	67.5 Å²	67.5	52%	0.521	34%	0.339	S	S	.	.	H	α-helix	trans	-67.4	-39.2	175.9	-77.1	-177.5	-175.3	177.1	6.3	113.2	Q322 L323 E329 Q330	Q322-R326 WeakPolarHBondContact O-CG 3.33Å; Q322-R326 PolarHBondContact O-N 3.1Å; L323-R326 PolarHBondContact O-N 2.96Å; R326-E329 PolarHBondContact O-N 2.92Å; R326-Q330 WeakPolarHBondContact O-CG 3.41Å; R326-Q330 PolarHBondContact O-N 3.21Å
327	T	71.5	Confident	70.8	Confident	58 Å²	58	57.5 Å²	57.5	36%	0.356	30%	0.301	S	S	.	.	H	α-helix	trans	-72.2	-31.8	177.4	50	0	0	0	0	111.9	L323 E324 S331	L323-T327 WeakPolarHBondContact O-CG2 3.31Å; L323-T327 PolarHBondContact O-N 3.46Å; L323-T327 PolarHBondContact O-OG1 3.05Å; E324-T327 WeakPolarHBondContact CA-OG1 3.29Å; E324-T327 PolarHBondContact O-N 3.16Å; E324-T327 PolarHBondContact O-OG1 3.16Å; T327-S331 WeakPolarHBondContact O-CB 3.21Å; T327-S331 PolarHBondContact O-N 3.23Å; T327-S331 PolarHBondContact O-OG 2.95Å
328	L	74.6	Confident	72	Confident	18 Å²	18	55.1 Å²	55.1	9%	0.094	28%	0.282	C	S	.	.	H	α-helix	trans	-64.6	-44.9	166.6	177.3	65.1	0	0	0	111.7	E324 L325 S331 L332 A350 H353	E324-L328 VanDerWaalsContact O-CB 3.29Å; E324-L328 WeakPolarHBondContact O-CB 3.41Å; E324-L328 PolarHBondContact O-N 2.89Å; L325-L328 PolarHBondContact O-N 3.29Å; L328-S331 WeakPolarHBondContact O-CB 3.3Å; L328-S331 PolarHBondContact O-N 3.37Å; L328-S331 VanDerWaalsContact O-N 3.09Å; L328-L332 HydrophobicContact CD1-CD1 4.01Å; L328-L332 HydrophobicContact CD1-CG 4.05Å; L328-L332 HydrophobicContact CG-CD1 3.92Å; L328-L332 HydrophobicContact CG-CG 4.35Å; L328-L332 WeakPolarHBondContact O-CB 3.45Å; L328-L332 WeakPolarHBondContact O-CG 3.33Å; L328-L332 PolarHBondContact O-N 3Å; L328-A350 HydrophobicContact CD1-CB 4.45Å; L328-H353 HydrophobicContact CD1-CB 3.86Å; L328-H353 HydrophobicContact CD2-CB 3.61Å; L328-H353 HydrophobicContact CG-CB 4.37Å
329	E	76.1	Confident	73.1	Confident	48 Å²	48	53 Å²	53	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-48	176.9	169.8	168.5	-138.8	0	0	111.7	L299 L325 R326 S331 L332 L333	L299-E329 HydrophobicContact CD1-CB 3.8Å; L299-E329 HydrophobicContact CD1-CG 3.69Å; L299-E329 HydrophobicContact CG-CG 4.42Å; L325-E329 WeakPolarHBondContact O-CB 3.35Å; L325-E329 PolarHBondContact O-N 3.38Å; R326-E329 PolarHBondContact O-N 2.92Å; E329-S331 VanDerWaalsContact C-N 3.28Å; E329-S331 PolarHBondContact O-N 3.13Å; E329-L332 PolarHBondContact O-N 3.12Å; E329-L333 HydrophobicContact CG-CD1 3.85Å; E329-L333 WeakPolarHBondContact O-CB 3.48Å; E329-L333 VanDerWaalsContact O-CG 3.32Å; E329-L333 WeakPolarHBondContact O-CG 3.45Å; E329-L333 PolarHBondContact O-N 2.83Å
330	Q	75.9	Confident	74.4	Confident	103 Å²	103	53.1 Å²	53.1	48%	0.481	27%	0.265	S	S	.	.	H	α-helix	trans	-58.1	-39.3	171.6	-72.3	175.3	-32.2	0	0	112.3	R326 A334	R326-Q330 WeakPolarHBondContact O-CG 3.41Å; R326-Q330 PolarHBondContact O-N 3.21Å; Q330-A334 PolarHBondContact O-N 2.96Å
331	S	79.8	Confident	75.4	Confident	5 Å²	5	49 Å²	49	4%	0.035	26%	0.261	C	S	.	.	H	α-helix	trans	-67.8	-40	178.5	-58.7	0	0	0	0	112.6	T327 L328 E329 L346	T327-S331 WeakPolarHBondContact O-CB 3.21Å; T327-S331 PolarHBondContact O-N 3.23Å; T327-S331 PolarHBondContact O-OG 2.95Å; L328-S331 WeakPolarHBondContact O-CB 3.3Å; L328-S331 PolarHBondContact O-N 3.37Å; L328-S331 VanDerWaalsContact O-N 3.09Å; E329-S331 VanDerWaalsContact C-N 3.28Å; E329-S331 PolarHBondContact O-N 3.13Å; S331-L346 WeakPolarHBondContact OG-CD2 3.37Å
332	L	81.1	Confident	76.4	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.021	26%	0.26	C	S	.	.	H	α-helix	trans	-75	-33.6	-179.1	-73.7	175.6	0	0	0	112.7	L299 L328 E329 A350 L423 M424	L299-L332 HydrophobicContact CD2-CB 3.84Å; L299-L332 HydrophobicContact CD2-CD1 4.18Å; L328-L332 HydrophobicContact CD1-CD1 4.01Å; L328-L332 HydrophobicContact CD1-CG 4.05Å; L328-L332 HydrophobicContact CG-CD1 3.92Å; L328-L332 HydrophobicContact CG-CG 4.35Å; L328-L332 WeakPolarHBondContact O-CB 3.45Å; L328-L332 WeakPolarHBondContact O-CG 3.33Å; L328-L332 PolarHBondContact O-N 3Å; E329-L332 PolarHBondContact O-N 3.12Å; L332-A350 HydrophobicContact CD2-CB 3.79Å; L332-L423 PolarHBondContact O-N 3.33Å; L332-M424 HydrophobicContact CB-CB 4.08Å; L332-M424 HydrophobicContact CD2-CB 3.89Å; L332-M424 PolarHBondContact O-N 3.03Å
333	L	82.7	Confident	77.4	Confident	17 Å²	17	45 Å²	45	9%	0.089	24%	0.235	C	C	.	.	H	α-helix	trans	-84.5	-5.6	178.7	-64.8	179.8	0	0	0	114	L297 L299 E329 T335 P422	L297-L333 HydrophobicContact CB-CD2 4.27Å; L299-L333 HydrophobicContact CD2-CD2 3.72Å; L299-L333 HydrophobicContact CD2-CG 4Å; L299-L333 HydrophobicContact CG-CD1 4.48Å; L299-L333 HydrophobicContact CG-CD2 4.11Å; L299-L333 HydrophobicContact CG-CG 4.24Å; E329-L333 HydrophobicContact CG-CD1 3.85Å; E329-L333 WeakPolarHBondContact O-CB 3.48Å; E329-L333 VanDerWaalsContact O-CG 3.32Å; E329-L333 WeakPolarHBondContact O-CG 3.45Å; E329-L333 PolarHBondContact O-N 2.83Å; L333-T335 PolarHBondContact O-N 3.36Å; L333-P422 HydrophobicContact CD2-CB 4.47Å
334	A	82.8	Confident	78.3	Confident	16 Å²	16	42.3 Å²	42.3	13%	0.132	23%	0.225	C	C	.	.			trans	-58.2	126.9	178	0	0	0	0	0	111.8	Q330 L423	Q330-A334 PolarHBondContact O-N 2.96Å; A334-L423 WeakPolarHBondContact O-CB 3.37Å; A334-L423 PolarHBondContact O-N 3.34Å
335	T	79.3	Confident	79	Confident	7 Å²	7	40.9 Å²	40.9	4%	0.043	22%	0.22	C	C	.	.			trans	-108.1	-11.5	-178.7	53.1	0	0	0	0	113.7	L297 L333 L420 P422	L297-T335 HydrophobicContact CD1-CG2 4.1Å; L333-T335 PolarHBondContact O-N 3.36Å; T335-L420 WeakPolarHBondContact CG2-O 3.31Å; T335-L420 WeakPolarHBondContact O-CB 3.45Å; T335-L420 VanDerWaalsContact O-CD1 3.24Å; T335-L420 WeakPolarHBondContact O-CD1 3.44Å; T335-P422 HydrophobicContact CG2-CB 4.49Å
336	C	76.7	Confident	79.8	Confident	25 Å²	25	39.2 Å²	39.2	17%	0.169	21%	0.211	C	C	.	.			trans	-145.2	155.2	-179.7	-70.2	0	0	0	0	109.2	L391 C393	C336-L391 CarbonylContact C-O 3.6Å; C336-L391 VanDerWaalsContact CA-O 3.29Å; C336-L391 WeakPolarHBondContact CA-O 3.33Å; C336-C393 HydrophobicContact CB-CB 4.34Å
337	V	78.5	Confident	80.6	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.018	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-139.5	146	178.1	-166.2	0	0	0	0	110.4	S339 E342 L343 L346 L391 C393	V337-S339 WeakPolarHBondContact CG1-O 3.4Å; V337-E342 HydrophobicContact CG1-CB 3.75Å; V337-E342 VanDerWaalsContact CG1-CD 3.44Å; V337-E342 HydrophobicContact CG1-CG 3.62Å; V337-E342 VanDerWaalsContact CG1-OE2 3.28Å; V337-E342 WeakPolarHBondContact CG1-OE2 3.39Å; V337-L343 HydrophobicContact CG1-CB 3.99Å; V337-L343 HydrophobicContact CG2-CD1 4.13Å; V337-L346 HydrophobicContact CG1-CD1 4.32Å; V337-L346 HydrophobicContact CG2-CD1 4.17Å; V337-L391 HydrophobicContact CG2-CB 4.21Å; V337-L391 HydrophobicContact CG2-CD1 4.26Å; V337-L391 PolarHBondContact N-O 2.77Å; V337-C393 PolarHBondContact O-N 3.25Å
338	G	73.1	Confident	81.2	Confident	7 Å²	7	33.3 Å²	33.3	7%	0.072	19%	0.194	C	C	.	.	S	Bend	trans	-83.1	-45.4	178.5	0	0	0	0	0	113.8	E342 Y388	G338-E342 WeakPolarHBondContact CA-OE2 3.45Å; G338-E342 PolarHBondContact N-OE2 3.25Å; G338-Y388 PolarHBondContact O-OH 3.16Å
339	S	79.4	Confident	81.6	Confident	22 Å²	22	36.6 Å²	36.6	15%	0.154	21%	0.205	C	C	.	.			trans	-131.8	158.3	-175.7	71.2	0	0	0	0	113.7	V337 S341 E342 L343	V337-S339 WeakPolarHBondContact CG1-O 3.4Å; S339-S341 VanDerWaalsContact C-N 3.27Å; S339-S341 PolarHBondContact O-N 2.7Å; S339-S341 PolarHBondContact OG-OG 3.28Å; S339-E342 PolarHBondContact N-OE2 3.27Å; S339-E342 PolarHBondContact O-N 3.06Å; S339-E342 VanDerWaalsContact OG-CB 3.28Å; S339-E342 WeakPolarHBondContact OG-CB 3.44Å; S339-E342 PolarHBondContact OG-N 2.79Å; S339-E342 VanDerWaalsContact OG-N 3.11Å; S339-L343 PolarHBondContact O-N 3.3Å
340	I	83.3	Confident	81.8	Confident	56 Å²	56	34.3 Å²	34.3	29%	0.287	19%	0.194	S	C	.	.	H	α-helix	trans	-66.5	-29.4	174.3	-168.3	167.8	0	0	0	112.6	L343 S344 H385 Y388	I340-L343 PolarHBondContact O-N 2.97Å; I340-S344 WeakPolarHBondContact O-CB 3.27Å; I340-S344 PolarHBondContact O-N 3.13Å; I340-H385 HydrophobicContact CD1-CB 4.38Å; I340-H385 WeakPolarHBondContact CD1-CE1 3.49Å; I340-H385 VanDerWaalsContact CD1-ND1 3.28Å; I340-H385 WeakPolarHBondContact CD1-ND1 3.39Å; I340-Y388 HydrophobicContact CB-CG 4.38Å
341	S	83.8	Confident	82	Confident	84 Å²	84	30.2 Å²	30.2	59%	0.587	18%	0.175	S	C	*	.	H	α-helix	trans	-63.5	-45.6	172.3	27.5	0	0	0	0	111.9	S339 S344 D345	S339-S341 VanDerWaalsContact C-N 3.27Å; S339-S341 PolarHBondContact O-N 2.7Å; S339-S341 PolarHBondContact OG-OG 3.28Å; S341-S344 PolarHBondContact O-N 2.74Å; S341-D345 VanDerWaalsContact O-CB 3.3Å; S341-D345 WeakPolarHBondContact O-CB 3.26Å; S341-D345 PolarHBondContact O-N 2.91Å
342	E	84.8	Confident	81.8	Confident	73 Å²	73	36.7 Å²	36.7	34%	0.341	21%	0.205	S	C	.	.	H	α-helix	trans	-62.6	-44.8	175.4	-177.8	-170.2	-175.3	0	0	110.9	V337 G338 S339 S344 D345 L346	V337-E342 HydrophobicContact CG1-CB 3.75Å; V337-E342 VanDerWaalsContact CG1-CD 3.44Å; V337-E342 HydrophobicContact CG1-CG 3.62Å; V337-E342 VanDerWaalsContact CG1-OE2 3.28Å; V337-E342 WeakPolarHBondContact CG1-OE2 3.39Å; G338-E342 WeakPolarHBondContact CA-OE2 3.45Å; G338-E342 PolarHBondContact N-OE2 3.25Å; S339-E342 PolarHBondContact N-OE2 3.27Å; S339-E342 PolarHBondContact O-N 3.06Å; S339-E342 VanDerWaalsContact OG-CB 3.28Å; S339-E342 WeakPolarHBondContact OG-CB 3.44Å; S339-E342 PolarHBondContact OG-N 2.79Å; S339-E342 VanDerWaalsContact OG-N 3.11Å; E342-S344 PolarHBondContact O-N 3.01Å; E342-D345 PolarHBondContact O-N 3.3Å; E342-L346 HydrophobicContact CG-CD1 4.1Å; E342-L346 WeakPolarHBondContact O-CB 3.24Å; E342-L346 VanDerWaalsContact O-CG 3.27Å; E342-L346 WeakPolarHBondContact O-CG 3.48Å; E342-L346 PolarHBondContact O-N 3.49Å
343	L	85.7	Confident	81.4	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-46.2	175.6	178.2	62.6	0	0	0	111.7	V337 S339 I340 D345 L346 V347 L384 L387 L391 L423	V337-L343 HydrophobicContact CG1-CB 3.99Å; V337-L343 HydrophobicContact CG2-CD1 4.13Å; S339-L343 PolarHBondContact O-N 3.3Å; I340-L343 PolarHBondContact O-N 2.97Å; L343-D345 PolarHBondContact O-N 3.21Å; L343-L346 PolarHBondContact O-N 3.25Å; L343-V347 HydrophobicContact CD1-CG2 3.95Å; L343-V347 HydrophobicContact CG-CG2 4.39Å; L343-V347 WeakPolarHBondContact O-CB 3.32Å; L343-V347 VanDerWaalsContact O-CG2 3.32Å; L343-V347 WeakPolarHBondContact O-CG2 3.48Å; L343-V347 PolarHBondContact O-N 2.88Å; L343-L384 WeakPolarHBondContact CD2-O 3.36Å; L343-L387 HydrophobicContact CD1-CD2 3.98Å; L343-L387 HydrophobicContact CD1-CG 4.33Å; L343-L387 HydrophobicContact CD2-CB 4.1Å; L343-L387 HydrophobicContact CD2-CD2 4.22Å; L343-L387 HydrophobicContact CD2-CG 4.02Å; L343-L391 HydrophobicContact CD1-CD1 3.92Å; L343-L423 HydrophobicContact CD1-CD1 4.04Å
344	S	86.8	Confident	80.8	Confident	45 Å²	45	39.7 Å²	39.7	32%	0.315	22%	0.218	S	C	.	.	H	α-helix	trans	-60.8	-36.5	178.8	-173.6	0	0	0	0	111.9	I340 S341 E342 S348	I340-S344 WeakPolarHBondContact O-CB 3.27Å; I340-S344 PolarHBondContact O-N 3.13Å; S341-S344 PolarHBondContact O-N 2.74Å; E342-S344 PolarHBondContact O-N 3.01Å; S344-S348 VanDerWaalsContact O-CB 3.23Å; S344-S348 WeakPolarHBondContact O-CB 3.45Å; S344-S348 PolarHBondContact O-N 2.98Å; S344-S348 PolarHBondContact O-OG 3.17Å
345	D	84.4	Confident	79.9	Confident	78 Å²	78	42.9 Å²	42.9	42%	0.417	23%	0.23	S	C	.	.	H	α-helix	trans	-74.4	-44	179.6	-178.1	40.7	0	0	0	111.8	S341 E342 L343 S348 R349	S341-D345 VanDerWaalsContact O-CB 3.3Å; S341-D345 WeakPolarHBondContact O-CB 3.26Å; S341-D345 PolarHBondContact O-N 2.91Å; E342-D345 PolarHBondContact O-N 3.3Å; L343-D345 PolarHBondContact O-N 3.21Å; D345-S348 PolarHBondContact O-N 3.47Å; D345-R349 PolarHBondContact O-N 2.67Å; D345-R349 IonicContact OD1-CZ 3.15Å; D345-R349 IonicContact OD1-NH1 2.67Å; D345-R349 PolarHBondContact OD1-NH1 2.97Å; D345-R349 IonicContact OD1-NH2 3.91Å; D345-R349 IonicContact OD2-CZ 2.98Å; D345-R349 IonicContact OD2-NH1 2.68Å; D345-R349 PolarHBondContact OD2-NH1 3.4Å; D345-R349 IonicContact OD2-NH2 2.76Å; D345-R349 PolarHBondContact OD2-NH2 3.46Å
346	L	86.2	Confident	78.6	Confident	16 Å²	16	45.9 Å²	45.9	8%	0.084	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-50	172.3	-70.6	168.9	0	0	0	112.1	S331 V337 E342 L343 S348 R349 A350 L423	S331-L346 WeakPolarHBondContact OG-CD2 3.37Å; V337-L346 HydrophobicContact CG1-CD1 4.32Å; V337-L346 HydrophobicContact CG2-CD1 4.17Å; E342-L346 HydrophobicContact CG-CD1 4.1Å; E342-L346 WeakPolarHBondContact O-CB 3.24Å; E342-L346 VanDerWaalsContact O-CG 3.27Å; E342-L346 WeakPolarHBondContact O-CG 3.48Å; E342-L346 PolarHBondContact O-N 3.49Å; L343-L346 PolarHBondContact O-N 3.25Å; L346-S348 VanDerWaalsContact C-N 3.33Å; L346-S348 PolarHBondContact O-N 3.47Å; L346-R349 PolarHBondContact O-N 3.13Å; L346-A350 WeakPolarHBondContact O-CB 3.44Å; L346-A350 PolarHBondContact O-N 2.94Å; L346-L423 HydrophobicContact CB-CD2 3.89Å
347	V	86.6	Confident	77.3	Confident	4 Å²	4	52 Å²	52	2%	0.024	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-41.2	176.5	172.3	0	0	0	0	110.5	L343 A350 M351 W379 L384 L423 M427	L343-V347 HydrophobicContact CD1-CG2 3.95Å; L343-V347 HydrophobicContact CG-CG2 4.39Å; L343-V347 WeakPolarHBondContact O-CB 3.32Å; L343-V347 VanDerWaalsContact O-CG2 3.32Å; L343-V347 WeakPolarHBondContact O-CG2 3.48Å; L343-V347 PolarHBondContact O-N 2.88Å; V347-A350 PolarHBondContact O-N 3.39Å; V347-M351 HydrophobicContact CG1-CG 4.04Å; V347-M351 WeakPolarHBondContact O-CB 3.41Å; V347-M351 WeakPolarHBondContact O-CG 3.42Å; V347-M351 PolarHBondContact O-N 3.45Å; V347-W379 HydrophobicContact CG1-CD2 3.94Å; V347-W379 HydrophobicContact CG1-CG 4.05Å; V347-W379 HydrophobicContact CG1-CZ2 4.38Å; V347-L384 HydrophobicContact CG1-CD2 4.49Å; V347-L384 HydrophobicContact CG2-CD2 4.41Å; V347-L423 HydrophobicContact CG2-CD1 4.27Å; V347-L423 HydrophobicContact CG2-CD2 4.32Å; V347-M427 HydrophobicContact CG1-CE 4.4Å; V347-M427 HydrophobicContact CG2-SD 4.45Å
348	S	84.5	Confident	75.7	Confident	68 Å²	68	57 Å²	57	48%	0.476	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-44.7	178.6	-63.3	0	0	0	0	112.6	S344 D345 L346 H352	S344-S348 VanDerWaalsContact O-CB 3.23Å; S344-S348 WeakPolarHBondContact O-CB 3.45Å; S344-S348 PolarHBondContact O-N 2.98Å; S344-S348 PolarHBondContact O-OG 3.17Å; D345-S348 PolarHBondContact O-N 3.47Å; L346-S348 VanDerWaalsContact C-N 3.33Å; L346-S348 PolarHBondContact O-N 3.47Å; S348-H352 WeakPolarHBondContact O-CB 3.43Å; S348-H352 PolarHBondContact O-N 3.24Å
349	R	81.6	Confident	74.1	Confident	88 Å²	88	59.4 Å²	59.4	33%	0.332	32%	0.32	S	S	.	.	H	α-helix	trans	-58.5	-52.5	173.3	-83.6	-168.9	-76.3	-81.4	-3.5	111.7	D345 L346 M351 H352 H353	D345-R349 PolarHBondContact O-N 2.67Å; D345-R349 IonicContact OD1-CZ 3.15Å; D345-R349 IonicContact OD1-NH1 2.67Å; D345-R349 PolarHBondContact OD1-NH1 2.97Å; D345-R349 IonicContact OD1-NH2 3.91Å; D345-R349 IonicContact OD2-CZ 2.98Å; D345-R349 IonicContact OD2-NH1 2.68Å; D345-R349 PolarHBondContact OD2-NH1 3.4Å; D345-R349 IonicContact OD2-NH2 2.76Å; D345-R349 PolarHBondContact OD2-NH2 3.46Å; L346-R349 PolarHBondContact O-N 3.13Å; R349-M351 PolarHBondContact O-N 3.25Å; R349-H352 PolarHBondContact O-N 3.05Å; R349-H353 PolarHBondContact O-CD2 3.4Å; R349-H353 PolarHBondContact O-N 3.15Å; R349-H353 VanDerWaalsContact O-N 3.14Å
350	A	80.5	Confident	72	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-60.1	-45.9	-178.5	0	0	0	0	0	111.7	L328 L332 L346 V347 H352 H353 M354 M427	L328-A350 HydrophobicContact CD1-CB 4.45Å; L332-A350 HydrophobicContact CD2-CB 3.79Å; L346-A350 WeakPolarHBondContact O-CB 3.44Å; L346-A350 PolarHBondContact O-N 2.94Å; V347-A350 PolarHBondContact O-N 3.39Å; A350-H352 PolarHBondContact O-N 2.81Å; A350-H353 PolarHBondContact O-N 3.22Å; A350-M354 WeakPolarHBondContact O-CB 3.14Å; A350-M354 VanDerWaalsContact O-CG 3.26Å; A350-M354 WeakPolarHBondContact O-CG 3.24Å; A350-M354 PolarHBondContact O-N 2.96Å; A350-M427 HydrophobicContact CB-CE 3.6Å; A350-M427 HydrophobicContact CB-SD 3.68Å
351	M	80.8	Confident	69.7	Low	17 Å²	17	67.1 Å²	67.1	8%	0.084	37%	0.365	C	S	.	.	H	α-helix	trans	-60.7	-41.6	176.1	-69.8	-62	-61.8	0	0	112.3	V347 R349 H353 M354 Q355 I377 M427 I431	V347-M351 HydrophobicContact CG1-CG 4.04Å; V347-M351 WeakPolarHBondContact O-CB 3.41Å; V347-M351 WeakPolarHBondContact O-CG 3.42Å; V347-M351 PolarHBondContact O-N 3.45Å; R349-M351 PolarHBondContact O-N 3.25Å; M351-H353 PolarHBondContact O-N 2.89Å; M351-M354 PolarHBondContact O-N 2.87Å; M351-Q355 VanDerWaalsContact O-CB 3.31Å; M351-Q355 WeakPolarHBondContact O-CB 3.38Å; M351-Q355 WeakPolarHBondContact O-CG 3.44Å; M351-Q355 PolarHBondContact O-N 2.91Å; M351-I377 HydrophobicContact CE-CB 4.13Å; M351-I377 HydrophobicContact CE-CG2 4.46Å; M351-I377 WeakPolarHBondContact CE-O 3.34Å; M351-M427 HydrophobicContact CG-CE 3.7Å; M351-M427 HydrophobicContact SD-CE 3.47Å; M351-M427 WeakPolarHBondContact SD-CE 3.49Å; M351-I431 HydrophobicContact CE-CD1 4.17Å; M351-I431 HydrophobicContact SD-CD1 3.6Å
352	H	76.4	Confident	67.1	Low	141 Å²	141	67.3 Å²	67.3	65%	0.653	36%	0.364	S	S	*	.	H	α-helix	trans	-61.2	-44.2	178.6	-171.3	-87.1	0	0	0	112	S348 R349 A350 G356	S348-H352 WeakPolarHBondContact O-CB 3.43Å; S348-H352 PolarHBondContact O-N 3.24Å; R349-H352 PolarHBondContact O-N 3.05Å; A350-H352 PolarHBondContact O-N 2.81Å; H352-G356 PolarHBondContact O-N 3.22Å
353	H	71.8	Confident	64.9	Low	55 Å²	55	67.5 Å²	67.5	26%	0.255	39%	0.386	S	S	.	.	H	α-helix	trans	-71.2	-36.8	176.9	-77.1	-81	0	0	0	113.4	L328 R349 A350 M351	L328-H353 HydrophobicContact CD1-CB 3.86Å; L328-H353 HydrophobicContact CD2-CB 3.61Å; L328-H353 HydrophobicContact CG-CB 4.37Å; R349-H353 PolarHBondContact O-CD2 3.4Å; R349-H353 PolarHBondContact O-N 3.15Å; R349-H353 VanDerWaalsContact O-N 3.14Å; A350-H353 PolarHBondContact O-N 3.22Å; M351-H353 PolarHBondContact O-N 2.89Å
354	M	69.4	Low	62.4	Low	28 Å²	28	70.2 Å²	70.2	14%	0.138	41%	0.408	C	S	.	.	H	α-helix	trans	-66.6	-41.9	176.5	-71.1	173.9	72.5	0	0	111.9	W168 F303 A350 M351 G356 R357 M427 I431	W168-M354 HydrophobicContact CE3-CE 4.35Å; W168-M354 HydrophobicContact CH2-CE 3.81Å; W168-M354 HydrophobicContact CZ3-CE 3.51Å; F303-M354 HydrophobicContact CE1-CG 4.12Å; F303-M354 HydrophobicContact CZ-CG 4.37Å; A350-M354 WeakPolarHBondContact O-CB 3.14Å; A350-M354 VanDerWaalsContact O-CG 3.26Å; A350-M354 WeakPolarHBondContact O-CG 3.24Å; A350-M354 PolarHBondContact O-N 2.96Å; M351-M354 PolarHBondContact O-N 2.87Å; M354-G356 VanDerWaalsContact C-N 3.3Å; M354-G356 PolarHBondContact O-N 2.94Å; M354-R357 PolarHBondContact O-N 3.49Å; M354-M427 HydrophobicContact SD-CE 3.99Å; M354-I431 HydrophobicContact CE-CD1 4.46Å
355	Q	64.7	Low	59.7	Low	83 Å²	83	72.3 Å²	72.3	39%	0.388	42%	0.423	S	S	.	.	H	α-helix	trans	-65	-31.8	-180	-73	166.5	11.4	0	0	112.8	M351 R357 P376 I377	M351-Q355 VanDerWaalsContact O-CB 3.31Å; M351-Q355 WeakPolarHBondContact O-CB 3.38Å; M351-Q355 WeakPolarHBondContact O-CG 3.44Å; M351-Q355 PolarHBondContact O-N 2.91Å; Q355-R357 VanDerWaalsContact C-N 3.25Å; Q355-R357 PolarHBondContact O-N 2.93Å; Q355-P376 VanDerWaalsContact CD-CB 3.43Å; Q355-P376 HydrophobicContact CG-CB 4.38Å; Q355-P376 VanDerWaalsContact NE2-CB 3.34Å; Q355-I377 PolarHBondContact NE2-O 3.07Å
356	G	52.7	Low	57.3	Low	71 Å²	71	74.9 Å²	74.9	73%	0.732	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-8.3	177.6	0	0	0	0	0	115.7	H352 M354	H352-G356 PolarHBondContact O-N 3.22Å; M354-G356 VanDerWaalsContact C-N 3.3Å; M354-G356 PolarHBondContact O-N 2.94Å
357	R	49.1	Very low	54.8	Low	154 Å²	154	78.4 Å²	78.4	58%	0.581	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.2	-0.3	-173.3	-55.9	-176	91.4	107.5	-2.1	114.8	Y302 M354 Q355 P359	Y302-R357 PolarHBondContact OH-O 2.82Å; Y302-R357 VanDerWaalsContact OH-O 3.08Å; M354-R357 PolarHBondContact O-N 3.49Å; Q355-R357 VanDerWaalsContact C-N 3.25Å; Q355-R357 PolarHBondContact O-N 2.93Å; R357-P359 VanDerWaalsContact O-CD 3.28Å; R357-P359 WeakPolarHBondContact O-CD 3.48Å
358	H	44.8	Very low	52.3	Low	108 Å²	108	89.6 Å²	89.6	50%	0.5	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-63.4	118	-174.4	-158.3	-57.2	0	0	0	111.7
359	P	39.2	Very low	50	Low	56 Å²	56	93 Å²	93	36%	0.364	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-64.6	145.1	171.6	-17.3	31.6	0	0	0	110.1	R357 C361	R357-P359 VanDerWaalsContact O-CD 3.28Å; R357-P359 WeakPolarHBondContact O-CD 3.48Å; P359-C361 PolarHBondContact O-N 2.81Å
360	L	36	Very low	47.5	Very low	152 Å²	152	92.9 Å²	92.9	80%	0.796	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-58.3	129.5	173.6	-73.7	159.7	0	0	0	109.9	P362	L360-P362 WeakPolarHBondContact O-CD 3.35Å
361	C	35.1	Very low	45.3	Very low	89 Å²	89	104 Å²	104	60%	0.601	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-57.5	118.3	-173.8	-143	0	0	0	0	111.2	P359 G363	P359-C361 PolarHBondContact O-N 2.81Å; C361-G363 PolarHBondContact O-N 2.64Å
362	P	27.9	Very low	42.9	Very low	88 Å²	88	110.5 Å²	110.5	57%	0.571	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	106.4	-177.2	-14.1	28	0	0	0	110.5	L176 L360	L176-P362 HydrophobicContact CD2-CG 4.23Å; L360-P362 WeakPolarHBondContact O-CD 3.35Å
363	G	39	Very low	40.9	Very low	77 Å²	77	108.8 Å²	108.8	79%	0.794	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.6	-12.9	176.7	0	0	0	0	0	116.1	C361	C361-G363 PolarHBondContact O-N 2.64Å
364	A	32.1	Very low	39.7	Very low	56 Å²	56	111.9 Å²	111.9	46%	0.463	64%	0.642	S	S	.	*			trans	-84.3	121.8	172.6	0	0	0	0	0	110.9
365	S	30.1	Very low	39.1	Very low	90 Å²	90	114.2 Å²	114.2	63%	0.629	65%	0.653	S	S	*	*			trans	-62.6	133.1	174.6	-41.2	0	0	0	0	110.5	A367 R368	S365-A367 PolarHBondContact O-N 2.84Å; S365-R368 PolarHBondContact O-N 3.16Å
366	P	34.1	Very low	39.2	Very low	131 Å²	131	113.3 Å²	113.3	85%	0.851	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-13.5	-174.3	20.3	-30.3	0	0	0	114.6	R368	P366-R368 PolarHBondContact O-N 3.14Å
367	A	33.7	Very low	40.4	Very low	91 Å²	91	111.3 Å²	111.3	75%	0.752	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-14.1	-176.6	0	0	0	0	0	115.9	S365	S365-A367 PolarHBondContact O-N 2.84Å
368	R	35.4	Very low	42	Very low	239 Å²	239	107 Å²	107	90%	0.902	62%	0.617	S	S	*	*	S	Bend	trans	-110.1	-3.6	-176.2	-76	-168.9	178.4	-175.3	1.4	116.1	S365 P366	S365-R368 PolarHBondContact O-N 3.16Å; P366-R368 PolarHBondContact O-N 3.14Å
369	Q	35.9	Very low	44	Very low	138 Å²	138	103.1 Å²	103.1	65%	0.645	60%	0.598	S	S	*	*			trans	-102.7	26.6	-178.6	-75.2	-171.7	-17.8	0	0	114.8	R371	Q369-R371 PolarHBondContact O-N 3.08Å
370	A	27.9	Very low	46.2	Very low	87 Å²	87	101.7 Å²	101.7	72%	0.719	59%	0.589	S	S	*	*			trans	-78.1	52.1	172.6	0	0	0	0	0	113.2
371	R	34.5	Very low	48.6	Very low	233 Å²	233	97.6 Å²	97.6	88%	0.879	57%	0.572	S	S	*	*	S	Bend	trans	-179.2	124.5	159.4	-98.7	148	-162.7	-154.8	5.7	111.4	Q369	Q369-R371 PolarHBondContact O-N 3.08Å
372	Q	31.2	Very low	50.9	Low	153 Å²	153	98.2 Å²	98.2	72%	0.715	57%	0.569	S	S	*	*			trans	77.2	131.5	175.3	-52	-171.9	7.5	0	0	116.9
373	P	35	Very low	53.7	Low	106 Å²	106	94 Å²	94	69%	0.688	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-69.4	156.3	168	31.5	-34.6	0	0	0	110.8	Q375	P373-Q375 PolarHBondContact O-N 2.86Å
374	P	46.3	Very low	56	Low	119 Å²	119	91.4 Å²	91.4	77%	0.773	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-58.1	130.1	177.3	24.8	-33.8	0	0	0	110.4
375	Q	56.6	Low	58.6	Low	78 Å²	78	94 Å²	94	36%	0.364	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-76.6	135.9	-177.7	-59.9	-170.7	20.8	0	0	110	P373 L440	P373-Q375 PolarHBondContact O-N 2.86Å; Q375-L440 HydrophobicContact CB-CD1 4.11Å
376	P	66.3	Low	61.3	Low	64 Å²	64	91.1 Å²	91.1	42%	0.416	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-65.7	138.1	-177	25.6	-34.1	0	0	0	111.7	Q355 T378	Q355-P376 VanDerWaalsContact CD-CB 3.43Å; Q355-P376 HydrophobicContact CG-CB 4.38Å; Q355-P376 VanDerWaalsContact NE2-CB 3.34Å; P376-T378 PolarHBondContact O-N 2.71Å
377	I	77.5	Confident	63.8	Low	29 Å²	29	84.9 Å²	84.9	15%	0.149	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-63.5	134.2	171.9	-64.2	174.5	0	0	0	108.9	M351 Q355 I431 E435 L440 V442	M351-I377 HydrophobicContact CE-CB 4.13Å; M351-I377 HydrophobicContact CE-CG2 4.46Å; M351-I377 WeakPolarHBondContact CE-O 3.34Å; Q355-I377 PolarHBondContact NE2-O 3.07Å; I377-I431 HydrophobicContact CD1-CG2 3.77Å; I377-E435 HydrophobicContact CD1-CG 3.85Å; I377-L440 WeakPolarHBondContact CA-O 3.26Å; I377-V442 HydrophobicContact CG2-CG2 3.83Å
378	T	84.1	Confident	66.2	Low	64 Å²	64	82.5 Å²	82.5	39%	0.393	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	157.7	-177.6	56.8	0	0	0	0	111.2	P376 L440 T441 V442	P376-T378 PolarHBondContact O-N 2.71Å; T378-L440 PolarHBondContact N-O 2.99Å; T378-L440 PolarHBondContact OG1-O 3.17Å; T378-L440 VanDerWaalsContact OG1-O 3.07Å; T378-T441 CarbonylContact O-C 3.48Å; T378-T441 VanDerWaalsContact O-CA 3.27Å; T378-T441 WeakPolarHBondContact O-CA 3.28Å; T378-V442 PolarHBondContact O-N 3.06Å
379	W	87.1	Confident	68.5	Low	26 Å²	26	79.3 Å²	79.3	10%	0.098	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.5	178.4	-72.4	63.9	0	0	0	110	V347 A383 L384 L387 M427 A430 I431 V442 I447	V347-W379 HydrophobicContact CG1-CD2 3.94Å; V347-W379 HydrophobicContact CG1-CG 4.05Å; V347-W379 HydrophobicContact CG1-CZ2 4.38Å; W379-A383 HydrophobicContact CE3-CB 4.14Å; W379-L384 HydrophobicContact CB-CD2 4.19Å; W379-L384 HydrophobicContact CB-CG 4.21Å; W379-L384 HydrophobicContact CD2-CD2 4.37Å; W379-L384 HydrophobicContact CE3-CD2 3.89Å; W379-L387 HydrophobicContact CH2-CD2 4.05Å; W379-L387 HydrophobicContact CZ3-CD2 3.68Å; W379-M427 HydrophobicContact CH2-CG 4.32Å; W379-M427 HydrophobicContact CZ2-CB 4.43Å; W379-M427 HydrophobicContact CZ2-CG 4.02Å; W379-A430 HydrophobicContact CH2-CB 4.04Å; W379-I431 HydrophobicContact CZ2-CG1 4.42Å; W379-V442 HydrophobicContact CD2-CB 4.07Å; W379-V442 HydrophobicContact CD2-CG1 4.24Å; W379-V442 HydrophobicContact CD2-CG2 4.29Å; W379-V442 HydrophobicContact CE3-CB 4.36Å; W379-V442 HydrophobicContact CE3-CG1 4.1Å; W379-V442 HydrophobicContact CG-CB 4.29Å; W379-V442 HydrophobicContact CG-CG2 4.48Å; W379-V442 HydrophobicContact CH2-CG1 4.35Å; W379-V442 HydrophobicContact CZ2-CG1 4.48Å; W379-V442 HydrophobicContact CZ2-CG2 4.43Å; W379-V442 HydrophobicContact CZ3-CG1 4.17Å; W379-I447 HydrophobicContact CE3-CD1 4.36Å; W379-I447 HydrophobicContact CH2-CD1 3.86Å; W379-I447 HydrophobicContact CZ3-CD1 3.43Å; W379-I447 VanDerWaalsContact CZ3-CD1 3.43Å; W379-I447 HydrophobicContact CZ3-CG1 4.49Å
380	S	85.5	Confident	70.6	Confident	25 Å²	25	74.3 Å²	74.3	18%	0.175	39%	0.387	C	S	.	.			trans	-72.8	153.2	172.2	61.1	0	0	0	0	111	D382 A383 L384 V442 D443	S380-D382 VanDerWaalsContact C-N 3.25Å; S380-D382 PolarHBondContact O-N 3.4Å; S380-A383 WeakPolarHBondContact O-CB 3.37Å; S380-A383 PolarHBondContact O-N 3.11Å; S380-A383 VanDerWaalsContact OG-CB 3.24Å; S380-A383 WeakPolarHBondContact OG-CB 3.34Å; S380-A383 PolarHBondContact OG-N 3.46Å; S380-L384 PolarHBondContact O-N 3.36Å; S380-V442 VanDerWaalsContact CB-O 3.3Å; S380-V442 WeakPolarHBondContact CB-O 3.37Å; S380-V442 PolarHBondContact N-O 3.21Å; S380-V442 PolarHBondContact OG-O 3.27Å; S380-D443 WeakPolarHBondContact OG-CA 3.47Å
381	P	84.5	Confident	73.1	Confident	66 Å²	66	70.2 Å²	70.2	43%	0.429	35%	0.353	S	S	.	.	H	α-helix	trans	-55.6	-42.5	174.5	-25	35.1	0	0	0	112.1	A383 L384 H385	P381-A383 VanDerWaalsContact C-N 3.31Å; P381-A383 PolarHBondContact O-N 3.12Å; P381-L384 PolarHBondContact O-N 3.03Å; P381-L384 VanDerWaalsContact O-N 3.13Å; P381-H385 PolarHBondContact O-CD2 3.46Å; P381-H385 PolarHBondContact O-N 2.98Å
382	D	83.6	Confident	75	Confident	103 Å²	103	64.4 Å²	64.4	55%	0.551	33%	0.331	S	S	*	.	H	α-helix	trans	-64.4	-34.2	-179.6	-54.7	-24.6	0	0	0	112.4	S380 T386	S380-D382 VanDerWaalsContact C-N 3.25Å; S380-D382 PolarHBondContact O-N 3.4Å; D382-T386 VanDerWaalsContact O-CB 3.31Å; D382-T386 WeakPolarHBondContact O-CB 3.42Å; D382-T386 PolarHBondContact O-N 3.27Å; D382-T386 PolarHBondContact O-OG1 3.02Å
383	A	88.1	Confident	76.5	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.2	-45.8	171.8	0	0	0	0	0	111.5	W379 S380 P381 T386 L387 V442 I447	W379-A383 HydrophobicContact CE3-CB 4.14Å; S380-A383 WeakPolarHBondContact O-CB 3.37Å; S380-A383 PolarHBondContact O-N 3.11Å; S380-A383 VanDerWaalsContact OG-CB 3.24Å; S380-A383 WeakPolarHBondContact OG-CB 3.34Å; S380-A383 PolarHBondContact OG-N 3.46Å; P381-A383 VanDerWaalsContact C-N 3.31Å; P381-A383 PolarHBondContact O-N 3.12Å; A383-T386 PolarHBondContact O-N 3.15Å; A383-L387 WeakPolarHBondContact O-CB 3.45Å; A383-L387 PolarHBondContact O-N 2.88Å; A383-V442 HydrophobicContact CB-CG1 4.23Å; A383-V442 WeakPolarHBondContact CB-O 3.4Å; A383-I447 HydrophobicContact CB-CG1 4.01Å
384	L	87.6	Confident	77.2	Confident	21 Å²	21	57 Å²	57	11%	0.11	30%	0.297	C	S	.	.	H	α-helix	trans	-64.9	-41.1	178	-65.6	174	0	0	0	112.1	L343 V347 W379 S380 P381 T386 L387 Y388	L343-L384 WeakPolarHBondContact CD2-O 3.36Å; V347-L384 HydrophobicContact CG1-CD2 4.49Å; V347-L384 HydrophobicContact CG2-CD2 4.41Å; W379-L384 HydrophobicContact CB-CD2 4.19Å; W379-L384 HydrophobicContact CB-CG 4.21Å; W379-L384 HydrophobicContact CD2-CD2 4.37Å; W379-L384 HydrophobicContact CE3-CD2 3.89Å; S380-L384 PolarHBondContact O-N 3.36Å; P381-L384 PolarHBondContact O-N 3.03Å; P381-L384 VanDerWaalsContact O-N 3.13Å; L384-T386 VanDerWaalsContact C-N 3.35Å; L384-T386 PolarHBondContact O-N 3.21Å; L384-L387 PolarHBondContact O-N 2.8Å; L384-Y388 VanDerWaalsContact O-CB 3.29Å; L384-Y388 WeakPolarHBondContact O-CB 3.42Å; L384-Y388 PolarHBondContact O-N 3.07Å
385	H	85.4	Confident	77.3	Confident	112 Å²	112	57.2 Å²	57.2	52%	0.519	29%	0.287	S	S	.	.	H	α-helix	trans	-61.2	-42	172.6	-81.1	-73.3	0	0	0	112.2	I340 P381 Y389	I340-H385 HydrophobicContact CD1-CB 4.38Å; I340-H385 WeakPolarHBondContact CD1-CE1 3.49Å; I340-H385 VanDerWaalsContact CD1-ND1 3.28Å; I340-H385 WeakPolarHBondContact CD1-ND1 3.39Å; P381-H385 PolarHBondContact O-CD2 3.46Å; P381-H385 PolarHBondContact O-N 2.98Å; H385-Y389 PolarHBondContact O-N 3.3Å; H385-Y389 VanDerWaalsContact O-N 3.15Å
386	T	86.6	Confident	76.8	Confident	28 Å²	28	56.2 Å²	56.2	17%	0.172	28%	0.283	C	S	.	.	H	α-helix	trans	-69.4	-38.7	178.9	-54.7	0	0	0	0	111.7	D382 A383 L384 Y389 F390 S444 I447 R448	D382-T386 VanDerWaalsContact O-CB 3.31Å; D382-T386 WeakPolarHBondContact O-CB 3.42Å; D382-T386 PolarHBondContact O-N 3.27Å; D382-T386 PolarHBondContact O-OG1 3.02Å; A383-T386 PolarHBondContact O-N 3.15Å; L384-T386 VanDerWaalsContact C-N 3.35Å; L384-T386 PolarHBondContact O-N 3.21Å; T386-Y389 WeakPolarHBondContact O-CB 3.34Å; T386-Y389 PolarHBondContact O-N 2.93Å; T386-F390 HydrophobicContact CG2-CE2 4.06Å; T386-F390 WeakPolarHBondContact O-CD2 3.24Å; T386-S444 VanDerWaalsContact OG1-CB 3.26Å; T386-S444 WeakPolarHBondContact OG1-CB 3.09Å; T386-I447 HydrophobicContact CG2-CB 3.95Å; T386-I447 HydrophobicContact CG2-CG2 3.82Å; T386-R448 HydrophobicContact CG2-CG 4.19Å
387	L	86.4	Confident	75.7	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.9	-40.3	176.8	-179.3	61	0	0	0	111.3	L343 W379 A383 L384 Y389 F390 L391 L423 W426 I447	L343-L387 HydrophobicContact CD1-CD2 3.98Å; L343-L387 HydrophobicContact CD1-CG 4.33Å; L343-L387 HydrophobicContact CD2-CB 4.1Å; L343-L387 HydrophobicContact CD2-CD2 4.22Å; L343-L387 HydrophobicContact CD2-CG 4.02Å; W379-L387 HydrophobicContact CH2-CD2 4.05Å; W379-L387 HydrophobicContact CZ3-CD2 3.68Å; A383-L387 WeakPolarHBondContact O-CB 3.45Å; A383-L387 PolarHBondContact O-N 2.88Å; L384-L387 PolarHBondContact O-N 2.8Å; L387-Y389 VanDerWaalsContact C-N 3.27Å; L387-Y389 PolarHBondContact O-N 2.82Å; L387-F390 PolarHBondContact O-N 3.36Å; L387-F390 VanDerWaalsContact O-N 3.11Å; L387-L391 HydrophobicContact CD1-CD1 3.8Å; L387-L391 HydrophobicContact CD1-CG 4.08Å; L387-L391 HydrophobicContact CD2-CD1 4.32Å; L387-L391 HydrophobicContact CG-CD1 3.81Å; L387-L391 HydrophobicContact CG-CG 4.39Å; L387-L391 PolarHBondContact O-N 3.03Å; L387-L391 VanDerWaalsContact O-N 3.07Å; L387-L423 HydrophobicContact CD2-CD1 4.04Å; L387-W426 HydrophobicContact CD1-CB 3.98Å; L387-W426 HydrophobicContact CD1-CD2 3.67Å; L387-W426 HydrophobicContact CD1-CE3 3.55Å; L387-W426 HydrophobicContact CD1-CG 3.88Å; L387-W426 HydrophobicContact CD1-CZ3 4.22Å; L387-I447 HydrophobicContact CB-CD1 4.48Å; L387-I447 HydrophobicContact CB-CG2 4.03Å; L387-I447 HydrophobicContact CD1-CG2 4.28Å
388	Y	84.6	Confident	74.3	Confident	41 Å²	41	61.6 Å²	61.6	16%	0.161	31%	0.314	C	S	.	.	H	α-helix	trans	-57.9	-39.2	173.9	178	-109.2	0	0	0	112	G338 I340 L384 F390 L391 R392	G338-Y388 PolarHBondContact O-OH 3.16Å; I340-Y388 HydrophobicContact CB-CG 4.38Å; L384-Y388 VanDerWaalsContact O-CB 3.29Å; L384-Y388 WeakPolarHBondContact O-CB 3.42Å; L384-Y388 PolarHBondContact O-N 3.07Å; Y388-F390 VanDerWaalsContact C-N 3.27Å; Y388-F390 PolarHBondContact O-N 3.43Å; Y388-L391 PolarHBondContact O-N 3.28Å; Y388-R392 HydrophobicContact CE2-CB 4.4Å; Y388-R392 VanDerWaalsContact O-CB 3.26Å; Y388-R392 WeakPolarHBondContact O-CB 3.5Å; Y388-R392 PolarHBondContact O-N 2.87Å
389	Y	84.1	Confident	72.4	Confident	173 Å²	173	64.6 Å²	64.6	68%	0.678	33%	0.325	S	S	*	.	H	α-helix	trans	-56.2	-38.8	175.1	173.4	-93.2	0	0	0	113.2	H385 T386 L387	H385-Y389 PolarHBondContact O-N 3.3Å; H385-Y389 VanDerWaalsContact O-N 3.15Å; T386-Y389 WeakPolarHBondContact O-CB 3.34Å; T386-Y389 PolarHBondContact O-N 2.93Å; L387-Y389 VanDerWaalsContact C-N 3.27Å; L387-Y389 PolarHBondContact O-N 2.82Å
390	F	80.9	Confident	70.4	Confident	33 Å²	33	69.2 Å²	69.2	15%	0.145	35%	0.348	C	S	.	.	H	α-helix	trans	-82.6	-27.2	179	-66.9	-67.3	0	0	0	114.2	T386 L387 Y388 W426 I447 A451 L455 L458	T386-F390 HydrophobicContact CG2-CE2 4.06Å; T386-F390 WeakPolarHBondContact O-CD2 3.24Å; L387-F390 PolarHBondContact O-N 3.36Å; L387-F390 VanDerWaalsContact O-N 3.11Å; Y388-F390 VanDerWaalsContact C-N 3.27Å; Y388-F390 PolarHBondContact O-N 3.43Å; F390-W426 HydrophobicContact CB-CH2 3.66Å; F390-W426 HydrophobicContact CB-CZ2 3.94Å; F390-W426 HydrophobicContact CB-CZ3 4.4Å; F390-W426 HydrophobicContact CD1-CH2 4.36Å; F390-W426 AromaticContact CD2-CH2 3.94Å; F390-W426 HydrophobicContact CD2-CH2 3.94Å; F390-W426 HydrophobicContact CD2-CZ3 4.11Å; F390-W426 AromaticContact CG-CH2 3.74Å; F390-W426 HydrophobicContact CG-CH2 3.74Å; F390-W426 HydrophobicContact CG-CZ2 4.47Å; F390-W426 HydrophobicContact CG-CZ3 4.36Å; F390-I447 HydrophobicContact CD2-CG2 4.18Å; F390-I447 HydrophobicContact CE2-CG2 4.35Å; F390-A451 HydrophobicContact CD1-CB 4.34Å; F390-A451 HydrophobicContact CD2-CB 4.14Å; F390-A451 HydrophobicContact CE1-CB 3.9Å; F390-A451 HydrophobicContact CE2-CB 3.67Å; F390-A451 HydrophobicContact CG-CB 4.47Å; F390-A451 HydrophobicContact CZ-CB 3.54Å; F390-L455 HydrophobicContact CD1-CD1 3.85Å; F390-L455 HydrophobicContact CE1-CD1 4.4Å; F390-L455 HydrophobicContact CG-CD1 4.47Å; F390-L458 HydrophobicContact CD1-CD1 4.42Å; F390-L458 HydrophobicContact CE1-CD1 3.71Å; F390-L458 HydrophobicContact CZ-CD1 4.36Å
391	L	79.4	Confident	68.6	Low	1 Å²	1	72.5 Å²	72.5	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-97.4	-3.5	-178.3	-63	179.6	0	0	0	114.5	C336 V337 L343 L387 Y388 C393 L423	C336-L391 CarbonylContact C-O 3.6Å; C336-L391 VanDerWaalsContact CA-O 3.29Å; C336-L391 WeakPolarHBondContact CA-O 3.33Å; V337-L391 HydrophobicContact CG2-CB 4.21Å; V337-L391 HydrophobicContact CG2-CD1 4.26Å; V337-L391 PolarHBondContact N-O 2.77Å; L343-L391 HydrophobicContact CD1-CD1 3.92Å; L387-L391 HydrophobicContact CD1-CD1 3.8Å; L387-L391 HydrophobicContact CD1-CG 4.08Å; L387-L391 HydrophobicContact CD2-CD1 4.32Å; L387-L391 HydrophobicContact CG-CD1 3.81Å; L387-L391 HydrophobicContact CG-CG 4.39Å; L387-L391 PolarHBondContact O-N 3.03Å; L387-L391 VanDerWaalsContact O-N 3.07Å; Y388-L391 PolarHBondContact O-N 3.28Å; L391-C393 PolarHBondContact O-N 3.4Å; L391-L423 HydrophobicContact CD1-CD1 3.84Å
392	R	74.5	Confident	66.9	Low	111 Å²	111	74.9 Å²	74.9	42%	0.419	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-64.7	129.9	-176.2	173.5	175.5	169.2	-174.7	-3.3	112.3	Y388 P394 E397	Y388-R392 HydrophobicContact CE2-CB 4.4Å; Y388-R392 VanDerWaalsContact O-CB 3.26Å; Y388-R392 WeakPolarHBondContact O-CB 3.5Å; Y388-R392 PolarHBondContact O-N 2.87Å; R392-P394 WeakPolarHBondContact O-CD 3.44Å; R392-E397 IonicContact CZ-OE1 2.74Å; R392-E397 IonicContact CZ-OE2 3.15Å; R392-E397 IonicContact NE-OE1 2.65Å; R392-E397 IonicContact NE-OE2 2.7Å; R392-E397 IonicContact NH2-OE1 3.18Å; R392-E397 PolarHBondContact NH2-OE1 3.04Å; R392-E397 IonicContact NH2-OE2 3.65Å; R392-E397 PolarHBondContact NH2-OE2 3.43Å
393	C	61.7	Low	65.5	Low	14 Å²	14	77.1 Å²	77.1	10%	0.095	39%	0.391	C	S	.	.			trans	-92.6	117.2	169.3	-171.5	0	0	0	0	111.4	C336 V337 L391 Q395 M396	C336-C393 HydrophobicContact CB-CB 4.34Å; V337-C393 PolarHBondContact O-N 3.25Å; L391-C393 PolarHBondContact O-N 3.4Å; C393-Q395 PolarHBondContact O-N 3.31Å; C393-Q395 VanDerWaalsContact O-N 3.08Å; C393-M396 HydrophobicContact CB-CG 4.4Å; C393-M396 HydrophobicContact CB-SD 4Å; C393-M396 PolarHBondContact O-N 2.95Å
394	P	51.4	Low	63.5	Low	89 Å²	89	83.2 Å²	83.2	58%	0.578	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.7	178.7	-23.3	34.3	0	0	0	114.8	R392	R392-P394 WeakPolarHBondContact O-CD 3.44Å
395	Q	47.3	Very low	61.1	Low	123 Å²	123	89.4 Å²	89.4	58%	0.575	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-7.8	-172.1	-63.1	169.6	-47.6	0	0	113.4	C393	C393-Q395 PolarHBondContact O-N 3.31Å; C393-Q395 VanDerWaalsContact O-N 3.08Å
396	M	46.5	Very low	58.8	Low	58 Å²	58	89.4 Å²	89.4	29%	0.286	47%	0.466	S	S	.	.	S	Bend	trans	-96.5	-19.1	-175.5	-70.1	170.2	72.7	0	0	114.1	C393 S398 M399	C393-M396 HydrophobicContact CB-CG 4.4Å; C393-M396 HydrophobicContact CB-SD 4Å; C393-M396 PolarHBondContact O-N 2.95Å; M396-S398 PolarHBondContact O-N 3.14Å; M396-M399 PolarHBondContact O-N 2.92Å; M396-M399 VanDerWaalsContact O-N 3.12Å
397	E	43.9	Very low	56.5	Low	99 Å²	99	93.7 Å²	93.7	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-65.5	-24.3	-177.5	-71.5	-178.9	119.3	0	0	113.8	R392 M399	R392-E397 IonicContact CZ-OE1 2.74Å; R392-E397 IonicContact CZ-OE2 3.15Å; R392-E397 IonicContact NE-OE1 2.65Å; R392-E397 IonicContact NE-OE2 2.7Å; R392-E397 IonicContact NH2-OE1 3.18Å; R392-E397 PolarHBondContact NH2-OE1 3.04Å; R392-E397 IonicContact NH2-OE2 3.65Å; R392-E397 PolarHBondContact NH2-OE2 3.43Å; E397-M399 PolarHBondContact O-N 3.39Å
398	S	47	Very low	54.1	Low	106 Å²	106	105 Å²	105	74%	0.741	54%	0.537	S	S	*	.	H	α-helix	trans	-70.4	-5.3	175.8	57.6	0	0	0	0	114.3	M396	M396-S398 PolarHBondContact O-N 3.14Å
399	M	43.9	Very low	52	Low	128 Å²	128	110.6 Å²	110.6	63%	0.631	57%	0.566	S	S	*	*	H	α-helix	trans	-106	-22.4	178.9	-102.6	169.8	53.4	0	0	114.3	W68 M396 E397	W68-M399 HydrophobicContact CH2-CE 3.51Å; W68-M399 HydrophobicContact CH2-SD 3.47Å; W68-M399 WeakPolarHBondContact CH2-SD 3.33Å; W68-M399 HydrophobicContact CZ2-CE 3.81Å; W68-M399 HydrophobicContact CZ2-SD 3.55Å; W68-M399 VanDerWaalsContact CZ2-SD 3.55Å; W68-M399 HydrophobicContact CZ3-CE 4.2Å; M396-M399 PolarHBondContact O-N 2.92Å; M396-M399 VanDerWaalsContact O-N 3.12Å; E397-M399 PolarHBondContact O-N 3.39Å
400	E	45.5	Very low	49.6	Very low	122 Å²	122	108.4 Å²	108.4	57%	0.57	57%	0.571	S	S	*	*	H	α-helix	trans	-84.9	-13	-176.9	-66.9	-168.9	151.9	0	0	114
401	N	47	Very low	47.4	Very low	95 Å²	95	111.7 Å²	111.7	51%	0.508	59%	0.59	S	S	.	*			trans	-137.9	92	176.9	-91.6	-60.2	0	0	0	112.7	N403 L404	N401-N403 PolarHBondContact O-N 3.02Å; N401-N403 VanDerWaalsContact O-N 3.08Å; N401-L404 HydrophobicContact CB-CD1 3.82Å; N401-L404 HydrophobicContact CB-CG 4.18Å; N401-L404 PolarHBondContact O-N 3.49Å
402	P	50.1	Low	45.3	Very low	115 Å²	115	116.3 Å²	116.3	75%	0.747	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-1.2	177.9	29.6	-36.2	0	0	0	114.6
403	N	53.9	Low	43.6	Very low	151 Å²	151	116.4 Å²	116.4	81%	0.807	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	2.4	-176.1	-64.4	-36.8	0	0	0	114.1	N401	N401-N403 PolarHBondContact O-N 3.02Å; N401-N403 VanDerWaalsContact O-N 3.08Å
404	L	45.8	Very low	42.4	Very low	127 Å²	127	120.8 Å²	120.8	67%	0.665	64%	0.642	S	S	*	*	S	Bend	trans	-89.7	124.4	169.3	-73.7	168.9	0	0	0	108.4	N401	N401-L404 HydrophobicContact CB-CD1 3.82Å; N401-L404 HydrophobicContact CB-CG 4.18Å; N401-L404 PolarHBondContact O-N 3.49Å
405	D	37.5	Very low	42.1	Very low	152 Å²	152	121.3 Å²	121.3	81%	0.813	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-51	135.3	168.4	-87.4	-42.7	0	0	0	109.1	P407	D405-P407 WeakPolarHBondContact O-CD 3.28Å; D405-P407 VanDerWaalsContact O-N 3.08Å
406	P	37.4	Very low	42	Very low	111 Å²	111	120.7 Å²	120.7	72%	0.721	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-57.4	120.9	-177.8	22.7	-32.7	0	0	0	108.8	R408	P406-R408 PolarHBondContact O-N 2.84Å
407	P	37.7	Very low	42.4	Very low	118 Å²	118	120 Å²	120	77%	0.766	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-57.5	130	-178.4	23.1	-32.7	0	0	0	108.1	D405 M409	D405-P407 WeakPolarHBondContact O-CD 3.28Å; D405-P407 VanDerWaalsContact O-N 3.08Å; P407-M409 WeakPolarHBondContact O-CA 3.25Å; P407-M409 PolarHBondContact O-N 3.18Å
408	R	36.6	Very low	42.7	Very low	239 Å²	239	120.8 Å²	120.8	90%	0.902	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-47.3	116.5	-176.2	-80.4	-176.6	173.5	175.6	-1.3	109.2	P406 T410	P406-R408 PolarHBondContact O-N 2.84Å; R408-T410 VanDerWaalsContact C-N 3.28Å; R408-T410 PolarHBondContact O-N 3.25Å
409	M	38.9	Very low	43.4	Very low	157 Å²	157	117.8 Å²	117.8	77%	0.773	62%	0.615	S	S	*	*			trans	-76.4	73.3	-154.7	-170.7	142.2	70.6	0	0	113	P407 L411	P407-M409 WeakPolarHBondContact O-CA 3.25Å; P407-M409 PolarHBondContact O-N 3.18Å; M409-L411 VanDerWaalsContact C-N 3.35Å; M409-L411 HydrophobicContact CG-CD1 4.16Å; M409-L411 HydrophobicContact CG-CD2 3.52Å; M409-L411 HydrophobicContact CG-CG 3.51Å; M409-L411 PolarHBondContact O-N 2.75Å; M409-L411 HydrophobicContact SD-CD2 3.77Å; M409-L411 HydrophobicContact SD-CG 4.27Å
410	T	34.3	Very low	44.8	Very low	128 Å²	128	113.2 Å²	113.2	79%	0.785	59%	0.593	S	S	*	*			trans	-77.9	89.7	156.7	49.7	0	0	0	0	107.9	R408 N412	R408-T410 VanDerWaalsContact C-N 3.28Å; R408-T410 PolarHBondContact O-N 3.25Å; T410-N412 VanDerWaalsContact C-N 3.26Å; T410-N412 PolarHBondContact O-N 2.92Å
411	L	34.7	Very low	46.5	Very low	102 Å²	102	108.1 Å²	108.1	53%	0.534	57%	0.571	S	S	.	*			trans	-67.2	80.7	175.6	-66.6	170	0	0	0	110.8	M409 N413	M409-L411 VanDerWaalsContact C-N 3.35Å; M409-L411 HydrophobicContact CG-CD1 4.16Å; M409-L411 HydrophobicContact CG-CD2 3.52Å; M409-L411 HydrophobicContact CG-CG 3.51Å; M409-L411 PolarHBondContact O-N 2.75Å; M409-L411 HydrophobicContact SD-CD2 3.77Å; M409-L411 HydrophobicContact SD-CG 4.27Å; L411-N413 WeakPolarHBondContact CD2-OD1 3.34Å; L411-N413 PolarHBondContact O-N 3.41Å
412	N	36.2	Very low	48.3	Very low	98 Å²	98	103.6 Å²	103.6	52%	0.524	55%	0.547	S	S	.	.			trans	-74	73.2	154.2	-81.8	13.5	0	0	0	107.8	W55 T410 E414	W55-N412 HydrophobicContact CE3-CB 4.23Å; W55-N412 HydrophobicContact CH2-CB 3.65Å; W55-N412 VanDerWaalsContact CH2-CG 3.45Å; W55-N412 WeakPolarHBondContact CH2-ND2 3.34Å; W55-N412 HydrophobicContact CZ2-CB 4.42Å; W55-N412 WeakPolarHBondContact CZ2-ND2 3.43Å; W55-N412 HydrophobicContact CZ3-CB 3.51Å; T410-N412 VanDerWaalsContact C-N 3.26Å; T410-N412 PolarHBondContact O-N 2.92Å; N412-E414 PolarHBondContact O-N 2.87Å
413	N	37.8	Very low	50	Low	112 Å²	112	98.2 Å²	98.2	60%	0.599	51%	0.511	S	S	*	.			trans	-78.1	6.9	179.5	-86.1	-1.3	0	0	0	113.3	L411 R415	L411-N413 WeakPolarHBondContact CD2-OD1 3.34Å; L411-N413 PolarHBondContact O-N 3.41Å; N413-R415 PolarHBondContact O-N 3.09Å
414	E	37.2	Very low	51.5	Low	106 Å²	106	91.8 Å²	91.8	50%	0.495	48%	0.477	S	S	.	.			trans	-76.6	107.5	177	-62.5	177.3	-159.2	0	0	108.7	W55 N412	W55-E414 VanDerWaalsContact CE3-CD 3.46Å; W55-E414 HydrophobicContact CE3-CG 4.13Å; W55-E414 HydrophobicContact CH2-CB 4.07Å; W55-E414 HydrophobicContact CH2-CG 4.47Å; W55-E414 HydrophobicContact CZ3-CB 3.64Å; W55-E414 HydrophobicContact CZ3-CG 3.6Å; N412-E414 PolarHBondContact O-N 2.87Å
415	R	45.6	Very low	53.4	Low	100 Å²	100	85.9 Å²	85.9	38%	0.377	45%	0.446	S	S	.	.			trans	-60.4	133.7	165.2	-67	-178.7	172.5	-169.5	-4.9	107.6	N413 F417 M418	N413-R415 PolarHBondContact O-N 3.09Å; R415-F417 WeakPolarHBondContact CB-O 3.3Å; R415-F417 PolarHBondContact O-N 2.93Å; R415-M418 HydrophobicContact CB-SD 4.18Å
416	P	45.5	Very low	55.9	Low	111 Å²	111	78.6 Å²	78.6	72%	0.721	41%	0.407	S	S	*	.	S	Bend	trans	-61.6	-27.5	175.6	24.9	-33.3	0	0	0	111.9
417	F	54.3	Low	58.4	Low	42 Å²	42	73.4 Å²	73.4	18%	0.184	37%	0.373	C	S	.	.			trans	-136.4	125.5	174.3	-50.2	-71.8	0	0	0	109.6	R415 L420 L455 P456 L458	R415-F417 WeakPolarHBondContact CB-O 3.3Å; R415-F417 PolarHBondContact O-N 2.93Å; F417-L420 HydrophobicContact CB-CD2 4.02Å; F417-L420 HydrophobicContact CD2-CD2 4.38Å; F417-L455 HydrophobicContact CD1-CB 4.39Å; F417-L455 HydrophobicContact CD2-CD1 4.02Å; F417-L455 HydrophobicContact CD2-CD2 4.34Å; F417-L455 HydrophobicContact CE1-CB 4.17Å; F417-L455 HydrophobicContact CE2-CD1 3.82Å; F417-L455 HydrophobicContact CG-CD2 4.21Å; F417-L455 HydrophobicContact CZ-CB 4.3Å; F417-L455 HydrophobicContact CZ-CD1 4.22Å; F417-P456 HydrophobicContact CD1-CG 3.99Å; F417-P456 HydrophobicContact CE1-CG 4.28Å; F417-P456 WeakPolarHBondContact CE1-O 3.16Å; F417-L458 HydrophobicContact CZ-CD1 4.16Å; F417-L458 HydrophobicContact CZ-CD2 4.13Å; F417-L458 HydrophobicContact CZ-CG 4.09Å
418	M	49.7	Very low	60.9	Low	117 Å²	117	68.2 Å²	68.2	58%	0.576	34%	0.338	S	S	*	.	S	Bend	trans	-76.8	-25.9	-176.5	-76	-61.8	-65.5	0	0	113.9	R415	R415-M418 HydrophobicContact CB-SD 4.18Å
419	L	62.8	Low	63.5	Low	43 Å²	43	56.8 Å²	56.8	23%	0.225	30%	0.295	C	S	.	.	S	Bend	trans	-130.9	109.8	-179.8	-76.2	148.8	0	0	0	108.3	L75 F85	L75-L419 HydrophobicContact CD1-CD1 4.37Å; F85-L419 HydrophobicContact CE2-CD1 4.37Å; F85-L419 HydrophobicContact CZ-CD1 4.2Å
420	L	71.8	Confident	66	Low	31 Å²	31	49.3 Å²	49.3	16%	0.162	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-91.9	142	175	-70.5	172.4	0	0	0	110.3	T335 F417 L455	T335-L420 WeakPolarHBondContact CG2-O 3.31Å; T335-L420 WeakPolarHBondContact O-CB 3.45Å; T335-L420 VanDerWaalsContact O-CD1 3.24Å; T335-L420 WeakPolarHBondContact O-CD1 3.44Å; F417-L420 HydrophobicContact CB-CD2 4.02Å; F417-L420 HydrophobicContact CD2-CD2 4.38Å; L420-L455 HydrophobicContact CD2-CD2 3.84Å
421	P	81.2	Confident	68.6	Low	15 Å²	15	43.7 Å²	43.7	10%	0.097	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-63.3	150.3	170.6	-6.9	16.1	0	0	0	111.2	E425 L454 L455	P421-E425 HydrophobicContact CB-CB 4.22Å; P421-L454 HydrophobicContact CG-CB 3.77Å; P421-L454 HydrophobicContact CG-CD1 4.36Å; P421-L454 HydrophobicContact CG-CD2 4.49Å; P421-L454 HydrophobicContact CG-CG 4.44Å; P421-L455 HydrophobicContact CG-CD2 4.38Å
422	P	84.7	Confident	71.2	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-65.7	151.5	173.6	29.2	-34.3	0	0	0	111.3	L297 L333 T335 M424 E425	L297-P422 HydrophobicContact CD2-CG 4.15Å; L333-P422 HydrophobicContact CD2-CB 4.47Å; T335-P422 HydrophobicContact CG2-CB 4.49Å; P422-M424 HydrophobicContact CB-CG 4.13Å; P422-M424 HydrophobicContact CG-CG 3.94Å; P422-M424 PolarHBondContact O-N 3.45Å; P422-E425 HydrophobicContact CG-CG 3.98Å; P422-E425 PolarHBondContact O-N 3.37Å
423	L	86.3	Confident	73.8	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-52.1	-34.1	-175.9	179.9	61.9	0	0	0	112.9	L332 A334 L343 L346 V347 L387 L391 E425 W426 M427	L332-L423 PolarHBondContact O-N 3.33Å; A334-L423 WeakPolarHBondContact O-CB 3.37Å; A334-L423 PolarHBondContact O-N 3.34Å; L343-L423 HydrophobicContact CD1-CD1 4.04Å; L346-L423 HydrophobicContact CB-CD2 3.89Å; V347-L423 HydrophobicContact CG2-CD1 4.27Å; V347-L423 HydrophobicContact CG2-CD2 4.32Å; L387-L423 HydrophobicContact CD2-CD1 4.04Å; L391-L423 HydrophobicContact CD1-CD1 3.84Å; L423-E425 PolarHBondContact O-N 2.62Å; L423-W426 WeakPolarHBondContact O-CB 3.45Å; L423-W426 PolarHBondContact O-N 3.35Å; L423-M427 HydrophobicContact CD1-CG 4.31Å; L423-M427 HydrophobicContact CD2-SD 4.39Å; L423-M427 HydrophobicContact CG-CG 4.27Å; L423-M427 HydrophobicContact CG-SD 4.02Å; L423-M427 WeakPolarHBondContact O-CG 3.21Å; L423-M427 PolarHBondContact O-N 3.17Å
424	M	86	Confident	76	Confident	16 Å²	16	30.1 Å²	30.1	8%	0.079	15%	0.15	C	C	.	.	H	α-helix	trans	-56	-34.6	175.8	67.4	171.1	-69.5	0	0	114.1	L299 P300 L332 P422 R428	L299-M424 HydrophobicContact CD2-SD 3.5Å; L299-M424 VanDerWaalsContact CD2-SD 3.5Å; P300-M424 HydrophobicContact CG-CE 3.65Å; L332-M424 HydrophobicContact CB-CB 4.08Å; L332-M424 HydrophobicContact CD2-CB 3.89Å; L332-M424 PolarHBondContact O-N 3.03Å; P422-M424 HydrophobicContact CB-CG 4.13Å; P422-M424 HydrophobicContact CG-CG 3.94Å; P422-M424 PolarHBondContact O-N 3.45Å; M424-R428 VanDerWaalsContact O-CB 3.29Å; M424-R428 WeakPolarHBondContact O-CB 3.45Å; M424-R428 PolarHBondContact O-N 3.26Å
425	E	86.1	Confident	78.2	Confident	3 Å²	3	28 Å²	28	1%	0.014	14%	0.14	C	C	.	.	H	α-helix	trans	-77.5	-39.6	-178	-66.2	-59.4	141.6	0	0	110.5	C289 P421 P422 L423 M427 R428 V429 L454	C289-E425 HydrophobicContact CB-CG 4.11Å; C289-E425 PolarHBondContact SG-OE2 2.78Å; P421-E425 HydrophobicContact CB-CB 4.22Å; P422-E425 HydrophobicContact CG-CG 3.98Å; P422-E425 PolarHBondContact O-N 3.37Å; L423-E425 PolarHBondContact O-N 2.62Å; E425-M427 VanDerWaalsContact C-N 3.33Å; E425-M427 PolarHBondContact O-N 3.01Å; E425-R428 PolarHBondContact O-N 2.96Å; E425-R428 IonicContact OE1-NE 2.84Å; E425-R428 IonicContact OE2-CZ 3.22Å; E425-R428 IonicContact OE2-NE 3.75Å; E425-R428 PolarHBondContact OE2-NE 3.37Å; E425-R428 IonicContact OE2-NH2 2.67Å; E425-R428 PolarHBondContact OE2-NH2 3.3Å; E425-V429 WeakPolarHBondContact O-CB 3.4Å; E425-V429 VanDerWaalsContact O-CG2 3.28Å; E425-V429 WeakPolarHBondContact O-CG2 3.41Å; E425-V429 PolarHBondContact O-N 2.9Å; E425-L454 HydrophobicContact CB-CD1 4.47Å; E425-L454 HydrophobicContact CB-CD2 4.33Å
426	W	90	Very high	80	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.9	-45.9	169	-73.7	96.2	0	0	0	111.8	L387 F390 L423 A430 I447 A450 A451 L454 L455	L387-W426 HydrophobicContact CD1-CB 3.98Å; L387-W426 HydrophobicContact CD1-CD2 3.67Å; L387-W426 HydrophobicContact CD1-CE3 3.55Å; L387-W426 HydrophobicContact CD1-CG 3.88Å; L387-W426 HydrophobicContact CD1-CZ3 4.22Å; F390-W426 HydrophobicContact CB-CH2 3.66Å; F390-W426 HydrophobicContact CB-CZ2 3.94Å; F390-W426 HydrophobicContact CB-CZ3 4.4Å; F390-W426 HydrophobicContact CD1-CH2 4.36Å; F390-W426 AromaticContact CD2-CH2 3.94Å; F390-W426 HydrophobicContact CD2-CH2 3.94Å; F390-W426 HydrophobicContact CD2-CZ3 4.11Å; F390-W426 AromaticContact CG-CH2 3.74Å; F390-W426 HydrophobicContact CG-CH2 3.74Å; F390-W426 HydrophobicContact CG-CZ2 4.47Å; F390-W426 HydrophobicContact CG-CZ3 4.36Å; L423-W426 WeakPolarHBondContact O-CB 3.45Å; L423-W426 PolarHBondContact O-N 3.35Å; W426-A430 WeakPolarHBondContact O-CB 3.26Å; W426-A430 PolarHBondContact O-N 3.34Å; W426-I447 HydrophobicContact CE3-CG2 4.47Å; W426-I447 HydrophobicContact CZ3-CG2 4.19Å; W426-A450 HydrophobicContact CE3-CB 4.05Å; W426-A450 HydrophobicContact CZ3-CB 4.25Å; W426-A451 HydrophobicContact CH2-CB 3.68Å; W426-A451 HydrophobicContact CZ3-CB 3.78Å; W426-L454 HydrophobicContact CD2-CD1 3.9Å; W426-L454 HydrophobicContact CE3-CD1 4.2Å; W426-L454 HydrophobicContact CG-CD1 4.08Å; W426-L455 HydrophobicContact CH2-CD1 3.8Å; W426-L455 HydrophobicContact CH2-CG 4.26Å; W426-L455 HydrophobicContact CZ2-CD1 3.84Å; W426-L455 HydrophobicContact CZ2-CD2 4.32Å; W426-L455 HydrophobicContact CZ2-CG 4.07Å
427	M	89.8	Confident	81.7	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-64	-50.3	177.1	-70.1	-179.4	63.9	0	0	111.5	V347 A350 M351 M354 W379 L423 E425 V429 A430 I431	V347-M427 HydrophobicContact CG1-CE 4.4Å; V347-M427 HydrophobicContact CG2-SD 4.45Å; A350-M427 HydrophobicContact CB-CE 3.6Å; A350-M427 HydrophobicContact CB-SD 3.68Å; M351-M427 HydrophobicContact CG-CE 3.7Å; M351-M427 HydrophobicContact SD-CE 3.47Å; M351-M427 WeakPolarHBondContact SD-CE 3.49Å; M354-M427 HydrophobicContact SD-CE 3.99Å; W379-M427 HydrophobicContact CH2-CG 4.32Å; W379-M427 HydrophobicContact CZ2-CB 4.43Å; W379-M427 HydrophobicContact CZ2-CG 4.02Å; L423-M427 HydrophobicContact CD1-CG 4.31Å; L423-M427 HydrophobicContact CD2-SD 4.39Å; L423-M427 HydrophobicContact CG-CG 4.27Å; L423-M427 HydrophobicContact CG-SD 4.02Å; L423-M427 WeakPolarHBondContact O-CG 3.21Å; L423-M427 PolarHBondContact O-N 3.17Å; E425-M427 VanDerWaalsContact C-N 3.33Å; E425-M427 PolarHBondContact O-N 3.01Å; M427-V429 PolarHBondContact O-N 3.32Å; M427-A430 PolarHBondContact O-N 3.07Å; M427-I431 HydrophobicContact CB-CD1 4.27Å; M427-I431 WeakPolarHBondContact O-CB 3.46Å; M427-I431 WeakPolarHBondContact O-CD1 3.32Å; M427-I431 WeakPolarHBondContact O-CG1 3.21Å; M427-I431 PolarHBondContact O-N 2.97Å
428	R	89.1	Confident	82.6	Confident	9 Å²	9	25.1 Å²	25.1	3%	0.034	12%	0.115	C	C	.	.	H	α-helix	trans	-53.2	-51.5	178.1	179.5	-177.2	65.1	74.3	0.5	111.7	R163 L164 H166 W168 M424 E425 T432	R163-R428 PolarHBondContact O-NH1 2.89Å; L164-R428 VanDerWaalsContact C-NH1 3.27Å; L164-R428 PolarHBondContact O-NH1 3.33Å; L164-R428 PolarHBondContact O-NH2 3.44Å; H166-R428 PolarHBondContact O-NH1 2.81Å; H166-R428 VanDerWaalsContact O-NH1 3.15Å; W168-R428 HydrophobicContact CE3-CG 4.43Å; M424-R428 VanDerWaalsContact O-CB 3.29Å; M424-R428 WeakPolarHBondContact O-CB 3.45Å; M424-R428 PolarHBondContact O-N 3.26Å; E425-R428 PolarHBondContact O-N 2.96Å; E425-R428 IonicContact OE1-NE 2.84Å; E425-R428 IonicContact OE2-CZ 3.22Å; E425-R428 IonicContact OE2-NE 3.75Å; E425-R428 PolarHBondContact OE2-NE 3.37Å; E425-R428 IonicContact OE2-NH2 2.67Å; E425-R428 PolarHBondContact OE2-NH2 3.3Å; R428-T432 WeakPolarHBondContact O-CB 3.38Å; R428-T432 PolarHBondContact O-N 3.07Å; R428-T432 PolarHBondContact O-OG1 3.26Å
