A0A087X7G3_POEFO Loading...

Ankyrin repeat and BTB/POZ domain-containing protein 2

May be involved in the initiation of hepatocyte growth.

AlphaFold DB , UniProt , Accession A0A087X7G3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,049 aa.

						>A0A087X7G3_POEFO|A0A087X7G3
MAGLSKVHMKTLEDLTLDSGYGAGDSCKSLSLSSSKSNSQAFMTTPHRGNWWYYSGSMNSRNNSWDTVNTVLPEDPEDIFSKCHRLPELEEFPWTEEEVARILRKVAESGGSAKSGSASVFSQEAVRRLSALLRRALIRISREAQRLSVMHCRCTRFEVQSAMRLVLSWALADHCVSATVKAISMYCMSAGELLRKGKSARCGLSFSVGRFFRWMVDTRISVRIHEYAAISLTACMEALVEEIGLRVLMAERGHSGADSGSGCAPVTAEALEAVVNNDAELWGVLQHYEHLICGKNANGVLSLPAHFSPYTENQQAVDSREDAYAQLELRTLEQSLLATCVGSISELSDLVSRAMHHMQRLSSMRPGQSPARHARAQQPVSWLPDALHTLYYFLRCPQMESMENPNLDPPRMALSKERPFMLLPPLMEWMRVAIVHAEHRKSLLVDSDDVRQTARLLLPGLDCEPRQLKPECCFSSFKRLDSKAAIDKFNLDLGFRMLNCGRTDLIGQAIDLLRPDGVNSMDDQGMTPLMYACAAGDEALVQMLIDAGANLDVAVPLYSPKYPSVHPDSRHWTALTFAVLHGHIPVVQLLLDAGANVEGAAIRNGQETTADTPLQLASAAGNYEMVTLLLARGADPLSRSHDGNALTSSLYEDMNCFSHAAAHGHRNVLRKLLTQPQQIKEDVLSLEEILAEGVENEIPGMCPYLPTPSNGTPALQDADIPNLCKARMKALQEASYYSAEHGYLDVTMELHAMGVPWKLHVWLESLRCAHQQSKTGAILSLLREFTTVREEDYCDELVTTGLPLMFTILRTTKNDAIIQQLAAIFSHCFGSAPLPAIPEMKASLSAQLDPLFLNNPDMSDVTFLVEGKPFYGHKVLLITSSDKFKSLLASSGSDGSPSKEIEISDVKYHIFQMMMSYLYCGGTESLKTNVMDLLELLSAANQFKLGALQRHCELICSKHINLDNAVSIYKTAKANGSVDLSSCCESFFLQQMPALLEKDGFRTLLLGTNCTRQGNNCTSLAHSRSDSPLEELEAILAQRIRSLYISSQV
					

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	27.8	Very low	34.9	Very low	249 Å²	249	121.5 Å²	121.5	100%	1.227	69%	0.691	S	S	*	*				0	82.9	0	-71.8	-66.4	-114.3	0	0	109
2	A	25.5	Very low	36.5	Very low	111 Å²	111	111.5 Å²	111.5	92%	0.917	63%	0.634	S	S	*	*			trans	-149.3	111.4	175.2	0	0	0	0	0	107.8
3	G	31.6	Very low	37.6	Very low	71 Å²	71	108.3 Å²	108.3	73%	0.732	61%	0.61	S	S	*	*			trans	-179.2	162.2	-173.8	0	0	0	0	0	109.9
4	L	28.5	Very low	37.8	Very low	187 Å²	187	108.4 Å²	108.4	98%	0.979	61%	0.608	S	S	*	*	S	Bend	trans	71.5	40.3	-174.9	-52.3	175.7	0	0	0	116.4
5	S	26.6	Very low	38.3	Very low	120 Å²	120	104.9 Å²	104.9	84%	0.839	59%	0.587	S	S	*	*			trans	-150.2	35.6	151.4	77.5	0	0	0	0	113.9
6	K	31.6	Very low	38.5	Very low	171 Å²	171	101.6 Å²	101.6	74%	0.743	57%	0.57	S	S	*	*			trans	-101.9	97.2	164.3	-84	-162.8	172.6	-166.5	0	109.7	H8	K6-H8 PolarHBondContact O-N 3.37Å
7	V	32.2	Very low	38.3	Very low	114 Å²	114	106.7 Å²	106.7	69%	0.691	60%	0.595	S	S	*	*			trans	-58.1	119.1	140.2	178.5	0	0	0	0	104.6	M9	V7-M9 PolarHBondContact O-N 3.17Å; V7-M9 VanDerWaalsContact O-N 3.08Å
8	H	36.8	Very low	38.2	Very low	141 Å²	141	105.5 Å²	105.5	65%	0.653	59%	0.587	S	S	*	*			trans	-74.6	101.5	173	-85.4	59.5	0	0	0	106.9	K6 K10	K6-H8 PolarHBondContact O-N 3.37Å; H8-K10 PolarHBondContact O-N 2.95Å; H8-K10 VanDerWaalsContact O-N 3.1Å
9	M	43	Very low	37.9	Very low	67 Å²	67	106.9 Å²	106.9	33%	0.33	61%	0.605	S	S	.	*			trans	-55.3	117.8	160	-59.1	-165.4	83.1	0	0	106.5	V7 T11 E91 D217	V7-M9 PolarHBondContact O-N 3.17Å; V7-M9 VanDerWaalsContact O-N 3.08Å; M9-T11 PolarHBondContact O-N 2.67Å; M9-E91 HydrophobicContact CE-CB 3.7Å; M9-E91 HydrophobicContact CE-CG 3.99Å; M9-E91 WeakPolarHBondContact CE-OE2 3.5Å; M9-D217 HydrophobicContact SD-CB 4.46Å
10	K	45.4	Very low	37.9	Very low	92 Å²	92	104 Å²	104	40%	0.4	60%	0.599	S	S	.	*			trans	-62.6	110.3	173.6	-58.8	151.4	178.5	155.9	0	106.1	H8 L15 L89 E90	H8-K10 PolarHBondContact O-N 2.95Å; H8-K10 VanDerWaalsContact O-N 3.1Å; K10-L15 HydrophobicContact CB-CD1 3.62Å; K10-L15 HydrophobicContact CB-CD2 4.01Å; K10-L15 HydrophobicContact CB-CG 3.94Å; K10-L15 HydrophobicContact CD-CD2 4.35Å; K10-L15 HydrophobicContact CG-CD2 4.43Å; K10-L89 WeakPolarHBondContact O-CD2 3.26Å; K10-E90 WeakPolarHBondContact CE-OE1 3.17Å; K10-E90 IonicContact NZ-OE1 3.48Å; K10-E90 PolarHBondContact NZ-OE1 2.9Å
11	T	54.5	Low	38	Very low	14 Å²	14	105.4 Å²	105.4	9%	0.086	60%	0.596	C	S	.	*			trans	-68.8	167.4	179.1	65.2	0	0	0	0	109.9	M9 E13 D14 L15 R219	M9-T11 PolarHBondContact O-N 2.67Å; T11-E13 PolarHBondContact O-N 3.14Å; T11-D14 VanDerWaalsContact CB-OD2 3.31Å; T11-D14 WeakPolarHBondContact CB-OD2 3.36Å; T11-D14 WeakPolarHBondContact CG2-OD2 3.47Å; T11-D14 PolarHBondContact N-OD2 3Å; T11-D14 PolarHBondContact O-N 2.82Å; T11-D14 PolarHBondContact OG1-N 2.64Å; T11-D14 VanDerWaalsContact OG1-N 3.12Å; T11-D14 PolarHBondContact OG1-OD2 2.85Å; T11-L15 WeakPolarHBondContact O-CD1 3.36Å; T11-L15 WeakPolarHBondContact O-CG 3.38Å; T11-R219 HydrophobicContact CG2-CG 4.41Å
12	L	54.2	Low	38.2	Very low	1 Å²	1	96.6 Å²	96.6	1%	0.005	57%	0.569	C	S	.	*	S	Bend	trans	-65	-25.3	176	-116.3	168.1	0	0	0	111.9	R142 T218	L12-R142 HydrophobicContact CD1-CG 4.21Å; L12-R142 HydrophobicContact CD2-CG 3.39Å; L12-R142 VanDerWaalsContact CD2-NE 3.31Å; L12-R142 HydrophobicContact CG-CG 4.46Å; L12-T218 WeakPolarHBondContact CB-O 3.45Å; L12-T218 PolarHBondContact N-O 3.29Å; L12-T218 VanDerWaalsContact N-O 3.1Å
13	E	50.5	Low	38.8	Very low	70 Å²	70	96.7 Å²	96.7	33%	0.327	57%	0.57	S	S	.	*	S	Bend	trans	-74.4	-45	175.5	-62	168.4	-174	0	0	112.1	T11 L15 T16 R219	T11-E13 PolarHBondContact O-N 3.14Å; E13-L15 PolarHBondContact O-N 3.46Å; E13-T16 PolarHBondContact O-N 2.86Å; E13-T16 VanDerWaalsContact O-O 3.11Å; E13-T16 PolarHBondContact O-OG1 3.31Å; E13-R219 HydrophobicContact CG-CB 4.48Å; E13-R219 VanDerWaalsContact OE1-CB 3.31Å; E13-R219 WeakPolarHBondContact OE1-CB 3.43Å; E13-R219 WeakPolarHBondContact OE1-CD 3.19Å; E13-R219 WeakPolarHBondContact OE2-CD 3.47Å; E13-R219 IonicContact OE2-CZ 3.66Å; E13-R219 IonicContact OE2-NE 3.64Å; E13-R219 IonicContact OE2-NH1 2.76Å; E13-R219 PolarHBondContact OE2-NH1 2.74Å
14	D	40.3	Very low	38.8	Very low	110 Å²	110	96.3 Å²	96.3	59%	0.588	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-13.6	176.2	-64	-56.9	0	0	0	113.4	T11	T11-D14 VanDerWaalsContact CB-OD2 3.31Å; T11-D14 WeakPolarHBondContact CB-OD2 3.36Å; T11-D14 WeakPolarHBondContact CG2-OD2 3.47Å; T11-D14 PolarHBondContact N-OD2 3Å; T11-D14 PolarHBondContact O-N 2.82Å; T11-D14 PolarHBondContact OG1-N 2.64Å; T11-D14 VanDerWaalsContact OG1-N 3.12Å; T11-D14 PolarHBondContact OG1-OD2 2.85Å
15	L	45.9	Very low	38.6	Very low	55 Å²	55	95.4 Å²	95.4	29%	0.288	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.3	11.3	-175.5	-58.2	168.9	0	0	0	112.3	K10 T11 E13 P87 L89 R142	K10-L15 HydrophobicContact CB-CD1 3.62Å; K10-L15 HydrophobicContact CB-CD2 4.01Å; K10-L15 HydrophobicContact CB-CG 3.94Å; K10-L15 HydrophobicContact CD-CD2 4.35Å; K10-L15 HydrophobicContact CG-CD2 4.43Å; T11-L15 WeakPolarHBondContact O-CD1 3.36Å; T11-L15 WeakPolarHBondContact O-CG 3.38Å; E13-L15 PolarHBondContact O-N 3.46Å; L15-P87 HydrophobicContact CB-CB 3.69Å; L15-P87 HydrophobicContact CB-CG 3.66Å; L15-P87 HydrophobicContact CD1-CB 3.33Å; L15-P87 HydrophobicContact CD1-CG 4.17Å; L15-P87 HydrophobicContact CD2-CB 4.36Å; L15-P87 HydrophobicContact CG-CB 3.96Å; L15-P87 HydrophobicContact CG-CG 4.48Å; L15-L89 HydrophobicContact CD1-CD2 3.74Å; L15-R142 PolarHBondContact O-NH2 2.91Å
16	T	41.3	Very low	38.7	Very low	52 Å²	52	94.7 Å²	94.7	32%	0.319	56%	0.557	S	S	.	*	S	Bend	trans	-113.2	143.2	161.9	46	0	0	0	0	108.8	E13 D18	E13-T16 PolarHBondContact O-N 2.86Å; E13-T16 VanDerWaalsContact O-O 3.11Å; E13-T16 PolarHBondContact O-OG1 3.31Å; T16-D18 PolarHBondContact O-N 2.79Å
17	L	35.4	Very low	38.4	Very low	189 Å²	189	92.3 Å²	92.3	99%	0.99	56%	0.56	S	S	*	*	S	Bend	trans	-76	23.8	-172.9	-89.9	170.8	0	0	0	114.8
18	D	36.8	Very low	38	Very low	85 Å²	85	96.1 Å²	96.1	46%	0.455	57%	0.568	S	S	.	*			trans	-139.4	92.3	-177.2	-158.3	-35.9	0	0	0	111.8	T16 G20 Y21	T16-D18 PolarHBondContact O-N 2.79Å; D18-G20 PolarHBondContact O-N 2.87Å; D18-G20 VanDerWaalsContact O-N 3.17Å; D18-G20 WeakPolarHBondContact OD1-CA 3.33Å; D18-G20 PolarHBondContact OD1-N 3.5Å; D18-Y21 HydrophobicContact CB-CD2 4.37Å; D18-Y21 WeakPolarHBondContact OD2-CE2 3.46Å
19	S	31.6	Very low	37.4	Very low	133 Å²	133	94.3 Å²	94.3	93%	0.93	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	30.3	173.7	67.5	0	0	0	0	112.8
20	G	38	Very low	36.6	Very low	47 Å²	47	99.3 Å²	99.3	49%	0.485	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.5	-24.5	-175.1	0	0	0	0	0	115.5	D18 G22	D18-G20 PolarHBondContact O-N 2.87Å; D18-G20 VanDerWaalsContact O-N 3.17Å; D18-G20 WeakPolarHBondContact OD1-CA 3.33Å; D18-G20 PolarHBondContact OD1-N 3.5Å; G20-G22 PolarHBondContact O-N 2.96Å
21	Y	40.3	Very low	35.6	Very low	134 Å²	134	99.8 Å²	99.8	53%	0.525	61%	0.613	S	S	.	*	S	Bend	trans	-83.3	47.9	-172.7	-71.5	-76.2	0	0	0	114.4	D18	D18-Y21 HydrophobicContact CB-CD2 4.37Å; D18-Y21 WeakPolarHBondContact OD2-CE2 3.46Å
22	G	33.1	Very low	34.2	Very low	65 Å²	65	107.7 Å²	107.7	67%	0.67	65%	0.654	S	S	*	*	S	Bend	trans	-157.8	72.4	-178.2	0	0	0	0	0	113.6	G20	G20-G22 PolarHBondContact O-N 2.96Å
23	A	38	Very low	32.8	Very low	112 Å²	112	113 Å²	113	93%	0.926	69%	0.692	S	S	*	*	S	Bend	trans	50.3	72	169.9	0	0	0	0	0	115.5
24	G	30.8	Very low	31.7	Very low	64 Å²	64	115.6 Å²	115.6	66%	0.66	72%	0.717	S	S	*	*			trans	-172.7	27.7	-176.4	0	0	0	0	0	121
25	D	25.2	Very low	30.8	Very low	168 Å²	168	116.1 Å²	116.1	90%	0.898	73%	0.73	S	S	*	*	S	Bend	trans	-169.4	160.4	144.4	-117	-29.1	0	0	0	114.4
26	S	28.7	Very low	29.9	Very low	104 Å²	104	123.5 Å²	123.5	73%	0.727	76%	0.759	S	S	*	*			trans	-69.9	127.3	-173.1	-175.8	0	0	0	0	114.1	K28	S26-K28 PolarHBondContact O-N 2.66Å
27	C	24.1	Very low	29.1	Very low	121 Å²	121	126.6 Å²	126.6	82%	0.818	78%	0.783	S	S	*	*			trans	-56.6	102	177.2	-68.3	0	0	0	0	113	S29	C27-S29 PolarHBondContact O-N 2.99Å
28	K	24.2	Very low	28.7	Very low	194 Å²	194	125.3 Å²	125.3	84%	0.843	78%	0.777	S	S	*	*			trans	-79.7	108	170.7	-77.7	177.7	-179.5	165	0	110.8	S26 L30	S26-K28 PolarHBondContact O-N 2.66Å; K28-L30 PolarHBondContact O-N 3.06Å
29	S	25	Very low	28.1	Very low	104 Å²	104	127 Å²	127	73%	0.727	80%	0.796	S	S	*	*			trans	-48.3	125.3	174.3	57.4	0	0	0	0	113.1	C27	C27-S29 PolarHBondContact O-N 2.99Å
30	L	25	Very low	27.7	Very low	171 Å²	171	129.3 Å²	129.3	90%	0.895	79%	0.792	S	S	*	*			trans	-115.7	87.2	165.4	-74.8	178	0	0	0	110.2	K28 L32	K28-L30 PolarHBondContact O-N 3.06Å; L30-L32 PolarHBondContact O-N 3.21Å
31	S	25.4	Very low	27	Very low	103 Å²	103	132 Å²	132	72%	0.72	81%	0.809	S	S	*	*			trans	-65.5	126.4	171.4	-49.4	0	0	0	0	110.5	S33	S31-S33 PolarHBondContact O-N 3.03Å
32	L	24.5	Very low	26.1	Very low	180 Å²	180	133.7 Å²	133.7	94%	0.942	82%	0.82	S	S	*	*			trans	-63.8	115.9	167	-76.6	167	0	0	0	109.4	L30	L30-L32 PolarHBondContact O-N 3.21Å
33	S	24.4	Very low	25.7	Very low	113 Å²	113	138 Å²	138	79%	0.79	83%	0.825	S	S	*	*			trans	-150.2	121.5	171.1	-82.7	0	0	0	0	111.5	S31	S31-S33 PolarHBondContact O-N 3.03Å
34	S	27	Very low	25	Very low	123 Å²	123	138 Å²	138	86%	0.86	81%	0.813	S	S	*	*			trans	-79.5	117.7	178.7	176.2	0	0	0	0	111.1
35	S	22.8	Very low	24.6	Very low	122 Å²	122	141 Å²	141	85%	0.853	82%	0.818	S	S	*	*			trans	-165	148.8	149.8	-89.5	0	0	0	0	113.6
36	K	27.1	Very low	24.7	Very low	209 Å²	209	138.7 Å²	138.7	91%	0.909	81%	0.813	S	S	*	*			trans	-75.9	149.3	-169.4	-51.5	156	-177.6	171.5	0	112.9
37	S	22.7	Very low	24.4	Very low	117 Å²	117	142.8 Å²	142.8	82%	0.818	82%	0.82	S	S	*	*				-170.1	155.8	124	-160.3	0	0	0	0	113.1
38	N	27.7	Very low	24.5	Very low	162 Å²	162	148.6 Å²	148.6	87%	0.866	83%	0.825	S	S	*	*			trans	-98.6	131.9	168.3	-84.7	-18.1	0	0	0	110.5
39	S	24	Very low	24.5	Very low	122 Å²	122	142.1 Å²	142.1	85%	0.853	81%	0.813	S	S	*	*			trans	-161.1	150.4	150.4	54.6	0	0	0	0	110.6
40	Q	24.6	Very low	24.8	Very low	180 Å²	180	144.9 Å²	144.9	84%	0.841	82%	0.82	S	S	*	*			trans	-105.3	144.4	-175	-64.3	174.3	-50.8	0	0	111.8
41	A	22.2	Very low	24.7	Very low	103 Å²	103	147.9 Å²	147.9	85%	0.851	82%	0.82	S	S	*	*			trans	-149.2	121.1	157.2	0	0	0	0	0	111.8
42	F	22	Very low	24.8	Very low	171 Å²	171	153 Å²	153	75%	0.75	82%	0.823	S	S	*	*			trans	-72.2	161.9	171.3	-74.4	-76.1	0	0	0	112
43	M	24.3	Very low	24.7	Very low	156 Å²	156	155.5 Å²	155.5	77%	0.768	82%	0.822	S	S	*	*			cis	-134.2	-156.8	-6.2	-79.4	-142.4	176.8	0	0	107.7
44	T	22.7	Very low	24.9	Very low	111 Å²	111	158.7 Å²	158.7	68%	0.681	82%	0.818	S	S	*	*			cis	-164.4	155.7	12.5	-24	0	0	0	0	112.3
45	T	23.2	Very low	24.7	Very low	126 Å²	126	159 Å²	159	77%	0.773	82%	0.82	S	S	*	*	S	Bend	trans	66.4	146.3	165	70.3	0	0	0	0	118.3
46	P	27	Very low	24.8	Very low	121 Å²	121	155.9 Å²	155.9	79%	0.786	81%	0.807	S	S	*	*				-109.3	148.1	-62.1	35.1	-27	0	0	0	110.9
47	H	22.6	Very low	24.6	Very low	190 Å²	190	150.3 Å²	150.3	88%	0.88	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-73.8	129.9	-165.4	-64.2	-73.8	0	0	0	114.8
48	R	26.3	Very low	24.6	Very low	242 Å²	242	152 Å²	152	91%	0.913	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-61	133.8	144.2	-77	-174.5	175.3	-173.5	-0.6	107.8
49	G	24.4	Very low	24.4	Very low	58 Å²	58	150.8 Å²	150.8	60%	0.598	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-75	137.2	179.7	0	0	0	0	0	112.6
50	N	30	Very low	24.4	Very low	162 Å²	162	150.9 Å²	150.9	87%	0.866	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-71.4	126.8	163.9	-73.8	-11.4	0	0	0	109.2
51	W	24.5	Very low	24.5	Very low	235 Å²	235	153.1 Å²	153.1	89%	0.89	79%	0.786	S	S	*	*			trans	-113	84.5	178.6	-80.7	50	0	0	0	111
52	W	25.8	Very low	24.7	Very low	211 Å²	211	154.9 Å²	154.9	80%	0.799	78%	0.781	S	S	*	*			trans	-145.6	104.5	159.2	-72.5	113.5	0	0	0	107.6
53	Y	22.8	Very low	24.9	Very low	231 Å²	231	154.7 Å²	154.7	91%	0.906	79%	0.788	S	S	*	*			trans	-141.1	138.4	177.3	-112.4	-78.8	0	0	0	111.8
54	Y	29.1	Very low	25.3	Very low	181 Å²	181	151.7 Å²	151.7	71%	0.71	78%	0.782	S	S	*	*			trans	-97.9	113.4	-165	-126.6	-104.4	0	0	0	112.4	A413	Y54-A413 HydrophobicContact CE1-CB 3.9Å; Y54-A413 WeakPolarHBondContact OH-CB 3.35Å
55	S	23.7	Very low	25.5	Very low	129 Å²	129	157.6 Å²	157.6	90%	0.902	79%	0.792	S	S	*	*			trans	177.1	143.9	159.2	-82.3	0	0	0	0	109.8
56	G	23.7	Very low	25.8	Very low	56 Å²	56	157.2 Å²	157.2	58%	0.577	79%	0.785	S	S	*	*			cis	178.3	172.5	-5.4	0	0	0	0	0	111.4
57	S	22.5	Very low	26.5	Very low	93 Å²	93	155.9 Å²	155.9	65%	0.65	78%	0.775	S	S	*	*			trans	61.7	112.6	168.3	-139.8	0	0	0	0	120.5	K416	S57-K416 PolarHBondContact O-NZ 3.44Å
58	M	23.5	Very low	27	Very low	151 Å²	151	150.8 Å²	150.8	74%	0.744	76%	0.757	S	S	*	*				23.1	137.2	113.2	-55.5	172.5	77	0	0	117.7
59	N	23	Very low	27.3	Very low	138 Å²	138	145 Å²	145	74%	0.738	74%	0.744	S	S	*	*			cis	-158.9	140.9	32.5	-96.4	-36.7	0	0	0	112.2
60	S	24.3	Very low	28	Very low	124 Å²	124	144.8 Å²	144.8	87%	0.867	73%	0.732	S	S	*	*				166.3	154.2	109.9	60.7	0	0	0	0	114.9
61	R	26.7	Very low	28.2	Very low	227 Å²	227	143.3 Å²	143.3	86%	0.857	73%	0.728	S	S	*	*			trans	-42.4	143.3	-171.2	-72.6	166.1	152.3	141.7	-5.5	120.4
62	N	27.6	Very low	28.7	Very low	140 Å²	140	136.3 Å²	136.3	75%	0.749	71%	0.707	S	S	*	*			trans	53.9	113.6	139.2	-61.1	24.9	0	0	0	120.1
63	N	25	Very low	29.4	Very low	166 Å²	166	129 Å²	129	89%	0.888	69%	0.687	S	S	*	*				-157.9	167	108.6	-94.3	-17.1	0	0	0	109.9
64	S	32.5	Very low	30.1	Very low	93 Å²	93	127.3 Å²	127.3	65%	0.65	69%	0.688	S	S	*	*			trans	-136.4	159.9	-177.3	56.6	0	0	0	0	112.1	D66	S64-D66 VanDerWaalsContact C-N 3.31Å; S64-D66 PolarHBondContact O-N 3.11Å
65	W	27	Very low	30.8	Very low	236 Å²	236	124.1 Å²	124.1	89%	0.894	68%	0.683	S	S	*	*	S	Bend	trans	69.3	-4.7	173.8	-65.1	99.2	0	0	0	119.3	T67	W65-T67 PolarHBondContact O-N 3.05Å
66	D	30.6	Very low	32	Very low	118 Å²	118	120.3 Å²	120.3	63%	0.631	66%	0.655	S	S	*	*			trans	-92.3	82.2	168.7	-83.4	-42.3	0	0	0	112.8	S64 V68	S64-D66 VanDerWaalsContact C-N 3.31Å; S64-D66 PolarHBondContact O-N 3.11Å; D66-V68 PolarHBondContact O-N 3.14Å
67	T	41.4	Very low	33.1	Very low	92 Å²	92	125.2 Å²	125.2	56%	0.564	66%	0.663	S	S	*	*			trans	-74	-6.6	173.3	-24.6	0	0	0	0	113.4	W65	W65-T67 PolarHBondContact O-N 3.05Å
68	V	33.2	Very low	34.4	Very low	83 Å²	83	125.4 Å²	125.4	50%	0.503	66%	0.657	S	S	.	*	S	Bend	trans	-86.9	-28.9	-176.2	-173	0	0	0	0	112.3	D66 T70	D66-V68 PolarHBondContact O-N 3.14Å; V68-T70 PolarHBondContact O-N 2.7Å
69	N	33	Very low	35.7	Very low	120 Å²	120	121.3 Å²	121.3	64%	0.642	64%	0.637	S	S	*	*			trans	-98.5	83.4	-179.3	-90.1	-47	0	0	0	112	V71	N69-V71 VanDerWaalsContact C-N 3.25Å; N69-V71 PolarHBondContact O-N 2.89Å
70	T	38	Very low	37.4	Very low	55 Å²	55	116.5 Å²	116.5	34%	0.337	61%	0.61	S	S	.	*			trans	-74	83.6	161.1	56.6	0	0	0	0	109.4	V68 L72	V68-T70 PolarHBondContact O-N 2.7Å; T70-L72 PolarHBondContact O-N 3.06Å
71	V	33.9	Very low	38.9	Very low	130 Å²	130	113.8 Å²	113.8	79%	0.788	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-51.2	126.6	171.8	179.1	0	0	0	0	108.9	N69	N69-V71 VanDerWaalsContact C-N 3.25Å; N69-V71 PolarHBondContact O-N 2.89Å
72	L	36.1	Very low	40.3	Very low	88 Å²	88	110 Å²	110	46%	0.461	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-62.3	144.1	-177.8	-68.4	165.2	0	0	0	110.6	T70	T70-L72 PolarHBondContact O-N 3.06Å
73	P	40.3	Very low	42	Very low	58 Å²	58	104.4 Å²	104.4	38%	0.377	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-61	147.2	157.5	29.8	-33.1	0	0	0	109	D75 I79 M421	P73-D75 PolarHBondContact O-N 3.26Å; P73-I79 HydrophobicContact CG-CD1 3.5Å; P73-I79 VanDerWaalsContact CG-CD1 3.5Å; P73-M421 HydrophobicContact CG-CE 4.22Å
74	E	37.5	Very low	44.1	Very low	196 Å²	196	102.4 Å²	102.4	92%	0.916	54%	0.537	S	S	*	.	S	Bend	trans	-65.4	-9.4	-160.1	-64.5	-177	127.7	0	0	116.1
75	D	43.4	Very low	46.3	Very low	113 Å²	113	105.4 Å²	105.4	60%	0.604	53%	0.534	S	S	*	.			trans	-132.8	104.8	168.6	-90.8	-56.5	0	0	0	111.6	P73	P73-D75 PolarHBondContact O-N 3.26Å
76	P	48.6	Very low	48.8	Very low	49 Å²	49	95 Å²	95	32%	0.318	50%	0.496	S	S	.	.	S	Bend	trans	-73.8	-28.4	174.6	29	-33.7	0	0	0	112.6	D78 I79 F80	P76-D78 VanDerWaalsContact C-N 3.29Å; P76-D78 PolarHBondContact O-N 2.98Å; P76-I79 PolarHBondContact O-N 3.32Å; P76-I79 VanDerWaalsContact O-N 3.12Å; P76-F80 HydrophobicContact CB-CD2 4.29Å; P76-F80 HydrophobicContact CB-CE2 4.33Å; P76-F80 VanDerWaalsContact O-CD2 3.25Å; P76-F80 WeakPolarHBondContact O-CD2 3.17Å; P76-F80 PolarHBondContact O-N 2.89Å; P76-F80 VanDerWaalsContact O-N 3.08Å
77	E	47.8	Very low	50.9	Low	159 Å²	159	90.1 Å²	90.1	74%	0.743	47%	0.471	S	S	*	.	H	α-helix	trans	-61.6	-37.4	-177.8	-60.9	-157.9	155.8	0	0	112	I79 F80 S81	E77-I79 PolarHBondContact O-N 3.06Å; E77-F80 PolarHBondContact O-N 3.26Å; E77-S81 VanDerWaalsContact O-CB 3.3Å; E77-S81 WeakPolarHBondContact O-CB 3.42Å; E77-S81 PolarHBondContact O-N 3.46Å; E77-S81 PolarHBondContact O-OG 2.87Å
78	D	48.2	Very low	52.3	Low	98 Å²	98	93 Å²	93	52%	0.524	48%	0.478	S	S	.	.	H	α-helix	trans	-75.1	-9.1	-179.4	-156.3	50.7	0	0	0	113.3	P76 S81 K82	P76-D78 VanDerWaalsContact C-N 3.29Å; P76-D78 PolarHBondContact O-N 2.98Å; D78-S81 PolarHBondContact O-OG 2.91Å; D78-S81 VanDerWaalsContact O-OG 3.1Å; D78-K82 PolarHBondContact O-NZ 3.2Å; D78-K82 IonicContact OD1-NZ 3.49Å; D78-K82 IonicContact OD2-NZ 3.71Å; D78-K82 PolarHBondContact OD2-NZ 3.4Å
79	I	52.5	Low	54.3	Low	64 Å²	64	89.9 Å²	89.9	33%	0.328	46%	0.458	S	S	.	.	H	α-helix	trans	-92.5	-46.6	170.1	-61	175.9	0	0	0	109.8	P73 P76 E77 S81 K82	P73-I79 HydrophobicContact CG-CD1 3.5Å; P73-I79 VanDerWaalsContact CG-CD1 3.5Å; P76-I79 PolarHBondContact O-N 3.32Å; P76-I79 VanDerWaalsContact O-N 3.12Å; E77-I79 PolarHBondContact O-N 3.06Å; I79-S81 VanDerWaalsContact C-N 3.27Å; I79-S81 PolarHBondContact O-N 3.45Å; I79-K82 PolarHBondContact O-N 3.47Å; I79-K82 VanDerWaalsContact O-N 3.16Å
80	F	57.1	Low	55.9	Low	38 Å²	38	90.2 Å²	90.2	17%	0.167	46%	0.456	C	S	.	.	H	α-helix	trans	-69.2	-22.3	179.2	-75.6	-62.6	0	0	0	113.7	P76 E77 K82 C83 Y288 I292	P76-F80 HydrophobicContact CB-CD2 4.29Å; P76-F80 HydrophobicContact CB-CE2 4.33Å; P76-F80 VanDerWaalsContact O-CD2 3.25Å; P76-F80 WeakPolarHBondContact O-CD2 3.17Å; P76-F80 PolarHBondContact O-N 2.89Å; P76-F80 VanDerWaalsContact O-N 3.08Å; E77-F80 PolarHBondContact O-N 3.26Å; F80-K82 PolarHBondContact O-N 3.28Å; F80-C83 PolarHBondContact O-N 2.91Å; F80-Y288 HydrophobicContact CB-CE1 3.69Å; F80-Y288 WeakPolarHBondContact CB-OH 3.37Å; F80-Y288 HydrophobicContact CD1-CD1 4.09Å; F80-Y288 HydrophobicContact CD1-CD2 4.01Å; F80-Y288 AromaticContact CD1-CE1 3.75Å; F80-Y288 HydrophobicContact CD1-CE1 3.75Å; F80-Y288 AromaticContact CD1-CE2 3.66Å; F80-Y288 HydrophobicContact CD1-CE2 3.66Å; F80-Y288 HydrophobicContact CD1-CG 4.22Å; F80-Y288 AromaticContact CD1-CZ 3.53Å; F80-Y288 HydrophobicContact CE1-CD2 4.19Å; F80-Y288 HydrophobicContact CE1-CE2 4.02Å; F80-Y288 HydrophobicContact CG-CE1 4.03Å; F80-Y288 HydrophobicContact CG-CE2 4.13Å; F80-Y288 AromaticContact CG-CZ 3.67Å; F80-I292 HydrophobicContact CE1-CD1 4.24Å; F80-I292 HydrophobicContact CZ-CD1 4.49Å
81	S	56.6	Low	57.8	Low	67 Å²	67	93.5 Å²	93.5	47%	0.469	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.4	170.6	66.3	0	0	0	0	113.5	E77 D78 I79	E77-S81 VanDerWaalsContact O-CB 3.3Å; E77-S81 WeakPolarHBondContact O-CB 3.42Å; E77-S81 PolarHBondContact O-N 3.46Å; E77-S81 PolarHBondContact O-OG 2.87Å; D78-S81 PolarHBondContact O-OG 2.91Å; D78-S81 VanDerWaalsContact O-OG 3.1Å; I79-S81 VanDerWaalsContact C-N 3.27Å; I79-S81 PolarHBondContact O-N 3.45Å
82	K	55.7	Low	60.4	Low	147 Å²	147	88.6 Å²	88.6	64%	0.639	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-5.7	-177.9	-60.1	169.5	-179	109.6	0	113.1	D78 I79 F80	D78-K82 PolarHBondContact O-NZ 3.2Å; D78-K82 IonicContact OD1-NZ 3.49Å; D78-K82 IonicContact OD2-NZ 3.71Å; D78-K82 PolarHBondContact OD2-NZ 3.4Å; I79-K82 PolarHBondContact O-N 3.47Å; I79-K82 VanDerWaalsContact O-N 3.16Å; F80-K82 PolarHBondContact O-N 3.28Å
83	C	63.8	Low	63	Low	23 Å²	23	84.6 Å²	84.6	16%	0.155	42%	0.415	C	S	.	.	S	Bend	trans	-86.4	139.4	178.6	-70.3	0	0	0	0	111.9	F80 Y288	F80-C83 PolarHBondContact O-N 2.91Å; C83-Y288 HydrophobicContact CB-CD1 4.07Å
84	H	68.6	Low	65.5	Low	124 Å²	124	82.6 Å²	82.6	57%	0.574	40%	0.4	S	S	*	.			trans	-59.2	142.5	171.2	-57.6	142.6	0	0	0	111.3	E289	H84-E289 HydrophobicContact CB-CB 4.12Å; H84-E289 WeakPolarHBondContact CB-OE2 3.4Å; H84-E289 IonicContact CG-OE2 3.62Å; H84-E289 IonicContact ND1-OE2 2.86Å; H84-E289 PolarHBondContact O-N 3.03Å
85	R	78.9	Confident	68	Low	156 Å²	156	75.8 Å²	75.8	59%	0.589	37%	0.372	S	S	*	.	B	Isolated β-bridge	trans	-104.4	152.9	179.9	-62.4	-177.5	-178.4	-165.7	-1.6	110.2	H287	R85-H287 CarbonylContact C-O 3.53Å; R85-H287 VanDerWaalsContact CA-O 3.28Å; R85-H287 WeakPolarHBondContact CA-O 3.31Å
86	L	80.1	Confident	70.2	Confident	16 Å²	16	73.2 Å²	73.2	8%	0.084	36%	0.356	C	S	.	.			trans	-57.6	144.4	169.9	-66.9	172.7	0	0	0	109.9	R135 I138 R139 H287	L86-R135 HydrophobicContact CD1-CB 3.9Å; L86-R135 HydrophobicContact CD1-CG 4.38Å; L86-I138 HydrophobicContact CD2-CG2 4.29Å; L86-R139 HydrophobicContact CD1-CG 4.07Å; L86-R139 HydrophobicContact CD2-CG 4.19Å; L86-H287 PolarHBondContact N-O 2.98Å
87	P	75.1	Confident	72.1	Confident	17 Å²	17	77.5 Å²	77.5	11%	0.11	37%	0.372	C	S	.	.			trans	-66.3	138.9	179.8	-18.3	30.4	0	0	0	112.8	L15 L89 I138	L15-P87 HydrophobicContact CB-CB 3.69Å; L15-P87 HydrophobicContact CB-CG 3.66Å; L15-P87 HydrophobicContact CD1-CB 3.33Å; L15-P87 HydrophobicContact CD1-CG 4.17Å; L15-P87 HydrophobicContact CD2-CB 4.36Å; L15-P87 HydrophobicContact CG-CB 3.96Å; L15-P87 HydrophobicContact CG-CG 4.48Å; P87-L89 PolarHBondContact O-N 3.49Å; P87-I138 WeakPolarHBondContact O-CD1 3.24Å
88	E	70.8	Confident	74.2	Confident	153 Å²	153	70.8 Å²	70.8	72%	0.715	34%	0.341	S	S	*	.			trans	-85.9	97.6	173.5	-67.5	-176.8	177.1	0	0	110
89	L	75	Confident	76.3	Confident	16 Å²	16	66.1 Å²	66.1	8%	0.084	32%	0.316	C	S	.	.			trans	-75.9	146	167.9	-59.6	176.1	0	0	0	110.1	K10 L15 P87 F92 I138 W214 T218	K10-L89 WeakPolarHBondContact O-CD2 3.26Å; L15-L89 HydrophobicContact CD1-CD2 3.74Å; P87-L89 PolarHBondContact O-N 3.49Å; L89-F92 HydrophobicContact CB-CE1 4.34Å; L89-F92 HydrophobicContact CB-CE2 4.27Å; L89-F92 HydrophobicContact CB-CZ 3.8Å; L89-F92 WeakPolarHBondContact O-CE2 3.46Å; L89-I138 HydrophobicContact CD1-CD1 4.05Å; L89-I138 HydrophobicContact CD1-CG1 3.98Å; L89-I138 HydrophobicContact CG-CD1 4.22Å; L89-W214 HydrophobicContact CD1-CZ2 3.72Å; L89-T218 HydrophobicContact CD1-CG2 4.22Å
90	E	66.6	Low	78.1	Confident	127 Å²	127	63.5 Å²	63.5	59%	0.593	30%	0.303	S	S	*	.	S	Bend	trans	-88.9	-30.7	-173.9	-72.3	167.3	-150.6	0	0	112.7	K10	K10-E90 WeakPolarHBondContact CE-OE1 3.17Å; K10-E90 IonicContact NZ-OE1 3.48Å; K10-E90 PolarHBondContact NZ-OE1 2.9Å
91	E	77.8	Confident	79.7	Confident	124 Å²	124	66.5 Å²	66.5	58%	0.579	31%	0.314	S	S	*	.			trans	-123.4	150.9	179.6	-53.6	-174.6	169.5	0	0	112.4	M9 W214	M9-E91 HydrophobicContact CE-CB 3.7Å; M9-E91 HydrophobicContact CE-CG 3.99Å; M9-E91 WeakPolarHBondContact CE-OE2 3.5Å; E91-W214 PolarHBondContact O-NE1 3.39Å
92	F	87.4	Confident	81.3	Confident	28 Å²	28	63.3 Å²	63.3	12%	0.123	29%	0.291	C	S	.	.			trans	-139.1	154.7	-175.8	-70.3	-84.9	0	0	0	110.9	L89 W94 R134 L137 I138	L89-F92 HydrophobicContact CB-CE1 4.34Å; L89-F92 HydrophobicContact CB-CE2 4.27Å; L89-F92 HydrophobicContact CB-CZ 3.8Å; L89-F92 WeakPolarHBondContact O-CE2 3.46Å; F92-W94 PolarHBondContact O-N 3.47Å; F92-W94 VanDerWaalsContact O-N 3.08Å; F92-R134 HydrophobicContact CD1-CB 4.19Å; F92-R134 HydrophobicContact CD1-CG 3.74Å; F92-R134 HydrophobicContact CD2-CG 3.84Å; F92-R134 HydrophobicContact CE1-CB 3.58Å; F92-R134 HydrophobicContact CE1-CG 3.54Å; F92-R134 HydrophobicContact CE2-CB 4.28Å; F92-R134 VanDerWaalsContact CE2-CD 3.41Å; F92-R134 HydrophobicContact CE2-CG 3.66Å; F92-R134 HydrophobicContact CG-CG 3.88Å; F92-R134 HydrophobicContact CZ-CB 3.63Å; F92-R134 HydrophobicContact CZ-CG 3.5Å; F92-R134 VanDerWaalsContact CZ-CG 3.5Å; F92-L137 HydrophobicContact CD1-CD2 3.87Å; F92-L137 HydrophobicContact CE1-CD2 4.37Å; F92-I138 HydrophobicContact CE1-CD1 4.04Å; F92-I138 HydrophobicContact CE1-CG1 4.36Å; F92-I138 HydrophobicContact CZ-CD1 4.15Å
93	P	91.4	Very high	82.9	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.026	26%	0.262	C	S	.	.	S	Bend	trans	-77.6	7.9	-169.2	30.9	-35.6	0	0	0	115.4	L137 R210 F211 W214	P93-L137 HydrophobicContact CG-CD2 4.18Å; P93-R210 HydrophobicContact CB-CB 4.37Å; P93-R210 PolarHBondContact O-NH1 2.92Å; P93-R210 VanDerWaalsContact O-NH1 3.11Å; P93-R210 PolarHBondContact O-NH2 3.32Å; P93-F211 HydrophobicContact CB-CB 4.29Å; P93-F211 HydrophobicContact CB-CD1 4.32Å; P93-F211 HydrophobicContact CB-CD2 3.54Å; P93-F211 HydrophobicContact CB-CE2 3.94Å; P93-F211 HydrophobicContact CB-CG 3.76Å; P93-F211 HydrophobicContact CG-CD1 3.77Å; P93-F211 HydrophobicContact CG-CD2 3.67Å; P93-F211 HydrophobicContact CG-CE1 3.8Å; P93-F211 HydrophobicContact CG-CE2 3.68Å; P93-F211 HydrophobicContact CG-CG 3.73Å; P93-F211 HydrophobicContact CG-CZ 3.76Å; P93-W214 HydrophobicContact CB-CB 3.91Å; P93-W214 HydrophobicContact CB-CG 4.21Å; P93-W214 HydrophobicContact CG-CB 4.27Å; P93-W214 HydrophobicContact CG-CD2 4.22Å; P93-W214 HydrophobicContact CG-CG 4.09Å
94	W	92.7	Very high	84.1	Confident	15 Å²	15	61 Å²	61	6%	0.057	28%	0.276	C	S	.	.			trans	-130.9	163.6	178.2	65.2	78.1	0	0	0	113	F92 E98 V99 S130 L133 R134 L137 F206 F211 M236	F92-W94 PolarHBondContact O-N 3.47Å; F92-W94 VanDerWaalsContact O-N 3.08Å; W94-E98 WeakPolarHBondContact CA-OE2 3.21Å; W94-V99 HydrophobicContact CG-CG2 4.36Å; W94-S130 PolarHBondContact NE1-OG 3.43Å; W94-L133 HydrophobicContact CH2-CB 4.08Å; W94-L133 HydrophobicContact CZ2-CB 3.87Å; W94-R134 HydrophobicContact CZ2-CG 4.11Å; W94-L137 HydrophobicContact CH2-CB 4.07Å; W94-L137 HydrophobicContact CH2-CD2 4.02Å; W94-L137 HydrophobicContact CZ3-CB 4.25Å; W94-L137 HydrophobicContact CZ3-CD1 4.44Å; W94-L137 HydrophobicContact CZ3-CD2 3.74Å; W94-L137 HydrophobicContact CZ3-CG 4.36Å; W94-F206 HydrophobicContact CB-CD1 3.65Å; W94-F206 HydrophobicContact CB-CE1 3.45Å; W94-F206 VanDerWaalsContact CB-CE1 3.45Å; W94-F206 HydrophobicContact CB-CZ 4.21Å; W94-F206 AromaticContact CG-CE1 3.97Å; W94-F206 HydrophobicContact CG-CE1 3.97Å; W94-F206 HydrophobicContact CG-CZ 4.32Å; W94-F211 HydrophobicContact CE3-CE2 4.08Å; W94-F211 AromaticContact CE3-CZ 3.67Å; W94-F211 HydrophobicContact CE3-CZ 3.67Å; W94-F211 AromaticContact CZ3-CZ 3.95Å; W94-F211 HydrophobicContact CZ3-CZ 3.95Å; W94-M236 HydrophobicContact CH2-CE 3.85Å; W94-M236 HydrophobicContact CZ3-CE 3.98Å; W94-M236 HydrophobicContact CZ3-CG 4.34Å
95	T	89.8	Confident	85	Confident	53 Å²	53	59.3 Å²	59.3	33%	0.325	27%	0.267	S	S	.	.			trans	-107.8	161.5	171.7	72.8	0	0	0	0	111.8	E97 E98 V99	T95-E97 PolarHBondContact O-N 3.19Å; T95-E97 PolarHBondContact OG1-N 3.22Å; T95-E98 PolarHBondContact N-OE2 3.04Å; T95-E98 PolarHBondContact O-N 3.3Å; T95-E98 PolarHBondContact OG1-N 2.84Å; T95-V99 PolarHBondContact O-N 3.44Å
96	E	90.1	Very high	85.3	Confident	60 Å²	60	52 Å²	52	28%	0.28	24%	0.239	S	C	.	.	H	α-helix	trans	-57.2	-32.5	172.1	-71	-171.9	-175	0	0	111.6	V99 A100 Q123 V126 R127	E96-V99 PolarHBondContact O-N 3.05Å; E96-A100 WeakPolarHBondContact O-CB 3.32Å; E96-A100 PolarHBondContact O-N 2.99Å; E96-Q123 PolarHBondContact OE2-NE2 2.62Å; E96-V126 HydrophobicContact CB-CG1 4.28Å; E96-V126 VanDerWaalsContact O-CG1 3.26Å; E96-V126 WeakPolarHBondContact O-CG1 3.5Å; E96-R127 WeakPolarHBondContact OE1-CG 3.34Å; E96-R127 IonicContact OE1-CZ 2.73Å; E96-R127 IonicContact OE1-NE 3.64Å; E96-R127 PolarHBondContact OE1-NE 3.35Å; E96-R127 IonicContact OE1-NH2 3.83Å; E96-R127 PolarHBondContact OE1-NH2 2.97Å; E96-R127 IonicContact OE2-CZ 2.77Å; E96-R127 IonicContact OE2-NE 2.77Å; E96-R127 IonicContact OE2-NH2 3.19Å; E96-R127 PolarHBondContact OE2-NH2 3.07Å
97	E	87.9	Confident	85.4	Confident	139 Å²	139	51.6 Å²	51.6	65%	0.65	24%	0.239	S	C	*	.	H	α-helix	trans	-69	-33.9	-178.4	-57.6	-179.3	161.7	0	0	113.4	T95 R101	T95-E97 PolarHBondContact O-N 3.19Å; T95-E97 PolarHBondContact OG1-N 3.22Å; E97-R101 WeakPolarHBondContact O-CB 3.36Å; E97-R101 PolarHBondContact O-N 3.13Å
98	E	91.1	Very high	85.6	Confident	17 Å²	17	56.5 Å²	56.5	8%	0.079	26%	0.26	C	S	.	.	H	α-helix	trans	-71.6	-43.7	175.9	-67.8	170.3	136.2	0	0	111.2	W94 T95 A100 R101 I102 F206 R210	W94-E98 WeakPolarHBondContact CA-OE2 3.21Å; T95-E98 PolarHBondContact N-OE2 3.04Å; T95-E98 PolarHBondContact O-N 3.3Å; T95-E98 PolarHBondContact OG1-N 2.84Å; E98-A100 VanDerWaalsContact C-N 3.3Å; E98-A100 PolarHBondContact O-N 3.34Å; E98-R101 WeakPolarHBondContact O-CA 3.45Å; E98-R101 WeakPolarHBondContact O-CB 3.37Å; E98-R101 PolarHBondContact O-N 2.97Å; E98-I102 WeakPolarHBondContact O-CG1 3.26Å; E98-I102 PolarHBondContact O-N 2.78Å; E98-F206 HydrophobicContact CB-CD1 3.77Å; E98-F206 HydrophobicContact CB-CE1 3.79Å; E98-R210 IonicContact OE1-NH2 2.85Å; E98-R210 PolarHBondContact OE1-NH2 2.91Å; E98-R210 IonicContact OE2-CZ 3.63Å; E98-R210 IonicContact OE2-NH2 2.85Å; E98-R210 PolarHBondContact OE2-NH2 3.08Å
99	V	92.9	Very high	85.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-45.3	173	-179	0	0	0	0	110	W94 T95 E96 R101 I102 L103 V126 L129 F206 V240	W94-V99 HydrophobicContact CG-CG2 4.36Å; T95-V99 PolarHBondContact O-N 3.44Å; E96-V99 PolarHBondContact O-N 3.05Å; V99-R101 VanDerWaalsContact C-N 3.29Å; V99-R101 PolarHBondContact O-N 3.03Å; V99-I102 PolarHBondContact O-N 3.38Å; V99-L103 HydrophobicContact CG1-CD1 4.13Å; V99-L103 WeakPolarHBondContact O-CG 3.45Å; V99-L103 PolarHBondContact O-N 2.94Å; V99-V126 HydrophobicContact CB-CG1 4.15Å; V99-V126 HydrophobicContact CG1-CG1 4.16Å; V99-L129 HydrophobicContact CG1-CD2 4.14Å; V99-F206 HydrophobicContact CG2-CE1 4.04Å; V99-F206 HydrophobicContact CG2-CZ 4.04Å; V99-V240 HydrophobicContact CG1-CG1 4.28Å
100	A	90.6	Very high	85	Confident	9 Å²	9	54.1 Å²	54.1	7%	0.074	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-32.3	174.3	0	0	0	0	0	113.2	E96 E98 R104 V126	E96-A100 WeakPolarHBondContact O-CB 3.32Å; E96-A100 PolarHBondContact O-N 2.99Å; E98-A100 VanDerWaalsContact C-N 3.3Å; E98-A100 PolarHBondContact O-N 3.34Å; A100-R104 WeakPolarHBondContact O-CG 3.43Å; A100-R104 PolarHBondContact O-N 3.42Å; A100-R104 VanDerWaalsContact O-N 3.13Å; A100-R104 PolarHBondContact O-NH1 2.68Å; A100-R104 VanDerWaalsContact O-NH1 3.13Å; A100-V126 HydrophobicContact CB-CG1 4.01Å; A100-V126 HydrophobicContact CB-CG2 4.01Å
101	R	89.8	Confident	84.2	Confident	101 Å²	101	50.2 Å²	50.2	38%	0.381	26%	0.259	S	S	.	.	H	α-helix	trans	-69.2	-42.1	177.2	-164.1	-169.9	-55.2	124.6	4.7	111.7	E97 E98 V99 R104 K105 S205	E97-R101 WeakPolarHBondContact O-CB 3.36Å; E97-R101 PolarHBondContact O-N 3.13Å; E98-R101 WeakPolarHBondContact O-CA 3.45Å; E98-R101 WeakPolarHBondContact O-CB 3.37Å; E98-R101 PolarHBondContact O-N 2.97Å; V99-R101 VanDerWaalsContact C-N 3.29Å; V99-R101 PolarHBondContact O-N 3.03Å; R101-R104 PolarHBondContact O-N 3.27Å; R101-K105 PolarHBondContact O-N 3.37Å; R101-S205 PolarHBondContact NH1-O 3.31Å; R101-S205 VanDerWaalsContact NH1-O 3.15Å
102	I	91.3	Very high	82.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-49.5	175.8	-61	155.2	0	0	0	109.6	E98 V99 R104 K105 V106 F206 E237 V240 E241	E98-I102 WeakPolarHBondContact O-CG1 3.26Å; E98-I102 PolarHBondContact O-N 2.78Å; V99-I102 PolarHBondContact O-N 3.38Å; I102-R104 PolarHBondContact O-N 3.32Å; I102-K105 WeakPolarHBondContact O-CB 3.49Å; I102-K105 PolarHBondContact O-N 2.71Å; I102-V106 HydrophobicContact CG2-CG2 4.36Å; I102-V106 WeakPolarHBondContact O-CG2 3.23Å; I102-V106 PolarHBondContact O-N 2.82Å; I102-F206 HydrophobicContact CD1-CD1 4.02Å; I102-F206 HydrophobicContact CD1-CD2 3.98Å; I102-F206 HydrophobicContact CD1-CE1 3.6Å; I102-F206 HydrophobicContact CD1-CE2 3.58Å; I102-F206 HydrophobicContact CD1-CG 4.18Å; I102-F206 HydrophobicContact CD1-CZ 3.38Å; I102-E237 HydrophobicContact CD1-CG 3.83Å; I102-E237 HydrophobicContact CG1-CG 4.09Å; I102-E237 HydrophobicContact CG2-CG 4.32Å; I102-V240 HydrophobicContact CB-CG1 3.83Å; I102-V240 HydrophobicContact CD1-CB 4.47Å; I102-V240 HydrophobicContact CD1-CG1 4.4Å; I102-V240 HydrophobicContact CD1-CG2 4.42Å; I102-V240 HydrophobicContact CG2-CB 3.95Å; I102-V240 HydrophobicContact CG2-CG1 3.55Å; I102-E241 HydrophobicContact CG2-CG 3.63Å
103	L	90.1	Very high	80.4	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-58.8	-31.2	178.6	-71.2	172.3	0	0	0	113.7	V99 A107 F121 V126 L129 V240	V99-L103 HydrophobicContact CG1-CD1 4.13Å; V99-L103 WeakPolarHBondContact O-CG 3.45Å; V99-L103 PolarHBondContact O-N 2.94Å; L103-A107 PolarHBondContact O-N 3.47Å; L103-F121 HydrophobicContact CB-CD2 3.76Å; L103-F121 HydrophobicContact CB-CE2 4.07Å; L103-F121 HydrophobicContact CB-CG 4.17Å; L103-F121 HydrophobicContact CD1-CB 4.25Å; L103-F121 HydrophobicContact CD1-CD1 4.15Å; L103-F121 HydrophobicContact CD1-CD2 4.44Å; L103-F121 HydrophobicContact CD1-CG 4.04Å; L103-F121 HydrophobicContact CD2-CD1 4.41Å; L103-F121 HydrophobicContact CD2-CD2 4.38Å; L103-F121 HydrophobicContact CD2-CE1 4.1Å; L103-F121 HydrophobicContact CD2-CE2 4.07Å; L103-F121 HydrophobicContact CD2-CZ 3.92Å; L103-F121 HydrophobicContact CG-CD2 4.42Å; L103-F121 HydrophobicContact CG-CG 4.49Å; L103-V126 HydrophobicContact CD1-CG2 4.05Å; L103-L129 HydrophobicContact CD1-CD2 3.93Å; L103-L129 HydrophobicContact CD2-CD2 3.96Å; L103-L129 HydrophobicContact CG-CD2 4.29Å; L103-V240 HydrophobicContact CD2-CG1 3.99Å; L103-V240 HydrophobicContact CG-CG1 3.97Å
104	R	88.1	Confident	78.3	Confident	119 Å²	119	61.1 Å²	61.1	45%	0.449	33%	0.332	S	S	.	.	H	α-helix	trans	-67.2	-48.3	170.8	-76.4	-172.1	-60.3	-85.6	6.3	112.5	A100 R101 I102 V106 A107 E108	A100-R104 WeakPolarHBondContact O-CG 3.43Å; A100-R104 PolarHBondContact O-N 3.42Å; A100-R104 VanDerWaalsContact O-N 3.13Å; A100-R104 PolarHBondContact O-NH1 2.68Å; A100-R104 VanDerWaalsContact O-NH1 3.13Å; R101-R104 PolarHBondContact O-N 3.27Å; I102-R104 PolarHBondContact O-N 3.32Å; R104-V106 PolarHBondContact O-N 3.15Å; R104-A107 PolarHBondContact O-N 3.44Å; R104-A107 VanDerWaalsContact O-N 3.1Å; R104-E108 WeakPolarHBondContact O-CB 3.38Å; R104-E108 VanDerWaalsContact O-CG 3.29Å; R104-E108 WeakPolarHBondContact O-CG 3.1Å; R104-E108 PolarHBondContact O-N 3.38Å
105	K	87.3	Confident	75.9	Confident	88 Å²	88	64 Å²	64	38%	0.383	36%	0.355	S	S	.	.	H	α-helix	trans	-54.3	-38.5	173.2	-68.4	175.4	168.9	-176.4	0	112	R101 I102 S109 S205	R101-K105 PolarHBondContact O-N 3.37Å; I102-K105 WeakPolarHBondContact O-CB 3.49Å; I102-K105 PolarHBondContact O-N 2.71Å; K105-S109 WeakPolarHBondContact O-CB 3.26Å; K105-S109 PolarHBondContact O-N 3.11Å; K105-S109 PolarHBondContact O-OG 3.44Å; K105-S205 PolarHBondContact NZ-OG 3.32Å
106	V	86	Confident	73.7	Confident	3 Å²	3	66 Å²	66	2%	0.018	39%	0.386	C	S	.	.	H	α-helix	trans	-67.3	-45	177.7	176.4	0	0	0	0	111.3	I102 R104 E108 S109 G110 E241 L245 L248	I102-V106 HydrophobicContact CG2-CG2 4.36Å; I102-V106 WeakPolarHBondContact O-CG2 3.23Å; I102-V106 PolarHBondContact O-N 2.82Å; R104-V106 PolarHBondContact O-N 3.15Å; V106-E108 VanDerWaalsContact C-N 3.35Å; V106-E108 PolarHBondContact O-N 3.37Å; V106-S109 PolarHBondContact O-OG 3.06Å; V106-G110 PolarHBondContact O-N 2.99Å; V106-E241 HydrophobicContact CG2-CB 4.03Å; V106-E241 HydrophobicContact CG2-CG 3.83Å; V106-L245 HydrophobicContact CG1-CD2 3.82Å; V106-L245 HydrophobicContact CG1-CG 3.82Å; V106-L248 HydrophobicContact CG1-CD1 4.04Å
107	A	82.1	Confident	71.8	Confident	8 Å²	8	66.4 Å²	66.4	7%	0.066	40%	0.395	C	S	.	.	H	α-helix	trans	-64.5	-37	175.7	0	0	0	0	0	112.9	L103 R104 S119 L248	L103-A107 PolarHBondContact O-N 3.47Å; R104-A107 PolarHBondContact O-N 3.44Å; R104-A107 VanDerWaalsContact O-N 3.1Å; A107-S119 WeakPolarHBondContact CB-O 3.36Å; A107-L248 HydrophobicContact CB-CD1 4.23Å
108	E	79.6	Confident	70.2	Confident	120 Å²	120	62.3 Å²	62.3	56%	0.561	39%	0.385	S	S	*	.	H	α-helix	trans	-67.8	-47.1	176.5	-70.3	158.3	-156	0	0	111.9	R104 V106	R104-E108 WeakPolarHBondContact O-CB 3.38Å; R104-E108 VanDerWaalsContact O-CG 3.29Å; R104-E108 WeakPolarHBondContact O-CG 3.1Å; R104-E108 PolarHBondContact O-N 3.38Å; V106-E108 VanDerWaalsContact C-N 3.35Å; V106-E108 PolarHBondContact O-N 3.37Å
109	S	74.6	Confident	68.9	Low	96 Å²	96	62.7 Å²	62.7	67%	0.671	39%	0.39	S	S	*	.	H	α-helix	trans	-75.2	-29.6	179.8	57.4	0	0	0	0	114	K105 V106 G111	K105-S109 WeakPolarHBondContact O-CB 3.26Å; K105-S109 PolarHBondContact O-N 3.11Å; K105-S109 PolarHBondContact O-OG 3.44Å; V106-S109 PolarHBondContact O-OG 3.06Å; S109-G111 PolarHBondContact O-N 2.97Å
110	G	57.8	Low	68.1	Low	23 Å²	23	67 Å²	67	24%	0.237	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-4.3	174.3	0	0	0	0	0	114.7	V106 R252	V106-G110 PolarHBondContact O-N 2.99Å; G110-R252 VanDerWaalsContact O-CZ 3.31Å; G110-R252 PolarHBondContact O-NH1 2.91Å; G110-R252 PolarHBondContact O-NH2 2.78Å
111	G	49	Very low	67.8	Low	44 Å²	44	67.7 Å²	67.7	45%	0.454	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.4	92.8	158	0	0	0	0	0	115.2	S109 R252	S109-G111 PolarHBondContact O-N 2.97Å; G111-R252 PolarHBondContact O-NH2 3.12Å
112	S	42.3	Very low	67.8	Low	66 Å²	66	64.4 Å²	64.4	46%	0.462	41%	0.41	S	S	.	.			trans	-162.1	69.5	133.7	-163.2	0	0	0	0	112.2	K114 S115	S112-K114 PolarHBondContact O-N 3.25Å; S112-S115 PolarHBondContact O-N 3.01Å; S112-S115 PolarHBondContact OG-N 2.96Å
113	A	44.6	Very low	67.6	Low	109 Å²	109	69 Å²	69	90%	0.901	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	18.9	172.7	0	0	0	0	0	114.4
114	K	46.5	Very low	67.6	Low	211 Å²	211	72 Å²	72	92%	0.917	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.2	0.9	-178.7	-68.9	-171.6	176.7	-179.2	0	114.1	S112	S112-K114 PolarHBondContact O-N 3.25Å
115	S	42.5	Very low	67.7	Low	75 Å²	75	66.3 Å²	66.3	52%	0.524	42%	0.424	S	S	.	.	S	Bend	trans	-131.5	125.6	168.4	-171.9	0	0	0	0	109	S112 S117	S112-S115 PolarHBondContact O-N 3.01Å; S112-S115 PolarHBondContact OG-N 2.96Å; S115-S117 PolarHBondContact O-N 3.3Å
116	G	44.6	Very low	67.9	Low	95 Å²	95	62.2 Å²	62.2	98%	0.979	41%	0.406	S	S	*	.	S	Bend	trans	-74.5	36.7	-168.4	0	0	0	0	0	115.8
117	S	49.5	Very low	68.2	Low	69 Å²	69	66.8 Å²	66.8	48%	0.483	42%	0.423	S	S	.	.			trans	-142.9	91	179.5	-172	0	0	0	0	109.4	S115	S115-S117 PolarHBondContact O-N 3.3Å
118	A	55	Low	68.7	Low	52 Å²	52	71.1 Å²	71.1	43%	0.43	44%	0.438	S	S	.	.			trans	-75.9	144.1	169.2	0	0	0	0	0	110	V120	A118-V120 PolarHBondContact O-N 2.71Å
119	S	62.4	Low	69.3	Low	25 Å²	25	65.5 Å²	65.5	18%	0.175	41%	0.412	C	S	.	.			trans	-71.4	110	178.7	46.1	0	0	0	0	111.1	A107 L248	A107-S119 WeakPolarHBondContact CB-O 3.36Å; S119-L248 VanDerWaalsContact OG-CD2 3.27Å; S119-L248 WeakPolarHBondContact OG-CD2 3.43Å
120	V	76.6	Confident	70.2	Confident	92 Å²	92	61.1 Å²	61.1	56%	0.558	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-85.9	125.8	-177	-176.9	0	0	0	0	110.2	A118 P265 V266	A118-V120 PolarHBondContact O-N 2.71Å; V120-P265 CarbonylContact O-C 3.54Å; V120-P265 WeakPolarHBondContact O-CA 3.37Å; V120-P265 WeakPolarHBondContact O-CB 3.3Å; V120-V266 PolarHBondContact O-N 3.23Å
121	F	84.9	Confident	71.8	Confident	22 Å²	22	61.8 Å²	61.8	10%	0.096	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-70.5	133.9	170.1	-73.7	-99.8	0	0	0	110.7	L103 V126 V247 L248 V266	L103-F121 HydrophobicContact CB-CD2 3.76Å; L103-F121 HydrophobicContact CB-CE2 4.07Å; L103-F121 HydrophobicContact CB-CG 4.17Å; L103-F121 HydrophobicContact CD1-CB 4.25Å; L103-F121 HydrophobicContact CD1-CD1 4.15Å; L103-F121 HydrophobicContact CD1-CD2 4.44Å; L103-F121 HydrophobicContact CD1-CG 4.04Å; L103-F121 HydrophobicContact CD2-CD1 4.41Å; L103-F121 HydrophobicContact CD2-CD2 4.38Å; L103-F121 HydrophobicContact CD2-CE1 4.1Å; L103-F121 HydrophobicContact CD2-CE2 4.07Å; L103-F121 HydrophobicContact CD2-CZ 3.92Å; L103-F121 HydrophobicContact CG-CD2 4.42Å; L103-F121 HydrophobicContact CG-CG 4.49Å; F121-V126 HydrophobicContact CB-CG2 4.26Å; F121-V247 HydrophobicContact CE1-CG1 4.24Å; F121-L248 HydrophobicContact CE2-CD1 4.23Å; F121-L248 HydrophobicContact CE2-CD2 4.12Å; F121-L248 HydrophobicContact CE2-CG 4.21Å; F121-L248 HydrophobicContact CZ-CD1 4.35Å; F121-L248 HydrophobicContact CZ-CD2 4.09Å; F121-L248 HydrophobicContact CZ-CG 3.95Å; F121-V266 HydrophobicContact CD1-CB 3.8Å; F121-V266 HydrophobicContact CD1-CG1 3.86Å; F121-V266 HydrophobicContact CD1-CG2 4.31Å; F121-V266 HydrophobicContact CE1-CB 4.1Å; F121-V266 HydrophobicContact CE1-CG1 3.84Å; F121-V266 HydrophobicContact CE1-CG2 4.29Å; F121-V266 HydrophobicContact CG-CB 4.22Å; F121-V266 HydrophobicContact CZ-CG2 4.49Å
122	S	88.6	Confident	73.8	Confident	32 Å²	32	60.6 Å²	60.6	22%	0.224	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-66.7	149.6	175.6	64.1	0	0	0	0	112	E124 A125 V126 V266	S122-E124 PolarHBondContact O-N 3.33Å; S122-A125 WeakPolarHBondContact O-CB 3.28Å; S122-A125 PolarHBondContact O-N 2.97Å; S122-A125 WeakPolarHBondContact OG-CB 3.48Å; S122-A125 PolarHBondContact OG-N 3.01Å; S122-V126 WeakPolarHBondContact O-CG2 3.34Å; S122-V126 PolarHBondContact O-N 3.21Å; S122-V266 VanDerWaalsContact CB-O 3.28Å; S122-V266 WeakPolarHBondContact CB-O 3.27Å; S122-V266 PolarHBondContact N-O 2.98Å; S122-V266 PolarHBondContact OG-O 2.87Å
123	Q	88.4	Confident	76.2	Confident	96 Å²	96	57.5 Å²	57.5	45%	0.449	35%	0.346	S	S	.	.	H	α-helix	trans	-61.4	-30.8	-178.7	-170.3	65.3	29.7	0	0	112.7	E96 V126 R127	E96-Q123 PolarHBondContact OE2-NE2 2.62Å; Q123-V126 PolarHBondContact O-N 2.87Å; Q123-R127 WeakPolarHBondContact O-CB 3.35Å; Q123-R127 PolarHBondContact O-N 2.96Å
124	E	90.1	Very high	78.5	Confident	66 Å²	66	56.8 Å²	56.8	31%	0.308	32%	0.319	S	S	.	.	H	α-helix	trans	-71.5	-39.2	173.9	-173.3	61.6	-169.4	0	0	111.3	S122 V126 R127 R128 A268	S122-E124 PolarHBondContact O-N 3.33Å; E124-V126 VanDerWaalsContact C-N 3.33Å; E124-V126 PolarHBondContact O-N 2.99Å; E124-R127 WeakPolarHBondContact O-CB 3.36Å; E124-R127 PolarHBondContact O-N 2.98Å; E124-R127 IonicContact OE2-CZ 2.67Å; E124-R127 IonicContact OE2-NH1 2.76Å; E124-R127 PolarHBondContact OE2-NH1 3.37Å; E124-R128 HydrophobicContact CG-CG 4.38Å; E124-R128 WeakPolarHBondContact O-CB 3.48Å; E124-R128 VanDerWaalsContact O-CG 3.26Å; E124-R128 WeakPolarHBondContact O-CG 3.46Å; E124-R128 PolarHBondContact O-N 3.38Å; E124-R128 IonicContact OE1-CZ 2.85Å; E124-R128 IonicContact OE1-NE 2.69Å; E124-R128 PolarHBondContact OE1-NE 3.15Å; E124-R128 IonicContact OE1-NH2 2.7Å; E124-R128 PolarHBondContact OE1-NH2 3.41Å; E124-A268 HydrophobicContact CG-CB 4.04Å
125	A	89.4	Confident	80.6	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-60.5	-41.2	171.8	0	0	0	0	0	112.1	S122 R127 R128 L129 L271	S122-A125 WeakPolarHBondContact O-CB 3.28Å; S122-A125 PolarHBondContact O-N 2.97Å; S122-A125 WeakPolarHBondContact OG-CB 3.48Å; S122-A125 PolarHBondContact OG-N 3.01Å; A125-R127 PolarHBondContact O-N 3.08Å; A125-R128 PolarHBondContact O-N 3.47Å; A125-L129 WeakPolarHBondContact O-CB 3.45Å; A125-L129 PolarHBondContact O-N 2.86Å; A125-L271 HydrophobicContact CB-CD2 4.46Å; A125-L271 VanDerWaalsContact O-CD2 3.32Å; A125-L271 WeakPolarHBondContact O-CD2 3.29Å
126	V	92.3	Very high	83	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-46.5	173	174.4	0	0	0	0	111.1	E96 V99 A100 L103 F121 S122 Q123 E124 S130	E96-V126 HydrophobicContact CB-CG1 4.28Å; E96-V126 VanDerWaalsContact O-CG1 3.26Å; E96-V126 WeakPolarHBondContact O-CG1 3.5Å; V99-V126 HydrophobicContact CB-CG1 4.15Å; V99-V126 HydrophobicContact CG1-CG1 4.16Å; A100-V126 HydrophobicContact CB-CG1 4.01Å; A100-V126 HydrophobicContact CB-CG2 4.01Å; L103-V126 HydrophobicContact CD1-CG2 4.05Å; F121-V126 HydrophobicContact CB-CG2 4.26Å; S122-V126 WeakPolarHBondContact O-CG2 3.34Å; S122-V126 PolarHBondContact O-N 3.21Å; Q123-V126 PolarHBondContact O-N 2.87Å; E124-V126 VanDerWaalsContact C-N 3.33Å; E124-V126 PolarHBondContact O-N 2.99Å; V126-S130 VanDerWaalsContact O-CB 3.28Å; V126-S130 WeakPolarHBondContact O-CB 3.5Å; V126-S130 PolarHBondContact O-N 3.34Å
127	R	92.4	Very high	85.4	Confident	98 Å²	98	40.9 Å²	40.9	37%	0.37	21%	0.213	S	C	.	.	H	α-helix	trans	-62.7	-44.2	177.6	-179.4	171.3	-58.5	113	12.6	112.4	E96 Q123 E124 A125 S130 A131	E96-R127 WeakPolarHBondContact OE1-CG 3.34Å; E96-R127 IonicContact OE1-CZ 2.73Å; E96-R127 IonicContact OE1-NE 3.64Å; E96-R127 PolarHBondContact OE1-NE 3.35Å; E96-R127 IonicContact OE1-NH2 3.83Å; E96-R127 PolarHBondContact OE1-NH2 2.97Å; E96-R127 IonicContact OE2-CZ 2.77Å; E96-R127 IonicContact OE2-NE 2.77Å; E96-R127 IonicContact OE2-NH2 3.19Å; E96-R127 PolarHBondContact OE2-NH2 3.07Å; Q123-R127 WeakPolarHBondContact O-CB 3.35Å; Q123-R127 PolarHBondContact O-N 2.96Å; E124-R127 WeakPolarHBondContact O-CB 3.36Å; E124-R127 PolarHBondContact O-N 2.98Å; E124-R127 IonicContact OE2-CZ 2.67Å; E124-R127 IonicContact OE2-NH1 2.76Å; E124-R127 PolarHBondContact OE2-NH1 3.37Å; A125-R127 PolarHBondContact O-N 3.08Å; R127-S130 WeakPolarHBondContact O-CB 3.44Å; R127-S130 PolarHBondContact O-N 3.48Å; R127-A131 WeakPolarHBondContact O-CB 3.46Å; R127-A131 PolarHBondContact O-N 2.85Å
128	R	91.8	Very high	87.4	Confident	99 Å²	99	37.9 Å²	37.9	37%	0.374	19%	0.191	S	C	.	.	H	α-helix	trans	-62.6	-48.8	176.9	-68.5	-63.3	171	118.1	-1.7	111.3	E124 A125 S130 A131 L132 A268 L271 E272	E124-R128 HydrophobicContact CG-CG 4.38Å; E124-R128 WeakPolarHBondContact O-CB 3.48Å; E124-R128 VanDerWaalsContact O-CG 3.26Å; E124-R128 WeakPolarHBondContact O-CG 3.46Å; E124-R128 PolarHBondContact O-N 3.38Å; E124-R128 IonicContact OE1-CZ 2.85Å; E124-R128 IonicContact OE1-NE 2.69Å; E124-R128 PolarHBondContact OE1-NE 3.15Å; E124-R128 IonicContact OE1-NH2 2.7Å; E124-R128 PolarHBondContact OE1-NH2 3.41Å; A125-R128 PolarHBondContact O-N 3.47Å; R128-S130 VanDerWaalsContact C-N 3.33Å; R128-S130 PolarHBondContact O-N 2.8Å; R128-A131 WeakPolarHBondContact O-CB 3.44Å; R128-A131 PolarHBondContact O-N 3.46Å; R128-A131 VanDerWaalsContact O-N 3.08Å; R128-L132 WeakPolarHBondContact O-CG 3.39Å; R128-L132 PolarHBondContact O-N 3.36Å; R128-A268 HydrophobicContact CG-CB 4.09Å; R128-L271 HydrophobicContact CB-CD2 4.03Å; R128-E272 WeakPolarHBondContact CD-OE1 3.31Å; R128-E272 IonicContact CZ-OE1 2.94Å; R128-E272 IonicContact NE-OE1 3.16Å; R128-E272 IonicContact NH1-OE1 3.65Å; R128-E272 PolarHBondContact NH1-OE1 2.9Å
129	L	92.8	Very high	89.1	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-58.2	-46.7	175.2	-176.1	60.1	0	0	0	111.3	V99 L103 A125 A131 L132 L133 V240 I243 L271	V99-L129 HydrophobicContact CG1-CD2 4.14Å; L103-L129 HydrophobicContact CD1-CD2 3.93Å; L103-L129 HydrophobicContact CD2-CD2 3.96Å; L103-L129 HydrophobicContact CG-CD2 4.29Å; A125-L129 WeakPolarHBondContact O-CB 3.45Å; A125-L129 PolarHBondContact O-N 2.86Å; L129-A131 VanDerWaalsContact C-N 3.27Å; L129-A131 PolarHBondContact O-N 3.07Å; L129-L132 PolarHBondContact O-N 3.15Å; L129-L133 HydrophobicContact CD1-CD1 4.06Å; L129-L133 HydrophobicContact CD1-CG 4.09Å; L129-L133 HydrophobicContact CD2-CD1 4.39Å; L129-L133 HydrophobicContact CG-CD1 3.74Å; L129-L133 HydrophobicContact CG-CG 4.26Å; L129-L133 WeakPolarHBondContact O-CB 3.4Å; L129-L133 VanDerWaalsContact O-CG 3.28Å; L129-L133 WeakPolarHBondContact O-CG 3.39Å; L129-L133 PolarHBondContact O-N 3.41Å; L129-V240 HydrophobicContact CD2-CG1 4.12Å; L129-I243 HydrophobicContact CD1-CB 4.24Å; L129-I243 HydrophobicContact CD1-CD1 3.92Å; L129-I243 HydrophobicContact CD1-CG2 3.74Å; L129-L271 HydrophobicContact CB-CD2 3.83Å; L129-L271 HydrophobicContact CD1-CD1 4.32Å
130	S	92.9	Very high	90.7	Very high	4 Å²	4	34.7 Å²	34.7	3%	0.028	16%	0.164	C	C	.	.	H	α-helix	trans	-57.8	-37.6	175.4	-174.9	0	0	0	0	112.3	W94 V126 R127 R128 R134	W94-S130 PolarHBondContact NE1-OG 3.43Å; V126-S130 VanDerWaalsContact O-CB 3.28Å; V126-S130 WeakPolarHBondContact O-CB 3.5Å; V126-S130 PolarHBondContact O-N 3.34Å; R127-S130 WeakPolarHBondContact O-CB 3.44Å; R127-S130 PolarHBondContact O-N 3.48Å; R128-S130 VanDerWaalsContact C-N 3.33Å; R128-S130 PolarHBondContact O-N 2.8Å; S130-R134 WeakPolarHBondContact O-CG 3.31Å
131	A	91	Very high	91.4	Very high	36 Å²	36	30.3 Å²	30.3	30%	0.298	14%	0.138	S	C	.	.	H	α-helix	trans	-72.4	-36	176.4	0	0	0	0	0	113.5	R127 R128 L129	R127-A131 WeakPolarHBondContact O-CB 3.46Å; R127-A131 PolarHBondContact O-N 2.85Å; R128-A131 WeakPolarHBondContact O-CB 3.44Å; R128-A131 PolarHBondContact O-N 3.46Å; R128-A131 VanDerWaalsContact O-N 3.08Å; L129-A131 VanDerWaalsContact C-N 3.27Å; L129-A131 PolarHBondContact O-N 3.07Å
132	L	91.4	Very high	91.7	Very high	19 Å²	19	30.5 Å²	30.5	10%	0.099	14%	0.138	C	C	.	.	H	α-helix	trans	-68	-46.4	175	-65.4	176.9	0	0	0	111.4	R128 L129 R134 R135 V275 L285	R128-L132 WeakPolarHBondContact O-CG 3.39Å; R128-L132 PolarHBondContact O-N 3.36Å; L129-L132 PolarHBondContact O-N 3.15Å; L132-R134 PolarHBondContact O-N 3.42Å; L132-R135 WeakPolarHBondContact O-CB 3.47Å; L132-R135 PolarHBondContact O-N 2.91Å; L132-V275 HydrophobicContact CD1-CG1 4.34Å; L132-V275 HydrophobicContact CD1-CG2 4.27Å; L132-L285 HydrophobicContact CB-CD1 4.32Å; L132-L285 HydrophobicContact CB-CD2 4.21Å; L132-L285 HydrophobicContact CD1-CD1 4.4Å
133	L	92.8	Very high	91.9	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	13%	0.13	C	C	.	.	H	α-helix	trans	-61.7	-25.9	-176.7	-73.7	168.8	0	0	0	114	W94 L129 R135 A136 L137 M236 L239 V240 I243	W94-L133 HydrophobicContact CH2-CB 4.08Å; W94-L133 HydrophobicContact CZ2-CB 3.87Å; L129-L133 HydrophobicContact CD1-CD1 4.06Å; L129-L133 HydrophobicContact CD1-CG 4.09Å; L129-L133 HydrophobicContact CD2-CD1 4.39Å; L129-L133 HydrophobicContact CG-CD1 3.74Å; L129-L133 HydrophobicContact CG-CG 4.26Å; L129-L133 WeakPolarHBondContact O-CB 3.4Å; L129-L133 VanDerWaalsContact O-CG 3.28Å; L129-L133 WeakPolarHBondContact O-CG 3.39Å; L129-L133 PolarHBondContact O-N 3.41Å; L133-R135 PolarHBondContact O-N 3.16Å; L133-A136 PolarHBondContact O-N 3.34Å; L133-L137 PolarHBondContact O-N 3.15Å; L133-M236 HydrophobicContact CB-CE 3.84Å; L133-M236 HydrophobicContact CD2-CE 3.86Å; L133-M236 HydrophobicContact CG-CE 4.37Å; L133-M236 WeakPolarHBondContact O-CE 3.48Å; L133-L239 HydrophobicContact CD2-CB 4.04Å; L133-V240 HydrophobicContact CD1-CG2 3.41Å; L133-V240 VanDerWaalsContact CD1-CG2 3.41Å; L133-I243 HydrophobicContact CD2-CD1 4.18Å
134	R	92.1	Very high	92.1	Very high	93 Å²	93	25 Å²	25	35%	0.351	11%	0.109	S	C	.	.	H	α-helix	trans	-52.9	-39.2	171	-67.4	169.2	-173.9	-141.1	-2.9	111.9	F92 W94 S130 L132 I138	F92-R134 HydrophobicContact CD1-CB 4.19Å; F92-R134 HydrophobicContact CD1-CG 3.74Å; F92-R134 HydrophobicContact CD2-CG 3.84Å; F92-R134 HydrophobicContact CE1-CB 3.58Å; F92-R134 HydrophobicContact CE1-CG 3.54Å; F92-R134 HydrophobicContact CE2-CB 4.28Å; F92-R134 VanDerWaalsContact CE2-CD 3.41Å; F92-R134 HydrophobicContact CE2-CG 3.66Å; F92-R134 HydrophobicContact CG-CG 3.88Å; F92-R134 HydrophobicContact CZ-CB 3.63Å; F92-R134 HydrophobicContact CZ-CG 3.5Å; F92-R134 VanDerWaalsContact CZ-CG 3.5Å; W94-R134 HydrophobicContact CZ2-CG 4.11Å; S130-R134 WeakPolarHBondContact O-CG 3.31Å; L132-R134 PolarHBondContact O-N 3.42Å; R134-I138 WeakPolarHBondContact O-CB 3.4Å; R134-I138 WeakPolarHBondContact O-CD1 3.33Å; R134-I138 VanDerWaalsContact O-CG1 3.24Å; R134-I138 WeakPolarHBondContact O-CG1 3.44Å; R134-I138 PolarHBondContact O-N 3Å
135	R	91.7	Very high	92.2	Very high	46 Å²	46	23.1 Å²	23.1	17%	0.174	10%	0.1	C	C	.	.	H	α-helix	trans	-70.8	-44	-177.7	-55.7	167.6	-166	164.3	9.1	110.6	L86 L132 L133 I138 R139 L285 H287	L86-R135 HydrophobicContact CD1-CB 3.9Å; L86-R135 HydrophobicContact CD1-CG 4.38Å; L132-R135 WeakPolarHBondContact O-CB 3.47Å; L132-R135 PolarHBondContact O-N 2.91Å; L133-R135 PolarHBondContact O-N 3.16Å; R135-I138 PolarHBondContact O-N 3.26Å; R135-R139 WeakPolarHBondContact O-CG 3.38Å; R135-R139 PolarHBondContact O-N 2.68Å; R135-L285 WeakPolarHBondContact CD-O 3.29Å; R135-L285 PolarHBondContact NH1-O 3.5Å; R135-H287 VanDerWaalsContact CZ-NE2 3.26Å; R135-H287 PolarHBondContact NH2-CE1 3.01Å; R135-H287 PolarHBondContact NH2-NE2 2.91Å
136	A	92.6	Very high	92.3	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.008	11%	0.11	C	C	.	.	H	α-helix	trans	-60.2	-47.2	173.6	0	0	0	0	0	111.7	L133 I138 R139 I140 M236 L239 V284 L285	L133-A136 PolarHBondContact O-N 3.34Å; A136-I138 PolarHBondContact O-N 2.91Å; A136-R139 PolarHBondContact O-N 3.2Å; A136-I140 WeakPolarHBondContact O-CG1 3.3Å; A136-I140 PolarHBondContact O-N 3.18Å; A136-M236 HydrophobicContact CB-CE 4.46Å; A136-L239 HydrophobicContact CB-CD1 4.37Å; A136-V284 HydrophobicContact CB-CG1 4.05Å; A136-L285 HydrophobicContact CB-CD2 4.07Å
137	L	94.4	Very high	92.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-55.9	-50.7	175.7	179.4	72.8	0	0	0	111.4	F92 P93 W94 L133 R139 I140 S141 F211 W214 L232 M236	F92-L137 HydrophobicContact CD1-CD2 3.87Å; F92-L137 HydrophobicContact CE1-CD2 4.37Å; P93-L137 HydrophobicContact CG-CD2 4.18Å; W94-L137 HydrophobicContact CH2-CB 4.07Å; W94-L137 HydrophobicContact CH2-CD2 4.02Å; W94-L137 HydrophobicContact CZ3-CB 4.25Å; W94-L137 HydrophobicContact CZ3-CD1 4.44Å; W94-L137 HydrophobicContact CZ3-CD2 3.74Å; W94-L137 HydrophobicContact CZ3-CG 4.36Å; L133-L137 PolarHBondContact O-N 3.15Å; L137-R139 PolarHBondContact O-N 3.22Å; L137-I140 PolarHBondContact O-N 3.27Å; L137-S141 WeakPolarHBondContact O-CB 3.44Å; L137-S141 PolarHBondContact O-N 3.42Å; L137-S141 PolarHBondContact O-OG 3.06Å; L137-F211 HydrophobicContact CD1-CD1 4.45Å; L137-F211 HydrophobicContact CD1-CE1 3.81Å; L137-W214 HydrophobicContact CD1-CH2 4.16Å; L137-W214 HydrophobicContact CD1-CZ3 3.94Å; L137-W214 HydrophobicContact CD2-CD2 4.31Å; L137-W214 HydrophobicContact CD2-CE3 4.23Å; L137-W214 HydrophobicContact CD2-CH2 3.43Å; L137-W214 VanDerWaalsContact CD2-CH2 3.43Å; L137-W214 HydrophobicContact CD2-CZ2 3.47Å; L137-W214 VanDerWaalsContact CD2-CZ2 3.47Å; L137-W214 HydrophobicContact CD2-CZ3 3.81Å; L137-W214 HydrophobicContact CG-CH2 3.55Å; L137-W214 HydrophobicContact CG-CZ2 4.09Å; L137-W214 HydrophobicContact CG-CZ3 3.86Å; L137-L232 HydrophobicContact CD1-CD1 4.04Å; L137-L232 HydrophobicContact CD1-CD2 3.95Å; L137-L232 HydrophobicContact CD1-CG 3.97Å; L137-M236 HydrophobicContact CB-CE 4.14Å; L137-M236 HydrophobicContact CB-SD 4.03Å; L137-M236 HydrophobicContact CD1-CG 3.93Å; L137-M236 HydrophobicContact CD1-SD 4.14Å
138	I	91.4	Very high	91.9	Very high	6 Å²	6	21.9 Å²	21.9	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-63.5	-40.5	-177.4	-70.1	165.6	0	0	0	111.4	L86 P87 L89 F92 R134 R135 A136 S141 R142	L86-I138 HydrophobicContact CD2-CG2 4.29Å; P87-I138 WeakPolarHBondContact O-CD1 3.24Å; L89-I138 HydrophobicContact CD1-CD1 4.05Å; L89-I138 HydrophobicContact CD1-CG1 3.98Å; L89-I138 HydrophobicContact CG-CD1 4.22Å; F92-I138 HydrophobicContact CE1-CD1 4.04Å; F92-I138 HydrophobicContact CE1-CG1 4.36Å; F92-I138 HydrophobicContact CZ-CD1 4.15Å; R134-I138 WeakPolarHBondContact O-CB 3.4Å; R134-I138 WeakPolarHBondContact O-CD1 3.33Å; R134-I138 VanDerWaalsContact O-CG1 3.24Å; R134-I138 WeakPolarHBondContact O-CG1 3.44Å; R134-I138 PolarHBondContact O-N 3Å; R135-I138 PolarHBondContact O-N 3.26Å; A136-I138 PolarHBondContact O-N 2.91Å; I138-S141 PolarHBondContact O-N 3.18Å; I138-R142 WeakPolarHBondContact O-CB 3.24Å; I138-R142 WeakPolarHBondContact O-CG 3.33Å; I138-R142 PolarHBondContact O-N 3.17Å
139	R	91.8	Very high	91.7	Very high	10 Å²	10	20 Å²	20	4%	0.038	10%	0.096	C	C	.	.	H	α-helix	trans	-61.3	-53.3	174.8	-71.2	179.4	-171	-70.3	-2.1	112	L86 R135 A136 L137 S141 R142 E143 V166 V284 Q286 Y288 E289 H290	L86-R139 HydrophobicContact CD1-CG 4.07Å; L86-R139 HydrophobicContact CD2-CG 4.19Å; R135-R139 WeakPolarHBondContact O-CG 3.38Å; R135-R139 PolarHBondContact O-N 2.68Å; A136-R139 PolarHBondContact O-N 3.2Å; L137-R139 PolarHBondContact O-N 3.22Å; R139-S141 PolarHBondContact O-N 3.36Å; R139-R142 PolarHBondContact O-N 3.06Å; R139-E143 PolarHBondContact O-N 2.69Å; R139-E143 VanDerWaalsContact O-N 3.11Å; R139-V166 HydrophobicContact CB-CG1 3.62Å; R139-V166 HydrophobicContact CB-CG2 4.05Å; R139-V166 HydrophobicContact CG-CG1 4.48Å; R139-V284 WeakPolarHBondContact CD-O 3.49Å; R139-V284 PolarHBondContact NE-O 2.75Å; R139-Q286 PolarHBondContact NH2-O 3.34Å; R139-Y288 VanDerWaalsContact CZ-O 3.24Å; R139-Y288 PolarHBondContact NH1-O 3.41Å; R139-Y288 PolarHBondContact NH2-O 2.96Å; R139-E289 PolarHBondContact NH1-O 2.7Å; R139-E289 VanDerWaalsContact NH1-O 3.16Å; R139-H290 PolarHBondContact NH1-O 2.93Å
140	I	94.2	Very high	91.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61	-38.6	-179.8	-63.7	168.8	0	0	0	110.2	A136 L137 A144 V159 A162 M163 V166 L167 L232 L239	A136-I140 WeakPolarHBondContact O-CG1 3.3Å; A136-I140 PolarHBondContact O-N 3.18Å; L137-I140 PolarHBondContact O-N 3.27Å; I140-A144 VanDerWaalsContact O-CB 3.29Å; I140-A144 WeakPolarHBondContact O-CB 3.25Å; I140-A144 PolarHBondContact O-N 3.35Å; I140-V159 HydrophobicContact CG2-CG1 4.41Å; I140-A162 HydrophobicContact CG2-CB 4.09Å; I140-A162 WeakPolarHBondContact O-CB 3.46Å; I140-M163 HydrophobicContact CG2-CG 4.47Å; I140-V166 HydrophobicContact CG1-CB 3.98Å; I140-V166 HydrophobicContact CG1-CG1 3.93Å; I140-V166 HydrophobicContact CG1-CG2 4.29Å; I140-L167 HydrophobicContact CD1-CD1 4.45Å; I140-L167 HydrophobicContact CD1-CD2 4.43Å; I140-L167 HydrophobicContact CD1-CG 4.45Å; I140-L232 HydrophobicContact CB-CD1 4.45Å; I140-L232 HydrophobicContact CG2-CD1 3.78Å; I140-L239 HydrophobicContact CD1-CD1 4.43Å
141	S	93.2	Very high	90.5	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.007	10%	0.104	C	C	.	.	H	α-helix	trans	-68.3	-39.7	178.9	-58.5	0	0	0	0	113	L137 I138 R139 A144 Q145 W214	L137-S141 WeakPolarHBondContact O-CB 3.44Å; L137-S141 PolarHBondContact O-N 3.42Å; L137-S141 PolarHBondContact O-OG 3.06Å; I138-S141 PolarHBondContact O-N 3.18Å; R139-S141 PolarHBondContact O-N 3.36Å; S141-A144 PolarHBondContact O-N 2.68Å; S141-Q145 VanDerWaalsContact O-CB 3.28Å; S141-Q145 WeakPolarHBondContact O-CB 3.34Å; S141-Q145 PolarHBondContact O-N 3.28Å; S141-W214 WeakPolarHBondContact OG-CH2 3.43Å; S141-W214 VanDerWaalsContact OG-CZ3 3.31Å; S141-W214 WeakPolarHBondContact OG-CZ3 3.46Å
142	R	90.4	Very high	90.1	Very high	25 Å²	25	21.2 Å²	21.2	9%	0.094	10%	0.098	C	C	.	.	H	α-helix	trans	-63.4	-43.5	174.4	-86.2	-179.9	155	-155.5	-9.1	112.6	L12 L15 I138 R139 Q145 R146 E289	L12-R142 HydrophobicContact CD1-CG 4.21Å; L12-R142 HydrophobicContact CD2-CG 3.39Å; L12-R142 VanDerWaalsContact CD2-NE 3.31Å; L12-R142 HydrophobicContact CG-CG 4.46Å; L15-R142 PolarHBondContact O-NH2 2.91Å; I138-R142 WeakPolarHBondContact O-CB 3.24Å; I138-R142 WeakPolarHBondContact O-CG 3.33Å; I138-R142 PolarHBondContact O-N 3.17Å; R139-R142 PolarHBondContact O-N 3.06Å; R142-Q145 WeakPolarHBondContact O-CB 3.43Å; R142-Q145 PolarHBondContact O-N 3.32Å; R142-R146 PolarHBondContact O-N 3.26Å; R142-E289 IonicContact CZ-OE1 3.98Å; R142-E289 IonicContact NH1-OE1 2.9Å; R142-E289 PolarHBondContact NH1-OE1 2.71Å; R142-E289 IonicContact NH2-OE1 3.51Å
143	E	92.3	Very high	89.8	Confident	10 Å²	10	21.3 Å²	21.3	5%	0.047	10%	0.097	C	C	.	.	H	α-helix	trans	-70.8	-39.3	177.5	-62.5	-53.3	131.3	0	0	111.3	R139 Q145 R146 L147 A162 L165 V166 R455 L456	R139-E143 PolarHBondContact O-N 2.69Å; R139-E143 VanDerWaalsContact O-N 3.11Å; E143-Q145 VanDerWaalsContact C-N 3.29Å; E143-Q145 PolarHBondContact O-N 3.34Å; E143-R146 PolarHBondContact O-N 3.37Å; E143-L147 WeakPolarHBondContact O-CB 3.24Å; E143-L147 VanDerWaalsContact O-CG 3.27Å; E143-L147 WeakPolarHBondContact O-CG 3.32Å; E143-L147 PolarHBondContact O-N 2.92Å; E143-A162 HydrophobicContact CB-CB 3.84Å; E143-L165 HydrophobicContact CB-CD1 4.26Å; E143-V166 HydrophobicContact CB-CG2 4.3Å; E143-V166 HydrophobicContact CG-CG2 3.73Å; E143-R455 VanDerWaalsContact CD-NH2 3.35Å; E143-R455 IonicContact OE1-CZ 2.69Å; E143-R455 IonicContact OE1-NH1 3.18Å; E143-R455 PolarHBondContact OE1-NH1 3.49Å; E143-R455 IonicContact OE1-NH2 2.74Å; E143-R455 PolarHBondContact OE1-NH2 3.04Å; E143-R455 IonicContact OE2-CZ 3.53Å; E143-R455 IonicContact OE2-NH1 2.84Å; E143-R455 IonicContact OE2-NH2 3.15Å; E143-R455 PolarHBondContact OE2-NH2 3.42Å; E143-L456 HydrophobicContact CG-CD1 4.26Å
144	A	93.6	Very high	89.7	Confident	2 Å²	2	21.2 Å²	21.2	2%	0.017	10%	0.097	C	C	.	.	H	α-helix	trans	-61.4	-37.6	172.1	0	0	0	0	0	112.1	I140 S141 S148 V159 A162 I220	I140-A144 VanDerWaalsContact O-CB 3.29Å; I140-A144 WeakPolarHBondContact O-CB 3.25Å; I140-A144 PolarHBondContact O-N 3.35Å; S141-A144 PolarHBondContact O-N 2.68Å; A144-S148 WeakPolarHBondContact O-CB 3.41Å; A144-S148 PolarHBondContact O-N 3.18Å; A144-V159 HydrophobicContact CB-CG2 4.31Å; A144-A162 HydrophobicContact CB-CB 3.9Å; A144-I220 HydrophobicContact CB-CG2 4.2Å
145	Q	92	Very high	89.5	Confident	27 Å²	27	17 Å²	17	13%	0.126	8%	0.081	C	C	.	.	H	α-helix	trans	-61.8	-54.6	174.8	-178.1	-179	38	0	0	110.9	S141 R142 E143 L147 S148 V149 R219 I220	S141-Q145 VanDerWaalsContact O-CB 3.28Å; S141-Q145 WeakPolarHBondContact O-CB 3.34Å; S141-Q145 PolarHBondContact O-N 3.28Å; R142-Q145 WeakPolarHBondContact O-CB 3.43Å; R142-Q145 PolarHBondContact O-N 3.32Å; E143-Q145 VanDerWaalsContact C-N 3.29Å; E143-Q145 PolarHBondContact O-N 3.34Å; Q145-L147 VanDerWaalsContact C-N 3.33Å; Q145-L147 PolarHBondContact O-N 2.77Å; Q145-S148 PolarHBondContact O-N 2.77Å; Q145-S148 VanDerWaalsContact O-N 3.09Å; Q145-S148 PolarHBondContact O-OG 3.48Å; Q145-V149 PolarHBondContact O-N 2.82Å; Q145-R219 PolarHBondContact NE2-O 3.49Å; Q145-I220 VanDerWaalsContact CA-O 3.29Å; Q145-I220 WeakPolarHBondContact CA-O 3.39Å; Q145-I220 HydrophobicContact CB-CG2 4.17Å; Q145-I220 WeakPolarHBondContact CG-O 3.3Å
146	R	90.2	Very high	89.3	Confident	57 Å²	57	17.2 Å²	17.2	22%	0.215	8%	0.082	C	C	.	.	H	α-helix	trans	-60	-38.8	179.1	-68.9	-175.1	92.8	95.9	-15.2	112.9	R142 E143 D462 C463 P465	R142-R146 PolarHBondContact O-N 3.26Å; E143-R146 PolarHBondContact O-N 3.37Å; R146-D462 IonicContact CZ-OD1 3.7Å; R146-D462 IonicContact NH2-OD1 3.13Å; R146-D462 PolarHBondContact NH2-OD1 3.32Å; R146-C463 PolarHBondContact NH2-O 3.15Å; R146-P465 HydrophobicContact CG-CG 4.37Å
147	L	89.4	Confident	89	Confident	16 Å²	16	19.3 Å²	19.3	8%	0.084	9%	0.091	C	C	.	.	H	α-helix	trans	-66.9	-38.3	174.9	-66.6	177.7	0	0	0	112	E143 Q145 V149 E158 L165	E143-L147 WeakPolarHBondContact O-CB 3.24Å; E143-L147 VanDerWaalsContact O-CG 3.27Å; E143-L147 WeakPolarHBondContact O-CG 3.32Å; E143-L147 PolarHBondContact O-N 2.92Å; Q145-L147 VanDerWaalsContact C-N 3.33Å; Q145-L147 PolarHBondContact O-N 2.77Å; L147-V149 PolarHBondContact O-N 3.44Å; L147-E158 HydrophobicContact CB-CB 4.22Å; L147-E158 HydrophobicContact CB-CG 4.1Å; L147-L165 HydrophobicContact CD1-CD1 3.97Å; L147-L165 HydrophobicContact CG-CD1 4.46Å
148	S	88.8	Confident	88.9	Confident	3 Å²	3	19.4 Å²	19.4	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-65.7	-19	-178.9	84.4	0	0	0	0	114.8	A144 Q145 M150 H151 C152 R153 I220 S221	A144-S148 WeakPolarHBondContact O-CB 3.41Å; A144-S148 PolarHBondContact O-N 3.18Å; Q145-S148 PolarHBondContact O-N 2.77Å; Q145-S148 VanDerWaalsContact O-N 3.09Å; Q145-S148 PolarHBondContact O-OG 3.48Å; S148-M150 VanDerWaalsContact C-N 3.25Å; S148-M150 PolarHBondContact O-N 3.29Å; S148-H151 PolarHBondContact O-N 3.16Å; S148-C152 WeakPolarHBondContact O-CA 3.38Å; S148-C152 PolarHBondContact O-N 3.07Å; S148-R153 WeakPolarHBondContact CB-O 3.43Å; S148-R153 PolarHBondContact O-N 3.12Å; S148-I220 PolarHBondContact OG-O 3.31Å; S148-I220 VanDerWaalsContact OG-O 3.12Å; S148-S221 WeakPolarHBondContact CB-OG 3.31Å; S148-S221 VanDerWaalsContact OG-CB 3.29Å; S148-S221 WeakPolarHBondContact OG-CB 3.43Å; S148-S221 PolarHBondContact OG-OG 3.43Å
149	V	86	Confident	89	Confident	58 Å²	58	19.1 Å²	19.1	35%	0.352	9%	0.09	S	C	.	.	G	3₁₀ helix	trans	-57.2	-38.5	-179.2	178.9	0	0	0	0	111.5	Q145 L147 H151 C152 P465	Q145-V149 PolarHBondContact O-N 2.82Å; L147-V149 PolarHBondContact O-N 3.44Å; V149-H151 PolarHBondContact O-N 3.48Å; V149-H151 VanDerWaalsContact O-N 3.15Å; V149-C152 PolarHBondContact O-N 2.98Å; V149-P465 HydrophobicContact CB-CB 4.14Å; V149-P465 HydrophobicContact CG1-CB 4.23Å; V149-P465 HydrophobicContact CG2-CB 4.11Å; V149-P465 HydrophobicContact CG2-CG 4.31Å
150	M	82.2	Confident	89.1	Confident	28 Å²	28	19.8 Å²	19.8	14%	0.138	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-54.9	-33.3	-178.9	-78.4	-76.6	-65.8	0	0	114.1	S148 R466 L468	S148-M150 VanDerWaalsContact C-N 3.25Å; S148-M150 PolarHBondContact O-N 3.29Å; M150-R466 WeakPolarHBondContact CG-O 3.34Å; M150-R466 HydrophobicContact SD-CB 4.03Å; M150-R466 HydrophobicContact SD-CG 4Å; M150-L468 HydrophobicContact CE-CB 4.33Å; M150-L468 HydrophobicContact CE-CD1 4.04Å
151	H	79	Confident	89	Confident	17 Å²	17	20.4 Å²	20.4	8%	0.079	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-129.3	9.5	-175.2	-56.5	123.4	0	0	0	113	S148 V149 R153 H566 L580	S148-H151 PolarHBondContact O-N 3.16Å; V149-H151 PolarHBondContact O-N 3.48Å; V149-H151 VanDerWaalsContact O-N 3.15Å; H151-R153 PolarHBondContact O-N 2.91Å; H151-H566 AromaticContact CE1-CE1 3.77Å; H151-H566 AromaticContact CE1-CG 3.8Å; H151-H566 AromaticContact CE1-ND1 3.54Å; H151-L580 HydrophobicContact CB-CD2 4.43Å; H151-L580 WeakPolarHBondContact O-CD1 3.47Å; H151-L580 VanDerWaalsContact O-CD2 3.3Å; H151-L580 WeakPolarHBondContact O-CD2 2.99Å; H151-L580 VanDerWaalsContact O-CG 3.32Å; H151-L580 WeakPolarHBondContact O-CG 3.31Å
152	C	83.3	Confident	89.1	Confident	25 Å²	25	20.3 Å²	20.3	17%	0.169	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.9	39.8	-172.6	-62.3	0	0	0	0	113.6	S148 V149 R223 H581	S148-C152 WeakPolarHBondContact O-CA 3.38Å; S148-C152 PolarHBondContact O-N 3.07Å; V149-C152 PolarHBondContact O-N 2.98Å; C152-R223 PolarHBondContact O-NE 3.06Å; C152-R223 PolarHBondContact O-NH2 3.18Å; C152-H581 PolarHBondContact SG-ND1 3.5Å
153	R	84.9	Confident	89.3	Confident	21 Å²	21	19.1 Å²	19.1	8%	0.079	9%	0.093	C	C	.	.			trans	-151.6	133.4	-178.4	-170.9	-173.9	-164.3	154.1	10.7	109.7	S148 H151 T155 S221 R223 D611	S148-R153 WeakPolarHBondContact CB-O 3.43Å; S148-R153 PolarHBondContact O-N 3.12Å; H151-R153 PolarHBondContact O-N 2.91Å; R153-T155 HydrophobicContact CG-CG2 4Å; R153-S221 PolarHBondContact N-OG 2.84Å; R153-R223 CarbonylContact C-O 3.59Å; R153-R223 WeakPolarHBondContact CA-O 3.48Å; R153-R223 HydrophobicContact CG-CB 4.22Å; R153-D611 IonicContact CZ-OD2 3.75Å; R153-D611 IonicContact NH1-OD2 3.4Å; R153-D611 PolarHBondContact NH1-OD2 3.37Å; R153-D611 IonicContact NH2-OD1 3.17Å; R153-D611 IonicContact NH2-OD2 3.81Å; R153-D611 PolarHBondContact NH2-OD2 2.85Å
154	C	89.8	Confident	89.3	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.103	C	C	.	.	B	Isolated β-bridge	trans	-99.6	115	167.9	-170.6	0	0	0	0	109.4	I220 R223 I224 H225 A228	C154-I220 HydrophobicContact CB-CG2 4.41Å; C154-R223 PolarHBondContact N-O 2.93Å; C154-I224 HydrophobicContact CB-CG1 4.13Å; C154-H225 PolarHBondContact O-N 2.87Å; C154-A228 WeakPolarHBondContact O-CB 3.34Å
155	T	87.8	Confident	89.3	Confident	4 Å²	4	21.8 Å²	21.8	3%	0.025	10%	0.102	C	C	.	.			trans	-109.4	-177.4	172.3	82.5	0	0	0	0	110.1	R153 F157 E158 V159 A228	R153-T155 HydrophobicContact CG-CG2 4Å; T155-F157 PolarHBondContact O-N 3.28Å; T155-F157 WeakPolarHBondContact OG1-CD2 3.25Å; T155-F157 PolarHBondContact OG1-N 3.24Å; T155-E158 VanDerWaalsContact CA-OE2 3.3Å; T155-E158 WeakPolarHBondContact CA-OE2 3.5Å; T155-E158 VanDerWaalsContact CB-OE2 3.25Å; T155-E158 WeakPolarHBondContact CB-OE2 3.22Å; T155-E158 PolarHBondContact N-OE2 3.06Å; T155-E158 PolarHBondContact O-N 3.04Å; T155-E158 PolarHBondContact OG1-OE2 3.42Å; T155-V159 PolarHBondContact O-N 3.38Å; T155-A228 VanDerWaalsContact C-CB 3.46Å; T155-A228 WeakPolarHBondContact O-CB 3.28Å
156	R	88.1	Confident	89.3	Confident	50 Å²	50	20.6 Å²	20.6	19%	0.189	10%	0.096	C	C	.	.	H	α-helix	trans	-57.3	-26.1	169	66.1	177.9	-171.7	168.6	-1.4	113.4	Q160 S231	R156-Q160 WeakPolarHBondContact O-CB 3.49Å; R156-Q160 WeakPolarHBondContact O-CG 3.34Å; R156-Q160 PolarHBondContact O-N 3.17Å; R156-S231 WeakPolarHBondContact CB-OG 3.47Å
157	F	87.2	Confident	89.3	Confident	46 Å²	46	17.9 Å²	17.9	20%	0.202	9%	0.086	C	C	.	.	H	α-helix	trans	-72.3	-42.9	-176.3	-62.2	-59.2	0	0	0	111.5	T155 Q160 S161 P567 D568	T155-F157 PolarHBondContact O-N 3.28Å; T155-F157 WeakPolarHBondContact OG1-CD2 3.25Å; T155-F157 PolarHBondContact OG1-N 3.24Å; F157-Q160 PolarHBondContact O-N 3.12Å; F157-S161 WeakPolarHBondContact O-CB 3.41Å; F157-S161 PolarHBondContact O-N 3.09Å; F157-S161 PolarHBondContact O-OG 2.97Å; F157-P567 HydrophobicContact CE2-CB 4.05Å; F157-P567 HydrophobicContact CE2-CG 4.27Å; F157-P567 HydrophobicContact CZ-CB 4.35Å; F157-P567 HydrophobicContact CZ-CG 4.34Å; F157-D568 WeakPolarHBondContact CE2-OD1 3.28Å
158	E	90.9	Very high	89.2	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-63.2	-46.2	175.9	-68	59	-117.5	0	0	110	L147 T155 S161 A162 H439	L147-E158 HydrophobicContact CB-CB 4.22Å; L147-E158 HydrophobicContact CB-CG 4.1Å; T155-E158 VanDerWaalsContact CA-OE2 3.3Å; T155-E158 WeakPolarHBondContact CA-OE2 3.5Å; T155-E158 VanDerWaalsContact CB-OE2 3.25Å; T155-E158 WeakPolarHBondContact CB-OE2 3.22Å; T155-E158 PolarHBondContact N-OE2 3.06Å; T155-E158 PolarHBondContact O-N 3.04Å; T155-E158 PolarHBondContact OG1-OE2 3.42Å; E158-S161 PolarHBondContact O-N 3.36Å; E158-A162 WeakPolarHBondContact O-CB 3.31Å; E158-A162 PolarHBondContact O-N 3.28Å; E158-H439 IonicContact OE1-CE1 2.68Å; E158-H439 PolarHBondContact OE1-CE1 2.87Å
159	V	94.2	Very high	88.9	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-66.7	-43.3	179.1	-170.1	0	0	0	0	111.5	I140 A144 T155 S161 A162 M163 M215 A228 L232	I140-V159 HydrophobicContact CG2-CG1 4.41Å; A144-V159 HydrophobicContact CB-CG2 4.31Å; T155-V159 PolarHBondContact O-N 3.38Å; V159-S161 VanDerWaalsContact C-N 3.33Å; V159-S161 PolarHBondContact O-N 2.95Å; V159-A162 WeakPolarHBondContact O-CB 3.49Å; V159-A162 PolarHBondContact O-N 2.87Å; V159-M163 HydrophobicContact CG1-CE 3.71Å; V159-M163 WeakPolarHBondContact O-CG 3.42Å; V159-M163 PolarHBondContact O-N 2.99Å; V159-M215 HydrophobicContact CG2-CE 4.35Å; V159-A228 HydrophobicContact CG2-CB 3.88Å; V159-L232 HydrophobicContact CG1-CB 4.09Å; V159-L232 HydrophobicContact CG1-CD1 4.07Å
160	Q	92.9	Very high	88.8	Confident	23 Å²	23	20.2 Å²	20.2	11%	0.107	9%	0.094	C	C	.	.	H	α-helix	trans	-69.6	-26	177.1	-74	-177.2	20.8	0	0	113.9	R156 F157 M163 R164 V176 T179	R156-Q160 WeakPolarHBondContact O-CB 3.49Å; R156-Q160 WeakPolarHBondContact O-CG 3.34Å; R156-Q160 PolarHBondContact O-N 3.17Å; F157-Q160 PolarHBondContact O-N 3.12Å; Q160-M163 HydrophobicContact CG-CE 4.29Å; Q160-R164 WeakPolarHBondContact O-CG 3.25Å; Q160-R164 PolarHBondContact O-N 2.87Å; Q160-R164 PolarHBondContact O-NH1 3.37Å; Q160-V176 HydrophobicContact CB-CG2 4.44Å; Q160-V176 HydrophobicContact CG-CG2 4.32Å; Q160-T179 HydrophobicContact CG-CG2 4.3Å; Q160-T179 VanDerWaalsContact NE2-CG2 3.33Å
161	S	92.4	Very high	89.1	Confident	13 Å²	13	19 Å²	19	9%	0.091	9%	0.089	C	C	.	.	H	α-helix	trans	-72.6	-44.9	167.6	-77.8	0	0	0	0	110.4	F157 E158 V159 M163 R164 L165 H439	F157-S161 WeakPolarHBondContact O-CB 3.41Å; F157-S161 PolarHBondContact O-N 3.09Å; F157-S161 PolarHBondContact O-OG 2.97Å; E158-S161 PolarHBondContact O-N 3.36Å; V159-S161 VanDerWaalsContact C-N 3.33Å; V159-S161 PolarHBondContact O-N 2.95Å; S161-M163 VanDerWaalsContact C-N 3.34Å; S161-M163 PolarHBondContact O-N 2.9Å; S161-R164 CarbonylContact O-C 3.44Å; S161-R164 WeakPolarHBondContact O-CA 3.45Å; S161-R164 PolarHBondContact O-N 3.48Å; S161-L165 WeakPolarHBondContact O-CG 3.07Å; S161-L165 PolarHBondContact O-N 3.12Å; S161-H439 WeakPolarHBondContact CB-ND1 3.3Å; S161-H439 WeakPolarHBondContact OG-CB 3.33Å; S161-H439 PolarHBondContact OG-ND1 3.08Å
162	A	95.4	Very high	89.7	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59	-40.2	176.2	0	0	0	0	0	113.3	I140 E143 A144 E158 V159 R164 L165 V166	I140-A162 HydrophobicContact CG2-CB 4.09Å; I140-A162 WeakPolarHBondContact O-CB 3.46Å; E143-A162 HydrophobicContact CB-CB 3.84Å; A144-A162 HydrophobicContact CB-CB 3.9Å; E158-A162 WeakPolarHBondContact O-CB 3.31Å; E158-A162 PolarHBondContact O-N 3.28Å; V159-A162 WeakPolarHBondContact O-CB 3.49Å; V159-A162 PolarHBondContact O-N 2.87Å; A162-R164 VanDerWaalsContact C-N 3.32Å; A162-R164 PolarHBondContact O-N 3.26Å; A162-L165 PolarHBondContact O-N 3.5Å; A162-V166 WeakPolarHBondContact O-CB 3.24Å; A162-V166 WeakPolarHBondContact O-CG2 3.39Å; A162-V166 PolarHBondContact O-N 3.15Å
163	M	94.5	Very high	89.8	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-54.2	-48.2	169.7	-69.2	176.1	-150.9	0	0	111.4	I140 V159 Q160 S161 L165 V166 L167 C175 V176 S231 C235	I140-M163 HydrophobicContact CG2-CG 4.47Å; V159-M163 HydrophobicContact CG1-CE 3.71Å; V159-M163 WeakPolarHBondContact O-CG 3.42Å; V159-M163 PolarHBondContact O-N 2.99Å; Q160-M163 HydrophobicContact CG-CE 4.29Å; S161-M163 VanDerWaalsContact C-N 3.34Å; S161-M163 PolarHBondContact O-N 2.9Å; M163-L165 VanDerWaalsContact C-N 3.34Å; M163-L165 PolarHBondContact O-N 2.92Å; M163-V166 PolarHBondContact O-N 2.83Å; M163-L167 HydrophobicContact CB-CD1 4.43Å; M163-L167 VanDerWaalsContact O-CB 3.25Å; M163-L167 WeakPolarHBondContact O-CB 3.45Å; M163-L167 WeakPolarHBondContact O-CG 3.14Å; M163-L167 PolarHBondContact O-N 3.34Å; M163-C175 HydrophobicContact SD-CB 3.99Å; M163-V176 HydrophobicContact SD-CG2 4.07Å; M163-S231 VanDerWaalsContact CE-O 3.23Å; M163-S231 WeakPolarHBondContact CE-O 3.5Å; M163-C235 HydrophobicContact CE-CB 3.61Å; M163-C235 HydrophobicContact CG-CB 4.28Å; M163-C235 HydrophobicContact SD-CB 3.85Å
164	R	92.5	Very high	90	Very high	67 Å²	67	22 Å²	22	25%	0.253	10%	0.103	S	C	.	.	H	α-helix	trans	-72.7	-20.8	-179.7	-71.9	-177.9	-176.8	90.1	-9.8	114.3	Q160 S161 A162 A172 R431 V435	Q160-R164 WeakPolarHBondContact O-CG 3.25Å; Q160-R164 PolarHBondContact O-N 2.87Å; Q160-R164 PolarHBondContact O-NH1 3.37Å; S161-R164 CarbonylContact O-C 3.44Å; S161-R164 WeakPolarHBondContact O-CA 3.45Å; S161-R164 PolarHBondContact O-N 3.48Å; A162-R164 VanDerWaalsContact C-N 3.32Å; A162-R164 PolarHBondContact O-N 3.26Å; R164-A172 HydrophobicContact CG-CB 3.98Å; R164-R431 PolarHBondContact O-NH1 2.91Å; R164-V435 HydrophobicContact CB-CB 4.44Å; R164-V435 HydrophobicContact CB-CG1 3.71Å; R164-V435 HydrophobicContact CB-CG2 3.78Å
165	L	93	Very high	90.2	Very high	1 Å²	1	22 Å²	22	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-78.3	-43.6	171.8	-67.5	172	0	0	0	111.1	E143 L147 S161 A162 M163 L291 R431 V432 V435 L456	E143-L165 HydrophobicContact CB-CD1 4.26Å; L147-L165 HydrophobicContact CD1-CD1 3.97Å; L147-L165 HydrophobicContact CG-CD1 4.46Å; S161-L165 WeakPolarHBondContact O-CG 3.07Å; S161-L165 PolarHBondContact O-N 3.12Å; A162-L165 PolarHBondContact O-N 3.5Å; M163-L165 VanDerWaalsContact C-N 3.34Å; M163-L165 PolarHBondContact O-N 2.92Å; L165-L291 WeakPolarHBondContact O-CD2 3.49Å; L165-R431 VanDerWaalsContact C-NH1 3.34Å; L165-R431 PolarHBondContact O-NH1 3.46Å; L165-V432 HydrophobicContact CD2-CB 4.49Å; L165-V432 HydrophobicContact CD2-CG1 3.76Å; L165-V435 HydrophobicContact CD2-CB 3.88Å; L165-V435 HydrophobicContact CD2-CG1 3.61Å; L165-V435 HydrophobicContact CG-CG1 3.75Å; L165-L456 HydrophobicContact CB-CD2 4.04Å
166	V	93.1	Very high	90.4	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.006	11%	0.107	C	C	.	.	H	α-helix	trans	-87.2	-38.6	-172.2	173.9	0	0	0	0	113.9	R139 I140 E143 A162 M163 V284 L291	R139-V166 HydrophobicContact CB-CG1 3.62Å; R139-V166 HydrophobicContact CB-CG2 4.05Å; R139-V166 HydrophobicContact CG-CG1 4.48Å; I140-V166 HydrophobicContact CG1-CB 3.98Å; I140-V166 HydrophobicContact CG1-CG1 3.93Å; I140-V166 HydrophobicContact CG1-CG2 4.29Å; E143-V166 HydrophobicContact CB-CG2 4.3Å; E143-V166 HydrophobicContact CG-CG2 3.73Å; A162-V166 WeakPolarHBondContact O-CB 3.24Å; A162-V166 WeakPolarHBondContact O-CG2 3.39Å; A162-V166 PolarHBondContact O-N 3.15Å; M163-V166 PolarHBondContact O-N 2.83Å; V166-V284 HydrophobicContact CG1-CG1 4.12Å; V166-L291 HydrophobicContact CG1-CD1 4.16Å
167	L	90.9	Very high	90.5	Very high	1 Å²	1	24 Å²	24	1%	0.005	13%	0.125	C	C	.	.	S	Bend	trans	-92	160	-174.1	-57	176.7	0	0	0	112	I140 M163 L171 A172 C175 L239 V284 R431	I140-L167 HydrophobicContact CD1-CD1 4.45Å; I140-L167 HydrophobicContact CD1-CD2 4.43Å; I140-L167 HydrophobicContact CD1-CG 4.45Å; M163-L167 HydrophobicContact CB-CD1 4.43Å; M163-L167 VanDerWaalsContact O-CB 3.25Å; M163-L167 WeakPolarHBondContact O-CB 3.45Å; M163-L167 WeakPolarHBondContact O-CG 3.14Å; M163-L167 PolarHBondContact O-N 3.34Å; L167-L171 HydrophobicContact CB-CB 4.01Å; L167-L171 HydrophobicContact CD1-CB 4.38Å; L167-A172 HydrophobicContact CB-CB 4.25Å; L167-C175 HydrophobicContact CD1-CB 4.28Å; L167-L239 HydrophobicContact CD1-CD2 4.32Å; L167-L239 HydrophobicContact CD2-CD1 4.32Å; L167-L239 HydrophobicContact CD2-CD2 4.2Å; L167-V284 HydrophobicContact CD2-CG1 4.02Å; L167-V284 HydrophobicContact CD2-CG2 4.4Å; L167-R431 PolarHBondContact O-NH1 3.01Å
168	S	86.8	Confident	90.7	Very high	8 Å²	8	23 Å²	23	6%	0.056	12%	0.124	C	C	.	.			trans	-57.7	155.6	164.2	82.6	0	0	0	0	110	A170 L171 A172 E280	S168-A170 PolarHBondContact O-N 3.31Å; S168-L171 PolarHBondContact O-N 3.2Å; S168-L171 WeakPolarHBondContact OG-CG 3.42Å; S168-L171 PolarHBondContact OG-N 3.4Å; S168-A172 VanDerWaalsContact O-CB 3.3Å; S168-A172 WeakPolarHBondContact O-CB 3.5Å; S168-A172 PolarHBondContact O-N 2.92Å; S168-E280 VanDerWaalsContact OG-CD 3.3Å; S168-E280 PolarHBondContact OG-OE1 3.01Å
169	W	82.9	Confident	90.8	Very high	89 Å²	89	22.9 Å²	22.9	34%	0.337	12%	0.124	S	C	.	.	H	α-helix	trans	-57.5	-36.7	179.1	-178	-50.6	0	0	0	112	A172 D173 H306 M358	W169-A172 PolarHBondContact O-N 2.84Å; W169-D173 PolarHBondContact NE1-OD2 3.42Å; W169-D173 PolarHBondContact O-N 3.19Å; W169-H306 AromaticContact CD1-CE1 3.97Å; W169-H306 AromaticContact CD1-NE2 3.79Å; W169-H306 AromaticContact CG-CE1 3.95Å; W169-H306 AromaticContact CG-NE2 3.62Å; W169-M358 HydrophobicContact CE3-CE 4.34Å; W169-M358 HydrophobicContact CH2-CE 4.19Å; W169-M358 HydrophobicContact CZ3-CE 3.57Å
170	A	83.1	Confident	90.6	Very high	28 Å²	28	26.8 Å²	26.8	23%	0.231	15%	0.147	C	C	.	.	H	α-helix	trans	-64.3	-51.2	178	0	0	0	0	0	111.9	S168 A172 D173 H174 E280 H306	S168-A170 PolarHBondContact O-N 3.31Å; A170-A172 VanDerWaalsContact C-N 3.28Å; A170-A172 PolarHBondContact O-N 3.09Å; A170-D173 PolarHBondContact O-N 3.07Å; A170-H174 WeakPolarHBondContact O-CB 3.48Å; A170-H174 PolarHBondContact O-N 3.39Å; A170-E280 WeakPolarHBondContact CB-OE1 3.33Å; A170-H306 PolarHBondContact N-CE1 3.09Å
171	L	88.8	Confident	90.6	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.016	17%	0.171	C	C	.	.	H	α-helix	trans	-63.8	-35.6	178.5	-66.1	175.2	0	0	0	111.3	L167 S168 C175 E242 E280 L281	L167-L171 HydrophobicContact CB-CB 4.01Å; L167-L171 HydrophobicContact CD1-CB 4.38Å; S168-L171 PolarHBondContact O-N 3.2Å; S168-L171 WeakPolarHBondContact OG-CG 3.42Å; S168-L171 PolarHBondContact OG-N 3.4Å; L171-C175 WeakPolarHBondContact O-CB 3.44Å; L171-C175 PolarHBondContact O-N 3.02Å; L171-C175 PolarHBondContact O-SG 3.47Å; L171-E242 HydrophobicContact CD2-CG 3.67Å; L171-E280 HydrophobicContact CD1-CB 3.85Å; L171-E280 HydrophobicContact CG-CB 4.44Å; L171-L281 HydrophobicContact CD1-CD2 3.91Å; L171-L281 HydrophobicContact CD2-CD2 4.47Å
172	A	90.4	Very high	90.6	Very high	3 Å²	3	31.8 Å²	31.8	3%	0.025	17%	0.168	C	C	.	.	H	α-helix	trans	-69.1	-47.9	176.5	0	0	0	0	0	112.9	R164 L167 S168 W169 A170 H174 C175 V176	R164-A172 HydrophobicContact CG-CB 3.98Å; L167-A172 HydrophobicContact CB-CB 4.25Å; S168-A172 VanDerWaalsContact O-CB 3.3Å; S168-A172 WeakPolarHBondContact O-CB 3.5Å; S168-A172 PolarHBondContact O-N 2.92Å; W169-A172 PolarHBondContact O-N 2.84Å; A170-A172 VanDerWaalsContact C-N 3.28Å; A170-A172 PolarHBondContact O-N 3.09Å; A172-H174 VanDerWaalsContact C-N 3.26Å; A172-H174 PolarHBondContact O-N 3.2Å; A172-C175 PolarHBondContact O-N 3.15Å; A172-V176 WeakPolarHBondContact O-CB 3.36Å; A172-V176 VanDerWaalsContact O-CG2 3.24Å; A172-V176 WeakPolarHBondContact O-CG2 3.41Å; A172-V176 PolarHBondContact O-N 2.84Å
173	D	86.9	Confident	90.3	Very high	54 Å²	54	32.3 Å²	32.3	29%	0.289	17%	0.17	S	C	.	.	H	α-helix	trans	-58.9	-39.6	175.2	-100.5	3.2	0	0	0	110.3	W169 A170 S177 R365	W169-D173 PolarHBondContact NE1-OD2 3.42Å; W169-D173 PolarHBondContact O-N 3.19Å; A170-D173 PolarHBondContact O-N 3.07Å; D173-S177 WeakPolarHBondContact O-CB 3.45Å; D173-S177 PolarHBondContact O-N 3.36Å; D173-R365 IonicContact OD2-CZ 3.11Å; D173-R365 IonicContact OD2-NH1 2.8Å; D173-R365 PolarHBondContact OD2-NH1 3.44Å; D173-R365 IonicContact OD2-NH2 2.78Å; D173-R365 PolarHBondContact OD2-NH2 2.86Å
174	H	89.3	Confident	90	Very high	69 Å²	69	35.2 Å²	35.2	32%	0.319	19%	0.19	S	C	.	.	H	α-helix	trans	-64.7	-52.7	174.9	-176.9	99.4	0	0	0	112.6	A170 A172 V176 S177 A178	A170-H174 WeakPolarHBondContact O-CB 3.48Å; A170-H174 PolarHBondContact O-N 3.39Å; A172-H174 VanDerWaalsContact C-N 3.26Å; A172-H174 PolarHBondContact O-N 3.2Å; H174-V176 VanDerWaalsContact C-N 3.32Å; H174-V176 PolarHBondContact O-N 3.16Å; H174-S177 WeakPolarHBondContact O-CB 3.34Å; H174-S177 PolarHBondContact O-N 3.16Å; H174-S177 VanDerWaalsContact O-N 3.12Å; H174-A178 PolarHBondContact O-N 2.82Å
175	C	93.6	Very high	89.8	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-63.4	-35	-179.3	-69.5	0	0	0	0	113	M163 L167 L171 A172 T179 C235	M163-C175 HydrophobicContact SD-CB 3.99Å; L167-C175 HydrophobicContact CD1-CB 4.28Å; L171-C175 WeakPolarHBondContact O-CB 3.44Å; L171-C175 PolarHBondContact O-N 3.02Å; L171-C175 PolarHBondContact O-SG 3.47Å; A172-C175 PolarHBondContact O-N 3.15Å; C175-T179 WeakPolarHBondContact O-CB 3.34Å; C175-T179 PolarHBondContact O-N 2.91Å; C175-T179 PolarHBondContact O-OG1 2.85Å; C175-C235 HydrophobicContact CB-CB 4.11Å; C175-C235 VanDerWaalsContact SG-SG 3.68Å
176	V	90.6	Very high	89.5	Confident	15 Å²	15	35.5 Å²	35.5	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-69.8	-38.5	173.8	172.1	0	0	0	0	111	Q160 M163 A172 H174 T179 V180	Q160-V176 HydrophobicContact CB-CG2 4.44Å; Q160-V176 HydrophobicContact CG-CG2 4.32Å; M163-V176 HydrophobicContact SD-CG2 4.07Å; A172-V176 WeakPolarHBondContact O-CB 3.36Å; A172-V176 VanDerWaalsContact O-CG2 3.24Å; A172-V176 WeakPolarHBondContact O-CG2 3.41Å; A172-V176 PolarHBondContact O-N 2.84Å; H174-V176 VanDerWaalsContact C-N 3.32Å; H174-V176 PolarHBondContact O-N 3.16Å; V176-T179 WeakPolarHBondContact O-CB 3.49Å; V176-T179 PolarHBondContact O-N 3.13Å; V176-V180 WeakPolarHBondContact O-CG2 3.45Å; V176-V180 PolarHBondContact O-N 3.46Å
177	S	90.3	Very high	89	Confident	81 Å²	81	37.1 Å²	37.1	57%	0.566	21%	0.206	S	C	*	.	H	α-helix	trans	-61.5	-47.4	173.8	-171.4	0	0	0	0	111.7	D173 H174 T179 V180 K181	D173-S177 WeakPolarHBondContact O-CB 3.45Å; D173-S177 PolarHBondContact O-N 3.36Å; H174-S177 WeakPolarHBondContact O-CB 3.34Å; H174-S177 PolarHBondContact O-N 3.16Å; H174-S177 VanDerWaalsContact O-N 3.12Å; S177-T179 VanDerWaalsContact C-N 3.32Å; S177-T179 PolarHBondContact O-N 2.63Å; S177-V180 PolarHBondContact O-N 3.13Å; S177-K181 WeakPolarHBondContact O-CB 3.45Å; S177-K181 PolarHBondContact O-N 3.21Å
178	A	92.9	Very high	88.6	Confident	23 Å²	23	44.6 Å²	44.6	19%	0.19	24%	0.243	C	C	.	.	H	α-helix	trans	-59.1	-41.6	173.9	0	0	0	0	0	112.3	H174 K181 A182 A238	H174-A178 PolarHBondContact O-N 2.82Å; A178-K181 WeakPolarHBondContact O-CB 3.27Å; A178-K181 PolarHBondContact O-N 3.37Å; A178-A182 WeakPolarHBondContact O-CB 3.38Å; A178-A182 PolarHBondContact O-N 3.35Å; A178-A238 HydrophobicContact CB-CB 3.75Å
179	T	92.6	Very high	88	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-47.5	174	-66.3	0	0	0	0	112.5	Q160 C175 V176 S177 K181 A182 I183 S231	Q160-T179 HydrophobicContact CG-CG2 4.3Å; Q160-T179 VanDerWaalsContact NE2-CG2 3.33Å; C175-T179 WeakPolarHBondContact O-CB 3.34Å; C175-T179 PolarHBondContact O-N 2.91Å; C175-T179 PolarHBondContact O-OG1 2.85Å; V176-T179 WeakPolarHBondContact O-CB 3.49Å; V176-T179 PolarHBondContact O-N 3.13Å; S177-T179 VanDerWaalsContact C-N 3.32Å; S177-T179 PolarHBondContact O-N 2.63Å; T179-K181 VanDerWaalsContact C-N 3.33Å; T179-K181 PolarHBondContact O-N 2.76Å; T179-A182 PolarHBondContact O-N 3.22Å; T179-I183 HydrophobicContact CG2-CD1 3.85Å; T179-I183 WeakPolarHBondContact O-CG1 2.95Å; T179-I183 PolarHBondContact O-N 3.34Å; T179-S231 WeakPolarHBondContact CG2-OG 3.37Å; T179-S231 PolarHBondContact OG1-O 2.89Å
180	V	90.6	Very high	87	Confident	82 Å²	82	43.6 Å²	43.6	50%	0.497	25%	0.253	S	S	.	.	H	α-helix	trans	-64.4	-39.5	178.7	170.8	0	0	0	0	111	V176 S177 S184	V176-V180 WeakPolarHBondContact O-CG2 3.45Å; V176-V180 PolarHBondContact O-N 3.46Å; S177-V180 PolarHBondContact O-N 3.13Å; V180-S184 WeakPolarHBondContact O-CB 3.31Å; V180-S184 PolarHBondContact O-N 3.1Å
181	K	92	Very high	85.8	Confident	140 Å²	140	46 Å²	46	61%	0.609	28%	0.281	S	S	*	.	H	α-helix	trans	-60.2	-48.6	173.8	-175	-163.3	171.6	-169	0	111.6	S177 A178 T179 S184 M185	S177-K181 WeakPolarHBondContact O-CB 3.45Å; S177-K181 PolarHBondContact O-N 3.21Å; A178-K181 WeakPolarHBondContact O-CB 3.27Å; A178-K181 PolarHBondContact O-N 3.37Å; T179-K181 VanDerWaalsContact C-N 3.33Å; T179-K181 PolarHBondContact O-N 2.76Å; K181-S184 PolarHBondContact O-N 2.9Å; K181-M185 HydrophobicContact CG-CE 4.17Å; K181-M185 PolarHBondContact O-N 3.33Å; K181-M185 VanDerWaalsContact O-N 3.14Å
182	A	92.4	Very high	84.5	Confident	2 Å²	2	49.2 Å²	49.2	2%	0.017	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-44.7	180	0	0	0	0	0	112.8	A178 T179 S184 M185 Y186 C202 L204 I230 A234	A178-A182 WeakPolarHBondContact O-CB 3.38Å; A178-A182 PolarHBondContact O-N 3.35Å; T179-A182 PolarHBondContact O-N 3.22Å; A182-S184 VanDerWaalsContact C-N 3.35Å; A182-M185 PolarHBondContact O-N 3.33Å; A182-Y186 PolarHBondContact O-N 3.2Å; A182-Y186 VanDerWaalsContact O-N 3.1Å; A182-C202 HydrophobicContact CB-CB 4.43Å; A182-L204 HydrophobicContact CB-CD1 4.39Å; A182-L204 HydrophobicContact CB-CD2 4.39Å; A182-L204 HydrophobicContact CB-CG 4.46Å; A182-I230 HydrophobicContact CB-CG2 4.06Å; A182-A234 HydrophobicContact CB-CB 3.91Å
183	I	88.8	Confident	83.1	Confident	10 Å²	10	52.3 Å²	52.3	5%	0.051	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-40.4	175.3	-66.1	171.5	0	0	0	110.7	T179 M185 Y186 C187 Y227 I230	T179-I183 HydrophobicContact CG2-CD1 3.85Å; T179-I183 WeakPolarHBondContact O-CG1 2.95Å; T179-I183 PolarHBondContact O-N 3.34Å; I183-M185 VanDerWaalsContact C-N 3.34Å; I183-M185 PolarHBondContact O-N 2.87Å; I183-Y186 WeakPolarHBondContact O-CB 3.19Å; I183-Y186 PolarHBondContact O-N 3.49Å; I183-C187 PolarHBondContact O-N 2.89Å; I183-C187 PolarHBondContact O-SG 3.14Å; I183-Y227 HydrophobicContact CD1-CD1 4.45Å; I183-Y227 HydrophobicContact CG1-CD1 4.23Å; I183-Y227 HydrophobicContact CG2-CD1 4.04Å; I183-Y227 HydrophobicContact CG2-CE1 4.01Å; I183-I230 HydrophobicContact CG1-CG2 3.77Å
184	S	89.2	Confident	82.2	Confident	61 Å²	61	50.6 Å²	50.6	43%	0.427	30%	0.302	S	S	.	.	H	α-helix	trans	-60.6	-41	177.8	-166.4	0	0	0	0	112.5	V180 K181 A182 C187 M188	V180-S184 WeakPolarHBondContact O-CB 3.31Å; V180-S184 PolarHBondContact O-N 3.1Å; K181-S184 PolarHBondContact O-N 2.9Å; A182-S184 VanDerWaalsContact C-N 3.35Å; S184-C187 PolarHBondContact O-N 2.91Å; S184-M188 WeakPolarHBondContact O-CB 3.46Å; S184-M188 VanDerWaalsContact O-CG 3.26Å; S184-M188 WeakPolarHBondContact O-CG 3.32Å; S184-M188 PolarHBondContact O-N 2.9Å
185	M	88.4	Confident	81.3	Confident	67 Å²	67	56.5 Å²	56.5	33%	0.33	32%	0.322	S	S	.	.	H	α-helix	trans	-69.5	-35.3	176.4	-65	-175.6	-65.5	0	0	112.2	K181 A182 I183 M188 S189 R201 C202	K181-M185 HydrophobicContact CG-CE 4.17Å; K181-M185 PolarHBondContact O-N 3.33Å; K181-M185 VanDerWaalsContact O-N 3.14Å; A182-M185 PolarHBondContact O-N 3.33Å; I183-M185 VanDerWaalsContact C-N 3.34Å; I183-M185 PolarHBondContact O-N 2.87Å; M185-M188 PolarHBondContact O-N 3.41Å; M185-S189 WeakPolarHBondContact O-CB 3.47Å; M185-S189 PolarHBondContact O-N 3.36Å; M185-S189 VanDerWaalsContact O-N 3.08Å; M185-S189 PolarHBondContact O-OG 3.45Å; M185-R201 CarbonylContact C-O 3.54Å; M185-R201 WeakPolarHBondContact CB-O 3.34Å; M185-C202 WeakPolarHBondContact CE-O 3.34Å
186	Y	86.9	Confident	80.5	Confident	8 Å²	8	60.3 Å²	60.3	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-62.3	-44.7	173.2	-172.3	-100.8	0	0	0	112.4	A182 I183 S189 K198 R201 E226 Y227 I230 E652	A182-Y186 PolarHBondContact O-N 3.2Å; A182-Y186 VanDerWaalsContact O-N 3.1Å; I183-Y186 WeakPolarHBondContact O-CB 3.19Å; I183-Y186 PolarHBondContact O-N 3.49Å; Y186-S189 PolarHBondContact O-N 3.44Å; Y186-S189 PolarHBondContact O-OG 2.55Å; Y186-K198 HydrophobicContact CE2-CB 4.32Å; Y186-K198 HydrophobicContact CE2-CG 4.25Å; Y186-R201 HydrophobicContact CD2-CB 4Å; Y186-R201 PolarHBondContact N-O 3.04Å; Y186-R201 PolarHBondContact O-NH2 2.93Å; Y186-R201 PolarHBondContact OH-NH1 3.3Å; Y186-E226 PolarHBondContact OH-OE2 2.67Å; Y186-Y227 AromaticContact CD1-CE1 3.94Å; Y186-Y227 HydrophobicContact CD1-CE1 3.94Å; Y186-Y227 HydrophobicContact CE1-CE1 4.24Å; Y186-I230 HydrophobicContact CD1-CD1 4.22Å; Y186-I230 HydrophobicContact CD2-CD1 4.1Å; Y186-I230 HydrophobicContact CE1-CD1 4.44Å; Y186-I230 HydrophobicContact CE2-CD1 4.35Å; Y186-I230 HydrophobicContact CG-CD1 4.03Å; Y186-E652 PolarHBondContact OH-OE1 3.41Å
187	C	82.7	Confident	80.1	Confident	35 Å²	35	59.9 Å²	59.9	24%	0.236	34%	0.336	C	S	.	.	H	α-helix	trans	-67.4	-39.2	176.6	-60.1	0	0	0	0	112	I183 S184 S189 A190	I183-C187 PolarHBondContact O-N 2.89Å; I183-C187 PolarHBondContact O-SG 3.14Å; S184-C187 PolarHBondContact O-N 2.91Å; C187-S189 PolarHBondContact O-N 3.44Å; C187-A190 WeakPolarHBondContact O-CB 3.3Å; C187-A190 PolarHBondContact O-N 2.95Å
188	M	81.2	Confident	80	Confident	157 Å²	157	56 Å²	56	77%	0.773	31%	0.31	S	S	*	.	H	α-helix	trans	-66.8	-22.5	176.5	-73.2	175	68.2	0	0	113.7	S184 M185	S184-M188 WeakPolarHBondContact O-CB 3.46Å; S184-M188 VanDerWaalsContact O-CG 3.26Å; S184-M188 WeakPolarHBondContact O-CG 3.32Å; S184-M188 PolarHBondContact O-N 2.9Å; M185-M188 PolarHBondContact O-N 3.41Å
189	S	75.4	Confident	79.8	Confident	15 Å²	15	56 Å²	56	11%	0.105	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	19.6	178.7	55.5	0	0	0	0	113.8	M185 Y186 C187 G191 E192 R201	M185-S189 WeakPolarHBondContact O-CB 3.47Å; M185-S189 PolarHBondContact O-N 3.36Å; M185-S189 VanDerWaalsContact O-N 3.08Å; M185-S189 PolarHBondContact O-OG 3.45Å; Y186-S189 PolarHBondContact O-N 3.44Å; Y186-S189 PolarHBondContact O-OG 2.55Å; C187-S189 PolarHBondContact O-N 3.44Å; S189-G191 PolarHBondContact O-N 3.44Å; S189-E192 PolarHBondContact O-N 3.17Å; S189-R201 PolarHBondContact O-NE 3.4Å; S189-R201 WeakPolarHBondContact OG-CB 3.21Å; S189-R201 WeakPolarHBondContact OG-CG 3.43Å; S189-R201 PolarHBondContact OG-NE 3Å; S189-R201 VanDerWaalsContact OG-NE 3.08Å
190	A	60.9	Low	79.6	Confident	62 Å²	62	58.9 Å²	58.9	51%	0.512	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-56.6	-33.3	-179.5	0	0	0	0	0	113.9	C187 E192 L193	C187-A190 WeakPolarHBondContact O-CB 3.3Å; C187-A190 PolarHBondContact O-N 2.95Å; A190-E192 PolarHBondContact O-N 3.22Å; A190-L193 WeakPolarHBondContact O-CB 3.43Å; A190-L193 PolarHBondContact O-N 2.99Å
191	G	57.8	Low	79.4	Confident	78 Å²	78	55.6 Å²	55.6	80%	0.804	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-69	-7.5	175.3	0	0	0	0	0	115.3	S189	S189-G191 PolarHBondContact O-N 3.44Å
192	E	61.4	Low	79.2	Confident	71 Å²	71	49 Å²	49	33%	0.332	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-103.8	15.1	177.7	-54.3	-167.5	130.3	0	0	112.9	S189 A190 L194 R195 K196	S189-E192 PolarHBondContact O-N 3.17Å; A190-E192 PolarHBondContact O-N 3.22Å; E192-L194 PolarHBondContact O-N 3.25Å; E192-R195 PolarHBondContact O-N 3.02Å; E192-K196 WeakPolarHBondContact OE1-CE 3.5Å; E192-K196 IonicContact OE1-NZ 2.89Å; E192-K196 PolarHBondContact OE1-NZ 3.17Å; E192-K196 WeakPolarHBondContact OE2-CD 3.49Å; E192-K196 WeakPolarHBondContact OE2-CE 3.49Å; E192-K196 IonicContact OE2-NZ 2.76Å; E192-K196 PolarHBondContact OE2-NZ 3.18Å
193	L	61	Low	79.1	Confident	67 Å²	67	51 Å²	51	35%	0.351	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	135.6	176.6	-164.6	69.2	0	0	0	110.7	A190 R195	A190-L193 WeakPolarHBondContact O-CB 3.43Å; A190-L193 PolarHBondContact O-N 2.99Å; L193-R195 PolarHBondContact O-N 3.4Å; L193-R195 VanDerWaalsContact O-N 3.16Å
194	L	67.5	Low	79.3	Confident	18 Å²	18	52 Å²	52	9%	0.094	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	-1.2	-176.1	-36.1	176.9	0	0	0	116.1	E192 Q732 Y736 K758	E192-L194 PolarHBondContact O-N 3.25Å; L194-Q732 HydrophobicContact CD1-CB 4.4Å; L194-Y736 VanDerWaalsContact CD2-CB 3.43Å; L194-Y736 HydrophobicContact CD2-CD1 3.87Å; L194-Y736 HydrophobicContact CD2-CD2 4.14Å; L194-Y736 HydrophobicContact CD2-CG 3.57Å; L194-K758 HydrophobicContact CB-CD 3.96Å; L194-K758 HydrophobicContact CD1-CD 4.38Å; L194-K758 VanDerWaalsContact CD1-NZ 3.26Å
195	R	70.3	Confident	79.4	Confident	194 Å²	194	49.6 Å²	49.6	73%	0.732	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-18.9	178.9	-81.2	-176.4	166.8	170.1	-3.7	115.5	E192 L193	E192-R195 PolarHBondContact O-N 3.02Å; L193-R195 PolarHBondContact O-N 3.4Å; L193-R195 VanDerWaalsContact O-N 3.16Å
196	K	77.3	Confident	79.6	Confident	81 Å²	81	46.4 Å²	46.4	35%	0.352	28%	0.276	S	S	.	.	S	Bend	trans	-143.1	155.5	177.1	-64.2	-176.7	-167.5	160.5	0	111.4	E192 R201 Y736	E192-K196 WeakPolarHBondContact OE1-CE 3.5Å; E192-K196 IonicContact OE1-NZ 2.89Å; E192-K196 PolarHBondContact OE1-NZ 3.17Å; E192-K196 WeakPolarHBondContact OE2-CD 3.49Å; E192-K196 WeakPolarHBondContact OE2-CE 3.49Å; E192-K196 IonicContact OE2-NZ 2.76Å; E192-K196 PolarHBondContact OE2-NZ 3.18Å; K196-R201 HydrophobicContact CB-CG 4.37Å; K196-Y736 PolarHBondContact O-OH 3.49Å
197	G	83.2	Confident	79.9	Confident	5 Å²	5	47.1 Å²	47.1	5%	0.052	28%	0.282	C	S	.	.			trans	-64.2	149.6	173.1	0	0	0	0	0	114	S199 A200 R201 E740 H760 E796	G197-S199 VanDerWaalsContact C-N 3.27Å; G197-S199 PolarHBondContact O-N 3.24Å; G197-A200 PolarHBondContact O-N 3.06Å; G197-A200 VanDerWaalsContact O-N 3.17Å; G197-R201 PolarHBondContact O-N 3.27Å; G197-E740 WeakPolarHBondContact CA-OE1 3.33Å; G197-H760 WeakPolarHBondContact CA-CE1 3.42Å; G197-H760 PolarHBondContact N-CE1 3.48Å; G197-H760 PolarHBondContact N-ND1 3Å; G197-E796 PolarHBondContact N-OE1 3.47Å
198	K	86.8	Confident	80.4	Confident	1 Å²	1	45.5 Å²	45.5	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-58.1	-41.6	-180	-62.3	178.1	-177	-169.9	0	111.6	Y186 A200 R201 C202 V208 E226 Y736 E740 H741	Y186-K198 HydrophobicContact CE2-CB 4.32Å; Y186-K198 HydrophobicContact CE2-CG 4.25Å; K198-A200 VanDerWaalsContact C-N 3.32Å; K198-A200 PolarHBondContact O-N 2.97Å; K198-R201 CarbonylContact O-C 3.57Å; K198-R201 WeakPolarHBondContact O-CB 3.18Å; K198-R201 PolarHBondContact O-N 3.42Å; K198-C202 WeakPolarHBondContact O-CB 3.29Å; K198-C202 PolarHBondContact O-N 3.41Å; K198-C202 PolarHBondContact O-SG 3.11Å; K198-C202 VanDerWaalsContact O-SG 3.33Å; K198-V208 HydrophobicContact CB-CB 4.15Å; K198-V208 HydrophobicContact CB-CG1 4.24Å; K198-V208 HydrophobicContact CD-CG1 4.43Å; K198-E226 WeakPolarHBondContact CE-OE2 3.22Å; K198-E226 IonicContact NZ-OE1 3.16Å; K198-E226 PolarHBondContact NZ-OE1 2.62Å; K198-E226 IonicContact NZ-OE2 3.22Å; K198-E226 PolarHBondContact NZ-OE2 3.36Å; K198-Y736 HydrophobicContact CG-CE1 4.39Å; K198-E740 HydrophobicContact CD-CB 4.38Å; K198-E740 HydrophobicContact CD-CG 4.07Å; K198-E740 WeakPolarHBondContact CD-OE2 3.19Å; K198-E740 HydrophobicContact CG-CG 3.96Å; K198-E740 PolarHBondContact N-OE1 3.29Å; K198-H741 PolarHBondContact NZ-NE2 3.48Å
199	S	90	Very high	80.9	Confident	21 Å²	21	38 Å²	38	15%	0.147	23%	0.234	C	C	.	.	H	α-helix	trans	-57.6	-44.5	178.2	-39.7	0	0	0	0	111.6	G197 C202 G203 L204 F206 S207 V208	G197-S199 VanDerWaalsContact C-N 3.27Å; G197-S199 PolarHBondContact O-N 3.24Å; S199-C202 CarbonylContact O-C 3.53Å; S199-C202 PolarHBondContact O-N 3.08Å; S199-G203 PolarHBondContact O-N 3.39Å; S199-G203 VanDerWaalsContact O-N 3.11Å; S199-L204 PolarHBondContact O-N 2.98Å; S199-F206 WeakPolarHBondContact CB-O 3.3Å; S199-S207 WeakPolarHBondContact OG-CA 3.47Å; S199-V208 PolarHBondContact OG-N 3.42Å
200	A	87.1	Confident	81.7	Confident	61 Å²	61	39.9 Å²	39.9	50%	0.504	24%	0.239	S	C	.	.	H	α-helix	trans	-68.1	-41.5	176.1	0	0	0	0	0	112	G197 K198 C202 G203	G197-A200 PolarHBondContact O-N 3.06Å; G197-A200 VanDerWaalsContact O-N 3.17Å; K198-A200 VanDerWaalsContact C-N 3.32Å; K198-A200 PolarHBondContact O-N 2.97Å; A200-C202 VanDerWaalsContact C-N 3.26Å; A200-C202 PolarHBondContact O-N 3.39Å; A200-G203 PolarHBondContact O-N 3.43Å
201	R	87.6	Confident	83.3	Confident	14 Å²	14	37 Å²	37	5%	0.053	21%	0.214	C	C	.	.	H	α-helix	trans	-60.8	-32.1	172.8	-76	-177.8	58.7	-148.2	-6.1	113.3	M185 Y186 S189 K196 G197 K198	M185-R201 CarbonylContact C-O 3.54Å; M185-R201 WeakPolarHBondContact CB-O 3.34Å; Y186-R201 HydrophobicContact CD2-CB 4Å; Y186-R201 PolarHBondContact N-O 3.04Å; Y186-R201 PolarHBondContact O-NH2 2.93Å; Y186-R201 PolarHBondContact OH-NH1 3.3Å; S189-R201 PolarHBondContact O-NE 3.4Å; S189-R201 WeakPolarHBondContact OG-CB 3.21Å; S189-R201 WeakPolarHBondContact OG-CG 3.43Å; S189-R201 PolarHBondContact OG-NE 3Å; S189-R201 VanDerWaalsContact OG-NE 3.08Å; K196-R201 HydrophobicContact CB-CG 4.37Å; G197-R201 PolarHBondContact O-N 3.27Å; K198-R201 CarbonylContact O-C 3.57Å; K198-R201 WeakPolarHBondContact O-CB 3.18Å; K198-R201 PolarHBondContact O-N 3.42Å
202	C	88.1	Confident	85	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-3.1	172.7	-67	0	0	0	0	114.1	A182 M185 K198 S199 A200 L204	A182-C202 HydrophobicContact CB-CB 4.43Å; M185-C202 WeakPolarHBondContact CE-O 3.34Å; K198-C202 WeakPolarHBondContact O-CB 3.29Å; K198-C202 PolarHBondContact O-N 3.41Å; K198-C202 PolarHBondContact O-SG 3.11Å; K198-C202 VanDerWaalsContact O-SG 3.33Å; S199-C202 CarbonylContact O-C 3.53Å; S199-C202 PolarHBondContact O-N 3.08Å; A200-C202 VanDerWaalsContact C-N 3.26Å; A200-C202 PolarHBondContact O-N 3.39Å; C202-L204 HydrophobicContact CB-CB 4.42Å; C202-L204 HydrophobicContact CB-CD1 3.9Å; C202-L204 HydrophobicContact CB-CG 3.84Å; C202-L204 PolarHBondContact O-N 3.05Å
203	G	89.3	Confident	86.5	Confident	46 Å²	46	33.3 Å²	33.3	47%	0.474	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	18.6	-174.8	0	0	0	0	0	115.1	S199 A200	S199-G203 PolarHBondContact O-N 3.39Å; S199-G203 VanDerWaalsContact O-N 3.11Å; A200-G203 PolarHBondContact O-N 3.43Å
204	L	92.2	Very high	88	Confident	29 Å²	29	30.7 Å²	30.7	15%	0.152	16%	0.159	C	C	.	.			trans	-93.3	152.4	-174.7	-65.3	178.3	0	0	0	112.5	A182 S199 C202 V208 T233 A234 E237	A182-L204 HydrophobicContact CB-CD1 4.39Å; A182-L204 HydrophobicContact CB-CD2 4.39Å; A182-L204 HydrophobicContact CB-CG 4.46Å; S199-L204 PolarHBondContact O-N 2.98Å; C202-L204 HydrophobicContact CB-CB 4.42Å; C202-L204 HydrophobicContact CB-CD1 3.9Å; C202-L204 HydrophobicContact CB-CG 3.84Å; C202-L204 PolarHBondContact O-N 3.05Å; L204-V208 HydrophobicContact CD1-CG2 4.06Å; L204-T233 WeakPolarHBondContact CD1-OG1 3.45Å; L204-A234 HydrophobicContact CD1-CB 4.33Å; L204-A234 HydrophobicContact CD2-CB 4.28Å; L204-E237 HydrophobicContact CD2-CB 4.49Å
205	S	91.5	Very high	89.2	Confident	11 Å²	11	29.9 Å²	29.9	8%	0.077	16%	0.155	C	C	.	.	S	Bend	trans	-89.8	-27	176.1	-43.9	0	0	0	0	113	R101 K105 E237	R101-S205 PolarHBondContact NH1-O 3.31Å; R101-S205 VanDerWaalsContact NH1-O 3.15Å; K105-S205 PolarHBondContact NZ-OG 3.32Å; S205-E237 WeakPolarHBondContact CA-OE2 3.21Å; S205-E237 WeakPolarHBondContact CB-OE1 3.39Å; S205-E237 PolarHBondContact N-OE1 2.89Å; S205-E237 PolarHBondContact N-OE2 2.94Å; S205-E237 PolarHBondContact OG-OE1 3.25Å
206	F	93.9	Very high	90.2	Very high	1 Å²	1	22 Å²	22	0%	0.004	13%	0.128	C	C	.	.	S	Bend	trans	-84.1	147.7	172.4	-72	-42.3	0	0	0	112.4	W94 E98 V99 I102 S199 V208 F211 M236 E237 V240	W94-F206 HydrophobicContact CB-CD1 3.65Å; W94-F206 HydrophobicContact CB-CE1 3.45Å; W94-F206 VanDerWaalsContact CB-CE1 3.45Å; W94-F206 HydrophobicContact CB-CZ 4.21Å; W94-F206 AromaticContact CG-CE1 3.97Å; W94-F206 HydrophobicContact CG-CE1 3.97Å; W94-F206 HydrophobicContact CG-CZ 4.32Å; E98-F206 HydrophobicContact CB-CD1 3.77Å; E98-F206 HydrophobicContact CB-CE1 3.79Å; V99-F206 HydrophobicContact CG2-CE1 4.04Å; V99-F206 HydrophobicContact CG2-CZ 4.04Å; I102-F206 HydrophobicContact CD1-CD1 4.02Å; I102-F206 HydrophobicContact CD1-CD2 3.98Å; I102-F206 HydrophobicContact CD1-CE1 3.6Å; I102-F206 HydrophobicContact CD1-CE2 3.58Å; I102-F206 HydrophobicContact CD1-CG 4.18Å; I102-F206 HydrophobicContact CD1-CZ 3.38Å; S199-F206 WeakPolarHBondContact CB-O 3.3Å; F206-V208 PolarHBondContact O-N 3.3Å; F206-F211 HydrophobicContact CB-CE2 4.01Å; F206-F211 HydrophobicContact CD2-CE2 4.3Å; F206-F211 HydrophobicContact CD2-CZ 4.49Å; F206-F211 HydrophobicContact CG-CE2 4.19Å; F206-M236 HydrophobicContact CD2-CB 4.49Å; F206-M236 HydrophobicContact CE2-CB 4.23Å; F206-E237 HydrophobicContact CD2-CB 3.85Å; F206-E237 HydrophobicContact CD2-CG 4.45Å; F206-E237 HydrophobicContact CE2-CB 4.17Å; F206-E237 PolarHBondContact N-OE2 3.07Å; F206-V240 HydrophobicContact CE2-CG2 4.08Å; F206-V240 HydrophobicContact CZ-CG2 3.95Å
207	S	91.8	Very high	90.7	Very high	23 Å²	23	20.7 Å²	20.7	16%	0.161	13%	0.125	C	C	.	.			trans	-72.8	109.9	178.1	175.1	0	0	0	0	112.3	S199 G209 R210 F211	S199-S207 WeakPolarHBondContact OG-CA 3.47Å; S207-G209 VanDerWaalsContact C-N 3.34Å; S207-G209 PolarHBondContact O-N 3.19Å; S207-R210 PolarHBondContact O-N 3.08Å; S207-R210 PolarHBondContact OG-N 2.83Å; S207-F211 WeakPolarHBondContact O-CD2 3.34Å; S207-F211 PolarHBondContact O-N 3.03Å; S207-F211 VanDerWaalsContact O-N 3.16Å
208	V	94.1	Very high	91	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-59.9	-44.5	176.6	175	0	0	0	0	111.3	K198 S199 L204 F206 R210 F211 F212 A229 I230 T233	K198-V208 HydrophobicContact CB-CB 4.15Å; K198-V208 HydrophobicContact CB-CG1 4.24Å; K198-V208 HydrophobicContact CD-CG1 4.43Å; S199-V208 PolarHBondContact OG-N 3.42Å; L204-V208 HydrophobicContact CD1-CG2 4.06Å; F206-V208 PolarHBondContact O-N 3.3Å; V208-R210 PolarHBondContact O-N 3.27Å; V208-F211 WeakPolarHBondContact O-CB 3.41Å; V208-F211 PolarHBondContact O-N 2.81Å; V208-F212 PolarHBondContact O-N 2.73Å; V208-A229 HydrophobicContact CG1-CB 4.43Å; V208-I230 HydrophobicContact CG1-CG1 3.66Å; V208-I230 HydrophobicContact CG2-CG1 4.45Å; V208-T233 HydrophobicContact CB-CG2 4.38Å; V208-T233 HydrophobicContact CG2-CG2 4.14Å
209	G	91.7	Very high	91	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.7	-36.1	179.1	0	0	0	0	0	114.7	S207 F212 R213 E740	S207-G209 VanDerWaalsContact C-N 3.34Å; S207-G209 PolarHBondContact O-N 3.19Å; G209-F212 PolarHBondContact O-N 2.9Å; G209-R213 WeakPolarHBondContact O-CB 3.22Å; G209-R213 PolarHBondContact O-N 3.48Å; G209-E740 CarbonylContact C-O 3.57Å; G209-E740 VanDerWaalsContact CA-O 3.3Å; G209-E740 WeakPolarHBondContact CA-O 3.5Å; G209-E740 PolarHBondContact N-OE2 2.62Å
210	R	92.1	Very high	91	Very high	54 Å²	54	25.9 Å²	25.9	20%	0.204	14%	0.14	C	C	.	.	H	α-helix	trans	-68.9	-35.4	172.5	-74.4	-165.2	-65.1	134.5	0.7	112.8	P93 E98 S207 V208 W214	P93-R210 HydrophobicContact CB-CB 4.37Å; P93-R210 PolarHBondContact O-NH1 2.92Å; P93-R210 VanDerWaalsContact O-NH1 3.11Å; P93-R210 PolarHBondContact O-NH2 3.32Å; E98-R210 IonicContact OE1-NH2 2.85Å; E98-R210 PolarHBondContact OE1-NH2 2.91Å; E98-R210 IonicContact OE2-CZ 3.63Å; E98-R210 IonicContact OE2-NH2 2.85Å; E98-R210 PolarHBondContact OE2-NH2 3.08Å; S207-R210 PolarHBondContact O-N 3.08Å; S207-R210 PolarHBondContact OG-N 2.83Å; V208-R210 PolarHBondContact O-N 3.27Å; R210-W214 VanDerWaalsContact O-CB 3.25Å; R210-W214 WeakPolarHBondContact O-CB 3.21Å; R210-W214 PolarHBondContact O-N 3.27Å
211	F	94.8	Very high	91.1	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.9	-50.1	170	-93.1	-102.7	0	0	0	111.5	P93 W94 L137 F206 S207 V208 R213 W214 M215 L232 T233 M236	P93-F211 HydrophobicContact CB-CB 4.29Å; P93-F211 HydrophobicContact CB-CD1 4.32Å; P93-F211 HydrophobicContact CB-CD2 3.54Å; P93-F211 HydrophobicContact CB-CE2 3.94Å; P93-F211 HydrophobicContact CB-CG 3.76Å; P93-F211 HydrophobicContact CG-CD1 3.77Å; P93-F211 HydrophobicContact CG-CD2 3.67Å; P93-F211 HydrophobicContact CG-CE1 3.8Å; P93-F211 HydrophobicContact CG-CE2 3.68Å; P93-F211 HydrophobicContact CG-CG 3.73Å; P93-F211 HydrophobicContact CG-CZ 3.76Å; W94-F211 HydrophobicContact CE3-CE2 4.08Å; W94-F211 AromaticContact CE3-CZ 3.67Å; W94-F211 HydrophobicContact CE3-CZ 3.67Å; W94-F211 AromaticContact CZ3-CZ 3.95Å; W94-F211 HydrophobicContact CZ3-CZ 3.95Å; L137-F211 HydrophobicContact CD1-CD1 4.45Å; L137-F211 HydrophobicContact CD1-CE1 3.81Å; F206-F211 HydrophobicContact CB-CE2 4.01Å; F206-F211 HydrophobicContact CD2-CE2 4.3Å; F206-F211 HydrophobicContact CD2-CZ 4.49Å; F206-F211 HydrophobicContact CG-CE2 4.19Å; S207-F211 WeakPolarHBondContact O-CD2 3.34Å; S207-F211 PolarHBondContact O-N 3.03Å; S207-F211 VanDerWaalsContact O-N 3.16Å; V208-F211 WeakPolarHBondContact O-CB 3.41Å; V208-F211 PolarHBondContact O-N 2.81Å; F211-R213 VanDerWaalsContact C-N 3.29Å; F211-R213 PolarHBondContact O-N 2.91Å; F211-W214 PolarHBondContact O-N 3.45Å; F211-W214 VanDerWaalsContact O-N 3.13Å; F211-M215 VanDerWaalsContact O-CG 3.28Å; F211-M215 WeakPolarHBondContact O-CG 3.43Å; F211-M215 PolarHBondContact O-N 3.37Å; F211-L232 HydrophobicContact CD1-CB 4.34Å; F211-L232 HydrophobicContact CD1-CD2 4.14Å; F211-L232 HydrophobicContact CD1-CG 3.97Å; F211-L232 HydrophobicContact CE1-CG 4.1Å; F211-T233 HydrophobicContact CB-CG2 3.3Å; F211-T233 HydrophobicContact CD1-CG2 3.8Å; F211-T233 HydrophobicContact CD2-CG2 3.46Å; F211-T233 VanDerWaalsContact CD2-CG2 3.46Å; F211-T233 HydrophobicContact CE1-CG2 4.41Å; F211-T233 HydrophobicContact CE2-CG2 4.13Å; F211-T233 HydrophobicContact CG-CG2 3.26Å; F211-M236 HydrophobicContact CE1-CB 4.14Å; F211-M236 HydrophobicContact CE1-CG 3.71Å; F211-M236 HydrophobicContact CZ-CB 3.81Å; F211-M236 HydrophobicContact CZ-CG 3.84Å
212	F	94.3	Very high	91	Very high	3 Å²	3	26.9 Å²	26.9	1%	0.013	14%	0.142	C	C	.	.	H	α-helix	trans	-52.6	-50.4	176.6	-173.8	-74.7	0	0	0	111	V208 G209 W214 M215 V216 I224 E226 A229 A662 H663 H741	V208-F212 PolarHBondContact O-N 2.73Å; G209-F212 PolarHBondContact O-N 2.9Å; F212-W214 PolarHBondContact O-N 3.01Å; F212-M215 WeakPolarHBondContact O-CB 3.41Å; F212-M215 PolarHBondContact O-N 3.41Å; F212-V216 HydrophobicContact CD1-CG2 3.97Å; F212-V216 HydrophobicContact CE1-CG2 3.69Å; F212-V216 WeakPolarHBondContact O-CG2 3.34Å; F212-V216 PolarHBondContact O-N 3.06Å; F212-V216 VanDerWaalsContact O-N 3.1Å; F212-I224 HydrophobicContact CD2-CG2 4.05Å; F212-I224 HydrophobicContact CE2-CB 4.33Å; F212-I224 HydrophobicContact CE2-CG2 3.89Å; F212-I224 WeakPolarHBondContact CE2-O 3.35Å; F212-I224 HydrophobicContact CZ-CB 4.32Å; F212-I224 HydrophobicContact CZ-CG2 4.32Å; F212-I224 VanDerWaalsContact CZ-O 3.3Å; F212-I224 WeakPolarHBondContact CZ-O 3.16Å; F212-E226 HydrophobicContact CD2-CG 4.46Å; F212-E226 HydrophobicContact CE2-CG 4.12Å; F212-A229 HydrophobicContact CB-CB 3.75Å; F212-A229 HydrophobicContact CD2-CB 3.88Å; F212-A229 HydrophobicContact CG-CB 4.29Å; F212-A662 VanDerWaalsContact CE1-O 3.32Å; F212-A662 WeakPolarHBondContact CE1-O 3.25Å; F212-H663 AromaticContact CE1-CE1 3.94Å; F212-H663 AromaticContact CZ-CE1 3.73Å; F212-H663 AromaticContact CZ-NE2 3.86Å; F212-H741 AromaticContact CD1-CE1 3.23Å; F212-H741 WeakPolarHBondContact CD1-CE1 3.46Å; F212-H741 AromaticContact CD1-CG 3.77Å; F212-H741 AromaticContact CD1-ND1 3.17Å; F212-H741 WeakPolarHBondContact CD1-ND1 3.21Å; F212-H741 AromaticContact CD1-NE2 3.84Å; F212-H741 AromaticContact CD2-CE1 3.64Å; F212-H741 AromaticContact CD2-NE2 3.92Å; F212-H741 AromaticContact CE1-CE1 3.44Å; F212-H741 VanDerWaalsContact CE1-CE1 3.44Å; F212-H741 WeakPolarHBondContact CE1-CE1 3.23Å; F212-H741 AromaticContact CE1-ND1 3.39Å; F212-H741 WeakPolarHBondContact CE1-ND1 3.4Å; F212-H741 AromaticContact CE2-CE1 3.82Å; F212-H741 AromaticContact CG-CE1 3.35Å; F212-H741 WeakPolarHBondContact CG-CE1 3.48Å; F212-H741 AromaticContact CG-ND1 3.75Å; F212-H741 AromaticContact CG-NE2 3.57Å; F212-H741 AromaticContact CZ-CE1 3.74Å
213	R	92.3	Very high	90.9	Very high	70 Å²	70	27.2 Å²	27.2	26%	0.264	14%	0.143	S	C	.	.	H	α-helix	trans	-60	-45.8	178.1	-169.2	-139	174.9	87.2	2.1	112.2	G209 F211 M215 V216 D217 H741 G742 Y743	G209-R213 WeakPolarHBondContact O-CB 3.22Å; G209-R213 PolarHBondContact O-N 3.48Å; F211-R213 VanDerWaalsContact C-N 3.29Å; F211-R213 PolarHBondContact O-N 2.91Å; R213-M215 VanDerWaalsContact C-N 3.31Å; R213-M215 PolarHBondContact O-N 2.78Å; R213-V216 WeakPolarHBondContact O-CB 3.43Å; R213-V216 PolarHBondContact O-N 2.97Å; R213-V216 VanDerWaalsContact O-N 3.07Å; R213-D217 WeakPolarHBondContact CD-OD2 3.31Å; R213-D217 IonicContact CZ-OD2 2.7Å; R213-D217 IonicContact NE-OD2 2.85Å; R213-D217 PolarHBondContact NE-OD2 2.97Å; R213-D217 IonicContact NH2-OD2 3.63Å; R213-D217 PolarHBondContact O-N 3.27Å; R213-H741 HydrophobicContact CB-CB 4.48Å; R213-H741 WeakPolarHBondContact CB-O 3.3Å; R213-H741 VanDerWaalsContact CG-O 3.3Å; R213-H741 WeakPolarHBondContact CG-O 3.23Å; R213-H741 PolarHBondContact NH1-O 3.03Å; R213-H741 VanDerWaalsContact NH1-O 3.14Å; R213-G742 VanDerWaalsContact NH1-C 3.29Å; R213-G742 PolarHBondContact NH1-O 2.62Å; R213-Y743 HydrophobicContact CG-CE1 4.48Å; R213-Y743 HydrophobicContact CG-CE2 4.4Å
214	W	93.1	Very high	90.9	Very high	12 Å²	12	25.4 Å²	25.4	5%	0.045	12%	0.123	C	C	.	.	H	α-helix	trans	-61.4	-36.5	176.3	179.2	91.4	0	0	0	112.4	L89 E91 P93 L137 S141 R210 F211 F212 V216 T218 I220 L232	L89-W214 HydrophobicContact CD1-CZ2 3.72Å; E91-W214 PolarHBondContact O-NE1 3.39Å; P93-W214 HydrophobicContact CB-CB 3.91Å; P93-W214 HydrophobicContact CB-CG 4.21Å; P93-W214 HydrophobicContact CG-CB 4.27Å; P93-W214 HydrophobicContact CG-CD2 4.22Å; P93-W214 HydrophobicContact CG-CG 4.09Å; L137-W214 HydrophobicContact CD1-CH2 4.16Å; L137-W214 HydrophobicContact CD1-CZ3 3.94Å; L137-W214 HydrophobicContact CD2-CD2 4.31Å; L137-W214 HydrophobicContact CD2-CE3 4.23Å; L137-W214 HydrophobicContact CD2-CH2 3.43Å; L137-W214 VanDerWaalsContact CD2-CH2 3.43Å; L137-W214 HydrophobicContact CD2-CZ2 3.47Å; L137-W214 VanDerWaalsContact CD2-CZ2 3.47Å; L137-W214 HydrophobicContact CD2-CZ3 3.81Å; L137-W214 HydrophobicContact CG-CH2 3.55Å; L137-W214 HydrophobicContact CG-CZ2 4.09Å; L137-W214 HydrophobicContact CG-CZ3 3.86Å; S141-W214 WeakPolarHBondContact OG-CH2 3.43Å; S141-W214 VanDerWaalsContact OG-CZ3 3.31Å; S141-W214 WeakPolarHBondContact OG-CZ3 3.46Å; R210-W214 VanDerWaalsContact O-CB 3.25Å; R210-W214 WeakPolarHBondContact O-CB 3.21Å; R210-W214 PolarHBondContact O-N 3.27Å; F211-W214 PolarHBondContact O-N 3.45Å; F211-W214 VanDerWaalsContact O-N 3.13Å; F212-W214 PolarHBondContact O-N 3.01Å; W214-V216 VanDerWaalsContact C-N 3.31Å; W214-V216 PolarHBondContact O-N 3.12Å; W214-T218 HydrophobicContact CD2-CG2 4.09Å; W214-T218 HydrophobicContact CG-CG2 4.42Å; W214-T218 HydrophobicContact CZ2-CG2 3.92Å; W214-T218 WeakPolarHBondContact O-CB 3.15Å; W214-T218 WeakPolarHBondContact O-CG2 3.44Å; W214-T218 PolarHBondContact O-N 3.34Å; W214-T218 PolarHBondContact O-OG1 3.22Å; W214-I220 HydrophobicContact CZ3-CD1 3.94Å; W214-L232 HydrophobicContact CZ3-CD2 4.35Å
215	M	92.9	Very high	90.7	Very high	1 Å²	1	25 Å²	25	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-64.1	-35.2	173.3	-62	178.5	69.7	0	0	112.2	V159 F211 F212 R213 R219 I220 I224 A228 A229 L232	V159-M215 HydrophobicContact CG2-CE 4.35Å; F211-M215 VanDerWaalsContact O-CG 3.28Å; F211-M215 WeakPolarHBondContact O-CG 3.43Å; F211-M215 PolarHBondContact O-N 3.37Å; F212-M215 WeakPolarHBondContact O-CB 3.41Å; F212-M215 PolarHBondContact O-N 3.41Å; R213-M215 VanDerWaalsContact C-N 3.31Å; R213-M215 PolarHBondContact O-N 2.78Å; M215-R219 PolarHBondContact O-N 3.15Å; M215-I220 HydrophobicContact CB-CB 4.48Å; M215-I220 HydrophobicContact CB-CD1 3.86Å; M215-I220 HydrophobicContact CB-CG1 4.34Å; M215-I220 HydrophobicContact CE-CD1 4.01Å; M215-I220 HydrophobicContact CE-CG2 4.32Å; M215-I220 HydrophobicContact CG-CD1 3.69Å; M215-I220 PolarHBondContact O-N 2.95Å; M215-I224 VanDerWaalsContact C-CD1 3.41Å; M215-I224 HydrophobicContact CB-CD1 3.68Å; M215-I224 HydrophobicContact CB-CG1 4.37Å; M215-I224 HydrophobicContact CB-CG2 4.36Å; M215-I224 HydrophobicContact CE-CG2 3.95Å; M215-I224 WeakPolarHBondContact O-CD1 3.3Å; M215-I224 HydrophobicContact SD-CG2 4.06Å; M215-A228 HydrophobicContact CE-CB 4.13Å; M215-A229 HydrophobicContact SD-CB 4.06Å; M215-L232 HydrophobicContact CE-CD2 4.22Å; M215-L232 HydrophobicContact CG-CD2 3.84Å; M215-L232 HydrophobicContact SD-CB 4.43Å; M215-L232 HydrophobicContact SD-CD2 3.76Å
216	V	90.3	Very high	90.4	Very high	27 Å²	27	24.6 Å²	24.6	16%	0.164	12%	0.117	C	C	.	.	H	α-helix	trans	-72.9	-51.6	175.3	176.8	0	0	0	0	111	F212 R213 W214 T218 R219 I224 H663	F212-V216 HydrophobicContact CD1-CG2 3.97Å; F212-V216 HydrophobicContact CE1-CG2 3.69Å; F212-V216 WeakPolarHBondContact O-CG2 3.34Å; F212-V216 PolarHBondContact O-N 3.06Å; F212-V216 VanDerWaalsContact O-N 3.1Å; R213-V216 WeakPolarHBondContact O-CB 3.43Å; R213-V216 PolarHBondContact O-N 2.97Å; R213-V216 VanDerWaalsContact O-N 3.07Å; W214-V216 VanDerWaalsContact C-N 3.31Å; W214-V216 PolarHBondContact O-N 3.12Å; V216-T218 VanDerWaalsContact C-N 3.27Å; V216-T218 PolarHBondContact O-N 3.29Å; V216-R219 PolarHBondContact O-N 3.28Å; V216-I224 HydrophobicContact CB-CD1 4.33Å; V216-I224 HydrophobicContact CG2-CD1 3.66Å; V216-H663 WeakPolarHBondContact CG2-ND1 3.18Å
217	D	88.8	Confident	90.2	Very high	54 Å²	54	25.1 Å²	25.1	29%	0.289	12%	0.119	S	C	.	.	H	α-helix	trans	-63.8	-30.5	-177.8	-75.7	-25.8	0	0	0	112	M9 R213	M9-D217 HydrophobicContact SD-CB 4.46Å; R213-D217 WeakPolarHBondContact CD-OD2 3.31Å; R213-D217 IonicContact CZ-OD2 2.7Å; R213-D217 IonicContact NE-OD2 2.85Å; R213-D217 PolarHBondContact NE-OD2 2.97Å; R213-D217 IonicContact NH2-OD2 3.63Å; R213-D217 PolarHBondContact O-N 3.27Å
218	T	88	Confident	90.2	Very high	5 Å²	5	24 Å²	24	3%	0.031	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-9.8	172.5	56.6	0	0	0	0	114.7	L12 L89 W214 V216	L12-T218 WeakPolarHBondContact CB-O 3.45Å; L12-T218 PolarHBondContact N-O 3.29Å; L12-T218 VanDerWaalsContact N-O 3.1Å; L89-T218 HydrophobicContact CD1-CG2 4.22Å; W214-T218 HydrophobicContact CD2-CG2 4.09Å; W214-T218 HydrophobicContact CG-CG2 4.42Å; W214-T218 HydrophobicContact CZ2-CG2 3.92Å; W214-T218 WeakPolarHBondContact O-CB 3.15Å; W214-T218 WeakPolarHBondContact O-CG2 3.44Å; W214-T218 PolarHBondContact O-N 3.34Å; W214-T218 PolarHBondContact O-OG1 3.22Å; V216-T218 VanDerWaalsContact C-N 3.27Å; V216-T218 PolarHBondContact O-N 3.29Å
219	R	88.3	Confident	90.2	Very high	130 Å²	130	24 Å²	24	49%	0.491	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	50.4	-176.6	-54	179	175.4	-175.8	-0.8	115.3	T11 E13 Q145 M215 V216 S221	T11-R219 HydrophobicContact CG2-CG 4.41Å; E13-R219 HydrophobicContact CG-CB 4.48Å; E13-R219 VanDerWaalsContact OE1-CB 3.31Å; E13-R219 WeakPolarHBondContact OE1-CB 3.43Å; E13-R219 WeakPolarHBondContact OE1-CD 3.19Å; E13-R219 WeakPolarHBondContact OE2-CD 3.47Å; E13-R219 IonicContact OE2-CZ 3.66Å; E13-R219 IonicContact OE2-NE 3.64Å; E13-R219 IonicContact OE2-NH1 2.76Å; E13-R219 PolarHBondContact OE2-NH1 2.74Å; Q145-R219 PolarHBondContact NE2-O 3.49Å; M215-R219 PolarHBondContact O-N 3.15Å; V216-R219 PolarHBondContact O-N 3.28Å; R219-S221 PolarHBondContact O-N 3.05Å
220	I	88.7	Confident	90.3	Very high	1 Å²	1	24 Å²	24	1%	0.005	11%	0.111	C	C	.	.	S	Bend	trans	-61.1	-34.9	170.3	-62.8	-176.8	0	0	0	111	A144 Q145 S148 C154 W214 M215	A144-I220 HydrophobicContact CB-CG2 4.2Å; Q145-I220 VanDerWaalsContact CA-O 3.29Å; Q145-I220 WeakPolarHBondContact CA-O 3.39Å; Q145-I220 HydrophobicContact CB-CG2 4.17Å; Q145-I220 WeakPolarHBondContact CG-O 3.3Å; S148-I220 PolarHBondContact OG-O 3.31Å; S148-I220 VanDerWaalsContact OG-O 3.12Å; C154-I220 HydrophobicContact CB-CG2 4.41Å; W214-I220 HydrophobicContact CZ3-CD1 3.94Å; M215-I220 HydrophobicContact CB-CB 4.48Å; M215-I220 HydrophobicContact CB-CD1 3.86Å; M215-I220 HydrophobicContact CB-CG1 4.34Å; M215-I220 HydrophobicContact CE-CD1 4.01Å; M215-I220 HydrophobicContact CE-CG2 4.32Å; M215-I220 HydrophobicContact CG-CD1 3.69Å; M215-I220 PolarHBondContact O-N 2.95Å
221	S	88.8	Confident	90.5	Very high	16 Å²	16	21.4 Å²	21.4	11%	0.112	10%	0.101	C	C	.	.			trans	-162.1	160.7	169.2	-154	0	0	0	0	111.3	S148 R153 R219 R223	S148-S221 WeakPolarHBondContact CB-OG 3.31Å; S148-S221 VanDerWaalsContact OG-CB 3.29Å; S148-S221 WeakPolarHBondContact OG-CB 3.43Å; S148-S221 PolarHBondContact OG-OG 3.43Å; R153-S221 PolarHBondContact N-OG 2.84Å; R219-S221 PolarHBondContact O-N 3.05Å; S221-R223 WeakPolarHBondContact CB-O 3.44Å; S221-R223 PolarHBondContact O-N 3.36Å
222	V	85.4	Confident	90.6	Very high	81 Å²	81	21.5 Å²	21.5	49%	0.491	10%	0.102	S	C	.	.	S	Bend	trans	-59.9	-29.7	177	178.4	0	0	0	0	111.9	A620	V222-A620 HydrophobicContact CG1-CB 3.57Å
223	R	86.2	Confident	90.7	Very high	6 Å²	6	21.4 Å²	21.4	2%	0.023	10%	0.101	C	C	.	.	S	Bend	trans	-133.5	136.7	172.5	-70.2	173.9	-70.4	-100.9	-18.6	110	C152 R153 C154 S221 L580 L616 A619 A620	C152-R223 PolarHBondContact O-NE 3.06Å; C152-R223 PolarHBondContact O-NH2 3.18Å; R153-R223 CarbonylContact C-O 3.59Å; R153-R223 WeakPolarHBondContact CA-O 3.48Å; R153-R223 HydrophobicContact CG-CB 4.22Å; C154-R223 PolarHBondContact N-O 2.93Å; S221-R223 WeakPolarHBondContact CB-O 3.44Å; S221-R223 PolarHBondContact O-N 3.36Å; R223-L580 PolarHBondContact NH1-O 3.03Å; R223-L580 VanDerWaalsContact NH2-CD1 3.35Å; R223-L580 PolarHBondContact NH2-O 3.14Å; R223-L616 WeakPolarHBondContact CD-O 3.47Å; R223-L616 PolarHBondContact NH1-O 2.88Å; R223-L616 VanDerWaalsContact NH1-O 3.08Å; R223-A619 HydrophobicContact CG-CB 3.72Å; R223-A620 HydrophobicContact CG-CB 4.28Å
224	I	90.1	Very high	90.9	Very high	8 Å²	8	18.1 Å²	18.1	4%	0.041	9%	0.09	C	C	.	.	B	Isolated β-bridge	trans	-126.2	123.9	179.7	-70.6	144.6	0	0	0	107.4	C154 F212 M215 V216 A228 H663	C154-I224 HydrophobicContact CB-CG1 4.13Å; F212-I224 HydrophobicContact CD2-CG2 4.05Å; F212-I224 HydrophobicContact CE2-CB 4.33Å; F212-I224 HydrophobicContact CE2-CG2 3.89Å; F212-I224 WeakPolarHBondContact CE2-O 3.35Å; F212-I224 HydrophobicContact CZ-CB 4.32Å; F212-I224 HydrophobicContact CZ-CG2 4.32Å; F212-I224 VanDerWaalsContact CZ-O 3.3Å; F212-I224 WeakPolarHBondContact CZ-O 3.16Å; M215-I224 VanDerWaalsContact C-CD1 3.41Å; M215-I224 HydrophobicContact CB-CD1 3.68Å; M215-I224 HydrophobicContact CB-CG1 4.37Å; M215-I224 HydrophobicContact CB-CG2 4.36Å; M215-I224 HydrophobicContact CE-CG2 3.95Å; M215-I224 WeakPolarHBondContact O-CD1 3.3Å; M215-I224 HydrophobicContact SD-CG2 4.06Å; V216-I224 HydrophobicContact CB-CD1 4.33Å; V216-I224 HydrophobicContact CG2-CD1 3.66Å; I224-A228 HydrophobicContact CG2-CB 4.33Å; I224-H663 PolarHBondContact N-CE1 3.02Å
225	H	87.1	Confident	91.1	Very high	20 Å²	20	17.6 Å²	17.6	9%	0.093	9%	0.087	C	C	.	.			trans	-82.7	145	175.2	-165	-15	0	0	0	109.5	C154 Y227 A228 A229 E652	C154-H225 PolarHBondContact O-N 2.87Å; H225-Y227 AromaticContact CE1-CD2 3.41Å; H225-Y227 VanDerWaalsContact CE1-CD2 3.41Å; H225-Y227 WeakPolarHBondContact CE1-CD2 3.15Å; H225-Y227 AromaticContact CE1-CE2 3.72Å; H225-Y227 AromaticContact NE2-CD2 3.47Å; H225-Y227 WeakPolarHBondContact NE2-CD2 3.45Å; H225-Y227 AromaticContact NE2-CE2 3.88Å; H225-Y227 PolarHBondContact O-N 3.05Å; H225-A228 WeakPolarHBondContact O-CA 3.11Å; H225-A228 WeakPolarHBondContact O-CB 3.27Å; H225-A228 PolarHBondContact O-N 2.8Å; H225-A229 PolarHBondContact O-N 2.97Å; H225-E652 IonicContact CE1-OE2 3.07Å; H225-E652 PolarHBondContact CE1-OE2 3.38Å; H225-E652 IonicContact ND1-OE2 2.74Å
226	E	86.2	Confident	91.2	Very high	3 Å²	3	17.5 Å²	17.5	1%	0.014	9%	0.087	C	C	.	.	H	α-helix	trans	-54	-38.3	176.8	-55.7	-148.7	164.3	0	0	113.9	Y186 K198 F212 A228 A229 I230 E652 M654 Y737 H741	Y186-E226 PolarHBondContact OH-OE2 2.67Å; K198-E226 WeakPolarHBondContact CE-OE2 3.22Å; K198-E226 IonicContact NZ-OE1 3.16Å; K198-E226 PolarHBondContact NZ-OE1 2.62Å; K198-E226 IonicContact NZ-OE2 3.22Å; K198-E226 PolarHBondContact NZ-OE2 3.36Å; F212-E226 HydrophobicContact CD2-CG 4.46Å; F212-E226 HydrophobicContact CE2-CG 4.12Å; E226-A228 PolarHBondContact O-N 2.6Å; E226-A229 PolarHBondContact O-N 3.07Å; E226-A229 VanDerWaalsContact O-N 3.11Å; E226-I230 WeakPolarHBondContact O-CG1 3.1Å; E226-I230 PolarHBondContact O-N 2.92Å; E226-E652 VanDerWaalsContact CG-OE2 3.29Å; E226-E652 WeakPolarHBondContact CG-OE2 3.1Å; E226-M654 HydrophobicContact CG-CE 4.18Å; E226-M654 WeakPolarHBondContact OE1-CE 3.31Å; E226-Y737 WeakPolarHBondContact OE1-CD1 3.37Å; E226-Y737 VanDerWaalsContact OE1-CE1 3.23Å; E226-Y737 WeakPolarHBondContact OE1-CE1 3.1Å; E226-H741 IonicContact OE1-CE1 2.81Å
227	Y	89.1	Confident	91.5	Very high	13 Å²	13	16.6 Å²	16.6	5%	0.051	8%	0.081	C	C	.	.	H	α-helix	trans	-63.8	-22.4	174.2	-59.8	-46.1	0	0	0	113.7	I183 Y186 H225 I230 S231 L650	I183-Y227 HydrophobicContact CD1-CD1 4.45Å; I183-Y227 HydrophobicContact CG1-CD1 4.23Å; I183-Y227 HydrophobicContact CG2-CD1 4.04Å; I183-Y227 HydrophobicContact CG2-CE1 4.01Å; Y186-Y227 AromaticContact CD1-CE1 3.94Å; Y186-Y227 HydrophobicContact CD1-CE1 3.94Å; Y186-Y227 HydrophobicContact CE1-CE1 4.24Å; H225-Y227 AromaticContact CE1-CD2 3.41Å; H225-Y227 VanDerWaalsContact CE1-CD2 3.41Å; H225-Y227 WeakPolarHBondContact CE1-CD2 3.15Å; H225-Y227 AromaticContact CE1-CE2 3.72Å; H225-Y227 AromaticContact NE2-CD2 3.47Å; H225-Y227 WeakPolarHBondContact NE2-CD2 3.45Å; H225-Y227 AromaticContact NE2-CE2 3.88Å; H225-Y227 PolarHBondContact O-N 3.05Å; Y227-I230 HydrophobicContact CD1-CD1 4.2Å; Y227-S231 VanDerWaalsContact O-CB 3.3Å; Y227-S231 WeakPolarHBondContact O-CB 3.43Å; Y227-S231 PolarHBondContact O-N 2.93Å; Y227-S231 PolarHBondContact O-OG 3.19Å; Y227-L650 WeakPolarHBondContact CE2-O 3.37Å
228	A	92.1	Very high	91.8	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-70.1	-47.1	171.3	0	0	0	0	0	110.7	C154 T155 V159 M215 I224 H225 E226 S231 L232	C154-A228 WeakPolarHBondContact O-CB 3.34Å; T155-A228 VanDerWaalsContact C-CB 3.46Å; T155-A228 WeakPolarHBondContact O-CB 3.28Å; V159-A228 HydrophobicContact CG2-CB 3.88Å; M215-A228 HydrophobicContact CE-CB 4.13Å; I224-A228 HydrophobicContact CG2-CB 4.33Å; H225-A228 WeakPolarHBondContact O-CA 3.11Å; H225-A228 WeakPolarHBondContact O-CB 3.27Å; H225-A228 PolarHBondContact O-N 2.8Å; E226-A228 PolarHBondContact O-N 2.6Å; A228-S231 WeakPolarHBondContact O-CB 3.44Å; A228-S231 PolarHBondContact O-N 3.2Å; A228-L232 PolarHBondContact O-N 3.13Å
229	A	94.3	Very high	92.2	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-62.1	-46.8	175.7	0	0	0	0	0	111.7	V208 F212 M215 H225 E226 S231 L232 T233	V208-A229 HydrophobicContact CG1-CB 4.43Å; F212-A229 HydrophobicContact CB-CB 3.75Å; F212-A229 HydrophobicContact CD2-CB 3.88Å; F212-A229 HydrophobicContact CG-CB 4.29Å; M215-A229 HydrophobicContact SD-CB 4.06Å; H225-A229 PolarHBondContact O-N 2.97Å; E226-A229 PolarHBondContact O-N 3.07Å; E226-A229 VanDerWaalsContact O-N 3.11Å; A229-S231 VanDerWaalsContact C-N 3.27Å; A229-S231 PolarHBondContact O-N 2.56Å; A229-L232 PolarHBondContact O-N 3.23Å; A229-L232 VanDerWaalsContact O-N 3.14Å; A229-T233 WeakPolarHBondContact O-CG2 3.26Å; A229-T233 PolarHBondContact O-N 3.39Å; A229-T233 PolarHBondContact O-OG1 2.77Å
230	I	94.3	Very high	92.5	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-60.5	-35.8	175.7	-64.5	164.9	0	0	0	111.5	A182 I183 Y186 V208 E226 Y227 T233 A234	A182-I230 HydrophobicContact CB-CG2 4.06Å; I183-I230 HydrophobicContact CG1-CG2 3.77Å; Y186-I230 HydrophobicContact CD1-CD1 4.22Å; Y186-I230 HydrophobicContact CD2-CD1 4.1Å; Y186-I230 HydrophobicContact CE1-CD1 4.44Å; Y186-I230 HydrophobicContact CE2-CD1 4.35Å; Y186-I230 HydrophobicContact CG-CD1 4.03Å; V208-I230 HydrophobicContact CG1-CG1 3.66Å; V208-I230 HydrophobicContact CG2-CG1 4.45Å; E226-I230 WeakPolarHBondContact O-CG1 3.1Å; E226-I230 PolarHBondContact O-N 2.92Å; Y227-I230 HydrophobicContact CD1-CD1 4.2Å; I230-T233 WeakPolarHBondContact CA-OG1 3.45Å; I230-T233 PolarHBondContact O-OG1 2.57Å; I230-A234 WeakPolarHBondContact O-CB 3.41Å; I230-A234 PolarHBondContact O-N 3.1Å
231	S	95.2	Very high	92.7	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-67.2	-44.6	174.3	-59.8	0	0	0	0	111.7	R156 M163 T179 Y227 A228 A229 C235	R156-S231 WeakPolarHBondContact CB-OG 3.47Å; M163-S231 VanDerWaalsContact CE-O 3.23Å; M163-S231 WeakPolarHBondContact CE-O 3.5Å; T179-S231 WeakPolarHBondContact CG2-OG 3.37Å; T179-S231 PolarHBondContact OG1-O 2.89Å; Y227-S231 VanDerWaalsContact O-CB 3.3Å; Y227-S231 WeakPolarHBondContact O-CB 3.43Å; Y227-S231 PolarHBondContact O-N 2.93Å; Y227-S231 PolarHBondContact O-OG 3.19Å; A228-S231 WeakPolarHBondContact O-CB 3.44Å; A228-S231 PolarHBondContact O-N 3.2Å; A229-S231 VanDerWaalsContact C-N 3.27Å; A229-S231 PolarHBondContact O-N 2.56Å; S231-C235 VanDerWaalsContact O-CB 3.3Å; S231-C235 WeakPolarHBondContact O-CB 3.5Å; S231-C235 PolarHBondContact O-N 2.99Å
232	L	96.6	Very high	92.9	Very high	2 Å²	2	12 Å²	12	1%	0.01	6%	0.062	C	C	.	.	H	α-helix	trans	-67.9	-39.5	-179.4	-167.5	59	0	0	0	111.5	L137 I140 V159 F211 W214 M215 A228 A229 M236	L137-L232 HydrophobicContact CD1-CD1 4.04Å; L137-L232 HydrophobicContact CD1-CD2 3.95Å; L137-L232 HydrophobicContact CD1-CG 3.97Å; I140-L232 HydrophobicContact CB-CD1 4.45Å; I140-L232 HydrophobicContact CG2-CD1 3.78Å; V159-L232 HydrophobicContact CG1-CB 4.09Å; V159-L232 HydrophobicContact CG1-CD1 4.07Å; F211-L232 HydrophobicContact CD1-CB 4.34Å; F211-L232 HydrophobicContact CD1-CD2 4.14Å; F211-L232 HydrophobicContact CD1-CG 3.97Å; F211-L232 HydrophobicContact CE1-CG 4.1Å; W214-L232 HydrophobicContact CZ3-CD2 4.35Å; M215-L232 HydrophobicContact CE-CD2 4.22Å; M215-L232 HydrophobicContact CG-CD2 3.84Å; M215-L232 HydrophobicContact SD-CB 4.43Å; M215-L232 HydrophobicContact SD-CD2 3.76Å; A228-L232 PolarHBondContact O-N 3.13Å; A229-L232 PolarHBondContact O-N 3.23Å; A229-L232 VanDerWaalsContact O-N 3.14Å; L232-M236 WeakPolarHBondContact O-CG 3.45Å; L232-M236 PolarHBondContact O-N 3.09Å
233	T	96.9	Very high	93.2	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-65.8	-46.8	176.6	58.9	0	0	0	0	111.6	L204 V208 F211 A229 I230 C235 M236 E237	L204-T233 WeakPolarHBondContact CD1-OG1 3.45Å; V208-T233 HydrophobicContact CB-CG2 4.38Å; V208-T233 HydrophobicContact CG2-CG2 4.14Å; F211-T233 HydrophobicContact CB-CG2 3.3Å; F211-T233 HydrophobicContact CD1-CG2 3.8Å; F211-T233 HydrophobicContact CD2-CG2 3.46Å; F211-T233 VanDerWaalsContact CD2-CG2 3.46Å; F211-T233 HydrophobicContact CE1-CG2 4.41Å; F211-T233 HydrophobicContact CE2-CG2 4.13Å; F211-T233 HydrophobicContact CG-CG2 3.26Å; A229-T233 WeakPolarHBondContact O-CG2 3.26Å; A229-T233 PolarHBondContact O-N 3.39Å; A229-T233 PolarHBondContact O-OG1 2.77Å; I230-T233 WeakPolarHBondContact CA-OG1 3.45Å; I230-T233 PolarHBondContact O-OG1 2.57Å; T233-C235 VanDerWaalsContact C-N 3.33Å; T233-C235 PolarHBondContact O-N 3.29Å; T233-M236 PolarHBondContact O-N 3.4Å; T233-E237 WeakPolarHBondContact O-CB 3.43Å; T233-E237 PolarHBondContact O-N 3.38Å
234	A	96.8	Very high	93.4	Very high	2 Å²	2	8 Å²	8	2%	0.017	4%	0.038	C	C	.	.	H	α-helix	trans	-65.3	-36.4	179.3	0	0	0	0	0	111.9	A182 L204 I230 A238	A182-A234 HydrophobicContact CB-CB 3.91Å; L204-A234 HydrophobicContact CD1-CB 4.33Å; L204-A234 HydrophobicContact CD2-CB 4.28Å; I230-A234 WeakPolarHBondContact O-CB 3.41Å; I230-A234 PolarHBondContact O-N 3.1Å; A234-A238 WeakPolarHBondContact O-CB 3.34Å; A234-A238 PolarHBondContact O-N 3.22Å
235	C	96.6	Very high	93.4	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-64.9	-46.8	172.6	176.6	0	0	0	0	112.2	M163 C175 S231 T233 E237 A238 L239	M163-C235 HydrophobicContact CE-CB 3.61Å; M163-C235 HydrophobicContact CG-CB 4.28Å; M163-C235 HydrophobicContact SD-CB 3.85Å; C175-C235 HydrophobicContact CB-CB 4.11Å; C175-C235 VanDerWaalsContact SG-SG 3.68Å; S231-C235 VanDerWaalsContact O-CB 3.3Å; S231-C235 WeakPolarHBondContact O-CB 3.5Å; S231-C235 PolarHBondContact O-N 2.99Å; T233-C235 VanDerWaalsContact C-N 3.33Å; T233-C235 PolarHBondContact O-N 3.29Å; C235-E237 PolarHBondContact O-N 2.84Å; C235-A238 PolarHBondContact O-N 3.36Å; C235-L239 WeakPolarHBondContact O-CG 3.36Å; C235-L239 PolarHBondContact O-N 2.94Å
236	M	96.3	Very high	93.5	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-67.5	-35.3	178.9	-67.4	-50.6	-55.8	0	0	112.6	W94 L133 A136 L137 F206 F211 L232 T233 L239 V240	W94-M236 HydrophobicContact CH2-CE 3.85Å; W94-M236 HydrophobicContact CZ3-CE 3.98Å; W94-M236 HydrophobicContact CZ3-CG 4.34Å; L133-M236 HydrophobicContact CB-CE 3.84Å; L133-M236 HydrophobicContact CD2-CE 3.86Å; L133-M236 HydrophobicContact CG-CE 4.37Å; L133-M236 WeakPolarHBondContact O-CE 3.48Å; A136-M236 HydrophobicContact CB-CE 4.46Å; L137-M236 HydrophobicContact CB-CE 4.14Å; L137-M236 HydrophobicContact CB-SD 4.03Å; L137-M236 HydrophobicContact CD1-CG 3.93Å; L137-M236 HydrophobicContact CD1-SD 4.14Å; F206-M236 HydrophobicContact CD2-CB 4.49Å; F206-M236 HydrophobicContact CE2-CB 4.23Å; F211-M236 HydrophobicContact CE1-CB 4.14Å; F211-M236 HydrophobicContact CE1-CG 3.71Å; F211-M236 HydrophobicContact CZ-CB 3.81Å; F211-M236 HydrophobicContact CZ-CG 3.84Å; L232-M236 WeakPolarHBondContact O-CG 3.45Å; L232-M236 PolarHBondContact O-N 3.09Å; T233-M236 PolarHBondContact O-N 3.4Å; M236-L239 HydrophobicContact SD-CD1 4.14Å; M236-V240 WeakPolarHBondContact O-CG2 3.32Å; M236-V240 PolarHBondContact O-N 3.17Å
237	E	95.9	Very high	93.7	Very high	7 Å²	7	11.5 Å²	11.5	3%	0.033	5%	0.054	C	C	.	.	H	α-helix	trans	-66.6	-46.3	173.7	-168.6	151.1	163.2	0	0	111.1	I102 L204 S205 F206 T233 C235 L239 V240 E241	I102-E237 HydrophobicContact CD1-CG 3.83Å; I102-E237 HydrophobicContact CG1-CG 4.09Å; I102-E237 HydrophobicContact CG2-CG 4.32Å; L204-E237 HydrophobicContact CD2-CB 4.49Å; S205-E237 WeakPolarHBondContact CA-OE2 3.21Å; S205-E237 WeakPolarHBondContact CB-OE1 3.39Å; S205-E237 PolarHBondContact N-OE1 2.89Å; S205-E237 PolarHBondContact N-OE2 2.94Å; S205-E237 PolarHBondContact OG-OE1 3.25Å; F206-E237 HydrophobicContact CD2-CB 3.85Å; F206-E237 HydrophobicContact CD2-CG 4.45Å; F206-E237 HydrophobicContact CE2-CB 4.17Å; F206-E237 PolarHBondContact N-OE2 3.07Å; T233-E237 WeakPolarHBondContact O-CB 3.43Å; T233-E237 PolarHBondContact O-N 3.38Å; C235-E237 PolarHBondContact O-N 2.84Å; E237-L239 VanDerWaalsContact C-N 3.31Å; E237-L239 PolarHBondContact O-N 3.36Å; E237-V240 WeakPolarHBondContact O-CB 3.37Å; E237-V240 PolarHBondContact O-N 3.06Å; E237-E241 WeakPolarHBondContact O-CG 3.33Å; E237-E241 PolarHBondContact O-N 3.44Å
238	A	95.4	Very high	93.6	Very high	2 Å²	2	11.3 Å²	11.3	2%	0.017	5%	0.054	C	C	.	.	H	α-helix	trans	-61.8	-34.3	176.3	0	0	0	0	0	113.4	A178 A234 C235 E241 E242	A178-A238 HydrophobicContact CB-CB 3.75Å; A234-A238 WeakPolarHBondContact O-CB 3.34Å; A234-A238 PolarHBondContact O-N 3.22Å; C235-A238 PolarHBondContact O-N 3.36Å; A238-E241 PolarHBondContact O-N 2.71Å; A238-E242 WeakPolarHBondContact O-CB 3.35Å; A238-E242 PolarHBondContact O-N 3.31Å
239	L	95.3	Very high	93.2	Very high	5 Å²	5	17.5 Å²	17.5	3%	0.026	8%	0.084	C	C	.	.	H	α-helix	trans	-67.9	-33.8	172.3	-72.5	171.8	0	0	0	112.6	L133 A136 I140 L167 C235 M236 E237 I243	L133-L239 HydrophobicContact CD2-CB 4.04Å; A136-L239 HydrophobicContact CB-CD1 4.37Å; I140-L239 HydrophobicContact CD1-CD1 4.43Å; L167-L239 HydrophobicContact CD1-CD2 4.32Å; L167-L239 HydrophobicContact CD2-CD1 4.32Å; L167-L239 HydrophobicContact CD2-CD2 4.2Å; C235-L239 WeakPolarHBondContact O-CG 3.36Å; C235-L239 PolarHBondContact O-N 2.94Å; M236-L239 HydrophobicContact SD-CD1 4.14Å; E237-L239 VanDerWaalsContact C-N 3.31Å; E237-L239 PolarHBondContact O-N 3.36Å; L239-I243 WeakPolarHBondContact O-CB 3.49Å; L239-I243 WeakPolarHBondContact O-CD1 3.43Å; L239-I243 WeakPolarHBondContact O-CG1 3.47Å; L239-I243 PolarHBondContact O-N 2.98Å; L239-I243 VanDerWaalsContact O-N 3.17Å
240	V	95.3	Very high	92.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-66.5	-43.6	170.6	178.7	0	0	0	0	110.3	V99 I102 L103 L129 L133 F206 M236 E237 G244	V99-V240 HydrophobicContact CG1-CG1 4.28Å; I102-V240 HydrophobicContact CB-CG1 3.83Å; I102-V240 HydrophobicContact CD1-CB 4.47Å; I102-V240 HydrophobicContact CD1-CG1 4.4Å; I102-V240 HydrophobicContact CD1-CG2 4.42Å; I102-V240 HydrophobicContact CG2-CB 3.95Å; I102-V240 HydrophobicContact CG2-CG1 3.55Å; L103-V240 HydrophobicContact CD2-CG1 3.99Å; L103-V240 HydrophobicContact CG-CG1 3.97Å; L129-V240 HydrophobicContact CD2-CG1 4.12Å; L133-V240 HydrophobicContact CD1-CG2 3.41Å; L133-V240 VanDerWaalsContact CD1-CG2 3.41Å; F206-V240 HydrophobicContact CE2-CG2 4.08Å; F206-V240 HydrophobicContact CZ-CG2 3.95Å; M236-V240 WeakPolarHBondContact O-CG2 3.32Å; M236-V240 PolarHBondContact O-N 3.17Å; E237-V240 WeakPolarHBondContact O-CB 3.37Å; E237-V240 PolarHBondContact O-N 3.06Å; V240-G244 PolarHBondContact O-N 3.21Å
241	E	93.7	Very high	91.9	Very high	65 Å²	65	22.6 Å²	22.6	30%	0.304	11%	0.113	S	C	.	.	H	α-helix	trans	-62.3	-51.8	179.7	-67.4	-172.2	152.7	0	0	111.7	I102 V106 E237 A238 G244 L245	I102-E241 HydrophobicContact CG2-CG 3.63Å; V106-E241 HydrophobicContact CG2-CB 4.03Å; V106-E241 HydrophobicContact CG2-CG 3.83Å; E237-E241 WeakPolarHBondContact O-CG 3.33Å; E237-E241 PolarHBondContact O-N 3.44Å; A238-E241 PolarHBondContact O-N 2.71Å; E241-G244 PolarHBondContact O-N 2.88Å; E241-L245 WeakPolarHBondContact O-CG 3.45Å; E241-L245 PolarHBondContact O-N 2.8Å
242	E	92.1	Very high	90.8	Very high	38 Å²	38	28.9 Å²	28.9	18%	0.178	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-42.9	-178.4	-179.4	65.9	-176	0	0	112.8	L171 A238 G244 L245 R246	L171-E242 HydrophobicContact CD2-CG 3.67Å; A238-E242 WeakPolarHBondContact O-CB 3.35Å; A238-E242 PolarHBondContact O-N 3.31Å; E242-G244 VanDerWaalsContact C-N 3.34Å; E242-L245 PolarHBondContact O-N 2.79Å; E242-R246 WeakPolarHBondContact O-CG 3.36Å; E242-R246 PolarHBondContact O-N 3.32Å; E242-R246 IonicContact OE1-CZ 3.38Å; E242-R246 IonicContact OE1-NE 3.9Å; E242-R246 PolarHBondContact OE1-NE 3.22Å; E242-R246 IonicContact OE1-NH2 2.68Å; E242-R246 PolarHBondContact OE1-NH2 2.87Å
243	I	92.4	Very high	89	Confident	2 Å²	2	32 Å²	32	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-64.9	-41.4	175.2	-63.8	168.2	0	0	0	110.2	L129 L133 L239 L245 R246 V247 L271 L281 L285	L129-I243 HydrophobicContact CD1-CB 4.24Å; L129-I243 HydrophobicContact CD1-CD1 3.92Å; L129-I243 HydrophobicContact CD1-CG2 3.74Å; L133-I243 HydrophobicContact CD2-CD1 4.18Å; L239-I243 WeakPolarHBondContact O-CB 3.49Å; L239-I243 WeakPolarHBondContact O-CD1 3.43Å; L239-I243 WeakPolarHBondContact O-CG1 3.47Å; L239-I243 PolarHBondContact O-N 2.98Å; L239-I243 VanDerWaalsContact O-N 3.17Å; I243-L245 PolarHBondContact O-N 3.47Å; I243-R246 PolarHBondContact O-N 3.15Å; I243-V247 HydrophobicContact CG2-CG2 4.46Å; I243-V247 VanDerWaalsContact O-CG2 3.31Å; I243-V247 WeakPolarHBondContact O-CG2 3.39Å; I243-V247 PolarHBondContact O-N 2.65Å; I243-L271 HydrophobicContact CG2-CD1 3.81Å; I243-L281 HydrophobicContact CD1-CD2 4.08Å; I243-L281 HydrophobicContact CG1-CD1 3.92Å; I243-L281 HydrophobicContact CG1-CD2 3.69Å; I243-L281 HydrophobicContact CG1-CG 4.48Å; I243-L285 HydrophobicContact CD1-CD1 4.17Å
244	G	90.5	Very high	87	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-43.4	174.7	0	0	0	0	0	112.7	V240 E241 E242 L248	V240-G244 PolarHBondContact O-N 3.21Å; E241-G244 PolarHBondContact O-N 2.88Å; E242-G244 VanDerWaalsContact C-N 3.34Å; G244-L248 VanDerWaalsContact O-CG 3.31Å; G244-L248 WeakPolarHBondContact O-CG 3.33Å; G244-L248 PolarHBondContact O-N 2.96Å
245	L	89.9	Confident	84.9	Confident	54 Å²	54	42.8 Å²	42.8	28%	0.283	23%	0.226	S	C	.	.	H	α-helix	trans	-63.3	-49.3	176.2	-74	170.7	0	0	0	111.9	V106 E241 E242 I243 V247 L248 M249	V106-L245 HydrophobicContact CG1-CD2 3.82Å; V106-L245 HydrophobicContact CG1-CG 3.82Å; E241-L245 WeakPolarHBondContact O-CG 3.45Å; E241-L245 PolarHBondContact O-N 2.8Å; E242-L245 PolarHBondContact O-N 2.79Å; I243-L245 PolarHBondContact O-N 3.47Å; L245-V247 VanDerWaalsContact C-N 3.3Å; L245-V247 PolarHBondContact O-N 3.14Å; L245-L248 PolarHBondContact O-N 2.84Å; L245-M249 WeakPolarHBondContact O-CG 3.28Å; L245-M249 PolarHBondContact O-N 3.31Å
246	R	89.3	Confident	82.5	Confident	51 Å²	51	45.1 Å²	45.1	19%	0.192	25%	0.25	C	S	.	.	H	α-helix	trans	-59.7	-39.3	179.1	-69.7	-176.5	-169.3	-162	1.8	111.9	E242 I243 M249 A250 V274 D278 E280	E242-R246 WeakPolarHBondContact O-CG 3.36Å; E242-R246 PolarHBondContact O-N 3.32Å; E242-R246 IonicContact OE1-CZ 3.38Å; E242-R246 IonicContact OE1-NE 3.9Å; E242-R246 PolarHBondContact OE1-NE 3.22Å; E242-R246 IonicContact OE1-NH2 2.68Å; E242-R246 PolarHBondContact OE1-NH2 2.87Å; I243-R246 PolarHBondContact O-N 3.15Å; R246-M249 PolarHBondContact O-N 2.67Å; R246-A250 PolarHBondContact O-N 2.76Å; R246-V274 HydrophobicContact CB-CG1 4.26Å; R246-D278 VanDerWaalsContact CD-OD2 3.28Å; R246-D278 WeakPolarHBondContact CD-OD2 3.22Å; R246-D278 IonicContact CZ-OD2 3.08Å; R246-D278 IonicContact NE-OD2 3.65Å; R246-D278 IonicContact NH1-OD1 3.64Å; R246-D278 PolarHBondContact NH1-OD1 3.29Å; R246-D278 IonicContact NH1-OD2 2.98Å; R246-D278 PolarHBondContact NH1-OD2 3Å; R246-E280 IonicContact CZ-OE2 3.75Å; R246-E280 IonicContact NH1-OE2 3.81Å; R246-E280 PolarHBondContact NH1-OE2 2.94Å; R246-E280 IonicContact NH2-OE2 3.6Å; R246-E280 PolarHBondContact NH2-OE2 2.98Å
247	V	90	Very high	80.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-66.9	-45	175.3	175.6	0	0	0	0	112.2	F121 I243 L245 M249 A250 E251 V266 L271 V274	F121-V247 HydrophobicContact CE1-CG1 4.24Å; I243-V247 HydrophobicContact CG2-CG2 4.46Å; I243-V247 VanDerWaalsContact O-CG2 3.31Å; I243-V247 WeakPolarHBondContact O-CG2 3.39Å; I243-V247 PolarHBondContact O-N 2.65Å; L245-V247 VanDerWaalsContact C-N 3.3Å; L245-V247 PolarHBondContact O-N 3.14Å; V247-M249 VanDerWaalsContact C-N 3.29Å; V247-M249 PolarHBondContact O-N 3.3Å; V247-A250 PolarHBondContact O-N 3Å; V247-E251 PolarHBondContact O-N 2.79Å; V247-V266 HydrophobicContact CG1-CG1 3.54Å; V247-L271 HydrophobicContact CG2-CD1 3.86Å; V247-V274 HydrophobicContact CG2-CB 3.95Å; V247-V274 HydrophobicContact CG2-CG1 3.97Å; V247-V274 HydrophobicContact CG2-CG2 4.18Å
248	L	86.4	Confident	77.5	Confident	9 Å²	9	58 Å²	58	5%	0.047	34%	0.335	C	S	.	.	H	α-helix	trans	-65.5	-30.8	177.3	-69.8	174.1	0	0	0	113.1	V106 A107 S119 F121 G244 L245 R252 V266	V106-L248 HydrophobicContact CG1-CD1 4.04Å; A107-L248 HydrophobicContact CB-CD1 4.23Å; S119-L248 VanDerWaalsContact OG-CD2 3.27Å; S119-L248 WeakPolarHBondContact OG-CD2 3.43Å; F121-L248 HydrophobicContact CE2-CD1 4.23Å; F121-L248 HydrophobicContact CE2-CD2 4.12Å; F121-L248 HydrophobicContact CE2-CG 4.21Å; F121-L248 HydrophobicContact CZ-CD1 4.35Å; F121-L248 HydrophobicContact CZ-CD2 4.09Å; F121-L248 HydrophobicContact CZ-CG 3.95Å; G244-L248 VanDerWaalsContact O-CG 3.31Å; G244-L248 WeakPolarHBondContact O-CG 3.33Å; G244-L248 PolarHBondContact O-N 2.96Å; L245-L248 PolarHBondContact O-N 2.84Å; L248-R252 WeakPolarHBondContact O-CD 3.23Å; L248-R252 VanDerWaalsContact O-CG 3.27Å; L248-R252 WeakPolarHBondContact O-CG 3.26Å; L248-R252 PolarHBondContact O-N 3.21Å; L248-V266 HydrophobicContact CD2-CG2 4.12Å
249	M	84.1	Confident	74.9	Confident	129 Å²	129	61.6 Å²	61.6	64%	0.635	36%	0.36	S	S	*	.	H	α-helix	trans	-69.8	-41.7	171.9	-70.6	-177.1	-174.4	0	0	111.9	L245 R246 V247 R252 G253	L245-M249 WeakPolarHBondContact O-CG 3.28Å; L245-M249 PolarHBondContact O-N 3.31Å; R246-M249 PolarHBondContact O-N 2.67Å; V247-M249 VanDerWaalsContact C-N 3.29Å; V247-M249 PolarHBondContact O-N 3.3Å; M249-R252 PolarHBondContact O-N 2.7Å; M249-G253 PolarHBondContact O-N 3.19Å; M249-G253 VanDerWaalsContact O-N 3.13Å
250	A	83.6	Confident	72.6	Confident	28 Å²	28	65.7 Å²	65.7	23%	0.231	40%	0.403	C	S	.	.	H	α-helix	trans	-62.4	-46.6	177.8	0	0	0	0	0	112.3	R246 V247 R252 G253 H254 V274	R246-A250 PolarHBondContact O-N 2.76Å; V247-A250 PolarHBondContact O-N 3Å; A250-R252 PolarHBondContact O-N 3.12Å; A250-G253 PolarHBondContact O-N 3.35Å; A250-G253 VanDerWaalsContact O-N 3.1Å; A250-H254 PolarHBondContact O-N 2.95Å; A250-H254 PolarHBondContact O-ND1 3.05Å; A250-V274 HydrophobicContact CB-CG2 3.48Å; A250-V274 VanDerWaalsContact CB-CG2 3.48Å
251	E	77.1	Confident	70.1	Confident	80 Å²	80	70.8 Å²	70.8	37%	0.374	44%	0.438	S	S	.	.	H	α-helix	trans	-58	-46.4	176.5	-73.8	-64.9	116.5	0	0	111.8	V247 G253 H254 S255 A270	V247-E251 PolarHBondContact O-N 2.79Å; E251-G253 PolarHBondContact O-N 3.2Å; E251-H254 PolarHBondContact O-N 3.49Å; E251-S255 PolarHBondContact O-N 3.13Å; E251-S255 PolarHBondContact O-OG 2.85Å; E251-A270 WeakPolarHBondContact OE1-CB 3.35Å
252	R	72.2	Confident	67.9	Low	132 Å²	132	70.8 Å²	70.8	50%	0.498	46%	0.456	S	S	.	.	H	α-helix	trans	-61	-28.4	176.4	-74.6	172.7	175.7	-178.7	-1.7	113.6	G110 G111 L248 M249 A250 S255	G110-R252 VanDerWaalsContact O-CZ 3.31Å; G110-R252 PolarHBondContact O-NH1 2.91Å; G110-R252 PolarHBondContact O-NH2 2.78Å; G111-R252 PolarHBondContact O-NH2 3.12Å; L248-R252 WeakPolarHBondContact O-CD 3.23Å; L248-R252 VanDerWaalsContact O-CG 3.27Å; L248-R252 WeakPolarHBondContact O-CG 3.26Å; L248-R252 PolarHBondContact O-N 3.21Å; M249-R252 PolarHBondContact O-N 2.7Å; A250-R252 PolarHBondContact O-N 3.12Å; R252-S255 WeakPolarHBondContact CA-OG 3.29Å; R252-S255 PolarHBondContact O-OG 3.17Å
253	G	60.3	Low	66.1	Low	67 Å²	67	72.4 Å²	72.4	69%	0.691	47%	0.47	S	S	*	.	H	α-helix	trans	-74.2	-25.8	174.6	0	0	0	0	0	114	M249 A250 E251	M249-G253 PolarHBondContact O-N 3.19Å; M249-G253 VanDerWaalsContact O-N 3.13Å; A250-G253 PolarHBondContact O-N 3.35Å; A250-G253 VanDerWaalsContact O-N 3.1Å; E251-G253 PolarHBondContact O-N 3.2Å
254	H	55	Low	64.8	Low	160 Å²	160	75.8 Å²	75.8	74%	0.741	50%	0.499	S	S	*	.	H	α-helix	trans	-90.3	-27.6	177.5	-67.9	82.5	0	0	0	112.5	A250 E251 G256	A250-H254 PolarHBondContact O-N 2.95Å; A250-H254 PolarHBondContact O-ND1 3.05Å; E251-H254 PolarHBondContact O-N 3.49Å; H254-G256 PolarHBondContact O-N 3.49Å
255	S	52.3	Low	64.2	Low	69 Å²	69	79.2 Å²	79.2	48%	0.483	52%	0.521	S	S	.	.	S	Bend	trans	-74.2	84.2	174	64	0	0	0	0	112	E251 R252	E251-S255 PolarHBondContact O-N 3.13Å; E251-S255 PolarHBondContact O-OG 2.85Å; R252-S255 WeakPolarHBondContact CA-OG 3.29Å; R252-S255 PolarHBondContact O-OG 3.17Å
256	G	45.3	Very low	63.8	Low	49 Å²	49	76.9 Å²	76.9	51%	0.505	51%	0.509	S	S	.	.			trans	-57.2	150.3	168.9	0	0	0	0	0	112.5	H254 D258 S259	H254-G256 PolarHBondContact O-N 3.49Å; G256-D258 PolarHBondContact O-N 2.87Å; G256-S259 PolarHBondContact O-N 3.33Å; G256-S259 PolarHBondContact O-OG 2.91Å; G256-S259 VanDerWaalsContact O-OG 3.06Å
257	A	45.3	Very low	63.8	Low	109 Å²	109	77.2 Å²	77.2	90%	0.901	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-12.9	-163.1	0	0	0	0	0	117
258	D	41.9	Very low	63.7	Low	169 Å²	169	77.6 Å²	77.6	90%	0.904	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	8	-174.1	-69.2	-47.1	0	0	0	114.7	G256 G260	G256-D258 PolarHBondContact O-N 2.87Å; D258-G260 PolarHBondContact O-N 3.47Å
259	S	42	Very low	63.8	Low	77 Å²	77	83.4 Å²	83.4	54%	0.538	55%	0.547	S	S	.	.			trans	-95.3	80.2	-178.2	55.4	0	0	0	0	113.4	G256 S261	G256-S259 PolarHBondContact O-N 3.33Å; G256-S259 PolarHBondContact O-OG 2.91Å; G256-S259 VanDerWaalsContact O-OG 3.06Å; S259-S261 PolarHBondContact O-N 2.92Å
260	G	46	Very low	63.9	Low	90 Å²	90	77.9 Å²	77.9	93%	0.928	52%	0.522	S	S	*	.			trans	-69.9	38.3	174.5	0	0	0	0	0	115.7	D258	D258-G260 PolarHBondContact O-N 3.47Å
261	S	42.4	Very low	64.3	Low	108 Å²	108	76.8 Å²	76.8	76%	0.755	51%	0.512	S	S	*	.			trans	-91.5	152.2	177.4	-165.8	0	0	0	0	111.2	S259	S259-S261 PolarHBondContact O-N 2.92Å
262	G	48.1	Very low	64.9	Low	65 Å²	65	76.1 Å²	76.1	67%	0.67	51%	0.508	S	S	*	.			trans	-61.3	145.9	176.7	0	0	0	0	0	112	A264	G262-A264 PolarHBondContact O-N 3.35Å
263	C	54.1	Low	65.7	Low	71 Å²	71	72.1 Å²	72.1	48%	0.48	50%	0.504	S	S	.	.			trans	-58.3	106	-175.5	-169.9	0	0	0	0	111.2
264	A	65.4	Low	67.1	Low	74 Å²	74	70.1 Å²	70.1	61%	0.612	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-68.6	142.1	176.8	0	0	0	0	0	110	G262	G262-A264 PolarHBondContact O-N 3.35Å
265	P	76.8	Confident	68.7	Low	73 Å²	73	62.7 Å²	62.7	47%	0.474	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-70.3	138.6	177	29.5	-34.1	0	0	0	110.5	V120 T267	V120-P265 CarbonylContact O-C 3.54Å; V120-P265 WeakPolarHBondContact O-CA 3.37Å; V120-P265 WeakPolarHBondContact O-CB 3.3Å; P265-T267 WeakPolarHBondContact O-CG2 3.45Å; P265-T267 PolarHBondContact O-N 3.32Å
266	V	82.3	Confident	70.4	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.024	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-60.6	121.9	-179.4	-178.1	0	0	0	0	109.3	V120 F121 S122 V247 L248 A270	V120-V266 PolarHBondContact O-N 3.23Å; F121-V266 HydrophobicContact CD1-CB 3.8Å; F121-V266 HydrophobicContact CD1-CG1 3.86Å; F121-V266 HydrophobicContact CD1-CG2 4.31Å; F121-V266 HydrophobicContact CE1-CB 4.1Å; F121-V266 HydrophobicContact CE1-CG1 3.84Å; F121-V266 HydrophobicContact CE1-CG2 4.29Å; F121-V266 HydrophobicContact CG-CB 4.22Å; F121-V266 HydrophobicContact CZ-CG2 4.49Å; S122-V266 VanDerWaalsContact CB-O 3.28Å; S122-V266 WeakPolarHBondContact CB-O 3.27Å; S122-V266 PolarHBondContact N-O 2.98Å; S122-V266 PolarHBondContact OG-O 2.87Å; V247-V266 HydrophobicContact CG1-CG1 3.54Å; L248-V266 HydrophobicContact CD2-CG2 4.12Å; V266-A270 HydrophobicContact CG1-CB 4.4Å