429	V	91.9	Very high	83.9	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-69.6	-46.3	-175.5	175.3	0	0	0	0	111.2	L164 E425 M427 T432 Y433 A450 L453 L454	L164-V429 HydrophobicContact CD2-CB 4.46Å; L164-V429 HydrophobicContact CD2-CG1 3.79Å; E425-V429 WeakPolarHBondContact O-CB 3.4Å; E425-V429 VanDerWaalsContact O-CG2 3.28Å; E425-V429 WeakPolarHBondContact O-CG2 3.41Å; E425-V429 PolarHBondContact O-N 2.9Å; M427-V429 PolarHBondContact O-N 3.32Å; V429-T432 PolarHBondContact O-N 3.38Å; V429-Y433 HydrophobicContact CG1-CD2 3.98Å; V429-Y433 HydrophobicContact CG1-CE2 3.59Å; V429-Y433 VanDerWaalsContact O-CD2 3.28Å; V429-Y433 WeakPolarHBondContact O-CD2 3.22Å; V429-Y433 PolarHBondContact O-N 3.32Å; V429-Y433 VanDerWaalsContact O-N 3.09Å; V429-A450 HydrophobicContact CB-CB 4.09Å; V429-A450 HydrophobicContact CG1-CB 3.57Å; V429-L453 HydrophobicContact CG1-CD2 3.96Å; V429-L453 HydrophobicContact CG2-CD2 4.19Å; V429-L454 HydrophobicContact CG2-CD1 4.37Å; V429-L454 HydrophobicContact CG2-CD2 4.28Å; V429-L454 HydrophobicContact CG2-CG 4.47Å
430	A	91.9	Very high	84.6	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.1	-41	179.1	0	0	0	0	0	113.1	W379 W426 M427 T432 Y433 A434 V442 D446 I447	W379-A430 HydrophobicContact CH2-CB 4.04Å; W426-A430 WeakPolarHBondContact O-CB 3.26Å; W426-A430 PolarHBondContact O-N 3.34Å; M427-A430 PolarHBondContact O-N 3.07Å; A430-T432 VanDerWaalsContact C-N 3.35Å; A430-Y433 PolarHBondContact O-N 3.07Å; A430-A434 PolarHBondContact O-N 3.05Å; A430-A434 VanDerWaalsContact O-N 3.09Å; A430-V442 HydrophobicContact CB-CG1 4.03Å; A430-D446 HydrophobicContact CB-CB 4.42Å; A430-I447 HydrophobicContact CB-CD1 3.61Å
431	I	88.6	Confident	85	Confident	10 Å²	10	21.9 Å²	21.9	5%	0.051	10%	0.102	C	C	.	.	H	α-helix	trans	-63.6	-42.2	174.8	-68.8	165.6	0	0	0	110.2	M351 M354 I377 W379 M427 Y433 A434 E435 V442	M351-I431 HydrophobicContact CE-CD1 4.17Å; M351-I431 HydrophobicContact SD-CD1 3.6Å; M354-I431 HydrophobicContact CE-CD1 4.46Å; I377-I431 HydrophobicContact CD1-CG2 3.77Å; W379-I431 HydrophobicContact CZ2-CG1 4.42Å; M427-I431 HydrophobicContact CB-CD1 4.27Å; M427-I431 WeakPolarHBondContact O-CB 3.46Å; M427-I431 WeakPolarHBondContact O-CD1 3.32Å; M427-I431 WeakPolarHBondContact O-CG1 3.21Å; M427-I431 PolarHBondContact O-N 2.97Å; I431-Y433 VanDerWaalsContact C-N 3.35Å; I431-Y433 PolarHBondContact O-N 3.04Å; I431-A434 PolarHBondContact O-N 3.48Å; I431-A434 VanDerWaalsContact O-N 3.16Å; I431-E435 HydrophobicContact CG2-CG 4.26Å; I431-E435 WeakPolarHBondContact O-CG 3.34Å; I431-E435 PolarHBondContact O-N 3.39Å; I431-V442 HydrophobicContact CG1-CG2 4.42Å
432	T	90	Very high	85.3	Confident	9 Å²	9	21.2 Å²	21.2	6%	0.055	10%	0.098	C	C	.	.	H	α-helix	trans	-62.3	-39.5	178.6	-58.2	0	0	0	0	112.2	R163 L164 R428 V429 A430 H436	R163-T432 HydrophobicContact CB-CG2 3.62Å; L164-T432 HydrophobicContact CD2-CG2 3.81Å; L164-T432 HydrophobicContact CG-CG2 3.79Å; R428-T432 WeakPolarHBondContact O-CB 3.38Å; R428-T432 PolarHBondContact O-N 3.07Å; R428-T432 PolarHBondContact O-OG1 3.26Å; V429-T432 PolarHBondContact O-N 3.38Å; A430-T432 VanDerWaalsContact C-N 3.35Å; T432-H436 WeakPolarHBondContact O-CB 3.38Å; T432-H436 PolarHBondContact O-N 2.89Å
433	Y	89.1	Confident	85.4	Confident	18 Å²	18	22 Å²	22	7%	0.071	10%	0.102	C	C	.	.	H	α-helix	trans	-64.5	-43	172.8	-76.4	-60.5	0	0	0	112.1	E142 L146 L164 V429 A430 I431 H436 R437 Q449 R452	E142-Y433 PolarHBondContact OE2-OH 3.5Å; L146-Y433 HydrophobicContact CD2-CD1 4.1Å; L146-Y433 HydrophobicContact CD2-CE1 3.95Å; L164-Y433 HydrophobicContact CD1-CD1 4.21Å; L164-Y433 HydrophobicContact CD1-CE1 3.55Å; L164-Y433 HydrophobicContact CD1-CE2 4.5Å; L164-Y433 HydrophobicContact CD2-CD1 4.23Å; L164-Y433 HydrophobicContact CD2-CD2 3.85Å; L164-Y433 HydrophobicContact CD2-CE1 4Å; L164-Y433 HydrophobicContact CD2-CE2 3.6Å; L164-Y433 HydrophobicContact CD2-CG 4.15Å; L164-Y433 HydrophobicContact CG-CE1 4.46Å; V429-Y433 HydrophobicContact CG1-CD2 3.98Å; V429-Y433 HydrophobicContact CG1-CE2 3.59Å; V429-Y433 VanDerWaalsContact O-CD2 3.28Å; V429-Y433 WeakPolarHBondContact O-CD2 3.22Å; V429-Y433 PolarHBondContact O-N 3.32Å; V429-Y433 VanDerWaalsContact O-N 3.09Å; A430-Y433 PolarHBondContact O-N 3.07Å; I431-Y433 VanDerWaalsContact C-N 3.35Å; I431-Y433 PolarHBondContact O-N 3.04Å; Y433-H436 PolarHBondContact O-N 3.04Å; Y433-R437 WeakPolarHBondContact O-CG 3.17Å; Y433-R437 PolarHBondContact O-N 2.78Å; Y433-Q449 HydrophobicContact CD1-CB 4.47Å; Y433-Q449 HydrophobicContact CD2-CB 3.77Å; Y433-Q449 HydrophobicContact CE1-CB 4.19Å; Y433-Q449 HydrophobicContact CE2-CB 3.42Å; Y433-Q449 VanDerWaalsContact CE2-CB 3.42Å; Y433-Q449 HydrophobicContact CG-CB 4.3Å; Y433-R452 PolarHBondContact OH-NH2 2.64Å
434	A	85	Confident	85.4	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63	-41.6	176	0	0	0	0	0	112.7	A430 I431 R437 R438 S439 V442	A430-A434 PolarHBondContact O-N 3.05Å; A430-A434 VanDerWaalsContact O-N 3.09Å; I431-A434 PolarHBondContact O-N 3.48Å; I431-A434 VanDerWaalsContact O-N 3.16Å; A434-R437 CarbonylContact O-C 3.55Å; A434-R437 WeakPolarHBondContact O-CG 3.45Å; A434-R438 PolarHBondContact O-N 3.42Å; A434-S439 PolarHBondContact O-N 2.93Å; A434-V442 HydrophobicContact CB-CG2 4.01Å
435	E	83.4	Confident	85.4	Confident	60 Å²	60	23.2 Å²	23.2	28%	0.28	11%	0.114	S	C	.	.	H	α-helix	trans	-63.5	-43.7	174.3	-76.7	-176	-178.2	0	0	112.6	R163 I377 I431 R437 R438	R163-E435 IonicContact NH1-OE2 3.73Å; R163-E435 PolarHBondContact NH1-OE2 3.35Å; R163-E435 VanDerWaalsContact NH1-OE2 3.14Å; I377-E435 HydrophobicContact CD1-CG 3.85Å; I431-E435 HydrophobicContact CG2-CG 4.26Å; I431-E435 WeakPolarHBondContact O-CG 3.34Å; I431-E435 PolarHBondContact O-N 3.39Å; E435-R437 VanDerWaalsContact C-N 3.33Å; E435-R437 PolarHBondContact O-N 3.13Å; E435-R438 WeakPolarHBondContact O-CA 3.38Å; E435-R438 PolarHBondContact O-N 3.2Å
436	H	83.6	Confident	85.6	Confident	30 Å²	30	23.3 Å²	23.3	14%	0.139	12%	0.115	C	C	.	.	H	α-helix	trans	-59	-45.3	179.3	179.4	76.8	0	0	0	111.2	E157 S160 T432 Y433 R438	E157-H436 IonicContact OE1-CE1 3.38Å; E157-H436 PolarHBondContact OE1-CE1 3.15Å; S160-H436 WeakPolarHBondContact CB-ND1 3.45Å; S160-H436 PolarHBondContact OG-ND1 3.28Å; T432-H436 WeakPolarHBondContact O-CB 3.38Å; T432-H436 PolarHBondContact O-N 2.89Å; Y433-H436 PolarHBondContact O-N 3.04Å; H436-R438 PolarHBondContact O-N 2.87Å
437	R	79.6	Confident	85.5	Confident	47 Å²	47	23.3 Å²	23.3	18%	0.177	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	12.5	172.5	72.2	-170.6	178.9	76.9	0.7	114.3	Y433 A434 E435 S439 T441 D443 D446	Y433-R437 WeakPolarHBondContact O-CG 3.17Å; Y433-R437 PolarHBondContact O-N 2.78Å; A434-R437 CarbonylContact O-C 3.55Å; A434-R437 WeakPolarHBondContact O-CG 3.45Å; E435-R437 VanDerWaalsContact C-N 3.33Å; E435-R437 PolarHBondContact O-N 3.13Å; R437-S439 PolarHBondContact NH1-OG 3.46Å; R437-S439 VanDerWaalsContact NH1-OG 3.07Å; R437-S439 PolarHBondContact O-N 3.3Å; R437-T441 PolarHBondContact NH2-O 3.47Å; R437-D443 IonicContact CZ-OD2 3.79Å; R437-D443 IonicContact NH2-OD2 3.68Å; R437-D446 IonicContact CZ-OD1 3.18Å; R437-D446 IonicContact CZ-OD2 2.85Å; R437-D446 IonicContact NE-OD1 3.67Å; R437-D446 PolarHBondContact NE-OD1 3.5Å; R437-D446 IonicContact NE-OD2 3.91Å; R437-D446 PolarHBondContact NE-OD2 3.28Å; R437-D446 IonicContact NH2-OD1 2.7Å; R437-D446 IonicContact NH2-OD2 3.69Å; R437-D446 PolarHBondContact NH2-OD2 3.26Å
438	R	75.1	Confident	85.4	Confident	116 Å²	116	28.4 Å²	28.4	44%	0.438	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	31.6	175.7	-54.4	173.3	-172.6	-111.2	-4.3	114.1	A434 E435 H436 H563 P564	A434-R438 PolarHBondContact O-N 3.42Å; E435-R438 WeakPolarHBondContact O-CA 3.38Å; E435-R438 PolarHBondContact O-N 3.2Å; H436-R438 PolarHBondContact O-N 2.87Å; R438-H563 PolarHBondContact NE-CD2 2.64Å; R438-H563 PolarHBondContact NE-NE2 2.82Å; R438-P564 VanDerWaalsContact CZ-CG 3.48Å; R438-P564 VanDerWaalsContact NH1-CG 3.27Å; R438-P564 VanDerWaalsContact NH2-CD 3.35Å
439	S	76.8	Confident	85.5	Confident	18 Å²	18	29 Å²	29	13%	0.126	14%	0.137	C	C	.	.			trans	-97.2	138	-178.1	179.5	0	0	0	0	112.2	A434 R437 T441	A434-S439 PolarHBondContact O-N 2.93Å; R437-S439 PolarHBondContact NH1-OG 3.46Å; R437-S439 VanDerWaalsContact NH1-OG 3.07Å; R437-S439 PolarHBondContact O-N 3.3Å; S439-T441 VanDerWaalsContact C-N 3.25Å; S439-T441 PolarHBondContact OG-N 3.18Å; S439-T441 PolarHBondContact OG-O 3.45Å; S439-T441 PolarHBondContact OG-OG1 3.41Å
440	L	76.1	Confident	85.4	Confident	86 Å²	86	29 Å²	29	45%	0.45	14%	0.137	S	C	.	.	S	Bend	trans	-86.3	4.3	170.3	-57.2	175.3	0	0	0	112.8	Q375 I377 T378	Q375-L440 HydrophobicContact CB-CD1 4.11Å; I377-L440 WeakPolarHBondContact CA-O 3.26Å; T378-L440 PolarHBondContact N-O 2.99Å; T378-L440 PolarHBondContact OG1-O 3.17Å; T378-L440 VanDerWaalsContact OG1-O 3.07Å
441	T	81.9	Confident	85.2	Confident	20 Å²	20	29 Å²	29	12%	0.123	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.1	177.2	66.3	0	0	0	0	110.8	T378 R437 S439	T378-T441 CarbonylContact O-C 3.48Å; T378-T441 VanDerWaalsContact O-CA 3.27Å; T378-T441 WeakPolarHBondContact O-CA 3.28Å; R437-T441 PolarHBondContact NH2-O 3.47Å; S439-T441 VanDerWaalsContact C-N 3.25Å; S439-T441 PolarHBondContact OG-N 3.18Å; S439-T441 PolarHBondContact OG-O 3.45Å; S439-T441 PolarHBondContact OG-OG1 3.41Å
442	V	87.4	Confident	85.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	128.7	168.1	-177.8	0	0	0	0	109	I377 T378 W379 S380 A383 A430 I431 A434 D446 I447	I377-V442 HydrophobicContact CG2-CG2 3.83Å; T378-V442 PolarHBondContact O-N 3.06Å; W379-V442 HydrophobicContact CD2-CB 4.07Å; W379-V442 HydrophobicContact CD2-CG1 4.24Å; W379-V442 HydrophobicContact CD2-CG2 4.29Å; W379-V442 HydrophobicContact CE3-CB 4.36Å; W379-V442 HydrophobicContact CE3-CG1 4.1Å; W379-V442 HydrophobicContact CG-CB 4.29Å; W379-V442 HydrophobicContact CG-CG2 4.48Å; W379-V442 HydrophobicContact CH2-CG1 4.35Å; W379-V442 HydrophobicContact CZ2-CG1 4.48Å; W379-V442 HydrophobicContact CZ2-CG2 4.43Å; W379-V442 HydrophobicContact CZ3-CG1 4.17Å; S380-V442 VanDerWaalsContact CB-O 3.3Å; S380-V442 WeakPolarHBondContact CB-O 3.37Å; S380-V442 PolarHBondContact N-O 3.21Å; S380-V442 PolarHBondContact OG-O 3.27Å; A383-V442 HydrophobicContact CB-CG1 4.23Å; A383-V442 WeakPolarHBondContact CB-O 3.4Å; A430-V442 HydrophobicContact CB-CG1 4.03Å; I431-V442 HydrophobicContact CG1-CG2 4.42Å; A434-V442 HydrophobicContact CB-CG2 4.01Å; V442-D446 WeakPolarHBondContact CA-OD2 3.25Å; V442-D446 HydrophobicContact CG1-CB 3.97Å; V442-I447 HydrophobicContact CG1-CD1 4.02Å
443	D	86.4	Confident	85	Confident	19 Å²	19	29.7 Å²	29.7	10%	0.102	14%	0.139	C	C	.	.			trans	-110.5	173.3	-177.6	81.6	18.1	0	0	0	113	S380 R437 G445 D446 R463	S380-D443 WeakPolarHBondContact OG-CA 3.47Å; R437-D443 IonicContact CZ-OD2 3.79Å; R437-D443 IonicContact NH2-OD2 3.68Å; D443-G445 PolarHBondContact O-N 3.29Å; D443-G445 WeakPolarHBondContact OD1-CA 3.39Å; D443-G445 PolarHBondContact OD1-N 2.75Å; D443-D446 PolarHBondContact N-OD2 3.38Å; D443-D446 PolarHBondContact O-N 3.06Å; D443-D446 PolarHBondContact OD1-N 3.19Å; D443-R463 IonicContact OD2-CZ 3.85Å; D443-R463 IonicContact OD2-NH2 3.33Å; D443-R463 PolarHBondContact OD2-NH2 3.04Å
444	S	85.9	Confident	84.9	Confident	28 Å²	28	29.1 Å²	29.1	20%	0.196	14%	0.137	C	C	.	.	H	α-helix	trans	-66.8	-21.4	179.9	68.3	0	0	0	0	113.7	T386 R448	T386-S444 VanDerWaalsContact OG1-CB 3.26Å; T386-S444 WeakPolarHBondContact OG1-CB 3.09Å; S444-R448 VanDerWaalsContact CB-NH1 3.26Å; S444-R448 WeakPolarHBondContact O-CG 3.37Å; S444-R448 VanDerWaalsContact O-CZ 3.3Å; S444-R448 PolarHBondContact O-N 3.25Å; S444-R448 PolarHBondContact O-NH1 2.89Å; S444-R448 PolarHBondContact OG-NH1 3.18Å; S444-R448 PolarHBondContact OG-NH2 2.67Å
445	G	85.5	Confident	84.7	Confident	13 Å²	13	29.3 Å²	29.3	13%	0.134	14%	0.138	C	C	.	.	H	α-helix	trans	-71.6	-44	174.4	0	0	0	0	0	112.1	D443 I447 R448 Q449	D443-G445 PolarHBondContact O-N 3.29Å; D443-G445 WeakPolarHBondContact OD1-CA 3.39Å; D443-G445 PolarHBondContact OD1-N 2.75Å; G445-I447 PolarHBondContact O-N 3.42Å; G445-R448 PolarHBondContact O-N 2.91Å; G445-R448 VanDerWaalsContact O-N 3.1Å; G445-Q449 WeakPolarHBondContact O-CG 3.44Å; G445-Q449 PolarHBondContact O-N 3.21Å
446	D	89.8	Confident	84.4	Confident	5 Å²	5	28.5 Å²	28.5	3%	0.027	14%	0.138	C	C	.	.	H	α-helix	trans	-56	-39	174.8	-54.5	-43.5	0	0	0	111	A430 R437 V442 D443 Q449 A450	A430-D446 HydrophobicContact CB-CB 4.42Å; R437-D446 IonicContact CZ-OD1 3.18Å; R437-D446 IonicContact CZ-OD2 2.85Å; R437-D446 IonicContact NE-OD1 3.67Å; R437-D446 PolarHBondContact NE-OD1 3.5Å; R437-D446 IonicContact NE-OD2 3.91Å; R437-D446 PolarHBondContact NE-OD2 3.28Å; R437-D446 IonicContact NH2-OD1 2.7Å; R437-D446 IonicContact NH2-OD2 3.69Å; R437-D446 PolarHBondContact NH2-OD2 3.26Å; V442-D446 WeakPolarHBondContact CA-OD2 3.25Å; V442-D446 HydrophobicContact CG1-CB 3.97Å; D443-D446 PolarHBondContact N-OD2 3.38Å; D443-D446 PolarHBondContact O-N 3.06Å; D443-D446 PolarHBondContact OD1-N 3.19Å; D446-Q449 PolarHBondContact O-N 2.75Å; D446-A450 WeakPolarHBondContact O-CB 3.21Å; D446-A450 PolarHBondContact O-N 2.84Å
447	I	89.6	Confident	83.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.9	-39.3	177	-51.7	-55.1	0	0	0	112.5	W379 A383 T386 L387 F390 W426 A430 V442 G445 A450 A451	W379-I447 HydrophobicContact CE3-CD1 4.36Å; W379-I447 HydrophobicContact CH2-CD1 3.86Å; W379-I447 HydrophobicContact CZ3-CD1 3.43Å; W379-I447 VanDerWaalsContact CZ3-CD1 3.43Å; W379-I447 HydrophobicContact CZ3-CG1 4.49Å; A383-I447 HydrophobicContact CB-CG1 4.01Å; T386-I447 HydrophobicContact CG2-CB 3.95Å; T386-I447 HydrophobicContact CG2-CG2 3.82Å; L387-I447 HydrophobicContact CB-CD1 4.48Å; L387-I447 HydrophobicContact CB-CG2 4.03Å; L387-I447 HydrophobicContact CD1-CG2 4.28Å; F390-I447 HydrophobicContact CD2-CG2 4.18Å; F390-I447 HydrophobicContact CE2-CG2 4.35Å; W426-I447 HydrophobicContact CE3-CG2 4.47Å; W426-I447 HydrophobicContact CZ3-CG2 4.19Å; A430-I447 HydrophobicContact CB-CD1 3.61Å; V442-I447 HydrophobicContact CG1-CD1 4.02Å; G445-I447 PolarHBondContact O-N 3.42Å; I447-A450 PolarHBondContact O-N 3.32Å; I447-A451 WeakPolarHBondContact O-CB 3.09Å; I447-A451 PolarHBondContact O-N 3.28Å
448	R	87.8	Confident	83.5	Confident	109 Å²	109	31.1 Å²	31.1	41%	0.411	17%	0.173	S	C	.	.	H	α-helix	trans	-66.5	-37.6	175.3	-72.3	-175	-64.2	-83	0.7	111.9	T386 S444 G445 A451 R452 C460	T386-R448 HydrophobicContact CG2-CG 4.19Å; S444-R448 VanDerWaalsContact CB-NH1 3.26Å; S444-R448 WeakPolarHBondContact O-CG 3.37Å; S444-R448 VanDerWaalsContact O-CZ 3.3Å; S444-R448 PolarHBondContact O-N 3.25Å; S444-R448 PolarHBondContact O-NH1 2.89Å; S444-R448 PolarHBondContact OG-NH1 3.18Å; S444-R448 PolarHBondContact OG-NH2 2.67Å; G445-R448 PolarHBondContact O-N 2.91Å; G445-R448 VanDerWaalsContact O-N 3.1Å; R448-A451 PolarHBondContact O-N 3.21Å; R448-R452 PolarHBondContact O-N 2.83Å; R448-R452 VanDerWaalsContact O-N 3.08Å; R448-C460 HydrophobicContact CB-CB 4.49Å
449	Q	89.6	Confident	83.4	Confident	20 Å²	20	30.1 Å²	30.1	9%	0.093	18%	0.176	C	C	.	.	H	α-helix	trans	-66.8	-38.6	172.9	-65.7	-64.9	-7.8	0	0	112.1	Y433 G445 D446 R452 L453 C460 E461	Y433-Q449 HydrophobicContact CD1-CB 4.47Å; Y433-Q449 HydrophobicContact CD2-CB 3.77Å; Y433-Q449 HydrophobicContact CE1-CB 4.19Å; Y433-Q449 HydrophobicContact CE2-CB 3.42Å; Y433-Q449 VanDerWaalsContact CE2-CB 3.42Å; Y433-Q449 HydrophobicContact CG-CB 4.3Å; G445-Q449 WeakPolarHBondContact O-CG 3.44Å; G445-Q449 PolarHBondContact O-N 3.21Å; D446-Q449 PolarHBondContact O-N 2.75Å; Q449-R452 PolarHBondContact O-N 3.44Å; Q449-L453 PolarHBondContact O-N 3.4Å; Q449-C460 PolarHBondContact NE2-SG 2.9Å; Q449-C460 VanDerWaalsContact NE2-SG 3.4Å; Q449-C460 PolarHBondContact OE1-O 3.39Å; Q449-E461 PolarHBondContact NE2-O 3.27Å
450	A	91.1	Very high	83.6	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-41.9	172.3	0	0	0	0	0	112.2	W426 V429 D446 I447 R452 L453 L454	W426-A450 HydrophobicContact CE3-CB 4.05Å; W426-A450 HydrophobicContact CZ3-CB 4.25Å; V429-A450 HydrophobicContact CB-CB 4.09Å; V429-A450 HydrophobicContact CG1-CB 3.57Å; D446-A450 WeakPolarHBondContact O-CB 3.21Å; D446-A450 PolarHBondContact O-N 2.84Å; I447-A450 PolarHBondContact O-N 3.32Å; A450-R452 PolarHBondContact O-N 3.09Å; A450-L453 PolarHBondContact O-N 3.19Å; A450-L454 WeakPolarHBondContact O-CB 3.36Å; A450-L454 VanDerWaalsContact O-CG 3.3Å; A450-L454 WeakPolarHBondContact O-CG 3.35Å; A450-L454 PolarHBondContact O-N 2.99Å
451	A	86.1	Confident	83.6	Confident	1 Å²	1	32.7 Å²	32.7	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-44	177.3	0	0	0	0	0	112.2	F390 W426 I447 R448 L453 L454 L455 L458	F390-A451 HydrophobicContact CD1-CB 4.34Å; F390-A451 HydrophobicContact CD2-CB 4.14Å; F390-A451 HydrophobicContact CE1-CB 3.9Å; F390-A451 HydrophobicContact CE2-CB 3.67Å; F390-A451 HydrophobicContact CG-CB 4.47Å; F390-A451 HydrophobicContact CZ-CB 3.54Å; W426-A451 HydrophobicContact CH2-CB 3.68Å; W426-A451 HydrophobicContact CZ3-CB 3.78Å; I447-A451 WeakPolarHBondContact O-CB 3.09Å; I447-A451 PolarHBondContact O-N 3.28Å; R448-A451 PolarHBondContact O-N 3.21Å; A451-L453 VanDerWaalsContact C-N 3.33Å; A451-L453 PolarHBondContact O-N 2.9Å; A451-L454 PolarHBondContact O-N 2.94Å; A451-L455 HydrophobicContact CB-CD1 4.45Å; A451-L455 WeakPolarHBondContact O-CB 3.44Å; A451-L455 PolarHBondContact O-N 3.42Å; A451-L458 HydrophobicContact CB-CD1 3.85Å
452	R	88.2	Confident	83.4	Confident	26 Å²	26	32.9 Å²	32.9	10%	0.098	19%	0.188	C	C	.	.	H	α-helix	trans	-57.8	-42.2	173.6	178.7	-149.8	57.7	84.6	6	112.2	E142 Y433 R448 Q449 A450 L458 C460	E142-R452 IonicContact OE1-CZ 3.14Å; E142-R452 VanDerWaalsContact OE1-CZ 3.27Å; E142-R452 IonicContact OE1-NH1 3.53Å; E142-R452 PolarHBondContact OE1-NH1 3Å; E142-R452 IonicContact OE1-NH2 2.85Å; E142-R452 PolarHBondContact OE1-NH2 3.21Å; E142-R452 IonicContact OE2-CZ 3.11Å; E142-R452 IonicContact OE2-NH2 3.37Å; E142-R452 PolarHBondContact OE2-NH2 3.11Å; Y433-R452 PolarHBondContact OH-NH2 2.64Å; R448-R452 PolarHBondContact O-N 2.83Å; R448-R452 VanDerWaalsContact O-N 3.08Å; Q449-R452 PolarHBondContact O-N 3.44Å; A450-R452 PolarHBondContact O-N 3.09Å; R452-L458 WeakPolarHBondContact CG-O 3.42Å; R452-C460 HydrophobicContact CB-CB 4.09Å
453	L	87.8	Confident	83.1	Confident	8 Å²	8	36.4 Å²	36.4	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-71.9	-39.9	180	-176.7	57.2	0	0	0	112.3	E142 L164 L287 V429 Q449 A450 A451	E142-L453 HydrophobicContact CG-CD1 4.43Å; L164-L453 HydrophobicContact CB-CD2 4.06Å; L287-L453 HydrophobicContact CB-CD1 3.94Å; L287-L453 HydrophobicContact CB-CG 4.01Å; L287-L453 WeakPolarHBondContact CB-O 3.29Å; L287-L453 HydrophobicContact CD2-CD2 4.28Å; L287-L453 HydrophobicContact CD2-CG 4.3Å; L287-L453 PolarHBondContact N-O 2.9Å; V429-L453 HydrophobicContact CG1-CD2 3.96Å; V429-L453 HydrophobicContact CG2-CD2 4.19Å; Q449-L453 PolarHBondContact O-N 3.4Å; A450-L453 PolarHBondContact O-N 3.19Å; A451-L453 VanDerWaalsContact C-N 3.33Å; A451-L453 PolarHBondContact O-N 2.9Å
454	L	86.3	Confident	82.6	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-94.9	-21.2	-167.9	-65.5	174.6	0	0	0	114.9	L287 C289 P421 E425 W426 V429 A450 A451	L287-L454 HydrophobicContact CD2-CD2 4.42Å; C289-L454 WeakPolarHBondContact SG-CD2 3.35Å; P421-L454 HydrophobicContact CG-CB 3.77Å; P421-L454 HydrophobicContact CG-CD1 4.36Å; P421-L454 HydrophobicContact CG-CD2 4.49Å; P421-L454 HydrophobicContact CG-CG 4.44Å; E425-L454 HydrophobicContact CB-CD1 4.47Å; E425-L454 HydrophobicContact CB-CD2 4.33Å; W426-L454 HydrophobicContact CD2-CD1 3.9Å; W426-L454 HydrophobicContact CE3-CD1 4.2Å; W426-L454 HydrophobicContact CG-CD1 4.08Å; V429-L454 HydrophobicContact CG2-CD1 4.37Å; V429-L454 HydrophobicContact CG2-CD2 4.28Å; V429-L454 HydrophobicContact CG2-CG 4.47Å; A450-L454 WeakPolarHBondContact O-CB 3.36Å; A450-L454 VanDerWaalsContact O-CG 3.3Å; A450-L454 WeakPolarHBondContact O-CG 3.35Å; A450-L454 PolarHBondContact O-N 2.99Å; A451-L454 PolarHBondContact O-N 2.94Å
455	L	81.4	Confident	82.2	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.016	22%	0.223	C	C	.	.	S	Bend	trans	-117.2	141.9	-175.9	-58.1	176.1	0	0	0	111.6	F390 F417 L420 P421 W426 A451 L458	F390-L455 HydrophobicContact CD1-CD1 3.85Å; F390-L455 HydrophobicContact CE1-CD1 4.4Å; F390-L455 HydrophobicContact CG-CD1 4.47Å; F417-L455 HydrophobicContact CD1-CB 4.39Å; F417-L455 HydrophobicContact CD2-CD1 4.02Å; F417-L455 HydrophobicContact CD2-CD2 4.34Å; F417-L455 HydrophobicContact CE1-CB 4.17Å; F417-L455 HydrophobicContact CE2-CD1 3.82Å; F417-L455 HydrophobicContact CG-CD2 4.21Å; F417-L455 HydrophobicContact CZ-CB 4.3Å; F417-L455 HydrophobicContact CZ-CD1 4.22Å; L420-L455 HydrophobicContact CD2-CD2 3.84Å; P421-L455 HydrophobicContact CG-CD2 4.38Å; W426-L455 HydrophobicContact CH2-CD1 3.8Å; W426-L455 HydrophobicContact CH2-CG 4.26Å; W426-L455 HydrophobicContact CZ2-CD1 3.84Å; W426-L455 HydrophobicContact CZ2-CD2 4.32Å; W426-L455 HydrophobicContact CZ2-CG 4.07Å; A451-L455 HydrophobicContact CB-CD1 4.45Å; A451-L455 WeakPolarHBondContact O-CB 3.44Å; A451-L455 PolarHBondContact O-N 3.42Å; L455-L458 HydrophobicContact CB-CD1 3.87Å; L455-L458 HydrophobicContact CB-CG 4.3Å; L455-L458 HydrophobicContact CD1-CD1 3.72Å; L455-L458 HydrophobicContact CG-CD1 4.39Å
456	P	75.9	Confident	81.6	Confident	43 Å²	43	44.9 Å²	44.9	28%	0.279	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	136.4	-179.6	28.9	-34.8	0	0	0	112.2	F417 L458	F417-P456 HydrophobicContact CD1-CG 3.99Å; F417-P456 HydrophobicContact CE1-CG 4.28Å; F417-P456 WeakPolarHBondContact CE1-O 3.16Å; P456-L458 VanDerWaalsContact C-N 3.33Å; P456-L458 PolarHBondContact O-N 3.18Å
457	G	68.4	Low	80.4	Confident	72 Å²	72	45.9 Å²	45.9	74%	0.742	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.4	12.6	168.8	0	0	0	0	0	116
458	L	75.8	Confident	79	Confident	60 Å²	60	50.8 Å²	50.8	31%	0.314	26%	0.264	S	S	.	.			trans	-93.8	135.4	168.4	-64.7	-173.8	0	0	0	110.4	F390 F417 A451 R452 L455 P456	F390-L458 HydrophobicContact CD1-CD1 4.42Å; F390-L458 HydrophobicContact CE1-CD1 3.71Å; F390-L458 HydrophobicContact CZ-CD1 4.36Å; F417-L458 HydrophobicContact CZ-CD1 4.16Å; F417-L458 HydrophobicContact CZ-CD2 4.13Å; F417-L458 HydrophobicContact CZ-CG 4.09Å; A451-L458 HydrophobicContact CB-CD1 3.85Å; R452-L458 WeakPolarHBondContact CG-O 3.42Å; L455-L458 HydrophobicContact CB-CD1 3.87Å; L455-L458 HydrophobicContact CB-CG 4.3Å; L455-L458 HydrophobicContact CD1-CD1 3.72Å; L455-L458 HydrophobicContact CG-CD1 4.39Å; P456-L458 VanDerWaalsContact C-N 3.33Å; P456-L458 PolarHBondContact O-N 3.18Å
459	D	72.8	Confident	77.5	Confident	96 Å²	96	48 Å²	48	51%	0.513	26%	0.255	S	S	.	.			trans	-115.1	149.3	170.4	-170.7	16.9	0	0	0	110.8	R145	R145-D459 IonicContact NH2-OD1 3.46Å; R145-D459 PolarHBondContact NH2-OD1 2.9Å
460	C	81.4	Confident	75.8	Confident	25 Å²	25	47.9 Å²	47.9	17%	0.169	26%	0.256	C	S	.	.			trans	-153.3	110	177.3	-177.6	0	0	0	0	108.3	R145 R448 Q449 R452	R145-C460 PolarHBondContact NH2-O 3.4Å; R448-C460 HydrophobicContact CB-CB 4.49Å; Q449-C460 PolarHBondContact NE2-SG 2.9Å; Q449-C460 VanDerWaalsContact NE2-SG 3.4Å; Q449-C460 PolarHBondContact OE1-O 3.39Å; R452-C460 HydrophobicContact CB-CB 4.09Å
461	E	75.7	Confident	74	Confident	132 Å²	132	52.4 Å²	52.4	62%	0.617	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-51.3	146.4	-178.1	-66	-176.3	158.4	0	0	112.6	Q449	Q449-E461 PolarHBondContact NE2-O 3.27Å
462	P	79.4	Confident	72.4	Confident	25 Å²	25	54.1 Å²	54.1	16%	0.162	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-56	146	172.3	-23.3	34.3	0	0	0	112.3	R145 V148 Q464	R145-P462 HydrophobicContact CG-CG 4.44Å; V148-P462 HydrophobicContact CB-CB 4.27Å; V148-P462 HydrophobicContact CG1-CB 4.4Å; V148-P462 HydrophobicContact CG2-CB 4.17Å; V148-P462 HydrophobicContact CG2-CG 4.31Å; P462-Q464 PolarHBondContact O-N 3.21Å
463	R	79.5	Confident	70.7	Confident	74 Å²	74	55.5 Å²	55.5	28%	0.279	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-70.7	124	-178	-153.8	177.3	-161.8	-120.4	10.9	109.8	D443 H469	D443-R463 IonicContact OD2-CZ 3.85Å; D443-R463 IonicContact OD2-NH2 3.33Å; D443-R463 PolarHBondContact OD2-NH2 3.04Å; R463-H469 VanDerWaalsContact CZ-CG 3.48Å; R463-H469 PolarHBondContact NH2-ND1 3.27Å
464	Q	77.1	Confident	69	Low	109 Å²	109	59.9 Å²	59.9	51%	0.509	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-85.7	158.9	178.6	-67.4	175.2	-11.8	0	0	111.9	P462 K466 H469	P462-Q464 PolarHBondContact O-N 3.21Å; Q464-K466 HydrophobicContact CB-CG 4.28Å; Q464-K466 PolarHBondContact O-N 3.16Å; Q464-K466 VanDerWaalsContact O-N 3.15Å; Q464-H469 PolarHBondContact O-CD2 3.39Å
465	L	76.1	Confident	67.3	Low	47 Å²	47	69 Å²	69	25%	0.246	36%	0.355	C	S	.	.			trans	-74.9	101.4	175	-172.8	64.6	0	0	0	109.8	L149 M523 Y528 A531 F574	L149-L465 HydrophobicContact CD1-CB 3.7Å; L149-L465 HydrophobicContact CD1-CD1 4.09Å; L465-M523 HydrophobicContact CD2-CE 4.14Å; L465-Y528 HydrophobicContact CD1-CE1 4.19Å; L465-Y528 HydrophobicContact CG-CD1 4.12Å; L465-Y528 HydrophobicContact CG-CE1 3.92Å; L465-A531 HydrophobicContact CD2-CB 3.85Å; L465-F574 HydrophobicContact CD2-CD1 4.5Å; L465-F574 HydrophobicContact CD2-CE1 4.3Å
466	K	73.3	Confident	66.2	Low	82 Å²	82	77.1 Å²	77.1	36%	0.357	39%	0.385	S	S	.	.			trans	-137.3	146.2	-178.5	-62.9	-175.7	-179.9	174.9	0	112.3	Q464 E468 H469	Q464-K466 HydrophobicContact CB-CG 4.28Å; Q464-K466 PolarHBondContact O-N 3.16Å; Q464-K466 VanDerWaalsContact O-N 3.15Å; K466-E468 HydrophobicContact CB-CG 3.95Å; K466-E468 HydrophobicContact CD-CG 4.4Å; K466-E468 WeakPolarHBondContact CD-OE1 3.37Å; K466-E468 IonicContact NZ-OE1 2.68Å; K466-E468 PolarHBondContact O-N 3.08Å; K466-H469 PolarHBondContact O-N 3.22Å
467	P	64.5	Low	65.8	Low	26 Å²	26	78.3 Å²	78.3	17%	0.169	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-62.7	-26.1	178.4	-27.7	39.3	0	0	0	114.5	H469 C470 F492 N496 Y528	P467-H469 PolarHBondContact O-N 3.41Å; P467-C470 PolarHBondContact O-N 3.48Å; P467-F492 HydrophobicContact CB-CD1 4.08Å; P467-F492 HydrophobicContact CG-CD1 4.15Å; P467-N496 WeakPolarHBondContact CG-ND2 3.39Å; P467-Y528 HydrophobicContact CB-CE2 4.35Å; P467-Y528 HydrophobicContact CG-CD1 3.83Å; P467-Y528 HydrophobicContact CG-CD2 3.63Å; P467-Y528 HydrophobicContact CG-CE1 3.9Å; P467-Y528 HydrophobicContact CG-CE2 3.7Å; P467-Y528 HydrophobicContact CG-CG 3.69Å
468	E	60.6	Low	66.3	Low	103 Å²	103	79.7 Å²	79.7	48%	0.481	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-67.7	-1.8	-178.6	67	-171.1	168.6	0	0	114.9	K466 F471	K466-E468 HydrophobicContact CB-CG 3.95Å; K466-E468 HydrophobicContact CD-CG 4.4Å; K466-E468 WeakPolarHBondContact CD-OE1 3.37Å; K466-E468 IonicContact NZ-OE1 2.68Å; K466-E468 PolarHBondContact O-N 3.08Å; E468-F471 VanDerWaalsContact O-CE2 3.29Å; E468-F471 WeakPolarHBondContact O-CE2 3.31Å; E468-F471 VanDerWaalsContact O-CZ 3.23Å; E468-F471 WeakPolarHBondContact O-CZ 3.45Å
469	H	57	Low	66.6	Low	50 Å²	50	80.8 Å²	80.8	23%	0.231	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-98.4	-0.5	-178.3	-72	-31.1	0	0	0	114.6	R463 Q464 K466 P467 F471	R463-H469 VanDerWaalsContact CZ-CG 3.48Å; R463-H469 PolarHBondContact NH2-ND1 3.27Å; Q464-H469 PolarHBondContact O-CD2 3.39Å; K466-H469 PolarHBondContact O-N 3.22Å; P467-H469 PolarHBondContact O-N 3.41Å; H469-F471 PolarHBondContact O-N 3.2Å; H469-F471 VanDerWaalsContact O-N 3.14Å
470	C	52.8	Low	67.2	Low	17 Å²	17	84.5 Å²	84.5	12%	0.115	40%	0.403	C	S	.	.			trans	-87.6	65.7	-174.1	-64	0	0	0	0	113.6	P467 S472 K485 D519 D520 Q521	P467-C470 PolarHBondContact O-N 3.48Å; C470-S472 PolarHBondContact O-N 3.24Å; C470-S472 VanDerWaalsContact O-N 3.16Å; C470-K485 PolarHBondContact O-NZ 3.21Å; C470-D519 PolarHBondContact SG-OD2 2.85Å; C470-D520 HydrophobicContact CB-CB 4.43Å; C470-Q521 VanDerWaalsContact SG-CG 3.55Å
471	F	53.5	Low	67.1	Low	95 Å²	95	84.6 Å²	84.6	42%	0.417	41%	0.406	S	S	.	.			trans	-87.1	70.3	179.5	-61.1	-66	0	0	0	113.8	E468 H469 S473	E468-F471 VanDerWaalsContact O-CE2 3.29Å; E468-F471 WeakPolarHBondContact O-CE2 3.31Å; E468-F471 VanDerWaalsContact O-CZ 3.23Å; E468-F471 WeakPolarHBondContact O-CZ 3.45Å; H469-F471 PolarHBondContact O-N 3.2Å; H469-F471 VanDerWaalsContact O-N 3.14Å; F471-S473 PolarHBondContact O-N 2.78Å
472	S	53.4	Low	67.3	Low	37 Å²	37	79.8 Å²	79.8	26%	0.259	39%	0.389	S	S	.	.			trans	-59	124.1	151.9	55.2	0	0	0	0	108.7	C470 F474 K485 D520	C470-S472 PolarHBondContact O-N 3.24Å; C470-S472 VanDerWaalsContact O-N 3.16Å; S472-F474 PolarHBondContact O-N 3.18Å; S472-K485 PolarHBondContact O-NZ 3.5Å; S472-K485 WeakPolarHBondContact OG-CE 3.13Å; S472-K485 PolarHBondContact OG-NZ 3.13Å; S472-D520 VanDerWaalsContact CB-OD2 3.24Å; S472-D520 WeakPolarHBondContact CB-OD2 3.49Å; S472-D520 PolarHBondContact OG-OD2 2.91Å
473	S	51.2	Low	67.6	Low	55 Å²	55	82.3 Å²	82.3	39%	0.385	40%	0.404	S	S	.	.			trans	-69.2	119.5	-163.6	69.6	0	0	0	0	112.5	F471 R475	F471-S473 PolarHBondContact O-N 2.78Å; S473-R475 PolarHBondContact O-N 2.7Å
474	F	52.6	Low	67.7	Low	100 Å²	100	83.5 Å²	83.5	44%	0.439	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-56.2	-17.8	179.2	-69.4	-79.9	0	0	0	114.6	S472 R476 L477 K485	S472-F474 PolarHBondContact O-N 3.18Å; F474-R476 PolarHBondContact O-N 3.25Å; F474-L477 HydrophobicContact CD1-CD1 4.33Å; F474-L477 PolarHBondContact O-N 3.29Å; F474-K485 HydrophobicContact CE1-CD 4.14Å; F474-K485 HydrophobicContact CZ-CD 4.38Å
475	R	51.6	Low	67.8	Low	198 Å²	198	78.9 Å²	78.9	75%	0.747	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-65.2	-0.9	-176.5	-64.8	-170.9	179.6	-170.6	2.3	115.2	S473	S473-R475 PolarHBondContact O-N 2.7Å
476	R	56.9	Low	68.2	Low	174 Å²	174	82.5 Å²	82.5	66%	0.657	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-138.1	6.1	-178	-64.4	-172	-179.2	163.9	4	115.4	F474	F474-R476 PolarHBondContact O-N 3.25Å
477	L	67.8	Low	68.9	Low	68 Å²	68	81.5 Å²	81.5	36%	0.356	40%	0.404	S	S	.	.			trans	-84.2	147.1	174.2	-63.8	176.2	0	0	0	110	F474 A481 A482 K485	F474-L477 HydrophobicContact CD1-CD1 4.33Å; F474-L477 PolarHBondContact O-N 3.29Å; L477-A481 HydrophobicContact CB-CB 4.35Å; L477-A481 HydrophobicContact CD2-CB 4.13Å; L477-A482 HydrophobicContact CB-CB 4.21Å; L477-K485 HydrophobicContact CD1-CB 4.46Å; L477-K485 HydrophobicContact CD1-CD 4.11Å
478	D	79.4	Confident	70	Confident	100 Å²	100	82.3 Å²	82.3	54%	0.535	41%	0.405	S	S	.	.			trans	-74.9	166.1	167.3	75.8	-24.9	0	0	0	110	R480 A481 A482	D478-R480 PolarHBondContact O-N 3.48Å; D478-R480 VanDerWaalsContact O-N 3.11Å; D478-A481 PolarHBondContact O-N 2.76Å; D478-A481 WeakPolarHBondContact OD1-CB 3.21Å; D478-A481 PolarHBondContact OD1-N 3.5Å; D478-A482 VanDerWaalsContact O-CB 3.26Å; D478-A482 WeakPolarHBondContact O-CB 3.48Å; D478-A482 PolarHBondContact O-N 3.31Å
479	A	83.2	Confident	71.1	Confident	83 Å²	83	79.4 Å²	79.4	69%	0.686	39%	0.393	S	S	*	.	H	α-helix	trans	-59	-29.4	-176	0	0	0	0	0	112.8	T483	A479-T483 WeakPolarHBondContact O-CB 3.46Å; A479-T483 PolarHBondContact O-N 3.36Å; A479-T483 PolarHBondContact O-OG1 2.97Å
480	R	84.8	Confident	72.5	Confident	174 Å²	174	80 Å²	80	66%	0.657	40%	0.398	S	S	*	.	H	α-helix	trans	-71.5	-56.6	176.7	-176.6	178	170.7	166.1	1.3	111.8	D478 A482 T483 E484	D478-R480 PolarHBondContact O-N 3.48Å; D478-R480 VanDerWaalsContact O-N 3.11Å; R480-A482 PolarHBondContact O-N 3.1Å; R480-T483 WeakPolarHBondContact O-CB 3.49Å; R480-T483 PolarHBondContact O-N 3.01Å; R480-E484 HydrophobicContact CG-CG 4.5Å; R480-E484 IonicContact CZ-OE1 3.32Å; R480-E484 VanDerWaalsContact CZ-OE1 3.32Å; R480-E484 IonicContact NE-OE1 2.74Å; R480-E484 PolarHBondContact NE-OE1 3.08Å; R480-E484 IonicContact NH2-OE1 2.96Å; R480-E484 PolarHBondContact NH2-OE1 3.13Å; R480-E484 PolarHBondContact O-N 3.28Å
481	A	79.9	Confident	74.2	Confident	28 Å²	28	79.2 Å²	79.2	23%	0.231	39%	0.392	C	S	.	.	H	α-helix	trans	-63.6	-31.2	178.7	0	0	0	0	0	112.1	L477 D478 T483 K485	L477-A481 HydrophobicContact CB-CB 4.35Å; L477-A481 HydrophobicContact CD2-CB 4.13Å; D478-A481 PolarHBondContact O-N 2.76Å; D478-A481 WeakPolarHBondContact OD1-CB 3.21Å; D478-A481 PolarHBondContact OD1-N 3.5Å; A481-T483 VanDerWaalsContact C-N 3.32Å; A481-T483 PolarHBondContact O-N 3.03Å; A481-K485 VanDerWaalsContact O-CB 3.24Å; A481-K485 WeakPolarHBondContact O-CB 3.34Å; A481-K485 PolarHBondContact O-N 3.38Å
482	A	79.9	Confident	75.9	Confident	30 Å²	30	75 Å²	75	25%	0.248	37%	0.374	C	S	.	.	H	α-helix	trans	-63.6	-36.2	171.5	0	0	0	0	0	112.6	L477 D478 R480 F486	L477-A482 HydrophobicContact CB-CB 4.21Å; D478-A482 VanDerWaalsContact O-CB 3.26Å; D478-A482 WeakPolarHBondContact O-CB 3.48Å; D478-A482 PolarHBondContact O-N 3.31Å; R480-A482 PolarHBondContact O-N 3.1Å; A482-F486 VanDerWaalsContact O-CB 3.28Å; A482-F486 WeakPolarHBondContact O-CB 3.25Å; A482-F486 PolarHBondContact O-N 3.19Å
483	T	83.8	Confident	77.5	Confident	78 Å²	78	80.4 Å²	80.4	48%	0.479	39%	0.388	S	S	.	.	H	α-helix	trans	-75.9	-44	176.9	-55.5	0	0	0	0	111.2	A479 R480 A481 K485 F486 N487	A479-T483 WeakPolarHBondContact O-CB 3.46Å; A479-T483 PolarHBondContact O-N 3.36Å; A479-T483 PolarHBondContact O-OG1 2.97Å; R480-T483 WeakPolarHBondContact O-CB 3.49Å; R480-T483 PolarHBondContact O-N 3.01Å; A481-T483 VanDerWaalsContact C-N 3.32Å; A481-T483 PolarHBondContact O-N 3.03Å; T483-K485 PolarHBondContact O-N 3.38Å; T483-F486 PolarHBondContact O-N 3.14Å; T483-N487 PolarHBondContact O-N 2.94Å
484	E	82.5	Confident	79.3	Confident	99 Å²	99	79.5 Å²	79.5	46%	0.463	38%	0.379	S	S	.	.	H	α-helix	trans	-59.8	-45.1	175.2	-70.1	172.8	175.5	0	0	110.6	R480 N487 Q488	R480-E484 HydrophobicContact CG-CG 4.5Å; R480-E484 IonicContact CZ-OE1 3.32Å; R480-E484 VanDerWaalsContact CZ-OE1 3.32Å; R480-E484 IonicContact NE-OE1 2.74Å; R480-E484 PolarHBondContact NE-OE1 3.08Å; R480-E484 IonicContact NH2-OE1 2.96Å; R480-E484 PolarHBondContact NH2-OE1 3.13Å; R480-E484 PolarHBondContact O-N 3.28Å; E484-N487 PolarHBondContact O-N 3.07Å; E484-Q488 PolarHBondContact O-N 3.48Å
485	K	80.1	Confident	80.9	Confident	13 Å²	13	74.9 Å²	74.9	6%	0.057	36%	0.358	C	S	.	.	H	α-helix	trans	-64.8	-42.3	173.7	-168	-176.3	179.9	-166.5	0	112.8	C470 S472 F474 L477 A481 T483 N487 Q488 D489 D520	C470-K485 PolarHBondContact O-NZ 3.21Å; S472-K485 PolarHBondContact O-NZ 3.5Å; S472-K485 WeakPolarHBondContact OG-CE 3.13Å; S472-K485 PolarHBondContact OG-NZ 3.13Å; F474-K485 HydrophobicContact CE1-CD 4.14Å; F474-K485 HydrophobicContact CZ-CD 4.38Å; L477-K485 HydrophobicContact CD1-CB 4.46Å; L477-K485 HydrophobicContact CD1-CD 4.11Å; A481-K485 VanDerWaalsContact O-CB 3.24Å; A481-K485 WeakPolarHBondContact O-CB 3.34Å; A481-K485 PolarHBondContact O-N 3.38Å; T483-K485 PolarHBondContact O-N 3.38Å; K485-N487 VanDerWaalsContact C-N 3.3Å; K485-N487 PolarHBondContact O-N 2.86Å; K485-Q488 WeakPolarHBondContact O-CB 3.47Å; K485-Q488 PolarHBondContact O-N 3.36Å; K485-D489 WeakPolarHBondContact O-CB 3.49Å; K485-D489 PolarHBondContact O-N 3.46Å; K485-D520 IonicContact NZ-OD2 2.91Å
486	F	84.5	Confident	82.4	Confident	122 Å²	122	68.1 Å²	68.1	54%	0.535	34%	0.337	S	S	.	.	H	α-helix	trans	-60.3	-41.1	176.7	175.7	-92.8	0	0	0	112	A482 T483 D489 L490	A482-F486 VanDerWaalsContact O-CB 3.28Å; A482-F486 WeakPolarHBondContact O-CB 3.25Å; A482-F486 PolarHBondContact O-N 3.19Å; T483-F486 PolarHBondContact O-N 3.14Å; F486-D489 PolarHBondContact O-N 2.93Å; F486-L490 HydrophobicContact CE1-CD2 4.23Å; F486-L490 VanDerWaalsContact O-CB 3.23Å; F486-L490 WeakPolarHBondContact O-CB 3.03Å; F486-L490 PolarHBondContact O-N 2.8Å
487	N	87.5	Confident	83.7	Confident	62 Å²	62	62.9 Å²	62.9	33%	0.332	33%	0.326	S	S	.	.	H	α-helix	trans	-67.1	-37.6	176.2	-70	-14.3	0	0	0	111.9	T483 E484 K485 L490 G491	T483-N487 PolarHBondContact O-N 2.94Å; E484-N487 PolarHBondContact O-N 3.07Å; K485-N487 VanDerWaalsContact C-N 3.3Å; K485-N487 PolarHBondContact O-N 2.86Å; N487-L490 PolarHBondContact O-N 3.48Å; N487-G491 PolarHBondContact O-N 2.97Å
488	Q	86.2	Confident	84.2	Confident	43 Å²	43	61.7 Å²	61.7	20%	0.201	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-53.1	172.4	-171	-176.9	27	0	0	111.4	E484 K485 L490 G491 F492 L510 M518	E484-Q488 PolarHBondContact O-N 3.48Å; K485-Q488 WeakPolarHBondContact O-CB 3.47Å; K485-Q488 PolarHBondContact O-N 3.36Å; Q488-L490 VanDerWaalsContact C-N 3.25Å; Q488-L490 PolarHBondContact O-N 2.79Å; Q488-G491 PolarHBondContact O-N 2.92Å; Q488-F492 HydrophobicContact CG-CD2 4.1Å; Q488-F492 HydrophobicContact CG-CE2 4.09Å; Q488-F492 WeakPolarHBondContact O-CD2 3.35Å; Q488-F492 PolarHBondContact O-N 2.78Å; Q488-L510 HydrophobicContact CG-CD2 4.41Å; Q488-M518 PolarHBondContact NE2-O 3.41Å
489	D	84.6	Confident	84.5	Confident	42 Å²	42	63.5 Å²	63.5	23%	0.225	33%	0.33	C	S	.	.	H	α-helix	trans	-55.7	-40.6	176.2	-74.7	-17.5	0	0	0	111.4	K485 F486 R493	K485-D489 WeakPolarHBondContact O-CB 3.49Å; K485-D489 PolarHBondContact O-N 3.46Å; F486-D489 PolarHBondContact O-N 2.93Å; D489-R493 WeakPolarHBondContact O-CB 3.33Å; D489-R493 VanDerWaalsContact O-CG 3.24Å; D489-R493 WeakPolarHBondContact O-CG 3.48Å; D489-R493 PolarHBondContact O-N 3.44Å; D489-R493 VanDerWaalsContact O-N 3.07Å
490	L	87.3	Confident	84.7	Confident	63 Å²	63	63.7 Å²	63.7	33%	0.33	32%	0.322	S	S	.	.	H	α-helix	trans	-67.4	-47.4	177	-179.9	62.1	0	0	0	112	F486 N487 Q488 R493 M494	F486-L490 HydrophobicContact CE1-CD2 4.23Å; F486-L490 VanDerWaalsContact O-CB 3.23Å; F486-L490 WeakPolarHBondContact O-CB 3.03Å; F486-L490 PolarHBondContact O-N 2.8Å; N487-L490 PolarHBondContact O-N 3.48Å; Q488-L490 VanDerWaalsContact C-N 3.25Å; Q488-L490 PolarHBondContact O-N 2.79Å; L490-R493 PolarHBondContact O-N 2.95Å; L490-M494 HydrophobicContact CD1-CE 4.09Å; L490-M494 HydrophobicContact CD2-CE 4.13Å; L490-M494 HydrophobicContact CG-CE 3.95Å; L490-M494 HydrophobicContact CG-SD 4.38Å; L490-M494 WeakPolarHBondContact O-CG 3.48Å; L490-M494 PolarHBondContact O-N 3.29Å
491	G	88.6	Confident	84.9	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.4	-43.8	178.9	0	0	0	0	0	112.4	N487 Q488 R493 M494 L495	N487-G491 PolarHBondContact O-N 2.97Å; Q488-G491 PolarHBondContact O-N 2.92Å; G491-R493 PolarHBondContact O-N 3.45Å; G491-M494 WeakPolarHBondContact O-CB 3.36Å; G491-M494 PolarHBondContact O-N 3.01Å; G491-L495 PolarHBondContact O-N 2.8Å
492	F	87.6	Confident	85.4	Confident	7 Å²	7	61.7 Å²	61.7	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-58.8	-46.5	171	-90.3	-101.4	0	0	0	111.1	P467 Q488 M494 L495 N496 L510 T517 D519 P525 Y528	P467-F492 HydrophobicContact CB-CD1 4.08Å; P467-F492 HydrophobicContact CG-CD1 4.15Å; Q488-F492 HydrophobicContact CG-CD2 4.1Å; Q488-F492 HydrophobicContact CG-CE2 4.09Å; Q488-F492 WeakPolarHBondContact O-CD2 3.35Å; Q488-F492 PolarHBondContact O-N 2.78Å; F492-M494 VanDerWaalsContact C-N 3.32Å; F492-M494 PolarHBondContact O-N 3.37Å; F492-L495 PolarHBondContact O-N 2.95Å; F492-N496 WeakPolarHBondContact O-CB 3.27Å; F492-N496 VanDerWaalsContact O-CG 3.26Å; F492-N496 PolarHBondContact O-N 2.9Å; F492-N496 PolarHBondContact O-ND2 3.35Å; F492-L510 HydrophobicContact CD2-CD2 3.7Å; F492-L510 HydrophobicContact CE2-CD2 3.94Å; F492-T517 HydrophobicContact CE2-CG2 4.35Å; F492-T517 WeakPolarHBondContact CZ-O 3.36Å; F492-D519 HydrophobicContact CE1-CB 4.11Å; F492-D519 HydrophobicContact CE2-CB 4.28Å; F492-D519 HydrophobicContact CZ-CB 3.81Å; F492-P525 HydrophobicContact CD1-CG 4.14Å; F492-P525 HydrophobicContact CE1-CG 3.8Å; F492-P525 HydrophobicContact CZ-CG 4.04Å; F492-Y528 HydrophobicContact CE1-CD2 4.29Å; F492-Y528 HydrophobicContact CE1-CE2 4.15Å
493	R	86.8	Confident	85.8	Confident	149 Å²	149	61.4 Å²	61.4	56%	0.562	31%	0.314	S	S	*	.	H	α-helix	trans	-62	-36.6	176.2	-73.8	173.7	-167.1	-160.3	4.6	113.1	D489 L490 G491 C497	D489-R493 WeakPolarHBondContact O-CB 3.33Å; D489-R493 VanDerWaalsContact O-CG 3.24Å; D489-R493 WeakPolarHBondContact O-CG 3.48Å; D489-R493 PolarHBondContact O-N 3.44Å; D489-R493 VanDerWaalsContact O-N 3.07Å; L490-R493 PolarHBondContact O-N 2.95Å; G491-R493 PolarHBondContact O-N 3.45Å; R493-C497 PolarHBondContact O-N 3.23Å; R493-C497 PolarHBondContact O-SG 3.3Å
494	M	89.1	Confident	86	Confident	37 Å²	37	63.2 Å²	63.2	18%	0.182	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-45.9	176.5	-75.9	176.2	170.2	0	0	111.8	L490 G491 F492 C497 L502 Q505 A506	L490-M494 HydrophobicContact CD1-CE 4.09Å; L490-M494 HydrophobicContact CD2-CE 4.13Å; L490-M494 HydrophobicContact CG-CE 3.95Å; L490-M494 HydrophobicContact CG-SD 4.38Å; L490-M494 WeakPolarHBondContact O-CG 3.48Å; L490-M494 PolarHBondContact O-N 3.29Å; G491-M494 WeakPolarHBondContact O-CB 3.36Å; G491-M494 PolarHBondContact O-N 3.01Å; F492-M494 VanDerWaalsContact C-N 3.32Å; F492-M494 PolarHBondContact O-N 3.37Å; M494-C497 WeakPolarHBondContact O-CB 3.25Å; M494-C497 PolarHBondContact O-N 3.28Å; M494-L502 HydrophobicContact CB-CB 4.31Å; M494-Q505 HydrophobicContact CE-CB 4.5Å; M494-Q505 HydrophobicContact SD-CB 4.16Å; M494-A506 HydrophobicContact CB-CB 3.78Å; M494-A506 HydrophobicContact SD-CB 4.33Å
495	L	86.9	Confident	86.4	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-63.7	-49.3	175.3	-65.5	176.5	0	0	0	111.1	G491 F492 C497 G498 A506 L510 V515 P525 L541	G491-L495 PolarHBondContact O-N 2.8Å; F492-L495 PolarHBondContact O-N 2.95Å; L495-C497 PolarHBondContact O-N 3.01Å; L495-G498 PolarHBondContact O-N 3.44Å; L495-A506 HydrophobicContact CD2-CB 3.71Å; L495-A506 HydrophobicContact CG-CB 3.76Å; L495-L510 HydrophobicContact CD1-CD1 3.63Å; L495-L510 HydrophobicContact CG-CD1 4.44Å; L495-V515 HydrophobicContact CD1-CG1 4.35Å; L495-V515 HydrophobicContact CD2-CG1 4.34Å; L495-P525 HydrophobicContact CD1-CB 3.81Å; L495-P525 HydrophobicContact CD1-CG 3.54Å; L495-L541 HydrophobicContact CD1-CD2 4.3Å; L495-L541 HydrophobicContact CD2-CD2 4.22Å
496	N	83.1	Confident	86.8	Confident	57 Å²	57	62.7 Å²	62.7	31%	0.305	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-8.6	178.6	-68.2	-51.5	0	0	0	114.7	P467 F492 G498	P467-N496 WeakPolarHBondContact CG-ND2 3.39Å; F492-N496 WeakPolarHBondContact O-CB 3.27Å; F492-N496 VanDerWaalsContact O-CG 3.26Å; F492-N496 PolarHBondContact O-N 2.9Å; F492-N496 PolarHBondContact O-ND2 3.35Å; N496-G498 PolarHBondContact O-N 3.43Å
497	C	83.6	Confident	87	Confident	64 Å²	64	59.5 Å²	59.5	43%	0.432	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-9.6	170.8	-74.8	0	0	0	0	113.6	R493 M494 L495 R499	R493-C497 PolarHBondContact O-N 3.23Å; R493-C497 PolarHBondContact O-SG 3.3Å; M494-C497 WeakPolarHBondContact O-CB 3.25Å; M494-C497 PolarHBondContact O-N 3.28Å; L495-C497 PolarHBondContact O-N 3.01Å; C497-R499 PolarHBondContact O-N 2.59Å; C497-R499 VanDerWaalsContact O-N 3.17Å
498	G	79.8	Confident	87.1	Confident	42 Å²	42	64.2 Å²	64.2	43%	0.433	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	16.3	-179.1	0	0	0	0	0	114.3	L495 N496	L495-G498 PolarHBondContact O-N 3.44Å; N496-G498 PolarHBondContact O-N 3.43Å
499	R	85.6	Confident	87.2	Confident	139 Å²	139	63.5 Å²	63.5	53%	0.525	33%	0.329	S	S	.	.			trans	-100.5	110	-177.6	-76.1	-173.6	-75.4	165.9	-3.4	110.5	C497 D501 L502	C497-R499 PolarHBondContact O-N 2.59Å; C497-R499 VanDerWaalsContact O-N 3.17Å; R499-D501 PolarHBondContact O-N 3.22Å; R499-L502 HydrophobicContact CB-CD1 4.18Å; R499-L502 HydrophobicContact CB-CG 4.18Å; R499-L502 PolarHBondContact O-N 3.39Å
500	T	86.6	Confident	87.3	Confident	87 Å²	87	62.3 Å²	62.3	53%	0.534	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-53.5	-35.8	179.3	48.7	0	0	0	0	113.5	L502 I503 M540	T500-L502 PolarHBondContact O-N 3.31Å; T500-L502 VanDerWaalsContact O-N 3.15Å; T500-I503 HydrophobicContact CG2-CD1 4.4Å; T500-I503 WeakPolarHBondContact O-CB 3.33Å; T500-I503 WeakPolarHBondContact O-CD1 3.42Å; T500-I503 VanDerWaalsContact O-CG1 3.24Å; T500-I503 WeakPolarHBondContact O-CG1 3.44Å; T500-I503 PolarHBondContact O-N 3.4Å; T500-I503 VanDerWaalsContact O-N 3.17Å; T500-M540 HydrophobicContact CG2-CG 4.03Å
501	D	88.4	Confident	87.3	Confident	131 Å²	131	60.8 Å²	60.8	70%	0.701	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-63.6	-22.3	-178.4	-50.1	-27.2	0	0	0	113.2	R499	R499-D501 PolarHBondContact O-N 3.22Å
502	L	90.4	Very high	86.9	Confident	28 Å²	28	67 Å²	67	15%	0.147	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-91.5	-8.1	-178.8	-59.9	-177.2	0	0	0	113.4	M494 R499 T500 N504 Q505 A506	M494-L502 HydrophobicContact CB-CB 4.31Å; R499-L502 HydrophobicContact CB-CD1 4.18Å; R499-L502 HydrophobicContact CB-CG 4.18Å; R499-L502 PolarHBondContact O-N 3.39Å; T500-L502 PolarHBondContact O-N 3.31Å; T500-L502 VanDerWaalsContact O-N 3.15Å; L502-N504 PolarHBondContact O-N 3.3Å; L502-Q505 PolarHBondContact O-N 2.84Å; L502-A506 WeakPolarHBondContact O-CB 3.39Å; L502-A506 PolarHBondContact O-N 3.26Å
503	I	88.4	Confident	86.7	Confident	24 Å²	24	71.7 Å²	71.7	12%	0.123	39%	0.387	C	S	.	.	H	α-helix	trans	-56.4	-48.5	-176.2	-63.6	166.3	0	0	0	111.1	T500 Q505 A506 I507 M540 A544	T500-I503 HydrophobicContact CG2-CD1 4.4Å; T500-I503 WeakPolarHBondContact O-CB 3.33Å; T500-I503 WeakPolarHBondContact O-CD1 3.42Å; T500-I503 VanDerWaalsContact O-CG1 3.24Å; T500-I503 WeakPolarHBondContact O-CG1 3.44Å; T500-I503 PolarHBondContact O-N 3.4Å; T500-I503 VanDerWaalsContact O-N 3.17Å; I503-Q505 PolarHBondContact O-N 3.25Å; I503-A506 WeakPolarHBondContact O-CB 3.31Å; I503-A506 PolarHBondContact O-N 3.11Å; I503-I507 HydrophobicContact CG2-CD1 3.75Å; I503-I507 HydrophobicContact CG2-CG1 4.39Å; I503-I507 WeakPolarHBondContact O-CG1 3.28Å; I503-I507 PolarHBondContact O-N 2.65Å; I503-M540 HydrophobicContact CD1-CG 3.67Å; I503-M540 HydrophobicContact CD1-SD 3.44Å; I503-M540 WeakPolarHBondContact CD1-SD 3.48Å; I503-M540 HydrophobicContact CG1-CG 4.4Å; I503-M540 HydrophobicContact CG1-SD 3.62Å; I503-A544 HydrophobicContact CG2-CB 3.91Å
504	N	88	Confident	86.8	Confident	116 Å²	116	64.9 Å²	64.9	62%	0.62	36%	0.363	S	S	*	.	H	α-helix	trans	-63.3	-41.2	-179	-65.5	-35.7	0	0	0	112	L502 A506 I507 E508	L502-N504 PolarHBondContact O-N 3.3Å; N504-A506 VanDerWaalsContact C-N 3.33Å; N504-A506 PolarHBondContact O-N 2.85Å; N504-I507 PolarHBondContact O-N 2.98Å; N504-E508 WeakPolarHBondContact O-CG 3.48Å; N504-E508 PolarHBondContact O-N 2.74Å
505	Q	91	Very high	86.7	Confident	101 Å²	101	63.4 Å²	63.4	47%	0.472	36%	0.357	S	S	.	.	H	α-helix	trans	-67.3	-35.2	176.6	-62.5	177.2	13.6	0	0	111.7	M494 L502 I503 A509	M494-Q505 HydrophobicContact CE-CB 4.5Å; M494-Q505 HydrophobicContact SD-CB 4.16Å; L502-Q505 PolarHBondContact O-N 2.84Å; I503-Q505 PolarHBondContact O-N 3.25Å; Q505-A509 WeakPolarHBondContact O-CB 3.41Å; Q505-A509 PolarHBondContact O-N 3.14Å
506	A	89	Confident	86.9	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-68.4	-42.7	174.7	0	0	0	0	0	111.6	M494 L495 L502 I503 N504 A509 L510	M494-A506 HydrophobicContact CB-CB 3.78Å; M494-A506 HydrophobicContact SD-CB 4.33Å; L495-A506 HydrophobicContact CD2-CB 3.71Å; L495-A506 HydrophobicContact CG-CB 3.76Å; L502-A506 WeakPolarHBondContact O-CB 3.39Å; L502-A506 PolarHBondContact O-N 3.26Å; I503-A506 WeakPolarHBondContact O-CB 3.31Å; I503-A506 PolarHBondContact O-N 3.11Å; N504-A506 VanDerWaalsContact C-N 3.33Å; N504-A506 PolarHBondContact O-N 2.85Å; A506-A509 PolarHBondContact O-N 2.9Å; A506-L510 HydrophobicContact CB-CD1 4.46Å; A506-L510 VanDerWaalsContact O-CB 3.26Å; A506-L510 WeakPolarHBondContact O-CB 3.38Å; A506-L510 WeakPolarHBondContact O-CD1 3.41Å; A506-L510 WeakPolarHBondContact O-CG 3.44Å; A506-L510 PolarHBondContact O-N 3.27Å
507	I	89.4	Confident	87.2	Confident	56 Å²	56	63.4 Å²	63.4	29%	0.287	36%	0.357	S	S	.	.	H	α-helix	trans	-61	-44.7	174.5	-68.8	167.2	0	0	0	110.4	I503 N504 A509 L510 G511 V515	I503-I507 HydrophobicContact CG2-CD1 3.75Å; I503-I507 HydrophobicContact CG2-CG1 4.39Å; I503-I507 WeakPolarHBondContact O-CG1 3.28Å; I503-I507 PolarHBondContact O-N 2.65Å; N504-I507 PolarHBondContact O-N 2.98Å; I507-A509 VanDerWaalsContact C-N 3.31Å; I507-A509 PolarHBondContact O-N 2.68Å; I507-L510 PolarHBondContact O-N 2.64Å; I507-G511 PolarHBondContact O-N 3.01Å; I507-V515 HydrophobicContact CD1-CG1 4.17Å; I507-V515 HydrophobicContact CG1-CG1 4.01Å
508	E	88.8	Confident	87.4	Confident	161 Å²	161	62.7 Å²	62.7	75%	0.752	35%	0.348	S	S	*	.	H	α-helix	trans	-58.9	-39.3	174.2	-74.5	175.2	-173.7	0	0	112.6	N504	N504-E508 WeakPolarHBondContact O-CG 3.48Å; N504-E508 PolarHBondContact O-N 2.74Å
509	A	88.8	Confident	87.6	Confident	28 Å²	28	61.1 Å²	61.1	23%	0.231	33%	0.33	C	S	.	.	H	α-helix	trans	-74.6	-33.2	177	0	0	0	0	0	113.8	Q505 A506 I507	Q505-A509 WeakPolarHBondContact O-CB 3.41Å; Q505-A509 PolarHBondContact O-N 3.14Å; A506-A509 PolarHBondContact O-N 2.9Å; I507-A509 VanDerWaalsContact C-N 3.31Å; I507-A509 PolarHBondContact O-N 2.68Å
510	L	87.1	Confident	87.2	Confident	16 Å²	16	55.5 Å²	55.5	8%	0.084	31%	0.31	C	S	.	.	H	α-helix	trans	-83.8	-14.3	-178.6	-69.9	166.4	0	0	0	113.5	Q488 F492 L495 A506 I507 G514 T517	Q488-L510 HydrophobicContact CG-CD2 4.41Å; F492-L510 HydrophobicContact CD2-CD2 3.7Å; F492-L510 HydrophobicContact CE2-CD2 3.94Å; L495-L510 HydrophobicContact CD1-CD1 3.63Å; L495-L510 HydrophobicContact CG-CD1 4.44Å; A506-L510 HydrophobicContact CB-CD1 4.46Å; A506-L510 VanDerWaalsContact O-CB 3.26Å; A506-L510 WeakPolarHBondContact O-CB 3.38Å; A506-L510 WeakPolarHBondContact O-CD1 3.41Å; A506-L510 WeakPolarHBondContact O-CG 3.44Å; A506-L510 PolarHBondContact O-N 3.27Å; I507-L510 PolarHBondContact O-N 2.64Å; L510-G514 WeakPolarHBondContact CB-O 3.35Å; L510-G514 WeakPolarHBondContact CD1-O 3.27Å; L510-T517 HydrophobicContact CD2-CG2 4.06Å; L510-T517 PolarHBondContact O-OG1 3.13Å
511	G	85.6	Confident	86.8	Confident	31 Å²	31	53.5 Å²	53.5	32%	0.32	30%	0.295	S	S	.	.			trans	83.6	-153.1	174.2	0	0	0	0	0	113.8	I507 D513 G514	I507-G511 PolarHBondContact O-N 3.01Å; G511-D513 VanDerWaalsContact C-N 3.29Å; G511-D513 PolarHBondContact O-N 3.4Å; G511-G514 PolarHBondContact O-N 3.1Å; G511-G514 VanDerWaalsContact O-N 3.08Å
512	P	81.9	Confident	86.5	Confident	132 Å²	132	47.3 Å²	47.3	86%	0.857	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-26.4	-166.3	28.2	-36.1	0	0	0	114.2	G514	P512-G514 VanDerWaalsContact C-N 3.34Å
513	D	82.6	Confident	86.4	Confident	104 Å²	104	46.1 Å²	46.1	56%	0.556	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-13.9	178.7	-57.3	-42.2	0	0	0	111.9	G511 V515 N516 T517	G511-D513 VanDerWaalsContact C-N 3.29Å; G511-D513 PolarHBondContact O-N 3.4Å; D513-V515 PolarHBondContact O-N 3.14Å; D513-N516 WeakPolarHBondContact O-CA 3.38Å; D513-N516 WeakPolarHBondContact O-CB 3.31Å; D513-N516 PolarHBondContact O-N 3.47Å; D513-T517 WeakPolarHBondContact CB-OG1 3.28Å
514	G	88	Confident	86.5	Confident	6 Å²	6	45 Å²	45	6%	0.062	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	54.4	-123.8	171.8	0	0	0	0	0	113.9	L510 G511 P512 N516 T517	L510-G514 WeakPolarHBondContact CB-O 3.35Å; L510-G514 WeakPolarHBondContact CD1-O 3.27Å; G511-G514 PolarHBondContact O-N 3.1Å; G511-G514 VanDerWaalsContact O-N 3.08Å; P512-G514 VanDerWaalsContact C-N 3.34Å; G514-N516 PolarHBondContact O-N 3.36Å; G514-T517 WeakPolarHBondContact O-CB 3.25Å; G514-T517 PolarHBondContact O-N 3.06Å; G514-T517 PolarHBondContact O-OG1 3.08Å; G514-T517 VanDerWaalsContact O-OG1 3.11Å
515	V	88.7	Confident	86.6	Confident	6 Å²	6	39.5 Å²	39.5	4%	0.036	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-67.6	-11.4	177.1	-65	0	0	0	0	114.1	L495 I507 D513 P525 L541 A544 A546	L495-V515 HydrophobicContact CD1-CG1 4.35Å; L495-V515 HydrophobicContact CD2-CG1 4.34Å; I507-V515 HydrophobicContact CD1-CG1 4.17Å; I507-V515 HydrophobicContact CG1-CG1 4.01Å; D513-V515 PolarHBondContact O-N 3.14Å; V515-P525 WeakPolarHBondContact O-CD 3.43Å; V515-L541 HydrophobicContact CB-CD2 4.46Å; V515-L541 HydrophobicContact CG1-CD2 4.28Å; V515-A544 HydrophobicContact CG1-CB 4.05Å; V515-A546 HydrophobicContact CG2-CB 4.07Å
516	N	91.1	Very high	86.7	Confident	44 Å²	44	34.7 Å²	34.7	24%	0.235	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-96.1	-0.5	178.4	-61.1	-60.2	0	0	0	113.2	D513 G514 M518 A546 N547 I550	D513-N516 WeakPolarHBondContact O-CA 3.38Å; D513-N516 WeakPolarHBondContact O-CB 3.31Å; D513-N516 PolarHBondContact O-N 3.47Å; G514-N516 PolarHBondContact O-N 3.36Å; N516-M518 PolarHBondContact O-N 3.08Å; N516-A546 WeakPolarHBondContact OD1-CA 3.18Å; N516-N547 PolarHBondContact OD1-N 3.34Å; N516-I550 HydrophobicContact CB-CD1 3.67Å; N516-I550 WeakPolarHBondContact OD1-CD1 3.43Å
517	T	89.5	Confident	86.8	Confident	15 Å²	15	34.7 Å²	34.7	9%	0.092	20%	0.198	C	C	.	.			trans	-57.7	131.4	175	-63	0	0	0	0	110.8	F492 L510 D513 G514 P525	F492-T517 HydrophobicContact CE2-CG2 4.35Å; F492-T517 WeakPolarHBondContact CZ-O 3.36Å; L510-T517 HydrophobicContact CD2-CG2 4.06Å; L510-T517 PolarHBondContact O-OG1 3.13Å; D513-T517 WeakPolarHBondContact CB-OG1 3.28Å; G514-T517 WeakPolarHBondContact O-CB 3.25Å; G514-T517 PolarHBondContact O-N 3.06Å; G514-T517 PolarHBondContact O-OG1 3.08Å; G514-T517 VanDerWaalsContact O-OG1 3.11Å; T517-P525 WeakPolarHBondContact O-CD 3.44Å
518	M	87.1	Confident	86.8	Confident	49 Å²	49	32.4 Å²	32.4	24%	0.241	19%	0.186	C	C	.	.			trans	-94.6	146.4	175.9	-68.5	176.8	-71.4	0	0	111.5	Q488 N516 M523 T524 I550 P553	Q488-M518 PolarHBondContact NE2-O 3.41Å; N516-M518 PolarHBondContact O-N 3.08Å; M518-M523 WeakPolarHBondContact CA-O 3.06Å; M518-T524 HydrophobicContact CG-CG2 3.89Å; M518-I550 HydrophobicContact SD-CG2 4.41Å; M518-P553 HydrophobicContact CE-CG 4.19Å; M518-P553 HydrophobicContact SD-CG 3.9Å