267	T	88.4	Confident	72.4	Confident	59 Å²	59	64.6 Å²	64.6	36%	0.362	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-87.1	169.8	-173.4	85.1	0	0	0	0	112.1	P265 E269 A270 L271	P265-T267 WeakPolarHBondContact O-CG2 3.45Å; P265-T267 PolarHBondContact O-N 3.32Å; T267-E269 VanDerWaalsContact C-N 3.33Å; T267-E269 WeakPolarHBondContact CB-OE2 3.34Å; T267-E269 PolarHBondContact OG1-N 2.89Å; T267-E269 PolarHBondContact OG1-OE2 3.48Å; T267-A270 PolarHBondContact OG1-N 2.88Å; T267-L271 PolarHBondContact O-N 3.05Å
268	A	88.5	Confident	74.4	Confident	7 Å²	7	60.8 Å²	60.8	6%	0.058	40%	0.402	C	S	.	.	H	α-helix	trans	-69.5	-34.8	177.2	0	0	0	0	0	111.8	E124 R128 L271 E272	E124-A268 HydrophobicContact CG-CB 4.04Å; R128-A268 HydrophobicContact CG-CB 4.09Å; A268-L271 PolarHBondContact O-N 3.21Å; A268-E272 WeakPolarHBondContact O-CG 3.13Å; A268-E272 PolarHBondContact O-N 3.03Å
269	E	88.2	Confident	76.3	Confident	132 Å²	132	53.3 Å²	53.3	62%	0.617	36%	0.363	S	S	*	.	H	α-helix	trans	-67.6	-38.8	-179.4	-54.8	74.9	-164.7	0	0	111.3	T267 E272 A273	T267-E269 VanDerWaalsContact C-N 3.33Å; T267-E269 WeakPolarHBondContact CB-OE2 3.34Å; T267-E269 PolarHBondContact OG1-N 2.89Å; T267-E269 PolarHBondContact OG1-OE2 3.48Å; E269-E272 PolarHBondContact O-N 2.99Å; E269-A273 WeakPolarHBondContact O-CB 3.46Å; E269-A273 PolarHBondContact O-N 3.32Å
270	A	87.4	Confident	78.4	Confident	13 Å²	13	50.7 Å²	50.7	11%	0.107	34%	0.343	C	S	.	.	H	α-helix	trans	-62.2	-45.1	173.7	0	0	0	0	0	112	E251 V266 T267 A273 V274	E251-A270 WeakPolarHBondContact OE1-CB 3.35Å; V266-A270 HydrophobicContact CG1-CB 4.4Å; T267-A270 PolarHBondContact OG1-N 2.88Å; A270-A273 PolarHBondContact O-N 3.41Å; A270-V274 WeakPolarHBondContact O-CG2 3.34Å; A270-V274 PolarHBondContact O-N 3.41Å; A270-V274 VanDerWaalsContact O-N 3.08Å
271	L	90.7	Very high	80.4	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-60.5	-50	174.3	168.6	66.2	0	0	0	111.8	A125 R128 L129 I243 V247 T267 A268 A273 V274 V275	A125-L271 HydrophobicContact CB-CD2 4.46Å; A125-L271 VanDerWaalsContact O-CD2 3.32Å; A125-L271 WeakPolarHBondContact O-CD2 3.29Å; R128-L271 HydrophobicContact CB-CD2 4.03Å; L129-L271 HydrophobicContact CB-CD2 3.83Å; L129-L271 HydrophobicContact CD1-CD1 4.32Å; I243-L271 HydrophobicContact CG2-CD1 3.81Å; V247-L271 HydrophobicContact CG2-CD1 3.86Å; T267-L271 PolarHBondContact O-N 3.05Å; A268-L271 PolarHBondContact O-N 3.21Å; L271-A273 VanDerWaalsContact C-N 3.33Å; L271-A273 PolarHBondContact O-N 2.69Å; L271-V274 PolarHBondContact O-N 2.96Å; L271-V275 HydrophobicContact CD1-CG2 4.17Å; L271-V275 WeakPolarHBondContact O-CG2 3.47Å; L271-V275 PolarHBondContact O-N 3.41Å
272	E	89.6	Confident	82.6	Confident	66 Å²	66	42.7 Å²	42.7	31%	0.308	27%	0.268	S	S	.	.	H	α-helix	trans	-65.3	-35.8	179.9	-71.9	-177.5	-173.1	0	0	111.4	R128 A268 E269 V275 N276	R128-E272 WeakPolarHBondContact CD-OE1 3.31Å; R128-E272 IonicContact CZ-OE1 2.94Å; R128-E272 IonicContact NE-OE1 3.16Å; R128-E272 IonicContact NH1-OE1 3.65Å; R128-E272 PolarHBondContact NH1-OE1 2.9Å; A268-E272 WeakPolarHBondContact O-CG 3.13Å; A268-E272 PolarHBondContact O-N 3.03Å; E269-E272 PolarHBondContact O-N 2.99Å; E272-V275 PolarHBondContact O-N 2.84Å; E272-N276 VanDerWaalsContact O-CB 3.25Å; E272-N276 WeakPolarHBondContact O-CB 3.07Å; E272-N276 PolarHBondContact O-N 3.18Å; E272-N276 PolarHBondContact O-ND2 2.94Å
273	A	89.1	Confident	84.3	Confident	48 Å²	48	39.7 Å²	39.7	40%	0.397	24%	0.237	S	C	.	.	H	α-helix	trans	-64.6	-41	175.1	0	0	0	0	0	112.9	E269 A270 L271 N277	E269-A273 WeakPolarHBondContact O-CB 3.46Å; E269-A273 PolarHBondContact O-N 3.32Å; A270-A273 PolarHBondContact O-N 3.41Å; L271-A273 VanDerWaalsContact C-N 3.33Å; L271-A273 PolarHBondContact O-N 2.69Å; A273-N277 PolarHBondContact O-N 2.92Å; A273-N277 PolarHBondContact O-ND2 2.94Å
274	V	90.1	Very high	85.9	Confident	25 Å²	25	36.7 Å²	36.7	15%	0.152	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-48.5	175.5	171.3	0	0	0	0	110.6	R246 V247 A250 A270 L271 N276 N277 D278	R246-V274 HydrophobicContact CB-CG1 4.26Å; V247-V274 HydrophobicContact CG2-CB 3.95Å; V247-V274 HydrophobicContact CG2-CG1 3.97Å; V247-V274 HydrophobicContact CG2-CG2 4.18Å; A250-V274 HydrophobicContact CB-CG2 3.48Å; A250-V274 VanDerWaalsContact CB-CG2 3.48Å; A270-V274 WeakPolarHBondContact O-CG2 3.34Å; A270-V274 PolarHBondContact O-N 3.41Å; A270-V274 VanDerWaalsContact O-N 3.08Å; L271-V274 PolarHBondContact O-N 2.96Å; V274-N276 VanDerWaalsContact C-N 3.25Å; V274-N276 PolarHBondContact O-N 2.7Å; V274-N277 PolarHBondContact O-N 3.49Å; V274-D278 WeakPolarHBondContact O-CB 3.49Å; V274-D278 PolarHBondContact O-N 3.23Å
275	V	89.4	Confident	87.1	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.024	19%	0.188	C	C	.	.	H	α-helix	trans	-61.1	-31.8	177.8	169.4	0	0	0	0	112.5	L132 L271 E272 W282 L285	L132-V275 HydrophobicContact CD1-CG1 4.34Å; L132-V275 HydrophobicContact CD1-CG2 4.27Å; L271-V275 HydrophobicContact CD1-CG2 4.17Å; L271-V275 WeakPolarHBondContact O-CG2 3.47Å; L271-V275 PolarHBondContact O-N 3.41Å; E272-V275 PolarHBondContact O-N 2.84Å; V275-W282 WeakPolarHBondContact O-CA 3.48Å; V275-W282 VanDerWaalsContact O-CB 3.25Å; V275-W282 WeakPolarHBondContact O-CB 3.31Å; V275-L285 HydrophobicContact CG1-CB 4.44Å; V275-L285 HydrophobicContact CG1-CD1 3.81Å; V275-L285 HydrophobicContact CG2-CD1 4.18Å
276	N	88.4	Confident	87.6	Confident	62 Å²	62	31.1 Å²	31.1	33%	0.332	17%	0.172	S	C	.	.	H	α-helix	trans	-78.5	-28.3	178.5	-76.2	-34.4	0	0	0	114.1	E272 V274 W282 A297	E272-N276 VanDerWaalsContact O-CB 3.25Å; E272-N276 WeakPolarHBondContact O-CB 3.07Å; E272-N276 PolarHBondContact O-N 3.18Å; E272-N276 PolarHBondContact O-ND2 2.94Å; V274-N276 VanDerWaalsContact C-N 3.25Å; V274-N276 PolarHBondContact O-N 2.7Å; N276-W282 VanDerWaalsContact OD1-CD1 3.31Å; N276-W282 PolarHBondContact OD1-NE1 3.1Å; N276-A297 HydrophobicContact CB-CB 3.86Å; N276-A297 WeakPolarHBondContact O-CB 3.34Å; N276-A297 PolarHBondContact O-N 3.23Å
277	N	86.6	Confident	87.6	Confident	97 Å²	97	34.4 Å²	34.4	52%	0.519	19%	0.187	S	C	.	.	H	α-helix	trans	-88.3	-24.7	178.5	-74.1	-64.8	0	0	0	113.3	A273 V274 N296	A273-N277 PolarHBondContact O-N 2.92Å; A273-N277 PolarHBondContact O-ND2 2.94Å; V274-N277 PolarHBondContact O-N 3.49Å; N277-N296 VanDerWaalsContact O-CB 3.23Å; N277-N296 WeakPolarHBondContact O-CB 3.48Å; N277-N296 PolarHBondContact O-ND2 3.49Å
278	D	86	Confident	87.3	Confident	29 Å²	29	33.3 Å²	33.3	16%	0.155	18%	0.176	C	C	.	.			trans	-81.3	115.5	179.8	-173.4	-38.7	0	0	0	112.3	R246 V274 E280 L281 W282	R246-D278 VanDerWaalsContact CD-OD2 3.28Å; R246-D278 WeakPolarHBondContact CD-OD2 3.22Å; R246-D278 IonicContact CZ-OD2 3.08Å; R246-D278 IonicContact NE-OD2 3.65Å; R246-D278 IonicContact NH1-OD1 3.64Å; R246-D278 PolarHBondContact NH1-OD1 3.29Å; R246-D278 IonicContact NH1-OD2 2.98Å; R246-D278 PolarHBondContact NH1-OD2 3Å; V274-D278 WeakPolarHBondContact O-CB 3.49Å; V274-D278 PolarHBondContact O-N 3.23Å; D278-E280 VanDerWaalsContact C-N 3.34Å; D278-E280 PolarHBondContact O-N 3.09Å; D278-E280 WeakPolarHBondContact OD1-CA 3.4Å; D278-E280 WeakPolarHBondContact OD1-CB 3.46Å; D278-E280 PolarHBondContact OD1-N 2.73Å; D278-L281 HydrophobicContact CB-CB 4.12Å; D278-L281 HydrophobicContact CB-CD1 4.17Å; D278-L281 HydrophobicContact CB-CG 4.3Å; D278-L281 PolarHBondContact O-N 3Å; D278-L281 PolarHBondContact OD1-N 3.07Å; D278-L281 WeakPolarHBondContact OD2-CD1 3.28Å; D278-W282 WeakPolarHBondContact O-CB 3.26Å; D278-W282 PolarHBondContact O-N 3.08Å
279	A	82.4	Confident	86.8	Confident	12 Å²	12	36.7 Å²	36.7	10%	0.099	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-15.3	-178.4	0	0	0	0	0	115.2	K295 N296 S302	A279-K295 WeakPolarHBondContact CA-O 3.34Å; A279-K295 VanDerWaalsContact CB-C 3.47Å; A279-N296 HydrophobicContact CB-CB 4.4Å; A279-S302 WeakPolarHBondContact CB-OG 3.33Å
280	E	85.8	Confident	86.4	Confident	22 Å²	22	31.4 Å²	31.4	10%	0.103	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-35.8	173.4	-55.9	-170.8	145.4	0	0	111.1	S168 A170 L171 R246 D278 P304	S168-E280 VanDerWaalsContact OG-CD 3.3Å; S168-E280 PolarHBondContact OG-OE1 3.01Å; A170-E280 WeakPolarHBondContact CB-OE1 3.33Å; L171-E280 HydrophobicContact CD1-CB 3.85Å; L171-E280 HydrophobicContact CG-CB 4.44Å; R246-E280 IonicContact CZ-OE2 3.75Å; R246-E280 IonicContact NH1-OE2 3.81Å; R246-E280 PolarHBondContact NH1-OE2 2.94Å; R246-E280 IonicContact NH2-OE2 3.6Å; R246-E280 PolarHBondContact NH2-OE2 2.98Å; D278-E280 VanDerWaalsContact C-N 3.34Å; D278-E280 PolarHBondContact O-N 3.09Å; D278-E280 WeakPolarHBondContact OD1-CA 3.4Å; D278-E280 WeakPolarHBondContact OD1-CB 3.46Å; D278-E280 PolarHBondContact OD1-N 2.73Å; E280-P304 WeakPolarHBondContact OE1-CB 3.46Å
281	L	89.2	Confident	86.3	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.021	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-44.8	-178.8	-65.2	178.1	0	0	0	113.3	L171 I243 D278 G283 V284 L285	L171-L281 HydrophobicContact CD1-CD2 3.91Å; L171-L281 HydrophobicContact CD2-CD2 4.47Å; I243-L281 HydrophobicContact CD1-CD2 4.08Å; I243-L281 HydrophobicContact CG1-CD1 3.92Å; I243-L281 HydrophobicContact CG1-CD2 3.69Å; I243-L281 HydrophobicContact CG1-CG 4.48Å; D278-L281 HydrophobicContact CB-CB 4.12Å; D278-L281 HydrophobicContact CB-CD1 4.17Å; D278-L281 HydrophobicContact CB-CG 4.3Å; D278-L281 PolarHBondContact O-N 3Å; D278-L281 PolarHBondContact OD1-N 3.07Å; D278-L281 WeakPolarHBondContact OD2-CD1 3.28Å; L281-G283 PolarHBondContact O-N 2.66Å; L281-V284 PolarHBondContact O-N 3.37Å; L281-L285 HydrophobicContact CB-CD1 4.37Å; L281-L285 WeakPolarHBondContact O-CG 3.47Å; L281-L285 PolarHBondContact O-N 3.3Å
282	W	87.8	Confident	85.8	Confident	26 Å²	26	31.2 Å²	31.2	10%	0.098	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-52.1	-166.7	-178.3	66.9	0	0	0	112.7	V275 N276 D278 L285 Q286 I292 K295 A297	V275-W282 WeakPolarHBondContact O-CA 3.48Å; V275-W282 VanDerWaalsContact O-CB 3.25Å; V275-W282 WeakPolarHBondContact O-CB 3.31Å; N276-W282 VanDerWaalsContact OD1-CD1 3.31Å; N276-W282 PolarHBondContact OD1-NE1 3.1Å; D278-W282 WeakPolarHBondContact O-CB 3.26Å; D278-W282 PolarHBondContact O-N 3.08Å; W282-L285 PolarHBondContact O-N 2.88Å; W282-Q286 VanDerWaalsContact CD1-NE2 3.31Å; W282-Q286 HydrophobicContact CD2-CG 4.32Å; W282-Q286 HydrophobicContact CZ2-CG 4.18Å; W282-Q286 VanDerWaalsContact NE1-NE2 3.13Å; W282-Q286 WeakPolarHBondContact O-CG 3.34Å; W282-Q286 PolarHBondContact O-N 3.21Å; W282-Q286 PolarHBondContact O-NE2 2.82Å; W282-I292 HydrophobicContact CE3-CG2 4.03Å; W282-I292 HydrophobicContact CZ3-CD1 4.46Å; W282-I292 HydrophobicContact CZ3-CG2 3.75Å; W282-K295 HydrophobicContact CZ3-CD 4.2Å; W282-K295 HydrophobicContact CZ3-CG 4.39Å; W282-A297 HydrophobicContact CD2-CB 4.29Å; W282-A297 HydrophobicContact CG-CB 4.41Å; W282-A297 HydrophobicContact CZ2-CB 4.21Å
283	G	83.2	Confident	85.2	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.01	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-37.8	-172.7	0	0	0	0	0	114.4	L281 L285 Q286 I292	L281-G283 PolarHBondContact O-N 2.66Å; G283-L285 VanDerWaalsContact C-N 3.27Å; G283-L285 PolarHBondContact O-N 3.24Å; G283-Q286 PolarHBondContact O-N 3.08Å; G283-I292 CarbonylContact C-O 3.55Å; G283-I292 VanDerWaalsContact CA-O 3.24Å; G283-I292 WeakPolarHBondContact CA-O 3.33Å
284	V	89	Confident	84.5	Confident	9 Å²	9	26.8 Å²	26.8	6%	0.055	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-39.1	173.9	-179.2	0	0	0	0	110.5	A136 R139 V166 L167 L281 Q286 L291	A136-V284 HydrophobicContact CB-CG1 4.05Å; R139-V284 WeakPolarHBondContact CD-O 3.49Å; R139-V284 PolarHBondContact NE-O 2.75Å; V166-V284 HydrophobicContact CG1-CG1 4.12Å; L167-V284 HydrophobicContact CD2-CG1 4.02Å; L167-V284 HydrophobicContact CD2-CG2 4.4Å; L281-V284 PolarHBondContact O-N 3.37Å; V284-Q286 VanDerWaalsContact C-N 3.31Å; V284-Q286 PolarHBondContact O-N 2.78Å; V284-L291 HydrophobicContact CG2-CD1 4.47Å
285	L	89.9	Confident	83.8	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.021	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	7.7	-176.6	-58.3	177.3	0	0	0	113.7	L132 R135 A136 I243 V275 L281 W282 G283	L132-L285 HydrophobicContact CB-CD1 4.32Å; L132-L285 HydrophobicContact CB-CD2 4.21Å; L132-L285 HydrophobicContact CD1-CD1 4.4Å; R135-L285 WeakPolarHBondContact CD-O 3.29Å; R135-L285 PolarHBondContact NH1-O 3.5Å; A136-L285 HydrophobicContact CB-CD2 4.07Å; I243-L285 HydrophobicContact CD1-CD1 4.17Å; V275-L285 HydrophobicContact CG1-CB 4.44Å; V275-L285 HydrophobicContact CG1-CD1 3.81Å; V275-L285 HydrophobicContact CG2-CD1 4.18Å; L281-L285 HydrophobicContact CB-CD1 4.37Å; L281-L285 WeakPolarHBondContact O-CG 3.47Å; L281-L285 PolarHBondContact O-N 3.3Å; W282-L285 PolarHBondContact O-N 2.88Å; G283-L285 VanDerWaalsContact C-N 3.27Å; G283-L285 PolarHBondContact O-N 3.24Å
286	Q	87.3	Confident	83.5	Confident	26 Å²	26	26.9 Å²	26.9	12%	0.121	14%	0.136	C	C	.	.	S	Bend	trans	-79.2	159.4	172.7	-67.6	-40.8	-59.4	0	0	114	R139 W282 G283 V284 Y288 I292	R139-Q286 PolarHBondContact NH2-O 3.34Å; W282-Q286 VanDerWaalsContact CD1-NE2 3.31Å; W282-Q286 HydrophobicContact CD2-CG 4.32Å; W282-Q286 HydrophobicContact CZ2-CG 4.18Å; W282-Q286 VanDerWaalsContact NE1-NE2 3.13Å; W282-Q286 WeakPolarHBondContact O-CG 3.34Å; W282-Q286 PolarHBondContact O-N 3.21Å; W282-Q286 PolarHBondContact O-NE2 2.82Å; G283-Q286 PolarHBondContact O-N 3.08Å; V284-Q286 VanDerWaalsContact C-N 3.31Å; V284-Q286 PolarHBondContact O-N 2.78Å; Q286-Y288 VanDerWaalsContact C-N 3.35Å; Q286-Y288 HydrophobicContact CB-CD2 3.86Å; Q286-Y288 HydrophobicContact CB-CE2 4.11Å; Q286-Y288 HydrophobicContact CG-CE2 4.44Å; Q286-Y288 PolarHBondContact O-N 3.44Å; Q286-I292 HydrophobicContact CB-CD1 4.41Å; Q286-I292 HydrophobicContact CG-CD1 4.26Å
287	H	83.5	Confident	83.1	Confident	73 Å²	73	25.9 Å²	25.9	34%	0.338	14%	0.136	S	C	.	.	S	Bend	trans	-75.2	-13	-177.8	-60.7	96.5	0	0	0	115.1	R85 L86 R135	R85-H287 CarbonylContact C-O 3.53Å; R85-H287 VanDerWaalsContact CA-O 3.28Å; R85-H287 WeakPolarHBondContact CA-O 3.31Å; L86-H287 PolarHBondContact N-O 2.98Å; R135-H287 VanDerWaalsContact CZ-NE2 3.26Å; R135-H287 PolarHBondContact NH2-CE1 3.01Å; R135-H287 PolarHBondContact NH2-NE2 2.91Å
288	Y	81.6	Confident	82.6	Confident	36 Å²	36	26.6 Å²	26.6	14%	0.141	14%	0.14	C	C	.	.	B	Isolated β-bridge	trans	-79.9	149.4	-169.8	-48.3	-66.2	0	0	0	112.8	F80 C83 R139 Q286 H290 I292	F80-Y288 HydrophobicContact CB-CE1 3.69Å; F80-Y288 WeakPolarHBondContact CB-OH 3.37Å; F80-Y288 HydrophobicContact CD1-CD1 4.09Å; F80-Y288 HydrophobicContact CD1-CD2 4.01Å; F80-Y288 AromaticContact CD1-CE1 3.75Å; F80-Y288 HydrophobicContact CD1-CE1 3.75Å; F80-Y288 AromaticContact CD1-CE2 3.66Å; F80-Y288 HydrophobicContact CD1-CE2 3.66Å; F80-Y288 HydrophobicContact CD1-CG 4.22Å; F80-Y288 AromaticContact CD1-CZ 3.53Å; F80-Y288 HydrophobicContact CE1-CD2 4.19Å; F80-Y288 HydrophobicContact CE1-CE2 4.02Å; F80-Y288 HydrophobicContact CG-CE1 4.03Å; F80-Y288 HydrophobicContact CG-CE2 4.13Å; F80-Y288 AromaticContact CG-CZ 3.67Å; C83-Y288 HydrophobicContact CB-CD1 4.07Å; R139-Y288 VanDerWaalsContact CZ-O 3.24Å; R139-Y288 PolarHBondContact NH1-O 3.41Å; R139-Y288 PolarHBondContact NH2-O 2.96Å; Q286-Y288 VanDerWaalsContact C-N 3.35Å; Q286-Y288 HydrophobicContact CB-CD2 3.86Å; Q286-Y288 HydrophobicContact CB-CE2 4.11Å; Q286-Y288 HydrophobicContact CG-CE2 4.44Å; Q286-Y288 PolarHBondContact O-N 3.44Å; Y288-H290 AromaticContact CG-CE1 3.96Å; Y288-I292 HydrophobicContact CD2-CD1 3.75Å; Y288-I292 HydrophobicContact CE2-CD1 4.23Å
289	E	76.6	Confident	81.9	Confident	78 Å²	78	26.7 Å²	26.7	36%	0.364	15%	0.148	S	C	.	.	S	Bend	trans	-61.5	-49.8	178.4	177.8	161.5	-117.9	0	0	112.4	H84 R139 R142	H84-E289 HydrophobicContact CB-CB 4.12Å; H84-E289 WeakPolarHBondContact CB-OE2 3.4Å; H84-E289 IonicContact CG-OE2 3.62Å; H84-E289 IonicContact ND1-OE2 2.86Å; H84-E289 PolarHBondContact O-N 3.03Å; R139-E289 PolarHBondContact NH1-O 2.7Å; R139-E289 VanDerWaalsContact NH1-O 3.16Å; R142-E289 IonicContact CZ-OE1 3.98Å; R142-E289 IonicContact NH1-OE1 2.9Å; R142-E289 PolarHBondContact NH1-OE1 2.71Å; R142-E289 IonicContact NH2-OE1 3.51Å
290	H	80.8	Confident	81.6	Confident	20 Å²	20	30.1 Å²	30.1	9%	0.093	17%	0.167	C	C	.	.	S	Bend	trans	-60.5	148.1	171.7	68.1	-86	0	0	0	111.1	R139 Y288	R139-H290 PolarHBondContact NH1-O 2.93Å; Y288-H290 AromaticContact CG-CE1 3.96Å
291	L	85.3	Confident	81.2	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.016	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-84.6	123.3	177	-174.5	70.1	0	0	0	109.5	L165 V166 V284 C293 L456 L457	L165-L291 WeakPolarHBondContact O-CD2 3.49Å; V166-L291 HydrophobicContact CG1-CD1 4.16Å; V284-L291 HydrophobicContact CG2-CD1 4.47Å; L291-C293 WeakPolarHBondContact CD2-SG 3.25Å; L291-C293 VanDerWaalsContact CG-SG 3.52Å; L291-L456 HydrophobicContact CB-CD1 3.85Å; L291-L456 HydrophobicContact CB-CG 3.99Å; L291-L456 WeakPolarHBondContact CB-O 3.46Å; L291-L456 HydrophobicContact CD2-CD1 4.26Å; L291-L456 HydrophobicContact CD2-CD2 4.04Å; L291-L456 HydrophobicContact CD2-CG 4.03Å; L291-L456 PolarHBondContact N-O 3.08Å; L291-L457 HydrophobicContact CB-CD2 4.42Å; L291-L457 HydrophobicContact CD2-CD2 4.23Å
292	I	80.3	Confident	80.6	Confident	10 Å²	10	32.9 Å²	32.9	5%	0.051	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-90.7	130	170	-66.2	176.7	0	0	0	107.8	F80 W282 G283 Q286 Y288 K295	F80-I292 HydrophobicContact CE1-CD1 4.24Å; F80-I292 HydrophobicContact CZ-CD1 4.49Å; W282-I292 HydrophobicContact CE3-CG2 4.03Å; W282-I292 HydrophobicContact CZ3-CD1 4.46Å; W282-I292 HydrophobicContact CZ3-CG2 3.75Å; G283-I292 CarbonylContact C-O 3.55Å; G283-I292 VanDerWaalsContact CA-O 3.24Å; G283-I292 WeakPolarHBondContact CA-O 3.33Å; Q286-I292 HydrophobicContact CB-CD1 4.41Å; Q286-I292 HydrophobicContact CG-CD1 4.26Å; Y288-I292 HydrophobicContact CD2-CD1 3.75Å; Y288-I292 HydrophobicContact CE2-CD1 4.23Å; I292-K295 HydrophobicContact CG2-CD 4.45Å; I292-K295 VanDerWaalsContact CG2-CE 3.45Å; I292-K295 HydrophobicContact CG2-CG 4.15Å
293	C	76.8	Confident	79.9	Confident	17 Å²	17	32.4 Å²	32.4	12%	0.115	19%	0.186	C	C	.	.			trans	-134.1	160.1	-179.8	-62.2	0	0	0	0	112.1	L291 K295 E428	L291-C293 WeakPolarHBondContact CD2-SG 3.25Å; L291-C293 VanDerWaalsContact CG-SG 3.52Å; C293-K295 PolarHBondContact O-N 2.92Å; C293-K295 VanDerWaalsContact O-N 3.12Å; C293-E428 HydrophobicContact CB-CB 4.24Å; C293-E428 HydrophobicContact CB-CG 3.57Å; C293-E428 WeakPolarHBondContact CB-OE1 3.4Å
294	G	73.8	Confident	79.3	Confident	5 Å²	5	32.6 Å²	32.6	5%	0.052	19%	0.187	C	C	.	.	S	Bend	trans	67.7	8.9	165.8	0	0	0	0	0	116.7	L301 S302	G294-L301 CarbonylContact O-C 3.59Å; G294-L301 VanDerWaalsContact O-CA 3.31Å; G294-L301 WeakPolarHBondContact O-CA 3.43Å; G294-S302 PolarHBondContact O-N 3Å
295	K	77.1	Confident	78.1	Confident	12 Å²	12	35 Å²	35	5%	0.052	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-144.6	153.8	177.9	57.4	157.6	-177.4	156.6	0	113.6	A279 W282 I292 C293 V300 L301 L422	A279-K295 WeakPolarHBondContact CA-O 3.34Å; A279-K295 VanDerWaalsContact CB-C 3.47Å; W282-K295 HydrophobicContact CZ3-CD 4.2Å; W282-K295 HydrophobicContact CZ3-CG 4.39Å; I292-K295 HydrophobicContact CG2-CD 4.45Å; I292-K295 VanDerWaalsContact CG2-CE 3.45Å; I292-K295 HydrophobicContact CG2-CG 4.15Å; C293-K295 PolarHBondContact O-N 2.92Å; C293-K295 VanDerWaalsContact O-N 3.12Å; K295-V300 WeakPolarHBondContact CA-O 3.48Å; K295-V300 WeakPolarHBondContact CB-O 3.46Å; K295-L301 HydrophobicContact CB-CD2 4.23Å; K295-L422 HydrophobicContact CD-CD2 4.28Å
296	N	81.9	Confident	76.7	Confident	19 Å²	19	38.2 Å²	38.2	10%	0.102	22%	0.223	C	C	.	.			trans	-91.6	-178.8	173.4	69.4	14	0	0	0	112.8	N277 A279 N298 G299 V300	N277-N296 VanDerWaalsContact O-CB 3.23Å; N277-N296 WeakPolarHBondContact O-CB 3.48Å; N277-N296 PolarHBondContact O-ND2 3.49Å; A279-N296 HydrophobicContact CB-CB 4.4Å; N296-N298 PolarHBondContact O-N 3.37Å; N296-N298 WeakPolarHBondContact OD1-CB 3.24Å; N296-N298 PolarHBondContact OD1-N 3.03Å; N296-N298 VanDerWaalsContact OD1-N 3.14Å; N296-G299 PolarHBondContact O-N 3.19Å; N296-G299 PolarHBondContact OD1-N 3.29Å; N296-V300 PolarHBondContact N-O 3.27Å; N296-V300 PolarHBondContact OD1-N 2.84Å; N296-V300 VanDerWaalsContact OD1-N 3.14Å
297	A	80.6	Confident	75.5	Confident	40 Å²	40	38.2 Å²	38.2	33%	0.331	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.8	-179.8	0	0	0	0	0	113.7	N276 W282 G299	N276-A297 HydrophobicContact CB-CB 3.86Å; N276-A297 WeakPolarHBondContact O-CB 3.34Å; N276-A297 PolarHBondContact O-N 3.23Å; W282-A297 HydrophobicContact CD2-CB 4.29Å; W282-A297 HydrophobicContact CG-CB 4.41Å; W282-A297 HydrophobicContact CZ2-CB 4.21Å; A297-G299 PolarHBondContact O-N 3.1Å
298	N	75.7	Confident	74.5	Confident	112 Å²	112	36.3 Å²	36.3	60%	0.599	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	1.2	178.1	-57	-39.4	0	0	0	112.8	N296 V300	N296-N298 PolarHBondContact O-N 3.37Å; N296-N298 WeakPolarHBondContact OD1-CB 3.24Å; N296-N298 PolarHBondContact OD1-N 3.03Å; N296-N298 VanDerWaalsContact OD1-N 3.14Å; N298-V300 VanDerWaalsContact C-N 3.27Å; N298-V300 HydrophobicContact CB-CG2 4.31Å; N298-V300 PolarHBondContact O-N 3.11Å
299	G	70.5	Confident	73.1	Confident	32 Å²	32	36.5 Å²	36.5	33%	0.33	22%	0.223	S	C	.	.			trans	78.9	2.5	-179.5	0	0	0	0	0	114.9	N296 A297 L301	N296-G299 PolarHBondContact O-N 3.19Å; N296-G299 PolarHBondContact OD1-N 3.29Å; A297-G299 PolarHBondContact O-N 3.1Å; G299-L301 PolarHBondContact O-N 3.24Å
300	V	76.2	Confident	72	Confident	83 Å²	83	38.5 Å²	38.5	50%	0.503	23%	0.228	S	C	.	.			trans	-70	122.5	179.3	-177.8	0	0	0	0	109.1	K295 N296 N298	K295-V300 WeakPolarHBondContact CA-O 3.48Å; K295-V300 WeakPolarHBondContact CB-O 3.46Å; N296-V300 PolarHBondContact N-O 3.27Å; N296-V300 PolarHBondContact OD1-N 2.84Å; N296-V300 VanDerWaalsContact OD1-N 3.14Å; N298-V300 VanDerWaalsContact C-N 3.27Å; N298-V300 HydrophobicContact CB-CG2 4.31Å; N298-V300 PolarHBondContact O-N 3.11Å
301	L	79.1	Confident	70.4	Confident	35 Å²	35	41.5 Å²	41.5	18%	0.183	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-74	136.5	171.4	-72	167.6	0	0	0	110.3	G294 K295 G299 L337 T339 P425	G294-L301 CarbonylContact O-C 3.59Å; G294-L301 VanDerWaalsContact O-CA 3.31Å; G294-L301 WeakPolarHBondContact O-CA 3.43Å; K295-L301 HydrophobicContact CB-CD2 4.23Å; G299-L301 PolarHBondContact O-N 3.24Å; L301-L337 HydrophobicContact CB-CD2 4.29Å; L301-T339 HydrophobicContact CD1-CG2 4.01Å; L301-P425 HydrophobicContact CD2-CG 4.14Å
302	S	76	Confident	68.3	Low	50 Å²	50	49.7 Å²	49.7	35%	0.35	29%	0.286	S	S	.	.			trans	-149.9	139.7	175.7	61.4	0	0	0	0	111.4	A279 G294	A279-S302 WeakPolarHBondContact CB-OG 3.33Å; G294-S302 PolarHBondContact O-N 3Å
303	L	73.2	Confident	66.3	Low	15 Å²	15	55.4 Å²	55.4	8%	0.079	32%	0.317	C	S	.	.			trans	-72.8	147.6	171.2	-65.6	-179.1	0	0	0	111.4	F307 E333 L336 L337 M427	L303-F307 HydrophobicContact CB-CB 4.2Å; L303-F307 HydrophobicContact CD1-CB 4.2Å; L303-E333 HydrophobicContact CD1-CB 4.15Å; L303-E333 HydrophobicContact CD1-CG 3.96Å; L303-L336 HydrophobicContact CD1-CB 4.12Å; L303-L336 HydrophobicContact CD1-CD1 4.02Å; L303-L336 HydrophobicContact CD2-CB 3.86Å; L303-L337 HydrophobicContact CD2-CD2 3.55Å; L303-L337 HydrophobicContact CD2-CG 3.92Å; L303-L337 HydrophobicContact CG-CD1 4.35Å; L303-L337 HydrophobicContact CG-CD2 3.8Å; L303-L337 HydrophobicContact CG-CG 3.93Å; L303-M427 HydrophobicContact CD2-CB 4.39Å; L303-M427 HydrophobicContact CD2-CG 4.43Å
304	P	69.6	Low	64.4	Low	6 Å²	6	63.8 Å²	63.8	4%	0.039	35%	0.354	C	S	.	.			trans	-48.9	151.6	167.6	-32.1	38.8	0	0	0	113.6	E280 H306 F307 S308 M427	E280-P304 WeakPolarHBondContact OE1-CB 3.46Å; P304-H306 WeakPolarHBondContact CB-CE1 3.22Å; P304-H306 PolarHBondContact O-N 3.24Å; P304-F307 PolarHBondContact O-N 2.74Å; P304-S308 PolarHBondContact O-N 3.12Å; P304-M427 HydrophobicContact CG-CE 3.8Å
305	A	65	Low	62.7	Low	58 Å²	58	70.7 Å²	70.7	48%	0.479	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.6	-171.8	0	0	0	0	0	115.3	T311	A305-T311 HydrophobicContact CB-CG2 4.4Å; A305-T311 WeakPolarHBondContact O-CB 3.46Å; A305-T311 PolarHBondContact O-OG1 2.98Å
306	H	60.3	Low	61	Low	73 Å²	73	75.1 Å²	75.1	34%	0.338	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-9.5	177.1	59.3	-91.7	0	0	0	114.7	W169 A170 P304	W169-H306 AromaticContact CD1-CE1 3.97Å; W169-H306 AromaticContact CD1-NE2 3.79Å; W169-H306 AromaticContact CG-CE1 3.95Å; W169-H306 AromaticContact CG-NE2 3.62Å; A170-H306 PolarHBondContact N-CE1 3.09Å; P304-H306 WeakPolarHBondContact CB-CE1 3.22Å; P304-H306 PolarHBondContact O-N 3.24Å
307	F	60.9	Low	59.2	Low	25 Å²	25	78.3 Å²	78.3	11%	0.11	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-16.8	169.1	-71.8	-54.3	0	0	0	112.5	L303 P304 P309 M358 L361 M427	L303-F307 HydrophobicContact CB-CB 4.2Å; L303-F307 HydrophobicContact CD1-CB 4.2Å; P304-F307 PolarHBondContact O-N 2.74Å; F307-P309 WeakPolarHBondContact O-CD 3.22Å; F307-M358 HydrophobicContact CE1-CG 4.01Å; F307-M358 HydrophobicContact CZ-CE 4.2Å; F307-M358 HydrophobicContact CZ-CG 4.02Å; F307-L361 HydrophobicContact CD1-CD1 3.9Å; F307-L361 HydrophobicContact CE1-CD1 3.76Å; F307-M427 HydrophobicContact CE2-SD 4.48Å
308	S	62.3	Low	57.6	Low	34 Å²	34	84.5 Å²	84.5	24%	0.238	47%	0.471	C	S	.	.			trans	-60.8	122	167.6	174.7	0	0	0	0	110.4	P304 Y310 T311	P304-S308 PolarHBondContact O-N 3.12Å; S308-Y310 PolarHBondContact O-N 2.84Å; S308-Y310 VanDerWaalsContact O-N 3.14Å; S308-T311 WeakPolarHBondContact CB-OG1 3.5Å; S308-T311 PolarHBondContact O-OG1 3.29Å
309	P	52.5	Low	56.8	Low	40 Å²	40	81.6 Å²	81.6	26%	0.26	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	11.4	-178.3	33.4	-36	0	0	0	113.6	F307 L329	F307-P309 WeakPolarHBondContact O-CD 3.22Å; P309-L329 HydrophobicContact CB-CB 3.84Å; P309-L329 HydrophobicContact CB-CD1 3.96Å; P309-L329 HydrophobicContact CB-CD2 4.35Å; P309-L329 HydrophobicContact CB-CG 4.27Å; P309-L329 HydrophobicContact CG-CB 4.36Å
310	Y	53.4	Low	56.1	Low	119 Å²	119	91.1 Å²	91.1	47%	0.467	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-5.4	-174.4	-55.5	-76	0	0	0	113.7	S308 R330	S308-Y310 PolarHBondContact O-N 2.84Å; S308-Y310 VanDerWaalsContact O-N 3.14Å; Y310-R330 PolarHBondContact OH-NE 3.33Å
311	T	48.6	Very low	55.2	Low	83 Å²	83	95 Å²	95	51%	0.509	50%	0.498	S	S	.	.	S	Bend	trans	-89	-22.2	-168.4	-20.5	0	0	0	0	114.3	A305 S308	A305-T311 HydrophobicContact CB-CG2 4.4Å; A305-T311 WeakPolarHBondContact O-CB 3.46Å; A305-T311 PolarHBondContact O-OG1 2.98Å; S308-T311 WeakPolarHBondContact CB-OG1 3.5Å; S308-T311 PolarHBondContact O-OG1 3.29Å
312	E	40.3	Very low	54.1	Low	176 Å²	176	97.1 Å²	97.1	82%	0.822	51%	0.51	S	S	*	.	S	Bend	trans	-114.1	132.1	173.9	-67.1	-167.7	152.1	0	0	110.7
313	N	39.2	Very low	53.4	Low	130 Å²	130	97.4 Å²	97.4	70%	0.695	52%	0.516	S	S	*	.			trans	57.4	77.4	173.8	-66.3	-32.6	0	0	0	118.1	Q315	N313-Q315 PolarHBondContact O-N 3.11Å
314	Q	36.3	Very low	53	Low	192 Å²	192	104 Å²	104	90%	0.897	54%	0.541	S	S	*	.			trans	-73.8	63.3	144.7	-67.6	-171.7	9.2	0	0	110.9
315	Q	38.1	Very low	52.7	Low	150 Å²	150	105.9 Å²	105.9	70%	0.701	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-101.7	149.7	163.1	-65.5	-166	3.7	0	0	109.1	N313	N313-Q315 PolarHBondContact O-N 3.11Å
316	A	40.8	Very low	52.7	Low	105 Å²	105	107.1 Å²	107.1	87%	0.868	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-63.4	137.8	-166.5	0	0	0	0	0	112.9
317	V	44.7	Very low	53.2	Low	86 Å²	86	108.6 Å²	108.6	52%	0.521	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-95	128.5	-173.4	-178.9	0	0	0	0	110.5
318	D	46.9	Very low	53.5	Low	170 Å²	170	110.8 Å²	110.8	91%	0.909	57%	0.573	S	S	*	*			trans	-141.8	5.3	177.2	-105.6	-36.2	0	0	0	114.6
319	S	59	Low	53.7	Low	51 Å²	51	112.7 Å²	112.7	36%	0.357	58%	0.579	S	S	.	*			trans	-112.6	154.5	-179.7	118.2	0	0	0	0	114.4	E321 D322	S319-E321 PolarHBondContact OG-N 3.23Å; S319-D322 WeakPolarHBondContact CB-OD2 3.41Å; S319-D322 VanDerWaalsContact OG-CG 3.3Å; S319-D322 PolarHBondContact OG-N 2.89Å; S319-D322 PolarHBondContact OG-OD2 2.92Å
320	R	56.6	Low	54.6	Low	233 Å²	233	116.9 Å²	116.9	88%	0.879	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-15.2	-177.3	-165.9	173.6	179.3	-179.4	-0.5	113.3
321	E	55.5	Low	55.4	Low	163 Å²	163	114.6 Å²	114.6	76%	0.762	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-37.9	178.4	-62.7	-178.1	166.9	0	0	110.2	S319 A323 Y324 A325	S319-E321 PolarHBondContact OG-N 3.23Å; E321-A323 VanDerWaalsContact C-N 3.25Å; E321-A323 PolarHBondContact O-N 3.24Å; E321-Y324 WeakPolarHBondContact O-CB 3.32Å; E321-Y324 PolarHBondContact O-N 2.91Å; E321-A325 PolarHBondContact O-N 2.97Å; E321-A325 VanDerWaalsContact O-N 3.14Å
322	D	56.4	Low	56.6	Low	80 Å²	80	111.3 Å²	111.3	43%	0.428	57%	0.568	S	S	.	*	H	α-helix	trans	-58.9	-36.2	173.4	-57.2	-55	0	0	0	112.3	S319 Y324 A325 Q326	S319-D322 WeakPolarHBondContact CB-OD2 3.41Å; S319-D322 VanDerWaalsContact OG-CG 3.3Å; S319-D322 PolarHBondContact OG-N 2.89Å; S319-D322 PolarHBondContact OG-OD2 2.92Å; D322-Y324 VanDerWaalsContact C-N 3.25Å; D322-Y324 PolarHBondContact O-N 3.32Å; D322-A325 PolarHBondContact O-N 3.14Å; D322-Q326 WeakPolarHBondContact O-CB 3.43Å; D322-Q326 WeakPolarHBondContact O-CG 3.41Å; D322-Q326 PolarHBondContact O-N 2.88Å
323	A	61.7	Low	58.4	Low	57 Å²	57	104.9 Å²	104.9	47%	0.471	54%	0.538	S	S	.	.	H	α-helix	trans	-64.2	-28.4	176.3	0	0	0	0	0	113.1	E321 L327	E321-A323 VanDerWaalsContact C-N 3.25Å; E321-A323 PolarHBondContact O-N 3.24Å; A323-L327 PolarHBondContact O-N 3.35Å
324	Y	64.3	Low	60.1	Low	154 Å²	154	105 Å²	105	60%	0.604	53%	0.534	S	S	*	.	H	α-helix	trans	-77.9	-43	173.4	-170.4	-99.6	0	0	0	110.9	E321 D322 Q326 L327 E328	E321-Y324 WeakPolarHBondContact O-CB 3.32Å; E321-Y324 PolarHBondContact O-N 2.91Å; D322-Y324 VanDerWaalsContact C-N 3.25Å; D322-Y324 PolarHBondContact O-N 3.32Å; Y324-Q326 VanDerWaalsContact C-N 3.34Å; Y324-Q326 PolarHBondContact O-N 3.4Å; Y324-L327 WeakPolarHBondContact O-CB 3.31Å; Y324-L327 PolarHBondContact O-N 2.89Å; Y324-E328 HydrophobicContact CD1-CG 4.27Å; Y324-E328 HydrophobicContact CE1-CG 3.99Å; Y324-E328 WeakPolarHBondContact CE1-OE1 3.46Å; Y324-E328 PolarHBondContact O-N 3.3Å
325	A	64	Low	62.2	Low	44 Å²	44	96.1 Å²	96.1	36%	0.364	49%	0.493	S	S	.	.	H	α-helix	trans	-59.5	-41.5	174.4	0	0	0	0	0	112.3	E321 D322 L327 E328 L329	E321-A325 PolarHBondContact O-N 2.97Å; E321-A325 VanDerWaalsContact O-N 3.14Å; D322-A325 PolarHBondContact O-N 3.14Å; A325-L327 VanDerWaalsContact C-N 3.27Å; A325-L327 PolarHBondContact O-N 3.17Å; A325-E328 PolarHBondContact O-N 3.46Å; A325-L329 WeakPolarHBondContact O-CB 3.21Å; A325-L329 VanDerWaalsContact O-CG 3.27Å; A325-L329 WeakPolarHBondContact O-CG 3.42Å; A325-L329 PolarHBondContact O-N 3.09Å
326	Q	65.4	Low	64.3	Low	85 Å²	85	89 Å²	89	40%	0.397	46%	0.461	S	S	.	.	H	α-helix	trans	-63.8	-29.9	173.9	-72.8	179	12.1	0	0	112.9	D322 Y324 R330	D322-Q326 WeakPolarHBondContact O-CB 3.43Å; D322-Q326 WeakPolarHBondContact O-CG 3.41Å; D322-Q326 PolarHBondContact O-N 2.88Å; Y324-Q326 VanDerWaalsContact C-N 3.34Å; Y324-Q326 PolarHBondContact O-N 3.4Å; Q326-R330 WeakPolarHBondContact O-CG 3.48Å; Q326-R330 PolarHBondContact O-N 3.13Å
327	L	69.2	Low	66.3	Low	104 Å²	104	85.1 Å²	85.1	55%	0.545	43%	0.425	S	S	.	.	H	α-helix	trans	-76.6	-40.6	175.6	-173.6	63.9	0	0	0	112	A323 Y324 A325 L329 R330 T331	A323-L327 PolarHBondContact O-N 3.35Å; Y324-L327 WeakPolarHBondContact O-CB 3.31Å; Y324-L327 PolarHBondContact O-N 2.89Å; A325-L327 VanDerWaalsContact C-N 3.27Å; A325-L327 PolarHBondContact O-N 3.17Å; L327-L329 VanDerWaalsContact C-N 3.32Å; L327-R330 PolarHBondContact O-N 3.3Å; L327-T331 WeakPolarHBondContact O-CG2 3.45Å; L327-T331 PolarHBondContact O-N 2.95Å; L327-T331 PolarHBondContact O-OG1 3.46Å
328	E	67.8	Low	68.1	Low	71 Å²	71	82.2 Å²	82.2	33%	0.332	41%	0.41	S	S	.	.	H	α-helix	trans	-59.2	-43.5	169.4	-71.2	-163.8	157.7	0	0	111	Y324 A325 T331 L332 H357	Y324-E328 HydrophobicContact CD1-CG 4.27Å; Y324-E328 HydrophobicContact CE1-CG 3.99Å; Y324-E328 WeakPolarHBondContact CE1-OE1 3.46Å; Y324-E328 PolarHBondContact O-N 3.3Å; A325-E328 PolarHBondContact O-N 3.46Å; E328-T331 WeakPolarHBondContact CA-OG1 3.26Å; E328-T331 PolarHBondContact O-N 2.81Å; E328-T331 PolarHBondContact O-OG1 3.22Å; E328-T331 VanDerWaalsContact O-OG1 3.08Å; E328-L332 VanDerWaalsContact O-CB 3.27Å; E328-L332 WeakPolarHBondContact O-CB 3.48Å; E328-L332 PolarHBondContact O-N 2.87Å; E328-H357 IonicContact OE2-CE1 3.81Å
329	L	67.6	Low	69.7	Low	73 Å²	73	74.7 Å²	74.7	38%	0.382	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-41	179	-74	168.5	0	0	0	112.8	P309 A325 L327 L332 E333	P309-L329 HydrophobicContact CB-CB 3.84Å; P309-L329 HydrophobicContact CB-CD1 3.96Å; P309-L329 HydrophobicContact CB-CD2 4.35Å; P309-L329 HydrophobicContact CB-CG 4.27Å; P309-L329 HydrophobicContact CG-CB 4.36Å; A325-L329 WeakPolarHBondContact O-CB 3.21Å; A325-L329 VanDerWaalsContact O-CG 3.27Å; A325-L329 WeakPolarHBondContact O-CG 3.42Å; A325-L329 PolarHBondContact O-N 3.09Å; L327-L329 VanDerWaalsContact C-N 3.32Å; L329-L332 PolarHBondContact O-N 3.42Å; L329-E333 WeakPolarHBondContact O-CB 3.19Å; L329-E333 PolarHBondContact O-N 2.61Å
330	R	70.1	Confident	70.6	Confident	128 Å²	128	73.1 Å²	73.1	48%	0.483	36%	0.359	S	S	.	.	H	α-helix	trans	-69.3	-35.9	175.8	-76.7	179.7	-179.7	165.6	6.8	113.4	Y310 Q326 L327 E333 Q334	Y310-R330 PolarHBondContact OH-NE 3.33Å; Q326-R330 WeakPolarHBondContact O-CG 3.48Å; Q326-R330 PolarHBondContact O-N 3.13Å; L327-R330 PolarHBondContact O-N 3.3Å; R330-E333 PolarHBondContact O-N 2.85Å; R330-Q334 WeakPolarHBondContact O-CG 3.49Å; R330-Q334 PolarHBondContact O-N 3.3Å
331	T	71.4	Confident	71.7	Confident	71 Å²	71	62.1 Å²	62.1	44%	0.436	32%	0.318	S	S	.	.	H	α-helix	trans	-74.2	-32.5	176.1	49.5	0	0	0	0	111.8	L327 E328 S335	L327-T331 WeakPolarHBondContact O-CG2 3.45Å; L327-T331 PolarHBondContact O-N 2.95Å; L327-T331 PolarHBondContact O-OG1 3.46Å; E328-T331 WeakPolarHBondContact CA-OG1 3.26Å; E328-T331 PolarHBondContact O-N 2.81Å; E328-T331 PolarHBondContact O-OG1 3.22Å; E328-T331 VanDerWaalsContact O-OG1 3.08Å; T331-S335 WeakPolarHBondContact O-CB 3.33Å; T331-S335 PolarHBondContact O-N 3.41Å
332	L	74.1	Confident	72.6	Confident	15 Å²	15	54.7 Å²	54.7	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-49	166.1	179	65.6	0	0	0	111.3	E328 L329 Q334 S335 L336 H357	E328-L332 VanDerWaalsContact O-CB 3.27Å; E328-L332 WeakPolarHBondContact O-CB 3.48Å; E328-L332 PolarHBondContact O-N 2.87Å; L329-L332 PolarHBondContact O-N 3.42Å; L332-Q334 PolarHBondContact O-N 3.01Å; L332-S335 WeakPolarHBondContact CA-OG 3.45Å; L332-S335 PolarHBondContact O-N 2.76Å; L332-S335 VanDerWaalsContact O-N 3.07Å; L332-S335 PolarHBondContact O-OG 3.25Å; L332-L336 HydrophobicContact CD1-CD1 4.08Å; L332-L336 HydrophobicContact CD1-CG 4.12Å; L332-L336 HydrophobicContact CG-CD1 3.93Å; L332-L336 HydrophobicContact CG-CG 4.35Å; L332-L336 WeakPolarHBondContact O-CB 3.46Å; L332-L336 WeakPolarHBondContact O-CG 3.28Å; L332-L336 PolarHBondContact O-N 3.38Å; L332-H357 HydrophobicContact CD1-CB 3.91Å; L332-H357 HydrophobicContact CD2-CB 3.59Å; L332-H357 HydrophobicContact CG-CB 4.41Å
333	E	76.7	Confident	73.7	Confident	40 Å²	40	51.5 Å²	51.5	19%	0.187	27%	0.268	C	S	.	.	H	α-helix	trans	-54.9	-49.2	177.1	174.1	170.6	-137.5	0	0	111.4	L303 L329 R330 S335 L336 L337	L303-E333 HydrophobicContact CD1-CB 4.15Å; L303-E333 HydrophobicContact CD1-CG 3.96Å; L329-E333 WeakPolarHBondContact O-CB 3.19Å; L329-E333 PolarHBondContact O-N 2.61Å; R330-E333 PolarHBondContact O-N 2.85Å; E333-S335 PolarHBondContact O-N 3.06Å; E333-L336 PolarHBondContact O-N 3.3Å; E333-L337 HydrophobicContact CG-CD1 4.02Å; E333-L337 WeakPolarHBondContact O-CB 3.39Å; E333-L337 WeakPolarHBondContact O-CG 3.44Å; E333-L337 PolarHBondContact O-N 2.85Å
334	Q	76	Confident	74.8	Confident	132 Å²	132	51.3 Å²	51.3	62%	0.617	26%	0.259	S	S	*	.	H	α-helix	trans	-60.2	-41.2	173.9	-72.8	174.4	-18.4	0	0	112.7	R330 L332 A338	R330-Q334 WeakPolarHBondContact O-CG 3.49Å; R330-Q334 PolarHBondContact O-N 3.3Å; L332-Q334 PolarHBondContact O-N 3.01Å; Q334-A338 PolarHBondContact O-N 2.8Å
335	S	79.8	Confident	75.8	Confident	6 Å²	6	47.9 Å²	47.9	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-35.6	177.4	74.7	0	0	0	0	113.5	T331 L332 E333 A338	T331-S335 WeakPolarHBondContact O-CB 3.33Å; T331-S335 PolarHBondContact O-N 3.41Å; L332-S335 WeakPolarHBondContact CA-OG 3.45Å; L332-S335 PolarHBondContact O-N 2.76Å; L332-S335 VanDerWaalsContact O-N 3.07Å; L332-S335 PolarHBondContact O-OG 3.25Å; E333-S335 PolarHBondContact O-N 3.06Å; S335-A338 WeakPolarHBondContact O-CB 3.28Å
336	L	81.6	Confident	76.8	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-75.7	-32	-179.4	-74.4	177.1	0	0	0	111.8	L303 L332 E333 A354 P425 L426 M427	L303-L336 HydrophobicContact CD1-CB 4.12Å; L303-L336 HydrophobicContact CD1-CD1 4.02Å; L303-L336 HydrophobicContact CD2-CB 3.86Å; L332-L336 HydrophobicContact CD1-CD1 4.08Å; L332-L336 HydrophobicContact CD1-CG 4.12Å; L332-L336 HydrophobicContact CG-CD1 3.93Å; L332-L336 HydrophobicContact CG-CG 4.35Å; L332-L336 WeakPolarHBondContact O-CB 3.46Å; L332-L336 WeakPolarHBondContact O-CG 3.28Å; L332-L336 PolarHBondContact O-N 3.38Å; E333-L336 PolarHBondContact O-N 3.3Å; L336-A354 HydrophobicContact CD2-CB 3.72Å; L336-P425 WeakPolarHBondContact O-CB 3.26Å; L336-L426 PolarHBondContact O-N 3.12Å; L336-M427 HydrophobicContact CB-CB 4.1Å; L336-M427 HydrophobicContact CD2-CB 4Å; L336-M427 HydrophobicContact CD2-CG 4.07Å; L336-M427 WeakPolarHBondContact O-CB 3.49Å; L336-M427 PolarHBondContact O-N 2.95Å
337	L	83.1	Confident	77.8	Confident	23 Å²	23	45.4 Å²	45.4	12%	0.12	24%	0.238	C	C	.	.	H	α-helix	trans	-84.3	-5.2	176.6	-67.8	177.7	0	0	0	114.3	L301 L303 E333 T339 P425	L301-L337 HydrophobicContact CB-CD2 4.29Å; L303-L337 HydrophobicContact CD2-CD2 3.55Å; L303-L337 HydrophobicContact CD2-CG 3.92Å; L303-L337 HydrophobicContact CG-CD1 4.35Å; L303-L337 HydrophobicContact CG-CD2 3.8Å; L303-L337 HydrophobicContact CG-CG 3.93Å; E333-L337 HydrophobicContact CG-CD1 4.02Å; E333-L337 WeakPolarHBondContact O-CB 3.39Å; E333-L337 WeakPolarHBondContact O-CG 3.44Å; E333-L337 PolarHBondContact O-N 2.85Å; L337-T339 PolarHBondContact O-N 2.85Å; L337-P425 HydrophobicContact CD2-CB 4.4Å
338	A	83.3	Confident	78.7	Confident	25 Å²	25	42.6 Å²	42.6	21%	0.207	23%	0.228	C	C	.	.			trans	-60.9	126.7	178.7	0	0	0	0	0	111.8	Q334 S335 L426	Q334-A338 PolarHBondContact O-N 2.8Å; S335-A338 WeakPolarHBondContact O-CB 3.28Å; A338-L426 WeakPolarHBondContact O-CB 3.42Å; A338-L426 PolarHBondContact O-N 3.1Å
339	T	80.5	Confident	79.5	Confident	11 Å²	11	43 Å²	43	7%	0.067	23%	0.232	C	C	.	.			trans	-104.4	-16.1	-179	52.4	0	0	0	0	113.8	L301 L337 L423	L301-T339 HydrophobicContact CD1-CG2 4.01Å; L337-T339 PolarHBondContact O-N 2.85Å; T339-L423 WeakPolarHBondContact CG2-O 3.28Å; T339-L423 WeakPolarHBondContact O-CD1 3.48Å
340	C	77.8	Confident	80.4	Confident	19 Å²	19	40.4 Å²	40.4	13%	0.128	22%	0.218	C	C	.	.			trans	-137.5	154.3	178.4	-66	0	0	0	0	109.7	L394 C396	C340-L394 CarbonylContact C-O 3.46Å; C340-L394 VanDerWaalsContact CA-O 3.29Å; C340-L394 WeakPolarHBondContact CA-O 3.18Å; C340-C396 HydrophobicContact CB-CB 4.22Å
341	V	79.5	Confident	81.2	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.012	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-136.9	146.8	176.3	-169.6	0	0	0	0	110.6	S343 E346 L347 L350 L394 C396	V341-S343 WeakPolarHBondContact CG1-O 3.23Å; V341-E346 HydrophobicContact CG1-CB 3.8Å; V341-E346 HydrophobicContact CG1-CG 3.7Å; V341-E346 VanDerWaalsContact CG1-OE2 3.28Å; V341-E346 WeakPolarHBondContact CG1-OE2 3.46Å; V341-L347 HydrophobicContact CG1-CB 3.99Å; V341-L347 HydrophobicContact CG2-CD1 4.15Å; V341-L350 HydrophobicContact CG1-CD1 4.29Å; V341-L350 HydrophobicContact CG2-CD1 4.17Å; V341-L394 HydrophobicContact CG2-CB 4.23Å; V341-L394 HydrophobicContact CG2-CD1 4.24Å; V341-L394 PolarHBondContact N-O 3.25Å; V341-C396 PolarHBondContact O-N 3.39Å
342	G	74.1	Confident	81.9	Confident	6 Å²	6	34.4 Å²	34.4	6%	0.062	20%	0.199	C	C	.	.	S	Bend	trans	-85	-43.9	-178.9	0	0	0	0	0	114.3	E346 Y391 M399	G342-E346 VanDerWaalsContact CA-OE2 3.31Å; G342-E346 WeakPolarHBondContact CA-OE2 3.16Å; G342-E346 PolarHBondContact N-OE2 2.81Å; G342-Y391 PolarHBondContact O-OH 3Å; G342-Y391 VanDerWaalsContact O-OH 3.07Å; G342-M399 VanDerWaalsContact CA-CE 3.44Å
343	S	80.3	Confident	82.2	Confident	13 Å²	13	38.3 Å²	38.3	9%	0.091	21%	0.212	C	C	.	.			trans	-135.1	159.3	-179.4	69.8	0	0	0	0	113.9	V341 S345 E346 L347 E403	V341-S343 WeakPolarHBondContact CG1-O 3.23Å; S343-S345 VanDerWaalsContact C-N 3.26Å; S343-S345 PolarHBondContact O-N 3.49Å; S343-S345 PolarHBondContact OG-OG 3.22Å; S343-E346 PolarHBondContact N-OE2 2.81Å; S343-E346 WeakPolarHBondContact O-CB 3.49Å; S343-E346 PolarHBondContact O-N 2.82Å; S343-E346 WeakPolarHBondContact OG-CB 3.46Å; S343-E346 PolarHBondContact OG-N 3Å; S343-L347 PolarHBondContact O-N 3.18Å; S343-E403 WeakPolarHBondContact CB-OE1 3.34Å
344	I	84.8	Confident	82.3	Confident	54 Å²	54	36.4 Å²	36.4	28%	0.277	20%	0.204	S	C	.	.	H	α-helix	trans	-67	-28.2	175.2	-168.4	168.6	0	0	0	112.6	L347 S348 L387 H388 Y391	I344-L347 PolarHBondContact O-N 3.49Å; I344-S348 VanDerWaalsContact O-CB 3.3Å; I344-S348 WeakPolarHBondContact O-CB 3.42Å; I344-S348 PolarHBondContact O-N 3.42Å; I344-L387 HydrophobicContact CD1-CB 4.46Å; I344-H388 HydrophobicContact CD1-CB 4.29Å; I344-H388 VanDerWaalsContact CD1-CE1 3.43Å; I344-H388 WeakPolarHBondContact CD1-CE1 3.25Å; I344-H388 VanDerWaalsContact CD1-ND1 3.32Å; I344-H388 WeakPolarHBondContact CD1-ND1 3.34Å; I344-Y391 HydrophobicContact CB-CD2 4.48Å; I344-Y391 HydrophobicContact CB-CG 4.27Å
345	S	85	Confident	82.5	Confident	82 Å²	82	31.1 Å²	31.1	57%	0.573	18%	0.179	S	C	*	.	H	α-helix	trans	-61.9	-47.4	170.6	21.2	0	0	0	0	111.7	S343 S348 D349	S343-S345 VanDerWaalsContact C-N 3.26Å; S343-S345 PolarHBondContact O-N 3.49Å; S343-S345 PolarHBondContact OG-OG 3.22Å; S345-S348 PolarHBondContact O-N 2.99Å; S345-D349 VanDerWaalsContact O-CB 3.32Å; S345-D349 WeakPolarHBondContact O-CB 3.43Å; S345-D349 PolarHBondContact O-N 3.5Å; S345-D349 VanDerWaalsContact O-N 3.07Å
346	E	85.2	Confident	82.4	Confident	76 Å²	76	34.7 Å²	34.7	36%	0.355	20%	0.195	S	C	.	.	H	α-helix	trans	-61.4	-46.6	175.1	-176.2	-172.5	-169.3	0	0	110.9	V341 G342 S343 S348 D349 L350	V341-E346 HydrophobicContact CG1-CB 3.8Å; V341-E346 HydrophobicContact CG1-CG 3.7Å; V341-E346 VanDerWaalsContact CG1-OE2 3.28Å; V341-E346 WeakPolarHBondContact CG1-OE2 3.46Å; G342-E346 VanDerWaalsContact CA-OE2 3.31Å; G342-E346 WeakPolarHBondContact CA-OE2 3.16Å; G342-E346 PolarHBondContact N-OE2 2.81Å; S343-E346 PolarHBondContact N-OE2 2.81Å; S343-E346 WeakPolarHBondContact O-CB 3.49Å; S343-E346 PolarHBondContact O-N 2.82Å; S343-E346 WeakPolarHBondContact OG-CB 3.46Å; S343-E346 PolarHBondContact OG-N 3Å; E346-S348 PolarHBondContact O-N 2.7Å; E346-D349 PolarHBondContact O-N 3.23Å; E346-L350 HydrophobicContact CG-CD1 3.97Å; E346-L350 HydrophobicContact CG-CG 4.46Å; E346-L350 WeakPolarHBondContact O-CB 3.39Å; E346-L350 VanDerWaalsContact O-CG 3.24Å; E346-L350 WeakPolarHBondContact O-CG 3.35Å; E346-L350 PolarHBondContact O-N 2.83Å
347	L	86.5	Confident	81.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.4	-47.2	176.7	179.9	63.1	0	0	0	112.2	V341 S343 I344 D349 L350 V351 L387 L390 L394 L426	V341-L347 HydrophobicContact CG1-CB 3.99Å; V341-L347 HydrophobicContact CG2-CD1 4.15Å; S343-L347 PolarHBondContact O-N 3.18Å; I344-L347 PolarHBondContact O-N 3.49Å; L347-D349 PolarHBondContact O-N 2.83Å; L347-L350 PolarHBondContact O-N 2.95Å; L347-V351 HydrophobicContact CD1-CG2 3.96Å; L347-V351 HydrophobicContact CG-CG2 4.38Å; L347-V351 WeakPolarHBondContact O-CB 3.27Å; L347-V351 WeakPolarHBondContact O-CG2 3.44Å; L347-V351 PolarHBondContact O-N 3.01Å; L347-L387 WeakPolarHBondContact CD2-O 3.03Å; L347-L390 HydrophobicContact CD1-CD2 3.96Å; L347-L390 HydrophobicContact CD1-CG 4.27Å; L347-L390 HydrophobicContact CD2-CB 4.05Å; L347-L390 HydrophobicContact CD2-CD2 4.17Å; L347-L390 HydrophobicContact CD2-CG 3.96Å; L347-L390 HydrophobicContact CG-CD2 4.46Å; L347-L394 HydrophobicContact CD1-CD1 3.87Å; L347-L426 HydrophobicContact CD1-CD1 4Å
348	S	87.8	Confident	81.3	Confident	46 Å²	46	36.2 Å²	36.2	32%	0.322	20%	0.202	S	C	.	.	H	α-helix	trans	-61.7	-34.5	-180	-173.3	0	0	0	0	111.9	I344 S345 E346 S352	I344-S348 VanDerWaalsContact O-CB 3.3Å; I344-S348 WeakPolarHBondContact O-CB 3.42Å; I344-S348 PolarHBondContact O-N 3.42Å; S345-S348 PolarHBondContact O-N 2.99Å; E346-S348 PolarHBondContact O-N 2.7Å; S348-S352 WeakPolarHBondContact O-CB 3.41Å; S348-S352 PolarHBondContact O-N 3.25Å; S348-S352 PolarHBondContact O-OG 2.9Å
349	D	84.8	Confident	80.5	Confident	79 Å²	79	38.2 Å²	38.2	42%	0.422	21%	0.207	S	C	.	.	H	α-helix	trans	-76.9	-43.3	179.5	-177.4	38.4	0	0	0	111.9	S345 E346 L347 S352 R353	S345-D349 VanDerWaalsContact O-CB 3.32Å; S345-D349 WeakPolarHBondContact O-CB 3.43Å; S345-D349 PolarHBondContact O-N 3.5Å; S345-D349 VanDerWaalsContact O-N 3.07Å; E346-D349 PolarHBondContact O-N 3.23Å; L347-D349 PolarHBondContact O-N 2.83Å; D349-S352 PolarHBondContact O-N 2.8Å; D349-R353 VanDerWaalsContact CG-NH2 3.3Å; D349-R353 PolarHBondContact O-N 2.75Å; D349-R353 IonicContact OD1-CZ 2.68Å; D349-R353 IonicContact OD1-NH1 3.97Å; D349-R353 PolarHBondContact OD1-NH1 3.34Å; D349-R353 IonicContact OD1-NH2 3.26Å; D349-R353 IonicContact OD2-CZ 2.66Å; D349-R353 IonicContact OD2-NH1 3.7Å; D349-R353 PolarHBondContact OD2-NH1 3.3Å; D349-R353 IonicContact OD2-NH2 3.26Å; D349-R353 PolarHBondContact OD2-NH2 3Å
350	L	86.3	Confident	79.7	Confident	18 Å²	18	44.1 Å²	44.1	9%	0.094	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-51.1	171.8	-68.6	167.4	0	0	0	111.7	V341 E346 L347 S352 R353 A354 L426	V341-L350 HydrophobicContact CG1-CD1 4.29Å; V341-L350 HydrophobicContact CG2-CD1 4.17Å; E346-L350 HydrophobicContact CG-CD1 3.97Å; E346-L350 HydrophobicContact CG-CG 4.46Å; E346-L350 WeakPolarHBondContact O-CB 3.39Å; E346-L350 VanDerWaalsContact O-CG 3.24Å; E346-L350 WeakPolarHBondContact O-CG 3.35Å; E346-L350 PolarHBondContact O-N 2.83Å; L347-L350 PolarHBondContact O-N 2.95Å; L350-S352 VanDerWaalsContact C-N 3.32Å; L350-S352 PolarHBondContact O-N 2.71Å; L350-R353 PolarHBondContact O-N 3.2Å; L350-A354 WeakPolarHBondContact O-CB 3.49Å; L350-A354 PolarHBondContact O-N 2.95Å; L350-L426 HydrophobicContact CB-CD2 3.89Å
351	V	87.6	Confident	78.7	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.024	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-39.7	177.5	172.7	0	0	0	0	111	L347 A354 M355 W382 L387 L390 L426 M430	L347-V351 HydrophobicContact CD1-CG2 3.96Å; L347-V351 HydrophobicContact CG-CG2 4.38Å; L347-V351 WeakPolarHBondContact O-CB 3.27Å; L347-V351 WeakPolarHBondContact O-CG2 3.44Å; L347-V351 PolarHBondContact O-N 3.01Å; V351-A354 PolarHBondContact O-N 3.45Å; V351-M355 HydrophobicContact CG1-CG 4.15Å; V351-M355 WeakPolarHBondContact O-CB 3.46Å; V351-M355 WeakPolarHBondContact O-CG 3.25Å; V351-M355 PolarHBondContact O-N 2.87Å; V351-W382 HydrophobicContact CG1-CD2 4.16Å; V351-W382 HydrophobicContact CG1-CG 4.08Å; V351-L387 HydrophobicContact CB-CD2 4.49Å; V351-L387 HydrophobicContact CG1-CD2 4.41Å; V351-L387 HydrophobicContact CG2-CD2 4.41Å; V351-L390 HydrophobicContact CG2-CD2 4.38Å; V351-L426 HydrophobicContact CG2-CD1 4.23Å; V351-L426 HydrophobicContact CG2-CD2 4.37Å; V351-M430 HydrophobicContact CB-SD 4.49Å; V351-M430 HydrophobicContact CG1-CE 4.28Å; V351-M430 HydrophobicContact CG1-SD 4.41Å; V351-M430 HydrophobicContact CG2-SD 4.16Å
352	S	84.3	Confident	77.4	Confident	69 Å²	69	51.2 Å²	51.2	48%	0.483	27%	0.27	S	S	.	.	H	α-helix	trans	-64.9	-43.2	178.1	-64.8	0	0	0	0	112.6	S348 D349 L350 H356	S348-S352 WeakPolarHBondContact O-CB 3.41Å; S348-S352 PolarHBondContact O-N 3.25Å; S348-S352 PolarHBondContact O-OG 2.9Å; D349-S352 PolarHBondContact O-N 2.8Å; L350-S352 VanDerWaalsContact C-N 3.32Å; L350-S352 PolarHBondContact O-N 2.71Å; S352-H356 WeakPolarHBondContact O-CB 3.44Å; S352-H356 PolarHBondContact O-N 3.12Å; S352-H356 VanDerWaalsContact O-N 3.16Å
353	R	80.4	Confident	76	Confident	97 Å²	97	55 Å²	55	37%	0.366	30%	0.295	S	S	.	.	H	α-helix	trans	-58.7	-57.7	171.8	-83.9	-171.1	-75.5	-82.8	-3.5	111	D349 L350 M355 H356 H357	D349-R353 VanDerWaalsContact CG-NH2 3.3Å; D349-R353 PolarHBondContact O-N 2.75Å; D349-R353 IonicContact OD1-CZ 2.68Å; D349-R353 IonicContact OD1-NH1 3.97Å; D349-R353 PolarHBondContact OD1-NH1 3.34Å; D349-R353 IonicContact OD1-NH2 3.26Å; D349-R353 IonicContact OD2-CZ 2.66Å; D349-R353 IonicContact OD2-NH1 3.7Å; D349-R353 PolarHBondContact OD2-NH1 3.3Å; D349-R353 IonicContact OD2-NH2 3.26Å; D349-R353 PolarHBondContact OD2-NH2 3Å; L350-R353 PolarHBondContact O-N 3.2Å; R353-M355 VanDerWaalsContact C-N 3.33Å; R353-M355 PolarHBondContact O-N 2.95Å; R353-H356 PolarHBondContact O-N 3.48Å; R353-H357 PolarHBondContact O-CD2 2.96Å; R353-H357 VanDerWaalsContact O-CD2 3.26Å; R353-H357 PolarHBondContact O-N 2.94Å
354	A	80.3	Confident	73.8	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-55	-47.2	-176.3	0	0	0	0	0	112	L336 L350 V351 H356 H357 M358 M430	L336-A354 HydrophobicContact CD2-CB 3.72Å; L350-A354 WeakPolarHBondContact O-CB 3.49Å; L350-A354 PolarHBondContact O-N 2.95Å; V351-A354 PolarHBondContact O-N 3.45Å; A354-H356 PolarHBondContact O-N 2.96Å; A354-H357 PolarHBondContact O-N 3.3Å; A354-M358 WeakPolarHBondContact O-CB 3.3Å; A354-M358 VanDerWaalsContact O-CG 3.26Å; A354-M358 WeakPolarHBondContact O-CG 3.48Å; A354-M358 PolarHBondContact O-N 2.95Å; A354-M430 HydrophobicContact CB-CE 3.61Å; A354-M430 HydrophobicContact CB-SD 3.73Å
355	M	80	Confident	71.7	Confident	21 Å²	21	65.7 Å²	65.7	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-58.6	-44.1	176.1	-72.6	-60	-78.6	0	0	112.8	V351 R353 M358 Q359 V380 M430 I434	V351-M355 HydrophobicContact CG1-CG 4.15Å; V351-M355 WeakPolarHBondContact O-CB 3.46Å; V351-M355 WeakPolarHBondContact O-CG 3.25Å; V351-M355 PolarHBondContact O-N 2.87Å; R353-M355 VanDerWaalsContact C-N 3.33Å; R353-M355 PolarHBondContact O-N 2.95Å; M355-M358 PolarHBondContact O-N 3.35Å; M355-Q359 WeakPolarHBondContact O-CB 3.3Å; M355-Q359 WeakPolarHBondContact O-CG 3.27Å; M355-Q359 PolarHBondContact O-N 2.72Å; M355-Q359 PolarHBondContact O-NE2 3.1Å; M355-V380 HydrophobicContact CE-CB 4.1Å; M355-V380 WeakPolarHBondContact CE-O 3.39Å; M355-M430 HydrophobicContact CG-CE 3.61Å; M355-M430 HydrophobicContact SD-CE 3.51Å; M355-M430 VanDerWaalsContact SD-CE 3.51Å; M355-I434 HydrophobicContact CE-CD1 3.91Å; M355-I434 HydrophobicContact CE-CG1 4.46Å; M355-I434 HydrophobicContact SD-CD1 3.47Å; M355-I434 WeakPolarHBondContact SD-CD1 3.47Å; M355-I434 HydrophobicContact SD-CG1 4.48Å
356	H	76.4	Confident	69.1	Low	82 Å²	82	68 Å²	68	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-39	179	164.8	-106.9	0	0	0	112.7	S352 R353 A354 R360	S352-H356 WeakPolarHBondContact O-CB 3.44Å; S352-H356 PolarHBondContact O-N 3.12Å; S352-H356 VanDerWaalsContact O-N 3.16Å; R353-H356 PolarHBondContact O-N 3.48Å; A354-H356 PolarHBondContact O-N 2.96Å; H356-R360 PolarHBondContact CE1-NE 3.47Å; H356-R360 PolarHBondContact CE1-NH2 3.2Å; H356-R360 PolarHBondContact NE2-NE 3.25Å; H356-R360 PolarHBondContact NE2-NH2 3.31Å; H356-R360 PolarHBondContact O-N 2.95Å
357	H	71.4	Confident	66.9	Low	33 Å²	33	68.3 Å²	68.3	15%	0.153	38%	0.375	C	S	.	.	H	α-helix	trans	-70.8	-42.7	175.1	-74.7	-88.7	0	0	0	112.3	E328 L332 R353 A354 Q359 R360 L361	E328-H357 IonicContact OE2-CE1 3.81Å; L332-H357 HydrophobicContact CD1-CB 3.91Å; L332-H357 HydrophobicContact CD2-CB 3.59Å; L332-H357 HydrophobicContact CG-CB 4.41Å; R353-H357 PolarHBondContact O-CD2 2.96Å; R353-H357 VanDerWaalsContact O-CD2 3.26Å; R353-H357 PolarHBondContact O-N 2.94Å; A354-H357 PolarHBondContact O-N 3.3Å; H357-Q359 VanDerWaalsContact C-N 3.28Å; H357-Q359 PolarHBondContact O-N 3.07Å; H357-R360 PolarHBondContact O-N 2.9Å; H357-L361 PolarHBondContact O-N 3.17Å
358	M	70.4	Confident	64.5	Low	24 Å²	24	74.5 Å²	74.5	12%	0.118	40%	0.404	C	S	.	.	H	α-helix	trans	-58.3	-40.3	174.5	-69.1	170	75.2	0	0	111.9	W169 F307 A354 M355 L361 S362 M430	W169-M358 HydrophobicContact CE3-CE 4.34Å; W169-M358 HydrophobicContact CH2-CE 4.19Å; W169-M358 HydrophobicContact CZ3-CE 3.57Å; F307-M358 HydrophobicContact CE1-CG 4.01Å; F307-M358 HydrophobicContact CZ-CE 4.2Å; F307-M358 HydrophobicContact CZ-CG 4.02Å; A354-M358 WeakPolarHBondContact O-CB 3.3Å; A354-M358 VanDerWaalsContact O-CG 3.26Å; A354-M358 WeakPolarHBondContact O-CG 3.48Å; A354-M358 PolarHBondContact O-N 2.95Å; M355-M358 PolarHBondContact O-N 3.35Å; M358-L361 PolarHBondContact O-N 3.39Å; M358-S362 PolarHBondContact O-N 3.48Å; M358-M430 HydrophobicContact SD-CE 4.07Å
359	Q	67.9	Low	61.7	Low	67 Å²	67	76.3 Å²	76.3	31%	0.313	42%	0.417	S	S	.	.	H	α-helix	trans	-62.7	-42.8	175.9	-73.1	158.8	34.2	0	0	112.3	M355 H357 S362 S363 P379	M355-Q359 WeakPolarHBondContact O-CB 3.3Å; M355-Q359 WeakPolarHBondContact O-CG 3.27Å; M355-Q359 PolarHBondContact O-N 2.72Å; M355-Q359 PolarHBondContact O-NE2 3.1Å; H357-Q359 VanDerWaalsContact C-N 3.28Å; H357-Q359 PolarHBondContact O-N 3.07Å; Q359-S362 PolarHBondContact O-N 3.18Å; Q359-S362 PolarHBondContact O-OG 2.92Å; Q359-S363 PolarHBondContact O-N 3.48Å; Q359-P379 HydrophobicContact CG-CB 4.18Å
360	R	62.9	Low	59.2	Low	135 Å²	135	78.4 Å²	78.4	51%	0.509	43%	0.434	S	S	.	.	H	α-helix	trans	-62.3	-42.6	175.1	-70.9	-179	-178.6	-156.5	-0.1	112.4	H356 H357 S362 S363 M364	H356-R360 PolarHBondContact CE1-NE 3.47Å; H356-R360 PolarHBondContact CE1-NH2 3.2Å; H356-R360 PolarHBondContact NE2-NE 3.25Å; H356-R360 PolarHBondContact NE2-NH2 3.31Å; H356-R360 PolarHBondContact O-N 2.95Å; H357-R360 PolarHBondContact O-N 2.9Å; R360-S362 VanDerWaalsContact C-N 3.29Å; R360-S362 PolarHBondContact O-N 2.74Å; R360-S363 PolarHBondContact O-N 3.18Å; R360-S363 PolarHBondContact O-OG 3.19Å; R360-M364 WeakPolarHBondContact O-CG 3.48Å
361	L	56	Low	56.6	Low	93 Å²	93	82.1 Å²	82.1	49%	0.487	47%	0.468	S	S	.	.	H	α-helix	trans	-63.1	-37.1	177.5	-69.1	167.2	0	0	0	111.7	F307 H357 M358 S363	F307-L361 HydrophobicContact CD1-CD1 3.9Å; F307-L361 HydrophobicContact CE1-CD1 3.76Å; H357-L361 PolarHBondContact O-N 3.17Å; M358-L361 PolarHBondContact O-N 3.39Å; L361-S363 VanDerWaalsContact C-N 3.29Å; L361-S363 PolarHBondContact O-N 3.12Å
362	S	52.6	Low	54	Low	76 Å²	76	93 Å²	93	53%	0.531	51%	0.508	S	S	.	.	H	α-helix	trans	-65.6	-27.5	176.3	77.4	0	0	0	0	114.1	M358 Q359 R360	M358-S362 PolarHBondContact O-N 3.48Å; Q359-S362 PolarHBondContact O-N 3.18Å; Q359-S362 PolarHBondContact O-OG 2.92Å; R360-S362 VanDerWaalsContact C-N 3.29Å; R360-S362 PolarHBondContact O-N 2.74Å
363	S	45	Very low	51.8	Low	85 Å²	85	95.8 Å²	95.8	59%	0.594	51%	0.514	S	S	*	.	H	α-helix	trans	-89.5	-11	-174.7	68	0	0	0	0	115.1	Q359 R360 L361	Q359-S363 PolarHBondContact O-N 3.48Å; R360-S363 PolarHBondContact O-N 3.18Å; R360-S363 PolarHBondContact O-OG 3.19Å; L361-S363 VanDerWaalsContact C-N 3.29Å; L361-S363 PolarHBondContact O-N 3.12Å
364	M	34.1	Very low	49.3	Very low	147 Å²	147	96.1 Å²	96.1	72%	0.724	54%	0.537	S	S	*	.			trans	-101.6	-2	-170.4	-71.7	-67.5	173.8	0	0	115.3	R360 P366	R360-M364 WeakPolarHBondContact O-CG 3.48Å; M364-P366 WeakPolarHBondContact O-CD 3.36Å
365	R	39.8	Very low	47.4	Very low	145 Å²	145	103.1 Å²	103.1	55%	0.547	56%	0.563	S	S	.	*			trans	-64.3	110.5	-177	-73.3	-178.8	168.9	-176.5	-5.4	112.2	D173	D173-R365 IonicContact OD2-CZ 3.11Å; D173-R365 IonicContact OD2-NH1 2.8Å; D173-R365 PolarHBondContact OD2-NH1 3.44Å; D173-R365 IonicContact OD2-NH2 2.78Å; D173-R365 PolarHBondContact OD2-NH2 2.86Å
366	P	31.3	Very low	45.3	Very low	130 Å²	130	106.7 Å²	106.7	84%	0.844	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	139.9	176.2	-3.7	24	0	0	0	111	M364	M364-P366 WeakPolarHBondContact O-CD 3.36Å
367	G	39.4	Very low	43.9	Very low	83 Å²	83	110 Å²	110	86%	0.856	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.1	-1.6	166.5	0	0	0	0	0	117.4
368	Q	35.8	Very low	43.2	Very low	131 Å²	131	113.4 Å²	113.4	61%	0.612	63%	0.628	S	S	*	*	S	Bend	trans	-87	142.2	168.3	-63.7	-170.4	-2	0	0	110.8
369	S	29.9	Very low	42.9	Very low	84 Å²	84	114.6 Å²	114.6	59%	0.587	64%	0.637	S	S	*	*			trans	-74	140	-165.5	62.9	0	0	0	0	113.3	A371	S369-A371 PolarHBondContact O-N 2.94Å; S369-A371 VanDerWaalsContact O-N 3.1Å
370	P	31.9	Very low	43.3	Very low	122 Å²	122	112.2 Å²	112.2	79%	0.792	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-64.4	-21.4	-172	-24.7	34.7	0	0	0	115.4	R372	P370-R372 VanDerWaalsContact C-N 3.29Å; P370-R372 PolarHBondContact O-N 2.8Å; P370-R372 VanDerWaalsContact O-N 3.13Å
371	A	30.7	Very low	44.3	Very low	96 Å²	96	107.9 Å²	107.9	79%	0.793	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-75.4	-1.8	-160.8	0	0	0	0	0	116.4	S369	S369-A371 PolarHBondContact O-N 2.94Å; S369-A371 VanDerWaalsContact O-N 3.1Å
372	R	34.3	Very low	45.8	Very low	232 Å²	232	104.5 Å²	104.5	88%	0.875	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-122.3	0.5	178.4	-72.6	-172.3	172.1	-177.7	-2.4	115.4	P370 A374	P370-R372 VanDerWaalsContact C-N 3.29Å; P370-R372 PolarHBondContact O-N 2.8Å; P370-R372 VanDerWaalsContact O-N 3.13Å; R372-A374 VanDerWaalsContact C-N 3.26Å; R372-A374 PolarHBondContact O-N 2.82Å
373	H	37.1	Very low	47.4	Very low	129 Å²	129	102.6 Å²	102.6	60%	0.597	58%	0.582	S	S	*	*			trans	-85.7	57.6	175.8	-73.7	-78.3	0	0	0	113.3	R375	H373-R375 PolarHBondContact O-N 3.41Å
374	A	27.8	Very low	49.4	Very low	104 Å²	104	101.8 Å²	101.8	86%	0.86	58%	0.575	S	S	*	*			trans	-72.5	3	163.4	0	0	0	0	0	112.9	R372	R372-A374 VanDerWaalsContact C-N 3.26Å; R372-A374 PolarHBondContact O-N 2.82Å
375	R	40	Very low	51.8	Low	146 Å²	146	99.7 Å²	99.7	55%	0.551	57%	0.567	S	S	*	*			trans	-132.9	102	174.2	-71.5	-179.5	172	-177	-6.4	109.3	H373 Q377	H373-R375 PolarHBondContact O-N 3.41Å; R375-Q377 PolarHBondContact O-N 3.09Å
376	A	36.7	Very low	54.2	Low	97 Å²	97	92.8 Å²	92.8	80%	0.802	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-65.3	116.5	146.2	0	0	0	0	0	106.3	Q378	A376-Q378 PolarHBondContact O-N 3.2Å; A376-Q378 VanDerWaalsContact O-N 3.11Å
377	Q	47.7	Very low	56.9	Low	150 Å²	150	87.6 Å²	87.6	70%	0.701	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-62.1	116.3	176.1	-75.4	173.6	-74.6	0	0	108.1	R375	R375-Q377 PolarHBondContact O-N 3.09Å
378	Q	55.8	Low	59.2	Low	105 Å²	105	88.9 Å²	88.9	49%	0.491	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-64.2	136.9	168.9	-70.6	-161.6	22.4	0	0	108.1	A376 V380 L443	A376-Q378 PolarHBondContact O-N 3.2Å; A376-Q378 VanDerWaalsContact O-N 3.11Å; Q378-V380 PolarHBondContact O-N 3.32Å; Q378-L443 HydrophobicContact CB-CD1 4.02Å; Q378-L443 HydrophobicContact CB-CD2 4.24Å
379	P	63.8	Low	61.7	Low	49 Å²	49	84 Å²	84	32%	0.318	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-62.7	124.7	-174.8	24.5	-34.5	0	0	0	110.5	Q359	Q359-P379 HydrophobicContact CG-CB 4.18Å
380	V	76.4	Confident	64.4	Low	18 Å²	18	80 Å²	80	11%	0.109	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-57.4	139.3	171	178.4	0	0	0	0	108.5	M355 Q378 L443 V445	M355-V380 HydrophobicContact CE-CB 4.1Å; M355-V380 WeakPolarHBondContact CE-O 3.39Å; Q378-V380 PolarHBondContact O-N 3.32Å; V380-L443 WeakPolarHBondContact CA-O 3.5Å; V380-V445 HydrophobicContact CG1-CG2 3.72Å
381	S	83.6	Confident	67	Low	43 Å²	43	76 Å²	76	30%	0.301	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	156.5	-175.6	53.7	0	0	0	0	111.2	L443 L444 V445	S381-L443 PolarHBondContact N-O 3.39Å; S381-L443 PolarHBondContact OG-O 2.77Å; S381-L444 CarbonylContact O-C 3.08Å; S381-L444 VanDerWaalsContact O-CA 3.23Å; S381-L444 WeakPolarHBondContact O-CA 3.49Å; S381-L444 VanDerWaalsContact OG-CD2 3.23Å; S381-L444 WeakPolarHBondContact OG-CD2 3.22Å; S381-V445 PolarHBondContact O-N 3.34Å
382	W	87.8	Confident	69.5	Low	22 Å²	22	79.4 Å²	79.4	8%	0.083	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	135.5	-175.9	-70.1	66.1	0	0	0	110.9	V351 A386 L387 L390 M430 A433 V445 V450	V351-W382 HydrophobicContact CG1-CD2 4.16Å; V351-W382 HydrophobicContact CG1-CG 4.08Å; W382-A386 HydrophobicContact CE3-CB 3.92Å; W382-A386 HydrophobicContact CZ3-CB 4.49Å; W382-L387 HydrophobicContact CB-CD1 4.37Å; W382-L387 HydrophobicContact CB-CD2 3.97Å; W382-L387 HydrophobicContact CB-CG 4Å; W382-L387 HydrophobicContact CD2-CD2 4.16Å; W382-L387 HydrophobicContact CE3-CD2 3.91Å; W382-L387 HydrophobicContact CG-CD2 4.21Å; W382-L390 HydrophobicContact CH2-CD2 3.95Å; W382-L390 HydrophobicContact CZ3-CB 4.46Å; W382-L390 HydrophobicContact CZ3-CD2 3.73Å; W382-M430 HydrophobicContact CZ2-CB 4.45Å; W382-M430 HydrophobicContact CZ2-CG 4.1Å; W382-A433 HydrophobicContact CH2-CB 3.68Å; W382-A433 HydrophobicContact CZ2-CB 4.2Å; W382-A433 HydrophobicContact CZ3-CB 4.46Å; W382-V445 HydrophobicContact CD2-CB 3.98Å; W382-V445 HydrophobicContact CD2-CG1 4.09Å; W382-V445 HydrophobicContact CD2-CG2 4.27Å; W382-V445 HydrophobicContact CE3-CB 4.2Å; W382-V445 HydrophobicContact CE3-CG1 3.85Å; W382-V445 HydrophobicContact CG-CB 4.27Å; W382-V445 HydrophobicContact CH2-CG1 4.08Å; W382-V445 HydrophobicContact CZ2-CG1 4.3Å; W382-V445 HydrophobicContact CZ2-CG2 4.36Å; W382-V445 HydrophobicContact CZ3-CG1 3.85Å; W382-V450 HydrophobicContact CH2-CG2 4.42Å; W382-V450 HydrophobicContact CZ3-CG2 3.71Å
383	L	85.8	Confident	71.8	Confident	37 Å²	37	69.5 Å²	69.5	19%	0.194	37%	0.367	C	S	.	.			trans	-73.3	151.2	168	-72.3	173.8	0	0	0	110.6	D385 A386 L387 L444 V445 D446	L383-D385 PolarHBondContact O-N 3.02Å; L383-A386 HydrophobicContact CB-CB 4.37Å; L383-A386 WeakPolarHBondContact O-CB 3.38Å; L383-A386 PolarHBondContact O-N 3.43Å; L383-L387 PolarHBondContact O-N 3Å; L383-L387 VanDerWaalsContact O-N 3.17Å; L383-L444 HydrophobicContact CD2-CD1 3.97Å; L383-L444 HydrophobicContact CD2-CD2 3.85Å; L383-L444 HydrophobicContact CD2-CG 4.42Å; L383-L444 HydrophobicContact CG-CB 4.32Å; L383-L444 HydrophobicContact CG-CD1 4.41Å; L383-L444 HydrophobicContact CG-CD2 4.02Å; L383-L444 HydrophobicContact CG-CG 4.5Å; L383-V445 WeakPolarHBondContact CB-O 3.24Å; L383-V445 PolarHBondContact N-O 3.47Å; L383-D446 HydrophobicContact CD1-CB 3.91Å
384	P	86.6	Confident	73.9	Confident	68 Å²	68	63.4 Å²	63.4	44%	0.442	34%	0.338	S	S	.	.	H	α-helix	trans	-53.9	-43.5	175.6	-25.3	35.2	0	0	0	112.1	A386 L387 H388	P384-A386 VanDerWaalsContact C-N 3.26Å; P384-A386 PolarHBondContact O-N 3.3Å; P384-L387 PolarHBondContact O-N 3.26Å; P384-L387 VanDerWaalsContact O-N 3.1Å; P384-H388 PolarHBondContact O-CD2 3.44Å; P384-H388 VanDerWaalsContact O-CD2 3.24Å; P384-H388 PolarHBondContact O-N 2.82Å
385	D	85.4	Confident	76.2	Confident	103 Å²	103	63.6 Å²	63.6	55%	0.551	32%	0.317	S	S	*	.	H	α-helix	trans	-65.1	-29.8	-179.5	-50.5	-24.5	0	0	0	112.5	L383 T389	L383-D385 PolarHBondContact O-N 3.02Å; D385-T389 WeakPolarHBondContact O-CB 3.45Å; D385-T389 PolarHBondContact O-N 3.17Å; D385-T389 PolarHBondContact O-OG1 3.06Å
386	A	89.9	Confident	77.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68.5	-43.6	172.7	0	0	0	0	0	111	W382 L383 P384 T389 L390 V445 D446 V450	W382-A386 HydrophobicContact CE3-CB 3.92Å; W382-A386 HydrophobicContact CZ3-CB 4.49Å; L383-A386 HydrophobicContact CB-CB 4.37Å; L383-A386 WeakPolarHBondContact O-CB 3.38Å; L383-A386 PolarHBondContact O-N 3.43Å; P384-A386 VanDerWaalsContact C-N 3.26Å; P384-A386 PolarHBondContact O-N 3.3Å; A386-T389 PolarHBondContact O-N 3.34Å; A386-L390 WeakPolarHBondContact O-CB 3.39Å; A386-L390 PolarHBondContact O-N 3.45Å; A386-V445 HydrophobicContact CB-CG1 4.27Å; A386-V445 WeakPolarHBondContact CB-O 3.47Å; A386-D446 WeakPolarHBondContact CB-O 3.45Å; A386-V450 HydrophobicContact CB-CG2 4.12Å
387	L	89.4	Confident	78.1	Confident	20 Å²	20	56.6 Å²	56.6	11%	0.105	28%	0.283	C	S	.	.	H	α-helix	trans	-66.6	-38.7	175.5	-63.9	174.1	0	0	0	112.1	I344 L347 V351 W382 L383 P384 L390 Y391	I344-L387 HydrophobicContact CD1-CB 4.46Å; L347-L387 WeakPolarHBondContact CD2-O 3.03Å; V351-L387 HydrophobicContact CB-CD2 4.49Å; V351-L387 HydrophobicContact CG1-CD2 4.41Å; V351-L387 HydrophobicContact CG2-CD2 4.41Å; W382-L387 HydrophobicContact CB-CD1 4.37Å; W382-L387 HydrophobicContact CB-CD2 3.97Å; W382-L387 HydrophobicContact CB-CG 4Å; W382-L387 HydrophobicContact CD2-CD2 4.16Å; W382-L387 HydrophobicContact CE3-CD2 3.91Å; W382-L387 HydrophobicContact CG-CD2 4.21Å; L383-L387 PolarHBondContact O-N 3Å; L383-L387 VanDerWaalsContact O-N 3.17Å; P384-L387 PolarHBondContact O-N 3.26Å; P384-L387 VanDerWaalsContact O-N 3.1Å; L387-L390 PolarHBondContact O-N 3.11Å; L387-Y391 VanDerWaalsContact O-CB 3.28Å; L387-Y391 WeakPolarHBondContact O-CB 3.46Å; L387-Y391 PolarHBondContact O-N 3.09Å
388	H	87.2	Confident	78.2	Confident	111 Å²	111	54.9 Å²	54.9	51%	0.514	28%	0.275	S	S	.	.	H	α-helix	trans	-62.1	-41.6	171.4	-81.8	-74.9	0	0	0	112.1	I344 P384 Y392	I344-H388 HydrophobicContact CD1-CB 4.29Å; I344-H388 VanDerWaalsContact CD1-CE1 3.43Å; I344-H388 WeakPolarHBondContact CD1-CE1 3.25Å; I344-H388 VanDerWaalsContact CD1-ND1 3.32Å; I344-H388 WeakPolarHBondContact CD1-ND1 3.34Å; P384-H388 PolarHBondContact O-CD2 3.44Å; P384-H388 VanDerWaalsContact O-CD2 3.24Å; P384-H388 PolarHBondContact O-N 2.82Å; H388-Y392 PolarHBondContact O-N 3.44Å; H388-Y392 VanDerWaalsContact O-N 3.1Å
389	T	87.1	Confident	77.9	Confident	28 Å²	28	53.1 Å²	53.1	17%	0.172	27%	0.267	C	S	.	.	H	α-helix	trans	-68.7	-39.1	177.9	-54.8	0	0	0	0	111.6	D385 A386 Y392 F393 S447 V450 R451	D385-T389 WeakPolarHBondContact O-CB 3.45Å; D385-T389 PolarHBondContact O-N 3.17Å; D385-T389 PolarHBondContact O-OG1 3.06Å; A386-T389 PolarHBondContact O-N 3.34Å; T389-Y392 WeakPolarHBondContact O-CB 3.35Å; T389-Y392 PolarHBondContact O-N 3.49Å; T389-F393 HydrophobicContact CG2-CE2 4.02Å; T389-F393 WeakPolarHBondContact O-CD2 3.36Å; T389-S447 WeakPolarHBondContact OG1-CB 3.13Å; T389-V450 HydrophobicContact CG2-CB 4.03Å; T389-V450 HydrophobicContact CG2-CG1 3.8Å; T389-R451 HydrophobicContact CG2-CG 4.11Å
390	L	87.9	Confident	77.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-69.4	-40.4	176.6	-179	60.8	0	0	0	111.4	L347 V351 W382 A386 L387 Y392 F393 L394 L426 W429 V450	L347-L390 HydrophobicContact CD1-CD2 3.96Å; L347-L390 HydrophobicContact CD1-CG 4.27Å; L347-L390 HydrophobicContact CD2-CB 4.05Å; L347-L390 HydrophobicContact CD2-CD2 4.17Å; L347-L390 HydrophobicContact CD2-CG 3.96Å; L347-L390 HydrophobicContact CG-CD2 4.46Å; V351-L390 HydrophobicContact CG2-CD2 4.38Å; W382-L390 HydrophobicContact CH2-CD2 3.95Å; W382-L390 HydrophobicContact CZ3-CB 4.46Å; W382-L390 HydrophobicContact CZ3-CD2 3.73Å; A386-L390 WeakPolarHBondContact O-CB 3.39Å; A386-L390 PolarHBondContact O-N 3.45Å; L387-L390 PolarHBondContact O-N 3.11Å; L390-Y392 VanDerWaalsContact C-N 3.29Å; L390-Y392 PolarHBondContact O-N 3.05Å; L390-F393 PolarHBondContact O-N 2.62Å; L390-F393 VanDerWaalsContact O-N 3.16Å; L390-L394 HydrophobicContact CD1-CD1 3.79Å; L390-L394 HydrophobicContact CD1-CG 4.13Å; L390-L394 HydrophobicContact CD2-CD1 4.41Å; L390-L394 HydrophobicContact CG-CD1 3.83Å; L390-L394 HydrophobicContact CG-CG 4.45Å; L390-L394 PolarHBondContact O-N 3.42Å; L390-L394 VanDerWaalsContact O-N 3.08Å; L390-L426 HydrophobicContact CD2-CD1 4.13Å; L390-W429 HydrophobicContact CD1-CB 3.91Å; L390-W429 HydrophobicContact CD1-CD2 3.67Å; L390-W429 HydrophobicContact CD1-CE3 3.44Å; L390-W429 VanDerWaalsContact CD1-CE3 3.44Å; L390-W429 HydrophobicContact CD1-CG 3.9Å; L390-W429 HydrophobicContact CD1-CZ3 4.18Å; L390-V450 HydrophobicContact CB-CG1 3.97Å; L390-V450 HydrophobicContact CD1-CG1 4.31Å
391	Y	85.3	Confident	75.7	Confident	38 Å²	38	57 Å²	57	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-59	-39.3	173.5	178.6	-110.4	0	0	0	111.8	G342 I344 L387 F393 L394 R395	G342-Y391 PolarHBondContact O-OH 3Å; G342-Y391 VanDerWaalsContact O-OH 3.07Å; I344-Y391 HydrophobicContact CB-CD2 4.48Å; I344-Y391 HydrophobicContact CB-CG 4.27Å; L387-Y391 VanDerWaalsContact O-CB 3.28Å; L387-Y391 WeakPolarHBondContact O-CB 3.46Å; L387-Y391 PolarHBondContact O-N 3.09Å; Y391-F393 VanDerWaalsContact C-N 3.26Å; Y391-F393 PolarHBondContact O-N 3.48Å; Y391-L394 PolarHBondContact O-N 2.95Å; Y391-R395 HydrophobicContact CE1-CB 4.37Å; Y391-R395 HydrophobicContact CE1-CG 4.33Å; Y391-R395 HydrophobicContact CE2-CB 4.14Å; Y391-R395 HydrophobicContact CE2-CG 4.42Å; Y391-R395 WeakPolarHBondContact O-CB 3.38Å; Y391-R395 PolarHBondContact O-N 2.86Å
392	Y	84.4	Confident	73.8	Confident	167 Å²	167	62.4 Å²	62.4	66%	0.655	31%	0.31	S	S	*	.	H	α-helix	trans	-56.1	-37.5	175.9	173.4	-94.7	0	0	0	113.3	H388 T389 L390	H388-Y392 PolarHBondContact O-N 3.44Å; H388-Y392 VanDerWaalsContact O-N 3.1Å; T389-Y392 WeakPolarHBondContact O-CB 3.35Å; T389-Y392 PolarHBondContact O-N 3.49Å; L390-Y392 VanDerWaalsContact C-N 3.29Å; L390-Y392 PolarHBondContact O-N 3.05Å
393	F	82.2	Confident	71.8	Confident	25 Å²	25	67 Å²	67	11%	0.11	33%	0.333	C	S	.	.	H	α-helix	trans	-84	-28	178.5	-65	-66.3	0	0	0	114.3	T389 L390 Y391 F420 W429 V450 A454 L458 L461	T389-F393 HydrophobicContact CG2-CE2 4.02Å; T389-F393 WeakPolarHBondContact O-CD2 3.36Å; L390-F393 PolarHBondContact O-N 2.62Å; L390-F393 VanDerWaalsContact O-N 3.16Å; Y391-F393 VanDerWaalsContact C-N 3.26Å; Y391-F393 PolarHBondContact O-N 3.48Å; F393-F420 HydrophobicContact CD1-CE2 4.35Å; F393-W429 HydrophobicContact CB-CH2 3.49Å; F393-W429 VanDerWaalsContact CB-CH2 3.49Å; F393-W429 HydrophobicContact CB-CZ2 3.88Å; F393-W429 HydrophobicContact CB-CZ3 4.17Å; F393-W429 HydrophobicContact CD1-CH2 4.3Å; F393-W429 AromaticContact CD2-CH2 3.84Å; F393-W429 HydrophobicContact CD2-CH2 3.84Å; F393-W429 AromaticContact CD2-CZ3 3.9Å; F393-W429 HydrophobicContact CD2-CZ3 3.9Å; F393-W429 AromaticContact CG-CH2 3.63Å; F393-W429 HydrophobicContact CG-CH2 3.63Å; F393-W429 HydrophobicContact CG-CZ2 4.45Å; F393-W429 HydrophobicContact CG-CZ3 4.17Å; F393-V450 HydrophobicContact CD2-CG1 4.38Å; F393-A454 HydrophobicContact CD1-CB 4.3Å; F393-A454 HydrophobicContact CD2-CB 4.02Å; F393-A454 HydrophobicContact CE1-CB 3.89Å; F393-A454 HydrophobicContact CE2-CB 3.57Å; F393-A454 HydrophobicContact CG-CB 4.37Å; F393-A454 HydrophobicContact CZ-CB 3.5Å; F393-L458 HydrophobicContact CD1-CD1 3.9Å; F393-L458 HydrophobicContact CG-CD1 4.46Å; F393-L461 HydrophobicContact CD1-CD1 4.28Å; F393-L461 HydrophobicContact CE1-CD1 3.61Å; F393-L461 HydrophobicContact CZ-CD1 4.27Å
394	L	80.6	Confident	69.9	Low	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-96.2	-8.9	-178.3	-62.9	179.4	0	0	0	114.7	C340 V341 L347 L390 Y391 C396 L426	C340-L394 CarbonylContact C-O 3.46Å; C340-L394 VanDerWaalsContact CA-O 3.29Å; C340-L394 WeakPolarHBondContact CA-O 3.18Å; V341-L394 HydrophobicContact CG2-CB 4.23Å; V341-L394 HydrophobicContact CG2-CD1 4.24Å; V341-L394 PolarHBondContact N-O 3.25Å; L347-L394 HydrophobicContact CD1-CD1 3.87Å; L390-L394 HydrophobicContact CD1-CD1 3.79Å; L390-L394 HydrophobicContact CD1-CG 4.13Å; L390-L394 HydrophobicContact CD2-CD1 4.41Å; L390-L394 HydrophobicContact CG-CD1 3.83Å; L390-L394 HydrophobicContact CG-CG 4.45Å; L390-L394 PolarHBondContact O-N 3.42Å; L390-L394 VanDerWaalsContact O-N 3.08Å; Y391-L394 PolarHBondContact O-N 2.95Å; L394-C396 PolarHBondContact O-N 2.87Å; L394-L426 HydrophobicContact CD1-CD1 3.79Å
395	R	75.7	Confident	68.2	Low	108 Å²	108	72.1 Å²	72.1	41%	0.408	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-63.5	124.9	-177.7	172.7	-178.9	179.5	-143.8	5	112	Y391 P397 E400	Y391-R395 HydrophobicContact CE1-CB 4.37Å; Y391-R395 HydrophobicContact CE1-CG 4.33Å; Y391-R395 HydrophobicContact CE2-CB 4.14Å; Y391-R395 HydrophobicContact CE2-CG 4.42Å; Y391-R395 WeakPolarHBondContact O-CB 3.38Å; Y391-R395 PolarHBondContact O-N 2.86Å; R395-P397 WeakPolarHBondContact O-CD 3.42Å; R395-E400 IonicContact CZ-OE1 2.75Å; R395-E400 IonicContact CZ-OE2 3.78Å; R395-E400 VanDerWaalsContact NE-CD 3.27Å; R395-E400 IonicContact NE-OE1 2.72Å; R395-E400 PolarHBondContact NE-OE1 3.15Å; R395-E400 IonicContact NE-OE2 3.56Å; R395-E400 PolarHBondContact NE-OE2 2.68Å; R395-E400 IonicContact NH2-OE1 2.68Å; R395-E400 PolarHBondContact NH2-OE1 2.84Å; R395-E400 IonicContact NH2-OE2 3.12Å; R395-E400 PolarHBondContact NH2-OE2 2.67Å
396	C	64.1	Low	66.6	Low	18 Å²	18	74.5 Å²	74.5	12%	0.122	38%	0.376	C	S	.	.			trans	-93.1	115.3	169.4	-171.9	0	0	0	0	111	C340 V341 L394 Q398 M399	C340-C396 HydrophobicContact CB-CB 4.22Å; V341-C396 PolarHBondContact O-N 3.39Å; L394-C396 PolarHBondContact O-N 2.87Å; C396-Q398 PolarHBondContact O-N 2.91Å; C396-M399 HydrophobicContact CB-CG 4.17Å; C396-M399 HydrophobicContact CB-SD 3.93Å; C396-M399 PolarHBondContact O-N 2.69Å; C396-M399 VanDerWaalsContact O-N 3.16Å
397	P	53.2	Low	64.6	Low	79 Å²	79	80.2 Å²	80.2	51%	0.513	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-13.1	179.6	-24.4	34.9	0	0	0	115	R395	R395-P397 WeakPolarHBondContact O-CD 3.42Å
398	Q	50.3	Low	62.3	Low	114 Å²	114	86.6 Å²	86.6	53%	0.533	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-10	-177.9	-60.6	173	-17	0	0	113.3	C396	C396-Q398 PolarHBondContact O-N 2.91Å