519	D	82.7	Confident	87	Confident	10 Å²	10	24.9 Å²	24.9	5%	0.053	15%	0.151	C	C	.	.			trans	-85.1	-171.2	176.2	86.8	-42.6	0	0	0	113.4	C470 F492 Q521 G522 M523 Y528 H559	C470-D519 PolarHBondContact SG-OD2 2.85Å; F492-D519 HydrophobicContact CE1-CB 4.11Å; F492-D519 HydrophobicContact CE2-CB 4.28Å; F492-D519 HydrophobicContact CZ-CB 3.81Å; D519-Q521 VanDerWaalsContact CG-N 3.27Å; D519-Q521 PolarHBondContact O-N 2.93Å; D519-Q521 VanDerWaalsContact O-N 3.16Å; D519-Q521 WeakPolarHBondContact OD1-CA 3.2Å; D519-Q521 VanDerWaalsContact OD1-CB 3.3Å; D519-Q521 WeakPolarHBondContact OD1-CB 3.32Å; D519-Q521 PolarHBondContact OD1-N 2.97Å; D519-Q521 WeakPolarHBondContact OD2-CG 2.98Å; D519-Q521 PolarHBondContact OD2-N 2.94Å; D519-G522 PolarHBondContact O-N 3.5Å; D519-G522 PolarHBondContact OD1-N 2.66Å; D519-G522 VanDerWaalsContact OD1-N 3.16Å; D519-M523 PolarHBondContact N-O 2.75Å; D519-M523 WeakPolarHBondContact OD1-CB 3.46Å; D519-M523 PolarHBondContact OD1-N 3.27Å; D519-Y528 PolarHBondContact OD2-OH 2.86Å; D519-H559 PolarHBondContact O-ND1 2.89Å
520	D	77.7	Confident	87.1	Confident	21 Å²	21	23.5 Å²	23.5	11%	0.112	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.6	175.2	-82.1	-18.1	0	0	0	114	C470 S472 K485 H559 S561	C470-D520 HydrophobicContact CB-CB 4.43Å; S472-D520 VanDerWaalsContact CB-OD2 3.24Å; S472-D520 WeakPolarHBondContact CB-OD2 3.49Å; S472-D520 PolarHBondContact OG-OD2 2.91Å; K485-D520 IonicContact NZ-OD2 2.91Å; D520-H559 CarbonylContact O-C 3.33Å; D520-H559 WeakPolarHBondContact O-CA 3.41Å; D520-S561 WeakPolarHBondContact O-CB 3.26Å; D520-S561 PolarHBondContact O-N 3.33Å; D520-S561 VanDerWaalsContact O-N 3.14Å
521	Q	77.9	Confident	87.2	Confident	45 Å²	45	23.2 Å²	23.2	21%	0.21	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-6.2	175.3	-61.2	-72.1	-36.4	0	0	113.5	C470 D519 M523 S561 I562	C470-Q521 VanDerWaalsContact SG-CG 3.55Å; D519-Q521 VanDerWaalsContact CG-N 3.27Å; D519-Q521 PolarHBondContact O-N 2.93Å; D519-Q521 VanDerWaalsContact O-N 3.16Å; D519-Q521 WeakPolarHBondContact OD1-CA 3.2Å; D519-Q521 VanDerWaalsContact OD1-CB 3.3Å; D519-Q521 WeakPolarHBondContact OD1-CB 3.32Å; D519-Q521 PolarHBondContact OD1-N 2.97Å; D519-Q521 WeakPolarHBondContact OD2-CG 2.98Å; D519-Q521 PolarHBondContact OD2-N 2.94Å; Q521-M523 VanDerWaalsContact C-N 3.33Å; Q521-M523 HydrophobicContact CB-CB 4.39Å; Q521-M523 HydrophobicContact CB-CG 3.78Å; Q521-S561 VanDerWaalsContact NE2-CB 3.27Å; Q521-S561 PolarHBondContact NE2-O 3.43Å; Q521-S561 PolarHBondContact OE1-O 2.89Å; Q521-I562 VanDerWaalsContact O-CG1 3.26Å; Q521-I562 WeakPolarHBondContact O-CG1 3.44Å
522	G	83.9	Confident	87.3	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	77.5	18.4	-172.2	0	0	0	0	0	113.6	D519	D519-G522 PolarHBondContact O-N 3.5Å; D519-G522 PolarHBondContact OD1-N 2.66Å; D519-G522 VanDerWaalsContact OD1-N 3.16Å
523	M	87.4	Confident	87.7	Confident	4 Å²	4	19 Å²	19	2%	0.02	11%	0.114	C	C	.	.			trans	-100.6	138.7	-174.2	-66.9	-74.4	-72.1	0	0	111.6	L465 M518 D519 Q521 M527 Y528 V552 F574	L465-M523 HydrophobicContact CD2-CE 4.14Å; M518-M523 WeakPolarHBondContact CA-O 3.06Å; D519-M523 PolarHBondContact N-O 2.75Å; D519-M523 WeakPolarHBondContact OD1-CB 3.46Å; D519-M523 PolarHBondContact OD1-N 3.27Å; Q521-M523 VanDerWaalsContact C-N 3.33Å; Q521-M523 HydrophobicContact CB-CB 4.39Å; Q521-M523 HydrophobicContact CB-CG 3.78Å; M523-M527 HydrophobicContact CE-CB 3.56Å; M523-M527 HydrophobicContact CE-SD 4.43Å; M523-M527 HydrophobicContact SD-CB 4.23Å; M523-M527 HydrophobicContact SD-SD 3.87Å; M523-Y528 HydrophobicContact CB-CD2 4.11Å; M523-Y528 HydrophobicContact CB-CE2 3.36Å; M523-Y528 HydrophobicContact CG-CE2 4.29Å; M523-V552 HydrophobicContact SD-CG2 3.74Å; M523-F574 HydrophobicContact CE-CD1 4.25Å; M523-F574 HydrophobicContact CE-CD2 4.26Å; M523-F574 HydrophobicContact CE-CE1 3.67Å; M523-F574 HydrophobicContact CE-CE2 3.69Å; M523-F574 HydrophobicContact CE-CZ 3.36Å; M523-F574 HydrophobicContact SD-CE1 4.14Å; M523-F574 HydrophobicContact SD-CE2 3.6Å; M523-F574 VanDerWaalsContact SD-CE2 3.6Å; M523-F574 HydrophobicContact SD-CZ 3.29Å; M523-F574 WeakPolarHBondContact SD-CZ 3.48Å
524	T	90.7	Very high	88.1	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.105	C	C	.	.			trans	-90.1	158.7	173.4	68.7	0	0	0	0	111.5	M518 L526 M527 Y528 I550	M518-T524 HydrophobicContact CG-CG2 3.89Å; T524-L526 PolarHBondContact O-N 3.03Å; T524-M527 HydrophobicContact CG2-CE 4.45Å; T524-M527 HydrophobicContact CG2-SD 4.31Å; T524-M527 PolarHBondContact N-SD 3.46Å; T524-M527 VanDerWaalsContact N-SD 3.43Å; T524-M527 PolarHBondContact O-N 3.27Å; T524-M527 VanDerWaalsContact O-N 3.08Å; T524-M527 WeakPolarHBondContact OG1-CG 3.36Å; T524-M527 PolarHBondContact OG1-N 3.32Å; T524-Y528 VanDerWaalsContact O-CD2 3.3Å; T524-Y528 WeakPolarHBondContact O-CD2 3.4Å; T524-Y528 PolarHBondContact O-N 2.95Å; T524-I550 HydrophobicContact CG2-CB 4.46Å; T524-I550 HydrophobicContact CG2-CD1 4.18Å; T524-I550 HydrophobicContact CG2-CG2 3.93Å
525	P	90.3	Very high	88.3	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-51.7	-36.6	170.6	-26.9	34.3	0	0	0	113.3	F492 L495 V515 T517 Y528 A529 L541	F492-P525 HydrophobicContact CD1-CG 4.14Å; F492-P525 HydrophobicContact CE1-CG 3.8Å; F492-P525 HydrophobicContact CZ-CG 4.04Å; L495-P525 HydrophobicContact CD1-CB 3.81Å; L495-P525 HydrophobicContact CD1-CG 3.54Å; V515-P525 WeakPolarHBondContact O-CD 3.43Å; T517-P525 WeakPolarHBondContact O-CD 3.44Å; P525-Y528 PolarHBondContact O-N 3.08Å; P525-A529 PolarHBondContact O-N 3.43Å; P525-L541 HydrophobicContact CB-CD1 4.08Å; P525-L541 HydrophobicContact CB-CD2 4.28Å
526	L	92.6	Very high	88.5	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-65.4	-41.7	177.7	-178.9	63.5	0	0	0	111.8	T524 Y528 A529 C530 V538 L541 A546 L548 S571	T524-L526 PolarHBondContact O-N 3.03Å; L526-Y528 VanDerWaalsContact C-N 3.33Å; L526-Y528 PolarHBondContact O-N 3.09Å; L526-A529 PolarHBondContact O-N 3.23Å; L526-C530 WeakPolarHBondContact O-CB 3.1Å; L526-C530 PolarHBondContact O-N 2.7Å; L526-C530 PolarHBondContact O-SG 3.13Å; L526-V538 HydrophobicContact CD1-CG1 4.15Å; L526-V538 HydrophobicContact CD1-CG2 4.39Å; L526-L541 HydrophobicContact CB-CD1 4.29Å; L526-L541 HydrophobicContact CD1-CB 4.11Å; L526-L541 HydrophobicContact CD1-CD1 4.43Å; L526-A546 HydrophobicContact CB-CB 4.34Å; L526-A546 HydrophobicContact CD2-CB 3.98Å; L526-L548 HydrophobicContact CD2-CD2 3.79Å; L526-S571 WeakPolarHBondContact CD2-OG 3.49Å
527	M	91.6	Very high	88.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-39.7	176.5	-67	165	174.5	0	0	112	M523 T524 C530 A531 I550 V552 F574	M523-M527 HydrophobicContact CE-CB 3.56Å; M523-M527 HydrophobicContact CE-SD 4.43Å; M523-M527 HydrophobicContact SD-CB 4.23Å; M523-M527 HydrophobicContact SD-SD 3.87Å; T524-M527 HydrophobicContact CG2-CE 4.45Å; T524-M527 HydrophobicContact CG2-SD 4.31Å; T524-M527 PolarHBondContact N-SD 3.46Å; T524-M527 VanDerWaalsContact N-SD 3.43Å; T524-M527 PolarHBondContact O-N 3.27Å; T524-M527 VanDerWaalsContact O-N 3.08Å; T524-M527 WeakPolarHBondContact OG1-CG 3.36Å; T524-M527 PolarHBondContact OG1-N 3.32Å; M527-C530 PolarHBondContact O-N 3.45Å; M527-A531 WeakPolarHBondContact O-CB 3.34Å; M527-A531 PolarHBondContact O-N 3.2Å; M527-I550 HydrophobicContact CE-CB 4.42Å; M527-I550 HydrophobicContact CE-CG2 4.11Å; M527-I550 WeakPolarHBondContact CE-O 3.43Å; M527-V552 HydrophobicContact CE-CG2 3.9Å; M527-V552 HydrophobicContact SD-CG2 3.8Å; M527-F574 HydrophobicContact CB-CD2 3.94Å; M527-F574 HydrophobicContact CB-CE2 4.17Å; M527-F574 HydrophobicContact CG-CD2 3.99Å; M527-F574 HydrophobicContact CG-CE2 4.13Å; M527-F574 HydrophobicContact SD-CE2 4.16Å
528	Y	89.8	Confident	88.7	Confident	7 Å²	7	22.7 Å²	22.7	3%	0.027	14%	0.139	C	C	.	.	H	α-helix	trans	-65.3	-44.3	174.3	-74.8	-74	0	0	0	112.5	L465 P467 F492 D519 M523 T524 P525 L526 C530 A531 A532	L465-Y528 HydrophobicContact CD1-CE1 4.19Å; L465-Y528 HydrophobicContact CG-CD1 4.12Å; L465-Y528 HydrophobicContact CG-CE1 3.92Å; P467-Y528 HydrophobicContact CB-CE2 4.35Å; P467-Y528 HydrophobicContact CG-CD1 3.83Å; P467-Y528 HydrophobicContact CG-CD2 3.63Å; P467-Y528 HydrophobicContact CG-CE1 3.9Å; P467-Y528 HydrophobicContact CG-CE2 3.7Å; P467-Y528 HydrophobicContact CG-CG 3.69Å; F492-Y528 HydrophobicContact CE1-CD2 4.29Å; F492-Y528 HydrophobicContact CE1-CE2 4.15Å; D519-Y528 PolarHBondContact OD2-OH 2.86Å; M523-Y528 HydrophobicContact CB-CD2 4.11Å; M523-Y528 HydrophobicContact CB-CE2 3.36Å; M523-Y528 HydrophobicContact CG-CE2 4.29Å; T524-Y528 VanDerWaalsContact O-CD2 3.3Å; T524-Y528 WeakPolarHBondContact O-CD2 3.4Å; T524-Y528 PolarHBondContact O-N 2.95Å; P525-Y528 PolarHBondContact O-N 3.08Å; L526-Y528 VanDerWaalsContact C-N 3.33Å; L526-Y528 PolarHBondContact O-N 3.09Å; Y528-C530 VanDerWaalsContact C-N 3.3Å; Y528-C530 PolarHBondContact O-N 3.14Å; Y528-A531 PolarHBondContact O-N 3.43Å; Y528-A532 WeakPolarHBondContact O-CB 3.43Å; Y528-A532 PolarHBondContact O-N 2.97Å
529	A	91.2	Very high	89	Confident	3 Å²	3	23.7 Å²	23.7	3%	0.025	14%	0.143	C	C	.	.	H	α-helix	trans	-60.1	-41.1	174.9	0	0	0	0	0	111.7	P525 L526 A532 G533 D534 M537 V538 L541	P525-A529 PolarHBondContact O-N 3.43Å; L526-A529 PolarHBondContact O-N 3.23Å; A529-A532 PolarHBondContact O-N 3.07Å; A529-G533 PolarHBondContact O-N 3.06Å; A529-D534 PolarHBondContact O-N 3.48Å; A529-M537 HydrophobicContact CB-CB 3.93Å; A529-M537 HydrophobicContact CB-CG 3.57Å; A529-V538 HydrophobicContact CB-CG2 3.73Å; A529-L541 HydrophobicContact CB-CD1 4.05Å
530	C	92.1	Very high	89.5	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.7	-38.8	177.1	-68	0	0	0	0	113.1	L526 M527 Y528 S571 F574 A575 H580 V583	L526-C530 WeakPolarHBondContact O-CB 3.1Å; L526-C530 PolarHBondContact O-N 2.7Å; L526-C530 PolarHBondContact O-SG 3.13Å; M527-C530 PolarHBondContact O-N 3.45Å; Y528-C530 VanDerWaalsContact C-N 3.3Å; Y528-C530 PolarHBondContact O-N 3.14Å; C530-S571 WeakPolarHBondContact CB-O 3.01Å; C530-F574 HydrophobicContact CB-CB 4.4Å; C530-A575 HydrophobicContact CB-CB 4.19Å; C530-H580 PolarHBondContact O-CD2 3.47Å; C530-H580 VanDerWaalsContact O-CD2 3.27Å; C530-V583 HydrophobicContact CB-CG1 4.28Å
531	A	89.1	Confident	90.2	Very high	9 Å²	9	23 Å²	23	7%	0.074	14%	0.139	C	C	.	.	H	α-helix	trans	-70.6	-36	175.2	0	0	0	0	0	112.5	L465 M527 Y528 G533 F574 H580	L465-A531 HydrophobicContact CD2-CB 3.85Å; M527-A531 WeakPolarHBondContact O-CB 3.34Å; M527-A531 PolarHBondContact O-N 3.2Å; Y528-A531 PolarHBondContact O-N 3.43Å; A531-G533 VanDerWaalsContact C-N 3.31Å; A531-F574 HydrophobicContact CB-CB 4.37Å; A531-F574 HydrophobicContact CB-CD1 4.34Å; A531-H580 PolarHBondContact O-NE2 2.81Å
532	A	87.6	Confident	90.9	Very high	64 Å²	64	22.5 Å²	22.5	53%	0.529	14%	0.137	S	C	.	.	H	α-helix	trans	-72.1	-22.3	176.4	0	0	0	0	0	113.7	Y528 A529	Y528-A532 WeakPolarHBondContact O-CB 3.43Å; Y528-A532 PolarHBondContact O-N 2.97Å; A529-A532 PolarHBondContact O-N 3.07Å
533	G	89.8	Confident	91.2	Very high	12 Å²	12	28.3 Å²	28.3	12%	0.124	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	19.1	-175.6	0	0	0	0	0	113.9	A529 A531 E535 H580	A529-G533 PolarHBondContact O-N 3.06Å; A531-G533 VanDerWaalsContact C-N 3.31Å; G533-E535 PolarHBondContact O-N 3Å; G533-E535 VanDerWaalsContact O-N 3.08Å; G533-H580 VanDerWaalsContact CA-CD2 3.47Å; G533-H580 WeakPolarHBondContact CA-CD2 3.44Å; G533-H580 PolarHBondContact N-NE2 3.48Å
534	D	90.7	Very high	91.3	Very high	67 Å²	67	29.6 Å²	29.6	36%	0.358	18%	0.179	S	C	.	.			trans	-81.7	89.3	-178.1	-171	-23.2	0	0	0	110.5	A529 A536 M537 V538	A529-D534 PolarHBondContact O-N 3.48Å; D534-A536 PolarHBondContact O-N 2.79Å; D534-A536 PolarHBondContact OD1-N 3.23Å; D534-M537 HydrophobicContact CB-CB 3.74Å; D534-M537 PolarHBondContact O-N 2.85Å; D534-M537 PolarHBondContact OD1-N 2.99Å; D534-V538 WeakPolarHBondContact O-CG2 2.92Å; D534-V538 PolarHBondContact O-N 3.14Å
535	E	93.1	Very high	91.2	Very high	96 Å²	96	32 Å²	32	45%	0.449	20%	0.204	S	C	.	.	H	α-helix	trans	-52.2	-38.6	179	-62.5	176.4	-160.1	0	0	112.9	G533 Q539 S582 V583 L586	G533-E535 PolarHBondContact O-N 3Å; G533-E535 VanDerWaalsContact O-N 3.08Å; E535-Q539 PolarHBondContact O-N 3.39Å; E535-S582 WeakPolarHBondContact OE1-CB 3.21Å; E535-S582 PolarHBondContact OE1-OG 2.89Å; E535-V583 HydrophobicContact CG-CG2 3.95Å; E535-L586 HydrophobicContact CB-CD1 4.21Å; E535-L586 HydrophobicContact CG-CD1 4.5Å
536	A	92.1	Very high	91.3	Very high	74 Å²	74	32.5 Å²	32.5	61%	0.612	21%	0.209	S	C	*	.	H	α-helix	trans	-73.8	-40.4	-178	0	0	0	0	0	111.6	D534 M540	D534-A536 PolarHBondContact O-N 2.79Å; D534-A536 PolarHBondContact OD1-N 3.23Å; A536-M540 VanDerWaalsContact O-CB 3.29Å; A536-M540 WeakPolarHBondContact O-CB 3.4Å; A536-M540 PolarHBondContact O-N 3.47Å
537	M	91.1	Very high	91.2	Very high	14 Å²	14	36.5 Å²	36.5	7%	0.069	23%	0.23	C	C	.	.	H	α-helix	trans	-64.5	-42.3	173.3	-168	79	67.3	0	0	111.8	A529 D534 M540 L541	A529-M537 HydrophobicContact CB-CB 3.93Å; A529-M537 HydrophobicContact CB-CG 3.57Å; D534-M537 HydrophobicContact CB-CB 3.74Å; D534-M537 PolarHBondContact O-N 2.85Å; D534-M537 PolarHBondContact OD1-N 2.99Å; M537-M540 HydrophobicContact CG-CE 4.21Å; M537-M540 PolarHBondContact O-N 3.14Å; M537-M540 HydrophobicContact SD-CE 3.36Å; M537-M540 WeakPolarHBondContact SD-CE 3.4Å; M537-L541 HydrophobicContact CG-CD1 4.12Å; M537-L541 WeakPolarHBondContact O-CG 3.43Å; M537-L541 PolarHBondContact O-N 2.9Å
538	V	94.1	Very high	91.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-50.2	176.8	168.7	0	0	0	0	110.2	L526 A529 D534 M540 L541 I542 V583 L587	L526-V538 HydrophobicContact CD1-CG1 4.15Å; L526-V538 HydrophobicContact CD1-CG2 4.39Å; A529-V538 HydrophobicContact CB-CG2 3.73Å; D534-V538 WeakPolarHBondContact O-CG2 2.92Å; D534-V538 PolarHBondContact O-N 3.14Å; V538-M540 VanDerWaalsContact C-N 3.34Å; V538-M540 PolarHBondContact O-N 2.95Å; V538-L541 PolarHBondContact O-N 3.37Å; V538-I542 HydrophobicContact CG1-CD1 3.71Å; V538-I542 HydrophobicContact CG1-CG1 4.42Å; V538-I542 VanDerWaalsContact O-CG1 3.26Å; V538-I542 WeakPolarHBondContact O-CG1 3.11Å; V538-I542 PolarHBondContact O-N 2.75Å; V538-V583 HydrophobicContact CG1-CG1 4.29Å; V538-V583 HydrophobicContact CG2-CG1 3.94Å; V538-V583 HydrophobicContact CG2-CG2 4.45Å; V538-L587 HydrophobicContact CG1-CD2 4.37Å
539	Q	93.8	Very high	91.1	Very high	71 Å²	71	39.9 Å²	39.9	33%	0.332	25%	0.248	S	C	.	.	H	α-helix	trans	-59.2	-45.1	177.3	-172.4	62.5	54.5	0	0	111.8	E535 L541 I542 D543	E535-Q539 PolarHBondContact O-N 3.39Å; Q539-L541 VanDerWaalsContact C-N 3.32Å; Q539-L541 PolarHBondContact O-N 3.49Å; Q539-I542 PolarHBondContact O-N 3.44Å; Q539-D543 PolarHBondContact NE2-OD1 3.21Å; Q539-D543 WeakPolarHBondContact O-CB 3.01Å; Q539-D543 PolarHBondContact O-N 2.67Å
540	M	92.4	Very high	91	Very high	16 Å²	16	41.2 Å²	41.2	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-58.4	-41	178	176.7	-82.7	-67.7	0	0	112.8	T500 I503 A536 M537 V538 A544	T500-M540 HydrophobicContact CG2-CG 4.03Å; I503-M540 HydrophobicContact CD1-CG 3.67Å; I503-M540 HydrophobicContact CD1-SD 3.44Å; I503-M540 WeakPolarHBondContact CD1-SD 3.48Å; I503-M540 HydrophobicContact CG1-CG 4.4Å; I503-M540 HydrophobicContact CG1-SD 3.62Å; A536-M540 VanDerWaalsContact O-CB 3.29Å; A536-M540 WeakPolarHBondContact O-CB 3.4Å; A536-M540 PolarHBondContact O-N 3.47Å; M537-M540 HydrophobicContact CG-CE 4.21Å; M537-M540 PolarHBondContact O-N 3.14Å; M537-M540 HydrophobicContact SD-CE 3.36Å; M537-M540 WeakPolarHBondContact SD-CE 3.4Å; V538-M540 VanDerWaalsContact C-N 3.34Å; V538-M540 PolarHBondContact O-N 2.95Å; M540-A544 WeakPolarHBondContact O-CB 3.18Å; M540-A544 PolarHBondContact O-N 3.47Å
541	L	92.4	Very high	90.8	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-73.6	-35.4	178.5	-69.9	170.1	0	0	0	112.3	L495 V515 P525 L526 A529 M537 V538 Q539 A544 G545 A546	L495-L541 HydrophobicContact CD1-CD2 4.3Å; L495-L541 HydrophobicContact CD2-CD2 4.22Å; V515-L541 HydrophobicContact CB-CD2 4.46Å; V515-L541 HydrophobicContact CG1-CD2 4.28Å; P525-L541 HydrophobicContact CB-CD1 4.08Å; P525-L541 HydrophobicContact CB-CD2 4.28Å; L526-L541 HydrophobicContact CB-CD1 4.29Å; L526-L541 HydrophobicContact CD1-CB 4.11Å; L526-L541 HydrophobicContact CD1-CD1 4.43Å; A529-L541 HydrophobicContact CB-CD1 4.05Å; M537-L541 HydrophobicContact CG-CD1 4.12Å; M537-L541 WeakPolarHBondContact O-CG 3.43Å; M537-L541 PolarHBondContact O-N 2.9Å; V538-L541 PolarHBondContact O-N 3.37Å; Q539-L541 VanDerWaalsContact C-N 3.32Å; Q539-L541 PolarHBondContact O-N 3.49Å; L541-A544 PolarHBondContact O-N 3.1Å; L541-G545 PolarHBondContact O-N 3.36Å; L541-A546 HydrophobicContact CB-CB 4.19Å; L541-A546 WeakPolarHBondContact O-CB 3.29Å; L541-A546 PolarHBondContact O-N 3.28Å
542	I	93.4	Very high	90.6	Very high	34 Å²	34	43.3 Å²	43.3	17%	0.174	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-47.7	172	-66.5	170.4	0	0	0	110	V538 Q539 A544 G545 L548 L587 A590	V538-I542 HydrophobicContact CG1-CD1 3.71Å; V538-I542 HydrophobicContact CG1-CG1 4.42Å; V538-I542 VanDerWaalsContact O-CG1 3.26Å; V538-I542 WeakPolarHBondContact O-CG1 3.11Å; V538-I542 PolarHBondContact O-N 2.75Å; Q539-I542 PolarHBondContact O-N 3.44Å; I542-A544 PolarHBondContact O-N 3.25Å; I542-G545 PolarHBondContact O-N 3.28Å; I542-L548 HydrophobicContact CD1-CD2 4.35Å; I542-L548 HydrophobicContact CG1-CD2 3.91Å; I542-L587 HydrophobicContact CD1-CD2 4.3Å; I542-A590 HydrophobicContact CD1-CB 4.27Å; I542-A590 HydrophobicContact CG2-CB 4.33Å
543	D	91.3	Very high	90.3	Very high	121 Å²	121	41.9 Å²	41.9	65%	0.647	25%	0.248	S	C	*	.	H	α-helix	trans	-62	-30.1	177.1	-66.2	-14.7	0	0	0	112.2	Q539 G545	Q539-D543 PolarHBondContact NE2-OD1 3.21Å; Q539-D543 WeakPolarHBondContact O-CB 3.01Å; Q539-D543 PolarHBondContact O-N 2.67Å; D543-G545 VanDerWaalsContact C-N 3.27Å; D543-G545 PolarHBondContact O-N 3.1Å
544	A	89.1	Confident	89.5	Confident	31 Å²	31	43.5 Å²	43.5	26%	0.256	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	0.9	174	0	0	0	0	0	114.5	I503 V515 M540 L541 I542	I503-A544 HydrophobicContact CG2-CB 3.91Å; V515-A544 HydrophobicContact CG1-CB 4.05Å; M540-A544 WeakPolarHBondContact O-CB 3.18Å; M540-A544 PolarHBondContact O-N 3.47Å; L541-A544 PolarHBondContact O-N 3.1Å; I542-A544 PolarHBondContact O-N 3.25Å
545	G	88.9	Confident	88.4	Confident	51 Å²	51	46.6 Å²	46.6	53%	0.526	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	28.3	177.3	0	0	0	0	0	115.1	L541 I542 D543	L541-G545 PolarHBondContact O-N 3.36Å; I542-G545 PolarHBondContact O-N 3.28Å; D543-G545 VanDerWaalsContact C-N 3.27Å; D543-G545 PolarHBondContact O-N 3.1Å
546	A	91.7	Very high	87.1	Confident	11 Å²	11	43.2 Å²	43.2	9%	0.091	26%	0.261	C	S	.	.			trans	-65.6	135.3	170.9	0	0	0	0	0	111.5	V515 N516 L526 L541	V515-A546 HydrophobicContact CG2-CB 4.07Å; N516-A546 WeakPolarHBondContact OD1-CA 3.18Å; L526-A546 HydrophobicContact CB-CB 4.34Å; L526-A546 HydrophobicContact CD2-CB 3.98Å; L541-A546 HydrophobicContact CB-CB 4.19Å; L541-A546 WeakPolarHBondContact O-CB 3.29Å; L541-A546 PolarHBondContact O-N 3.28Å
547	N	90.7	Very high	85.7	Confident	84 Å²	84	46 Å²	46	45%	0.449	27%	0.273	S	S	.	.			trans	-84.9	123.1	177.4	177.3	4.8	0	0	0	110.1	N516 D549 I550	N516-N547 PolarHBondContact OD1-N 3.34Å; N547-D549 PolarHBondContact OD1-N 3.04Å; N547-I550 HydrophobicContact CB-CD1 3.86Å; N547-I550 HydrophobicContact CB-CG1 3.85Å
548	L	90.8	Very high	84.6	Confident	16 Å²	16	55 Å²	55	8%	0.084	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-35.5	-170.8	-46.4	-177.6	0	0	0	112.6	L526 I542 S571 L587 A590 A592	L526-L548 HydrophobicContact CD2-CD2 3.79Å; I542-L548 HydrophobicContact CD1-CD2 4.35Å; I542-L548 HydrophobicContact CG1-CD2 3.91Å; L548-S571 PolarHBondContact O-OG 3.07Å; L548-L587 HydrophobicContact CD2-CD2 4.03Å; L548-A590 HydrophobicContact CD1-CB 3.76Å; L548-A592 HydrophobicContact CB-CB 3.94Å; L548-A592 HydrophobicContact CD1-CB 3.86Å
549	D	87.9	Confident	83.5	Confident	62 Å²	62	56 Å²	56	33%	0.332	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	15.4	-170.4	-58.2	-48.7	0	0	0	113.1	N547 Q551 H593	N547-D549 PolarHBondContact OD1-N 3.04Å; D549-Q551 PolarHBondContact O-N 3.49Å; D549-H593 PolarHBondContact OD1-N 2.78Å
550	I	88.6	Confident	82.2	Confident	31 Å²	31	57 Å²	57	16%	0.159	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-60.1	130.7	167.5	-66.1	177.1	0	0	0	108.6	N516 M518 T524 M527 N547 T570	N516-I550 HydrophobicContact CB-CD1 3.67Å; N516-I550 WeakPolarHBondContact OD1-CD1 3.43Å; M518-I550 HydrophobicContact SD-CG2 4.41Å; T524-I550 HydrophobicContact CG2-CB 4.46Å; T524-I550 HydrophobicContact CG2-CD1 4.18Å; T524-I550 HydrophobicContact CG2-CG2 3.93Å; M527-I550 HydrophobicContact CE-CB 4.42Å; M527-I550 HydrophobicContact CE-CG2 4.11Å; M527-I550 WeakPolarHBondContact CE-O 3.43Å; N547-I550 HydrophobicContact CB-CD1 3.86Å; N547-I550 HydrophobicContact CB-CG1 3.85Å; I550-T570 WeakPolarHBondContact O-CA 3.28Å
551	Q	87.6	Confident	81.2	Confident	54 Å²	54	58.1 Å²	58.1	25%	0.252	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-101	140.2	176.3	-65.4	174	13.7	0	0	110.7	D549 P553 W569 T570 S597	D549-Q551 PolarHBondContact O-N 3.49Å; Q551-P553 WeakPolarHBondContact O-CD 3.29Å; Q551-W569 WeakPolarHBondContact CA-O 3.44Å; Q551-T570 HydrophobicContact CG-CG2 3.9Å; Q551-S597 PolarHBondContact NE2-OG 3.34Å; Q551-S597 VanDerWaalsContact NE2-OG 3.08Å; Q551-S597 PolarHBondContact OE1-OG 3.46Å
552	V	85.1	Confident	80.3	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-60.9	124.7	167.5	177.5	0	0	0	0	109.1	M523 M527 I562 S566 H568 W569 F574	M523-V552 HydrophobicContact SD-CG2 3.74Å; M527-V552 HydrophobicContact CE-CG2 3.9Å; M527-V552 HydrophobicContact SD-CG2 3.8Å; V552-I562 HydrophobicContact CG1-CG2 3.85Å; V552-S566 WeakPolarHBondContact CB-O 3.22Å; V552-S566 WeakPolarHBondContact CG1-O 3.24Å; V552-S566 WeakPolarHBondContact CG2-O 3.3Å; V552-H568 WeakPolarHBondContact O-CA 3.45Å; V552-H568 PolarHBondContact O-N 3.31Å; V552-W569 PolarHBondContact N-O 2.96Å; V552-F574 HydrophobicContact CG2-CE2 4.08Å; V552-F574 HydrophobicContact CG2-CZ 4.39Å
553	P	82.1	Confident	79.3	Confident	34 Å²	34	58 Å²	58	22%	0.221	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-60.7	146.9	-176.7	-24.8	34.3	0	0	0	113.3	M518 Q551 I562	M518-P553 HydrophobicContact CE-CG 4.19Å; M518-P553 HydrophobicContact SD-CG 3.9Å; Q551-P553 WeakPolarHBondContact O-CD 3.29Å; P553-I562 HydrophobicContact CB-CD1 4.19Å; P553-I562 WeakPolarHBondContact O-CD1 3.3Å
554	S	72.6	Confident	78.3	Confident	45 Å²	45	53.6 Å²	53.6	32%	0.315	31%	0.31	S	S	.	.	S	Bend	trans	-64.4	-51	179.1	-172.9	0	0	0	0	113	R567 H568	S554-R567 VanDerWaalsContact O-CD 3.28Å; S554-R567 WeakPolarHBondContact O-CD 3.47Å; S554-R567 PolarHBondContact O-NE 3.17Å; S554-H568 WeakPolarHBondContact CB-CE1 3.48Å; S554-H568 PolarHBondContact OG-NE2 3.45Å
555	N	67.5	Low	77.5	Confident	132 Å²	132	53.7 Å²	53.7	71%	0.706	31%	0.306	S	S	*	.	S	Bend	trans	-159.5	126.9	172.4	-171.8	-0.4	0	0	0	108.8
556	S	65.6	Low	76.9	Confident	25 Å²	25	51.5 Å²	51.5	18%	0.175	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-141.5	136	-179.1	177.5	0	0	0	0	110.6	R558 H559	S556-R558 PolarHBondContact O-N 2.65Å; S556-R558 VanDerWaalsContact O-N 3.08Å; S556-R558 PolarHBondContact OG-N 2.82Å; S556-H559 CarbonylContact O-C 3.43Å; S556-H559 PolarHBondContact O-N 3.35Å
557	P	64.3	Low	76.3	Confident	133 Å²	133	55 Å²	55	86%	0.864	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-10	172.8	29.4	-35.8	0	0	0	113.2
558	R	66.1	Low	75.9	Confident	202 Å²	202	53.1 Å²	53.1	76%	0.762	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-21.6	172.2	-60.9	-172.7	-178.5	-169.6	1.3	113.8	S556	S556-R558 PolarHBondContact O-N 2.65Å; S556-R558 VanDerWaalsContact O-N 3.08Å; S556-R558 PolarHBondContact OG-N 2.82Å
559	H	72.1	Confident	75.6	Confident	22 Å²	22	52.6 Å²	52.6	10%	0.102	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-130.7	73.5	-174.1	-54	-67.9	0	0	0	108.3	D519 D520 S556 S561 I562	D519-H559 PolarHBondContact O-ND1 2.89Å; D520-H559 CarbonylContact O-C 3.33Å; D520-H559 WeakPolarHBondContact O-CA 3.41Å; S556-H559 CarbonylContact O-C 3.43Å; S556-H559 PolarHBondContact O-N 3.35Å; H559-S561 PolarHBondContact O-N 3.35Å; H559-S561 VanDerWaalsContact O-N 3.12Å; H559-I562 HydrophobicContact CB-CD1 3.63Å; H559-I562 HydrophobicContact CB-CG1 3.78Å; H559-I562 VanDerWaalsContact O-CD1 3.3Å; H559-I562 WeakPolarHBondContact O-CD1 3.26Å; H559-I562 WeakPolarHBondContact O-CG1 3.28Å
560	P	65.9	Low	75.7	Confident	92 Å²	92	49.7 Å²	49.7	60%	0.597	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-7.8	-167.1	30.4	-37	0	0	0	113.9
561	S	71.6	Confident	75.9	Confident	40 Å²	40	48.2 Å²	48.2	28%	0.28	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	1	-170.2	-57.9	0	0	0	0	115	D520 Q521 H559 H563	D520-S561 WeakPolarHBondContact O-CB 3.26Å; D520-S561 PolarHBondContact O-N 3.33Å; D520-S561 VanDerWaalsContact O-N 3.14Å; Q521-S561 VanDerWaalsContact NE2-CB 3.27Å; Q521-S561 PolarHBondContact NE2-O 3.43Å; Q521-S561 PolarHBondContact OE1-O 2.89Å; H559-S561 PolarHBondContact O-N 3.35Å; H559-S561 VanDerWaalsContact O-N 3.12Å; S561-H563 PolarHBondContact O-N 2.88Å
562	I	73.6	Confident	76.1	Confident	15 Å²	15	45.7 Å²	45.7	8%	0.077	24%	0.244	C	C	.	.			trans	-43.3	124.8	179.5	-63.2	155.2	0	0	0	112.2	Q521 V552 P553 H559 R567	Q521-I562 VanDerWaalsContact O-CG1 3.26Å; Q521-I562 WeakPolarHBondContact O-CG1 3.44Å; V552-I562 HydrophobicContact CG1-CG2 3.85Å; P553-I562 HydrophobicContact CB-CD1 4.19Å; P553-I562 WeakPolarHBondContact O-CD1 3.3Å; H559-I562 HydrophobicContact CB-CD1 3.63Å; H559-I562 HydrophobicContact CB-CG1 3.78Å; H559-I562 VanDerWaalsContact O-CD1 3.3Å; H559-I562 WeakPolarHBondContact O-CD1 3.26Å; H559-I562 WeakPolarHBondContact O-CG1 3.28Å; I562-R567 HydrophobicContact CG2-CG 3.91Å
563	H	71.8	Confident	76.3	Confident	18 Å²	18	45.8 Å²	45.8	8%	0.083	25%	0.245	C	C	.	.			trans	-70.9	133.5	172.7	-162.1	-103.5	0	0	0	110.9	H150 R438 S561 D565 S566	H150-H563 AromaticContact CE1-CE1 3.54Å; H150-H563 AromaticContact CE1-CG 3.81Å; H150-H563 AromaticContact CE1-ND1 3.47Å; H150-H563 PolarHBondContact CE1-ND1 2.97Å; H150-H563 AromaticContact CE1-NE2 3.95Å; H150-H563 AromaticContact ND1-CE1 3.98Å; H150-H563 AromaticContact NE2-CG 3.86Å; H150-H563 AromaticContact NE2-ND1 3.62Å; R438-H563 PolarHBondContact NE-CD2 2.64Å; R438-H563 PolarHBondContact NE-NE2 2.82Å; S561-H563 PolarHBondContact O-N 2.88Å; H563-D565 VanDerWaalsContact C-N 3.28Å; H563-D565 IonicContact CE1-OD2 3.78Å; H563-D565 PolarHBondContact CE1-OD2 3Å; H563-D565 IonicContact ND1-OD2 3.69Å; H563-D565 PolarHBondContact O-N 2.78Å; H563-S566 PolarHBondContact O-N 3.01Å; H563-S566 VanDerWaalsContact O-N 3.16Å; H563-S566 PolarHBondContact O-OG 3.06Å
564	P	71.1	Confident	76.7	Confident	28 Å²	28	44.3 Å²	44.3	18%	0.182	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-57.7	-38.7	-177.8	-29.7	38.2	0	0	0	114.3	R438 S566 R567	R438-P564 VanDerWaalsContact CZ-CG 3.48Å; R438-P564 VanDerWaalsContact NH1-CG 3.27Å; R438-P564 VanDerWaalsContact NH2-CD 3.35Å; P564-S566 VanDerWaalsContact C-N 3.29Å; P564-S566 PolarHBondContact O-N 3.12Å; P564-R567 WeakPolarHBondContact O-CB 3.43Å; P564-R567 WeakPolarHBondContact O-CD 3.44Å; P564-R567 VanDerWaalsContact O-CG 3.27Å; P564-R567 WeakPolarHBondContact O-CG 3.49Å; P564-R567 PolarHBondContact O-N 2.85Å
565	D	71.9	Confident	77.6	Confident	33 Å²	33	42.1 Å²	42.1	18%	0.176	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-74.1	-25.4	-176.5	-54	-10	0	0	0	111.3	H563 R567 W569	H563-D565 VanDerWaalsContact C-N 3.28Å; H563-D565 IonicContact CE1-OD2 3.78Å; H563-D565 PolarHBondContact CE1-OD2 3Å; H563-D565 IonicContact ND1-OD2 3.69Å; H563-D565 PolarHBondContact O-N 2.78Å; D565-R567 VanDerWaalsContact C-N 3.29Å; D565-R567 PolarHBondContact O-N 3.46Å; D565-W569 WeakPolarHBondContact O-CZ2 3.14Å; D565-W569 PolarHBondContact O-NE1 3.4Å
566	S	76.6	Confident	78.7	Confident	5 Å²	5	36 Å²	36	4%	0.035	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-82.9	-3	177.4	68.8	0	0	0	0	113.7	V552 H563 P564 W569	V552-S566 WeakPolarHBondContact CB-O 3.22Å; V552-S566 WeakPolarHBondContact CG1-O 3.24Å; V552-S566 WeakPolarHBondContact CG2-O 3.3Å; H563-S566 PolarHBondContact O-N 3.01Å; H563-S566 VanDerWaalsContact O-N 3.16Å; H563-S566 PolarHBondContact O-OG 3.06Å; P564-S566 VanDerWaalsContact C-N 3.29Å; P564-S566 PolarHBondContact O-N 3.12Å; S566-W569 WeakPolarHBondContact O-CB 3.48Å; S566-W569 PolarHBondContact O-N 3.04Å
567	R	78.9	Confident	79.8	Confident	84 Å²	84	34.9 Å²	34.9	32%	0.317	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	142.6	-179.1	-70	173.3	179.1	146.4	4.6	110.9	S554 I562 P564 D565 W569	S554-R567 VanDerWaalsContact O-CD 3.28Å; S554-R567 WeakPolarHBondContact O-CD 3.47Å; S554-R567 PolarHBondContact O-NE 3.17Å; I562-R567 HydrophobicContact CG2-CG 3.91Å; P564-R567 WeakPolarHBondContact O-CB 3.43Å; P564-R567 WeakPolarHBondContact O-CD 3.44Å; P564-R567 VanDerWaalsContact O-CG 3.27Å; P564-R567 WeakPolarHBondContact O-CG 3.49Å; P564-R567 PolarHBondContact O-N 2.85Å; D565-R567 VanDerWaalsContact C-N 3.29Å; D565-R567 PolarHBondContact O-N 3.46Å; R567-W569 PolarHBondContact O-N 3.34Å
568	H	81.6	Confident	80.8	Confident	44 Å²	44	31 Å²	31	20%	0.204	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	1.3	-178.9	-47.4	-73.5	0	0	0	114.3	V552 S554 S597 S605 A607	V552-H568 WeakPolarHBondContact O-CA 3.45Å; V552-H568 PolarHBondContact O-N 3.31Å; S554-H568 WeakPolarHBondContact CB-CE1 3.48Å; S554-H568 PolarHBondContact OG-NE2 3.45Å; H568-S597 WeakPolarHBondContact O-CB 3.33Å; H568-S597 PolarHBondContact O-OG 3.38Å; H568-S597 VanDerWaalsContact O-OG 3.1Å; H568-S605 PolarHBondContact CD2-OG 3.07Å; H568-A607 HydrophobicContact CB-CB 4.05Å
569	W	85.8	Confident	81.9	Confident	5 Å²	5	22.6 Å²	22.6	2%	0.019	13%	0.126	C	C	.	.			trans	-69.3	144.6	176	-72.8	2.2	0	0	0	111.5	Q551 V552 D565 S566 R567 T573 F574 L577	Q551-W569 WeakPolarHBondContact CA-O 3.44Å; V552-W569 PolarHBondContact N-O 2.96Å; D565-W569 WeakPolarHBondContact O-CZ2 3.14Å; D565-W569 PolarHBondContact O-NE1 3.4Å; S566-W569 WeakPolarHBondContact O-CB 3.48Å; S566-W569 PolarHBondContact O-N 3.04Å; R567-W569 PolarHBondContact O-N 3.34Å; W569-T573 WeakPolarHBondContact CA-OG1 3.33Å; W569-T573 VanDerWaalsContact CB-OG1 3.29Å; W569-T573 WeakPolarHBondContact CB-OG1 3.41Å; W569-F574 HydrophobicContact CB-CD2 4.32Å; W569-F574 HydrophobicContact CB-CE2 3.76Å; W569-F574 HydrophobicContact CB-CZ 4.16Å; W569-F574 HydrophobicContact CE3-CD1 4.09Å; W569-F574 AromaticContact CE3-CE1 3.56Å; W569-F574 HydrophobicContact CE3-CE1 3.56Å; W569-F574 HydrophobicContact CE3-CE2 4.25Å; W569-F574 AromaticContact CE3-CZ 3.64Å; W569-F574 HydrophobicContact CE3-CZ 3.64Å; W569-F574 HydrophobicContact CZ3-CD1 4.49Å; W569-F574 AromaticContact CZ3-CE1 3.99Å; W569-F574 HydrophobicContact CZ3-CE1 3.99Å; W569-F574 HydrophobicContact CZ3-CZ 4.45Å; W569-L577 HydrophobicContact CE3-CD2 4.24Å; W569-L577 HydrophobicContact CH2-CD1 3.44Å; W569-L577 VanDerWaalsContact CH2-CD1 3.44Å; W569-L577 HydrophobicContact CH2-CD2 3.86Å; W569-L577 HydrophobicContact CH2-CG 4.32Å; W569-L577 HydrophobicContact CZ2-CD1 3.98Å; W569-L577 HydrophobicContact CZ3-CD1 3.81Å; W569-L577 HydrophobicContact CZ3-CD2 3.41Å; W569-L577 VanDerWaalsContact CZ3-CD2 3.41Å; W569-L577 HydrophobicContact CZ3-CG 4.25Å
570	T	89.7	Confident	82.9	Confident	1 Å²	1	24 Å²	24	1%	0.006	13%	0.132	C	C	.	.			trans	-106	171.1	173	65.5	0	0	0	0	111	I550 Q551 L572 T573 F574	I550-T570 WeakPolarHBondContact O-CA 3.28Å; Q551-T570 HydrophobicContact CG-CG2 3.9Å; T570-L572 PolarHBondContact O-N 3.47Å; T570-T573 PolarHBondContact N-OG1 3.32Å; T570-T573 PolarHBondContact O-N 2.97Å; T570-T573 VanDerWaalsContact O-N 3.09Å; T570-T573 PolarHBondContact O-OG1 3.48Å; T570-F574 VanDerWaalsContact O-CD2 3.3Å; T570-F574 WeakPolarHBondContact O-CD2 3.46Å; T570-F574 PolarHBondContact O-N 2.98Å
571	S	91.5	Very high	84.2	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-53.1	-38.3	175.2	-49.6	0	0	0	0	112.6	L526 C530 L548 F574 A575	L526-S571 WeakPolarHBondContact CD2-OG 3.49Å; C530-S571 WeakPolarHBondContact CB-O 3.01Å; L548-S571 PolarHBondContact O-OG 3.07Å; S571-F574 PolarHBondContact O-N 3.41Å; S571-A575 PolarHBondContact O-N 3.16Å; S571-A575 VanDerWaalsContact O-N 3.15Å
572	L	91.9	Very high	85.3	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-64.9	-44.6	176.7	-176.3	68.5	0	0	0	112.4	T570 F574 A575 V576 V584 L587 L588 H593 P610	T570-L572 PolarHBondContact O-N 3.47Å; L572-F574 VanDerWaalsContact C-N 3.3Å; L572-F574 PolarHBondContact O-N 3.46Å; L572-A575 PolarHBondContact O-N 2.96Å; L572-V576 WeakPolarHBondContact O-CG2 3.01Å; L572-V576 PolarHBondContact O-N 3.21Å; L572-V584 HydrophobicContact CD1-CG1 3.97Å; L572-L587 HydrophobicContact CB-CD1 4.34Å; L572-L587 HydrophobicContact CD1-CB 4.12Å; L572-L587 HydrophobicContact CD1-CD1 4.2Å; L572-L588 HydrophobicContact CD1-CD1 4.46Å; L572-L588 HydrophobicContact CD1-CD2 4.1Å; L572-L588 HydrophobicContact CD1-CG 3.96Å; L572-L588 HydrophobicContact CD2-CD2 3.89Å; L572-H593 WeakPolarHBondContact CD2-O 3.4Å; L572-P610 HydrophobicContact CD2-CG 4.07Å; L572-P610 HydrophobicContact CG-CG 4.39Å
573	T	89.8	Confident	86.3	Confident	3 Å²	3	22.1 Å²	22.1	2%	0.018	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-37.6	178	42.6	0	0	0	0	111.5	W569 T570 V576 L577 P610 L613	W569-T573 WeakPolarHBondContact CA-OG1 3.33Å; W569-T573 VanDerWaalsContact CB-OG1 3.29Å; W569-T573 WeakPolarHBondContact CB-OG1 3.41Å; T570-T573 PolarHBondContact N-OG1 3.32Å; T570-T573 PolarHBondContact O-N 2.97Å; T570-T573 VanDerWaalsContact O-N 3.09Å; T570-T573 PolarHBondContact O-OG1 3.48Å; T573-V576 PolarHBondContact O-N 3.47Å; T573-L577 VanDerWaalsContact O-CB 3.23Å; T573-L577 WeakPolarHBondContact O-CB 3.33Å; T573-L577 PolarHBondContact O-N 2.83Å; T573-P610 HydrophobicContact CG2-CG 3.78Å; T573-L613 HydrophobicContact CG2-CD1 4.35Å
574	F	89.9	Confident	87.5	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.009	11%	0.114	C	C	.	.	H	α-helix	trans	-65.6	-42.4	174.9	-77.9	-75	0	0	0	113.2	L465 M523 M527 C530 A531 V552 W569 T570 S571 L572 V576 L577 H578	L465-F574 HydrophobicContact CD2-CD1 4.5Å; L465-F574 HydrophobicContact CD2-CE1 4.3Å; M523-F574 HydrophobicContact CE-CD1 4.25Å; M523-F574 HydrophobicContact CE-CD2 4.26Å; M523-F574 HydrophobicContact CE-CE1 3.67Å; M523-F574 HydrophobicContact CE-CE2 3.69Å; M523-F574 HydrophobicContact CE-CZ 3.36Å; M523-F574 HydrophobicContact SD-CE1 4.14Å; M523-F574 HydrophobicContact SD-CE2 3.6Å; M523-F574 VanDerWaalsContact SD-CE2 3.6Å; M523-F574 HydrophobicContact SD-CZ 3.29Å; M523-F574 WeakPolarHBondContact SD-CZ 3.48Å; M527-F574 HydrophobicContact CB-CD2 3.94Å; M527-F574 HydrophobicContact CB-CE2 4.17Å; M527-F574 HydrophobicContact CG-CD2 3.99Å; M527-F574 HydrophobicContact CG-CE2 4.13Å; M527-F574 HydrophobicContact SD-CE2 4.16Å; C530-F574 HydrophobicContact CB-CB 4.4Å; A531-F574 HydrophobicContact CB-CB 4.37Å; A531-F574 HydrophobicContact CB-CD1 4.34Å; V552-F574 HydrophobicContact CG2-CE2 4.08Å; V552-F574 HydrophobicContact CG2-CZ 4.39Å; W569-F574 HydrophobicContact CB-CD2 4.32Å; W569-F574 HydrophobicContact CB-CE2 3.76Å; W569-F574 HydrophobicContact CB-CZ 4.16Å; W569-F574 HydrophobicContact CE3-CD1 4.09Å; W569-F574 AromaticContact CE3-CE1 3.56Å; W569-F574 HydrophobicContact CE3-CE1 3.56Å; W569-F574 HydrophobicContact CE3-CE2 4.25Å; W569-F574 AromaticContact CE3-CZ 3.64Å; W569-F574 HydrophobicContact CE3-CZ 3.64Å; W569-F574 HydrophobicContact CZ3-CD1 4.49Å; W569-F574 AromaticContact CZ3-CE1 3.99Å; W569-F574 HydrophobicContact CZ3-CE1 3.99Å; W569-F574 HydrophobicContact CZ3-CZ 4.45Å; T570-F574 VanDerWaalsContact O-CD2 3.3Å; T570-F574 WeakPolarHBondContact O-CD2 3.46Å; T570-F574 PolarHBondContact O-N 2.98Å; S571-F574 PolarHBondContact O-N 3.41Å; L572-F574 VanDerWaalsContact C-N 3.3Å; L572-F574 PolarHBondContact O-N 3.46Å; F574-V576 VanDerWaalsContact C-N 3.33Å; F574-V576 PolarHBondContact O-N 3.14Å; F574-L577 HydrophobicContact CD1-CD2 4.26Å; F574-L577 WeakPolarHBondContact O-CB 3.37Å; F574-L577 PolarHBondContact O-N 3.05Å; F574-H578 PolarHBondContact O-CD2 2.88Å; F574-H578 PolarHBondContact O-N 3.33Å
575	A	92.2	Very high	88.6	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-41.2	176.4	0	0	0	0	0	111.8	C530 S571 L572 G579 H580 V583 V584 L587	C530-A575 HydrophobicContact CB-CB 4.19Å; S571-A575 PolarHBondContact O-N 3.16Å; S571-A575 VanDerWaalsContact O-N 3.15Å; L572-A575 PolarHBondContact O-N 2.96Å; A575-G579 PolarHBondContact O-N 2.92Å; A575-H580 PolarHBondContact O-N 3.07Å; A575-V583 HydrophobicContact CB-CB 4.24Å; A575-V583 HydrophobicContact CB-CG1 3.68Å; A575-V584 HydrophobicContact CB-CG2 3.59Å; A575-L587 HydrophobicContact CB-CD1 4.03Å
576	V	91.4	Very high	89.7	Confident	2 Å²	2	25 Å²	25	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-69.6	-37	174.7	171.6	0	0	0	0	112.3	L572 T573 F574 H578 G579 V584 P610 L613 A614 L622 L626	L572-V576 WeakPolarHBondContact O-CG2 3.01Å; L572-V576 PolarHBondContact O-N 3.21Å; T573-V576 PolarHBondContact O-N 3.47Å; F574-V576 VanDerWaalsContact C-N 3.33Å; F574-V576 PolarHBondContact O-N 3.14Å; V576-H578 VanDerWaalsContact C-N 3.25Å; V576-H578 PolarHBondContact O-N 3.04Å; V576-G579 PolarHBondContact O-N 2.71Å; V576-V584 HydrophobicContact CB-CG2 4.43Å; V576-V584 HydrophobicContact CG2-CB 4.46Å; V576-V584 HydrophobicContact CG2-CG1 4.02Å; V576-V584 HydrophobicContact CG2-CG2 3.51Å; V576-P610 HydrophobicContact CG1-CB 4.45Å; V576-P610 WeakPolarHBondContact CG1-O 3.4Å; V576-P610 HydrophobicContact CG2-CB 4.19Å; V576-L613 HydrophobicContact CG1-CB 3.98Å; V576-A614 HydrophobicContact CG1-CB 4.04Å; V576-L622 HydrophobicContact CG1-CD1 4.29Å; V576-L626 HydrophobicContact CG2-CD1 4.43Å
577	L	88.1	Confident	90.5	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-54	-42.3	-180	-167.2	79.4	0	0	0	112.1	R222 W569 T573 F574 L613	R222-L577 PolarHBondContact NH1-O 2.67Å; R222-L577 VanDerWaalsContact NH2-CG 3.29Å; R222-L577 PolarHBondContact NH2-O 3.3Å; W569-L577 HydrophobicContact CE3-CD2 4.24Å; W569-L577 HydrophobicContact CH2-CD1 3.44Å; W569-L577 VanDerWaalsContact CH2-CD1 3.44Å; W569-L577 HydrophobicContact CH2-CD2 3.86Å; W569-L577 HydrophobicContact CH2-CG 4.32Å; W569-L577 HydrophobicContact CZ2-CD1 3.98Å; W569-L577 HydrophobicContact CZ3-CD1 3.81Å; W569-L577 HydrophobicContact CZ3-CD2 3.41Å; W569-L577 VanDerWaalsContact CZ3-CD2 3.41Å; W569-L577 HydrophobicContact CZ3-CG 4.25Å; T573-L577 VanDerWaalsContact O-CB 3.23Å; T573-L577 WeakPolarHBondContact O-CB 3.33Å; T573-L577 PolarHBondContact O-N 2.83Å; F574-L577 HydrophobicContact CD1-CD2 4.26Å; F574-L577 WeakPolarHBondContact O-CB 3.37Å; F574-L577 PolarHBondContact O-N 3.05Å; L577-L613 HydrophobicContact CD1-CD1 4.19Å; L577-L613 HydrophobicContact CD1-CD2 4.13Å
578	H	86	Confident	91.2	Very high	51 Å²	51	21.4 Å²	21.4	24%	0.236	12%	0.116	C	C	.	.	H	α-helix	trans	-97.7	-4.8	-178.1	-66.4	-75.7	0	0	0	114.3	F574 V576 H580	F574-H578 PolarHBondContact O-CD2 2.88Å; F574-H578 PolarHBondContact O-N 3.33Å; V576-H578 VanDerWaalsContact C-N 3.25Å; V576-H578 PolarHBondContact O-N 3.04Å; H578-H580 WeakPolarHBondContact CB-NE2 3.39Å
579	G	89.1	Confident	91.8	Very high	26 Å²	26	23.6 Å²	23.6	27%	0.268	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	14.7	173.8	0	0	0	0	0	116	A575 V576 I581	A575-G579 PolarHBondContact O-N 2.92Å; V576-G579 PolarHBondContact O-N 2.71Å; G579-I581 PolarHBondContact O-N 3.35Å
580	H	92.9	Very high	92.1	Very high	51 Å²	51	25.7 Å²	25.7	24%	0.236	15%	0.148	C	C	.	.			trans	-78.7	78.8	-171.1	-62.7	-53	0	0	0	113	C530 A531 G533 A575 H578 S582 V583 V584	C530-H580 PolarHBondContact O-CD2 3.47Å; C530-H580 VanDerWaalsContact O-CD2 3.27Å; A531-H580 PolarHBondContact O-NE2 2.81Å; G533-H580 VanDerWaalsContact CA-CD2 3.47Å; G533-H580 WeakPolarHBondContact CA-CD2 3.44Å; G533-H580 PolarHBondContact N-NE2 3.48Å; A575-H580 PolarHBondContact O-N 3.07Å; H578-H580 WeakPolarHBondContact CB-NE2 3.39Å; H580-S582 PolarHBondContact O-N 3.27Å; H580-V583 HydrophobicContact CB-CB 4.07Å; H580-V583 HydrophobicContact CB-CG2 4.24Å; H580-V583 PolarHBondContact O-N 3.24Å; H580-V583 VanDerWaalsContact O-N 3.12Å; H580-V584 WeakPolarHBondContact O-CG2 3.45Å; H580-V584 PolarHBondContact O-N 2.88Å
581	I	93.5	Very high	92	Very high	53 Å²	53	28.4 Å²	28.4	27%	0.272	18%	0.175	S	C	.	.	H	α-helix	trans	-53	-45.3	-172.7	-64.4	158	0	0	0	113.2	G579 V583 V584 Q585 E621 L622	G579-I581 PolarHBondContact O-N 3.35Å; I581-V583 PolarHBondContact O-N 3.28Å; I581-V584 PolarHBondContact O-N 3.49Å; I581-Q585 PolarHBondContact O-N 3.38Å; I581-E621 HydrophobicContact CD1-CB 3.93Å; I581-E621 WeakPolarHBondContact CD1-OE2 3.21Å; I581-L622 HydrophobicContact CB-CD2 4.29Å; I581-L622 HydrophobicContact CG1-CD2 3.72Å; I581-L622 HydrophobicContact CG1-CG 3.79Å
582	S	94.6	Very high	92	Very high	53 Å²	53	28.7 Å²	28.7	37%	0.371	18%	0.178	S	C	.	.	H	α-helix	trans	-60.4	-45.2	179.1	-38.3	0	0	0	0	112.3	E535 H580 Q585 L586	E535-S582 WeakPolarHBondContact OE1-CB 3.21Å; E535-S582 PolarHBondContact OE1-OG 2.89Å; H580-S582 PolarHBondContact O-N 3.27Å; S582-Q585 PolarHBondContact O-N 3.1Å; S582-L586 WeakPolarHBondContact O-CG 3.37Å; S582-L586 PolarHBondContact O-N 3.48Å
583	V	95	Very high	91.8	Very high	1 Å²	1	32 Å²	32	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-66.1	-41.6	179.2	174.4	0	0	0	0	110.6	C530 E535 V538 A575 H580 I581 Q585 L586 L587	C530-V583 HydrophobicContact CB-CG1 4.28Å; E535-V583 HydrophobicContact CG-CG2 3.95Å; V538-V583 HydrophobicContact CG1-CG1 4.29Å; V538-V583 HydrophobicContact CG2-CG1 3.94Å; V538-V583 HydrophobicContact CG2-CG2 4.45Å; A575-V583 HydrophobicContact CB-CB 4.24Å; A575-V583 HydrophobicContact CB-CG1 3.68Å; H580-V583 HydrophobicContact CB-CB 4.07Å; H580-V583 HydrophobicContact CB-CG2 4.24Å; H580-V583 PolarHBondContact O-N 3.24Å; H580-V583 VanDerWaalsContact O-N 3.12Å; I581-V583 PolarHBondContact O-N 3.28Å; V583-Q585 VanDerWaalsContact C-N 3.3Å; V583-Q585 PolarHBondContact O-N 3.3Å; V583-L586 PolarHBondContact O-N 3.48Å; V583-L587 HydrophobicContact CG1-CD1 4.09Å; V583-L587 HydrophobicContact CG1-CG 4.4Å; V583-L587 WeakPolarHBondContact O-CG 3.36Å; V583-L587 PolarHBondContact O-N 3.32Å
584	V	95.3	Very high	91.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.3	-42.8	173.7	173.8	0	0	0	0	110.8	L572 A575 V576 H580 I581 L588 L622 L625	L572-V584 HydrophobicContact CD1-CG1 3.97Å; A575-V584 HydrophobicContact CB-CG2 3.59Å; V576-V584 HydrophobicContact CB-CG2 4.43Å; V576-V584 HydrophobicContact CG2-CB 4.46Å; V576-V584 HydrophobicContact CG2-CG1 4.02Å; V576-V584 HydrophobicContact CG2-CG2 3.51Å; H580-V584 WeakPolarHBondContact O-CG2 3.45Å; H580-V584 PolarHBondContact O-N 2.88Å; I581-V584 PolarHBondContact O-N 3.49Å; V584-L588 HydrophobicContact CG1-CD1 3.66Å; V584-L588 HydrophobicContact CG1-CG 4.42Å; V584-L588 WeakPolarHBondContact O-CB 3.29Å; V584-L588 WeakPolarHBondContact O-CD1 3.31Å; V584-L588 WeakPolarHBondContact O-CG 3.24Å; V584-L588 PolarHBondContact O-N 3.22Å; V584-L622 HydrophobicContact CB-CD2 3.91Å; V584-L622 HydrophobicContact CG1-CD2 3.89Å; V584-L622 HydrophobicContact CG2-CD2 3.85Å; V584-L625 HydrophobicContact CB-CD2 4.44Å; V584-L625 HydrophobicContact CG1-CD2 3.85Å
585	Q	95.1	Very high	91.3	Very high	90 Å²	90	33.8 Å²	33.8	42%	0.421	20%	0.203	S	C	.	.	H	α-helix	trans	-63.1	-47.7	175	-178.4	175.5	-18.6	0	0	111.9	I581 S582 V583 L587 L588 D589 L625	I581-Q585 PolarHBondContact O-N 3.38Å; S582-Q585 PolarHBondContact O-N 3.1Å; V583-Q585 VanDerWaalsContact C-N 3.3Å; V583-Q585 PolarHBondContact O-N 3.3Å; Q585-L587 PolarHBondContact O-N 3.31Å; Q585-L588 PolarHBondContact O-N 3.33Å; Q585-D589 WeakPolarHBondContact CG-OD2 3.35Å; Q585-D589 PolarHBondContact NE2-OD2 3.47Å; Q585-D589 WeakPolarHBondContact O-CB 3.25Å; Q585-D589 VanDerWaalsContact O-CG 3.23Å; Q585-D589 PolarHBondContact O-N 3.18Å; Q585-L625 HydrophobicContact CB-CD2 4.24Å
586	L	94.8	Very high	90.7	Very high	49 Å²	49	33.8 Å²	33.8	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-57.2	-45.6	178	-72.4	170.4	0	0	0	112.2	E535 S582 V583 D589 A590	E535-L586 HydrophobicContact CB-CD1 4.21Å; E535-L586 HydrophobicContact CG-CD1 4.5Å; S582-L586 WeakPolarHBondContact O-CG 3.37Å; S582-L586 PolarHBondContact O-N 3.48Å; V583-L586 PolarHBondContact O-N 3.48Å; L586-D589 PolarHBondContact O-N 3.42Å; L586-A590 VanDerWaalsContact O-CB 3.29Å; L586-A590 WeakPolarHBondContact O-CB 3.34Å; L586-A590 PolarHBondContact O-N 3.21Å
587	L	94.1	Very high	89.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-43.2	177.6	-69.1	171.7	0	0	0	112.2	V538 I542 L548 L572 A575 V583 Q585 A590 G591 A592	V538-L587 HydrophobicContact CG1-CD2 4.37Å; I542-L587 HydrophobicContact CD1-CD2 4.3Å; L548-L587 HydrophobicContact CD2-CD2 4.03Å; L572-L587 HydrophobicContact CB-CD1 4.34Å; L572-L587 HydrophobicContact CD1-CB 4.12Å; L572-L587 HydrophobicContact CD1-CD1 4.2Å; A575-L587 HydrophobicContact CB-CD1 4.03Å; V583-L587 HydrophobicContact CG1-CD1 4.09Å; V583-L587 HydrophobicContact CG1-CG 4.4Å; V583-L587 WeakPolarHBondContact O-CG 3.36Å; V583-L587 PolarHBondContact O-N 3.32Å; Q585-L587 PolarHBondContact O-N 3.31Å; L587-A590 PolarHBondContact O-N 3.37Å; L587-G591 PolarHBondContact O-N 3.08Å; L587-G591 VanDerWaalsContact O-N 3.17Å; L587-A592 HydrophobicContact CB-CB 4.09Å; L587-A592 WeakPolarHBondContact O-CB 3.45Å; L587-A592 PolarHBondContact O-N 3.23Å
588	L	93.4	Very high	88.4	Confident	14 Å²	14	34.3 Å²	34.3	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-71.8	-28.3	178.9	-67.6	169.4	0	0	0	112.7	L572 V584 Q585 V594 L625 L626 R629	L572-L588 HydrophobicContact CD1-CD1 4.46Å; L572-L588 HydrophobicContact CD1-CD2 4.1Å; L572-L588 HydrophobicContact CD1-CG 3.96Å; L572-L588 HydrophobicContact CD2-CD2 3.89Å; V584-L588 HydrophobicContact CG1-CD1 3.66Å; V584-L588 HydrophobicContact CG1-CG 4.42Å; V584-L588 WeakPolarHBondContact O-CB 3.29Å; V584-L588 WeakPolarHBondContact O-CD1 3.31Å; V584-L588 WeakPolarHBondContact O-CG 3.24Å; V584-L588 PolarHBondContact O-N 3.22Å; Q585-L588 PolarHBondContact O-N 3.33Å; L588-V594 HydrophobicContact CD2-CB 4.41Å; L588-V594 HydrophobicContact CD2-CG1 4.41Å; L588-V594 HydrophobicContact CD2-CG2 4.06Å; L588-L625 HydrophobicContact CD1-CD2 4.32Å; L588-L625 HydrophobicContact CD1-CG 4.19Å; L588-L626 HydrophobicContact CD1-CD2 4.13Å; L588-R629 HydrophobicContact CD1-CG 4.14Å; L588-R629 PolarHBondContact O-NH1 3.24Å
589	D	93.8	Very high	86.9	Confident	90 Å²	90	35.4 Å²	35.4	48%	0.481	22%	0.218	S	C	.	.	H	α-helix	trans	-76.8	-31.2	172.9	-70.8	-12.7	0	0	0	111.4	Q585 L586 G591 R629	Q585-D589 WeakPolarHBondContact CG-OD2 3.35Å; Q585-D589 PolarHBondContact NE2-OD2 3.47Å; Q585-D589 WeakPolarHBondContact O-CB 3.25Å; Q585-D589 VanDerWaalsContact O-CG 3.23Å; Q585-D589 PolarHBondContact O-N 3.18Å; L586-D589 PolarHBondContact O-N 3.42Å; D589-G591 VanDerWaalsContact C-N 3.26Å; D589-G591 PolarHBondContact O-N 2.87Å; D589-R629 IonicContact OD1-CZ 2.89Å; D589-R629 IonicContact OD1-NH1 2.86Å; D589-R629 PolarHBondContact OD1-NH1 3.32Å; D589-R629 IonicContact OD1-NH2 2.87Å; D589-R629 PolarHBondContact OD1-NH2 3.16Å
590	A	91.8	Very high	85	Confident	50 Å²	50	39.2 Å²	39.2	41%	0.413	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-4.8	171.4	0	0	0	0	0	114.1	I542 L548 L586 L587	I542-A590 HydrophobicContact CD1-CB 4.27Å; I542-A590 HydrophobicContact CG2-CB 4.33Å; L548-A590 HydrophobicContact CD1-CB 3.76Å; L586-A590 VanDerWaalsContact O-CB 3.29Å; L586-A590 WeakPolarHBondContact O-CB 3.34Å; L586-A590 PolarHBondContact O-N 3.21Å; L587-A590 PolarHBondContact O-N 3.37Å
591	G	88.8	Confident	82.8	Confident	57 Å²	57	38.2 Å²	38.2	59%	0.588	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.3	15.6	172.4	0	0	0	0	0	116.4	L587 D589	L587-G591 PolarHBondContact O-N 3.08Å; L587-G591 VanDerWaalsContact O-N 3.17Å; D589-G591 VanDerWaalsContact C-N 3.26Å; D589-G591 PolarHBondContact O-N 2.87Å
592	A	90	Very high	80.7	Confident	6 Å²	6	38.4 Å²	38.4	5%	0.05	25%	0.251	C	S	.	.			trans	-58.5	147.2	174.2	0	0	0	0	0	112.2	L548 L587 V594	L548-A592 HydrophobicContact CB-CB 3.94Å; L548-A592 HydrophobicContact CD1-CB 3.86Å; L587-A592 HydrophobicContact CB-CB 4.09Å; L587-A592 WeakPolarHBondContact O-CB 3.45Å; L587-A592 PolarHBondContact O-N 3.23Å; A592-V594 PolarHBondContact O-N 2.97Å
593	H	87.3	Confident	78.3	Confident	70 Å²	70	45.9 Å²	45.9	32%	0.324	28%	0.28	S	S	.	.			trans	-70	124.9	-177.1	-163.3	69.7	0	0	0	112.3	D549 L572 E595 G596 V599	D549-H593 PolarHBondContact OD1-N 2.78Å; L572-H593 WeakPolarHBondContact CD2-O 3.4Å; H593-E595 VanDerWaalsContact C-N 3.31Å; H593-E595 PolarHBondContact O-N 2.67Å; H593-G596 PolarHBondContact CD2-O 3.31Å; H593-G596 WeakPolarHBondContact O-CA 3.42Å; H593-G596 PolarHBondContact O-N 3.5Å; H593-V599 WeakPolarHBondContact NE2-CG2 3.2Å
594	V	86.9	Confident	76.1	Confident	28 Å²	28	53.7 Å²	53.7	17%	0.17	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-34.9	-171.1	-168.1	0	0	0	0	113.2	L588 A592 G596 P610 L626 R629 A631	L588-V594 HydrophobicContact CD2-CB 4.41Å; L588-V594 HydrophobicContact CD2-CG1 4.41Å; L588-V594 HydrophobicContact CD2-CG2 4.06Å; A592-V594 PolarHBondContact O-N 2.97Å; V594-G596 VanDerWaalsContact C-N 3.26Å; V594-G596 PolarHBondContact O-N 3.43Å; V594-P610 WeakPolarHBondContact O-CG 3.4Å; V594-L626 HydrophobicContact CG1-CD2 4.14Å; V594-R629 HydrophobicContact CG1-CB 4.03Å; V594-R629 HydrophobicContact CG2-CB 3.86Å; V594-A631 HydrophobicContact CG1-CB 3.87Å
595	E	82.5	Confident	74.1	Confident	15 Å²	15	54.7 Å²	54.7	7%	0.07	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	0.6	175.5	-55.8	-60	169.5	0	0	113.1	H593 S597 A598 V599 P610 A631 D632 L635	H593-E595 VanDerWaalsContact C-N 3.31Å; H593-E595 PolarHBondContact O-N 2.67Å; E595-S597 PolarHBondContact O-N 2.7Å; E595-A598 PolarHBondContact O-N 3.33Å; E595-V599 HydrophobicContact CB-CG2 3.82Å; E595-V599 HydrophobicContact CG-CG2 4.03Å; E595-P610 VanDerWaalsContact C-CD 3.48Å; E595-P610 VanDerWaalsContact O-CD 3.3Å; E595-P610 WeakPolarHBondContact O-CD 3.27Å; E595-A631 WeakPolarHBondContact OE1-CA 3.34Å; E595-D632 PolarHBondContact OE1-N 3.03Å; E595-L635 HydrophobicContact CB-CD2 4.1Å; E595-L635 HydrophobicContact CG-CD2 3.95Å
596	G	79.8	Confident	72.4	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.01	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	-119.2	-173.6	0	0	0	0	0	111.7	H593 V594	H593-G596 PolarHBondContact CD2-O 3.31Å; H593-G596 WeakPolarHBondContact O-CA 3.42Å; H593-G596 PolarHBondContact O-N 3.5Å; V594-G596 VanDerWaalsContact C-N 3.26Å; V594-G596 PolarHBondContact O-N 3.43Å
597	S	72.4	Confident	71.1	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.021	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-17.4	-176.1	-179.3	0	0	0	0	115.2	Q551 H568 E595 V599 N600	Q551-S597 PolarHBondContact NE2-OG 3.34Å; Q551-S597 VanDerWaalsContact NE2-OG 3.08Å; Q551-S597 PolarHBondContact OE1-OG 3.46Å; H568-S597 WeakPolarHBondContact O-CB 3.33Å; H568-S597 PolarHBondContact O-OG 3.38Å; H568-S597 VanDerWaalsContact O-OG 3.1Å; E595-S597 PolarHBondContact O-N 2.7Å; S597-V599 PolarHBondContact O-N 2.83Å; S597-V599 VanDerWaalsContact O-N 3.07Å; S597-N600 PolarHBondContact O-N 3.49Å
598	A	60.4	Low	70.2	Confident	13 Å²	13	53.5 Å²	53.5	11%	0.107	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-58.4	-31.1	-166.5	0	0	0	0	0	113.3	E595 N600 T609 L635	E595-A598 PolarHBondContact O-N 3.33Å; A598-N600 VanDerWaalsContact C-N 3.31Å; A598-N600 PolarHBondContact O-N 2.78Å; A598-T609 HydrophobicContact CB-CG2 3.69Å; A598-L635 HydrophobicContact CB-CD2 3.78Å
599	V	53.3	Low	69.8	Low	73 Å²	73	53.2 Å²	53.2	44%	0.442	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-78.2	-11	-178.8	177.3	0	0	0	0	113.8	H593 E595 S597 L635	H593-V599 WeakPolarHBondContact NE2-CG2 3.2Å; E595-V599 HydrophobicContact CB-CG2 3.82Å; E595-V599 HydrophobicContact CG-CG2 4.03Å; S597-V599 PolarHBondContact O-N 2.83Å; S597-V599 VanDerWaalsContact O-N 3.07Å; V599-L635 HydrophobicContact CG2-CD2 4.32Å
600	N	49.5	Very low	69.6	Low	106 Å²	106	48.9 Å²	48.9	57%	0.567	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-118	7.5	-172.3	-67.8	-52.7	0	0	0	113.7	S597 A598	S597-N600 PolarHBondContact O-N 3.49Å; A598-N600 VanDerWaalsContact C-N 3.31Å; A598-N600 PolarHBondContact O-N 2.78Å
601	G	47.2	Very low	69.6	Low	30 Å²	30	46.6 Å²	46.6	31%	0.309	28%	0.278	S	S	.	.			trans	-75.8	135.9	179.2	0	0	0	0	0	112.9
602	G	48.2	Very low	69.6	Low	57 Å²	57	44.2 Å²	44.2	59%	0.588	25%	0.252	S	S	*	.			trans	-75.3	173	160.7	0	0	0	0	0	111.5	D604 S605	G602-D604 PolarHBondContact O-N 3.11Å; G602-S605 VanDerWaalsContact O-CB 3.23Å; G602-S605 WeakPolarHBondContact O-CB 3.42Å; G602-S605 PolarHBondContact O-N 3.45Å
603	E	45.4	Very low	69.5	Low	210 Å²	210	44 Å²	44	98%	0.981	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-10.1	-172.2	-60.9	176.9	148.4	0	0	116.6
604	D	48	Very low	69.7	Low	165 Å²	165	40.8 Å²	40.8	88%	0.882	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	6.7	177.2	-79.7	-39.8	0	0	0	114.2	G602	G602-D604 PolarHBondContact O-N 3.11Å
605	S	53.5	Low	69.9	Low	21 Å²	21	39.4 Å²	39.4	15%	0.147	23%	0.227	C	C	.	.			trans	-110.5	77.7	-163.9	-176.1	0	0	0	0	115.2	H568 G602 A607	H568-S605 PolarHBondContact CD2-OG 3.07Å; G602-S605 VanDerWaalsContact O-CB 3.23Å; G602-S605 WeakPolarHBondContact O-CB 3.42Å; G602-S605 PolarHBondContact O-N 3.45Å; S605-A607 PolarHBondContact O-N 2.99Å
606	Y	58.5	Low	70.2	Confident	74 Å²	74	38.9 Å²	38.9	29%	0.29	23%	0.225	S	C	.	.			trans	-75.1	112.7	168.1	-167.1	-98.8	0	0	0	111.2	E608 H648 E649	Y606-E608 HydrophobicContact CE1-CG 4.41Å; Y606-H648 HydrophobicContact CD1-CB 3.74Å; Y606-H648 HydrophobicContact CE1-CB 3.93Å; Y606-H648 HydrophobicContact CG-CB 4.24Å; Y606-E649 PolarHBondContact OH-O 3.46Å