399	M	49.9	Very low	60	Low	67 Å²	67	86.4 Å²	86.4	33%	0.33	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-24.5	-177.5	-66.2	174.8	74.2	0	0	113.5	G342 C396 S401 M402	G342-M399 VanDerWaalsContact CA-CE 3.44Å; C396-M399 HydrophobicContact CB-CG 4.17Å; C396-M399 HydrophobicContact CB-SD 3.93Å; C396-M399 PolarHBondContact O-N 2.69Å; C396-M399 VanDerWaalsContact O-N 3.16Å; M399-S401 VanDerWaalsContact C-N 3.26Å; M399-S401 PolarHBondContact O-N 2.99Å; M399-M402 WeakPolarHBondContact O-CB 3.43Å; M399-M402 PolarHBondContact O-N 2.81Å; M399-M402 VanDerWaalsContact O-N 3.12Å
400	E	45.3	Very low	57.7	Low	74 Å²	74	89.7 Å²	89.7	35%	0.346	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-66.7	-23.2	-171.9	-61	-173.9	121.4	0	0	114.2	R395 M402	R395-E400 IonicContact CZ-OE1 2.75Å; R395-E400 IonicContact CZ-OE2 3.78Å; R395-E400 VanDerWaalsContact NE-CD 3.27Å; R395-E400 IonicContact NE-OE1 2.72Å; R395-E400 PolarHBondContact NE-OE1 3.15Å; R395-E400 IonicContact NE-OE2 3.56Å; R395-E400 PolarHBondContact NE-OE2 2.68Å; R395-E400 IonicContact NH2-OE1 2.68Å; R395-E400 PolarHBondContact NH2-OE1 2.84Å; R395-E400 IonicContact NH2-OE2 3.12Å; R395-E400 PolarHBondContact NH2-OE2 2.67Å; E400-M402 PolarHBondContact O-N 3.23Å; E400-M402 VanDerWaalsContact O-N 3.11Å
401	S	47.1	Very low	55.4	Low	75 Å²	75	101.4 Å²	101.4	52%	0.524	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-70.1	0.1	175	56.8	0	0	0	0	114.1	M399	M399-S401 VanDerWaalsContact C-N 3.26Å; M399-S401 PolarHBondContact O-N 2.99Å
402	M	44.7	Very low	53.4	Low	156 Å²	156	107.3 Å²	107.3	77%	0.768	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-106.6	-15.6	-176.7	-139.2	163.2	65.9	0	0	113.8	M399 E400	M399-M402 WeakPolarHBondContact O-CB 3.43Å; M399-M402 PolarHBondContact O-N 2.81Å; M399-M402 VanDerWaalsContact O-N 3.12Å; E400-M402 PolarHBondContact O-N 3.23Å; E400-M402 VanDerWaalsContact O-N 3.11Å
403	E	45.8	Very low	51.1	Low	118 Å²	118	101.9 Å²	101.9	55%	0.551	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-12.3	-177.3	-63.8	-166.2	147	0	0	114.4	S343	S343-E403 WeakPolarHBondContact CB-OE1 3.34Å
404	N	45.8	Very low	49	Very low	92 Å²	92	107 Å²	107	49%	0.492	56%	0.564	S	S	.	*			trans	-125.2	93.4	-179.4	-95.3	-68.2	0	0	0	112.8	N406 L407	N404-N406 PolarHBondContact O-N 3.31Å; N404-L407 HydrophobicContact CB-CD1 3.92Å; N404-L407 HydrophobicContact CB-CG 4.33Å
405	P	51.1	Low	46.9	Very low	122 Å²	122	110.1 Å²	110.1	79%	0.792	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-3.7	178.8	30.8	-36.6	0	0	0	114.4
406	N	52.6	Low	45.1	Very low	152 Å²	152	112 Å²	112	81%	0.813	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	2.9	-176.7	-64.6	-35.5	0	0	0	113.9	N404	N404-N406 PolarHBondContact O-N 3.31Å
407	L	46.1	Very low	43.8	Very low	121 Å²	121	117.6 Å²	117.6	63%	0.634	62%	0.621	S	S	*	*	S	Bend	trans	-99.5	130.8	170.4	-74.5	169.5	0	0	0	108.5	N404	N404-L407 HydrophobicContact CB-CD1 3.92Å; N404-L407 HydrophobicContact CB-CG 4.33Å
408	D	40.8	Very low	43.4	Very low	153 Å²	153	118.5 Å²	118.5	82%	0.818	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-52.5	131.6	167.6	-91.5	-45.7	0	0	0	108.8	P410	D408-P410 WeakPolarHBondContact O-CD 3.44Å
409	P	39.6	Very low	43.2	Very low	107 Å²	107	117.9 Å²	117.9	70%	0.695	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-59.6	118.3	-175.9	22.9	-32.7	0	0	0	109.1	R411	P409-R411 PolarHBondContact O-N 3.07Å; P409-R411 VanDerWaalsContact O-N 3.15Å
410	P	38.3	Very low	43.3	Very low	98 Å²	98	116.4 Å²	116.4	64%	0.636	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-58.3	126.5	179.6	24.3	-33	0	0	0	107.6	D408 M412	D408-P410 WeakPolarHBondContact O-CD 3.44Å; P410-M412 WeakPolarHBondContact O-CA 3.44Å; P410-M412 PolarHBondContact O-N 2.82Å
411	R	40.3	Very low	43.6	Very low	245 Å²	245	117.2 Å²	117.2	93%	0.925	62%	0.616	S	S	*	*			trans	-42.8	113.1	-171.9	-76.4	-176.8	175.7	177.1	-0.6	109.4	P409 A413	P409-R411 PolarHBondContact O-N 3.07Å; P409-R411 VanDerWaalsContact O-N 3.15Å; R411-A413 PolarHBondContact O-N 3.38Å
412	M	43.4	Very low	44.3	Very low	162 Å²	162	116.9 Å²	116.9	80%	0.798	61%	0.608	S	S	*	*			trans	-74.6	64.9	-158.8	-159.5	-179.6	-165.3	0	0	112.6	P410 L414	P410-M412 WeakPolarHBondContact O-CA 3.44Å; P410-M412 PolarHBondContact O-N 2.82Å; M412-L414 PolarHBondContact O-N 3.13Å
413	A	36.9	Very low	45.7	Very low	53 Å²	53	110.5 Å²	110.5	44%	0.438	58%	0.577	S	S	.	*			trans	-72.2	107.8	170.3	0	0	0	0	0	107.9	Y54 R411 S415	Y54-A413 HydrophobicContact CE1-CB 3.9Å; Y54-A413 WeakPolarHBondContact OH-CB 3.35Å; R411-A413 PolarHBondContact O-N 3.38Å; A413-S415 VanDerWaalsContact C-N 3.34Å; A413-S415 PolarHBondContact O-N 2.92Å
414	L	37.2	Very low	47.5	Very low	134 Å²	134	105.4 Å²	105.4	70%	0.702	55%	0.554	S	S	*	*			trans	-63.5	94.2	172.6	-68.6	165	0	0	0	109.2	M412 K416	M412-L414 PolarHBondContact O-N 3.13Å; L414-K416 VanDerWaalsContact C-N 3.32Å; L414-K416 PolarHBondContact O-N 3.47Å
415	S	36	Very low	49.4	Very low	64 Å²	64	101 Å²	101	45%	0.448	53%	0.531	S	S	.	.			trans	-62.5	97.5	160.9	57.4	0	0	0	0	107.4	A413 E417	A413-S415 VanDerWaalsContact C-N 3.34Å; A413-S415 PolarHBondContact O-N 2.92Å; S415-E417 PolarHBondContact O-N 3.25Å
416	K	39.2	Very low	51.1	Low	149 Å²	149	95.3 Å²	95.3	65%	0.648	49%	0.494	S	S	*	.			trans	-63.3	-20.2	177.9	-67.4	-176.9	-179	175	0	112.2	S57 L414	S57-K416 PolarHBondContact O-NZ 3.44Å; L414-K416 VanDerWaalsContact C-N 3.32Å; L414-K416 PolarHBondContact O-N 3.47Å
417	E	36.5	Very low	52.7	Low	135 Å²	135	88.3 Å²	88.3	63%	0.631	46%	0.456	S	S	*	.			trans	-85.1	116.4	-179.8	-65	167.4	165.8	0	0	110.3	S415	S415-E417 PolarHBondContact O-N 3.25Å
418	R	45.1	Very low	54.6	Low	97 Å²	97	82.7 Å²	82.7	37%	0.366	43%	0.427	S	S	.	.			trans	-79.4	143.3	158.5	-65.3	179.2	172.1	-170.9	-4.3	108	F420 M421	R418-F420 WeakPolarHBondContact CB-O 3.5Å; R418-F420 PolarHBondContact O-N 3.48Å; R418-M421 HydrophobicContact CB-SD 4.03Å
419	P	44.5	Very low	57	Low	101 Å²	101	75.5 Å²	75.5	66%	0.656	39%	0.388	S	S	*	.	S	Bend	trans	-61.4	-31.1	175.8	25.6	-33.9	0	0	0	112.1
420	F	53.2	Low	59.4	Low	37 Å²	37	70.4 Å²	70.4	16%	0.162	36%	0.355	C	S	.	.	S	Bend	trans	-127.5	119	168.2	-52	-75	0	0	0	108.2	F393 R418 L422 L423 L458 L461	F393-F420 HydrophobicContact CD1-CE2 4.35Å; R418-F420 WeakPolarHBondContact CB-O 3.5Å; R418-F420 PolarHBondContact O-N 3.48Å; F420-L422 PolarHBondContact O-N 3.37Å; F420-L423 HydrophobicContact CB-CD2 3.88Å; F420-L423 HydrophobicContact CB-CG 4.36Å; F420-L423 HydrophobicContact CD2-CD2 4.23Å; F420-L423 HydrophobicContact CG-CD2 4.37Å; F420-L458 HydrophobicContact CB-CD2 4.47Å; F420-L458 HydrophobicContact CD1-CB 4.21Å; F420-L458 HydrophobicContact CD1-CD1 4.2Å; F420-L458 HydrophobicContact CD1-CD2 4.4Å; F420-L458 HydrophobicContact CD2-CD1 4.04Å; F420-L458 HydrophobicContact CE1-CB 4.18Å; F420-L458 HydrophobicContact CE1-CD1 4.06Å; F420-L458 HydrophobicContact CE2-CD1 3.91Å; F420-L458 HydrophobicContact CG-CD1 4.19Å; F420-L458 HydrophobicContact CG-CD2 4.27Å; F420-L458 HydrophobicContact CZ-CD1 3.93Å; F420-L461 HydrophobicContact CE1-CD1 4.3Å; F420-L461 HydrophobicContact CE1-CD2 4.33Å; F420-L461 HydrophobicContact CE1-CG 4.23Å; F420-L461 HydrophobicContact CZ-CD1 4.03Å; F420-L461 HydrophobicContact CZ-CD2 4.15Å; F420-L461 HydrophobicContact CZ-CG 4.29Å
421	M	51.1	Low	61.8	Low	90 Å²	90	66 Å²	66	44%	0.443	33%	0.326	S	S	.	.	S	Bend	trans	-72.3	-18.8	-176.6	-72.4	-63.7	-70.3	0	0	113.3	P73 R418	P73-M421 HydrophobicContact CG-CE 4.22Å; R418-M421 HydrophobicContact CB-SD 4.03Å
422	L	62.8	Low	64.2	Low	68 Å²	68	54.3 Å²	54.3	36%	0.356	28%	0.282	S	S	.	.	S	Bend	trans	-141.1	117.5	178.7	-158.6	146.4	0	0	0	108.8	K295 F420	K295-L422 HydrophobicContact CD-CD2 4.28Å; F420-L422 PolarHBondContact O-N 3.37Å
423	L	73.5	Confident	66.6	Low	22 Å²	22	46.7 Å²	46.7	12%	0.115	24%	0.244	C	C	.	.			trans	-106.3	139.4	-177.8	-74.5	168.3	0	0	0	110.1	T339 F420 L458	T339-L423 WeakPolarHBondContact CG2-O 3.28Å; T339-L423 WeakPolarHBondContact O-CD1 3.48Å; F420-L423 HydrophobicContact CB-CD2 3.88Å; F420-L423 HydrophobicContact CB-CG 4.36Å; F420-L423 HydrophobicContact CD2-CD2 4.23Å; F420-L423 HydrophobicContact CG-CD2 4.37Å; L423-L458 HydrophobicContact CD2-CD2 3.96Å
424	P	82.9	Confident	69.1	Low	11 Å²	11	44.9 Å²	44.9	7%	0.071	23%	0.227	C	C	.	.			trans	-66.1	151	172	-10.2	21.6	0	0	0	111.5	E428 L457 L458	P424-E428 HydrophobicContact CB-CB 4.24Å; P424-L457 HydrophobicContact CB-CD1 4.23Å; P424-L457 HydrophobicContact CG-CB 3.67Å; P424-L457 HydrophobicContact CG-CD1 4.03Å; P424-L457 HydrophobicContact CG-CG 4.35Å; P424-L458 HydrophobicContact CG-CD2 4.34Å
425	P	85.6	Confident	71.6	Confident	1 Å²	1	39 Å²	39	1%	0.006	20%	0.197	C	C	.	.			trans	-65.9	150.2	170.5	28.3	-32.9	0	0	0	111.3	L301 L336 L337 M427 E428	L301-P425 HydrophobicContact CD2-CG 4.14Å; L336-P425 WeakPolarHBondContact O-CB 3.26Å; L337-P425 HydrophobicContact CD2-CB 4.4Å; P425-M427 PolarHBondContact O-N 2.97Å; P425-M427 VanDerWaalsContact O-N 3.08Å; P425-E428 HydrophobicContact CG-CG 3.89Å; P425-E428 PolarHBondContact O-N 3.17Å
426	L	87	Confident	74.2	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-52.5	-33.7	-175.5	179.5	61.6	0	0	0	113.4	L336 A338 L347 L350 V351 L390 L394 E428 W429 M430	L336-L426 PolarHBondContact O-N 3.12Å; A338-L426 WeakPolarHBondContact O-CB 3.42Å; A338-L426 PolarHBondContact O-N 3.1Å; L347-L426 HydrophobicContact CD1-CD1 4Å; L350-L426 HydrophobicContact CB-CD2 3.89Å; V351-L426 HydrophobicContact CG2-CD1 4.23Å; V351-L426 HydrophobicContact CG2-CD2 4.37Å; L390-L426 HydrophobicContact CD2-CD1 4.13Å; L394-L426 HydrophobicContact CD1-CD1 3.79Å; L426-E428 VanDerWaalsContact C-N 3.26Å; L426-E428 PolarHBondContact O-N 2.66Å; L426-W429 PolarHBondContact O-N 2.68Å; L426-M430 HydrophobicContact CD1-CG 4.27Å; L426-M430 HydrophobicContact CD1-SD 4.49Å; L426-M430 HydrophobicContact CD2-SD 4.46Å; L426-M430 HydrophobicContact CG-CG 4.32Å; L426-M430 HydrophobicContact CG-SD 4.06Å; L426-M430 WeakPolarHBondContact O-CG 3.28Å; L426-M430 PolarHBondContact O-N 2.77Å
427	M	85.8	Confident	76.4	Confident	5 Å²	5	29.6 Å²	29.6	3%	0.025	15%	0.148	C	C	.	.	H	α-helix	trans	-53.9	-40.8	175	-168.9	-80.7	-65.6	0	0	112.8	L303 P304 F307 L336 P425 M430 R431	L303-M427 HydrophobicContact CD2-CB 4.39Å; L303-M427 HydrophobicContact CD2-CG 4.43Å; P304-M427 HydrophobicContact CG-CE 3.8Å; F307-M427 HydrophobicContact CE2-SD 4.48Å; L336-M427 HydrophobicContact CB-CB 4.1Å; L336-M427 HydrophobicContact CD2-CB 4Å; L336-M427 HydrophobicContact CD2-CG 4.07Å; L336-M427 WeakPolarHBondContact O-CB 3.49Å; L336-M427 PolarHBondContact O-N 2.95Å; P425-M427 PolarHBondContact O-N 2.97Å; P425-M427 VanDerWaalsContact O-N 3.08Å; M427-M430 PolarHBondContact O-N 2.79Å; M427-R431 WeakPolarHBondContact O-CB 3.35Å; M427-R431 PolarHBondContact O-N 3.15Å; M427-R431 HydrophobicContact SD-CB 4.43Å
428	E	86.4	Confident	78.7	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.019	13%	0.134	C	C	.	.	H	α-helix	trans	-74	-39.1	-177.2	-61.1	-68.4	179.9	0	0	111.6	C293 P424 P425 L426 M430 R431 V432 L457	C293-E428 HydrophobicContact CB-CB 4.24Å; C293-E428 HydrophobicContact CB-CG 3.57Å; C293-E428 WeakPolarHBondContact CB-OE1 3.4Å; P424-E428 HydrophobicContact CB-CB 4.24Å; P425-E428 HydrophobicContact CG-CG 3.89Å; P425-E428 PolarHBondContact O-N 3.17Å; L426-E428 VanDerWaalsContact C-N 3.26Å; L426-E428 PolarHBondContact O-N 2.66Å; E428-M430 VanDerWaalsContact C-N 3.32Å; E428-M430 PolarHBondContact O-N 3.11Å; E428-R431 PolarHBondContact O-N 3.45Å; E428-R431 IonicContact OE2-CZ 3.79Å; E428-R431 IonicContact OE2-NE 2.78Å; E428-R431 PolarHBondContact OE2-NE 2.91Å; E428-R431 IonicContact OE2-NH2 3.12Å; E428-R431 PolarHBondContact OE2-NH2 2.95Å; E428-V432 WeakPolarHBondContact O-CG2 3.32Å; E428-V432 PolarHBondContact O-N 3.36Å; E428-L457 HydrophobicContact CB-CD1 4.27Å
429	W	90.8	Very high	80.6	Confident	1 Å²	1	22.6 Å²	22.6	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-58.9	-43.9	169.9	-75.6	93.5	0	0	0	111.7	L390 F393 L426 A433 V450 T453 A454 L457 L458	L390-W429 HydrophobicContact CD1-CB 3.91Å; L390-W429 HydrophobicContact CD1-CD2 3.67Å; L390-W429 HydrophobicContact CD1-CE3 3.44Å; L390-W429 VanDerWaalsContact CD1-CE3 3.44Å; L390-W429 HydrophobicContact CD1-CG 3.9Å; L390-W429 HydrophobicContact CD1-CZ3 4.18Å; F393-W429 HydrophobicContact CB-CH2 3.49Å; F393-W429 VanDerWaalsContact CB-CH2 3.49Å; F393-W429 HydrophobicContact CB-CZ2 3.88Å; F393-W429 HydrophobicContact CB-CZ3 4.17Å; F393-W429 HydrophobicContact CD1-CH2 4.3Å; F393-W429 AromaticContact CD2-CH2 3.84Å; F393-W429 HydrophobicContact CD2-CH2 3.84Å; F393-W429 AromaticContact CD2-CZ3 3.9Å; F393-W429 HydrophobicContact CD2-CZ3 3.9Å; F393-W429 AromaticContact CG-CH2 3.63Å; F393-W429 HydrophobicContact CG-CH2 3.63Å; F393-W429 HydrophobicContact CG-CZ2 4.45Å; F393-W429 HydrophobicContact CG-CZ3 4.17Å; L426-W429 PolarHBondContact O-N 2.68Å; W429-A433 VanDerWaalsContact O-CB 3.26Å; W429-A433 WeakPolarHBondContact O-CB 3.45Å; W429-A433 PolarHBondContact O-N 3.39Å; W429-V450 HydrophobicContact CZ3-CG1 4.33Å; W429-T453 HydrophobicContact CD2-CG2 4.19Å; W429-T453 HydrophobicContact CE3-CG2 3.53Å; W429-T453 HydrophobicContact CZ3-CG2 4.05Å; W429-A454 HydrophobicContact CH2-CB 3.73Å; W429-A454 HydrophobicContact CZ3-CB 3.8Å; W429-L457 HydrophobicContact CD2-CD1 4.24Å; W429-L457 HydrophobicContact CG-CD1 4.26Å; W429-L458 HydrophobicContact CH2-CD1 3.78Å; W429-L458 HydrophobicContact CH2-CG 4.22Å; W429-L458 HydrophobicContact CZ2-CD1 3.81Å; W429-L458 HydrophobicContact CZ2-CD2 4.24Å; W429-L458 HydrophobicContact CZ2-CG 4.02Å
430	M	90	Very high	82.3	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-66.2	-48.3	177.5	-71.8	-179.3	57.7	0	0	111.7	V351 A354 M355 M358 W382 L426 M427 E428 V432 I434	V351-M430 HydrophobicContact CB-SD 4.49Å; V351-M430 HydrophobicContact CG1-CE 4.28Å; V351-M430 HydrophobicContact CG1-SD 4.41Å; V351-M430 HydrophobicContact CG2-SD 4.16Å; A354-M430 HydrophobicContact CB-CE 3.61Å; A354-M430 HydrophobicContact CB-SD 3.73Å; M355-M430 HydrophobicContact CG-CE 3.61Å; M355-M430 HydrophobicContact SD-CE 3.51Å; M355-M430 VanDerWaalsContact SD-CE 3.51Å; M358-M430 HydrophobicContact SD-CE 4.07Å; W382-M430 HydrophobicContact CZ2-CB 4.45Å; W382-M430 HydrophobicContact CZ2-CG 4.1Å; L426-M430 HydrophobicContact CD1-CG 4.27Å; L426-M430 HydrophobicContact CD1-SD 4.49Å; L426-M430 HydrophobicContact CD2-SD 4.46Å; L426-M430 HydrophobicContact CG-CG 4.32Å; L426-M430 HydrophobicContact CG-SD 4.06Å; L426-M430 WeakPolarHBondContact O-CG 3.28Å; L426-M430 PolarHBondContact O-N 2.77Å; M427-M430 PolarHBondContact O-N 2.79Å; E428-M430 VanDerWaalsContact C-N 3.32Å; E428-M430 PolarHBondContact O-N 3.11Å; M430-V432 PolarHBondContact O-N 2.89Å; M430-I434 HydrophobicContact CB-CD1 4.34Å; M430-I434 WeakPolarHBondContact O-CB 3.2Å; M430-I434 VanDerWaalsContact O-CD1 3.25Å; M430-I434 WeakPolarHBondContact O-CD1 3.42Å; M430-I434 WeakPolarHBondContact O-CG1 3.05Å; M430-I434 PolarHBondContact O-N 3.3Å
431	R	88.8	Confident	83.4	Confident	5 Å²	5	21 Å²	21	2%	0.019	10%	0.101	C	C	.	.	H	α-helix	trans	-53.4	-55.4	178.7	179	-178.3	62.2	76	0.1	111.3	R164 L165 L167 M427 E428 I434 V435	R164-R431 PolarHBondContact O-NH1 2.91Å; L165-R431 VanDerWaalsContact C-NH1 3.34Å; L165-R431 PolarHBondContact O-NH1 3.46Å; L167-R431 PolarHBondContact O-NH1 3.01Å; M427-R431 WeakPolarHBondContact O-CB 3.35Å; M427-R431 PolarHBondContact O-N 3.15Å; M427-R431 HydrophobicContact SD-CB 4.43Å; E428-R431 PolarHBondContact O-N 3.45Å; E428-R431 IonicContact OE2-CZ 3.79Å; E428-R431 IonicContact OE2-NE 2.78Å; E428-R431 PolarHBondContact OE2-NE 2.91Å; E428-R431 IonicContact OE2-NH2 3.12Å; E428-R431 PolarHBondContact OE2-NH2 2.95Å; R431-I434 PolarHBondContact O-N 2.96Å; R431-V435 VanDerWaalsContact O-CG2 3.22Å; R431-V435 WeakPolarHBondContact O-CG2 3.45Å; R431-V435 PolarHBondContact O-N 3.02Å
432	V	92	Very high	84.7	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-67.3	-43.3	-174	177	0	0	0	0	111.3	L165 E428 M430 I434 V435 H436 T453 L456 L457	L165-V432 HydrophobicContact CD2-CB 4.49Å; L165-V432 HydrophobicContact CD2-CG1 3.76Å; E428-V432 WeakPolarHBondContact O-CG2 3.32Å; E428-V432 PolarHBondContact O-N 3.36Å; M430-V432 PolarHBondContact O-N 2.89Å; V432-I434 PolarHBondContact O-N 3.27Å; V432-V435 PolarHBondContact O-N 3.08Å; V432-H436 PolarHBondContact O-CD2 2.97Å; V432-H436 VanDerWaalsContact O-CD2 3.26Å; V432-H436 PolarHBondContact O-N 3Å; V432-H436 VanDerWaalsContact O-N 3.08Å; V432-T453 HydrophobicContact CB-CG2 3.74Å; V432-T453 HydrophobicContact CG1-CG2 3.77Å; V432-T453 WeakPolarHBondContact CG1-OG1 3.46Å; V432-L456 HydrophobicContact CG1-CD2 3.82Å; V432-L456 HydrophobicContact CG2-CD2 4.24Å; V432-L457 HydrophobicContact CG2-CD1 4.46Å; V432-L457 HydrophobicContact CG2-CD2 4.35Å
433	A	92.7	Very high	85.4	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-66.4	-38.2	179.1	0	0	0	0	0	112.9	W382 W429 H436 A437 V445 D449 T453	W382-A433 HydrophobicContact CH2-CB 3.68Å; W382-A433 HydrophobicContact CZ2-CB 4.2Å; W382-A433 HydrophobicContact CZ3-CB 4.46Å; W429-A433 VanDerWaalsContact O-CB 3.26Å; W429-A433 WeakPolarHBondContact O-CB 3.45Å; W429-A433 PolarHBondContact O-N 3.39Å; A433-H436 PolarHBondContact O-N 3.48Å; A433-A437 PolarHBondContact O-N 3.13Å; A433-V445 HydrophobicContact CB-CG1 3.96Å; A433-D449 HydrophobicContact CB-CB 4.48Å; A433-T453 WeakPolarHBondContact CA-OG1 3.48Å; A433-T453 PolarHBondContact N-OG1 3.38Å
434	I	89.4	Confident	85.8	Confident	15 Å²	15	17.5 Å²	17.5	8%	0.077	9%	0.086	C	C	.	.	H	α-helix	trans	-65.6	-42.3	174.8	-67.7	163	0	0	0	110.5	M355 M430 R431 V432 H436 A437 E438 V445	M355-I434 HydrophobicContact CE-CD1 3.91Å; M355-I434 HydrophobicContact CE-CG1 4.46Å; M355-I434 HydrophobicContact SD-CD1 3.47Å; M355-I434 WeakPolarHBondContact SD-CD1 3.47Å; M355-I434 HydrophobicContact SD-CG1 4.48Å; M430-I434 HydrophobicContact CB-CD1 4.34Å; M430-I434 WeakPolarHBondContact O-CB 3.2Å; M430-I434 VanDerWaalsContact O-CD1 3.25Å; M430-I434 WeakPolarHBondContact O-CD1 3.42Å; M430-I434 WeakPolarHBondContact O-CG1 3.05Å; M430-I434 PolarHBondContact O-N 3.3Å; R431-I434 PolarHBondContact O-N 2.96Å; V432-I434 PolarHBondContact O-N 3.27Å; I434-H436 VanDerWaalsContact C-N 3.32Å; I434-H436 PolarHBondContact O-N 3.36Å; I434-A437 PolarHBondContact O-N 2.78Å; I434-A437 VanDerWaalsContact O-N 3.15Å; I434-E438 HydrophobicContact CG2-CG 4.22Å; I434-E438 WeakPolarHBondContact O-CG 3.28Å; I434-E438 PolarHBondContact O-N 2.92Å; I434-V445 HydrophobicContact CG1-CG2 4.29Å
435	V	90.4	Very high	86.1	Confident	12 Å²	12	17 Å²	17	7%	0.073	8%	0.082	C	C	.	.	H	α-helix	trans	-64.3	-35.5	178.8	171.8	0	0	0	0	111.9	R164 L165 R431 V432 H439	R164-V435 HydrophobicContact CB-CB 4.44Å; R164-V435 HydrophobicContact CB-CG1 3.71Å; R164-V435 HydrophobicContact CB-CG2 3.78Å; L165-V435 HydrophobicContact CD2-CB 3.88Å; L165-V435 HydrophobicContact CD2-CG1 3.61Å; L165-V435 HydrophobicContact CG-CG1 3.75Å; R431-V435 VanDerWaalsContact O-CG2 3.22Å; R431-V435 WeakPolarHBondContact O-CG2 3.45Å; R431-V435 PolarHBondContact O-N 3.02Å; V432-V435 PolarHBondContact O-N 3.08Å; V435-H439 WeakPolarHBondContact O-CB 3.49Å; V435-H439 PolarHBondContact O-N 3.18Å
436	H	89.8	Confident	86.2	Confident	15 Å²	15	17.9 Å²	17.9	7%	0.069	9%	0.087	C	C	.	.	H	α-helix	trans	-62.8	-45.4	170.7	-77.5	-62.3	0	0	0	112.2	V432 A433 I434 H439 R440 D449 Q452	V432-H436 PolarHBondContact O-CD2 2.97Å; V432-H436 VanDerWaalsContact O-CD2 3.26Å; V432-H436 PolarHBondContact O-N 3Å; V432-H436 VanDerWaalsContact O-N 3.08Å; A433-H436 PolarHBondContact O-N 3.48Å; I434-H436 VanDerWaalsContact C-N 3.32Å; I434-H436 PolarHBondContact O-N 3.36Å; H436-H439 PolarHBondContact O-N 3.34Å; H436-R440 WeakPolarHBondContact O-CG 3.04Å; H436-R440 PolarHBondContact O-N 3.32Å; H436-D449 HydrophobicContact CB-CB 4Å; H436-Q452 WeakPolarHBondContact NE2-CB 3.39Å
437	A	86.6	Confident	86.2	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63	-42.9	175.9	0	0	0	0	0	112.7	A433 I434 R440 K441 S442 V445	A433-A437 PolarHBondContact O-N 3.13Å; I434-A437 PolarHBondContact O-N 2.78Å; I434-A437 VanDerWaalsContact O-N 3.15Å; A437-R440 CarbonylContact O-C 3.5Å; A437-R440 WeakPolarHBondContact O-CG 3.29Å; A437-R440 PolarHBondContact O-N 3.4Å; A437-K441 PolarHBondContact O-N 3.49Å; A437-K441 VanDerWaalsContact O-N 3.15Å; A437-S442 PolarHBondContact O-N 2.95Å; A437-V445 HydrophobicContact CB-CG2 4.08Å
438	E	84.5	Confident	86.3	Confident	72 Å²	72	20.4 Å²	20.4	34%	0.336	10%	0.103	S	C	.	.	H	α-helix	trans	-66.4	-34.5	176	-73.1	-165.6	150.8	0	0	112.9	I434 K441	I434-E438 HydrophobicContact CG2-CG 4.22Å; I434-E438 WeakPolarHBondContact O-CG 3.28Å; I434-E438 PolarHBondContact O-N 2.92Å; E438-K441 PolarHBondContact O-N 2.98Å; E438-K441 VanDerWaalsContact O-N 3.15Å; E438-K441 PolarHBondContact O-NZ 2.98Å
439	H	84.8	Confident	86.5	Confident	13 Å²	13	20.2 Å²	20.2	6%	0.06	10%	0.102	C	C	.	.	H	α-helix	trans	-60	-51.7	174.5	179.7	75.3	0	0	0	110.5	E158 S161 V435 H436 K441	E158-H439 IonicContact OE1-CE1 2.68Å; E158-H439 PolarHBondContact OE1-CE1 2.87Å; S161-H439 WeakPolarHBondContact CB-ND1 3.3Å; S161-H439 WeakPolarHBondContact OG-CB 3.33Å; S161-H439 PolarHBondContact OG-ND1 3.08Å; V435-H439 WeakPolarHBondContact O-CB 3.49Å; V435-H439 PolarHBondContact O-N 3.18Å; H436-H439 PolarHBondContact O-N 3.34Å; H439-K441 PolarHBondContact O-N 3.04Å; H439-K441 VanDerWaalsContact O-N 3.13Å; H439-K441 PolarHBondContact O-NZ 3.01Å
440	R	81	Confident	86.5	Confident	35 Å²	35	20.2 Å²	20.2	13%	0.132	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	12.5	174.4	70	-169.1	176.7	80.1	8.9	115	H436 A437 S442 L444 D446 D449 C472	H436-R440 WeakPolarHBondContact O-CG 3.04Å; H436-R440 PolarHBondContact O-N 3.32Å; A437-R440 CarbonylContact O-C 3.5Å; A437-R440 WeakPolarHBondContact O-CG 3.29Å; A437-R440 PolarHBondContact O-N 3.4Å; R440-S442 PolarHBondContact NH1-OG 2.92Å; R440-S442 PolarHBondContact O-N 3.37Å; R440-L444 PolarHBondContact NH2-O 2.9Å; R440-D446 IonicContact CZ-OD2 2.85Å; R440-D446 IonicContact NE-OD2 2.67Å; R440-D446 IonicContact NH1-OD2 3.65Å; R440-D446 PolarHBondContact NH1-OD2 3.19Å; R440-D446 VanDerWaalsContact NH2-CG 3.33Å; R440-D446 IonicContact NH2-OD1 2.69Å; R440-D446 IonicContact NH2-OD2 3.46Å; R440-D446 PolarHBondContact NH2-OD2 2.75Å; R440-D449 IonicContact CZ-OD1 2.68Å; R440-D449 IonicContact CZ-OD2 3.55Å; R440-D449 IonicContact NE-OD1 3.34Å; R440-D449 PolarHBondContact NE-OD1 2.66Å; R440-D449 IonicContact NE-OD2 3.53Å; R440-D449 IonicContact NH2-OD1 3.32Å; R440-D449 PolarHBondContact NH2-OD1 2.93Å; R440-D449 IonicContact NH2-OD2 3.54Å; R440-D449 PolarHBondContact NH2-OD2 3.37Å; R440-C472 PolarHBondContact NH1-O 3.48Å
441	K	76.3	Confident	86.4	Confident	68 Å²	68	24.6 Å²	24.6	30%	0.296	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	28.2	176.8	-53	-66.8	163.9	-73.6	0	114.3	A437 E438 H439	A437-K441 PolarHBondContact O-N 3.49Å; A437-K441 VanDerWaalsContact O-N 3.15Å; E438-K441 PolarHBondContact O-N 2.98Å; E438-K441 VanDerWaalsContact O-N 3.15Å; E438-K441 PolarHBondContact O-NZ 2.98Å; H439-K441 PolarHBondContact O-N 3.04Å; H439-K441 VanDerWaalsContact O-N 3.13Å; H439-K441 PolarHBondContact O-NZ 3.01Å
442	S	77.9	Confident	86.5	Confident	16 Å²	16	24.9 Å²	24.9	11%	0.112	12%	0.12	C	C	.	.			trans	-85.8	147.6	176.6	-179.2	0	0	0	0	112	A437 R440 L444	A437-S442 PolarHBondContact O-N 2.95Å; R440-S442 PolarHBondContact NH1-OG 2.92Å; R440-S442 PolarHBondContact O-N 3.37Å; S442-L444 PolarHBondContact OG-N 3.36Å; S442-L444 PolarHBondContact OG-O 2.92Å
443	L	77.1	Confident	86.5	Confident	85 Å²	85	24.9 Å²	24.9	45%	0.445	12%	0.12	S	C	.	.	S	Bend	trans	-95.2	5.6	168	-59.4	177.6	0	0	0	112.5	Q378 V380 S381	Q378-L443 HydrophobicContact CB-CD1 4.02Å; Q378-L443 HydrophobicContact CB-CD2 4.24Å; V380-L443 WeakPolarHBondContact CA-O 3.5Å; S381-L443 PolarHBondContact N-O 3.39Å; S381-L443 PolarHBondContact OG-O 2.77Å
444	L	82.3	Confident	86.2	Confident	7 Å²	7	24.9 Å²	24.9	4%	0.037	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128.8	-179.2	-79.8	167.7	0	0	0	111	S381 L383 R440 S442 F474	S381-L444 CarbonylContact O-C 3.08Å; S381-L444 VanDerWaalsContact O-CA 3.23Å; S381-L444 WeakPolarHBondContact O-CA 3.49Å; S381-L444 VanDerWaalsContact OG-CD2 3.23Å; S381-L444 WeakPolarHBondContact OG-CD2 3.22Å; L383-L444 HydrophobicContact CD2-CD1 3.97Å; L383-L444 HydrophobicContact CD2-CD2 3.85Å; L383-L444 HydrophobicContact CD2-CG 4.42Å; L383-L444 HydrophobicContact CG-CB 4.32Å; L383-L444 HydrophobicContact CG-CD1 4.41Å; L383-L444 HydrophobicContact CG-CD2 4.02Å; L383-L444 HydrophobicContact CG-CG 4.5Å; R440-L444 PolarHBondContact NH2-O 2.9Å; S442-L444 PolarHBondContact OG-N 3.36Å; S442-L444 PolarHBondContact OG-O 2.92Å; L444-F474 WeakPolarHBondContact CD1-O 3.46Å
445	V	88.6	Confident	86.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	129.5	164.6	-177.4	0	0	0	0	108.8	V380 S381 W382 L383 A386 A433 I434 A437 D449 V450	V380-V445 HydrophobicContact CG1-CG2 3.72Å; S381-V445 PolarHBondContact O-N 3.34Å; W382-V445 HydrophobicContact CD2-CB 3.98Å; W382-V445 HydrophobicContact CD2-CG1 4.09Å; W382-V445 HydrophobicContact CD2-CG2 4.27Å; W382-V445 HydrophobicContact CE3-CB 4.2Å; W382-V445 HydrophobicContact CE3-CG1 3.85Å; W382-V445 HydrophobicContact CG-CB 4.27Å; W382-V445 HydrophobicContact CH2-CG1 4.08Å; W382-V445 HydrophobicContact CZ2-CG1 4.3Å; W382-V445 HydrophobicContact CZ2-CG2 4.36Å; W382-V445 HydrophobicContact CZ3-CG1 3.85Å; L383-V445 WeakPolarHBondContact CB-O 3.24Å; L383-V445 PolarHBondContact N-O 3.47Å; A386-V445 HydrophobicContact CB-CG1 4.27Å; A386-V445 WeakPolarHBondContact CB-O 3.47Å; A433-V445 HydrophobicContact CB-CG1 3.96Å; I434-V445 HydrophobicContact CG1-CG2 4.29Å; A437-V445 HydrophobicContact CB-CG2 4.08Å; V445-D449 VanDerWaalsContact CA-OD2 3.32Å; V445-D449 WeakPolarHBondContact CA-OD2 3.5Å; V445-D449 HydrophobicContact CG1-CB 3.92Å; V445-V450 HydrophobicContact CG1-CG2 4.25Å
446	D	87.6	Confident	86.1	Confident	19 Å²	19	25.6 Å²	25.6	10%	0.102	12%	0.121	C	C	.	.			trans	-109.6	176.5	-179.8	69.1	32.7	0	0	0	113.1	L383 A386 R440 D448 D449 R466	L383-D446 HydrophobicContact CD1-CB 3.91Å; A386-D446 WeakPolarHBondContact CB-O 3.45Å; R440-D446 IonicContact CZ-OD2 2.85Å; R440-D446 IonicContact NE-OD2 2.67Å; R440-D446 IonicContact NH1-OD2 3.65Å; R440-D446 PolarHBondContact NH1-OD2 3.19Å; R440-D446 VanDerWaalsContact NH2-CG 3.33Å; R440-D446 IonicContact NH2-OD1 2.69Å; R440-D446 IonicContact NH2-OD2 3.46Å; R440-D446 PolarHBondContact NH2-OD2 2.75Å; D446-D448 PolarHBondContact O-N 3.24Å; D446-D448 WeakPolarHBondContact OD1-CA 3.41Å; D446-D448 WeakPolarHBondContact OD1-CB 3.22Å; D446-D448 PolarHBondContact OD1-N 3.16Å; D446-D449 PolarHBondContact N-OD2 3.1Å; D446-D449 PolarHBondContact OD1-N 3.4Å; D446-R466 IonicContact OD1-CZ 3.95Å; D446-R466 IonicContact OD1-NH1 2.97Å; D446-R466 IonicContact OD1-NH2 2.64Å; D446-R466 PolarHBondContact OD1-NH2 3.28Å; D446-R466 IonicContact OD2-CZ 3.46Å; D446-R466 IonicContact OD2-NH1 3.7Å; D446-R466 PolarHBondContact OD2-NH1 3.32Å; D446-R466 IonicContact OD2-NH2 3.94Å; D446-R466 PolarHBondContact OD2-NH2 3.09Å; D446-R466 VanDerWaalsContact OD2-NH2 3.17Å
447	S	88.3	Confident	85.9	Confident	34 Å²	34	25.1 Å²	25.1	24%	0.238	12%	0.12	C	C	.	.	H	α-helix	trans	-67.4	-19.2	-179.1	66.4	0	0	0	0	113.4	T389 R451	T389-S447 WeakPolarHBondContact OG1-CB 3.13Å; S447-R451 VanDerWaalsContact C-NH1 3.31Å; S447-R451 WeakPolarHBondContact O-CG 3.35Å; S447-R451 PolarHBondContact O-N 2.95Å; S447-R451 PolarHBondContact O-NH1 3.07Å; S447-R451 PolarHBondContact OG-NH1 3.4Å; S447-R451 VanDerWaalsContact OG-NH1 3.12Å
448	D	87.2	Confident	85.6	Confident	25 Å²	25	25.2 Å²	25.2	13%	0.134	12%	0.12	C	C	.	.	H	α-helix	trans	-84.2	-41.2	179.8	-175.5	78.2	0	0	0	111.5	D446 V450 R451 Q452 R466	D446-D448 PolarHBondContact O-N 3.24Å; D446-D448 WeakPolarHBondContact OD1-CA 3.41Å; D446-D448 WeakPolarHBondContact OD1-CB 3.22Å; D446-D448 PolarHBondContact OD1-N 3.16Å; D448-V450 PolarHBondContact O-N 3.24Å; D448-V450 VanDerWaalsContact O-N 3.13Å; D448-R451 PolarHBondContact O-N 2.85Å; D448-R451 IonicContact OD1-CZ 3.84Å; D448-R451 IonicContact OD1-NE 2.93Å; D448-R451 IonicContact OD1-NH2 3.76Å; D448-R451 PolarHBondContact OD1-NH2 3.1Å; D448-Q452 WeakPolarHBondContact O-CG 3.4Å; D448-Q452 PolarHBondContact O-N 3.05Å; D448-R466 VanDerWaalsContact CB-NH2 3.3Å; D448-R466 IonicContact OD2-CZ 3.56Å; D448-R466 VanDerWaalsContact OD2-CZ 3.22Å; D448-R466 IonicContact OD2-NE 2.77Å; D448-R466 PolarHBondContact OD2-NE 2.93Å; D448-R466 IonicContact OD2-NH2 2.67Å; D448-R466 PolarHBondContact OD2-NH2 3.37Å
449	D	90.8	Very high	85.2	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-52	-38	171.4	-57.2	-44.7	0	0	0	111.3	A433 H436 R440 V445 D446 T453 R466	A433-D449 HydrophobicContact CB-CB 4.48Å; H436-D449 HydrophobicContact CB-CB 4Å; R440-D449 IonicContact CZ-OD1 2.68Å; R440-D449 IonicContact CZ-OD2 3.55Å; R440-D449 IonicContact NE-OD1 3.34Å; R440-D449 PolarHBondContact NE-OD1 2.66Å; R440-D449 IonicContact NE-OD2 3.53Å; R440-D449 IonicContact NH2-OD1 3.32Å; R440-D449 PolarHBondContact NH2-OD1 2.93Å; R440-D449 IonicContact NH2-OD2 3.54Å; R440-D449 PolarHBondContact NH2-OD2 3.37Å; V445-D449 VanDerWaalsContact CA-OD2 3.32Å; V445-D449 WeakPolarHBondContact CA-OD2 3.5Å; V445-D449 HydrophobicContact CG1-CB 3.92Å; D446-D449 PolarHBondContact N-OD2 3.1Å; D446-D449 PolarHBondContact OD1-N 3.4Å; D449-T453 WeakPolarHBondContact O-CB 3.49Å; D449-T453 PolarHBondContact O-N 2.61Å; D449-T453 PolarHBondContact O-OG1 3.38Å; D449-R466 IonicContact OD1-NH2 2.63Å; D449-R466 PolarHBondContact OD1-NH2 3.01Å
450	V	90.4	Very high	84.5	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-72.4	-34.5	176.9	-177.8	0	0	0	0	112.6	W382 A386 T389 L390 F393 W429 V445 D448 T453 A454	W382-V450 HydrophobicContact CH2-CG2 4.42Å; W382-V450 HydrophobicContact CZ3-CG2 3.71Å; A386-V450 HydrophobicContact CB-CG2 4.12Å; T389-V450 HydrophobicContact CG2-CB 4.03Å; T389-V450 HydrophobicContact CG2-CG1 3.8Å; L390-V450 HydrophobicContact CB-CG1 3.97Å; L390-V450 HydrophobicContact CD1-CG1 4.31Å; F393-V450 HydrophobicContact CD2-CG1 4.38Å; W429-V450 HydrophobicContact CZ3-CG1 4.33Å; V445-V450 HydrophobicContact CG1-CG2 4.25Å; D448-V450 PolarHBondContact O-N 3.24Å; D448-V450 VanDerWaalsContact O-N 3.13Å; V450-T453 WeakPolarHBondContact O-CB 3.34Å; V450-T453 PolarHBondContact O-N 3.43Å; V450-A454 WeakPolarHBondContact O-CB 3.39Å; V450-A454 PolarHBondContact O-N 3.12Å
451	R	88.1	Confident	84.2	Confident	94 Å²	94	28 Å²	28	36%	0.355	16%	0.159	S	C	.	.	H	α-helix	trans	-71.8	-39.1	173.9	-69.1	-175.2	-55.7	-90.7	6.7	112.3	T389 S447 D448 T453 A454 R455 C463	T389-R451 HydrophobicContact CG2-CG 4.11Å; S447-R451 VanDerWaalsContact C-NH1 3.31Å; S447-R451 WeakPolarHBondContact O-CG 3.35Å; S447-R451 PolarHBondContact O-N 2.95Å; S447-R451 PolarHBondContact O-NH1 3.07Å; S447-R451 PolarHBondContact OG-NH1 3.4Å; S447-R451 VanDerWaalsContact OG-NH1 3.12Å; D448-R451 PolarHBondContact O-N 2.85Å; D448-R451 IonicContact OD1-CZ 3.84Å; D448-R451 IonicContact OD1-NE 2.93Å; D448-R451 IonicContact OD1-NH2 3.76Å; D448-R451 PolarHBondContact OD1-NH2 3.1Å; R451-T453 VanDerWaalsContact C-N 3.26Å; R451-T453 PolarHBondContact O-N 3.28Å; R451-A454 PolarHBondContact O-N 3.35Å; R451-R455 PolarHBondContact O-N 3.37Å; R451-C463 HydrophobicContact CB-CB 4.26Å; R451-C463 VanDerWaalsContact CB-SG 3.51Å
452	Q	90	Very high	84	Confident	11 Å²	11	30.8 Å²	30.8	5%	0.051	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-39.1	172.1	-61.2	-61.1	-18.8	0	0	111.1	H436 D448 L456 C463 E464	H436-Q452 WeakPolarHBondContact NE2-CB 3.39Å; D448-Q452 WeakPolarHBondContact O-CG 3.4Å; D448-Q452 PolarHBondContact O-N 3.05Å; Q452-L456 PolarHBondContact O-N 3.13Å; Q452-L456 VanDerWaalsContact O-N 3.16Å; Q452-C463 PolarHBondContact NE2-SG 2.84Å; Q452-C463 VanDerWaalsContact NE2-SG 3.43Å; Q452-C463 PolarHBondContact OE1-O 3.3Å; Q452-E464 PolarHBondContact NE2-O 3.07Å
453	T	92.1	Very high	84.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.7	-45.8	172.2	-59.2	0	0	0	0	112	W429 V432 A433 D449 V450 R451 R455 L456 L457	W429-T453 HydrophobicContact CD2-CG2 4.19Å; W429-T453 HydrophobicContact CE3-CG2 3.53Å; W429-T453 HydrophobicContact CZ3-CG2 4.05Å; V432-T453 HydrophobicContact CB-CG2 3.74Å; V432-T453 HydrophobicContact CG1-CG2 3.77Å; V432-T453 WeakPolarHBondContact CG1-OG1 3.46Å; A433-T453 WeakPolarHBondContact CA-OG1 3.48Å; A433-T453 PolarHBondContact N-OG1 3.38Å; D449-T453 WeakPolarHBondContact O-CB 3.49Å; D449-T453 PolarHBondContact O-N 2.61Å; D449-T453 PolarHBondContact O-OG1 3.38Å; V450-T453 WeakPolarHBondContact O-CB 3.34Å; V450-T453 PolarHBondContact O-N 3.43Å; R451-T453 VanDerWaalsContact C-N 3.26Å; R451-T453 PolarHBondContact O-N 3.28Å; T453-R455 PolarHBondContact O-N 2.89Å; T453-L456 PolarHBondContact O-N 3.46Å; T453-L456 VanDerWaalsContact O-N 3.14Å; T453-L457 HydrophobicContact CG2-CD1 3.64Å; T453-L457 HydrophobicContact CG2-CG 4.24Å; T453-L457 WeakPolarHBondContact O-CG 3.38Å; T453-L457 PolarHBondContact O-N 3.08Å
454	A	86.9	Confident	84.2	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-42.6	178.9	0	0	0	0	0	112.3	F393 W429 V450 R451 L456 L457 L458 L461	F393-A454 HydrophobicContact CD1-CB 4.3Å; F393-A454 HydrophobicContact CD2-CB 4.02Å; F393-A454 HydrophobicContact CE1-CB 3.89Å; F393-A454 HydrophobicContact CE2-CB 3.57Å; F393-A454 HydrophobicContact CG-CB 4.37Å; F393-A454 HydrophobicContact CZ-CB 3.5Å; W429-A454 HydrophobicContact CH2-CB 3.73Å; W429-A454 HydrophobicContact CZ3-CB 3.8Å; V450-A454 WeakPolarHBondContact O-CB 3.39Å; V450-A454 PolarHBondContact O-N 3.12Å; R451-A454 PolarHBondContact O-N 3.35Å; A454-L456 VanDerWaalsContact C-N 3.35Å; A454-L456 PolarHBondContact O-N 3.02Å; A454-L457 PolarHBondContact O-N 3.14Å; A454-L458 VanDerWaalsContact O-CB 3.32Å; A454-L458 WeakPolarHBondContact O-CB 3.21Å; A454-L458 PolarHBondContact O-N 3.18Å; A454-L461 HydrophobicContact CB-CD1 3.86Å
455	R	88.6	Confident	84.2	Confident	32 Å²	32	33 Å²	33	12%	0.121	19%	0.187	C	C	.	.	H	α-helix	trans	-58.1	-43.5	171.9	173	-156.9	62.4	80.9	6	112.1	E143 R451 T453 C463	E143-R455 VanDerWaalsContact CD-NH2 3.35Å; E143-R455 IonicContact OE1-CZ 2.69Å; E143-R455 IonicContact OE1-NH1 3.18Å; E143-R455 PolarHBondContact OE1-NH1 3.49Å; E143-R455 IonicContact OE1-NH2 2.74Å; E143-R455 PolarHBondContact OE1-NH2 3.04Å; E143-R455 IonicContact OE2-CZ 3.53Å; E143-R455 IonicContact OE2-NH1 2.84Å; E143-R455 IonicContact OE2-NH2 3.15Å; E143-R455 PolarHBondContact OE2-NH2 3.42Å; R451-R455 PolarHBondContact O-N 3.37Å; T453-R455 PolarHBondContact O-N 2.89Å; R455-C463 HydrophobicContact CB-CB 4.28Å
456	L	88.4	Confident	83.9	Confident	9 Å²	9	35 Å²	35	5%	0.047	20%	0.195	C	C	.	.	H	α-helix	trans	-68.9	-41.1	-178.8	-177.3	58.6	0	0	0	111.9	E143 L165 L291 V432 Q452 T453 A454	E143-L456 HydrophobicContact CG-CD1 4.26Å; L165-L456 HydrophobicContact CB-CD2 4.04Å; L291-L456 HydrophobicContact CB-CD1 3.85Å; L291-L456 HydrophobicContact CB-CG 3.99Å; L291-L456 WeakPolarHBondContact CB-O 3.46Å; L291-L456 HydrophobicContact CD2-CD1 4.26Å; L291-L456 HydrophobicContact CD2-CD2 4.04Å; L291-L456 HydrophobicContact CD2-CG 4.03Å; L291-L456 PolarHBondContact N-O 3.08Å; V432-L456 HydrophobicContact CG1-CD2 3.82Å; V432-L456 HydrophobicContact CG2-CD2 4.24Å; Q452-L456 PolarHBondContact O-N 3.13Å; Q452-L456 VanDerWaalsContact O-N 3.16Å; T453-L456 PolarHBondContact O-N 3.46Å; T453-L456 VanDerWaalsContact O-N 3.14Å; A454-L456 VanDerWaalsContact C-N 3.35Å; A454-L456 PolarHBondContact O-N 3.02Å
457	L	86.8	Confident	83.6	Confident	6 Å²	6	38 Å²	38	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-96.3	-20.2	-169	-61.6	-178.8	0	0	0	115.4	L291 P424 E428 W429 V432 T453 A454	L291-L457 HydrophobicContact CB-CD2 4.42Å; L291-L457 HydrophobicContact CD2-CD2 4.23Å; P424-L457 HydrophobicContact CB-CD1 4.23Å; P424-L457 HydrophobicContact CG-CB 3.67Å; P424-L457 HydrophobicContact CG-CD1 4.03Å; P424-L457 HydrophobicContact CG-CG 4.35Å; E428-L457 HydrophobicContact CB-CD1 4.27Å; W429-L457 HydrophobicContact CD2-CD1 4.24Å; W429-L457 HydrophobicContact CG-CD1 4.26Å; V432-L457 HydrophobicContact CG2-CD1 4.46Å; V432-L457 HydrophobicContact CG2-CD2 4.35Å; T453-L457 HydrophobicContact CG2-CD1 3.64Å; T453-L457 HydrophobicContact CG2-CG 4.24Å; T453-L457 WeakPolarHBondContact O-CG 3.38Å; T453-L457 PolarHBondContact O-N 3.08Å; A454-L457 PolarHBondContact O-N 3.14Å
458	L	81.1	Confident	83.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.204	C	C	.	.	S	Bend	trans	-115.5	141	-176	-58.6	178.9	0	0	0	112.4	F393 F420 L423 P424 W429 A454 L461	F393-L458 HydrophobicContact CD1-CD1 3.9Å; F393-L458 HydrophobicContact CG-CD1 4.46Å; F420-L458 HydrophobicContact CB-CD2 4.47Å; F420-L458 HydrophobicContact CD1-CB 4.21Å; F420-L458 HydrophobicContact CD1-CD1 4.2Å; F420-L458 HydrophobicContact CD1-CD2 4.4Å; F420-L458 HydrophobicContact CD2-CD1 4.04Å; F420-L458 HydrophobicContact CE1-CB 4.18Å; F420-L458 HydrophobicContact CE1-CD1 4.06Å; F420-L458 HydrophobicContact CE2-CD1 3.91Å; F420-L458 HydrophobicContact CG-CD1 4.19Å; F420-L458 HydrophobicContact CG-CD2 4.27Å; F420-L458 HydrophobicContact CZ-CD1 3.93Å; L423-L458 HydrophobicContact CD2-CD2 3.96Å; P424-L458 HydrophobicContact CG-CD2 4.34Å; W429-L458 HydrophobicContact CH2-CD1 3.78Å; W429-L458 HydrophobicContact CH2-CG 4.22Å; W429-L458 HydrophobicContact CZ2-CD1 3.81Å; W429-L458 HydrophobicContact CZ2-CD2 4.24Å; W429-L458 HydrophobicContact CZ2-CG 4.02Å; A454-L458 VanDerWaalsContact O-CB 3.32Å; A454-L458 WeakPolarHBondContact O-CB 3.21Å; A454-L458 PolarHBondContact O-N 3.18Å; L458-L461 HydrophobicContact CB-CD1 3.91Å; L458-L461 HydrophobicContact CB-CG 4.3Å; L458-L461 HydrophobicContact CD1-CD1 3.74Å; L458-L461 HydrophobicContact CG-CD1 4.41Å
459	P	75.9	Confident	82.6	Confident	51 Å²	51	41.4 Å²	41.4	33%	0.331	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	137.3	177.9	28.5	-34.4	0	0	0	112.1	L461	P459-L461 VanDerWaalsContact C-N 3.33Å; P459-L461 PolarHBondContact O-N 2.94Å
460	G	68.4	Low	81.5	Confident	71 Å²	71	43.2 Å²	43.2	73%	0.732	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.6	7.7	168.6	0	0	0	0	0	116.1
461	L	75.3	Confident	80.2	Confident	57 Å²	57	48.8 Å²	48.8	30%	0.298	26%	0.257	S	S	.	.			trans	-94.6	138.5	169.2	-60.9	-173.4	0	0	0	110.5	F393 F420 A454 L458 P459	F393-L461 HydrophobicContact CD1-CD1 4.28Å; F393-L461 HydrophobicContact CE1-CD1 3.61Å; F393-L461 HydrophobicContact CZ-CD1 4.27Å; F420-L461 HydrophobicContact CE1-CD1 4.3Å; F420-L461 HydrophobicContact CE1-CD2 4.33Å; F420-L461 HydrophobicContact CE1-CG 4.23Å; F420-L461 HydrophobicContact CZ-CD1 4.03Å; F420-L461 HydrophobicContact CZ-CD2 4.15Å; F420-L461 HydrophobicContact CZ-CG 4.29Å; A454-L461 HydrophobicContact CB-CD1 3.86Å; L458-L461 HydrophobicContact CB-CD1 3.91Å; L458-L461 HydrophobicContact CB-CG 4.3Å; L458-L461 HydrophobicContact CD1-CD1 3.74Å; L458-L461 HydrophobicContact CG-CD1 4.41Å; P459-L461 VanDerWaalsContact C-N 3.33Å; P459-L461 PolarHBondContact O-N 2.94Å
462	D	72.2	Confident	78.6	Confident	126 Å²	126	45.2 Å²	45.2	67%	0.674	25%	0.246	S	C	*	.			trans	-123.6	154.7	165.8	-162.2	7.7	0	0	0	110.5	R146	R146-D462 IonicContact CZ-OD1 3.7Å; R146-D462 IonicContact NH2-OD1 3.13Å; R146-D462 PolarHBondContact NH2-OD1 3.32Å
463	C	82.4	Confident	76.8	Confident	16 Å²	16	45.8 Å²	45.8	11%	0.108	25%	0.25	C	S	.	.			trans	-152.9	113.1	178.3	-176.6	0	0	0	0	107	R146 R451 Q452 R455	R146-C463 PolarHBondContact NH2-O 3.15Å; R451-C463 HydrophobicContact CB-CB 4.26Å; R451-C463 VanDerWaalsContact CB-SG 3.51Å; Q452-C463 PolarHBondContact NE2-SG 2.84Å; Q452-C463 VanDerWaalsContact NE2-SG 3.43Å; Q452-C463 PolarHBondContact OE1-O 3.3Å; R455-C463 HydrophobicContact CB-CB 4.28Å
464	E	77.9	Confident	75.1	Confident	115 Å²	115	49.6 Å²	49.6	54%	0.537	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-46.5	144.6	-177.8	-68.5	175.2	-165.3	0	0	112.1	Q452 R466	Q452-E464 PolarHBondContact NE2-O 3.07Å; E464-R466 PolarHBondContact O-N 3.47Å
465	P	82.3	Confident	73.7	Confident	23 Å²	23	51.5 Å²	51.5	15%	0.149	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-54.3	139.2	171.1	-22	33.1	0	0	0	110.8	R146 V149 Q467	R146-P465 HydrophobicContact CG-CG 4.37Å; V149-P465 HydrophobicContact CB-CB 4.14Å; V149-P465 HydrophobicContact CG1-CB 4.23Å; V149-P465 HydrophobicContact CG2-CB 4.11Å; V149-P465 HydrophobicContact CG2-CG 4.31Å; P465-Q467 PolarHBondContact O-N 3.19Å
466	R	81.8	Confident	72	Confident	43 Å²	43	51.6 Å²	51.6	16%	0.162	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-58.7	140.7	176.4	-168.4	176.2	-67.5	-150.9	15.7	109.6	M150 D446 D448 D449 E464	M150-R466 WeakPolarHBondContact CG-O 3.34Å; M150-R466 HydrophobicContact SD-CB 4.03Å; M150-R466 HydrophobicContact SD-CG 4Å; D446-R466 IonicContact OD1-CZ 3.95Å; D446-R466 IonicContact OD1-NH1 2.97Å; D446-R466 IonicContact OD1-NH2 2.64Å; D446-R466 PolarHBondContact OD1-NH2 3.28Å; D446-R466 IonicContact OD2-CZ 3.46Å; D446-R466 IonicContact OD2-NH1 3.7Å; D446-R466 PolarHBondContact OD2-NH1 3.32Å; D446-R466 IonicContact OD2-NH2 3.94Å; D446-R466 PolarHBondContact OD2-NH2 3.09Å; D446-R466 VanDerWaalsContact OD2-NH2 3.17Å; D448-R466 VanDerWaalsContact CB-NH2 3.3Å; D448-R466 IonicContact OD2-CZ 3.56Å; D448-R466 VanDerWaalsContact OD2-CZ 3.22Å; D448-R466 IonicContact OD2-NE 2.77Å; D448-R466 PolarHBondContact OD2-NE 2.93Å; D448-R466 IonicContact OD2-NH2 2.67Å; D448-R466 PolarHBondContact OD2-NH2 3.37Å; D449-R466 IonicContact OD1-NH2 2.63Å; D449-R466 PolarHBondContact OD1-NH2 3.01Å; E464-R466 PolarHBondContact O-N 3.47Å
467	Q	80.9	Confident	70.5	Confident	81 Å²	81	56 Å²	56	38%	0.379	31%	0.305	S	S	.	.			trans	-106.1	148.8	177.1	-67.1	174.2	-8.1	0	0	110.1	P465 K469	P465-Q467 PolarHBondContact O-N 3.19Å; Q467-K469 HydrophobicContact CB-CD 4.38Å; Q467-K469 HydrophobicContact CB-CG 4.4Å; Q467-K469 PolarHBondContact O-N 2.93Å
468	L	80.1	Confident	69	Low	31 Å²	31	63.6 Å²	63.6	16%	0.162	34%	0.338	C	S	.	.			trans	-68.4	96	179.5	-177.3	60.7	0	0	0	110.8	M150 M526 Y531 A534 F577	M150-L468 HydrophobicContact CE-CB 4.33Å; M150-L468 HydrophobicContact CE-CD1 4.04Å; L468-M526 HydrophobicContact CD2-CE 4.22Å; L468-Y531 HydrophobicContact CD1-CE1 3.99Å; L468-Y531 HydrophobicContact CG-CD1 4.26Å; L468-Y531 HydrophobicContact CG-CE1 3.97Å; L468-A534 HydrophobicContact CD2-CB 3.99Å; L468-F577 HydrophobicContact CD2-CD1 4.33Å; L468-F577 HydrophobicContact CD2-CE1 4.06Å
469	K	75.2	Confident	68	Low	101 Å²	101	71.1 Å²	71.1	44%	0.439	37%	0.366	S	S	.	.			trans	-130.8	149	-176.5	-69.1	176.8	-179	166.9	0	111.5	Q467 E471 C472	Q467-K469 HydrophobicContact CB-CD 4.38Å; Q467-K469 HydrophobicContact CB-CG 4.4Å; Q467-K469 PolarHBondContact O-N 2.93Å; K469-E471 PolarHBondContact O-N 3.46Å; K469-E471 VanDerWaalsContact O-N 3.11Å; K469-C472 WeakPolarHBondContact O-CB 2.98Å; K469-C472 PolarHBondContact O-N 2.97Å; K469-C472 VanDerWaalsContact O-N 3.08Å; K469-C472 PolarHBondContact O-SG 2.94Å
470	P	67.3	Low	67.6	Low	38 Å²	38	72 Å²	72	25%	0.247	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-54.6	-31.3	178.3	-25.6	32.7	0	0	0	114.1	C472 F495 Y531	P470-C472 PolarHBondContact O-N 3.31Å; P470-C472 VanDerWaalsContact O-N 3.1Å; P470-F495 HydrophobicContact CB-CD1 4.49Å; P470-Y531 HydrophobicContact CB-CE2 4.36Å; P470-Y531 HydrophobicContact CG-CD1 4.11Å; P470-Y531 HydrophobicContact CG-CD2 3.83Å; P470-Y531 HydrophobicContact CG-CE1 4.36Å; P470-Y531 HydrophobicContact CG-CE2 4.09Å; P470-Y531 HydrophobicContact CG-CG 3.84Å
471	E	62.8	Low	68.2	Low	118 Å²	118	73.2 Å²	73.2	55%	0.551	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-68.5	-5.4	-179.1	-55.3	-171.4	154	0	0	114.1	K469 C473 F474	K469-E471 PolarHBondContact O-N 3.46Å; K469-E471 VanDerWaalsContact O-N 3.11Å; E471-C473 PolarHBondContact O-N 3.12Å; E471-F474 WeakPolarHBondContact O-CD2 3.12Å; E471-F474 WeakPolarHBondContact O-CE2 3.48Å
472	C	53.3	Low	68.6	Low	19 Å²	19	75.1 Å²	75.1	13%	0.128	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-73.5	-9.1	-178.2	-64.3	0	0	0	0	114.5	R440 K469 P470	R440-C472 PolarHBondContact NH1-O 3.48Å; K469-C472 WeakPolarHBondContact O-CB 2.98Å; K469-C472 PolarHBondContact O-N 2.97Å; K469-C472 VanDerWaalsContact O-N 3.08Å; K469-C472 PolarHBondContact O-SG 2.94Å; P470-C472 PolarHBondContact O-N 3.31Å; P470-C472 VanDerWaalsContact O-N 3.1Å
473	C	53.1	Low	69.2	Low	22 Å²	22	75.6 Å²	75.6	15%	0.149	37%	0.372	C	S	.	.			trans	-127.1	47.8	-160.2	-69.1	0	0	0	0	115.1	E471 S475 K488 Q524	E471-C473 PolarHBondContact O-N 3.12Å; C473-S475 PolarHBondContact O-N 2.94Å; C473-K488 PolarHBondContact O-NZ 2.66Å; C473-Q524 HydrophobicContact CB-CG 4.4Å; C473-Q524 WeakPolarHBondContact SG-CG 3.48Å; C473-Q524 PolarHBondContact SG-NE2 3.34Å
474	F	56.8	Low	69.2	Low	80 Å²	80	76.4 Å²	76.4	35%	0.351	38%	0.38	S	S	.	.			trans	-70.7	94.3	165.8	-57.7	-65.9	0	0	0	111.6	L444 E471	L444-F474 WeakPolarHBondContact CD1-O 3.46Å; E471-F474 WeakPolarHBondContact O-CD2 3.12Å; E471-F474 WeakPolarHBondContact O-CE2 3.48Å
475	S	56.3	Low	69.3	Low	42 Å²	42	72.1 Å²	72.1	29%	0.294	36%	0.364	S	S	.	.			trans	-73.7	148.9	156.7	61.6	0	0	0	0	111.3	C473 F477 K488 D523	C473-S475 PolarHBondContact O-N 2.94Å; S475-F477 PolarHBondContact O-N 2.87Å; S475-K488 PolarHBondContact OG-NZ 3.13Å; S475-D523 VanDerWaalsContact CB-OD2 3.22Å; S475-D523 WeakPolarHBondContact CB-OD2 3.08Å; S475-D523 PolarHBondContact OG-OD2 3.42Å
476	S	53.9	Low	69.4	Low	33 Å²	33	75.9 Å²	75.9	23%	0.231	38%	0.381	C	S	.	.			trans	-79.8	121.7	-159.4	-160.6	0	0	0	0	115	K478 R479	S476-K478 PolarHBondContact O-N 2.94Å; S476-K478 PolarHBondContact OG-N 3.29Å; S476-R479 PolarHBondContact O-N 3.22Å
477	F	57.7	Low	69.4	Low	101 Å²	101	77.8 Å²	77.8	44%	0.443	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-55.5	-21.4	168.7	-64.4	-75.8	0	0	0	114.1	S475 R479 L480 A485 K488	S475-F477 PolarHBondContact O-N 2.87Å; F477-R479 PolarHBondContact O-N 2.88Å; F477-L480 HydrophobicContact CD1-CD1 4.26Å; F477-L480 PolarHBondContact O-N 3.41Å; F477-A485 HydrophobicContact CD1-CB 4.28Å; F477-K488 HydrophobicContact CE1-CG 4.46Å
478	K	54.8	Low	69.4	Low	167 Å²	167	74.7 Å²	74.7	73%	0.726	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-64.6	-4.5	-178.4	-64.8	-177.1	178.7	177.1	0	114.9	S476	S476-K478 PolarHBondContact O-N 2.94Å; S476-K478 PolarHBondContact OG-N 3.29Å
479	R	58.9	Low	69.6	Low	159 Å²	159	78.9 Å²	78.9	60%	0.6	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-133.5	6.6	-179.8	-65.9	-173.8	179.4	157.4	6.3	114.6	S476 F477	S476-R479 PolarHBondContact O-N 3.22Å; F477-R479 PolarHBondContact O-N 2.88Å
480	L	68.8	Low	70.2	Confident	69 Å²	69	76.2 Å²	76.2	36%	0.361	39%	0.388	S	S	.	.			trans	-90.5	151.9	177	-63.4	177.8	0	0	0	110.6	F477 A484 A485 K488	F477-L480 HydrophobicContact CD1-CD1 4.26Å; F477-L480 PolarHBondContact O-N 3.41Å; L480-A484 HydrophobicContact CB-CB 4.35Å; L480-A484 HydrophobicContact CD2-CB 4.18Å; L480-A485 HydrophobicContact CB-CB 4.27Å; L480-K488 HydrophobicContact CD1-CD 4.4Å
481	D	80.4	Confident	71.1	Confident	96 Å²	96	76.3 Å²	76.3	51%	0.513	39%	0.386	S	S	.	.			trans	-75.5	168.1	166.1	82.2	-53.8	0	0	0	110.3	K483 A484 A485	D481-K483 PolarHBondContact O-N 3.03Å; D481-K483 VanDerWaalsContact OD2-CB 3.32Å; D481-K483 WeakPolarHBondContact OD2-CB 3.39Å; D481-K483 PolarHBondContact OD2-N 3.28Å; D481-A484 PolarHBondContact O-N 3.16Å; D481-A484 WeakPolarHBondContact OD1-CB 3.34Å; D481-A484 PolarHBondContact OD1-N 3.48Å; D481-A485 VanDerWaalsContact O-CB 3.29Å; D481-A485 WeakPolarHBondContact O-CB 3.35Å; D481-A485 PolarHBondContact O-N 3.44Å
482	S	83.3	Confident	72.2	Confident	97 Å²	97	72 Å²	72	68%	0.678	37%	0.367	S	S	*	.	H	α-helix	trans	-61.7	-28	-177.7	54	0	0	0	0	112.9	I486	S482-I486 WeakPolarHBondContact O-CD1 3.11Å; S482-I486 VanDerWaalsContact O-CG1 3.29Å; S482-I486 WeakPolarHBondContact O-CG1 3.32Å; S482-I486 PolarHBondContact O-N 3.04Å
483	K	85.6	Confident	73.8	Confident	137 Å²	137	74 Å²	74	60%	0.596	38%	0.376	S	S	*	.	H	α-helix	trans	-74.6	-54.9	175.7	-167.9	-172.2	170.6	-167.4	0	111.5	D481 A485 I486 D487	D481-K483 PolarHBondContact O-N 3.03Å; D481-K483 VanDerWaalsContact OD2-CB 3.32Å; D481-K483 WeakPolarHBondContact OD2-CB 3.39Å; D481-K483 PolarHBondContact OD2-N 3.28Å; K483-A485 PolarHBondContact O-N 3.21Å; K483-I486 PolarHBondContact O-N 3.14Å; K483-D487 VanDerWaalsContact CE-OD2 3.24Å; K483-D487 WeakPolarHBondContact CE-OD2 3.2Å; K483-D487 PolarHBondContact O-N 3.03Å
484	A	81.3	Confident	75.5	Confident	33 Å²	33	73 Å²	73	27%	0.273	37%	0.369	S	S	.	.	H	α-helix	trans	-62.4	-28.6	-180	0	0	0	0	0	112.6	L480 D481 K488	L480-A484 HydrophobicContact CB-CB 4.35Å; L480-A484 HydrophobicContact CD2-CB 4.18Å; D481-A484 PolarHBondContact O-N 3.16Å; D481-A484 WeakPolarHBondContact OD1-CB 3.34Å; D481-A484 PolarHBondContact OD1-N 3.48Å; A484-K488 WeakPolarHBondContact O-CB 3.5Å; A484-K488 PolarHBondContact O-N 3.31Å
485	A	80.7	Confident	77	Confident	25 Å²	25	69.6 Å²	69.6	21%	0.207	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-38.4	171.7	0	0	0	0	0	113.1	F477 L480 D481 K483 F489	F477-A485 HydrophobicContact CD1-CB 4.28Å; L480-A485 HydrophobicContact CB-CB 4.27Å; D481-A485 VanDerWaalsContact O-CB 3.29Å; D481-A485 WeakPolarHBondContact O-CB 3.35Å; D481-A485 PolarHBondContact O-N 3.44Å; K483-A485 PolarHBondContact O-N 3.21Å; A485-F489 WeakPolarHBondContact O-CB 3.42Å; A485-F489 PolarHBondContact O-N 3.27Å
486	I	83.9	Confident	78.5	Confident	101 Å²	101	73.5 Å²	73.5	52%	0.518	36%	0.363	S	S	.	.	H	α-helix	trans	-73.4	-47.7	175.2	-69.2	166.4	0	0	0	110.6	S482 K483 K488 F489 N490	S482-I486 WeakPolarHBondContact O-CD1 3.11Å; S482-I486 VanDerWaalsContact O-CG1 3.29Å; S482-I486 WeakPolarHBondContact O-CG1 3.32Å; S482-I486 PolarHBondContact O-N 3.04Å; K483-I486 PolarHBondContact O-N 3.14Å; I486-K488 VanDerWaalsContact C-N 3.27Å; I486-K488 PolarHBondContact O-N 3.03Å; I486-F489 PolarHBondContact O-N 3.39Å; I486-F489 VanDerWaalsContact O-N 3.11Å; I486-N490 VanDerWaalsContact O-CG 3.3Å; I486-N490 PolarHBondContact O-N 3.42Å; I486-N490 PolarHBondContact O-ND2 3.39Å
487	D	83.2	Confident	80.2	Confident	84 Å²	84	73 Å²	73	45%	0.449	36%	0.357	S	S	.	.	H	α-helix	trans	-58.4	-41.5	178.7	-66.5	-16	0	0	0	110.3	K483 L491	K483-D487 VanDerWaalsContact CE-OD2 3.24Å; K483-D487 WeakPolarHBondContact CE-OD2 3.2Å; K483-D487 PolarHBondContact O-N 3.03Å; D487-L491 PolarHBondContact O-N 3.33Å; D487-L491 VanDerWaalsContact O-N 3.1Å
488	K	80.6	Confident	81.7	Confident	16 Å²	16	68.3 Å²	68.3	7%	0.07	34%	0.336	C	S	.	.	H	α-helix	trans	-68.5	-41.7	172.4	179.5	160	-175.5	154.7	0	113.4	C473 S475 F477 L480 A484 I486 N490 L491 D492 D523	C473-K488 PolarHBondContact O-NZ 2.66Å; S475-K488 PolarHBondContact OG-NZ 3.13Å; F477-K488 HydrophobicContact CE1-CG 4.46Å; L480-K488 HydrophobicContact CD1-CD 4.4Å; A484-K488 WeakPolarHBondContact O-CB 3.5Å; A484-K488 PolarHBondContact O-N 3.31Å; I486-K488 VanDerWaalsContact C-N 3.27Å; I486-K488 PolarHBondContact O-N 3.03Å; K488-N490 PolarHBondContact O-N 3.32Å; K488-L491 WeakPolarHBondContact O-CB 3.48Å; K488-L491 PolarHBondContact O-N 3.41Å; K488-L491 VanDerWaalsContact O-N 3.11Å; K488-D492 VanDerWaalsContact CE-OD1 3.22Å; K488-D492 WeakPolarHBondContact CE-OD1 3.28Å; K488-D492 PolarHBondContact O-N 3.33Å; K488-D523 IonicContact NZ-OD1 3.58Å; K488-D523 IonicContact NZ-OD2 3.82Å; K488-D523 PolarHBondContact NZ-OD2 2.69Å
489	F	84.8	Confident	83.1	Confident	118 Å²	118	62.5 Å²	62.5	52%	0.518	31%	0.313	S	S	.	.	H	α-helix	trans	-59	-39.2	176.5	176.5	-92.8	0	0	0	111.6	A485 I486 L493	A485-F489 WeakPolarHBondContact O-CB 3.42Å; A485-F489 PolarHBondContact O-N 3.27Å; I486-F489 PolarHBondContact O-N 3.39Å; I486-F489 VanDerWaalsContact O-N 3.11Å; F489-L493 HydrophobicContact CE1-CD2 4.03Å; F489-L493 HydrophobicContact CZ-CD2 4.46Å; F489-L493 WeakPolarHBondContact O-CB 3.35Å; F489-L493 PolarHBondContact O-N 3.32Å
490	N	87.8	Confident	84.4	Confident	45 Å²	45	57.6 Å²	57.6	24%	0.241	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-37.9	175	-65.4	-26.6	0	0	0	112.2	I486 K488 G494 L512	I486-N490 VanDerWaalsContact O-CG 3.3Å; I486-N490 PolarHBondContact O-N 3.42Å; I486-N490 PolarHBondContact O-ND2 3.39Å; K488-N490 PolarHBondContact O-N 3.32Å; N490-G494 PolarHBondContact O-N 3.49Å; N490-L512 HydrophobicContact CB-CD2 4.4Å
491	L	86.1	Confident	85	Confident	40 Å²	40	56.3 Å²	56.3	21%	0.209	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-55.1	172.6	-170.9	73.8	0	0	0	111.3	D487 K488 L493 G494 F495 L513	D487-L491 PolarHBondContact O-N 3.33Å; D487-L491 VanDerWaalsContact O-N 3.1Å; K488-L491 WeakPolarHBondContact O-CB 3.48Å; K488-L491 PolarHBondContact O-N 3.41Å; K488-L491 VanDerWaalsContact O-N 3.11Å; L491-L493 PolarHBondContact O-N 2.94Å; L491-G494 PolarHBondContact O-N 3.36Å; L491-F495 HydrophobicContact CD1-CD2 4.08Å; L491-F495 HydrophobicContact CD1-CE2 3.8Å; L491-F495 HydrophobicContact CG-CD2 4.21Å; L491-F495 HydrophobicContact CG-CE2 4.27Å; L491-F495 WeakPolarHBondContact O-CB 3.36Å; L491-F495 WeakPolarHBondContact O-CD2 3.32Å; L491-F495 PolarHBondContact O-N 2.98Å; L491-L513 HydrophobicContact CD1-CD2 3.82Å
492	D	84.9	Confident	85.3	Confident	27 Å²	27	57.6 Å²	57.6	14%	0.144	30%	0.303	C	S	.	.	H	α-helix	trans	-58.1	-35.3	179	-74.5	4.2	0	0	0	112.3	K488 R496	K488-D492 VanDerWaalsContact CE-OD1 3.22Å; K488-D492 WeakPolarHBondContact CE-OD1 3.28Å; K488-D492 PolarHBondContact O-N 3.33Å; D492-R496 WeakPolarHBondContact O-CG 3.49Å; D492-R496 PolarHBondContact O-N 3.29Å; D492-R496 PolarHBondContact O-NE 3.32Å
493	L	87.3	Confident	85.6	Confident	63 Å²	63	58 Å²	58	33%	0.33	30%	0.302	S	S	.	.	H	α-helix	trans	-75.2	-49.7	176.9	178.9	58.8	0	0	0	111.3	F489 L491 F495 R496 M497 L512	F489-L493 HydrophobicContact CE1-CD2 4.03Å; F489-L493 HydrophobicContact CZ-CD2 4.46Å; F489-L493 WeakPolarHBondContact O-CB 3.35Å; F489-L493 PolarHBondContact O-N 3.32Å; L491-L493 PolarHBondContact O-N 2.94Å; L493-F495 VanDerWaalsContact C-N 3.32Å; L493-F495 PolarHBondContact O-N 3.31Å; L493-R496 PolarHBondContact O-N 2.79Å; L493-R496 VanDerWaalsContact O-N 3.08Å; L493-M497 HydrophobicContact CD1-CG 4.25Å; L493-M497 HydrophobicContact CD1-SD 4.15Å; L493-M497 HydrophobicContact CG-CG 4.46Å; L493-M497 HydrophobicContact CG-SD 3.92Å; L493-M497 VanDerWaalsContact O-CG 3.3Å; L493-M497 WeakPolarHBondContact O-CG 3.3Å; L493-M497 PolarHBondContact O-N 3.12Å; L493-L512 HydrophobicContact CD2-CD1 3.9Å; L493-L512 HydrophobicContact CG-CD1 4.02Å
494	G	88.9	Confident	85.8	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.5	-40.9	178.5	0	0	0	0	0	112.6	N490 L491 M497 L498	N490-G494 PolarHBondContact O-N 3.49Å; L491-G494 PolarHBondContact O-N 3.36Å; G494-M497 PolarHBondContact O-N 3.27Å; G494-L498 PolarHBondContact O-N 3.03Å
495	F	87.9	Confident	86.2	Confident	9 Å²	9	55.3 Å²	55.3	4%	0.039	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-45.7	171.8	-95.2	-107	0	0	0	111.8	P470 L491 L493 M497 L498 N499 L513 S520 D522 P528 Y531	P470-F495 HydrophobicContact CB-CD1 4.49Å; L491-F495 HydrophobicContact CD1-CD2 4.08Å; L491-F495 HydrophobicContact CD1-CE2 3.8Å; L491-F495 HydrophobicContact CG-CD2 4.21Å; L491-F495 HydrophobicContact CG-CE2 4.27Å; L491-F495 WeakPolarHBondContact O-CB 3.36Å; L491-F495 WeakPolarHBondContact O-CD2 3.32Å; L491-F495 PolarHBondContact O-N 2.98Å; L493-F495 VanDerWaalsContact C-N 3.32Å; L493-F495 PolarHBondContact O-N 3.31Å; F495-M497 VanDerWaalsContact C-N 3.3Å; F495-M497 PolarHBondContact O-N 2.78Å; F495-L498 PolarHBondContact O-N 2.92Å; F495-N499 WeakPolarHBondContact O-CB 3.44Å; F495-N499 PolarHBondContact O-N 3.37Å; F495-N499 PolarHBondContact O-ND2 2.81Å; F495-L513 HydrophobicContact CD2-CD2 3.96Å; F495-L513 HydrophobicContact CE2-CD2 4.28Å; F495-S520 WeakPolarHBondContact CZ-O 3.41Å; F495-D522 HydrophobicContact CE1-CB 3.99Å; F495-D522 HydrophobicContact CZ-CB 3.93Å; F495-P528 HydrophobicContact CD1-CG 4.16Å; F495-P528 HydrophobicContact CE1-CG 3.87Å; F495-P528 HydrophobicContact CZ-CG 4.09Å; F495-Y531 HydrophobicContact CE1-CE2 4.48Å
496	R	87.3	Confident	86.6	Confident	124 Å²	124	55.3 Å²	55.3	47%	0.468	29%	0.286	S	S	.	.	H	α-helix	trans	-65	-32.6	175.9	-76	-177.2	-114	-157.1	-4.1	113.1	D492 L493 C500	D492-R496 WeakPolarHBondContact O-CG 3.49Å; D492-R496 PolarHBondContact O-N 3.29Å; D492-R496 PolarHBondContact O-NE 3.32Å; L493-R496 PolarHBondContact O-N 2.79Å; L493-R496 VanDerWaalsContact O-N 3.08Å; R496-C500 WeakPolarHBondContact O-CB 3.39Å; R496-C500 PolarHBondContact O-N 2.82Å
497	M	89.8	Confident	86.7	Confident	23 Å²	23	52.7 Å²	52.7	11%	0.113	28%	0.284	C	S	.	.	H	α-helix	trans	-69.6	-38.4	176.8	-69.5	176.1	72.3	0	0	112.2	L493 G494 F495 C500 L505 Q508 A509 L512	L493-M497 HydrophobicContact CD1-CG 4.25Å; L493-M497 HydrophobicContact CD1-SD 4.15Å; L493-M497 HydrophobicContact CG-CG 4.46Å; L493-M497 HydrophobicContact CG-SD 3.92Å; L493-M497 VanDerWaalsContact O-CG 3.3Å; L493-M497 WeakPolarHBondContact O-CG 3.3Å; L493-M497 PolarHBondContact O-N 3.12Å; G494-M497 PolarHBondContact O-N 3.27Å; F495-M497 VanDerWaalsContact C-N 3.3Å; F495-M497 PolarHBondContact O-N 2.78Å; M497-C500 PolarHBondContact O-SG 2.88Å; M497-L505 HydrophobicContact CB-CB 4.27Å; M497-L505 HydrophobicContact CB-CD1 4.13Å; M497-L505 HydrophobicContact CE-CB 4.07Å; M497-L505 HydrophobicContact CE-CD1 4Å; M497-L505 HydrophobicContact CE-CD2 4.06Å; M497-L505 HydrophobicContact CE-CG 4.27Å; M497-L505 HydrophobicContact CG-CD1 4Å; M497-Q508 HydrophobicContact CE-CB 3.5Å; M497-Q508 VanDerWaalsContact CE-CB 3.5Å; M497-A509 HydrophobicContact CB-CB 3.84Å; M497-L512 HydrophobicContact SD-CD1 3.65Å
498	L	88.6	Confident	87.1	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-70.3	-48.5	171.9	-67.9	176	0	0	0	111.9	G494 F495 C500 G501 I506 A509 L513 V518 P528 L540 L544	G494-L498 PolarHBondContact O-N 3.03Å; F495-L498 PolarHBondContact O-N 2.92Å; L498-C500 PolarHBondContact O-N 3.41Å; L498-C500 VanDerWaalsContact O-N 3.08Å; L498-G501 PolarHBondContact O-N 3.46Å; L498-I506 HydrophobicContact CD2-CG2 4.33Å; L498-A509 HydrophobicContact CD2-CB 3.81Å; L498-A509 HydrophobicContact CG-CB 3.76Å; L498-L513 HydrophobicContact CD1-CD1 3.56Å; L498-L513 HydrophobicContact CG-CD1 4.3Å; L498-V518 HydrophobicContact CD1-CG1 4.43Å; L498-P528 HydrophobicContact CB-CB 4.37Å; L498-P528 HydrophobicContact CD1-CB 4.16Å; L498-P528 HydrophobicContact CD1-CG 3.68Å; L498-L540 WeakPolarHBondContact O-CD1 3.38Å; L498-L544 HydrophobicContact CB-CD2 4.44Å; L498-L544 HydrophobicContact CD2-CD2 4.32Å
499	N	85.5	Confident	87.5	Confident	46 Å²	46	53.1 Å²	53.1	25%	0.246	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-3.7	-177.3	-73.9	-82.3	0	0	0	114.4	F495 G501	F495-N499 WeakPolarHBondContact O-CB 3.44Å; F495-N499 PolarHBondContact O-N 3.37Å; F495-N499 PolarHBondContact O-ND2 2.81Å; N499-G501 VanDerWaalsContact C-N 3.29Å
500	C	85.2	Confident	87.7	Confident	56 Å²	56	50.3 Å²	50.3	38%	0.378	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-1.9	173.5	83.1	0	0	0	0	114.2	R496 M497 L498 R502	R496-C500 WeakPolarHBondContact O-CB 3.39Å; R496-C500 PolarHBondContact O-N 2.82Å; M497-C500 PolarHBondContact O-SG 2.88Å; L498-C500 PolarHBondContact O-N 3.41Å; L498-C500 VanDerWaalsContact O-N 3.08Å; C500-R502 PolarHBondContact O-N 2.64Å
501	G	82.3	Confident	87.7	Confident	41 Å²	41	52.6 Å²	52.6	42%	0.423	29%	0.285	S	S	.	.			trans	71.6	7.6	175.1	0	0	0	0	0	115.5	L498 N499	L498-G501 PolarHBondContact O-N 3.46Å; N499-G501 VanDerWaalsContact C-N 3.29Å
502	R	87.4	Confident	87.9	Confident	124 Å²	124	53.5 Å²	53.5	47%	0.468	29%	0.29	S	S	.	.			trans	-100	122.7	-176	-53.4	-168.2	-71.1	120.9	-18.9	112.5	C500 D504 L505	C500-R502 PolarHBondContact O-N 2.64Å; R502-D504 VanDerWaalsContact C-N 3.28Å; R502-D504 WeakPolarHBondContact CB-OD1 3.23Å; R502-D504 IonicContact CZ-OD1 3.61Å; R502-D504 IonicContact NH1-OD1 3.95Å; R502-D504 PolarHBondContact NH1-OD1 3.23Å; R502-D504 IonicContact NH1-OD2 3.14Å; R502-D504 PolarHBondContact NH1-OD2 2.97Å; R502-D504 PolarHBondContact O-N 2.74Å; R502-L505 VanDerWaalsContact NH2-CD1 3.35Å; R502-L505 PolarHBondContact O-N 2.63Å
503	T	88.4	Confident	87.9	Confident	105 Å²	105	52.4 Å²	52.4	64%	0.644	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-68.2	-22.6	-175.6	52.4	0	0	0	0	114.1	L505 I506 M543	T503-L505 VanDerWaalsContact C-N 3.26Å; T503-L505 PolarHBondContact O-N 3.18Å; T503-I506 HydrophobicContact CG2-CD1 4.14Å; T503-M543 HydrophobicContact CG2-CG 3.91Å
504	D	89.7	Confident	87.5	Confident	94 Å²	94	57.7 Å²	57.7	50%	0.503	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-67.9	-24.2	177.3	70.5	-52.1	0	0	0	113.4	R502	R502-D504 VanDerWaalsContact C-N 3.28Å; R502-D504 WeakPolarHBondContact CB-OD1 3.23Å; R502-D504 IonicContact CZ-OD1 3.61Å; R502-D504 IonicContact NH1-OD1 3.95Å; R502-D504 PolarHBondContact NH1-OD1 3.23Å; R502-D504 IonicContact NH1-OD2 3.14Å; R502-D504 PolarHBondContact NH1-OD2 2.97Å; R502-D504 PolarHBondContact O-N 2.74Å
505	L	91.1	Very high	87	Confident	19 Å²	19	63.4 Å²	63.4	10%	0.099	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-92.7	-12.8	-178.4	-64.7	-160.7	0	0	0	114.5	M497 R502 T503 G507 Q508 A509	M497-L505 HydrophobicContact CB-CB 4.27Å; M497-L505 HydrophobicContact CB-CD1 4.13Å; M497-L505 HydrophobicContact CE-CB 4.07Å; M497-L505 HydrophobicContact CE-CD1 4Å; M497-L505 HydrophobicContact CE-CD2 4.06Å; M497-L505 HydrophobicContact CE-CG 4.27Å; M497-L505 HydrophobicContact CG-CD1 4Å; R502-L505 VanDerWaalsContact NH2-CD1 3.35Å; R502-L505 PolarHBondContact O-N 2.63Å; T503-L505 VanDerWaalsContact C-N 3.26Å; T503-L505 PolarHBondContact O-N 3.18Å; L505-G507 PolarHBondContact O-N 3.3Å; L505-Q508 PolarHBondContact O-N 3.01Å; L505-Q508 VanDerWaalsContact O-N 3.16Å; L505-A509 WeakPolarHBondContact O-CB 3.35Å; L505-A509 PolarHBondContact O-N 3.35Å
506	I	88.3	Confident	86.7	Confident	26 Å²	26	66.4 Å²	66.4	13%	0.133	35%	0.353	C	S	.	.	H	α-helix	trans	-54.5	-50.7	-175.1	-59.3	167.6	0	0	0	111.2	L498 T503 Q508 A509 I510 M543 A547	L498-I506 HydrophobicContact CD2-CG2 4.33Å; T503-I506 HydrophobicContact CG2-CD1 4.14Å; I506-Q508 VanDerWaalsContact C-N 3.34Å; I506-Q508 PolarHBondContact O-N 3.1Å; I506-A509 PolarHBondContact O-N 3.46Å; I506-I510 HydrophobicContact CG2-CD1 3.76Å; I506-I510 HydrophobicContact CG2-CG1 4.37Å; I506-I510 WeakPolarHBondContact O-CG1 3.17Å; I506-I510 PolarHBondContact O-N 2.98Å; I506-M543 HydrophobicContact CD1-CG 3.77Å; I506-M543 HydrophobicContact CD1-SD 3.39Å; I506-M543 WeakPolarHBondContact CD1-SD 3.47Å; I506-M543 HydrophobicContact CG1-SD 3.65Å; I506-A547 HydrophobicContact CD1-CB 4.46Å; I506-A547 HydrophobicContact CG2-CB 3.82Å
507	G	86.9	Confident	86.7	Confident	46 Å²	46	60.8 Å²	60.8	47%	0.474	33%	0.334	S	S	.	.	H	α-helix	trans	-62.2	-40	-178.8	0	0	0	0	0	113	L505 I510 D511	L505-G507 PolarHBondContact O-N 3.3Å; G507-I510 PolarHBondContact O-N 3.2Å; G507-D511 PolarHBondContact O-N 2.94Å
508	Q	90.7	Very high	86.6	Confident	109 Å²	109	60 Å²	60	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-68.2	-37	176.5	-61	174.4	47.6	0	0	111.6	M497 L505 I506 D511 L512	M497-Q508 HydrophobicContact CE-CB 3.5Å; M497-Q508 VanDerWaalsContact CE-CB 3.5Å; L505-Q508 PolarHBondContact O-N 3.01Å; L505-Q508 VanDerWaalsContact O-N 3.16Å; I506-Q508 VanDerWaalsContact C-N 3.34Å; I506-Q508 PolarHBondContact O-N 3.1Å; Q508-D511 PolarHBondContact O-N 2.95Å; Q508-L512 WeakPolarHBondContact O-CG 3.36Å; Q508-L512 PolarHBondContact O-N 3.32Å; Q508-L512 VanDerWaalsContact O-N 3.13Å
509	A	89.3	Confident	86.6	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-67.2	-44.5	175.3	0	0	0	0	0	111.5	M497 L498 L505 I506 D511 L512 L513	M497-A509 HydrophobicContact CB-CB 3.84Å; L498-A509 HydrophobicContact CD2-CB 3.81Å; L498-A509 HydrophobicContact CG-CB 3.76Å; L505-A509 WeakPolarHBondContact O-CB 3.35Å; L505-A509 PolarHBondContact O-N 3.35Å; I506-A509 PolarHBondContact O-N 3.46Å; A509-D511 PolarHBondContact O-N 3.16Å; A509-L512 PolarHBondContact O-N 3.42Å; A509-L512 VanDerWaalsContact O-N 3.12Å; A509-L513 HydrophobicContact CB-CD1 4.35Å; A509-L513 VanDerWaalsContact O-CB 3.24Å; A509-L513 WeakPolarHBondContact O-CB 3.17Å; A509-L513 WeakPolarHBondContact O-CD1 3.04Å; A509-L513 WeakPolarHBondContact O-CG 3.17Å; A509-L513 PolarHBondContact O-N 2.88Å
510	I	88.8	Confident	86.8	Confident	58 Å²	58	60.1 Å²	60.1	30%	0.297	33%	0.332	S	S	.	.	H	α-helix	trans	-57.5	-39.5	173.9	-69	169.2	0	0	0	110.9	I506 G507 L512 L513 R514 V518	I506-I510 HydrophobicContact CG2-CD1 3.76Å; I506-I510 HydrophobicContact CG2-CG1 4.37Å; I506-I510 WeakPolarHBondContact O-CG1 3.17Å; I506-I510 PolarHBondContact O-N 2.98Å; G507-I510 PolarHBondContact O-N 3.2Å; I510-L512 PolarHBondContact O-N 3.47Å; I510-L513 PolarHBondContact O-N 3.24Å; I510-R514 WeakPolarHBondContact O-CG 3.26Å; I510-R514 PolarHBondContact O-N 3.27Å; I510-V518 HydrophobicContact CD1-CG2 3.63Å; I510-V518 HydrophobicContact CG1-CG2 3.63Å
511	D	88.6	Confident	86.9	Confident	93 Å²	93	59.3 Å²	59.3	50%	0.497	32%	0.323	S	S	.	.	H	α-helix	trans	-68	-29.5	177.2	-90.1	-17.6	0	0	0	114.4	G507 Q508 A509 R514	G507-D511 PolarHBondContact O-N 2.94Å; Q508-D511 PolarHBondContact O-N 2.95Å; A509-D511 PolarHBondContact O-N 3.16Å; D511-R514 VanDerWaalsContact CG-NH2 3.26Å; D511-R514 IonicContact OD1-CZ 3.08Å; D511-R514 VanDerWaalsContact OD1-CZ 3.26Å; D511-R514 IonicContact OD1-NE 2.89Å; D511-R514 PolarHBondContact OD1-NE 2.92Å; D511-R514 VanDerWaalsContact OD1-NE 3.08Å; D511-R514 IonicContact OD1-NH2 2.72Å; D511-R514 PolarHBondContact OD1-NH2 2.88Å; D511-R514 IonicContact OD2-NH2 3.07Å
512	L	88.7	Confident	86.9	Confident	60 Å²	60	58 Å²	58	31%	0.314	31%	0.306	S	S	.	.	H	α-helix	trans	-80.5	-31.1	171.7	-68.7	171.3	0	0	0	112.9	N490 L493 M497 Q508 A509 I510	N490-L512 HydrophobicContact CB-CD2 4.4Å; L493-L512 HydrophobicContact CD2-CD1 3.9Å; L493-L512 HydrophobicContact CG-CD1 4.02Å; M497-L512 HydrophobicContact SD-CD1 3.65Å; Q508-L512 WeakPolarHBondContact O-CG 3.36Å; Q508-L512 PolarHBondContact O-N 3.32Å; Q508-L512 VanDerWaalsContact O-N 3.13Å; A509-L512 PolarHBondContact O-N 3.42Å; A509-L512 VanDerWaalsContact O-N 3.12Å; I510-L512 PolarHBondContact O-N 3.47Å
513	L	86.1	Confident	86.5	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	29%	0.289	C	S	.	.	S	Bend	trans	-94	16	-173.4	-65.7	170.6	0	0	0	113.9	L491 F495 L498 A509 I510 D516 G517 S520	L491-L513 HydrophobicContact CD1-CD2 3.82Å; F495-L513 HydrophobicContact CD2-CD2 3.96Å; F495-L513 HydrophobicContact CE2-CD2 4.28Å; L498-L513 HydrophobicContact CD1-CD1 3.56Å; L498-L513 HydrophobicContact CG-CD1 4.3Å; A509-L513 HydrophobicContact CB-CD1 4.35Å; A509-L513 VanDerWaalsContact O-CB 3.24Å; A509-L513 WeakPolarHBondContact O-CB 3.17Å; A509-L513 WeakPolarHBondContact O-CD1 3.04Å; A509-L513 WeakPolarHBondContact O-CG 3.17Å; A509-L513 PolarHBondContact O-N 2.88Å; I510-L513 PolarHBondContact O-N 3.24Å; L513-D516 PolarHBondContact O-N 2.78Å; L513-G517 WeakPolarHBondContact CB-O 3.47Å; L513-G517 PolarHBondContact O-N 2.55Å; L513-S520 PolarHBondContact O-OG 2.92Å
514	R	79.1	Confident	86	Confident	173 Å²	173	49.3 Å²	49.3	65%	0.653	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	140.8	178.4	-59.3	178.8	-171.3	161.4	0.6	110.7	I510 D511	I510-R514 WeakPolarHBondContact O-CG 3.26Å; I510-R514 PolarHBondContact O-N 3.27Å; D511-R514 VanDerWaalsContact CG-NH2 3.26Å; D511-R514 IonicContact OD1-CZ 3.08Å; D511-R514 VanDerWaalsContact OD1-CZ 3.26Å; D511-R514 IonicContact OD1-NE 2.89Å; D511-R514 PolarHBondContact OD1-NE 2.92Å; D511-R514 VanDerWaalsContact OD1-NE 3.08Å; D511-R514 IonicContact OD1-NH2 2.72Å; D511-R514 PolarHBondContact OD1-NH2 2.88Å; D511-R514 IonicContact OD2-NH2 3.07Å
515	P	77.8	Confident	85.7	Confident	121 Å²	121	44.8 Å²	44.8	79%	0.786	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	cis	-89.5	-22.6	9.8	34.4	-35.2	0	0	0	114.9	G517	P515-G517 VanDerWaalsContact C-N 3.35Å; P515-G517 PolarHBondContact O-N 3Å
516	D	81.6	Confident	85.5	Confident	71 Å²	71	44.1 Å²	44.1	38%	0.38	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-15.8	-166.7	-56.3	-37.3	0	0	0	112.7	L513 V518 N519 K561	L513-D516 PolarHBondContact O-N 2.78Å; D516-V518 PolarHBondContact O-N 3.4Å; D516-N519 WeakPolarHBondContact O-CB 3.49Å; D516-N519 PolarHBondContact O-N 3.46Å; D516-K561 IonicContact OD2-NZ 2.73Å
517	G	87.1	Confident	85.6	Confident	7 Å²	7	43 Å²	43	7%	0.072	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	64.8	-127.3	170.1	0	0	0	0	0	112.5	L513 P515 N519 S520	L513-G517 WeakPolarHBondContact CB-O 3.47Å; L513-G517 PolarHBondContact O-N 2.55Å; P515-G517 VanDerWaalsContact C-N 3.35Å; P515-G517 PolarHBondContact O-N 3Å; G517-N519 PolarHBondContact O-N 3Å; G517-S520 PolarHBondContact N-OG 2.67Å; G517-S520 VanDerWaalsContact O-CB 3.27Å; G517-S520 WeakPolarHBondContact O-CB 3.45Å; G517-S520 PolarHBondContact O-N 3.34Å; G517-S520 VanDerWaalsContact O-N 3.1Å; G517-S520 PolarHBondContact O-OG 2.87Å
518	V	87.6	Confident	85.8	Confident	6 Å²	6	40.8 Å²	40.8	4%	0.036	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-61	-24	175.1	-167.4	0	0	0	0	112	L498 I510 D516 S520 P528 L544 A547 A549	L498-V518 HydrophobicContact CD1-CG1 4.43Å; I510-V518 HydrophobicContact CD1-CG2 3.63Å; I510-V518 HydrophobicContact CG1-CG2 3.63Å; D516-V518 PolarHBondContact O-N 3.4Å; V518-S520 VanDerWaalsContact C-N 3.35Å; V518-P528 WeakPolarHBondContact O-CD 3.5Å; V518-L544 HydrophobicContact CG1-CD2 3.63Å; V518-A547 HydrophobicContact CG2-CB 4.12Å; V518-A549 HydrophobicContact CG1-CB 3.95Å
519	N	89.6	Confident	85.9	Confident	43 Å²	43	35.7 Å²	35.7	23%	0.23	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-91.8	6.8	179.6	-59	-64.2	0	0	0	113.3	D516 G517 G548 A549 N550	D516-N519 WeakPolarHBondContact O-CB 3.49Å; D516-N519 PolarHBondContact O-N 3.46Å; G517-N519 PolarHBondContact O-N 3Å; N519-G548 PolarHBondContact ND2-O 3.1Å; N519-A549 WeakPolarHBondContact OD1-CA 3.35Å; N519-N550 WeakPolarHBondContact OD1-CB 3.42Å; N519-N550 PolarHBondContact OD1-N 2.86Å
520	S	88.4	Confident	86	Confident	7 Å²	7	35.8 Å²	35.8	5%	0.049	19%	0.185	C	C	.	.			trans	-56.9	145.3	171	-76.8	0	0	0	0	111.6	F495 L513 G517 V518 P528	F495-S520 WeakPolarHBondContact CZ-O 3.41Å; L513-S520 PolarHBondContact O-OG 2.92Å; G517-S520 PolarHBondContact N-OG 2.67Å; G517-S520 VanDerWaalsContact O-CB 3.27Å; G517-S520 WeakPolarHBondContact O-CB 3.45Å; G517-S520 PolarHBondContact O-N 3.34Å; G517-S520 VanDerWaalsContact O-N 3.1Å; G517-S520 PolarHBondContact O-OG 2.87Å; V518-S520 VanDerWaalsContact C-N 3.35Å; S520-P528 WeakPolarHBondContact O-CD 3.19Å
521	M	87.1	Confident	86.1	Confident	39 Å²	39	33.3 Å²	33.3	19%	0.192	17%	0.172	C	C	.	.			trans	-115.9	142.9	179.7	-73.8	170.2	-91.4	0	0	110.7	M526 T527 P556 Y562	M521-M526 WeakPolarHBondContact CA-O 3.31Å; M521-T527 HydrophobicContact CG-CG2 3.81Å; M521-P556 HydrophobicContact SD-CG 4.22Å; M521-Y562 HydrophobicContact CB-CE1 3.66Å
522	D	83	Confident	86.2	Confident	14 Å²	14	28.9 Å²	28.9	8%	0.075	15%	0.148	C	C	.	.			trans	-83.6	-171.3	177.9	82	-33.9	0	0	0	113.3	F495 Q524 G525 M526 Y531 Y562	F495-D522 HydrophobicContact CE1-CB 3.99Å; F495-D522 HydrophobicContact CZ-CB 3.93Å; D522-Q524 VanDerWaalsContact CG-N 3.35Å; D522-Q524 PolarHBondContact O-N 3.24Å; D522-Q524 VanDerWaalsContact O-N 3.11Å; D522-Q524 WeakPolarHBondContact OD1-CA 3.31Å; D522-Q524 WeakPolarHBondContact OD1-CB 3.28Å; D522-Q524 PolarHBondContact OD1-N 3.45Å; D522-Q524 PolarHBondContact OD2-N 3.01Å; D522-G525 PolarHBondContact O-N 3.44Å; D522-G525 PolarHBondContact OD1-N 3.02Å; D522-G525 VanDerWaalsContact OD1-N 3.14Å; D522-M526 PolarHBondContact N-O 3.25Å; D522-M526 WeakPolarHBondContact OD1-CB 3.34Å; D522-M526 PolarHBondContact OD1-N 2.96Å; D522-Y531 PolarHBondContact OD2-OH 3.18Å; D522-Y562 WeakPolarHBondContact O-CD1 3.48Å; D522-Y562 WeakPolarHBondContact O-CE1 3.42Å
523	D	78.1	Confident	86.4	Confident	21 Å²	21	26 Å²	26	11%	0.112	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.2	176.3	-74.7	4.1	0	0	0	113.8	S475 K488 Y562 S564	S475-D523 VanDerWaalsContact CB-OD2 3.22Å; S475-D523 WeakPolarHBondContact CB-OD2 3.08Å; S475-D523 PolarHBondContact OG-OD2 3.42Å; K488-D523 IonicContact NZ-OD1 3.58Å; K488-D523 IonicContact NZ-OD2 3.82Å; K488-D523 PolarHBondContact NZ-OD2 2.69Å; D523-Y562 CarbonylContact O-C 3.59Å; D523-S564 WeakPolarHBondContact O-CB 3.45Å; D523-S564 PolarHBondContact O-N 3.05Å; D523-S564 VanDerWaalsContact O-N 3.15Å
524	Q	78.1	Confident	86.6	Confident	24 Å²	24	26.2 Å²	26.2	11%	0.112	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-5	175.1	-68.7	-71.2	-15.3	0	0	114	C473 D522 M526 S564 V565 H566	C473-Q524 HydrophobicContact CB-CG 4.4Å; C473-Q524 WeakPolarHBondContact SG-CG 3.48Å; C473-Q524 PolarHBondContact SG-NE2 3.34Å; D522-Q524 VanDerWaalsContact CG-N 3.35Å; D522-Q524 PolarHBondContact O-N 3.24Å; D522-Q524 VanDerWaalsContact O-N 3.11Å; D522-Q524 WeakPolarHBondContact OD1-CA 3.31Å; D522-Q524 WeakPolarHBondContact OD1-CB 3.28Å; D522-Q524 PolarHBondContact OD1-N 3.45Å; D522-Q524 PolarHBondContact OD2-N 3.01Å; Q524-M526 VanDerWaalsContact C-N 3.29Å; Q524-M526 HydrophobicContact CB-CB 4.37Å; Q524-M526 HydrophobicContact CB-CG 3.74Å; Q524-S564 PolarHBondContact NE2-O 3.03Å; Q524-S564 PolarHBondContact OE1-O 3.38Å; Q524-V565 WeakPolarHBondContact O-CG2 3.45Å; Q524-H566 VanDerWaalsContact OE1-N 3.16Å
525	G	84.1	Confident	87	Confident	0 Å²	0	21 Å²	21	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	75.4	18	-172.3	0	0	0	0	0	113.5	D522	D522-G525 PolarHBondContact O-N 3.44Å; D522-G525 PolarHBondContact OD1-N 3.02Å; D522-G525 VanDerWaalsContact OD1-N 3.14Å
526	M	87.3	Confident	87.6	Confident	4 Å²	4	16.2 Å²	16.2	2%	0.02	10%	0.101	C	C	.	.			trans	-97.6	138.4	-175.2	-67.1	-75.3	-72.3	0	0	111.5	L468 M521 D522 Q524 M530 Y531 V555 F577	L468-M526 HydrophobicContact CD2-CE 4.22Å; M521-M526 WeakPolarHBondContact CA-O 3.31Å; D522-M526 PolarHBondContact N-O 3.25Å; D522-M526 WeakPolarHBondContact OD1-CB 3.34Å; D522-M526 PolarHBondContact OD1-N 2.96Å; Q524-M526 VanDerWaalsContact C-N 3.29Å; Q524-M526 HydrophobicContact CB-CB 4.37Å; Q524-M526 HydrophobicContact CB-CG 3.74Å; M526-M530 HydrophobicContact CE-CB 3.63Å; M526-M530 HydrophobicContact SD-CB 4.27Å; M526-M530 HydrophobicContact SD-SD 3.95Å; M526-Y531 HydrophobicContact CB-CD2 4.15Å; M526-Y531 HydrophobicContact CB-CE2 3.45Å; M526-Y531 VanDerWaalsContact CB-CE2 3.45Å; M526-Y531 HydrophobicContact CE-CE1 4.42Å; M526-Y531 HydrophobicContact CG-CE2 4.3Å; M526-V555 HydrophobicContact SD-CG2 3.78Å; M526-F577 HydrophobicContact CE-CD1 4.39Å; M526-F577 HydrophobicContact CE-CD2 4.36Å; M526-F577 HydrophobicContact CE-CE1 3.78Å; M526-F577 HydrophobicContact CE-CE2 3.76Å; M526-F577 HydrophobicContact CE-CZ 3.44Å; M526-F577 VanDerWaalsContact CE-CZ 3.44Å; M526-F577 HydrophobicContact SD-CE1 4.25Å; M526-F577 HydrophobicContact SD-CE2 3.68Å; M526-F577 HydrophobicContact SD-CZ 3.37Å; M526-F577 WeakPolarHBondContact SD-CZ 3.44Å
527	T	90.6	Very high	88.1	Confident	2 Å²	2	16.2 Å²	16.2	1%	0.012	10%	0.101	C	C	.	.			trans	-90.4	159.3	172.9	68.5	0	0	0	0	111.6	M521 L529 M530 Y531 V553	M521-T527 HydrophobicContact CG-CG2 3.81Å; T527-L529 PolarHBondContact O-N 3.25Å; T527-M530 HydrophobicContact CG2-CE 4.44Å; T527-M530 HydrophobicContact CG2-SD 4.32Å; T527-M530 PolarHBondContact N-SD 2.91Å; T527-M530 VanDerWaalsContact N-SD 3.4Å; T527-M530 PolarHBondContact O-N 3.13Å; T527-M530 VanDerWaalsContact O-N 3.09Å; T527-M530 WeakPolarHBondContact OG1-CG 3.37Å; T527-M530 PolarHBondContact OG1-N 3.04Å; T527-Y531 WeakPolarHBondContact O-CD2 3.33Å; T527-Y531 PolarHBondContact O-N 3.1Å; T527-V553 HydrophobicContact CG2-CB 4.46Å; T527-V553 HydrophobicContact CG2-CG1 3.9Å
528	P	90.4	Very high	88.4	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-53.3	-35.9	170.7	-26.5	34.7	0	0	0	113.3	F495 L498 V518 S520 Y531 A532 L544	F495-P528 HydrophobicContact CD1-CG 4.16Å; F495-P528 HydrophobicContact CE1-CG 3.87Å; F495-P528 HydrophobicContact CZ-CG 4.09Å; L498-P528 HydrophobicContact CB-CB 4.37Å; L498-P528 HydrophobicContact CD1-CB 4.16Å; L498-P528 HydrophobicContact CD1-CG 3.68Å; V518-P528 WeakPolarHBondContact O-CD 3.5Å; S520-P528 WeakPolarHBondContact O-CD 3.19Å; P528-Y531 PolarHBondContact O-N 3.22Å; P528-A532 PolarHBondContact O-N 3.03Å; P528-L544 HydrophobicContact CB-CD1 4.14Å; P528-L544 HydrophobicContact CB-CD2 4.25Å
529	L	92.6	Very high	88.7	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-65.1	-40.8	177.1	-178.2	65.9	0	0	0	111.8	T527 Y531 A532 C533 V541 L544 I545 A549 L551 A574	T527-L529 PolarHBondContact O-N 3.25Å; L529-Y531 VanDerWaalsContact C-N 3.34Å; L529-Y531 PolarHBondContact O-N 3Å; L529-A532 PolarHBondContact O-N 3.18Å; L529-C533 WeakPolarHBondContact O-CB 3.48Å; L529-C533 PolarHBondContact O-N 3.03Å; L529-C533 PolarHBondContact O-SG 3.47Å; L529-V541 HydrophobicContact CD1-CG1 4.17Å; L529-V541 HydrophobicContact CD1-CG2 4.44Å; L529-L544 HydrophobicContact CB-CD1 4.39Å; L529-L544 HydrophobicContact CD1-CB 4.11Å; L529-L544 HydrophobicContact CD1-CD1 4.48Å; L529-I545 HydrophobicContact CD1-CG1 4.43Å; L529-A549 HydrophobicContact CB-CB 4.28Å; L529-A549 HydrophobicContact CD2-CB 3.96Å; L529-L551 HydrophobicContact CD2-CD2 3.85Å; L529-A574 HydrophobicContact CD2-CB 3.84Å; L529-A574 HydrophobicContact CG-CB 3.91Å
530	M	91.7	Very high	88.8	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-62.6	-40.2	176.3	-67	163.8	175.3	0	0	111.7	M526 T527 C533 A534 V553 V555 F577	M526-M530 HydrophobicContact CE-CB 3.63Å; M526-M530 HydrophobicContact SD-CB 4.27Å; M526-M530 HydrophobicContact SD-SD 3.95Å; T527-M530 HydrophobicContact CG2-CE 4.44Å; T527-M530 HydrophobicContact CG2-SD 4.32Å; T527-M530 PolarHBondContact N-SD 2.91Å; T527-M530 VanDerWaalsContact N-SD 3.4Å; T527-M530 PolarHBondContact O-N 3.13Å; T527-M530 VanDerWaalsContact O-N 3.09Å; T527-M530 WeakPolarHBondContact OG1-CG 3.37Å; T527-M530 PolarHBondContact OG1-N 3.04Å; M530-C533 PolarHBondContact O-N 2.72Å; M530-A534 WeakPolarHBondContact O-CB 3.24Å; M530-A534 PolarHBondContact O-N 2.92Å; M530-V553 HydrophobicContact CE-CB 4.41Å; M530-V553 HydrophobicContact CE-CG1 4.17Å; M530-V553 WeakPolarHBondContact CE-O 3.42Å; M530-V555 HydrophobicContact CE-CG2 3.84Å; M530-V555 HydrophobicContact SD-CG2 3.73Å; M530-F577 HydrophobicContact CB-CD2 3.95Å; M530-F577 HydrophobicContact CB-CE2 4.15Å; M530-F577 HydrophobicContact CG-CD2 4Å; M530-F577 HydrophobicContact CG-CE2 4.12Å; M530-F577 HydrophobicContact SD-CE2 4.21Å
531	Y	90.1	Very high	89.1	Confident	7 Å²	7	21.8 Å²	21.8	3%	0.027	14%	0.136	C	C	.	.	H	α-helix	trans	-65	-44.2	174.3	-77.7	-68.2	0	0	0	112.6	L468 P470 F495 D522 M526 T527 P528 L529 C533 A534 A535	L468-Y531 HydrophobicContact CD1-CE1 3.99Å; L468-Y531 HydrophobicContact CG-CD1 4.26Å; L468-Y531 HydrophobicContact CG-CE1 3.97Å; P470-Y531 HydrophobicContact CB-CE2 4.36Å; P470-Y531 HydrophobicContact CG-CD1 4.11Å; P470-Y531 HydrophobicContact CG-CD2 3.83Å; P470-Y531 HydrophobicContact CG-CE1 4.36Å; P470-Y531 HydrophobicContact CG-CE2 4.09Å; P470-Y531 HydrophobicContact CG-CG 3.84Å; F495-Y531 HydrophobicContact CE1-CE2 4.48Å; D522-Y531 PolarHBondContact OD2-OH 3.18Å; M526-Y531 HydrophobicContact CB-CD2 4.15Å; M526-Y531 HydrophobicContact CB-CE2 3.45Å; M526-Y531 VanDerWaalsContact CB-CE2 3.45Å; M526-Y531 HydrophobicContact CE-CE1 4.42Å; M526-Y531 HydrophobicContact CG-CE2 4.3Å; T527-Y531 WeakPolarHBondContact O-CD2 3.33Å; T527-Y531 PolarHBondContact O-N 3.1Å; P528-Y531 PolarHBondContact O-N 3.22Å; L529-Y531 VanDerWaalsContact C-N 3.34Å; L529-Y531 PolarHBondContact O-N 3Å; Y531-C533 VanDerWaalsContact C-N 3.3Å; Y531-C533 PolarHBondContact O-N 2.83Å; Y531-A534 PolarHBondContact O-N 3.21Å; Y531-A535 WeakPolarHBondContact O-CB 3.46Å; Y531-A535 PolarHBondContact O-N 2.83Å
532	A	91.7	Very high	89.4	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.3	-42.2	174.5	0	0	0	0	0	111.8	P528 L529 A535 G536 D537 L540 V541 L544	P528-A532 PolarHBondContact O-N 3.03Å; L529-A532 PolarHBondContact O-N 3.18Å; A532-A535 PolarHBondContact O-N 2.91Å; A532-G536 PolarHBondContact O-N 3.03Å; A532-D537 PolarHBondContact O-N 3.33Å; A532-L540 HydrophobicContact CB-CB 4.15Å; A532-L540 HydrophobicContact CB-CD2 3.59Å; A532-L540 HydrophobicContact CB-CG 3.79Å; A532-V541 HydrophobicContact CB-CG2 3.64Å; A532-L544 HydrophobicContact CB-CD1 3.95Å
533	C	92.4	Very high	89.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68.7	-33.8	178.6	-67.5	0	0	0	0	113.5	L529 M530 Y531 A574 F577 A578 H583 V586	L529-C533 WeakPolarHBondContact O-CB 3.48Å; L529-C533 PolarHBondContact O-N 3.03Å; L529-C533 PolarHBondContact O-SG 3.47Å; M530-C533 PolarHBondContact O-N 2.72Å; Y531-C533 VanDerWaalsContact C-N 3.3Å; Y531-C533 PolarHBondContact O-N 2.83Å; C533-A574 WeakPolarHBondContact CB-O 3.46Å; C533-F577 HydrophobicContact CB-CB 4.46Å; C533-A578 HydrophobicContact CB-CB 4.19Å; C533-H583 PolarHBondContact O-CD2 3.32Å; C533-H583 VanDerWaalsContact O-CD2 3.31Å; C533-V586 HydrophobicContact CB-CG1 4.25Å
534	A	89.5	Confident	90.6	Very high	8 Å²	8	22.4 Å²	22.4	7%	0.066	14%	0.137	C	C	.	.	H	α-helix	trans	-73.6	-36.9	173.4	0	0	0	0	0	112.4	L468 M530 Y531 G536 F577 H583	L468-A534 HydrophobicContact CD2-CB 3.99Å; M530-A534 WeakPolarHBondContact O-CB 3.24Å; M530-A534 PolarHBondContact O-N 2.92Å; Y531-A534 PolarHBondContact O-N 3.21Å; A534-G536 VanDerWaalsContact C-N 3.31Å; A534-G536 PolarHBondContact O-N 3.32Å; A534-F577 HydrophobicContact CB-CB 4.44Å; A534-F577 HydrophobicContact CB-CD1 4.41Å; A534-H583 PolarHBondContact O-NE2 3.07Å
535	A	88.3	Confident	91.3	Very high	64 Å²	64	22.8 Å²	22.8	53%	0.529	14%	0.14	S	C	.	.	H	α-helix	trans	-71.1	-23.2	176.8	0	0	0	0	0	113.7	Y531 A532	Y531-A535 WeakPolarHBondContact O-CB 3.46Å; Y531-A535 PolarHBondContact O-N 2.83Å; A532-A535 PolarHBondContact O-N 2.91Å
536	G	90.6	Very high	91.7	Very high	19 Å²	19	28.7 Å²	28.7	20%	0.196	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	18	-176	0	0	0	0	0	113.8	A532 A534 E538 H583	A532-G536 PolarHBondContact O-N 3.03Å; A534-G536 VanDerWaalsContact C-N 3.31Å; A534-G536 PolarHBondContact O-N 3.32Å; G536-E538 PolarHBondContact O-N 3.47Å; G536-E538 VanDerWaalsContact O-N 3.1Å; G536-H583 VanDerWaalsContact CA-CD2 3.49Å; G536-H583 WeakPolarHBondContact CA-CD2 3.41Å; G536-H583 PolarHBondContact N-NE2 3.43Å
537	D	91.8	Very high	91.8	Very high	71 Å²	71	29.9 Å²	29.9	38%	0.38	18%	0.182	S	C	.	.			trans	-82.4	89.2	-177.5	-171.2	-24.2	0	0	0	110.7	A532 A539 L540 V541	A532-D537 PolarHBondContact O-N 3.33Å; D537-A539 PolarHBondContact O-N 3.08Å; D537-A539 PolarHBondContact OD1-N 3.37Å; D537-A539 VanDerWaalsContact OD1-N 3.16Å; D537-L540 HydrophobicContact CB-CB 3.78Å; D537-L540 HydrophobicContact CB-CD2 4.44Å; D537-L540 PolarHBondContact O-N 2.88Å; D537-L540 WeakPolarHBondContact OD1-CB 3.49Å; D537-L540 PolarHBondContact OD1-N 3.36Å; D537-L540 WeakPolarHBondContact OD2-CB 3.35Å; D537-V541 WeakPolarHBondContact O-CB 3.39Å; D537-V541 VanDerWaalsContact O-CG2 3.32Å; D537-V541 WeakPolarHBondContact O-CG2 3.29Å; D537-V541 PolarHBondContact O-N 3.01Å
538	E	93.6	Very high	91.7	Very high	98 Å²	98	32.1 Å²	32.1	46%	0.458	21%	0.206	S	C	.	.	H	α-helix	trans	-52	-37.5	178.2	-65.5	173	-144.3	0	0	113.2	G536 Q542 P585 V586 L589	G536-E538 PolarHBondContact O-N 3.47Å; G536-E538 VanDerWaalsContact O-N 3.1Å; E538-Q542 WeakPolarHBondContact O-CB 3.5Å; E538-Q542 PolarHBondContact O-N 3.03Å; E538-P585 VanDerWaalsContact CD-CB 3.49Å; E538-P585 HydrophobicContact CG-CB 4.06Å; E538-P585 WeakPolarHBondContact OE1-CB 3.43Å; E538-P585 WeakPolarHBondContact OE1-CG 3.32Å; E538-V586 HydrophobicContact CG-CG2 3.86Å; E538-L589 HydrophobicContact CB-CD1 4.12Å; E538-L589 HydrophobicContact CG-CD1 4.32Å
539	A	93	Very high	91.8	Very high	72 Å²	72	32.7 Å²	32.7	60%	0.595	21%	0.21	S	C	*	.	H	α-helix	trans	-75.4	-40.7	-177.8	0	0	0	0	0	111.7	D537 M543	D537-A539 PolarHBondContact O-N 3.08Å; D537-A539 PolarHBondContact OD1-N 3.37Å; D537-A539 VanDerWaalsContact OD1-N 3.16Å; A539-M543 VanDerWaalsContact O-CB 3.28Å; A539-M543 WeakPolarHBondContact O-CB 3.34Å; A539-M543 PolarHBondContact O-N 3.44Å
540	L	92.6	Very high	91.6	Very high	10 Å²	10	36.3 Å²	36.3	5%	0.052	23%	0.229	C	C	.	.	H	α-helix	trans	-66.6	-39.2	173.5	-170.6	72.1	0	0	0	111.2	L498 A532 D537 M543 L544	L498-L540 WeakPolarHBondContact O-CD1 3.38Å; A532-L540 HydrophobicContact CB-CB 4.15Å; A532-L540 HydrophobicContact CB-CD2 3.59Å; A532-L540 HydrophobicContact CB-CG 3.79Å; D537-L540 HydrophobicContact CB-CB 3.78Å; D537-L540 HydrophobicContact CB-CD2 4.44Å; D537-L540 PolarHBondContact O-N 2.88Å; D537-L540 WeakPolarHBondContact OD1-CB 3.49Å; D537-L540 PolarHBondContact OD1-N 3.36Å; D537-L540 WeakPolarHBondContact OD2-CB 3.35Å; L540-M543 HydrophobicContact CD1-CE 3.44Å; L540-M543 VanDerWaalsContact CD1-CE 3.44Å; L540-M543 HydrophobicContact CG-CE 4.38Å; L540-L544 HydrophobicContact CG-CD1 4.2Å; L540-L544 WeakPolarHBondContact O-CB 3.4Å; L540-L544 WeakPolarHBondContact O-CD1 3.45Å; L540-L544 WeakPolarHBondContact O-CG 3.28Å; L540-L544 PolarHBondContact O-N 3.33Å
541	V	94.6	Very high	91.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-52.8	173.6	168.4	0	0	0	0	110.8	L529 A532 D537 M543 L544 I545 V586 L590	L529-V541 HydrophobicContact CD1-CG1 4.17Å; L529-V541 HydrophobicContact CD1-CG2 4.44Å; A532-V541 HydrophobicContact CB-CG2 3.64Å; D537-V541 WeakPolarHBondContact O-CB 3.39Å; D537-V541 VanDerWaalsContact O-CG2 3.32Å; D537-V541 WeakPolarHBondContact O-CG2 3.29Å; D537-V541 PolarHBondContact O-N 3.01Å; V541-M543 VanDerWaalsContact C-N 3.33Å; V541-M543 PolarHBondContact O-N 3.08Å; V541-L544 PolarHBondContact O-N 2.91Å; V541-I545 HydrophobicContact CG1-CD1 3.72Å; V541-I545 HydrophobicContact CG1-CG1 4.42Å; V541-I545 VanDerWaalsContact O-CG1 3.31Å; V541-I545 WeakPolarHBondContact O-CG1 3.04Å; V541-I545 PolarHBondContact O-N 2.83Å; V541-V586 HydrophobicContact CG1-CG1 4.33Å; V541-V586 HydrophobicContact CG2-CG1 3.98Å; V541-V586 HydrophobicContact CG2-CG2 4.5Å; V541-L590 HydrophobicContact CG1-CD2 4.44Å
542	Q	94.2	Very high	91.5	Very high	73 Å²	73	39 Å²	39	34%	0.341	24%	0.244	S	C	.	.	H	α-helix	trans	-58.5	-44.9	178.7	-173.5	63.9	54.2	0	0	111.6	E538 L544 I545 D546	E538-Q542 WeakPolarHBondContact O-CB 3.5Å; E538-Q542 PolarHBondContact O-N 3.03Å; Q542-L544 VanDerWaalsContact C-N 3.31Å; Q542-L544 PolarHBondContact O-N 3.49Å; Q542-I545 PolarHBondContact O-N 3.43Å; Q542-D546 PolarHBondContact NE2-OD1 3.36Å; Q542-D546 WeakPolarHBondContact O-CB 3.39Å; Q542-D546 PolarHBondContact O-N 2.84Å
543	M	93	Very high	91.3	Very high	14 Å²	14	40.1 Å²	40.1	7%	0.069	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-40.7	177.4	178.6	-81	-66.6	0	0	112.8	T503 I506 A539 L540 V541 A547	T503-M543 HydrophobicContact CG2-CG 3.91Å; I506-M543 HydrophobicContact CD1-CG 3.77Å; I506-M543 HydrophobicContact CD1-SD 3.39Å; I506-M543 WeakPolarHBondContact CD1-SD 3.47Å; I506-M543 HydrophobicContact CG1-SD 3.65Å; A539-M543 VanDerWaalsContact O-CB 3.28Å; A539-M543 WeakPolarHBondContact O-CB 3.34Å; A539-M543 PolarHBondContact O-N 3.44Å; L540-M543 HydrophobicContact CD1-CE 3.44Å; L540-M543 VanDerWaalsContact CD1-CE 3.44Å; L540-M543 HydrophobicContact CG-CE 4.38Å; V541-M543 VanDerWaalsContact C-N 3.33Å; V541-M543 PolarHBondContact O-N 3.08Å; M543-A547 VanDerWaalsContact O-CB 3.3Å; M543-A547 WeakPolarHBondContact O-CB 3.27Å; M543-A547 PolarHBondContact O-N 2.94Å
544	L	92.6	Very high	91	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-73.1	-35.4	178.5	-68.8	168.3	0	0	0	112.1	L498 V518 P528 L529 A532 L540 V541 Q542 A547 G548 A549	L498-L544 HydrophobicContact CB-CD2 4.44Å; L498-L544 HydrophobicContact CD2-CD2 4.32Å; V518-L544 HydrophobicContact CG1-CD2 3.63Å; P528-L544 HydrophobicContact CB-CD1 4.14Å; P528-L544 HydrophobicContact CB-CD2 4.25Å; L529-L544 HydrophobicContact CB-CD1 4.39Å; L529-L544 HydrophobicContact CD1-CB 4.11Å; L529-L544 HydrophobicContact CD1-CD1 4.48Å; A532-L544 HydrophobicContact CB-CD1 3.95Å; L540-L544 HydrophobicContact CG-CD1 4.2Å; L540-L544 WeakPolarHBondContact O-CB 3.4Å; L540-L544 WeakPolarHBondContact O-CD1 3.45Å; L540-L544 WeakPolarHBondContact O-CG 3.28Å; L540-L544 PolarHBondContact O-N 3.33Å; V541-L544 PolarHBondContact O-N 2.91Å; Q542-L544 VanDerWaalsContact C-N 3.31Å; Q542-L544 PolarHBondContact O-N 3.49Å; L544-A547 PolarHBondContact O-N 2.97Å; L544-G548 PolarHBondContact O-N 2.83Å; L544-A549 HydrophobicContact CB-CB 4.18Å; L544-A549 WeakPolarHBondContact O-CB 3.33Å; L544-A549 PolarHBondContact O-N 3.11Å
545	I	93.6	Very high	90.8	Very high	33 Å²	33	41.1 Å²	41.1	17%	0.169	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-48.7	172.5	-65.7	171.1	0	0	0	110.1	L529 V541 Q542 A547 G548 L551 L590 A593	L529-I545 HydrophobicContact CD1-CG1 4.43Å; V541-I545 HydrophobicContact CG1-CD1 3.72Å; V541-I545 HydrophobicContact CG1-CG1 4.42Å; V541-I545 VanDerWaalsContact O-CG1 3.31Å; V541-I545 WeakPolarHBondContact O-CG1 3.04Å; V541-I545 PolarHBondContact O-N 2.83Å; Q542-I545 PolarHBondContact O-N 3.43Å; I545-A547 PolarHBondContact O-N 3.06Å; I545-G548 PolarHBondContact O-N 3.25Å; I545-L551 HydrophobicContact CD1-CD2 4.32Å; I545-L551 HydrophobicContact CG1-CD2 3.93Å; I545-L590 HydrophobicContact CD1-CD2 4.27Å; I545-A593 HydrophobicContact CD1-CB 4.36Å; I545-A593 HydrophobicContact CG2-CB 4.39Å
546	D	91.7	Very high	90.4	Very high	123 Å²	123	39.6 Å²	39.6	66%	0.658	24%	0.244	S	C	*	.	H	α-helix	trans	-60.2	-29.9	176.4	-66.6	-13.6	0	0	0	112.1	Q542 G548	Q542-D546 PolarHBondContact NE2-OD1 3.36Å; Q542-D546 WeakPolarHBondContact O-CB 3.39Å; Q542-D546 PolarHBondContact O-N 2.84Å; D546-G548 VanDerWaalsContact C-N 3.3Å; D546-G548 PolarHBondContact O-N 3.08Å
547	A	89.4	Confident	89.5	Confident	29 Å²	29	43.9 Å²	43.9	24%	0.24	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	0.7	174.8	0	0	0	0	0	114.6	I506 V518 M543 L544 I545	I506-A547 HydrophobicContact CD1-CB 4.46Å; I506-A547 HydrophobicContact CG2-CB 3.82Å; V518-A547 HydrophobicContact CG2-CB 4.12Å; M543-A547 VanDerWaalsContact O-CB 3.3Å; M543-A547 WeakPolarHBondContact O-CB 3.27Å; M543-A547 PolarHBondContact O-N 2.94Å; L544-A547 PolarHBondContact O-N 2.97Å; I545-A547 PolarHBondContact O-N 3.06Å
548	G	88.8	Confident	88.4	Confident	50 Å²	50	46 Å²	46	52%	0.515	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	29.6	177.9	0	0	0	0	0	115.2	N519 L544 I545 D546	N519-G548 PolarHBondContact ND2-O 3.1Å; L544-G548 PolarHBondContact O-N 2.83Å; I545-G548 PolarHBondContact O-N 3.25Å; D546-G548 VanDerWaalsContact C-N 3.3Å; D546-G548 PolarHBondContact O-N 3.08Å
549	A	91.3	Very high	87.1	Confident	11 Å²	11	43 Å²	43	9%	0.091	26%	0.255	C	S	.	.			trans	-64.8	137.2	168.3	0	0	0	0	0	111.4	V518 N519 L529 L544	V518-A549 HydrophobicContact CG1-CB 3.95Å; N519-A549 WeakPolarHBondContact OD1-CA 3.35Å; L529-A549 HydrophobicContact CB-CB 4.28Å; L529-A549 HydrophobicContact CD2-CB 3.96Å; L544-A549 HydrophobicContact CB-CB 4.18Å; L544-A549 WeakPolarHBondContact O-CB 3.33Å; L544-A549 PolarHBondContact O-N 3.11Å
550	N	90.1	Very high	85.8	Confident	80 Å²	80	45.7 Å²	45.7	43%	0.428	27%	0.266	S	S	.	.			trans	-89.4	119.3	179.1	176.2	-0.6	0	0	0	109.9	N519 D552 V553	N519-N550 WeakPolarHBondContact OD1-CB 3.42Å; N519-N550 PolarHBondContact OD1-N 2.86Å; N550-D552 PolarHBondContact OD1-N 2.83Å; N550-V553 HydrophobicContact CB-CG2 3.71Å; N550-V553 WeakPolarHBondContact O-CG2 3.25Å
551	L	90.4	Very high	84.7	Confident	19 Å²	19	51.2 Å²	51.2	10%	0.099	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-34.9	-171.2	-45.3	-177.8	0	0	0	112.6	L529 I545 V553 L590 A593 A595	L529-L551 HydrophobicContact CD2-CD2 3.85Å; I545-L551 HydrophobicContact CD1-CD2 4.32Å; I545-L551 HydrophobicContact CG1-CD2 3.93Å; L551-V553 VanDerWaalsContact C-N 3.35Å; L551-V553 PolarHBondContact O-N 3.1Å; L551-L590 HydrophobicContact CD2-CD2 4.04Å; L551-A593 HydrophobicContact CD1-CB 3.83Å; L551-A595 HydrophobicContact CB-CB 3.85Å; L551-A595 HydrophobicContact CD1-CB 3.83Å; L551-A595 HydrophobicContact CG-CB 4.48Å
552	D	87.6	Confident	83.7	Confident	45 Å²	45	52 Å²	52	24%	0.241	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	16.4	-172.9	-55.1	-48.2	0	0	0	113	N550 A554 N596 R603	N550-D552 PolarHBondContact OD1-N 2.83Å; D552-A554 PolarHBondContact O-N 2.95Å; D552-N596 WeakPolarHBondContact OD1-CB 3.34Å; D552-N596 PolarHBondContact OD1-N 2.83Å; D552-R603 PolarHBondContact O-NH2 3.41Å
553	V	87.5	Confident	82.4	Confident	24 Å²	24	51.5 Å²	51.5	15%	0.145	30%	0.296	C	S	.	.			trans	-62.8	125.1	166.7	178.1	0	0	0	0	108	T527 M530 N550 L551 T573	T527-V553 HydrophobicContact CG2-CB 4.46Å; T527-V553 HydrophobicContact CG2-CG1 3.9Å; M530-V553 HydrophobicContact CE-CB 4.41Å; M530-V553 HydrophobicContact CE-CG1 4.17Å; M530-V553 WeakPolarHBondContact CE-O 3.42Å; N550-V553 HydrophobicContact CB-CG2 3.71Å; N550-V553 WeakPolarHBondContact O-CG2 3.25Å; L551-V553 VanDerWaalsContact C-N 3.35Å; L551-V553 PolarHBondContact O-N 3.1Å; V553-T573 WeakPolarHBondContact O-CA 3.48Å
554	A	87.4	Confident	81.4	Confident	27 Å²	27	51.8 Å²	51.8	22%	0.223	30%	0.299	C	S	.	.			trans	-105.1	137.1	178.3	0	0	0	0	0	109.8	D552 W572 T573 A600	D552-A554 PolarHBondContact O-N 2.95Å; A554-W572 CarbonylContact C-O 3.5Å; A554-W572 WeakPolarHBondContact CA-O 3.25Å; A554-T573 HydrophobicContact CB-CG2 4.34Å; A554-A600 HydrophobicContact CB-CB 3.8Å
555	V	84.4	Confident	80.6	Confident	1 Å²	1	52 Å²	52	1%	0.006	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-56	125.9	175.2	174.4	0	0	0	0	109.3	M526 M530 V565 S569 H571 W572 F577	M526-V555 HydrophobicContact SD-CG2 3.78Å; M530-V555 HydrophobicContact CE-CG2 3.84Å; M530-V555 HydrophobicContact SD-CG2 3.73Å; V555-V565 HydrophobicContact CG1-CG1 3.86Å; V555-S569 WeakPolarHBondContact CB-O 3.21Å; V555-S569 WeakPolarHBondContact CG2-O 3.41Å; V555-H571 WeakPolarHBondContact O-CA 3.14Å; V555-H571 PolarHBondContact O-N 3.2Å; V555-W572 PolarHBondContact N-O 3.46Å; V555-F577 HydrophobicContact CG2-CE2 4.11Å; V555-F577 HydrophobicContact CG2-CZ 4.46Å
556	P	80.4	Confident	79.5	Confident	33 Å²	33	51 Å²	51	21%	0.214	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-69	160.1	-173.4	27.2	-35	0	0	0	112.9	M521 Y562	M521-P556 HydrophobicContact SD-CG 4.22Å; P556-Y562 HydrophobicContact CB-CD2 4.26Å; P556-Y562 HydrophobicContact CG-CD2 3.48Å; P556-Y562 VanDerWaalsContact CG-CD2 3.48Å; P556-Y562 HydrophobicContact CG-CE2 3.82Å; P556-Y562 HydrophobicContact CG-CG 4.14Å
557	L	72.5	Confident	78.5	Confident	108 Å²	108	46 Å²	46	57%	0.565	27%	0.27	S	S	*	.	P	Polyproline II helix	trans	-60.3	155.4	161.7	-73.1	117.7	0	0	0	110.6	S559	L557-S559 PolarHBondContact O-N 3.01Å
558	Y	67.1	Low	77.5	Confident	116 Å²	116	45.4 Å²	45.4	46%	0.455	26%	0.262	S	S	.	.	S	Bend	trans	-48	126.9	176.4	170	-90.8	0	0	0	111.6	P563	Y558-P563 WeakPolarHBondContact CE2-O 3.35Å
559	S	67.3	Low	76.9	Confident	35 Å²	35	43.2 Å²	43.2	25%	0.245	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-141.9	150.9	-172.9	169.9	0	0	0	0	109.4	L557 K561 Y562	L557-S559 PolarHBondContact O-N 3.01Å; S559-K561 PolarHBondContact O-N 2.68Å; S559-K561 VanDerWaalsContact O-N 3.13Å; S559-K561 PolarHBondContact OG-N 2.68Å; S559-Y562 CarbonylContact O-C 3.52Å; S559-Y562 PolarHBondContact O-N 2.95Å
560	P	66.3	Low	76.2	Confident	129 Å²	129	46 Å²	46	84%	0.838	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-17.3	169.8	26	-35.1	0	0	0	113.7
561	K	68.4	Low	75.6	Confident	125 Å²	125	44.1 Å²	44.1	54%	0.543	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-26.1	169.7	-168.8	-178	176.6	-160.9	0	112.5	D516 S559	D516-K561 IonicContact OD2-NZ 2.73Å; S559-K561 PolarHBondContact O-N 2.68Å; S559-K561 VanDerWaalsContact O-N 3.13Å; S559-K561 PolarHBondContact OG-N 2.68Å
562	Y	73.1	Confident	75.4	Confident	17 Å²	17	43.4 Å²	43.4	7%	0.067	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-134.9	76	-172.1	-54.9	-59.7	0	0	0	109.4	M521 D522 D523 P556 S559 S564 V565	M521-Y562 HydrophobicContact CB-CE1 3.66Å; D522-Y562 WeakPolarHBondContact O-CD1 3.48Å; D522-Y562 WeakPolarHBondContact O-CE1 3.42Å; D523-Y562 CarbonylContact O-C 3.59Å; P556-Y562 HydrophobicContact CB-CD2 4.26Å; P556-Y562 HydrophobicContact CG-CD2 3.48Å; P556-Y562 VanDerWaalsContact CG-CD2 3.48Å; P556-Y562 HydrophobicContact CG-CE2 3.82Å; P556-Y562 HydrophobicContact CG-CG 4.14Å; S559-Y562 CarbonylContact O-C 3.52Å; S559-Y562 PolarHBondContact O-N 2.95Å; Y562-S564 PolarHBondContact O-N 3.44Å; Y562-V565 VanDerWaalsContact O-CG2 3.27Å; Y562-V565 WeakPolarHBondContact O-CG2 3.23Å
563	P	68.3	Low	75.5	Confident	63 Å²	63	41.3 Å²	41.3	41%	0.409	22%	0.221	S	C	.	.	S	Bend	trans	-76.3	-21.4	-167.8	30.5	-36.1	0	0	0	113.7	Y558	Y558-P563 WeakPolarHBondContact CE2-O 3.35Å
564	S	72.1	Confident	75.7	Confident	19 Å²	19	40.2 Å²	40.2	13%	0.133	21%	0.214	C	C	.	.	S	Bend	trans	-97.6	-14.2	-168.9	-58.6	0	0	0	0	114.4	D523 Q524 Y562 H566	D523-S564 WeakPolarHBondContact O-CB 3.45Å; D523-S564 PolarHBondContact O-N 3.05Å; D523-S564 VanDerWaalsContact O-N 3.15Å; Q524-S564 PolarHBondContact NE2-O 3.03Å; Q524-S564 PolarHBondContact OE1-O 3.38Å; Y562-S564 PolarHBondContact O-N 3.44Å; S564-H566 PolarHBondContact O-N 3.23Å
565	V	74.8	Confident	75.9	Confident	6 Å²	6	39 Å²	39	4%	0.036	20%	0.204	C	C	.	.			trans	-35.7	115.7	-175.5	-177.4	0	0	0	0	112.8	Q524 V555 Y562 R570	Q524-V565 WeakPolarHBondContact O-CG2 3.45Å; V555-V565 HydrophobicContact CG1-CG1 3.86Å; Y562-V565 VanDerWaalsContact O-CG2 3.27Å; Y562-V565 WeakPolarHBondContact O-CG2 3.23Å; V565-R570 HydrophobicContact CG1-CG 3.92Å
566	H	71.6	Confident	76.1	Confident	10 Å²	10	39.1 Å²	39.1	5%	0.046	21%	0.205	C	C	.	.			trans	-58.6	141.1	176.4	-159.1	-107.8	0	0	0	111.3	H151 Q524 S564 D568 S569	H151-H566 AromaticContact CE1-CE1 3.77Å; H151-H566 AromaticContact CE1-CG 3.8Å; H151-H566 AromaticContact CE1-ND1 3.54Å; Q524-H566 VanDerWaalsContact OE1-N 3.16Å; S564-H566 PolarHBondContact O-N 3.23Å; H566-D568 VanDerWaalsContact C-N 3.25Å; H566-D568 IonicContact CE1-OD2 3.49Å; H566-D568 PolarHBondContact CE1-OD2 3.07Å; H566-D568 VanDerWaalsContact CE1-OD2 3.25Å; H566-D568 IonicContact ND1-OD2 2.91Å; H566-D568 PolarHBondContact O-N 2.82Å; H566-S569 PolarHBondContact O-OG 2.89Å
567	P	69.6	Low	76.5	Confident	20 Å²	20	37.6 Å²	37.6	13%	0.13	20%	0.195	C	C	.	.	S	Bend	trans	-59.4	-36.6	-177.8	-25.6	35.9	0	0	0	114.2	F157 R570 Y651	F157-P567 HydrophobicContact CE2-CB 4.05Å; F157-P567 HydrophobicContact CE2-CG 4.27Å; F157-P567 HydrophobicContact CZ-CB 4.35Å; F157-P567 HydrophobicContact CZ-CG 4.34Å; P567-R570 WeakPolarHBondContact O-CD 3.49Å; P567-R570 WeakPolarHBondContact O-CG 3.34Å; P567-Y651 PolarHBondContact O-OH 3.26Å; P567-Y651 VanDerWaalsContact O-OH 3.06Å
568	D	69.7	Low	77.5	Confident	15 Å²	15	32.4 Å²	32.4	8%	0.08	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-17.5	-168.9	-45.9	-24.9	0	0	0	112.7	F157 H566 R570 W572	F157-D568 WeakPolarHBondContact CE2-OD1 3.28Å; H566-D568 VanDerWaalsContact C-N 3.25Å; H566-D568 IonicContact CE1-OD2 3.49Å; H566-D568 PolarHBondContact CE1-OD2 3.07Å; H566-D568 VanDerWaalsContact CE1-OD2 3.25Å; H566-D568 IonicContact ND1-OD2 2.91Å; H566-D568 PolarHBondContact O-N 2.82Å; D568-R570 VanDerWaalsContact C-N 3.33Å; D568-W572 WeakPolarHBondContact O-CZ2 3.43Å
569	S	74.5	Confident	78.6	Confident	4 Å²	4	27.1 Å²	27.1	3%	0.028	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.4	177.5	64.8	0	0	0	0	113.6	V555 H566 W572	V555-S569 WeakPolarHBondContact CB-O 3.21Å; V555-S569 WeakPolarHBondContact CG2-O 3.41Å; H566-S569 PolarHBondContact O-OG 2.89Å; S569-W572 WeakPolarHBondContact O-CB 3.3Å; S569-W572 PolarHBondContact O-N 3.5Å
570	R	76.8	Confident	79.5	Confident	71 Å²	71	25.6 Å²	25.6	27%	0.268	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	145.6	-179.2	-64	175.9	-169.7	150.9	7.4	110.7	V565 P567 D568 W572	V565-R570 HydrophobicContact CG1-CG 3.92Å; P567-R570 WeakPolarHBondContact O-CD 3.49Å; P567-R570 WeakPolarHBondContact O-CG 3.34Å; D568-R570 VanDerWaalsContact C-N 3.33Å; R570-W572 PolarHBondContact O-N 2.9Å
571	H	78.8	Confident	80.5	Confident	39 Å²	39	21.5 Å²	21.5	18%	0.181	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	-4.3	-176.6	-52.3	-93.1	0	0	0	115.1	V555 A600 A610	V555-H571 WeakPolarHBondContact O-CA 3.14Å; V555-H571 PolarHBondContact O-N 3.2Å; H571-A600 WeakPolarHBondContact O-CB 3.13Å; H571-A610 HydrophobicContact CB-CB 3.82Å
572	W	85.2	Confident	81.5	Confident	5 Å²	5	16.9 Å²	16.9	2%	0.019	9%	0.094	C	C	.	.			trans	-67.8	141	175.9	-70.1	-1.3	0	0	0	111.7	A554 V555 D568 S569 R570 T576 F577 L580	A554-W572 CarbonylContact C-O 3.5Å; A554-W572 WeakPolarHBondContact CA-O 3.25Å; V555-W572 PolarHBondContact N-O 3.46Å; D568-W572 WeakPolarHBondContact O-CZ2 3.43Å; S569-W572 WeakPolarHBondContact O-CB 3.3Å; S569-W572 PolarHBondContact O-N 3.5Å; R570-W572 PolarHBondContact O-N 2.9Å; W572-T576 VanDerWaalsContact CA-OG1 3.32Å; W572-T576 WeakPolarHBondContact CA-OG1 3.4Å; W572-T576 VanDerWaalsContact CB-OG1 3.28Å; W572-T576 WeakPolarHBondContact CB-OG1 3.5Å; W572-F577 HydrophobicContact CB-CD2 4.31Å; W572-F577 HydrophobicContact CB-CE2 3.79Å; W572-F577 HydrophobicContact CB-CZ 4.22Å; W572-F577 HydrophobicContact CE3-CD1 4.17Å; W572-F577 AromaticContact CE3-CE1 3.63Å; W572-F577 HydrophobicContact CE3-CE1 3.63Å; W572-F577 HydrophobicContact CE3-CE2 4.32Å; W572-F577 AromaticContact CE3-CZ 3.71Å; W572-F577 HydrophobicContact CE3-CZ 3.71Å; W572-F577 HydrophobicContact CZ3-CE1 4.08Å; W572-L580 HydrophobicContact CE3-CD2 4.17Å; W572-L580 HydrophobicContact CH2-CD1 3.54Å; W572-L580 HydrophobicContact CH2-CD2 3.88Å; W572-L580 HydrophobicContact CH2-CG 4.38Å; W572-L580 HydrophobicContact CZ2-CD1 4.1Å; W572-L580 HydrophobicContact CZ3-CD1 3.9Å; W572-L580 HydrophobicContact CZ3-CD2 3.39Å; W572-L580 HydrophobicContact CZ3-CG 4.28Å
573	T	89.6	Confident	82.5	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.103	C	C	.	.			trans	-102.7	173.4	172.3	67.4	0	0	0	0	111.2	V553 A554 L575 T576 F577 A600	V553-T573 WeakPolarHBondContact O-CA 3.48Å; A554-T573 HydrophobicContact CB-CG2 4.34Å; T573-L575 PolarHBondContact O-N 2.98Å; T573-L575 PolarHBondContact OG1-N 3.45Å; T573-T576 PolarHBondContact N-OG1 3.5Å; T573-T576 PolarHBondContact O-N 2.93Å; T573-T576 VanDerWaalsContact O-N 3.16Å; T573-T576 PolarHBondContact O-OG1 3.32Å; T573-F577 VanDerWaalsContact O-CD2 3.3Å; T573-F577 WeakPolarHBondContact O-CD2 3.21Å; T573-F577 PolarHBondContact O-N 3.16Å; T573-A600 HydrophobicContact CG2-CB 3.72Å
574	A	91.3	Very high	83.7	Confident	2 Å²	2	17.9 Å²	17.9	2%	0.017	9%	0.094	C	C	.	.	H	α-helix	trans	-51.7	-40.4	173.3	0	0	0	0	0	112.8	L529 C533 F577 A578 L590	L529-A574 HydrophobicContact CD2-CB 3.84Å; L529-A574 HydrophobicContact CG-CB 3.91Å; C533-A574 WeakPolarHBondContact CB-O 3.46Å; A574-F577 PolarHBondContact O-N 3.06Å; A574-A578 PolarHBondContact O-N 2.93Å; A574-A578 VanDerWaalsContact O-N 3.08Å; A574-L590 HydrophobicContact CB-CD1 4.36Å; A574-L590 HydrophobicContact CB-CD2 4.34Å
575	L	91.7	Very high	84.8	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63	-46.5	177.8	-176	69	0	0	0	112.4	T573 F577 A578 V579 V587 L590 L591 N596 P613	T573-L575 PolarHBondContact O-N 2.98Å; T573-L575 PolarHBondContact OG1-N 3.45Å; L575-F577 VanDerWaalsContact C-N 3.29Å; L575-F577 PolarHBondContact O-N 3.12Å; L575-A578 PolarHBondContact O-N 3.03Å; L575-V579 WeakPolarHBondContact O-CG2 3.48Å; L575-V579 PolarHBondContact O-N 3.35Å; L575-V587 HydrophobicContact CD1-CG1 3.93Å; L575-L590 HydrophobicContact CB-CD1 4.38Å; L575-L590 HydrophobicContact CD1-CB 4.14Å; L575-L590 HydrophobicContact CD1-CD1 4.25Å; L575-L591 HydrophobicContact CD1-CD1 4.36Å; L575-L591 HydrophobicContact CD1-CD2 3.92Å; L575-L591 HydrophobicContact CD1-CG 3.87Å; L575-L591 HydrophobicContact CD2-CD2 3.79Å; L575-N596 WeakPolarHBondContact CD2-O 3.29Å; L575-P613 HydrophobicContact CD2-CG 3.97Å; L575-P613 HydrophobicContact CG-CG 4.3Å
576	T	89.2	Confident	85.7	Confident	4 Å²	4	19.6 Å²	19.6	3%	0.025	11%	0.105	C	C	.	.	H	α-helix	trans	-61.6	-36.4	177.7	38.6	0	0	0	0	111.9	W572 T573 V579 L580 P613 L616	W572-T576 VanDerWaalsContact CA-OG1 3.32Å; W572-T576 WeakPolarHBondContact CA-OG1 3.4Å; W572-T576 VanDerWaalsContact CB-OG1 3.28Å; W572-T576 WeakPolarHBondContact CB-OG1 3.5Å; T573-T576 PolarHBondContact N-OG1 3.5Å; T573-T576 PolarHBondContact O-N 2.93Å; T573-T576 VanDerWaalsContact O-N 3.16Å; T573-T576 PolarHBondContact O-OG1 3.32Å; T576-V579 PolarHBondContact O-N 3.03Å; T576-L580 WeakPolarHBondContact O-CB 3.31Å; T576-L580 PolarHBondContact O-N 3.42Å; T576-P613 HydrophobicContact CG2-CG 3.78Å; T576-L616 HydrophobicContact CG2-CD1 4.15Å
577	F	89.5	Confident	86.9	Confident	1 Å²	1	19.1 Å²	19.1	0%	0.004	10%	0.103	C	C	.	.	H	α-helix	trans	-66.7	-43.6	174.4	-78	-75.1	0	0	0	112.9	L468 M526 M530 C533 A534 V555 W572 T573 A574 L575 V579 L580 H581	L468-F577 HydrophobicContact CD2-CD1 4.33Å; L468-F577 HydrophobicContact CD2-CE1 4.06Å; M526-F577 HydrophobicContact CE-CD1 4.39Å; M526-F577 HydrophobicContact CE-CD2 4.36Å; M526-F577 HydrophobicContact CE-CE1 3.78Å; M526-F577 HydrophobicContact CE-CE2 3.76Å; M526-F577 HydrophobicContact CE-CZ 3.44Å; M526-F577 VanDerWaalsContact CE-CZ 3.44Å; M526-F577 HydrophobicContact SD-CE1 4.25Å; M526-F577 HydrophobicContact SD-CE2 3.68Å; M526-F577 HydrophobicContact SD-CZ 3.37Å; M526-F577 WeakPolarHBondContact SD-CZ 3.44Å; M530-F577 HydrophobicContact CB-CD2 3.95Å; M530-F577 HydrophobicContact CB-CE2 4.15Å; M530-F577 HydrophobicContact CG-CD2 4Å; M530-F577 HydrophobicContact CG-CE2 4.12Å; M530-F577 HydrophobicContact SD-CE2 4.21Å; C533-F577 HydrophobicContact CB-CB 4.46Å; A534-F577 HydrophobicContact CB-CB 4.44Å; A534-F577 HydrophobicContact CB-CD1 4.41Å; V555-F577 HydrophobicContact CG2-CE2 4.11Å; V555-F577 HydrophobicContact CG2-CZ 4.46Å; W572-F577 HydrophobicContact CB-CD2 4.31Å; W572-F577 HydrophobicContact CB-CE2 3.79Å; W572-F577 HydrophobicContact CB-CZ 4.22Å; W572-F577 HydrophobicContact CE3-CD1 4.17Å; W572-F577 AromaticContact CE3-CE1 3.63Å; W572-F577 HydrophobicContact CE3-CE1 3.63Å; W572-F577 HydrophobicContact CE3-CE2 4.32Å; W572-F577 AromaticContact CE3-CZ 3.71Å; W572-F577 HydrophobicContact CE3-CZ 3.71Å; W572-F577 HydrophobicContact CZ3-CE1 4.08Å; T573-F577 VanDerWaalsContact O-CD2 3.3Å; T573-F577 WeakPolarHBondContact O-CD2 3.21Å; T573-F577 PolarHBondContact O-N 3.16Å; A574-F577 PolarHBondContact O-N 3.06Å; L575-F577 VanDerWaalsContact C-N 3.29Å; L575-F577 PolarHBondContact O-N 3.12Å; F577-V579 VanDerWaalsContact C-N 3.3Å; F577-V579 PolarHBondContact O-N 2.73Å; F577-L580 HydrophobicContact CD1-CD2 4.2Å; F577-L580 WeakPolarHBondContact O-CB 3.48Å; F577-L580 PolarHBondContact O-N 3.16Å; F577-H581 PolarHBondContact O-CD2 2.95Å; F577-H581 PolarHBondContact O-N 2.93Å; F577-H581 VanDerWaalsContact O-N 3.14Å
578	A	92.1	Very high	88.1	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.8	-39.6	176.6	0	0	0	0	0	111.8	C533 A574 L575 G582 H583 V586 V587 L590	C533-A578 HydrophobicContact CB-CB 4.19Å; A574-A578 PolarHBondContact O-N 2.93Å; A574-A578 VanDerWaalsContact O-N 3.08Å; L575-A578 PolarHBondContact O-N 3.03Å; A578-G582 PolarHBondContact O-N 2.88Å; A578-H583 PolarHBondContact O-N 3.48Å; A578-V586 HydrophobicContact CB-CB 4.27Å; A578-V586 HydrophobicContact CB-CG1 3.7Å; A578-V587 HydrophobicContact CB-CG2 3.5Å; A578-V587 VanDerWaalsContact CB-CG2 3.5Å; A578-L590 HydrophobicContact CB-CD1 3.99Å
579	V	91	Very high	89.3	Confident	4 Å²	4	24 Å²	24	2%	0.024	13%	0.125	C	C	.	.	H	α-helix	trans	-71.6	-34	173.6	174.7	0	0	0	0	112.5	L575 T576 F577 H581 G582 V587 P613 L616 A617 M625 L629	L575-V579 WeakPolarHBondContact O-CG2 3.48Å; L575-V579 PolarHBondContact O-N 3.35Å; T576-V579 PolarHBondContact O-N 3.03Å; F577-V579 VanDerWaalsContact C-N 3.3Å; F577-V579 PolarHBondContact O-N 2.73Å; V579-H581 PolarHBondContact O-N 3.35Å; V579-G582 PolarHBondContact O-N 3.16Å; V579-V587 HydrophobicContact CB-CG2 4.45Å; V579-V587 HydrophobicContact CG2-CB 4.45Å; V579-V587 HydrophobicContact CG2-CG1 4.01Å; V579-V587 HydrophobicContact CG2-CG2 3.52Å; V579-P613 HydrophobicContact CG1-CB 4.44Å; V579-P613 WeakPolarHBondContact CG1-O 3.29Å; V579-P613 HydrophobicContact CG2-CB 4.19Å; V579-L616 HydrophobicContact CG1-CB 4.24Å; V579-A617 HydrophobicContact CG1-CB 3.99Å; V579-M625 HydrophobicContact CG1-CG 4.13Å; V579-M625 HydrophobicContact CG2-CG 4.36Å; V579-M625 HydrophobicContact CG2-SD 3.99Å; V579-L629 HydrophobicContact CG1-CD1 4.46Å; V579-L629 HydrophobicContact CG2-CD1 4.41Å
580	L	87.1	Confident	90.2	Very high	4 Å²	4	23.8 Å²	23.8	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-58.4	-48.3	177.3	-167.9	79.9	0	0	0	110.8	H151 R223 W572 T576 F577 L616	H151-L580 HydrophobicContact CB-CD2 4.43Å; H151-L580 WeakPolarHBondContact O-CD1 3.47Å; H151-L580 VanDerWaalsContact O-CD2 3.3Å; H151-L580 WeakPolarHBondContact O-CD2 2.99Å; H151-L580 VanDerWaalsContact O-CG 3.32Å; H151-L580 WeakPolarHBondContact O-CG 3.31Å; R223-L580 PolarHBondContact NH1-O 3.03Å; R223-L580 VanDerWaalsContact NH2-CD1 3.35Å; R223-L580 PolarHBondContact NH2-O 3.14Å; W572-L580 HydrophobicContact CE3-CD2 4.17Å; W572-L580 HydrophobicContact CH2-CD1 3.54Å; W572-L580 HydrophobicContact CH2-CD2 3.88Å; W572-L580 HydrophobicContact CH2-CG 4.38Å; W572-L580 HydrophobicContact CZ2-CD1 4.1Å; W572-L580 HydrophobicContact CZ3-CD1 3.9Å; W572-L580 HydrophobicContact CZ3-CD2 3.39Å; W572-L580 HydrophobicContact CZ3-CG 4.28Å; T576-L580 WeakPolarHBondContact O-CB 3.31Å; T576-L580 PolarHBondContact O-N 3.42Å; F577-L580 HydrophobicContact CD1-CD2 4.2Å; F577-L580 WeakPolarHBondContact O-CB 3.48Å; F577-L580 PolarHBondContact O-N 3.16Å; L580-L616 HydrophobicContact CD1-CD1 4.4Å; L580-L616 HydrophobicContact CD1-CD2 4.29Å
581	H	86.9	Confident	91	Very high	43 Å²	43	21 Å²	21	20%	0.199	11%	0.114	C	C	.	.	H	α-helix	trans	-88	-8.4	-179.6	-64.5	-77.7	0	0	0	113.8	C152 F577 V579 H583	C152-H581 PolarHBondContact SG-ND1 3.5Å; F577-H581 PolarHBondContact O-CD2 2.95Å; F577-H581 PolarHBondContact O-N 2.93Å; F577-H581 VanDerWaalsContact O-N 3.14Å; V579-H581 PolarHBondContact O-N 3.35Å; H581-H583 WeakPolarHBondContact CB-NE2 3.23Å
582	G	89.3	Confident	91.7	Very high	27 Å²	27	23.6 Å²	23.6	28%	0.278	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	16.2	172.8	0	0	0	0	0	115.5	A578 V579 I584	A578-G582 PolarHBondContact O-N 2.88Å; V579-G582 PolarHBondContact O-N 3.16Å; G582-I584 PolarHBondContact O-N 3.08Å
583	H	93.2	Very high	92	Very high	55 Å²	55	25.8 Å²	25.8	26%	0.255	15%	0.148	S	C	.	.			trans	-76.6	77.8	-173.9	-61.7	-55.4	0	0	0	112.5	C533 A534 G536 A578 H581 P585 V586 V587	C533-H583 PolarHBondContact O-CD2 3.32Å; C533-H583 VanDerWaalsContact O-CD2 3.31Å; A534-H583 PolarHBondContact O-NE2 3.07Å; G536-H583 VanDerWaalsContact CA-CD2 3.49Å; G536-H583 WeakPolarHBondContact CA-CD2 3.41Å; G536-H583 PolarHBondContact N-NE2 3.43Å; A578-H583 PolarHBondContact O-N 3.48Å; H581-H583 WeakPolarHBondContact CB-NE2 3.23Å; H583-P585 VanDerWaalsContact C-CD 3.48Å; H583-V586 HydrophobicContact CB-CB 4.07Å; H583-V586 HydrophobicContact CB-CG2 4.24Å; H583-V586 PolarHBondContact O-N 2.73Å; H583-V586 VanDerWaalsContact O-N 3.14Å; H583-V587 WeakPolarHBondContact O-CG2 3.22Å; H583-V587 PolarHBondContact O-N 3.37Å
584	I	93.4	Very high	91.9	Very high	46 Å²	46	28.5 Å²	28.5	24%	0.236	18%	0.176	C	C	.	.	H	α-helix	trans	-50.2	-44.2	-176.1	-61.6	170.3	0	0	0	113.6	G582 V587 Q588 E624 M625 L628	G582-I584 PolarHBondContact O-N 3.08Å; I584-V587 PolarHBondContact O-N 2.81Å; I584-Q588 PolarHBondContact O-N 3.36Å; I584-E624 HydrophobicContact CD1-CB 3.82Å; I584-M625 HydrophobicContact CB-CE 4.38Å; I584-M625 HydrophobicContact CG1-CE 3.62Å; I584-M625 HydrophobicContact CG1-SD 4.26Å; I584-L628 HydrophobicContact CG2-CD2 4.24Å
585	P	95.1	Very high	91.9	Very high	60 Å²	60	28.8 Å²	28.8	39%	0.39	18%	0.178	S	C	.	.	H	α-helix	trans	-63.4	-43.3	179	-23.6	35.5	0	0	0	113.1	E538 H583 V587 Q588 L589	E538-P585 VanDerWaalsContact CD-CB 3.49Å; E538-P585 HydrophobicContact CG-CB 4.06Å; E538-P585 WeakPolarHBondContact OE1-CB 3.43Å; E538-P585 WeakPolarHBondContact OE1-CG 3.32Å; H583-P585 VanDerWaalsContact C-CD 3.48Å; P585-V587 PolarHBondContact O-N 3.17Å; P585-Q588 PolarHBondContact O-N 3.39Å; P585-L589 WeakPolarHBondContact O-CG 3.35Å; P585-L589 PolarHBondContact O-N 2.72Å
586	V	95	Very high	91.7	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-64.2	-41	176.2	174.6	0	0	0	0	111.1	C533 E538 V541 A578 H583 Q588 L589 L590	C533-V586 HydrophobicContact CB-CG1 4.25Å; E538-V586 HydrophobicContact CG-CG2 3.86Å; V541-V586 HydrophobicContact CG1-CG1 4.33Å; V541-V586 HydrophobicContact CG2-CG1 3.98Å; V541-V586 HydrophobicContact CG2-CG2 4.5Å; A578-V586 HydrophobicContact CB-CB 4.27Å; A578-V586 HydrophobicContact CB-CG1 3.7Å; H583-V586 HydrophobicContact CB-CB 4.07Å; H583-V586 HydrophobicContact CB-CG2 4.24Å; H583-V586 PolarHBondContact O-N 2.73Å; H583-V586 VanDerWaalsContact O-N 3.14Å; V586-Q588 VanDerWaalsContact C-N 3.31Å; V586-Q588 PolarHBondContact O-N 3.24Å; V586-L589 PolarHBondContact O-N 3.34Å; V586-L590 HydrophobicContact CG1-CD1 4.08Å; V586-L590 HydrophobicContact CG1-CG 4.42Å; V586-L590 WeakPolarHBondContact O-CG 3.32Å; V586-L590 PolarHBondContact O-N 3.18Å
587	V	95.3	Very high	91.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.2	-41.8	174	173.2	0	0	0	0	110.9	L575 A578 V579 H583 I584 P585 L591 M625 L628	L575-V587 HydrophobicContact CD1-CG1 3.93Å; A578-V587 HydrophobicContact CB-CG2 3.5Å; A578-V587 VanDerWaalsContact CB-CG2 3.5Å; V579-V587 HydrophobicContact CB-CG2 4.45Å; V579-V587 HydrophobicContact CG2-CB 4.45Å; V579-V587 HydrophobicContact CG2-CG1 4.01Å; V579-V587 HydrophobicContact CG2-CG2 3.52Å; H583-V587 WeakPolarHBondContact O-CG2 3.22Å; H583-V587 PolarHBondContact O-N 3.37Å; I584-V587 PolarHBondContact O-N 2.81Å; P585-V587 PolarHBondContact O-N 3.17Å; V587-L591 HydrophobicContact CG1-CD1 3.7Å; V587-L591 HydrophobicContact CG1-CG 4.38Å; V587-L591 WeakPolarHBondContact O-CB 3.45Å; V587-L591 WeakPolarHBondContact O-CG 3.33Å; V587-L591 PolarHBondContact O-N 2.86Å; V587-M625 HydrophobicContact CB-CE 4.37Å; V587-M625 HydrophobicContact CB-SD 3.9Å; V587-M625 HydrophobicContact CG1-SD 3.71Å; V587-M625 HydrophobicContact CG2-CE 3.79Å; V587-M625 HydrophobicContact CG2-SD 3.75Å; V587-L628 HydrophobicContact CB-CD2 4.46Å; V587-L628 HydrophobicContact CG1-CD2 3.91Å
588	Q	95.1	Very high	91.1	Very high	89 Å²	89	33.6 Å²	33.6	42%	0.416	20%	0.204	S	C	.	.	H	α-helix	trans	-62.3	-48.1	174.1	-178.1	177.9	-24.1	0	0	111.5	I584 P585 V586 L590 L591 D592 L628	I584-Q588 PolarHBondContact O-N 3.36Å; P585-Q588 PolarHBondContact O-N 3.39Å; V586-Q588 VanDerWaalsContact C-N 3.31Å; V586-Q588 PolarHBondContact O-N 3.24Å; Q588-L590 VanDerWaalsContact C-N 3.34Å; Q588-L590 PolarHBondContact O-N 2.89Å; Q588-L591 PolarHBondContact O-N 3.4Å; Q588-D592 VanDerWaalsContact CG-OD2 3.28Å; Q588-D592 WeakPolarHBondContact CG-OD2 3.38Å; Q588-D592 PolarHBondContact NE2-OD2 3.11Å; Q588-D592 VanDerWaalsContact O-CB 3.31Å; Q588-D592 WeakPolarHBondContact O-CB 3.47Å; Q588-D592 VanDerWaalsContact O-CG 3.24Å; Q588-D592 PolarHBondContact O-N 3.17Å; Q588-L628 HydrophobicContact CB-CD2 4.35Å
589	L	94.7	Very high	90.4	Very high	48 Å²	48	33.7 Å²	33.7	25%	0.251	21%	0.205	S	C	.	.	H	α-helix	trans	-57.2	-44.8	178.8	-71.7	171.2	0	0	0	112.2	E538 P585 V586 D592 A593	E538-L589 HydrophobicContact CB-CD1 4.12Å; E538-L589 HydrophobicContact CG-CD1 4.32Å; P585-L589 WeakPolarHBondContact O-CG 3.35Å; P585-L589 PolarHBondContact O-N 2.72Å; V586-L589 PolarHBondContact O-N 3.34Å; L589-D592 PolarHBondContact O-N 3.03Å; L589-A593 VanDerWaalsContact O-CB 3.24Å; L589-A593 WeakPolarHBondContact O-CB 3.29Å; L589-A593 PolarHBondContact O-N 3.42Å
590	L	93.9	Very high	89.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-41.1	177.6	-69	170.5	0	0	0	112.4	V541 I545 L551 A574 L575 A578 V586 Q588 A593 G594 A595	V541-L590 HydrophobicContact CG1-CD2 4.44Å; I545-L590 HydrophobicContact CD1-CD2 4.27Å; L551-L590 HydrophobicContact CD2-CD2 4.04Å; A574-L590 HydrophobicContact CB-CD1 4.36Å; A574-L590 HydrophobicContact CB-CD2 4.34Å; L575-L590 HydrophobicContact CB-CD1 4.38Å; L575-L590 HydrophobicContact CD1-CB 4.14Å; L575-L590 HydrophobicContact CD1-CD1 4.25Å; A578-L590 HydrophobicContact CB-CD1 3.99Å; V586-L590 HydrophobicContact CG1-CD1 4.08Å; V586-L590 HydrophobicContact CG1-CG 4.42Å; V586-L590 WeakPolarHBondContact O-CG 3.32Å; V586-L590 PolarHBondContact O-N 3.18Å; Q588-L590 VanDerWaalsContact C-N 3.34Å; Q588-L590 PolarHBondContact O-N 2.89Å; L590-A593 CarbonylContact O-C 3.55Å; L590-A593 PolarHBondContact O-N 3.22Å; L590-G594 PolarHBondContact O-N 3.29Å; L590-A595 HydrophobicContact CB-CB 4.19Å; L590-A595 VanDerWaalsContact O-CB 3.24Å; L590-A595 WeakPolarHBondContact O-CB 3.47Å; L590-A595 PolarHBondContact O-N 3.31Å
591	L	93.4	Very high	88	Confident	14 Å²	14	34 Å²	34	7%	0.073	21%	0.209	C	C	.	.	H	α-helix	trans	-76	-29.2	179.2	-66.5	173.8	0	0	0	112.8	L575 V587 Q588 G594 V597 L628 L629 R632	L575-L591 HydrophobicContact CD1-CD1 4.36Å; L575-L591 HydrophobicContact CD1-CD2 3.92Å; L575-L591 HydrophobicContact CD1-CG 3.87Å; L575-L591 HydrophobicContact CD2-CD2 3.79Å; V587-L591 HydrophobicContact CG1-CD1 3.7Å; V587-L591 HydrophobicContact CG1-CG 4.38Å; V587-L591 WeakPolarHBondContact O-CB 3.45Å; V587-L591 WeakPolarHBondContact O-CG 3.33Å; V587-L591 PolarHBondContact O-N 2.86Å; Q588-L591 PolarHBondContact O-N 3.4Å; L591-G594 PolarHBondContact O-N 2.89Å; L591-V597 HydrophobicContact CD2-CG2 4.03Å; L591-L628 HydrophobicContact CD1-CG 4.43Å; L591-L629 HydrophobicContact CD1-CD2 4.06Å; L591-R632 HydrophobicContact CB-CG 4.44Å; L591-R632 HydrophobicContact CD1-CG 4.05Å
592	D	93.5	Very high	86.3	Confident	92 Å²	92	36.3 Å²	36.3	49%	0.492	22%	0.222	S	C	.	.	H	α-helix	trans	-73.7	-30.7	171.7	-70.9	-6.8	0	0	0	111	Q588 L589 G594 R632	Q588-D592 VanDerWaalsContact CG-OD2 3.28Å; Q588-D592 WeakPolarHBondContact CG-OD2 3.38Å; Q588-D592 PolarHBondContact NE2-OD2 3.11Å; Q588-D592 VanDerWaalsContact O-CB 3.31Å; Q588-D592 WeakPolarHBondContact O-CB 3.47Å; Q588-D592 VanDerWaalsContact O-CG 3.24Å; Q588-D592 PolarHBondContact O-N 3.17Å; L589-D592 PolarHBondContact O-N 3.03Å; D592-G594 VanDerWaalsContact C-N 3.29Å; D592-R632 IonicContact OD1-CZ 2.9Å; D592-R632 IonicContact OD1-NH1 2.91Å; D592-R632 PolarHBondContact OD1-NH1 3.28Å; D592-R632 IonicContact OD1-NH2 3.22Å; D592-R632 PolarHBondContact OD1-NH2 2.88Å
593	A	91.6	Very high	84.2	Confident	52 Å²	52	40.2 Å²	40.2	43%	0.43	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-3.7	170.8	0	0	0	0	0	114.3	I545 L551 L589 L590	I545-A593 HydrophobicContact CD1-CB 4.36Å; I545-A593 HydrophobicContact CG2-CB 4.39Å; L551-A593 HydrophobicContact CD1-CB 3.83Å; L589-A593 VanDerWaalsContact O-CB 3.24Å; L589-A593 WeakPolarHBondContact O-CB 3.29Å; L589-A593 PolarHBondContact O-N 3.42Å; L590-A593 CarbonylContact O-C 3.55Å; L590-A593 PolarHBondContact O-N 3.22Å
594	G	88.6	Confident	81.6	Confident	57 Å²	57	45.1 Å²	45.1	59%	0.588	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	20.9	171.9	0	0	0	0	0	116.8	L590 L591 D592	L590-G594 PolarHBondContact O-N 3.29Å; L591-G594 PolarHBondContact O-N 2.89Å; D592-G594 VanDerWaalsContact C-N 3.29Å
595	A	89.6	Confident	79	Confident	7 Å²	7	46.5 Å²	46.5	6%	0.058	28%	0.282	C	S	.	.			trans	-59.3	147	171.4	0	0	0	0	0	112	L551 L590 V597	L551-A595 HydrophobicContact CB-CB 3.85Å; L551-A595 HydrophobicContact CD1-CB 3.83Å; L551-A595 HydrophobicContact CG-CB 4.48Å; L590-A595 HydrophobicContact CB-CB 4.19Å; L590-A595 VanDerWaalsContact O-CB 3.24Å; L590-A595 WeakPolarHBondContact O-CB 3.47Å; L590-A595 PolarHBondContact O-N 3.31Å; A595-V597 PolarHBondContact O-N 3.33Å
596	N	87.5	Confident	76.4	Confident	63 Å²	63	50.9 Å²	50.9	34%	0.337	30%	0.297	S	S	.	.			trans	-64.9	124.2	178.6	-177.7	27.4	0	0	0	111.7	D552 L575 E598 G599	D552-N596 WeakPolarHBondContact OD1-CB 3.34Å; D552-N596 PolarHBondContact OD1-N 2.83Å; L575-N596 WeakPolarHBondContact CD2-O 3.29Å; N596-E598 PolarHBondContact O-N 3.32Å; N596-G599 PolarHBondContact ND2-O 3.4Å; N596-G599 PolarHBondContact O-N 3.21Å
597	V	86.2	Confident	74	Confident	25 Å²	25	55.6 Å²	55.6	15%	0.152	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-32.2	-176.9	-174.3	0	0	0	0	112.4	L591 A595 G599 P613 L629 R632 A634	L591-V597 HydrophobicContact CD2-CG2 4.03Å; A595-V597 PolarHBondContact O-N 3.33Å; V597-G599 VanDerWaalsContact C-N 3.32Å; V597-P613 WeakPolarHBondContact O-CG 3.35Å; V597-L629 HydrophobicContact CG1-CD2 4.33Å; V597-R632 HydrophobicContact CG1-CB 4.43Å; V597-R632 HydrophobicContact CG2-CB 3.97Å; V597-A634 HydrophobicContact CG1-CB 3.65Å
598	E	80.8	Confident	72	Confident	19 Å²	19	57 Å²	57	9%	0.089	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	9.2	176.4	-57.3	-57.6	164	0	0	113.7	N596 A600 A601 I602 T612 A634 D635	N596-E598 PolarHBondContact O-N 3.32Å; E598-A600 PolarHBondContact O-N 2.84Å; E598-A601 PolarHBondContact O-N 3.37Å; E598-I602 HydrophobicContact CB-CD1 4.42Å; E598-I602 HydrophobicContact CG-CD1 4.28Å; E598-T612 WeakPolarHBondContact OE2-CB 3.42Å; E598-A634 VanDerWaalsContact OE1-CA 3.23Å; E598-A634 WeakPolarHBondContact OE1-CA 3.16Å; E598-D635 PolarHBondContact OE1-N 3.16Å
599	G	77.9	Confident	70	Confident	2 Å²	2	54.7 Å²	54.7	2%	0.021	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.5	-120.2	-177.5	0	0	0	0	0	111.9	N596 V597	N596-G599 PolarHBondContact ND2-O 3.4Å; N596-G599 PolarHBondContact O-N 3.21Å; V597-G599 VanDerWaalsContact C-N 3.32Å
600	A	68.8	Low	68.5	Low	5 Å²	5	52.9 Å²	52.9	4%	0.041	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	6.8	175.9	0	0	0	0	0	114.4	A554 H571 T573 E598 I602 T608	A554-A600 HydrophobicContact CB-CB 3.8Å; H571-A600 WeakPolarHBondContact O-CB 3.13Å; T573-A600 HydrophobicContact CG2-CB 3.72Å; E598-A600 PolarHBondContact O-N 2.84Å; A600-I602 PolarHBondContact O-N 3.37Å; A600-T608 PolarHBondContact O-OG1 2.93Å
601	A	57.3	Low	67.6	Low	10 Å²	10	53.8 Å²	53.8	8%	0.083	32%	0.316	C	S	.	.	S	Bend	trans	-53.5	-40.7	179.3	0	0	0	0	0	111.5	E598 T608 T612	E598-A601 PolarHBondContact O-N 3.37Å; A601-T608 WeakPolarHBondContact CA-OG1 3.35Å; A601-T608 PolarHBondContact O-N 3.11Å; A601-T608 PolarHBondContact O-OG1 3Å; A601-T612 HydrophobicContact CB-CG2 3.81Å
602	I	51.3	Low	67.2	Low	91 Å²	91	53.4 Å²	53.4	47%	0.467	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	104.7	172.4	-51.3	174.2	0	0	0	109.2	E598 A600	E598-I602 HydrophobicContact CB-CD1 4.42Å; E598-I602 HydrophobicContact CG-CD1 4.28Å; A600-I602 PolarHBondContact O-N 3.37Å
603	R	46.1	Very low	66.9	Low	109 Å²	109	49 Å²	49	41%	0.411	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	124.5	166.4	-92.1	-173.7	165.8	-81.9	3.4	111.1	D552 G605 Q606	D552-R603 PolarHBondContact O-NH2 3.41Å; R603-G605 PolarHBondContact O-N 3.09Å; R603-G605 VanDerWaalsContact O-N 3.11Å; R603-Q606 PolarHBondContact O-N 3.36Å; R603-Q606 VanDerWaalsContact O-O 3.09Å
604	N	38.5	Very low	66.8	Low	157 Å²	157	46.6 Å²	46.6	84%	0.84	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	27.7	171.4	-56.8	-5.2	0	0	0	116	Q606	N604-Q606 VanDerWaalsContact C-N 3.26Å; N604-Q606 PolarHBondContact O-N 2.8Å
605	G	39.8	Very low	66.8	Low	75 Å²	75	44.4 Å²	44.4	77%	0.773	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.8	14.1	-177.9	0	0	0	0	0	114.4	R603	R603-G605 PolarHBondContact O-N 3.09Å; R603-G605 VanDerWaalsContact O-N 3.11Å
606	Q	40.2	Very low	66.6	Low	152 Å²	152	44.2 Å²	44.2	71%	0.71	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	112.9	161.6	-59.7	-165	-71.6	0	0	107.6	R603 N604	R603-Q606 PolarHBondContact O-N 3.36Å; R603-Q606 VanDerWaalsContact O-O 3.09Å; N604-Q606 VanDerWaalsContact C-N 3.26Å; N604-Q606 PolarHBondContact O-N 2.8Å
607	E	44.9	Very low	66.8	Low	101 Å²	101	41.3 Å²	41.3	47%	0.472	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	140.7	171.1	-67.2	177.9	-151.8	0	0	108.9	H641	E607-H641 WeakPolarHBondContact OE2-CB 3.45Å; E607-H641 PolarHBondContact OE2-N 3.12Å
608	T	51.3	Low	67	Low	28 Å²	28	40.1 Å²	40.1	17%	0.172	22%	0.221	C	C	.	.			trans	-121.6	150.6	-177.4	59.2	0	0	0	0	110.9	A600 A601 A610	A600-T608 PolarHBondContact O-OG1 2.93Å; A601-T608 WeakPolarHBondContact CA-OG1 3.35Å; A601-T608 PolarHBondContact O-N 3.11Å; A601-T608 PolarHBondContact O-OG1 3Å; T608-A610 PolarHBondContact O-N 3.39Å
609	T	54.2	Low	67.3	Low	42 Å²	42	39.4 Å²	39.4	26%	0.258	22%	0.218	S	C	.	.	S	Bend	trans	-74.9	48.6	-170.4	69.8	0	0	0	0	113	D642	T609-D642 VanDerWaalsContact CG2-OD2 3.25Å; T609-D642 WeakPolarHBondContact CG2-OD2 3.38Å
610	A	63.8	Low	67.8	Low	9 Å²	9	40.4 Å²	40.4	7%	0.074	23%	0.226	C	C	.	.			trans	-127.4	122.1	-169.1	0	0	0	0	0	110.7	H571 T608 T612	H571-A610 HydrophobicContact CB-CB 3.82Å; T608-A610 PolarHBondContact O-N 3.39Å; A610-T612 PolarHBondContact O-N 2.98Å
611	D	73.9	Confident	68.7	Low	20 Å²	20	41.2 Å²	41.2	11%	0.107	24%	0.235	C	C	.	.			trans	-56.4	126	178.4	-50.4	-47.6	0	0	0	110.8	R153 Q615 L616	R153-D611 IonicContact CZ-OD2 3.75Å; R153-D611 IonicContact NH1-OD2 3.4Å; R153-D611 PolarHBondContact NH1-OD2 3.37Å; R153-D611 IonicContact NH2-OD1 3.17Å; R153-D611 IonicContact NH2-OD2 3.81Å; R153-D611 PolarHBondContact NH2-OD2 2.85Å; D611-Q615 HydrophobicContact CB-CB 4.4Å; D611-L616 HydrophobicContact CB-CD1 4.44Å; D611-L616 HydrophobicContact CB-CD2 3.76Å; D611-L616 HydrophobicContact CB-CG 3.79Å
612	T	84.5	Confident	70.3	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.031	24%	0.242	C	C	.	.			trans	-64	155	174.9	72.4	0	0	0	0	110.8	E598 A601 A610 L614 Q615 L616	E598-T612 WeakPolarHBondContact OE2-CB 3.42Å; A601-T612 HydrophobicContact CB-CG2 3.81Å; A610-T612 PolarHBondContact O-N 2.98Å; T612-L614 PolarHBondContact O-N 3.23Å; T612-L614 VanDerWaalsContact O-N 3.12Å; T612-L614 PolarHBondContact OG1-N 2.86Å; T612-Q615 PolarHBondContact O-N 3.06Å; T612-Q615 PolarHBondContact OG1-N 2.95Å; T612-Q615 VanDerWaalsContact OG1-N 3.16Å; T612-Q615 PolarHBondContact OG1-OE1 2.78Å; T612-L616 PolarHBondContact O-N 3.14Å
613	P	88.4	Confident	72.2	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-49.7	-36.6	170.5	-30.4	38.7	0	0	0	113.1	L575 T576 V579 V597 L616 A617 L629	L575-P613 HydrophobicContact CD2-CG 3.97Å; L575-P613 HydrophobicContact CG-CG 4.3Å; T576-P613 HydrophobicContact CG2-CG 3.78Å; V579-P613 HydrophobicContact CG1-CB 4.44Å; V579-P613 WeakPolarHBondContact CG1-O 3.29Å; V579-P613 HydrophobicContact CG2-CB 4.19Å; V597-P613 WeakPolarHBondContact O-CG 3.35Å; P613-L616 PolarHBondContact O-N 2.94Å; P613-A617 VanDerWaalsContact O-CB 3.31Å; P613-A617 WeakPolarHBondContact O-CB 3.28Å; P613-A617 PolarHBondContact O-N 3.34Å; P613-L629 HydrophobicContact CB-CD1 3.99Å; P613-L629 HydrophobicContact CB-CD2 4Å; P613-L629 WeakPolarHBondContact O-CD1 3.39Å
614	L	89.3	Confident	74.5	Confident	1 Å²	1	45 Å²	45	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-70.4	-40.2	178.3	-173.9	64.2	0	0	0	112.7	T612 S618 V626 L629 L630 A634 P636 C656 L672	T612-L614 PolarHBondContact O-N 3.23Å; T612-L614 VanDerWaalsContact O-N 3.12Å; T612-L614 PolarHBondContact OG1-N 2.86Å; L614-S618 WeakPolarHBondContact O-CB 3.34Å; L614-S618 PolarHBondContact O-N 3.24Å; L614-S618 PolarHBondContact O-OG 2.91Å; L614-V626 HydrophobicContact CD1-CG1 4.11Å; L614-V626 HydrophobicContact CD1-CG2 4.49Å; L614-L629 HydrophobicContact CD1-CB 4.35Å; L614-L630 HydrophobicContact CD1-CD2 3.86Å; L614-L630 HydrophobicContact CD1-CG 3.96Å; L614-L630 HydrophobicContact CD2-CD2 3.7Å; L614-L630 HydrophobicContact CG-CD2 4.47Å; L614-A634 HydrophobicContact CB-CB 4.23Å; L614-A634 HydrophobicContact CD2-CB 3.99Å; L614-A634 HydrophobicContact CG-CB 4.48Å; L614-P636 HydrophobicContact CD2-CG 4.38Å; L614-C656 HydrophobicContact CG-CB 4.45Å; L614-L672 HydrophobicContact CD1-CD2 4.12Å; L614-L672 HydrophobicContact CD2-CD2 4.33Å; L614-L672 HydrophobicContact CG-CD2 4.39Å
615	Q	87.6	Confident	77.1	Confident	12 Å²	12	37.6 Å²	37.6	6%	0.056	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-47.7	172.1	-74.5	164.7	-48.7	0	0	110.9	D611 T612 A617 S618 A619 M654 C656	D611-Q615 HydrophobicContact CB-CB 4.4Å; T612-Q615 PolarHBondContact O-N 3.06Å; T612-Q615 PolarHBondContact OG1-N 2.95Å; T612-Q615 VanDerWaalsContact OG1-N 3.16Å; T612-Q615 PolarHBondContact OG1-OE1 2.78Å; Q615-A617 PolarHBondContact O-N 3.37Å; Q615-S618 PolarHBondContact O-N 3.46Å; Q615-A619 PolarHBondContact O-N 3.11Å; Q615-M654 PolarHBondContact NE2-O 2.9Å; Q615-C656 HydrophobicContact CG-CB 4.45Å
616	L	86.8	Confident	79.6	Confident	3 Å²	3	34 Å²	34	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-38.6	179	-69.8	176.1	0	0	0	113.3	R223 T576 V579 L580 D611 T612 P613 A620	R223-L616 WeakPolarHBondContact CD-O 3.47Å; R223-L616 PolarHBondContact NH1-O 2.88Å; R223-L616 VanDerWaalsContact NH1-O 3.08Å; T576-L616 HydrophobicContact CG2-CD1 4.15Å; V579-L616 HydrophobicContact CG1-CB 4.24Å; L580-L616 HydrophobicContact CD1-CD1 4.4Å; L580-L616 HydrophobicContact CD1-CD2 4.29Å; D611-L616 HydrophobicContact CB-CD1 4.44Å; D611-L616 HydrophobicContact CB-CD2 3.76Å; D611-L616 HydrophobicContact CB-CG 3.79Å; T612-L616 PolarHBondContact O-N 3.14Å; P613-L616 PolarHBondContact O-N 2.94Å; L616-A620 WeakPolarHBondContact O-CB 3.29Å; L616-A620 PolarHBondContact O-N 2.91Å
617	A	90.8	Very high	82.2	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-72.1	-35.7	174.5	0	0	0	0	0	112.1	V579 P613 Q615 A620 G621 N622 M625 V626 L629	V579-A617 HydrophobicContact CG1-CB 3.99Å; P613-A617 VanDerWaalsContact O-CB 3.31Å; P613-A617 WeakPolarHBondContact O-CB 3.28Å; P613-A617 PolarHBondContact O-N 3.34Å; Q615-A617 PolarHBondContact O-N 3.37Å; A617-A620 PolarHBondContact O-N 3.02Å; A617-G621 PolarHBondContact O-N 3.34Å; A617-G621 VanDerWaalsContact O-N 3.13Å; A617-N622 PolarHBondContact O-N 3.31Å; A617-M625 HydrophobicContact CB-CB 4.17Å; A617-M625 HydrophobicContact CB-CG 3.81Å; A617-V626 HydrophobicContact CB-CG2 3.71Å; A617-L629 HydrophobicContact CB-CD1 3.92Å
618	S	90.7	Very high	84.5	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-70.8	-40.4	-179.2	-61.1	0	0	0	0	112.6	L614 Q615 A620 G621 H665	L614-S618 WeakPolarHBondContact O-CB 3.34Å; L614-S618 PolarHBondContact O-N 3.24Å; L614-S618 PolarHBondContact O-OG 2.91Å; Q615-S618 PolarHBondContact O-N 3.46Å; S618-A620 VanDerWaalsContact C-N 3.34Å; S618-G621 PolarHBondContact O-N 3.46Å; S618-H665 PolarHBondContact O-CD2 2.99Å
619	A	87.8	Confident	86.4	Confident	4 Å²	4	23.9 Å²	23.9	3%	0.033	13%	0.129	C	C	.	.	H	α-helix	trans	-66.4	-36.1	173.1	0	0	0	0	0	112.2	R223 Q615 G621 H659 H663 H665	R223-A619 HydrophobicContact CG-CB 3.72Å; Q615-A619 PolarHBondContact O-N 3.11Å; A619-G621 VanDerWaalsContact C-N 3.27Å; A619-G621 PolarHBondContact O-N 3.49Å; A619-H659 HydrophobicContact CB-CB 3.97Å; A619-H663 PolarHBondContact O-CD2 3.27Å; A619-H665 PolarHBondContact O-CD2 3.37Å; A619-H665 VanDerWaalsContact O-CD2 3.32Å; A619-H665 PolarHBondContact O-NE2 3.24Å
620	A	87.2	Confident	88.2	Confident	24 Å²	24	22.4 Å²	22.4	20%	0.198	12%	0.119	C	C	.	.	H	α-helix	trans	-73.5	-13.4	176.3	0	0	0	0	0	114.3	V222 R223 L616 A617 S618 N622	V222-A620 HydrophobicContact CG1-CB 3.57Å; R223-A620 HydrophobicContact CG-CB 4.28Å; L616-A620 WeakPolarHBondContact O-CB 3.29Å; L616-A620 PolarHBondContact O-N 2.91Å; A617-A620 PolarHBondContact O-N 3.02Å; S618-A620 VanDerWaalsContact C-N 3.34Å; A620-N622 PolarHBondContact O-N 3.01Å
621	G	88.5	Confident	89.4	Confident	21 Å²	21	25.7 Å²	25.7	22%	0.216	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	8.2	-179.7	0	0	0	0	0	115.1	A617 S618 A619 Y623 H665	A617-G621 PolarHBondContact O-N 3.34Å; A617-G621 VanDerWaalsContact O-N 3.13Å; S618-G621 PolarHBondContact O-N 3.46Å; A619-G621 VanDerWaalsContact C-N 3.27Å; A619-G621 PolarHBondContact O-N 3.49Å; G621-Y623 PolarHBondContact O-N 2.93Å; G621-H665 WeakPolarHBondContact CA-CD2 3.15Å; G621-H665 VanDerWaalsContact CA-CG 3.47Å; G621-H665 WeakPolarHBondContact CA-NE2 3.46Å; G621-H665 PolarHBondContact N-CD2 2.91Å; G621-H665 PolarHBondContact N-NE2 3.2Å
622	N	90.4	Very high	90.1	Very high	45 Å²	45	29 Å²	29	24%	0.241	16%	0.157	C	C	.	.			trans	-75.3	91.9	-176	-172.9	-25.4	0	0	0	110.6	A617 A620 E624 M625 V626	A617-N622 PolarHBondContact O-N 3.31Å; A620-N622 PolarHBondContact O-N 3.01Å; N622-E624 VanDerWaalsContact C-N 3.28Å; N622-E624 PolarHBondContact O-N 3.46Å; N622-E624 PolarHBondContact OD1-N 2.94Å; N622-M625 HydrophobicContact CB-CB 3.85Å; N622-M625 VanDerWaalsContact CG-CB 3.41Å; N622-M625 PolarHBondContact O-N 3.04Å; N622-M625 WeakPolarHBondContact OD1-CB 3.11Å; N622-M625 PolarHBondContact OD1-N 3.34Å; N622-V626 WeakPolarHBondContact O-CG2 3.37Å; N622-V626 PolarHBondContact O-N 2.84Å
623	Y	92.3	Very high	90.1	Very high	114 Å²	114	31.2 Å²	31.2	45%	0.447	18%	0.181	S	C	.	.	H	α-helix	trans	-57.5	-36	-178.2	179.4	-87.3	0	0	0	113.7	G621 T627 N667 K671	G621-Y623 PolarHBondContact O-N 2.93Å; Y623-T627 VanDerWaalsContact O-CB 3.28Å; Y623-T627 WeakPolarHBondContact O-CB 3.37Å; Y623-T627 PolarHBondContact O-N 3.39Å; Y623-T627 PolarHBondContact O-OG1 3.01Å; Y623-N667 HydrophobicContact CD2-CB 4.25Å; Y623-K671 HydrophobicContact CD2-CB 4.3Å; Y623-K671 HydrophobicContact CE2-CB 3.82Å; Y623-K671 HydrophobicContact CE2-CD 4.43Å; Y623-K671 HydrophobicContact CE2-CG 4.13Å
624	E	93.4	Very high	90	Very high	131 Å²	131	31.5 Å²	31.5	61%	0.612	18%	0.183	S	C	*	.	H	α-helix	trans	-73.1	-45.2	-179.8	-64.4	-175.3	175.7	0	0	110.6	I584 N622 V626 T627 L628	I584-E624 HydrophobicContact CD1-CB 3.82Å; N622-E624 VanDerWaalsContact C-N 3.28Å; N622-E624 PolarHBondContact O-N 3.46Å; N622-E624 PolarHBondContact OD1-N 2.94Å; E624-V626 PolarHBondContact O-N 2.94Å; E624-T627 CarbonylContact O-C 3.59Å; E624-T627 PolarHBondContact O-N 2.75Å; E624-T627 VanDerWaalsContact O-N 3.12Å; E624-L628 PolarHBondContact O-N 3.33Å
625	M	92.8	Very high	89.6	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-59.9	-45.5	174.1	-166.7	70.7	80	0	0	112.1	V579 I584 V587 A617 N622 T627 L628 L629	V579-M625 HydrophobicContact CG1-CG 4.13Å; V579-M625 HydrophobicContact CG2-CG 4.36Å; V579-M625 HydrophobicContact CG2-SD 3.99Å; I584-M625 HydrophobicContact CB-CE 4.38Å; I584-M625 HydrophobicContact CG1-CE 3.62Å; I584-M625 HydrophobicContact CG1-SD 4.26Å; V587-M625 HydrophobicContact CB-CE 4.37Å; V587-M625 HydrophobicContact CB-SD 3.9Å; V587-M625 HydrophobicContact CG1-SD 3.71Å; V587-M625 HydrophobicContact CG2-CE 3.79Å; V587-M625 HydrophobicContact CG2-SD 3.75Å; A617-M625 HydrophobicContact CB-CB 4.17Å; A617-M625 HydrophobicContact CB-CG 3.81Å; N622-M625 HydrophobicContact CB-CB 3.85Å; N622-M625 VanDerWaalsContact CG-CB 3.41Å; N622-M625 PolarHBondContact O-N 3.04Å; N622-M625 WeakPolarHBondContact OD1-CB 3.11Å; N622-M625 PolarHBondContact OD1-N 3.34Å; M625-T627 VanDerWaalsContact C-N 3.31Å; M625-T627 PolarHBondContact O-N 3.23Å; M625-L628 PolarHBondContact O-N 2.98Å; M625-L629 HydrophobicContact CG-CD1 4.18Å; M625-L629 WeakPolarHBondContact O-CG 3.35Å; M625-L629 PolarHBondContact O-N 2.86Å
626	V	93.5	Very high	89.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-40.9	173.9	169.6	0	0	0	0	110.7	L614 A617 N622 E624 L630 V668 K671 L672	L614-V626 HydrophobicContact CD1-CG1 4.11Å; L614-V626 HydrophobicContact CD1-CG2 4.49Å; A617-V626 HydrophobicContact CB-CG2 3.71Å; N622-V626 WeakPolarHBondContact O-CG2 3.37Å; N622-V626 PolarHBondContact O-N 2.84Å; E624-V626 PolarHBondContact O-N 2.94Å; V626-L630 HydrophobicContact CG1-CD1 3.64Å; V626-L630 HydrophobicContact CG1-CG 4.26Å; V626-L630 WeakPolarHBondContact O-CB 3.49Å; V626-L630 WeakPolarHBondContact O-CD1 3.37Å; V626-L630 WeakPolarHBondContact O-CG 3.38Å; V626-L630 PolarHBondContact O-N 2.71Å; V626-V668 HydrophobicContact CG1-CG1 4.31Å; V626-V668 HydrophobicContact CG2-CG1 4.01Å; V626-K671 HydrophobicContact CG1-CG 4.33Å; V626-L672 HydrophobicContact CG1-CD2 4.09Å; V626-L672 HydrophobicContact CG1-CG 4.48Å
627	T	93.5	Very high	88.7	Confident	41 Å²	41	36 Å²	36	25%	0.252	21%	0.209	S	C	.	.	H	α-helix	trans	-66.1	-38.7	177.5	-62.6	0	0	0	0	112.2	Y623 E624 M625 A631 K671	Y623-T627 VanDerWaalsContact O-CB 3.28Å; Y623-T627 WeakPolarHBondContact O-CB 3.37Å; Y623-T627 PolarHBondContact O-N 3.39Å; Y623-T627 PolarHBondContact O-OG1 3.01Å; E624-T627 CarbonylContact O-C 3.59Å; E624-T627 PolarHBondContact O-N 2.75Å; E624-T627 VanDerWaalsContact O-N 3.12Å; M625-T627 VanDerWaalsContact C-N 3.31Å; M625-T627 PolarHBondContact O-N 3.23Å; T627-A631 VanDerWaalsContact O-CB 3.22Å; T627-A631 WeakPolarHBondContact O-CB 3.38Å; T627-A631 PolarHBondContact O-N 2.95Å; T627-K671 WeakPolarHBondContact OG1-CE 3.33Å
628	L	93.3	Very high	87.5	Confident	28 Å²	28	36.8 Å²	36.8	15%	0.147	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-52.8	175.8	177.6	60.5	0	0	0	111.6	I584 V587 Q588 L591 E624 M625 L630 A631 R632	I584-L628 HydrophobicContact CG2-CD2 4.24Å; V587-L628 HydrophobicContact CB-CD2 4.46Å; V587-L628 HydrophobicContact CG1-CD2 3.91Å; Q588-L628 HydrophobicContact CB-CD2 4.35Å; L591-L628 HydrophobicContact CD1-CG 4.43Å; E624-L628 PolarHBondContact O-N 3.33Å; M625-L628 PolarHBondContact O-N 2.98Å; L628-L630 PolarHBondContact O-N 3.17Å; L628-A631 WeakPolarHBondContact O-CB 3.35Å; L628-A631 PolarHBondContact O-N 3.48Å; L628-A631 VanDerWaalsContact O-N 3.1Å; L628-R632 PolarHBondContact O-N 3.27Å; L628-R632 VanDerWaalsContact O-N 3.1Å
629	L	92.1	Very high	85.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.4	-46.4	-179.3	-71.2	168.3	0	0	0	111.9	V579 L591 V597 P613 L614 A617 M625 A631 R632 G633 A634	V579-L629 HydrophobicContact CG1-CD1 4.46Å; V579-L629 HydrophobicContact CG2-CD1 4.41Å; L591-L629 HydrophobicContact CD1-CD2 4.06Å; V597-L629 HydrophobicContact CG1-CD2 4.33Å; P613-L629 HydrophobicContact CB-CD1 3.99Å; P613-L629 HydrophobicContact CB-CD2 4Å; P613-L629 WeakPolarHBondContact O-CD1 3.39Å; L614-L629 HydrophobicContact CD1-CB 4.35Å; A617-L629 HydrophobicContact CB-CD1 3.92Å; M625-L629 HydrophobicContact CG-CD1 4.18Å; M625-L629 WeakPolarHBondContact O-CG 3.35Å; M625-L629 PolarHBondContact O-N 2.86Å; L629-A631 VanDerWaalsContact C-N 3.3Å; L629-A631 PolarHBondContact O-N 2.84Å; L629-R632 CarbonylContact O-C 3.55Å; L629-R632 PolarHBondContact O-N 2.74Å; L629-R632 VanDerWaalsContact O-N 3.08Å; L629-G633 PolarHBondContact O-N 2.82Å; L629-A634 HydrophobicContact CB-CB 4.07Å; L629-A634 WeakPolarHBondContact O-CB 3.44Å; L629-A634 PolarHBondContact O-N 2.8Å; L629-A634 VanDerWaalsContact O-N 3.11Å
630	L	90.6	Very high	84.1	Confident	11 Å²	11	40.1 Å²	40.1	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-64.1	-34.4	175.9	-65.4	172.4	0	0	0	112.5	L614 V626 L628 R632 G633 A634 P636 K671 L672 Q675	L614-L630 HydrophobicContact CD1-CD2 3.86Å; L614-L630 HydrophobicContact CD1-CG 3.96Å; L614-L630 HydrophobicContact CD2-CD2 3.7Å; L614-L630 HydrophobicContact CG-CD2 4.47Å; V626-L630 HydrophobicContact CG1-CD1 3.64Å; V626-L630 HydrophobicContact CG1-CG 4.26Å; V626-L630 WeakPolarHBondContact O-CB 3.49Å; V626-L630 WeakPolarHBondContact O-CD1 3.37Å; V626-L630 WeakPolarHBondContact O-CG 3.38Å; V626-L630 PolarHBondContact O-N 2.71Å; L628-L630 PolarHBondContact O-N 3.17Å; L630-R632 PolarHBondContact O-N 3.27Å; L630-G633 PolarHBondContact O-N 2.98Å; L630-G633 VanDerWaalsContact O-N 3.13Å; L630-A634 HydrophobicContact CD2-CB 4.46Å; L630-A634 WeakPolarHBondContact CD2-O 3.32Å; L630-P636 HydrophobicContact CD2-CG 3.92Å; L630-K671 HydrophobicContact CD1-CG 4.19Å; L630-L672 HydrophobicContact CD1-CD2 4.15Å; L630-L672 HydrophobicContact CD2-CD2 4.42Å; L630-Q675 HydrophobicContact CD1-CG 4.01Å; L630-Q675 HydrophobicContact CD2-CG 4.09Å; L630-Q675 HydrophobicContact CG-CG 4.49Å
631	A	90.4	Very high	82	Confident	78 Å²	78	44.6 Å²	44.6	65%	0.645	25%	0.245	S	C	*	.	H	α-helix	trans	-70.8	-16.7	175	0	0	0	0	0	113.4	T627 L628 L629	T627-A631 VanDerWaalsContact O-CB 3.22Å; T627-A631 WeakPolarHBondContact O-CB 3.38Å; T627-A631 PolarHBondContact O-N 2.95Å; L628-A631 WeakPolarHBondContact O-CB 3.35Å; L628-A631 PolarHBondContact O-N 3.48Å; L628-A631 VanDerWaalsContact O-N 3.1Å; L629-A631 VanDerWaalsContact C-N 3.3Å; L629-A631 PolarHBondContact O-N 2.84Å
632	R	89.1	Confident	79.7	Confident	89 Å²	89	46.1 Å²	46.1	34%	0.336	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	1.5	169.7	-55.9	-50	178.1	89.2	-3.3	113.6	L591 D592 V597 L628 L629 L630	L591-R632 HydrophobicContact CB-CG 4.44Å; L591-R632 HydrophobicContact CD1-CG 4.05Å; D592-R632 IonicContact OD1-CZ 2.9Å; D592-R632 IonicContact OD1-NH1 2.91Å; D592-R632 PolarHBondContact OD1-NH1 3.28Å; D592-R632 IonicContact OD1-NH2 3.22Å; D592-R632 PolarHBondContact OD1-NH2 2.88Å; V597-R632 HydrophobicContact CG1-CB 4.43Å; V597-R632 HydrophobicContact CG2-CB 3.97Å; L628-R632 PolarHBondContact O-N 3.27Å; L628-R632 VanDerWaalsContact O-N 3.1Å; L629-R632 CarbonylContact O-C 3.55Å; L629-R632 PolarHBondContact O-N 2.74Å; L629-R632 VanDerWaalsContact O-N 3.08Å; L630-R632 PolarHBondContact O-N 3.27Å
633	G	84.5	Confident	77	Confident	51 Å²	51	47.8 Å²	47.8	53%	0.526	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	100	17	172.8	0	0	0	0	0	116	L629 L630	L629-G633 PolarHBondContact O-N 2.82Å; L630-G633 PolarHBondContact O-N 2.98Å; L630-G633 VanDerWaalsContact O-N 3.13Å
634	A	85.3	Confident	74.2	Confident	6 Å²	6	47.3 Å²	47.3	5%	0.05	28%	0.281	C	S	.	.			trans	-58.2	138.3	174.7	0	0	0	0	0	112.2	V597 E598 L614 L629 L630 P636	V597-A634 HydrophobicContact CG1-CB 3.65Å; E598-A634 VanDerWaalsContact OE1-CA 3.23Å; E598-A634 WeakPolarHBondContact OE1-CA 3.16Å; L614-A634 HydrophobicContact CB-CB 4.23Å; L614-A634 HydrophobicContact CD2-CB 3.99Å; L614-A634 HydrophobicContact CG-CB 4.48Å; L629-A634 HydrophobicContact CB-CB 4.07Å; L629-A634 WeakPolarHBondContact O-CB 3.44Å; L629-A634 PolarHBondContact O-N 2.8Å; L629-A634 VanDerWaalsContact O-N 3.11Å; L630-A634 HydrophobicContact CD2-CB 4.46Å; L630-A634 WeakPolarHBondContact CD2-O 3.32Å; A634-P636 WeakPolarHBondContact O-CD 3.33Å
635	D	81.3	Confident	71.4	Confident	31 Å²	31	46.1 Å²	46.1	17%	0.166	29%	0.294	C	S	.	.			trans	-95.4	115.1	-174.9	-167.5	-24.2	0	0	0	112.2	E598 L637 S638 K680	E598-D635 PolarHBondContact OE1-N 3.16Å; D635-L637 PolarHBondContact O-N 3.32Å; D635-L637 VanDerWaalsContact O-N 3.1Å; D635-L637 PolarHBondContact OD1-N 3.43Å; D635-S638 PolarHBondContact O-N 2.96Å; D635-S638 PolarHBondContact O-OG 2.83Å; D635-K680 IonicContact OD2-NZ 2.67Å; D635-K680 PolarHBondContact OD2-NZ 3.21Å
636	P	80.8	Confident	68.8	Low	17 Å²	17	53.9 Å²	53.9	11%	0.11	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-17.7	176.4	-23.3	34.6	0	0	0	115.3	L614 L630 A634 C656 F657 L672 Q675	L614-P636 HydrophobicContact CD2-CG 4.38Å; L630-P636 HydrophobicContact CD2-CG 3.92Å; A634-P636 WeakPolarHBondContact O-CD 3.33Å; P636-C656 VanDerWaalsContact CA-SG 3.54Å; P636-C656 PolarHBondContact O-SG 3.47Å; P636-F657 HydrophobicContact CB-CE2 3.72Å; P636-F657 HydrophobicContact CB-CZ 3.68Å; P636-L672 HydrophobicContact CB-CD2 4.49Å; P636-Q675 HydrophobicContact CG-CB 4.31Å; P636-Q675 HydrophobicContact CG-CG 4.3Å
637	L	75.3	Confident	65.9	Low	63 Å²	63	59.3 Å²	59.3	33%	0.33	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	5.1	-177.7	-63.6	174.5	0	0	0	113	D635 R639 F657 R727 A730	D635-L637 PolarHBondContact O-N 3.32Å; D635-L637 VanDerWaalsContact O-N 3.1Å; D635-L637 PolarHBondContact OD1-N 3.43Å; L637-R639 PolarHBondContact O-N 3.18Å; L637-R639 VanDerWaalsContact O-N 3.14Å; L637-F657 HydrophobicContact CD2-CE2 3.91Å; L637-R727 HydrophobicContact CD1-CB 4.27Å; L637-R727 HydrophobicContact CD2-CB 4.33Å; L637-A730 HydrophobicContact CD2-CB 4.27Å
638	S	65.3	Low	63.3	Low	18 Å²	18	59.1 Å²	59.1	13%	0.126	37%	0.368	C	S	.	.			trans	-55	119.5	168.1	63.6	0	0	0	0	109.7	D635	D635-S638 PolarHBondContact O-N 2.96Å; D635-S638 PolarHBondContact O-OG 2.83Å
639	R	57	Low	60.6	Low	55 Å²	55	61.1 Å²	61.1	21%	0.208	39%	0.385	C	S	.	.			trans	-103.5	161.7	172.4	-89.1	-175.3	164.9	136.1	2.1	110.4	L637 H641 E733	L637-R639 PolarHBondContact O-N 3.18Å; L637-R639 VanDerWaalsContact O-N 3.14Å; R639-H641 WeakPolarHBondContact CD-NE2 3.34Å; R639-E733 IonicContact NH2-OE1 3.92Å; R639-E733 PolarHBondContact NH2-OE1 3.42Å; R639-E733 VanDerWaalsContact NH2-OE1 3.07Å; R639-E733 IonicContact NH2-OE2 3.55Å; R639-E733 PolarHBondContact NH2-OE2 3.03Å
640	S	49.9	Very low	58.3	Low	19 Å²	19	64.8 Å²	64.8	13%	0.133	40%	0.404	C	S	.	.			trans	-97.1	99	148.6	160.6	0	0	0	0	105.5	D642	S640-D642 PolarHBondContact O-N 3.42Å
641	H	42.2	Very low	56.2	Low	117 Å²	117	67.1 Å²	67.1	54%	0.542	41%	0.412	S	S	.	.			trans	-82.3	101.7	171.3	-91	-89.1	0	0	0	109.9	E607 R639 G643	E607-H641 WeakPolarHBondContact OE2-CB 3.45Å; E607-H641 PolarHBondContact OE2-N 3.12Å; R639-H641 WeakPolarHBondContact CD-NE2 3.34Å; H641-G643 PolarHBondContact O-N 3.48Å
642	D	40.2	Very low	54.5	Low	54 Å²	54	64.9 Å²	64.9	29%	0.289	39%	0.388	S	S	.	.			trans	-77.8	88.4	179	-136.4	-38.9	0	0	0	111.2	T609 S640 N644 S648	T609-D642 VanDerWaalsContact CG2-OD2 3.25Å; T609-D642 WeakPolarHBondContact CG2-OD2 3.38Å; S640-D642 PolarHBondContact O-N 3.42Å; D642-N644 PolarHBondContact O-N 3.33Å; D642-S648 VanDerWaalsContact CG-CB 3.44Å; D642-S648 WeakPolarHBondContact OD2-CB 3.46Å; D642-S648 PolarHBondContact OD2-OG 3.05Å
643	G	34.3	Very low	53.1	Low	79 Å²	79	64.8 Å²	64.8	81%	0.814	39%	0.394	S	S	*	.			trans	-68.4	26.6	-178.9	0	0	0	0	0	115.6	H641	H641-G643 PolarHBondContact O-N 3.48Å
644	N	32.8	Very low	52.6	Low	104 Å²	104	62.6 Å²	62.6	56%	0.556	37%	0.371	S	S	*	.			trans	-155.3	81.7	-178.2	-128.2	-29.2	0	0	0	114	D642 L646 T647	D642-N644 PolarHBondContact O-N 3.33Å; N644-L646 PolarHBondContact O-N 3.45Å; N644-T647 PolarHBondContact O-N 3.03Å
645	A	36.2	Very low	52.4	Low	106 Å²	106	62.5 Å²	62.5	88%	0.876	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	5.1	-173.9	0	0	0	0	0	117.3
646	L	36.8	Very low	52.7	Low	164 Å²	164	61.2 Å²	61.2	86%	0.859	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	-7.4	-174.5	-65.4	178	0	0	0	115	N644	N644-L646 PolarHBondContact O-N 3.45Å
647	T	32.9	Very low	53	Low	115 Å²	115	60.4 Å²	60.4	71%	0.706	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.9	-20.7	-179.6	45.7	0	0	0	0	115.7	N644	N644-T647 PolarHBondContact O-N 3.03Å
648	S	38.2	Very low	53.7	Low	36 Å²	36	57.4 Å²	57.4	25%	0.252	34%	0.342	S	S	.	.			trans	-106.6	60.2	-176.1	-159.5	0	0	0	0	112.9	D642 L650	D642-S648 VanDerWaalsContact CG-CB 3.44Å; D642-S648 WeakPolarHBondContact OD2-CB 3.46Å; D642-S648 PolarHBondContact OD2-OG 3.05Å; S648-L650 VanDerWaalsContact C-N 3.28Å; S648-L650 PolarHBondContact O-N 3.31Å
649	S	38.5	Very low	54.7	Low	71 Å²	71	57.7 Å²	57.7	50%	0.497	34%	0.341	S	S	.	.			trans	-92.7	30.1	178.8	78.9	0	0	0	0	113.3
650	L	42.1	Very low	56.3	Low	77 Å²	77	55 Å²	55	40%	0.403	33%	0.331	S	S	.	.	S	Bend	trans	-136.7	-10.1	-165.4	-68.9	-177.1	0	0	0	115.9	Y227 S648	Y227-L650 WeakPolarHBondContact CE2-O 3.37Å; S648-L650 VanDerWaalsContact C-N 3.28Å; S648-L650 PolarHBondContact O-N 3.31Å
651	Y	47.1	Very low	58.3	Low	59 Å²	59	54.1 Å²	54.1	23%	0.231	33%	0.325	C	S	.	.	S	Bend	trans	-117.5	166.1	167.9	-72.1	-67.1	0	0	0	109	P567	P567-Y651 PolarHBondContact O-OH 3.26Å; P567-Y651 VanDerWaalsContact O-OH 3.06Å