607	A	67.4	Low	70.6	Confident	15 Å²	15	39.8 Å²	39.8	12%	0.124	23%	0.233	C	C	.	.			trans	-130.5	124	176.7	0	0	0	0	0	110.5	H568 S605 T609	H568-A607 HydrophobicContact CB-CB 4.05Å; S605-A607 PolarHBondContact O-N 2.99Å; A607-T609 PolarHBondContact O-N 3.41Å
608	E	75.8	Confident	71.4	Confident	26 Å²	26	40.6 Å²	40.6	12%	0.121	24%	0.241	C	C	.	.			trans	-64.4	123.6	176.7	-67	177.1	144.1	0	0	110.4	K152 Y606 L613	K152-E608 IonicContact NZ-OE1 3.64Å; K152-E608 PolarHBondContact NZ-OE1 3.24Å; K152-E608 IonicContact NZ-OE2 2.66Å; K152-E608 PolarHBondContact NZ-OE2 3.07Å; Y606-E608 HydrophobicContact CE1-CG 4.41Å; E608-L613 HydrophobicContact CB-CD2 4.03Å; E608-L613 HydrophobicContact CB-CG 4.13Å; E608-L613 WeakPolarHBondContact OE2-CD2 3.41Å
609	T	86	Confident	72.9	Confident	7 Å²	7	41.9 Å²	41.9	4%	0.043	25%	0.246	C	C	.	.			trans	-63.4	151.8	176.7	58	0	0	0	0	111.2	A598 A607 L611 Q612 L613 L635	A598-T609 HydrophobicContact CB-CG2 3.69Å; A607-T609 PolarHBondContact O-N 3.41Å; T609-L611 PolarHBondContact O-N 3.26Å; T609-L611 VanDerWaalsContact O-N 3.15Å; T609-Q612 PolarHBondContact O-N 3.43Å; T609-Q612 VanDerWaalsContact O-N 3.07Å; T609-Q612 WeakPolarHBondContact OG1-CB 3.18Å; T609-Q612 VanDerWaalsContact OG1-CG 3.27Å; T609-Q612 WeakPolarHBondContact OG1-CG 3.4Å; T609-Q612 PolarHBondContact OG1-N 3.24Å; T609-Q612 PolarHBondContact OG1-OE1 2.95Å; T609-L613 PolarHBondContact O-N 3.07Å; T609-L635 HydrophobicContact CG2-CD2 3.94Å
610	P	89.7	Confident	74.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-50	-37.7	168.6	-28.6	36.5	0	0	0	112.9	L572 T573 V576 V594 E595 L613 A614 L626	L572-P610 HydrophobicContact CD2-CG 4.07Å; L572-P610 HydrophobicContact CG-CG 4.39Å; T573-P610 HydrophobicContact CG2-CG 3.78Å; V576-P610 HydrophobicContact CG1-CB 4.45Å; V576-P610 WeakPolarHBondContact CG1-O 3.4Å; V576-P610 HydrophobicContact CG2-CB 4.19Å; V594-P610 WeakPolarHBondContact O-CG 3.4Å; E595-P610 VanDerWaalsContact C-CD 3.48Å; E595-P610 VanDerWaalsContact O-CD 3.3Å; E595-P610 WeakPolarHBondContact O-CD 3.27Å; P610-L613 PolarHBondContact O-N 3.15Å; P610-A614 WeakPolarHBondContact O-CB 3.42Å; P610-A614 PolarHBondContact O-N 2.83Å; P610-L626 HydrophobicContact CB-CD1 3.94Å; P610-L626 HydrophobicContact CB-CD2 4.07Å
611	L	90.6	Very high	76.8	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-69.4	-38.8	178.9	-173.9	63	0	0	0	112.8	T609 S615 V623 L626 L627 A631 P633 L669	T609-L611 PolarHBondContact O-N 3.26Å; T609-L611 VanDerWaalsContact O-N 3.15Å; L611-S615 WeakPolarHBondContact O-CB 3.39Å; L611-S615 PolarHBondContact O-N 2.9Å; L611-S615 PolarHBondContact O-OG 3.02Å; L611-V623 HydrophobicContact CD1-CG1 4.17Å; L611-V623 HydrophobicContact CD1-CG2 4.45Å; L611-L626 HydrophobicContact CD1-CB 4.3Å; L611-L627 HydrophobicContact CD1-CD2 4.12Å; L611-L627 HydrophobicContact CD1-CG 4.09Å; L611-L627 HydrophobicContact CD2-CD2 3.86Å; L611-A631 HydrophobicContact CB-CB 4.31Å; L611-A631 HydrophobicContact CD2-CB 3.97Å; L611-P633 HydrophobicContact CD2-CG 4.27Å; L611-L669 HydrophobicContact CD1-CD2 4.15Å; L611-L669 HydrophobicContact CD2-CD2 4.33Å; L611-L669 HydrophobicContact CG-CD2 4.39Å
612	Q	88.8	Confident	79	Confident	7 Å²	7	43.3 Å²	43.3	3%	0.033	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-47.6	171.8	-78.1	160.8	-59.5	0	0	111	T609 A614 S615 A616 S636 M651 C653	T609-Q612 PolarHBondContact O-N 3.43Å; T609-Q612 VanDerWaalsContact O-N 3.07Å; T609-Q612 WeakPolarHBondContact OG1-CB 3.18Å; T609-Q612 VanDerWaalsContact OG1-CG 3.27Å; T609-Q612 WeakPolarHBondContact OG1-CG 3.4Å; T609-Q612 PolarHBondContact OG1-N 3.24Å; T609-Q612 PolarHBondContact OG1-OE1 2.95Å; Q612-A614 PolarHBondContact O-N 3.23Å; Q612-S615 PolarHBondContact O-N 3.12Å; Q612-S615 VanDerWaalsContact O-N 3.14Å; Q612-A616 WeakPolarHBondContact O-CB 3.48Å; Q612-A616 PolarHBondContact O-N 3.44Å; Q612-S636 PolarHBondContact NE2-OG 2.9Å; Q612-M651 PolarHBondContact NE2-O 3.06Å; Q612-C653 HydrophobicContact CG-CB 4.38Å
613	L	88.7	Confident	81.2	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-59.2	-45.5	178.9	-68.6	176	0	0	0	112.5	T573 V576 L577 E608 T609 P610 S615 A617	T573-L613 HydrophobicContact CG2-CD1 4.35Å; V576-L613 HydrophobicContact CG1-CB 3.98Å; L577-L613 HydrophobicContact CD1-CD1 4.19Å; L577-L613 HydrophobicContact CD1-CD2 4.13Å; E608-L613 HydrophobicContact CB-CD2 4.03Å; E608-L613 HydrophobicContact CB-CG 4.13Å; E608-L613 WeakPolarHBondContact OE2-CD2 3.41Å; T609-L613 PolarHBondContact O-N 3.07Å; P610-L613 PolarHBondContact O-N 3.15Å; L613-S615 VanDerWaalsContact C-N 3.35Å; L613-A617 VanDerWaalsContact O-CB 3.29Å; L613-A617 WeakPolarHBondContact O-CB 3.37Å; L613-A617 PolarHBondContact O-N 2.7Å; L613-A617 VanDerWaalsContact O-N 3.07Å
614	A	91.4	Very high	83.5	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.008	17%	0.167	C	C	.	.	H	α-helix	trans	-67	-35.3	176.1	0	0	0	0	0	112.4	V576 P610 Q612 G618 N619 L622 V623 L626	V576-A614 HydrophobicContact CG1-CB 4.04Å; P610-A614 WeakPolarHBondContact O-CB 3.42Å; P610-A614 PolarHBondContact O-N 2.83Å; Q612-A614 PolarHBondContact O-N 3.23Å; A614-G618 PolarHBondContact O-N 3.03Å; A614-G618 VanDerWaalsContact O-N 3.13Å; A614-N619 PolarHBondContact O-N 2.97Å; A614-L622 HydrophobicContact CB-CB 3.91Å; A614-V623 HydrophobicContact CB-CG2 3.75Å; A614-L626 HydrophobicContact CB-CD1 4.03Å
615	S	91.3	Very high	85.6	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-71.7	-39	179.4	-60.8	0	0	0	0	112.9	L611 Q612 L613 G618 H662	L611-S615 WeakPolarHBondContact O-CB 3.39Å; L611-S615 PolarHBondContact O-N 2.9Å; L611-S615 PolarHBondContact O-OG 3.02Å; Q612-S615 PolarHBondContact O-N 3.12Å; Q612-S615 VanDerWaalsContact O-N 3.14Å; L613-S615 VanDerWaalsContact C-N 3.35Å; S615-G618 PolarHBondContact O-N 3.46Å; S615-H662 PolarHBondContact O-CD2 3.43Å
616	A	89.1	Confident	87.5	Confident	3 Å²	3	24.2 Å²	24.2	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-68.9	-35.5	173.8	0	0	0	0	0	112.2	R222 Q612 G618 H656 H660 H662	R222-A616 HydrophobicContact CG-CB 3.77Å; Q612-A616 WeakPolarHBondContact O-CB 3.48Å; Q612-A616 PolarHBondContact O-N 3.44Å; A616-G618 VanDerWaalsContact C-N 3.29Å; A616-G618 PolarHBondContact O-N 3.38Å; A616-H656 HydrophobicContact CB-CB 3.92Å; A616-H660 PolarHBondContact O-CD2 3.03Å; A616-H662 PolarHBondContact O-CD2 3.42Å
617	A	87.7	Confident	89.1	Confident	21 Å²	21	21.1 Å²	21.1	17%	0.174	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-11.7	176.1	0	0	0	0	0	114.3	V221 R222 L613 N619	V221-A617 HydrophobicContact CG1-CB 3.47Å; V221-A617 VanDerWaalsContact CG1-CB 3.47Å; R222-A617 HydrophobicContact CG-CB 4.36Å; L613-A617 VanDerWaalsContact O-CB 3.29Å; L613-A617 WeakPolarHBondContact O-CB 3.37Å; L613-A617 PolarHBondContact O-N 2.7Å; L613-A617 VanDerWaalsContact O-N 3.07Å; A617-N619 PolarHBondContact O-N 3.39Å
618	G	88.8	Confident	90.2	Very high	20 Å²	20	24.4 Å²	24.4	21%	0.206	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	10	-179.2	0	0	0	0	0	115.3	A614 S615 A616 Y620 H662	A614-G618 PolarHBondContact O-N 3.03Å; A614-G618 VanDerWaalsContact O-N 3.13Å; S615-G618 PolarHBondContact O-N 3.46Å; A616-G618 VanDerWaalsContact C-N 3.29Å; A616-G618 PolarHBondContact O-N 3.38Å; G618-Y620 PolarHBondContact O-N 2.79Å; G618-H662 WeakPolarHBondContact CA-CD2 3.49Å; G618-H662 VanDerWaalsContact CA-CG 3.41Å; G618-H662 PolarHBondContact N-CD2 3.47Å; G618-H662 VanDerWaalsContact N-CD2 3.28Å
619	N	91.1	Very high	90.9	Very high	39 Å²	39	27.3 Å²	27.3	21%	0.209	15%	0.145	C	C	.	.			trans	-75.8	92.7	-176.9	-171.3	-31.2	0	0	0	110.6	A614 A617 E621 L622 V623	A614-N619 PolarHBondContact O-N 2.97Å; A617-N619 PolarHBondContact O-N 3.39Å; N619-E621 PolarHBondContact O-N 3.2Å; N619-E621 PolarHBondContact OD1-N 3.21Å; N619-E621 VanDerWaalsContact OD1-N 3.17Å; N619-L622 HydrophobicContact CB-CB 4.13Å; N619-L622 HydrophobicContact CB-CD1 4.22Å; N619-L622 HydrophobicContact CB-CG 4.36Å; N619-L622 WeakPolarHBondContact ND2-CD1 3.1Å; N619-L622 PolarHBondContact O-N 3.36Å; N619-L622 PolarHBondContact OD1-N 3.27Å; N619-V623 WeakPolarHBondContact O-CG2 3.47Å; N619-V623 PolarHBondContact O-N 2.97Å
620	Y	92.2	Very high	90.9	Very high	112 Å²	112	29.5 Å²	29.5	44%	0.439	17%	0.168	S	C	.	.	H	α-helix	trans	-57.2	-33.6	-179.1	179.9	-87.7	0	0	0	113.5	G618 S624 N664 K668	G618-Y620 PolarHBondContact O-N 2.79Å; Y620-S624 WeakPolarHBondContact CE1-OG 3.46Å; Y620-S624 VanDerWaalsContact O-CB 3.26Å; Y620-S624 WeakPolarHBondContact O-CB 3.12Å; Y620-S624 PolarHBondContact O-N 3.22Å; Y620-S624 PolarHBondContact O-OG 3.38Å; Y620-N664 HydrophobicContact CD2-CB 4.3Å; Y620-K668 HydrophobicContact CD2-CB 4.33Å; Y620-K668 HydrophobicContact CE2-CB 3.82Å; Y620-K668 HydrophobicContact CE2-CD 4.38Å; Y620-K668 HydrophobicContact CE2-CG 4.15Å
621	E	93.3	Very high	90.7	Very high	127 Å²	127	29.8 Å²	29.8	59%	0.593	17%	0.171	S	C	*	.	H	α-helix	trans	-74.3	-46.4	-178.3	-62.9	-173	178.9	0	0	110.7	I581 N619 V623 S624 L625	I581-E621 HydrophobicContact CD1-CB 3.93Å; I581-E621 WeakPolarHBondContact CD1-OE2 3.21Å; N619-E621 PolarHBondContact O-N 3.2Å; N619-E621 PolarHBondContact OD1-N 3.21Å; N619-E621 VanDerWaalsContact OD1-N 3.17Å; E621-V623 PolarHBondContact O-N 3.23Å; E621-S624 PolarHBondContact O-N 3.08Å; E621-L625 WeakPolarHBondContact O-CB 3.48Å; E621-L625 PolarHBondContact O-N 2.92Å
622	L	93.2	Very high	90.3	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-60.5	-44.5	172	-75.7	-178.1	0	0	0	112.5	V576 I581 V584 A614 N619 S624 L625 L626	V576-L622 HydrophobicContact CG1-CD1 4.29Å; I581-L622 HydrophobicContact CB-CD2 4.29Å; I581-L622 HydrophobicContact CG1-CD2 3.72Å; I581-L622 HydrophobicContact CG1-CG 3.79Å; V584-L622 HydrophobicContact CB-CD2 3.91Å; V584-L622 HydrophobicContact CG1-CD2 3.89Å; V584-L622 HydrophobicContact CG2-CD2 3.85Å; A614-L622 HydrophobicContact CB-CB 3.91Å; N619-L622 HydrophobicContact CB-CB 4.13Å; N619-L622 HydrophobicContact CB-CD1 4.22Å; N619-L622 HydrophobicContact CB-CG 4.36Å; N619-L622 WeakPolarHBondContact ND2-CD1 3.1Å; N619-L622 PolarHBondContact O-N 3.36Å; N619-L622 PolarHBondContact OD1-N 3.27Å; L622-S624 VanDerWaalsContact C-N 3.29Å; L622-S624 PolarHBondContact O-N 3.18Å; L622-L625 PolarHBondContact O-N 3Å; L622-L626 WeakPolarHBondContact O-CB 3.37Å; L622-L626 WeakPolarHBondContact O-CG 3.31Å; L622-L626 PolarHBondContact O-N 3.02Å
623	V	94.1	Very high	90	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-42.3	175	170.3	0	0	0	0	110.5	L611 A614 N619 E621 L627 V665 K668 L669	L611-V623 HydrophobicContact CD1-CG1 4.17Å; L611-V623 HydrophobicContact CD1-CG2 4.45Å; A614-V623 HydrophobicContact CB-CG2 3.75Å; N619-V623 WeakPolarHBondContact O-CG2 3.47Å; N619-V623 PolarHBondContact O-N 2.97Å; E621-V623 PolarHBondContact O-N 3.23Å; V623-L627 HydrophobicContact CG1-CD1 3.72Å; V623-L627 HydrophobicContact CG1-CG 4.3Å; V623-L627 WeakPolarHBondContact O-CB 3.43Å; V623-L627 WeakPolarHBondContact O-CD1 3.22Å; V623-L627 WeakPolarHBondContact O-CG 3.45Å; V623-L627 PolarHBondContact O-N 3.42Å; V623-V665 HydrophobicContact CG1-CG1 4.3Å; V623-V665 HydrophobicContact CG2-CG1 3.96Å; V623-V665 HydrophobicContact CG2-CG2 4.44Å; V623-K668 HydrophobicContact CG1-CG 4.23Å; V623-L669 HydrophobicContact CG1-CD2 4.06Å; V623-L669 HydrophobicContact CG1-CG 4.37Å
624	S	93.8	Very high	89.5	Confident	27 Å²	27	33.8 Å²	33.8	19%	0.189	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-38.9	177.3	-63.6	0	0	0	0	112.8	Y620 E621 L622 S628 K668	Y620-S624 WeakPolarHBondContact CE1-OG 3.46Å; Y620-S624 VanDerWaalsContact O-CB 3.26Å; Y620-S624 WeakPolarHBondContact O-CB 3.12Å; Y620-S624 PolarHBondContact O-N 3.22Å; Y620-S624 PolarHBondContact O-OG 3.38Å; E621-S624 PolarHBondContact O-N 3.08Å; L622-S624 VanDerWaalsContact C-N 3.29Å; L622-S624 PolarHBondContact O-N 3.18Å; S624-S628 WeakPolarHBondContact O-CB 3.41Å; S624-S628 PolarHBondContact O-N 3.26Å; S624-K668 WeakPolarHBondContact OG-CE 3.38Å
625	L	93.4	Very high	88.4	Confident	24 Å²	24	35.7 Å²	35.7	13%	0.126	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-54.2	177.3	178.8	60.8	0	0	0	111.3	V584 Q585 L588 E621 L622 L627 S628 R629	V584-L625 HydrophobicContact CB-CD2 4.44Å; V584-L625 HydrophobicContact CG1-CD2 3.85Å; Q585-L625 HydrophobicContact CB-CD2 4.24Å; L588-L625 HydrophobicContact CD1-CD2 4.32Å; L588-L625 HydrophobicContact CD1-CG 4.19Å; E621-L625 WeakPolarHBondContact O-CB 3.48Å; E621-L625 PolarHBondContact O-N 2.92Å; L622-L625 PolarHBondContact O-N 3Å; L625-L627 VanDerWaalsContact C-N 3.35Å; L625-L627 PolarHBondContact O-N 2.88Å; L625-S628 WeakPolarHBondContact O-CA 3.42Å; L625-S628 WeakPolarHBondContact O-CB 3.43Å; L625-S628 PolarHBondContact O-N 3.27Å; L625-S628 PolarHBondContact O-OG 2.95Å; L625-R629 PolarHBondContact O-N 3.06Å; L625-R629 VanDerWaalsContact O-N 3.14Å
626	L	92.8	Very high	86.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.5	-45.6	179.6	-69.5	169.2	0	0	0	111.6	V576 L588 V594 P610 L611 A614 L622 S628 R629 G630 A631	V576-L626 HydrophobicContact CG2-CD1 4.43Å; L588-L626 HydrophobicContact CD1-CD2 4.13Å; V594-L626 HydrophobicContact CG1-CD2 4.14Å; P610-L626 HydrophobicContact CB-CD1 3.94Å; P610-L626 HydrophobicContact CB-CD2 4.07Å; L611-L626 HydrophobicContact CD1-CB 4.3Å; A614-L626 HydrophobicContact CB-CD1 4.03Å; L622-L626 WeakPolarHBondContact O-CB 3.37Å; L622-L626 WeakPolarHBondContact O-CG 3.31Å; L622-L626 PolarHBondContact O-N 3.02Å; L626-S628 VanDerWaalsContact C-N 3.29Å; L626-S628 PolarHBondContact O-N 2.68Å; L626-R629 PolarHBondContact O-N 2.98Å; L626-R629 VanDerWaalsContact O-N 3.1Å; L626-G630 PolarHBondContact O-N 3.08Å; L626-A631 HydrophobicContact CB-CB 4.1Å; L626-A631 WeakPolarHBondContact O-CB 3.35Å; L626-A631 PolarHBondContact O-N 2.89Å; L626-A631 VanDerWaalsContact O-N 3.14Å
627	L	91.3	Very high	85.1	Confident	10 Å²	10	39.3 Å²	39.3	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-33.4	174.6	-72	177.4	0	0	0	113.1	L611 V623 L625 R629 G630 P633 K668 L669 Q672	L611-L627 HydrophobicContact CD1-CD2 4.12Å; L611-L627 HydrophobicContact CD1-CG 4.09Å; L611-L627 HydrophobicContact CD2-CD2 3.86Å; V623-L627 HydrophobicContact CG1-CD1 3.72Å; V623-L627 HydrophobicContact CG1-CG 4.3Å; V623-L627 WeakPolarHBondContact O-CB 3.43Å; V623-L627 WeakPolarHBondContact O-CD1 3.22Å; V623-L627 WeakPolarHBondContact O-CG 3.45Å; V623-L627 PolarHBondContact O-N 3.42Å; L625-L627 VanDerWaalsContact C-N 3.35Å; L625-L627 PolarHBondContact O-N 2.88Å; L627-R629 VanDerWaalsContact C-N 3.27Å; L627-R629 PolarHBondContact O-N 2.68Å; L627-G630 PolarHBondContact O-N 3.36Å; L627-P633 HydrophobicContact CD2-CG 4.05Å; L627-K668 HydrophobicContact CD1-CG 4.02Å; L627-L669 HydrophobicContact CD1-CD2 4.25Å; L627-Q672 HydrophobicContact CD1-CG 4.14Å; L627-Q672 HydrophobicContact CD2-CG 3.85Å; L627-Q672 HydrophobicContact CG-CG 4.5Å
628	S	91	Very high	83.1	Confident	84 Å²	84	44.7 Å²	44.7	59%	0.587	25%	0.249	S	C	*	.	H	α-helix	trans	-70.2	-23.5	175.5	78.2	0	0	0	0	113.4	S624 L625 L626	S624-S628 WeakPolarHBondContact O-CB 3.41Å; S624-S628 PolarHBondContact O-N 3.26Å; L625-S628 WeakPolarHBondContact O-CA 3.42Å; L625-S628 WeakPolarHBondContact O-CB 3.43Å; L625-S628 PolarHBondContact O-N 3.27Å; L625-S628 PolarHBondContact O-OG 2.95Å; L626-S628 VanDerWaalsContact C-N 3.29Å; L626-S628 PolarHBondContact O-N 2.68Å
629	R	89.9	Confident	80.9	Confident	87 Å²	87	49.6 Å²	49.6	33%	0.328	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	1.3	173.6	-55.9	-54.2	176.5	99.2	-2	113.3	L588 D589 V594 L625 L626 L627	L588-R629 HydrophobicContact CD1-CG 4.14Å; L588-R629 PolarHBondContact O-NH1 3.24Å; D589-R629 IonicContact OD1-CZ 2.89Å; D589-R629 IonicContact OD1-NH1 2.86Å; D589-R629 PolarHBondContact OD1-NH1 3.32Å; D589-R629 IonicContact OD1-NH2 2.87Å; D589-R629 PolarHBondContact OD1-NH2 3.16Å; V594-R629 HydrophobicContact CG1-CB 4.03Å; V594-R629 HydrophobicContact CG2-CB 3.86Å; L625-R629 PolarHBondContact O-N 3.06Å; L625-R629 VanDerWaalsContact O-N 3.14Å; L626-R629 PolarHBondContact O-N 2.98Å; L626-R629 VanDerWaalsContact O-N 3.1Å; L627-R629 VanDerWaalsContact C-N 3.27Å; L627-R629 PolarHBondContact O-N 2.68Å
630	G	85.8	Confident	78.6	Confident	52 Å²	52	50.8 Å²	50.8	54%	0.536	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.4	17.4	172.2	0	0	0	0	0	116.1	L626 L627	L626-G630 PolarHBondContact O-N 3.08Å; L627-G630 PolarHBondContact O-N 3.36Å
631	A	86.2	Confident	76	Confident	7 Å²	7	52.2 Å²	52.2	6%	0.058	29%	0.292	C	S	.	.			trans	-58.6	137.3	176.6	0	0	0	0	0	112.8	V594 E595 L611 L626 P633	V594-A631 HydrophobicContact CG1-CB 3.87Å; E595-A631 WeakPolarHBondContact OE1-CA 3.34Å; L611-A631 HydrophobicContact CB-CB 4.31Å; L611-A631 HydrophobicContact CD2-CB 3.97Å; L626-A631 HydrophobicContact CB-CB 4.1Å; L626-A631 WeakPolarHBondContact O-CB 3.35Å; L626-A631 PolarHBondContact O-N 2.89Å; L626-A631 VanDerWaalsContact O-N 3.14Å; A631-P633 WeakPolarHBondContact O-CD 3.28Å
632	D	82.8	Confident	73.2	Confident	35 Å²	35	48.8 Å²	48.8	19%	0.187	29%	0.291	C	S	.	.			trans	-95.1	114.1	-177.5	-168.4	-20.4	0	0	0	112.3	E595 L634 L635	E595-D632 PolarHBondContact OE1-N 3.03Å; D632-L634 PolarHBondContact O-N 2.96Å; D632-L634 VanDerWaalsContact O-N 3.08Å; D632-L634 PolarHBondContact OD1-N 3.39Å; D632-L635 HydrophobicContact CB-CB 4.36Å; D632-L635 HydrophobicContact CB-CD1 4.43Å; D632-L635 PolarHBondContact O-N 2.87Å
633	P	83	Confident	70.7	Confident	20 Å²	20	58.4 Å²	58.4	13%	0.13	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.9	175.4	-27.3	37.2	0	0	0	116	L611 L627 A631 C653 F654 Q672	L611-P633 HydrophobicContact CD2-CG 4.27Å; L627-P633 HydrophobicContact CD2-CG 4.05Å; A631-P633 WeakPolarHBondContact O-CD 3.28Å; P633-C653 VanDerWaalsContact CA-SG 3.56Å; P633-C653 VanDerWaalsContact CB-SG 3.53Å; P633-C653 PolarHBondContact O-SG 3.3Å; P633-F654 HydrophobicContact CB-CE2 3.79Å; P633-F654 HydrophobicContact CB-CZ 3.79Å; P633-Q672 HydrophobicContact CG-CB 4.46Å; P633-Q672 HydrophobicContact CG-CG 4.34Å
634	L	76.4	Confident	67.9	Low	40 Å²	40	61.5 Å²	61.5	21%	0.209	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	0.2	-171.5	-66.1	174.9	0	0	0	114.4	D632 S636 M637 F654 A716	D632-L634 PolarHBondContact O-N 2.96Å; D632-L634 VanDerWaalsContact O-N 3.08Å; D632-L634 PolarHBondContact OD1-N 3.39Å; L634-S636 PolarHBondContact O-N 3.09Å; L634-S636 VanDerWaalsContact O-N 3.11Å; L634-M637 PolarHBondContact O-N 3.45Å; L634-F654 HydrophobicContact CD2-CD2 4.49Å; L634-F654 HydrophobicContact CD2-CE2 3.85Å; L634-F654 HydrophobicContact CG-CE2 4.46Å; L634-A716 HydrophobicContact CD2-CB 4.09Å
635	L	69.5	Low	65.1	Low	40 Å²	40	64.2 Å²	64.2	21%	0.209	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-49.1	-44.5	-173.3	-161.4	81.6	0	0	0	113	E595 A598 V599 T609 D632 M637 L638	E595-L635 HydrophobicContact CB-CD2 4.1Å; E595-L635 HydrophobicContact CG-CD2 3.95Å; A598-L635 HydrophobicContact CB-CD2 3.78Å; V599-L635 HydrophobicContact CG2-CD2 4.32Å; T609-L635 HydrophobicContact CG2-CD2 3.94Å; D632-L635 HydrophobicContact CB-CB 4.36Å; D632-L635 HydrophobicContact CB-CD1 4.43Å; D632-L635 PolarHBondContact O-N 2.87Å; L635-M637 PolarHBondContact O-N 2.92Å; L635-L638 PolarHBondContact O-N 2.9Å
636	S	60.6	Low	62.7	Low	35 Å²	35	66.4 Å²	66.4	25%	0.245	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-59.2	-13.8	-177.4	-170.1	0	0	0	0	115.7	Q612 L634	Q612-S636 PolarHBondContact NE2-OG 2.9Å; L634-S636 PolarHBondContact O-N 3.09Å; L634-S636 VanDerWaalsContact O-N 3.11Å
637	M	50.4	Low	60.2	Low	45 Å²	45	70.1 Å²	70.1	22%	0.222	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-90	-22.5	-179	-168.4	174.1	-70.8	0	0	113.5	L634 L635 T712 K715 A716	L634-M637 PolarHBondContact O-N 3.45Å; L635-M637 PolarHBondContact O-N 2.92Å; M637-T712 HydrophobicContact CG-CG2 4.44Å; M637-T712 HydrophobicContact SD-CG2 3.4Å; M637-T712 WeakPolarHBondContact SD-CG2 3.31Å; M637-K715 HydrophobicContact CE-CB 4.27Å; M637-A716 HydrophobicContact CE-CB 3.91Å
638	L	44.8	Very low	58.2	Low	134 Å²	134	74.2 Å²	74.2	70%	0.702	45%	0.445	S	S	*	.	S	Bend	trans	-77.2	-24.6	-171.6	-105.6	73.8	0	0	0	114.2	L635	L635-L638 PolarHBondContact O-N 2.9Å
639	E	43.3	Very low	56.5	Low	123 Å²	123	71 Å²	71	58%	0.575	42%	0.42	S	S	*	.	S	Bend	trans	-101.3	-9.1	-170.8	-62.5	178.8	165	0	0	113.3	H641	E639-H641 PolarHBondContact O-N 3.16Å
640	A	42.2	Very low	55.3	Low	63 Å²	63	72 Å²	72	52%	0.521	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	26	-172	0	0	0	0	0	115.7
641	H	38.2	Very low	54.8	Low	142 Å²	142	69.7 Å²	69.7	66%	0.657	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	1.7	178.1	-72.3	71.3	0	0	0	113.7	E639	E639-H641 PolarHBondContact O-N 3.16Å
642	G	34.6	Very low	54.7	Low	56 Å²	56	69.8 Å²	69.8	58%	0.577	41%	0.407	S	S	*	.	S	Bend	trans	-79.6	149.7	163.5	0	0	0	0	0	111.5	G644	G642-G644 PolarHBondContact O-N 3.32Å
643	M	40	Very low	54.9	Low	203 Å²	203	68.2 Å²	68.2	100%	1	40%	0.399	S	S	*	.			trans	-71.5	67.1	175.4	-170.1	76.6	-178	0	0	111.1
644	G	35.4	Very low	55.2	Low	64 Å²	64	67.4 Å²	67.4	66%	0.66	39%	0.393	S	S	*	.			trans	-68.8	156.4	-176.3	0	0	0	0	0	113.6	G642 S646	G642-G644 PolarHBondContact O-N 3.32Å; G644-S646 PolarHBondContact O-N 2.98Å
645	S	36	Very low	55.9	Low	84 Å²	84	65.5 Å²	65.5	59%	0.587	38%	0.383	S	S	*	.			trans	-69.4	127.2	-179.8	-169	0	0	0	0	111.3	L647	S645-L647 PolarHBondContact O-N 3.14Å
646	S	42.4	Very low	56.8	Low	70 Å²	70	64.1 Å²	64.1	49%	0.49	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	41.4	179.6	55	0	0	0	0	115	S186 Y226 G644	S186-S646 PolarHBondContact OG-O 3.28Å; Y226-S646 PolarHBondContact OH-O 2.72Å; G644-S646 PolarHBondContact O-N 2.98Å
647	L	40.6	Very low	58.2	Low	79 Å²	79	62.5 Å²	62.5	41%	0.414	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-3	-174.3	-67	179.7	0	0	0	113.4	Y226 S645	Y226-L647 WeakPolarHBondContact CE2-O 3.49Å; S645-L647 PolarHBondContact O-N 3.14Å
648	H	48.3	Very low	60.2	Low	96 Å²	96	60.3 Å²	60.3	44%	0.444	35%	0.354	S	S	.	.	S	Bend	trans	-121.5	147.9	174.7	-60.8	82.2	0	0	0	109.4	Y606	Y606-H648 HydrophobicContact CD1-CB 3.74Å; Y606-H648 HydrophobicContact CE1-CB 3.93Å; Y606-H648 HydrophobicContact CG-CB 4.24Å
649	E	56.2	Low	62.3	Low	15 Å²	15	54 Å²	54	7%	0.07	32%	0.32	C	S	.	.			trans	-90.6	104.4	-174.8	173.7	163.1	-144.9	0	0	109	H224 E225 Y606 M651	H224-E649 WeakPolarHBondContact CA-OE2 3.31Å; H224-E649 IonicContact CE1-OE2 3.49Å; H224-E649 PolarHBondContact CE1-OE2 3.5Å; H224-E649 IonicContact CG-OE2 2.67Å; H224-E649 IonicContact ND1-OE2 3.65Å; H224-E649 PolarHBondContact ND1-OE2 3.18Å; E225-E649 WeakPolarHBondContact CB-OE1 3.26Å; E225-E649 HydrophobicContact CG-CG 4.46Å; E225-E649 WeakPolarHBondContact CG-OE1 3.36Å; E225-E649 PolarHBondContact N-OE2 3.3Å; Y606-E649 PolarHBondContact OH-O 3.46Å; E649-M651 HydrophobicContact CG-CB 4.2Å; E649-M651 HydrophobicContact CG-CE 4.3Å; E649-M651 HydrophobicContact CG-CG 3.7Å; E649-M651 HydrophobicContact CG-SD 4.02Å; E649-M651 PolarHBondContact O-N 3.33Å; E649-M651 WeakPolarHBondContact OE1-CE 3.39Å
650	D	63.8	Low	64.5	Low	109 Å²	109	48.4 Å²	48.4	58%	0.583	29%	0.294	S	S	*	.			trans	-70.7	49.8	-178.7	-59.6	-39.5	0	0	0	112.6
651	M	75.4	Confident	66.8	Low	4 Å²	4	46.3 Å²	46.3	2%	0.02	28%	0.278	C	S	.	.			trans	-83	119.6	179.6	-89.7	-172.3	-179.8	0	0	112	Q612 E649 H656 A659 Y723	Q612-M651 PolarHBondContact NE2-O 3.06Å; E649-M651 HydrophobicContact CG-CB 4.2Å; E649-M651 HydrophobicContact CG-CE 4.3Å; E649-M651 HydrophobicContact CG-CG 3.7Å; E649-M651 HydrophobicContact CG-SD 4.02Å; E649-M651 PolarHBondContact O-N 3.33Å; E649-M651 WeakPolarHBondContact OE1-CE 3.39Å; M651-H656 VanDerWaalsContact CB-CE1 3.49Å; M651-H656 WeakPolarHBondContact CB-CE1 3.38Å; M651-H656 WeakPolarHBondContact CB-NE2 3.27Å; M651-H656 PolarHBondContact O-CD2 3.23Å; M651-H656 PolarHBondContact O-NE2 3.29Å; M651-H656 PolarHBondContact SD-ND1 3.4Å; M651-A659 HydrophobicContact CE-CB 3.93Å; M651-A659 HydrophobicContact SD-CB 4.4Å; M651-Y723 HydrophobicContact CE-CD1 3.44Å; M651-Y723 VanDerWaalsContact CE-CD1 3.44Å; M651-Y723 HydrophobicContact CE-CD2 3.82Å; M651-Y723 HydrophobicContact CE-CE1 3.31Å; M651-Y723 HydrophobicContact CE-CE2 3.72Å; M651-Y723 HydrophobicContact CE-CG 3.68Å; M651-Y723 VanDerWaalsContact CE-CZ 3.44Å; M651-Y723 HydrophobicContact CG-CE2 4.05Å
652	N	84.3	Confident	69.4	Low	8 Å²	8	42.9 Å²	42.9	4%	0.043	26%	0.263	C	S	.	.			trans	-64.5	165.2	163.4	75.8	69.6	0	0	0	112.3	F654 S655 H656 A716 E719	N652-F654 VanDerWaalsContact C-N 3.31Å; N652-F654 PolarHBondContact O-N 3.01Å; N652-F654 WeakPolarHBondContact OD1-CA 3.34Å; N652-F654 VanDerWaalsContact OD1-CB 3.22Å; N652-F654 WeakPolarHBondContact OD1-CB 3.3Å; N652-F654 PolarHBondContact OD1-N 2.93Å; N652-S655 VanDerWaalsContact CG-OG 3.27Å; N652-S655 PolarHBondContact N-OG 3.32Å; N652-S655 PolarHBondContact ND2-OG 2.9Å; N652-S655 PolarHBondContact O-N 2.92Å; N652-S655 PolarHBondContact O-OG 3.44Å; N652-S655 PolarHBondContact OD1-N 2.89Å; N652-S655 PolarHBondContact OD1-OG 3.32Å; N652-H656 PolarHBondContact O-CD2 3.39Å; N652-H656 PolarHBondContact O-N 2.93Å; N652-A716 WeakPolarHBondContact ND2-CA 3.44Å; N652-A716 PolarHBondContact ND2-O 3.11Å; N652-A716 VanDerWaalsContact ND2-O 3.08Å; N652-E719 PolarHBondContact ND2-OE2 2.9Å
653	C	87.6	Confident	72.1	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.02	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-31.1	-177.1	68.8	0	0	0	0	113.8	Q612 P633 S657 L669	Q612-C653 HydrophobicContact CG-CB 4.38Å; P633-C653 VanDerWaalsContact CA-SG 3.56Å; P633-C653 VanDerWaalsContact CB-SG 3.53Å; P633-C653 PolarHBondContact O-SG 3.3Å; C653-S657 PolarHBondContact O-N 3.03Å; C653-S657 PolarHBondContact O-OG 2.83Å; C653-L669 HydrophobicContact CB-CD1 4.21Å; C653-L669 HydrophobicContact CB-CD2 4.45Å
654	F	90.1	Very high	74.5	Confident	2 Å²	2	40 Å²	40	1%	0.009	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-43.7	175.1	-54.2	-87.9	0	0	0	110	P633 L634 N652 S657 A658 L666 L669 L670 A716 L717 A720	P633-F654 HydrophobicContact CB-CE2 3.79Å; P633-F654 HydrophobicContact CB-CZ 3.79Å; L634-F654 HydrophobicContact CD2-CD2 4.49Å; L634-F654 HydrophobicContact CD2-CE2 3.85Å; L634-F654 HydrophobicContact CG-CE2 4.46Å; N652-F654 VanDerWaalsContact C-N 3.31Å; N652-F654 PolarHBondContact O-N 3.01Å; N652-F654 WeakPolarHBondContact OD1-CA 3.34Å; N652-F654 VanDerWaalsContact OD1-CB 3.22Å; N652-F654 WeakPolarHBondContact OD1-CB 3.3Å; N652-F654 PolarHBondContact OD1-N 2.93Å; F654-S657 PolarHBondContact O-N 3.42Å; F654-S657 PolarHBondContact O-OG 3.39Å; F654-A658 VanDerWaalsContact O-CB 3.26Å; F654-A658 WeakPolarHBondContact O-CB 3.47Å; F654-A658 PolarHBondContact O-N 2.88Å; F654-L666 HydrophobicContact CB-CD1 3.94Å; F654-L666 HydrophobicContact CD1-CD1 3.92Å; F654-L666 HydrophobicContact CG-CD1 4.44Å; F654-L669 HydrophobicContact CD1-CB 3.94Å; F654-L669 HydrophobicContact CD1-CD1 4.45Å; F654-L669 HydrophobicContact CE1-CB 3.62Å; F654-L669 HydrophobicContact CZ-CB 4.35Å; F654-L670 HydrophobicContact CD1-CD2 4.3Å; F654-L670 HydrophobicContact CD1-CG 4.41Å; F654-L670 HydrophobicContact CE1-CD2 3.98Å; F654-L670 HydrophobicContact CE1-CG 4.19Å; F654-A716 HydrophobicContact CD2-CB 4.45Å; F654-L717 HydrophobicContact CB-CD2 4.03Å; F654-L717 HydrophobicContact CD1-CD2 3.69Å; F654-L717 HydrophobicContact CD2-CD2 4.48Å; F654-L717 HydrophobicContact CE1-CD2 4.28Å; F654-L717 HydrophobicContact CG-CD2 3.82Å; F654-A720 HydrophobicContact CB-CB 3.98Å
655	S	89.4	Confident	77.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-40	177.6	51.8	0	0	0	0	112.9	N652 S657 A658 A659	N652-S655 VanDerWaalsContact CG-OG 3.27Å; N652-S655 PolarHBondContact N-OG 3.32Å; N652-S655 PolarHBondContact ND2-OG 2.9Å; N652-S655 PolarHBondContact O-N 2.92Å; N652-S655 PolarHBondContact O-OG 3.44Å; N652-S655 PolarHBondContact OD1-N 2.89Å; N652-S655 PolarHBondContact OD1-OG 3.32Å; S655-S657 PolarHBondContact O-N 3.39Å; S655-A658 PolarHBondContact O-N 3.42Å; S655-A659 WeakPolarHBondContact O-CB 3.38Å; S655-A659 PolarHBondContact O-N 3.46Å
656	H	88.7	Confident	79.9	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.056	17%	0.173	C	C	.	.	H	α-helix	trans	-56.4	-50.3	169.5	-81.4	-57.8	0	0	0	112.2	A616 M651 N652 A658 A659 H660	A616-H656 HydrophobicContact CB-CB 3.92Å; M651-H656 VanDerWaalsContact CB-CE1 3.49Å; M651-H656 WeakPolarHBondContact CB-CE1 3.38Å; M651-H656 WeakPolarHBondContact CB-NE2 3.27Å; M651-H656 PolarHBondContact O-CD2 3.23Å; M651-H656 PolarHBondContact O-NE2 3.29Å; M651-H656 PolarHBondContact SD-ND1 3.4Å; N652-H656 PolarHBondContact O-CD2 3.39Å; N652-H656 PolarHBondContact O-N 2.93Å; H656-A658 VanDerWaalsContact C-N 3.32Å; H656-A658 PolarHBondContact O-N 2.91Å; H656-A659 PolarHBondContact O-N 3.27Å; H656-H660 PolarHBondContact O-CD2 2.91Å; H656-H660 PolarHBondContact O-N 3Å
657	S	90.8	Very high	82.2	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-34.1	-179.5	71.8	0	0	0	0	112.9	C653 F654 S655 G661 H662 L666	C653-S657 PolarHBondContact O-N 3.03Å; C653-S657 PolarHBondContact O-OG 2.83Å; F654-S657 PolarHBondContact O-N 3.42Å; F654-S657 PolarHBondContact O-OG 3.39Å; S655-S657 PolarHBondContact O-N 3.39Å; S657-G661 PolarHBondContact O-N 3.36Å; S657-H662 PolarHBondContact O-N 3.39Å; S657-L666 WeakPolarHBondContact OG-CB 3.48Å; S657-L666 WeakPolarHBondContact OG-CD1 3.43Å
658	A	91.9	Very high	84.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-77.4	-38.3	178.5	0	0	0	0	0	112.8	F654 S655 H656 H660 G661 A720 I732	F654-A658 VanDerWaalsContact O-CB 3.26Å; F654-A658 WeakPolarHBondContact O-CB 3.47Å; F654-A658 PolarHBondContact O-N 2.88Å; S655-A658 PolarHBondContact O-N 3.42Å; H656-A658 VanDerWaalsContact C-N 3.32Å; H656-A658 PolarHBondContact O-N 2.91Å; A658-H660 VanDerWaalsContact C-N 3.28Å; A658-H660 PolarHBondContact O-N 3.13Å; A658-G661 PolarHBondContact O-N 2.95Å; A658-A720 HydrophobicContact CB-CB 3.86Å; A658-A720 VanDerWaalsContact CB-O 3.28Å; A658-A720 WeakPolarHBondContact CB-O 3.29Å; A658-I732 HydrophobicContact CB-CG2 3.97Å
659	A	89.8	Confident	86.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.3	-34.9	175.9	0	0	0	0	0	112.3	F211 M651 S655 H656 Y723 H727 Y729	F211-A659 WeakPolarHBondContact CE1-O 3.28Å; F211-A659 HydrophobicContact CZ-CB 4.5Å; M651-A659 HydrophobicContact CE-CB 3.93Å; M651-A659 HydrophobicContact SD-CB 4.4Å; S655-A659 WeakPolarHBondContact O-CB 3.38Å; S655-A659 PolarHBondContact O-N 3.46Å; H656-A659 PolarHBondContact O-N 3.27Å; A659-Y723 HydrophobicContact CB-CG 4.49Å; A659-H727 PolarHBondContact O-ND1 3.46Å; A659-Y729 VanDerWaalsContact O-CE2 3.29Å; A659-Y729 WeakPolarHBondContact O-CE2 3.35Å
660	H	88.5	Confident	88.1	Confident	7 Å²	7	30.2 Å²	30.2	3%	0.032	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	0.3	178	-77.9	-79	0	0	0	114.7	F211 V215 I223 A616 H656 A658 H662	F211-H660 AromaticContact CZ-CE1 3.88Å; F211-H660 AromaticContact CZ-NE2 3.88Å; V215-H660 WeakPolarHBondContact CG2-ND1 3.44Å; I223-H660 PolarHBondContact N-CE1 3.45Å; I223-H660 VanDerWaalsContact N-CE1 3.28Å; A616-H660 PolarHBondContact O-CD2 3.03Å; H656-H660 PolarHBondContact O-CD2 2.91Å; H656-H660 PolarHBondContact O-N 3Å; A658-H660 VanDerWaalsContact C-N 3.28Å; A658-H660 PolarHBondContact O-N 3.13Å; H660-H662 VanDerWaalsContact C-N 3.33Å; H660-H662 WeakPolarHBondContact CB-CD2 3.23Å; H660-H662 PolarHBondContact O-N 3.4Å
661	G	90.4	Very high	89.2	Confident	18 Å²	18	29.6 Å²	29.6	19%	0.186	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	10.9	178.8	0	0	0	0	0	115.5	S657 A658 R663 Y729	S657-G661 PolarHBondContact O-N 3.36Å; A658-G661 PolarHBondContact O-N 2.95Å; G661-R663 PolarHBondContact O-N 3Å; G661-Y729 VanDerWaalsContact CA-CE1 3.47Å
662	H	92.5	Very high	89.4	Confident	70 Å²	70	32 Å²	32	32%	0.324	16%	0.156	S	C	.	.			trans	-77.5	62.2	-175.2	-60	-42.7	0	0	0	113.4	S615 A616 G618 S657 H660 N664 V665 L666	S615-H662 PolarHBondContact O-CD2 3.43Å; A616-H662 PolarHBondContact O-CD2 3.42Å; G618-H662 WeakPolarHBondContact CA-CD2 3.49Å; G618-H662 VanDerWaalsContact CA-CG 3.41Å; G618-H662 PolarHBondContact N-CD2 3.47Å; G618-H662 VanDerWaalsContact N-CD2 3.28Å; S657-H662 PolarHBondContact O-N 3.39Å; H660-H662 VanDerWaalsContact C-N 3.33Å; H660-H662 WeakPolarHBondContact CB-CD2 3.23Å; H660-H662 PolarHBondContact O-N 3.4Å; H662-N664 VanDerWaalsContact C-N 3.26Å; H662-N664 PolarHBondContact O-N 2.82Å; H662-N664 VanDerWaalsContact O-N 3.12Å; H662-V665 HydrophobicContact CB-CB 4.04Å; H662-V665 HydrophobicContact CB-CG2 4.32Å; H662-V665 WeakPolarHBondContact O-CB 3.45Å; H662-V665 PolarHBondContact O-N 2.82Å; H662-L666 PolarHBondContact O-N 2.6Å
663	R	91.5	Very high	88.5	Confident	93 Å²	93	36.4 Å²	36.4	35%	0.351	19%	0.186	S	C	.	.	H	α-helix	trans	-50.9	-37.1	-177.9	-179.5	172.9	170.1	-123.5	22.5	114.8	G661 R667 I732 E735	G661-R663 PolarHBondContact O-N 3Å; R663-R667 WeakPolarHBondContact O-CB 3.36Å; R663-R667 WeakPolarHBondContact O-CD 3.45Å; R663-R667 VanDerWaalsContact O-CG 3.26Å; R663-R667 WeakPolarHBondContact O-CG 3.47Å; R663-R667 PolarHBondContact O-N 3.17Å; R663-I732 HydrophobicContact CB-CD1 4.15Å; R663-I732 HydrophobicContact CB-CG1 4.08Å; R663-I732 HydrophobicContact CG-CG1 4.43Å; R663-E735 IonicContact CZ-OE1 3.99Å; R663-E735 IonicContact NE-OE1 2.72Å; R663-E735 PolarHBondContact NE-OE1 2.81Å; R663-E735 IonicContact NE-OE2 3.27Å; R663-E735 PolarHBondContact NE-OE2 3.31Å; R663-E735 IonicContact NH2-OE1 3.69Å; R663-E735 PolarHBondContact NH2-OE1 2.67Å
664	N	91.5	Very high	87.3	Confident	106 Å²	106	40.3 Å²	40.3	57%	0.567	20%	0.204	S	C	*	.	H	α-helix	trans	-70.2	-38.1	178.8	-68.1	-15.2	0	0	0	112.2	Y620 H662 K668	Y620-N664 HydrophobicContact CD2-CB 4.3Å; H662-N664 VanDerWaalsContact C-N 3.26Å; H662-N664 PolarHBondContact O-N 2.82Å; H662-N664 VanDerWaalsContact O-N 3.12Å; N664-K668 PolarHBondContact O-N 2.95Å; N664-K668 VanDerWaalsContact O-N 3.1Å
665	V	92.3	Very high	85.6	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-47.9	173.6	166.5	0	0	0	0	110.2	V623 H662 R667 K668 L669	V623-V665 HydrophobicContact CG1-CG1 4.3Å; V623-V665 HydrophobicContact CG2-CG1 3.96Å; V623-V665 HydrophobicContact CG2-CG2 4.44Å; H662-V665 HydrophobicContact CB-CB 4.04Å; H662-V665 HydrophobicContact CB-CG2 4.32Å; H662-V665 WeakPolarHBondContact O-CB 3.45Å; H662-V665 PolarHBondContact O-N 2.82Å; V665-R667 VanDerWaalsContact C-N 3.28Å; V665-R667 PolarHBondContact O-N 3.36Å; V665-K668 WeakPolarHBondContact O-CA 3.21Å; V665-K668 WeakPolarHBondContact O-CB 3.46Å; V665-K668 PolarHBondContact O-N 3.44Å; V665-L669 HydrophobicContact CG1-CD1 3.95Å; V665-L669 HydrophobicContact CG1-CG 4.3Å; V665-L669 WeakPolarHBondContact O-CG 3.46Å; V665-L669 PolarHBondContact O-N 3.12Å
666	L	91.6	Very high	83.5	Confident	3 Å²	3	51 Å²	51	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-54	-46.1	176.9	-178.4	67.6	0	0	0	111.6	F654 S657 H662 K668 L669 L670 I732 L736	F654-L666 HydrophobicContact CB-CD1 3.94Å; F654-L666 HydrophobicContact CD1-CD1 3.92Å; F654-L666 HydrophobicContact CG-CD1 4.44Å; S657-L666 WeakPolarHBondContact OG-CB 3.48Å; S657-L666 WeakPolarHBondContact OG-CD1 3.43Å; H662-L666 PolarHBondContact O-N 2.6Å; L666-K668 PolarHBondContact O-N 3.42Å; L666-L669 PolarHBondContact O-N 3.47Å; L666-L670 HydrophobicContact CG-CD1 4.13Å; L666-L670 WeakPolarHBondContact O-CB 3.47Å; L666-L670 VanDerWaalsContact O-CG 3.24Å; L666-L670 WeakPolarHBondContact O-CG 3.23Å; L666-L670 PolarHBondContact O-N 3.39Å; L666-I732 HydrophobicContact CD2-CG2 3.49Å; L666-I732 VanDerWaalsContact CD2-CG2 3.49Å; L666-L736 HydrophobicContact CD2-CD2 4.22Å; L666-L736 HydrophobicContact CD2-CG 4.39Å
667	R	91.8	Very high	81.4	Confident	106 Å²	106	57 Å²	57	40%	0.4	30%	0.297	S	S	.	.	H	α-helix	trans	-60.7	-41	174.6	-74.1	166.6	169.6	-148	-11.3	112.6	R663 V665 L670 T671 E735	R663-R667 WeakPolarHBondContact O-CB 3.36Å; R663-R667 WeakPolarHBondContact O-CD 3.45Å; R663-R667 VanDerWaalsContact O-CG 3.26Å; R663-R667 WeakPolarHBondContact O-CG 3.47Å; R663-R667 PolarHBondContact O-N 3.17Å; V665-R667 VanDerWaalsContact C-N 3.28Å; V665-R667 PolarHBondContact O-N 3.36Å; R667-L670 PolarHBondContact O-N 2.82Å; R667-T671 WeakPolarHBondContact O-CG2 3.44Å; R667-T671 PolarHBondContact O-N 2.87Å; R667-T671 VanDerWaalsContact O-N 3.16Å; R667-E735 IonicContact CZ-OE1 3.72Å; R667-E735 IonicContact CZ-OE2 2.7Å; R667-E735 VanDerWaalsContact CZ-OE2 3.28Å; R667-E735 IonicContact NE-OE1 2.75Å; R667-E735 IonicContact NE-OE2 3.21Å; R667-E735 PolarHBondContact NE-OE2 3.4Å; R667-E735 IonicContact NH2-OE1 2.74Å; R667-E735 PolarHBondContact NH2-OE1 3.06Å; R667-E735 IonicContact NH2-OE2 2.82Å; R667-E735 PolarHBondContact NH2-OE2 2.71Å
668	K	91.8	Very high	79	Confident	57 Å²	57	61.1 Å²	61.1	25%	0.248	33%	0.331	C	S	.	.	H	α-helix	trans	-64.6	-45.3	176.7	-177	61.3	178.2	-177.1	0	111.8	Y620 V623 S624 L627 N664 V665 L666 L670 T671	Y620-K668 HydrophobicContact CD2-CB 4.33Å; Y620-K668 HydrophobicContact CE2-CB 3.82Å; Y620-K668 HydrophobicContact CE2-CD 4.38Å; Y620-K668 HydrophobicContact CE2-CG 4.15Å; V623-K668 HydrophobicContact CG1-CG 4.23Å; S624-K668 WeakPolarHBondContact OG-CE 3.38Å; L627-K668 HydrophobicContact CD1-CG 4.02Å; N664-K668 PolarHBondContact O-N 2.95Å; N664-K668 VanDerWaalsContact O-N 3.1Å; V665-K668 WeakPolarHBondContact O-CA 3.21Å; V665-K668 WeakPolarHBondContact O-CB 3.46Å; V665-K668 PolarHBondContact O-N 3.44Å; L666-K668 PolarHBondContact O-N 3.42Å; K668-L670 VanDerWaalsContact C-N 3.28Å; K668-L670 PolarHBondContact O-N 3.05Å; K668-T671 PolarHBondContact O-N 3.03Å; K668-T671 VanDerWaalsContact O-N 3.16Å; K668-T671 PolarHBondContact O-OG1 3.49Å
669	L	89.3	Confident	76.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-57.5	-42.7	173.3	-66.1	168	0	0	0	111	L611 V623 L627 C653 F654 V665 L666 T671 Q672	L611-L669 HydrophobicContact CD1-CD2 4.15Å; L611-L669 HydrophobicContact CD2-CD2 4.33Å; L611-L669 HydrophobicContact CG-CD2 4.39Å; V623-L669 HydrophobicContact CG1-CD2 4.06Å; V623-L669 HydrophobicContact CG1-CG 4.37Å; L627-L669 HydrophobicContact CD1-CD2 4.25Å; C653-L669 HydrophobicContact CB-CD1 4.21Å; C653-L669 HydrophobicContact CB-CD2 4.45Å; F654-L669 HydrophobicContact CD1-CB 3.94Å; F654-L669 HydrophobicContact CD1-CD1 4.45Å; F654-L669 HydrophobicContact CE1-CB 3.62Å; F654-L669 HydrophobicContact CZ-CB 4.35Å; V665-L669 HydrophobicContact CG1-CD1 3.95Å; V665-L669 HydrophobicContact CG1-CG 4.3Å; V665-L669 WeakPolarHBondContact O-CG 3.46Å; V665-L669 PolarHBondContact O-N 3.12Å; L666-L669 PolarHBondContact O-N 3.47Å; L669-T671 VanDerWaalsContact C-N 3.29Å; L669-T671 PolarHBondContact O-N 2.86Å; L669-Q672 PolarHBondContact O-N 3.17Å
670	L	87.1	Confident	74.7	Confident	34 Å²	34	72.7 Å²	72.7	18%	0.178	40%	0.398	C	S	.	.	H	α-helix	trans	-64.6	-26.2	178.2	-73.8	167.3	0	0	0	114.2	F654 L666 R667 K668 Q672 R713 L717 L739	F654-L670 HydrophobicContact CD1-CD2 4.3Å; F654-L670 HydrophobicContact CD1-CG 4.41Å; F654-L670 HydrophobicContact CE1-CD2 3.98Å; F654-L670 HydrophobicContact CE1-CG 4.19Å; L666-L670 HydrophobicContact CG-CD1 4.13Å; L666-L670 WeakPolarHBondContact O-CB 3.47Å; L666-L670 VanDerWaalsContact O-CG 3.24Å; L666-L670 WeakPolarHBondContact O-CG 3.23Å; L666-L670 PolarHBondContact O-N 3.39Å; R667-L670 PolarHBondContact O-N 2.82Å; K668-L670 VanDerWaalsContact C-N 3.28Å; K668-L670 PolarHBondContact O-N 3.05Å; L670-Q672 PolarHBondContact O-N 3Å; L670-R713 PolarHBondContact O-NH2 2.99Å; L670-L717 HydrophobicContact CD2-CD1 4.11Å; L670-L717 HydrophobicContact CD2-CD2 3.84Å; L670-L739 HydrophobicContact CD1-CD1 3.59Å; L670-L739 HydrophobicContact CD2-CD1 4.15Å
671	T	86.1	Confident	72.7	Confident	96 Å²	96	75.9 Å²	75.9	59%	0.589	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-13.1	176.5	60.4	0	0	0	0	114.4	R667 K668 L669	R667-T671 WeakPolarHBondContact O-CG2 3.44Å; R667-T671 PolarHBondContact O-N 2.87Å; R667-T671 VanDerWaalsContact O-N 3.16Å; K668-T671 PolarHBondContact O-N 3.03Å; K668-T671 VanDerWaalsContact O-N 3.16Å; K668-T671 PolarHBondContact O-OG1 3.49Å; L669-T671 VanDerWaalsContact C-N 3.29Å; L669-T671 PolarHBondContact O-N 2.86Å
672	Q	79.5	Confident	70.8	Confident	53 Å²	53	76.8 Å²	76.8	25%	0.248	42%	0.418	C	S	.	.	S	Bend	trans	-69.6	134.8	179.7	-68.7	-60.9	-24.4	0	0	111.9	L627 P633 L669 L670 R713	L627-Q672 HydrophobicContact CD1-CG 4.14Å; L627-Q672 HydrophobicContact CD2-CG 3.85Å; L627-Q672 HydrophobicContact CG-CG 4.5Å; P633-Q672 HydrophobicContact CG-CB 4.46Å; P633-Q672 HydrophobicContact CG-CG 4.34Å; L669-Q672 PolarHBondContact O-N 3.17Å; L670-Q672 PolarHBondContact O-N 3Å; Q672-R713 PolarHBondContact O-NH1 3.06Å; Q672-R713 VanDerWaalsContact O-NH1 3.16Å
673	P	65.8	Low	68.4	Low	101 Å²	101	79.7 Å²	79.7	66%	0.656	44%	0.435	S	S	*	.			trans	-63.7	144.9	178.1	28.6	-33.7	0	0	0	109.9	Q675	P673-Q675 PolarHBondContact O-N 2.9Å; P673-Q675 VanDerWaalsContact O-N 3.11Å
674	Q	63.9	Low	66.4	Low	85 Å²	85	82.1 Å²	82.1	40%	0.397	45%	0.451	S	S	.	.			trans	-67	111.6	173.3	-62.8	-178.8	14.1	0	0	108.5	A676 R708	Q674-A676 PolarHBondContact O-N 3.37Å; Q674-R708 PolarHBondContact NE2-O 3.35Å
675	Q	53.6	Low	64.4	Low	126 Å²	126	79.3 Å²	79.3	59%	0.589	43%	0.434	S	S	*	.			trans	-68	105.1	165.9	-72.4	-168.5	19.5	0	0	108	P673 K677	P673-Q675 PolarHBondContact O-N 2.9Å; P673-Q675 VanDerWaalsContact O-N 3.11Å; Q675-K677 PolarHBondContact O-N 2.85Å
676	A	45.1	Very low	62.6	Low	102 Å²	102	83.7 Å²	83.7	84%	0.843	46%	0.457	S	S	*	.			trans	-74.6	61	171.8	0	0	0	0	0	110.9	Q674 A678	Q674-A676 PolarHBondContact O-N 3.37Å; A676-A678 PolarHBondContact O-N 2.96Å
677	K	45	Very low	60.4	Low	137 Å²	137	89.9 Å²	89.9	60%	0.596	49%	0.489	S	S	*	.			trans	-64.2	123.7	154.9	-71.9	174.7	-176	162	0	105.2	Q675 D679	Q675-K677 PolarHBondContact O-N 2.85Å; K677-D679 PolarHBondContact O-N 3.39Å
678	A	39.4	Very low	58.3	Low	87 Å²	87	89 Å²	89	72%	0.719	50%	0.504	S	S	*	.			trans	-54.7	130.6	-173	0	0	0	0	0	110.4	A676 V680	A676-A678 PolarHBondContact O-N 2.96Å; A678-V680 VanDerWaalsContact C-N 3.26Å; A678-V680 PolarHBondContact O-N 2.79Å
679	D	43.5	Very low	56.3	Low	105 Å²	105	90.9 Å²	90.9	56%	0.561	51%	0.514	S	S	*	.			trans	-62.9	87.7	175.3	-76.2	-36.9	0	0	0	108.9	K677 L681	K677-D679 PolarHBondContact O-N 3.39Å; D679-L681 PolarHBondContact O-N 3.02Å
680	V	47.8	Very low	53.9	Low	138 Å²	138	94 Å²	94	84%	0.836	55%	0.546	S	S	*	.			trans	-75.7	82.7	165.3	-176.9	0	0	0	0	106.2	A678 S682	A678-V680 VanDerWaalsContact C-N 3.26Å; A678-V680 PolarHBondContact O-N 2.79Å; V680-S682 PolarHBondContact O-N 3.38Å
681	L	46.6	Very low	51.2	Low	73 Å²	73	98.9 Å²	98.9	38%	0.382	58%	0.577	S	S	.	*			trans	-50.1	131.8	172.7	-66.4	166.4	0	0	0	109.1	D679 E685 I686	D679-L681 PolarHBondContact O-N 3.02Å; L681-E685 HydrophobicContact CD2-CB 4.47Å; L681-I686 HydrophobicContact CB-CD1 4.16Å; L681-I686 HydrophobicContact CB-CG1 3.9Å
682	S	51.7	Low	48.8	Very low	38 Å²	38	103 Å²	103	27%	0.266	59%	0.59	S	S	.	*			trans	-66.1	154.7	175.1	73.5	0	0	0	0	109.8	V680 E684 E685 I686	V680-S682 PolarHBondContact O-N 3.38Å; S682-E684 PolarHBondContact O-N 3.25Å; S682-E684 VanDerWaalsContact O-N 3.12Å; S682-E685 PolarHBondContact O-N 3.32Å; S682-E685 PolarHBondContact OG-N 3.27Å; S682-I686 WeakPolarHBondContact O-CG1 3.47Å; S682-I686 PolarHBondContact O-N 3.39Å; S682-I686 VanDerWaalsContact O-N 3.11Å
683	L	42.2	Very low	46.5	Very low	131 Å²	131	109.4 Å²	109.4	69%	0.686	62%	0.619	S	S	*	*	H	α-helix	trans	-59.4	-27.4	178.6	-154.6	78.7	0	0	0	111.6	L687	L683-L687 HydrophobicContact CD2-CD1 4.4Å; L683-L687 HydrophobicContact CG-CD1 4.25Å; L683-L687 WeakPolarHBondContact O-CB 3.37Å; L683-L687 WeakPolarHBondContact O-CD1 3.19Å; L683-L687 WeakPolarHBondContact O-CG 3.36Å; L683-L687 PolarHBondContact O-N 3.36Å
684	E	48.3	Very low	45	Very low	144 Å²	144	109.9 Å²	109.9	67%	0.673	63%	0.625	S	S	*	*	H	α-helix	trans	-73.7	-38.6	175.1	-65.2	-177.1	143.1	0	0	112.9	S682 I686 L687 A688	S682-E684 PolarHBondContact O-N 3.25Å; S682-E684 VanDerWaalsContact O-N 3.12Å; E684-I686 VanDerWaalsContact C-N 3.3Å; E684-I686 PolarHBondContact O-N 3.4Å; E684-L687 PolarHBondContact O-N 3.4Å; E684-A688 VanDerWaalsContact O-CB 3.25Å; E684-A688 WeakPolarHBondContact O-CB 3.39Å; E684-A688 PolarHBondContact O-N 3.5Å
685	E	49.3	Very low	43.2	Very low	47 Å²	47	113 Å²	113	22%	0.22	65%	0.645	C	S	.	*	H	α-helix	trans	-64.6	-36.4	172.3	-74.3	-165.4	132.4	0	0	111.4	L681 S682 L687 E689 K715	L681-E685 HydrophobicContact CD2-CB 4.47Å; S682-E685 PolarHBondContact O-N 3.32Å; S682-E685 PolarHBondContact OG-N 3.27Å; E685-L687 VanDerWaalsContact C-N 3.33Å; E685-L687 PolarHBondContact O-N 3.1Å; E685-E689 PolarHBondContact O-N 3.43Å; E685-K715 IonicContact OE1-NZ 3.54Å; E685-K715 PolarHBondContact OE1-NZ 2.94Å
686	I	56.1	Low	42.2	Very low	95 Å²	95	112 Å²	112	49%	0.487	66%	0.658	S	S	.	*	H	α-helix	trans	-68.2	-30.2	174.9	-62.3	169.4	0	0	0	112.1	L681 S682 E684	L681-I686 HydrophobicContact CB-CD1 4.16Å; L681-I686 HydrophobicContact CB-CG1 3.9Å; S682-I686 WeakPolarHBondContact O-CG1 3.47Å; S682-I686 PolarHBondContact O-N 3.39Å; S682-I686 VanDerWaalsContact O-N 3.11Å; E684-I686 VanDerWaalsContact C-N 3.3Å; E684-I686 PolarHBondContact O-N 3.4Å
687	L	44.5	Very low	41.5	Very low	132 Å²	132	111.7 Å²	111.7	69%	0.691	65%	0.649	S	S	*	*	H	α-helix	trans	-91.6	-25.4	-178.9	-72.4	168.6	0	0	0	113.6	L683 E684 E685	L683-L687 HydrophobicContact CD2-CD1 4.4Å; L683-L687 HydrophobicContact CG-CD1 4.25Å; L683-L687 WeakPolarHBondContact O-CB 3.37Å; L683-L687 WeakPolarHBondContact O-CD1 3.19Å; L683-L687 WeakPolarHBondContact O-CG 3.36Å; L683-L687 PolarHBondContact O-N 3.36Å; E684-L687 PolarHBondContact O-N 3.4Å; E685-L687 VanDerWaalsContact C-N 3.33Å; E685-L687 PolarHBondContact O-N 3.1Å
688	A	48.1	Very low	40.8	Very low	88 Å²	88	111 Å²	111	73%	0.727	66%	0.661	S	S	*	*	H	α-helix	trans	-75.7	-26.7	173.9	0	0	0	0	0	112.3	E684	E684-A688 VanDerWaalsContact O-CB 3.25Å; E684-A688 WeakPolarHBondContact O-CB 3.39Å; E684-A688 PolarHBondContact O-N 3.5Å
689	E	49.4	Very low	40.8	Very low	97 Å²	97	116.7 Å²	116.7	45%	0.453	67%	0.673	S	S	.	*	S	Bend	trans	-93.6	94.8	171.7	-65.2	-171.3	144.3	0	0	110.1	E685 V691 R711	E685-E689 PolarHBondContact O-N 3.43Å; E689-V691 PolarHBondContact O-N 2.91Å; E689-R711 IonicContact OE1-CZ 3.22Å; E689-R711 IonicContact OE1-NH1 3.78Å; E689-R711 PolarHBondContact OE1-NH1 2.78Å; E689-R711 IonicContact OE1-NH2 3.63Å; E689-R711 PolarHBondContact OE1-NH2 3.16Å; E689-R711 IonicContact OE2-CZ 3.75Å; E689-R711 IonicContact OE2-NH1 2.66Å; E689-R711 PolarHBondContact OE2-NH1 3.02Å; E689-R711 IonicContact OE2-NH2 3.11Å
690	G	38.2	Very low	40.1	Very low	64 Å²	64	115.2 Å²	115.2	66%	0.66	68%	0.683	S	S	*	*			trans	-52.6	137.1	162	0	0	0	0	0	109.7	E692	G690-E692 PolarHBondContact O-N 2.86Å
691	V	30.9	Very low	39.1	Very low	138 Å²	138	114.3 Å²	114.3	84%	0.836	68%	0.683	S	S	*	*			trans	-56.7	96.8	-166.7	-175.7	0	0	0	0	112.3	E689	E689-V691 PolarHBondContact O-N 2.91Å
692	E	35.3	Very low	38.7	Very low	183 Å²	183	114.7 Å²	114.7	86%	0.855	70%	0.704	S	S	*	*			trans	-87.9	117.9	158.8	-69.3	-157	159.9	0	0	108.7	G690 S694	G690-E692 PolarHBondContact O-N 2.86Å; E692-S694 PolarHBondContact O-N 3.36Å
693	E	31.7	Very low	37.5	Very low	186 Å²	186	118.2 Å²	118.2	87%	0.869	73%	0.729	S	S	*	*			trans	-63.9	106	176.2	-67.1	-175.5	140.8	0	0	109.4	D695	E693-D695 PolarHBondContact O-N 3.35Å
694	S	33.6	Very low	37.1	Very low	111 Å²	111	121.6 Å²	121.6	78%	0.776	74%	0.741	S	S	*	*			trans	-78.8	114	174.5	39.9	0	0	0	0	109.9	E692 A696	E692-S694 PolarHBondContact O-N 3.36Å; S694-A696 PolarHBondContact O-N 3.14Å
695	D	28	Very low	36.3	Very low	152 Å²	152	117 Å²	117	81%	0.813	73%	0.733	S	S	*	*			trans	-57.8	92.3	179.5	-99.5	-38.9	0	0	0	112.3	E693 S697	E693-D695 PolarHBondContact O-N 3.35Å; D695-S697 PolarHBondContact O-N 3.3Å
696	A	32.3	Very low	36	Very low	104 Å²	104	120.4 Å²	120.4	86%	0.86	76%	0.759	S	S	*	*			trans	-79.4	56.5	179	0	0	0	0	0	112.2	S694	S694-A696 PolarHBondContact O-N 3.14Å
697	S	30.2	Very low	35.7	Very low	96 Å²	96	121.1 Å²	121.1	67%	0.671	77%	0.768	S	S	*	*			trans	-148.6	72.3	176.2	63.5	0	0	0	0	115.8	D695	D695-S697 PolarHBondContact O-N 3.3Å
698	S	30.8	Very low	36.4	Very low	121 Å²	121	126 Å²	126	85%	0.846	78%	0.777	S	S	*	*			trans	-166.2	69.2	154	40.6	0	0	0	0	113.7
699	Q	38.3	Very low	37.5	Very low	207 Å²	207	123.5 Å²	123.5	97%	0.967	75%	0.751	S	S	*	*			trans	-84	114.2	155.9	-77.8	-167.3	-6.5	0	0	109.5
700	G	29.1	Very low	38.8	Very low	75 Å²	75	120.3 Å²	120.3	77%	0.773	74%	0.74	S	S	*	*			trans	147.4	92.2	165.2	0	0	0	0	0	115.9
701	S	27.2	Very low	40.6	Very low	118 Å²	118	122.1 Å²	122.1	83%	0.825	73%	0.726	S	S	*	*			trans	167.1	136.3	137.6	-174	0	0	0	0	109.4	S703	S701-S703 PolarHBondContact O-N 2.96Å
702	G	37.2	Very low	42.7	Very low	81 Å²	81	117.1 Å²	117.1	84%	0.835	70%	0.696	S	S	*	*			trans	-72.1	118.7	174.4	0	0	0	0	0	111.4
703	S	26.2	Very low	45	Very low	112 Å²	112	109.6 Å²	109.6	78%	0.783	66%	0.66	S	S	*	*			trans	-148	146.1	164.2	-174.1	0	0	0	0	107.8	S701 G705	S701-S703 PolarHBondContact O-N 2.96Å; S703-G705 PolarHBondContact O-N 3.42Å
704	E	34.3	Very low	47.4	Very low	202 Å²	202	102.4 Å²	102.4	94%	0.944	63%	0.629	S	S	*	*			trans	-71.2	72.7	173.3	-66.9	-178.6	137.2	0	0	109.9
705	G	31.5	Very low	49.8	Very low	48 Å²	48	101 Å²	101	50%	0.495	61%	0.609	S	S	.	*			trans	-78.7	160.4	170.4	0	0	0	0	0	111.9	S703 V707	S703-G705 PolarHBondContact O-N 3.42Å; G705-V707 PolarHBondContact O-N 3.09Å
706	P	42.8	Very low	52.5	Low	119 Å²	119	93.8 Å²	93.8	77%	0.773	57%	0.57	S	S	*	*			trans	-58.1	134.2	175.3	25.8	-33.9	0	0	0	110.3	R708	P706-R708 PolarHBondContact O-N 3.24Å
707	V	50.9	Low	55.2	Low	110 Å²	110	88.9 Å²	88.9	67%	0.667	53%	0.529	S	S	*	.			trans	-56.5	113.9	-178.9	176.8	0	0	0	0	109.3	G705 L709	G705-V707 PolarHBondContact O-N 3.09Å; V707-L709 PolarHBondContact O-N 3.21Å
708	R	58.1	Low	58.1	Low	234 Å²	234	85.6 Å²	85.6	88%	0.883	50%	0.504	S	S	*	.			trans	-62	110.6	175.8	-171.1	176	177.9	-178.9	-1.2	108.5	Q674 P706	Q674-R708 PolarHBondContact NE2-O 3.35Å; P706-R708 PolarHBondContact O-N 3.24Å
709	L	71.4	Confident	60.8	Low	36 Å²	36	82.4 Å²	82.4	19%	0.188	48%	0.475	C	S	.	.			trans	-75	145.3	177.3	-62	173.1	0	0	0	109.6	V707 T714 L717 V741	V707-L709 PolarHBondContact O-N 3.21Å; L709-T714 VanDerWaalsContact CB-OG1 3.31Å; L709-T714 WeakPolarHBondContact CB-OG1 3.27Å; L709-L717 HydrophobicContact CD1-CD1 4.1Å; L709-L717 HydrophobicContact CD2-CD1 4.43Å; L709-V741 HydrophobicContact CD1-CG2 4.5Å
710	S	77.6	Confident	63.3	Low	30 Å²	30	72.6 Å²	72.6	21%	0.21	43%	0.429	C	S	.	.			trans	-67	157	167.6	68	0	0	0	0	110.5	T712 R713 T714	S710-T712 VanDerWaalsContact C-N 3.34Å; S710-T712 PolarHBondContact O-N 3.4Å; S710-R713 PolarHBondContact O-N 2.91Å; S710-R713 VanDerWaalsContact OG-CB 3.3Å; S710-R713 WeakPolarHBondContact OG-CB 3.22Å; S710-R713 PolarHBondContact OG-N 3.3Å; S710-T714 WeakPolarHBondContact O-CB 3.24Å; S710-T714 PolarHBondContact O-N 2.97Å; S710-T714 PolarHBondContact O-OG1 3.2Å
711	R	75.8	Confident	66.3	Low	101 Å²	101	69 Å²	69	38%	0.381	39%	0.392	S	S	.	.	H	α-helix	trans	-58.6	-47.5	-179.5	-170.2	-179.2	-172.7	154.7	3.7	111.1	E689 R713 T714 K715	E689-R711 IonicContact OE1-CZ 3.22Å; E689-R711 IonicContact OE1-NH1 3.78Å; E689-R711 PolarHBondContact OE1-NH1 2.78Å; E689-R711 IonicContact OE1-NH2 3.63Å; E689-R711 PolarHBondContact OE1-NH2 3.16Å; E689-R711 IonicContact OE2-CZ 3.75Å; E689-R711 IonicContact OE2-NH1 2.66Å; E689-R711 PolarHBondContact OE2-NH1 3.02Å; E689-R711 IonicContact OE2-NH2 3.11Å; R711-R713 PolarHBondContact O-N 2.81Å; R711-T714 WeakPolarHBondContact O-CB 3.46Å; R711-T714 PolarHBondContact O-N 3.11Å; R711-T714 VanDerWaalsContact O-N 3.14Å; R711-K715 PolarHBondContact O-N 3.47Å
712	T	75.2	Confident	69.4	Low	34 Å²	34	63.6 Å²	63.6	21%	0.209	35%	0.354	C	S	.	.	H	α-helix	trans	-53	-51.4	174.1	-45.2	0	0	0	0	112.1	M637 S710 T714 K715 A716	M637-T712 HydrophobicContact CG-CG2 4.44Å; M637-T712 HydrophobicContact SD-CG2 3.4Å; M637-T712 WeakPolarHBondContact SD-CG2 3.31Å; S710-T712 VanDerWaalsContact C-N 3.34Å; S710-T712 PolarHBondContact O-N 3.4Å; T712-T714 VanDerWaalsContact C-N 3.32Å; T712-T714 PolarHBondContact O-N 3.12Å; T712-K715 PolarHBondContact O-N 3.21Å; T712-A716 PolarHBondContact O-N 2.83Å; T712-A716 VanDerWaalsContact O-N 3.13Å
713	R	82	Confident	72	Confident	24 Å²	24	61.1 Å²	61.1	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-68	-31.8	177.9	-171.6	168.2	175.2	158	-4.6	112.1	L670 Q672 S710 R711 L717	L670-R713 PolarHBondContact O-NH2 2.99Å; Q672-R713 PolarHBondContact O-NH1 3.06Å; Q672-R713 VanDerWaalsContact O-NH1 3.16Å; S710-R713 PolarHBondContact O-N 2.91Å; S710-R713 VanDerWaalsContact OG-CB 3.3Å; S710-R713 WeakPolarHBondContact OG-CB 3.22Å; S710-R713 PolarHBondContact OG-N 3.3Å; R711-R713 PolarHBondContact O-N 2.81Å; R713-L717 HydrophobicContact CG-CD1 4.01Å; R713-L717 HydrophobicContact CG-CG 4.38Å; R713-L717 WeakPolarHBondContact O-CB 3.37Å; R713-L717 WeakPolarHBondContact O-CG 3.47Å; R713-L717 PolarHBondContact O-N 3.37Å
714	T	83.5	Confident	75.2	Confident	35 Å²	35	55.8 Å²	55.8	22%	0.215	28%	0.282	C	S	.	.	H	α-helix	trans	-68.4	-44.9	176.2	-52.6	0	0	0	0	111.4	L709 S710 R711 T712 L717 Q718	L709-T714 VanDerWaalsContact CB-OG1 3.31Å; L709-T714 WeakPolarHBondContact CB-OG1 3.27Å; S710-T714 WeakPolarHBondContact O-CB 3.24Å; S710-T714 PolarHBondContact O-N 2.97Å; S710-T714 PolarHBondContact O-OG1 3.2Å; R711-T714 WeakPolarHBondContact O-CB 3.46Å; R711-T714 PolarHBondContact O-N 3.11Å; R711-T714 VanDerWaalsContact O-N 3.14Å; T712-T714 VanDerWaalsContact C-N 3.32Å; T712-T714 PolarHBondContact O-N 3.12Å; T714-L717 PolarHBondContact O-N 3.07Å; T714-Q718 WeakPolarHBondContact O-CB 3.14Å; T714-Q718 PolarHBondContact O-N 3.23Å