652	E	54.9	Low	60.5	Low	31 Å²	31	48.7 Å²	48.7	15%	0.145	30%	0.3	C	S	.	.			trans	-129.5	123.3	-169	-167.6	170.9	-147.5	0	0	108.8	Y186 H225 E226 M654	Y186-E652 PolarHBondContact OH-OE1 3.41Å; H225-E652 IonicContact CE1-OE2 3.07Å; H225-E652 PolarHBondContact CE1-OE2 3.38Å; H225-E652 IonicContact ND1-OE2 2.74Å; E226-E652 VanDerWaalsContact CG-OE2 3.29Å; E226-E652 WeakPolarHBondContact CG-OE2 3.1Å; E652-M654 HydrophobicContact CB-CG 4.47Å; E652-M654 HydrophobicContact CG-CG 4.01Å; E652-M654 PolarHBondContact O-N 3.26Å
653	D	60.5	Low	62.8	Low	87 Å²	87	46.7 Å²	46.7	47%	0.465	29%	0.289	S	S	.	.			trans	-74.1	51.4	-173	-60.2	-17.8	0	0	0	112.7	N655	D653-N655 PolarHBondContact O-N 3.22Å
654	M	72.9	Confident	65.4	Low	5 Å²	5	43.9 Å²	43.9	3%	0.025	26%	0.26	C	S	.	.			trans	-72.4	112.9	-179.3	-82.7	-73.9	-168	0	0	111.1	E226 Q615 E652 S658 H659 Y737	E226-M654 HydrophobicContact CG-CE 4.18Å; E226-M654 WeakPolarHBondContact OE1-CE 3.31Å; Q615-M654 PolarHBondContact NE2-O 2.9Å; E652-M654 HydrophobicContact CB-CG 4.47Å; E652-M654 HydrophobicContact CG-CG 4.01Å; E652-M654 PolarHBondContact O-N 3.26Å; M654-S658 PolarHBondContact SD-OG 3.04Å; M654-H659 VanDerWaalsContact CB-CE1 3.47Å; M654-H659 WeakPolarHBondContact CB-CE1 3.46Å; M654-H659 VanDerWaalsContact CB-NE2 3.31Å; M654-H659 WeakPolarHBondContact CB-NE2 3.27Å; M654-Y737 HydrophobicContact CE-CD1 3.73Å; M654-Y737 HydrophobicContact CE-CD2 3.81Å; M654-Y737 HydrophobicContact CE-CE1 3.46Å; M654-Y737 VanDerWaalsContact CE-CE1 3.46Å; M654-Y737 HydrophobicContact CE-CE2 3.54Å; M654-Y737 HydrophobicContact CE-CG 3.89Å; M654-Y737 HydrophobicContact SD-CD2 3.85Å; M654-Y737 HydrophobicContact SD-CE2 3.55Å; M654-Y737 VanDerWaalsContact SD-CE2 3.55Å; M654-Y737 HydrophobicContact SD-CG 4.46Å
655	N	81.9	Confident	68.2	Low	5 Å²	5	41.4 Å²	41.4	3%	0.027	25%	0.245	C	C	.	.			trans	-68.5	164.4	169.4	73.4	72.3	0	0	0	111.4	D653 F657 S658 H659 A730 E733	D653-N655 PolarHBondContact O-N 3.22Å; N655-F657 VanDerWaalsContact C-N 3.28Å; N655-F657 PolarHBondContact O-N 3.02Å; N655-F657 WeakPolarHBondContact OD1-CA 3.31Å; N655-F657 VanDerWaalsContact OD1-CB 3.22Å; N655-F657 WeakPolarHBondContact OD1-CB 3.24Å; N655-F657 PolarHBondContact OD1-N 3.34Å; N655-S658 PolarHBondContact N-OG 3.38Å; N655-S658 PolarHBondContact ND2-OG 2.8Å; N655-S658 PolarHBondContact O-N 3.19Å; N655-S658 PolarHBondContact O-OG 3.2Å; N655-S658 PolarHBondContact OD1-N 3.27Å; N655-H659 PolarHBondContact O-N 3.04Å; N655-A730 HydrophobicContact CB-CB 4.32Å; N655-A730 VanDerWaalsContact ND2-CA 3.34Å; N655-A730 WeakPolarHBondContact ND2-CA 3.41Å; N655-A730 PolarHBondContact ND2-O 3.03Å; N655-A730 VanDerWaalsContact ND2-O 3.09Å; N655-E733 PolarHBondContact ND2-OE2 3.48Å
656	C	85.9	Confident	70.8	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.02	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-29.7	-177	69.9	0	0	0	0	113.6	L614 Q615 P636 A660 L672	L614-C656 HydrophobicContact CG-CB 4.45Å; Q615-C656 HydrophobicContact CG-CB 4.45Å; P636-C656 VanDerWaalsContact CA-SG 3.54Å; P636-C656 PolarHBondContact O-SG 3.47Å; C656-A660 WeakPolarHBondContact O-CB 3.45Å; C656-A660 PolarHBondContact O-N 3.36Å; C656-L672 HydrophobicContact CB-CD1 4.17Å; C656-L672 HydrophobicContact CB-CD2 4.41Å
657	F	88.9	Confident	73.4	Confident	1 Å²	1	38.5 Å²	38.5	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-69.9	-39.8	175.7	-52.1	-94.6	0	0	0	111	P636 L637 N655 A660 A661 L669 L672 L673 A730 L731 A734	P636-F657 HydrophobicContact CB-CE2 3.72Å; P636-F657 HydrophobicContact CB-CZ 3.68Å; L637-F657 HydrophobicContact CD2-CE2 3.91Å; N655-F657 VanDerWaalsContact C-N 3.28Å; N655-F657 PolarHBondContact O-N 3.02Å; N655-F657 WeakPolarHBondContact OD1-CA 3.31Å; N655-F657 VanDerWaalsContact OD1-CB 3.22Å; N655-F657 WeakPolarHBondContact OD1-CB 3.24Å; N655-F657 PolarHBondContact OD1-N 3.34Å; F657-A660 PolarHBondContact O-N 2.91Å; F657-A661 VanDerWaalsContact O-CB 3.23Å; F657-A661 WeakPolarHBondContact O-CB 3.21Å; F657-A661 PolarHBondContact O-N 3.22Å; F657-L669 HydrophobicContact CB-CD1 3.84Å; F657-L669 HydrophobicContact CD1-CD1 3.98Å; F657-L669 HydrophobicContact CG-CD1 4.42Å; F657-L672 HydrophobicContact CD1-CB 3.92Å; F657-L672 HydrophobicContact CD1-CD1 4.46Å; F657-L672 HydrophobicContact CE1-CB 3.59Å; F657-L672 HydrophobicContact CZ-CB 4.23Å; F657-L673 HydrophobicContact CD1-CD2 4.26Å; F657-L673 HydrophobicContact CD1-CG 4.34Å; F657-L673 HydrophobicContact CE1-CD2 3.94Å; F657-L673 HydrophobicContact CE1-CG 4.14Å; F657-A730 HydrophobicContact CD2-CB 4.44Å; F657-L731 HydrophobicContact CB-CD2 4.06Å; F657-L731 HydrophobicContact CD1-CD2 3.82Å; F657-L731 HydrophobicContact CG-CD2 4.01Å; F657-A734 HydrophobicContact CB-CB 4.18Å
658	S	88.5	Confident	76.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-69.2	-38.8	175.9	58.6	0	0	0	0	112.1	M654 N655 A661 A662	M654-S658 PolarHBondContact SD-OG 3.04Å; N655-S658 PolarHBondContact N-OG 3.38Å; N655-S658 PolarHBondContact ND2-OG 2.8Å; N655-S658 PolarHBondContact O-N 3.19Å; N655-S658 PolarHBondContact O-OG 3.2Å; N655-S658 PolarHBondContact OD1-N 3.27Å; S658-A661 PolarHBondContact O-N 2.81Å; S658-A662 WeakPolarHBondContact O-CB 3.35Å; S658-A662 PolarHBondContact O-N 3.44Å
659	H	87.4	Confident	78.7	Confident	23 Å²	23	31.7 Å²	31.7	11%	0.106	16%	0.164	C	C	.	.	H	α-helix	trans	-58.4	-47.6	169.4	-84.3	-52.2	0	0	0	112.8	A619 M654 N655 A661 H663	A619-H659 HydrophobicContact CB-CB 3.97Å; M654-H659 VanDerWaalsContact CB-CE1 3.47Å; M654-H659 WeakPolarHBondContact CB-CE1 3.46Å; M654-H659 VanDerWaalsContact CB-NE2 3.31Å; M654-H659 WeakPolarHBondContact CB-NE2 3.27Å; N655-H659 PolarHBondContact O-N 3.04Å; H659-A661 PolarHBondContact O-N 3.1Å; H659-H663 PolarHBondContact O-N 3.24Å
660	A	90.9	Very high	81.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.2	-39.7	178.3	0	0	0	0	0	112.1	C656 F657 G664 H665 V668 L669 L672	C656-A660 WeakPolarHBondContact O-CB 3.45Å; C656-A660 PolarHBondContact O-N 3.36Å; F657-A660 PolarHBondContact O-N 2.91Å; A660-G664 PolarHBondContact O-N 3.03Å; A660-H665 HydrophobicContact CB-CB 4.44Å; A660-H665 PolarHBondContact O-N 3.21Å; A660-V668 HydrophobicContact CB-CB 4.44Å; A660-V668 HydrophobicContact CB-CG1 3.96Å; A660-L669 HydrophobicContact CB-CB 4.19Å; A660-L669 HydrophobicContact CB-CD1 4.41Å; A660-L672 HydrophobicContact CB-CD1 4.15Å
661	A	91.4	Very high	83.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-74.2	-39	179.8	0	0	0	0	0	113.1	F657 S658 H659 H663 G664 A734 V746	F657-A661 VanDerWaalsContact O-CB 3.23Å; F657-A661 WeakPolarHBondContact O-CB 3.21Å; F657-A661 PolarHBondContact O-N 3.22Å; S658-A661 PolarHBondContact O-N 2.81Å; H659-A661 PolarHBondContact O-N 3.1Å; A661-H663 PolarHBondContact O-N 3.28Å; A661-G664 PolarHBondContact O-N 3.48Å; A661-G664 VanDerWaalsContact O-N 3.09Å; A661-A734 HydrophobicContact CB-CB 3.82Å; A661-A734 WeakPolarHBondContact CB-O 3.44Å; A661-V746 HydrophobicContact CB-CG1 4.11Å
662	A	88.9	Confident	85.4	Confident	3 Å²	3	29.4 Å²	29.4	3%	0.025	14%	0.14	C	C	.	.	H	α-helix	trans	-61.6	-30.5	176.2	0	0	0	0	0	112.7	F212 S658 H741 Y743	F212-A662 VanDerWaalsContact CE1-O 3.32Å; F212-A662 WeakPolarHBondContact CE1-O 3.25Å; S658-A662 WeakPolarHBondContact O-CB 3.35Å; S658-A662 PolarHBondContact O-N 3.44Å; A662-H741 PolarHBondContact O-ND1 3.42Å; A662-Y743 VanDerWaalsContact O-CE2 3.25Å; A662-Y743 WeakPolarHBondContact O-CE2 3.49Å
663	H	88.1	Confident	86.8	Confident	11 Å²	11	29.3 Å²	29.3	5%	0.051	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	2	175.2	-76.9	-75.5	0	0	0	114.3	F212 V216 I224 A619 H659 A661 H665	F212-H663 AromaticContact CE1-CE1 3.94Å; F212-H663 AromaticContact CZ-CE1 3.73Å; F212-H663 AromaticContact CZ-NE2 3.86Å; V216-H663 WeakPolarHBondContact CG2-ND1 3.18Å; I224-H663 PolarHBondContact N-CE1 3.02Å; A619-H663 PolarHBondContact O-CD2 3.27Å; H659-H663 PolarHBondContact O-N 3.24Å; A661-H663 PolarHBondContact O-N 3.28Å; H663-H665 VanDerWaalsContact C-N 3.3Å; H663-H665 WeakPolarHBondContact CB-CD2 3.47Å; H663-H665 WeakPolarHBondContact CB-NE2 3.48Å; H663-H665 PolarHBondContact O-N 3.29Å
664	G	89.4	Confident	88	Confident	20 Å²	20	29.8 Å²	29.8	21%	0.206	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	13.8	179.2	0	0	0	0	0	115.4	A660 A661 R666	A660-G664 PolarHBondContact O-N 3.03Å; A661-G664 PolarHBondContact O-N 3.48Å; A661-G664 VanDerWaalsContact O-N 3.09Å; G664-R666 PolarHBondContact O-N 3.14Å
665	H	91.6	Very high	88.2	Confident	52 Å²	52	31.9 Å²	31.9	24%	0.241	16%	0.156	C	C	.	.			trans	-74.7	61.3	-175	-64.3	-46.9	0	0	0	113.3	S618 A619 G621 A660 H663 N667 V668 L669	S618-H665 PolarHBondContact O-CD2 2.99Å; A619-H665 PolarHBondContact O-CD2 3.37Å; A619-H665 VanDerWaalsContact O-CD2 3.32Å; A619-H665 PolarHBondContact O-NE2 3.24Å; G621-H665 WeakPolarHBondContact CA-CD2 3.15Å; G621-H665 VanDerWaalsContact CA-CG 3.47Å; G621-H665 WeakPolarHBondContact CA-NE2 3.46Å; G621-H665 PolarHBondContact N-CD2 2.91Å; G621-H665 PolarHBondContact N-NE2 3.2Å; A660-H665 HydrophobicContact CB-CB 4.44Å; A660-H665 PolarHBondContact O-N 3.21Å; H663-H665 VanDerWaalsContact C-N 3.3Å; H663-H665 WeakPolarHBondContact CB-CD2 3.47Å; H663-H665 WeakPolarHBondContact CB-NE2 3.48Å; H663-H665 PolarHBondContact O-N 3.29Å; H665-N667 PolarHBondContact O-N 3.06Å; H665-N667 VanDerWaalsContact O-N 3.08Å; H665-V668 HydrophobicContact CB-CB 4.07Å; H665-V668 HydrophobicContact CB-CG2 4.35Å; H665-V668 WeakPolarHBondContact O-CB 3.43Å; H665-V668 PolarHBondContact O-N 3.36Å; H665-L669 PolarHBondContact O-N 2.94Å
666	R	90.8	Very high	87.3	Confident	102 Å²	102	36.5 Å²	36.5	39%	0.385	19%	0.187	S	C	.	.	H	α-helix	trans	-47.2	-39.9	-176.8	-170.5	-176.4	-172.4	175.9	9.7	114.4	G664 R670 V746 E749	G664-R666 PolarHBondContact O-N 3.14Å; R666-R670 WeakPolarHBondContact O-CB 3.49Å; R666-R670 VanDerWaalsContact O-CG 3.28Å; R666-R670 WeakPolarHBondContact O-CG 3.19Å; R666-R670 PolarHBondContact O-N 2.96Å; R666-V746 HydrophobicContact CB-CG2 4.26Å; R666-E749 IonicContact CZ-OE2 3.23Å; R666-E749 IonicContact NE-OE2 2.64Å; R666-E749 PolarHBondContact NE-OE2 3.45Å; R666-E749 IonicContact NH2-OE2 2.59Å; R666-E749 PolarHBondContact NH2-OE2 3.45Å
667	N	91.3	Very high	86.2	Confident	108 Å²	108	40 Å²	40	58%	0.578	20%	0.203	S	C	*	.	H	α-helix	trans	-70.2	-36.4	-179.5	-67.3	-12.8	0	0	0	112.5	Y623 H665 K671	Y623-N667 HydrophobicContact CD2-CB 4.25Å; H665-N667 PolarHBondContact O-N 3.06Å; H665-N667 VanDerWaalsContact O-N 3.08Å; N667-K671 PolarHBondContact O-N 2.8Å; N667-K671 VanDerWaalsContact O-N 3.12Å
668	V	91.4	Very high	84.4	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-70.1	-46.5	173.6	168.9	0	0	0	0	110.1	V626 A660 H665 R670 K671 L672	V626-V668 HydrophobicContact CG1-CG1 4.31Å; V626-V668 HydrophobicContact CG2-CG1 4.01Å; A660-V668 HydrophobicContact CB-CB 4.44Å; A660-V668 HydrophobicContact CB-CG1 3.96Å; H665-V668 HydrophobicContact CB-CB 4.07Å; H665-V668 HydrophobicContact CB-CG2 4.35Å; H665-V668 WeakPolarHBondContact O-CB 3.43Å; H665-V668 PolarHBondContact O-N 3.36Å; V668-R670 VanDerWaalsContact C-N 3.28Å; V668-R670 PolarHBondContact O-N 3.24Å; V668-K671 WeakPolarHBondContact O-CA 3.26Å; V668-K671 WeakPolarHBondContact O-CB 3.17Å; V668-K671 PolarHBondContact O-N 2.87Å; V668-L672 HydrophobicContact CG1-CD1 3.92Å; V668-L672 HydrophobicContact CG1-CG 4.26Å; V668-L672 WeakPolarHBondContact O-CG 3.31Å; V668-L672 PolarHBondContact O-N 3.2Å
669	L	90.1	Very high	82.5	Confident	6 Å²	6	53.3 Å²	53.3	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-54.9	-44.8	176.7	-175.2	68.5	0	0	0	111.5	F657 A660 H665 L672 L673 V746 L750	F657-L669 HydrophobicContact CB-CD1 3.84Å; F657-L669 HydrophobicContact CD1-CD1 3.98Å; F657-L669 HydrophobicContact CG-CD1 4.42Å; A660-L669 HydrophobicContact CB-CB 4.19Å; A660-L669 HydrophobicContact CB-CD1 4.41Å; H665-L669 PolarHBondContact O-N 2.94Å; L669-L672 PolarHBondContact O-N 3.04Å; L669-L673 HydrophobicContact CG-CD1 4.29Å; L669-L673 WeakPolarHBondContact O-CB 3.36Å; L669-L673 VanDerWaalsContact O-CG 3.28Å; L669-L673 WeakPolarHBondContact O-CG 3.4Å; L669-L673 PolarHBondContact O-N 2.59Å; L669-V746 HydrophobicContact CD2-CG1 3.58Å; L669-L750 HydrophobicContact CD2-CD1 4.44Å; L669-L750 HydrophobicContact CD2-CD2 4.12Å; L669-L750 HydrophobicContact CD2-CG 4.24Å
670	R	90.4	Very high	80.5	Confident	110 Å²	110	57 Å²	57	42%	0.415	28%	0.284	S	S	.	.	H	α-helix	trans	-58.9	-45.4	171.8	-75.4	170.2	173	-160.9	-9.8	112.6	R666 V668 L673 T674 E749	R666-R670 WeakPolarHBondContact O-CB 3.49Å; R666-R670 VanDerWaalsContact O-CG 3.28Å; R666-R670 WeakPolarHBondContact O-CG 3.19Å; R666-R670 PolarHBondContact O-N 2.96Å; V668-R670 VanDerWaalsContact C-N 3.28Å; V668-R670 PolarHBondContact O-N 3.24Å; R670-L673 PolarHBondContact O-N 2.64Å; R670-T674 WeakPolarHBondContact O-CG2 3.24Å; R670-T674 PolarHBondContact O-N 2.66Å; R670-E749 IonicContact CZ-OE1 3.32Å; R670-E749 VanDerWaalsContact CZ-OE1 3.25Å; R670-E749 IonicContact CZ-OE2 3.47Å; R670-E749 IonicContact NE-OE1 3.63Å; R670-E749 PolarHBondContact NE-OE1 3.25Å; R670-E749 IonicContact NE-OE2 3.13Å; R670-E749 IonicContact NH2-OE1 3.64Å; R670-E749 PolarHBondContact NH2-OE1 2.94Å; R670-E749 IonicContact NH2-OE2 3.44Å; R670-E749 PolarHBondContact NH2-OE2 2.77Å
671	K	90.2	Very high	77.9	Confident	48 Å²	48	66.2 Å²	66.2	21%	0.209	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-42	179.9	-176	56.9	178.2	171	0	112.2	Y623 V626 T627 L630 N667 V668 L673 T674	Y623-K671 HydrophobicContact CD2-CB 4.3Å; Y623-K671 HydrophobicContact CE2-CB 3.82Å; Y623-K671 HydrophobicContact CE2-CD 4.43Å; Y623-K671 HydrophobicContact CE2-CG 4.13Å; V626-K671 HydrophobicContact CG1-CG 4.33Å; T627-K671 WeakPolarHBondContact OG1-CE 3.33Å; L630-K671 HydrophobicContact CD1-CG 4.19Å; N667-K671 PolarHBondContact O-N 2.8Å; N667-K671 VanDerWaalsContact O-N 3.12Å; V668-K671 WeakPolarHBondContact O-CA 3.26Å; V668-K671 WeakPolarHBondContact O-CB 3.17Å; V668-K671 PolarHBondContact O-N 2.87Å; K671-L673 VanDerWaalsContact C-N 3.34Å; K671-T674 PolarHBondContact O-N 3.43Å; K671-T674 PolarHBondContact O-OG1 3.04Å
672	L	87.6	Confident	75.3	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.4	-44.2	171.9	-64.8	167.7	0	0	0	110.9	L614 V626 L630 P636 C656 F657 A660 V668 L669 T674 Q675	L614-L672 HydrophobicContact CD1-CD2 4.12Å; L614-L672 HydrophobicContact CD2-CD2 4.33Å; L614-L672 HydrophobicContact CG-CD2 4.39Å; V626-L672 HydrophobicContact CG1-CD2 4.09Å; V626-L672 HydrophobicContact CG1-CG 4.48Å; L630-L672 HydrophobicContact CD1-CD2 4.15Å; L630-L672 HydrophobicContact CD2-CD2 4.42Å; P636-L672 HydrophobicContact CB-CD2 4.49Å; C656-L672 HydrophobicContact CB-CD1 4.17Å; C656-L672 HydrophobicContact CB-CD2 4.41Å; F657-L672 HydrophobicContact CD1-CB 3.92Å; F657-L672 HydrophobicContact CD1-CD1 4.46Å; F657-L672 HydrophobicContact CE1-CB 3.59Å; F657-L672 HydrophobicContact CZ-CB 4.23Å; A660-L672 HydrophobicContact CB-CD1 4.15Å; V668-L672 HydrophobicContact CG1-CD1 3.92Å; V668-L672 HydrophobicContact CG1-CG 4.26Å; V668-L672 WeakPolarHBondContact O-CG 3.31Å; V668-L672 PolarHBondContact O-N 3.2Å; L669-L672 PolarHBondContact O-N 3.04Å; L672-T674 VanDerWaalsContact C-N 3.3Å; L672-T674 PolarHBondContact O-N 3.24Å; L672-Q675 PolarHBondContact O-N 2.88Å
673	L	84.8	Confident	73.3	Confident	30 Å²	30	78.7 Å²	78.7	16%	0.157	40%	0.398	C	S	.	.	H	α-helix	trans	-63.7	-29.4	177.6	-74.8	169.5	0	0	0	113.8	F657 L669 R670 K671 Q675 R727 L731	F657-L673 HydrophobicContact CD1-CD2 4.26Å; F657-L673 HydrophobicContact CD1-CG 4.34Å; F657-L673 HydrophobicContact CE1-CD2 3.94Å; F657-L673 HydrophobicContact CE1-CG 4.14Å; L669-L673 HydrophobicContact CG-CD1 4.29Å; L669-L673 WeakPolarHBondContact O-CB 3.36Å; L669-L673 VanDerWaalsContact O-CG 3.28Å; L669-L673 WeakPolarHBondContact O-CG 3.4Å; L669-L673 PolarHBondContact O-N 2.59Å; R670-L673 PolarHBondContact O-N 2.64Å; K671-L673 VanDerWaalsContact C-N 3.34Å; L673-Q675 PolarHBondContact O-N 3.14Å; L673-R727 PolarHBondContact O-NH2 2.98Å; L673-L731 HydrophobicContact CD2-CD1 4.07Å; L673-L731 HydrophobicContact CD2-CD2 3.96Å
674	T	84.6	Confident	71.1	Confident	96 Å²	96	82 Å²	82	59%	0.589	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-10.3	176.4	58.9	0	0	0	0	114.8	R670 K671 L672	R670-T674 WeakPolarHBondContact O-CG2 3.24Å; R670-T674 PolarHBondContact O-N 2.66Å; K671-T674 PolarHBondContact O-N 3.43Å; K671-T674 PolarHBondContact O-OG1 3.04Å; L672-T674 VanDerWaalsContact C-N 3.3Å; L672-T674 PolarHBondContact O-N 3.24Å
675	Q	77.2	Confident	69.4	Low	49 Å²	49	83.4 Å²	83.4	23%	0.229	42%	0.423	C	S	.	.	S	Bend	trans	-73.5	136.9	-179.8	-65.3	-60.6	-16.9	0	0	112	L630 P636 L672 L673 R727	L630-Q675 HydrophobicContact CD1-CG 4.01Å; L630-Q675 HydrophobicContact CD2-CG 4.09Å; L630-Q675 HydrophobicContact CG-CG 4.49Å; P636-Q675 HydrophobicContact CG-CB 4.31Å; P636-Q675 HydrophobicContact CG-CG 4.3Å; L672-Q675 PolarHBondContact O-N 2.88Å; L673-Q675 PolarHBondContact O-N 3.14Å; Q675-R727 PolarHBondContact O-NH1 2.9Å
676	P	64.9	Low	67	Low	102 Å²	102	87 Å²	87	66%	0.662	44%	0.443	S	S	*	.			trans	-63.2	145.3	177.9	28.8	-34.3	0	0	0	109.9	Q678	P676-Q678 PolarHBondContact O-N 3.44Å; P676-Q678 VanDerWaalsContact O-N 3.07Å
677	Q	61.6	Low	65	Low	78 Å²	78	89.8 Å²	89.8	36%	0.364	46%	0.46	S	S	.	.			trans	-69.7	106.8	175.5	-59.5	-175.5	28.3	0	0	108.7	I679 N722	Q677-I679 PolarHBondContact O-N 3.39Å; Q677-N722 PolarHBondContact NE2-O 3.44Å
678	Q	51.6	Low	62.9	Low	137 Å²	137	89.6 Å²	89.6	64%	0.64	46%	0.456	S	S	*	.			trans	-69.8	99.5	160.2	-71.2	-167.2	20.1	0	0	107.4	P676 K680	P676-Q678 PolarHBondContact O-N 3.44Å; P676-Q678 VanDerWaalsContact O-N 3.07Å; Q678-K680 PolarHBondContact O-N 2.78Å
679	I	48.4	Very low	61.2	Low	143 Å²	143	93.5 Å²	93.5	73%	0.733	48%	0.476	S	S	*	.			trans	-74.8	84.2	164.1	-53.5	174.7	0	0	0	105.9	Q677	Q677-I679 PolarHBondContact O-N 3.39Å
680	K	44.5	Very low	58.8	Low	100 Å²	100	99.5 Å²	99.5	44%	0.435	51%	0.507	S	S	.	.			trans	-65.2	136.4	156.8	-69.2	167	179.5	165.1	0	106.5	D635 Q678 D682	D635-K680 IonicContact OD2-NZ 2.67Å; D635-K680 PolarHBondContact OD2-NZ 3.21Å; Q678-K680 PolarHBondContact O-N 2.78Å; K680-D682 WeakPolarHBondContact CB-OD1 3.21Å; K680-D682 WeakPolarHBondContact CB-OD2 3.41Å; K680-D682 PolarHBondContact O-N 3.07Å
681	E	36.6	Very low	56.6	Low	193 Å²	193	98.2 Å²	98.2	90%	0.902	52%	0.52	S	S	*	.			trans	-77.6	59.3	172.1	-64.7	-177.2	143.4	0	0	108.8	V683	E681-V683 PolarHBondContact O-N 3.39Å
682	D	37.9	Very low	54.5	Low	123 Å²	123	100.9 Å²	100.9	66%	0.658	53%	0.533	S	S	*	.			trans	-65.6	118.4	-176.9	-69.6	-34.6	0	0	0	108.9	K680 L684	K680-D682 WeakPolarHBondContact CB-OD1 3.21Å; K680-D682 WeakPolarHBondContact CB-OD2 3.41Å; K680-D682 PolarHBondContact O-N 3.07Å; D682-L684 PolarHBondContact O-N 2.94Å
683	V	45.5	Very low	52.1	Low	142 Å²	142	103.4 Å²	103.4	86%	0.861	56%	0.559	S	S	*	*			trans	-63.5	110.1	-179.8	177.3	0	0	0	0	108	E681 S685	E681-V683 PolarHBondContact O-N 3.39Å; V683-S685 PolarHBondContact O-N 3.17Å
684	L	43.2	Very low	49.8	Very low	82 Å²	82	109.2 Å²	109.2	43%	0.429	60%	0.595	S	S	.	*			trans	-44.9	128.6	178.3	-71.4	168.1	0	0	0	110.3	D682 E688 I689	D682-L684 PolarHBondContact O-N 2.94Å; L684-E688 HydrophobicContact CD2-CB 4.29Å; L684-I689 HydrophobicContact CB-CD1 4.1Å; L684-I689 HydrophobicContact CB-CG1 3.83Å
685	S	52.8	Low	47.5	Very low	49 Å²	49	112.9 Å²	112.9	34%	0.343	61%	0.606	S	S	.	*			trans	-61.4	151.4	176.8	62.8	0	0	0	0	110.1	V683 E687 E688 I689	V683-S685 PolarHBondContact O-N 3.17Å; S685-E687 PolarHBondContact O-N 3.28Å; S685-E687 VanDerWaalsContact O-N 3.11Å; S685-E688 WeakPolarHBondContact CB-OE2 3.2Å; S685-E688 PolarHBondContact N-OE2 2.74Å; S685-E688 PolarHBondContact O-N 3.22Å; S685-E688 WeakPolarHBondContact OG-CB 3.32Å; S685-E688 VanDerWaalsContact OG-CG 3.26Å; S685-E688 WeakPolarHBondContact OG-CG 3.44Å; S685-E688 PolarHBondContact OG-N 3.27Å; S685-E688 PolarHBondContact OG-OE2 3.33Å; S685-I689 WeakPolarHBondContact O-CG1 3.49Å; S685-I689 PolarHBondContact O-N 2.97Å
686	L	41.9	Very low	45.3	Very low	127 Å²	127	117.2 Å²	117.2	67%	0.665	63%	0.631	S	S	*	*	H	α-helix	trans	-59.9	-26.6	177.8	-158.8	76.7	0	0	0	111.4	L690	L686-L690 HydrophobicContact CD2-CD1 4.32Å; L686-L690 HydrophobicContact CG-CD1 4.12Å; L686-L690 VanDerWaalsContact O-CB 3.29Å; L686-L690 WeakPolarHBondContact O-CB 3.24Å; L686-L690 WeakPolarHBondContact O-CD1 3.33Å; L686-L690 WeakPolarHBondContact O-CG 3.49Å; L686-L690 PolarHBondContact O-N 3.21Å
687	E	47.7	Very low	43.6	Very low	161 Å²	161	121.4 Å²	121.4	75%	0.752	64%	0.641	S	S	*	*	H	α-helix	trans	-72.8	-35.5	174.7	-61.6	-174	147	0	0	112.7	S685 L690 A691	S685-E687 PolarHBondContact O-N 3.28Å; S685-E687 VanDerWaalsContact O-N 3.11Å; E687-L690 PolarHBondContact O-N 3.16Å; E687-A691 WeakPolarHBondContact O-CB 3.47Å; E687-A691 PolarHBondContact O-N 3.23Å
688	E	48.8	Very low	42.1	Very low	103 Å²	103	125.1 Å²	125.1	48%	0.481	66%	0.662	S	S	.	*	H	α-helix	trans	-68.2	-40.9	170.7	-74.7	163.5	125.3	0	0	111.6	L684 S685 L690 A691 E692	L684-E688 HydrophobicContact CD2-CB 4.29Å; S685-E688 WeakPolarHBondContact CB-OE2 3.2Å; S685-E688 PolarHBondContact N-OE2 2.74Å; S685-E688 PolarHBondContact O-N 3.22Å; S685-E688 WeakPolarHBondContact OG-CB 3.32Å; S685-E688 VanDerWaalsContact OG-CG 3.26Å; S685-E688 WeakPolarHBondContact OG-CG 3.44Å; S685-E688 PolarHBondContact OG-N 3.27Å; S685-E688 PolarHBondContact OG-OE2 3.33Å; E688-L690 VanDerWaalsContact C-N 3.3Å; E688-L690 PolarHBondContact O-N 3.33Å; E688-A691 PolarHBondContact O-N 2.97Å; E688-E692 PolarHBondContact O-N 3.29Å
689	I	54.3	Low	40.9	Very low	85 Å²	85	125.1 Å²	125.1	44%	0.436	67%	0.674	S	S	.	*	H	α-helix	trans	-65.3	-33.4	175.8	-62	168.9	0	0	0	111.3	L684 S685	L684-I689 HydrophobicContact CB-CD1 4.1Å; L684-I689 HydrophobicContact CB-CG1 3.83Å; S685-I689 WeakPolarHBondContact O-CG1 3.49Å; S685-I689 PolarHBondContact O-N 2.97Å
690	L	39.9	Very low	40.2	Very low	132 Å²	132	121.2 Å²	121.2	69%	0.691	67%	0.669	S	S	*	*	H	α-helix	trans	-84.4	-20.3	175.6	-70.2	168.4	0	0	0	113.3	L686 E687 E688 E692	L686-L690 HydrophobicContact CD2-CD1 4.32Å; L686-L690 HydrophobicContact CG-CD1 4.12Å; L686-L690 VanDerWaalsContact O-CB 3.29Å; L686-L690 WeakPolarHBondContact O-CB 3.24Å; L686-L690 WeakPolarHBondContact O-CD1 3.33Å; L686-L690 WeakPolarHBondContact O-CG 3.49Å; L686-L690 PolarHBondContact O-N 3.21Å; E687-L690 PolarHBondContact O-N 3.16Å; E688-L690 VanDerWaalsContact C-N 3.3Å; E688-L690 PolarHBondContact O-N 3.33Å; L690-E692 VanDerWaalsContact C-N 3.34Å
691	A	44.8	Very low	39.3	Very low	82 Å²	82	124.9 Å²	124.9	68%	0.678	69%	0.69	S	S	*	*	H	α-helix	trans	-78.8	-17.1	169.1	0	0	0	0	0	112.6	E687 E688 G693	E687-A691 WeakPolarHBondContact O-CB 3.47Å; E687-A691 PolarHBondContact O-N 3.23Å; E688-A691 PolarHBondContact O-N 2.97Å; A691-G693 PolarHBondContact O-N 2.78Å
692	E	46.4	Very low	38.9	Very low	105 Å²	105	121.4 Å²	121.4	49%	0.491	69%	0.685	S	S	.	*			trans	-73.4	50.8	163.8	-70.2	-175.4	157.5	0	0	111.7	E688 L690 K725	E688-E692 PolarHBondContact O-N 3.29Å; L690-E692 VanDerWaalsContact C-N 3.34Å; E692-K725 IonicContact OE1-NZ 2.76Å; E692-K725 PolarHBondContact OE1-NZ 2.95Å
693	G	37.3	Very low	38.7	Very low	52 Å²	52	120.7 Å²	120.7	54%	0.536	69%	0.687	S	S	.	*			trans	-57.5	142.9	160.4	0	0	0	0	0	110.1	A691 E695	A691-G693 PolarHBondContact O-N 2.78Å; G693-E695 PolarHBondContact O-N 3.17Å
694	V	36.7	Very low	37.9	Very low	153 Å²	153	124.5 Å²	124.5	93%	0.927	69%	0.688	S	S	*	*			trans	-72	86.6	-166.6	-177.9	0	0	0	0	111.4
695	E	34.5	Very low	37.1	Very low	172 Å²	172	128.6 Å²	128.6	80%	0.804	71%	0.709	S	S	*	*			trans	-120.5	105.3	170.9	-69.7	-163.9	172.1	0	0	111.8	G693	G693-E695 PolarHBondContact O-N 3.17Å
696	N	31.6	Very low	36.2	Very low	141 Å²	141	131.5 Å²	131.5	75%	0.754	73%	0.727	S	S	*	*			trans	65.9	56	154.6	-53	-52.7	0	0	0	117.8	I698	N696-I698 PolarHBondContact O-N 3.47Å
697	E	28.7	Very low	36	Very low	189 Å²	189	132 Å²	132	88%	0.883	74%	0.735	S	S	*	*			trans	-56	127.9	141.4	-73.7	-164.7	147.3	0	0	108.9	P699	E697-P699 VanDerWaalsContact O-CD 3.29Å; E697-P699 WeakPolarHBondContact O-CD 3.49Å
698	I	30.1	Very low	35	Very low	156 Å²	156	130.1 Å²	130.1	80%	0.8	74%	0.738	S	S	*	*			trans	-78.7	115.1	175.7	-60.4	170.7	0	0	0	108.1	N696 G700	N696-I698 PolarHBondContact O-N 3.47Å; I698-G700 VanDerWaalsContact C-N 3.3Å; I698-G700 PolarHBondContact O-N 2.98Å
699	P	27.4	Very low	34.3	Very low	137 Å²	137	130.1 Å²	130.1	89%	0.89	75%	0.749	S	S	*	*	S	Bend	trans	-76.9	79.8	-176.8	31.7	-34.8	0	0	0	110.6	E697	E697-P699 VanDerWaalsContact O-CD 3.29Å; E697-P699 WeakPolarHBondContact O-CD 3.49Å
700	G	33.1	Very low	33	Very low	62 Å²	62	133.6 Å²	133.6	64%	0.639	77%	0.768	S	S	*	*			trans	-153.4	8.1	-166.7	0	0	0	0	0	118	I698	I698-G700 VanDerWaalsContact C-N 3.3Å; I698-G700 PolarHBondContact O-N 2.98Å
701	M	27.1	Very low	32.5	Very low	177 Å²	177	130.9 Å²	130.9	87%	0.872	77%	0.773	S	S	*	*			trans	-144.9	114.6	174.1	-109.1	-65.8	175.1	0	0	112.2
702	C	27.1	Very low	31.6	Very low	119 Å²	119	133.6 Å²	133.6	80%	0.804	78%	0.781	S	S	*	*			trans	-85.5	128	169.3	-64.2	0	0	0	0	109.7	Y704	C702-Y704 PolarHBondContact O-N 3.41Å
703	P	34.5	Very low	30.9	Very low	108 Å²	108	135 Å²	135	70%	0.701	80%	0.799	S	S	*	*			trans	-71.3	130.1	170.2	30	-32.9	0	0	0	109.8
704	Y	29	Very low	30.4	Very low	222 Å²	222	137 Å²	137	87%	0.871	81%	0.811	S	S	*	*			trans	168.6	153.7	140.9	-88	-55.7	0	0	0	111.3	C702	C702-Y704 PolarHBondContact O-N 3.41Å
705	L	26.4	Very low	30.1	Very low	168 Å²	168	138 Å²	138	88%	0.88	81%	0.81	S	S	*	*			trans	80.5	153.1	173	-61.4	170.6	0	0	0	117.1
706	P	32.4	Very low	29.9	Very low	110 Å²	110	138.9 Å²	138.9	71%	0.714	81%	0.814	S	S	*	*			trans	-110.6	177.5	-140.3	41.7	-36.7	0	0	0	116.3
707	T	38.3	Very low	29.7	Very low	137 Å²	137	139.6 Å²	139.6	84%	0.84	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-53.1	125.8	-179.6	41.3	0	0	0	0	115.5
708	P	26.8	Very low	29.9	Very low	123 Å²	123	134.8 Å²	134.8	80%	0.799	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-84.8	141.8	156.2	33.6	-30.3	0	0	0	110.5
709	S	33.1	Very low	30.3	Very low	102 Å²	102	134.8 Å²	134.8	71%	0.713	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-95.6	164.9	173.3	50	0	0	0	0	111.7
710	N	28.3	Very low	31.2	Very low	158 Å²	158	134.1 Å²	134.1	85%	0.845	80%	0.8	S	S	*	*			trans	71	87.6	167.6	-56.6	-18.7	0	0	0	118.1
711	G	29.9	Very low	32	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	79%	0.786	S	S	*	*				84.3	88.2	94	0	0	0	0	0	119.7
712	T	25.6	Very low	33.3	Very low	138 Å²	138	132.6 Å²	132.6	85%	0.847	78%	0.783	S	S	*	*			trans	-149.6	140.4	135.8	13	0	0	0	0	109.2	A714	T712-A714 PolarHBondContact O-N 3.26Å
713	P	32.1	Very low	35.3	Very low	135 Å²	135	128.2 Å²	128.2	88%	0.877	75%	0.752	S	S	*	*			trans	-82.3	114.5	179	31.6	-31.7	0	0	0	110.9
714	A	25.9	Very low	37.2	Very low	95 Å²	95	125.5 Å²	125.5	79%	0.785	74%	0.735	S	S	*	*			trans	-100.6	148.8	164.7	0	0	0	0	0	109.7	T712	T712-A714 PolarHBondContact O-N 3.26Å
715	L	29.4	Very low	39.4	Very low	174 Å²	174	122.2 Å²	122.2	91%	0.911	73%	0.725	S	S	*	*			trans	-38.7	140.5	-171.9	-66.3	157.6	0	0	0	115.5	D717	L715-D717 PolarHBondContact O-N 3.08Å
716	Q	30.6	Very low	41.6	Very low	190 Å²	190	116.5 Å²	116.5	89%	0.888	70%	0.702	S	S	*	*			trans	-67.1	106.9	177.3	-65.7	164.2	-51.4	0	0	111.2
717	D	28.1	Very low	43.9	Very low	155 Å²	155	112.3 Å²	112.3	83%	0.829	67%	0.672	S	S	*	*			trans	-62.9	141.3	142.6	-78.5	-46.1	0	0	0	108	L715	L715-D717 PolarHBondContact O-N 3.08Å
718	A	32.8	Very low	46	Very low	88 Å²	88	108.9 Å²	108.9	73%	0.727	65%	0.647	S	S	*	*			trans	-71.8	133.9	-174.4	0	0	0	0	0	111.2	I720	A718-I720 VanDerWaalsContact C-N 3.35Å; A718-I720 PolarHBondContact O-N 3.37Å
719	D	38.1	Very low	48.7	Very low	157 Å²	157	108.3 Å²	108.3	84%	0.84	63%	0.632	S	S	*	*			trans	-62.3	86.6	178.4	-66.1	-70	0	0	0	112	P721	D719-P721 WeakPolarHBondContact O-CD 3.45Å
720	I	47.1	Very low	51.1	Low	123 Å²	123	103.6 Å²	103.6	63%	0.631	60%	0.599	S	S	*	*			trans	-68.2	116.2	164.9	-57.9	176.7	0	0	0	106.6	A718 N722	A718-I720 VanDerWaalsContact C-N 3.35Å; A718-I720 PolarHBondContact O-N 3.37Å; I720-N722 PolarHBondContact O-N 2.65Å
721	P	50	Low	53.9	Low	54 Å²	54	96.1 Å²	96.1	35%	0.351	56%	0.559	S	S	.	*			trans	-69.3	125.8	-174.7	27.2	-33.3	0	0	0	110.1	D719 L723 M753	D719-P721 WeakPolarHBondContact O-CD 3.45Å; P721-L723 PolarHBondContact O-N 2.78Å; P721-M753 HydrophobicContact CG-CE 3.89Å
722	N	54.9	Low	56.7	Low	153 Å²	153	94.1 Å²	94.1	82%	0.818	53%	0.529	S	S	*	.			trans	-61.6	110.5	172.7	-79.7	-31.2	0	0	0	110	Q677 I720	Q677-N722 PolarHBondContact NE2-O 3.44Å; I720-N722 PolarHBondContact O-N 2.65Å
723	L	68.9	Low	59.7	Low	26 Å²	26	88.3 Å²	88.3	14%	0.136	49%	0.492	C	S	.	.			trans	-93.1	131.3	177.9	-64.8	168.2	0	0	0	109.5	P721 R727 M728 L731	P721-L723 PolarHBondContact O-N 2.78Å; L723-R727 HydrophobicContact CD2-CG 4.11Å; L723-M728 HydrophobicContact CB-CB 4.31Å; L723-M728 HydrophobicContact CB-CE 4.26Å; L723-L731 HydrophobicContact CD1-CD1 3.91Å; L723-L731 HydrophobicContact CD2-CD1 4.17Å
724	C	73.1	Confident	62.4	Low	51 Å²	51	81.9 Å²	81.9	35%	0.345	45%	0.451	S	S	.	.			trans	-63.6	154.2	172.2	67.6	0	0	0	0	111.8	A726 R727 M728	C724-A726 VanDerWaalsContact C-N 3.25Å; C724-A726 PolarHBondContact O-N 3.37Å; C724-A726 VanDerWaalsContact O-N 3.14Å; C724-R727 PolarHBondContact O-N 2.85Å; C724-R727 VanDerWaalsContact O-N 3.08Å; C724-R727 WeakPolarHBondContact SG-CB 3.33Å; C724-M728 PolarHBondContact O-N 2.98Å
725	K	74.9	Confident	65.6	Low	154 Å²	154	77.8 Å²	77.8	67%	0.67	42%	0.416	S	S	*	.	H	α-helix	trans	-47.2	-46.8	-177.8	-69.2	-175.3	-179.2	-179.1	0	112.3	E692 M728 K729	E692-K725 IonicContact OE1-NZ 2.76Å; E692-K725 PolarHBondContact OE1-NZ 2.95Å; K725-M728 PolarHBondContact O-N 2.65Å; K725-K729 PolarHBondContact O-N 3.1Å
726	A	73	Confident	68.5	Low	47 Å²	47	69.5 Å²	69.5	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-48.4	179.8	0	0	0	0	0	113.3	C724 M728 K729 A730	C724-A726 VanDerWaalsContact C-N 3.25Å; C724-A726 PolarHBondContact O-N 3.37Å; C724-A726 VanDerWaalsContact O-N 3.14Å; A726-M728 VanDerWaalsContact C-N 3.35Å; A726-M728 PolarHBondContact O-N 2.9Å; A726-K729 PolarHBondContact O-N 3.24Å; A726-A730 WeakPolarHBondContact O-CB 3.3Å; A726-A730 PolarHBondContact O-N 3.21Å
727	R	80.7	Confident	71.4	Confident	23 Å²	23	61.1 Å²	61.1	9%	0.087	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-34.9	178	-171.7	170.8	168.4	154.9	-7	111.6	L637 L673 Q675 L723 C724 A730 L731	L637-R727 HydrophobicContact CD1-CB 4.27Å; L637-R727 HydrophobicContact CD2-CB 4.33Å; L673-R727 PolarHBondContact O-NH2 2.98Å; Q675-R727 PolarHBondContact O-NH1 2.9Å; L723-R727 HydrophobicContact CD2-CG 4.11Å; C724-R727 PolarHBondContact O-N 2.85Å; C724-R727 VanDerWaalsContact O-N 3.08Å; C724-R727 WeakPolarHBondContact SG-CB 3.33Å; R727-A730 PolarHBondContact O-N 3.36Å; R727-L731 HydrophobicContact CG-CD1 4.09Å; R727-L731 WeakPolarHBondContact O-CB 3.47Å; R727-L731 VanDerWaalsContact O-CG 3.24Å; R727-L731 WeakPolarHBondContact O-CG 3.32Å; R727-L731 PolarHBondContact O-N 3.26Å
728	M	83.6	Confident	74.4	Confident	64 Å²	64	53.7 Å²	53.7	32%	0.315	29%	0.294	S	S	.	.	H	α-helix	trans	-66.1	-43.8	173.5	-171.5	177.5	-70.7	0	0	111.8	L723 C724 K725 A726 L731 Q732	L723-M728 HydrophobicContact CB-CB 4.31Å; L723-M728 HydrophobicContact CB-CE 4.26Å; C724-M728 PolarHBondContact O-N 2.98Å; K725-M728 PolarHBondContact O-N 2.65Å; A726-M728 VanDerWaalsContact C-N 3.35Å; A726-M728 PolarHBondContact O-N 2.9Å; M728-L731 PolarHBondContact O-N 3.38Å; M728-Q732 WeakPolarHBondContact O-CG 3.47Å; M728-Q732 PolarHBondContact O-N 2.94Å
729	K	82.6	Confident	77.3	Confident	112 Å²	112	49.6 Å²	49.6	49%	0.487	26%	0.259	S	S	.	.	H	α-helix	trans	-59.1	-46.8	173.2	179.6	176.5	174.9	-176.6	0	111.2	K725 A726 L731 Q732 E733	K725-K729 PolarHBondContact O-N 3.1Å; A726-K729 PolarHBondContact O-N 3.24Å; K729-L731 VanDerWaalsContact C-N 3.29Å; K729-L731 PolarHBondContact O-N 2.91Å; K729-Q732 PolarHBondContact O-N 3.34Å; K729-E733 WeakPolarHBondContact CE-OE1 3.35Å; K729-E733 VanDerWaalsContact CG-OE1 3.3Å; K729-E733 WeakPolarHBondContact CG-OE1 3.3Å; K729-E733 WeakPolarHBondContact O-CG 3.47Å; K729-E733 PolarHBondContact O-N 3.21Å
730	A	83.4	Confident	79.7	Confident	2 Å²	2	42.8 Å²	42.8	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-59.8	-36.1	177.5	0	0	0	0	0	113.5	L637 N655 F657 A726 R727 E733 A734	L637-A730 HydrophobicContact CD2-CB 4.27Å; N655-A730 HydrophobicContact CB-CB 4.32Å; N655-A730 VanDerWaalsContact ND2-CA 3.34Å; N655-A730 WeakPolarHBondContact ND2-CA 3.41Å; N655-A730 PolarHBondContact ND2-O 3.03Å; N655-A730 VanDerWaalsContact ND2-O 3.09Å; F657-A730 HydrophobicContact CD2-CB 4.44Å; A726-A730 WeakPolarHBondContact O-CB 3.3Å; A726-A730 PolarHBondContact O-N 3.21Å; R727-A730 PolarHBondContact O-N 3.36Å; A730-E733 WeakPolarHBondContact O-CB 3.47Å; A730-A734 WeakPolarHBondContact O-CB 3.45Å; A730-A734 PolarHBondContact O-N 3.37Å
731	L	88.3	Confident	81.8	Confident	1 Å²	1	37 Å²	37	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-80.6	-26.2	177.5	-65.9	169.5	0	0	0	113.4	F657 L673 L723 R727 M728 K729 A734 S735 L750 V755	F657-L731 HydrophobicContact CB-CD2 4.06Å; F657-L731 HydrophobicContact CD1-CD2 3.82Å; F657-L731 HydrophobicContact CG-CD2 4.01Å; L673-L731 HydrophobicContact CD2-CD1 4.07Å; L673-L731 HydrophobicContact CD2-CD2 3.96Å; L723-L731 HydrophobicContact CD1-CD1 3.91Å; L723-L731 HydrophobicContact CD2-CD1 4.17Å; R727-L731 HydrophobicContact CG-CD1 4.09Å; R727-L731 WeakPolarHBondContact O-CB 3.47Å; R727-L731 VanDerWaalsContact O-CG 3.24Å; R727-L731 WeakPolarHBondContact O-CG 3.32Å; R727-L731 PolarHBondContact O-N 3.26Å; M728-L731 PolarHBondContact O-N 3.38Å; K729-L731 VanDerWaalsContact C-N 3.29Å; K729-L731 PolarHBondContact O-N 2.91Å; L731-A734 PolarHBondContact O-N 3.31Å; L731-S735 PolarHBondContact O-N 3.48Å; L731-L750 HydrophobicContact CD2-CD2 3.75Å; L731-V755 HydrophobicContact CB-CG2 3.77Å
732	Q	88.6	Confident	83.7	Confident	35 Å²	35	34.7 Å²	34.7	16%	0.164	18%	0.179	C	C	.	.	H	α-helix	trans	-69.9	-37.1	167.1	-72	177.9	15.5	0	0	112.1	L194 M728 K729 S735 Y736 V755	L194-Q732 HydrophobicContact CD1-CB 4.4Å; M728-Q732 WeakPolarHBondContact O-CG 3.47Å; M728-Q732 PolarHBondContact O-N 2.94Å; K729-Q732 PolarHBondContact O-N 3.34Å; Q732-S735 PolarHBondContact O-OG 2.82Å; Q732-S735 VanDerWaalsContact O-OG 3.1Å; Q732-Y736 PolarHBondContact O-N 3.36Å; Q732-V755 HydrophobicContact CG-CG1 3.9Å
733	E	87.1	Confident	85.5	Confident	15 Å²	15	28.7 Å²	28.7	7%	0.07	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-50.2	169.1	-70.3	157	-170	0	0	109.2	R639 N655 K729 A730 S735 Y736 Y737	R639-E733 IonicContact NH2-OE1 3.92Å; R639-E733 PolarHBondContact NH2-OE1 3.42Å; R639-E733 VanDerWaalsContact NH2-OE1 3.07Å; R639-E733 IonicContact NH2-OE2 3.55Å; R639-E733 PolarHBondContact NH2-OE2 3.03Å; N655-E733 PolarHBondContact ND2-OE2 3.48Å; K729-E733 WeakPolarHBondContact CE-OE1 3.35Å; K729-E733 VanDerWaalsContact CG-OE1 3.3Å; K729-E733 WeakPolarHBondContact CG-OE1 3.3Å; K729-E733 WeakPolarHBondContact O-CG 3.47Å; K729-E733 PolarHBondContact O-N 3.21Å; A730-E733 WeakPolarHBondContact O-CB 3.47Å; E733-S735 PolarHBondContact O-N 3.03Å; E733-Y736 PolarHBondContact O-N 3.08Å; E733-Y737 HydrophobicContact CB-CE2 4.32Å; E733-Y737 WeakPolarHBondContact O-CD2 3.25Å; E733-Y737 PolarHBondContact O-N 3.14Å; E733-Y737 VanDerWaalsContact O-N 3.14Å
734	A	90.1	Very high	86.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.7	-36	178.2	0	0	0	0	0	114.5	F657 A661 A730 L731 S738 L750	F657-A734 HydrophobicContact CB-CB 4.18Å; A661-A734 HydrophobicContact CB-CB 3.82Å; A661-A734 WeakPolarHBondContact CB-O 3.44Å; A730-A734 WeakPolarHBondContact O-CB 3.45Å; A730-A734 PolarHBondContact O-N 3.37Å; L731-A734 PolarHBondContact O-N 3.31Å; A734-S738 PolarHBondContact O-N 3.08Å; A734-S738 PolarHBondContact O-OG 3.34Å; A734-L750 HydrophobicContact CB-CD1 4.02Å
735	S	91.4	Very high	87.5	Confident	9 Å²	9	29.2 Å²	29.2	6%	0.063	15%	0.145	C	C	.	.	H	α-helix	trans	-71.2	-36.7	177.9	69.6	0	0	0	0	112.4	L731 Q732 E733 S738 A739	L731-S735 PolarHBondContact O-N 3.48Å; Q732-S735 PolarHBondContact O-OG 2.82Å; Q732-S735 VanDerWaalsContact O-OG 3.1Å; E733-S735 PolarHBondContact O-N 3.03Å; S735-S738 WeakPolarHBondContact CA-OG 3.46Å; S735-S738 PolarHBondContact O-OG 3.35Å; S735-A739 WeakPolarHBondContact O-CB 3.49Å; S735-A739 PolarHBondContact O-N 2.88Å
736	Y	91.3	Very high	88.3	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-60.7	-50.7	171.6	172.1	-100.4	0	0	0	112.1	L194 K196 K198 Q732 E733 S738 A739 E740 H760 V761	L194-Y736 VanDerWaalsContact CD2-CB 3.43Å; L194-Y736 HydrophobicContact CD2-CD1 3.87Å; L194-Y736 HydrophobicContact CD2-CD2 4.14Å; L194-Y736 HydrophobicContact CD2-CG 3.57Å; K196-Y736 PolarHBondContact O-OH 3.49Å; K198-Y736 HydrophobicContact CG-CE1 4.39Å; Q732-Y736 PolarHBondContact O-N 3.36Å; E733-Y736 PolarHBondContact O-N 3.08Å; Y736-S738 PolarHBondContact O-N 3.39Å; Y736-A739 PolarHBondContact O-N 3.27Å; Y736-E740 HydrophobicContact CE2-CG 4.45Å; Y736-E740 PolarHBondContact O-N 3.19Å; Y736-H760 AromaticContact CD2-CD2 3.66Å; Y736-H760 AromaticContact CE2-CD2 3.48Å; Y736-H760 VanDerWaalsContact CE2-CD2 3.48Å; Y736-H760 WeakPolarHBondContact CE2-CD2 3.5Å; Y736-H760 AromaticContact CE2-NE2 3.77Å; Y736-V761 HydrophobicContact CD2-CG2 4.19Å
737	Y	90.7	Very high	89.2	Confident	14 Å²	14	20 Å²	20	6%	0.055	10%	0.097	C	C	.	.	H	α-helix	trans	-67.2	-35.2	-177.7	-66.4	-60.5	0	0	0	113.4	E226 M654 E733 H741	E226-Y737 WeakPolarHBondContact OE1-CD1 3.37Å; E226-Y737 VanDerWaalsContact OE1-CE1 3.23Å; E226-Y737 WeakPolarHBondContact OE1-CE1 3.1Å; M654-Y737 HydrophobicContact CE-CD1 3.73Å; M654-Y737 HydrophobicContact CE-CD2 3.81Å; M654-Y737 HydrophobicContact CE-CE1 3.46Å; M654-Y737 VanDerWaalsContact CE-CE1 3.46Å; M654-Y737 HydrophobicContact CE-CE2 3.54Å; M654-Y737 HydrophobicContact CE-CG 3.89Å; M654-Y737 HydrophobicContact SD-CD2 3.85Å; M654-Y737 HydrophobicContact SD-CE2 3.55Å; M654-Y737 VanDerWaalsContact SD-CE2 3.55Å; M654-Y737 HydrophobicContact SD-CG 4.46Å; E733-Y737 HydrophobicContact CB-CE2 4.32Å; E733-Y737 WeakPolarHBondContact O-CD2 3.25Å; E733-Y737 PolarHBondContact O-N 3.14Å; E733-Y737 VanDerWaalsContact O-N 3.14Å; Y737-H741 WeakPolarHBondContact O-CB 3.3Å; Y737-H741 VanDerWaalsContact O-CG 3.28Å; Y737-H741 PolarHBondContact O-N 3.1Å
738	S	92.9	Very high	89.7	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-71.8	-28.6	172.9	45.8	0	0	0	0	113.4	A734 S735 Y736 G742 Y743 T747	A734-S738 PolarHBondContact O-N 3.08Å; A734-S738 PolarHBondContact O-OG 3.34Å; S735-S738 WeakPolarHBondContact CA-OG 3.46Å; S735-S738 PolarHBondContact O-OG 3.35Å; Y736-S738 PolarHBondContact O-N 3.39Å; S738-G742 PolarHBondContact O-N 3.46Å; S738-Y743 PolarHBondContact O-N 3.15Å; S738-T747 VanDerWaalsContact C-CG2 3.45Å; S738-T747 WeakPolarHBondContact OG-CG2 3.49Å
739	A	91.9	Very high	90	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.008	10%	0.096	C	C	.	.	H	α-helix	trans	-72.6	-50.2	174.5	0	0	0	0	0	112.3	S735 Y736 H741 G742 T747 V761 E764	S735-A739 WeakPolarHBondContact O-CB 3.49Å; S735-A739 PolarHBondContact O-N 2.88Å; Y736-A739 PolarHBondContact O-N 3.27Å; A739-H741 PolarHBondContact O-N 2.75Å; A739-G742 PolarHBondContact O-N 3.22Å; A739-T747 HydrophobicContact CB-CG2 3.77Å; A739-T747 VanDerWaalsContact N-CG2 3.26Å; A739-V761 HydrophobicContact CB-CB 4.44Å; A739-V761 HydrophobicContact CB-CG1 3.73Å; A739-E764 HydrophobicContact CB-CB 4.41Å
740	E	90.3	Very high	90.3	Very high	14 Å²	14	14.6 Å²	14.6	7%	0.065	7%	0.074	C	C	.	.	H	α-helix	trans	-54.1	-40.6	176.1	-99.6	-84.1	160.9	0	0	112	G197 K198 G209 Y736 G742 H760	G197-E740 WeakPolarHBondContact CA-OE1 3.33Å; K198-E740 HydrophobicContact CD-CB 4.38Å; K198-E740 HydrophobicContact CD-CG 4.07Å; K198-E740 WeakPolarHBondContact CD-OE2 3.19Å; K198-E740 HydrophobicContact CG-CG 3.96Å; K198-E740 PolarHBondContact N-OE1 3.29Å; G209-E740 CarbonylContact C-O 3.57Å; G209-E740 VanDerWaalsContact CA-O 3.3Å; G209-E740 WeakPolarHBondContact CA-O 3.5Å; G209-E740 PolarHBondContact N-OE2 2.62Å; Y736-E740 HydrophobicContact CE2-CG 4.45Å; Y736-E740 PolarHBondContact O-N 3.19Å; E740-G742 VanDerWaalsContact C-N 3.3Å; E740-G742 PolarHBondContact O-N 3.42Å; E740-H760 IonicContact OE1-NE2 3.35Å
741	H	90.9	Very high	90.6	Very high	2 Å²	2	16.7 Å²	16.7	1%	0.009	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	3.4	-179.8	-56.2	173	0	0	0	113.3	K198 F212 R213 E226 A662 Y737 A739 Y743	K198-H741 PolarHBondContact NZ-NE2 3.48Å; F212-H741 AromaticContact CD1-CE1 3.23Å; F212-H741 WeakPolarHBondContact CD1-CE1 3.46Å; F212-H741 AromaticContact CD1-CG 3.77Å; F212-H741 AromaticContact CD1-ND1 3.17Å; F212-H741 WeakPolarHBondContact CD1-ND1 3.21Å; F212-H741 AromaticContact CD1-NE2 3.84Å; F212-H741 AromaticContact CD2-CE1 3.64Å; F212-H741 AromaticContact CD2-NE2 3.92Å; F212-H741 AromaticContact CE1-CE1 3.44Å; F212-H741 VanDerWaalsContact CE1-CE1 3.44Å; F212-H741 WeakPolarHBondContact CE1-CE1 3.23Å; F212-H741 AromaticContact CE1-ND1 3.39Å; F212-H741 WeakPolarHBondContact CE1-ND1 3.4Å; F212-H741 AromaticContact CE2-CE1 3.82Å; F212-H741 AromaticContact CG-CE1 3.35Å; F212-H741 WeakPolarHBondContact CG-CE1 3.48Å; F212-H741 AromaticContact CG-ND1 3.75Å; F212-H741 AromaticContact CG-NE2 3.57Å; F212-H741 AromaticContact CZ-CE1 3.74Å; R213-H741 HydrophobicContact CB-CB 4.48Å; R213-H741 WeakPolarHBondContact CB-O 3.3Å; R213-H741 VanDerWaalsContact CG-O 3.3Å; R213-H741 WeakPolarHBondContact CG-O 3.23Å; R213-H741 PolarHBondContact NH1-O 3.03Å; R213-H741 VanDerWaalsContact NH1-O 3.14Å; E226-H741 IonicContact OE1-CE1 2.81Å; A662-H741 PolarHBondContact O-ND1 3.42Å; Y737-H741 WeakPolarHBondContact O-CB 3.3Å; Y737-H741 VanDerWaalsContact O-CG 3.28Å; Y737-H741 PolarHBondContact O-N 3.1Å; A739-H741 PolarHBondContact O-N 2.75Å; H741-Y743 VanDerWaalsContact C-N 3.34Å; H741-Y743 HydrophobicContact CB-CD2 3.67Å; H741-Y743 HydrophobicContact CB-CE2 3.63Å; H741-Y743 PolarHBondContact O-N 3.03Å
742	G	90.1	Very high	90.6	Very high	6 Å²	6	20.6 Å²	20.6	6%	0.062	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	22.4	175.5	0	0	0	0	0	115.7	R213 S738 A739 E740 L744 C768 Q772	R213-G742 VanDerWaalsContact NH1-C 3.29Å; R213-G742 PolarHBondContact NH1-O 2.62Å; S738-G742 PolarHBondContact O-N 3.46Å; A739-G742 PolarHBondContact O-N 3.22Å; E740-G742 VanDerWaalsContact C-N 3.3Å; E740-G742 PolarHBondContact O-N 3.42Å; G742-L744 PolarHBondContact O-N 2.99Å; G742-C768 WeakPolarHBondContact CA-SG 3.27Å; G742-Q772 PolarHBondContact O-NE2 2.88Å
743	Y	92.3	Very high	90.3	Very high	27 Å²	27	22.2 Å²	22.2	11%	0.106	12%	0.124	C	C	.	.			trans	-80	60.3	172.2	-64.1	-67.2	0	0	0	110.8	R213 A662 S738 H741 D745 V746 T747	R213-Y743 HydrophobicContact CG-CE1 4.48Å; R213-Y743 HydrophobicContact CG-CE2 4.4Å; A662-Y743 VanDerWaalsContact O-CE2 3.25Å; A662-Y743 WeakPolarHBondContact O-CE2 3.49Å; S738-Y743 PolarHBondContact O-N 3.15Å; H741-Y743 VanDerWaalsContact C-N 3.34Å; H741-Y743 HydrophobicContact CB-CD2 3.67Å; H741-Y743 HydrophobicContact CB-CE2 3.63Å; H741-Y743 PolarHBondContact O-N 3.03Å; Y743-D745 PolarHBondContact O-N 3.37Å; Y743-D745 VanDerWaalsContact O-N 3.11Å; Y743-V746 WeakPolarHBondContact O-CA 3.17Å; Y743-V746 WeakPolarHBondContact O-CB 3.35Å; Y743-V746 PolarHBondContact O-N 2.9Å; Y743-T747 PolarHBondContact O-N 2.85Å; Y743-T747 VanDerWaalsContact O-N 3.1Å
744	L	91.6	Very high	90.1	Very high	3 Å²	3	23 Å²	23	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-50.4	-37	-178.9	179.5	66	0	0	0	113.6	G742 V746 T747 M748 A769 K774 A777 L781	G742-L744 PolarHBondContact O-N 2.99Å; L744-V746 PolarHBondContact O-N 3.37Å; L744-T747 WeakPolarHBondContact CA-OG1 3.33Å; L744-T747 PolarHBondContact O-N 2.99Å; L744-T747 PolarHBondContact O-OG1 3.26Å; L744-T747 VanDerWaalsContact O-OG1 3.12Å; L744-M748 HydrophobicContact CD1-CG 3.9Å; L744-M748 HydrophobicContact CD1-SD 4.2Å; L744-M748 HydrophobicContact CG-CG 4.25Å; L744-M748 WeakPolarHBondContact O-CG 3.43Å; L744-M748 PolarHBondContact O-N 3.42Å; L744-A769 HydrophobicContact CD1-CB 4.46Å; L744-A769 HydrophobicContact CD2-CB 3.66Å; L744-K774 HydrophobicContact CD2-CD 3.82Å; L744-A777 HydrophobicContact CD2-CB 4.07Å; L744-L781 HydrophobicContact CD1-CD1 4.41Å
745	D	91.2	Very high	89.9	Confident	85 Å²	85	23.2 Å²	23.2	46%	0.455	14%	0.137	S	C	.	.	H	α-helix	trans	-72.4	-10.9	-179.9	-55.5	-34.5	0	0	0	112.9	Y743 K774	Y743-D745 PolarHBondContact O-N 3.37Å; Y743-D745 VanDerWaalsContact O-N 3.11Å; D745-K774 IonicContact OD1-NZ 2.78Å; D745-K774 PolarHBondContact OD1-NZ 3.2Å; D745-K774 IonicContact OD2-NZ 2.65Å; D745-K774 PolarHBondContact OD2-NZ 3.47Å
746	V	91.9	Very high	89.6	Confident	7 Å²	7	25.8 Å²	25.8	4%	0.042	15%	0.154	C	C	.	.	H	α-helix	trans	-95.8	-40.9	169.8	177.6	0	0	0	0	110.9	A661 R666 L669 Y743 L744 E749 L750	A661-V746 HydrophobicContact CB-CG1 4.11Å; R666-V746 HydrophobicContact CB-CG2 4.26Å; L669-V746 HydrophobicContact CD2-CG1 3.58Å; Y743-V746 WeakPolarHBondContact O-CA 3.17Å; Y743-V746 WeakPolarHBondContact O-CB 3.35Å; Y743-V746 PolarHBondContact O-N 2.9Å; L744-V746 PolarHBondContact O-N 3.37Å; V746-E749 PolarHBondContact O-N 2.81Å; V746-L750 HydrophobicContact CG1-CD1 4.1Å; V746-L750 HydrophobicContact CG1-CG 4.47Å; V746-L750 WeakPolarHBondContact O-CG 3.45Å; V746-L750 PolarHBondContact O-N 2.98Å
747	T	92.4	Very high	89.4	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-45.1	178.6	64.6	0	0	0	0	111.9	S738 A739 Y743 L744 E749 L750 H751 S765	S738-T747 VanDerWaalsContact C-CG2 3.45Å; S738-T747 WeakPolarHBondContact OG-CG2 3.49Å; A739-T747 HydrophobicContact CB-CG2 3.77Å; A739-T747 VanDerWaalsContact N-CG2 3.26Å; Y743-T747 PolarHBondContact O-N 2.85Å; Y743-T747 VanDerWaalsContact O-N 3.1Å; L744-T747 WeakPolarHBondContact CA-OG1 3.33Å; L744-T747 PolarHBondContact O-N 2.99Å; L744-T747 PolarHBondContact O-OG1 3.26Å; L744-T747 VanDerWaalsContact O-OG1 3.12Å; T747-E749 VanDerWaalsContact C-N 3.28Å; T747-E749 PolarHBondContact O-N 2.93Å; T747-L750 PolarHBondContact O-N 2.87Å; T747-H751 PolarHBondContact O-N 3.22Å; T747-S765 PolarHBondContact OG1-OG 2.82Å
748	M	91	Very high	89.2	Confident	40 Å²	40	29.3 Å²	29.3	20%	0.197	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-31.5	176.7	-62.9	-56.6	-56.9	0	0	112.3	L744 A752 W757 L781	L744-M748 HydrophobicContact CD1-CG 3.9Å; L744-M748 HydrophobicContact CD1-SD 4.2Å; L744-M748 HydrophobicContact CG-CG 4.25Å; L744-M748 WeakPolarHBondContact O-CG 3.43Å; L744-M748 PolarHBondContact O-N 3.42Å; M748-A752 WeakPolarHBondContact O-CB 3.47Å; M748-A752 PolarHBondContact O-N 2.91Å; M748-W757 HydrophobicContact CE-CZ2 4.22Å; M748-W757 HydrophobicContact SD-CH2 3.82Å; M748-W757 HydrophobicContact SD-CZ2 3.84Å; M748-L781 HydrophobicContact CE-CD2 4.4Å; M748-L781 HydrophobicContact CE-CG 4.44Å; M748-L781 HydrophobicContact SD-CD1 4.37Å; M748-L781 HydrophobicContact SD-CD2 3.75Å; M748-L781 HydrophobicContact SD-CG 3.98Å
749	E	90.1	Very high	88.8	Confident	42 Å²	42	29.8 Å²	29.8	20%	0.196	17%	0.172	C	C	.	.	H	α-helix	trans	-75.7	-36.6	176	-174	163.9	155.1	0	0	112	R666 R670 V746 T747 A752 M753	R666-E749 IonicContact CZ-OE2 3.23Å; R666-E749 IonicContact NE-OE2 2.64Å; R666-E749 PolarHBondContact NE-OE2 3.45Å; R666-E749 IonicContact NH2-OE2 2.59Å; R666-E749 PolarHBondContact NH2-OE2 3.45Å; R670-E749 IonicContact CZ-OE1 3.32Å; R670-E749 VanDerWaalsContact CZ-OE1 3.25Å; R670-E749 IonicContact CZ-OE2 3.47Å; R670-E749 IonicContact NE-OE1 3.63Å; R670-E749 PolarHBondContact NE-OE1 3.25Å; R670-E749 IonicContact NE-OE2 3.13Å; R670-E749 IonicContact NH2-OE1 3.64Å; R670-E749 PolarHBondContact NH2-OE1 2.94Å; R670-E749 IonicContact NH2-OE2 3.44Å; R670-E749 PolarHBondContact NH2-OE2 2.77Å; V746-E749 PolarHBondContact O-N 2.81Å; T747-E749 VanDerWaalsContact C-N 3.28Å; T747-E749 PolarHBondContact O-N 2.93Å; E749-A752 PolarHBondContact O-N 3.35Å; E749-M753 VanDerWaalsContact O-CG 3.31Å; E749-M753 WeakPolarHBondContact O-CG 3.32Å; E749-M753 PolarHBondContact O-N 3.46Å
750	L	89.6	Confident	88.6	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-41.3	170.7	-74.5	170.6	0	0	0	111.5	L669 L731 A734 V746 T747 M753 V755	L669-L750 HydrophobicContact CD2-CD1 4.44Å; L669-L750 HydrophobicContact CD2-CD2 4.12Å; L669-L750 HydrophobicContact CD2-CG 4.24Å; L731-L750 HydrophobicContact CD2-CD2 3.75Å; A734-L750 HydrophobicContact CB-CD1 4.02Å; V746-L750 HydrophobicContact CG1-CD1 4.1Å; V746-L750 HydrophobicContact CG1-CG 4.47Å; V746-L750 WeakPolarHBondContact O-CG 3.45Å; V746-L750 PolarHBondContact O-N 2.98Å; T747-L750 PolarHBondContact O-N 2.87Å; L750-M753 PolarHBondContact O-N 2.96Å; L750-V755 HydrophobicContact CB-CG2 4.41Å; L750-V755 WeakPolarHBondContact O-CB 3.25Å; L750-V755 VanDerWaalsContact O-CG2 3.26Å; L750-V755 WeakPolarHBondContact O-CG2 3.35Å; L750-V755 PolarHBondContact O-N 3.38Å
751	H	89.4	Confident	88.6	Confident	46 Å²	46	29.3 Å²	29.3	21%	0.213	17%	0.17	C	C	.	.	H	α-helix	trans	-62.6	-46.2	174.6	-177.4	52.7	0	0	0	111.9	T747 M753 G754 V755 W757 E784	T747-H751 PolarHBondContact O-N 3.22Å; H751-M753 PolarHBondContact O-N 3.48Å; H751-M753 VanDerWaalsContact O-N 3.08Å; H751-G754 PolarHBondContact O-N 3.24Å; H751-V755 PolarHBondContact ND1-O 3.43Å; H751-W757 HydrophobicContact CB-CH2 4.09Å; H751-W757 HydrophobicContact CB-CZ2 3.7Å; H751-W757 AromaticContact CD2-CE2 3.63Å; H751-W757 AromaticContact CD2-CZ2 3.7Å; H751-W757 AromaticContact CD2-NE1 3.31Å; H751-W757 PolarHBondContact CD2-NE1 3.44Å; H751-W757 VanDerWaalsContact CD2-NE1 3.31Å; H751-W757 AromaticContact CE1-CD1 3.54Å; H751-W757 AromaticContact CE1-NE1 3.41Å; H751-W757 PolarHBondContact CE1-NE1 3.47Å; H751-W757 AromaticContact CG-CE2 3.54Å; H751-W757 AromaticContact CG-CZ2 3.6Å; H751-W757 AromaticContact CG-NE1 3.59Å; H751-W757 AromaticContact ND1-CD1 3.88Å; H751-W757 AromaticContact ND1-CE2 3.82Å; H751-W757 AromaticContact ND1-NE1 3.63Å; H751-W757 AromaticContact NE2-CD1 3.76Å; H751-W757 AromaticContact NE2-CE2 3.99Å; H751-W757 AromaticContact NE2-NE1 3.22Å; H751-W757 PolarHBondContact NE2-NE1 2.7Å; H751-E784 IonicContact CD2-OE2 2.8Å; H751-E784 PolarHBondContact CD2-OE2 3.43Å; H751-E784 VanDerWaalsContact CD2-OE2 3.32Å; H751-E784 IonicContact NE2-OE2 2.67Å; H751-E784 PolarHBondContact NE2-OE2 3.16Å
752	A	87.8	Confident	88.6	Confident	84 Å²	84	29.2 Å²	29.2	69%	0.694	17%	0.169	S	C	*	.	H	α-helix	trans	-61.3	-17.7	176.9	0	0	0	0	0	114.2	M748 E749 G754	M748-A752 WeakPolarHBondContact O-CB 3.47Å; M748-A752 PolarHBondContact O-N 2.91Å; E749-A752 PolarHBondContact O-N 3.35Å; A752-G754 VanDerWaalsContact C-N 3.33Å
753	M	82.6	Confident	88.6	Confident	69 Å²	69	29 Å²	29	34%	0.34	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	8.9	172.3	-68.4	-64.2	-56.9	0	0	113.7	P721 E749 L750 H751	P721-M753 HydrophobicContact CG-CE 3.89Å; E749-M753 VanDerWaalsContact O-CG 3.31Å; E749-M753 WeakPolarHBondContact O-CG 3.32Å; E749-M753 PolarHBondContact O-N 3.46Å; L750-M753 PolarHBondContact O-N 2.96Å; H751-M753 PolarHBondContact O-N 3.48Å; H751-M753 VanDerWaalsContact O-N 3.08Å
754	G	82.6	Confident	88.5	Confident	32 Å²	32	29 Å²	29	33%	0.33	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.2	13.6	176.7	0	0	0	0	0	115.5	H751 A752 P756	H751-G754 PolarHBondContact O-N 3.24Å; A752-G754 VanDerWaalsContact C-N 3.33Å; G754-P756 WeakPolarHBondContact O-CD 3.47Å
755	V	86.3	Confident	88.6	Confident	3 Å²	3	28.9 Å²	28.9	2%	0.018	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-78	120.3	173.4	-178.8	0	0	0	0	109.4	L731 Q732 L750 H751	L731-V755 HydrophobicContact CB-CG2 3.77Å; Q732-V755 HydrophobicContact CG-CG1 3.9Å; L750-V755 HydrophobicContact CB-CG2 4.41Å; L750-V755 WeakPolarHBondContact O-CB 3.25Å; L750-V755 VanDerWaalsContact O-CG2 3.26Å; L750-V755 WeakPolarHBondContact O-CG2 3.35Å; L750-V755 PolarHBondContact O-N 3.38Å; H751-V755 PolarHBondContact ND1-O 3.43Å
756	P	84.9	Confident	88.6	Confident	64 Å²	64	24.9 Å²	24.9	42%	0.416	15%	0.145	S	C	.	.	P	Polyproline II helix	trans	-68.7	148	-178.3	28.2	-35.2	0	0	0	112	G754 K758	G754-P756 WeakPolarHBondContact O-CD 3.47Å; P756-K758 PolarHBondContact O-N 3.13Å
757	W	86.5	Confident	88.6	Confident	20 Å²	20	27.1 Å²	27.1	8%	0.076	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-65.6	131.9	172.8	-73.8	120.8	0	0	0	110.8	M748 H751 V761 W762 L781 E784 V788	M748-W757 HydrophobicContact CE-CZ2 4.22Å; M748-W757 HydrophobicContact SD-CH2 3.82Å; M748-W757 HydrophobicContact SD-CZ2 3.84Å; H751-W757 HydrophobicContact CB-CH2 4.09Å; H751-W757 HydrophobicContact CB-CZ2 3.7Å; H751-W757 AromaticContact CD2-CE2 3.63Å; H751-W757 AromaticContact CD2-CZ2 3.7Å; H751-W757 AromaticContact CD2-NE1 3.31Å; H751-W757 PolarHBondContact CD2-NE1 3.44Å; H751-W757 VanDerWaalsContact CD2-NE1 3.31Å; H751-W757 AromaticContact CE1-CD1 3.54Å; H751-W757 AromaticContact CE1-NE1 3.41Å; H751-W757 PolarHBondContact CE1-NE1 3.47Å; H751-W757 AromaticContact CG-CE2 3.54Å; H751-W757 AromaticContact CG-CZ2 3.6Å; H751-W757 AromaticContact CG-NE1 3.59Å; H751-W757 AromaticContact ND1-CD1 3.88Å; H751-W757 AromaticContact ND1-CE2 3.82Å; H751-W757 AromaticContact ND1-NE1 3.63Å; H751-W757 AromaticContact NE2-CD1 3.76Å; H751-W757 AromaticContact NE2-CE2 3.99Å; H751-W757 AromaticContact NE2-NE1 3.22Å; H751-W757 PolarHBondContact NE2-NE1 2.7Å; W757-V761 HydrophobicContact CE3-CG1 4.33Å; W757-V761 HydrophobicContact CZ3-CG1 4.17Å; W757-W762 HydrophobicContact CB-CB 4.41Å; W757-W762 HydrophobicContact CD2-CB 4.27Å; W757-W762 AromaticContact CD2-CD1 3.98Å; W757-W762 HydrophobicContact CE3-CB 4Å; W757-W762 HydrophobicContact CG-CB 4.45Å; W757-L781 HydrophobicContact CH2-CD2 3.58Å; W757-L781 HydrophobicContact CZ2-CD2 3.38Å; W757-L781 HydrophobicContact CZ3-CD2 4.28Å; W757-E784 PolarHBondContact NE1-OE2 3.04Å; W757-V788 HydrophobicContact CB-CG2 4.38Å
758	K	86.3	Confident	88.4	Confident	67 Å²	67	27.6 Å²	27.6	29%	0.291	16%	0.156	S	C	.	.	P	Polyproline II helix	trans	-102.8	140.4	160	-64.2	-171.7	-179	-174.2	0	107.8	L194 P756 H760 V761 W762	L194-K758 HydrophobicContact CB-CD 3.96Å; L194-K758 HydrophobicContact CD1-CD 4.38Å; L194-K758 VanDerWaalsContact CD1-NZ 3.26Å; P756-K758 PolarHBondContact O-N 3.13Å; K758-H760 VanDerWaalsContact C-N 3.31Å; K758-H760 PolarHBondContact O-N 2.88Å; K758-H760 VanDerWaalsContact O-N 3.17Å; K758-V761 HydrophobicContact CB-CB 4.47Å; K758-V761 HydrophobicContact CB-CG2 4.06Å; K758-V761 WeakPolarHBondContact O-CA 3.35Å; K758-V761 WeakPolarHBondContact O-CB 3.37Å; K758-V761 PolarHBondContact O-N 3.03Å; K758-W762 PolarHBondContact O-N 3.2Å
759	L	86.2	Confident	88.4	Confident	10 Å²	10	25.7 Å²	25.7	5%	0.052	15%	0.147	C	C	.	.	H	α-helix	trans	-47.7	-49.4	-172	175.9	56.7	0	0	0	113.3	V761 W762 L763 V788 D792 C794 L797	L759-V761 PolarHBondContact O-N 3.14Å; L759-W762 PolarHBondContact O-N 3.45Å; L759-L763 HydrophobicContact CD1-CD1 3.97Å; L759-L763 HydrophobicContact CD1-CG 4.06Å; L759-L763 HydrophobicContact CG-CD1 4.05Å; L759-L763 WeakPolarHBondContact O-CB 3.41Å; L759-L763 VanDerWaalsContact O-CG 3.27Å; L759-L763 WeakPolarHBondContact O-CG 3.49Å; L759-L763 PolarHBondContact O-N 2.79Å; L759-V788 HydrophobicContact CB-CG1 4.26Å; L759-V788 HydrophobicContact CD1-CG1 4.39Å; L759-D792 WeakPolarHBondContact CD2-O 3.4Å; L759-C794 HydrophobicContact CD2-CB 4.4Å; L759-L797 HydrophobicContact CD1-CB 4.3Å; L759-L797 HydrophobicContact CD1-CD1 4.36Å; L759-L797 HydrophobicContact CD1-CD2 4.39Å; L759-L797 HydrophobicContact CD2-CB 4.04Å; L759-L797 HydrophobicContact CD2-CD2 4.47Å
760	H	87.8	Confident	88.5	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.019	15%	0.147	C	C	.	.	H	α-helix	trans	-57.8	-46.5	175.8	177.6	72.2	0	0	0	113.3	G197 Y736 E740 K758 W762 L763 E764 E796	G197-H760 WeakPolarHBondContact CA-CE1 3.42Å; G197-H760 PolarHBondContact N-CE1 3.48Å; G197-H760 PolarHBondContact N-ND1 3Å; Y736-H760 AromaticContact CD2-CD2 3.66Å; Y736-H760 AromaticContact CE2-CD2 3.48Å; Y736-H760 VanDerWaalsContact CE2-CD2 3.48Å; Y736-H760 WeakPolarHBondContact CE2-CD2 3.5Å; Y736-H760 AromaticContact CE2-NE2 3.77Å; E740-H760 IonicContact OE1-NE2 3.35Å; K758-H760 VanDerWaalsContact C-N 3.31Å; K758-H760 PolarHBondContact O-N 2.88Å; K758-H760 VanDerWaalsContact O-N 3.17Å; H760-W762 VanDerWaalsContact C-N 3.31Å; H760-W762 PolarHBondContact O-N 2.91Å; H760-L763 PolarHBondContact O-N 2.85Å; H760-E764 PolarHBondContact O-N 3.43Å; H760-E796 WeakPolarHBondContact CB-OE2 3.32Å; H760-E796 IonicContact CE1-OE1 2.8Å; H760-E796 IonicContact CE1-OE2 3.36Å; H760-E796 IonicContact CG-OE2 3.91Å; H760-E796 VanDerWaalsContact ND1-CD 3.29Å; H760-E796 IonicContact ND1-OE1 3Å; H760-E796 PolarHBondContact ND1-OE1 3.45Å; H760-E796 VanDerWaalsContact ND1-OE1 3.12Å; H760-E796 IonicContact ND1-OE2 2.81Å; H760-E796 PolarHBondContact ND1-OE2 2.97Å
761	V	89.8	Confident	88.4	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-66.3	-35.6	-178	-174.9	0	0	0	0	111.2	Y736 A739 W757 K758 L759 S765	Y736-V761 HydrophobicContact CD2-CG2 4.19Å; A739-V761 HydrophobicContact CB-CB 4.44Å; A739-V761 HydrophobicContact CB-CG1 3.73Å; W757-V761 HydrophobicContact CE3-CG1 4.33Å; W757-V761 HydrophobicContact CZ3-CG1 4.17Å; K758-V761 HydrophobicContact CB-CB 4.47Å; K758-V761 HydrophobicContact CB-CG2 4.06Å; K758-V761 WeakPolarHBondContact O-CA 3.35Å; K758-V761 WeakPolarHBondContact O-CB 3.37Å; K758-V761 PolarHBondContact O-N 3.03Å; L759-V761 PolarHBondContact O-N 3.14Å; V761-S765 VanDerWaalsContact O-CB 3.25Å; V761-S765 WeakPolarHBondContact O-CB 3.36Å; V761-S765 PolarHBondContact O-N 3.28Å; V761-S765 VanDerWaalsContact O-N 3.11Å; V761-S765 PolarHBondContact O-OG 3.47Å
762	W	91.4	Very high	88.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.9	-44.9	172.4	-179.2	92	0	0	0	111.7	W757 K758 L759 H760 S765 L766 L781 L782 F785 M805	W757-W762 HydrophobicContact CB-CB 4.41Å; W757-W762 HydrophobicContact CD2-CB 4.27Å; W757-W762 AromaticContact CD2-CD1 3.98Å; W757-W762 HydrophobicContact CE3-CB 4Å; W757-W762 HydrophobicContact CG-CB 4.45Å; K758-W762 PolarHBondContact O-N 3.2Å; L759-W762 PolarHBondContact O-N 3.45Å; H760-W762 VanDerWaalsContact C-N 3.31Å; H760-W762 PolarHBondContact O-N 2.91Å; W762-S765 PolarHBondContact O-N 2.88Å; W762-L766 HydrophobicContact CH2-CD2 3.61Å; W762-L766 HydrophobicContact CZ2-CD2 4.16Å; W762-L766 HydrophobicContact CZ3-CD2 3.92Å; W762-L766 WeakPolarHBondContact O-CB 3.28Å; W762-L766 PolarHBondContact O-N 3.05Å; W762-L781 PolarHBondContact NE1-O 3.2Å; W762-L782 HydrophobicContact CH2-CD2 4.31Å; W762-L782 HydrophobicContact CZ2-CD2 4.16Å; W762-F785 HydrophobicContact CD2-CD2 4.23Å; W762-F785 AromaticContact CE2-CD2 3.9Å; W762-F785 HydrophobicContact CE3-CD2 4.12Å; W762-F785 HydrophobicContact CE3-CE2 4.42Å; W762-F785 HydrophobicContact CH2-CB 4.48Å; W762-F785 AromaticContact CH2-CD2 3.4Å; W762-F785 HydrophobicContact CH2-CD2 3.4Å; W762-F785 VanDerWaalsContact CH2-CD2 3.4Å; W762-F785 HydrophobicContact CH2-CE2 4.02Å; W762-F785 HydrophobicContact CH2-CG 4.27Å; W762-F785 HydrophobicContact CZ2-CB 3.85Å; W762-F785 AromaticContact CZ2-CD2 3.51Å; W762-F785 HydrophobicContact CZ2-CD2 3.51Å; W762-F785 HydrophobicContact CZ2-CG 4.11Å; W762-F785 AromaticContact CZ3-CD2 3.72Å; W762-F785 HydrophobicContact CZ3-CD2 3.72Å; W762-F785 AromaticContact CZ3-CE2 3.96Å; W762-F785 HydrophobicContact CZ3-CE2 3.96Å; W762-M805 HydrophobicContact CH2-SD 4.42Å
763	L	90	Very high	88.3	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.8	-48.5	178.7	-76.9	172.1	0	0	0	112.4	L759 H760 L766 R767 E796 L797 G801	L759-L763 HydrophobicContact CD1-CD1 3.97Å; L759-L763 HydrophobicContact CD1-CG 4.06Å; L759-L763 HydrophobicContact CG-CD1 4.05Å; L759-L763 WeakPolarHBondContact O-CB 3.41Å; L759-L763 VanDerWaalsContact O-CG 3.27Å; L759-L763 WeakPolarHBondContact O-CG 3.49Å; L759-L763 PolarHBondContact O-N 2.79Å; H760-L763 PolarHBondContact O-N 2.85Å; L763-L766 PolarHBondContact O-N 3.46Å; L763-R767 WeakPolarHBondContact O-CB 3.36Å; L763-R767 PolarHBondContact O-N 2.81Å; L763-E796 HydrophobicContact CD1-CG 4.36Å; L763-L797 HydrophobicContact CD2-CD1 4.31Å; L763-G801 VanDerWaalsContact CD2-CA 3.46Å
764	E	90.3	Very high	88.6	Confident	28 Å²	28	32.3 Å²	32.3	13%	0.131	17%	0.172	C	C	.	.	H	α-helix	trans	-72.1	-31.3	177.4	-68.6	-51.3	131.2	0	0	112.7	A739 H760 R767 C768	A739-E764 HydrophobicContact CB-CB 4.41Å; H760-E764 PolarHBondContact O-N 3.43Å; E764-R767 PolarHBondContact O-N 2.73Å; E764-R767 IonicContact OE1-CZ 3.25Å; E764-R767 IonicContact OE1-NE 2.86Å; E764-R767 PolarHBondContact OE1-NE 2.77Å; E764-R767 IonicContact OE1-NH2 3.69Å; E764-R767 PolarHBondContact OE1-NH2 2.77Å; E764-R767 VanDerWaalsContact OE2-CD 3.27Å; E764-R767 WeakPolarHBondContact OE2-CD 3.42Å; E764-R767 IonicContact OE2-CZ 3.33Å; E764-R767 IonicContact OE2-NE 3.45Å; E764-R767 PolarHBondContact OE2-NE 2.95Å; E764-C768 WeakPolarHBondContact O-CB 3.23Å; E764-C768 PolarHBondContact O-N 3.45Å; E764-C768 PolarHBondContact O-SG 3.12Å
765	S	92.4	Very high	88.8	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.007	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-42.4	169.8	-64.5	0	0	0	0	111.5	T747 V761 W762 C768 A769	T747-S765 PolarHBondContact OG1-OG 2.82Å; V761-S765 VanDerWaalsContact O-CB 3.25Å; V761-S765 WeakPolarHBondContact O-CB 3.36Å; V761-S765 PolarHBondContact O-N 3.28Å; V761-S765 VanDerWaalsContact O-N 3.11Å; V761-S765 PolarHBondContact O-OG 3.47Å; W762-S765 PolarHBondContact O-N 2.88Å; S765-C768 PolarHBondContact O-N 2.86Å; S765-A769 VanDerWaalsContact O-CB 3.28Å; S765-A769 WeakPolarHBondContact O-CB 3.09Å; S765-A769 PolarHBondContact O-N 3.24Å
766	L	92.1	Very high	88.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.4	-41.8	174.9	-178	65.4	0	0	0	111.6	W762 L763 A769 H770 I778 L781 L782 L804 M805 I808	W762-L766 HydrophobicContact CH2-CD2 3.61Å; W762-L766 HydrophobicContact CZ2-CD2 4.16Å; W762-L766 HydrophobicContact CZ3-CD2 3.92Å; W762-L766 WeakPolarHBondContact O-CB 3.28Å; W762-L766 PolarHBondContact O-N 3.05Å; L763-L766 PolarHBondContact O-N 3.46Å; L766-A769 PolarHBondContact O-N 3.41Å; L766-H770 WeakPolarHBondContact O-CB 3.33Å; L766-H770 PolarHBondContact O-N 3.38Å; L766-I778 HydrophobicContact CD1-CG2 4.06Å; L766-L781 HydrophobicContact CB-CD1 4.39Å; L766-L782 HydrophobicContact CD1-CD2 4.19Å; L766-L782 HydrophobicContact CD1-CG 4.35Å; L766-L782 HydrophobicContact CD2-CD2 4.24Å; L766-L804 HydrophobicContact CB-CD2 4.47Å; L766-L804 HydrophobicContact CD2-CD2 4.29Å; L766-L804 HydrophobicContact CG-CD2 4.25Å; L766-M805 HydrophobicContact CD2-CG 4.19Å; L766-I808 HydrophobicContact CD1-CD1 3.92Å; L766-I808 HydrophobicContact CD2-CD1 4.04Å; L766-I808 HydrophobicContact CG-CD1 3.83Å
767	R	90.6	Very high	89.1	Confident	54 Å²	54	34.9 Å²	34.9	20%	0.204	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-47.6	175.9	-163.1	-172.2	-50.9	-68.9	-2.1	111	L763 E764 H770 Q771 T800 L804	L763-R767 WeakPolarHBondContact O-CB 3.36Å; L763-R767 PolarHBondContact O-N 2.81Å; E764-R767 PolarHBondContact O-N 2.73Å; E764-R767 IonicContact OE1-CZ 3.25Å; E764-R767 IonicContact OE1-NE 2.86Å; E764-R767 PolarHBondContact OE1-NE 2.77Å; E764-R767 IonicContact OE1-NH2 3.69Å; E764-R767 PolarHBondContact OE1-NH2 2.77Å; E764-R767 VanDerWaalsContact OE2-CD 3.27Å; E764-R767 WeakPolarHBondContact OE2-CD 3.42Å; E764-R767 IonicContact OE2-CZ 3.33Å; E764-R767 IonicContact OE2-NE 3.45Å; E764-R767 PolarHBondContact OE2-NE 2.95Å; R767-H770 PolarHBondContact O-N 3.35Å; R767-Q771 WeakPolarHBondContact O-CG 3.37Å; R767-Q771 PolarHBondContact O-N 3.39Å; R767-T800 PolarHBondContact NH2-OG1 3.3Å; R767-L804 HydrophobicContact CB-CD2 3.8Å; R767-L804 HydrophobicContact CG-CD1 4.33Å; R767-L804 HydrophobicContact CG-CD2 4.23Å
768	C	89.1	Confident	89.2	Confident	11 Å²	11	34.1 Å²	34.1	7%	0.074	19%	0.19	C	C	.	.	H	α-helix	trans	-67	-38.3	178	-67.8	0	0	0	0	112.2	G742 E764 S765 H770 Q771 Q772	G742-C768 WeakPolarHBondContact CA-SG 3.27Å; E764-C768 WeakPolarHBondContact O-CB 3.23Å; E764-C768 PolarHBondContact O-N 3.45Å; E764-C768 PolarHBondContact O-SG 3.12Å; S765-C768 PolarHBondContact O-N 2.86Å; C768-H770 VanDerWaalsContact C-N 3.35Å; C768-Q771 PolarHBondContact O-N 2.93Å; C768-Q772 VanDerWaalsContact O-CB 3.29Å; C768-Q772 WeakPolarHBondContact O-CB 3.48Å; C768-Q772 VanDerWaalsContact O-CG 3.26Å; C768-Q772 WeakPolarHBondContact O-CG 3.2Å; C768-Q772 PolarHBondContact O-N 3.26Å
769	A	91.7	Very high	89.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.4	-38.6	175.2	0	0	0	0	0	112.1	L744 S765 L766 S773 K774 A777 I778 L781	L744-A769 HydrophobicContact CD1-CB 4.46Å; L744-A769 HydrophobicContact CD2-CB 3.66Å; S765-A769 VanDerWaalsContact O-CB 3.28Å; S765-A769 WeakPolarHBondContact O-CB 3.09Å; S765-A769 PolarHBondContact O-N 3.24Å; L766-A769 PolarHBondContact O-N 3.41Å; A769-S773 PolarHBondContact O-N 3.13Å; A769-K774 PolarHBondContact O-N 3.28Å; A769-A777 HydrophobicContact CB-CB 4.15Å; A769-I778 HydrophobicContact CB-CG1 3.69Å; A769-L781 HydrophobicContact CB-CD1 4.11Å
770	H	90.8	Very high	89.4	Confident	44 Å²	44	34 Å²	34	20%	0.204	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-49.6	173.8	-178.6	40.4	0	0	0	112.2	L766 R767 C768 Q772 S773 I778 I808 T811	L766-H770 WeakPolarHBondContact O-CB 3.33Å; L766-H770 PolarHBondContact O-N 3.38Å; R767-H770 PolarHBondContact O-N 3.35Å; C768-H770 VanDerWaalsContact C-N 3.35Å; H770-Q772 VanDerWaalsContact C-N 3.34Å; H770-Q772 PolarHBondContact O-N 2.98Å; H770-S773 WeakPolarHBondContact O-CA 3.32Å; H770-S773 PolarHBondContact O-N 2.68Å; H770-I778 HydrophobicContact CB-CD1 4.47Å; H770-I808 HydrophobicContact CB-CD1 4.1Å; H770-I808 HydrophobicContact CB-CG1 4.06Å; H770-T811 PolarHBondContact CE1-OG1 3.14Å
771	Q	87.4	Confident	89.5	Confident	109 Å²	109	33.8 Å²	33.8	51%	0.509	20%	0.196	S	C	.	.	H	α-helix	trans	-58.9	-43.2	177.2	-72.9	173.6	-1.4	0	0	112.1	R767 C768 S773	R767-Q771 WeakPolarHBondContact O-CG 3.37Å; R767-Q771 PolarHBondContact O-N 3.39Å; C768-Q771 PolarHBondContact O-N 2.93Å; Q771-S773 PolarHBondContact O-N 3.23Å
772	Q	87.1	Confident	89.5	Confident	73 Å²	73	33.9 Å²	33.9	34%	0.341	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	1.7	176	-64.2	172.8	28.4	0	0	113.3	G742 C768 H770 K774	G742-Q772 PolarHBondContact O-NE2 2.88Å; C768-Q772 VanDerWaalsContact O-CB 3.29Å; C768-Q772 WeakPolarHBondContact O-CB 3.48Å; C768-Q772 VanDerWaalsContact O-CG 3.26Å; C768-Q772 WeakPolarHBondContact O-CG 3.2Å; C768-Q772 PolarHBondContact O-N 3.26Å; H770-Q772 VanDerWaalsContact C-N 3.34Å; H770-Q772 PolarHBondContact O-N 2.98Å; Q772-K774 HydrophobicContact CB-CD 4.04Å; Q772-K774 HydrophobicContact CB-CG 4.05Å; Q772-K774 PolarHBondContact O-N 3.01Å; Q772-K774 VanDerWaalsContact O-N 3.08Å; Q772-K774 VanDerWaalsContact OE1-CE 3.24Å
773	S	88.4	Confident	89.3	Confident	94 Å²	94	41.2 Å²	41.2	66%	0.657	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	25.7	-176.3	-62.7	0	0	0	0	114.9	A769 H770 Q771 T775	A769-S773 PolarHBondContact O-N 3.13Å; H770-S773 WeakPolarHBondContact O-CA 3.32Å; H770-S773 PolarHBondContact O-N 2.68Å; Q771-S773 PolarHBondContact O-N 3.23Å; S773-T775 VanDerWaalsContact C-N 3.31Å; S773-T775 PolarHBondContact O-N 3Å
774	K	88.4	Confident	89.1	Confident	63 Å²	63	42.9 Å²	42.9	27%	0.274	23%	0.231	S	C	.	.			trans	-79.2	73	-176.5	-79.5	175.3	170.8	173.2	0	111.1	L744 D745 A769 Q772 G776 A777 I778	L744-K774 HydrophobicContact CD2-CD 3.82Å; D745-K774 IonicContact OD1-NZ 2.78Å; D745-K774 PolarHBondContact OD1-NZ 3.2Å; D745-K774 IonicContact OD2-NZ 2.65Å; D745-K774 PolarHBondContact OD2-NZ 3.47Å; A769-K774 PolarHBondContact O-N 3.28Å; Q772-K774 HydrophobicContact CB-CD 4.04Å; Q772-K774 HydrophobicContact CB-CG 4.05Å; Q772-K774 PolarHBondContact O-N 3.01Å; Q772-K774 VanDerWaalsContact O-N 3.08Å; Q772-K774 VanDerWaalsContact OE1-CE 3.24Å; K774-G776 PolarHBondContact O-N 3.11Å; K774-G776 VanDerWaalsContact O-N 3.08Å; K774-A777 HydrophobicContact CB-CB 4.1Å; K774-A777 PolarHBondContact O-N 3.47Å; K774-I778 PolarHBondContact O-N 3.18Å; K774-I778 VanDerWaalsContact O-N 3.11Å
775	T	87.8	Confident	88.8	Confident	77 Å²	77	41.6 Å²	41.6	47%	0.472	23%	0.225	S	C	.	.	H	α-helix	trans	-50.3	-35.4	-176.5	55.2	0	0	0	0	114.9	S773 L779 I817	S773-T775 VanDerWaalsContact C-N 3.31Å; S773-T775 PolarHBondContact O-N 3Å; T775-L779 PolarHBondContact O-N 2.82Å; T775-I817 HydrophobicContact CG2-CD1 4.49Å
776	G	87.6	Confident	87.9	Confident	53 Å²	53	46.3 Å²	46.3	55%	0.546	25%	0.254	S	S	.	.	H	α-helix	trans	-66.7	-39.1	175.3	0	0	0	0	0	113.8	K774 L779 S780	K774-G776 PolarHBondContact O-N 3.11Å; K774-G776 VanDerWaalsContact O-N 3.08Å; G776-L779 PolarHBondContact O-N 2.94Å; G776-S780 PolarHBondContact O-N 2.8Å
777	A	88.7	Confident	87.2	Confident	22 Å²	22	50.2 Å²	50.2	18%	0.182	28%	0.278	C	S	.	.	H	α-helix	trans	-70.7	-40.3	176.2	0	0	0	0	0	111.3	L744 A769 K774 L779 S780 L781	L744-A777 HydrophobicContact CD2-CB 4.07Å; A769-A777 HydrophobicContact CB-CB 4.15Å; K774-A777 HydrophobicContact CB-CB 4.1Å; K774-A777 PolarHBondContact O-N 3.47Å; A777-L779 VanDerWaalsContact C-N 3.29Å; A777-L779 PolarHBondContact O-N 2.91Å; A777-S780 PolarHBondContact O-N 3.28Å; A777-S780 VanDerWaalsContact O-N 3.17Å; A777-L781 WeakPolarHBondContact O-CG 3.19Å; A777-L781 PolarHBondContact O-N 2.86Å
778	I	89	Confident	86.6	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-56.1	-45.2	172.5	-59.4	172.2	0	0	0	110.3	L766 A769 H770 K774 S780 L782 I808 I817	L766-I778 HydrophobicContact CD1-CG2 4.06Å; A769-I778 HydrophobicContact CB-CG1 3.69Å; H770-I778 HydrophobicContact CB-CD1 4.47Å; K774-I778 PolarHBondContact O-N 3.18Å; K774-I778 VanDerWaalsContact O-N 3.11Å; I778-S780 VanDerWaalsContact C-N 3.35Å; I778-S780 PolarHBondContact O-N 3.4Å; I778-L782 HydrophobicContact CG2-CD1 3.66Å; I778-L782 HydrophobicContact CG2-CG 4.21Å; I778-L782 WeakPolarHBondContact O-CB 3.47Å; I778-L782 WeakPolarHBondContact O-CG 3.41Å; I778-L782 PolarHBondContact O-N 3.35Å; I778-I808 HydrophobicContact CG2-CG2 4.49Å; I778-I817 HydrophobicContact CB-CD1 4.18Å; I778-I817 HydrophobicContact CG2-CD1 3.89Å; I778-I817 HydrophobicContact CG2-CG1 4.26Å; I778-I817 HydrophobicContact CG2-CG2 4.17Å
779	L	88.6	Confident	85.8	Confident	30 Å²	30	54.2 Å²	54.2	16%	0.157	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-32.8	178	-82.3	171	0	0	0	114.3	T775 G776 A777 R783 A816 I817	T775-L779 PolarHBondContact O-N 2.82Å; G776-L779 PolarHBondContact O-N 2.94Å; A777-L779 VanDerWaalsContact C-N 3.29Å; A777-L779 PolarHBondContact O-N 2.91Å; L779-R783 WeakPolarHBondContact O-CD 3.49Å; L779-R783 VanDerWaalsContact O-CG 3.29Å; L779-R783 WeakPolarHBondContact O-CG 3.15Å; L779-R783 PolarHBondContact O-N 2.93Å; L779-A816 HydrophobicContact CD1-CB 4.44Å; L779-A816 HydrophobicContact CD2-CB 3.76Å; L779-I817 HydrophobicContact CD1-CG1 4.4Å; L779-I817 HydrophobicContact CD2-CB 4.42Å; L779-I817 HydrophobicContact CD2-CG1 3.51Å; L779-I817 HydrophobicContact CG-CD1 4.21Å; L779-I817 HydrophobicContact CG-CG1 3.6Å
780	S	89.2	Confident	84.8	Confident	45 Å²	45	59 Å²	59	32%	0.315	31%	0.314	S	S	.	.	H	α-helix	trans	-70.4	-55.2	175.1	-139.4	0	0	0	0	110.2	G776 A777 I778 L782 R783 E784	G776-S780 PolarHBondContact O-N 2.8Å; A777-S780 PolarHBondContact O-N 3.28Å; A777-S780 VanDerWaalsContact O-N 3.17Å; I778-S780 VanDerWaalsContact C-N 3.35Å; I778-S780 PolarHBondContact O-N 3.4Å; S780-L782 VanDerWaalsContact C-N 3.3Å; S780-L782 PolarHBondContact O-N 3.2Å; S780-R783 WeakPolarHBondContact O-CB 3.09Å; S780-R783 PolarHBondContact O-N 2.76Å; S780-E784 VanDerWaalsContact C-OE1 3.28Å; S780-E784 WeakPolarHBondContact CB-OE1 3.29Å; S780-E784 WeakPolarHBondContact O-CG 3.41Å; S780-E784 PolarHBondContact O-N 3.39Å; S780-E784 PolarHBondContact OG-OE1 2.79Å
781	L	89.7	Confident	83.6	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-54.4	-43	-179.9	-71.4	166.8	0	0	0	112.7	L744 M748 W757 W762 L766 A769 A777 E784 F785	L744-L781 HydrophobicContact CD1-CD1 4.41Å; M748-L781 HydrophobicContact CE-CD2 4.4Å; M748-L781 HydrophobicContact CE-CG 4.44Å; M748-L781 HydrophobicContact SD-CD1 4.37Å; M748-L781 HydrophobicContact SD-CD2 3.75Å; M748-L781 HydrophobicContact SD-CG 3.98Å; W757-L781 HydrophobicContact CH2-CD2 3.58Å; W757-L781 HydrophobicContact CZ2-CD2 3.38Å; W757-L781 HydrophobicContact CZ3-CD2 4.28Å; W762-L781 PolarHBondContact NE1-O 3.2Å; L766-L781 HydrophobicContact CB-CD1 4.39Å; A769-L781 HydrophobicContact CB-CD1 4.11Å; A777-L781 WeakPolarHBondContact O-CG 3.19Å; A777-L781 PolarHBondContact O-N 2.86Å; L781-E784 PolarHBondContact O-N 2.77Å; L781-F785 PolarHBondContact O-N 3.18Å; L781-F785 VanDerWaalsContact O-N 3.14Å
782	L	89	Confident	82.9	Confident	3 Å²	3	62 Å²	62	2%	0.016	33%	0.331	C	S	.	.	H	α-helix	trans	-69.4	-31.8	178.7	-66.6	174.5	0	0	0	113.3	W762 L766 I778 S780 I817 Q820 L821 I824	W762-L782 HydrophobicContact CH2-CD2 4.31Å; W762-L782 HydrophobicContact CZ2-CD2 4.16Å; L766-L782 HydrophobicContact CD1-CD2 4.19Å; L766-L782 HydrophobicContact CD1-CG 4.35Å; L766-L782 HydrophobicContact CD2-CD2 4.24Å; I778-L782 HydrophobicContact CG2-CD1 3.66Å; I778-L782 HydrophobicContact CG2-CG 4.21Å; I778-L782 WeakPolarHBondContact O-CB 3.47Å; I778-L782 WeakPolarHBondContact O-CG 3.41Å; I778-L782 PolarHBondContact O-N 3.35Å; S780-L782 VanDerWaalsContact C-N 3.3Å; S780-L782 PolarHBondContact O-N 3.2Å; L782-I817 HydrophobicContact CD1-CG2 3.82Å; L782-Q820 HydrophobicContact CB-CB 4.08Å; L782-L821 HydrophobicContact CD1-CD2 4Å; L782-L821 HydrophobicContact CD1-CG 3.94Å; L782-L821 HydrophobicContact CD2-CD2 3.65Å; L782-L821 HydrophobicContact CD2-CG 4.43Å; L782-I824 HydrophobicContact CB-CD1 4.08Å; L782-I824 HydrophobicContact CD2-CD1 3.61Å; L782-I824 HydrophobicContact CG-CD1 4.43Å