715	K	83.6	Confident	78	Confident	83 Å²	83	46.2 Å²	46.2	36%	0.361	24%	0.238	S	C	.	.	H	α-helix	trans	-55.1	-53.3	172.5	-68.8	177.3	-175.9	174.6	0	110.7	M637 E685 R711 T712 L717 Q718 E719	M637-K715 HydrophobicContact CE-CB 4.27Å; E685-K715 IonicContact OE1-NZ 3.54Å; E685-K715 PolarHBondContact OE1-NZ 2.94Å; R711-K715 PolarHBondContact O-N 3.47Å; T712-K715 PolarHBondContact O-N 3.21Å; K715-L717 PolarHBondContact O-N 3.35Å; K715-Q718 WeakPolarHBondContact O-CB 3.38Å; K715-Q718 PolarHBondContact O-N 2.95Å; K715-Q718 VanDerWaalsContact O-N 3.09Å; K715-E719 PolarHBondContact O-N 3.37Å
716	A	84.7	Confident	80.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-40	-179.5	0	0	0	0	0	114	L634 M637 N652 F654 T712 A720	L634-A716 HydrophobicContact CD2-CB 4.09Å; M637-A716 HydrophobicContact CE-CB 3.91Å; N652-A716 WeakPolarHBondContact ND2-CA 3.44Å; N652-A716 PolarHBondContact ND2-O 3.11Å; N652-A716 VanDerWaalsContact ND2-O 3.08Å; F654-A716 HydrophobicContact CD2-CB 4.45Å; T712-A716 PolarHBondContact O-N 2.83Å; T712-A716 VanDerWaalsContact O-N 3.13Å; A716-A720 PolarHBondContact O-N 3.17Å; A716-A720 VanDerWaalsContact O-N 3.09Å
717	L	89.6	Confident	83.1	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-75.5	-27.4	176.9	-66.9	175.7	0	0	0	112.9	F654 L670 L709 R713 T714 K715 A720 M721 L736 V741	F654-L717 HydrophobicContact CB-CD2 4.03Å; F654-L717 HydrophobicContact CD1-CD2 3.69Å; F654-L717 HydrophobicContact CD2-CD2 4.48Å; F654-L717 HydrophobicContact CE1-CD2 4.28Å; F654-L717 HydrophobicContact CG-CD2 3.82Å; L670-L717 HydrophobicContact CD2-CD1 4.11Å; L670-L717 HydrophobicContact CD2-CD2 3.84Å; L709-L717 HydrophobicContact CD1-CD1 4.1Å; L709-L717 HydrophobicContact CD2-CD1 4.43Å; R713-L717 HydrophobicContact CG-CD1 4.01Å; R713-L717 HydrophobicContact CG-CG 4.38Å; R713-L717 WeakPolarHBondContact O-CB 3.37Å; R713-L717 WeakPolarHBondContact O-CG 3.47Å; R713-L717 PolarHBondContact O-N 3.37Å; T714-L717 PolarHBondContact O-N 3.07Å; K715-L717 PolarHBondContact O-N 3.35Å; L717-A720 PolarHBondContact O-N 2.89Å; L717-M721 WeakPolarHBondContact O-CB 3.2Å; L717-M721 PolarHBondContact O-N 2.94Å; L717-L736 HydrophobicContact CB-CD2 4.47Å; L717-L736 HydrophobicContact CD2-CD2 3.87Å; L717-V741 HydrophobicContact CB-CG2 3.9Å
718	Q	89.4	Confident	85	Confident	28 Å²	28	34.1 Å²	34.1	13%	0.131	15%	0.153	C	C	.	.	H	α-helix	trans	-70.4	-38.9	173.3	-171.1	-176.6	-35.5	0	0	111.5	L193 T714 K715 M721 Y722 V741 K744	L193-Q718 HydrophobicContact CD1-CG 4.44Å; T714-Q718 WeakPolarHBondContact O-CB 3.14Å; T714-Q718 PolarHBondContact O-N 3.23Å; K715-Q718 WeakPolarHBondContact O-CB 3.38Å; K715-Q718 PolarHBondContact O-N 2.95Å; K715-Q718 VanDerWaalsContact O-N 3.09Å; Q718-M721 PolarHBondContact O-N 2.88Å; Q718-Y722 PolarHBondContact O-N 3.33Å; Q718-V741 HydrophobicContact CB-CG1 4.11Å; Q718-V741 HydrophobicContact CG-CG1 4.5Å; Q718-K744 VanDerWaalsContact NE2-CE 3.32Å
719	E	88.4	Confident	86.6	Confident	54 Å²	54	24.2 Å²	24.2	25%	0.252	12%	0.116	S	C	.	.	H	α-helix	trans	-60.5	-48.1	168.5	-70.3	156.3	-161.3	0	0	111.1	N652 K715 M721 Y722 Y723	N652-E719 PolarHBondContact ND2-OE2 2.9Å; K715-E719 PolarHBondContact O-N 3.37Å; E719-M721 PolarHBondContact O-N 3.23Å; E719-Y722 WeakPolarHBondContact O-CB 3.17Å; E719-Y722 PolarHBondContact O-N 3.38Å; E719-Y723 HydrophobicContact CB-CE2 4.42Å; E719-Y723 WeakPolarHBondContact O-CD2 3.37Å; E719-Y723 PolarHBondContact O-N 3.27Å
720	A	91	Very high	87.6	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.5	-36.4	176.3	0	0	0	0	0	112.7	F654 A658 A716 L717 S724 L736	F654-A720 HydrophobicContact CB-CB 3.98Å; A658-A720 HydrophobicContact CB-CB 3.86Å; A658-A720 VanDerWaalsContact CB-O 3.28Å; A658-A720 WeakPolarHBondContact CB-O 3.29Å; A716-A720 PolarHBondContact O-N 3.17Å; A716-A720 VanDerWaalsContact O-N 3.09Å; L717-A720 PolarHBondContact O-N 2.89Å; A720-S724 WeakPolarHBondContact O-CB 3.29Å; A720-S724 PolarHBondContact O-N 3.44Å; A720-S724 VanDerWaalsContact O-N 3.07Å; A720-S724 PolarHBondContact O-OG 3.15Å; A720-L736 HydrophobicContact CB-CD1 4.08Å
721	M	92.4	Very high	88.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-70.3	-35.6	175.4	-164.5	173.2	59.4	0	0	112.6	L717 Q718 E719 S724 A725 T733 L736 V741 P742 W743 I747	L717-M721 WeakPolarHBondContact O-CB 3.2Å; L717-M721 PolarHBondContact O-N 2.94Å; Q718-M721 PolarHBondContact O-N 2.88Å; E719-M721 PolarHBondContact O-N 3.23Å; M721-S724 WeakPolarHBondContact CA-OG 3.12Å; M721-S724 PolarHBondContact O-OG 3.28Å; M721-A725 WeakPolarHBondContact O-CB 3.22Å; M721-A725 PolarHBondContact O-N 2.8Å; M721-A725 VanDerWaalsContact O-N 3.07Å; M721-T733 HydrophobicContact CG-CG2 4.46Å; M721-L736 HydrophobicContact CB-CB 4.29Å; M721-L736 HydrophobicContact CB-CD1 3.82Å; M721-L736 HydrophobicContact CG-CB 4.21Å; M721-L736 HydrophobicContact CG-CD1 4.34Å; M721-L736 HydrophobicContact SD-CB 4.22Å; M721-V741 HydrophobicContact CE-CB 4.26Å; M721-V741 HydrophobicContact CE-CG1 3.51Å; M721-V741 HydrophobicContact SD-CB 4.26Å; M721-V741 HydrophobicContact SD-CG1 4.05Å; M721-P742 VanDerWaalsContact CE-O 3.26Å; M721-P742 WeakPolarHBondContact CE-O 3.29Å; M721-W743 HydrophobicContact SD-CZ3 4.44Å; M721-I747 HydrophobicContact CE-CD1 4.08Å; M721-I747 HydrophobicContact CE-CG2 4.34Å; M721-I747 HydrophobicContact CG-CG2 3.93Å
722	Y	91.9	Very high	89	Confident	4 Å²	4	19.8 Å²	19.8	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-53.2	172.9	172	-97	0	0	0	111.5	G192 L193 R195 K197 Q718 E719 S724 A725 E726 H746 I747	G192-Y722 WeakPolarHBondContact O-CE2 3.47Å; G192-Y722 PolarHBondContact O-OH 3.24Å; G192-Y722 VanDerWaalsContact O-OH 3.14Å; L193-Y722 HydrophobicContact CD2-CD1 4.25Å; L193-Y722 HydrophobicContact CD2-CD2 4.08Å; L193-Y722 HydrophobicContact CD2-CG 3.73Å; R195-Y722 PolarHBondContact O-OH 3Å; K197-Y722 HydrophobicContact CG-CE1 4.44Å; Q718-Y722 PolarHBondContact O-N 3.33Å; E719-Y722 WeakPolarHBondContact O-CB 3.17Å; E719-Y722 PolarHBondContact O-N 3.38Å; Y722-S724 PolarHBondContact O-N 2.91Å; Y722-A725 PolarHBondContact O-N 3.2Å; Y722-E726 HydrophobicContact CE1-CG 4.27Å; Y722-E726 HydrophobicContact CE2-CG 4.14Å; Y722-E726 PolarHBondContact O-N 3.39Å; Y722-H746 AromaticContact CD2-CD2 3.75Å; Y722-H746 AromaticContact CE2-CD2 3.42Å; Y722-H746 VanDerWaalsContact CE2-CD2 3.42Å; Y722-H746 WeakPolarHBondContact CE2-CD2 3.4Å; Y722-H746 AromaticContact CE2-NE2 3.55Å; Y722-I747 HydrophobicContact CD2-CG1 4.17Å
723	Y	91.5	Very high	89.9	Confident	30 Å²	30	18.2 Å²	18.2	12%	0.118	9%	0.088	C	C	.	.	H	α-helix	trans	-65.3	-37.5	-178.1	-67	-67.7	0	0	0	112.9	K197 M651 A659 E719 H727	K197-Y723 VanDerWaalsContact NZ-CD1 3.31Å; K197-Y723 VanDerWaalsContact NZ-CE1 3.31Å; M651-Y723 HydrophobicContact CE-CD1 3.44Å; M651-Y723 VanDerWaalsContact CE-CD1 3.44Å; M651-Y723 HydrophobicContact CE-CD2 3.82Å; M651-Y723 HydrophobicContact CE-CE1 3.31Å; M651-Y723 HydrophobicContact CE-CE2 3.72Å; M651-Y723 HydrophobicContact CE-CG 3.68Å; M651-Y723 VanDerWaalsContact CE-CZ 3.44Å; M651-Y723 HydrophobicContact CG-CE2 4.05Å; A659-Y723 HydrophobicContact CB-CG 4.49Å; E719-Y723 HydrophobicContact CB-CE2 4.42Å; E719-Y723 WeakPolarHBondContact O-CD2 3.37Å; E719-Y723 PolarHBondContact O-N 3.27Å; Y723-H727 WeakPolarHBondContact O-CB 3.42Å; Y723-H727 PolarHBondContact O-N 3.01Å
724	S	93.3	Very high	90.4	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-68.5	-31.5	174.8	46.4	0	0	0	0	113.2	A720 M721 Y722 G728 Y729 T733	A720-S724 WeakPolarHBondContact O-CB 3.29Å; A720-S724 PolarHBondContact O-N 3.44Å; A720-S724 VanDerWaalsContact O-N 3.07Å; A720-S724 PolarHBondContact O-OG 3.15Å; M721-S724 WeakPolarHBondContact CA-OG 3.12Å; M721-S724 PolarHBondContact O-OG 3.28Å; Y722-S724 PolarHBondContact O-N 2.91Å; S724-G728 PolarHBondContact O-N 3.08Å; S724-Y729 WeakPolarHBondContact O-CA 3.47Å; S724-Y729 PolarHBondContact O-N 2.8Å; S724-T733 WeakPolarHBondContact OG-CG2 3.3Å
725	A	92.6	Very high	90.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-69.8	-52.7	173.6	0	0	0	0	0	111.9	M721 Y722 H727 G728 T733 I747	M721-A725 WeakPolarHBondContact O-CB 3.22Å; M721-A725 PolarHBondContact O-N 2.8Å; M721-A725 VanDerWaalsContact O-N 3.07Å; Y722-A725 PolarHBondContact O-N 3.2Å; A725-H727 PolarHBondContact O-N 3.41Å; A725-G728 PolarHBondContact O-N 2.79Å; A725-T733 HydrophobicContact CB-CG2 3.77Å; A725-T733 VanDerWaalsContact N-CG2 3.28Å; A725-I747 HydrophobicContact CB-CB 4.38Å; A725-I747 HydrophobicContact CB-CG2 3.59Å
726	E	90.6	Very high	91.2	Very high	12 Å²	12	15.7 Å²	15.7	6%	0.056	8%	0.077	C	C	.	.	H	α-helix	trans	-55.8	-38.6	178.3	-83.7	-79.1	97.1	0	0	112.3	K197 G208 Y722 G728 H746	K197-E726 VanDerWaalsContact CB-OE2 3.3Å; K197-E726 WeakPolarHBondContact CB-OE2 3.35Å; K197-E726 VanDerWaalsContact CG-OE2 3.3Å; K197-E726 WeakPolarHBondContact CG-OE2 3.46Å; K197-E726 PolarHBondContact N-OE2 3.22Å; G208-E726 VanDerWaalsContact CA-O 3.25Å; G208-E726 WeakPolarHBondContact CA-O 3.29Å; Y722-E726 HydrophobicContact CE1-CG 4.27Å; Y722-E726 HydrophobicContact CE2-CG 4.14Å; Y722-E726 PolarHBondContact O-N 3.39Å; E726-G728 VanDerWaalsContact C-N 3.32Å; E726-H746 IonicContact OE1-CE1 2.76Å; E726-H746 PolarHBondContact OE1-CE1 2.76Å; E726-H746 IonicContact OE1-NE2 2.77Å; E726-H746 PolarHBondContact OE1-NE2 3.41Å
727	H	91.2	Very high	91.5	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.009	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	5.8	179.8	-53.7	176.3	0	0	0	113	K197 F211 R212 A659 Y723 A725 Y729	K197-H727 PolarHBondContact NZ-NE2 3.35Å; F211-H727 AromaticContact CD1-CE1 3.28Å; F211-H727 WeakPolarHBondContact CD1-CE1 3.45Å; F211-H727 AromaticContact CD1-CG 3.77Å; F211-H727 AromaticContact CD1-ND1 3.13Å; F211-H727 WeakPolarHBondContact CD1-ND1 3.38Å; F211-H727 AromaticContact CD1-NE2 3.97Å; F211-H727 AromaticContact CD2-CE1 3.7Å; F211-H727 AromaticContact CE1-CE1 3.43Å; F211-H727 VanDerWaalsContact CE1-CE1 3.43Å; F211-H727 WeakPolarHBondContact CE1-CE1 3.04Å; F211-H727 AromaticContact CE1-ND1 3.34Å; F211-H727 VanDerWaalsContact CE1-ND1 3.34Å; F211-H727 WeakPolarHBondContact CE1-ND1 3.23Å; F211-H727 AromaticContact CE2-CE1 3.82Å; F211-H727 AromaticContact CG-CE1 3.44Å; F211-H727 VanDerWaalsContact CG-CE1 3.44Å; F211-H727 WeakPolarHBondContact CG-CE1 3.33Å; F211-H727 AromaticContact CG-ND1 3.74Å; F211-H727 AromaticContact CG-NE2 3.74Å; F211-H727 AromaticContact CZ-CE1 3.7Å; R212-H727 WeakPolarHBondContact CD-O 3.29Å; R212-H727 WeakPolarHBondContact CG-O 3.36Å; R212-H727 PolarHBondContact NH1-O 2.73Å; A659-H727 PolarHBondContact O-ND1 3.46Å; Y723-H727 WeakPolarHBondContact O-CB 3.42Å; Y723-H727 PolarHBondContact O-N 3.01Å; A725-H727 PolarHBondContact O-N 3.41Å; H727-Y729 HydrophobicContact CB-CD2 3.81Å; H727-Y729 HydrophobicContact CB-CE2 3.78Å; H727-Y729 PolarHBondContact O-N 3.09Å
728	G	90.3	Very high	91.5	Very high	9 Å²	9	22.7 Å²	22.7	9%	0.093	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	17.8	172.9	0	0	0	0	0	116.6	S724 A725 E726 V730	S724-G728 PolarHBondContact O-N 3.08Å; A725-G728 PolarHBondContact O-N 2.79Å; E726-G728 VanDerWaalsContact C-N 3.32Å; G728-V730 VanDerWaalsContact C-N 3.28Å; G728-V730 PolarHBondContact O-N 2.78Å; G728-V730 VanDerWaalsContact O-N 3.08Å
729	Y	92.8	Very high	91.4	Very high	27 Å²	27	25.1 Å²	25.1	11%	0.106	14%	0.135	C	C	.	.			trans	-83.7	63.6	175.9	-63.9	-72.1	0	0	0	112.1	R212 A659 G661 S724 H727 D731 I732 T733	R212-Y729 VanDerWaalsContact NH1-CD1 3.26Å; A659-Y729 VanDerWaalsContact O-CE2 3.29Å; A659-Y729 WeakPolarHBondContact O-CE2 3.35Å; G661-Y729 VanDerWaalsContact CA-CE1 3.47Å; S724-Y729 WeakPolarHBondContact O-CA 3.47Å; S724-Y729 PolarHBondContact O-N 2.8Å; H727-Y729 HydrophobicContact CB-CD2 3.81Å; H727-Y729 HydrophobicContact CB-CE2 3.78Å; H727-Y729 PolarHBondContact O-N 3.09Å; Y729-D731 PolarHBondContact O-N 2.95Å; Y729-D731 VanDerWaalsContact O-N 3.14Å; Y729-I732 WeakPolarHBondContact O-CB 3.43Å; Y729-I732 PolarHBondContact O-N 3.18Å; Y729-T733 PolarHBondContact O-N 3.18Å
730	V	91.6	Very high	91.2	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.012	15%	0.146	C	C	.	.	H	α-helix	trans	-56.3	-32.4	-174.2	-171.4	0	0	0	0	113.8	G728 I732 T733 M734 T754 V763	G728-V730 VanDerWaalsContact C-N 3.28Å; G728-V730 PolarHBondContact O-N 2.78Å; G728-V730 VanDerWaalsContact O-N 3.08Å; V730-I732 VanDerWaalsContact C-N 3.26Å; V730-I732 PolarHBondContact O-N 3.24Å; V730-T733 PolarHBondContact O-N 3.04Å; V730-T733 PolarHBondContact O-OG1 3.35Å; V730-M734 HydrophobicContact CG1-CG 4.12Å; V730-M734 WeakPolarHBondContact O-CB 3.21Å; V730-M734 VanDerWaalsContact O-CG 3.28Å; V730-M734 WeakPolarHBondContact O-CG 3.27Å; V730-M734 PolarHBondContact O-N 3.4Å; V730-T754 WeakPolarHBondContact CG2-OG1 3.44Å; V730-V763 HydrophobicContact CG1-CG1 3.79Å
731	D	91.3	Very high	91.1	Very high	68 Å²	68	24.8 Å²	24.8	36%	0.364	15%	0.146	S	C	.	.	H	α-helix	trans	-66	-28.9	176.3	-67	-66.2	0	0	0	113	Y729 E735 R760	Y729-D731 PolarHBondContact O-N 2.95Å; Y729-D731 VanDerWaalsContact O-N 3.14Å; D731-E735 WeakPolarHBondContact O-CG 3.43Å; D731-E735 PolarHBondContact O-N 3.21Å; D731-R760 VanDerWaalsContact CG-NH1 3.3Å; D731-R760 IonicContact OD1-CZ 2.77Å; D731-R760 IonicContact OD1-NH1 2.66Å; D731-R760 PolarHBondContact OD1-NH1 3.45Å; D731-R760 IonicContact OD1-NH2 3.81Å; D731-R760 PolarHBondContact OD1-NH2 2.92Å; D731-R760 IonicContact OD2-CZ 3.6Å; D731-R760 IonicContact OD2-NH1 3.4Å; D731-R760 PolarHBondContact OD2-NH1 3.5Å; D731-R760 IonicContact OD2-NH2 3.99Å
732	I	93.1	Very high	90.9	Very high	4 Å²	4	27.5 Å²	27.5	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-77.5	-43.4	174.9	-66	179.8	0	0	0	110.1	A658 R663 L666 Y729 V730 M734 E735 L736	A658-I732 HydrophobicContact CB-CG2 3.97Å; R663-I732 HydrophobicContact CB-CD1 4.15Å; R663-I732 HydrophobicContact CB-CG1 4.08Å; R663-I732 HydrophobicContact CG-CG1 4.43Å; L666-I732 HydrophobicContact CD2-CG2 3.49Å; L666-I732 VanDerWaalsContact CD2-CG2 3.49Å; Y729-I732 WeakPolarHBondContact O-CB 3.43Å; Y729-I732 PolarHBondContact O-N 3.18Å; V730-I732 VanDerWaalsContact C-N 3.26Å; V730-I732 PolarHBondContact O-N 3.24Å; I732-M734 VanDerWaalsContact C-N 3.33Å; I732-M734 PolarHBondContact O-N 2.94Å; I732-E735 PolarHBondContact O-N 3.43Å; I732-L736 HydrophobicContact CG2-CD1 3.89Å; I732-L736 HydrophobicContact CG2-CG 4.32Å; I732-L736 WeakPolarHBondContact O-CG 3.47Å; I732-L736 PolarHBondContact O-N 2.65Å
733	T	93.4	Very high	90.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.9	-42.4	178.8	66.6	0	0	0	0	111.4	M721 S724 A725 Y729 V730 E735 L736 R737	M721-T733 HydrophobicContact CG-CG2 4.46Å; S724-T733 WeakPolarHBondContact OG-CG2 3.3Å; A725-T733 HydrophobicContact CB-CG2 3.77Å; A725-T733 VanDerWaalsContact N-CG2 3.28Å; Y729-T733 PolarHBondContact O-N 3.18Å; V730-T733 PolarHBondContact O-N 3.04Å; V730-T733 PolarHBondContact O-OG1 3.35Å; T733-E735 PolarHBondContact O-N 3.4Å; T733-L736 PolarHBondContact O-N 3.21Å; T733-R737 WeakPolarHBondContact O-CB 3.2Å; T733-R737 PolarHBondContact O-N 3.11Å
734	M	92.9	Very high	90.6	Very high	41 Å²	41	29 Å²	29	20%	0.202	17%	0.171	C	C	.	.	H	α-helix	trans	-67.7	-31.2	176.9	-66.8	-60	-61.9	0	0	113.1	V730 I732 A738 W743 V763 L767	V730-M734 HydrophobicContact CG1-CG 4.12Å; V730-M734 WeakPolarHBondContact O-CB 3.21Å; V730-M734 VanDerWaalsContact O-CG 3.28Å; V730-M734 WeakPolarHBondContact O-CG 3.27Å; V730-M734 PolarHBondContact O-N 3.4Å; I732-M734 VanDerWaalsContact C-N 3.33Å; I732-M734 PolarHBondContact O-N 2.94Å; M734-A738 WeakPolarHBondContact O-CB 3.46Å; M734-A738 PolarHBondContact O-N 3.09Å; M734-W743 HydrophobicContact SD-CH2 4.09Å; M734-W743 HydrophobicContact SD-CZ2 4.06Å; M734-V763 HydrophobicContact CE-CG1 4.48Å; M734-V763 HydrophobicContact CG-CG1 3.94Å; M734-V763 HydrophobicContact SD-CG1 4.08Å; M734-L767 HydrophobicContact SD-CD2 3.71Å; M734-L767 HydrophobicContact SD-CG 4.12Å
735	E	91.6	Very high	90.3	Very high	48 Å²	48	29.2 Å²	29.2	22%	0.224	17%	0.172	C	C	.	.	H	α-helix	trans	-72.7	-41.8	172.7	-83.1	179.1	-153.8	0	0	112.5	R663 R667 D731 I732 T733 R737 A738 L739	R663-E735 IonicContact CZ-OE1 3.99Å; R663-E735 IonicContact NE-OE1 2.72Å; R663-E735 PolarHBondContact NE-OE1 2.81Å; R663-E735 IonicContact NE-OE2 3.27Å; R663-E735 PolarHBondContact NE-OE2 3.31Å; R663-E735 IonicContact NH2-OE1 3.69Å; R663-E735 PolarHBondContact NH2-OE1 2.67Å; R667-E735 IonicContact CZ-OE1 3.72Å; R667-E735 IonicContact CZ-OE2 2.7Å; R667-E735 VanDerWaalsContact CZ-OE2 3.28Å; R667-E735 IonicContact NE-OE1 2.75Å; R667-E735 IonicContact NE-OE2 3.21Å; R667-E735 PolarHBondContact NE-OE2 3.4Å; R667-E735 IonicContact NH2-OE1 2.74Å; R667-E735 PolarHBondContact NH2-OE1 3.06Å; R667-E735 IonicContact NH2-OE2 2.82Å; R667-E735 PolarHBondContact NH2-OE2 2.71Å; D731-E735 WeakPolarHBondContact O-CG 3.43Å; D731-E735 PolarHBondContact O-N 3.21Å; I732-E735 PolarHBondContact O-N 3.43Å; T733-E735 PolarHBondContact O-N 3.4Å; E735-R737 VanDerWaalsContact C-N 3.3Å; E735-R737 PolarHBondContact O-N 3.41Å; E735-A738 PolarHBondContact O-N 2.93Å; E735-A738 VanDerWaalsContact O-N 3.17Å; E735-L739 WeakPolarHBondContact O-CG 3.25Å; E735-L739 PolarHBondContact O-N 3.05Å; E735-L739 VanDerWaalsContact O-N 3.16Å
736	L	90.9	Very high	90.1	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-62.2	-39.6	173.4	-68.7	172.5	0	0	0	111.2	L666 L717 A720 M721 I732 T733 L739 V741	L666-L736 HydrophobicContact CD2-CD2 4.22Å; L666-L736 HydrophobicContact CD2-CG 4.39Å; L717-L736 HydrophobicContact CB-CD2 4.47Å; L717-L736 HydrophobicContact CD2-CD2 3.87Å; A720-L736 HydrophobicContact CB-CD1 4.08Å; M721-L736 HydrophobicContact CB-CB 4.29Å; M721-L736 HydrophobicContact CB-CD1 3.82Å; M721-L736 HydrophobicContact CG-CB 4.21Å; M721-L736 HydrophobicContact CG-CD1 4.34Å; M721-L736 HydrophobicContact SD-CB 4.22Å; I732-L736 HydrophobicContact CG2-CD1 3.89Å; I732-L736 HydrophobicContact CG2-CG 4.32Å; I732-L736 WeakPolarHBondContact O-CG 3.47Å; I732-L736 PolarHBondContact O-N 2.65Å; T733-L736 PolarHBondContact O-N 3.21Å; L736-L739 HydrophobicContact CD2-CD1 4.46Å; L736-L739 PolarHBondContact O-N 3.36Å; L736-V741 WeakPolarHBondContact O-CB 3.32Å; L736-V741 VanDerWaalsContact O-CG2 3.27Å; L736-V741 WeakPolarHBondContact O-CG2 3.36Å; L736-V741 PolarHBondContact O-N 3.03Å
737	R	91.8	Very high	90.2	Very high	59 Å²	59	28.7 Å²	28.7	22%	0.223	17%	0.17	C	C	.	.	H	α-helix	trans	-60.4	-43.9	171.3	175.8	57.8	-175.2	152.3	-1.9	112.5	T733 E735 L739 G740 V741 W743 D770	T733-R737 WeakPolarHBondContact O-CB 3.2Å; T733-R737 PolarHBondContact O-N 3.11Å; E735-R737 VanDerWaalsContact C-N 3.3Å; E735-R737 PolarHBondContact O-N 3.41Å; R737-L739 PolarHBondContact O-N 3.24Å; R737-G740 PolarHBondContact O-N 3.31Å; R737-V741 WeakPolarHBondContact CD-O 3.32Å; R737-V741 PolarHBondContact NH1-O 3.4Å; R737-W743 HydrophobicContact CB-CH2 4.33Å; R737-W743 HydrophobicContact CB-CZ2 3.91Å; R737-W743 HydrophobicContact CG-CZ2 3.63Å; R737-W743 VanDerWaalsContact NE-NE1 3.15Å; R737-D770 IonicContact CZ-OD2 3.3Å; R737-D770 IonicContact NE-OD2 2.67Å; R737-D770 PolarHBondContact NE-OD2 3Å; R737-D770 IonicContact NH2-OD2 3Å; R737-D770 PolarHBondContact NH2-OD2 3.36Å; R737-D770 VanDerWaalsContact NH2-OD2 3.15Å
738	A	89.9	Confident	90.3	Very high	88 Å²	88	28.6 Å²	28.6	73%	0.727	17%	0.169	S	C	*	.	H	α-helix	trans	-64.3	-22.4	178.3	0	0	0	0	0	113.5	M734 E735 G740	M734-A738 WeakPolarHBondContact O-CB 3.46Å; M734-A738 PolarHBondContact O-N 3.09Å; E735-A738 PolarHBondContact O-N 2.93Å; E735-A738 VanDerWaalsContact O-N 3.17Å; A738-G740 PolarHBondContact O-N 2.59Å
739	L	86.8	Confident	90.3	Very high	78 Å²	78	28.2 Å²	28.2	41%	0.408	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	1.5	172.2	-64.3	168.4	0	0	0	113.7	L670 E735 L736 R737	L670-L739 HydrophobicContact CD1-CD1 3.59Å; L670-L739 HydrophobicContact CD2-CD1 4.15Å; E735-L739 WeakPolarHBondContact O-CG 3.25Å; E735-L739 PolarHBondContact O-N 3.05Å; E735-L739 VanDerWaalsContact O-N 3.16Å; L736-L739 HydrophobicContact CD2-CD1 4.46Å; L736-L739 PolarHBondContact O-N 3.36Å; R737-L739 PolarHBondContact O-N 3.24Å
740	G	84.9	Confident	90.2	Very high	47 Å²	47	27.8 Å²	27.8	49%	0.485	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	7.3	176.3	0	0	0	0	0	115.3	R737 A738	R737-G740 PolarHBondContact O-N 3.31Å; A738-G740 PolarHBondContact O-N 2.59Å
741	V	88.3	Confident	90.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-64.6	132.8	174.7	-173	0	0	0	0	109.3	L709 L717 Q718 M721 L736 R737	L709-V741 HydrophobicContact CD1-CG2 4.5Å; L717-V741 HydrophobicContact CB-CG2 3.9Å; Q718-V741 HydrophobicContact CB-CG1 4.11Å; Q718-V741 HydrophobicContact CG-CG1 4.5Å; M721-V741 HydrophobicContact CE-CB 4.26Å; M721-V741 HydrophobicContact CE-CG1 3.51Å; M721-V741 HydrophobicContact SD-CB 4.26Å; M721-V741 HydrophobicContact SD-CG1 4.05Å; L736-V741 WeakPolarHBondContact O-CB 3.32Å; L736-V741 VanDerWaalsContact O-CG2 3.27Å; L736-V741 WeakPolarHBondContact O-CG2 3.36Å; L736-V741 PolarHBondContact O-N 3.03Å; R737-V741 WeakPolarHBondContact CD-O 3.32Å; R737-V741 PolarHBondContact NH1-O 3.4Å
742	P	87.8	Confident	90.4	Very high	58 Å²	58	24.5 Å²	24.5	38%	0.377	15%	0.146	S	C	.	.	P	Polyproline II helix	trans	-76.5	142.3	-179.4	30.6	-34.9	0	0	0	111.4	M721	M721-P742 VanDerWaalsContact CE-O 3.26Å; M721-P742 WeakPolarHBondContact CE-O 3.29Å
743	W	88.4	Confident	90.3	Very high	8 Å²	8	27.8 Å²	27.8	3%	0.03	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-62.4	143.4	173.6	-73.2	114.7	0	0	0	111.3	M721 M734 R737 I747 W748 L767 D770 I774	M721-W743 HydrophobicContact SD-CZ3 4.44Å; M734-W743 HydrophobicContact SD-CH2 4.09Å; M734-W743 HydrophobicContact SD-CZ2 4.06Å; R737-W743 HydrophobicContact CB-CH2 4.33Å; R737-W743 HydrophobicContact CB-CZ2 3.91Å; R737-W743 HydrophobicContact CG-CZ2 3.63Å; R737-W743 VanDerWaalsContact NE-NE1 3.15Å; W743-I747 HydrophobicContact CE3-CG2 4.14Å; W743-I747 HydrophobicContact CZ3-CG2 3.97Å; W743-W748 HydrophobicContact CD2-CB 4.33Å; W743-W748 HydrophobicContact CE3-CB 4.03Å; W743-L767 HydrophobicContact CH2-CD2 3.49Å; W743-L767 VanDerWaalsContact CH2-CD2 3.49Å; W743-L767 HydrophobicContact CZ2-CD2 3.42Å; W743-L767 VanDerWaalsContact CZ2-CD2 3.42Å; W743-L767 HydrophobicContact CZ3-CD2 4.36Å; W743-D770 PolarHBondContact NE1-OD2 2.97Å; W743-I774 HydrophobicContact CB-CD1 4.39Å; W743-I774 HydrophobicContact CB-CG1 4.03Å
744	K	88.3	Confident	90.2	Very high	56 Å²	56	28.5 Å²	28.5	24%	0.243	16%	0.163	C	C	.	.			trans	-107.9	144.6	155	-68	-58.8	179.8	-173.1	0	108.9	Q718 H746 I747 W748 E778	Q718-K744 VanDerWaalsContact NE2-CE 3.32Å; K744-H746 PolarHBondContact O-N 2.98Å; K744-I747 HydrophobicContact CB-CD1 3.91Å; K744-I747 HydrophobicContact CB-CG1 4.05Å; K744-I747 HydrophobicContact CG-CD1 4.39Å; K744-I747 WeakPolarHBondContact O-CB 3.3Å; K744-I747 PolarHBondContact O-N 3.23Å; K744-W748 PolarHBondContact O-N 3.5Å; K744-E778 WeakPolarHBondContact CD-OE2 3.21Å; K744-E778 VanDerWaalsContact NZ-CD 3.29Å; K744-E778 IonicContact NZ-OE1 3.42Å; K744-E778 PolarHBondContact NZ-OE1 3.08Å; K744-E778 IonicContact NZ-OE2 2.87Å; K744-E778 PolarHBondContact NZ-OE2 3.15Å
745	L	88.1	Confident	90.1	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-52.5	-49.9	-171.7	-179.7	54.6	0	0	0	113.3	I747 W748 I749 I774 E778 Y779 N780 L783	L745-I747 PolarHBondContact O-N 3.5Å; L745-W748 HydrophobicContact CD1-CE3 4.49Å; L745-W748 WeakPolarHBondContact O-CB 3.33Å; L745-W748 PolarHBondContact O-N 3.41Å; L745-I749 HydrophobicContact CD1-CD1 4.01Å; L745-I749 HydrophobicContact CD1-CG1 4.22Å; L745-I749 HydrophobicContact CG-CD1 4.06Å; L745-I749 WeakPolarHBondContact O-CG1 3.44Å; L745-I749 PolarHBondContact O-N 2.67Å; L745-I774 HydrophobicContact CB-CG2 4.43Å; L745-I774 HydrophobicContact CD1-CD1 4.27Å; L745-I774 HydrophobicContact CD1-CG2 4.45Å; L745-E778 WeakPolarHBondContact CD2-O 3.33Å; L745-Y779 HydrophobicContact CD2-CD1 4.29Å; L745-N780 HydrophobicContact CD2-CB 4.28Å; L745-N780 VanDerWaalsContact CD2-OD1 3.24Å; L745-N780 WeakPolarHBondContact CD2-OD1 3.49Å; L745-L783 HydrophobicContact CD1-CB 4.33Å; L745-L783 HydrophobicContact CD1-CD1 4.34Å; L745-L783 HydrophobicContact CD1-CD2 4.3Å; L745-L783 HydrophobicContact CD2-CB 3.95Å; L745-L783 HydrophobicContact CD2-CD2 4.23Å; L745-L783 HydrophobicContact CG-CB 4.43Å
746	H	89.2	Confident	90	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.009	15%	0.152	C	C	.	.	H	α-helix	trans	-56.2	-49.4	175.6	169.2	61.5	0	0	0	112.7	G196 Y722 E726 K744 W748 I749 E750 E782	G196-H746 WeakPolarHBondContact CA-CE1 3.37Å; G196-H746 WeakPolarHBondContact CA-NE2 3.3Å; G196-H746 PolarHBondContact N-CE1 2.97Å; G196-H746 PolarHBondContact N-ND1 3.36Å; Y722-H746 AromaticContact CD2-CD2 3.75Å; Y722-H746 AromaticContact CE2-CD2 3.42Å; Y722-H746 VanDerWaalsContact CE2-CD2 3.42Å; Y722-H746 WeakPolarHBondContact CE2-CD2 3.4Å; Y722-H746 AromaticContact CE2-NE2 3.55Å; E726-H746 IonicContact OE1-CE1 2.76Å; E726-H746 PolarHBondContact OE1-CE1 2.76Å; E726-H746 IonicContact OE1-NE2 2.77Å; E726-H746 PolarHBondContact OE1-NE2 3.41Å; K744-H746 PolarHBondContact O-N 2.98Å; H746-W748 VanDerWaalsContact C-N 3.26Å; H746-W748 PolarHBondContact O-N 3.24Å; H746-I749 PolarHBondContact O-N 2.97Å; H746-E750 PolarHBondContact O-N 3.31Å; H746-E782 VanDerWaalsContact CB-OE2 3.31Å; H746-E782 WeakPolarHBondContact CB-OE2 3.5Å; H746-E782 IonicContact CE1-OE1 3.11Å; H746-E782 IonicContact CG-OE1 2.81Å; H746-E782 IonicContact CG-OE2 2.63Å; H746-E782 IonicContact ND1-OE1 3.18Å; H746-E782 PolarHBondContact ND1-OE1 3.22Å; H746-E782 IonicContact ND1-OE2 2.7Å; H746-E782 PolarHBondContact ND1-OE2 3.18Å
747	I	91.1	Very high	89.8	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.8	-39.6	178.7	-54.6	-179.5	0	0	0	110.9	M721 Y722 A725 W743 K744 L745 S751	M721-I747 HydrophobicContact CE-CD1 4.08Å; M721-I747 HydrophobicContact CE-CG2 4.34Å; M721-I747 HydrophobicContact CG-CG2 3.93Å; Y722-I747 HydrophobicContact CD2-CG1 4.17Å; A725-I747 HydrophobicContact CB-CB 4.38Å; A725-I747 HydrophobicContact CB-CG2 3.59Å; W743-I747 HydrophobicContact CE3-CG2 4.14Å; W743-I747 HydrophobicContact CZ3-CG2 3.97Å; K744-I747 HydrophobicContact CB-CD1 3.91Å; K744-I747 HydrophobicContact CB-CG1 4.05Å; K744-I747 HydrophobicContact CG-CD1 4.39Å; K744-I747 WeakPolarHBondContact O-CB 3.3Å; K744-I747 PolarHBondContact O-N 3.23Å; L745-I747 PolarHBondContact O-N 3.5Å; I747-S751 VanDerWaalsContact O-CB 3.23Å; I747-S751 WeakPolarHBondContact O-CB 3.4Å; I747-S751 PolarHBondContact O-N 3.44Å; I747-S751 PolarHBondContact O-OG 3.34Å
748	W	92.9	Very high	89.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-68.7	-44.6	176.7	178.3	91.9	0	0	0	112.1	W743 K744 L745 H746 S751 L752 L767 L768 F771 I774 M791	W743-W748 HydrophobicContact CD2-CB 4.33Å; W743-W748 HydrophobicContact CE3-CB 4.03Å; K744-W748 PolarHBondContact O-N 3.5Å; L745-W748 HydrophobicContact CD1-CE3 4.49Å; L745-W748 WeakPolarHBondContact O-CB 3.33Å; L745-W748 PolarHBondContact O-N 3.41Å; H746-W748 VanDerWaalsContact C-N 3.26Å; H746-W748 PolarHBondContact O-N 3.24Å; W748-S751 PolarHBondContact O-N 2.91Å; W748-L752 HydrophobicContact CH2-CD2 3.54Å; W748-L752 HydrophobicContact CZ2-CD2 3.95Å; W748-L752 HydrophobicContact CZ3-CD2 3.97Å; W748-L752 WeakPolarHBondContact O-CB 3.34Å; W748-L752 PolarHBondContact O-N 3.45Å; W748-L767 PolarHBondContact NE1-O 3.39Å; W748-L768 HydrophobicContact CZ2-CD2 4.25Å; W748-F771 HydrophobicContact CD2-CD2 4.15Å; W748-F771 AromaticContact CE2-CD2 3.82Å; W748-F771 HydrophobicContact CE3-CD2 4.08Å; W748-F771 HydrophobicContact CE3-CE2 4.38Å; W748-F771 AromaticContact CH2-CD2 3.44Å; W748-F771 HydrophobicContact CH2-CD2 3.44Å; W748-F771 VanDerWaalsContact CH2-CD2 3.44Å; W748-F771 AromaticContact CH2-CE2 3.99Å; W748-F771 HydrophobicContact CH2-CE2 3.99Å; W748-F771 HydrophobicContact CH2-CG 4.31Å; W748-F771 HydrophobicContact CZ2-CB 3.88Å; W748-F771 AromaticContact CZ2-CD2 3.49Å; W748-F771 HydrophobicContact CZ2-CD2 3.49Å; W748-F771 VanDerWaalsContact CZ2-CD2 3.49Å; W748-F771 HydrophobicContact CZ2-CE2 4.45Å; W748-F771 HydrophobicContact CZ2-CG 4.08Å; W748-F771 AromaticContact CZ3-CD2 3.75Å; W748-F771 HydrophobicContact CZ3-CD2 3.75Å; W748-F771 AromaticContact CZ3-CE2 3.95Å; W748-F771 HydrophobicContact CZ3-CE2 3.95Å; W748-I774 HydrophobicContact CB-CD1 3.82Å; W748-I774 HydrophobicContact CD2-CD1 3.97Å; W748-I774 HydrophobicContact CE3-CD1 4.4Å; W748-I774 HydrophobicContact CG-CD1 3.68Å; W748-M791 HydrophobicContact CH2-SD 3.92Å
749	I	91.4	Very high	89.6	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.6	-48.4	177.2	-68.2	171.1	0	0	0	110.5	L745 H746 L752 R753 E782 L783 L790	L745-I749 HydrophobicContact CD1-CD1 4.01Å; L745-I749 HydrophobicContact CD1-CG1 4.22Å; L745-I749 HydrophobicContact CG-CD1 4.06Å; L745-I749 WeakPolarHBondContact O-CG1 3.44Å; L745-I749 PolarHBondContact O-N 2.67Å; H746-I749 PolarHBondContact O-N 2.97Å; I749-L752 PolarHBondContact O-N 3.31Å; I749-R753 WeakPolarHBondContact O-CB 3.5Å; I749-R753 PolarHBondContact O-N 3.36Å; I749-E782 HydrophobicContact CD1-CG 4.09Å; I749-L783 HydrophobicContact CD1-CB 4.24Å; I749-L790 HydrophobicContact CG2-CD2 4.49Å
750	E	91	Very high	89.7	Confident	19 Å²	19	29.4 Å²	29.4	9%	0.089	17%	0.167	C	C	.	.	H	α-helix	trans	-72.1	-34	-178.2	-164.3	57.2	-145.2	0	0	111.8	H746 L752 R753 T754	H746-E750 PolarHBondContact O-N 3.31Å; E750-L752 VanDerWaalsContact C-N 3.34Å; E750-L752 PolarHBondContact O-N 2.89Å; E750-R753 PolarHBondContact O-N 3.49Å; E750-R753 WeakPolarHBondContact OE2-CD 3.44Å; E750-R753 IonicContact OE2-CZ 3.76Å; E750-R753 IonicContact OE2-NE 2.74Å; E750-R753 IonicContact OE2-NH1 3.2Å; E750-R753 PolarHBondContact OE2-NH1 2.96Å; E750-T754 HydrophobicContact CG-CG2 4.43Å; E750-T754 WeakPolarHBondContact O-CB 3.49Å; E750-T754 WeakPolarHBondContact O-CG2 3.34Å; E750-T754 PolarHBondContact O-N 3.4Å; E750-T754 PolarHBondContact O-OG1 2.74Å
751	S	93.3	Very high	89.7	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.4	-37.4	170.3	-62.6	0	0	0	0	112.4	I747 W748 T754 S755 L767	I747-S751 VanDerWaalsContact O-CB 3.23Å; I747-S751 WeakPolarHBondContact O-CB 3.4Å; I747-S751 PolarHBondContact O-N 3.44Å; I747-S751 PolarHBondContact O-OG 3.34Å; W748-S751 PolarHBondContact O-N 2.91Å; S751-T754 WeakPolarHBondContact CA-OG1 3.45Å; S751-T754 PolarHBondContact O-OG1 3Å; S751-S755 VanDerWaalsContact O-CB 3.27Å; S751-S755 WeakPolarHBondContact O-CB 3.49Å; S751-S755 PolarHBondContact O-N 2.99Å; S751-S755 PolarHBondContact O-OG 2.84Å; S751-L767 WeakPolarHBondContact O-CD1 3.49Å
752	L	93.4	Very high	89.8	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-68.8	-42.3	174.8	-178.9	64.4	0	0	0	111	W748 I749 E750 S755 F756 V764 L767 L768 L790 M791 I794	W748-L752 HydrophobicContact CH2-CD2 3.54Å; W748-L752 HydrophobicContact CZ2-CD2 3.95Å; W748-L752 HydrophobicContact CZ3-CD2 3.97Å; W748-L752 WeakPolarHBondContact O-CB 3.34Å; W748-L752 PolarHBondContact O-N 3.45Å; I749-L752 PolarHBondContact O-N 3.31Å; E750-L752 VanDerWaalsContact C-N 3.34Å; E750-L752 PolarHBondContact O-N 2.89Å; L752-S755 PolarHBondContact O-OG 3.24Å; L752-F756 VanDerWaalsContact O-CB 3.22Å; L752-F756 WeakPolarHBondContact O-CB 3.44Å; L752-F756 PolarHBondContact O-N 2.99Å; L752-V764 HydrophobicContact CD1-CG1 3.93Å; L752-L767 HydrophobicContact CB-CD1 4.43Å; L752-L767 HydrophobicContact CD1-CB 4.43Å; L752-L768 HydrophobicContact CD1-CD2 4.07Å; L752-L768 HydrophobicContact CD1-CG 4.27Å; L752-L768 HydrophobicContact CD2-CD2 4.13Å; L752-L790 HydrophobicContact CB-CD2 4.13Å; L752-L790 HydrophobicContact CD2-CD2 3.98Å; L752-L790 HydrophobicContact CD2-CG 4.48Å; L752-L790 HydrophobicContact CG-CD2 3.91Å; L752-M791 HydrophobicContact CD2-CG 4.1Å; L752-I794 HydrophobicContact CD1-CD1 3.89Å; L752-I794 HydrophobicContact CD2-CD1 4.02Å; L752-I794 HydrophobicContact CG-CD1 3.85Å
753	R	91.7	Very high	89.9	Confident	73 Å²	73	34.4 Å²	34.4	28%	0.275	18%	0.18	S	C	.	.	H	α-helix	trans	-60.8	-50.3	177.8	178.5	174.4	-69.5	161.6	-8.8	112	I749 E750 F756 S757 E786 L790	I749-R753 WeakPolarHBondContact O-CB 3.5Å; I749-R753 PolarHBondContact O-N 3.36Å; E750-R753 PolarHBondContact O-N 3.49Å; E750-R753 WeakPolarHBondContact OE2-CD 3.44Å; E750-R753 IonicContact OE2-CZ 3.76Å; E750-R753 IonicContact OE2-NE 2.74Å; E750-R753 IonicContact OE2-NH1 3.2Å; E750-R753 PolarHBondContact OE2-NH1 2.96Å; R753-F756 PolarHBondContact O-N 3.41Å; R753-S757 PolarHBondContact O-N 3.01Å; R753-S757 PolarHBondContact O-OG 3.33Å; R753-E786 IonicContact CZ-OE2 2.86Å; R753-E786 IonicContact NH1-OE2 2.83Å; R753-E786 PolarHBondContact NH1-OE2 2.76Å; R753-E786 IonicContact NH2-OE2 3.38Å; R753-E786 PolarHBondContact NH2-OE2 3.32Å; R753-L790 HydrophobicContact CB-CD1 4.38Å; R753-L790 HydrophobicContact CB-CD2 3.83Å
754	T	89.7	Confident	90	Very high	15 Å²	15	34 Å²	34	9%	0.092	18%	0.179	C	C	.	.	H	α-helix	trans	-70.6	-39.6	-177.1	50	0	0	0	0	112.2	V730 E750 S751 S757 Q758	V730-T754 WeakPolarHBondContact CG2-OG1 3.44Å; E750-T754 HydrophobicContact CG-CG2 4.43Å; E750-T754 WeakPolarHBondContact O-CB 3.49Å; E750-T754 WeakPolarHBondContact O-CG2 3.34Å; E750-T754 PolarHBondContact O-N 3.4Å; E750-T754 PolarHBondContact O-OG1 2.74Å; S751-T754 WeakPolarHBondContact CA-OG1 3.45Å; S751-T754 PolarHBondContact O-OG1 3Å; T754-S757 PolarHBondContact O-OG 3.5Å; T754-S757 VanDerWaalsContact O-OG 3.07Å; T754-Q758 WeakPolarHBondContact O-CB 3.13Å; T754-Q758 VanDerWaalsContact O-CG 3.23Å; T754-Q758 WeakPolarHBondContact O-CG 3.11Å; T754-Q758 PolarHBondContact O-N 2.99Å
755	S	91.4	Very high	90	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.4	-34.5	173.6	58.7	0	0	0	0	113	S751 L752 S759 R760 V764 L767	S751-S755 VanDerWaalsContact O-CB 3.27Å; S751-S755 WeakPolarHBondContact O-CB 3.49Å; S751-S755 PolarHBondContact O-N 2.99Å; S751-S755 PolarHBondContact O-OG 2.84Å; L752-S755 PolarHBondContact O-OG 3.24Å; S755-S759 PolarHBondContact O-N 3.01Å; S755-R760 PolarHBondContact O-N 3.12Å; S755-V764 WeakPolarHBondContact OG-CG2 3.05Å; S755-L767 WeakPolarHBondContact OG-CD1 3.24Å
756	F	90.1	Very high	90.2	Very high	43 Å²	43	35.8 Å²	35.8	19%	0.189	19%	0.191	C	C	.	.	H	α-helix	trans	-70.2	-44.8	174.3	175.3	-114.7	0	0	0	112.5	L752 R753 Q758 S759 V764 L790 I794 T797	L752-F756 VanDerWaalsContact O-CB 3.22Å; L752-F756 WeakPolarHBondContact O-CB 3.44Å; L752-F756 PolarHBondContact O-N 2.99Å; R753-F756 PolarHBondContact O-N 3.41Å; F756-Q758 VanDerWaalsContact C-N 3.3Å; F756-Q758 PolarHBondContact O-N 2.92Å; F756-S759 WeakPolarHBondContact O-CA 3.42Å; F756-S759 PolarHBondContact O-N 3.45Å; F756-V764 HydrophobicContact CB-CG2 4.32Å; F756-L790 HydrophobicContact CD1-CD1 4.13Å; F756-I794 HydrophobicContact CB-CD1 4.27Å; F756-I794 HydrophobicContact CB-CG1 4.29Å; F756-I794 HydrophobicContact CD1-CG1 3.93Å; F756-I794 HydrophobicContact CD2-CD1 4.46Å; F756-I794 HydrophobicContact CD2-CG1 3.68Å; F756-I794 HydrophobicContact CD2-CG2 4.41Å; F756-I794 HydrophobicContact CE1-CG1 4.16Å; F756-I794 HydrophobicContact CE2-CB 4.42Å; F756-I794 HydrophobicContact CE2-CG1 3.92Å; F756-I794 HydrophobicContact CE2-CG2 4.45Å; F756-I794 HydrophobicContact CG-CD1 4.2Å; F756-I794 HydrophobicContact CG-CG1 3.68Å; F756-I794 HydrophobicContact CZ-CG1 4.17Å; F756-T797 WeakPolarHBondContact CE2-OG1 3.39Å; F756-T797 HydrophobicContact CZ-CG2 4.45Å; F756-T797 WeakPolarHBondContact CZ-OG1 3.46Å
757	S	86.7	Confident	90.3	Very high	87 Å²	87	35.7 Å²	35.7	61%	0.608	19%	0.19	S	C	*	.	H	α-helix	trans	-63.9	-35.6	177	66.6	0	0	0	0	112.4	R753 T754 S759	R753-S757 PolarHBondContact O-N 3.01Å; R753-S757 PolarHBondContact O-OG 3.33Å; T754-S757 PolarHBondContact O-OG 3.5Å; T754-S757 VanDerWaalsContact O-OG 3.07Å; S757-S759 PolarHBondContact O-N 3.41Å
758	Q	87.3	Confident	90.2	Very high	84 Å²	84	35.9 Å²	35.9	39%	0.393	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	1.4	170.9	-66.8	175	9.7	0	0	114.1	T754 F756 R760	T754-Q758 WeakPolarHBondContact O-CB 3.13Å; T754-Q758 VanDerWaalsContact O-CG 3.23Å; T754-Q758 WeakPolarHBondContact O-CG 3.11Å; T754-Q758 PolarHBondContact O-N 2.99Å; F756-Q758 VanDerWaalsContact C-N 3.3Å; F756-Q758 PolarHBondContact O-N 2.92Å; Q758-R760 HydrophobicContact CB-CG 3.96Å; Q758-R760 PolarHBondContact O-N 3.48Å; Q758-R760 VanDerWaalsContact OE1-CD 3.32Å
759	S	89.1	Confident	90.1	Very high	71 Å²	71	43.3 Å²	43.3	50%	0.497	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	27.3	-177.2	-57.4	0	0	0	0	115	S755 F756 S757 Y761	S755-S759 PolarHBondContact O-N 3.01Å; F756-S759 WeakPolarHBondContact O-CA 3.42Å; F756-S759 PolarHBondContact O-N 3.45Å; S757-S759 PolarHBondContact O-N 3.41Å; S759-Y761 VanDerWaalsContact C-N 3.33Å; S759-Y761 VanDerWaalsContact O-CD2 3.24Å; S759-Y761 WeakPolarHBondContact O-CD2 3.48Å; S759-Y761 PolarHBondContact O-N 3.42Å
760	R	89.1	Confident	90	Very high	48 Å²	48	44.5 Å²	44.5	18%	0.181	23%	0.225	C	C	.	.			trans	-86.4	66.4	-177.5	-67.6	-177.4	65.5	174.5	-0.2	112	D731 S755 Q758 S762 V763 V764	D731-R760 VanDerWaalsContact CG-NH1 3.3Å; D731-R760 IonicContact OD1-CZ 2.77Å; D731-R760 IonicContact OD1-NH1 2.66Å; D731-R760 PolarHBondContact OD1-NH1 3.45Å; D731-R760 IonicContact OD1-NH2 3.81Å; D731-R760 PolarHBondContact OD1-NH2 2.92Å; D731-R760 IonicContact OD2-CZ 3.6Å; D731-R760 IonicContact OD2-NH1 3.4Å; D731-R760 PolarHBondContact OD2-NH1 3.5Å; D731-R760 IonicContact OD2-NH2 3.99Å; S755-R760 PolarHBondContact O-N 3.12Å; Q758-R760 HydrophobicContact CB-CG 3.96Å; Q758-R760 PolarHBondContact O-N 3.48Å; Q758-R760 VanDerWaalsContact OE1-CD 3.32Å; R760-S762 PolarHBondContact O-N 3.42Å; R760-V763 HydrophobicContact CB-CB 4.37Å; R760-V763 HydrophobicContact CB-CG2 4.25Å; R760-V763 PolarHBondContact O-N 2.93Å; R760-V764 PolarHBondContact O-N 3.21Å; R760-V764 VanDerWaalsContact O-N 3.17Å
761	Y	86.5	Confident	89.8	Confident	102 Å²	102	43.7 Å²	43.7	40%	0.4	22%	0.222	S	C	.	.	H	α-helix	trans	-54.9	-29.3	-172.7	-61.1	-69.8	0	0	0	115.7	S759 Q765	S759-Y761 VanDerWaalsContact C-N 3.33Å; S759-Y761 VanDerWaalsContact O-CD2 3.24Å; S759-Y761 WeakPolarHBondContact O-CD2 3.48Å; S759-Y761 PolarHBondContact O-N 3.42Å; Y761-Q765 WeakPolarHBondContact O-CB 3.48Å; Y761-Q765 PolarHBondContact O-N 3.21Å
762	S	89	Confident	89.3	Confident	94 Å²	94	48.3 Å²	48.3	66%	0.657	25%	0.254	S	S	*	.	H	α-helix	trans	-67.5	-35.9	175.5	53.3	0	0	0	0	113	R760 S766	R760-S762 PolarHBondContact O-N 3.42Å; S762-S766 PolarHBondContact O-N 2.94Å
763	V	90.6	Very high	88.9	Confident	15 Å²	15	51.1 Å²	51.1	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-73.4	-44.3	175.5	-177.3	0	0	0	0	109.8	V730 M734 R760 Q765 S766 L767	V730-V763 HydrophobicContact CG1-CG1 3.79Å; M734-V763 HydrophobicContact CE-CG1 4.48Å; M734-V763 HydrophobicContact CG-CG1 3.94Å; M734-V763 HydrophobicContact SD-CG1 4.08Å; R760-V763 HydrophobicContact CB-CB 4.37Å; R760-V763 HydrophobicContact CB-CG2 4.25Å; R760-V763 PolarHBondContact O-N 2.93Å; V763-Q765 VanDerWaalsContact C-N 3.32Å; V763-Q765 PolarHBondContact O-N 3.44Å; V763-S766 PolarHBondContact O-N 3.35Å; V763-L767 HydrophobicContact CG1-CD1 4Å; V763-L767 HydrophobicContact CG1-CG 4.32Å; V763-L767 WeakPolarHBondContact O-CG 3.46Å; V763-L767 PolarHBondContact O-N 2.77Å
764	V	90	Very high	88.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-52.1	-49.1	172.6	173.5	0	0	0	0	110.9	L752 S755 F756 R760 S766 L767 L768 V803	L752-V764 HydrophobicContact CD1-CG1 3.93Å; S755-V764 WeakPolarHBondContact OG-CG2 3.05Å; F756-V764 HydrophobicContact CB-CG2 4.32Å; R760-V764 PolarHBondContact O-N 3.21Å; R760-V764 VanDerWaalsContact O-N 3.17Å; V764-S766 VanDerWaalsContact C-N 3.28Å; V764-S766 PolarHBondContact O-N 3.35Å; V764-L767 PolarHBondContact O-N 2.91Å; V764-L768 HydrophobicContact CG1-CD1 3.79Å; V764-L768 HydrophobicContact CG1-CG 4.27Å; V764-L768 VanDerWaalsContact O-CG 3.28Å; V764-L768 WeakPolarHBondContact O-CG 3.24Å; V764-L768 PolarHBondContact O-N 3.44Å; V764-V803 HydrophobicContact CG1-CG1 4.42Å
765	Q	89	Confident	88.1	Confident	73 Å²	73	53.4 Å²	53.4	34%	0.341	28%	0.284	S	S	.	.	H	α-helix	trans	-63.3	-30.8	178.6	-166.7	-173.9	-10.7	0	0	113.4	Y761 V763 R769 S802 V803 Q806	Y761-Q765 WeakPolarHBondContact O-CB 3.48Å; Y761-Q765 PolarHBondContact O-N 3.21Å; V763-Q765 VanDerWaalsContact C-N 3.32Å; V763-Q765 PolarHBondContact O-N 3.44Å; Q765-R769 PolarHBondContact O-N 3.49Å; Q765-S802 PolarHBondContact NE2-OG 3.08Å; Q765-V803 HydrophobicContact CB-CG2 4.32Å; Q765-Q806 VanDerWaalsContact CG-OE1 3.25Å; Q765-Q806 PolarHBondContact O-NE2 3.31Å; Q765-Q806 PolarHBondContact O-OE1 3.48Å; Q765-Q806 VanDerWaalsContact O-OE1 3.11Å
766	S	90.8	Very high	87.3	Confident	25 Å²	25	57.8 Å²	57.8	18%	0.175	31%	0.305	C	S	.	.	H	α-helix	trans	-74.3	-42.6	173.2	-165.4	0	0	0	0	111.7	S762 V763 V764 R769 D770	S762-S766 PolarHBondContact O-N 2.94Å; V763-S766 PolarHBondContact O-N 3.35Å; V764-S766 VanDerWaalsContact C-N 3.28Å; V764-S766 PolarHBondContact O-N 3.35Å; S766-R769 PolarHBondContact O-N 3.17Å; S766-R769 PolarHBondContact OG-NH2 2.73Å; S766-D770 WeakPolarHBondContact O-CB 3.46Å; S766-D770 PolarHBondContact O-N 2.86Å
767	L	91.4	Very high	86.5	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-43.5	178.2	-72.4	169.3	0	0	0	111.7	M734 W743 W748 S751 L752 S755 V763 V764 R769 D770 F771	M734-L767 HydrophobicContact SD-CD2 3.71Å; M734-L767 HydrophobicContact SD-CG 4.12Å; W743-L767 HydrophobicContact CH2-CD2 3.49Å; W743-L767 VanDerWaalsContact CH2-CD2 3.49Å; W743-L767 HydrophobicContact CZ2-CD2 3.42Å; W743-L767 VanDerWaalsContact CZ2-CD2 3.42Å; W743-L767 HydrophobicContact CZ3-CD2 4.36Å; W748-L767 PolarHBondContact NE1-O 3.39Å; S751-L767 WeakPolarHBondContact O-CD1 3.49Å; L752-L767 HydrophobicContact CB-CD1 4.43Å; L752-L767 HydrophobicContact CD1-CB 4.43Å; S755-L767 WeakPolarHBondContact OG-CD1 3.24Å; V763-L767 HydrophobicContact CG1-CD1 4Å; V763-L767 HydrophobicContact CG1-CG 4.32Å; V763-L767 WeakPolarHBondContact O-CG 3.46Å; V763-L767 PolarHBondContact O-N 2.77Å; V764-L767 PolarHBondContact O-N 2.91Å; L767-R769 VanDerWaalsContact C-N 3.35Å; L767-R769 PolarHBondContact O-N 3.39Å; L767-D770 PolarHBondContact O-N 3.38Å; L767-D770 VanDerWaalsContact O-N 3.14Å; L767-F771 PolarHBondContact O-N 3.35Å
768	L	90.8	Very high	85.9	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-64.6	-37.5	177.4	-66.3	172.6	0	0	0	112.2	W748 L752 V764 D770 F771 V803 Q806 L807 I810	W748-L768 HydrophobicContact CZ2-CD2 4.25Å; L752-L768 HydrophobicContact CD1-CD2 4.07Å; L752-L768 HydrophobicContact CD1-CG 4.27Å; L752-L768 HydrophobicContact CD2-CD2 4.13Å; V764-L768 HydrophobicContact CG1-CD1 3.79Å; V764-L768 HydrophobicContact CG1-CG 4.27Å; V764-L768 VanDerWaalsContact O-CG 3.28Å; V764-L768 WeakPolarHBondContact O-CG 3.24Å; V764-L768 PolarHBondContact O-N 3.44Å; L768-D770 VanDerWaalsContact C-N 3.33Å; L768-F771 WeakPolarHBondContact O-CB 3.48Å; L768-F771 PolarHBondContact O-N 2.81Å; L768-V803 HydrophobicContact CD1-CG1 3.77Å; L768-Q806 HydrophobicContact CB-CB 4.09Å; L768-Q806 HydrophobicContact CD1-CB 4.5Å; L768-L807 HydrophobicContact CD1-CD2 4.25Å; L768-L807 HydrophobicContact CD1-CG 4.04Å; L768-L807 HydrophobicContact CD2-CD2 3.63Å; L768-L807 HydrophobicContact CD2-CG 4.29Å; L768-I810 HydrophobicContact CB-CD1 3.98Å; L768-I810 HydrophobicContact CD2-CD1 3.59Å; L768-I810 HydrophobicContact CG-CD1 4.37Å
769	R	89.7	Confident	85.7	Confident	155 Å²	155	58 Å²	58	59%	0.585	30%	0.296	S	S	*	.	H	α-helix	trans	-63	-41	171.2	179.7	-178	58.6	-164.1	-9	111.9	Q765 S766 L767 F771 S772	Q765-R769 PolarHBondContact O-N 3.49Å; S766-R769 PolarHBondContact O-N 3.17Å; S766-R769 PolarHBondContact OG-NH2 2.73Å; L767-R769 VanDerWaalsContact C-N 3.35Å; L767-R769 PolarHBondContact O-N 3.39Å; R769-F771 PolarHBondContact O-N 2.8Å; R769-S772 PolarHBondContact O-OG 2.81Å
770	D	88.8	Confident	85.4	Confident	25 Å²	25	55.7 Å²	55.7	13%	0.134	28%	0.279	C	S	.	.	H	α-helix	trans	-72	-12.9	-177.6	-91.3	49.3	0	0	0	113.9	R737 W743 S766 L767 L768 S772 S773	R737-D770 IonicContact CZ-OD2 3.3Å; R737-D770 IonicContact NE-OD2 2.67Å; R737-D770 PolarHBondContact NE-OD2 3Å; R737-D770 IonicContact NH2-OD2 3Å; R737-D770 PolarHBondContact NH2-OD2 3.36Å; R737-D770 VanDerWaalsContact NH2-OD2 3.15Å; W743-D770 PolarHBondContact NE1-OD2 2.97Å; S766-D770 WeakPolarHBondContact O-CB 3.46Å; S766-D770 PolarHBondContact O-N 2.86Å; L767-D770 PolarHBondContact O-N 3.38Å; L767-D770 VanDerWaalsContact O-N 3.14Å; L768-D770 VanDerWaalsContact C-N 3.33Å; D770-S772 PolarHBondContact O-N 3.36Å; D770-S772 VanDerWaalsContact O-N 3.14Å; D770-S773 WeakPolarHBondContact O-CB 3.12Å; D770-S773 PolarHBondContact O-N 2.76Å; D770-S773 PolarHBondContact O-OG 3.31Å
771	F	87.6	Confident	85	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.009	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-53.4	-35.1	178.6	-175.9	-97.5	0	0	0	112.7	W748 L767 L768 R769 S773 I774 Y779 I810	W748-F771 HydrophobicContact CD2-CD2 4.15Å; W748-F771 AromaticContact CE2-CD2 3.82Å; W748-F771 HydrophobicContact CE3-CD2 4.08Å; W748-F771 HydrophobicContact CE3-CE2 4.38Å; W748-F771 AromaticContact CH2-CD2 3.44Å; W748-F771 HydrophobicContact CH2-CD2 3.44Å; W748-F771 VanDerWaalsContact CH2-CD2 3.44Å; W748-F771 AromaticContact CH2-CE2 3.99Å; W748-F771 HydrophobicContact CH2-CE2 3.99Å; W748-F771 HydrophobicContact CH2-CG 4.31Å; W748-F771 HydrophobicContact CZ2-CB 3.88Å; W748-F771 AromaticContact CZ2-CD2 3.49Å; W748-F771 HydrophobicContact CZ2-CD2 3.49Å; W748-F771 VanDerWaalsContact CZ2-CD2 3.49Å; W748-F771 HydrophobicContact CZ2-CE2 4.45Å; W748-F771 HydrophobicContact CZ2-CG 4.08Å; W748-F771 AromaticContact CZ3-CD2 3.75Å; W748-F771 HydrophobicContact CZ3-CD2 3.75Å; W748-F771 AromaticContact CZ3-CE2 3.95Å; W748-F771 HydrophobicContact CZ3-CE2 3.95Å; L767-F771 PolarHBondContact O-N 3.35Å; L768-F771 WeakPolarHBondContact O-CB 3.48Å; L768-F771 PolarHBondContact O-N 2.81Å; R769-F771 PolarHBondContact O-N 2.8Å; F771-S773 PolarHBondContact O-N 3.49Å; F771-I774 HydrophobicContact CD2-CD1 4.08Å; F771-I774 HydrophobicContact CE2-CD1 4.41Å; F771-I774 WeakPolarHBondContact O-CB 3.26Å; F771-I774 PolarHBondContact O-N 3.2Å; F771-Y779 HydrophobicContact CZ-CE1 4.07Å; F771-I810 HydrophobicContact CB-CD1 4.02Å; F771-I810 HydrophobicContact CB-CG1 4.12Å; F771-I810 HydrophobicContact CD1-CB 4.34Å; F771-I810 HydrophobicContact CD1-CG1 3.9Å; F771-I810 HydrophobicContact CD1-CG2 3.75Å; F771-I810 HydrophobicContact CE1-CG2 3.72Å; F771-I810 HydrophobicContact CG-CD1 4.26Å; F771-I810 HydrophobicContact CG-CG1 4.13Å; F771-I810 HydrophobicContact CG-CG2 4.21Å; F771-I810 HydrophobicContact CZ-CG2 4.14Å
772	S	82.8	Confident	84.8	Confident	98 Å²	98	55.1 Å²	55.1	69%	0.685	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-64.5	-3.9	177.2	66.5	0	0	0	0	115.1	R769 D770	R769-S772 PolarHBondContact O-OG 2.81Å; D770-S772 PolarHBondContact O-N 3.36Å; D770-S772 VanDerWaalsContact O-N 3.14Å
773	S	85.1	Confident	84.6	Confident	59 Å²	59	50.6 Å²	50.6	41%	0.413	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-93.2	-7.8	172	66.2	0	0	0	0	113.9	D770 F771	D770-S773 WeakPolarHBondContact O-CB 3.12Å; D770-S773 PolarHBondContact O-N 2.76Å; D770-S773 PolarHBondContact O-OG 3.31Å; F771-S773 PolarHBondContact O-N 3.49Å
774	I	84.2	Confident	84.3	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.031	25%	0.251	C	S	.	.	S	Bend	trans	-87.9	125.8	173.5	-55.6	172.3	0	0	0	107.6	W743 L745 W748 F771 E778 Y779	W743-I774 HydrophobicContact CB-CD1 4.39Å; W743-I774 HydrophobicContact CB-CG1 4.03Å; L745-I774 HydrophobicContact CB-CG2 4.43Å; L745-I774 HydrophobicContact CD1-CD1 4.27Å; L745-I774 HydrophobicContact CD1-CG2 4.45Å; W748-I774 HydrophobicContact CB-CD1 3.82Å; W748-I774 HydrophobicContact CD2-CD1 3.97Å; W748-I774 HydrophobicContact CE3-CD1 4.4Å; W748-I774 HydrophobicContact CG-CD1 3.68Å; F771-I774 HydrophobicContact CD2-CD1 4.08Å; F771-I774 HydrophobicContact CE2-CD1 4.41Å; F771-I774 WeakPolarHBondContact O-CB 3.26Å; F771-I774 PolarHBondContact O-N 3.2Å; I774-E778 HydrophobicContact CG2-CB 4.18Å; I774-Y779 HydrophobicContact CG2-CE1 4.5Å
775	K	79.4	Confident	84	Confident	130 Å²	130	54.6 Å²	54.6	57%	0.565	28%	0.275	S	S	*	.			trans	-76.1	149.4	177.5	-65.9	-176.9	173.8	-171.5	0	111.2	E777 E778	K775-E777 HydrophobicContact CB-CB 4.44Å; K775-E777 IonicContact NZ-OE2 2.77Å; K775-E777 PolarHBondContact O-N 3.1Å; K775-E778 PolarHBondContact O-N 3.21Å
776	E	76.1	Confident	83.7	Confident	93 Å²	93	54.9 Å²	54.9	44%	0.435	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-58.4	-30.9	175	-60.4	-179.8	-174	0	0	112.4	E778 Y779 H813	E776-E778 PolarHBondContact O-N 3.07Å; E776-Y779 HydrophobicContact CB-CD2 4.27Å; E776-Y779 HydrophobicContact CB-CE2 3.96Å; E776-Y779 HydrophobicContact CG-CE2 3.88Å; E776-Y779 VanDerWaalsContact O-CB 3.32Å; E776-Y779 WeakPolarHBondContact O-CB 3.44Å; E776-Y779 VanDerWaalsContact O-CG 3.27Å; E776-Y779 PolarHBondContact O-N 3.31Å; E776-Y779 VanDerWaalsContact O-N 3.13Å; E776-H813 IonicContact OE1-CE1 3.95Å; E776-H813 PolarHBondContact OE1-CE1 2.9Å; E776-H813 IonicContact OE1-ND1 3.39Å
777	E	72.8	Confident	83.5	Confident	146 Å²	146	53.7 Å²	53.7	68%	0.682	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-59.3	-24.4	172.7	-65	162.6	-171.3	0	0	114	K775	K775-E777 HydrophobicContact CB-CB 4.44Å; K775-E777 IonicContact NZ-OE2 2.77Å; K775-E777 PolarHBondContact O-N 3.1Å
778	E	74.4	Confident	83.4	Confident	59 Å²	59	53.7 Å²	53.7	28%	0.276	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-88.5	-3.5	179.1	-60.6	-155	-178.9	0	0	113.4	K744 L745 I774 K775 E776 N780	K744-E778 WeakPolarHBondContact CD-OE2 3.21Å; K744-E778 VanDerWaalsContact NZ-CD 3.29Å; K744-E778 IonicContact NZ-OE1 3.42Å; K744-E778 PolarHBondContact NZ-OE1 3.08Å; K744-E778 IonicContact NZ-OE2 2.87Å; K744-E778 PolarHBondContact NZ-OE2 3.15Å; L745-E778 WeakPolarHBondContact CD2-O 3.33Å; I774-E778 HydrophobicContact CG2-CB 4.18Å; K775-E778 PolarHBondContact O-N 3.21Å; E776-E778 PolarHBondContact O-N 3.07Å; E778-N780 PolarHBondContact O-N 2.86Å
779	Y	83.1	Confident	83.3	Confident	12 Å²	12	56.7 Å²	56.7	5%	0.047	28%	0.282	C	S	.	.			trans	-59.1	137.7	179.1	-66.6	-9.4	0	0	0	111.5	L745 F771 I774 E776 L783 V1016 Y1020	L745-Y779 HydrophobicContact CD2-CD1 4.29Å; F771-Y779 HydrophobicContact CZ-CE1 4.07Å; I774-Y779 HydrophobicContact CG2-CE1 4.5Å; E776-Y779 HydrophobicContact CB-CD2 4.27Å; E776-Y779 HydrophobicContact CB-CE2 3.96Å; E776-Y779 HydrophobicContact CG-CE2 3.88Å; E776-Y779 VanDerWaalsContact O-CB 3.32Å; E776-Y779 WeakPolarHBondContact O-CB 3.44Å; E776-Y779 VanDerWaalsContact O-CG 3.27Å; E776-Y779 PolarHBondContact O-N 3.31Å; E776-Y779 VanDerWaalsContact O-N 3.13Å; Y779-L783 HydrophobicContact CD1-CD2 3.61Å; Y779-L783 HydrophobicContact CD2-CD2 4.35Å; Y779-L783 HydrophobicContact CE1-CD2 3.99Å; Y779-L783 HydrophobicContact CG-CD2 3.81Å; Y779-V1016 HydrophobicContact CD2-CG1 4.42Å; Y779-Y1020 WeakPolarHBondContact O-CD2 3.46Å; Y779-Y1020 VanDerWaalsContact O-CE2 3.25Å; Y779-Y1020 WeakPolarHBondContact O-CE2 3.1Å
780	N	81.4	Confident	83.3	Confident	23 Å²	23	50 Å²	50	12%	0.123	26%	0.258	C	S	.	.			trans	-134.3	169.8	-175.6	71.1	-3.5	0	0	0	111.2	R194 L745 E778 E782 L783	R194-N780 PolarHBondContact O-ND2 3.3Å; L745-N780 HydrophobicContact CD2-CB 4.28Å; L745-N780 VanDerWaalsContact CD2-OD1 3.24Å; L745-N780 WeakPolarHBondContact CD2-OD1 3.49Å; E778-N780 PolarHBondContact O-N 2.86Å; N780-E782 PolarHBondContact ND2-OE2 3.36Å; N780-E782 PolarHBondContact O-N 2.92Å; N780-E782 WeakPolarHBondContact OD1-CB 3.44Å; N780-E782 PolarHBondContact OD1-N 3.22Å; N780-L783 PolarHBondContact O-N 3.23Å; N780-L783 PolarHBondContact OD1-N 2.98Å
781	E	81.5	Confident	83.4	Confident	112 Å²	112	48.8 Å²	48.8	52%	0.523	25%	0.251	S	S	.	.	H	α-helix	trans	-60.3	-28.8	177.3	-172.6	-176.7	177.3	0	0	112.9	V784 T785	E781-V784 PolarHBondContact O-N 3.4Å; E781-T785 HydrophobicContact CG-CG2 4.25Å; E781-T785 WeakPolarHBondContact O-CB 3.32Å; E781-T785 WeakPolarHBondContact O-CG2 3.37Å; E781-T785 PolarHBondContact O-N 3.07Å; E781-T785 PolarHBondContact O-OG1 3.02Å
782	E	82.2	Confident	83.6	Confident	26 Å²	26	48.9 Å²	48.9	12%	0.121	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-35.8	177.3	-179.6	-175.8	-141	0	0	112.3	H746 I749 N780 V784 T785 E786 G787	H746-E782 VanDerWaalsContact CB-OE2 3.31Å; H746-E782 WeakPolarHBondContact CB-OE2 3.5Å; H746-E782 IonicContact CE1-OE1 3.11Å; H746-E782 IonicContact CG-OE1 2.81Å; H746-E782 IonicContact CG-OE2 2.63Å; H746-E782 IonicContact ND1-OE1 3.18Å; H746-E782 PolarHBondContact ND1-OE1 3.22Å; H746-E782 IonicContact ND1-OE2 2.7Å; H746-E782 PolarHBondContact ND1-OE2 3.18Å; I749-E782 HydrophobicContact CD1-CG 4.09Å; N780-E782 PolarHBondContact ND2-OE2 3.36Å; N780-E782 PolarHBondContact O-N 2.92Å; N780-E782 WeakPolarHBondContact OD1-CB 3.44Å; N780-E782 PolarHBondContact OD1-N 3.22Å; E782-V784 VanDerWaalsContact C-N 3.33Å; E782-V784 PolarHBondContact O-N 3.34Å; E782-T785 WeakPolarHBondContact CA-OG1 2.87Å; E782-E786 HydrophobicContact CG-CB 4.38Å; E782-E786 CarbonylContact O-C 3.37Å; E782-E786 WeakPolarHBondContact O-CA 3.3Å; E782-E786 WeakPolarHBondContact O-CB 3.39Å; E782-E786 PolarHBondContact O-N 3.03Å; E782-G787 PolarHBondContact O-N 3.46Å
783	L	85.6	Confident	83.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.233	C	C	.	.	I	π-helix	trans	-61.2	-43.1	170.3	174.1	61.7	0	0	0	111.2	L745 I749 Y779 N780 G787 L788 M791 V1016	L745-L783 HydrophobicContact CD1-CB 4.33Å; L745-L783 HydrophobicContact CD1-CD1 4.34Å; L745-L783 HydrophobicContact CD1-CD2 4.3Å; L745-L783 HydrophobicContact CD2-CB 3.95Å; L745-L783 HydrophobicContact CD2-CD2 4.23Å; L745-L783 HydrophobicContact CG-CB 4.43Å; I749-L783 HydrophobicContact CD1-CB 4.24Å; Y779-L783 HydrophobicContact CD1-CD2 3.61Å; Y779-L783 HydrophobicContact CD2-CD2 4.35Å; Y779-L783 HydrophobicContact CE1-CD2 3.99Å; Y779-L783 HydrophobicContact CG-CD2 3.81Å; N780-L783 PolarHBondContact O-N 3.23Å; N780-L783 PolarHBondContact OD1-N 2.98Å; L783-G787 CarbonylContact O-C 3.57Å; L783-G787 WeakPolarHBondContact O-CA 3.36Å; L783-G787 PolarHBondContact O-N 3.36Å; L783-L788 WeakPolarHBondContact O-CG 3.35Å; L783-L788 PolarHBondContact O-N 3.23Å; L783-M791 HydrophobicContact CD1-CE 4.03Å; L783-V1016 HydrophobicContact CD2-CG1 4.36Å