783	R	87.3	Confident	82.6	Confident	155 Å²	155	58.8 Å²	58.8	59%	0.585	32%	0.316	S	S	*	.	H	α-helix	trans	-69.9	-36.9	171.7	-75.7	167.4	176	-177.3	-1.6	111.9	L779 S780 F785 T786 Q820	L779-R783 WeakPolarHBondContact O-CD 3.49Å; L779-R783 VanDerWaalsContact O-CG 3.29Å; L779-R783 WeakPolarHBondContact O-CG 3.15Å; L779-R783 PolarHBondContact O-N 2.93Å; S780-R783 WeakPolarHBondContact O-CB 3.09Å; S780-R783 PolarHBondContact O-N 2.76Å; R783-F785 VanDerWaalsContact C-N 3.28Å; R783-F785 PolarHBondContact O-N 3.48Å; R783-T786 PolarHBondContact O-OG1 3.23Å; R783-Q820 HydrophobicContact CG-CG 4.44Å
784	E	85.5	Confident	82	Confident	34 Å²	34	55.7 Å²	55.7	16%	0.159	29%	0.294	C	S	.	.	H	α-helix	trans	-77.5	-8.6	-178.1	-68.5	154.8	-141.7	0	0	113.1	H751 W757 S780 L781 T786 T787	H751-E784 IonicContact CD2-OE2 2.8Å; H751-E784 PolarHBondContact CD2-OE2 3.43Å; H751-E784 VanDerWaalsContact CD2-OE2 3.32Å; H751-E784 IonicContact NE2-OE2 2.67Å; H751-E784 PolarHBondContact NE2-OE2 3.16Å; W757-E784 PolarHBondContact NE1-OE2 3.04Å; S780-E784 VanDerWaalsContact C-OE1 3.28Å; S780-E784 WeakPolarHBondContact CB-OE1 3.29Å; S780-E784 WeakPolarHBondContact O-CG 3.41Å; S780-E784 PolarHBondContact O-N 3.39Å; S780-E784 PolarHBondContact OG-OE1 2.79Å; L781-E784 PolarHBondContact O-N 2.77Å; E784-T786 PolarHBondContact O-N 2.87Å; E784-T786 VanDerWaalsContact O-N 3.15Å; E784-T787 WeakPolarHBondContact O-CB 3.49Å; E784-T787 WeakPolarHBondContact O-CG2 3.46Å; E784-T787 PolarHBondContact O-N 2.99Å; E784-T787 PolarHBondContact O-OG1 3.38Å
785	F	83.7	Confident	81.6	Confident	1 Å²	1	55.8 Å²	55.8	0%	0.004	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-55.8	-32.9	179.9	-178.6	-95.2	0	0	0	113.2	W762 L781 R783 T787 V788 Y793 I824	W762-F785 HydrophobicContact CD2-CD2 4.23Å; W762-F785 AromaticContact CE2-CD2 3.9Å; W762-F785 HydrophobicContact CE3-CD2 4.12Å; W762-F785 HydrophobicContact CE3-CE2 4.42Å; W762-F785 HydrophobicContact CH2-CB 4.48Å; W762-F785 AromaticContact CH2-CD2 3.4Å; W762-F785 HydrophobicContact CH2-CD2 3.4Å; W762-F785 VanDerWaalsContact CH2-CD2 3.4Å; W762-F785 HydrophobicContact CH2-CE2 4.02Å; W762-F785 HydrophobicContact CH2-CG 4.27Å; W762-F785 HydrophobicContact CZ2-CB 3.85Å; W762-F785 AromaticContact CZ2-CD2 3.51Å; W762-F785 HydrophobicContact CZ2-CD2 3.51Å; W762-F785 HydrophobicContact CZ2-CG 4.11Å; W762-F785 AromaticContact CZ3-CD2 3.72Å; W762-F785 HydrophobicContact CZ3-CD2 3.72Å; W762-F785 AromaticContact CZ3-CE2 3.96Å; W762-F785 HydrophobicContact CZ3-CE2 3.96Å; L781-F785 PolarHBondContact O-N 3.18Å; L781-F785 VanDerWaalsContact O-N 3.14Å; R783-F785 VanDerWaalsContact C-N 3.28Å; R783-F785 PolarHBondContact O-N 3.48Å; F785-T787 PolarHBondContact O-N 3.07Å; F785-V788 WeakPolarHBondContact O-CB 3.45Å; F785-V788 PolarHBondContact O-N 2.89Å; F785-Y793 AromaticContact CZ-CE1 3.99Å; F785-Y793 HydrophobicContact CZ-CE1 3.99Å; F785-I824 HydrophobicContact CB-CD1 3.95Å; F785-I824 HydrophobicContact CB-CG1 4.13Å; F785-I824 HydrophobicContact CD1-CB 4.31Å; F785-I824 HydrophobicContact CD1-CD1 4.46Å; F785-I824 HydrophobicContact CD1-CG1 3.96Å; F785-I824 HydrophobicContact CD1-CG2 3.47Å; F785-I824 VanDerWaalsContact CD1-CG2 3.47Å; F785-I824 HydrophobicContact CE1-CG2 3.47Å; F785-I824 VanDerWaalsContact CE1-CG2 3.47Å; F785-I824 HydrophobicContact CE2-CG2 4.49Å; F785-I824 HydrophobicContact CG-CD1 4.18Å; F785-I824 HydrophobicContact CG-CG1 4.16Å; F785-I824 HydrophobicContact CG-CG2 4.02Å; F785-I824 HydrophobicContact CZ-CG2 4Å
786	T	74.9	Confident	81.3	Confident	100 Å²	100	53.5 Å²	53.5	61%	0.613	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-65.4	-3.7	176.7	54.3	0	0	0	0	114.4	R783 E784	R783-T786 PolarHBondContact O-OG1 3.23Å; E784-T786 PolarHBondContact O-N 2.87Å; E784-T786 VanDerWaalsContact O-N 3.15Å
787	T	77.6	Confident	81.2	Confident	82 Å²	82	51 Å²	51	50%	0.503	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-84.5	-15.5	169.4	65.4	0	0	0	0	113.4	E784 F785	E784-T787 WeakPolarHBondContact O-CB 3.49Å; E784-T787 WeakPolarHBondContact O-CG2 3.46Å; E784-T787 PolarHBondContact O-N 2.99Å; E784-T787 PolarHBondContact O-OG1 3.38Å; F785-T787 PolarHBondContact O-N 3.07Å
788	V	78.3	Confident	81	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.03	25%	0.25	C	C	.	.	S	Bend	trans	-85.2	126.6	172.9	-175.5	0	0	0	0	108.5	W757 L759 F785 D792	W757-V788 HydrophobicContact CB-CG2 4.38Å; L759-V788 HydrophobicContact CB-CG1 4.26Å; L759-V788 HydrophobicContact CD1-CG1 4.39Å; F785-V788 WeakPolarHBondContact O-CB 3.45Å; F785-V788 PolarHBondContact O-N 2.89Å; V788-D792 HydrophobicContact CG1-CB 4Å
789	R	71.2	Confident	80.6	Confident	145 Å²	145	53.5 Å²	53.5	55%	0.547	27%	0.269	S	S	.	.			trans	-81.5	155.2	-178.3	-65.7	173.2	68.4	167.2	-0.4	111.2	E791 D792	R789-E791 HydrophobicContact CB-CB 4.39Å; R789-E791 IonicContact CZ-OE1 2.73Å; R789-E791 IonicContact CZ-OE2 3.78Å; R789-E791 VanDerWaalsContact CZ-OE2 3.22Å; R789-E791 IonicContact NE-OE1 2.78Å; R789-E791 PolarHBondContact NE-OE1 3.47Å; R789-E791 IonicContact NE-OE2 3.78Å; R789-E791 IonicContact NH1-OE2 2.75Å; R789-E791 IonicContact NH2-OE1 2.66Å; R789-E791 PolarHBondContact NH2-OE1 3.33Å; R789-E791 IonicContact NH2-OE2 3.86Å; R789-E791 PolarHBondContact NH2-OE2 3.22Å; R789-E791 PolarHBondContact O-N 3.32Å; R789-D792 WeakPolarHBondContact O-CB 3.31Å; R789-D792 PolarHBondContact O-N 3.16Å
790	E	69.9	Low	80.4	Confident	100 Å²	100	54 Å²	54	47%	0.467	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-60.2	-26.8	173.4	-59.6	-176.5	-170.6	0	0	112.2	D792 Y793 H827	E790-D792 VanDerWaalsContact C-N 3.31Å; E790-D792 PolarHBondContact O-N 2.77Å; E790-Y793 HydrophobicContact CB-CD2 4.25Å; E790-Y793 HydrophobicContact CB-CE2 3.95Å; E790-Y793 HydrophobicContact CG-CE2 3.85Å; E790-Y793 WeakPolarHBondContact O-CB 3.28Å; E790-Y793 PolarHBondContact O-N 3.33Å; E790-H827 IonicContact OE1-CE1 2.77Å
791	E	67.1	Low	80.2	Confident	125 Å²	125	51.9 Å²	51.9	58%	0.584	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-65.5	-27.9	172.7	-66.7	146.1	-104.7	0	0	113.6	R789	R789-E791 HydrophobicContact CB-CB 4.39Å; R789-E791 IonicContact CZ-OE1 2.73Å; R789-E791 IonicContact CZ-OE2 3.78Å; R789-E791 VanDerWaalsContact CZ-OE2 3.22Å; R789-E791 IonicContact NE-OE1 2.78Å; R789-E791 PolarHBondContact NE-OE1 3.47Å; R789-E791 IonicContact NE-OE2 3.78Å; R789-E791 IonicContact NH1-OE2 2.75Å; R789-E791 IonicContact NH2-OE1 2.66Å; R789-E791 PolarHBondContact NH2-OE1 3.33Å; R789-E791 IonicContact NH2-OE2 3.86Å; R789-E791 PolarHBondContact NH2-OE2 3.22Å; R789-E791 PolarHBondContact O-N 3.32Å
792	D	72	Confident	80.1	Confident	90 Å²	90	52 Å²	52	48%	0.481	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-85.9	-6.4	179.8	-70.7	-63.9	0	0	0	113	L759 V788 R789 E790 C794	L759-D792 WeakPolarHBondContact CD2-O 3.4Å; V788-D792 HydrophobicContact CG1-CB 4Å; R789-D792 WeakPolarHBondContact O-CB 3.31Å; R789-D792 PolarHBondContact O-N 3.16Å; E790-D792 VanDerWaalsContact C-N 3.31Å; E790-D792 PolarHBondContact O-N 2.77Å; D792-C794 PolarHBondContact O-N 2.77Å
793	Y	80.2	Confident	80.1	Confident	6 Å²	6	53.7 Å²	53.7	2%	0.024	27%	0.271	C	S	.	.			trans	-60.6	135.9	179.1	-67.4	-11.1	0	0	0	111.2	F785 E790 L797 I1040 Y1044	F785-Y793 AromaticContact CZ-CE1 3.99Å; F785-Y793 HydrophobicContact CZ-CE1 3.99Å; E790-Y793 HydrophobicContact CB-CD2 4.25Å; E790-Y793 HydrophobicContact CB-CE2 3.95Å; E790-Y793 HydrophobicContact CG-CE2 3.85Å; E790-Y793 WeakPolarHBondContact O-CB 3.28Å; E790-Y793 PolarHBondContact O-N 3.33Å; Y793-L797 HydrophobicContact CD1-CD2 3.75Å; Y793-L797 HydrophobicContact CE1-CD2 4.17Å; Y793-L797 HydrophobicContact CG-CD2 4.04Å; Y793-I1040 HydrophobicContact CD2-CG2 4.39Å; Y793-Y1044 WeakPolarHBondContact O-CD2 3.38Å
794	C	77.4	Confident	80.1	Confident	29 Å²	29	47 Å²	47	20%	0.196	25%	0.246	C	C	.	.			trans	-140.1	168.4	-179.5	74.7	0	0	0	0	111.7	L759 D792 E796 L797 Y1044	L759-C794 HydrophobicContact CD2-CB 4.4Å; D792-C794 PolarHBondContact O-N 2.77Å; C794-E796 PolarHBondContact O-N 3.3Å; C794-E796 VanDerWaalsContact O-N 3.11Å; C794-E796 VanDerWaalsContact SG-CB 3.59Å; C794-L797 WeakPolarHBondContact O-CB 3.48Å; C794-L797 PolarHBondContact O-N 2.94Å; C794-Y1044 HydrophobicContact CB-CE2 4.47Å
795	D	79.6	Confident	80.4	Confident	65 Å²	65	45.5 Å²	45.5	35%	0.348	24%	0.239	S	C	.	.	H	α-helix	trans	-64.2	-15.7	-179.2	-170.1	66.2	0	0	0	113.3	V798 T799 R1041	D795-V798 PolarHBondContact O-N 3.42Å; D795-T799 WeakPolarHBondContact O-CB 3.48Å; D795-T799 WeakPolarHBondContact O-CG2 3.22Å; D795-T799 PolarHBondContact O-N 3.4Å; D795-T799 PolarHBondContact O-OG1 2.99Å; D795-T799 VanDerWaalsContact OD2-CG2 3.26Å; D795-T799 WeakPolarHBondContact OD2-CG2 3.48Å; D795-R1041 IonicContact OD1-CZ 2.7Å; D795-R1041 IonicContact OD1-NE 3.75Å; D795-R1041 PolarHBondContact OD1-NE 3.4Å; D795-R1041 VanDerWaalsContact OD1-NE 3.15Å; D795-R1041 IonicContact OD1-NH2 2.71Å; D795-R1041 PolarHBondContact OD1-NH2 3.41Å
796	E	81.3	Confident	80.6	Confident	29 Å²	29	45.5 Å²	45.5	14%	0.136	24%	0.239	C	C	.	.	H	α-helix	trans	-67.5	-33.7	171.9	-163.5	179	-121.7	0	0	112.3	G197 H760 L763 C794 V798 T800 G801	G197-E796 PolarHBondContact N-OE1 3.47Å; H760-E796 WeakPolarHBondContact CB-OE2 3.32Å; H760-E796 IonicContact CE1-OE1 2.8Å; H760-E796 IonicContact CE1-OE2 3.36Å; H760-E796 IonicContact CG-OE2 3.91Å; H760-E796 VanDerWaalsContact ND1-CD 3.29Å; H760-E796 IonicContact ND1-OE1 3Å; H760-E796 PolarHBondContact ND1-OE1 3.45Å; H760-E796 VanDerWaalsContact ND1-OE1 3.12Å; H760-E796 IonicContact ND1-OE2 2.81Å; H760-E796 PolarHBondContact ND1-OE2 2.97Å; L763-E796 HydrophobicContact CD1-CG 4.36Å; C794-E796 PolarHBondContact O-N 3.3Å; C794-E796 VanDerWaalsContact O-N 3.11Å; C794-E796 VanDerWaalsContact SG-CB 3.59Å; E796-V798 VanDerWaalsContact C-N 3.35Å; E796-T800 HydrophobicContact CG-CG2 4.36Å; E796-T800 WeakPolarHBondContact O-CA 3.34Å; E796-T800 PolarHBondContact O-N 3.26Å; E796-T800 PolarHBondContact O-OG1 3.01Å; E796-G801 PolarHBondContact O-N 3.48Å; E796-G801 VanDerWaalsContact O-N 3.13Å
797	L	85.2	Confident	81.2	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.226	C	C	.	.	I	π-helix	trans	-65.5	-39.4	170.8	172.8	61.4	0	0	0	110.9	L759 L763 Y793 C794 G801 L802 I1040	L759-L797 HydrophobicContact CD1-CB 4.3Å; L759-L797 HydrophobicContact CD1-CD1 4.36Å; L759-L797 HydrophobicContact CD1-CD2 4.39Å; L759-L797 HydrophobicContact CD2-CB 4.04Å; L759-L797 HydrophobicContact CD2-CD2 4.47Å; L763-L797 HydrophobicContact CD2-CD1 4.31Å; Y793-L797 HydrophobicContact CD1-CD2 3.75Å; Y793-L797 HydrophobicContact CE1-CD2 4.17Å; Y793-L797 HydrophobicContact CG-CD2 4.04Å; C794-L797 WeakPolarHBondContact O-CB 3.48Å; C794-L797 PolarHBondContact O-N 2.94Å; L797-G801 CarbonylContact O-C 3.57Å; L797-G801 VanDerWaalsContact O-CA 3.22Å; L797-G801 WeakPolarHBondContact O-CA 3.49Å; L797-G801 PolarHBondContact O-N 2.97Å; L797-G801 VanDerWaalsContact O-N 3.09Å; L797-L802 PolarHBondContact O-N 3.25Å; L797-I1040 HydrophobicContact CD2-CD1 4.33Å
798	V	83.8	Confident	81.6	Confident	9 Å²	9	39.4 Å²	39.4	6%	0.055	20%	0.202	C	C	.	.	I	π-helix	trans	-73.4	-43.6	179.5	-177.3	0	0	0	0	111.8	D795 E796 A1037 I1040 R1041	D795-V798 PolarHBondContact O-N 3.42Å; E796-V798 VanDerWaalsContact C-N 3.35Å; V798-A1037 HydrophobicContact CG1-CB 3.62Å; V798-I1040 HydrophobicContact CG2-CB 3.93Å; V798-I1040 HydrophobicContact CG2-CG2 3.55Å; V798-R1041 HydrophobicContact CG1-CG 4.18Å; V798-R1041 HydrophobicContact CG2-CG 4.24Å
799	T	82.4	Confident	82	Confident	69 Å²	69	39.2 Å²	39.2	42%	0.423	20%	0.201	S	C	.	.	I	π-helix	trans	-87.9	-20.6	-172.9	54.8	0	0	0	0	114.6	D795	D795-T799 WeakPolarHBondContact O-CB 3.48Å; D795-T799 WeakPolarHBondContact O-CG2 3.22Å; D795-T799 PolarHBondContact O-N 3.4Å; D795-T799 PolarHBondContact O-OG1 2.99Å; D795-T799 VanDerWaalsContact OD2-CG2 3.26Å; D795-T799 WeakPolarHBondContact OD2-CG2 3.48Å
800	T	82.8	Confident	82.7	Confident	41 Å²	41	38.2 Å²	38.2	25%	0.252	20%	0.197	S	C	.	.	I	π-helix	trans	-132.8	-29.8	-179.5	83.8	0	0	0	0	114.2	R767 E796 L804	R767-T800 PolarHBondContact NH2-OG1 3.3Å; E796-T800 HydrophobicContact CG-CG2 4.36Å; E796-T800 WeakPolarHBondContact O-CA 3.34Å; E796-T800 PolarHBondContact O-N 3.26Å; E796-T800 PolarHBondContact O-OG1 3.01Å; T800-L804 VanDerWaalsContact O-CB 3.24Å; T800-L804 WeakPolarHBondContact O-CB 3.35Å; T800-L804 PolarHBondContact O-N 3.35Å
801	G	85.5	Confident	83.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.	I	π-helix	trans	-76.1	-52.5	-177.9	0	0	0	0	0	113.7	L763 E796 L797 L804 M805	L763-G801 VanDerWaalsContact CD2-CA 3.46Å; E796-G801 PolarHBondContact O-N 3.48Å; E796-G801 VanDerWaalsContact O-N 3.13Å; L797-G801 CarbonylContact O-C 3.57Å; L797-G801 VanDerWaalsContact O-CA 3.22Å; L797-G801 WeakPolarHBondContact O-CA 3.49Å; L797-G801 PolarHBondContact O-N 2.97Å; L797-G801 VanDerWaalsContact O-N 3.09Å; G801-L804 WeakPolarHBondContact O-CB 3.47Å; G801-L804 PolarHBondContact O-N 2.95Å; G801-M805 WeakPolarHBondContact O-CG 3.45Å; G801-M805 PolarHBondContact O-N 3.14Å
802	L	88.1	Confident	84.3	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-57.8	-51.2	175.1	-66.7	-176.1	0	0	0	111.9	L797 L804 M805 F806 F825 E1033 L1036 A1037 I1040	L797-L802 PolarHBondContact O-N 3.25Å; L802-L804 PolarHBondContact O-N 2.97Å; L802-M805 PolarHBondContact O-N 3.31Å; L802-F806 HydrophobicContact CB-CD2 4.47Å; L802-F806 WeakPolarHBondContact O-CD2 3.3Å; L802-F806 PolarHBondContact O-N 3.45Å; L802-F825 HydrophobicContact CD2-CE1 4.25Å; L802-E1033 HydrophobicContact CB-CG 4.39Å; L802-L1036 HydrophobicContact CD1-CB 4.25Å; L802-L1036 HydrophobicContact CD1-CD2 4.38Å; L802-L1036 HydrophobicContact CD1-CG 4.05Å; L802-L1036 HydrophobicContact CD2-CD2 3.67Å; L802-L1036 HydrophobicContact CD2-CG 4.15Å; L802-A1037 HydrophobicContact CD1-CB 4Å; L802-I1040 HydrophobicContact CD1-CD1 4.11Å; L802-I1040 HydrophobicContact CD2-CD1 4.19Å; L802-I1040 HydrophobicContact CG-CD1 4.42Å
803	P	89.4	Confident	84.9	Confident	40 Å²	40	37.6 Å²	37.6	26%	0.26	20%	0.195	S	C	.	.	H	α-helix	trans	-56.2	-37.5	176.2	-23.2	29	0	0	0	113.5	T807 E1033	P803-T807 VanDerWaalsContact O-CB 3.22Å; P803-T807 WeakPolarHBondContact O-CB 3.46Å; P803-T807 PolarHBondContact O-N 3.36Å; P803-T807 PolarHBondContact O-OG1 3.34Å; P803-E1033 WeakPolarHBondContact CA-OE1 3.28Å; P803-E1033 WeakPolarHBondContact CG-OE1 3.32Å
804	L	87.1	Confident	85.1	Confident	14 Å²	14	39.9 Å²	39.9	7%	0.073	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-46.6	175.3	174.4	63.9	0	0	0	111.3	L766 R767 T800 G801 L802 T807 I808	L766-L804 HydrophobicContact CB-CD2 4.47Å; L766-L804 HydrophobicContact CD2-CD2 4.29Å; L766-L804 HydrophobicContact CG-CD2 4.25Å; R767-L804 HydrophobicContact CB-CD2 3.8Å; R767-L804 HydrophobicContact CG-CD1 4.33Å; R767-L804 HydrophobicContact CG-CD2 4.23Å; T800-L804 VanDerWaalsContact O-CB 3.24Å; T800-L804 WeakPolarHBondContact O-CB 3.35Å; T800-L804 PolarHBondContact O-N 3.35Å; G801-L804 WeakPolarHBondContact O-CB 3.47Å; G801-L804 PolarHBondContact O-N 2.95Å; L802-L804 PolarHBondContact O-N 2.97Å; L804-T807 WeakPolarHBondContact O-CB 3.35Å; L804-T807 PolarHBondContact O-N 3.39Å; L804-I808 HydrophobicContact CD1-CD1 4.08Å; L804-I808 HydrophobicContact CD1-CG1 4.33Å; L804-I808 HydrophobicContact CG-CD1 3.99Å; L804-I808 VanDerWaalsContact O-CG1 3.27Å; L804-I808 WeakPolarHBondContact O-CG1 3.14Å; L804-I808 PolarHBondContact O-N 2.9Å
805	M	90.4	Very high	85.5	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-64.7	-42.3	179.2	-71.5	174.9	71.2	0	0	112.5	W762 L766 G801 L802 T807 I808 L809 L821 I824 F825	W762-M805 HydrophobicContact CH2-SD 4.42Å; L766-M805 HydrophobicContact CD2-CG 4.19Å; G801-M805 WeakPolarHBondContact O-CG 3.45Å; G801-M805 PolarHBondContact O-N 3.14Å; L802-M805 PolarHBondContact O-N 3.31Å; M805-T807 VanDerWaalsContact C-N 3.33Å; M805-I808 PolarHBondContact O-N 2.94Å; M805-L809 PolarHBondContact O-N 3.23Å; M805-L821 HydrophobicContact CB-CD2 4Å; M805-L821 HydrophobicContact CE-CD2 3.74Å; M805-L821 HydrophobicContact CG-CD2 4.12Å; M805-I824 HydrophobicContact CE-CB 3.94Å; M805-I824 HydrophobicContact CE-CD1 3.97Å; M805-I824 HydrophobicContact CE-CG2 3.56Å; M805-F825 HydrophobicContact CB-CE1 3.83Å; M805-F825 HydrophobicContact CB-CZ 3.74Å; M805-F825 HydrophobicContact CE-CD1 4.05Å; M805-F825 HydrophobicContact CE-CE1 3.59Å; M805-F825 HydrophobicContact CE-CZ 4.18Å; M805-F825 HydrophobicContact SD-CE1 4.24Å
806	F	88.6	Confident	85.9	Confident	1 Å²	1	41.3 Å²	41.3	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-67.1	-33.1	173.2	-81.5	-81.3	0	0	0	112.1	L802 L809 R810 F825 L1029 L1032 E1033 L1036	L802-F806 HydrophobicContact CB-CD2 4.47Å; L802-F806 WeakPolarHBondContact O-CD2 3.3Å; L802-F806 PolarHBondContact O-N 3.45Å; F806-L809 HydrophobicContact CD1-CD2 4.37Å; F806-L809 PolarHBondContact O-N 3.34Å; F806-R810 VanDerWaalsContact O-CB 3.3Å; F806-R810 WeakPolarHBondContact O-CB 3.36Å; F806-R810 PolarHBondContact O-N 3.31Å; F806-F825 HydrophobicContact CD1-CZ 4.38Å; F806-F825 HydrophobicContact CD2-CE1 4.16Å; F806-F825 AromaticContact CD2-CZ 3.93Å; F806-F825 HydrophobicContact CD2-CZ 3.93Å; F806-F825 HydrophobicContact CE1-CE2 4.25Å; F806-F825 HydrophobicContact CE1-CZ 4.3Å; F806-F825 HydrophobicContact CE2-CD1 4.4Å; F806-F825 AromaticContact CE2-CE1 3.79Å; F806-F825 HydrophobicContact CE2-CE1 3.79Å; F806-F825 HydrophobicContact CE2-CE2 4.47Å; F806-F825 AromaticContact CE2-CZ 3.82Å; F806-F825 HydrophobicContact CE2-CZ 3.82Å; F806-F825 HydrophobicContact CG-CZ 4.21Å; F806-F825 HydrophobicContact CZ-CE1 4.21Å; F806-F825 HydrophobicContact CZ-CE2 4.21Å; F806-F825 HydrophobicContact CZ-CZ 4.02Å; F806-L1029 HydrophobicContact CD1-CB 4.44Å; F806-L1029 HydrophobicContact CD1-CD2 4.1Å; F806-L1029 HydrophobicContact CE1-CD2 4.35Å; F806-L1032 HydrophobicContact CE1-CB 4.19Å; F806-L1032 HydrophobicContact CZ-CB 4.23Å; F806-E1033 HydrophobicContact CD2-CB 3.74Å; F806-E1033 HydrophobicContact CD2-CG 3.65Å; F806-E1033 HydrophobicContact CE1-CB 4.48Å; F806-E1033 HydrophobicContact CE2-CB 3.7Å; F806-E1033 HydrophobicContact CE2-CG 3.91Å; F806-E1033 HydrophobicContact CG-CB 4.18Å; F806-E1033 HydrophobicContact CG-CG 4.33Å; F806-E1033 HydrophobicContact CZ-CB 4.09Å; F806-L1036 HydrophobicContact CE2-CD2 4.34Å
807	T	87.4	Confident	86.1	Confident	54 Å²	54	39.9 Å²	39.9	33%	0.331	21%	0.213	S	C	.	.	H	α-helix	trans	-67.1	-40.7	171.5	-62.2	0	0	0	0	112.1	P803 L804 M805 R810 T811	P803-T807 VanDerWaalsContact O-CB 3.22Å; P803-T807 WeakPolarHBondContact O-CB 3.46Å; P803-T807 PolarHBondContact O-N 3.36Å; P803-T807 PolarHBondContact O-OG1 3.34Å; L804-T807 WeakPolarHBondContact O-CB 3.35Å; L804-T807 PolarHBondContact O-N 3.39Å; M805-T807 VanDerWaalsContact C-N 3.33Å; T807-R810 PolarHBondContact O-N 3Å; T807-T811 HydrophobicContact CG2-CG2 4.46Å; T807-T811 WeakPolarHBondContact O-CB 3.49Å; T807-T811 WeakPolarHBondContact O-CG2 3.37Å; T807-T811 PolarHBondContact O-N 2.95Å; T807-T811 PolarHBondContact O-OG1 2.97Å
808	I	87.1	Confident	86.2	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.2	-44.4	173.2	-65.6	163.9	0	0	0	109.9	L766 H770 I778 L804 M805 R810 T811 T812 I817 L821	L766-I808 HydrophobicContact CD1-CD1 3.92Å; L766-I808 HydrophobicContact CD2-CD1 4.04Å; L766-I808 HydrophobicContact CG-CD1 3.83Å; H770-I808 HydrophobicContact CB-CD1 4.1Å; H770-I808 HydrophobicContact CB-CG1 4.06Å; I778-I808 HydrophobicContact CG2-CG2 4.49Å; L804-I808 HydrophobicContact CD1-CD1 4.08Å; L804-I808 HydrophobicContact CD1-CG1 4.33Å; L804-I808 HydrophobicContact CG-CD1 3.99Å; L804-I808 VanDerWaalsContact O-CG1 3.27Å; L804-I808 WeakPolarHBondContact O-CG1 3.14Å; L804-I808 PolarHBondContact O-N 2.9Å; M805-I808 PolarHBondContact O-N 2.94Å; I808-R810 VanDerWaalsContact C-N 3.34Å; I808-R810 PolarHBondContact O-N 2.92Å; I808-T811 PolarHBondContact O-N 3.41Å; I808-T811 PolarHBondContact O-OG1 3.18Å; I808-T812 WeakPolarHBondContact CG2-OG1 3.47Å; I808-T812 WeakPolarHBondContact O-CB 3.26Å; I808-T812 PolarHBondContact O-N 2.9Å; I808-T812 PolarHBondContact O-OG1 2.91Å; I808-I817 HydrophobicContact CG2-CG2 3.94Å; I808-L821 HydrophobicContact CB-CD1 4.3Å; I808-L821 HydrophobicContact CG2-CD1 3.91Å
809	L	86.6	Confident	86.4	Confident	2 Å²	2	42 Å²	42	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-57.8	-45.2	175.5	-177.9	65.7	0	0	0	111.9	M805 F806 T811 I818 L821 F825 M992 L1029	M805-L809 PolarHBondContact O-N 3.23Å; F806-L809 HydrophobicContact CD1-CD2 4.37Å; F806-L809 PolarHBondContact O-N 3.34Å; L809-T811 VanDerWaalsContact C-N 3.34Å; L809-T811 PolarHBondContact O-N 3.48Å; L809-I818 HydrophobicContact CD1-CB 4.35Å; L809-I818 HydrophobicContact CD1-CG1 4.2Å; L809-I818 HydrophobicContact CD1-CG2 3.96Å; L809-L821 HydrophobicContact CB-CD1 3.99Å; L809-L821 HydrophobicContact CD1-CD1 4.38Å; L809-F825 HydrophobicContact CD2-CE2 4.21Å; L809-M992 HydrophobicContact CD2-CE 4.08Å; L809-L1029 HydrophobicContact CD2-CD2 3.85Å
810	R	84.9	Confident	86.7	Confident	123 Å²	123	41.8 Å²	41.8	46%	0.464	22%	0.216	S	C	.	.	H	α-helix	trans	-68	-28.5	-179	-171.6	-174.7	-69.8	157.6	-8.5	113.4	F806 T807 I808 E1030	F806-R810 VanDerWaalsContact O-CB 3.3Å; F806-R810 WeakPolarHBondContact O-CB 3.36Å; F806-R810 PolarHBondContact O-N 3.31Å; T807-R810 PolarHBondContact O-N 3Å; I808-R810 VanDerWaalsContact C-N 3.34Å; I808-R810 PolarHBondContact O-N 2.92Å; R810-E1030 IonicContact NH2-OE1 2.65Å
811	T	85.7	Confident	86.9	Confident	79 Å²	79	39.8 Å²	39.8	49%	0.485	20%	0.204	S	C	.	.	H	α-helix	trans	-101.3	-22.9	-174.9	53.4	0	0	0	0	114.2	H770 T807 I808 L809	H770-T811 PolarHBondContact CE1-OG1 3.14Å; T807-T811 HydrophobicContact CG2-CG2 4.46Å; T807-T811 WeakPolarHBondContact O-CB 3.49Å; T807-T811 WeakPolarHBondContact O-CG2 3.37Å; T807-T811 PolarHBondContact O-N 2.95Å; T807-T811 PolarHBondContact O-OG1 2.97Å; I808-T811 PolarHBondContact O-N 3.41Å; I808-T811 PolarHBondContact O-OG1 3.18Å; L809-T811 VanDerWaalsContact C-N 3.34Å; L809-T811 PolarHBondContact O-N 3.48Å
812	T	85.4	Confident	87	Confident	22 Å²	22	39.9 Å²	39.9	14%	0.135	21%	0.205	C	C	.	.			trans	-86.6	134.2	-169.6	-63.2	0	0	0	0	113	I808 N814 I817	I808-T812 WeakPolarHBondContact CG2-OG1 3.47Å; I808-T812 WeakPolarHBondContact O-CB 3.26Å; I808-T812 PolarHBondContact O-N 2.9Å; I808-T812 PolarHBondContact O-OG1 2.91Å; T812-N814 HydrophobicContact CG2-CB 3.85Å; T812-I817 HydrophobicContact CG2-CB 3.75Å; T812-I817 HydrophobicContact CG2-CD1 3.84Å; T812-I817 HydrophobicContact CG2-CG1 4.32Å; T812-I817 HydrophobicContact CG2-CG2 3.79Å
813	K	83.3	Confident	86.9	Confident	201 Å²	201	41.8 Å²	41.8	87%	0.874	22%	0.221	S	C	*	.			trans	-100.7	6.6	177.1	-60.9	179.9	-179.3	177.1	0	114.2
814	N	85.5	Confident	86.7	Confident	55 Å²	55	40.2 Å²	40.2	29%	0.294	21%	0.21	S	C	.	.			trans	-99.3	111.7	-176.8	-177.8	-10.4	0	0	0	110.3	T812 A816 I817 I818	T812-N814 HydrophobicContact CG2-CB 3.85Å; N814-A816 PolarHBondContact O-N 3.48Å; N814-A816 WeakPolarHBondContact OD1-CB 3.44Å; N814-A816 PolarHBondContact OD1-N 2.9Å; N814-A816 VanDerWaalsContact OD1-N 3.07Å; N814-I817 HydrophobicContact CB-CB 4.42Å; N814-I817 HydrophobicContact CB-CD1 4.13Å; N814-I817 HydrophobicContact CB-CG1 4.27Å; N814-I817 PolarHBondContact O-N 3.12Å; N814-I818 PolarHBondContact O-N 2.76Å; N814-I818 VanDerWaalsContact O-N 3.15Å
815	D	84.6	Confident	86.8	Confident	80 Å²	80	39.6 Å²	39.6	43%	0.428	21%	0.207	S	C	.	.	H	α-helix	trans	-56.9	-31.9	-178.6	-67.6	-57.2	0	0	0	114	I817 I818 Q819 R1002	D815-I817 VanDerWaalsContact C-N 3.34Å; D815-I817 PolarHBondContact O-N 3.01Å; D815-I818 PolarHBondContact O-N 3.12Å; D815-Q819 WeakPolarHBondContact O-CB 3.39Å; D815-Q819 PolarHBondContact O-N 3Å; D815-R1002 IonicContact OD1-CZ 3.15Å; D815-R1002 IonicContact OD1-NH1 2.71Å; D815-R1002 PolarHBondContact OD1-NH1 3.23Å; D815-R1002 IonicContact OD1-NH2 2.68Å; D815-R1002 PolarHBondContact OD1-NH2 3.45Å
816	A	87.9	Confident	86.6	Confident	43 Å²	43	40.5 Å²	40.5	36%	0.355	21%	0.213	S	C	.	.	H	α-helix	trans	-67.3	-34.5	176.4	0	0	0	0	0	112.1	L779 N814 Q820	L779-A816 HydrophobicContact CD1-CB 4.44Å; L779-A816 HydrophobicContact CD2-CB 3.76Å; N814-A816 PolarHBondContact O-N 3.48Å; N814-A816 WeakPolarHBondContact OD1-CB 3.44Å; N814-A816 PolarHBondContact OD1-N 2.9Å; N814-A816 VanDerWaalsContact OD1-N 3.07Å; A816-Q820 VanDerWaalsContact O-CG 3.24Å; A816-Q820 WeakPolarHBondContact O-CG 3.38Å; A816-Q820 PolarHBondContact O-N 2.98Å; A816-Q820 VanDerWaalsContact O-N 3.16Å
817	I	86.8	Confident	86.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-71.9	-43.4	175.2	-67.7	175	0	0	0	109.7	T775 I778 L779 L782 I808 T812 N814 D815 Q819 Q820 L821	T775-I817 HydrophobicContact CG2-CD1 4.49Å; I778-I817 HydrophobicContact CB-CD1 4.18Å; I778-I817 HydrophobicContact CG2-CD1 3.89Å; I778-I817 HydrophobicContact CG2-CG1 4.26Å; I778-I817 HydrophobicContact CG2-CG2 4.17Å; L779-I817 HydrophobicContact CD1-CG1 4.4Å; L779-I817 HydrophobicContact CD2-CB 4.42Å; L779-I817 HydrophobicContact CD2-CG1 3.51Å; L779-I817 HydrophobicContact CG-CD1 4.21Å; L779-I817 HydrophobicContact CG-CG1 3.6Å; L782-I817 HydrophobicContact CD1-CG2 3.82Å; I808-I817 HydrophobicContact CG2-CG2 3.94Å; T812-I817 HydrophobicContact CG2-CB 3.75Å; T812-I817 HydrophobicContact CG2-CD1 3.84Å; T812-I817 HydrophobicContact CG2-CG1 4.32Å; T812-I817 HydrophobicContact CG2-CG2 3.79Å; N814-I817 HydrophobicContact CB-CB 4.42Å; N814-I817 HydrophobicContact CB-CD1 4.13Å; N814-I817 HydrophobicContact CB-CG1 4.27Å; N814-I817 PolarHBondContact O-N 3.12Å; D815-I817 VanDerWaalsContact C-N 3.34Å; D815-I817 PolarHBondContact O-N 3.01Å; I817-Q819 PolarHBondContact O-N 3.36Å; I817-Q820 PolarHBondContact O-N 2.91Å; I817-L821 HydrophobicContact CG2-CD1 3.86Å; I817-L821 HydrophobicContact CG2-CG 4.34Å; I817-L821 WeakPolarHBondContact O-CG 3.33Å; I817-L821 PolarHBondContact O-N 2.94Å
818	I	86.4	Confident	86.2	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-46.9	177.9	-65.5	169.1	0	0	0	110.8	L809 N814 D815 L821 A822 L996 L1006	L809-I818 HydrophobicContact CD1-CB 4.35Å; L809-I818 HydrophobicContact CD1-CG1 4.2Å; L809-I818 HydrophobicContact CD1-CG2 3.96Å; N814-I818 PolarHBondContact O-N 2.76Å; N814-I818 VanDerWaalsContact O-N 3.15Å; D815-I818 PolarHBondContact O-N 3.12Å; I818-L821 PolarHBondContact O-N 3.04Å; I818-A822 WeakPolarHBondContact O-CB 3.42Å; I818-A822 PolarHBondContact O-N 2.88Å; I818-L996 HydrophobicContact CG2-CD1 3.99Å; I818-L996 HydrophobicContact CG2-CD2 4.16Å; I818-L1006 HydrophobicContact CD1-CD1 4.25Å
819	Q	87.8	Confident	85.9	Confident	53 Å²	53	41.8 Å²	41.8	25%	0.248	22%	0.216	C	C	.	.	H	α-helix	trans	-68.9	-35.5	178.8	-78.1	-69	2.3	0	0	113.5	D815 I817 A823 P993	D815-Q819 WeakPolarHBondContact O-CB 3.39Å; D815-Q819 PolarHBondContact O-N 3Å; I817-Q819 PolarHBondContact O-N 3.36Å; Q819-A823 PolarHBondContact O-N 3.26Å; Q819-P993 PolarHBondContact NE2-O 3.13Å; Q819-P993 PolarHBondContact OE1-O 2.94Å
820	Q	88.8	Confident	85.4	Confident	63 Å²	63	42.9 Å²	42.9	29%	0.294	23%	0.228	S	C	.	.	H	α-helix	trans	-71	-39.8	174.8	-66.1	-62	-92.3	0	0	112.3	L782 R783 A816 I817 A822 A823 I824	L782-Q820 HydrophobicContact CB-CB 4.08Å; R783-Q820 HydrophobicContact CG-CG 4.44Å; A816-Q820 VanDerWaalsContact O-CG 3.24Å; A816-Q820 WeakPolarHBondContact O-CG 3.38Å; A816-Q820 PolarHBondContact O-N 2.98Å; A816-Q820 VanDerWaalsContact O-N 3.16Å; I817-Q820 PolarHBondContact O-N 2.91Å; Q820-A822 VanDerWaalsContact C-N 3.31Å; Q820-A822 PolarHBondContact O-N 2.69Å; Q820-A823 PolarHBondContact O-N 3.08Å; Q820-I824 WeakPolarHBondContact O-CG1 3.38Å; Q820-I824 PolarHBondContact O-N 2.75Å
821	L	88.3	Confident	84.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.6	-44.3	172.6	-73.7	169	0	0	0	111.5	L782 M805 I808 L809 I817 I818 A823 I824 F825	L782-L821 HydrophobicContact CD1-CD2 4Å; L782-L821 HydrophobicContact CD1-CG 3.94Å; L782-L821 HydrophobicContact CD2-CD2 3.65Å; L782-L821 HydrophobicContact CD2-CG 4.43Å; M805-L821 HydrophobicContact CB-CD2 4Å; M805-L821 HydrophobicContact CE-CD2 3.74Å; M805-L821 HydrophobicContact CG-CD2 4.12Å; I808-L821 HydrophobicContact CB-CD1 4.3Å; I808-L821 HydrophobicContact CG2-CD1 3.91Å; L809-L821 HydrophobicContact CB-CD1 3.99Å; L809-L821 HydrophobicContact CD1-CD1 4.38Å; I817-L821 HydrophobicContact CG2-CD1 3.86Å; I817-L821 HydrophobicContact CG2-CG 4.34Å; I817-L821 WeakPolarHBondContact O-CG 3.33Å; I817-L821 PolarHBondContact O-N 2.94Å; I818-L821 PolarHBondContact O-N 3.04Å; L821-A823 PolarHBondContact O-N 3.29Å; L821-I824 PolarHBondContact O-N 3.35Å; L821-F825 HydrophobicContact CB-CD2 4.49Å; L821-F825 HydrophobicContact CB-CE2 4.05Å; L821-F825 WeakPolarHBondContact O-CD2 3.21Å; L821-F825 VanDerWaalsContact O-CG 3.23Å; L821-F825 WeakPolarHBondContact O-CG 3.19Å; L821-F825 PolarHBondContact O-N 2.93Å
822	A	86.1	Confident	83.5	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-61.7	-41.1	176.3	0	0	0	0	0	113.1	I818 Q820 I824 F825 S826 M992 P993 L996	I818-A822 WeakPolarHBondContact O-CB 3.42Å; I818-A822 PolarHBondContact O-N 2.88Å; Q820-A822 VanDerWaalsContact C-N 3.31Å; Q820-A822 PolarHBondContact O-N 2.69Å; A822-I824 VanDerWaalsContact C-N 3.34Å; A822-I824 PolarHBondContact O-N 3.37Å; A822-F825 PolarHBondContact O-N 3.02Å; A822-S826 PolarHBondContact O-N 2.85Å; A822-S826 PolarHBondContact O-OG 2.92Å; A822-M992 HydrophobicContact CB-CB 3.99Å; A822-M992 HydrophobicContact CB-CG 3.89Å; A822-M992 HydrophobicContact CB-SD 4.14Å; A822-P993 HydrophobicContact CB-CG 4.08Å; A822-L996 HydrophobicContact CB-CD1 3.33Å
823	A	86.4	Confident	82.5	Confident	42 Å²	42	44.5 Å²	44.5	35%	0.347	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-40.6	175.6	0	0	0	0	0	111.7	Q819 Q820 L821 H827 P993	Q819-A823 PolarHBondContact O-N 3.26Å; Q820-A823 PolarHBondContact O-N 3.08Å; L821-A823 PolarHBondContact O-N 3.29Å; A823-H827 WeakPolarHBondContact O-CB 3.39Å; A823-H827 PolarHBondContact O-N 3.48Å; A823-P993 HydrophobicContact CB-CG 4.31Å
824	I	86.3	Confident	81.8	Confident	8 Å²	8	37.4 Å²	37.4	4%	0.041	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-45.2	174.2	-60.9	160.9	0	0	0	111	L782 F785 M805 Q820 L821 A822 S826 H827 C828	L782-I824 HydrophobicContact CB-CD1 4.08Å; L782-I824 HydrophobicContact CD2-CD1 3.61Å; L782-I824 HydrophobicContact CG-CD1 4.43Å; F785-I824 HydrophobicContact CB-CD1 3.95Å; F785-I824 HydrophobicContact CB-CG1 4.13Å; F785-I824 HydrophobicContact CD1-CB 4.31Å; F785-I824 HydrophobicContact CD1-CD1 4.46Å; F785-I824 HydrophobicContact CD1-CG1 3.96Å; F785-I824 HydrophobicContact CD1-CG2 3.47Å; F785-I824 VanDerWaalsContact CD1-CG2 3.47Å; F785-I824 HydrophobicContact CE1-CG2 3.47Å; F785-I824 VanDerWaalsContact CE1-CG2 3.47Å; F785-I824 HydrophobicContact CE2-CG2 4.49Å; F785-I824 HydrophobicContact CG-CD1 4.18Å; F785-I824 HydrophobicContact CG-CG1 4.16Å; F785-I824 HydrophobicContact CG-CG2 4.02Å; F785-I824 HydrophobicContact CZ-CG2 4Å; M805-I824 HydrophobicContact CE-CB 3.94Å; M805-I824 HydrophobicContact CE-CD1 3.97Å; M805-I824 HydrophobicContact CE-CG2 3.56Å; Q820-I824 WeakPolarHBondContact O-CG1 3.38Å; Q820-I824 PolarHBondContact O-N 2.75Å; L821-I824 PolarHBondContact O-N 3.35Å; A822-I824 VanDerWaalsContact C-N 3.34Å; A822-I824 PolarHBondContact O-N 3.37Å; I824-S826 VanDerWaalsContact C-N 3.33Å; I824-S826 PolarHBondContact O-N 3.41Å; I824-H827 WeakPolarHBondContact O-CB 3.47Å; I824-H827 PolarHBondContact O-N 3.44Å; I824-H827 VanDerWaalsContact O-N 3.12Å; I824-C828 WeakPolarHBondContact O-CB 3.47Å; I824-C828 PolarHBondContact O-N 3.19Å; I824-C828 PolarHBondContact O-SG 3.44Å; I824-C828 VanDerWaalsContact O-SG 3.35Å
825	F	88.3	Confident	80.8	Confident	1 Å²	1	37.4 Å²	37.4	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-39.4	179.6	-63.8	-38.9	0	0	0	112.4	L802 M805 F806 L809 L821 A822 F829 M992 L1036	L802-F825 HydrophobicContact CD2-CE1 4.25Å; M805-F825 HydrophobicContact CB-CE1 3.83Å; M805-F825 HydrophobicContact CB-CZ 3.74Å; M805-F825 HydrophobicContact CE-CD1 4.05Å; M805-F825 HydrophobicContact CE-CE1 3.59Å; M805-F825 HydrophobicContact CE-CZ 4.18Å; M805-F825 HydrophobicContact SD-CE1 4.24Å; F806-F825 HydrophobicContact CD1-CZ 4.38Å; F806-F825 HydrophobicContact CD2-CE1 4.16Å; F806-F825 AromaticContact CD2-CZ 3.93Å; F806-F825 HydrophobicContact CD2-CZ 3.93Å; F806-F825 HydrophobicContact CE1-CE2 4.25Å; F806-F825 HydrophobicContact CE1-CZ 4.3Å; F806-F825 HydrophobicContact CE2-CD1 4.4Å; F806-F825 AromaticContact CE2-CE1 3.79Å; F806-F825 HydrophobicContact CE2-CE1 3.79Å; F806-F825 HydrophobicContact CE2-CE2 4.47Å; F806-F825 AromaticContact CE2-CZ 3.82Å; F806-F825 HydrophobicContact CE2-CZ 3.82Å; F806-F825 HydrophobicContact CG-CZ 4.21Å; F806-F825 HydrophobicContact CZ-CE1 4.21Å; F806-F825 HydrophobicContact CZ-CE2 4.21Å; F806-F825 HydrophobicContact CZ-CZ 4.02Å; L809-F825 HydrophobicContact CD2-CE2 4.21Å; L821-F825 HydrophobicContact CB-CD2 4.49Å; L821-F825 HydrophobicContact CB-CE2 4.05Å; L821-F825 WeakPolarHBondContact O-CD2 3.21Å; L821-F825 VanDerWaalsContact O-CG 3.23Å; L821-F825 WeakPolarHBondContact O-CG 3.19Å; L821-F825 PolarHBondContact O-N 2.93Å; A822-F825 PolarHBondContact O-N 3.02Å; F825-F829 WeakPolarHBondContact O-CB 3.35Å; F825-F829 PolarHBondContact O-N 3.06Å; F825-F829 VanDerWaalsContact O-N 3.13Å; F825-M992 HydrophobicContact CB-SD 4.06Å; F825-M992 HydrophobicContact CD2-CE 4.24Å; F825-M992 HydrophobicContact CD2-SD 3.7Å; F825-M992 HydrophobicContact CG-SD 4.36Å; F825-L1036 HydrophobicContact CB-CD2 4.17Å; F825-L1036 HydrophobicContact CD1-CD2 3.48Å; F825-L1036 VanDerWaalsContact CD1-CD2 3.48Å; F825-L1036 HydrophobicContact CE1-CD2 4.18Å; F825-L1036 HydrophobicContact CG-CD2 4.13Å
826	S	86.5	Confident	79.7	Confident	21 Å²	21	38.2 Å²	38.2	15%	0.147	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-37.7	171.8	-61.3	0	0	0	0	113	A822 I824 F829 G830 L989 M992 P993	A822-S826 PolarHBondContact O-N 2.85Å; A822-S826 PolarHBondContact O-OG 2.92Å; I824-S826 VanDerWaalsContact C-N 3.33Å; I824-S826 PolarHBondContact O-N 3.41Å; S826-F829 PolarHBondContact O-N 3.46Å; S826-G830 PolarHBondContact O-N 3.48Å; S826-L989 WeakPolarHBondContact CA-O 3.5Å; S826-L989 WeakPolarHBondContact CB-O 3.32Å; S826-L989 PolarHBondContact OG-O 2.9Å; S826-M992 PolarHBondContact OG-N 3.06Å; S826-P993 WeakPolarHBondContact OG-CD 3.37Å
827	H	84.6	Confident	78.9	Confident	68 Å²	68	36.8 Å²	36.8	32%	0.315	24%	0.238	S	C	.	.	H	α-helix	trans	-63.4	-49.7	174.7	179.8	21.5	0	0	0	111.9	E790 A823 I824 F829 G830	E790-H827 IonicContact OE1-CE1 2.77Å; A823-H827 WeakPolarHBondContact O-CB 3.39Å; A823-H827 PolarHBondContact O-N 3.48Å; I824-H827 WeakPolarHBondContact O-CB 3.47Å; I824-H827 PolarHBondContact O-N 3.44Å; I824-H827 VanDerWaalsContact O-N 3.12Å; H827-F829 VanDerWaalsContact C-N 3.26Å; H827-F829 PolarHBondContact O-N 2.89Å; H827-G830 PolarHBondContact O-N 3.45Å
828	C	82.8	Confident	77.9	Confident	4 Å²	4	41 Å²	41	3%	0.027	27%	0.265	C	S	.	.	H	α-helix	trans	-66.3	-23.3	179.4	-66.5	0	0	0	0	114	I824 L1036 I1040	I824-C828 WeakPolarHBondContact O-CB 3.47Å; I824-C828 PolarHBondContact O-N 3.19Å; I824-C828 PolarHBondContact O-SG 3.44Å; I824-C828 VanDerWaalsContact O-SG 3.35Å; C828-L1036 HydrophobicContact CB-CD1 4.06Å; C828-I1040 HydrophobicContact CB-CD1 4.03Å; C828-I1040 HydrophobicContact CB-CG1 4.44Å
829	F	80.8	Confident	76.8	Confident	10 Å²	10	47 Å²	47	4%	0.044	29%	0.294	C	S	.	.	H	α-helix	trans	-79.7	-40.5	172.6	-168.9	-97.8	0	0	0	112	F825 S826 H827 A832 L989 Q990 I1035 L1036 R1039	F825-F829 WeakPolarHBondContact O-CB 3.35Å; F825-F829 PolarHBondContact O-N 3.06Å; F825-F829 VanDerWaalsContact O-N 3.13Å; S826-F829 PolarHBondContact O-N 3.46Å; H827-F829 VanDerWaalsContact C-N 3.26Å; H827-F829 PolarHBondContact O-N 2.89Å; F829-A832 HydrophobicContact CE1-CB 4.22Å; F829-L989 HydrophobicContact CB-CB 4.19Å; F829-L989 HydrophobicContact CD1-CB 4.44Å; F829-L989 HydrophobicContact CD2-CB 3.92Å; F829-L989 HydrophobicContact CD2-CD1 3.63Å; F829-L989 HydrophobicContact CD2-CG 4.43Å; F829-L989 HydrophobicContact CE2-CB 4.45Å; F829-L989 HydrophobicContact CE2-CD1 3.92Å; F829-L989 HydrophobicContact CG-CB 3.92Å; F829-L989 HydrophobicContact CG-CD1 4.45Å; F829-Q990 HydrophobicContact CD1-CB 4.09Å; F829-Q990 HydrophobicContact CE1-CB 4.32Å; F829-I1035 HydrophobicContact CE2-CG2 4.07Å; F829-L1036 HydrophobicContact CB-CD1 4.12Å; F829-L1036 HydrophobicContact CD2-CD1 4.37Å; F829-R1039 HydrophobicContact CD2-CB 4.26Å; F829-R1039 HydrophobicContact CD2-CG 4Å; F829-R1039 HydrophobicContact CE2-CB 4.45Å; F829-R1039 HydrophobicContact CE2-CG 4.33Å; F829-R1039 PolarHBondContact O-NE 3.43Å
830	G	77.3	Confident	75.5	Confident	25 Å²	25	50.3 Å²	50.3	26%	0.258	31%	0.31	S	S	.	.			trans	76.4	-174.9	177.7	0	0	0	0	0	114.5	S826 H827 A832 Q990	S826-G830 PolarHBondContact O-N 3.48Å; H827-G830 PolarHBondContact O-N 3.45Å; G830-A832 PolarHBondContact O-N 2.69Å; G830-Q990 PolarHBondContact O-NE2 3.07Å
831	S	68.7	Low	73.7	Confident	122 Å²	122	56.6 Å²	56.6	85%	0.853	34%	0.337	S	S	*	.	S	Bend	trans	-78.7	37.3	177.9	67.2	0	0	0	0	113.2
832	A	61.5	Low	71.8	Confident	15 Å²	15	58.6 Å²	58.6	12%	0.124	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-66	144.6	-179.1	0	0	0	0	0	111.4	F829 G830 Q990	F829-A832 HydrophobicContact CE1-CB 4.22Å; G830-A832 PolarHBondContact O-N 2.69Å; A832-Q990 PolarHBondContact O-NE2 3.17Å
833	P	63.3	Low	70	Confident	121 Å²	121	63.9 Å²	63.9	79%	0.786	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-65.9	141.4	169.4	29.1	-33.9	0	0	0	110
834	L	69.3	Low	68.5	Low	51 Å²	51	64.5 Å²	64.5	27%	0.267	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-60.4	149.8	177.6	-63.7	175.2	0	0	0	111.3	A836 F987	L834-A836 PolarHBondContact O-N 3.19Å; L834-A836 VanDerWaalsContact O-N 3.12Å; L834-F987 HydrophobicContact CD1-CD2 4.42Å; L834-F987 HydrophobicContact CD2-CB 4.06Å
835	P	63.8	Low	66.8	Low	56 Å²	56	68.8 Å²	68.8	36%	0.364	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-51.3	118.6	177.6	-28.3	35.1	0	0	0	112.5	I837 S986	P835-I837 PolarHBondContact O-N 2.74Å; P835-S986 WeakPolarHBondContact CD-OG 3.44Å; P835-S986 WeakPolarHBondContact CG-OG 3.35Å
836	A	62.3	Low	65.3	Low	96 Å²	96	71.1 Å²	71.1	79%	0.793	44%	0.437	S	S	*	.			trans	-75.3	106.7	-178.7	0	0	0	0	0	110.3	L834 P838	L834-A836 PolarHBondContact O-N 3.19Å; L834-A836 VanDerWaalsContact O-N 3.12Å; A836-P838 VanDerWaalsContact O-CD 3.23Å; A836-P838 WeakPolarHBondContact O-CD 3.39Å
837	I	71.6	Confident	64.2	Low	14 Å²	14	76.4 Å²	76.4	7%	0.072	46%	0.46	C	S	.	.			trans	-61.4	115.8	177.4	-60.1	-174.2	0	0	0	109.3	P835 E839 R950 E953 L954 D979 L980	P835-I837 PolarHBondContact O-N 2.74Å; I837-E839 PolarHBondContact O-N 3.36Å; I837-R950 VanDerWaalsContact CG2-NE 3.35Å; I837-E953 HydrophobicContact CD1-CB 4.15Å; I837-L954 HydrophobicContact CB-CD2 4.04Å; I837-L954 HydrophobicContact CB-CG 4.49Å; I837-L954 HydrophobicContact CG2-CD2 4.17Å; I837-L954 HydrophobicContact CG2-CG 4.12Å; I837-L954 WeakPolarHBondContact O-CD2 3.39Å; I837-D979 HydrophobicContact CG1-CB 4.37Å; I837-L980 HydrophobicContact CD1-CD1 4.38Å
838	P	65.4	Low	63.2	Low	87 Å²	87	76.2 Å²	76.2	57%	0.565	46%	0.461	S	S	*	.			trans	-69.1	134.8	-176.9	20.8	-29.3	0	0	0	112.6	A836 M840 R950	A836-P838 VanDerWaalsContact O-CD 3.23Å; A836-P838 WeakPolarHBondContact O-CD 3.39Å; P838-M840 PolarHBondContact O-N 3.22Å; P838-R950 VanDerWaalsContact CD-NH2 3.28Å; P838-R950 PolarHBondContact O-NE 3.08Å; P838-R950 PolarHBondContact O-NH2 3.39Å
839	E	62.9	Low	62.4	Low	130 Å²	130	79.9 Å²	79.9	61%	0.607	48%	0.48	S	S	*	.			trans	-71.8	117.4	-178	-63.2	-171.3	154.9	0	0	112.3	I837 K841 L954	I837-E839 PolarHBondContact O-N 3.36Å; E839-K841 PolarHBondContact O-N 3.37Å; E839-L954 HydrophobicContact CG-CD1 4.08Å; E839-L954 HydrophobicContact CG-CD2 4.43Å
840	M	59.9	Low	61.8	Low	122 Å²	122	83.4 Å²	83.4	60%	0.601	50%	0.504	S	S	*	.			trans	-78	101.2	171.2	-171.1	-177.4	-170.2	0	0	110.1	P838 A842 R950	P838-M840 PolarHBondContact O-N 3.22Å; M840-A842 HydrophobicContact CE-CB 4.4Å; M840-A842 HydrophobicContact CG-CB 4.23Å; M840-A842 PolarHBondContact O-N 3.25Å; M840-A842 HydrophobicContact SD-CB 4.4Å; M840-R950 HydrophobicContact CB-CB 4.48Å; M840-R950 HydrophobicContact CB-CG 3.97Å
841	K	50.9	Low	61.4	Low	195 Å²	195	88.4 Å²	88.4	85%	0.848	52%	0.524	S	S	*	.			trans	-74	61.7	171.2	-68.2	-174.6	178.4	178.7	0	111.7	E839 S843	E839-K841 PolarHBondContact O-N 3.37Å; K841-S843 PolarHBondContact O-N 3.16Å
842	A	48.8	Very low	61.5	Low	41 Å²	41	85.9 Å²	85.9	34%	0.339	50%	0.498	S	S	.	.			trans	-70.2	114.4	172.3	0	0	0	0	0	109.7	M840 L844 A947	M840-A842 HydrophobicContact CE-CB 4.4Å; M840-A842 HydrophobicContact CG-CB 4.23Å; M840-A842 PolarHBondContact O-N 3.25Å; M840-A842 HydrophobicContact SD-CB 4.4Å; A842-L844 PolarHBondContact O-N 3.25Å; A842-A947 HydrophobicContact CB-CB 3.87Å
843	S	49.5	Very low	62.2	Low	113 Å²	113	87.1 Å²	87.1	79%	0.79	50%	0.502	S	S	*	.			trans	-71.5	92.7	170	55.7	0	0	0	0	109.5	K841 S845	K841-S843 PolarHBondContact O-N 3.16Å; S843-S845 PolarHBondContact O-N 3.26Å
844	L	54.9	Low	62.9	Low	54 Å²	54	83.6 Å²	83.6	28%	0.283	48%	0.477	S	S	.	.			trans	-56.3	112.5	171.8	-69	169	0	0	0	108.7	A842 A846 Y917 G921	A842-L844 PolarHBondContact O-N 3.25Å; L844-A846 VanDerWaalsContact C-N 3.28Å; L844-A846 PolarHBondContact O-N 3.29Å; L844-Y917 HydrophobicContact CD1-CE1 4.31Å; L844-G921 VanDerWaalsContact CD1-CA 3.46Å
845	S	50.3	Low	63.4	Low	99 Å²	99	83.4 Å²	83.4	69%	0.692	48%	0.476	S	S	*	.	S	Bend	trans	-78.2	-5.4	-159	47.2	0	0	0	0	115.4	S843	S843-S845 PolarHBondContact O-N 3.26Å
846	A	56.3	Low	64.1	Low	50 Å²	50	84.1 Å²	84.1	41%	0.413	48%	0.48	S	S	.	.			trans	-151.7	94.4	170	0	0	0	0	0	109.8	L844 L876	L844-A846 VanDerWaalsContact C-N 3.28Å; L844-A846 PolarHBondContact O-N 3.29Å; A846-L876 HydrophobicContact CB-CD2 3.9Å
847	Q	62.5	Low	64.6	Low	131 Å²	131	86.5 Å²	86.5	61%	0.612	48%	0.48	S	S	*	.			trans	-77.7	139.4	165.3	-71.3	179	-18.7	0	0	109.4	Y919	Q847-Y919 WeakPolarHBondContact CA-O 3.34Å
848	L	64.9	Low	64.6	Low	64 Å²	64	91 Å²	91	34%	0.335	50%	0.502	S	S	.	.			trans	-129.4	152.9	174.4	-83.6	169.2	0	0	0	110.5	F852 L876 Y919	L848-F852 HydrophobicContact CB-CD2 4.31Å; L848-F852 HydrophobicContact CD2-CD2 4.15Å; L848-F852 HydrophobicContact CD2-CE2 4.27Å; L848-L876 HydrophobicContact CD1-CD1 3.63Å; L848-L876 HydrophobicContact CD1-CD2 3.78Å; L848-L876 HydrophobicContact CD1-CG 4.18Å; L848-Y919 HydrophobicContact CB-CD1 4.38Å; L848-Y919 PolarHBondContact N-O 3.08Å
849	D	65.4	Low	65.2	Low	82 Å²	82	88.1 Å²	88.1	44%	0.439	48%	0.484	S	S	.	.			trans	-58.9	139.3	179.3	-167.2	-61.4	0	0	0	111.1	L851 F852	D849-L851 PolarHBondContact O-N 2.94Å; D849-L851 VanDerWaalsContact OD1-CB 3.32Å; D849-L851 WeakPolarHBondContact OD1-CB 3.35Å; D849-L851 WeakPolarHBondContact OD1-CD1 3.33Å; D849-L851 WeakPolarHBondContact OD1-CG 3.37Å; D849-L851 PolarHBondContact OD1-N 3.45Å; D849-F852 HydrophobicContact CB-CD2 3.87Å; D849-F852 HydrophobicContact CB-CE2 3.99Å; D849-F852 WeakPolarHBondContact O-CD2 3.48Å; D849-F852 PolarHBondContact O-N 2.95Å
850	P	67.6	Low	65.9	Low	83 Å²	83	85.6 Å²	85.6	54%	0.539	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-44.4	-28.5	170.2	-30	33.3	0	0	0	115.4	F852 L853	P850-F852 PolarHBondContact O-N 3.08Å; P850-F852 VanDerWaalsContact O-N 3.14Å; P850-L853 VanDerWaalsContact O-CB 3.31Å; P850-L853 WeakPolarHBondContact O-CB 3.24Å; P850-L853 PolarHBondContact O-N 3.25Å
851	L	69.3	Low	66.9	Low	130 Å²	130	80.1 Å²	80.1	68%	0.681	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-59.2	-17.8	175.3	-69	168.2	0	0	0	114.8	D849 N855	D849-L851 PolarHBondContact O-N 2.94Å; D849-L851 VanDerWaalsContact OD1-CB 3.32Å; D849-L851 WeakPolarHBondContact OD1-CB 3.35Å; D849-L851 WeakPolarHBondContact OD1-CD1 3.33Å; D849-L851 WeakPolarHBondContact OD1-CG 3.37Å; D849-L851 PolarHBondContact OD1-N 3.45Å; L851-N855 PolarHBondContact O-ND2 2.76Å
852	F	70.6	Confident	68.4	Low	70 Å²	70	72.5 Å²	72.5	31%	0.307	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-92.1	-4.9	176	-64.9	-78.2	0	0	0	113.8	L848 D849 P850 M858 H873 Y919	L848-F852 HydrophobicContact CB-CD2 4.31Å; L848-F852 HydrophobicContact CD2-CD2 4.15Å; L848-F852 HydrophobicContact CD2-CE2 4.27Å; D849-F852 HydrophobicContact CB-CD2 3.87Å; D849-F852 HydrophobicContact CB-CE2 3.99Å; D849-F852 WeakPolarHBondContact O-CD2 3.48Å; D849-F852 PolarHBondContact O-N 2.95Å; P850-F852 PolarHBondContact O-N 3.08Å; P850-F852 VanDerWaalsContact O-N 3.14Å; F852-M858 HydrophobicContact CE1-CE 4.32Å; F852-H873 PolarHBondContact O-CE1 3.15Å; F852-Y919 HydrophobicContact CB-CD1 4.21Å; F852-Y919 HydrophobicContact CB-CE1 4.13Å; F852-Y919 WeakPolarHBondContact O-CE1 3.26Å
853	L	76.2	Confident	70	Confident	41 Å²	41	70.6 Å²	70.6	22%	0.215	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	123.2	-179.7	-172.8	68.6	0	0	0	110.9	P850 N855 F870 M915 Y919	P850-L853 VanDerWaalsContact O-CB 3.31Å; P850-L853 WeakPolarHBondContact O-CB 3.24Å; P850-L853 PolarHBondContact O-N 3.25Å; L853-N855 VanDerWaalsContact C-N 3.26Å; L853-N855 PolarHBondContact O-N 2.93Å; L853-F870 HydrophobicContact CD1-CE1 4.48Å; L853-F870 HydrophobicContact CD1-CZ 4.01Å; L853-F870 HydrophobicContact CG-CZ 4.42Å; L853-M915 HydrophobicContact CD1-CB 3.86Å; L853-Y919 HydrophobicContact CD1-CD2 4.24Å; L853-Y919 HydrophobicContact CD1-CE2 4.49Å; L853-Y919 HydrophobicContact CD1-CG 4.26Å
854	N	79.7	Confident	71.7	Confident	47 Å²	47	67 Å²	67	25%	0.251	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	31.9	176.8	-159.5	28.6	0	0	0	115	F870 Y871 Y908	N854-F870 HydrophobicContact CB-CD2 4.47Å; N854-F870 HydrophobicContact CB-CE1 4.23Å; N854-F870 HydrophobicContact CB-CE2 4.02Å; N854-F870 HydrophobicContact CB-CZ 3.88Å; N854-F870 WeakPolarHBondContact OD1-CA 3.45Å; N854-Y871 WeakPolarHBondContact CA-O 3.19Å; N854-Y871 PolarHBondContact N-O 3.11Å; N854-Y871 WeakPolarHBondContact OD1-CD2 3.38Å; N854-Y871 PolarHBondContact OD1-N 3.04Å; N854-Y908 PolarHBondContact ND2-OH 3.42Å
855	N	79.8	Confident	73	Confident	47 Å²	47	64.5 Å²	64.5	25%	0.251	36%	0.36	S	S	.	.			trans	-94	118.3	-179.7	-174	-26.9	0	0	0	111	L851 L853 D857 S859	L851-N855 PolarHBondContact O-ND2 2.76Å; L853-N855 VanDerWaalsContact C-N 3.26Å; L853-N855 PolarHBondContact O-N 2.93Å; N855-D857 PolarHBondContact O-N 3.2Å; N855-D857 PolarHBondContact OD1-N 3.15Å; N855-S859 PolarHBondContact O-N 3.5Å; N855-S859 PolarHBondContact O-OG 3.24Å
856	P	77.1	Confident	74.5	Confident	70 Å²	70	65.1 Å²	65.1	46%	0.455	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-28.2	-173.4	29.1	-36.2	0	0	0	114.2	M858 S859 Y871	P856-M858 VanDerWaalsContact C-N 3.32Å; P856-M858 PolarHBondContact O-N 2.99Å; P856-S859 PolarHBondContact O-OG 2.99Å; P856-Y871 HydrophobicContact CB-CD1 4.16Å; P856-Y871 HydrophobicContact CB-CD2 4.01Å; P856-Y871 HydrophobicContact CB-CE1 4.06Å; P856-Y871 HydrophobicContact CB-CE2 3.92Å; P856-Y871 HydrophobicContact CB-CG 4.14Å
857	D	74.1	Confident	75.3	Confident	147 Å²	147	65.5 Å²	65.5	79%	0.786	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-18.2	-173.8	-65.1	-32.3	0	0	0	112.8	N855	N855-D857 PolarHBondContact O-N 3.2Å; N855-D857 PolarHBondContact OD1-N 3.15Å
858	M	70.5	Confident	76.2	Confident	108 Å²	108	64.3 Å²	64.3	53%	0.532	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-15.5	-173.4	-60.2	-60.1	-64.6	0	0	113.8	F852 P856 H873	F852-M858 HydrophobicContact CE1-CE 4.32Å; P856-M858 VanDerWaalsContact C-N 3.32Å; P856-M858 PolarHBondContact O-N 2.99Å; M858-H873 PolarHBondContact O-CD2 3.43Å; M858-H873 PolarHBondContact O-NE2 2.83Å
859	S	77.6	Confident	77	Confident	27 Å²	27	63.9 Å²	63.9	19%	0.189	36%	0.356	C	S	.	.			trans	-74	145.9	-178.3	58.6	0	0	0	0	114	N855 P856 Y871 G872	N855-S859 PolarHBondContact O-N 3.5Å; N855-S859 PolarHBondContact O-OG 3.24Å; P856-S859 PolarHBondContact O-OG 2.99Å; S859-Y871 WeakPolarHBondContact OG-CD1 3.34Å; S859-G872 WeakPolarHBondContact CA-O 3.33Å; S859-G872 VanDerWaalsContact CB-O 3.23Å; S859-G872 WeakPolarHBondContact CB-O 3.38Å
860	D	78.6	Confident	77.9	Confident	76 Å²	76	60 Å²	60	41%	0.406	34%	0.335	S	S	.	.	S	Bend	trans	-111.1	1.4	172.6	72.1	-8.5	0	0	0	113.3	G872 H873 K874	D860-G872 PolarHBondContact N-O 2.56Å; D860-H873 VanDerWaalsContact OD1-CA 3.25Å; D860-H873 WeakPolarHBondContact OD1-CA 3.46Å; D860-K874 VanDerWaalsContact O-CE 3.3Å; D860-K874 WeakPolarHBondContact O-CE 3.44Å; D860-K874 PolarHBondContact O-NZ 3.38Å; D860-K874 WeakPolarHBondContact OD1-CG 3.44Å; D860-K874 PolarHBondContact OD1-N 2.94Å; D860-K874 WeakPolarHBondContact OD2-CB 3.38Å
861	V	80	Confident	78.7	Confident	8 Å²	8	59.3 Å²	59.3	5%	0.048	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	141.5	171.1	57.7	0	0	0	0	112	F863 G872 K874 L877 L888 I901	V861-F863 HydrophobicContact CB-CE2 4.44Å; V861-F863 HydrophobicContact CG1-CE2 3.67Å; V861-F863 HydrophobicContact CG1-CZ 4.08Å; V861-F863 HydrophobicContact CG2-CD2 4.42Å; V861-F863 HydrophobicContact CG2-CE1 4.36Å; V861-F863 HydrophobicContact CG2-CE2 3.91Å; V861-F863 HydrophobicContact CG2-CZ 3.87Å; V861-G872 WeakPolarHBondContact CG1-O 3.38Å; V861-G872 PolarHBondContact N-O 2.81Å; V861-G872 PolarHBondContact O-N 3.5Å; V861-K874 HydrophobicContact CB-CG 3.91Å; V861-K874 HydrophobicContact CG1-CG 3.9Å; V861-L877 HydrophobicContact CG1-CD1 4.33Å; V861-L888 HydrophobicContact CG2-CD2 4.09Å; V861-I901 HydrophobicContact CG2-CD1 3.97Å
862	T	82.5	Confident	79.4	Confident	34 Å²	34	53.1 Å²	53.1	21%	0.209	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.7	171.5	-46.8	0	0	0	0	109.4	P869 F870 Y871 E900 I901	T862-P869 HydrophobicContact CG2-CB 3.85Å; T862-F870 WeakPolarHBondContact CA-O 3.45Å; T862-Y871 HydrophobicContact CG2-CD1 4.17Å; T862-Y871 HydrophobicContact CG2-CE1 3.93Å; T862-E900 WeakPolarHBondContact O-CA 3.13Å; T862-I901 PolarHBondContact O-N 2.76Å
863	F	83.8	Confident	80	Confident	1 Å²	1	51.2 Å²	51.2	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	144.1	168.7	-61.5	-84.3	0	0	0	109.7	V861 V865 P869 F870 L877 F884 I901 I903 F911	V861-F863 HydrophobicContact CB-CE2 4.44Å; V861-F863 HydrophobicContact CG1-CE2 3.67Å; V861-F863 HydrophobicContact CG1-CZ 4.08Å; V861-F863 HydrophobicContact CG2-CD2 4.42Å; V861-F863 HydrophobicContact CG2-CE1 4.36Å; V861-F863 HydrophobicContact CG2-CE2 3.91Å; V861-F863 HydrophobicContact CG2-CZ 3.87Å; F863-V865 HydrophobicContact CB-CG2 4.11Å; F863-P869 CarbonylContact O-C 3.58Å; F863-P869 WeakPolarHBondContact O-CA 3.34Å; F863-F870 HydrophobicContact CB-CB 4.46Å; F863-F870 PolarHBondContact N-O 3.32Å; F863-F870 PolarHBondContact O-N 2.79Å; F863-L877 HydrophobicContact CE2-CD1 3.56Å; F863-L877 HydrophobicContact CZ-CD1 3.63Å; F863-F884 HydrophobicContact CE1-CE1 4.35Å; F863-F884 HydrophobicContact CZ-CD1 4.47Å; F863-F884 HydrophobicContact CZ-CE1 4.32Å; F863-I901 CarbonylContact C-O 3.58Å; F863-I901 VanDerWaalsContact CA-O 3.26Å; F863-I901 WeakPolarHBondContact CA-O 3.3Å; F863-I901 HydrophobicContact CD1-CB 3.69Å; F863-I901 HydrophobicContact CD1-CG2 3.85Å; F863-I901 HydrophobicContact CE1-CB 3.97Å; F863-I901 HydrophobicContact CE1-CD1 4.12Å; F863-I901 HydrophobicContact CE1-CG2 3.96Å; F863-I903 HydrophobicContact CB-CD1 4.24Å; F863-I903 HydrophobicContact CD1-CD1 3.67Å; F863-I903 HydrophobicContact CD1-CG1 4.32Å; F863-I903 HydrophobicContact CE1-CD1 4.41Å; F863-I903 HydrophobicContact CG-CD1 4.18Å; F863-F911 HydrophobicContact CB-CE1 4.26Å; F863-F911 HydrophobicContact CB-CZ 4.29Å; F863-F911 HydrophobicContact CD1-CZ 4.44Å; F863-F911 HydrophobicContact CD2-CE1 4.31Å; F863-F911 HydrophobicContact CD2-CZ 4.08Å; F863-F911 HydrophobicContact CG-CE1 4.34Å; F863-F911 AromaticContact CG-CZ 4Å; F863-F911 HydrophobicContact CG-CZ 4Å
864	L	83.6	Confident	80	Confident	39 Å²	39	53 Å²	53	20%	0.204	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	108.3	173.9	-171.5	72.7	0	0	0	108.4	I901 E902 I903	L864-I901 PolarHBondContact N-O 3.34Å; L864-E902 CarbonylContact O-C 3.59Å; L864-E902 WeakPolarHBondContact O-CA 3.46Å; L864-I903 PolarHBondContact O-N 3.23Å
865	V	83.2	Confident	79.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.5	-173.1	-166.2	0	0	0	0	108.5	F863 G867 K868 I903 V906 Y908 F911	F863-V865 HydrophobicContact CB-CG2 4.11Å; V865-G867 PolarHBondContact O-N 3.33Å; V865-K868 PolarHBondContact N-O 3.03Å; V865-K868 WeakPolarHBondContact O-CB 3.41Å; V865-K868 PolarHBondContact O-N 2.98Å; V865-I903 HydrophobicContact CG2-CB 4.21Å; V865-I903 HydrophobicContact CG2-CD1 4.36Å; V865-V906 WeakPolarHBondContact CG1-O 3.5Å; V865-Y908 HydrophobicContact CB-CD2 4.04Å; V865-F911 HydrophobicContact CG1-CB 4.12Å; V865-F911 HydrophobicContact CG1-CG 4.43Å; V865-F911 HydrophobicContact CG2-CD1 3.86Å; V865-F911 HydrophobicContact CG2-CE1 4.17Å; V865-F911 HydrophobicContact CG2-CG 4.08Å
866	E	81.4	Confident	79.7	Confident	112 Å²	112	54.8 Å²	54.8	52%	0.523	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	35.1	-169.4	-57.9	179.5	127.9	0	0	113.4	K868 Y908	E866-K868 VanDerWaalsContact C-N 3.28Å; E866-K868 PolarHBondContact O-N 2.93Å; E866-Y908 VanDerWaalsContact OE2-CB 3.26Å; E866-Y908 WeakPolarHBondContact OE2-CB 3.4Å; E866-Y908 PolarHBondContact OE2-N 3.15Å
867	G	72.3	Confident	79.7	Confident	59 Å²	59	51.5 Å²	51.5	61%	0.608	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	10.6	-177	0	0	0	0	0	115.5	V865	V865-G867 PolarHBondContact O-N 3.33Å
868	K	81.7	Confident	79.8	Confident	106 Å²	106	47.9 Å²	47.9	46%	0.461	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	138.9	175	-62.7	164.9	-173.1	157.1	0	110.6	V865 E866 Y908	V865-K868 PolarHBondContact N-O 3.03Å; V865-K868 WeakPolarHBondContact O-CB 3.41Å; V865-K868 PolarHBondContact O-N 2.98Å; E866-K868 VanDerWaalsContact C-N 3.28Å; E866-K868 PolarHBondContact O-N 2.93Å; K868-Y908 HydrophobicContact CB-CD2 3.55Å; K868-Y908 HydrophobicContact CB-CE2 3.44Å; K868-Y908 VanDerWaalsContact CB-CE2 3.44Å; K868-Y908 HydrophobicContact CB-CG 4.48Å; K868-Y908 HydrophobicContact CD-CD1 4.3Å; K868-Y908 HydrophobicContact CD-CD2 3.74Å; K868-Y908 HydrophobicContact CD-CE2 4.12Å; K868-Y908 HydrophobicContact CD-CG 3.84Å; K868-Y908 HydrophobicContact CG-CD2 4.3Å; K868-Y908 HydrophobicContact CG-CE2 4.45Å
869	P	82.9	Confident	80.1	Confident	55 Å²	55	46.9 Å²	46.9	36%	0.357	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	144.6	174	29.2	-34.1	0	0	0	111.7	T862 F863 Y871 Y908	T862-P869 HydrophobicContact CG2-CB 3.85Å; F863-P869 CarbonylContact O-C 3.58Å; F863-P869 WeakPolarHBondContact O-CA 3.34Å; P869-Y871 HydrophobicContact CB-CE2 4.22Å; P869-Y871 HydrophobicContact CG-CE2 4.45Å; P869-Y908 WeakPolarHBondContact O-CE2 3.35Å; P869-Y908 PolarHBondContact O-OH 3.33Å
870	F	84.6	Confident	79.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124.4	168.7	-166.4	-74.6	0	0	0	109.8	L853 N854 T862 F863 Y908 F911 Q912 M915	L853-F870 HydrophobicContact CD1-CE1 4.48Å; L853-F870 HydrophobicContact CD1-CZ 4.01Å; L853-F870 HydrophobicContact CG-CZ 4.42Å; N854-F870 HydrophobicContact CB-CD2 4.47Å; N854-F870 HydrophobicContact CB-CE1 4.23Å; N854-F870 HydrophobicContact CB-CE2 4.02Å; N854-F870 HydrophobicContact CB-CZ 3.88Å; N854-F870 WeakPolarHBondContact OD1-CA 3.45Å; T862-F870 WeakPolarHBondContact CA-O 3.45Å; F863-F870 HydrophobicContact CB-CB 4.46Å; F863-F870 PolarHBondContact N-O 3.32Å; F863-F870 PolarHBondContact O-N 2.79Å; F870-Y908 HydrophobicContact CB-CE2 4.23Å; F870-Y908 HydrophobicContact CD2-CE2 4.19Å; F870-Y908 AromaticContact CD2-CZ 3.93Å; F870-F911 HydrophobicContact CB-CD1 4.33Å; F870-F911 HydrophobicContact CB-CE1 4.16Å; F870-F911 HydrophobicContact CD1-CD1 4.22Å; F870-F911 AromaticContact CD1-CE1 3.76Å; F870-F911 HydrophobicContact CD1-CE1 3.76Å; F870-F911 HydrophobicContact CD2-CD1 4.14Å; F870-F911 HydrophobicContact CD2-CE1 4.48Å; F870-F911 HydrophobicContact CE1-CE1 4.32Å; F870-F911 AromaticContact CG-CD1 3.95Å; F870-F911 HydrophobicContact CG-CD1 3.95Å; F870-F911 AromaticContact CG-CE1 3.86Å; F870-F911 HydrophobicContact CG-CE1 3.86Å; F870-Q912 HydrophobicContact CE2-CB 3.9Å; F870-Q912 HydrophobicContact CE2-CG 4.05Å; F870-M915 HydrophobicContact CD1-CE 4.19Å; F870-M915 HydrophobicContact CD1-CG 4.37Å; F870-M915 HydrophobicContact CE1-CB 3.83Å; F870-M915 HydrophobicContact CE1-CE 3.66Å; F870-M915 HydrophobicContact CE1-CG 3.69Å; F870-M915 HydrophobicContact CZ-CB 3.67Å; F870-M915 HydrophobicContact CZ-CG 3.92Å
871	Y	83.7	Confident	80.1	Confident	69 Å²	69	44.4 Å²	44.4	27%	0.271	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	133	-172.3	-61.9	-75.2	0	0	0	111.8	N854 P856 S859 T862 P869	N854-Y871 WeakPolarHBondContact CA-O 3.19Å; N854-Y871 PolarHBondContact N-O 3.11Å; N854-Y871 WeakPolarHBondContact OD1-CD2 3.38Å; N854-Y871 PolarHBondContact OD1-N 3.04Å; P856-Y871 HydrophobicContact CB-CD1 4.16Å; P856-Y871 HydrophobicContact CB-CD2 4.01Å; P856-Y871 HydrophobicContact CB-CE1 4.06Å; P856-Y871 HydrophobicContact CB-CE2 3.92Å; P856-Y871 HydrophobicContact CB-CG 4.14Å; S859-Y871 WeakPolarHBondContact OG-CD1 3.34Å; T862-Y871 HydrophobicContact CG2-CD1 4.17Å; T862-Y871 HydrophobicContact CG2-CE1 3.93Å; P869-Y871 HydrophobicContact CB-CE2 4.22Å; P869-Y871 HydrophobicContact CG-CE2 4.45Å
872	G	82.7	Confident	80	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	177.5	-175.1	0	0	0	0	0	115.7	S859 D860 V861 Y919	S859-G872 WeakPolarHBondContact CA-O 3.33Å; S859-G872 VanDerWaalsContact CB-O 3.23Å; S859-G872 WeakPolarHBondContact CB-O 3.38Å; D860-G872 PolarHBondContact N-O 2.56Å; V861-G872 WeakPolarHBondContact CG1-O 3.38Å; V861-G872 PolarHBondContact N-O 2.81Å; V861-G872 PolarHBondContact O-N 3.5Å; G872-Y919 WeakPolarHBondContact CA-OH 3.36Å
873	H	83.9	Confident	79.9	Confident	30 Å²	30	50.6 Å²	50.6	14%	0.139	28%	0.276	C	S	.	.			trans	-117.8	118.7	-178	-53.4	89.3	0	0	0	111.8	F852 M858 D860 V875 L876 L877 Y919	F852-H873 PolarHBondContact O-CE1 3.15Å; M858-H873 PolarHBondContact O-CD2 3.43Å; M858-H873 PolarHBondContact O-NE2 2.83Å; D860-H873 VanDerWaalsContact OD1-CA 3.25Å; D860-H873 WeakPolarHBondContact OD1-CA 3.46Å; H873-V875 VanDerWaalsContact C-N 3.35Å; H873-V875 PolarHBondContact O-N 3.29Å; H873-L876 HydrophobicContact CB-CD1 3.84Å; H873-L876 HydrophobicContact CB-CG 4.09Å; H873-L876 PolarHBondContact O-N 3.09Å; H873-L877 WeakPolarHBondContact O-CG 3.49Å; H873-L877 PolarHBondContact O-N 3.29Å; H873-Y919 AromaticContact CE1-CE1 3.94Å; H873-Y919 PolarHBondContact N-OH 3.44Å; H873-Y919 AromaticContact ND1-CE1 3.46Å; H873-Y919 WeakPolarHBondContact ND1-CE1 3.25Å; H873-Y919 AromaticContact ND1-CZ 3.54Å; H873-Y919 PolarHBondContact ND1-OH 3.29Å
874	K	76.4	Confident	79.8	Confident	79 Å²	79	50.5 Å²	50.5	34%	0.343	28%	0.276	S	S	.	.	H	α-helix	trans	-56.4	-43.7	-177.7	-71.5	167.1	170.8	138.9	0	112.6	D860 V861 L876 L877 I878 L888	D860-K874 VanDerWaalsContact O-CE 3.3Å; D860-K874 WeakPolarHBondContact O-CE 3.44Å; D860-K874 PolarHBondContact O-NZ 3.38Å; D860-K874 WeakPolarHBondContact OD1-CG 3.44Å; D860-K874 PolarHBondContact OD1-N 2.94Å; D860-K874 WeakPolarHBondContact OD2-CB 3.38Å; V861-K874 HydrophobicContact CB-CG 3.91Å; V861-K874 HydrophobicContact CG1-CG 3.9Å; K874-L876 VanDerWaalsContact C-N 3.32Å; K874-L876 PolarHBondContact O-N 3.23Å; K874-L877 PolarHBondContact O-N 3.02Å; K874-I878 HydrophobicContact CB-CD1 4.18Å; K874-I878 VanDerWaalsContact O-CB 3.32Å; K874-I878 WeakPolarHBondContact O-CB 3.48Å; K874-I878 WeakPolarHBondContact O-CD1 3.46Å; K874-I878 WeakPolarHBondContact O-CG1 3.31Å; K874-I878 PolarHBondContact O-N 2.76Å; K874-L888 HydrophobicContact CB-CD1 4.3Å; K874-L888 HydrophobicContact CG-CD1 4.24Å; K874-L888 HydrophobicContact CG-CD2 4.05Å
875	V	75.4	Confident	79.6	Confident	105 Å²	105	53.5 Å²	53.5	64%	0.636	29%	0.287	S	S	*	.	H	α-helix	trans	-60.4	-41.5	-175.5	-178.7	0	0	0	0	111.6	H873 T879	H873-V875 VanDerWaalsContact C-N 3.35Å; H873-V875 PolarHBondContact O-N 3.29Å; V875-T879 WeakPolarHBondContact O-CB 3.44Å; V875-T879 PolarHBondContact O-N 3.31Å; V875-T879 PolarHBondContact O-OG1 3.29Å
876	L	77	Confident	79.4	Confident	25 Å²	25	56.6 Å²	56.6	13%	0.131	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-51.6	175.2	-57.7	172.4	0	0	0	110.7	A846 L848 H873 K874 I878 T879 S880 Y919	A846-L876 HydrophobicContact CB-CD2 3.9Å; L848-L876 HydrophobicContact CD1-CD1 3.63Å; L848-L876 HydrophobicContact CD1-CD2 3.78Å; L848-L876 HydrophobicContact CD1-CG 4.18Å; H873-L876 HydrophobicContact CB-CD1 3.84Å; H873-L876 HydrophobicContact CB-CG 4.09Å; H873-L876 PolarHBondContact O-N 3.09Å; K874-L876 VanDerWaalsContact C-N 3.32Å; K874-L876 PolarHBondContact O-N 3.23Å; L876-I878 PolarHBondContact O-N 3.4Å; L876-T879 CarbonylContact O-C 3.18Å; L876-T879 WeakPolarHBondContact O-CA 3.3Å; L876-T879 WeakPolarHBondContact O-CB 3.1Å; L876-T879 PolarHBondContact O-N 2.91Å; L876-S880 WeakPolarHBondContact O-CB 3.04Å; L876-S880 PolarHBondContact O-N 3.22Å; L876-S880 PolarHBondContact O-OG 2.93Å; L876-Y919 HydrophobicContact CD1-CD1 4.18Å; L876-Y919 HydrophobicContact CD1-CD2 4.23Å; L876-Y919 HydrophobicContact CD1-CE1 3.8Å; L876-Y919 HydrophobicContact CD1-CE2 3.82Å; L876-Y919 HydrophobicContact CD1-CG 4.4Å
877	L	77.5	Confident	79.2	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-65.5	-39.6	-173.5	-64.7	173.7	0	0	0	112.4	V861 F863 H873 K874 T879 S880 S881 F884 L888 M915 L918	V861-L877 HydrophobicContact CG1-CD1 4.33Å; F863-L877 HydrophobicContact CE2-CD1 3.56Å; F863-L877 HydrophobicContact CZ-CD1 3.63Å; H873-L877 WeakPolarHBondContact O-CG 3.49Å; H873-L877 PolarHBondContact O-N 3.29Å; K874-L877 PolarHBondContact O-N 3.02Å; L877-T879 VanDerWaalsContact C-N 3.28Å; L877-T879 PolarHBondContact O-N 2.83Å; L877-S880 WeakPolarHBondContact CA-OG 3.37Å; L877-S880 PolarHBondContact O-N 3.26Å; L877-S880 PolarHBondContact O-OG 3.08Å; L877-S881 PolarHBondContact O-N 3.38Å; L877-S881 VanDerWaalsContact O-N 3.13Å; L877-F884 HydrophobicContact CB-CB 3.95Å; L877-F884 HydrophobicContact CB-CD1 4.42Å; L877-F884 HydrophobicContact CB-CD2 4.43Å; L877-F884 HydrophobicContact CB-CG 4.04Å; L877-F884 HydrophobicContact CD2-CD1 4.49Å; L877-F884 HydrophobicContact CD2-CD2 4.03Å; L877-F884 HydrophobicContact CD2-CE1 4.48Å; L877-F884 HydrophobicContact CD2-CE2 4.03Å; L877-F884 HydrophobicContact CD2-CG 4.28Å; L877-F884 HydrophobicContact CD2-CZ 4.27Å; L877-F884 VanDerWaalsContact O-CB 3.31Å; L877-F884 WeakPolarHBondContact O-CB 3.25Å; L877-L888 HydrophobicContact CB-CD1 4.23Å; L877-M915 HydrophobicContact CD1-CE 4.26Å; L877-M915 HydrophobicContact CD2-CE 4.1Å; L877-M915 HydrophobicContact CD2-SD 3.78Å; L877-L918 HydrophobicContact CD2-CD1 3.9Å
878	I	77.4	Confident	79.4	Confident	71 Å²	71	51.8 Å²	51.8	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-62.8	-35.9	172.9	-70.3	166.8	0	0	0	111.4	K874 L876 K885 L888	K874-I878 HydrophobicContact CB-CD1 4.18Å; K874-I878 VanDerWaalsContact O-CB 3.32Å; K874-I878 WeakPolarHBondContact O-CB 3.48Å; K874-I878 WeakPolarHBondContact O-CD1 3.46Å; K874-I878 WeakPolarHBondContact O-CG1 3.31Å; K874-I878 PolarHBondContact O-N 2.76Å; L876-I878 PolarHBondContact O-N 3.4Å; I878-K885 HydrophobicContact CB-CB 4.5Å; I878-K885 HydrophobicContact CG1-CB 4.45Å; I878-K885 HydrophobicContact CG2-CB 4.25Å; I878-K885 HydrophobicContact CG2-CD 4.16Å; I878-K885 HydrophobicContact CG2-CG 4.05Å; I878-L888 HydrophobicContact CD1-CD1 4.14Å; I878-L888 HydrophobicContact CG1-CD1 3.66Å
879	T	75.9	Confident	79	Confident	87 Å²	87	50.1 Å²	50.1	53%	0.534	28%	0.279	S	S	.	.	H	α-helix	trans	-79.3	-29.3	179.2	-53.7	0	0	0	0	112	V875 L876 L877	V875-T879 WeakPolarHBondContact O-CB 3.44Å; V875-T879 PolarHBondContact O-N 3.31Å; V875-T879 PolarHBondContact O-OG1 3.29Å; L876-T879 CarbonylContact O-C 3.18Å; L876-T879 WeakPolarHBondContact O-CA 3.3Å; L876-T879 WeakPolarHBondContact O-CB 3.1Å; L876-T879 PolarHBondContact O-N 2.91Å; L877-T879 VanDerWaalsContact C-N 3.28Å; L877-T879 PolarHBondContact O-N 2.83Å
880	S	72.3	Confident	78.1	Confident	43 Å²	43	51.7 Å²	51.7	30%	0.301	29%	0.291	S	S	.	.	H	α-helix	trans	-86.4	-23.6	-177.1	69.4	0	0	0	0	114.9	L876 L877	L876-S880 WeakPolarHBondContact O-CB 3.04Å; L876-S880 PolarHBondContact O-N 3.22Å; L876-S880 PolarHBondContact O-OG 2.93Å; L877-S880 WeakPolarHBondContact CA-OG 3.37Å; L877-S880 PolarHBondContact O-N 3.26Å; L877-S880 PolarHBondContact O-OG 3.08Å
881	S	83.2	Confident	76.9	Confident	8 Å²	8	53.4 Å²	53.4	6%	0.056	30%	0.303	C	S	.	.			trans	-156.6	132.8	179.1	175.3	0	0	0	0	113.6	L877 K883 F884 K885 F943	L877-S881 PolarHBondContact O-N 3.38Å; L877-S881 VanDerWaalsContact O-N 3.13Å; S881-K883 PolarHBondContact O-N 3.33Å; S881-K883 PolarHBondContact OG-N 3.06Å; S881-F884 PolarHBondContact O-N 3.24Å; S881-K885 WeakPolarHBondContact O-CB 3.38Å; S881-K885 PolarHBondContact O-N 3.28Å; S881-F943 WeakPolarHBondContact CB-O 3.35Å; S881-F943 PolarHBondContact OG-O 3.17Å
882	D	77.6	Confident	75.5	Confident	111 Å²	111	53 Å²	53	59%	0.594	32%	0.319	S	S	*	.	H	α-helix	trans	-61.2	-22.4	167.8	-75.5	-59.2	0	0	0	113.3	K885 S886	D882-K885 WeakPolarHBondContact OD1-CD 3.39Å; D882-K885 IonicContact OD1-NZ 3.5Å; D882-K885 PolarHBondContact OD1-NZ 3.18Å; D882-S886 WeakPolarHBondContact O-CB 3.39Å; D882-S886 PolarHBondContact O-N 3.1Å; D882-S886 PolarHBondContact O-OG 3.18Å
883	K	81.4	Confident	73.9	Confident	61 Å²	61	57.8 Å²	57.8	27%	0.265	35%	0.353	S	S	.	.	H	α-helix	trans	-76	-41.9	173.9	-162.2	-173.6	-175.5	-168.8	0	112	S881 K885 S886 L887 Q942 F943	S881-K883 PolarHBondContact O-N 3.33Å; S881-K883 PolarHBondContact OG-N 3.06Å; K883-K885 VanDerWaalsContact C-N 3.3Å; K883-K885 PolarHBondContact O-N 2.78Å; K883-S886 WeakPolarHBondContact CA-OG 3.46Å; K883-S886 PolarHBondContact O-N 3.27Å; K883-S886 PolarHBondContact O-OG 3.21Å; K883-L887 HydrophobicContact CG-CD1 4.32Å; K883-L887 WeakPolarHBondContact O-CB 3.21Å; K883-L887 VanDerWaalsContact O-CG 3.3Å; K883-L887 WeakPolarHBondContact O-CG 3.13Å; K883-L887 PolarHBondContact O-N 3.18Å; K883-Q942 WeakPolarHBondContact CD-O 3.35Å; K883-Q942 WeakPolarHBondContact CE-O 3.35Å; K883-Q942 PolarHBondContact NZ-O 3.12Å; K883-F943 HydrophobicContact CD-CD1 4.5Å
884	F	81.4	Confident	72	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-62.3	-42.3	172.1	-86	-59.3	0	0	0	110.8	F863 L877 S881 S886 L887 L888 F911 M914 L918 F943	F863-F884 HydrophobicContact CE1-CE1 4.35Å; F863-F884 HydrophobicContact CZ-CD1 4.47Å; F863-F884 HydrophobicContact CZ-CE1 4.32Å; L877-F884 HydrophobicContact CB-CB 3.95Å; L877-F884 HydrophobicContact CB-CD1 4.42Å; L877-F884 HydrophobicContact CB-CD2 4.43Å; L877-F884 HydrophobicContact CB-CG 4.04Å; L877-F884 HydrophobicContact CD2-CD1 4.49Å; L877-F884 HydrophobicContact CD2-CD2 4.03Å; L877-F884 HydrophobicContact CD2-CE1 4.48Å; L877-F884 HydrophobicContact CD2-CE2 4.03Å; L877-F884 HydrophobicContact CD2-CG 4.28Å; L877-F884 HydrophobicContact CD2-CZ 4.27Å; L877-F884 VanDerWaalsContact O-CB 3.31Å; L877-F884 WeakPolarHBondContact O-CB 3.25Å; S881-F884 PolarHBondContact O-N 3.24Å; F884-S886 PolarHBondContact O-N 3.04Å; F884-L887 PolarHBondContact O-N 3.43Å; F884-L888 VanDerWaalsContact O-CB 3.3Å; F884-L888 WeakPolarHBondContact O-CB 3.44Å; F884-L888 WeakPolarHBondContact O-CD1 3.43Å; F884-L888 WeakPolarHBondContact O-CG 3.37Å; F884-L888 PolarHBondContact O-N 2.86Å; F884-F911 HydrophobicContact CZ-CE2 4.26Å; F884-M914 HydrophobicContact CE2-CE 4.35Å; F884-M914 HydrophobicContact CZ-CE 3.87Å; F884-L918 HydrophobicContact CE2-CD1 4.23Å; F884-F943 HydrophobicContact CD1-CD1 4.21Å; F884-F943 HydrophobicContact CD1-CE1 4.22Å; F884-F943 HydrophobicContact CD2-CD1 4.15Å; F884-F943 AromaticContact CE1-CD1 3.71Å; F884-F943 HydrophobicContact CE1-CD1 3.71Å; F884-F943 AromaticContact CE1-CE1 3.54Å; F884-F943 HydrophobicContact CE1-CE1 3.54Å; F884-F943 HydrophobicContact CE1-CZ 4.48Å; F884-F943 HydrophobicContact CE2-CB 4.26Å; F884-F943 AromaticContact CE2-CD1 3.64Å; F884-F943 HydrophobicContact CE2-CD1 3.64Å; F884-F943 HydrophobicContact CE2-CE1 4.3Å; F884-F943 HydrophobicContact CE2-CG 4.11Å; F884-F943 HydrophobicContact CG-CD1 4.4Å; F884-F943 AromaticContact CZ-CD1 3.39Å; F884-F943 HydrophobicContact CZ-CD1 3.39Å; F884-F943 AromaticContact CZ-CE1 3.58Å; F884-F943 HydrophobicContact CZ-CE1 3.58Å; F884-F943 HydrophobicContact CZ-CG 4.06Å; F884-F943 HydrophobicContact CZ-CZ 4.38Å
885	K	78.9	Confident	70.8	Confident	102 Å²	102	62.6 Å²	62.6	44%	0.443	41%	0.406	S	S	.	.	H	α-helix	trans	-56.3	-42.8	170.5	179.9	175.7	164.4	-162.9	0	113	I878 S881 D882 K883 A889	I878-K885 HydrophobicContact CB-CB 4.5Å; I878-K885 HydrophobicContact CG1-CB 4.45Å; I878-K885 HydrophobicContact CG2-CB 4.25Å; I878-K885 HydrophobicContact CG2-CD 4.16Å; I878-K885 HydrophobicContact CG2-CG 4.05Å; S881-K885 WeakPolarHBondContact O-CB 3.38Å; S881-K885 PolarHBondContact O-N 3.28Å; D882-K885 WeakPolarHBondContact OD1-CD 3.39Å; D882-K885 IonicContact OD1-NZ 3.5Å; D882-K885 PolarHBondContact OD1-NZ 3.18Å; K883-K885 VanDerWaalsContact C-N 3.3Å; K883-K885 PolarHBondContact O-N 2.78Å; K885-A889 WeakPolarHBondContact O-CB 2.94Å; K885-A889 PolarHBondContact O-N 3.08Å
886	S	78.8	Confident	69.4	Low	65 Å²	65	60.7 Å²	60.7	46%	0.455	40%	0.397	S	S	.	.	H	α-helix	trans	-69.1	-42.1	176.5	66.8	0	0	0	0	113	D882 K883 F884 A889 S890	D882-S886 WeakPolarHBondContact O-CB 3.39Å; D882-S886 PolarHBondContact O-N 3.1Å; D882-S886 PolarHBondContact O-OG 3.18Å; K883-S886 WeakPolarHBondContact CA-OG 3.46Å; K883-S886 PolarHBondContact O-N 3.27Å; K883-S886 PolarHBondContact O-OG 3.21Å; F884-S886 PolarHBondContact O-N 3.04Å; S886-A889 PolarHBondContact O-N 3.28Å; S886-S890 PolarHBondContact O-N 3.11Å; S886-S890 PolarHBondContact O-OG 3.13Å; S886-S890 VanDerWaalsContact O-OG 3.14Å
887	L	77.8	Confident	68.1	Low	54 Å²	54	66.1 Å²	66.1	28%	0.283	43%	0.434	S	S	.	.	H	α-helix	trans	-61.5	-47.6	176.9	-71.3	166	0	0	0	110.8	K883 F884 S890 S891 F943	K883-L887 HydrophobicContact CG-CD1 4.32Å; K883-L887 WeakPolarHBondContact O-CB 3.21Å; K883-L887 VanDerWaalsContact O-CG 3.3Å; K883-L887 WeakPolarHBondContact O-CG 3.13Å; K883-L887 PolarHBondContact O-N 3.18Å; F884-L887 PolarHBondContact O-N 3.43Å; L887-S890 WeakPolarHBondContact CA-OG 3.48Å; L887-S890 PolarHBondContact O-N 3.23Å; L887-S890 PolarHBondContact O-OG 2.68Å; L887-S891 PolarHBondContact O-N 3.15Å; L887-F943 HydrophobicContact CD1-CD1 4.48Å; L887-F943 HydrophobicContact CD1-CE1 3.89Å
888	L	76.6	Confident	67	Low	15 Å²	15	70.8 Å²	70.8	8%	0.079	47%	0.467	C	S	.	.	H	α-helix	trans	-64.6	-40.4	177.1	-68.9	168.8	0	0	0	111.8	V861 K874 L877 I878 F884 S891 I901	V861-L888 HydrophobicContact CG2-CD2 4.09Å; K874-L888 HydrophobicContact CB-CD1 4.3Å; K874-L888 HydrophobicContact CG-CD1 4.24Å; K874-L888 HydrophobicContact CG-CD2 4.05Å; L877-L888 HydrophobicContact CB-CD1 4.23Å; I878-L888 HydrophobicContact CD1-CD1 4.14Å; I878-L888 HydrophobicContact CG1-CD1 3.66Å; F884-L888 VanDerWaalsContact O-CB 3.3Å; F884-L888 WeakPolarHBondContact O-CB 3.44Å; F884-L888 WeakPolarHBondContact O-CD1 3.43Å; F884-L888 WeakPolarHBondContact O-CG 3.37Å; F884-L888 PolarHBondContact O-N 2.86Å; L888-S891 PolarHBondContact O-N 3.15Å; L888-S891 PolarHBondContact O-OG 2.74Å; L888-I901 HydrophobicContact CD2-CD1 3.63Å
889	A	72.6	Confident	66.1	Low	72 Å²	72	70.9 Å²	70.9	60%	0.595	46%	0.464	S	S	*	.	H	α-helix	trans	-63.4	-43.4	174.4	0	0	0	0	0	112.6	K885 S886 S891 G892	K885-A889 WeakPolarHBondContact O-CB 2.94Å; K885-A889 PolarHBondContact O-N 3.08Å; S886-A889 PolarHBondContact O-N 3.28Å; A889-S891 PolarHBondContact O-N 3.17Å; A889-G892 PolarHBondContact O-N 3.38Å
890	S	65.5	Low	65.7	Low	87 Å²	87	72.7 Å²	72.7	61%	0.608	47%	0.467	S	S	*	.	H	α-helix	trans	-64.4	-25.1	177.7	57.5	0	0	0	0	113.6	S886 L887 G892	S886-S890 PolarHBondContact O-N 3.11Å; S886-S890 PolarHBondContact O-OG 3.13Å; S886-S890 VanDerWaalsContact O-OG 3.14Å; L887-S890 WeakPolarHBondContact CA-OG 3.48Å; L887-S890 PolarHBondContact O-N 3.23Å; L887-S890 PolarHBondContact O-OG 2.68Å; S890-G892 PolarHBondContact O-N 2.98Å
891	S	58.5	Low	65.9	Low	36 Å²	36	72 Å²	72	25%	0.252	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-70.1	-17.4	173.6	79.6	0	0	0	0	113.8	L887 L888 A889 S893 K899	L887-S891 PolarHBondContact O-N 3.15Å; L888-S891 PolarHBondContact O-N 3.15Å; L888-S891 PolarHBondContact O-OG 2.74Å; A889-S891 PolarHBondContact O-N 3.17Å; S891-S893 PolarHBondContact O-N 2.89Å; S891-K899 WeakPolarHBondContact O-CD 3.43Å; S891-K899 PolarHBondContact O-NZ 3.07Å
892	G	54.6	Low	65.6	Low	60 Å²	60	78.4 Å²	78.4	62%	0.619	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-84.5	-3.6	-163.8	0	0	0	0	0	117.8	A889 S890	A889-G892 PolarHBondContact O-N 3.38Å; S890-G892 PolarHBondContact O-N 2.98Å
893	S	49.2	Very low	65.8	Low	102 Å²	102	73.9 Å²	73.9	71%	0.713	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-83	-12.9	-170.4	63.8	0	0	0	0	116.5	S891	S891-S893 PolarHBondContact O-N 2.89Å
894	D	44.3	Very low	65.3	Low	114 Å²	114	75.6 Å²	75.6	61%	0.61	48%	0.484	S	S	*	.	S	Bend	trans	-128	125.8	-179.8	-77.3	-66.1	0	0	0	111.2	S896 K899	D894-S896 PolarHBondContact O-N 3.44Å; D894-K899 VanDerWaalsContact O-CE 3.28Å; D894-K899 WeakPolarHBondContact O-CE 3.47Å; D894-K899 PolarHBondContact O-NZ 2.91Å
895	G	50.1	Low	64.9	Low	95 Å²	95	81 Å²	81	98%	0.979	51%	0.512	S	S	*	.			trans	-79.7	67.1	-168.7	0	0	0	0	0	115.5
896	S	47.3	Very low	65.1	Low	65 Å²	65	76.7 Å²	76.7	46%	0.455	50%	0.495	S	S	.	.			trans	-110.9	141.1	164.1	58.9	0	0	0	0	111	D894 S898 K899	D894-S896 PolarHBondContact O-N 3.44Å; S896-S898 VanDerWaalsContact C-N 3.33Å; S896-S898 PolarHBondContact O-N 3.49Å; S896-K899 VanDerWaalsContact OG-CE 3.3Å; S896-K899 WeakPolarHBondContact OG-CE 3.37Å