784	V	84	Confident	84	Confident	19 Å²	19	44.1 Å²	44.1	12%	0.115	21%	0.214	C	C	.	.	I	π-helix	trans	-67.2	-44.7	-179.8	-179.6	0	0	0	0	111.6	E781 E782 A1013 V1016	E781-V784 PolarHBondContact O-N 3.4Å; E782-V784 VanDerWaalsContact C-N 3.33Å; E782-V784 PolarHBondContact O-N 3.34Å; V784-A1013 HydrophobicContact CG1-CB 3.74Å; V784-V1016 HydrophobicContact CG2-CB 4.16Å; V784-V1016 HydrophobicContact CG2-CG1 3.71Å
785	T	82.6	Confident	84.1	Confident	80 Å²	80	43.9 Å²	43.9	49%	0.491	21%	0.212	S	C	.	.	I	π-helix	trans	-86.4	-43.1	-172.3	50.5	0	0	0	0	113.8	E781 E782	E781-T785 HydrophobicContact CG-CG2 4.25Å; E781-T785 WeakPolarHBondContact O-CB 3.32Å; E781-T785 WeakPolarHBondContact O-CG2 3.37Å; E781-T785 PolarHBondContact O-N 3.07Å; E781-T785 PolarHBondContact O-OG1 3.02Å; E782-T785 WeakPolarHBondContact CA-OG1 2.87Å
786	E	83.2	Confident	84.5	Confident	78 Å²	78	42.5 Å²	42.5	36%	0.364	21%	0.207	S	C	.	.	I	π-helix	trans	-110.5	-39.5	-174.1	-68.6	-158.9	-167.6	0	0	113.2	R753 E782 L790	R753-E786 IonicContact CZ-OE2 2.86Å; R753-E786 IonicContact NH1-OE2 2.83Å; R753-E786 PolarHBondContact NH1-OE2 2.76Å; R753-E786 IonicContact NH2-OE2 3.38Å; R753-E786 PolarHBondContact NH2-OE2 3.32Å; E782-E786 HydrophobicContact CG-CB 4.38Å; E782-E786 CarbonylContact O-C 3.37Å; E782-E786 WeakPolarHBondContact O-CA 3.3Å; E782-E786 WeakPolarHBondContact O-CB 3.39Å; E782-E786 PolarHBondContact O-N 3.03Å; E786-L790 VanDerWaalsContact O-CB 3.31Å; E786-L790 WeakPolarHBondContact O-CB 3.29Å; E786-L790 PolarHBondContact O-N 3.28Å
787	G	86.8	Confident	84.9	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.01	21%	0.209	C	C	.	.	I	π-helix	trans	-69.1	-48.6	-177.4	0	0	0	0	0	113.5	E782 L783 L790 M791	E782-G787 PolarHBondContact O-N 3.46Å; L783-G787 CarbonylContact O-C 3.57Å; L783-G787 WeakPolarHBondContact O-CA 3.36Å; L783-G787 PolarHBondContact O-N 3.36Å; G787-L790 PolarHBondContact O-N 2.87Å; G787-M791 WeakPolarHBondContact O-CG 3.43Å; G787-M791 PolarHBondContact O-N 3.34Å
788	L	89.1	Confident	85.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.5	-48.8	176	-69.3	-173	0	0	0	110.8	L783 L790 M791 F792 L1012 A1013	L783-L788 WeakPolarHBondContact O-CG 3.35Å; L783-L788 PolarHBondContact O-N 3.23Å; L788-L790 VanDerWaalsContact C-N 3.32Å; L788-L790 PolarHBondContact O-N 2.96Å; L788-M791 HydrophobicContact CD2-CE 3.71Å; L788-M791 PolarHBondContact O-N 3.3Å; L788-M791 VanDerWaalsContact O-N 3.1Å; L788-F792 VanDerWaalsContact O-CD2 3.29Å; L788-F792 WeakPolarHBondContact O-CD2 3.38Å; L788-F792 PolarHBondContact O-N 3.33Å; L788-L1012 HydrophobicContact CD1-CB 4.35Å; L788-L1012 HydrophobicContact CD1-CD2 4.35Å; L788-L1012 HydrophobicContact CD1-CG 4.08Å; L788-L1012 HydrophobicContact CD2-CD2 3.63Å; L788-L1012 HydrophobicContact CD2-CG 4.13Å; L788-A1013 HydrophobicContact CD1-CB 3.91Å
789	Q	89.9	Confident	85.9	Confident	66 Å²	66	41.9 Å²	41.9	31%	0.308	21%	0.206	S	C	.	.	H	α-helix	trans	-52.4	-50.6	176.6	179.6	63.9	57.9	0	0	111.3	M791 F792 D793	Q789-M791 PolarHBondContact O-N 3.1Å; Q789-F792 PolarHBondContact O-N 2.76Å; Q789-D793 PolarHBondContact NE2-OD2 3.39Å; Q789-D793 WeakPolarHBondContact O-CB 3.27Å; Q789-D793 PolarHBondContact O-N 3.41Å
790	L	88.9	Confident	86	Confident	15 Å²	15	44.2 Å²	44.2	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-58.3	-45.9	176.7	175.9	66.8	0	0	0	112.1	I749 L752 R753 F756 E786 G787 L788 D793 I794	I749-L790 HydrophobicContact CG2-CD2 4.49Å; L752-L790 HydrophobicContact CB-CD2 4.13Å; L752-L790 HydrophobicContact CD2-CD2 3.98Å; L752-L790 HydrophobicContact CD2-CG 4.48Å; L752-L790 HydrophobicContact CG-CD2 3.91Å; R753-L790 HydrophobicContact CB-CD1 4.38Å; R753-L790 HydrophobicContact CB-CD2 3.83Å; F756-L790 HydrophobicContact CD1-CD1 4.13Å; E786-L790 VanDerWaalsContact O-CB 3.31Å; E786-L790 WeakPolarHBondContact O-CB 3.29Å; E786-L790 PolarHBondContact O-N 3.28Å; G787-L790 PolarHBondContact O-N 2.87Å; L788-L790 VanDerWaalsContact C-N 3.32Å; L788-L790 PolarHBondContact O-N 2.96Å; L790-D793 PolarHBondContact O-N 2.98Å; L790-I794 HydrophobicContact CD1-CD1 4.2Å; L790-I794 HydrophobicContact CD1-CG1 4.43Å; L790-I794 HydrophobicContact CG-CD1 4Å; L790-I794 VanDerWaalsContact O-CG1 3.24Å; L790-I794 WeakPolarHBondContact O-CG1 3.44Å; L790-I794 PolarHBondContact O-N 2.96Å
791	M	91.4	Very high	86.1	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65	-38.5	179.7	-75.3	-170.5	-69.6	0	0	112.9	W748 L752 L783 G787 L788 Q789 I794 L795 L807 I810 F811	W748-M791 HydrophobicContact CH2-SD 3.92Å; L752-M791 HydrophobicContact CD2-CG 4.1Å; L783-M791 HydrophobicContact CD1-CE 4.03Å; G787-M791 WeakPolarHBondContact O-CG 3.43Å; G787-M791 PolarHBondContact O-N 3.34Å; L788-M791 HydrophobicContact CD2-CE 3.71Å; L788-M791 PolarHBondContact O-N 3.3Å; L788-M791 VanDerWaalsContact O-N 3.1Å; Q789-M791 PolarHBondContact O-N 3.1Å; M791-I794 PolarHBondContact O-N 3.26Å; M791-L795 PolarHBondContact O-N 3.08Å; M791-L807 HydrophobicContact CB-CD2 3.82Å; M791-L807 HydrophobicContact CG-CD2 3.84Å; M791-L807 HydrophobicContact SD-CD2 4.2Å; M791-I810 HydrophobicContact CE-CG2 4.35Å; M791-I810 HydrophobicContact SD-CG2 3.78Å; M791-F811 HydrophobicContact CB-CE1 3.72Å; M791-F811 HydrophobicContact CB-CZ 3.76Å; M791-F811 HydrophobicContact CE-CE1 4.27Å; M791-F811 HydrophobicContact SD-CE1 4.34Å
792	F	90.1	Very high	86.4	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-69.6	-35.8	173.6	-82.3	-76.5	0	0	0	112.4	L788 Q789 L795 K796 F811 L1005 L1008 Q1009 L1012	L788-F792 VanDerWaalsContact O-CD2 3.29Å; L788-F792 WeakPolarHBondContact O-CD2 3.38Å; L788-F792 PolarHBondContact O-N 3.33Å; Q789-F792 PolarHBondContact O-N 2.76Å; F792-L795 HydrophobicContact CD1-CD2 4.21Å; F792-L795 HydrophobicContact CE1-CD2 4.48Å; F792-L795 WeakPolarHBondContact O-CB 3.35Å; F792-L795 PolarHBondContact O-N 2.99Å; F792-K796 VanDerWaalsContact O-CB 3.24Å; F792-K796 WeakPolarHBondContact O-CB 3.1Å; F792-K796 PolarHBondContact O-N 3.08Å; F792-F811 HydrophobicContact CD1-CZ 4.29Å; F792-F811 HydrophobicContact CD2-CE1 4.2Å; F792-F811 HydrophobicContact CD2-CZ 4.15Å; F792-F811 HydrophobicContact CE1-CE2 4.31Å; F792-F811 HydrophobicContact CE1-CZ 4.26Å; F792-F811 HydrophobicContact CE2-CD1 4.43Å; F792-F811 AromaticContact CE2-CE1 3.89Å; F792-F811 HydrophobicContact CE2-CE1 3.89Å; F792-F811 HydrophobicContact CE2-CZ 4.09Å; F792-F811 HydrophobicContact CG-CZ 4.24Å; F792-F811 HydrophobicContact CZ-CE1 4.2Å; F792-F811 HydrophobicContact CZ-CE2 4.43Å; F792-F811 HydrophobicContact CZ-CZ 4.15Å; F792-L1005 HydrophobicContact CD1-CD2 3.98Å; F792-L1005 HydrophobicContact CE1-CD2 4.42Å; F792-L1008 HydrophobicContact CE1-CB 4.05Å; F792-L1008 HydrophobicContact CZ-CB 4.13Å; F792-Q1009 HydrophobicContact CD2-CB 3.7Å; F792-Q1009 HydrophobicContact CD2-CG 3.78Å; F792-Q1009 HydrophobicContact CE2-CB 3.72Å; F792-Q1009 HydrophobicContact CE2-CG 4.05Å; F792-Q1009 HydrophobicContact CG-CB 4.19Å; F792-Q1009 HydrophobicContact CZ-CB 4.2Å; F792-L1012 HydrophobicContact CE2-CD2 4.11Å; F792-L1012 HydrophobicContact CZ-CD2 4.38Å
793	D	87.8	Confident	86.6	Confident	56 Å²	56	43.2 Å²	43.2	30%	0.299	22%	0.222	S	C	.	.	H	α-helix	trans	-66.8	-37	172.7	-75.7	-39.3	0	0	0	112.1	Q789 L790 K796 T797	Q789-D793 PolarHBondContact NE2-OD2 3.39Å; Q789-D793 WeakPolarHBondContact O-CB 3.27Å; Q789-D793 PolarHBondContact O-N 3.41Å; L790-D793 PolarHBondContact O-N 2.98Å; D793-K796 PolarHBondContact O-N 3.26Å; D793-T797 WeakPolarHBondContact O-CB 3.38Å; D793-T797 VanDerWaalsContact O-CG2 3.29Å; D793-T797 WeakPolarHBondContact O-CG2 3.44Å; D793-T797 PolarHBondContact O-N 2.87Å; D793-T797 VanDerWaalsContact O-N 3.11Å; D793-T797 PolarHBondContact O-OG1 3.2Å
794	I	88.6	Confident	86.7	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-44.6	170.7	-62.5	163.6	0	0	0	110.4	L752 F756 L790 M791 K796 T797 S798 V803 L807	L752-I794 HydrophobicContact CD1-CD1 3.89Å; L752-I794 HydrophobicContact CD2-CD1 4.02Å; L752-I794 HydrophobicContact CG-CD1 3.85Å; F756-I794 HydrophobicContact CB-CD1 4.27Å; F756-I794 HydrophobicContact CB-CG1 4.29Å; F756-I794 HydrophobicContact CD1-CG1 3.93Å; F756-I794 HydrophobicContact CD2-CD1 4.46Å; F756-I794 HydrophobicContact CD2-CG1 3.68Å; F756-I794 HydrophobicContact CD2-CG2 4.41Å; F756-I794 HydrophobicContact CE1-CG1 4.16Å; F756-I794 HydrophobicContact CE2-CB 4.42Å; F756-I794 HydrophobicContact CE2-CG1 3.92Å; F756-I794 HydrophobicContact CE2-CG2 4.45Å; F756-I794 HydrophobicContact CG-CD1 4.2Å; F756-I794 HydrophobicContact CG-CG1 3.68Å; F756-I794 HydrophobicContact CZ-CG1 4.17Å; L790-I794 HydrophobicContact CD1-CD1 4.2Å; L790-I794 HydrophobicContact CD1-CG1 4.43Å; L790-I794 HydrophobicContact CG-CD1 4Å; L790-I794 VanDerWaalsContact O-CG1 3.24Å; L790-I794 WeakPolarHBondContact O-CG1 3.44Å; L790-I794 PolarHBondContact O-N 2.96Å; M791-I794 PolarHBondContact O-N 3.26Å; I794-K796 VanDerWaalsContact C-N 3.27Å; I794-K796 PolarHBondContact O-N 3.29Å; I794-T797 PolarHBondContact O-N 3.44Å; I794-T797 PolarHBondContact O-OG1 3.24Å; I794-S798 WeakPolarHBondContact O-CB 3.42Å; I794-S798 PolarHBondContact O-N 2.96Å; I794-S798 PolarHBondContact O-OG 3.35Å; I794-V803 HydrophobicContact CG2-CG1 3.87Å; I794-L807 HydrophobicContact CB-CD1 4.14Å; I794-L807 HydrophobicContact CG2-CD1 3.79Å
795	L	88.2	Confident	86.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.7	-41.1	177.1	-177.9	71.8	0	0	0	111.9	M791 F792 I804 L807 F811 M979 Y993 L1005	M791-L795 PolarHBondContact O-N 3.08Å; F792-L795 HydrophobicContact CD1-CD2 4.21Å; F792-L795 HydrophobicContact CE1-CD2 4.48Å; F792-L795 WeakPolarHBondContact O-CB 3.35Å; F792-L795 PolarHBondContact O-N 2.99Å; L795-I804 HydrophobicContact CD1-CB 4.43Å; L795-I804 HydrophobicContact CD1-CG1 4.35Å; L795-I804 HydrophobicContact CD1-CG2 3.94Å; L795-L807 HydrophobicContact CB-CD1 4.12Å; L795-L807 HydrophobicContact CD1-CD1 4.46Å; L795-F811 HydrophobicContact CD2-CE2 4.16Å; L795-M979 HydrophobicContact CD2-CE 3.8Å; L795-Y993 VanDerWaalsContact O-CE1 3.31Å; L795-Y993 WeakPolarHBondContact O-CE1 3.23Å; L795-Y993 PolarHBondContact O-OH 3.14Å; L795-L1005 HydrophobicContact CD2-CD2 3.84Å
796	K	85.9	Confident	87.2	Confident	102 Å²	102	43.4 Å²	43.4	44%	0.443	22%	0.216	S	C	.	.	H	α-helix	trans	-73.7	-29	-176.9	-174.6	178.2	-170.3	167.5	0	114.1	F792 D793 I794 L1005	F792-K796 VanDerWaalsContact O-CB 3.24Å; F792-K796 WeakPolarHBondContact O-CB 3.1Å; F792-K796 PolarHBondContact O-N 3.08Å; D793-K796 PolarHBondContact O-N 3.26Å; I794-K796 VanDerWaalsContact C-N 3.27Å; I794-K796 PolarHBondContact O-N 3.29Å; K796-L1005 HydrophobicContact CB-CD1 4.23Å; K796-L1005 HydrophobicContact CD-CD1 4.21Å; K796-L1005 HydrophobicContact CG-CD1 4.06Å
797	T	85.9	Confident	87.6	Confident	77 Å²	77	39.7 Å²	39.7	47%	0.472	20%	0.199	S	C	.	.	H	α-helix	trans	-104.2	-29.7	-174.2	54.5	0	0	0	0	113.7	F756 D793 I794	F756-T797 WeakPolarHBondContact CE2-OG1 3.39Å; F756-T797 HydrophobicContact CZ-CG2 4.45Å; F756-T797 WeakPolarHBondContact CZ-OG1 3.46Å; D793-T797 WeakPolarHBondContact O-CB 3.38Å; D793-T797 VanDerWaalsContact O-CG2 3.29Å; D793-T797 WeakPolarHBondContact O-CG2 3.44Å; D793-T797 PolarHBondContact O-N 2.87Å; D793-T797 VanDerWaalsContact O-N 3.11Å; D793-T797 PolarHBondContact O-OG1 3.2Å; I794-T797 PolarHBondContact O-N 3.44Å; I794-T797 PolarHBondContact O-OG1 3.24Å
798	S	84.8	Confident	87.6	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.042	20%	0.198	C	C	.	.			trans	-71.3	145.1	-178.3	64.9	0	0	0	0	112	I794	I794-S798 WeakPolarHBondContact O-CB 3.42Å; I794-S798 PolarHBondContact O-N 2.96Å; I794-S798 PolarHBondContact O-OG 3.35Å
799	K	83	Confident	87.5	Confident	201 Å²	201	42 Å²	42	87%	0.874	22%	0.218	S	C	*	.			trans	-114.2	12	174.7	-60	-180	-178.5	175.1	0	112.2
800	N	84.4	Confident	87.5	Confident	61 Å²	61	39.3 Å²	39.3	33%	0.326	21%	0.206	S	C	.	.			trans	-103.6	108.1	-174.4	-177.2	-1.3	0	0	0	109	S802 V803 I804	N800-S802 PolarHBondContact ND2-OG 3Å; N800-S802 PolarHBondContact O-N 3.42Å; N800-S802 VanDerWaalsContact O-N 3.11Å; N800-S802 PolarHBondContact OD1-N 2.75Å; N800-S802 PolarHBondContact OD1-OG 3.47Å; N800-V803 HydrophobicContact CB-CB 4.32Å; N800-V803 HydrophobicContact CB-CG2 4.21Å; N800-V803 WeakPolarHBondContact O-CB 3.41Å; N800-V803 PolarHBondContact O-N 3.03Å; N800-I804 PolarHBondContact O-N 3Å; N800-I804 VanDerWaalsContact O-N 3.1Å
801	D	84.7	Confident	87.5	Confident	102 Å²	102	38.6 Å²	38.6	55%	0.545	20%	0.202	S	C	.	.	H	α-helix	trans	-54.8	-31.2	-178.1	-67.7	-16.4	0	0	0	112.8	I804 Q805	D801-I804 PolarHBondContact O-N 3.3Å; D801-Q805 VanDerWaalsContact O-CB 3.28Å; D801-Q805 WeakPolarHBondContact O-CB 3.43Å; D801-Q805 WeakPolarHBondContact O-CG 3.28Å; D801-Q805 PolarHBondContact O-N 3.27Å
802	S	87.4	Confident	87.3	Confident	39 Å²	39	40.6 Å²	40.6	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-67.9	-37.6	178	72.3	0	0	0	0	112.8	Q765 N800 Q806	Q765-S802 PolarHBondContact NE2-OG 3.08Å; N800-S802 PolarHBondContact ND2-OG 3Å; N800-S802 PolarHBondContact O-N 3.42Å; N800-S802 VanDerWaalsContact O-N 3.11Å; N800-S802 PolarHBondContact OD1-N 2.75Å; N800-S802 PolarHBondContact OD1-OG 3.47Å; S802-Q806 WeakPolarHBondContact O-CB 3.33Å; S802-Q806 WeakPolarHBondContact O-CG 3.37Å; S802-Q806 PolarHBondContact O-N 3.17Å
803	V	86.9	Confident	87.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.3	-43.5	176.2	169.2	0	0	0	0	110	V764 Q765 L768 I794 N800 Q805 Q806 L807	V764-V803 HydrophobicContact CG1-CG1 4.42Å; Q765-V803 HydrophobicContact CB-CG2 4.32Å; L768-V803 HydrophobicContact CD1-CG1 3.77Å; I794-V803 HydrophobicContact CG2-CG1 3.87Å; N800-V803 HydrophobicContact CB-CB 4.32Å; N800-V803 HydrophobicContact CB-CG2 4.21Å; N800-V803 WeakPolarHBondContact O-CB 3.41Å; N800-V803 PolarHBondContact O-N 3.03Å; V803-Q805 PolarHBondContact O-N 3.16Å; V803-Q806 PolarHBondContact O-N 3.49Å; V803-L807 HydrophobicContact CG1-CD1 4.02Å; V803-L807 WeakPolarHBondContact O-CG 3.44Å; V803-L807 PolarHBondContact O-N 3.3Å
804	I	88.1	Confident	86.9	Confident	14 Å²	14	41.5 Å²	41.5	7%	0.072	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-45.3	176.9	-66.9	165.7	0	0	0	110.8	L795 N800 D801 L807 A808 L983	L795-I804 HydrophobicContact CD1-CB 4.43Å; L795-I804 HydrophobicContact CD1-CG1 4.35Å; L795-I804 HydrophobicContact CD1-CG2 3.94Å; N800-I804 PolarHBondContact O-N 3Å; N800-I804 VanDerWaalsContact O-N 3.1Å; D801-I804 PolarHBondContact O-N 3.3Å; I804-L807 PolarHBondContact O-N 3.5Å; I804-A808 WeakPolarHBondContact O-CB 3.17Å; I804-A808 PolarHBondContact O-N 3.37Å; I804-L983 HydrophobicContact CG2-CD1 3.97Å; I804-L983 HydrophobicContact CG2-CD2 4.17Å
805	Q	88.2	Confident	86.6	Confident	46 Å²	46	41.8 Å²	41.8	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-34.1	178.1	-74.3	-70.9	-18.3	0	0	113.1	D801 V803 A809	D801-Q805 VanDerWaalsContact O-CB 3.28Å; D801-Q805 WeakPolarHBondContact O-CB 3.43Å; D801-Q805 WeakPolarHBondContact O-CG 3.28Å; D801-Q805 PolarHBondContact O-N 3.27Å; V803-Q805 PolarHBondContact O-N 3.16Å; Q805-A809 PolarHBondContact O-N 3.49Å; Q805-A809 VanDerWaalsContact O-N 3.16Å
806	Q	88.8	Confident	86.2	Confident	42 Å²	42	43 Å²	43	20%	0.196	23%	0.23	C	C	.	.	H	α-helix	trans	-69.4	-44.4	172.6	-77.3	178.1	-24.8	0	0	112.1	Q765 L768 S802 V803 A808 A809 I810	Q765-Q806 VanDerWaalsContact CG-OE1 3.25Å; Q765-Q806 PolarHBondContact O-NE2 3.31Å; Q765-Q806 PolarHBondContact O-OE1 3.48Å; Q765-Q806 VanDerWaalsContact O-OE1 3.11Å; L768-Q806 HydrophobicContact CB-CB 4.09Å; L768-Q806 HydrophobicContact CD1-CB 4.5Å; S802-Q806 WeakPolarHBondContact O-CB 3.33Å; S802-Q806 WeakPolarHBondContact O-CG 3.37Å; S802-Q806 PolarHBondContact O-N 3.17Å; V803-Q806 PolarHBondContact O-N 3.49Å; Q806-A808 VanDerWaalsContact C-N 3.3Å; Q806-A808 PolarHBondContact O-N 3.26Å; Q806-A809 WeakPolarHBondContact O-CB 3.27Å; Q806-A809 PolarHBondContact O-N 3.36Å; Q806-A809 VanDerWaalsContact O-N 3.15Å; Q806-I810 WeakPolarHBondContact O-CG1 3.46Å; Q806-I810 PolarHBondContact O-N 3.47Å
807	L	89.9	Confident	85.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.5	-42.3	174.2	-74.8	167.2	0	0	0	111.5	L768 M791 I794 L795 V803 I804 A809 I810 F811	L768-L807 HydrophobicContact CD1-CD2 4.25Å; L768-L807 HydrophobicContact CD1-CG 4.04Å; L768-L807 HydrophobicContact CD2-CD2 3.63Å; L768-L807 HydrophobicContact CD2-CG 4.29Å; M791-L807 HydrophobicContact CB-CD2 3.82Å; M791-L807 HydrophobicContact CG-CD2 3.84Å; M791-L807 HydrophobicContact SD-CD2 4.2Å; I794-L807 HydrophobicContact CB-CD1 4.14Å; I794-L807 HydrophobicContact CG2-CD1 3.79Å; L795-L807 HydrophobicContact CB-CD1 4.12Å; L795-L807 HydrophobicContact CD1-CD1 4.46Å; V803-L807 HydrophobicContact CG1-CD1 4.02Å; V803-L807 WeakPolarHBondContact O-CG 3.44Å; V803-L807 PolarHBondContact O-N 3.3Å; I804-L807 PolarHBondContact O-N 3.5Å; L807-A809 VanDerWaalsContact C-N 3.32Å; L807-A809 PolarHBondContact O-N 3.47Å; L807-I810 WeakPolarHBondContact O-CB 3.43Å; L807-I810 PolarHBondContact O-N 3.15Å; L807-I810 VanDerWaalsContact O-N 3.17Å; L807-F811 HydrophobicContact CB-CD2 4.46Å; L807-F811 HydrophobicContact CB-CE2 3.96Å; L807-F811 HydrophobicContact CB-CZ 4.46Å; L807-F811 HydrophobicContact CD2-CZ 4.39Å; L807-F811 WeakPolarHBondContact O-CD2 3.28Å; L807-F811 VanDerWaalsContact O-CG 3.26Å; L807-F811 WeakPolarHBondContact O-CG 3.41Å; L807-F811 PolarHBondContact O-N 2.95Å
808	A	87.8	Confident	84.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.8	-40.7	175.1	0	0	0	0	0	113.2	I804 Q806 T812 M979 L983	I804-A808 WeakPolarHBondContact O-CB 3.17Å; I804-A808 PolarHBondContact O-N 3.37Å; Q806-A808 VanDerWaalsContact C-N 3.3Å; Q806-A808 PolarHBondContact O-N 3.26Å; A808-T812 WeakPolarHBondContact O-CB 3.28Å; A808-T812 PolarHBondContact O-N 3.39Å; A808-T812 PolarHBondContact O-OG1 3.01Å; A808-M979 HydrophobicContact CB-CB 4.29Å; A808-M979 HydrophobicContact CB-CG 4.14Å; A808-L983 HydrophobicContact CB-CD1 3.38Å
809	A	87.9	Confident	84.2	Confident	50 Å²	50	46.5 Å²	46.5	41%	0.413	27%	0.269	S	S	.	.	H	α-helix	trans	-66.2	-39.6	174.8	0	0	0	0	0	111.8	Q805 Q806 L807 T812 H813	Q805-A809 PolarHBondContact O-N 3.49Å; Q805-A809 VanDerWaalsContact O-N 3.16Å; Q806-A809 WeakPolarHBondContact O-CB 3.27Å; Q806-A809 PolarHBondContact O-N 3.36Å; Q806-A809 VanDerWaalsContact O-N 3.15Å; L807-A809 VanDerWaalsContact C-N 3.32Å; L807-A809 PolarHBondContact O-N 3.47Å; A809-T812 PolarHBondContact O-N 2.95Å; A809-H813 WeakPolarHBondContact O-CB 3.35Å; A809-H813 PolarHBondContact O-N 3.42Å
810	I	88.1	Confident	84.1	Confident	9 Å²	9	38.4 Å²	38.4	5%	0.046	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-49.4	174	-67.1	164.5	0	0	0	110.8	L768 F771 M791 Q806 L807 T812 H813 C814	L768-I810 HydrophobicContact CB-CD1 3.98Å; L768-I810 HydrophobicContact CD2-CD1 3.59Å; L768-I810 HydrophobicContact CG-CD1 4.37Å; F771-I810 HydrophobicContact CB-CD1 4.02Å; F771-I810 HydrophobicContact CB-CG1 4.12Å; F771-I810 HydrophobicContact CD1-CB 4.34Å; F771-I810 HydrophobicContact CD1-CG1 3.9Å; F771-I810 HydrophobicContact CD1-CG2 3.75Å; F771-I810 HydrophobicContact CE1-CG2 3.72Å; F771-I810 HydrophobicContact CG-CD1 4.26Å; F771-I810 HydrophobicContact CG-CG1 4.13Å; F771-I810 HydrophobicContact CG-CG2 4.21Å; F771-I810 HydrophobicContact CZ-CG2 4.14Å; M791-I810 HydrophobicContact CE-CG2 4.35Å; M791-I810 HydrophobicContact SD-CG2 3.78Å; Q806-I810 WeakPolarHBondContact O-CG1 3.46Å; Q806-I810 PolarHBondContact O-N 3.47Å; L807-I810 WeakPolarHBondContact O-CB 3.43Å; L807-I810 PolarHBondContact O-N 3.15Å; L807-I810 VanDerWaalsContact O-N 3.17Å; I810-T812 VanDerWaalsContact C-N 3.32Å; I810-T812 PolarHBondContact O-N 2.97Å; I810-H813 WeakPolarHBondContact O-CB 3.21Å; I810-H813 PolarHBondContact O-N 3.35Å; I810-H813 VanDerWaalsContact O-N 3.08Å; I810-C814 PolarHBondContact O-N 3.36Å; I810-C814 PolarHBondContact O-SG 3.39Å
811	F	89.4	Confident	83.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-39.4	178.9	-60.9	-41.7	0	0	0	112.4	M791 F792 L795 L807 H813 C814 Y815 L976 M979 L1012	M791-F811 HydrophobicContact CB-CE1 3.72Å; M791-F811 HydrophobicContact CB-CZ 3.76Å; M791-F811 HydrophobicContact CE-CE1 4.27Å; M791-F811 HydrophobicContact SD-CE1 4.34Å; F792-F811 HydrophobicContact CD1-CZ 4.29Å; F792-F811 HydrophobicContact CD2-CE1 4.2Å; F792-F811 HydrophobicContact CD2-CZ 4.15Å; F792-F811 HydrophobicContact CE1-CE2 4.31Å; F792-F811 HydrophobicContact CE1-CZ 4.26Å; F792-F811 HydrophobicContact CE2-CD1 4.43Å; F792-F811 AromaticContact CE2-CE1 3.89Å; F792-F811 HydrophobicContact CE2-CE1 3.89Å; F792-F811 HydrophobicContact CE2-CZ 4.09Å; F792-F811 HydrophobicContact CG-CZ 4.24Å; F792-F811 HydrophobicContact CZ-CE1 4.2Å; F792-F811 HydrophobicContact CZ-CE2 4.43Å; F792-F811 HydrophobicContact CZ-CZ 4.15Å; L795-F811 HydrophobicContact CD2-CE2 4.16Å; L807-F811 HydrophobicContact CB-CD2 4.46Å; L807-F811 HydrophobicContact CB-CE2 3.96Å; L807-F811 HydrophobicContact CB-CZ 4.46Å; L807-F811 HydrophobicContact CD2-CZ 4.39Å; L807-F811 WeakPolarHBondContact O-CD2 3.28Å; L807-F811 VanDerWaalsContact O-CG 3.26Å; L807-F811 WeakPolarHBondContact O-CG 3.41Å; L807-F811 PolarHBondContact O-N 2.95Å; F811-H813 VanDerWaalsContact C-N 3.33Å; F811-C814 PolarHBondContact O-N 3.01Å; F811-Y815 WeakPolarHBondContact O-CB 3.31Å; F811-Y815 PolarHBondContact O-N 3.47Å; F811-L976 HydrophobicContact CB-CD2 4.38Å; F811-M979 HydrophobicContact CB-SD 4.11Å; F811-M979 HydrophobicContact CD2-CE 4.1Å; F811-M979 HydrophobicContact CD2-SD 3.64Å; F811-M979 HydrophobicContact CE2-CE 4.45Å; F811-M979 HydrophobicContact CG-SD 4.32Å; F811-L1012 HydrophobicContact CB-CD2 4.24Å; F811-L1012 HydrophobicContact CD1-CD2 3.5Å; F811-L1012 HydrophobicContact CE1-CD2 4.21Å; F811-L1012 HydrophobicContact CG-CD2 4.18Å
812	T	87.4	Confident	83.6	Confident	42 Å²	42	39.3 Å²	39.3	26%	0.258	25%	0.252	S	S	.	.	H	α-helix	trans	-63.8	-38.9	173.6	-55.2	0	0	0	0	111.4	A808 A809 I810 L976 K977	A808-T812 WeakPolarHBondContact O-CB 3.28Å; A808-T812 PolarHBondContact O-N 3.39Å; A808-T812 PolarHBondContact O-OG1 3.01Å; A809-T812 PolarHBondContact O-N 2.95Å; I810-T812 VanDerWaalsContact C-N 3.32Å; I810-T812 PolarHBondContact O-N 2.97Å; T812-L976 WeakPolarHBondContact CA-O 3.43Å; T812-L976 PolarHBondContact OG1-O 3.27Å; T812-K977 WeakPolarHBondContact CG2-O 3.39Å
813	H	85.7	Confident	83.5	Confident	73 Å²	73	38 Å²	38	34%	0.338	24%	0.242	S	C	.	.	H	α-helix	trans	-68.1	-48.2	176.1	-179.4	34.4	0	0	0	112.1	E776 A809 I810 F811 Y815 G816	E776-H813 IonicContact OE1-CE1 3.95Å; E776-H813 PolarHBondContact OE1-CE1 2.9Å; E776-H813 IonicContact OE1-ND1 3.39Å; A809-H813 WeakPolarHBondContact O-CB 3.35Å; A809-H813 PolarHBondContact O-N 3.42Å; I810-H813 WeakPolarHBondContact O-CB 3.21Å; I810-H813 PolarHBondContact O-N 3.35Å; I810-H813 VanDerWaalsContact O-N 3.08Å; F811-H813 VanDerWaalsContact C-N 3.33Å; H813-Y815 VanDerWaalsContact C-N 3.26Å; H813-Y815 PolarHBondContact O-N 3.01Å; H813-G816 WeakPolarHBondContact O-CA 3.3Å; H813-G816 PolarHBondContact O-N 3.3Å
814	C	84.1	Confident	83.1	Confident	6 Å²	6	41.5 Å²	41.5	4%	0.041	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-26.7	178.2	-66.8	0	0	0	0	113.7	I810 F811 G816 L1012 V1016	I810-C814 PolarHBondContact O-N 3.36Å; I810-C814 PolarHBondContact O-SG 3.39Å; F811-C814 PolarHBondContact O-N 3.01Å; C814-G816 VanDerWaalsContact C-N 3.29Å; C814-L1012 HydrophobicContact CB-CD1 4.13Å; C814-V1016 HydrophobicContact CB-CG2 4.07Å
815	Y	82	Confident	82.6	Confident	8 Å²	8	46.5 Å²	46.5	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-73.7	-22.9	172.7	-163.9	-93.6	0	0	0	112.8	F811 H813 I820 G973 L976 K977 L1012 R1015	F811-Y815 WeakPolarHBondContact O-CB 3.31Å; F811-Y815 PolarHBondContact O-N 3.47Å; H813-Y815 VanDerWaalsContact C-N 3.26Å; H813-Y815 PolarHBondContact O-N 3.01Å; Y815-I820 HydrophobicContact CE1-CG1 4.14Å; Y815-G973 WeakPolarHBondContact OH-CA 3.41Å; Y815-L976 HydrophobicContact CD2-CB 3.76Å; Y815-L976 HydrophobicContact CD2-CD1 3.72Å; Y815-L976 HydrophobicContact CD2-CG 4.39Å; Y815-L976 HydrophobicContact CE2-CB 4.29Å; Y815-L976 HydrophobicContact CE2-CD1 3.93Å; Y815-L976 HydrophobicContact CG-CB 4.08Å; Y815-K977 HydrophobicContact CD1-CB 4.24Å; Y815-K977 HydrophobicContact CE1-CB 4.46Å; Y815-L1012 HydrophobicContact CD2-CD1 4.21Å; Y815-R1015 HydrophobicContact CD2-CB 4.24Å; Y815-R1015 HydrophobicContact CD2-CG 3.96Å; Y815-R1015 HydrophobicContact CE2-CB 4.26Å; Y815-R1015 HydrophobicContact CE2-CG 4.04Å; Y815-R1015 HydrophobicContact CG-CG 4.46Å
816	G	79	Confident	82	Confident	24 Å²	24	47 Å²	47	25%	0.247	29%	0.294	C	S	.	.			trans	79.4	169.8	174.8	0	0	0	0	0	115.1	H813 C814 S818	H813-G816 WeakPolarHBondContact O-CA 3.3Å; H813-G816 PolarHBondContact O-N 3.3Å; C814-G816 VanDerWaalsContact C-N 3.29Å; G816-S818 PolarHBondContact O-N 3.43Å
817	S	71.5	Confident	80.8	Confident	121 Å²	121	54 Å²	54	85%	0.846	32%	0.318	S	S	*	.	S	Bend	trans	-68.6	-22.7	179.4	58	0	0	0	0	113.7	K977	S817-K977 PolarHBondContact O-NZ 2.99Å
818	S	70.7	Confident	79.6	Confident	35 Å²	35	59.5 Å²	59.5	25%	0.245	34%	0.342	C	S	.	.	S	Bend	trans	-47.9	150.3	-177.1	64.6	0	0	0	0	115.1	G816 K977 R1015	G816-S818 PolarHBondContact O-N 3.43Å; S818-K977 PolarHBondContact O-NZ 3.07Å; S818-R1015 VanDerWaalsContact CB-NH2 3.33Å; S818-R1015 PolarHBondContact OG-NH2 3.26Å
819	P	74	Confident	78.3	Confident	104 Å²	104	65 Å²	65	68%	0.675	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-67.2	148.4	174.1	29	-34.2	0	0	0	111.1
820	I	80.4	Confident	77.2	Confident	30 Å²	30	63.8 Å²	63.8	15%	0.154	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-64.7	136.1	172	-57.3	162.7	0	0	0	107.5	Y815 S822 F970 F974 K977	Y815-I820 HydrophobicContact CE1-CG1 4.14Å; I820-S822 PolarHBondContact O-N 2.93Å; I820-F970 HydrophobicContact CB-CD2 4.45Å; I820-F970 HydrophobicContact CB-CE2 3.99Å; I820-F970 HydrophobicContact CB-CZ 4.49Å; I820-F970 HydrophobicContact CD1-CZ 4.42Å; I820-F970 HydrophobicContact CG2-CD2 3.56Å; I820-F970 HydrophobicContact CG2-CE2 3.6Å; I820-F970 HydrophobicContact CG2-CG 4.24Å; I820-F970 HydrophobicContact CG2-CZ 4.31Å; I820-F974 HydrophobicContact CD1-CB 3.94Å; I820-F974 HydrophobicContact CD1-CD2 4.17Å; I820-K977 HydrophobicContact CD1-CD 4.45Å; I820-K977 HydrophobicContact CG1-CD 4.3Å
821	P	78.2	Confident	75.8	Confident	79 Å²	79	68.6 Å²	68.6	51%	0.513	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-53.3	129.1	176.4	-26.7	35.4	0	0	0	111.9	F970	P821-F970 WeakPolarHBondContact O-CD2 3.29Å
822	S	80.2	Confident	74.5	Confident	103 Å²	103	69.9 Å²	69.9	72%	0.72	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-72.5	135.7	177.1	54.8	0	0	0	0	111.1	I820	I820-S822 PolarHBondContact O-N 2.93Å
823	I	84.3	Confident	73.4	Confident	13 Å²	13	75.8 Å²	75.8	7%	0.067	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-59.5	125.5	177.5	-62.1	176	0	0	0	109.9	R937 E940 I941 E966 L967 F970	I823-R937 HydrophobicContact CG2-CG 4.48Å; I823-E940 HydrophobicContact CD1-CB 4.08Å; I823-I941 HydrophobicContact CB-CG1 3.97Å; I823-I941 HydrophobicContact CG2-CG1 3.89Å; I823-E966 HydrophobicContact CG1-CB 4.27Å; I823-E966 HydrophobicContact CG2-CB 3.85Å; I823-L967 HydrophobicContact CD1-CB 4.36Å; I823-L967 HydrophobicContact CD1-CD1 4.37Å; I823-F970 HydrophobicContact CD1-CB 4.01Å; I823-F970 HydrophobicContact CD1-CG 4.33Å; I823-F970 HydrophobicContact CG1-CB 4.15Å; I823-F970 HydrophobicContact CG1-CD2 4.29Å; I823-F970 HydrophobicContact CG1-CG 4.42Å
824	P	79.9	Confident	72.6	Confident	73 Å²	73	75.1 Å²	75.1	47%	0.474	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-72.2	134.9	-175.4	27.2	-34.1	0	0	0	112.6	V826 R937	P824-V826 PolarHBondContact O-N 3.1Å; P824-R937 VanDerWaalsContact O-CD 3.3Å; P824-R937 WeakPolarHBondContact O-CD 3.46Å; P824-R937 WeakPolarHBondContact O-CG 3.24Å
825	E	76.9	Confident	71.9	Confident	119 Å²	119	79.6 Å²	79.6	56%	0.556	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-68.5	128.8	176.7	-75.9	-175.6	-174.1	0	0	112.7	R827 I941	E825-R827 IonicContact OE1-NH2 2.67Å; E825-R827 IonicContact OE2-CZ 2.82Å; E825-R827 IonicContact OE2-NE 2.65Å; E825-R827 PolarHBondContact OE2-NE 3.09Å; E825-R827 IonicContact OE2-NH2 2.71Å; E825-R827 PolarHBondContact OE2-NH2 3.41Å; E825-I941 HydrophobicContact CG-CD1 3.72Å
826	V	76.4	Confident	71.3	Confident	57 Å²	57	81.4 Å²	81.4	35%	0.345	46%	0.457	S	S	.	.			trans	-103.1	93.2	172.8	175.8	0	0	0	0	109.6	P824 K828 R937	P824-V826 PolarHBondContact O-N 3.1Å; V826-K828 HydrophobicContact CG1-CD 4.31Å; V826-K828 HydrophobicContact CG1-CG 3.95Å; V826-K828 PolarHBondContact O-N 3.41Å; V826-K828 VanDerWaalsContact O-N 3.12Å; V826-R937 HydrophobicContact CB-CB 4.32Å; V826-R937 HydrophobicContact CB-CG 4.09Å; V826-R937 HydrophobicContact CG2-CB 4.48Å; V826-R937 HydrophobicContact CG2-CG 3.93Å
827	R	64.1	Low	71.2	Confident	188 Å²	188	86.8 Å²	86.8	71%	0.709	48%	0.475	S	S	*	.			trans	-84	76.7	177.4	-61.7	-173.3	-175.8	-156.6	0.7	111.6	E825	E825-R827 IonicContact OE1-NH2 2.67Å; E825-R827 IonicContact OE2-CZ 2.82Å; E825-R827 IonicContact OE2-NE 2.65Å; E825-R827 PolarHBondContact OE2-NE 3.09Å; E825-R827 IonicContact OE2-NH2 2.71Å; E825-R827 PolarHBondContact OE2-NH2 3.41Å
828	K	63.5	Low	71.4	Confident	116 Å²	116	84.2 Å²	84.2	50%	0.504	45%	0.449	S	S	.	.			trans	-85.4	111.3	168.1	-75.5	-179	-179.3	-175.3	0	110	V826 L830 D933 A934	V826-K828 HydrophobicContact CG1-CD 4.31Å; V826-K828 HydrophobicContact CG1-CG 3.95Å; V826-K828 PolarHBondContact O-N 3.41Å; V826-K828 VanDerWaalsContact O-N 3.12Å; K828-L830 PolarHBondContact O-N 3.27Å; K828-D933 IonicContact NZ-OD2 3.41Å; K828-D933 PolarHBondContact NZ-OD2 2.93Å; K828-A934 HydrophobicContact CB-CB 4.19Å
829	T	60.6	Low	71.9	Confident	114 Å²	114	84.2 Å²	84.2	70%	0.699	45%	0.446	S	S	*	.			trans	-73.4	119.8	169.7	51.2	0	0	0	0	110.3
830	L	64.8	Low	72.2	Confident	25 Å²	25	81.9 Å²	81.9	13%	0.131	43%	0.428	C	S	.	.			trans	-61.6	136.4	175.3	-74.9	167.7	0	0	0	111.1	K828 A832 A866 Y904 L905	K828-L830 PolarHBondContact O-N 3.27Å; L830-A832 VanDerWaalsContact C-N 3.34Å; L830-A832 PolarHBondContact O-N 2.71Å; L830-A866 HydrophobicContact CD2-CB 3.9Å; L830-Y904 HydrophobicContact CD1-CE1 4.26Å; L830-L905 HydrophobicContact CD1-CD2 4.05Å
831	P	59.8	Low	72.2	Confident	110 Å²	110	82.3 Å²	82.3	71%	0.714	43%	0.431	S	S	*	.	S	Bend	trans	-76.8	-17.8	-170.6	30.6	-36.7	0	0	0	114.2
832	A	62.1	Low	72.3	Confident	28 Å²	28	85.6 Å²	85.6	23%	0.231	44%	0.437	C	S	.	.			trans	-121.4	129.6	174.6	0	0	0	0	0	109	L830	L830-A832 VanDerWaalsContact C-N 3.34Å; L830-A832 PolarHBondContact O-N 2.71Å
833	R	64.1	Low	72	Confident	166 Å²	166	89 Å²	89	63%	0.626	44%	0.442	S	S	*	.			trans	-121.9	125.2	176	-67.5	-178.1	172.7	-167.4	-10.4	108.9	G908	R833-G908 PolarHBondContact NH2-O 2.86Å
834	L	68.9	Low	71.3	Confident	59 Å²	59	94.1 Å²	94.1	31%	0.309	47%	0.467	S	S	.	.			trans	-108.1	145.5	166.7	-76.9	169.7	0	0	0	107.9	H859 L862 Y906	L834-H859 HydrophobicContact CD1-CB 3.8Å; L834-L862 HydrophobicContact CB-CD1 3.93Å; L834-L862 HydrophobicContact CD1-CB 4.1Å; L834-L862 HydrophobicContact CD1-CD1 3.89Å; L834-L862 HydrophobicContact CG-CD1 4.07Å; L834-Y906 HydrophobicContact CB-CD1 4.19Å; L834-Y906 HydrophobicContact CB-CE1 4.34Å
835	D	68.2	Low	71.3	Confident	99 Å²	99	92 Å²	92	53%	0.529	45%	0.454	S	S	.	.			trans	-58.5	136.2	177.5	-167.5	-61.6	0	0	0	110.3	H837 F838	D835-H837 PolarHBondContact O-N 2.91Å; D835-H837 VanDerWaalsContact OD1-CB 3.31Å; D835-H837 WeakPolarHBondContact OD1-CB 3.42Å; D835-H837 PolarHBondContact OD1-N 3.41Å; D835-F838 HydrophobicContact CB-CD2 3.79Å; D835-F838 HydrophobicContact CB-CE2 3.91Å; D835-F838 WeakPolarHBondContact O-CD2 3.41Å; D835-F838 PolarHBondContact O-N 3.01Å
836	P	70.8	Confident	71.4	Confident	46 Å²	46	89.4 Å²	89.4	30%	0.299	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-50.4	-23.6	174.2	-30.7	37.4	0	0	0	115.3	F838 L839 Y907	P836-F838 PolarHBondContact O-N 3.12Å; P836-F838 VanDerWaalsContact O-N 3.17Å; P836-L839 VanDerWaalsContact O-CB 3.22Å; P836-L839 WeakPolarHBondContact O-CB 3.43Å; P836-L839 PolarHBondContact O-N 3.2Å; P836-L839 VanDerWaalsContact O-N 3.07Å; P836-Y907 HydrophobicContact CB-CD1 3.94Å; P836-Y907 HydrophobicContact CB-CE1 3.39Å; P836-Y907 HydrophobicContact CG-CD1 3.35Å; P836-Y907 HydrophobicContact CG-CE1 3.31Å; P836-Y907 HydrophobicContact CG-CG 4.33Å
837	H	76.9	Confident	71.6	Confident	137 Å²	137	86.9 Å²	86.9	63%	0.634	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-57.7	-22.9	171.7	-174.2	72.1	0	0	0	114	D835	D835-H837 PolarHBondContact O-N 2.91Å; D835-H837 VanDerWaalsContact OD1-CB 3.31Å; D835-H837 WeakPolarHBondContact OD1-CB 3.42Å; D835-H837 PolarHBondContact OD1-N 3.41Å
838	F	74.7	Confident	72.5	Confident	67 Å²	67	78.9 Å²	78.9	29%	0.294	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-88.4	3.5	177.4	-62.4	-71.7	0	0	0	114	D835 P836 N840 M844 H859 Y906	D835-F838 HydrophobicContact CB-CD2 3.79Å; D835-F838 HydrophobicContact CB-CE2 3.91Å; D835-F838 WeakPolarHBondContact O-CD2 3.41Å; D835-F838 PolarHBondContact O-N 3.01Å; P836-F838 PolarHBondContact O-N 3.12Å; P836-F838 VanDerWaalsContact O-N 3.17Å; F838-N840 PolarHBondContact O-N 2.86Å; F838-M844 HydrophobicContact CE1-CG 4.45Å; F838-H859 PolarHBondContact O-CE1 3.5Å; F838-Y906 HydrophobicContact CB-CE1 3.93Å; F838-Y906 VanDerWaalsContact O-CE1 3.25Å; F838-Y906 WeakPolarHBondContact O-CE1 3.35Å; F838-Y906 PolarHBondContact O-OH 3.01Å
839	L	80.2	Confident	73.5	Confident	35 Å²	35	73.4 Å²	73.4	18%	0.183	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	123.1	176	-175.7	74.5	0	0	0	110.4	P836 N841 F856 M902 Q903 Y906	P836-L839 VanDerWaalsContact O-CB 3.22Å; P836-L839 WeakPolarHBondContact O-CB 3.43Å; P836-L839 PolarHBondContact O-N 3.2Å; P836-L839 VanDerWaalsContact O-N 3.07Å; L839-N841 PolarHBondContact O-N 3.19Å; L839-N841 VanDerWaalsContact O-N 3.17Å; L839-F856 HydrophobicContact CD1-CZ 4.02Å; L839-F856 HydrophobicContact CG-CZ 4.49Å; L839-M902 HydrophobicContact CD1-CB 4.11Å; L839-Q903 HydrophobicContact CD2-CG 3.53Å; L839-Y906 HydrophobicContact CB-CD1 4.3Å; L839-Y906 HydrophobicContact CB-CE1 4.45Å; L839-Y906 HydrophobicContact CD1-CD2 3.88Å; L839-Y906 HydrophobicContact CD1-CE2 4.11Å; L839-Y906 HydrophobicContact CD1-CG 4.06Å
840	N	81.4	Confident	74.7	Confident	55 Å²	55	70.2 Å²	70.2	29%	0.294	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	26.6	179.1	-157.3	20.5	0	0	0	115	F838 F856 Y857 Y895	F838-N840 PolarHBondContact O-N 2.86Å; N840-F856 HydrophobicContact CB-CD2 4.46Å; N840-F856 HydrophobicContact CB-CE1 4.38Å; N840-F856 HydrophobicContact CB-CE2 4.05Å; N840-F856 HydrophobicContact CB-CZ 4Å; N840-F856 WeakPolarHBondContact OD1-CA 3.46Å; N840-Y857 WeakPolarHBondContact CA-O 3.47Å; N840-Y857 PolarHBondContact N-O 3.32Å; N840-Y857 PolarHBondContact OD1-N 3.44Å; N840-Y895 PolarHBondContact ND2-OH 2.7Å
841	N	80.9	Confident	75.6	Confident	40 Å²	40	69 Å²	69	21%	0.214	35%	0.349	C	S	.	.			trans	-84.4	121.8	177.9	-172.7	-21	0	0	0	111.4	L839 E843 Y857	L839-N841 PolarHBondContact O-N 3.19Å; L839-N841 VanDerWaalsContact O-N 3.17Å; N841-E843 PolarHBondContact O-N 2.93Å; N841-E843 PolarHBondContact OD1-N 3.5Å; N841-Y857 WeakPolarHBondContact O-CB 3.14Å
842	K	79.3	Confident	76.7	Confident	147 Å²	147	69.2 Å²	69.2	64%	0.639	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-25	-176.5	-179.4	173.2	179	-178	0	114.7	Y857	K842-Y857 HydrophobicContact CB-CD1 4.33Å; K842-Y857 HydrophobicContact CB-CD2 3.99Å; K842-Y857 HydrophobicContact CB-CE1 4.25Å; K842-Y857 HydrophobicContact CB-CE2 3.89Å; K842-Y857 HydrophobicContact CB-CG 4.22Å; K842-Y857 HydrophobicContact CD-CE1 4.46Å; K842-Y857 HydrophobicContact CD-CE2 4.19Å; K842-Y857 HydrophobicContact CG-CD1 4.33Å; K842-Y857 HydrophobicContact CG-CE1 3.83Å; K842-Y857 HydrophobicContact CG-CE2 4.04Å
843	E	73.6	Confident	77.3	Confident	175 Å²	175	71 Å²	71	82%	0.818	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-28.2	-171.7	-63.5	-172.1	167.9	0	0	113.4	N841	N841-E843 PolarHBondContact O-N 2.93Å; N841-E843 PolarHBondContact OD1-N 3.5Å
844	M	70.7	Confident	78.2	Confident	121 Å²	121	68.6 Å²	68.6	60%	0.596	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-5.7	-170.8	-63.7	-64.4	-72.8	0	0	114.5	F838 H859	F838-M844 HydrophobicContact CE1-CG 4.45Å; M844-H859 PolarHBondContact O-CD2 3.14Å; M844-H859 PolarHBondContact O-NE2 2.76Å
845	S	78.7	Confident	78.9	Confident	29 Å²	29	69.5 Å²	69.5	20%	0.203	36%	0.361	C	S	.	.			trans	-73	138.9	-179.1	60.5	0	0	0	0	113.8	Y857 A858	S845-Y857 WeakPolarHBondContact OG-CD1 3.4Å; S845-A858 WeakPolarHBondContact CA-O 3.46Å; S845-A858 VanDerWaalsContact CB-O 3.32Å; S845-A858 WeakPolarHBondContact CB-O 3.42Å
846	D	78.9	Confident	79.7	Confident	63 Å²	63	64.8 Å²	64.8	34%	0.337	34%	0.335	S	S	.	.	S	Bend	trans	-106.5	-3.6	174.1	67.3	-10.9	0	0	0	113.7	A858 H859 K860	D846-A858 PolarHBondContact N-O 3.28Å; D846-H859 WeakPolarHBondContact OD1-CA 3.39Å; D846-K860 VanDerWaalsContact O-CE 3.31Å; D846-K860 WeakPolarHBondContact O-CE 3.36Å; D846-K860 WeakPolarHBondContact OD1-CG 3.41Å; D846-K860 PolarHBondContact OD1-N 2.97Å; D846-K860 VanDerWaalsContact OD2-CB 3.32Å; D846-K860 WeakPolarHBondContact OD2-CB 3.4Å; D846-K860 WeakPolarHBondContact OD2-CD 3.46Å; D846-K860 WeakPolarHBondContact OD2-CG 3.3Å
847	V	80.8	Confident	80.4	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.03	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	143.4	168.6	165.8	0	0	0	0	111.5	F849 A858 K860 M874 I888	V847-F849 HydrophobicContact CG1-CD2 3.8Å; V847-F849 HydrophobicContact CG1-CE2 3.4Å; V847-F849 HydrophobicContact CG1-CZ 3.82Å; V847-A858 PolarHBondContact N-O 3.48Å; V847-A858 PolarHBondContact O-N 3.37Å; V847-K860 HydrophobicContact CB-CG 4.44Å; V847-K860 HydrophobicContact CG2-CD 3.98Å; V847-K860 HydrophobicContact CG2-CG 3.35Å; V847-M874 HydrophobicContact CG2-CE 3.48Å; V847-M874 VanDerWaalsContact CG2-CE 3.48Å; V847-M874 HydrophobicContact CG2-SD 4.06Å; V847-I888 HydrophobicContact CG1-CD1 4.24Å
848	T	83.6	Confident	80.8	Confident	20 Å²	20	58.2 Å²	58.2	12%	0.123	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135.6	165.3	29	0	0	0	0	110.7	F856 Y857 K886 T887 I888	T848-F856 CarbonylContact C-O 3.51Å; T848-F856 WeakPolarHBondContact CA-O 3.41Å; T848-Y857 HydrophobicContact CG2-CD1 3.31Å; T848-Y857 HydrophobicContact CG2-CE1 3.3Å; T848-Y857 HydrophobicContact CG2-CG 4.32Å; T848-K886 PolarHBondContact N-O 3.4Å; T848-K886 VanDerWaalsContact N-O 3.16Å; T848-K886 PolarHBondContact OG1-O 3.02Å; T848-T887 CarbonylContact O-C 3.49Å; T848-T887 VanDerWaalsContact O-CA 3.29Å; T848-T887 WeakPolarHBondContact O-CA 3.36Å; T848-I888 PolarHBondContact O-N 3.22Å
849	F	84.9	Confident	81.3	Confident	1 Å²	1	56.2 Å²	56.2	0%	0.004	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	148.7	166.2	-67.1	-89.3	0	0	0	110.3	V847 V851 L855 F856 A858 L863 F870 I888 I890 F898	V847-F849 HydrophobicContact CG1-CD2 3.8Å; V847-F849 HydrophobicContact CG1-CE2 3.4Å; V847-F849 HydrophobicContact CG1-CZ 3.82Å; F849-V851 HydrophobicContact CB-CG2 4.16Å; F849-L855 CarbonylContact O-C 3.56Å; F849-L855 WeakPolarHBondContact O-CA 3.23Å; F849-F856 HydrophobicContact CB-CB 4.37Å; F849-F856 PolarHBondContact N-O 3.35Å; F849-F856 PolarHBondContact O-N 2.98Å; F849-A858 HydrophobicContact CD2-CB 4.11Å; F849-A858 HydrophobicContact CE2-CB 3.9Å; F849-L863 HydrophobicContact CE2-CD1 3.61Å; F849-L863 HydrophobicContact CZ-CD1 3.8Å; F849-F870 HydrophobicContact CE1-CE1 4.33Å; F849-F870 HydrophobicContact CZ-CD1 4.32Å; F849-F870 HydrophobicContact CZ-CE1 4.06Å; F849-I888 CarbonylContact C-O 3.53Å; F849-I888 WeakPolarHBondContact CA-O 3.03Å; F849-I888 HydrophobicContact CD1-CB 3.64Å; F849-I888 HydrophobicContact CD1-CG2 3.8Å; F849-I888 HydrophobicContact CE1-CB 3.74Å; F849-I888 HydrophobicContact CE1-CD1 4.03Å; F849-I888 HydrophobicContact CE1-CG1 4.46Å; F849-I888 HydrophobicContact CE1-CG2 3.7Å; F849-I888 HydrophobicContact CZ-CD1 4.32Å; F849-I890 HydrophobicContact CD1-CD1 3.6Å; F849-I890 HydrophobicContact CD1-CG1 4.09Å; F849-I890 HydrophobicContact CE1-CD1 4.13Å; F849-I890 HydrophobicContact CG-CD1 4.34Å; F849-F898 HydrophobicContact CB-CE1 3.92Å; F849-F898 HydrophobicContact CB-CZ 4.03Å; F849-F898 HydrophobicContact CD1-CZ 4.08Å; F849-F898 HydrophobicContact CD2-CE1 4.16Å; F849-F898 AromaticContact CD2-CZ 3.76Å; F849-F898 HydrophobicContact CD2-CZ 3.76Å; F849-F898 HydrophobicContact CE2-CZ 4.23Å; F849-F898 HydrophobicContact CG-CE1 4.06Å; F849-F898 AromaticContact CG-CZ 3.68Å; F849-F898 HydrophobicContact CG-CZ 3.68Å
850	L	85.2	Confident	81.3	Confident	46 Å²	46	58.8 Å²	58.8	24%	0.241	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	114.5	169.3	-178.2	69.7	0	0	0	107.7	K854 L855 T887 I888 E889 I890	L850-K854 WeakPolarHBondContact CA-O 3.47Å; L850-L855 HydrophobicContact CD1-CD2 3.97Å; L850-T887 HydrophobicContact CB-CG2 3.74Å; L850-I888 PolarHBondContact N-O 2.66Å; L850-E889 HydrophobicContact CD2-CG 4.32Å; L850-E889 WeakPolarHBondContact O-CA 3.39Å; L850-I890 PolarHBondContact O-N 3.22Å
851	V	84.5	Confident	81.1	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.9	-176.5	-168.2	0	0	0	0	107.8	F849 G853 K854 I890 M893 Y895 F898	F849-V851 HydrophobicContact CB-CG2 4.16Å; V851-G853 PolarHBondContact O-N 2.87Å; V851-K854 PolarHBondContact N-O 3.34Å; V851-K854 WeakPolarHBondContact O-CB 3.24Å; V851-K854 PolarHBondContact O-N 2.69Å; V851-I890 HydrophobicContact CG2-CB 4.14Å; V851-I890 HydrophobicContact CG2-CD1 4.16Å; V851-I890 HydrophobicContact CG2-CG1 4.49Å; V851-M893 WeakPolarHBondContact CG1-O 3.48Å; V851-Y895 HydrophobicContact CB-CD2 4.15Å; V851-F898 HydrophobicContact CG1-CB 4.23Å; V851-F898 HydrophobicContact CG2-CD1 3.7Å; V851-F898 HydrophobicContact CG2-CE1 4.02Å; V851-F898 HydrophobicContact CG2-CG 4.04Å
852	E	82.4	Confident	81.2	Confident	114 Å²	114	59.3 Å²	59.3	53%	0.533	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	39.4	-172	-61.3	-175.5	128	0	0	114.1	K854 K894 Y895	E852-K854 PolarHBondContact O-N 3.15Å; E852-K894 VanDerWaalsContact CD-CA 3.49Å; E852-K894 WeakPolarHBondContact OE2-CA 3.39Å; E852-Y895 PolarHBondContact OE2-N 2.78Å
853	G	75.3	Confident	81.3	Confident	67 Å²	67	52.3 Å²	52.3	69%	0.691	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	2.2	-178	0	0	0	0	0	115.4	V851	V851-G853 PolarHBondContact O-N 2.87Å
854	K	83.1	Confident	81.6	Confident	114 Å²	114	46.4 Å²	46.4	50%	0.496	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	143.5	175	-65.5	170.1	-176.2	165.4	0	110.9	L850 V851 E852 Y895	L850-K854 WeakPolarHBondContact CA-O 3.47Å; V851-K854 PolarHBondContact N-O 3.34Å; V851-K854 WeakPolarHBondContact O-CB 3.24Å; V851-K854 PolarHBondContact O-N 2.69Å; E852-K854 PolarHBondContact O-N 3.15Å; K854-Y895 HydrophobicContact CB-CD2 3.44Å; K854-Y895 VanDerWaalsContact CB-CD2 3.44Å; K854-Y895 HydrophobicContact CB-CE2 3.41Å; K854-Y895 VanDerWaalsContact CB-CE2 3.41Å; K854-Y895 HydrophobicContact CB-CG 4.26Å; K854-Y895 HydrophobicContact CD-CD1 4.02Å; K854-Y895 HydrophobicContact CD-CD2 3.74Å; K854-Y895 HydrophobicContact CD-CE1 4.37Å; K854-Y895 HydrophobicContact CD-CE2 4.12Å; K854-Y895 HydrophobicContact CD-CG 3.68Å; K854-Y895 HydrophobicContact CG-CD2 4.24Å; K854-Y895 HydrophobicContact CG-CE2 4.42Å
855	L	83.4	Confident	82.1	Confident	79 Å²	79	43.9 Å²	43.9	41%	0.414	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	144.7	175.6	-63.9	173.4	0	0	0	111.4	F849 L850 T887 Y895	F849-L855 CarbonylContact O-C 3.56Å; F849-L855 WeakPolarHBondContact O-CA 3.23Å; L850-L855 HydrophobicContact CD1-CD2 3.97Å; L855-T887 HydrophobicContact CD2-CG2 4.42Å; L855-Y895 PolarHBondContact O-OH 2.76Å; L855-Y895 VanDerWaalsContact O-OH 3.09Å
856	F	85.3	Confident	82.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	130	172.5	-166.9	-76.4	0	0	0	110.2	L839 N840 T848 F849 Y895 F898 Q899 M902	L839-F856 HydrophobicContact CD1-CZ 4.02Å; L839-F856 HydrophobicContact CG-CZ 4.49Å; N840-F856 HydrophobicContact CB-CD2 4.46Å; N840-F856 HydrophobicContact CB-CE1 4.38Å; N840-F856 HydrophobicContact CB-CE2 4.05Å; N840-F856 HydrophobicContact CB-CZ 4Å; N840-F856 WeakPolarHBondContact OD1-CA 3.46Å; T848-F856 CarbonylContact C-O 3.51Å; T848-F856 WeakPolarHBondContact CA-O 3.41Å; F849-F856 HydrophobicContact CB-CB 4.37Å; F849-F856 PolarHBondContact N-O 3.35Å; F849-F856 PolarHBondContact O-N 2.98Å; F856-Y895 HydrophobicContact CB-CE2 4.26Å; F856-Y895 HydrophobicContact CD2-CE2 4.24Å; F856-Y895 AromaticContact CD2-CZ 3.99Å; F856-F898 HydrophobicContact CB-CD1 4.24Å; F856-F898 HydrophobicContact CB-CE1 3.9Å; F856-F898 HydrophobicContact CD1-CD1 4.38Å; F856-F898 AromaticContact CD1-CE1 3.74Å; F856-F898 HydrophobicContact CD1-CE1 3.74Å; F856-F898 HydrophobicContact CD2-CD1 4.12Å; F856-F898 HydrophobicContact CD2-CE1 4.27Å; F856-F898 HydrophobicContact CE1-CE1 4.37Å; F856-F898 AromaticContact CG-CD1 3.99Å; F856-F898 HydrophobicContact CG-CD1 3.99Å; F856-F898 AromaticContact CG-CE1 3.7Å; F856-F898 HydrophobicContact CG-CE1 3.7Å; F856-Q899 HydrophobicContact CE2-CB 4.11Å; F856-Q899 HydrophobicContact CE2-CG 4.22Å; F856-M902 HydrophobicContact CD1-CE 4.39Å; F856-M902 HydrophobicContact CD1-CG 4.43Å; F856-M902 HydrophobicContact CE1-CB 3.88Å; F856-M902 HydrophobicContact CE1-CE 3.73Å; F856-M902 HydrophobicContact CE1-CG 3.74Å; F856-M902 HydrophobicContact CE2-CB 4.48Å; F856-M902 HydrophobicContact CZ-CB 3.59Å; F856-M902 HydrophobicContact CZ-CG 3.86Å
857	Y	84.8	Confident	82.3	Confident	45 Å²	45	40.9 Å²	40.9	18%	0.176	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.8	-173.7	-63.3	-77.8	0	0	0	111.5	N840 N841 K842 S845 T848	N840-Y857 WeakPolarHBondContact CA-O 3.47Å; N840-Y857 PolarHBondContact N-O 3.32Å; N840-Y857 PolarHBondContact OD1-N 3.44Å; N841-Y857 WeakPolarHBondContact O-CB 3.14Å; K842-Y857 HydrophobicContact CB-CD1 4.33Å; K842-Y857 HydrophobicContact CB-CD2 3.99Å; K842-Y857 HydrophobicContact CB-CE1 4.25Å; K842-Y857 HydrophobicContact CB-CE2 3.89Å; K842-Y857 HydrophobicContact CB-CG 4.22Å; K842-Y857 HydrophobicContact CD-CE1 4.46Å; K842-Y857 HydrophobicContact CD-CE2 4.19Å; K842-Y857 HydrophobicContact CG-CD1 4.33Å; K842-Y857 HydrophobicContact CG-CE1 3.83Å; K842-Y857 HydrophobicContact CG-CE2 4.04Å; S845-Y857 WeakPolarHBondContact OG-CD1 3.4Å; T848-Y857 HydrophobicContact CG2-CD1 3.31Å; T848-Y857 HydrophobicContact CG2-CE1 3.3Å; T848-Y857 HydrophobicContact CG2-CG 4.32Å
858	A	84.9	Confident	82.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	171.6	-170.4	0	0	0	0	0	114	S845 D846 V847 F849 L863 M902	S845-A858 WeakPolarHBondContact CA-O 3.46Å; S845-A858 VanDerWaalsContact CB-O 3.32Å; S845-A858 WeakPolarHBondContact CB-O 3.42Å; D846-A858 PolarHBondContact N-O 3.28Å; V847-A858 PolarHBondContact N-O 3.48Å; V847-A858 PolarHBondContact O-N 3.37Å; F849-A858 HydrophobicContact CD2-CB 4.11Å; F849-A858 HydrophobicContact CE2-CB 3.9Å; A858-L863 HydrophobicContact CB-CD1 4.01Å; A858-M902 HydrophobicContact CB-CE 3.59Å
859	H	85.5	Confident	82.4	Confident	24 Å²	24	49.8 Å²	49.8	11%	0.111	27%	0.268	C	S	.	.			trans	-116.4	122.9	-177.8	-57.1	87.2	0	0	0	112.7	L834 F838 M844 D846 V861 L862 L863 Y906	L834-H859 HydrophobicContact CD1-CB 3.8Å; F838-H859 PolarHBondContact O-CE1 3.5Å; M844-H859 PolarHBondContact O-CD2 3.14Å; M844-H859 PolarHBondContact O-NE2 2.76Å; D846-H859 WeakPolarHBondContact OD1-CA 3.39Å; H859-V861 PolarHBondContact O-N 2.6Å; H859-L862 PolarHBondContact O-N 3.01Å; H859-L863 WeakPolarHBondContact O-CG 3.48Å; H859-L863 PolarHBondContact O-N 3.39Å; H859-Y906 PolarHBondContact CE1-OH 3.11Å; H859-Y906 AromaticContact ND1-CE1 3.93Å; H859-Y906 AromaticContact ND1-CZ 3.65Å; H859-Y906 PolarHBondContact ND1-OH 3.07Å
860	K	79.6	Confident	82.3	Confident	89 Å²	89	49.8 Å²	49.8	39%	0.387	27%	0.268	S	S	.	.	H	α-helix	trans	-56.5	-45.4	-178.4	-69.6	176.6	-172.6	-178.1	0	112.8	D846 V847 L862 L863 V864 M874	D846-K860 VanDerWaalsContact O-CE 3.31Å; D846-K860 WeakPolarHBondContact O-CE 3.36Å; D846-K860 WeakPolarHBondContact OD1-CG 3.41Å; D846-K860 PolarHBondContact OD1-N 2.97Å; D846-K860 VanDerWaalsContact OD2-CB 3.32Å; D846-K860 WeakPolarHBondContact OD2-CB 3.4Å; D846-K860 WeakPolarHBondContact OD2-CD 3.46Å; D846-K860 WeakPolarHBondContact OD2-CG 3.3Å; V847-K860 HydrophobicContact CB-CG 4.44Å; V847-K860 HydrophobicContact CG2-CD 3.98Å; V847-K860 HydrophobicContact CG2-CG 3.35Å; K860-L862 VanDerWaalsContact C-N 3.28Å; K860-L862 PolarHBondContact O-N 3.35Å; K860-L863 PolarHBondContact O-N 2.79Å; K860-V864 WeakPolarHBondContact O-CB 3.4Å; K860-V864 VanDerWaalsContact O-CG2 3.27Å; K860-V864 WeakPolarHBondContact O-CG2 3.48Å; K860-V864 PolarHBondContact O-N 3.43Å; K860-M874 HydrophobicContact CD-CE 4.24Å; K860-M874 HydrophobicContact CG-CE 4.15Å
861	V	78.5	Confident	82.1	Confident	102 Å²	102	52.5 Å²	52.5	62%	0.618	28%	0.277	S	S	*	.	H	α-helix	trans	-58.7	-42.8	-174.1	178.6	0	0	0	0	111	H859 T865	H859-V861 PolarHBondContact O-N 2.6Å; V861-T865 WeakPolarHBondContact O-CB 3.36Å; V861-T865 VanDerWaalsContact O-CG2 3.31Å; V861-T865 WeakPolarHBondContact O-CG2 3.26Å; V861-T865 PolarHBondContact O-N 3.27Å; V861-T865 PolarHBondContact O-OG1 2.83Å
862	L	81.9	Confident	81.9	Confident	4 Å²	4	55 Å²	55	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-70.3	-42.8	178.6	178.9	142.9	0	0	0	111.7	L834 H859 K860 T865 A866 L905 Y906	L834-L862 HydrophobicContact CB-CD1 3.93Å; L834-L862 HydrophobicContact CD1-CB 4.1Å; L834-L862 HydrophobicContact CD1-CD1 3.89Å; L834-L862 HydrophobicContact CG-CD1 4.07Å; H859-L862 PolarHBondContact O-N 3.01Å; K860-L862 VanDerWaalsContact C-N 3.28Å; K860-L862 PolarHBondContact O-N 3.35Å; L862-T865 PolarHBondContact O-OG1 3.48Å; L862-A866 WeakPolarHBondContact O-CB 3.23Å; L862-A866 PolarHBondContact O-N 2.91Å; L862-L905 HydrophobicContact CD2-CB 3.83Å; L862-Y906 HydrophobicContact CD1-CD2 4.25Å; L862-Y906 HydrophobicContact CD1-CG 4.38Å; L862-Y906 HydrophobicContact CD2-CD2 3.98Å; L862-Y906 HydrophobicContact CD2-CE2 3.93Å
863	L	81.3	Confident	81.8	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.6	-45.2	179	-69	172.7	0	0	0	113.3	F849 A858 H859 K860 T865 A866 S867 F870 M902 L905	F849-L863 HydrophobicContact CE2-CD1 3.61Å; F849-L863 HydrophobicContact CZ-CD1 3.8Å; A858-L863 HydrophobicContact CB-CD1 4.01Å; H859-L863 WeakPolarHBondContact O-CG 3.48Å; H859-L863 PolarHBondContact O-N 3.39Å; K860-L863 PolarHBondContact O-N 2.79Å; L863-T865 VanDerWaalsContact C-N 3.32Å; L863-T865 PolarHBondContact O-N 3.15Å; L863-A866 PolarHBondContact O-N 3.17Å; L863-S867 PolarHBondContact O-N 2.82Å; L863-F870 HydrophobicContact CB-CB 4.09Å; L863-F870 HydrophobicContact CB-CD1 4.47Å; L863-F870 HydrophobicContact CB-CG 4.14Å; L863-F870 HydrophobicContact CD2-CD1 4.11Å; L863-F870 HydrophobicContact CD2-CD2 3.94Å; L863-F870 HydrophobicContact CD2-CE1 4.05Å; L863-F870 HydrophobicContact CD2-CE2 3.89Å; L863-F870 HydrophobicContact CD2-CG 4.07Å; L863-F870 HydrophobicContact CD2-CZ 3.94Å; L863-F870 WeakPolarHBondContact O-CB 3.28Å; L863-M902 HydrophobicContact CD2-CE 3.97Å; L863-M902 HydrophobicContact CD2-SD 3.84Å; L863-L905 HydrophobicContact CD2-CD1 3.88Å
864	V	81	Confident	81.8	Confident	52 Å²	52	50.7 Å²	50.7	32%	0.315	26%	0.257	S	S	.	.	H	α-helix	trans	-70.2	-28.4	-178.5	171.9	0	0	0	0	112.2	K860 K871 M874	K860-V864 WeakPolarHBondContact O-CB 3.4Å; K860-V864 VanDerWaalsContact O-CG2 3.27Å; K860-V864 WeakPolarHBondContact O-CG2 3.48Å; K860-V864 PolarHBondContact O-N 3.43Å; V864-K871 HydrophobicContact CG1-CB 4.13Å; V864-K871 HydrophobicContact CG1-CD 4.18Å; V864-K871 HydrophobicContact CG1-CG 3.95Å; V864-M874 HydrophobicContact CG2-CG 4.06Å
865	T	79.9	Confident	81.2	Confident	68 Å²	68	48.5 Å²	48.5	42%	0.417	25%	0.253	S	S	.	.	H	α-helix	trans	-84.6	-24.6	174.5	52	0	0	0	0	113.3	V861 L862 L863	V861-T865 WeakPolarHBondContact O-CB 3.36Å; V861-T865 VanDerWaalsContact O-CG2 3.31Å; V861-T865 WeakPolarHBondContact O-CG2 3.26Å; V861-T865 PolarHBondContact O-N 3.27Å; V861-T865 PolarHBondContact O-OG1 2.83Å; L862-T865 PolarHBondContact O-OG1 3.48Å; L863-T865 VanDerWaalsContact C-N 3.32Å; L863-T865 PolarHBondContact O-N 3.15Å
866	A	78.8	Confident	80.2	Confident	22 Å²	22	49.7 Å²	49.7	18%	0.182	26%	0.26	C	S	.	.	H	α-helix	trans	-82.1	-34.1	179.3	0	0	0	0	0	114.5	L830 L862 L863 L905	L830-A866 HydrophobicContact CD2-CB 3.9Å; L862-A866 WeakPolarHBondContact O-CB 3.23Å; L862-A866 PolarHBondContact O-N 2.91Å; L863-A866 PolarHBondContact O-N 3.17Å; A866-L905 HydrophobicContact CB-CD2 3.65Å
867	S	84.6	Confident	78.9	Confident	6 Å²	6	54.5 Å²	54.5	4%	0.042	28%	0.281	C	S	.	.			trans	-151.4	140.7	179.8	160.7	0	0	0	0	114.5	L863 R869 F870 K871 F930	L863-S867 PolarHBondContact O-N 2.82Å; S867-R869 VanDerWaalsContact C-N 3.27Å; S867-R869 PolarHBondContact O-N 3.04Å; S867-R869 PolarHBondContact OG-N 3.06Å; S867-F870 PolarHBondContact O-N 2.85Å; S867-K871 PolarHBondContact O-N 3.43Å; S867-K871 VanDerWaalsContact O-N 3.11Å; S867-F930 VanDerWaalsContact CB-O 3.3Å; S867-F930 WeakPolarHBondContact CB-O 3.32Å; S867-F930 PolarHBondContact OG-O 3.08Å
868	N	81.1	Confident	77.4	Confident	109 Å²	109	57 Å²	57	58%	0.583	31%	0.305	S	S	*	.	H	α-helix	trans	-62.9	-31.1	172.2	-72.1	-40.4	0	0	0	112.5	K871 T872	N868-K871 WeakPolarHBondContact O-CB 3.29Å; N868-K871 PolarHBondContact O-N 3.18Å; N868-T872 PolarHBondContact O-N 2.98Å; N868-T872 PolarHBondContact O-OG1 3.34Å; N868-T872 VanDerWaalsContact O-OG1 3.13Å
869	R	83.5	Confident	75.7	Confident	104 Å²	104	65.3 Å²	65.3	39%	0.392	34%	0.344	S	S	.	.	H	α-helix	trans	-66.7	-43.9	177.8	-174.3	62.1	174.8	162.8	1.4	111.4	S867 K871 T872 L873 F930 Q931	S867-R869 VanDerWaalsContact C-N 3.27Å; S867-R869 PolarHBondContact O-N 3.04Å; S867-R869 PolarHBondContact OG-N 3.06Å; R869-K871 VanDerWaalsContact C-N 3.33Å; R869-T872 PolarHBondContact O-N 3.35Å; R869-L873 HydrophobicContact CG-CD1 4.33Å; R869-L873 WeakPolarHBondContact O-CG 3.34Å; R869-L873 PolarHBondContact O-N 3.05Å; R869-F930 HydrophobicContact CG-CD1 4.49Å; R869-Q931 HydrophobicContact CB-CG 4.26Å
870	F	84.2	Confident	74	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-61.1	-43.7	172.3	-82	-61.2	0	0	0	111.2	F849 L863 S867 T872 L873 M874 M901 L905 F930	F849-F870 HydrophobicContact CE1-CE1 4.33Å; F849-F870 HydrophobicContact CZ-CD1 4.32Å; F849-F870 HydrophobicContact CZ-CE1 4.06Å; L863-F870 HydrophobicContact CB-CB 4.09Å; L863-F870 HydrophobicContact CB-CD1 4.47Å; L863-F870 HydrophobicContact CB-CG 4.14Å; L863-F870 HydrophobicContact CD2-CD1 4.11Å; L863-F870 HydrophobicContact CD2-CD2 3.94Å; L863-F870 HydrophobicContact CD2-CE1 4.05Å; L863-F870 HydrophobicContact CD2-CE2 3.89Å; L863-F870 HydrophobicContact CD2-CG 4.07Å; L863-F870 HydrophobicContact CD2-CZ 3.94Å; L863-F870 WeakPolarHBondContact O-CB 3.28Å; S867-F870 PolarHBondContact O-N 2.85Å; F870-T872 PolarHBondContact O-N 2.91Å; F870-L873 HydrophobicContact CD1-CD1 4.46Å; F870-L873 PolarHBondContact O-N 2.77Å; F870-M874 WeakPolarHBondContact O-CG 3.33Å; F870-M874 PolarHBondContact O-N 3.14Å; F870-M901 HydrophobicContact CE2-CE 4.3Å; F870-M901 HydrophobicContact CZ-CE 3.73Å; F870-L905 HydrophobicContact CE2-CD1 4.1Å; F870-F930 HydrophobicContact CD1-CD1 4.06Å; F870-F930 HydrophobicContact CD1-CE1 4.14Å; F870-F930 HydrophobicContact CD2-CD1 4.12Å; F870-F930 AromaticContact CE1-CD1 3.54Å; F870-F930 HydrophobicContact CE1-CD1 3.54Å; F870-F930 AromaticContact CE1-CE1 3.45Å; F870-F930 HydrophobicContact CE1-CE1 3.45Å; F870-F930 VanDerWaalsContact CE1-CE1 3.45Å; F870-F930 HydrophobicContact CE1-CZ 4.45Å; F870-F930 HydrophobicContact CE2-CB 4.09Å; F870-F930 AromaticContact CE2-CD1 3.59Å; F870-F930 HydrophobicContact CE2-CD1 3.59Å; F870-F930 HydrophobicContact CE2-CE1 4.33Å; F870-F930 HydrophobicContact CE2-CG 4.03Å; F870-F930 HydrophobicContact CG-CD1 4.32Å; F870-F930 HydrophobicContact CZ-CB 4.48Å; F870-F930 AromaticContact CZ-CD1 3.27Å; F870-F930 HydrophobicContact CZ-CD1 3.27Å; F870-F930 AromaticContact CZ-CE1 3.57Å; F870-F930 HydrophobicContact CZ-CE1 3.57Å; F870-F930 AromaticContact CZ-CG 3.91Å; F870-F930 HydrophobicContact CZ-CG 3.91Å; F870-F930 HydrophobicContact CZ-CZ 4.42Å
871	K	80.4	Confident	72.3	Confident	103 Å²	103	74.1 Å²	74.1	45%	0.448	39%	0.39	S	S	.	.	H	α-helix	trans	-53.5	-48.6	173.8	-175.5	176	-179.6	-177	0	112.6	V864 S867 N868 R869 M874 T875	V864-K871 HydrophobicContact CG1-CB 4.13Å; V864-K871 HydrophobicContact CG1-CD 4.18Å; V864-K871 HydrophobicContact CG1-CG 3.95Å; S867-K871 PolarHBondContact O-N 3.43Å; S867-K871 VanDerWaalsContact O-N 3.11Å; N868-K871 WeakPolarHBondContact O-CB 3.29Å; N868-K871 PolarHBondContact O-N 3.18Å; R869-K871 VanDerWaalsContact C-N 3.33Å; K871-M874 PolarHBondContact O-N 3.12Å; K871-T875 WeakPolarHBondContact O-CG2 3.39Å; K871-T875 PolarHBondContact O-N 2.95Å; K871-T875 PolarHBondContact O-OG1 3.17Å
872	T	80.8	Confident	70.7	Confident	54 Å²	54	73 Å²	73	33%	0.331	40%	0.399	S	S	.	.	H	α-helix	trans	-64.9	-39.6	177.4	-54.9	0	0	0	0	113.1	N868 R869 F870 M874 T875 N876	N868-T872 PolarHBondContact O-N 2.98Å; N868-T872 PolarHBondContact O-OG1 3.34Å; N868-T872 VanDerWaalsContact O-OG1 3.13Å; R869-T872 PolarHBondContact O-N 3.35Å; F870-T872 PolarHBondContact O-N 2.91Å; T872-M874 VanDerWaalsContact C-N 3.26Å; T872-M874 PolarHBondContact O-N 2.85Å; T872-T875 WeakPolarHBondContact CA-OG1 3.44Å; T872-T875 PolarHBondContact O-N 3.4Å; T872-T875 PolarHBondContact O-OG1 2.75Å; T872-N876 WeakPolarHBondContact O-CB 3.37Å; T872-N876 PolarHBondContact O-N 2.94Å; T872-N876 PolarHBondContact O-OD1 3.25Å
873	L	79.5	Confident	69.1	Low	51 Å²	51	80.2 Å²	80.2	27%	0.267	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-34.6	175.2	-71.7	169.3	0	0	0	111.9	R869 F870 F930	R869-L873 HydrophobicContact CG-CD1 4.33Å; R869-L873 WeakPolarHBondContact O-CG 3.34Å; R869-L873 PolarHBondContact O-N 3.05Å; F870-L873 HydrophobicContact CD1-CD1 4.46Å; F870-L873 PolarHBondContact O-N 2.77Å; L873-F930 HydrophobicContact CD1-CD1 4.43Å; L873-F930 HydrophobicContact CD1-CE1 3.84Å
874	M	75.2	Confident	67.6	Low	39 Å²	39	86 Å²	86	19%	0.192	48%	0.478	C	S	.	.	H	α-helix	trans	-74.7	-36.5	175.3	-63.2	-47.6	-49.9	0	0	113.3	V847 K860 V864 F870 K871 T872 I888	V847-M874 HydrophobicContact CG2-CE 3.48Å; V847-M874 VanDerWaalsContact CG2-CE 3.48Å; V847-M874 HydrophobicContact CG2-SD 4.06Å; K860-M874 HydrophobicContact CD-CE 4.24Å; K860-M874 HydrophobicContact CG-CE 4.15Å; V864-M874 HydrophobicContact CG2-CG 4.06Å; F870-M874 WeakPolarHBondContact O-CG 3.33Å; F870-M874 PolarHBondContact O-N 3.14Å; K871-M874 PolarHBondContact O-N 3.12Å; T872-M874 VanDerWaalsContact C-N 3.26Å; T872-M874 PolarHBondContact O-N 2.85Å; M874-I888 HydrophobicContact CE-CD1 3.86Å; M874-I888 HydrophobicContact SD-CD1 3.33Å; M874-I888 WeakPolarHBondContact SD-CD1 3.21Å
875	T	71.3	Confident	66.3	Low	67 Å²	67	86.9 Å²	86.9	41%	0.411	49%	0.487	S	S	.	.	H	α-helix	trans	-78.2	-41.4	-177.8	53	0	0	0	0	112.9	K871 T872 K877 S878	K871-T875 WeakPolarHBondContact O-CG2 3.39Å; K871-T875 PolarHBondContact O-N 2.95Å; K871-T875 PolarHBondContact O-OG1 3.17Å; T872-T875 WeakPolarHBondContact CA-OG1 3.44Å; T872-T875 PolarHBondContact O-N 3.4Å; T872-T875 PolarHBondContact O-OG1 2.75Å; T875-K877 PolarHBondContact O-N 3.37Å; T875-S878 PolarHBondContact O-N 3.3Å; T875-S878 VanDerWaalsContact O-N 3.08Å; T875-S878 PolarHBondContact O-OG 3.24Å
876	N	62.6	Low	65.5	Low	105 Å²	105	91.5 Å²	91.5	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-67	-24.7	-172.8	-70.9	15.8	0	0	0	113.2	T872	T872-N876 WeakPolarHBondContact O-CB 3.37Å; T872-N876 PolarHBondContact O-N 2.94Å; T872-N876 PolarHBondContact O-OD1 3.25Å
877	K	57.4	Low	65	Low	100 Å²	100	92.6 Å²	92.6	44%	0.435	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-80.1	-16	174.9	-88	-159.9	172.5	-159	0	114.4	T875 E879 T887	T875-K877 PolarHBondContact O-N 3.37Å; K877-E879 VanDerWaalsContact C-N 3.26Å; K877-E879 PolarHBondContact O-N 3.4Å; K877-T887 PolarHBondContact NZ-O 3.39Å; K877-T887 VanDerWaalsContact NZ-O 3.11Å
878	S	52.7	Low	64.7	Low	98 Å²	98	93 Å²	93	69%	0.685	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-78.5	-6.8	-178.9	65.7	0	0	0	0	114.4	T875	T875-S878 PolarHBondContact O-N 3.3Å; T875-S878 VanDerWaalsContact O-N 3.08Å; T875-S878 PolarHBondContact O-OG 3.24Å
879	E	50.6	Low	64.6	Low	175 Å²	175	94.5 Å²	94.5	82%	0.818	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-105.3	-11.2	-178.1	-63.6	-171.5	160.8	0	0	114.3	K877	K877-E879 VanDerWaalsContact C-N 3.26Å; K877-E879 PolarHBondContact O-N 3.4Å
880	Q	49.3	Very low	64.6	Low	174 Å²	174	90.7 Å²	90.7	81%	0.813	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	-20.4	-170	-88.2	-174.2	-11.6	0	0	117.5
881	D	43.6	Very low	64.1	Low	124 Å²	124	95 Å²	95	66%	0.663	53%	0.528	S	S	*	.			trans	-125.4	119.3	177.3	-88.8	-42	0	0	0	112.3	D883	D881-D883 PolarHBondContact O-N 3.4Å
882	G	46.1	Very low	63.7	Low	78 Å²	78	96.7 Å²	96.7	80%	0.804	54%	0.542	S	S	*	.			trans	-74	109.9	168.1	0	0	0	0	0	111
883	D	48.2	Very low	63.9	Low	156 Å²	156	95.2 Å²	95.2	83%	0.834	53%	0.532	S	S	*	.	S	Bend	trans	49.8	94	156.6	-151.1	16.2	0	0	0	117.5	D881	D881-D883 PolarHBondContact O-N 3.4Å
884	S	49.7	Very low	64.3	Low	122 Å²	122	96.8 Å²	96.8	85%	0.853	54%	0.536	S	S	*	.	S	Bend	trans	167.2	-6.5	139.8	49.2	0	0	0	0	116.7
885	S	52.6	Low	64.8	Low	70 Å²	70	96.4 Å²	96.4	49%	0.49	53%	0.533	S	S	.	.			trans	-111.3	103.2	174.4	78.5	0	0	0	0	113.7	T887	S885-T887 PolarHBondContact O-N 3.14Å; S885-T887 VanDerWaalsContact O-N 3.12Å
886	K	62.9	Low	65.5	Low	165 Å²	165	96.4 Å²	96.4	72%	0.717	53%	0.528	S	S	*	.			trans	-75.7	18.5	166	-66	-176	179.9	178.7	0	112.4	T848	T848-K886 PolarHBondContact N-O 3.4Å; T848-K886 VanDerWaalsContact N-O 3.16Å; T848-K886 PolarHBondContact OG1-O 3.02Å
887	T	68.9	Low	66.7	Low	45 Å²	45	91.5 Å²	91.5	28%	0.276	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122	-165.3	-46.3	0	0	0	0	110.5	T848 L850 L855 K877 S885	T848-T887 CarbonylContact O-C 3.49Å; T848-T887 VanDerWaalsContact O-CA 3.29Å; T848-T887 WeakPolarHBondContact O-CA 3.36Å; L850-T887 HydrophobicContact CB-CG2 3.74Å; L855-T887 HydrophobicContact CD2-CG2 4.42Å; K877-T887 PolarHBondContact NZ-O 3.39Å; K877-T887 VanDerWaalsContact NZ-O 3.11Å; S885-T887 PolarHBondContact O-N 3.14Å; S885-T887 VanDerWaalsContact O-N 3.12Å
888	I	78.3	Confident	68.1	Low	15 Å²	15	86.8 Å²	86.8	8%	0.077	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	112.6	175.4	-60.5	175.7	0	0	0	107.9	V847 T848 F849 L850 M874	V847-I888 HydrophobicContact CG1-CD1 4.24Å; T848-I888 PolarHBondContact O-N 3.22Å; F849-I888 CarbonylContact C-O 3.53Å; F849-I888 WeakPolarHBondContact CA-O 3.03Å; F849-I888 HydrophobicContact CD1-CB 3.64Å; F849-I888 HydrophobicContact CD1-CG2 3.8Å; F849-I888 HydrophobicContact CE1-CB 3.74Å; F849-I888 HydrophobicContact CE1-CD1 4.03Å; F849-I888 HydrophobicContact CE1-CG1 4.46Å; F849-I888 HydrophobicContact CE1-CG2 3.7Å; F849-I888 HydrophobicContact CZ-CD1 4.32Å; L850-I888 PolarHBondContact N-O 2.66Å; M874-I888 HydrophobicContact CE-CD1 3.86Å; M874-I888 HydrophobicContact SD-CD1 3.33Å; M874-I888 WeakPolarHBondContact SD-CD1 3.21Å
889	E	79.6	Confident	69.7	Low	140 Å²	140	85.4 Å²	85.4	65%	0.654	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	133.5	176.7	-171	166.9	-160.4	0	0	110.3	L850	L850-E889 HydrophobicContact CD2-CG 4.32Å; L850-E889 WeakPolarHBondContact O-CA 3.39Å
890	I	82	Confident	71.4	Confident	23 Å²	23	77.9 Å²	77.9	12%	0.118	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	101.5	170.4	-56.4	171.3	0	0	0	105.8	F849 L850 V851 M893 F898 F930	F849-I890 HydrophobicContact CD1-CD1 3.6Å; F849-I890 HydrophobicContact CD1-CG1 4.09Å; F849-I890 HydrophobicContact CE1-CD1 4.13Å; F849-I890 HydrophobicContact CG-CD1 4.34Å; L850-I890 PolarHBondContact O-N 3.22Å; V851-I890 HydrophobicContact CG2-CB 4.14Å; V851-I890 HydrophobicContact CG2-CD1 4.16Å; V851-I890 HydrophobicContact CG2-CG1 4.49Å; I890-M893 HydrophobicContact CD1-CE 4.29Å; I890-M893 HydrophobicContact CG2-CB 4.08Å; I890-M893 HydrophobicContact CG2-CE 3.8Å; I890-F898 HydrophobicContact CD1-CD2 3.95Å; I890-F898 HydrophobicContact CD1-CE2 3.48Å; I890-F898 VanDerWaalsContact CD1-CE2 3.48Å; I890-F898 HydrophobicContact CD1-CZ 3.87Å; I890-F930 HydrophobicContact CD1-CZ 4.05Å
891	S	73.9	Confident	73.2	Confident	91 Å²	91	69.6 Å²	69.6	64%	0.636	39%	0.39	S	S	*	.			trans	-76	-32.5	-178.9	51.7	0	0	0	0	113	M893	S891-M893 PolarHBondContact O-N 2.89Å
892	D	73.1	Confident	75.1	Confident	139 Å²	139	63.7 Å²	63.7	74%	0.743	36%	0.359	S	S	*	.	S	Bend	trans	-106	37.7	-160.4	-54.9	-9.4	0	0	0	112.8
893	M	84.9	Confident	77	Confident	23 Å²	23	62.3 Å²	62.3	11%	0.113	33%	0.331	C	S	.	.	S	Bend	trans	-158.2	142.5	177.5	178.3	167	38.9	0	0	111.8	V851 I890 S891 I897 F898 M901 A926 F930	V851-M893 WeakPolarHBondContact CG1-O 3.48Å; I890-M893 HydrophobicContact CD1-CE 4.29Å; I890-M893 HydrophobicContact CG2-CB 4.08Å; I890-M893 HydrophobicContact CG2-CE 3.8Å; S891-M893 PolarHBondContact O-N 2.89Å; M893-I897 HydrophobicContact CG-CB 4.12Å; M893-I897 HydrophobicContact CG-CG2 4.25Å; M893-I897 HydrophobicContact SD-CB 4.38Å; M893-I897 HydrophobicContact SD-CG2 4.01Å; M893-F898 HydrophobicContact CE-CB 3.96Å; M893-F898 HydrophobicContact CE-CD2 3.4Å; M893-F898 HydrophobicContact CE-CE2 4.26Å; M893-F898 HydrophobicContact CE-CG 4.08Å; M893-F898 HydrophobicContact CG-CB 4.39Å; M893-F898 HydrophobicContact SD-CB 4.05Å; M893-F898 HydrophobicContact SD-CD2 4.32Å; M893-M901 HydrophobicContact CE-CE 4.38Å; M893-A926 HydrophobicContact SD-CB 3.61Å; M893-F930 HydrophobicContact CE-CD2 4.43Å; M893-F930 HydrophobicContact CE-CE2 3.42Å; M893-F930 VanDerWaalsContact CE-CE2 3.42Å; M893-F930 HydrophobicContact CE-CZ 3.94Å; M893-F930 HydrophobicContact SD-CE2 4.43Å
894	K	86.8	Confident	78.7	Confident	83 Å²	83	55.3 Å²	55.3	36%	0.361	29%	0.293	S	S	.	.			trans	-71	146.7	174.8	-62.7	174.1	-169.9	156.9	0	112.1	E852 H896 I897 F898 E922	E852-K894 VanDerWaalsContact CD-CA 3.49Å; E852-K894 WeakPolarHBondContact OE2-CA 3.39Å; K894-H896 VanDerWaalsContact C-N 3.28Å; K894-H896 WeakPolarHBondContact CB-ND1 3.32Å; K894-H896 PolarHBondContact O-N 2.67Å; K894-I897 HydrophobicContact CB-CG1 4.25Å; K894-I897 PolarHBondContact O-N 2.85Å; K894-F898 PolarHBondContact O-N 3.19Å; K894-F898 VanDerWaalsContact O-N 3.12Å; K894-E922 WeakPolarHBondContact CD-OE2 3.26Å; K894-E922 VanDerWaalsContact CE-OE2 3.31Å; K894-E922 WeakPolarHBondContact CE-OE2 3.31Å; K894-E922 IonicContact NZ-OE1 2.65Å; K894-E922 PolarHBondContact NZ-OE1 3.18Å; K894-E922 IonicContact NZ-OE2 2.72Å; K894-E922 PolarHBondContact NZ-OE2 3.06Å
895	Y	86.1	Confident	80.2	Confident	32 Å²	32	49.5 Å²	49.5	13%	0.125	25%	0.253	C	S	.	.	H	α-helix	trans	-58.4	-37.2	-177	-173.8	-92.4	0	0	0	113.2	N840 V851 E852 K854 L855 F856 F898 Q899	N840-Y895 PolarHBondContact ND2-OH 2.7Å; V851-Y895 HydrophobicContact CB-CD2 4.15Å; E852-Y895 PolarHBondContact OE2-N 2.78Å; K854-Y895 HydrophobicContact CB-CD2 3.44Å; K854-Y895 VanDerWaalsContact CB-CD2 3.44Å; K854-Y895 HydrophobicContact CB-CE2 3.41Å; K854-Y895 VanDerWaalsContact CB-CE2 3.41Å; K854-Y895 HydrophobicContact CB-CG 4.26Å; K854-Y895 HydrophobicContact CD-CD1 4.02Å; K854-Y895 HydrophobicContact CD-CD2 3.74Å; K854-Y895 HydrophobicContact CD-CE1 4.37Å; K854-Y895 HydrophobicContact CD-CE2 4.12Å; K854-Y895 HydrophobicContact CD-CG 3.68Å; K854-Y895 HydrophobicContact CG-CD2 4.24Å; K854-Y895 HydrophobicContact CG-CE2 4.42Å; L855-Y895 PolarHBondContact O-OH 2.76Å; L855-Y895 VanDerWaalsContact O-OH 3.09Å; F856-Y895 HydrophobicContact CB-CE2 4.26Å; F856-Y895 HydrophobicContact CD2-CE2 4.24Å; F856-Y895 AromaticContact CD2-CZ 3.99Å; Y895-F898 PolarHBondContact O-N 3.43Å; Y895-Q899 WeakPolarHBondContact O-CB 3.17Å; Y895-Q899 PolarHBondContact O-N 3.47Å
896	H	86.3	Confident	81.5	Confident	67 Å²	67	46.4 Å²	46.4	31%	0.31	23%	0.23	S	C	.	.	H	α-helix	trans	-73.4	-39.6	-178	76.3	-47.6	0	0	0	112.4	K894 F898 Q899 M900 D919	K894-H896 VanDerWaalsContact C-N 3.28Å; K894-H896 WeakPolarHBondContact CB-ND1 3.32Å; K894-H896 PolarHBondContact O-N 2.67Å; H896-F898 VanDerWaalsContact C-N 3.32Å; H896-F898 PolarHBondContact O-N 3.37Å; H896-Q899 WeakPolarHBondContact O-CB 3.12Å; H896-Q899 PolarHBondContact O-N 3.07Å; H896-M900 WeakPolarHBondContact O-CG 3.47Å; H896-M900 PolarHBondContact O-N 3.46Å; H896-D919 IonicContact CD2-OD1 2.67Å; H896-D919 IonicContact CD2-OD2 3.31Å; H896-D919 IonicContact CE1-OD1 3.3Å; H896-D919 VanDerWaalsContact NE2-CG 3.25Å; H896-D919 IonicContact NE2-OD1 3.05Å; H896-D919 PolarHBondContact NE2-OD1 2.85Å; H896-D919 IonicContact NE2-OD2 3.17Å; H896-D919 PolarHBondContact NE2-OD2 2.96Å
897	I	87.3	Confident	82.2	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-60	-43.7	171.7	-55	-56.2	0	0	0	110.7	M893 K894 Q899 M900 M901 D919 E922 L923 A926	M893-I897 HydrophobicContact CG-CB 4.12Å; M893-I897 HydrophobicContact CG-CG2 4.25Å; M893-I897 HydrophobicContact SD-CB 4.38Å; M893-I897 HydrophobicContact SD-CG2 4.01Å; K894-I897 HydrophobicContact CB-CG1 4.25Å; K894-I897 PolarHBondContact O-N 2.85Å; I897-Q899 PolarHBondContact O-N 2.97Å; I897-M900 PolarHBondContact O-N 2.82Å; I897-M901 PolarHBondContact O-N 2.95Å; I897-D919 HydrophobicContact CD1-CB 3.74Å; I897-E922 HydrophobicContact CD1-CB 3.93Å; I897-E922 HydrophobicContact CG1-CB 4Å; I897-L923 HydrophobicContact CG2-CB 4.35Å; I897-L923 HydrophobicContact CG2-CD1 4.01Å; I897-A926 HydrophobicContact CG2-CB 3.85Å
898	F	87	Confident	82.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-44.2	175.3	-174.2	-113.8	0	0	0	111.7	F849 V851 F856 I890 M893 K894 Y895 H896 M900 M901 M902	F849-F898 HydrophobicContact CB-CE1 3.92Å; F849-F898 HydrophobicContact CB-CZ 4.03Å; F849-F898 HydrophobicContact CD1-CZ 4.08Å; F849-F898 HydrophobicContact CD2-CE1 4.16Å; F849-F898 AromaticContact CD2-CZ 3.76Å; F849-F898 HydrophobicContact CD2-CZ 3.76Å; F849-F898 HydrophobicContact CE2-CZ 4.23Å; F849-F898 HydrophobicContact CG-CE1 4.06Å; F849-F898 AromaticContact CG-CZ 3.68Å; F849-F898 HydrophobicContact CG-CZ 3.68Å; V851-F898 HydrophobicContact CG1-CB 4.23Å; V851-F898 HydrophobicContact CG2-CD1 3.7Å; V851-F898 HydrophobicContact CG2-CE1 4.02Å; V851-F898 HydrophobicContact CG2-CG 4.04Å; F856-F898 HydrophobicContact CB-CD1 4.24Å; F856-F898 HydrophobicContact CB-CE1 3.9Å; F856-F898 HydrophobicContact CD1-CD1 4.38Å; F856-F898 AromaticContact CD1-CE1 3.74Å; F856-F898 HydrophobicContact CD1-CE1 3.74Å; F856-F898 HydrophobicContact CD2-CD1 4.12Å; F856-F898 HydrophobicContact CD2-CE1 4.27Å; F856-F898 HydrophobicContact CE1-CE1 4.37Å; F856-F898 AromaticContact CG-CD1 3.99Å; F856-F898 HydrophobicContact CG-CD1 3.99Å; F856-F898 AromaticContact CG-CE1 3.7Å; F856-F898 HydrophobicContact CG-CE1 3.7Å; I890-F898 HydrophobicContact CD1-CD2 3.95Å; I890-F898 HydrophobicContact CD1-CE2 3.48Å; I890-F898 VanDerWaalsContact CD1-CE2 3.48Å; I890-F898 HydrophobicContact CD1-CZ 3.87Å; M893-F898 HydrophobicContact CE-CB 3.96Å; M893-F898 HydrophobicContact CE-CD2 3.4Å; M893-F898 HydrophobicContact CE-CE2 4.26Å; M893-F898 HydrophobicContact CE-CG 4.08Å; M893-F898 HydrophobicContact CG-CB 4.39Å; M893-F898 HydrophobicContact SD-CB 4.05Å; M893-F898 HydrophobicContact SD-CD2 4.32Å; K894-F898 PolarHBondContact O-N 3.19Å; K894-F898 VanDerWaalsContact O-N 3.12Å; Y895-F898 PolarHBondContact O-N 3.43Å; H896-F898 VanDerWaalsContact C-N 3.32Å; H896-F898 PolarHBondContact O-N 3.37Å; F898-M900 VanDerWaalsContact C-N 3.33Å; F898-M900 PolarHBondContact O-N 2.84Å; F898-M901 HydrophobicContact CD2-CE 3.51Å; F898-M901 HydrophobicContact CE2-CE 3.59Å; F898-M901 PolarHBondContact O-N 2.92Å; F898-M902 HydrophobicContact CD1-CG 4.2Å; F898-M902 HydrophobicContact CD2-CG 4.4Å; F898-M902 HydrophobicContact CE1-CG 3.9Å; F898-M902 HydrophobicContact CE2-CG 4.13Å; F898-M902 HydrophobicContact CE2-SD 4.28Å; F898-M902 HydrophobicContact CG-CG 4.47Å; F898-M902 HydrophobicContact CZ-CG 3.87Å; F898-M902 HydrophobicContact CZ-SD 4.02Å; F898-M902 WeakPolarHBondContact O-CB 3.37Å; F898-M902 VanDerWaalsContact O-CG 3.24Å; F898-M902 WeakPolarHBondContact O-CG 3.29Å; F898-M902 PolarHBondContact O-N 2.81Å
899	Q	86.6	Confident	82	Confident	70 Å²	70	42 Å²	42	33%	0.327	21%	0.214	S	C	.	.	H	α-helix	trans	-59	-42	175.2	177.8	176.7	-12.3	0	0	112.1	F856 Y895 H896 I897 M902 Q903	F856-Q899 HydrophobicContact CE2-CB 4.11Å; F856-Q899 HydrophobicContact CE2-CG 4.22Å; Y895-Q899 WeakPolarHBondContact O-CB 3.17Å; Y895-Q899 PolarHBondContact O-N 3.47Å; H896-Q899 WeakPolarHBondContact O-CB 3.12Å; H896-Q899 PolarHBondContact O-N 3.07Å; I897-Q899 PolarHBondContact O-N 2.97Å; Q899-M902 PolarHBondContact O-N 3.36Å; Q899-Q903 VanDerWaalsContact O-CG 3.31Å; Q899-Q903 WeakPolarHBondContact O-CG 3.5Å; Q899-Q903 PolarHBondContact O-N 3.09Å
900	M	85.4	Confident	81.6	Confident	17 Å²	17	36.8 Å²	36.8	8%	0.084	19%	0.191	C	C	.	.	H	α-helix	trans	-67.2	-42.5	177.6	-68.7	172.1	74.1	0	0	112.4	H896 I897 F898 M902 Q903 Y904 M913 I915 L923	H896-M900 WeakPolarHBondContact O-CG 3.47Å; H896-M900 PolarHBondContact O-N 3.46Å; I897-M900 PolarHBondContact O-N 2.82Å; F898-M900 VanDerWaalsContact C-N 3.33Å; F898-M900 PolarHBondContact O-N 2.84Å; M900-M902 VanDerWaalsContact C-N 3.28Å; M900-M902 PolarHBondContact O-N 3.14Å; M900-Q903 WeakPolarHBondContact O-CB 3.45Å; M900-Q903 PolarHBondContact O-N 2.74Å; M900-Y904 PolarHBondContact O-N 3.31Å; M900-Y904 VanDerWaalsContact O-N 3.08Å; M900-M913 HydrophobicContact CB-CE 4.32Å; M900-M913 WeakPolarHBondContact O-CE 3.48Å; M900-I915 HydrophobicContact CE-CB 4.02Å; M900-I915 HydrophobicContact CE-CG1 3.8Å; M900-I915 HydrophobicContact CE-CG2 3.88Å; M900-L923 HydrophobicContact CB-CD1 4.24Å; M900-L923 HydrophobicContact CE-CD2 4.31Å
901	M	87.7	Confident	80.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-38.4	172.8	-175.8	-173.4	64.8	0	0	111.5	F870 M893 I897 F898 Y904 L905 L923 A926 F930 L932 L935	F870-M901 HydrophobicContact CE2-CE 4.3Å; F870-M901 HydrophobicContact CZ-CE 3.73Å; M893-M901 HydrophobicContact CE-CE 4.38Å; I897-M901 PolarHBondContact O-N 2.95Å; F898-M901 HydrophobicContact CD2-CE 3.51Å; F898-M901 HydrophobicContact CE2-CE 3.59Å; F898-M901 PolarHBondContact O-N 2.92Å; M901-Y904 WeakPolarHBondContact O-CB 3.29Å; M901-Y904 PolarHBondContact O-N 2.9Å; M901-L905 WeakPolarHBondContact O-CG 3.37Å; M901-L905 PolarHBondContact O-N 2.86Å; M901-L923 HydrophobicContact CB-CD1 4.21Å; M901-A926 HydrophobicContact SD-CB 4.45Å; M901-F930 HydrophobicContact CE-CD1 4.49Å; M901-F930 HydrophobicContact CE-CD2 3.68Å; M901-F930 HydrophobicContact CE-CE2 3.91Å; M901-F930 HydrophobicContact CE-CG 4.02Å; M901-F930 HydrophobicContact CE-CZ 4.4Å; M901-F930 HydrophobicContact SD-CB 3.89Å; M901-F930 HydrophobicContact SD-CD2 3.46Å; M901-F930 WeakPolarHBondContact SD-CD2 3.45Å; M901-F930 HydrophobicContact SD-CE2 4.22Å; M901-F930 HydrophobicContact SD-CG 3.79Å; M901-L932 HydrophobicContact CG-CD1 3.59Å; M901-L932 HydrophobicContact SD-CD1 3.76Å; M901-L935 HydrophobicContact CB-CD2 4.44Å; M901-L935 HydrophobicContact CG-CD2 4.03Å
902	M	84.7	Confident	80.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-70.5	-34.6	175.6	-69.5	-62.2	-70.9	0	0	112.4	L839 F856 A858 L863 F898 Q899 M900 L905 Y906	L839-M902 HydrophobicContact CD1-CB 4.11Å; F856-M902 HydrophobicContact CD1-CE 4.39Å; F856-M902 HydrophobicContact CD1-CG 4.43Å; F856-M902 HydrophobicContact CE1-CB 3.88Å; F856-M902 HydrophobicContact CE1-CE 3.73Å; F856-M902 HydrophobicContact CE1-CG 3.74Å; F856-M902 HydrophobicContact CE2-CB 4.48Å; F856-M902 HydrophobicContact CZ-CB 3.59Å; F856-M902 HydrophobicContact CZ-CG 3.86Å; A858-M902 HydrophobicContact CB-CE 3.59Å; L863-M902 HydrophobicContact CD2-CE 3.97Å; L863-M902 HydrophobicContact CD2-SD 3.84Å; F898-M902 HydrophobicContact CD1-CG 4.2Å; F898-M902 HydrophobicContact CD2-CG 4.4Å; F898-M902 HydrophobicContact CE1-CG 3.9Å; F898-M902 HydrophobicContact CE2-CG 4.13Å; F898-M902 HydrophobicContact CE2-SD 4.28Å; F898-M902 HydrophobicContact CG-CG 4.47Å; F898-M902 HydrophobicContact CZ-CG 3.87Å; F898-M902 HydrophobicContact CZ-SD 4.02Å; F898-M902 WeakPolarHBondContact O-CB 3.37Å; F898-M902 VanDerWaalsContact O-CG 3.24Å; F898-M902 WeakPolarHBondContact O-CG 3.29Å; F898-M902 PolarHBondContact O-N 2.81Å; Q899-M902 PolarHBondContact O-N 3.36Å; M900-M902 VanDerWaalsContact C-N 3.28Å; M900-M902 PolarHBondContact O-N 3.14Å; M902-L905 PolarHBondContact O-N 3.42Å; M902-L905 HydrophobicContact SD-CD1 4.09Å; M902-Y906 HydrophobicContact CE-CE2 3.95Å; M902-Y906 VanDerWaalsContact O-CD2 3.28Å; M902-Y906 WeakPolarHBondContact O-CD2 3.26Å; M902-Y906 PolarHBondContact O-N 3.16Å
903	Q	84.1	Confident	80.4	Confident	48 Å²	48	38 Å²	38	22%	0.224	19%	0.191	C	C	.	.	H	α-helix	trans	-58.1	-50.1	171.2	-78.8	170	-20.5	0	0	111.1	L839 Q899 M900 L905 Y906 Y907	L839-Q903 HydrophobicContact CD2-CG 3.53Å; Q899-Q903 VanDerWaalsContact O-CG 3.31Å; Q899-Q903 WeakPolarHBondContact O-CG 3.5Å; Q899-Q903 PolarHBondContact O-N 3.09Å; M900-Q903 WeakPolarHBondContact O-CB 3.45Å; M900-Q903 PolarHBondContact O-N 2.74Å; Q903-L905 VanDerWaalsContact C-N 3.25Å; Q903-L905 PolarHBondContact O-N 3.03Å; Q903-Y906 PolarHBondContact O-N 3.06Å; Q903-Y906 VanDerWaalsContact O-N 3.1Å; Q903-Y907 HydrophobicContact CB-CD2 3.89Å; Q903-Y907 HydrophobicContact CB-CE2 3.81Å; Q903-Y907 HydrophobicContact CG-CE2 3.95Å; Q903-Y907 WeakPolarHBondContact O-CD2 3.42Å; Q903-Y907 PolarHBondContact O-N 2.67Å
904	Y	84.2	Confident	79.8	Confident	9 Å²	9	45.9 Å²	45.9	4%	0.035	23%	0.228	C	C	.	.	H	α-helix	trans	-49.7	-46.3	175.3	165.9	-106.1	0	0	0	112.6	L830 M900 M901 Y906 G908 T910 M913 L932 A934 L935	L830-Y904 HydrophobicContact CD1-CE1 4.26Å; M900-Y904 PolarHBondContact O-N 3.31Å; M900-Y904 VanDerWaalsContact O-N 3.08Å; M901-Y904 WeakPolarHBondContact O-CB 3.29Å; M901-Y904 PolarHBondContact O-N 2.9Å; Y904-Y906 VanDerWaalsContact C-N 3.34Å; Y904-Y906 PolarHBondContact O-N 3.46Å; Y904-G908 PolarHBondContact O-N 3Å; Y904-T910 HydrophobicContact CD2-CG2 3.65Å; Y904-T910 HydrophobicContact CE2-CG2 3.71Å; Y904-M913 VanDerWaalsContact CA-SD 3.58Å; Y904-M913 VanDerWaalsContact CB-SD 3.55Å; Y904-M913 HydrophobicContact CD2-SD 4.34Å; Y904-M913 HydrophobicContact CG-SD 4.45Å; Y904-L932 HydrophobicContact CD1-CD1 4.46Å; Y904-A934 WeakPolarHBondContact OH-CB 3.32Å; Y904-L935 HydrophobicContact CD1-CB 3.85Å; Y904-L935 HydrophobicContact CD1-CD1 4.44Å; Y904-L935 HydrophobicContact CD1-CD2 3.84Å; Y904-L935 HydrophobicContact CD1-CG 4.26Å; Y904-L935 HydrophobicContact CD2-CB 4.26Å; Y904-L935 HydrophobicContact CD2-CD1 4.01Å; Y904-L935 HydrophobicContact CE1-CB 3.76Å; Y904-L935 HydrophobicContact CE2-CB 4.17Å; Y904-L935 HydrophobicContact CG-CB 4.11Å; Y904-L935 HydrophobicContact CG-CD1 3.91Å; Y904-L935 HydrophobicContact CG-CD2 4.02Å; Y904-L935 HydrophobicContact CG-CG 4.23Å
905	L	82.1	Confident	79.6	Confident	1 Å²	1	43 Å²	43	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-67.9	-29.9	-177.3	-64.9	177.9	0	0	0	113.6	L830 L862 L863 A866 F870 M901 M902 Q903 L932	L830-L905 HydrophobicContact CD1-CD2 4.05Å; L862-L905 HydrophobicContact CD2-CB 3.83Å; L863-L905 HydrophobicContact CD2-CD1 3.88Å; A866-L905 HydrophobicContact CB-CD2 3.65Å; F870-L905 HydrophobicContact CE2-CD1 4.1Å; M901-L905 WeakPolarHBondContact O-CG 3.37Å; M901-L905 PolarHBondContact O-N 2.86Å; M902-L905 PolarHBondContact O-N 3.42Å; M902-L905 HydrophobicContact SD-CD1 4.09Å; Q903-L905 VanDerWaalsContact C-N 3.25Å; Q903-L905 PolarHBondContact O-N 3.03Å; L905-L932 HydrophobicContact CD2-CD1 4.26Å; L905-L932 HydrophobicContact CD2-CD2 3.94Å
906	Y	79.8	Confident	79.4	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-87.4	-41.5	177.6	-82.2	-115.1	0	0	0	112.7	L834 F838 L839 H859 L862 M902 Q903 Y904 G908	L834-Y906 HydrophobicContact CB-CD1 4.19Å; L834-Y906 HydrophobicContact CB-CE1 4.34Å; F838-Y906 HydrophobicContact CB-CE1 3.93Å; F838-Y906 VanDerWaalsContact O-CE1 3.25Å; F838-Y906 WeakPolarHBondContact O-CE1 3.35Å; F838-Y906 PolarHBondContact O-OH 3.01Å; L839-Y906 HydrophobicContact CB-CD1 4.3Å; L839-Y906 HydrophobicContact CB-CE1 4.45Å; L839-Y906 HydrophobicContact CD1-CD2 3.88Å; L839-Y906 HydrophobicContact CD1-CE2 4.11Å; L839-Y906 HydrophobicContact CD1-CG 4.06Å; H859-Y906 PolarHBondContact CE1-OH 3.11Å; H859-Y906 AromaticContact ND1-CE1 3.93Å; H859-Y906 AromaticContact ND1-CZ 3.65Å; H859-Y906 PolarHBondContact ND1-OH 3.07Å; L862-Y906 HydrophobicContact CD1-CD2 4.25Å; L862-Y906 HydrophobicContact CD1-CG 4.38Å; L862-Y906 HydrophobicContact CD2-CD2 3.98Å; L862-Y906 HydrophobicContact CD2-CE2 3.93Å; M902-Y906 HydrophobicContact CE-CE2 3.95Å; M902-Y906 VanDerWaalsContact O-CD2 3.28Å; M902-Y906 WeakPolarHBondContact O-CD2 3.26Å; M902-Y906 PolarHBondContact O-N 3.16Å; Q903-Y906 PolarHBondContact O-N 3.06Å; Q903-Y906 VanDerWaalsContact O-N 3.1Å; Y904-Y906 VanDerWaalsContact C-N 3.34Å; Y904-Y906 PolarHBondContact O-N 3.46Å; Y906-G908 PolarHBondContact O-N 2.9Å
907	Y	76.7	Confident	79	Confident	100 Å²	100	46.7 Å²	46.7	39%	0.392	25%	0.248	S	C	.	.	H	α-helix	trans	-67.7	-19.9	175.6	-69.3	-64.5	0	0	0	112.5	P836 Q903 G909	P836-Y907 HydrophobicContact CB-CD1 3.94Å; P836-Y907 HydrophobicContact CB-CE1 3.39Å; P836-Y907 HydrophobicContact CG-CD1 3.35Å; P836-Y907 HydrophobicContact CG-CE1 3.31Å; P836-Y907 HydrophobicContact CG-CG 4.33Å; Q903-Y907 HydrophobicContact CB-CD2 3.89Å; Q903-Y907 HydrophobicContact CB-CE2 3.81Å; Q903-Y907 HydrophobicContact CG-CE2 3.95Å; Q903-Y907 WeakPolarHBondContact O-CD2 3.42Å; Q903-Y907 PolarHBondContact O-N 2.67Å; Y907-G909 VanDerWaalsContact C-N 3.32Å; Y907-G909 PolarHBondContact O-N 3.35Å
908	G	70.1	Confident	78.7	Confident	6 Å²	6	50.5 Å²	50.5	6%	0.062	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	20.1	171.5	0	0	0	0	0	114.3	R833 Y904 Y906	R833-G908 PolarHBondContact NH2-O 2.86Å; Y904-G908 PolarHBondContact O-N 3Å; Y906-G908 PolarHBondContact O-N 2.9Å
909	G	73.4	Confident	78.7	Confident	26 Å²	26	51.6 Å²	51.6	27%	0.268	29%	0.285	S	S	.	.	S	Bend	trans	172.9	177.1	-176.6	0	0	0	0	0	111.5	Y907	Y907-G909 VanDerWaalsContact C-N 3.32Å; Y907-G909 PolarHBondContact O-N 3.35Å
910	T	71.1	Confident	78.6	Confident	31 Å²	31	48.5 Å²	48.5	19%	0.19	27%	0.271	C	S	.	.	S	Bend	trans	-104.2	-2.9	-178.2	54.1	0	0	0	0	114.2	Y904 S912 M913 L935 H938	Y904-T910 HydrophobicContact CD2-CG2 3.65Å; Y904-T910 HydrophobicContact CE2-CG2 3.71Å; T910-S912 PolarHBondContact O-N 3.43Å; T910-S912 VanDerWaalsContact O-N 3.08Å; T910-M913 PolarHBondContact O-N 3.42Å; T910-L935 HydrophobicContact CG2-CD1 4.26Å; T910-H938 HydrophobicContact CG2-CB 3.78Å; T910-H938 PolarHBondContact OG1-ND1 3.28Å
911	E	66.2	Low	78.6	Confident	179 Å²	179	49.7 Å²	49.7	84%	0.836	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.9	-173.6	-61.7	179.9	167.3	0	0	114.3
912	S	65.1	Low	78.5	Confident	76 Å²	76	52.6 Å²	52.6	53%	0.531	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	17.8	-177.2	67.6	0	0	0	0	114.1	T910	T910-S912 PolarHBondContact O-N 3.43Å; T910-S912 VanDerWaalsContact O-N 3.08Å
913	M	73.1	Confident	78.7	Confident	23 Å²	23	52.6 Å²	52.6	11%	0.113	29%	0.291	C	S	.	.			trans	-109.3	116.2	-176.5	-69.3	-175.7	69	0	0	112.2	M900 Y904 T910 I915	M900-M913 HydrophobicContact CB-CE 4.32Å; M900-M913 WeakPolarHBondContact O-CE 3.48Å; Y904-M913 VanDerWaalsContact CA-SD 3.58Å; Y904-M913 VanDerWaalsContact CB-SD 3.55Å; Y904-M913 HydrophobicContact CD2-SD 4.34Å; Y904-M913 HydrophobicContact CG-SD 4.45Å; T910-M913 PolarHBondContact O-N 3.42Å; M913-I915 HydrophobicContact CB-CG1 4.36Å; M913-I915 HydrophobicContact CE-CG1 4.5Å
914	E	73.3	Confident	78.8	Confident	190 Å²	190	50.3 Å²	50.3	89%	0.888	28%	0.28	S	S	*	.			trans	-87.4	112.4	166.2	-66.3	-176.9	177.3	0	0	109
915	I	81.1	Confident	78.9	Confident	23 Å²	23	51.5 Å²	51.5	12%	0.118	29%	0.29	C	S	.	.			trans	-106.8	115.1	-178.2	-61.4	166.1	0	0	0	108.5	M900 M913 I920 L923 L942	M900-I915 HydrophobicContact CE-CB 4.02Å; M900-I915 HydrophobicContact CE-CG1 3.8Å; M900-I915 HydrophobicContact CE-CG2 3.88Å; M913-I915 HydrophobicContact CB-CG1 4.36Å; M913-I915 HydrophobicContact CE-CG1 4.5Å; I915-I920 HydrophobicContact CG2-CB 4.48Å; I915-I920 HydrophobicContact CG2-CG1 3.74Å; I915-L923 HydrophobicContact CD1-CD2 3.71Å; I915-L923 HydrophobicContact CG1-CD2 4.05Å; I915-L923 HydrophobicContact CG2-CD2 4.03Å; I915-L942 HydrophobicContact CB-CD1 4.1Å; I915-L942 HydrophobicContact CD1-CD1 3.7Å; I915-L942 HydrophobicContact CG1-CD1 4.41Å
916	P	82.3	Confident	79.1	Confident	68 Å²	68	51.7 Å²	51.7	44%	0.442	29%	0.292	S	S	.	.			trans	-62.1	141.9	176.2	-22.6	34.3	0	0	0	111.7	A918 D919 I920	P916-A918 PolarHBondContact O-N 2.92Å; P916-A918 VanDerWaalsContact O-N 3.16Å; P916-D919 HydrophobicContact CB-CB 4.5Å; P916-D919 PolarHBondContact O-N 3.5Å; P916-I920 PolarHBondContact O-N 3.15Å
917	T	78.7	Confident	79.5	Confident	107 Å²	107	51.5 Å²	51.5	66%	0.656	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-31.2	-173.4	53.7	0	0	0	0	114.2	D919 I920 T946	T917-D919 VanDerWaalsContact C-N 3.31Å; T917-I920 HydrophobicContact CG2-CD1 4.49Å; T917-T946 HydrophobicContact CG2-CG2 3.96Å
918	A	81.1	Confident	80	Confident	82 Å²	82	48.1 Å²	48.1	68%	0.678	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-27.3	175.7	0	0	0	0	0	113.3	P916	P916-A918 PolarHBondContact O-N 2.92Å; P916-A918 VanDerWaalsContact O-N 3.16Å
919	D	85.4	Confident	80.8	Confident	24 Å²	24	52.1 Å²	52.1	13%	0.128	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.9	-173.7	-66.3	-42	0	0	0	112.9	H896 I897 P916 T917 L921 E922 L923	H896-D919 IonicContact CD2-OD1 2.67Å; H896-D919 IonicContact CD2-OD2 3.31Å; H896-D919 IonicContact CE1-OD1 3.3Å; H896-D919 VanDerWaalsContact NE2-CG 3.25Å; H896-D919 IonicContact NE2-OD1 3.05Å; H896-D919 PolarHBondContact NE2-OD1 2.85Å; H896-D919 IonicContact NE2-OD2 3.17Å; H896-D919 PolarHBondContact NE2-OD2 2.96Å; I897-D919 HydrophobicContact CD1-CB 3.74Å; P916-D919 HydrophobicContact CB-CB 4.5Å; P916-D919 PolarHBondContact O-N 3.5Å; T917-D919 VanDerWaalsContact C-N 3.31Å; D919-L921 PolarHBondContact O-N 3.29Å; D919-E922 PolarHBondContact O-N 3.25Å; D919-L923 WeakPolarHBondContact O-CB 3.47Å; D919-L923 PolarHBondContact O-N 2.93Å
920	I	85.9	Confident	81.4	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-57.9	-45	-175.3	-54.3	168.8	0	0	0	111.8	I915 P916 T917 L923 L924 C939 L942 C943 T946	I915-I920 HydrophobicContact CG2-CB 4.48Å; I915-I920 HydrophobicContact CG2-CG1 3.74Å; P916-I920 PolarHBondContact O-N 3.15Å; T917-I920 HydrophobicContact CG2-CD1 4.49Å; I920-L923 PolarHBondContact O-N 2.93Å; I920-L924 WeakPolarHBondContact O-CB 3.32Å; I920-L924 PolarHBondContact O-N 3.27Å; I920-C939 HydrophobicContact CG2-CB 4.22Å; I920-L942 HydrophobicContact CD1-CB 4Å; I920-L942 HydrophobicContact CG2-CB 4.24Å; I920-C943 WeakPolarHBondContact CG2-SG 3.3Å; I920-T946 HydrophobicContact CD1-CG2 4.31Å
921	L	85.6	Confident	82.1	Confident	41 Å²	41	54.7 Å²	54.7	22%	0.215	30%	0.304	C	S	.	.	H	α-helix	trans	-69.7	-35.7	-178.3	-66.4	177.8	0	0	0	112.4	D919 S925 T955 Y958	D919-L921 PolarHBondContact O-N 3.29Å; L921-S925 PolarHBondContact O-N 3.06Å; L921-T955 HydrophobicContact CD2-CG2 4.23Å; L921-Y958 HydrophobicContact CD1-CD2 4.17Å; L921-Y958 HydrophobicContact CD1-CE2 4.42Å; L921-Y958 HydrophobicContact CD2-CG 4.49Å
922	E	85.6	Confident	83	Confident	61 Å²	61	46.5 Å²	46.5	29%	0.285	27%	0.266	S	S	.	.	H	α-helix	trans	-71.6	-39.2	175.4	-63.7	-171.2	178.5	0	0	110.8	K894 I897 D919 S925 A926	K894-E922 WeakPolarHBondContact CD-OE2 3.26Å; K894-E922 VanDerWaalsContact CE-OE2 3.31Å; K894-E922 WeakPolarHBondContact CE-OE2 3.31Å; K894-E922 IonicContact NZ-OE1 2.65Å; K894-E922 PolarHBondContact NZ-OE1 3.18Å; K894-E922 IonicContact NZ-OE2 2.72Å; K894-E922 PolarHBondContact NZ-OE2 3.06Å; I897-E922 HydrophobicContact CD1-CB 3.93Å; I897-E922 HydrophobicContact CG1-CB 4Å; D919-E922 PolarHBondContact O-N 3.25Å; E922-S925 WeakPolarHBondContact O-CB 3.4Å; E922-S925 PolarHBondContact O-N 3.01Å; E922-S925 PolarHBondContact O-OG 3.02Å; E922-A926 PolarHBondContact O-N 2.66Å
923	L	87.6	Confident	83.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.4	-36.5	173.6	-172.4	63.4	0	0	0	112.5	I897 M900 M901 I915 D919 I920 S925 A926 A927 L935	I897-L923 HydrophobicContact CG2-CB 4.35Å; I897-L923 HydrophobicContact CG2-CD1 4.01Å; M900-L923 HydrophobicContact CB-CD1 4.24Å; M900-L923 HydrophobicContact CE-CD2 4.31Å; M901-L923 HydrophobicContact CB-CD1 4.21Å; I915-L923 HydrophobicContact CD1-CD2 3.71Å; I915-L923 HydrophobicContact CG1-CD2 4.05Å; I915-L923 HydrophobicContact CG2-CD2 4.03Å; D919-L923 WeakPolarHBondContact O-CB 3.47Å; D919-L923 PolarHBondContact O-N 2.93Å; I920-L923 PolarHBondContact O-N 2.93Å; L923-S925 VanDerWaalsContact C-N 3.34Å; L923-A926 PolarHBondContact O-N 2.68Å; L923-A927 WeakPolarHBondContact O-CB 3.47Å; L923-A927 PolarHBondContact O-N 3.46Å; L923-L935 HydrophobicContact CD1-CD2 4.36Å; L923-L935 HydrophobicContact CD2-CD1 4.49Å
924	L	86.4	Confident	84.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-43.5	171.1	-176.3	74.6	0	0	0	110.9	I920 A926 A927 S928 Q936 C939 E940 L967	I920-L924 WeakPolarHBondContact O-CB 3.32Å; I920-L924 PolarHBondContact O-N 3.27Å; L924-A926 PolarHBondContact O-N 3.45Å; L924-A927 PolarHBondContact O-N 2.81Å; L924-S928 WeakPolarHBondContact O-CB 3.34Å; L924-S928 PolarHBondContact O-N 3.27Å; L924-Q936 HydrophobicContact CD1-CG 3.76Å; L924-C939 HydrophobicContact CB-CB 4.1Å; L924-C939 HydrophobicContact CD1-CB 3.77Å; L924-E940 HydrophobicContact CD1-CG 3.83Å; L924-L967 HydrophobicContact CD2-CD2 3.85Å
925	S	86.8	Confident	85	Confident	34 Å²	34	37 Å²	37	24%	0.238	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-42.1	176.9	81.3	0	0	0	0	112.1	L921 E922 L923 L929 H962	L921-S925 PolarHBondContact O-N 3.06Å; E922-S925 WeakPolarHBondContact O-CB 3.4Å; E922-S925 PolarHBondContact O-N 3.01Å; E922-S925 PolarHBondContact O-OG 3.02Å; L923-S925 VanDerWaalsContact C-N 3.34Å; S925-L929 WeakPolarHBondContact O-CB 3.4Å; S925-L929 PolarHBondContact O-N 2.96Å; S925-H962 VanDerWaalsContact CB-CE1 3.4Å; S925-H962 WeakPolarHBondContact CB-CE1 3.47Å; S925-H962 VanDerWaalsContact CB-NE2 3.32Å; S925-H962 WeakPolarHBondContact CB-NE2 3.48Å
926	A	86.8	Confident	85.3	Confident	5 Å²	5	36.9 Å²	36.9	4%	0.041	22%	0.217	C	C	.	.	H	α-helix	trans	-66.8	-46	175.6	0	0	0	0	0	111.9	M893 I897 M901 E922 L923 L924 S928 L929 F930	M893-A926 HydrophobicContact SD-CB 3.61Å; I897-A926 HydrophobicContact CG2-CB 3.85Å; M901-A926 HydrophobicContact SD-CB 4.45Å; E922-A926 PolarHBondContact O-N 2.66Å; L923-A926 PolarHBondContact O-N 2.68Å; L924-A926 PolarHBondContact O-N 3.45Å; A926-S928 VanDerWaalsContact C-N 3.29Å; A926-S928 PolarHBondContact O-N 2.92Å; A926-L929 PolarHBondContact O-N 3.34Å; A926-L929 VanDerWaalsContact O-N 3.17Å; A926-F930 WeakPolarHBondContact O-CD2 3.46Å; A926-F930 PolarHBondContact O-N 3.24Å
927	A	87.4	Confident	85.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-40.1	178.6	0	0	0	0	0	112	L923 L924 Q931 L932 L935 Q936	L923-A927 WeakPolarHBondContact O-CB 3.47Å; L923-A927 PolarHBondContact O-N 3.46Å; L924-A927 PolarHBondContact O-N 2.81Å; A927-Q931 PolarHBondContact O-N 2.87Å; A927-L932 HydrophobicContact CB-CB 4.48Å; A927-L932 PolarHBondContact O-N 2.87Å; A927-L935 HydrophobicContact CB-CB 4.3Å; A927-L935 HydrophobicContact CB-CD2 4.07Å; A927-L935 HydrophobicContact CB-CG 4.02Å; A927-Q936 HydrophobicContact CB-CB 4.05Å
928	S	86.3	Confident	85.8	Confident	29 Å²	29	32.2 Å²	32.2	20%	0.203	18%	0.18	C	C	.	.	H	α-helix	trans	-65.8	-48.9	172.8	177.8	0	0	0	0	111.9	L924 A926 F930 Q931 H962	L924-S928 WeakPolarHBondContact O-CB 3.34Å; L924-S928 PolarHBondContact O-N 3.27Å; A926-S928 VanDerWaalsContact C-N 3.29Å; A926-S928 PolarHBondContact O-N 2.92Å; S928-F930 VanDerWaalsContact C-N 3.26Å; S928-F930 PolarHBondContact O-N 3.46Å; S928-Q931 PolarHBondContact O-N 3.2Å; S928-H962 PolarHBondContact OG-O 3Å
929	L	86.8	Confident	86.1	Confident	91 Å²	91	28.3 Å²	28.3	48%	0.476	15%	0.147	S	C	.	.	H	α-helix	trans	-59.2	-35.5	180	-171.7	148	0	0	0	112.8	S925 A926	S925-L929 WeakPolarHBondContact O-CB 3.4Å; S925-L929 PolarHBondContact O-N 2.96Å; A926-L929 PolarHBondContact O-N 3.34Å; A926-L929 VanDerWaalsContact O-N 3.17Å
930	F	86.7	Confident	86.2	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.018	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	7.5	176.5	-69.6	-81.8	0	0	0	114.5	S867 R869 F870 L873 I890 M893 M901 A926 S928 L932	S867-F930 VanDerWaalsContact CB-O 3.3Å; S867-F930 WeakPolarHBondContact CB-O 3.32Å; S867-F930 PolarHBondContact OG-O 3.08Å; R869-F930 HydrophobicContact CG-CD1 4.49Å; F870-F930 HydrophobicContact CD1-CD1 4.06Å; F870-F930 HydrophobicContact CD1-CE1 4.14Å; F870-F930 HydrophobicContact CD2-CD1 4.12Å; F870-F930 AromaticContact CE1-CD1 3.54Å; F870-F930 HydrophobicContact CE1-CD1 3.54Å; F870-F930 AromaticContact CE1-CE1 3.45Å; F870-F930 HydrophobicContact CE1-CE1 3.45Å; F870-F930 VanDerWaalsContact CE1-CE1 3.45Å; F870-F930 HydrophobicContact CE1-CZ 4.45Å; F870-F930 HydrophobicContact CE2-CB 4.09Å; F870-F930 AromaticContact CE2-CD1 3.59Å; F870-F930 HydrophobicContact CE2-CD1 3.59Å; F870-F930 HydrophobicContact CE2-CE1 4.33Å; F870-F930 HydrophobicContact CE2-CG 4.03Å; F870-F930 HydrophobicContact CG-CD1 4.32Å; F870-F930 HydrophobicContact CZ-CB 4.48Å; F870-F930 AromaticContact CZ-CD1 3.27Å; F870-F930 HydrophobicContact CZ-CD1 3.27Å; F870-F930 AromaticContact CZ-CE1 3.57Å; F870-F930 HydrophobicContact CZ-CE1 3.57Å; F870-F930 AromaticContact CZ-CG 3.91Å; F870-F930 HydrophobicContact CZ-CG 3.91Å; F870-F930 HydrophobicContact CZ-CZ 4.42Å; L873-F930 HydrophobicContact CD1-CD1 4.43Å; L873-F930 HydrophobicContact CD1-CE1 3.84Å; I890-F930 HydrophobicContact CD1-CZ 4.05Å; M893-F930 HydrophobicContact CE-CD2 4.43Å; M893-F930 HydrophobicContact CE-CE2 3.42Å; M893-F930 VanDerWaalsContact CE-CE2 3.42Å; M893-F930 HydrophobicContact CE-CZ 3.94Å; M893-F930 HydrophobicContact SD-CE2 4.43Å; M901-F930 HydrophobicContact CE-CD1 4.49Å; M901-F930 HydrophobicContact CE-CD2 3.68Å; M901-F930 HydrophobicContact CE-CE2 3.91Å; M901-F930 HydrophobicContact CE-CG 4.02Å; M901-F930 HydrophobicContact CE-CZ 4.4Å; M901-F930 HydrophobicContact SD-CB 3.89Å; M901-F930 HydrophobicContact SD-CD2 3.46Å; M901-F930 WeakPolarHBondContact SD-CD2 3.45Å; M901-F930 HydrophobicContact SD-CE2 4.22Å; M901-F930 HydrophobicContact SD-CG 3.79Å; A926-F930 WeakPolarHBondContact O-CD2 3.46Å; A926-F930 PolarHBondContact O-N 3.24Å; S928-F930 VanDerWaalsContact C-N 3.26Å; S928-F930 PolarHBondContact O-N 3.46Å; F930-L932 HydrophobicContact CB-CD1 4.3Å; F930-L932 HydrophobicContact CB-CG 4.25Å
931	Q	85.4	Confident	86.2	Confident	107 Å²	107	28 Å²	28	50%	0.5	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	50.6	176.3	-57.6	178.4	-22.4	0	0	113.7	R869 A927 S928	R869-Q931 HydrophobicContact CB-CG 4.26Å; A927-Q931 PolarHBondContact O-N 2.87Å; S928-Q931 PolarHBondContact O-N 3.2Å
932	L	86.3	Confident	86.2	Confident	6 Å²	6	27.7 Å²	27.7	3%	0.031	14%	0.144	C	C	.	.			trans	-106.8	71.4	-178.3	-63.7	177.9	0	0	0	111.8	M901 Y904 L905 A927 F930 A934 L935 Q936	M901-L932 HydrophobicContact CG-CD1 3.59Å; M901-L932 HydrophobicContact SD-CD1 3.76Å; Y904-L932 HydrophobicContact CD1-CD1 4.46Å; L905-L932 HydrophobicContact CD2-CD1 4.26Å; L905-L932 HydrophobicContact CD2-CD2 3.94Å; A927-L932 HydrophobicContact CB-CB 4.48Å; A927-L932 PolarHBondContact O-N 2.87Å; F930-L932 HydrophobicContact CB-CD1 4.3Å; F930-L932 HydrophobicContact CB-CG 4.25Å; L932-A934 VanDerWaalsContact C-N 3.27Å; L932-A934 PolarHBondContact O-N 3.32Å; L932-L935 HydrophobicContact CB-CB 4.14Å; L932-L935 HydrophobicContact CD1-CD2 4.16Å; L932-L935 PolarHBondContact O-N 3.2Å; L932-Q936 PolarHBondContact O-N 3.36Å
933	D	83.8	Confident	86.2	Confident	79 Å²	79	25 Å²	25	42%	0.422	13%	0.132	S	C	.	.	H	α-helix	trans	-45.9	-42	-170.5	-44.7	-28	0	0	0	115.5	K828 R937	K828-D933 IonicContact NZ-OD2 3.41Å; K828-D933 PolarHBondContact NZ-OD2 2.93Å; D933-R937 WeakPolarHBondContact O-CB 3.38Å; D933-R937 PolarHBondContact O-N 2.98Å
934	A	83.8	Confident	86.1	Confident	12 Å²	12	26 Å²	26	10%	0.099	14%	0.139	C	C	.	.	H	α-helix	trans	-79.3	-33.4	-175	0	0	0	0	0	112.7	K828 Y904 L932 H938	K828-A934 HydrophobicContact CB-CB 4.19Å; Y904-A934 WeakPolarHBondContact OH-CB 3.32Å; L932-A934 VanDerWaalsContact C-N 3.27Å; L932-A934 PolarHBondContact O-N 3.32Å; A934-H938 PolarHBondContact O-N 3.35Å; A934-H938 VanDerWaalsContact O-N 3.08Å
935	L	85.4	Confident	86.1	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-68.5	-41.4	169.2	180	61.4	0	0	0	110.3	M901 Y904 T910 L923 A927 L932 H938 C939	M901-L935 HydrophobicContact CB-CD2 4.44Å; M901-L935 HydrophobicContact CG-CD2 4.03Å; Y904-L935 HydrophobicContact CD1-CB 3.85Å; Y904-L935 HydrophobicContact CD1-CD1 4.44Å; Y904-L935 HydrophobicContact CD1-CD2 3.84Å; Y904-L935 HydrophobicContact CD1-CG 4.26Å; Y904-L935 HydrophobicContact CD2-CB 4.26Å; Y904-L935 HydrophobicContact CD2-CD1 4.01Å; Y904-L935 HydrophobicContact CE1-CB 3.76Å; Y904-L935 HydrophobicContact CE2-CB 4.17Å; Y904-L935 HydrophobicContact CG-CB 4.11Å; Y904-L935 HydrophobicContact CG-CD1 3.91Å; Y904-L935 HydrophobicContact CG-CD2 4.02Å; Y904-L935 HydrophobicContact CG-CG 4.23Å; T910-L935 HydrophobicContact CG2-CD1 4.26Å; L923-L935 HydrophobicContact CD1-CD2 4.36Å; L923-L935 HydrophobicContact CD2-CD1 4.49Å; A927-L935 HydrophobicContact CB-CB 4.3Å; A927-L935 HydrophobicContact CB-CD2 4.07Å; A927-L935 HydrophobicContact CB-CG 4.02Å; L932-L935 HydrophobicContact CB-CB 4.14Å; L932-L935 HydrophobicContact CD1-CD2 4.16Å; L932-L935 PolarHBondContact O-N 3.2Å; L935-H938 PolarHBondContact O-N 3.43Å; L935-C939 PolarHBondContact O-N 3.23Å; L935-C939 PolarHBondContact O-SG 3.4Å
936	Q	86.8	Confident	85.9	Confident	19 Å²	19	34.3 Å²	34.3	9%	0.089	18%	0.179	C	C	.	.	H	α-helix	trans	-57	-54	173.8	-173.3	179.9	-20.9	0	0	110.3	L924 A927 L932 H938 C939 E940 N963	L924-Q936 HydrophobicContact CD1-CG 3.76Å; A927-Q936 HydrophobicContact CB-CB 4.05Å; L932-Q936 PolarHBondContact O-N 3.36Å; Q936-H938 VanDerWaalsContact C-N 3.28Å; Q936-H938 PolarHBondContact O-N 2.87Å; Q936-C939 WeakPolarHBondContact O-CB 3.5Å; Q936-C939 PolarHBondContact O-N 3.08Å; Q936-C939 VanDerWaalsContact O-N 3.08Å; Q936-E940 WeakPolarHBondContact O-CG 3.43Å; Q936-E940 PolarHBondContact O-N 2.84Å; Q936-N963 PolarHBondContact NE2-O 2.88Å
937	R	86.6	Confident	85.9	Confident	37 Å²	37	35.1 Å²	35.1	14%	0.14	18%	0.182	C	C	.	.	H	α-helix	trans	-56.6	-37.7	177.5	-170.6	67.1	61.3	-124.9	-11.2	113.1	I823 P824 V826 D933 E940 I941	I823-R937 HydrophobicContact CG2-CG 4.48Å; P824-R937 VanDerWaalsContact O-CD 3.3Å; P824-R937 WeakPolarHBondContact O-CD 3.46Å; P824-R937 WeakPolarHBondContact O-CG 3.24Å; V826-R937 HydrophobicContact CB-CB 4.32Å; V826-R937 HydrophobicContact CB-CG 4.09Å; V826-R937 HydrophobicContact CG2-CB 4.48Å; V826-R937 HydrophobicContact CG2-CG 3.93Å; D933-R937 WeakPolarHBondContact O-CB 3.38Å; D933-R937 PolarHBondContact O-N 2.98Å; R937-E940 IonicContact CZ-OE1 3.43Å; R937-E940 IonicContact CZ-OE2 3.42Å; R937-E940 IonicContact NH1-OE1 2.6Å; R937-E940 PolarHBondContact NH1-OE1 2.82Å; R937-E940 IonicContact NH1-OE2 2.68Å; R937-E940 PolarHBondContact NH1-OE2 3.2Å; R937-E940 WeakPolarHBondContact O-CB 3.4Å; R937-E940 PolarHBondContact O-N 3.49Å; R937-I941 WeakPolarHBondContact O-CG1 3.4Å; R937-I941 PolarHBondContact O-N 3.48Å; R937-I941 VanDerWaalsContact O-N 3.08Å
938	H	85.7	Confident	85.9	Confident	40 Å²	40	37.6 Å²	37.6	19%	0.185	20%	0.2	C	C	.	.	H	α-helix	trans	-69.8	-41.3	176.3	-175.3	70.4	0	0	0	112.5	T910 A934 L935 Q936 E940 I941 L942	T910-H938 HydrophobicContact CG2-CB 3.78Å; T910-H938 PolarHBondContact OG1-ND1 3.28Å; A934-H938 PolarHBondContact O-N 3.35Å; A934-H938 VanDerWaalsContact O-N 3.08Å; L935-H938 PolarHBondContact O-N 3.43Å; Q936-H938 VanDerWaalsContact C-N 3.28Å; Q936-H938 PolarHBondContact O-N 2.87Å; H938-E940 VanDerWaalsContact C-N 3.27Å; H938-E940 PolarHBondContact O-N 3.19Å; H938-I941 PolarHBondContact O-N 3.11Å; H938-L942 PolarHBondContact O-N 3.16Å
939	C	85.9	Confident	85.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-38.2	172.2	-62.2	0	0	0	0	111.3	I920 L924 L935 Q936 L942 C943	I920-C939 HydrophobicContact CG2-CB 4.22Å; L924-C939 HydrophobicContact CB-CB 4.1Å; L924-C939 HydrophobicContact CD1-CB 3.77Å; L935-C939 PolarHBondContact O-N 3.23Å; L935-C939 PolarHBondContact O-SG 3.4Å; Q936-C939 WeakPolarHBondContact O-CB 3.5Å; Q936-C939 PolarHBondContact O-N 3.08Å; Q936-C939 VanDerWaalsContact O-N 3.08Å; C939-L942 PolarHBondContact O-N 3.16Å; C939-C943 WeakPolarHBondContact O-CB 3.38Å; C939-C943 PolarHBondContact O-N 2.99Å; C939-C943 PolarHBondContact O-SG 3.24Å; C939-C943 VanDerWaalsContact O-SG 3.36Å
940	E	88.4	Confident	85.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-42.9	173.6	-68.3	-176.2	-133.5	0	0	112.6	I823 L924 Q936 R937 H938 C943 S944 A964 L967	I823-E940 HydrophobicContact CD1-CB 4.08Å; L924-E940 HydrophobicContact CD1-CG 3.83Å; Q936-E940 WeakPolarHBondContact O-CG 3.43Å; Q936-E940 PolarHBondContact O-N 2.84Å; R937-E940 IonicContact CZ-OE1 3.43Å; R937-E940 IonicContact CZ-OE2 3.42Å; R937-E940 IonicContact NH1-OE1 2.6Å; R937-E940 PolarHBondContact NH1-OE1 2.82Å; R937-E940 IonicContact NH1-OE2 2.68Å; R937-E940 PolarHBondContact NH1-OE2 3.2Å; R937-E940 WeakPolarHBondContact O-CB 3.4Å; R937-E940 PolarHBondContact O-N 3.49Å; H938-E940 VanDerWaalsContact C-N 3.27Å; H938-E940 PolarHBondContact O-N 3.19Å; E940-C943 WeakPolarHBondContact O-CB 3.3Å; E940-C943 PolarHBondContact O-N 2.86Å; E940-S944 PolarHBondContact O-N 3.12Å; E940-A964 HydrophobicContact CG-CB 4.15Å; E940-A964 WeakPolarHBondContact OE1-CB 3.16Å; E940-L967 HydrophobicContact CB-CB 3.89Å; E940-L967 HydrophobicContact CB-CD2 4.48Å; E940-L967 HydrophobicContact CG-CB 3.63Å; E940-L967 HydrophobicContact CG-CD2 4.09Å; E940-L967 HydrophobicContact CG-CG 4.44Å; E940-L967 WeakPolarHBondContact OE2-CB 3.47Å; E940-L967 PolarHBondContact OE2-N 3.12Å
941	I	86.8	Confident	85.6	Confident	23 Å²	23	42.9 Å²	42.9	12%	0.118	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-44.7	174.7	-67.8	163.5	0	0	0	111.1	I823 E825 R937 H938 C943 S944 Q945	I823-I941 HydrophobicContact CB-CG1 3.97Å; I823-I941 HydrophobicContact CG2-CG1 3.89Å; E825-I941 HydrophobicContact CG-CD1 3.72Å; R937-I941 WeakPolarHBondContact O-CG1 3.4Å; R937-I941 PolarHBondContact O-N 3.48Å; R937-I941 VanDerWaalsContact O-N 3.08Å; H938-I941 PolarHBondContact O-N 3.11Å; I941-C943 PolarHBondContact O-N 3.22Å; I941-S944 WeakPolarHBondContact O-CB 3.41Å; I941-S944 PolarHBondContact O-N 2.98Å; I941-S944 VanDerWaalsContact O-N 3.15Å; I941-S944 PolarHBondContact O-OG 3.18Å; I941-Q945 PolarHBondContact O-N 3.07Å
942	L	85.2	Confident	85.7	Confident	35 Å²	35	37.8 Å²	37.8	18%	0.183	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-37.4	176.8	-65	175.9	0	0	0	112.6	I915 I920 H938 C939 S944 Q945 T946	I915-L942 HydrophobicContact CB-CD1 4.1Å; I915-L942 HydrophobicContact CD1-CD1 3.7Å; I915-L942 HydrophobicContact CG1-CD1 4.41Å; I920-L942 HydrophobicContact CD1-CB 4Å; I920-L942 HydrophobicContact CG2-CB 4.24Å; H938-L942 PolarHBondContact O-N 3.16Å; C939-L942 PolarHBondContact O-N 3.16Å; L942-S944 VanDerWaalsContact C-N 3.32Å; L942-S944 PolarHBondContact O-N 2.73Å; L942-Q945 PolarHBondContact O-N 2.91Å; L942-T946 PolarHBondContact O-N 2.84Å; L942-T946 PolarHBondContact O-OG1 3.45Å
943	C	85.2	Confident	85.6	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.02	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-40.8	170.5	-78.2	0	0	0	0	112	I920 C939 E940 I941 Q945 T946 L947 T955 L967	I920-C943 WeakPolarHBondContact CG2-SG 3.3Å; C939-C943 WeakPolarHBondContact O-CB 3.38Å; C939-C943 PolarHBondContact O-N 2.99Å; C939-C943 PolarHBondContact O-SG 3.24Å; C939-C943 VanDerWaalsContact O-SG 3.36Å; E940-C943 WeakPolarHBondContact O-CB 3.3Å; E940-C943 PolarHBondContact O-N 2.86Å; I941-C943 PolarHBondContact O-N 3.22Å; C943-Q945 VanDerWaalsContact C-N 3.28Å; C943-Q945 PolarHBondContact O-N 3.19Å; C943-T946 PolarHBondContact O-N 3.28Å; C943-T946 PolarHBondContact O-OG1 2.91Å; C943-L947 PolarHBondContact O-N 3.2Å; C943-T955 HydrophobicContact CB-CG2 4.14Å; C943-L967 HydrophobicContact CB-CD1 3.62Å; C943-L967 HydrophobicContact CB-CD2 3.9Å; C943-L967 HydrophobicContact CB-CG 4.44Å
944	S	85.8	Confident	85.7	Confident	22 Å²	22	37.9 Å²	37.9	15%	0.154	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-31.7	179.3	78.3	0	0	0	0	113.3	E940 I941 L942	E940-S944 PolarHBondContact O-N 3.12Å; I941-S944 WeakPolarHBondContact O-CB 3.41Å; I941-S944 PolarHBondContact O-N 2.98Å; I941-S944 VanDerWaalsContact O-N 3.15Å; I941-S944 PolarHBondContact O-OG 3.18Å; L942-S944 VanDerWaalsContact C-N 3.32Å; L942-S944 PolarHBondContact O-N 2.73Å
945	Q	85.6	Confident	85.9	Confident	142 Å²	142	37.7 Å²	37.7	66%	0.664	20%	0.2	S	C	*	.	H	α-helix	trans	-81.6	-24.3	179.2	-66.3	173.7	4.1	0	0	113.1	I941 L942 C943	I941-Q945 PolarHBondContact O-N 3.07Å; L942-Q945 PolarHBondContact O-N 2.91Å; C943-Q945 VanDerWaalsContact C-N 3.28Å; C943-Q945 PolarHBondContact O-N 3.19Å
946	T	83.6	Confident	86	Confident	67 Å²	67	37.8 Å²	37.8	41%	0.411	20%	0.201	S	C	.	.	S	Bend	trans	-103.1	6.6	-175.9	52.6	0	0	0	0	113.5	T917 I920 L942 C943	T917-T946 HydrophobicContact CG2-CG2 3.96Å; I920-T946 HydrophobicContact CD1-CG2 4.31Å; L942-T946 PolarHBondContact O-N 2.84Å; L942-T946 PolarHBondContact O-OG1 3.45Å; C943-T946 PolarHBondContact O-N 3.28Å; C943-T946 PolarHBondContact O-OG1 2.91Å
947	L	86.7	Confident	85.9	Confident	22 Å²	22	40.1 Å²	40.1	12%	0.115	21%	0.211	C	C	.	.			trans	-70.7	127.4	-175.4	-157.9	65.1	0	0	0	111.9	C943 A952 T955 F970 F974	C943-L947 PolarHBondContact O-N 3.2Å; L947-A952 HydrophobicContact CD1-CB 3.8Å; L947-A952 HydrophobicContact CD2-CB 4.44Å; L947-A952 HydrophobicContact CG-CB 3.98Å; L947-T955 HydrophobicContact CD1-CG2 3.97Å; L947-F970 HydrophobicContact CD2-CD1 3.98Å; L947-F970 HydrophobicContact CD2-CE1 3.84Å; L947-F974 HydrophobicContact CD2-CB 3.66Å; L947-F974 HydrophobicContact CD2-CD1 3.79Å; L947-F974 HydrophobicContact CD2-CD2 3.77Å; L947-F974 HydrophobicContact CD2-CE1 4.37Å; L947-F974 HydrophobicContact CD2-CE2 4.33Å; L947-F974 HydrophobicContact CD2-CG 3.46Å; L947-F974 VanDerWaalsContact CD2-CG 3.46Å; L947-F974 HydrophobicContact CG-CD1 4.23Å; L947-F974 HydrophobicContact CG-CD2 4.38Å; L947-F974 HydrophobicContact CG-CE1 4.34Å; L947-F974 HydrophobicContact CG-CE2 4.47Å; L947-F974 HydrophobicContact CG-CG 4.26Å; L947-F974 HydrophobicContact CG-CZ 4.45Å
948	S	86.6	Confident	85.8	Confident	52 Å²	52	43 Å²	43	36%	0.364	22%	0.222	S	C	.	.			trans	-126.6	164	176.2	80.4	0	0	0	0	110.9	E950 S951 A952	S948-E950 PolarHBondContact O-N 3.03Å; S948-E950 PolarHBondContact OG-N 3Å; S948-S951 PolarHBondContact N-OG 3.14Å; S948-S951 PolarHBondContact O-N 2.72Å; S948-S951 PolarHBondContact O-OG 2.81Å; S948-S951 PolarHBondContact OG-N 3.16Å; S948-S951 VanDerWaalsContact OG-N 3.16Å; S948-S951 PolarHBondContact OG-OG 3.16Å; S948-S951 VanDerWaalsContact OG-OG 3.14Å; S948-A952 VanDerWaalsContact O-CB 3.24Å; S948-A952 WeakPolarHBondContact O-CB 3.48Å; S948-A952 PolarHBondContact O-N 3.13Å
949	V	84.8	Confident	85.9	Confident	48 Å²	48	41.1 Å²	41.1	29%	0.291	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-32.9	178.5	-178.8	0	0	0	0	111.8	L982 Q985	V949-L982 HydrophobicContact CG1-CD2 3.76Å; V949-L982 HydrophobicContact CG1-CG 4.13Å; V949-L982 WeakPolarHBondContact O-CD2 3.37Å; V949-Q985 HydrophobicContact CG1-CG 4.33Å
950	E	83.8	Confident	85.9	Confident	151 Å²	151	43.8 Å²	43.8	71%	0.706	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-38.2	178.7	-62.3	178.7	179.7	0	0	112.7	S948	S948-E950 PolarHBondContact O-N 3.03Å; S948-E950 PolarHBondContact OG-N 3Å
951	S	86.1	Confident	85.7	Confident	36 Å²	36	48.8 Å²	48.8	25%	0.252	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-26.7	-176.8	67.4	0	0	0	0	113.8	S948 V953 N954 T955	S948-S951 PolarHBondContact N-OG 3.14Å; S948-S951 PolarHBondContact O-N 2.72Å; S948-S951 PolarHBondContact O-OG 2.81Å; S948-S951 PolarHBondContact OG-N 3.16Å; S948-S951 VanDerWaalsContact OG-N 3.16Å; S948-S951 PolarHBondContact OG-OG 3.16Å; S948-S951 VanDerWaalsContact OG-OG 3.14Å; S951-V953 VanDerWaalsContact C-N 3.34Å; S951-V953 PolarHBondContact O-N 3.31Å; S951-N954 PolarHBondContact O-N 3.21Å; S951-T955 PolarHBondContact O-N 2.67Å; S951-T955 PolarHBondContact O-OG1 2.99Å
952	A	86.2	Confident	85.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-36.8	-167.9	0	0	0	0	0	114.9	L947 S948 N954 T955 Y956 F974 F975	L947-A952 HydrophobicContact CD1-CB 3.8Å; L947-A952 HydrophobicContact CD2-CB 4.44Å; L947-A952 HydrophobicContact CG-CB 3.98Å; S948-A952 VanDerWaalsContact O-CB 3.24Å; S948-A952 WeakPolarHBondContact O-CB 3.48Å; S948-A952 PolarHBondContact O-N 3.13Å; A952-N954 VanDerWaalsContact C-N 3.28Å; A952-N954 PolarHBondContact O-N 3.25Å; A952-T955 PolarHBondContact O-N 3.33Å; A952-Y956 WeakPolarHBondContact O-CB 3.24Å; A952-Y956 PolarHBondContact O-N 3.19Å; A952-F974 HydrophobicContact CB-CD1 3.95Å; A952-F974 HydrophobicContact CB-CE1 3.92Å; A952-F975 HydrophobicContact CB-CD1 4.34Å; A952-F975 HydrophobicContact CB-CE1 3.64Å
953	V	85.2	Confident	85.6	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-62.4	-37.2	176.9	176.9	0	0	0	0	111.9	S951 K957 A987 F988 L991	S951-V953 VanDerWaalsContact C-N 3.34Å; S951-V953 PolarHBondContact O-N 3.31Å; V953-K957 WeakPolarHBondContact O-CG 3.5Å; V953-K957 PolarHBondContact O-N 2.84Å; V953-A987 HydrophobicContact CB-CB 4.42Å; V953-A987 HydrophobicContact CG1-CB 4.21Å; V953-A987 HydrophobicContact CG2-CB 4.35Å; V953-F988 HydrophobicContact CG2-CB 3.88Å; V953-F988 HydrophobicContact CG2-CD2 4.04Å; V953-F988 HydrophobicContact CG2-CG 4.47Å; V953-L991 HydrophobicContact CG1-CB 4.46Å; V953-L991 HydrophobicContact CG1-CD2 4.43Å
954	N	86.3	Confident	85.5	Confident	83 Å²	83	54.1 Å²	54.1	44%	0.444	28%	0.278	S	S	.	.	H	α-helix	trans	-76.4	-47.6	179.4	-66.8	-24.6	0	0	0	110	S951 A952 Y956 K957 Y958	S951-N954 PolarHBondContact O-N 3.21Å; A952-N954 VanDerWaalsContact C-N 3.28Å; A952-N954 PolarHBondContact O-N 3.25Å; N954-Y956 VanDerWaalsContact C-N 3.27Å; N954-Y956 PolarHBondContact O-N 3.38Å; N954-K957 PolarHBondContact O-N 3.18Å; N954-K957 VanDerWaalsContact O-N 3.07Å; N954-Y958 WeakPolarHBondContact O-CD2 3.5Å; N954-Y958 PolarHBondContact O-N 2.96Å
955	T	86.9	Confident	85.5	Confident	9 Å²	9	56 Å²	56	6%	0.055	29%	0.29	C	S	.	.	H	α-helix	trans	-53.2	-43.2	176	-54.7	0	0	0	0	112.1	L921 C943 L947 S951 A952 Y958 A959 L967	L921-T955 HydrophobicContact CD2-CG2 4.23Å; C943-T955 HydrophobicContact CB-CG2 4.14Å; L947-T955 HydrophobicContact CD1-CG2 3.97Å; S951-T955 PolarHBondContact O-N 2.67Å; S951-T955 PolarHBondContact O-OG1 2.99Å; A952-T955 PolarHBondContact O-N 3.33Å; T955-Y958 PolarHBondContact O-N 2.9Å; T955-A959 WeakPolarHBondContact O-CB 3.27Å; T955-A959 PolarHBondContact O-N 3.21Å; T955-L967 HydrophobicContact CG2-CD1 4.13Å; T955-L967 HydrophobicContact CG2-CD2 4.05Å; T955-L967 HydrophobicContact CG2-CG 4.33Å
956	Y	87.1	Confident	85.5	Confident	1 Å²	1	52.6 Å²	52.6	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-44.4	175.9	177.1	-103.7	0	0	0	113.6	A952 N954 Y958 A959 K960 C971 E972 F975 L991 P1004 D1007	A952-Y956 WeakPolarHBondContact O-CB 3.24Å; A952-Y956 PolarHBondContact O-N 3.19Å; N954-Y956 VanDerWaalsContact C-N 3.27Å; N954-Y956 PolarHBondContact O-N 3.38Å; Y956-Y958 PolarHBondContact O-N 3.03Å; Y956-A959 PolarHBondContact O-N 3.08Å; Y956-K960 HydrophobicContact CE1-CG 4.34Å; Y956-K960 HydrophobicContact CE2-CD 4.44Å; Y956-K960 HydrophobicContact CE2-CG 4.14Å; Y956-K960 VanDerWaalsContact CZ-CE 3.41Å; Y956-K960 PolarHBondContact O-N 3.09Å; Y956-K960 WeakPolarHBondContact OH-CE 3.49Å; Y956-C971 HydrophobicContact CD2-CB 3.88Å; Y956-C971 HydrophobicContact CG-CB 4.47Å; Y956-E972 HydrophobicContact CE2-CG 3.78Å; Y956-F975 HydrophobicContact CD1-CE2 4.03Å; Y956-F975 HydrophobicContact CD1-CZ 4.41Å; Y956-F975 AromaticContact CD2-CE2 3.78Å; Y956-F975 HydrophobicContact CD2-CE2 3.78Å; Y956-F975 HydrophobicContact CD2-CZ 4.42Å; Y956-F975 HydrophobicContact CE2-CE2 4.29Å; Y956-F975 AromaticContact CG-CE2 3.6Å; Y956-F975 HydrophobicContact CG-CE2 3.6Å; Y956-F975 AromaticContact CG-CZ 3.92Å; Y956-F975 HydrophobicContact CG-CZ 3.92Å; Y956-L991 HydrophobicContact CD1-CD1 4.27Å; Y956-L991 HydrophobicContact CD1-CD2 3.84Å; Y956-L991 HydrophobicContact CE1-CD1 4.24Å; Y956-L991 HydrophobicContact CE1-CD2 4.07Å; Y956-P1004 HydrophobicContact CE1-CB 4.07Å; Y956-D1007 PolarHBondContact OH-OD2 3.41Å
957	K	85.5	Confident	85.7	Confident	69 Å²	69	49.4 Å²	49.4	30%	0.3	25%	0.254	S	S	.	.	H	α-helix	trans	-60.7	-45.8	176.2	-72	170.1	-175.6	172.5	0	111	V953 N954 K960 I961	V953-K957 WeakPolarHBondContact O-CG 3.5Å; V953-K957 PolarHBondContact O-N 2.84Å; N954-K957 PolarHBondContact O-N 3.18Å; N954-K957 VanDerWaalsContact O-N 3.07Å; K957-K960 PolarHBondContact O-N 3.49Å; K957-I961 WeakPolarHBondContact O-CB 3.24Å; K957-I961 WeakPolarHBondContact O-CD1 3.4Å; K957-I961 WeakPolarHBondContact O-CG1 3.3Å; K957-I961 PolarHBondContact O-N 3.24Å
958	Y	85.2	Confident	85.7	Confident	97 Å²	97	48.5 Å²	48.5	38%	0.38	25%	0.25	S	S	.	.	H	α-helix	trans	-60.3	-43.9	174.3	-85.2	-86.1	0	0	0	111.8	L921 N954 T955 Y956 K960 I961 H962	L921-Y958 HydrophobicContact CD1-CD2 4.17Å; L921-Y958 HydrophobicContact CD1-CE2 4.42Å; L921-Y958 HydrophobicContact CD2-CG 4.49Å; N954-Y958 WeakPolarHBondContact O-CD2 3.5Å; N954-Y958 PolarHBondContact O-N 2.96Å; T955-Y958 PolarHBondContact O-N 2.9Å; Y956-Y958 PolarHBondContact O-N 3.03Å; Y958-K960 PolarHBondContact O-N 3.09Å; Y958-I961 PolarHBondContact O-N 2.8Å; Y958-H962 AromaticContact CD1-CD2 3.87Å; Y958-H962 AromaticContact CD1-NE2 3.83Å; Y958-H962 WeakPolarHBondContact O-CB 3.28Å; Y958-H962 PolarHBondContact O-CD2 2.93Å; Y958-H962 VanDerWaalsContact O-CD2 3.24Å; Y958-H962 PolarHBondContact O-N 3.3Å
959	A	86.9	Confident	85.7	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.8	-46.9	179.3	0	0	0	0	0	112.5	T955 Y956 N963 A964 L967 A968	T955-A959 WeakPolarHBondContact O-CB 3.27Å; T955-A959 PolarHBondContact O-N 3.21Å; Y956-A959 PolarHBondContact O-N 3.08Å; A959-N963 PolarHBondContact O-N 2.85Å; A959-N963 VanDerWaalsContact O-N 3.11Å; A959-A964 HydrophobicContact CB-CB 4.27Å; A959-A964 PolarHBondContact O-N 3.28Å; A959-L967 HydrophobicContact CB-CB 4.21Å; A959-L967 HydrophobicContact CB-CD2 3.92Å; A959-L967 HydrophobicContact CB-CG 3.92Å; A959-A968 HydrophobicContact CB-CB 4.34Å
960	K	85.9	Confident	85.8	Confident	57 Å²	57	48.3 Å²	48.3	25%	0.248	24%	0.242	C	C	.	.	H	α-helix	trans	-71.1	-39.6	178.4	-63	-81.7	-172.4	177.3	0	112.5	Y956 K957 Y958 H962 N963 A968 E972 L1002 D1007	Y956-K960 HydrophobicContact CE1-CG 4.34Å; Y956-K960 HydrophobicContact CE2-CD 4.44Å; Y956-K960 HydrophobicContact CE2-CG 4.14Å; Y956-K960 VanDerWaalsContact CZ-CE 3.41Å; Y956-K960 PolarHBondContact O-N 3.09Å; Y956-K960 WeakPolarHBondContact OH-CE 3.49Å; K957-K960 PolarHBondContact O-N 3.49Å; Y958-K960 PolarHBondContact O-N 3.09Å; K960-H962 VanDerWaalsContact C-N 3.31Å; K960-H962 PolarHBondContact O-N 3.36Å; K960-N963 PolarHBondContact O-N 3.33Å; K960-A968 HydrophobicContact CD-CB 4.09Å; K960-A968 HydrophobicContact CG-CB 4.49Å; K960-E972 VanDerWaalsContact CE-OE1 3.27Å; K960-E972 WeakPolarHBondContact CE-OE1 3.26Å; K960-E972 IonicContact NZ-OE1 2.7Å; K960-E972 PolarHBondContact NZ-OE1 3.38Å; K960-L1002 HydrophobicContact CB-CD2 3.37Å; K960-L1002 HydrophobicContact CD-CD2 4.36Å; K960-L1002 HydrophobicContact CG-CD2 3.78Å; K960-D1007 WeakPolarHBondContact CE-OD2 3.5Å; K960-D1007 IonicContact NZ-OD1 3.69Å; K960-D1007 PolarHBondContact NZ-OD1 2.97Å; K960-D1007 IonicContact NZ-OD2 3.42Å; K960-D1007 PolarHBondContact NZ-OD2 3.47Å
961	I	85.1	Confident	86	Confident	105 Å²	105	41.1 Å²	41.1	54%	0.538	21%	0.208	S	C	.	.	H	α-helix	trans	-61	-39.6	176.6	-71	165.9	0	0	0	111.5	K957 Y958	K957-I961 WeakPolarHBondContact O-CB 3.24Å; K957-I961 WeakPolarHBondContact O-CD1 3.4Å; K957-I961 WeakPolarHBondContact O-CG1 3.3Å; K957-I961 PolarHBondContact O-N 3.24Å; Y958-I961 PolarHBondContact O-N 2.8Å
962	H	84.3	Confident	86.1	Confident	38 Å²	38	39.7 Å²	39.7	18%	0.176	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	10.8	-178.3	-66.1	-62.6	0	0	0	114.3	S925 S928 Y958 K960	S925-H962 VanDerWaalsContact CB-CE1 3.4Å; S925-H962 WeakPolarHBondContact CB-CE1 3.47Å; S925-H962 VanDerWaalsContact CB-NE2 3.32Å; S925-H962 WeakPolarHBondContact CB-NE2 3.48Å; S928-H962 PolarHBondContact OG-O 3Å; Y958-H962 AromaticContact CD1-CD2 3.87Å; Y958-H962 AromaticContact CD1-NE2 3.83Å; Y958-H962 WeakPolarHBondContact O-CB 3.28Å; Y958-H962 PolarHBondContact O-CD2 2.93Å; Y958-H962 VanDerWaalsContact O-CD2 3.24Å; Y958-H962 PolarHBondContact O-N 3.3Å; K960-H962 VanDerWaalsContact C-N 3.31Å; K960-H962 PolarHBondContact O-N 3.36Å
963	N	83.9	Confident	86.1	Confident	132 Å²	132	39.7 Å²	39.7	71%	0.706	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	53.8	178.5	-165.6	40.8	0	0	0	113.6	Q936 A959 K960 P965	Q936-N963 PolarHBondContact NE2-O 2.88Å; A959-N963 PolarHBondContact O-N 2.85Å; A959-N963 VanDerWaalsContact O-N 3.11Å; K960-N963 PolarHBondContact O-N 3.33Å; N963-P965 VanDerWaalsContact O-CD 3.25Å; N963-P965 WeakPolarHBondContact O-CD 3.39Å
964	A	85	Confident	86.2	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	20%	0.202	C	C	.	.			trans	-106	87.1	177	0	0	0	0	0	110.3	E940 A959 L967 A968	E940-A964 HydrophobicContact CG-CB 4.15Å; E940-A964 WeakPolarHBondContact OE1-CB 3.16Å; A959-A964 HydrophobicContact CB-CB 4.27Å; A959-A964 PolarHBondContact O-N 3.28Å; A964-L967 HydrophobicContact CB-CB 4.38Å; A964-A968 WeakPolarHBondContact O-CB 3.47Å; A964-A968 PolarHBondContact O-N 3.25Å; A964-A968 VanDerWaalsContact O-N 3.11Å
965	P	84.7	Confident	86.4	Confident	62 Å²	62	36.7 Å²	36.7	40%	0.403	18%	0.181	S	C	.	.	H	α-helix	trans	-70.1	-39	-168.9	26.1	-35	0	0	0	114.1	N963 A968 L969	N963-P965 VanDerWaalsContact O-CD 3.25Å; N963-P965 WeakPolarHBondContact O-CD 3.39Å; P965-A968 WeakPolarHBondContact O-CB 3.37Å; P965-A968 PolarHBondContact O-N 2.99Å; P965-L969 WeakPolarHBondContact O-CG 3.46Å; P965-L969 PolarHBondContact O-N 3.28Å
966	E	86.2	Confident	86.4	Confident	70 Å²	70	36.3 Å²	36.3	33%	0.327	18%	0.178	S	C	.	.	H	α-helix	trans	-68.6	-41.4	-178.3	-51.1	-64.8	145.6	0	0	111.4	I823 A968 L969 F970	I823-E966 HydrophobicContact CG1-CB 4.27Å; I823-E966 HydrophobicContact CG2-CB 3.85Å; E966-A968 VanDerWaalsContact C-N 3.32Å; E966-A968 PolarHBondContact O-N 3.22Å; E966-L969 PolarHBondContact O-N 3.18Å; E966-F970 WeakPolarHBondContact O-CB 3.28Å; E966-F970 PolarHBondContact O-N 3.38Å
967	L	86.9	Confident	86.4	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64	-36	171.8	-179.4	60.9	0	0	0	112.6	I823 L924 E940 C943 T955 A959 A964 F970 C971	I823-L967 HydrophobicContact CD1-CB 4.36Å; I823-L967 HydrophobicContact CD1-CD1 4.37Å; L924-L967 HydrophobicContact CD2-CD2 3.85Å; E940-L967 HydrophobicContact CB-CB 3.89Å; E940-L967 HydrophobicContact CB-CD2 4.48Å; E940-L967 HydrophobicContact CG-CB 3.63Å; E940-L967 HydrophobicContact CG-CD2 4.09Å; E940-L967 HydrophobicContact CG-CG 4.44Å; E940-L967 WeakPolarHBondContact OE2-CB 3.47Å; E940-L967 PolarHBondContact OE2-N 3.12Å; C943-L967 HydrophobicContact CB-CD1 3.62Å; C943-L967 HydrophobicContact CB-CD2 3.9Å; C943-L967 HydrophobicContact CB-CG 4.44Å; T955-L967 HydrophobicContact CG2-CD1 4.13Å; T955-L967 HydrophobicContact CG2-CD2 4.05Å; T955-L967 HydrophobicContact CG2-CG 4.33Å; A959-L967 HydrophobicContact CB-CB 4.21Å; A959-L967 HydrophobicContact CB-CD2 3.92Å; A959-L967 HydrophobicContact CB-CG 3.92Å; A964-L967 HydrophobicContact CB-CB 4.38Å; L967-F970 PolarHBondContact O-N 3.21Å; L967-C971 WeakPolarHBondContact O-CB 3.49Å; L967-C971 PolarHBondContact O-N 3.03Å; L967-C971 PolarHBondContact O-SG 3Å
968	A	86.8	Confident	86.5	Confident	3 Å²	3	39 Å²	39	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-51.3	173.4	0	0	0	0	0	111.1	A959 K960 A964 P965 E966 F970 C971 E972	A959-A968 HydrophobicContact CB-CB 4.34Å; K960-A968 HydrophobicContact CD-CB 4.09Å; K960-A968 HydrophobicContact CG-CB 4.49Å; A964-A968 WeakPolarHBondContact O-CB 3.47Å; A964-A968 PolarHBondContact O-N 3.25Å; A964-A968 VanDerWaalsContact O-N 3.11Å; P965-A968 WeakPolarHBondContact O-CB 3.37Å; P965-A968 PolarHBondContact O-N 2.99Å; E966-A968 VanDerWaalsContact C-N 3.32Å; E966-A968 PolarHBondContact O-N 3.22Å; A968-F970 VanDerWaalsContact C-N 3.31Å; A968-F970 PolarHBondContact O-N 3.03Å; A968-C971 WeakPolarHBondContact O-CB 3.32Å; A968-C971 PolarHBondContact O-N 3.08Å; A968-C971 VanDerWaalsContact O-N 3.12Å; A968-E972 VanDerWaalsContact O-CG 3.25Å; A968-E972 WeakPolarHBondContact O-CG 3.42Å; A968-E972 PolarHBondContact O-N 3.21Å
969	L	86.3	Confident	86.6	Confident	71 Å²	71	34.3 Å²	34.3	37%	0.372	17%	0.172	S	C	.	.	H	α-helix	trans	-57.8	-40.2	175.3	-71.4	166.1	0	0	0	112.3	P965 E966 E972 G973 T1011	P965-L969 WeakPolarHBondContact O-CG 3.46Å; P965-L969 PolarHBondContact O-N 3.28Å; E966-L969 PolarHBondContact O-N 3.18Å; L969-E972 PolarHBondContact O-N 2.95Å; L969-G973 PolarHBondContact O-N 3.4Å; L969-T1011 HydrophobicContact CD2-CG2 4.46Å
970	F	87.9	Confident	86.5	Confident	26 Å²	26	40.1 Å²	40.1	11%	0.114	20%	0.197	C	C	.	.	H	α-helix	trans	-65.1	-42.8	175.1	-172.3	-86.6	0	0	0	112.1	I820 P821 I823 L947 E966 L967 A968 G973 F974	I820-F970 HydrophobicContact CB-CD2 4.45Å; I820-F970 HydrophobicContact CB-CE2 3.99Å; I820-F970 HydrophobicContact CB-CZ 4.49Å; I820-F970 HydrophobicContact CD1-CZ 4.42Å; I820-F970 HydrophobicContact CG2-CD2 3.56Å; I820-F970 HydrophobicContact CG2-CE2 3.6Å; I820-F970 HydrophobicContact CG2-CG 4.24Å; I820-F970 HydrophobicContact CG2-CZ 4.31Å; P821-F970 WeakPolarHBondContact O-CD2 3.29Å; I823-F970 HydrophobicContact CD1-CB 4.01Å; I823-F970 HydrophobicContact CD1-CG 4.33Å; I823-F970 HydrophobicContact CG1-CB 4.15Å; I823-F970 HydrophobicContact CG1-CD2 4.29Å; I823-F970 HydrophobicContact CG1-CG 4.42Å; L947-F970 HydrophobicContact CD2-CD1 3.98Å; L947-F970 HydrophobicContact CD2-CE1 3.84Å; E966-F970 WeakPolarHBondContact O-CB 3.28Å; E966-F970 PolarHBondContact O-N 3.38Å; L967-F970 PolarHBondContact O-N 3.21Å; A968-F970 VanDerWaalsContact C-N 3.31Å; A968-F970 PolarHBondContact O-N 3.03Å; F970-G973 PolarHBondContact O-N 3.49Å; F970-F974 WeakPolarHBondContact O-CB 3.38Å; F970-F974 PolarHBondContact O-N 2.84Å
971	C	87.8	Confident	86.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.6	-40	174.9	-69.2	0	0	0	0	111.7	Y956 L967 A968 F974 F975	Y956-C971 HydrophobicContact CD2-CB 3.88Å; Y956-C971 HydrophobicContact CG-CB 4.47Å; L967-C971 WeakPolarHBondContact O-CB 3.49Å; L967-C971 PolarHBondContact O-N 3.03Å; L967-C971 PolarHBondContact O-SG 3Å; A968-C971 WeakPolarHBondContact O-CB 3.32Å; A968-C971 PolarHBondContact O-N 3.08Å; A968-C971 VanDerWaalsContact O-N 3.12Å; C971-F974 PolarHBondContact O-N 2.99Å; C971-F975 HydrophobicContact CB-CE2 4.46Å; C971-F975 WeakPolarHBondContact O-CB 3.47Å; C971-F975 WeakPolarHBondContact O-CD2 3.48Å; C971-F975 WeakPolarHBondContact O-CG 3.39Å; C971-F975 PolarHBondContact O-N 3.44Å
972	E	88.4	Confident	86.5	Confident	5 Å²	5	34.4 Å²	34.4	2%	0.023	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-45.3	174.8	-69.2	154.8	-158	0	0	111.1	Y956 K960 A968 L969 F974 F975 L976 D1007 L1008 T1011	Y956-E972 HydrophobicContact CE2-CG 3.78Å; K960-E972 VanDerWaalsContact CE-OE1 3.27Å; K960-E972 WeakPolarHBondContact CE-OE1 3.26Å; K960-E972 IonicContact NZ-OE1 2.7Å; K960-E972 PolarHBondContact NZ-OE1 3.38Å; A968-E972 VanDerWaalsContact O-CG 3.25Å; A968-E972 WeakPolarHBondContact O-CG 3.42Å; A968-E972 PolarHBondContact O-N 3.21Å; L969-E972 PolarHBondContact O-N 2.95Å; E972-F974 PolarHBondContact O-N 3.27Å; E972-F975 WeakPolarHBondContact O-CB 3.42Å; E972-F975 PolarHBondContact O-N 3.47Å; E972-L976 WeakPolarHBondContact O-CG 3.32Å; E972-L976 PolarHBondContact O-N 3.36Å; E972-D1007 HydrophobicContact CG-CB 4.43Å; E972-L1008 HydrophobicContact CB-CD2 4.13Å; E972-L1008 HydrophobicContact CG-CD2 4.47Å; E972-L1008 WeakPolarHBondContact O-CD2 3.28Å; E972-T1011 HydrophobicContact CB-CG2 4.1Å; E972-T1011 WeakPolarHBondContact CB-OG1 3.42Å; E972-T1011 PolarHBondContact OE2-OG1 3.5Å
973	G	86	Confident	86.5	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.1	-39.8	172.2	0	0	0	0	0	113.7	Y815 L969 F970 L976 K977	Y815-G973 WeakPolarHBondContact OH-CA 3.41Å; L969-G973 PolarHBondContact O-N 3.4Å; F970-G973 PolarHBondContact O-N 3.49Å; G973-L976 PolarHBondContact O-N 3.24Å; G973-K977 WeakPolarHBondContact O-CB 3.28Å; G973-K977 PolarHBondContact O-N 3.32Å
974	F	88.2	Confident	86.4	Confident	23 Å²	23	32.6 Å²	32.6	10%	0.101	16%	0.164	C	C	.	.	H	α-helix	trans	-65.7	-38	174.4	-175.9	-89.8	0	0	0	112.3	I820 L947 A952 F970 C971 E972 K977 H978	I820-F974 HydrophobicContact CD1-CB 3.94Å; I820-F974 HydrophobicContact CD1-CD2 4.17Å; L947-F974 HydrophobicContact CD2-CB 3.66Å; L947-F974 HydrophobicContact CD2-CD1 3.79Å; L947-F974 HydrophobicContact CD2-CD2 3.77Å; L947-F974 HydrophobicContact CD2-CE1 4.37Å; L947-F974 HydrophobicContact CD2-CE2 4.33Å; L947-F974 HydrophobicContact CD2-CG 3.46Å; L947-F974 VanDerWaalsContact CD2-CG 3.46Å; L947-F974 HydrophobicContact CG-CD1 4.23Å; L947-F974 HydrophobicContact CG-CD2 4.38Å; L947-F974 HydrophobicContact CG-CE1 4.34Å; L947-F974 HydrophobicContact CG-CE2 4.47Å; L947-F974 HydrophobicContact CG-CG 4.26Å; L947-F974 HydrophobicContact CG-CZ 4.45Å; A952-F974 HydrophobicContact CB-CD1 3.95Å; A952-F974 HydrophobicContact CB-CE1 3.92Å; F970-F974 WeakPolarHBondContact O-CB 3.38Å; F970-F974 PolarHBondContact O-N 2.84Å; C971-F974 PolarHBondContact O-N 2.99Å; E972-F974 PolarHBondContact O-N 3.27Å; F974-K977 PolarHBondContact O-N 2.57Å; F974-H978 AromaticContact CD1-ND1 3.96Å; F974-H978 AromaticContact CD2-CE1 3.7Å; F974-H978 AromaticContact CD2-ND1 3.56Å; F974-H978 AromaticContact CE1-ND1 3.84Å; F974-H978 AromaticContact CE2-CE1 3.43Å; F974-H978 VanDerWaalsContact CE2-CE1 3.43Å; F974-H978 WeakPolarHBondContact CE2-CE1 3.47Å; F974-H978 AromaticContact CE2-ND1 3.43Å; F974-H978 WeakPolarHBondContact CE2-ND1 3.38Å; F974-H978 AromaticContact CG-ND1 3.83Å; F974-H978 AromaticContact CZ-CE1 3.93Å; F974-H978 AromaticContact CZ-ND1 3.58Å; F974-H978 PolarHBondContact O-N 2.88Å; F974-H978 VanDerWaalsContact O-N 3.12Å; F974-H978 PolarHBondContact O-ND1 3.49Å; F974-H978 VanDerWaalsContact O-ND1 3.13Å
975	F	89.8	Confident	86.4	Confident	1 Å²	1	36.1 Å²	36.1	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-47.1	175	-67.5	-27.3	0	0	0	111.5	A952 Y956 C971 E972 K977 H978 M979 L982 F988 L991 L1008	A952-F975 HydrophobicContact CB-CD1 4.34Å; A952-F975 HydrophobicContact CB-CE1 3.64Å; Y956-F975 HydrophobicContact CD1-CE2 4.03Å; Y956-F975 HydrophobicContact CD1-CZ 4.41Å; Y956-F975 AromaticContact CD2-CE2 3.78Å; Y956-F975 HydrophobicContact CD2-CE2 3.78Å; Y956-F975 HydrophobicContact CD2-CZ 4.42Å; Y956-F975 HydrophobicContact CE2-CE2 4.29Å; Y956-F975 AromaticContact CG-CE2 3.6Å; Y956-F975 HydrophobicContact CG-CE2 3.6Å; Y956-F975 AromaticContact CG-CZ 3.92Å; Y956-F975 HydrophobicContact CG-CZ 3.92Å; C971-F975 HydrophobicContact CB-CE2 4.46Å; C971-F975 WeakPolarHBondContact O-CB 3.47Å; C971-F975 WeakPolarHBondContact O-CD2 3.48Å; C971-F975 WeakPolarHBondContact O-CG 3.39Å; C971-F975 PolarHBondContact O-N 3.44Å; E972-F975 WeakPolarHBondContact O-CB 3.42Å; E972-F975 PolarHBondContact O-N 3.47Å; F975-K977 VanDerWaalsContact C-N 3.35Å; F975-K977 PolarHBondContact O-N 2.96Å; F975-H978 CarbonylContact O-C 3.57Å; F975-H978 PolarHBondContact O-N 2.8Å; F975-M979 WeakPolarHBondContact O-CA 3.26Å; F975-M979 VanDerWaalsContact O-CB 3.23Å; F975-M979 WeakPolarHBondContact O-CB 3.44Å; F975-M979 PolarHBondContact O-N 3.45Å; F975-L982 HydrophobicContact CB-CD1 4.23Å; F975-L982 HydrophobicContact CD1-CD1 3.67Å; F975-L982 HydrophobicContact CG-CD1 4.39Å; F975-F988 HydrophobicContact CB-CE2 4.09Å; F975-F988 HydrophobicContact CB-CZ 4.19Å; F975-F988 HydrophobicContact CD1-CD2 4.35Å; F975-F988 AromaticContact CD1-CE2 3.79Å; F975-F988 HydrophobicContact CD1-CE2 3.79Å; F975-F988 AromaticContact CD2-CE2 3.99Å; F975-F988 HydrophobicContact CD2-CE2 3.99Å; F975-F988 HydrophobicContact CE1-CD2 4.31Å; F975-F988 HydrophobicContact CE1-CE2 4.12Å; F975-F988 HydrophobicContact CE2-CE2 4.33Å; F975-F988 AromaticContact CG-CE2 3.71Å; F975-F988 HydrophobicContact CG-CE2 3.71Å; F975-F988 HydrophobicContact CG-CZ 4.31Å; F975-F988 HydrophobicContact CZ-CE2 4.39Å; F975-L991 HydrophobicContact CE2-CD2 4.16Å; F975-L991 HydrophobicContact CZ-CD2 4.28Å; F975-L1008 HydrophobicContact CB-CD2 3.82Å; F975-L1008 HydrophobicContact CD2-CD2 4.2Å
976	L	87.1	Confident	86.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.5	-41.7	177	-68.3	167.4	0	0	0	111.9	F811 T812 Y815 E972 G973 H978 L1008 L1012	F811-L976 HydrophobicContact CB-CD2 4.38Å; T812-L976 WeakPolarHBondContact CA-O 3.43Å; T812-L976 PolarHBondContact OG1-O 3.27Å; Y815-L976 HydrophobicContact CD2-CB 3.76Å; Y815-L976 HydrophobicContact CD2-CD1 3.72Å; Y815-L976 HydrophobicContact CD2-CG 4.39Å; Y815-L976 HydrophobicContact CE2-CB 4.29Å; Y815-L976 HydrophobicContact CE2-CD1 3.93Å; Y815-L976 HydrophobicContact CG-CB 4.08Å; E972-L976 WeakPolarHBondContact O-CG 3.32Å; E972-L976 PolarHBondContact O-N 3.36Å; G973-L976 PolarHBondContact O-N 3.24Å; L976-H978 PolarHBondContact O-N 3.3Å; L976-L1008 HydrophobicContact CD1-CD2 4.48Å; L976-L1008 HydrophobicContact CD2-CD2 4.1Å; L976-L1008 HydrophobicContact CG-CD2 3.87Å; L976-L1012 HydrophobicContact CD1-CB 3.82Å; L976-L1012 HydrophobicContact CD1-CD1 4.3Å; L976-L1012 HydrophobicContact CD2-CB 4.23Å; L976-L1012 HydrophobicContact CD2-CD2 4.29Å
977	K	86.8	Confident	86.1	Confident	58 Å²	58	36.8 Å²	36.8	25%	0.252	19%	0.189	S	C	.	.	H	α-helix	trans	-70.2	-27.5	-179.3	-169.8	162.5	-169.1	161	0	114.5	T812 Y815 S817 S818 I820 G973 F974 F975	T812-K977 WeakPolarHBondContact CG2-O 3.39Å; Y815-K977 HydrophobicContact CD1-CB 4.24Å; Y815-K977 HydrophobicContact CE1-CB 4.46Å; S817-K977 PolarHBondContact O-NZ 2.99Å; S818-K977 PolarHBondContact O-NZ 3.07Å; I820-K977 HydrophobicContact CD1-CD 4.45Å; I820-K977 HydrophobicContact CG1-CD 4.3Å; G973-K977 WeakPolarHBondContact O-CB 3.28Å; G973-K977 PolarHBondContact O-N 3.32Å; F974-K977 PolarHBondContact O-N 2.57Å; F975-K977 VanDerWaalsContact C-N 3.35Å; F975-K977 PolarHBondContact O-N 2.96Å
978	H	87.3	Confident	86	Confident	68 Å²	68	36.9 Å²	36.9	32%	0.315	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	19.5	-178.3	-56.3	103	0	0	0	113.1	F974 F975 L976 K980 A981 L982	F974-H978 AromaticContact CD1-ND1 3.96Å; F974-H978 AromaticContact CD2-CE1 3.7Å; F974-H978 AromaticContact CD2-ND1 3.56Å; F974-H978 AromaticContact CE1-ND1 3.84Å; F974-H978 AromaticContact CE2-CE1 3.43Å; F974-H978 VanDerWaalsContact CE2-CE1 3.43Å; F974-H978 WeakPolarHBondContact CE2-CE1 3.47Å; F974-H978 AromaticContact CE2-ND1 3.43Å; F974-H978 WeakPolarHBondContact CE2-ND1 3.38Å; F974-H978 AromaticContact CG-ND1 3.83Å; F974-H978 AromaticContact CZ-CE1 3.93Å; F974-H978 AromaticContact CZ-ND1 3.58Å; F974-H978 PolarHBondContact O-N 2.88Å; F974-H978 VanDerWaalsContact O-N 3.12Å; F974-H978 PolarHBondContact O-ND1 3.49Å; F974-H978 VanDerWaalsContact O-ND1 3.13Å; F975-H978 CarbonylContact O-C 3.57Å; F975-H978 PolarHBondContact O-N 2.8Å; L976-H978 PolarHBondContact O-N 3.3Å; H978-K980 PolarHBondContact O-N 3.48Å; H978-K980 VanDerWaalsContact O-N 3.11Å; H978-A981 PolarHBondContact O-N 2.92Å; H978-L982 HydrophobicContact CB-CD1 4.05Å; H978-L982 HydrophobicContact CB-CG 4.46Å; H978-L982 PolarHBondContact O-N 3.31Å
979	M	87.1	Confident	85.8	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-58.1	-36.6	-165.3	-161.9	164.2	-177.9	0	0	113.1	L795 A808 F811 F975 A981 L982 L983 F988 I992	L795-M979 HydrophobicContact CD2-CE 3.8Å; A808-M979 HydrophobicContact CB-CB 4.29Å; A808-M979 HydrophobicContact CB-CG 4.14Å; F811-M979 HydrophobicContact CB-SD 4.11Å; F811-M979 HydrophobicContact CD2-CE 4.1Å; F811-M979 HydrophobicContact CD2-SD 3.64Å; F811-M979 HydrophobicContact CE2-CE 4.45Å; F811-M979 HydrophobicContact CG-SD 4.32Å; F975-M979 WeakPolarHBondContact O-CA 3.26Å; F975-M979 VanDerWaalsContact O-CB 3.23Å; F975-M979 WeakPolarHBondContact O-CB 3.44Å; F975-M979 PolarHBondContact O-N 3.45Å; M979-A981 PolarHBondContact O-N 3.37Å; M979-L982 PolarHBondContact O-N 3.26Å; M979-L983 HydrophobicContact CE-CD1 4.46Å; M979-L983 HydrophobicContact CG-CD1 3.97Å; M979-L983 HydrophobicContact CG-CG 4.41Å; M979-L983 WeakPolarHBondContact O-CB 3.47Å; M979-L983 WeakPolarHBondContact O-CD1 3.43Å; M979-L983 VanDerWaalsContact O-CG 3.3Å; M979-L983 WeakPolarHBondContact O-CG 3.23Å; M979-L983 PolarHBondContact O-N 3.37Å; M979-F988 HydrophobicContact CG-CE1 4.27Å; M979-I992 HydrophobicContact CE-CD1 4.26Å
980	K	85	Confident	85.7	Confident	121 Å²	121	43.8 Å²	43.8	53%	0.526	22%	0.215	S	C	.	.	H	α-helix	trans	-57.7	-47.6	177	-168.6	-176.4	177.9	-178.6	0	112.8	H978	H978-K980 PolarHBondContact O-N 3.48Å; H978-K980 VanDerWaalsContact O-N 3.11Å
981	A	84.9	Confident	85.4	Confident	43 Å²	43	43 Å²	43	36%	0.355	21%	0.212	S	C	.	.	H	α-helix	trans	-75.2	-36.5	179.8	0	0	0	0	0	111.8	H978 M979 L983 E984	H978-A981 PolarHBondContact O-N 2.92Å; M979-A981 PolarHBondContact O-N 3.37Å; A981-L983 VanDerWaalsContact C-N 3.3Å; A981-L983 PolarHBondContact O-N 3.38Å; A981-E984 WeakPolarHBondContact O-CB 3.24Å; A981-E984 PolarHBondContact O-N 2.64Å; A981-E984 VanDerWaalsContact O-N 3.16Å
982	L	85.4	Confident	85.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.8	-32.9	175.9	-74	161.1	0	0	0	112.3	V949 F975 H978 M979 E984 Q985 F988	V949-L982 HydrophobicContact CG1-CD2 3.76Å; V949-L982 HydrophobicContact CG1-CG 4.13Å; V949-L982 WeakPolarHBondContact O-CD2 3.37Å; F975-L982 HydrophobicContact CB-CD1 4.23Å; F975-L982 HydrophobicContact CD1-CD1 3.67Å; F975-L982 HydrophobicContact CG-CD1 4.39Å; H978-L982 HydrophobicContact CB-CD1 4.05Å; H978-L982 HydrophobicContact CB-CG 4.46Å; H978-L982 PolarHBondContact O-N 3.31Å; M979-L982 PolarHBondContact O-N 3.26Å; L982-E984 PolarHBondContact O-N 3Å; L982-Q985 WeakPolarHBondContact O-CB 3.24Å; L982-Q985 PolarHBondContact O-N 3.41Å; L982-F988 HydrophobicContact CB-CB 4.4Å; L982-F988 HydrophobicContact CB-CD1 3.6Å; L982-F988 HydrophobicContact CB-CD2 4.33Å; L982-F988 HydrophobicContact CB-CE1 3.78Å; L982-F988 HydrophobicContact CB-CG 3.88Å; L982-F988 HydrophobicContact CB-CZ 4.24Å; L982-F988 HydrophobicContact CD1-CZ 4.49Å; L982-F988 WeakPolarHBondContact O-CB 3.37Å; L982-F988 WeakPolarHBondContact O-CD1 3.17Å
983	L	84.2	Confident	84.6	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-3.6	175.2	-75.8	164.8	0	0	0	114.6	I804 A808 M979 A981 F988 R989 I992	I804-L983 HydrophobicContact CG2-CD1 3.97Å; I804-L983 HydrophobicContact CG2-CD2 4.17Å; A808-L983 HydrophobicContact CB-CD1 3.38Å; M979-L983 HydrophobicContact CE-CD1 4.46Å; M979-L983 HydrophobicContact CG-CD1 3.97Å; M979-L983 HydrophobicContact CG-CG 4.41Å; M979-L983 WeakPolarHBondContact O-CB 3.47Å; M979-L983 WeakPolarHBondContact O-CD1 3.43Å; M979-L983 VanDerWaalsContact O-CG 3.3Å; M979-L983 WeakPolarHBondContact O-CG 3.23Å; M979-L983 PolarHBondContact O-N 3.37Å; A981-L983 VanDerWaalsContact C-N 3.3Å; A981-L983 PolarHBondContact O-N 3.38Å; L983-F988 HydrophobicContact CD2-CD1 4.06Å; L983-F988 HydrophobicContact CD2-CE1 4.07Å; L983-F988 HydrophobicContact CG-CD1 4.17Å; L983-F988 HydrophobicContact CG-CE1 4.03Å; L983-R989 PolarHBondContact O-NE 3.45Å; L983-R989 PolarHBondContact O-NH2 2.95Å; L983-I992 HydrophobicContact CD2-CD1 4.25Å
984	E	83.6	Confident	83.9	Confident	129 Å²	129	48.5 Å²	48.5	60%	0.603	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-19.2	166.1	-60.7	178.5	172.4	0	0	111.6	A981 L982	A981-E984 WeakPolarHBondContact O-CB 3.24Å; A981-E984 PolarHBondContact O-N 2.64Å; A981-E984 VanDerWaalsContact O-N 3.16Å; L982-E984 PolarHBondContact O-N 3Å
985	Q	85.1	Confident	82.5	Confident	76 Å²	76	58.7 Å²	58.7	36%	0.355	28%	0.278	S	S	.	.	S	Bend	trans	-87.2	123.6	-179.5	-64.4	-72.2	-11.1	0	0	112.1	V949 L982 A987 F988 R989	V949-Q985 HydrophobicContact CG1-CG 4.33Å; L982-Q985 WeakPolarHBondContact O-CB 3.24Å; L982-Q985 PolarHBondContact O-N 3.41Å; Q985-A987 PolarHBondContact O-N 2.93Å; Q985-F988 PolarHBondContact O-N 3.46Å; Q985-F988 VanDerWaalsContact O-N 3.12Å; Q985-R989 PolarHBondContact O-N 3.28Å; Q985-R989 VanDerWaalsContact O-N 3.16Å
986	D	82.4	Confident	80.6	Confident	104 Å²	104	62.7 Å²	62.7	56%	0.556	31%	0.306	S	S	*	.	H	α-helix	trans	-59.9	-32.4	178.4	-75.2	-34.9	0	0	0	113	F988 R989 Q990	D986-F988 VanDerWaalsContact C-N 3.31Å; D986-F988 PolarHBondContact O-N 2.93Å; D986-R989 PolarHBondContact O-N 2.88Å; D986-R989 IonicContact OD1-NH1 3.99Å; D986-Q990 WeakPolarHBondContact O-CB 3.44Å; D986-Q990 VanDerWaalsContact O-CG 3.29Å; D986-Q990 WeakPolarHBondContact O-CG 3.48Å; D986-Q990 PolarHBondContact O-N 3.34Å
987	A	82.1	Confident	78.9	Confident	43 Å²	43	63.5 Å²	63.5	36%	0.355	31%	0.312	S	S	.	.	H	α-helix	trans	-61.4	-37.3	177.4	0	0	0	0	0	112.8	V953 Q985 L991	V953-A987 HydrophobicContact CB-CB 4.42Å; V953-A987 HydrophobicContact CG1-CB 4.21Å; V953-A987 HydrophobicContact CG2-CB 4.35Å; Q985-A987 PolarHBondContact O-N 2.93Å; A987-L991 PolarHBondContact O-N 3.41Å
988	F	84.3	Confident	77	Confident	1 Å²	1	68.8 Å²	68.8	0%	0.004	34%	0.335	C	S	.	.	H	α-helix	trans	-79.6	-38.3	178.3	-173.2	-112.8	0	0	0	111.5	V953 F975 M979 L982 L983 Q985 D986 Q990 L991 I992	V953-F988 HydrophobicContact CG2-CB 3.88Å; V953-F988 HydrophobicContact CG2-CD2 4.04Å; V953-F988 HydrophobicContact CG2-CG 4.47Å; F975-F988 HydrophobicContact CB-CE2 4.09Å; F975-F988 HydrophobicContact CB-CZ 4.19Å; F975-F988 HydrophobicContact CD1-CD2 4.35Å; F975-F988 AromaticContact CD1-CE2 3.79Å; F975-F988 HydrophobicContact CD1-CE2 3.79Å; F975-F988 AromaticContact CD2-CE2 3.99Å; F975-F988 HydrophobicContact CD2-CE2 3.99Å; F975-F988 HydrophobicContact CE1-CD2 4.31Å; F975-F988 HydrophobicContact CE1-CE2 4.12Å; F975-F988 HydrophobicContact CE2-CE2 4.33Å; F975-F988 AromaticContact CG-CE2 3.71Å; F975-F988 HydrophobicContact CG-CE2 3.71Å; F975-F988 HydrophobicContact CG-CZ 4.31Å; F975-F988 HydrophobicContact CZ-CE2 4.39Å; M979-F988 HydrophobicContact CG-CE1 4.27Å; L982-F988 HydrophobicContact CB-CB 4.4Å; L982-F988 HydrophobicContact CB-CD1 3.6Å; L982-F988 HydrophobicContact CB-CD2 4.33Å; L982-F988 HydrophobicContact CB-CE1 3.78Å; L982-F988 HydrophobicContact CB-CG 3.88Å; L982-F988 HydrophobicContact CB-CZ 4.24Å; L982-F988 HydrophobicContact CD1-CZ 4.49Å; L982-F988 WeakPolarHBondContact O-CB 3.37Å; L982-F988 WeakPolarHBondContact O-CD1 3.17Å; L983-F988 HydrophobicContact CD2-CD1 4.06Å; L983-F988 HydrophobicContact CD2-CE1 4.07Å; L983-F988 HydrophobicContact CG-CD1 4.17Å; L983-F988 HydrophobicContact CG-CE1 4.03Å; Q985-F988 PolarHBondContact O-N 3.46Å; Q985-F988 VanDerWaalsContact O-N 3.12Å; D986-F988 VanDerWaalsContact C-N 3.31Å; D986-F988 PolarHBondContact O-N 2.93Å; F988-Q990 VanDerWaalsContact C-N 3.28Å; F988-Q990 PolarHBondContact O-N 3Å; F988-L991 HydrophobicContact CD2-CD2 4.31Å; F988-L991 WeakPolarHBondContact O-CB 3.31Å; F988-L991 PolarHBondContact O-N 3.43Å; F988-I992 HydrophobicContact CD1-CD1 3.9Å; F988-I992 HydrophobicContact CE1-CD1 3.4Å; F988-I992 VanDerWaalsContact CE1-CD1 3.4Å; F988-I992 HydrophobicContact CE1-CG1 4.49Å; F988-I992 HydrophobicContact CE2-CD1 4.31Å; F988-I992 HydrophobicContact CZ-CD1 3.65Å; F988-I992 HydrophobicContact CZ-CG1 4.49Å; F988-I992 PolarHBondContact O-N 3.35Å
989	R	83	Confident	74.8	Confident	90 Å²	90	71.5 Å²	71.5	34%	0.34	36%	0.356	S	S	.	.	H	α-helix	trans	-57.2	-42.1	169.9	-68.1	178.3	177.1	178.2	-4.6	111.8	L983 Q985 D986 L991 I992 Y993	L983-R989 PolarHBondContact O-NE 3.45Å; L983-R989 PolarHBondContact O-NH2 2.95Å; Q985-R989 PolarHBondContact O-N 3.28Å; Q985-R989 VanDerWaalsContact O-N 3.16Å; D986-R989 PolarHBondContact O-N 2.88Å; D986-R989 IonicContact OD1-NH1 3.99Å; R989-L991 VanDerWaalsContact C-N 3.33Å; R989-I992 PolarHBondContact O-N 3.22Å; R989-Y993 WeakPolarHBondContact O-CB 3.14Å; R989-Y993 WeakPolarHBondContact O-CD2 3.34Å; R989-Y993 PolarHBondContact O-N 3.02Å
990	Q	83.2	Confident	73.2	Confident	129 Å²	129	78 Å²	78	60%	0.603	39%	0.387	S	S	*	.	H	α-helix	trans	-67.3	-30.8	174.7	-72.9	178.7	20.6	0	0	113.1	D986 F988 G994	D986-Q990 WeakPolarHBondContact O-CB 3.44Å; D986-Q990 VanDerWaalsContact O-CG 3.29Å; D986-Q990 WeakPolarHBondContact O-CG 3.48Å; D986-Q990 PolarHBondContact O-N 3.34Å; F988-Q990 VanDerWaalsContact C-N 3.28Å; F988-Q990 PolarHBondContact O-N 3Å; Q990-G994 WeakPolarHBondContact O-CA 3.32Å; Q990-G994 PolarHBondContact O-N 2.93Å
991	L	81.5	Confident	71.9	Confident	9 Å²	9	75.8 Å²	75.8	5%	0.047	40%	0.398	C	S	.	.	H	α-helix	trans	-67.1	-42.8	174.1	-176.6	67.4	0	0	0	111.7	V953 Y956 F975 A987 F988 R989 P1004	V953-L991 HydrophobicContact CG1-CB 4.46Å; V953-L991 HydrophobicContact CG1-CD2 4.43Å; Y956-L991 HydrophobicContact CD1-CD1 4.27Å; Y956-L991 HydrophobicContact CD1-CD2 3.84Å; Y956-L991 HydrophobicContact CE1-CD1 4.24Å; Y956-L991 HydrophobicContact CE1-CD2 4.07Å; F975-L991 HydrophobicContact CE2-CD2 4.16Å; F975-L991 HydrophobicContact CZ-CD2 4.28Å; A987-L991 PolarHBondContact O-N 3.41Å; F988-L991 HydrophobicContact CD2-CD2 4.31Å; F988-L991 WeakPolarHBondContact O-CB 3.31Å; F988-L991 PolarHBondContact O-N 3.43Å; R989-L991 VanDerWaalsContact C-N 3.33Å; L991-P1004 HydrophobicContact CD1-CG 4.34Å; L991-P1004 HydrophobicContact CG-CB 4.32Å; L991-P1004 HydrophobicContact CG-CG 4.15Å; L991-P1004 WeakPolarHBondContact O-CG 3.3Å
992	I	81.2	Confident	70.9	Confident	11 Å²	11	74.6 Å²	74.6	6%	0.056	39%	0.386	C	S	.	.	H	α-helix	trans	-77.5	-49.3	-178.3	-70.7	174.9	0	0	0	112.4	M979 L983 F988 R989 L1005	M979-I992 HydrophobicContact CE-CD1 4.26Å; L983-I992 HydrophobicContact CD2-CD1 4.25Å; F988-I992 HydrophobicContact CD1-CD1 3.9Å; F988-I992 HydrophobicContact CE1-CD1 3.4Å; F988-I992 VanDerWaalsContact CE1-CD1 3.4Å; F988-I992 HydrophobicContact CE1-CG1 4.49Å; F988-I992 HydrophobicContact CE2-CD1 4.31Å; F988-I992 HydrophobicContact CZ-CD1 3.65Å; F988-I992 HydrophobicContact CZ-CG1 4.49Å; F988-I992 PolarHBondContact O-N 3.35Å; R989-I992 PolarHBondContact O-N 3.22Å; I992-L1005 HydrophobicContact CG2-CD1 4.29Å; I992-L1005 HydrophobicContact CG2-CD2 3.96Å; I992-L1005 HydrophobicContact CG2-CG 4.3Å
993	Y	79.1	Confident	70.5	Confident	90 Å²	90	78 Å²	78	35%	0.353	40%	0.404	S	S	.	.	H	α-helix	trans	-100.5	-9.1	-170.9	-62.1	-70.4	0	0	0	114.2	L795 R989	L795-Y993 VanDerWaalsContact O-CE1 3.31Å; L795-Y993 WeakPolarHBondContact O-CE1 3.23Å; L795-Y993 PolarHBondContact O-OH 3.14Å; R989-Y993 WeakPolarHBondContact O-CB 3.14Å; R989-Y993 WeakPolarHBondContact O-CD2 3.34Å; R989-Y993 PolarHBondContact O-N 3.02Å
994	G	71	Confident	70.4	Confident	21 Å²	21	78.1 Å²	78.1	22%	0.216	41%	0.405	C	S	.	.			trans	-70.1	137.4	-175.1	0	0	0	0	0	113.5	Q990 S996 S997	Q990-G994 WeakPolarHBondContact O-CA 3.32Å; Q990-G994 PolarHBondContact O-N 2.93Å; G994-S996 PolarHBondContact O-N 2.9Å; G994-S997 PolarHBondContact O-OG 3.48Å; G994-S997 VanDerWaalsContact O-OG 3.09Å
995	R	57.8	Low	70.4	Confident	237 Å²	237	72.7 Å²	72.7	89%	0.894	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-14.2	176.1	-71	-176.3	176.2	-176.5	-1.5	114.1
996	S	49.7	Very low	70.4	Confident	84 Å²	84	72.6 Å²	72.6	59%	0.587	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-18.8	-175.3	59.3	0	0	0	0	114.8	G994 K998 V999	G994-S996 PolarHBondContact O-N 2.9Å; S996-K998 PolarHBondContact O-N 3.35Å; S996-V999 PolarHBondContact O-N 3.24Å
997	S	51.3	Low	70.6	Confident	18 Å²	18	69.5 Å²	69.5	13%	0.126	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-60.4	-46.5	179.6	53.2	0	0	0	0	112	G994 V999 Q1000 L1002	G994-S997 PolarHBondContact O-OG 3.48Å; G994-S997 VanDerWaalsContact O-OG 3.09Å; S997-V999 PolarHBondContact O-N 3.01Å; S997-V999 VanDerWaalsContact O-N 3.1Å; S997-Q1000 PolarHBondContact O-N 3.46Å; S997-Q1000 VanDerWaalsContact O-N 3.12Å; S997-L1002 CarbonylContact C-O 3.58Å; S997-L1002 WeakPolarHBondContact CB-O 3.42Å; S997-L1002 PolarHBondContact O-N 3.37Å
998	K	47.2	Very low	70.8	Confident	168 Å²	168	67.5 Å²	67.5	73%	0.73	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-61	-19.5	179.5	-64.8	-168.3	175.6	-169.5	0	115.1	S996	S996-K998 PolarHBondContact O-N 3.35Å
999	V	42.1	Very low	71.1	Confident	126 Å²	126	68.3 Å²	68.3	76%	0.764	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-86.9	-16.2	-178.4	-174.4	0	0	0	0	111.8	S996 S997	S996-V999 PolarHBondContact O-N 3.24Å; S997-V999 PolarHBondContact O-N 3.01Å; S997-V999 VanDerWaalsContact O-N 3.1Å
1000	Q	52.8	Low	71.3	Confident	136 Å²	136	67.6 Å²	67.6	64%	0.636	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	9.6	-178.5	-69.7	-177.2	-29.3	0	0	113.8	S997 L1002	S997-Q1000 PolarHBondContact O-N 3.46Å; S997-Q1000 VanDerWaalsContact O-N 3.12Å; Q1000-L1002 VanDerWaalsContact C-N 3.26Å; Q1000-L1002 HydrophobicContact CB-CD1 4.23Å; Q1000-L1002 HydrophobicContact CB-CG 4.24Å; Q1000-L1002 PolarHBondContact O-N 3.41Å
1001	G	57.3	Low	71.4	Confident	74 Å²	74	62.1 Å²	62.1	76%	0.763	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	15.7	-177.6	0	0	0	0	0	114.5
1002	L	65.6	Low	71.7	Confident	19 Å²	19	61.7 Å²	61.7	10%	0.099	33%	0.326	C	S	.	.			trans	-93.6	115.3	177.9	-58.6	173.3	0	0	0	109.5	K960 S997 Q1000 P1004	K960-L1002 HydrophobicContact CB-CD2 3.37Å; K960-L1002 HydrophobicContact CD-CD2 4.36Å; K960-L1002 HydrophobicContact CG-CD2 3.78Å; S997-L1002 CarbonylContact C-O 3.58Å; S997-L1002 WeakPolarHBondContact CB-O 3.42Å; S997-L1002 PolarHBondContact O-N 3.37Å; Q1000-L1002 VanDerWaalsContact C-N 3.26Å; Q1000-L1002 HydrophobicContact CB-CD1 4.23Å; Q1000-L1002 HydrophobicContact CB-CG 4.24Å; Q1000-L1002 PolarHBondContact O-N 3.41Å; L1002-P1004 VanDerWaalsContact C-CD 3.44Å; L1002-P1004 WeakPolarHBondContact O-CD 3.27Å
1003	D	76.6	Confident	71.9	Confident	72 Å²	72	62.1 Å²	62.1	39%	0.385	33%	0.331	S	S	.	.			trans	-115.1	75.3	165.8	-160.6	-21.8	0	0	0	110.4	L1005 Q1006 D1007	D1003-L1005 PolarHBondContact O-N 2.88Å; D1003-L1005 VanDerWaalsContact O-N 3.08Å; D1003-L1005 PolarHBondContact OD1-N 3.11Å; D1003-Q1006 HydrophobicContact CB-CB 4.13Å; D1003-Q1006 PolarHBondContact O-N 2.89Å; D1003-Q1006 VanDerWaalsContact O-N 3.08Å; D1003-Q1006 PolarHBondContact OD1-N 3.01Å; D1003-D1007 PolarHBondContact O-N 3.14Å
1004	P	81.2	Confident	72.2	Confident	4 Å²	4	64.1 Å²	64.1	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-19.4	-175.3	25.8	-34.8	0	0	0	113.4	Y956 L991 L1002 L1008	Y956-P1004 HydrophobicContact CE1-CB 4.07Å; L991-P1004 HydrophobicContact CD1-CG 4.34Å; L991-P1004 HydrophobicContact CG-CB 4.32Å; L991-P1004 HydrophobicContact CG-CG 4.15Å; L991-P1004 WeakPolarHBondContact O-CG 3.3Å; L1002-P1004 VanDerWaalsContact C-CD 3.44Å; L1002-P1004 WeakPolarHBondContact O-CD 3.27Å; P1004-L1008 VanDerWaalsContact O-CB 3.3Å; P1004-L1008 WeakPolarHBondContact O-CB 3.29Å; P1004-L1008 VanDerWaalsContact O-CD1 3.31Å; P1004-L1008 WeakPolarHBondContact O-CD1 3.22Å; P1004-L1008 WeakPolarHBondContact O-CG 3.49Å; P1004-L1008 PolarHBondContact O-N 2.87Å; P1004-L1008 VanDerWaalsContact O-N 3.08Å
1005	L	84.3	Confident	72.7	Confident	14 Å²	14	65.7 Å²	65.7	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-74.8	-43.7	174.9	-76.5	170.5	0	0	0	111.3	F792 L795 K796 I992 D1003 Q1009	F792-L1005 HydrophobicContact CD1-CD2 3.98Å; F792-L1005 HydrophobicContact CE1-CD2 4.42Å; L795-L1005 HydrophobicContact CD2-CD2 3.84Å; K796-L1005 HydrophobicContact CB-CD1 4.23Å; K796-L1005 HydrophobicContact CD-CD1 4.21Å; K796-L1005 HydrophobicContact CG-CD1 4.06Å; I992-L1005 HydrophobicContact CG2-CD1 4.29Å; I992-L1005 HydrophobicContact CG2-CD2 3.96Å; I992-L1005 HydrophobicContact CG2-CG 4.3Å; D1003-L1005 PolarHBondContact O-N 2.88Å; D1003-L1005 VanDerWaalsContact O-N 3.08Å; D1003-L1005 PolarHBondContact OD1-N 3.11Å; L1005-Q1009 VanDerWaalsContact O-CB 3.32Å; L1005-Q1009 WeakPolarHBondContact O-CB 3.46Å; L1005-Q1009 PolarHBondContact O-N 2.72Å
1006	Q	85.4	Confident	73.9	Confident	74 Å²	74	54.5 Å²	54.5	35%	0.346	30%	0.301	S	S	.	.	H	α-helix	trans	-66.7	-39.6	175.2	-171.4	63.6	67	0	0	111.5	D1003 Q1009 N1010	D1003-Q1006 HydrophobicContact CB-CB 4.13Å; D1003-Q1006 PolarHBondContact O-N 2.89Å; D1003-Q1006 VanDerWaalsContact O-N 3.08Å; D1003-Q1006 PolarHBondContact OD1-N 3.01Å; Q1006-Q1009 PolarHBondContact O-N 2.98Å; Q1006-N1010 PolarHBondContact NE2-OD1 3.49Å; Q1006-N1010 PolarHBondContact O-N 3.01Å; Q1006-N1010 PolarHBondContact O-ND2 3.42Å; Q1006-N1010 PolarHBondContact O-OD1 2.95Å
1007	D	85.6	Confident	75.4	Confident	39 Å²	39	54.2 Å²	54.2	21%	0.209	29%	0.29	C	S	.	.	H	α-helix	trans	-58.1	-57.2	174.8	-70.1	-35.7	0	0	0	110.6	Y956 K960 E972 D1003 Q1009 N1010 T1011	Y956-D1007 PolarHBondContact OH-OD2 3.41Å; K960-D1007 WeakPolarHBondContact CE-OD2 3.5Å; K960-D1007 IonicContact NZ-OD1 3.69Å; K960-D1007 PolarHBondContact NZ-OD1 2.97Å; K960-D1007 IonicContact NZ-OD2 3.42Å; K960-D1007 PolarHBondContact NZ-OD2 3.47Å; E972-D1007 HydrophobicContact CG-CB 4.43Å; D1003-D1007 PolarHBondContact O-N 3.14Å; D1007-Q1009 VanDerWaalsContact C-N 3.27Å; D1007-Q1009 PolarHBondContact O-N 3.35Å; D1007-N1010 WeakPolarHBondContact O-CB 3.41Å; D1007-N1010 PolarHBondContact O-N 3.49Å; D1007-T1011 PolarHBondContact O-N 3.08Å; D1007-T1011 PolarHBondContact O-OG1 2.87Å
1008	L	87.6	Confident	76.7	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-56.2	-37.6	177.1	-74.7	168.8	0	0	0	113.5	F792 E972 F975 L976 P1004 L1012	F792-L1008 HydrophobicContact CE1-CB 4.05Å; F792-L1008 HydrophobicContact CZ-CB 4.13Å; E972-L1008 HydrophobicContact CB-CD2 4.13Å; E972-L1008 HydrophobicContact CG-CD2 4.47Å; E972-L1008 WeakPolarHBondContact O-CD2 3.28Å; F975-L1008 HydrophobicContact CB-CD2 3.82Å; F975-L1008 HydrophobicContact CD2-CD2 4.2Å; L976-L1008 HydrophobicContact CD1-CD2 4.48Å; L976-L1008 HydrophobicContact CD2-CD2 4.1Å; L976-L1008 HydrophobicContact CG-CD2 3.87Å; P1004-L1008 VanDerWaalsContact O-CB 3.3Å; P1004-L1008 WeakPolarHBondContact O-CB 3.29Å; P1004-L1008 VanDerWaalsContact O-CD1 3.31Å; P1004-L1008 WeakPolarHBondContact O-CD1 3.22Å; P1004-L1008 WeakPolarHBondContact O-CG 3.49Å; P1004-L1008 PolarHBondContact O-N 2.87Å; P1004-L1008 VanDerWaalsContact O-N 3.08Å; L1008-L1012 WeakPolarHBondContact O-CB 3.37Å; L1008-L1012 PolarHBondContact O-N 2.89Å
1009	Q	88.7	Confident	77.9	Confident	18 Å²	18	49.6 Å²	49.6	8%	0.084	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-43.7	175.8	179.5	-178	-22.9	0	0	111.3	F792 L1005 Q1006 D1007 L1012 A1013	F792-Q1009 HydrophobicContact CD2-CB 3.7Å; F792-Q1009 HydrophobicContact CD2-CG 3.78Å; F792-Q1009 HydrophobicContact CE2-CB 3.72Å; F792-Q1009 HydrophobicContact CE2-CG 4.05Å; F792-Q1009 HydrophobicContact CG-CB 4.19Å; F792-Q1009 HydrophobicContact CZ-CB 4.2Å; L1005-Q1009 VanDerWaalsContact O-CB 3.32Å; L1005-Q1009 WeakPolarHBondContact O-CB 3.46Å; L1005-Q1009 PolarHBondContact O-N 2.72Å; Q1006-Q1009 PolarHBondContact O-N 2.98Å; D1007-Q1009 VanDerWaalsContact C-N 3.27Å; D1007-Q1009 PolarHBondContact O-N 3.35Å; Q1009-L1012 PolarHBondContact O-N 3.49Å; Q1009-A1013 WeakPolarHBondContact O-CB 3.47Å; Q1009-A1013 PolarHBondContact O-N 2.89Å
1010	N	87.5	Confident	79.1	Confident	74 Å²	74	45 Å²	45	40%	0.396	25%	0.246	S	C	.	.	H	α-helix	trans	-65.5	-46.8	178.6	-62.3	-16.1	0	0	0	110.9	Q1006 D1007 L1012 A1013 E1014	Q1006-N1010 PolarHBondContact NE2-OD1 3.49Å; Q1006-N1010 PolarHBondContact O-N 3.01Å; Q1006-N1010 PolarHBondContact O-ND2 3.42Å; Q1006-N1010 PolarHBondContact O-OD1 2.95Å; D1007-N1010 WeakPolarHBondContact O-CB 3.41Å; D1007-N1010 PolarHBondContact O-N 3.49Å; N1010-L1012 VanDerWaalsContact C-N 3.31Å; N1010-L1012 PolarHBondContact O-N 2.99Å; N1010-A1013 PolarHBondContact O-N 2.92Å; N1010-E1014 WeakPolarHBondContact O-CG 3.41Å; N1010-E1014 PolarHBondContact O-N 2.97Å
1011	T	86.2	Confident	79.6	Confident	15 Å²	15	42.7 Å²	42.7	9%	0.092	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-40.9	177.9	-22.6	0	0	0	0	111.8	L969 E972 D1007 R1015	L969-T1011 HydrophobicContact CD2-CG2 4.46Å; E972-T1011 HydrophobicContact CB-CG2 4.1Å; E972-T1011 WeakPolarHBondContact CB-OG1 3.42Å; E972-T1011 PolarHBondContact OE2-OG1 3.5Å; D1007-T1011 PolarHBondContact O-N 3.08Å; D1007-T1011 PolarHBondContact O-OG1 2.87Å; T1011-R1015 WeakPolarHBondContact O-CB 3.3Å; T1011-R1015 PolarHBondContact O-N 2.7Å; T1011-R1015 VanDerWaalsContact O-N 3.15Å
1012	L	86.6	Confident	79.7	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-70.9	-39.4	177.3	-173	61.5	0	0	0	111.7	L788 F792 F811 C814 Y815 L976 L1008 Q1009 N1010 R1015 V1016	L788-L1012 HydrophobicContact CD1-CB 4.35Å; L788-L1012 HydrophobicContact CD1-CD2 4.35Å; L788-L1012 HydrophobicContact CD1-CG 4.08Å; L788-L1012 HydrophobicContact CD2-CD2 3.63Å; L788-L1012 HydrophobicContact CD2-CG 4.13Å; F792-L1012 HydrophobicContact CE2-CD2 4.11Å; F792-L1012 HydrophobicContact CZ-CD2 4.38Å; F811-L1012 HydrophobicContact CB-CD2 4.24Å; F811-L1012 HydrophobicContact CD1-CD2 3.5Å; F811-L1012 HydrophobicContact CE1-CD2 4.21Å; F811-L1012 HydrophobicContact CG-CD2 4.18Å; C814-L1012 HydrophobicContact CB-CD1 4.13Å; Y815-L1012 HydrophobicContact CD2-CD1 4.21Å; L976-L1012 HydrophobicContact CD1-CB 3.82Å; L976-L1012 HydrophobicContact CD1-CD1 4.3Å; L976-L1012 HydrophobicContact CD2-CB 4.23Å; L976-L1012 HydrophobicContact CD2-CD2 4.29Å; L1008-L1012 WeakPolarHBondContact O-CB 3.37Å; L1008-L1012 PolarHBondContact O-N 2.89Å; Q1009-L1012 PolarHBondContact O-N 3.49Å; N1010-L1012 VanDerWaalsContact C-N 3.31Å; N1010-L1012 PolarHBondContact O-N 2.99Å; L1012-R1015 PolarHBondContact O-N 3.21Å; L1012-V1016 HydrophobicContact CD1-CG2 4.17Å; L1012-V1016 HydrophobicContact CG-CG2 4.31Å; L1012-V1016 WeakPolarHBondContact O-CG2 3.4Å; L1012-V1016 PolarHBondContact O-N 3.32Å
1013	A	86.3	Confident	79.2	Confident	20 Å²	20	46.1 Å²	46.1	17%	0.165	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-48.3	176.8	0	0	0	0	0	111.6	V784 L788 Q1009 N1010 R1015 V1016 H1017	V784-A1013 HydrophobicContact CG1-CB 3.74Å; L788-A1013 HydrophobicContact CD1-CB 3.91Å; Q1009-A1013 WeakPolarHBondContact O-CB 3.47Å; Q1009-A1013 PolarHBondContact O-N 2.89Å; N1010-A1013 PolarHBondContact O-N 2.92Å; A1013-R1015 VanDerWaalsContact C-N 3.3Å; A1013-R1015 PolarHBondContact O-N 2.91Å; A1013-V1016 PolarHBondContact O-N 3.47Å; A1013-H1017 WeakPolarHBondContact O-CB 3.15Å; A1013-H1017 PolarHBondContact O-N 3.48Å
1014	E	85.3	Confident	78	Confident	131 Å²	131	50.8 Å²	50.8	61%	0.612	26%	0.259	S	S	*	.	H	α-helix	trans	-58.7	-41.8	174.1	-71.7	-179.7	178.3	0	0	111.6	N1010 H1017 S1018	N1010-E1014 WeakPolarHBondContact O-CG 3.41Å; N1010-E1014 PolarHBondContact O-N 2.97Å; E1014-H1017 PolarHBondContact O-N 3.11Å; E1014-S1018 PolarHBondContact O-N 2.95Å
1015	R	82.6	Confident	76	Confident	55 Å²	55	59.2 Å²	59.2	21%	0.208	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-51.2	179.5	-167.7	55.1	168.3	-175.5	-3.1	112.1	Y815 S818 T1011 L1012 A1013 H1017 S1018 V1019	Y815-R1015 HydrophobicContact CD2-CB 4.24Å; Y815-R1015 HydrophobicContact CD2-CG 3.96Å; Y815-R1015 HydrophobicContact CE2-CB 4.26Å; Y815-R1015 HydrophobicContact CE2-CG 4.04Å; Y815-R1015 HydrophobicContact CG-CG 4.46Å; S818-R1015 VanDerWaalsContact CB-NH2 3.33Å; S818-R1015 PolarHBondContact OG-NH2 3.26Å; T1011-R1015 WeakPolarHBondContact O-CB 3.3Å; T1011-R1015 PolarHBondContact O-N 2.7Å; T1011-R1015 VanDerWaalsContact O-N 3.15Å; L1012-R1015 PolarHBondContact O-N 3.21Å; A1013-R1015 VanDerWaalsContact C-N 3.3Å; A1013-R1015 PolarHBondContact O-N 2.91Å; R1015-H1017 VanDerWaalsContact C-N 3.28Å; R1015-H1017 PolarHBondContact O-N 3.13Å; R1015-S1018 PolarHBondContact O-N 2.76Å; R1015-S1018 VanDerWaalsContact O-N 3.13Å; R1015-S1018 PolarHBondContact O-OG 3.4Å; R1015-V1019 PolarHBondContact O-N 2.86Å; R1015-V1019 VanDerWaalsContact O-N 3.13Å
1016	V	82.1	Confident	75.6	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-62.3	-37.1	178	175.9	0	0	0	0	110.7	Y779 L783 V784 C814 L1012 A1013 S1018 V1019 Y1020	Y779-V1016 HydrophobicContact CD2-CG1 4.42Å; L783-V1016 HydrophobicContact CD2-CG1 4.36Å; V784-V1016 HydrophobicContact CG2-CB 4.16Å; V784-V1016 HydrophobicContact CG2-CG1 3.71Å; C814-V1016 HydrophobicContact CB-CG2 4.07Å; L1012-V1016 HydrophobicContact CD1-CG2 4.17Å; L1012-V1016 HydrophobicContact CG-CG2 4.31Å; L1012-V1016 WeakPolarHBondContact O-CG2 3.4Å; L1012-V1016 PolarHBondContact O-N 3.32Å; A1013-V1016 PolarHBondContact O-N 3.47Å; V1016-S1018 PolarHBondContact O-N 2.94Å; V1016-V1019 PolarHBondContact O-N 3.13Å; V1016-Y1020 WeakPolarHBondContact O-CB 3.5Å; V1016-Y1020 PolarHBondContact O-N 3.35Å
1017	H	81.1	Confident	75.1	Confident	79 Å²	79	60.8 Å²	60.8	37%	0.366	32%	0.321	S	S	.	.	H	α-helix	trans	-64.4	-37.8	175	-163.6	73.5	0	0	0	112.4	A1013 E1014 R1015 Y1020 I1021	A1013-H1017 WeakPolarHBondContact O-CB 3.15Å; A1013-H1017 PolarHBondContact O-N 3.48Å; E1014-H1017 PolarHBondContact O-N 3.11Å; R1015-H1017 VanDerWaalsContact C-N 3.28Å; R1015-H1017 PolarHBondContact O-N 3.13Å; H1017-Y1020 PolarHBondContact O-N 3.34Å; H1017-I1021 WeakPolarHBondContact O-CG1 3.28Å; H1017-I1021 PolarHBondContact O-N 2.96Å
1018	S	78.3	Confident	74.5	Confident	43 Å²	43	62.1 Å²	62.1	30%	0.301	33%	0.327	S	S	.	.	H	α-helix	trans	-65.8	-37	174.2	74.6	0	0	0	0	113.2	E1014 R1015 V1016 T1022	E1014-S1018 PolarHBondContact O-N 2.95Å; R1015-S1018 PolarHBondContact O-N 2.76Å; R1015-S1018 VanDerWaalsContact O-N 3.13Å; R1015-S1018 PolarHBondContact O-OG 3.4Å; V1016-S1018 PolarHBondContact O-N 2.94Å; S1018-T1022 WeakPolarHBondContact O-CG2 3.48Å; S1018-T1022 PolarHBondContact O-N 2.74Å; S1018-T1022 VanDerWaalsContact O-N 3.13Å; S1018-T1022 PolarHBondContact O-OG1 3.32Å
1019	V	72.8	Confident	73.7	Confident	46 Å²	46	65.6 Å²	65.6	28%	0.279	35%	0.346	S	S	.	.	H	α-helix	trans	-67.4	-44.4	173.8	176.4	0	0	0	0	110.5	R1015 V1016 I1021 T1022 S1023	R1015-V1019 PolarHBondContact O-N 2.86Å; R1015-V1019 VanDerWaalsContact O-N 3.13Å; V1016-V1019 PolarHBondContact O-N 3.13Å; V1019-I1021 PolarHBondContact O-N 2.74Å; V1019-T1022 WeakPolarHBondContact CA-OG1 3.26Å; V1019-T1022 PolarHBondContact O-N 3.45Å; V1019-T1022 PolarHBondContact O-OG1 3.36Å; V1019-T1022 VanDerWaalsContact O-OG1 3.04Å; V1019-S1023 PolarHBondContact O-N 2.82Å
1020	Y	67.7	Low	72.8	Confident	30 Å²	30	68.6 Å²	68.6	12%	0.118	36%	0.362	C	S	.	.	H	α-helix	trans	-62	-40.8	177	171.3	-110.2	0	0	0	113.8	Y779 V1016 H1017 S1023 R1024	Y779-Y1020 WeakPolarHBondContact O-CD2 3.46Å; Y779-Y1020 VanDerWaalsContact O-CE2 3.25Å; Y779-Y1020 WeakPolarHBondContact O-CE2 3.1Å; V1016-Y1020 WeakPolarHBondContact O-CB 3.5Å; V1016-Y1020 PolarHBondContact O-N 3.35Å; H1017-Y1020 PolarHBondContact O-N 3.34Å; Y1020-S1023 PolarHBondContact O-OG 3.46Å; Y1020-S1023 VanDerWaalsContact O-OG 3.05Å; Y1020-R1024 PolarHBondContact OH-NE 2.99Å; Y1020-R1024 PolarHBondContact OH-NH2 2.85Å; Y1020-R1024 VanDerWaalsContact OH-NH2 3.14Å
1021	I	63.1	Low	71.8	Confident	86 Å²	86	68.2 Å²	68.2	44%	0.441	36%	0.36	S	S	.	.	H	α-helix	trans	-66.7	-43.5	175.6	-71.4	169.5	0	0	0	110.3	H1017 V1019 S1023 R1024	H1017-I1021 WeakPolarHBondContact O-CG1 3.28Å; H1017-I1021 PolarHBondContact O-N 2.96Å; V1019-I1021 PolarHBondContact O-N 2.74Å; I1021-S1023 VanDerWaalsContact C-N 3.28Å; I1021-S1023 PolarHBondContact O-N 3.11Å; I1021-R1024 PolarHBondContact O-N 3.14Å
1022	T	59.2	Low	70.8	Confident	101 Å²	101	72 Å²	72	62%	0.62	38%	0.379	S	S	*	.	H	α-helix	trans	-71.2	-18.6	-178.2	47.5	0	0	0	0	113.9	S1018 V1019	S1018-T1022 WeakPolarHBondContact O-CG2 3.48Å; S1018-T1022 PolarHBondContact O-N 2.74Å; S1018-T1022 VanDerWaalsContact O-N 3.13Å; S1018-T1022 PolarHBondContact O-OG1 3.32Å; V1019-T1022 WeakPolarHBondContact CA-OG1 3.26Å; V1019-T1022 PolarHBondContact O-N 3.45Å; V1019-T1022 PolarHBondContact O-OG1 3.36Å; V1019-T1022 VanDerWaalsContact O-OG1 3.04Å
1023	S	54.3	Low	69.5	Low	64 Å²	64	77.5 Å²	77.5	45%	0.448	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.2	173	73.1	0	0	0	0	114.7	V1019 Y1020 I1021	V1019-S1023 PolarHBondContact O-N 2.82Å; Y1020-S1023 PolarHBondContact O-OG 3.46Å; Y1020-S1023 VanDerWaalsContact O-OG 3.05Å; I1021-S1023 VanDerWaalsContact C-N 3.28Å; I1021-S1023 PolarHBondContact O-N 3.11Å
1024	R	51.4	Low	68.2	Low	171 Å²	171	82.3 Å²	82.3	65%	0.645	43%	0.428	S	S	*	.			trans	-109.8	1.6	180	-76.9	-169.2	171.1	-151.1	1.1	114.5	Y1020 I1021	Y1020-R1024 PolarHBondContact OH-NE 2.99Å; Y1020-R1024 PolarHBondContact OH-NH2 2.85Å; Y1020-R1024 VanDerWaalsContact OH-NH2 3.14Å; I1021-R1024 PolarHBondContact O-N 3.14Å
1025	V	39.9	Very low	66.6	Low	181 Å²	181	77.9 Å²	77.9	100%	1.097	41%	0.412	S	S	*	.			trans	-109.8	0	178.1	178.9	0	0	0	0	109.3

Retrieved 1,025 of 1,025 residues in 264 ms (Link to these results)

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