897	P	49.3	Very low	65.4	Low	139 Å²	139	78.1 Å²	78.1	90%	0.903	49%	0.493	S	S	*	.	S	Bend	trans	-80.1	-8.1	-166.8	31.9	-37.2	0	0	0	115
898	S	54.7	Low	65.7	Low	99 Å²	99	77.4 Å²	77.4	69%	0.692	49%	0.487	S	S	*	.			trans	-138.4	92	-174.8	56.7	0	0	0	0	110.3	S896	S896-S898 VanDerWaalsContact C-N 3.33Å; S896-S898 PolarHBondContact O-N 3.49Å
899	K	57.8	Low	66	Low	73 Å²	73	81.2 Å²	81.2	32%	0.317	50%	0.504	S	S	.	.			trans	-107.8	104.1	169.7	-70.3	-174.4	-174.2	175.1	0	109.1	S891 D894 S896	S891-K899 WeakPolarHBondContact O-CD 3.43Å; S891-K899 PolarHBondContact O-NZ 3.07Å; D894-K899 VanDerWaalsContact O-CE 3.28Å; D894-K899 WeakPolarHBondContact O-CE 3.47Å; D894-K899 PolarHBondContact O-NZ 2.91Å; S896-K899 VanDerWaalsContact OG-CE 3.3Å; S896-K899 WeakPolarHBondContact OG-CE 3.37Å
900	E	67.4	Low	66.6	Low	126 Å²	126	78 Å²	78	59%	0.589	48%	0.476	S	S	*	.			trans	-66.9	130.5	163.5	-63.1	176.2	168.1	0	0	108	T862	T862-E900 WeakPolarHBondContact O-CA 3.13Å
901	I	76.3	Confident	67.5	Low	27 Å²	27	73.8 Å²	73.8	14%	0.138	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	105.5	-179.5	-61.5	179.2	0	0	0	108.3	V861 T862 F863 L864 L888	V861-I901 HydrophobicContact CG2-CD1 3.97Å; T862-I901 PolarHBondContact O-N 2.76Å; F863-I901 CarbonylContact C-O 3.58Å; F863-I901 VanDerWaalsContact CA-O 3.26Å; F863-I901 WeakPolarHBondContact CA-O 3.3Å; F863-I901 HydrophobicContact CD1-CB 3.69Å; F863-I901 HydrophobicContact CD1-CG2 3.85Å; F863-I901 HydrophobicContact CE1-CB 3.97Å; F863-I901 HydrophobicContact CE1-CD1 4.12Å; F863-I901 HydrophobicContact CE1-CG2 3.96Å; L864-I901 PolarHBondContact N-O 3.34Å; L888-I901 HydrophobicContact CD2-CD1 3.63Å
902	E	78.3	Confident	68.7	Low	144 Å²	144	75.7 Å²	75.7	67%	0.673	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.6	179.8	-168.9	170	-159	0	0	111.8	L864	L864-E902 CarbonylContact O-C 3.59Å; L864-E902 WeakPolarHBondContact O-CA 3.46Å
903	I	80.8	Confident	69.9	Low	15 Å²	15	73.2 Å²	73.2	8%	0.077	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	99.2	174.2	-57.9	176.9	0	0	0	107.2	F863 L864 V865 V906 F911 F943	F863-I903 HydrophobicContact CB-CD1 4.24Å; F863-I903 HydrophobicContact CD1-CD1 3.67Å; F863-I903 HydrophobicContact CD1-CG1 4.32Å; F863-I903 HydrophobicContact CE1-CD1 4.41Å; F863-I903 HydrophobicContact CG-CD1 4.18Å; L864-I903 PolarHBondContact O-N 3.23Å; V865-I903 HydrophobicContact CG2-CB 4.21Å; V865-I903 HydrophobicContact CG2-CD1 4.36Å; I903-V906 HydrophobicContact CG2-CB 4.26Å; I903-V906 HydrophobicContact CG2-CG2 4.47Å; I903-F911 HydrophobicContact CD1-CD2 3.94Å; I903-F911 HydrophobicContact CD1-CE2 3.28Å; I903-F911 HydrophobicContact CD1-CZ 3.66Å; I903-F943 HydrophobicContact CD1-CZ 4.16Å; I903-F943 HydrophobicContact CG2-CZ 4.3Å
904	S	72.1	Confident	71.5	Confident	97 Å²	97	68.4 Å²	68.4	68%	0.678	39%	0.391	S	S	*	.			trans	-75.8	-29.3	180	46.2	0	0	0	0	114
905	D	73	Confident	73.3	Confident	113 Å²	113	63 Å²	63	60%	0.604	36%	0.362	S	S	*	.	S	Bend	trans	-96.3	-0	-158.1	-58.1	-5.2	0	0	0	114.2	Q942	D905-Q942 PolarHBondContact OD2-NE2 3.22Å
906	V	83.3	Confident	74.7	Confident	12 Å²	12	59.1 Å²	59.1	7%	0.073	32%	0.32	C	S	.	.	S	Bend	trans	-137.1	132.6	-175.6	-177.9	0	0	0	0	109.9	V865 I903 I910 F911 A939 F943	V865-V906 WeakPolarHBondContact CG1-O 3.5Å; I903-V906 HydrophobicContact CG2-CB 4.26Å; I903-V906 HydrophobicContact CG2-CG2 4.47Å; V906-I910 HydrophobicContact CG1-CB 3.86Å; V906-I910 HydrophobicContact CG1-CG2 3.86Å; V906-F911 HydrophobicContact CG1-CB 4.14Å; V906-A939 HydrophobicContact CG1-CB 4.2Å; V906-A939 HydrophobicContact CG2-CB 4.09Å; V906-F943 HydrophobicContact CG2-CE2 4.14Å
907	K	84.6	Confident	76.2	Confident	95 Å²	95	57 Å²	57	41%	0.413	30%	0.302	S	S	.	.			trans	-65.1	148.3	176.7	-57.5	176.6	-168.5	155.4	0	111.5	H909 I910 F911 E935	K907-H909 VanDerWaalsContact C-N 3.26Å; K907-H909 PolarHBondContact O-N 2.91Å; K907-H909 VanDerWaalsContact O-N 3.14Å; K907-I910 HydrophobicContact CB-CG1 4.24Å; K907-I910 PolarHBondContact O-N 2.91Å; K907-F911 PolarHBondContact O-N 2.81Å; K907-E935 WeakPolarHBondContact CD-OE2 3.49Å; K907-E935 WeakPolarHBondContact CE-OE2 3.43Å; K907-E935 IonicContact NZ-OE1 2.64Å; K907-E935 PolarHBondContact NZ-OE1 2.67Å; K907-E935 IonicContact NZ-OE2 2.67Å; K907-E935 PolarHBondContact NZ-OE2 3.18Å
908	Y	84	Confident	77.6	Confident	40 Å²	40	51.3 Å²	51.3	16%	0.157	26%	0.264	C	S	.	.	H	α-helix	trans	-53.5	-40.9	-177.5	-170.8	-90.3	0	0	0	113.1	N854 V865 E866 K868 P869 F870 F911 Q912	N854-Y908 PolarHBondContact ND2-OH 3.42Å; V865-Y908 HydrophobicContact CB-CD2 4.04Å; E866-Y908 VanDerWaalsContact OE2-CB 3.26Å; E866-Y908 WeakPolarHBondContact OE2-CB 3.4Å; E866-Y908 PolarHBondContact OE2-N 3.15Å; K868-Y908 HydrophobicContact CB-CD2 3.55Å; K868-Y908 HydrophobicContact CB-CE2 3.44Å; K868-Y908 VanDerWaalsContact CB-CE2 3.44Å; K868-Y908 HydrophobicContact CB-CG 4.48Å; K868-Y908 HydrophobicContact CD-CD1 4.3Å; K868-Y908 HydrophobicContact CD-CD2 3.74Å; K868-Y908 HydrophobicContact CD-CE2 4.12Å; K868-Y908 HydrophobicContact CD-CG 3.84Å; K868-Y908 HydrophobicContact CG-CD2 4.3Å; K868-Y908 HydrophobicContact CG-CE2 4.45Å; P869-Y908 WeakPolarHBondContact O-CE2 3.35Å; P869-Y908 PolarHBondContact O-OH 3.33Å; F870-Y908 HydrophobicContact CB-CE2 4.23Å; F870-Y908 HydrophobicContact CD2-CE2 4.19Å; F870-Y908 AromaticContact CD2-CZ 3.93Å; Y908-F911 PolarHBondContact O-N 3.45Å; Y908-Q912 WeakPolarHBondContact O-CB 3.44Å; Y908-Q912 PolarHBondContact O-N 3.41Å
909	H	83.2	Confident	78.6	Confident	94 Å²	94	46.6 Å²	46.6	44%	0.435	23%	0.231	S	C	.	.	H	α-helix	trans	-68.2	-41.5	179.7	-173.7	48	0	0	0	112.9	K907 F911 Q912 M913	K907-H909 VanDerWaalsContact C-N 3.26Å; K907-H909 PolarHBondContact O-N 2.91Å; K907-H909 VanDerWaalsContact O-N 3.14Å; H909-F911 VanDerWaalsContact C-N 3.35Å; H909-Q912 WeakPolarHBondContact O-CB 3.42Å; H909-Q912 PolarHBondContact O-N 2.84Å; H909-M913 WeakPolarHBondContact O-CG 3.42Å; H909-M913 PolarHBondContact O-N 2.88Å
910	I	83.6	Confident	79.2	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-67.2	-39.2	177.6	-55.8	-57.5	0	0	0	110.3	V906 K907 M913 M914 D932 E935 L936 A939	V906-I910 HydrophobicContact CG1-CB 3.86Å; V906-I910 HydrophobicContact CG1-CG2 3.86Å; K907-I910 HydrophobicContact CB-CG1 4.24Å; K907-I910 PolarHBondContact O-N 2.91Å; I910-M913 HydrophobicContact CD1-SD 4.38Å; I910-M913 PolarHBondContact O-N 3.29Å; I910-M914 PolarHBondContact O-N 3.39Å; I910-D932 HydrophobicContact CD1-CB 3.89Å; I910-E935 HydrophobicContact CD1-CB 4.1Å; I910-E935 HydrophobicContact CG1-CB 4.08Å; I910-E935 HydrophobicContact CG2-CB 4.46Å; I910-L936 HydrophobicContact CG2-CB 4.12Å; I910-L936 HydrophobicContact CG2-CD1 4.03Å; I910-A939 HydrophobicContact CG2-CB 4.12Å
911	F	84.4	Confident	79.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-43.4	172.6	-169.1	-98.5	0	0	0	111.8	F863 V865 F870 F884 I903 V906 K907 Y908 H909 M913 M914 M915	F863-F911 HydrophobicContact CB-CE1 4.26Å; F863-F911 HydrophobicContact CB-CZ 4.29Å; F863-F911 HydrophobicContact CD1-CZ 4.44Å; F863-F911 HydrophobicContact CD2-CE1 4.31Å; F863-F911 HydrophobicContact CD2-CZ 4.08Å; F863-F911 HydrophobicContact CG-CE1 4.34Å; F863-F911 AromaticContact CG-CZ 4Å; F863-F911 HydrophobicContact CG-CZ 4Å; V865-F911 HydrophobicContact CG1-CB 4.12Å; V865-F911 HydrophobicContact CG1-CG 4.43Å; V865-F911 HydrophobicContact CG2-CD1 3.86Å; V865-F911 HydrophobicContact CG2-CE1 4.17Å; V865-F911 HydrophobicContact CG2-CG 4.08Å; F870-F911 HydrophobicContact CB-CD1 4.33Å; F870-F911 HydrophobicContact CB-CE1 4.16Å; F870-F911 HydrophobicContact CD1-CD1 4.22Å; F870-F911 AromaticContact CD1-CE1 3.76Å; F870-F911 HydrophobicContact CD1-CE1 3.76Å; F870-F911 HydrophobicContact CD2-CD1 4.14Å; F870-F911 HydrophobicContact CD2-CE1 4.48Å; F870-F911 HydrophobicContact CE1-CE1 4.32Å; F870-F911 AromaticContact CG-CD1 3.95Å; F870-F911 HydrophobicContact CG-CD1 3.95Å; F870-F911 AromaticContact CG-CE1 3.86Å; F870-F911 HydrophobicContact CG-CE1 3.86Å; F884-F911 HydrophobicContact CZ-CE2 4.26Å; I903-F911 HydrophobicContact CD1-CD2 3.94Å; I903-F911 HydrophobicContact CD1-CE2 3.28Å; I903-F911 HydrophobicContact CD1-CZ 3.66Å; V906-F911 HydrophobicContact CG1-CB 4.14Å; K907-F911 PolarHBondContact O-N 2.81Å; Y908-F911 PolarHBondContact O-N 3.45Å; H909-F911 VanDerWaalsContact C-N 3.35Å; F911-M913 PolarHBondContact O-N 2.98Å; F911-M914 HydrophobicContact CD2-CE 3.41Å; F911-M914 VanDerWaalsContact CD2-CE 3.41Å; F911-M914 HydrophobicContact CE2-CE 3.44Å; F911-M914 VanDerWaalsContact CE2-CE 3.44Å; F911-M914 HydrophobicContact CG-CE 4.37Å; F911-M914 HydrophobicContact CZ-CE 4.46Å; F911-M914 PolarHBondContact O-N 2.85Å; F911-M915 HydrophobicContact CD1-CG 3.95Å; F911-M915 HydrophobicContact CE1-CG 3.64Å; F911-M915 HydrophobicContact CE1-SD 4.22Å; F911-M915 HydrophobicContact CZ-CG 3.99Å; F911-M915 HydrophobicContact CZ-SD 4.07Å; F911-M915 WeakPolarHBondContact O-CB 3.5Å; F911-M915 VanDerWaalsContact O-CG 3.26Å; F911-M915 WeakPolarHBondContact O-CG 3.35Å; F911-M915 PolarHBondContact O-N 2.96Å
912	Q	84	Confident	78.5	Confident	75 Å²	75	40.3 Å²	40.3	35%	0.35	22%	0.22	S	C	.	.	H	α-helix	trans	-60.2	-41.7	173.7	-179.3	-178.3	14.9	0	0	112.3	F870 Y908 H909 M915 S916	F870-Q912 HydrophobicContact CE2-CB 3.9Å; F870-Q912 HydrophobicContact CE2-CG 4.05Å; Y908-Q912 WeakPolarHBondContact O-CB 3.44Å; Y908-Q912 PolarHBondContact O-N 3.41Å; H909-Q912 WeakPolarHBondContact O-CB 3.42Å; H909-Q912 PolarHBondContact O-N 2.84Å; Q912-M915 PolarHBondContact O-N 3.05Å; Q912-S916 WeakPolarHBondContact O-CB 3.35Å; Q912-S916 PolarHBondContact O-N 3.48Å
913	M	79.6	Confident	77.6	Confident	9 Å²	9	36.4 Å²	36.4	4%	0.044	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-49.5	175.2	-73.7	-179	77.2	0	0	111.5	H909 I910 F911 M915 S916 Y917 L926 T928 L936	H909-M913 WeakPolarHBondContact O-CG 3.42Å; H909-M913 PolarHBondContact O-N 2.88Å; I910-M913 HydrophobicContact CD1-SD 4.38Å; I910-M913 PolarHBondContact O-N 3.29Å; F911-M913 PolarHBondContact O-N 2.98Å; M913-M915 VanDerWaalsContact C-N 3.34Å; M913-M915 PolarHBondContact O-N 2.85Å; M913-S916 WeakPolarHBondContact O-CB 3.32Å; M913-S916 PolarHBondContact O-N 3.38Å; M913-S916 VanDerWaalsContact O-N 3.15Å; M913-S916 PolarHBondContact O-OG 3.36Å; M913-Y917 PolarHBondContact O-N 2.94Å; M913-Y917 VanDerWaalsContact O-N 3.15Å; M913-L926 HydrophobicContact CE-CD2 3.89Å; M913-T928 HydrophobicContact CE-CG2 4.23Å; M913-T928 WeakPolarHBondContact CE-OG1 3.15Å; M913-L936 HydrophobicContact CB-CD1 4.21Å; M913-L936 HydrophobicContact CB-CD2 4.27Å; M913-L936 HydrophobicContact CE-CD2 4.03Å
914	M	84.4	Confident	76.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56	-46.9	176	-178.9	177	67.4	0	0	111.7	F884 I910 F911 S916 Y917 L918 L936 F943 L945 L948	F884-M914 HydrophobicContact CE2-CE 4.35Å; F884-M914 HydrophobicContact CZ-CE 3.87Å; I910-M914 PolarHBondContact O-N 3.39Å; F911-M914 HydrophobicContact CD2-CE 3.41Å; F911-M914 VanDerWaalsContact CD2-CE 3.41Å; F911-M914 HydrophobicContact CE2-CE 3.44Å; F911-M914 VanDerWaalsContact CE2-CE 3.44Å; F911-M914 HydrophobicContact CG-CE 4.37Å; F911-M914 HydrophobicContact CZ-CE 4.46Å; F911-M914 PolarHBondContact O-N 2.85Å; M914-S916 PolarHBondContact O-N 3.46Å; M914-Y917 PolarHBondContact O-N 3.1Å; M914-L918 WeakPolarHBondContact O-CG 3.32Å; M914-L918 PolarHBondContact O-N 2.67Å; M914-L918 VanDerWaalsContact O-N 3.16Å; M914-L936 HydrophobicContact CB-CD1 3.83Å; M914-F943 HydrophobicContact CE-CD2 3.79Å; M914-F943 HydrophobicContact CE-CE2 3.98Å; M914-F943 HydrophobicContact CE-CG 4.18Å; M914-F943 HydrophobicContact CE-CZ 4.5Å; M914-F943 HydrophobicContact SD-CB 4.14Å; M914-F943 HydrophobicContact SD-CD2 3.76Å; M914-F943 HydrophobicContact SD-CE2 4.49Å; M914-F943 HydrophobicContact SD-CG 4.07Å; M914-L945 HydrophobicContact CG-CD1 3.6Å; M914-L945 HydrophobicContact SD-CD1 3.57Å; M914-L945 VanDerWaalsContact SD-CD1 3.57Å; M914-L948 HydrophobicContact CB-CD2 4.23Å; M914-L948 HydrophobicContact CG-CD2 3.75Å
915	M	81.1	Confident	75.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-37	177.2	-68.6	-67.6	-76.6	0	0	112.3	L853 F870 L877 F911 Q912 M913 Y917 L918 Y919	L853-M915 HydrophobicContact CD1-CB 3.86Å; F870-M915 HydrophobicContact CD1-CE 4.19Å; F870-M915 HydrophobicContact CD1-CG 4.37Å; F870-M915 HydrophobicContact CE1-CB 3.83Å; F870-M915 HydrophobicContact CE1-CE 3.66Å; F870-M915 HydrophobicContact CE1-CG 3.69Å; F870-M915 HydrophobicContact CZ-CB 3.67Å; F870-M915 HydrophobicContact CZ-CG 3.92Å; L877-M915 HydrophobicContact CD1-CE 4.26Å; L877-M915 HydrophobicContact CD2-CE 4.1Å; L877-M915 HydrophobicContact CD2-SD 3.78Å; F911-M915 HydrophobicContact CD1-CG 3.95Å; F911-M915 HydrophobicContact CE1-CG 3.64Å; F911-M915 HydrophobicContact CE1-SD 4.22Å; F911-M915 HydrophobicContact CZ-CG 3.99Å; F911-M915 HydrophobicContact CZ-SD 4.07Å; F911-M915 WeakPolarHBondContact O-CB 3.5Å; F911-M915 VanDerWaalsContact O-CG 3.26Å; F911-M915 WeakPolarHBondContact O-CG 3.35Å; F911-M915 PolarHBondContact O-N 2.96Å; Q912-M915 PolarHBondContact O-N 3.05Å; M913-M915 VanDerWaalsContact C-N 3.34Å; M913-M915 PolarHBondContact O-N 2.85Å; M915-Y917 VanDerWaalsContact C-N 3.32Å; M915-Y917 PolarHBondContact O-N 3.38Å; M915-L918 PolarHBondContact O-N 3.28Å; M915-L918 HydrophobicContact SD-CD1 4.27Å; M915-Y919 HydrophobicContact CE-CE2 3.83Å; M915-Y919 VanDerWaalsContact O-CD2 3.24Å; M915-Y919 WeakPolarHBondContact O-CD2 3.38Å; M915-Y919 PolarHBondContact O-N 3.18Å
916	S	79.5	Confident	75.4	Confident	15 Å²	15	34.9 Å²	34.9	11%	0.105	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-40.7	176.5	80.6	0	0	0	0	112.3	Q912 M913 M914 C920 S925	Q912-S916 WeakPolarHBondContact O-CB 3.35Å; Q912-S916 PolarHBondContact O-N 3.48Å; M913-S916 WeakPolarHBondContact O-CB 3.32Å; M913-S916 PolarHBondContact O-N 3.38Å; M913-S916 VanDerWaalsContact O-N 3.15Å; M913-S916 PolarHBondContact O-OG 3.36Å; M914-S916 PolarHBondContact O-N 3.46Å; S916-C920 VanDerWaalsContact O-CB 3.31Å; S916-C920 WeakPolarHBondContact O-CB 3.22Å; S916-C920 PolarHBondContact O-N 2.83Å; S916-C920 PolarHBondContact O-SG 3Å; S916-S925 PolarHBondContact OG-OG 3.02Å
917	Y	78.3	Confident	74.3	Confident	20 Å²	20	41.5 Å²	41.5	8%	0.078	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-42.4	176.7	178.4	-90.7	0	0	0	111.7	L844 M913 M914 M915 Y919 G921 L926 A947 L948 H951	L844-Y917 HydrophobicContact CD1-CE1 4.31Å; M913-Y917 PolarHBondContact O-N 2.94Å; M913-Y917 VanDerWaalsContact O-N 3.15Å; M914-Y917 PolarHBondContact O-N 3.1Å; M915-Y917 VanDerWaalsContact C-N 3.32Å; M915-Y917 PolarHBondContact O-N 3.38Å; Y917-Y919 VanDerWaalsContact C-N 3.27Å; Y917-Y919 PolarHBondContact O-N 2.87Å; Y917-G921 WeakPolarHBondContact O-CA 3.18Å; Y917-G921 PolarHBondContact O-N 2.9Å; Y917-L926 HydrophobicContact CD2-CD1 4.12Å; Y917-A947 PolarHBondContact OH-O 3.38Å; Y917-L948 HydrophobicContact CD1-CB 3.8Å; Y917-L948 HydrophobicContact CD1-CD1 3.83Å; Y917-L948 HydrophobicContact CD1-CD2 4.39Å; Y917-L948 HydrophobicContact CD1-CG 4.2Å; Y917-L948 HydrophobicContact CD2-CD1 3.95Å; Y917-L948 HydrophobicContact CE1-CB 3.64Å; Y917-L948 HydrophobicContact CE1-CD1 4.2Å; Y917-L948 HydrophobicContact CE1-CG 4.45Å; Y917-L948 HydrophobicContact CE2-CD1 4.29Å; Y917-L948 HydrophobicContact CG-CD1 3.7Å; Y917-H951 HydrophobicContact CE2-CB 4.4Å
918	L	78.4	Confident	73.2	Confident	19 Å²	19	39.8 Å²	39.8	10%	0.099	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-30.2	179.9	-72.8	178	0	0	0	113.8	L877 F884 M914 M915 L945	L877-L918 HydrophobicContact CD2-CD1 3.9Å; F884-L918 HydrophobicContact CE2-CD1 4.23Å; M914-L918 WeakPolarHBondContact O-CG 3.32Å; M914-L918 PolarHBondContact O-N 2.67Å; M914-L918 VanDerWaalsContact O-N 3.16Å; M915-L918 PolarHBondContact O-N 3.28Å; M915-L918 HydrophobicContact SD-CD1 4.27Å; L918-L945 HydrophobicContact CD1-CD1 4.11Å; L918-L945 HydrophobicContact CD2-CD1 4.2Å; L918-L945 HydrophobicContact CD2-CD2 3.95Å; L918-L945 HydrophobicContact CG-CD1 4.38Å
919	Y	76.2	Confident	72.6	Confident	1 Å²	1	42.6 Å²	42.6	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-89	-50.9	179	-77.8	-127.8	0	0	0	111.1	Q847 L848 F852 L853 G872 H873 L876 M915 Y917	Q847-Y919 WeakPolarHBondContact CA-O 3.34Å; L848-Y919 HydrophobicContact CB-CD1 4.38Å; L848-Y919 PolarHBondContact N-O 3.08Å; F852-Y919 HydrophobicContact CB-CD1 4.21Å; F852-Y919 HydrophobicContact CB-CE1 4.13Å; F852-Y919 WeakPolarHBondContact O-CE1 3.26Å; L853-Y919 HydrophobicContact CD1-CD2 4.24Å; L853-Y919 HydrophobicContact CD1-CE2 4.49Å; L853-Y919 HydrophobicContact CD1-CG 4.26Å; G872-Y919 WeakPolarHBondContact CA-OH 3.36Å; H873-Y919 AromaticContact CE1-CE1 3.94Å; H873-Y919 PolarHBondContact N-OH 3.44Å; H873-Y919 AromaticContact ND1-CE1 3.46Å; H873-Y919 WeakPolarHBondContact ND1-CE1 3.25Å; H873-Y919 AromaticContact ND1-CZ 3.54Å; H873-Y919 PolarHBondContact ND1-OH 3.29Å; L876-Y919 HydrophobicContact CD1-CD1 4.18Å; L876-Y919 HydrophobicContact CD1-CD2 4.23Å; L876-Y919 HydrophobicContact CD1-CE1 3.8Å; L876-Y919 HydrophobicContact CD1-CE2 3.82Å; L876-Y919 HydrophobicContact CD1-CG 4.4Å; M915-Y919 HydrophobicContact CE-CE2 3.83Å; M915-Y919 VanDerWaalsContact O-CD2 3.24Å; M915-Y919 WeakPolarHBondContact O-CD2 3.38Å; M915-Y919 PolarHBondContact O-N 3.18Å; Y917-Y919 VanDerWaalsContact C-N 3.27Å; Y917-Y919 PolarHBondContact O-N 2.87Å
920	C	70.7	Confident	72.3	Confident	43 Å²	43	39.3 Å²	39.3	29%	0.291	22%	0.22	S	C	.	.	H	α-helix	trans	-87.9	-19.7	-168.2	-48.5	0	0	0	0	113	S916 G922	S916-C920 VanDerWaalsContact O-CB 3.31Å; S916-C920 WeakPolarHBondContact O-CB 3.22Å; S916-C920 PolarHBondContact O-N 2.83Å; S916-C920 PolarHBondContact O-SG 3Å; C920-G922 PolarHBondContact O-N 2.94Å
921	G	64.4	Low	72.1	Confident	22 Å²	22	43.8 Å²	43.8	23%	0.227	24%	0.242	C	C	.	.			trans	60.1	9.6	-176.8	0	0	0	0	0	115.8	L844 Y917	L844-G921 VanDerWaalsContact CD1-CA 3.46Å; Y917-G921 WeakPolarHBondContact O-CA 3.18Å; Y917-G921 PolarHBondContact O-N 2.9Å
922	G	64.4	Low	71.9	Confident	28 Å²	28	45.9 Å²	45.9	29%	0.289	25%	0.253	S	S	.	.			trans	-99.1	156	-174.6	0	0	0	0	0	113.1	C920	C920-G922 PolarHBondContact O-N 2.94Å
923	T	59.8	Low	71.8	Confident	63 Å²	63	42.5 Å²	42.5	39%	0.387	24%	0.237	S	C	.	.	S	Bend	trans	-97.2	-9.4	-178.4	63	0	0	0	0	112.4	S925 L926 H951	T923-S925 VanDerWaalsContact C-N 3.34Å; T923-S925 PolarHBondContact O-N 2.74Å; T923-L926 WeakPolarHBondContact O-CB 3.39Å; T923-L926 PolarHBondContact O-N 2.88Å; T923-L926 VanDerWaalsContact O-N 3.15Å; T923-H951 WeakPolarHBondContact CB-NE2 3.13Å; T923-H951 WeakPolarHBondContact CG2-CE1 3.49Å; T923-H951 WeakPolarHBondContact CG2-NE2 3.37Å
924	E	59.5	Low	72	Confident	138 Å²	138	42.3 Å²	42.3	65%	0.645	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-70.7	-26.8	-170.2	-59	-128	98.4	0	0	113.9	L926 K927	E924-L926 PolarHBondContact O-N 2.83Å; E924-K927 WeakPolarHBondContact O-CG 3.42Å; E924-K927 IonicContact OE1-NZ 2.62Å; E924-K927 PolarHBondContact OE1-NZ 3.25Å
925	S	58.1	Low	72	Confident	54 Å²	54	45.1 Å²	45.1	38%	0.378	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-76	-8.7	174.6	55.6	0	0	0	0	113.8	S916 T923	S916-S925 PolarHBondContact OG-OG 3.02Å; T923-S925 VanDerWaalsContact C-N 3.34Å; T923-S925 PolarHBondContact O-N 2.74Å
926	L	62.2	Low	72.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-95.3	10.4	-177	-54.8	179.8	0	0	0	113.4	M913 Y917 T923 E924 T928 L936 L948 I955	M913-L926 HydrophobicContact CE-CD2 3.89Å; Y917-L926 HydrophobicContact CD2-CD1 4.12Å; T923-L926 WeakPolarHBondContact O-CB 3.39Å; T923-L926 PolarHBondContact O-N 2.88Å; T923-L926 VanDerWaalsContact O-N 3.15Å; E924-L926 PolarHBondContact O-N 2.83Å; L926-T928 PolarHBondContact O-N 3.2Å; L926-L936 HydrophobicContact CD2-CD2 3.57Å; L926-L948 HydrophobicContact CD1-CD1 4.31Å; L926-I955 HydrophobicContact CB-CD1 3.56Å; L926-I955 HydrophobicContact CD1-CD1 4.1Å; L926-I955 HydrophobicContact CG-CD1 4.49Å
927	K	59.1	Low	72.4	Confident	151 Å²	151	44.4 Å²	44.4	66%	0.657	25%	0.245	S	C	*	.			trans	-79.9	50	178.8	-62.6	173.3	-175.9	165.2	0	112	E924	E924-K927 WeakPolarHBondContact O-CG 3.42Å; E924-K927 IonicContact OE1-NZ 2.62Å; E924-K927 PolarHBondContact OE1-NZ 3.25Å
928	T	62.9	Low	72.7	Confident	59 Å²	59	46 Å²	46	36%	0.362	26%	0.259	S	S	.	.	S	Bend	trans	-117.8	-171.2	-174.1	57.3	0	0	0	0	112.5	M913 L926	M913-T928 HydrophobicContact CE-CG2 4.23Å; M913-T928 WeakPolarHBondContact CE-OG1 3.15Å; L926-T928 PolarHBondContact O-N 3.2Å
929	N	71.3	Confident	72.9	Confident	98 Å²	98	45.1 Å²	45.1	52%	0.524	26%	0.255	S	S	.	.			trans	-66.5	145.5	-174.1	-174.3	9.1	0	0	0	111.5	M931 D932 L933	N929-M931 PolarHBondContact O-N 2.68Å; N929-D932 WeakPolarHBondContact CB-OD2 3.29Å; N929-D932 PolarHBondContact O-N 3.16Å; N929-L933 PolarHBondContact O-N 3.01Å; N929-L933 VanDerWaalsContact O-N 3.11Å
930	V	76.8	Confident	73.4	Confident	26 Å²	26	45.1 Å²	45.1	16%	0.158	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-36.7	-177.9	179.8	0	0	0	0	111.4	D932 L933 L934 H959 N964 I968	V930-D932 PolarHBondContact O-N 2.96Å; V930-L933 WeakPolarHBondContact O-CB 3.43Å; V930-L933 PolarHBondContact O-N 3.17Å; V930-L934 HydrophobicContact CG1-CG 4.4Å; V930-L934 WeakPolarHBondContact O-CG 3.34Å; V930-L934 PolarHBondContact O-N 2.67Å; V930-H959 HydrophobicContact CG2-CB 4.32Å; V930-N964 HydrophobicContact CG1-CB 4.39Å; V930-I968 HydrophobicContact CG1-CD1 4.18Å; V930-I968 HydrophobicContact CG1-CG1 4.09Å
931	M	78.1	Confident	74	Confident	97 Å²	97	45.8 Å²	45.8	48%	0.478	26%	0.255	S	S	.	.	H	α-helix	trans	-61.2	-41.3	176.4	-67	-57.5	-58.3	0	0	112.9	N929 L933 L934 E935	N929-M931 PolarHBondContact O-N 2.68Å; M931-L933 VanDerWaalsContact C-N 3.34Å; M931-L934 PolarHBondContact O-N 3.34Å; M931-E935 PolarHBondContact O-N 2.78Å
932	D	80.8	Confident	74.9	Confident	44 Å²	44	47.5 Å²	47.5	24%	0.235	26%	0.257	C	S	.	.	H	α-helix	trans	-69.5	-35.6	178.3	-54.2	-39.6	0	0	0	110.7	I910 N929 V930 E935 L936	I910-D932 HydrophobicContact CD1-CB 3.89Å; N929-D932 WeakPolarHBondContact CB-OD2 3.29Å; N929-D932 PolarHBondContact O-N 3.16Å; V930-D932 PolarHBondContact O-N 2.96Å; D932-E935 PolarHBondContact O-N 3.47Å; D932-L936 VanDerWaalsContact O-CB 3.24Å; D932-L936 WeakPolarHBondContact O-CB 3.47Å; D932-L936 PolarHBondContact O-N 2.9Å
933	L	83.1	Confident	75.8	Confident	4 Å²	4	46.4 Å²	46.4	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-35.7	171.5	-91.1	150.9	0	0	0	113.2	N929 V930 M931 L937 I955	N929-L933 PolarHBondContact O-N 3.01Å; N929-L933 VanDerWaalsContact O-N 3.11Å; V930-L933 WeakPolarHBondContact O-CB 3.43Å; V930-L933 PolarHBondContact O-N 3.17Å; M931-L933 VanDerWaalsContact C-N 3.34Å; L933-L937 WeakPolarHBondContact O-CB 3.39Å; L933-L937 PolarHBondContact O-N 3.42Å; L933-I955 HydrophobicContact CD1-CG2 3.61Å; L933-I955 HydrophobicContact CD2-CB 4.11Å; L933-I955 HydrophobicContact CD2-CD1 4.18Å; L933-I955 HydrophobicContact CD2-CG2 3.91Å; L933-I955 HydrophobicContact CG-CG2 4.43Å
934	L	83.1	Confident	76.8	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-74.2	-38.2	176.2	-64.3	-169.9	0	0	0	112.4	V930 M931 L936 L937 S938 I968 T971	V930-L934 HydrophobicContact CG1-CG 4.4Å; V930-L934 WeakPolarHBondContact O-CG 3.34Å; V930-L934 PolarHBondContact O-N 2.67Å; M931-L934 PolarHBondContact O-N 3.34Å; L934-L936 VanDerWaalsContact C-N 3.34Å; L934-L937 PolarHBondContact O-N 3.21Å; L934-S938 PolarHBondContact O-N 3.39Å; L934-I968 HydrophobicContact CD1-CG1 4.15Å; L934-I968 HydrophobicContact CD2-CB 4.38Å; L934-I968 HydrophobicContact CD2-CG1 4.12Å; L934-I968 HydrophobicContact CD2-CG2 4.34Å; L934-T971 HydrophobicContact CB-CG2 4.23Å; L934-T971 HydrophobicContact CD1-CG2 4.16Å; L934-T971 WeakPolarHBondContact CD2-OG1 3.28Å
935	E	83.1	Confident	77.9	Confident	58 Å²	58	44.7 Å²	44.7	27%	0.271	23%	0.23	S	C	.	.	H	α-helix	trans	-64.8	-40.4	170.8	-70.2	-175.8	-174.2	0	0	110.9	K907 I910 M931 D932 S938 A939	K907-E935 WeakPolarHBondContact CD-OE2 3.49Å; K907-E935 WeakPolarHBondContact CE-OE2 3.43Å; K907-E935 IonicContact NZ-OE1 2.64Å; K907-E935 PolarHBondContact NZ-OE1 2.67Å; K907-E935 IonicContact NZ-OE2 2.67Å; K907-E935 PolarHBondContact NZ-OE2 3.18Å; I910-E935 HydrophobicContact CD1-CB 4.1Å; I910-E935 HydrophobicContact CG1-CB 4.08Å; I910-E935 HydrophobicContact CG2-CB 4.46Å; M931-E935 PolarHBondContact O-N 2.78Å; D932-E935 PolarHBondContact O-N 3.47Å; E935-S938 PolarHBondContact O-N 3.33Å; E935-S938 PolarHBondContact O-OG 3.19Å; E935-A939 PolarHBondContact O-N 3.4Å
936	L	85	Confident	78.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-38.1	174.3	-174.7	63.7	0	0	0	112.9	I910 M913 M914 L926 D932 L934 S938 A939 A940 L948	I910-L936 HydrophobicContact CG2-CB 4.12Å; I910-L936 HydrophobicContact CG2-CD1 4.03Å; M913-L936 HydrophobicContact CB-CD1 4.21Å; M913-L936 HydrophobicContact CB-CD2 4.27Å; M913-L936 HydrophobicContact CE-CD2 4.03Å; M914-L936 HydrophobicContact CB-CD1 3.83Å; L926-L936 HydrophobicContact CD2-CD2 3.57Å; D932-L936 VanDerWaalsContact O-CB 3.24Å; D932-L936 WeakPolarHBondContact O-CB 3.47Å; D932-L936 PolarHBondContact O-N 2.9Å; L934-L936 VanDerWaalsContact C-N 3.34Å; L936-S938 VanDerWaalsContact C-N 3.3Å; L936-S938 PolarHBondContact O-N 3.35Å; L936-A939 PolarHBondContact O-N 3.2Å; L936-A940 VanDerWaalsContact O-CB 3.29Å; L936-A940 WeakPolarHBondContact O-CB 3.35Å; L936-A940 PolarHBondContact O-N 3.31Å; L936-L948 HydrophobicContact CD1-CD2 4.24Å; L936-L948 HydrophobicContact CD2-CD1 4.38Å
937	L	84.2	Confident	79.6	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-43.1	171.8	-177.4	71.9	0	0	0	110.7	L933 L934 A940 N941 Q949 C952 E953 L980	L933-L937 WeakPolarHBondContact O-CB 3.39Å; L933-L937 PolarHBondContact O-N 3.42Å; L934-L937 PolarHBondContact O-N 3.21Å; L937-A940 PolarHBondContact O-N 3.41Å; L937-N941 PolarHBondContact O-N 3.16Å; L937-Q949 HydrophobicContact CD1-CG 3.85Å; L937-C952 HydrophobicContact CB-CB 4.21Å; L937-C952 HydrophobicContact CD1-CB 3.76Å; L937-E953 HydrophobicContact CD1-CG 4.08Å; L937-L980 HydrophobicContact CD2-CD2 3.87Å
938	S	84.9	Confident	80.7	Confident	54 Å²	54	37.8 Å²	37.8	38%	0.378	21%	0.208	S	C	.	.	H	α-helix	trans	-65.5	-42.1	176.8	79.5	0	0	0	0	112.6	L934 E935 L936 Q942 N975	L934-S938 PolarHBondContact O-N 3.39Å; E935-S938 PolarHBondContact O-N 3.33Å; E935-S938 PolarHBondContact O-OG 3.19Å; L936-S938 VanDerWaalsContact C-N 3.3Å; L936-S938 PolarHBondContact O-N 3.35Å; S938-Q942 VanDerWaalsContact O-CB 3.27Å; S938-Q942 WeakPolarHBondContact O-CB 3.47Å; S938-Q942 PolarHBondContact O-N 2.88Å; S938-N975 WeakPolarHBondContact CA-OD1 3.48Å
939	A	84.2	Confident	81.6	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-64.9	-42.2	174.2	0	0	0	0	0	111.7	V906 I910 E935 L936 N941 Q942 F943	V906-A939 HydrophobicContact CG1-CB 4.2Å; V906-A939 HydrophobicContact CG2-CB 4.09Å; I910-A939 HydrophobicContact CG2-CB 4.12Å; E935-A939 PolarHBondContact O-N 3.4Å; L936-A939 PolarHBondContact O-N 3.2Å; A939-N941 PolarHBondContact O-N 2.86Å; A939-Q942 CarbonylContact O-C 3.53Å; A939-Q942 WeakPolarHBondContact O-CB 3.44Å; A939-Q942 PolarHBondContact O-N 3.22Å; A939-Q942 VanDerWaalsContact O-N 3.16Å; A939-F943 WeakPolarHBondContact O-CD2 3.43Å; A939-F943 PolarHBondContact O-N 3.05Å
940	A	84.8	Confident	82	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.9	-45.2	178.3	0	0	0	0	0	111.8	L936 L937 F943 K944 L945 L948 Q949	L936-A940 VanDerWaalsContact O-CB 3.29Å; L936-A940 WeakPolarHBondContact O-CB 3.35Å; L936-A940 PolarHBondContact O-N 3.31Å; L937-A940 PolarHBondContact O-N 3.41Å; A940-F943 CarbonylContact O-C 3.49Å; A940-F943 PolarHBondContact O-N 3.43Å; A940-K944 PolarHBondContact O-N 3.1Å; A940-L945 HydrophobicContact CB-CB 4.45Å; A940-L945 PolarHBondContact O-N 2.8Å; A940-L948 HydrophobicContact CB-CB 4.24Å; A940-L948 HydrophobicContact CB-CD2 3.9Å; A940-L948 HydrophobicContact CB-CG 3.82Å; A940-Q949 HydrophobicContact CB-CB 4.11Å
941	N	84.3	Confident	82.1	Confident	57 Å²	57	34.5 Å²	34.5	31%	0.305	18%	0.182	S	C	.	.	H	α-helix	trans	-63.2	-48.3	171.1	175.2	35.1	0	0	0	111.5	L937 A939 F943 K944 N975	L937-N941 PolarHBondContact O-N 3.16Å; A939-N941 PolarHBondContact O-N 2.86Å; N941-F943 PolarHBondContact O-N 3.01Å; N941-F943 VanDerWaalsContact O-N 3.13Å; N941-K944 PolarHBondContact O-N 3.38Å; N941-N975 HydrophobicContact CB-CB 4.11Å; N941-N975 WeakPolarHBondContact CB-OD1 3.28Å; N941-N975 WeakPolarHBondContact ND2-CA 3.24Å; N941-N975 PolarHBondContact ND2-OD1 2.85Å
942	Q	83.9	Confident	82.3	Confident	59 Å²	59	29.9 Å²	29.9	28%	0.276	16%	0.159	S	C	.	.	H	α-helix	trans	-55.6	-34.5	178.9	-160.2	-160.5	28.4	0	0	112.3	K883 D905 S938 A939	K883-Q942 WeakPolarHBondContact CD-O 3.35Å; K883-Q942 WeakPolarHBondContact CE-O 3.35Å; K883-Q942 PolarHBondContact NZ-O 3.12Å; D905-Q942 PolarHBondContact OD2-NE2 3.22Å; S938-Q942 VanDerWaalsContact O-CB 3.27Å; S938-Q942 WeakPolarHBondContact O-CB 3.47Å; S938-Q942 PolarHBondContact O-N 2.88Å; A939-Q942 CarbonylContact O-C 3.53Å; A939-Q942 WeakPolarHBondContact O-CB 3.44Å; A939-Q942 PolarHBondContact O-N 3.22Å; A939-Q942 VanDerWaalsContact O-N 3.16Å
943	F	82.1	Confident	82.4	Confident	5 Å²	5	28.3 Å²	28.3	2%	0.022	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	7.2	176.3	-74.7	-82.8	0	0	0	114.7	S881 K883 F884 L887 I903 V906 M914 A939 A940 N941 L945	S881-F943 WeakPolarHBondContact CB-O 3.35Å; S881-F943 PolarHBondContact OG-O 3.17Å; K883-F943 HydrophobicContact CD-CD1 4.5Å; F884-F943 HydrophobicContact CD1-CD1 4.21Å; F884-F943 HydrophobicContact CD1-CE1 4.22Å; F884-F943 HydrophobicContact CD2-CD1 4.15Å; F884-F943 AromaticContact CE1-CD1 3.71Å; F884-F943 HydrophobicContact CE1-CD1 3.71Å; F884-F943 AromaticContact CE1-CE1 3.54Å; F884-F943 HydrophobicContact CE1-CE1 3.54Å; F884-F943 HydrophobicContact CE1-CZ 4.48Å; F884-F943 HydrophobicContact CE2-CB 4.26Å; F884-F943 AromaticContact CE2-CD1 3.64Å; F884-F943 HydrophobicContact CE2-CD1 3.64Å; F884-F943 HydrophobicContact CE2-CE1 4.3Å; F884-F943 HydrophobicContact CE2-CG 4.11Å; F884-F943 HydrophobicContact CG-CD1 4.4Å; F884-F943 AromaticContact CZ-CD1 3.39Å; F884-F943 HydrophobicContact CZ-CD1 3.39Å; F884-F943 AromaticContact CZ-CE1 3.58Å; F884-F943 HydrophobicContact CZ-CE1 3.58Å; F884-F943 HydrophobicContact CZ-CG 4.06Å; F884-F943 HydrophobicContact CZ-CZ 4.38Å; L887-F943 HydrophobicContact CD1-CD1 4.48Å; L887-F943 HydrophobicContact CD1-CE1 3.89Å; I903-F943 HydrophobicContact CD1-CZ 4.16Å; I903-F943 HydrophobicContact CG2-CZ 4.3Å; V906-F943 HydrophobicContact CG2-CE2 4.14Å; M914-F943 HydrophobicContact CE-CD2 3.79Å; M914-F943 HydrophobicContact CE-CE2 3.98Å; M914-F943 HydrophobicContact CE-CG 4.18Å; M914-F943 HydrophobicContact CE-CZ 4.5Å; M914-F943 HydrophobicContact SD-CB 4.14Å; M914-F943 HydrophobicContact SD-CD2 3.76Å; M914-F943 HydrophobicContact SD-CE2 4.49Å; M914-F943 HydrophobicContact SD-CG 4.07Å; A939-F943 WeakPolarHBondContact O-CD2 3.43Å; A939-F943 PolarHBondContact O-N 3.05Å; A940-F943 CarbonylContact O-C 3.49Å; A940-F943 PolarHBondContact O-N 3.43Å; N941-F943 PolarHBondContact O-N 3.01Å; N941-F943 VanDerWaalsContact O-N 3.13Å; F943-L945 VanDerWaalsContact C-N 3.3Å; F943-L945 HydrophobicContact CB-CD1 4.17Å; F943-L945 HydrophobicContact CB-CG 4.07Å; F943-L945 PolarHBondContact O-N 2.83Å
944	K	82.3	Confident	82.4	Confident	155 Å²	155	28.8 Å²	28.8	67%	0.674	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	33.5	179.8	-60.6	-171.6	172.1	-172.6	0	115	A940 N941 G946	A940-K944 PolarHBondContact O-N 3.1Å; N941-K944 PolarHBondContact O-N 3.38Å; K944-G946 PolarHBondContact O-N 3.14Å
945	L	82.2	Confident	82.2	Confident	9 Å²	9	29.5 Å²	29.5	5%	0.047	16%	0.157	C	C	.	.			trans	-88.4	71.2	-177.5	-64.2	178.2	0	0	0	111.9	M914 L918 A940 F943 A947 L948 Q949	M914-L945 HydrophobicContact CG-CD1 3.6Å; M914-L945 HydrophobicContact SD-CD1 3.57Å; M914-L945 VanDerWaalsContact SD-CD1 3.57Å; L918-L945 HydrophobicContact CD1-CD1 4.11Å; L918-L945 HydrophobicContact CD2-CD1 4.2Å; L918-L945 HydrophobicContact CD2-CD2 3.95Å; L918-L945 HydrophobicContact CG-CD1 4.38Å; A940-L945 HydrophobicContact CB-CB 4.45Å; A940-L945 PolarHBondContact O-N 2.8Å; F943-L945 VanDerWaalsContact C-N 3.3Å; F943-L945 HydrophobicContact CB-CD1 4.17Å; F943-L945 HydrophobicContact CB-CG 4.07Å; F943-L945 PolarHBondContact O-N 2.83Å; L945-A947 VanDerWaalsContact C-N 3.29Å; L945-A947 PolarHBondContact O-N 2.95Å; L945-A947 VanDerWaalsContact O-N 3.13Å; L945-L948 HydrophobicContact CB-CB 4.01Å; L945-L948 HydrophobicContact CD1-CD2 4.04Å; L945-L948 PolarHBondContact O-N 3.01Å; L945-Q949 PolarHBondContact O-N 2.88Å
946	G	77.4	Confident	82.2	Confident	38 Å²	38	26.8 Å²	26.8	39%	0.392	14%	0.144	S	C	.	.	H	α-helix	trans	-52.7	-37.4	-173	0	0	0	0	0	115.5	K944 R950	K944-G946 PolarHBondContact O-N 3.14Å; G946-R950 VanDerWaalsContact O-CB 3.28Å; G946-R950 WeakPolarHBondContact O-CB 3.4Å; G946-R950 PolarHBondContact O-N 3.42Å
947	A	78.8	Confident	82	Confident	22 Å²	22	27.8 Å²	27.8	18%	0.182	15%	0.151	C	C	.	.	H	α-helix	trans	-67.9	-40.1	176.6	0	0	0	0	0	113	A842 Y917 L945 H951	A842-A947 HydrophobicContact CB-CB 3.87Å; Y917-A947 PolarHBondContact OH-O 3.38Å; L945-A947 VanDerWaalsContact C-N 3.29Å; L945-A947 PolarHBondContact O-N 2.95Å; L945-A947 VanDerWaalsContact O-N 3.13Å; A947-H951 PolarHBondContact O-N 2.9Å
948	L	81	Confident	81.9	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-69.7	-44.8	175.3	174.9	58.3	0	0	0	110.9	M914 Y917 L926 L936 A940 L945 R950 H951 C952	M914-L948 HydrophobicContact CB-CD2 4.23Å; M914-L948 HydrophobicContact CG-CD2 3.75Å; Y917-L948 HydrophobicContact CD1-CB 3.8Å; Y917-L948 HydrophobicContact CD1-CD1 3.83Å; Y917-L948 HydrophobicContact CD1-CD2 4.39Å; Y917-L948 HydrophobicContact CD1-CG 4.2Å; Y917-L948 HydrophobicContact CD2-CD1 3.95Å; Y917-L948 HydrophobicContact CE1-CB 3.64Å; Y917-L948 HydrophobicContact CE1-CD1 4.2Å; Y917-L948 HydrophobicContact CE1-CG 4.45Å; Y917-L948 HydrophobicContact CE2-CD1 4.29Å; Y917-L948 HydrophobicContact CG-CD1 3.7Å; L926-L948 HydrophobicContact CD1-CD1 4.31Å; L936-L948 HydrophobicContact CD1-CD2 4.24Å; L936-L948 HydrophobicContact CD2-CD1 4.38Å; A940-L948 HydrophobicContact CB-CB 4.24Å; A940-L948 HydrophobicContact CB-CD2 3.9Å; A940-L948 HydrophobicContact CB-CG 3.82Å; L945-L948 HydrophobicContact CB-CB 4.01Å; L945-L948 HydrophobicContact CD1-CD2 4.04Å; L945-L948 PolarHBondContact O-N 3.01Å; L948-R950 VanDerWaalsContact C-N 3.31Å; L948-R950 PolarHBondContact O-N 3.11Å; L948-H951 PolarHBondContact O-N 3.22Å; L948-H951 VanDerWaalsContact O-N 3.12Å; L948-C952 PolarHBondContact O-N 3.3Å; L948-C952 PolarHBondContact O-SG 2.87Å
949	Q	82.3	Confident	81.8	Confident	31 Å²	31	37.4 Å²	37.4	15%	0.145	19%	0.187	C	C	.	.	H	α-helix	trans	-53.9	-50.8	174.7	-179	174	2.5	0	0	109.9	L937 A940 L945 H951 C952 E953 N975 S977	L937-Q949 HydrophobicContact CD1-CG 3.85Å; A940-Q949 HydrophobicContact CB-CB 4.11Å; L945-Q949 PolarHBondContact O-N 2.88Å; Q949-H951 VanDerWaalsContact C-N 3.29Å; Q949-H951 PolarHBondContact O-N 3.43Å; Q949-C952 WeakPolarHBondContact O-CB 3.27Å; Q949-C952 PolarHBondContact O-N 3.42Å; Q949-C952 VanDerWaalsContact O-N 3.12Å; Q949-E953 WeakPolarHBondContact O-CG 3.3Å; Q949-E953 PolarHBondContact O-N 2.73Å; Q949-N975 PolarHBondContact NE2-O 3.25Å; Q949-S977 PolarHBondContact NE2-OG 3.1Å
950	R	80.3	Confident	81.8	Confident	42 Å²	42	38.4 Å²	38.4	16%	0.158	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-34	177.8	-169.3	50.4	154.9	-153.4	-5.2	113.7	I837 P838 M840 G946 L948 E953 L954 D979	I837-R950 VanDerWaalsContact CG2-NE 3.35Å; P838-R950 VanDerWaalsContact CD-NH2 3.28Å; P838-R950 PolarHBondContact O-NE 3.08Å; P838-R950 PolarHBondContact O-NH2 3.39Å; M840-R950 HydrophobicContact CB-CB 4.48Å; M840-R950 HydrophobicContact CB-CG 3.97Å; G946-R950 VanDerWaalsContact O-CB 3.28Å; G946-R950 WeakPolarHBondContact O-CB 3.4Å; G946-R950 PolarHBondContact O-N 3.42Å; L948-R950 VanDerWaalsContact C-N 3.31Å; L948-R950 PolarHBondContact O-N 3.11Å; R950-E953 WeakPolarHBondContact CD-OE2 3.49Å; R950-E953 IonicContact CZ-OE2 3.25Å; R950-E953 IonicContact NE-OE2 3.13Å; R950-E953 IonicContact NH1-OE2 2.75Å; R950-E953 PolarHBondContact NH1-OE2 2.97Å; R950-L954 WeakPolarHBondContact O-CG 3.47Å; R950-L954 PolarHBondContact O-N 3Å; R950-L954 VanDerWaalsContact O-N 3.15Å; R950-D979 IonicContact CZ-OD2 3.6Å; R950-D979 IonicContact NH1-OD2 3.78Å; R950-D979 PolarHBondContact NH1-OD2 3.13Å; R950-D979 IonicContact NH2-OD2 2.79Å; R950-D979 PolarHBondContact NH2-OD2 3.37Å
951	H	78.9	Confident	81.7	Confident	41 Å²	41	41.9 Å²	41.9	19%	0.19	21%	0.211	C	C	.	.	H	α-helix	trans	-74.7	-35.8	175.3	-156.7	73.1	0	0	0	112.8	Y917 T923 A947 L948 Q949 E953 L954 I955	Y917-H951 HydrophobicContact CE2-CB 4.4Å; T923-H951 WeakPolarHBondContact CB-NE2 3.13Å; T923-H951 WeakPolarHBondContact CG2-CE1 3.49Å; T923-H951 WeakPolarHBondContact CG2-NE2 3.37Å; A947-H951 PolarHBondContact O-N 2.9Å; L948-H951 PolarHBondContact O-N 3.22Å; L948-H951 VanDerWaalsContact O-N 3.12Å; Q949-H951 VanDerWaalsContact C-N 3.29Å; Q949-H951 PolarHBondContact O-N 3.43Å; H951-E953 VanDerWaalsContact C-N 3.33Å; H951-E953 PolarHBondContact O-N 3.43Å; H951-L954 PolarHBondContact O-N 3.15Å; H951-I955 WeakPolarHBondContact O-CG1 3.36Å; H951-I955 PolarHBondContact O-N 2.84Å
952	C	81.1	Confident	81.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-41	172.4	-62.8	0	0	0	0	111	L937 L948 Q949 L954 I955 C956	L937-C952 HydrophobicContact CB-CB 4.21Å; L937-C952 HydrophobicContact CD1-CB 3.76Å; L948-C952 PolarHBondContact O-N 3.3Å; L948-C952 PolarHBondContact O-SG 2.87Å; Q949-C952 WeakPolarHBondContact O-CB 3.27Å; Q949-C952 PolarHBondContact O-N 3.42Å; Q949-C952 VanDerWaalsContact O-N 3.12Å; C952-L954 PolarHBondContact O-N 3.05Å; C952-I955 PolarHBondContact O-N 3.29Å; C952-C956 WeakPolarHBondContact O-CB 3.42Å; C952-C956 PolarHBondContact O-N 2.87Å; C952-C956 PolarHBondContact O-SG 3.31Å
953	E	83.6	Confident	81.6	Confident	10 Å²	10	45.1 Å²	45.1	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-58.2	-44.6	172.4	-66.6	167.9	-178.6	0	0	112.5	I837 L937 Q949 R950 H951 I955 C956 S957 S977 L980	I837-E953 HydrophobicContact CD1-CB 4.15Å; L937-E953 HydrophobicContact CD1-CG 4.08Å; Q949-E953 WeakPolarHBondContact O-CG 3.3Å; Q949-E953 PolarHBondContact O-N 2.73Å; R950-E953 WeakPolarHBondContact CD-OE2 3.49Å; R950-E953 IonicContact CZ-OE2 3.25Å; R950-E953 IonicContact NE-OE2 3.13Å; R950-E953 IonicContact NH1-OE2 2.75Å; R950-E953 PolarHBondContact NH1-OE2 2.97Å; H951-E953 VanDerWaalsContact C-N 3.33Å; H951-E953 PolarHBondContact O-N 3.43Å; E953-I955 VanDerWaalsContact C-N 3.32Å; E953-I955 PolarHBondContact O-N 3.24Å; E953-C956 PolarHBondContact O-N 3.1Å; E953-S957 WeakPolarHBondContact O-CB 3.47Å; E953-S957 PolarHBondContact O-N 3.17Å; E953-S957 PolarHBondContact O-OG 2.92Å; E953-S977 WeakPolarHBondContact OE1-CB 3.47Å; E953-S977 PolarHBondContact OE1-OG 3.33Å; E953-L980 HydrophobicContact CB-CB 4.28Å; E953-L980 HydrophobicContact CB-CD2 4.46Å; E953-L980 HydrophobicContact CG-CB 3.98Å; E953-L980 HydrophobicContact CG-CD2 4.09Å
954	L	82	Confident	81.7	Confident	14 Å²	14	45.7 Å²	45.7	7%	0.073	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-28.9	177.6	-83.5	164	0	0	0	114.2	I837 E839 R950 H951 C952 S957 K958	I837-L954 HydrophobicContact CB-CD2 4.04Å; I837-L954 HydrophobicContact CB-CG 4.49Å; I837-L954 HydrophobicContact CG2-CD2 4.17Å; I837-L954 HydrophobicContact CG2-CG 4.12Å; I837-L954 WeakPolarHBondContact O-CD2 3.39Å; E839-L954 HydrophobicContact CG-CD1 4.08Å; E839-L954 HydrophobicContact CG-CD2 4.43Å; R950-L954 WeakPolarHBondContact O-CG 3.47Å; R950-L954 PolarHBondContact O-N 3Å; R950-L954 VanDerWaalsContact O-N 3.15Å; H951-L954 PolarHBondContact O-N 3.15Å; C952-L954 PolarHBondContact O-N 3.05Å; L954-S957 PolarHBondContact O-OG 3.41Å; L954-K958 WeakPolarHBondContact O-CD 3.47Å; L954-K958 WeakPolarHBondContact O-CE 3.23Å; L954-K958 WeakPolarHBondContact O-CG 3.4Å
955	I	80.3	Confident	81.8	Confident	22 Å²	22	38.3 Å²	38.3	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-80.3	-47.2	172.7	-65	174.4	0	0	0	109.8	L926 L933 H951 C952 E953 S957 K958 H959	L926-I955 HydrophobicContact CB-CD1 3.56Å; L926-I955 HydrophobicContact CD1-CD1 4.1Å; L926-I955 HydrophobicContact CG-CD1 4.49Å; L933-I955 HydrophobicContact CD1-CG2 3.61Å; L933-I955 HydrophobicContact CD2-CB 4.11Å; L933-I955 HydrophobicContact CD2-CD1 4.18Å; L933-I955 HydrophobicContact CD2-CG2 3.91Å; L933-I955 HydrophobicContact CG-CG2 4.43Å; H951-I955 WeakPolarHBondContact O-CG1 3.36Å; H951-I955 PolarHBondContact O-N 2.84Å; C952-I955 PolarHBondContact O-N 3.29Å; E953-I955 VanDerWaalsContact C-N 3.32Å; E953-I955 PolarHBondContact O-N 3.24Å; I955-S957 PolarHBondContact O-N 3.07Å; I955-K958 PolarHBondContact O-N 3.33Å; I955-K958 VanDerWaalsContact O-N 3.09Å; I955-H959 PolarHBondContact O-CD2 3.48Å; I955-H959 PolarHBondContact O-N 3.4Å
956	C	82	Confident	81.9	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.007	20%	0.204	C	C	.	.	H	α-helix	trans	-58.4	-44.6	-178.4	-68.4	0	0	0	0	112.3	C952 E953 K958 H959 I960 I968 L980	C952-C956 WeakPolarHBondContact O-CB 3.42Å; C952-C956 PolarHBondContact O-N 2.87Å; C952-C956 PolarHBondContact O-SG 3.31Å; E953-C956 PolarHBondContact O-N 3.1Å; C956-K958 PolarHBondContact O-N 3.25Å; C956-H959 PolarHBondContact O-N 3Å; C956-I960 VanDerWaalsContact O-CG1 3.31Å; C956-I960 WeakPolarHBondContact O-CG1 3.12Å; C956-I960 PolarHBondContact O-N 3.28Å; C956-I968 HydrophobicContact CB-CG2 4.13Å; C956-L980 HydrophobicContact CB-CD1 3.85Å; C956-L980 HydrophobicContact CB-CD2 4.13Å
957	S	82.4	Confident	82.2	Confident	20 Å²	20	38.7 Å²	38.7	14%	0.14	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.8	176.9	49.8	0	0	0	0	114.6	E953 L954 I955	E953-S957 WeakPolarHBondContact O-CB 3.47Å; E953-S957 PolarHBondContact O-N 3.17Å; E953-S957 PolarHBondContact O-OG 2.92Å; L954-S957 PolarHBondContact O-OG 3.41Å; I955-S957 PolarHBondContact O-N 3.07Å
958	K	81.8	Confident	82.4	Confident	149 Å²	149	37.7 Å²	37.7	65%	0.648	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-11	176.5	-66.2	172.9	-173.1	172.1	0	113.6	L954 I955 C956	L954-K958 WeakPolarHBondContact O-CD 3.47Å; L954-K958 WeakPolarHBondContact O-CE 3.23Å; L954-K958 WeakPolarHBondContact O-CG 3.4Å; I955-K958 PolarHBondContact O-N 3.33Å; I955-K958 VanDerWaalsContact O-N 3.09Å; C956-K958 PolarHBondContact O-N 3.25Å
959	H	81.7	Confident	82.6	Confident	108 Å²	108	38.3 Å²	38.3	50%	0.5	19%	0.191	S	C	.	.	S	Bend	trans	-120.2	13.9	-175.1	-72.3	-67.5	0	0	0	113.8	V930 I955 C956 N961 N964	V930-H959 HydrophobicContact CG2-CB 4.32Å; I955-H959 PolarHBondContact O-CD2 3.48Å; I955-H959 PolarHBondContact O-N 3.4Å; C956-H959 PolarHBondContact O-N 3Å; H959-N961 PolarHBondContact O-N 2.89Å; H959-N964 PolarHBondContact O-ND2 3.14Å
960	I	84.2	Confident	82.7	Confident	21 Å²	21	42 Å²	42	11%	0.108	21%	0.207	C	C	.	.			trans	-63.1	130.8	174.3	-51.7	-177.4	0	0	0	110.2	C956 N964 A965 I968 F987	C956-I960 VanDerWaalsContact O-CG1 3.31Å; C956-I960 WeakPolarHBondContact O-CG1 3.12Å; C956-I960 PolarHBondContact O-N 3.28Å; I960-N964 WeakPolarHBondContact CA-OD1 3.47Å; I960-A965 HydrophobicContact CG2-CB 3.58Å; I960-I968 HydrophobicContact CG1-CD1 4.13Å; I960-F987 HydrophobicContact CG2-CB 4.16Å; I960-F987 HydrophobicContact CG2-CD1 3.47Å; I960-F987 VanDerWaalsContact CG2-CD1 3.47Å; I960-F987 HydrophobicContact CG2-CD2 3.98Å; I960-F987 HydrophobicContact CG2-CE1 3.75Å; I960-F987 HydrophobicContact CG2-CE2 4.22Å; I960-F987 HydrophobicContact CG2-CG 3.59Å; I960-F987 HydrophobicContact CG2-CZ 4.12Å
961	N	84.3	Confident	82.9	Confident	74 Å²	74	41.8 Å²	41.8	40%	0.396	21%	0.211	S	C	.	.			trans	-145.9	174.9	174.9	72.1	36.2	0	0	0	111.5	H959 D963 N964 A965	H959-N961 PolarHBondContact O-N 2.89Å; N961-D963 PolarHBondContact O-N 2.86Å; N961-D963 VanDerWaalsContact O-N 3.13Å; N961-D963 PolarHBondContact OD1-N 3.07Å; N961-N964 PolarHBondContact N-OD1 3.32Å; N961-N964 PolarHBondContact ND2-ND2 3.07Å; N961-N964 PolarHBondContact O-N 2.71Å; N961-N964 PolarHBondContact O-OD1 3.44Å; N961-N964 VanDerWaalsContact OD1-CG 3.25Å; N961-N964 PolarHBondContact OD1-N 3.43Å; N961-N964 PolarHBondContact OD1-OD1 2.77Å; N961-A965 VanDerWaalsContact O-CB 3.29Å; N961-A965 WeakPolarHBondContact O-CB 3.34Å; N961-A965 PolarHBondContact O-N 3.44Å
962	L	82.6	Confident	83.2	Confident	62 Å²	62	39.9 Å²	39.9	33%	0.325	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.7	-174.6	-62.7	176.8	0	0	0	115.1	F987 Q991 A994 L995	L962-F987 HydrophobicContact CD2-CE1 4.49Å; L962-F987 HydrophobicContact CD2-CZ 4.45Å; L962-Q991 HydrophobicContact CD2-CB 4.1Å; L962-A994 HydrophobicContact CD1-CB 4.39Å; L962-A994 HydrophobicContact CD2-CB 4.24Å; L962-L995 HydrophobicContact CB-CD2 4.42Å; L962-L995 HydrophobicContact CD2-CD2 3.73Å; L962-L995 HydrophobicContact CD2-CG 3.88Å
963	D	81.5	Confident	83.3	Confident	122 Å²	122	43.2 Å²	43.2	65%	0.652	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-28.5	-178	-67.3	-58.7	0	0	0	112.9	N961 K998	N961-D963 PolarHBondContact O-N 2.86Å; N961-D963 VanDerWaalsContact O-N 3.13Å; N961-D963 PolarHBondContact OD1-N 3.07Å; D963-K998 IonicContact OD1-NZ 2.66Å; D963-K998 PolarHBondContact OD1-NZ 3.3Å; D963-K998 IonicContact OD2-NZ 3.85Å
964	N	85.4	Confident	83.3	Confident	16 Å²	16	46.6 Å²	46.6	9%	0.086	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-17.1	-176.8	73.3	13.9	0	0	0	114.9	V930 H959 I960 N961 V966 S967 I968	V930-N964 HydrophobicContact CG1-CB 4.39Å; H959-N964 PolarHBondContact O-ND2 3.14Å; I960-N964 WeakPolarHBondContact CA-OD1 3.47Å; N961-N964 PolarHBondContact N-OD1 3.32Å; N961-N964 PolarHBondContact ND2-ND2 3.07Å; N961-N964 PolarHBondContact O-N 2.71Å; N961-N964 PolarHBondContact O-OD1 3.44Å; N961-N964 VanDerWaalsContact OD1-CG 3.25Å; N961-N964 PolarHBondContact OD1-N 3.43Å; N961-N964 PolarHBondContact OD1-OD1 2.77Å; N964-V966 PolarHBondContact O-N 2.98Å; N964-V966 VanDerWaalsContact O-N 3.11Å; N964-S967 PolarHBondContact O-N 3.11Å; N964-S967 PolarHBondContact O-OG 3.32Å; N964-I968 HydrophobicContact CB-CD1 4.26Å; N964-I968 WeakPolarHBondContact O-CG1 3.32Å; N964-I968 PolarHBondContact O-N 3.38Å; N964-I968 WeakPolarHBondContact OD1-CD1 3.26Å
965	A	84.6	Confident	83.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.1	-35.6	-174.2	0	0	0	0	0	113	I960 N961 Y969 F987 F988	I960-A965 HydrophobicContact CG2-CB 3.58Å; N961-A965 VanDerWaalsContact O-CB 3.29Å; N961-A965 WeakPolarHBondContact O-CB 3.34Å; N961-A965 PolarHBondContact O-N 3.44Å; A965-Y969 VanDerWaalsContact O-CB 3.24Å; A965-Y969 WeakPolarHBondContact O-CB 3.49Å; A965-Y969 PolarHBondContact O-N 2.98Å; A965-F987 HydrophobicContact CB-CD1 3.92Å; A965-F987 HydrophobicContact CB-CE1 3.97Å; A965-F988 HydrophobicContact CB-CD1 4.31Å; A965-F988 HydrophobicContact CB-CE1 3.64Å
966	V	84	Confident	83.2	Confident	19 Å²	19	48.3 Å²	48.3	12%	0.115	27%	0.268	C	S	.	.	H	α-helix	trans	-67.5	-38.1	177.4	178.4	0	0	0	0	112.7	N964 K970 G1000 F1001 L1004	N964-V966 PolarHBondContact O-N 2.98Å; N964-V966 VanDerWaalsContact O-N 3.11Å; V966-K970 HydrophobicContact CG1-CD 4.31Å; V966-K970 VanDerWaalsContact O-CG 3.31Å; V966-K970 WeakPolarHBondContact O-CG 3.44Å; V966-K970 PolarHBondContact O-N 3.3Å; V966-G1000 WeakPolarHBondContact CG1-O 3.1Å; V966-F1001 HydrophobicContact CG2-CB 3.82Å; V966-F1001 HydrophobicContact CG2-CD2 4.15Å; V966-F1001 HydrophobicContact CG2-CG 4.48Å; V966-L1004 HydrophobicContact CG1-CD1 4.43Å
967	S	82.9	Confident	83.1	Confident	37 Å²	37	48.4 Å²	48.4	26%	0.259	27%	0.269	S	S	.	.	H	α-helix	trans	-76.4	-41.6	177.7	49.5	0	0	0	0	111.3	N964 Y969 K970 T971	N964-S967 PolarHBondContact O-N 3.11Å; N964-S967 PolarHBondContact O-OG 3.32Å; S967-Y969 PolarHBondContact O-N 3.12Å; S967-K970 PolarHBondContact O-N 3.18Å; S967-T971 WeakPolarHBondContact O-CG2 3.43Å; S967-T971 PolarHBondContact O-N 3.05Å; S967-T971 VanDerWaalsContact O-N 3.08Å; S967-T971 PolarHBondContact O-OG1 3.45Å
968	I	84.4	Confident	83.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-55.3	-53.3	173.1	-59.1	168.6	0	0	0	109.4	V930 L934 C956 I960 N964 K970 T971 A972 L980	V930-I968 HydrophobicContact CG1-CD1 4.18Å; V930-I968 HydrophobicContact CG1-CG1 4.09Å; L934-I968 HydrophobicContact CD1-CG1 4.15Å; L934-I968 HydrophobicContact CD2-CB 4.38Å; L934-I968 HydrophobicContact CD2-CG1 4.12Å; L934-I968 HydrophobicContact CD2-CG2 4.34Å; C956-I968 HydrophobicContact CB-CG2 4.13Å; I960-I968 HydrophobicContact CG1-CD1 4.13Å; N964-I968 HydrophobicContact CB-CD1 4.26Å; N964-I968 WeakPolarHBondContact O-CG1 3.32Å; N964-I968 PolarHBondContact O-N 3.38Å; N964-I968 WeakPolarHBondContact OD1-CD1 3.26Å; I968-K970 PolarHBondContact O-N 3.33Å; I968-T971 PolarHBondContact O-N 3.31Å; I968-T971 PolarHBondContact O-OG1 2.88Å; I968-A972 WeakPolarHBondContact O-CB 3.32Å; I968-A972 PolarHBondContact O-N 3.44Å; I968-L980 HydrophobicContact CG2-CD1 4.14Å; I968-L980 HydrophobicContact CG2-CD2 4.12Å; I968-L980 HydrophobicContact CG2-CG 4.22Å
969	Y	85.1	Confident	83	Confident	15 Å²	15	48.5 Å²	48.5	6%	0.059	28%	0.279	C	S	.	.	H	α-helix	trans	-55.5	-49.4	178.9	175.2	-98.3	0	0	0	113.8	A965 S967 T971 A972 K973 C984 E985 F988 L1004 E1031	A965-Y969 VanDerWaalsContact O-CB 3.24Å; A965-Y969 WeakPolarHBondContact O-CB 3.49Å; A965-Y969 PolarHBondContact O-N 2.98Å; S967-Y969 PolarHBondContact O-N 3.12Å; Y969-T971 VanDerWaalsContact C-N 3.29Å; Y969-T971 PolarHBondContact O-N 3.17Å; Y969-A972 WeakPolarHBondContact O-CB 3.42Å; Y969-A972 PolarHBondContact O-N 3.38Å; Y969-A972 VanDerWaalsContact O-N 3.15Å; Y969-K973 HydrophobicContact CE1-CG 4.17Å; Y969-K973 HydrophobicContact CE2-CD 4.39Å; Y969-K973 VanDerWaalsContact CE2-CE 3.43Å; Y969-K973 HydrophobicContact CE2-CG 4.04Å; Y969-K973 VanDerWaalsContact CZ-CE 3.49Å; Y969-K973 PolarHBondContact O-N 3.49Å; Y969-K973 WeakPolarHBondContact OH-CE 3.42Å; Y969-C984 HydrophobicContact CD2-CB 4.03Å; Y969-E985 HydrophobicContact CD2-CG 4.26Å; Y969-E985 HydrophobicContact CE2-CG 3.7Å; Y969-E985 WeakPolarHBondContact CE2-OE1 3.49Å; Y969-F988 HydrophobicContact CD1-CE2 4.09Å; Y969-F988 HydrophobicContact CD1-CZ 4.36Å; Y969-F988 AromaticContact CD2-CE2 3.67Å; Y969-F988 HydrophobicContact CD2-CE2 3.67Å; Y969-F988 HydrophobicContact CD2-CZ 4.26Å; Y969-F988 HydrophobicContact CE2-CE2 4.2Å; Y969-F988 AromaticContact CG-CE2 3.59Å; Y969-F988 HydrophobicContact CG-CE2 3.59Å; Y969-F988 AromaticContact CG-CZ 3.82Å; Y969-F988 HydrophobicContact CG-CZ 3.82Å; Y969-L1004 HydrophobicContact CD1-CD1 3.82Å; Y969-L1004 HydrophobicContact CD1-CD2 4.47Å; Y969-L1004 HydrophobicContact CE1-CD1 3.93Å; Y969-L1004 HydrophobicContact CE1-CD2 4.25Å; Y969-E1031 PolarHBondContact OH-OE2 3.35Å; Y969-E1031 VanDerWaalsContact OH-OE2 3.05Å
970	K	84.4	Confident	83.1	Confident	109 Å²	109	43.4 Å²	43.4	47%	0.474	26%	0.255	S	S	.	.	H	α-helix	trans	-59.1	-40.9	179.4	-76.2	174.3	-178.2	177.4	0	111.8	V966 S967 I968 A974 L1004	V966-K970 HydrophobicContact CG1-CD 4.31Å; V966-K970 VanDerWaalsContact O-CG 3.31Å; V966-K970 WeakPolarHBondContact O-CG 3.44Å; V966-K970 PolarHBondContact O-N 3.3Å; S967-K970 PolarHBondContact O-N 3.18Å; I968-K970 PolarHBondContact O-N 3.33Å; K970-A974 WeakPolarHBondContact O-CB 3.44Å; K970-A974 PolarHBondContact O-N 3.13Å; K970-A974 VanDerWaalsContact O-N 3.09Å; K970-L1004 HydrophobicContact CD-CD1 4.47Å; K970-L1004 VanDerWaalsContact CE-CD1 3.5Å; K970-L1004 HydrophobicContact CG-CD1 4.13Å
971	T	83.3	Confident	83.1	Confident	38 Å²	38	42.5 Å²	42.5	23%	0.233	25%	0.251	C	S	.	.	H	α-helix	trans	-76.3	-28.7	177	61.8	0	0	0	0	113.4	L934 S967 I968 Y969 N975	L934-T971 HydrophobicContact CB-CG2 4.23Å; L934-T971 HydrophobicContact CD1-CG2 4.16Å; L934-T971 WeakPolarHBondContact CD2-OG1 3.28Å; S967-T971 WeakPolarHBondContact O-CG2 3.43Å; S967-T971 PolarHBondContact O-N 3.05Å; S967-T971 VanDerWaalsContact O-N 3.08Å; S967-T971 PolarHBondContact O-OG1 3.45Å; I968-T971 PolarHBondContact O-N 3.31Å; I968-T971 PolarHBondContact O-OG1 2.88Å; Y969-T971 VanDerWaalsContact C-N 3.29Å; Y969-T971 PolarHBondContact O-N 3.17Å; T971-N975 WeakPolarHBondContact O-CB 3.47Å; T971-N975 PolarHBondContact O-N 3.47Å; T971-N975 VanDerWaalsContact O-N 3.09Å; T971-N975 PolarHBondContact O-ND2 3.27Å
972	A	84.9	Confident	83	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-49.2	172.9	0	0	0	0	0	111.2	I968 Y969 N975 G976 S977 L980	I968-A972 WeakPolarHBondContact O-CB 3.32Å; I968-A972 PolarHBondContact O-N 3.44Å; Y969-A972 WeakPolarHBondContact O-CB 3.42Å; Y969-A972 PolarHBondContact O-N 3.38Å; Y969-A972 VanDerWaalsContact O-N 3.15Å; A972-N975 CarbonylContact O-C 3.6Å; A972-N975 PolarHBondContact O-N 2.88Å; A972-G976 PolarHBondContact O-N 3.27Å; A972-G976 VanDerWaalsContact O-N 3.09Å; A972-S977 PolarHBondContact O-N 2.95Å; A972-L980 HydrophobicContact CB-CB 4.17Å; A972-L980 HydrophobicContact CB-CD2 3.85Å; A972-L980 HydrophobicContact CB-CG 3.9Å
973	K	84	Confident	83.1	Confident	71 Å²	71	37.8 Å²	37.8	31%	0.309	23%	0.229	S	C	.	.	H	α-helix	trans	-61.9	-45.3	174.8	-67.5	-65.9	-172.5	-169.1	0	111.9	Y969 N975 G976 S981 E985 E1031	Y969-K973 HydrophobicContact CE1-CG 4.17Å; Y969-K973 HydrophobicContact CE2-CD 4.39Å; Y969-K973 VanDerWaalsContact CE2-CE 3.43Å; Y969-K973 HydrophobicContact CE2-CG 4.04Å; Y969-K973 VanDerWaalsContact CZ-CE 3.49Å; Y969-K973 PolarHBondContact O-N 3.49Å; Y969-K973 WeakPolarHBondContact OH-CE 3.42Å; K973-N975 PolarHBondContact O-N 3.13Å; K973-N975 VanDerWaalsContact O-N 3.15Å; K973-G976 PolarHBondContact O-N 2.95Å; K973-G976 VanDerWaalsContact O-N 3.1Å; K973-S981 WeakPolarHBondContact CE-OG 3.45Å; K973-S981 PolarHBondContact NZ-OG 3.12Å; K973-E985 VanDerWaalsContact CE-OE1 3.27Å; K973-E985 WeakPolarHBondContact CE-OE1 3.34Å; K973-E985 IonicContact NZ-OE1 3.71Å; K973-E985 PolarHBondContact NZ-OE1 2.69Å; K973-E1031 WeakPolarHBondContact CE-OE2 3.27Å; K973-E1031 IonicContact NZ-OE1 2.87Å; K973-E1031 PolarHBondContact NZ-OE1 2.87Å; K973-E1031 IonicContact NZ-OE2 2.84Å; K973-E1031 PolarHBondContact NZ-OE2 2.89Å
974	A	83.5	Confident	83.2	Confident	80 Å²	80	32 Å²	32	66%	0.661	20%	0.198	S	C	*	.	H	α-helix	trans	-60.5	-23.9	176.8	0	0	0	0	0	113.9	K970	K970-A974 WeakPolarHBondContact O-CB 3.44Å; K970-A974 PolarHBondContact O-N 3.13Å; K970-A974 VanDerWaalsContact O-N 3.09Å
975	N	80.8	Confident	83.2	Confident	17 Å²	17	31.7 Å²	31.7	9%	0.091	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	2.4	177.7	-70.4	-51.2	0	0	0	114.8	S938 N941 Q949 T971 A972 K973 S977	S938-N975 WeakPolarHBondContact CA-OD1 3.48Å; N941-N975 HydrophobicContact CB-CB 4.11Å; N941-N975 WeakPolarHBondContact CB-OD1 3.28Å; N941-N975 WeakPolarHBondContact ND2-CA 3.24Å; N941-N975 PolarHBondContact ND2-OD1 2.85Å; Q949-N975 PolarHBondContact NE2-O 3.25Å; T971-N975 WeakPolarHBondContact O-CB 3.47Å; T971-N975 PolarHBondContact O-N 3.47Å; T971-N975 VanDerWaalsContact O-N 3.09Å; T971-N975 PolarHBondContact O-ND2 3.27Å; A972-N975 CarbonylContact O-C 3.6Å; A972-N975 PolarHBondContact O-N 2.88Å; K973-N975 PolarHBondContact O-N 3.13Å; K973-N975 VanDerWaalsContact O-N 3.15Å; N975-S977 PolarHBondContact O-N 2.85Å
976	G	79.1	Confident	83.2	Confident	55 Å²	55	31.8 Å²	31.8	57%	0.567	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.5	17.2	-177.2	0	0	0	0	0	114.8	A972 K973 V978	A972-G976 PolarHBondContact O-N 3.27Å; A972-G976 VanDerWaalsContact O-N 3.09Å; K973-G976 PolarHBondContact O-N 2.95Å; K973-G976 VanDerWaalsContact O-N 3.1Å; G976-V978 PolarHBondContact O-N 3.04Å
977	S	81.3	Confident	83.3	Confident	4 Å²	4	32 Å²	32	3%	0.028	20%	0.196	C	C	.	.			trans	-80.1	77.1	-177.2	-75.2	0	0	0	0	111.8	Q949 E953 A972 N975 D979 L980 S981	Q949-S977 PolarHBondContact NE2-OG 3.1Å; E953-S977 WeakPolarHBondContact OE1-CB 3.47Å; E953-S977 PolarHBondContact OE1-OG 3.33Å; A972-S977 PolarHBondContact O-N 2.95Å; N975-S977 PolarHBondContact O-N 2.85Å; S977-D979 PolarHBondContact O-N 3.11Å; S977-L980 PolarHBondContact O-N 3.1Å; S977-S981 PolarHBondContact O-N 2.56Å
978	V	80.9	Confident	83.5	Confident	104 Å²	104	30.4 Å²	30.4	63%	0.63	18%	0.184	S	C	*	.	H	α-helix	trans	-54.5	-47.5	-174.7	-176.2	0	0	0	0	113.1	G976 L980 S981 S982	G976-V978 PolarHBondContact O-N 3.04Å; V978-L980 VanDerWaalsContact C-N 3.32Å; V978-L980 PolarHBondContact O-N 2.75Å; V978-S981 PolarHBondContact O-N 2.84Å; V978-S981 PolarHBondContact O-OG 3.37Å; V978-S982 WeakPolarHBondContact O-CB 3.38Å; V978-S982 PolarHBondContact O-N 3.23Å
979	D	80.9	Confident	83.5	Confident	67 Å²	67	30.4 Å²	30.4	36%	0.358	18%	0.184	S	C	.	.	H	α-helix	trans	-65.8	-35.1	-177.7	-62.7	-26.5	0	0	0	112.3	I837 R950 S977 C983	I837-D979 HydrophobicContact CG1-CB 4.37Å; R950-D979 IonicContact CZ-OD2 3.6Å; R950-D979 IonicContact NH1-OD2 3.78Å; R950-D979 PolarHBondContact NH1-OD2 3.13Å; R950-D979 IonicContact NH2-OD2 2.79Å; R950-D979 PolarHBondContact NH2-OD2 3.37Å; S977-D979 PolarHBondContact O-N 3.11Å; D979-C983 VanDerWaalsContact O-CB 3.31Å; D979-C983 WeakPolarHBondContact O-CB 3.49Å; D979-C983 PolarHBondContact O-N 3.23Å
980	L	83.4	Confident	83.5	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-73	-36.1	175.7	-179.1	63.8	0	0	0	111.4	I837 L937 E953 C956 I968 A972 S977 V978 C983 C984	I837-L980 HydrophobicContact CD1-CD1 4.38Å; L937-L980 HydrophobicContact CD2-CD2 3.87Å; E953-L980 HydrophobicContact CB-CB 4.28Å; E953-L980 HydrophobicContact CB-CD2 4.46Å; E953-L980 HydrophobicContact CG-CB 3.98Å; E953-L980 HydrophobicContact CG-CD2 4.09Å; C956-L980 HydrophobicContact CB-CD1 3.85Å; C956-L980 HydrophobicContact CB-CD2 4.13Å; I968-L980 HydrophobicContact CG2-CD1 4.14Å; I968-L980 HydrophobicContact CG2-CD2 4.12Å; I968-L980 HydrophobicContact CG2-CG 4.22Å; A972-L980 HydrophobicContact CB-CB 4.17Å; A972-L980 HydrophobicContact CB-CD2 3.85Å; A972-L980 HydrophobicContact CB-CG 3.9Å; S977-L980 PolarHBondContact O-N 3.1Å; V978-L980 VanDerWaalsContact C-N 3.32Å; V978-L980 PolarHBondContact O-N 2.75Å; L980-C983 PolarHBondContact O-N 2.95Å; L980-C984 PolarHBondContact O-N 3.11Å; L980-C984 PolarHBondContact O-SG 3.31Å
981	S	83.9	Confident	83.5	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-65.8	-48.1	174.6	93.8	0	0	0	0	110.2	K973 S977 V978 C983 C984 E985	K973-S981 WeakPolarHBondContact CE-OG 3.45Å; K973-S981 PolarHBondContact NZ-OG 3.12Å; S977-S981 PolarHBondContact O-N 2.56Å; V978-S981 PolarHBondContact O-N 2.84Å; V978-S981 PolarHBondContact O-OG 3.37Å; S981-C983 VanDerWaalsContact C-N 3.27Å; S981-C983 PolarHBondContact O-N 3.21Å; S981-C984 CarbonylContact O-C 3.33Å; S981-C984 WeakPolarHBondContact O-CA 3.49Å; S981-C984 WeakPolarHBondContact O-CB 3.42Å; S981-C984 PolarHBondContact O-N 3.21Å; S981-E985 WeakPolarHBondContact CB-OE1 3.39Å; S981-E985 WeakPolarHBondContact O-CB 3.45Å; S981-E985 WeakPolarHBondContact O-CG 3.31Å; S981-E985 PolarHBondContact O-N 3.37Å; S981-E985 PolarHBondContact OG-OE1 3.18Å
982	S	82.9	Confident	83.7	Confident	35 Å²	35	28.8 Å²	28.8	25%	0.245	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-35.2	175.4	-174.2	0	0	0	0	113.2	V978 E985 S986	V978-S982 WeakPolarHBondContact O-CB 3.38Å; V978-S982 PolarHBondContact O-N 3.23Å; S982-E985 WeakPolarHBondContact CA-OE2 3.47Å; S982-E985 PolarHBondContact N-OE1 3.48Å; S982-S986 WeakPolarHBondContact O-CB 3.39Å; S982-S986 PolarHBondContact O-N 2.99Å; S982-S986 PolarHBondContact O-OG 3.48Å
983	C	83.9	Confident	83.7	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.014	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-42.9	171.9	-167.1	0	0	0	0	112.2	D979 L980 S981 F987	D979-C983 VanDerWaalsContact O-CB 3.31Å; D979-C983 WeakPolarHBondContact O-CB 3.49Å; D979-C983 PolarHBondContact O-N 3.23Å; L980-C983 PolarHBondContact O-N 2.95Å; S981-C983 VanDerWaalsContact C-N 3.27Å; S981-C983 PolarHBondContact O-N 3.21Å; C983-F987 PolarHBondContact O-N 2.94Å; C983-F987 VanDerWaalsContact O-N 3.08Å
984	C	84.3	Confident	83.7	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.4	-41.3	174.2	-63	0	0	0	0	112.2	Y969 L980 S981 S986 F987 F988	Y969-C984 HydrophobicContact CD2-CB 4.03Å; L980-C984 PolarHBondContact O-N 3.11Å; L980-C984 PolarHBondContact O-SG 3.31Å; S981-C984 CarbonylContact O-C 3.33Å; S981-C984 WeakPolarHBondContact O-CA 3.49Å; S981-C984 WeakPolarHBondContact O-CB 3.42Å; S981-C984 PolarHBondContact O-N 3.21Å; C984-S986 VanDerWaalsContact C-N 3.33Å; C984-S986 PolarHBondContact O-N 3.35Å; C984-F987 PolarHBondContact O-N 3.4Å; C984-F988 HydrophobicContact CB-CZ 4.48Å; C984-F988 WeakPolarHBondContact O-CD1 3.48Å; C984-F988 WeakPolarHBondContact O-CD2 3.14Å; C984-F988 WeakPolarHBondContact O-CG 3.45Å; C984-F988 PolarHBondContact O-N 3.07Å
985	E	85.2	Confident	83.6	Confident	9 Å²	9	24.8 Å²	24.8	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-62	-40.4	176.6	-66.9	149.1	-145.5	0	0	110.9	Y969 K973 S981 S982 F988 L989 L1032 I1035	Y969-E985 HydrophobicContact CD2-CG 4.26Å; Y969-E985 HydrophobicContact CE2-CG 3.7Å; Y969-E985 WeakPolarHBondContact CE2-OE1 3.49Å; K973-E985 VanDerWaalsContact CE-OE1 3.27Å; K973-E985 WeakPolarHBondContact CE-OE1 3.34Å; K973-E985 IonicContact NZ-OE1 3.71Å; K973-E985 PolarHBondContact NZ-OE1 2.69Å; S981-E985 WeakPolarHBondContact CB-OE1 3.39Å; S981-E985 WeakPolarHBondContact O-CB 3.45Å; S981-E985 WeakPolarHBondContact O-CG 3.31Å; S981-E985 PolarHBondContact O-N 3.37Å; S981-E985 PolarHBondContact OG-OE1 3.18Å; S982-E985 WeakPolarHBondContact CA-OE2 3.47Å; S982-E985 PolarHBondContact N-OE1 3.48Å; E985-F988 WeakPolarHBondContact O-CB 3.27Å; E985-F988 PolarHBondContact O-N 3.16Å; E985-L989 PolarHBondContact O-N 3.3Å; E985-L1032 HydrophobicContact CB-CD2 4.05Å; E985-L1032 WeakPolarHBondContact O-CD2 3.44Å; E985-I1035 HydrophobicContact CB-CD1 3.66Å; E985-I1035 HydrophobicContact CG-CD1 4.46Å; E985-I1035 WeakPolarHBondContact OE2-CD1 3.35Å
986	S	84.8	Confident	83.7	Confident	3 Å²	3	24.3 Å²	24.3	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-42.6	172	-61.8	0	0	0	0	112.5	P835 S982 C984 L989 Q990	P835-S986 WeakPolarHBondContact CD-OG 3.44Å; P835-S986 WeakPolarHBondContact CG-OG 3.35Å; S982-S986 WeakPolarHBondContact O-CB 3.39Å; S982-S986 PolarHBondContact O-N 2.99Å; S982-S986 PolarHBondContact O-OG 3.48Å; C984-S986 VanDerWaalsContact C-N 3.33Å; C984-S986 PolarHBondContact O-N 3.35Å; S986-L989 PolarHBondContact O-N 3.04Å; S986-Q990 PolarHBondContact O-N 3.42Å
987	F	85.4	Confident	83.8	Confident	24 Å²	24	29.2 Å²	29.2	11%	0.105	16%	0.159	C	C	.	.	H	α-helix	trans	-66.4	-37.4	174.8	-178.1	-93.1	0	0	0	112	L834 I960 L962 A965 C983 C984 Q990 Q991 L995	L834-F987 HydrophobicContact CD1-CD2 4.42Å; L834-F987 HydrophobicContact CD2-CB 4.06Å; I960-F987 HydrophobicContact CG2-CB 4.16Å; I960-F987 HydrophobicContact CG2-CD1 3.47Å; I960-F987 VanDerWaalsContact CG2-CD1 3.47Å; I960-F987 HydrophobicContact CG2-CD2 3.98Å; I960-F987 HydrophobicContact CG2-CE1 3.75Å; I960-F987 HydrophobicContact CG2-CE2 4.22Å; I960-F987 HydrophobicContact CG2-CG 3.59Å; I960-F987 HydrophobicContact CG2-CZ 4.12Å; L962-F987 HydrophobicContact CD2-CE1 4.49Å; L962-F987 HydrophobicContact CD2-CZ 4.45Å; A965-F987 HydrophobicContact CB-CD1 3.92Å; A965-F987 HydrophobicContact CB-CE1 3.97Å; C983-F987 PolarHBondContact O-N 2.94Å; C983-F987 VanDerWaalsContact O-N 3.08Å; C984-F987 PolarHBondContact O-N 3.4Å; F987-Q990 PolarHBondContact O-N 3.35Å; F987-Q991 HydrophobicContact CE2-CG 4.26Å; F987-Q991 HydrophobicContact CZ-CG 4.2Å; F987-Q991 PolarHBondContact O-N 3.23Å; F987-L995 HydrophobicContact CD1-CD1 4.41Å; F987-L995 HydrophobicContact CE1-CD1 4.38Å
988	F	87.4	Confident	83.8	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.009	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-43.6	174.4	-66.3	-24	0	0	0	112	A965 Y969 C984 E985 M992 L995 F1001 L1032	A965-F988 HydrophobicContact CB-CD1 4.31Å; A965-F988 HydrophobicContact CB-CE1 3.64Å; Y969-F988 HydrophobicContact CD1-CE2 4.09Å; Y969-F988 HydrophobicContact CD1-CZ 4.36Å; Y969-F988 AromaticContact CD2-CE2 3.67Å; Y969-F988 HydrophobicContact CD2-CE2 3.67Å; Y969-F988 HydrophobicContact CD2-CZ 4.26Å; Y969-F988 HydrophobicContact CE2-CE2 4.2Å; Y969-F988 AromaticContact CG-CE2 3.59Å; Y969-F988 HydrophobicContact CG-CE2 3.59Å; Y969-F988 AromaticContact CG-CZ 3.82Å; Y969-F988 HydrophobicContact CG-CZ 3.82Å; C984-F988 HydrophobicContact CB-CZ 4.48Å; C984-F988 WeakPolarHBondContact O-CD1 3.48Å; C984-F988 WeakPolarHBondContact O-CD2 3.14Å; C984-F988 WeakPolarHBondContact O-CG 3.45Å; C984-F988 PolarHBondContact O-N 3.07Å; E985-F988 WeakPolarHBondContact O-CB 3.27Å; E985-F988 PolarHBondContact O-N 3.16Å; F988-M992 VanDerWaalsContact O-CA 3.25Å; F988-M992 WeakPolarHBondContact O-CA 3.24Å; F988-M992 WeakPolarHBondContact O-CB 3.19Å; F988-M992 PolarHBondContact O-N 3.05Å; F988-M992 VanDerWaalsContact O-N 3.12Å; F988-L995 HydrophobicContact CB-CD1 4.46Å; F988-L995 HydrophobicContact CD1-CD1 3.8Å; F988-F1001 HydrophobicContact CB-CE2 3.91Å; F988-F1001 HydrophobicContact CB-CZ 3.95Å; F988-F1001 HydrophobicContact CD1-CD2 4.15Å; F988-F1001 AromaticContact CD1-CE2 3.58Å; F988-F1001 HydrophobicContact CD1-CE2 3.58Å; F988-F1001 HydrophobicContact CD1-CZ 4.3Å; F988-F1001 AromaticContact CD2-CE2 3.84Å; F988-F1001 HydrophobicContact CD2-CE2 3.84Å; F988-F1001 HydrophobicContact CE1-CD2 4.09Å; F988-F1001 AromaticContact CE1-CE2 3.92Å; F988-F1001 HydrophobicContact CE1-CE2 3.92Å; F988-F1001 HydrophobicContact CE2-CE2 4.19Å; F988-F1001 HydrophobicContact CG-CD2 4.47Å; F988-F1001 AromaticContact CG-CE2 3.52Å; F988-F1001 HydrophobicContact CG-CE2 3.52Å; F988-F1001 HydrophobicContact CG-CZ 4.09Å; F988-F1001 HydrophobicContact CZ-CD2 4.39Å; F988-F1001 HydrophobicContact CZ-CE2 4.22Å; F988-L1032 HydrophobicContact CB-CD2 3.99Å; F988-L1032 HydrophobicContact CD2-CD2 4.46Å
989	L	84.2	Confident	83.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-43.5	173.5	-69.7	173.6	0	0	0	111.5	S826 F829 E985 S986 Q991 L1032 I1035 L1036	S826-L989 WeakPolarHBondContact CA-O 3.5Å; S826-L989 WeakPolarHBondContact CB-O 3.32Å; S826-L989 PolarHBondContact OG-O 2.9Å; F829-L989 HydrophobicContact CB-CB 4.19Å; F829-L989 HydrophobicContact CD1-CB 4.44Å; F829-L989 HydrophobicContact CD2-CB 3.92Å; F829-L989 HydrophobicContact CD2-CD1 3.63Å; F829-L989 HydrophobicContact CD2-CG 4.43Å; F829-L989 HydrophobicContact CE2-CB 4.45Å; F829-L989 HydrophobicContact CE2-CD1 3.92Å; F829-L989 HydrophobicContact CG-CB 3.92Å; F829-L989 HydrophobicContact CG-CD1 4.45Å; E985-L989 PolarHBondContact O-N 3.3Å; S986-L989 PolarHBondContact O-N 3.04Å; L989-Q991 PolarHBondContact O-N 2.64Å; L989-L1032 HydrophobicContact CD1-CD2 4.47Å; L989-L1032 HydrophobicContact CD2-CB 4.28Å; L989-L1032 HydrophobicContact CD2-CD2 3.99Å; L989-L1032 HydrophobicContact CG-CD2 3.78Å; L989-I1035 HydrophobicContact CD1-CB 4.25Å; L989-I1035 HydrophobicContact CD1-CG2 3.74Å; L989-L1036 HydrophobicContact CD1-CB 4.04Å; L989-L1036 HydrophobicContact CD2-CB 4.43Å; L989-L1036 HydrophobicContact CD2-CD2 4.44Å
990	Q	85.3	Confident	83.2	Confident	47 Å²	47	32.3 Å²	32.3	22%	0.22	18%	0.176	C	C	.	.	H	α-helix	trans	-69.4	-27.3	-176.2	-172.7	168.8	73	0	0	114.6	F829 G830 A832 S986 F987	F829-Q990 HydrophobicContact CD1-CB 4.09Å; F829-Q990 HydrophobicContact CE1-CB 4.32Å; G830-Q990 PolarHBondContact O-NE2 3.07Å; A832-Q990 PolarHBondContact O-NE2 3.17Å; S986-Q990 PolarHBondContact O-N 3.42Å; F987-Q990 PolarHBondContact O-N 3.35Å
991	Q	84.6	Confident	83.1	Confident	81 Å²	81	32.3 Å²	32.3	38%	0.379	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	24.8	-176.6	-67.8	-63.5	-39.4	0	0	113.4	L962 F987 L989 A994 L995	L962-Q991 HydrophobicContact CD2-CB 4.1Å; F987-Q991 HydrophobicContact CE2-CG 4.26Å; F987-Q991 HydrophobicContact CZ-CG 4.2Å; F987-Q991 PolarHBondContact O-N 3.23Å; L989-Q991 PolarHBondContact O-N 2.64Å; Q991-A994 PolarHBondContact O-N 3.31Å; Q991-L995 HydrophobicContact CB-CD1 4.1Å; Q991-L995 HydrophobicContact CB-CG 4.33Å; Q991-L995 WeakPolarHBondContact O-CG 3.22Å; Q991-L995 PolarHBondContact O-N 2.96Å
992	M	86.1	Confident	82.8	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-57	-42.4	-168.2	-154.8	177	-179	0	0	114.9	L809 A822 F825 S826 F988 A994 L995 L996 F1001 L1005	L809-M992 HydrophobicContact CD2-CE 4.08Å; A822-M992 HydrophobicContact CB-CB 3.99Å; A822-M992 HydrophobicContact CB-CG 3.89Å; A822-M992 HydrophobicContact CB-SD 4.14Å; F825-M992 HydrophobicContact CB-SD 4.06Å; F825-M992 HydrophobicContact CD2-CE 4.24Å; F825-M992 HydrophobicContact CD2-SD 3.7Å; F825-M992 HydrophobicContact CG-SD 4.36Å; S826-M992 PolarHBondContact OG-N 3.06Å; F988-M992 VanDerWaalsContact O-CA 3.25Å; F988-M992 WeakPolarHBondContact O-CA 3.24Å; F988-M992 WeakPolarHBondContact O-CB 3.19Å; F988-M992 PolarHBondContact O-N 3.05Å; F988-M992 VanDerWaalsContact O-N 3.12Å; M992-A994 PolarHBondContact O-N 3.47Å; M992-L995 PolarHBondContact O-N 3.36Å; M992-L996 HydrophobicContact CG-CD1 4.21Å; M992-L996 WeakPolarHBondContact O-CD1 3.45Å; M992-L996 WeakPolarHBondContact O-CG 3.14Å; M992-L996 PolarHBondContact O-N 2.94Å; M992-F1001 HydrophobicContact CG-CE1 4.13Å; M992-F1001 HydrophobicContact CG-CZ 4.37Å; M992-L1005 HydrophobicContact CE-CD1 3.68Å
993	P	85.4	Confident	82.6	Confident	37 Å²	37	37 Å²	37	24%	0.24	20%	0.195	C	C	.	.	H	α-helix	trans	-60.8	-45.2	178.2	-25.6	35.4	0	0	0	113.7	Q819 A822 A823 S826 L996	Q819-P993 PolarHBondContact NE2-O 3.13Å; Q819-P993 PolarHBondContact OE1-O 2.94Å; A822-P993 HydrophobicContact CB-CG 4.08Å; A823-P993 HydrophobicContact CB-CG 4.31Å; S826-P993 WeakPolarHBondContact OG-CD 3.37Å; P993-L996 PolarHBondContact O-N 3.43Å
994	A	83.6	Confident	82.4	Confident	30 Å²	30	38.2 Å²	38.2	25%	0.248	20%	0.201	C	C	.	.	H	α-helix	trans	-71.6	-33.7	-179.2	0	0	0	0	0	112.2	L962 Q991 M992	L962-A994 HydrophobicContact CD1-CB 4.39Å; L962-A994 HydrophobicContact CD2-CB 4.24Å; Q991-A994 PolarHBondContact O-N 3.31Å; M992-A994 PolarHBondContact O-N 3.47Å
995	L	82.9	Confident	82.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.9	-31.1	174	-70.9	167.5	0	0	0	112.2	L962 F987 F988 Q991 M992 E997 K998 F1001	L962-L995 HydrophobicContact CB-CD2 4.42Å; L962-L995 HydrophobicContact CD2-CD2 3.73Å; L962-L995 HydrophobicContact CD2-CG 3.88Å; F987-L995 HydrophobicContact CD1-CD1 4.41Å; F987-L995 HydrophobicContact CE1-CD1 4.38Å; F988-L995 HydrophobicContact CB-CD1 4.46Å; F988-L995 HydrophobicContact CD1-CD1 3.8Å; Q991-L995 HydrophobicContact CB-CD1 4.1Å; Q991-L995 HydrophobicContact CB-CG 4.33Å; Q991-L995 WeakPolarHBondContact O-CG 3.22Å; Q991-L995 PolarHBondContact O-N 2.96Å; M992-L995 PolarHBondContact O-N 3.36Å; L995-E997 PolarHBondContact O-N 3.32Å; L995-K998 WeakPolarHBondContact O-CB 3.23Å; L995-K998 PolarHBondContact O-N 3.26Å; L995-F1001 HydrophobicContact CB-CB 4.4Å; L995-F1001 HydrophobicContact CB-CD1 3.42Å; L995-F1001 VanDerWaalsContact CB-CD1 3.42Å; L995-F1001 HydrophobicContact CB-CD2 4.49Å; L995-F1001 HydrophobicContact CB-CE1 3.59Å; L995-F1001 HydrophobicContact CB-CG 3.88Å; L995-F1001 HydrophobicContact CB-CZ 4.23Å; L995-F1001 HydrophobicContact CD1-CE1 4.44Å; L995-F1001 HydrophobicContact CD1-CE2 4.48Å; L995-F1001 HydrophobicContact CD1-CZ 4.28Å; L995-F1001 WeakPolarHBondContact O-CB 3.46Å; L995-F1001 WeakPolarHBondContact O-CD1 3.22Å
996	L	82.2	Confident	81.4	Confident	6 Å²	6	41.5 Å²	41.5	3%	0.031	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-14.8	178.4	-80.1	163.9	0	0	0	114.5	I818 A822 M992 P993 F1001 L1005	I818-L996 HydrophobicContact CG2-CD1 3.99Å; I818-L996 HydrophobicContact CG2-CD2 4.16Å; A822-L996 HydrophobicContact CB-CD1 3.33Å; M992-L996 HydrophobicContact CG-CD1 4.21Å; M992-L996 WeakPolarHBondContact O-CD1 3.45Å; M992-L996 WeakPolarHBondContact O-CG 3.14Å; M992-L996 PolarHBondContact O-N 2.94Å; P993-L996 PolarHBondContact O-N 3.43Å; L996-F1001 HydrophobicContact CD2-CD1 4.27Å; L996-F1001 HydrophobicContact CD2-CE1 4.36Å; L996-F1001 HydrophobicContact CG-CD1 4.22Å; L996-F1001 HydrophobicContact CG-CE1 4.14Å; L996-L1005 HydrophobicContact CD2-CD1 3.94Å
997	E	81.1	Confident	80.4	Confident	159 Å²	159	43.1 Å²	43.1	74%	0.743	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-14	167.3	-57.7	-169	154.8	0	0	112.7	L995	L995-E997 PolarHBondContact O-N 3.32Å
998	K	82	Confident	78.6	Confident	76 Å²	76	47.6 Å²	47.6	33%	0.33	27%	0.265	S	S	.	.	S	Bend	trans	-95.9	117.6	179.6	-55.5	-76	-176.5	163	0	110.5	D963 L995 G1000 F1001 R1002	D963-K998 IonicContact OD1-NZ 2.66Å; D963-K998 PolarHBondContact OD1-NZ 3.3Å; D963-K998 IonicContact OD2-NZ 3.85Å; L995-K998 WeakPolarHBondContact O-CB 3.23Å; L995-K998 PolarHBondContact O-N 3.26Å; K998-G1000 PolarHBondContact O-N 2.9Å; K998-F1001 PolarHBondContact O-N 3.07Å; K998-R1002 PolarHBondContact O-N 2.88Å
999	D	75	Confident	76.3	Confident	129 Å²	129	54.6 Å²	54.6	69%	0.69	30%	0.303	S	S	*	.	H	α-helix	trans	-50.7	-36.6	177.7	-71.4	-50	0	0	0	113.5	F1001 R1002 T1003	D999-F1001 VanDerWaalsContact C-N 3.31Å; D999-F1001 PolarHBondContact O-N 3.42Å; D999-R1002 PolarHBondContact O-N 2.72Å; D999-T1003 WeakPolarHBondContact O-CB 3.07Å; D999-T1003 WeakPolarHBondContact O-CG2 3.2Å; D999-T1003 PolarHBondContact O-N 3.02Å; D999-T1003 PolarHBondContact O-OG1 3.21Å
1000	G	73.9	Confident	73.7	Confident	34 Å²	34	60.6 Å²	60.6	35%	0.351	34%	0.343	S	S	.	.	H	α-helix	trans	-64.5	-29.3	179.8	0	0	0	0	0	114.7	V966 K998 T1003	V966-G1000 WeakPolarHBondContact CG1-O 3.1Å; K998-G1000 PolarHBondContact O-N 2.9Å; G1000-T1003 PolarHBondContact O-OG1 2.86Å
1001	F	80.8	Confident	71	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-89.3	-41.1	175	-177.5	-113.4	0	0	0	111	V966 F988 M992 L995 L996 K998 D999 T1003 L1004 L1005	V966-F1001 HydrophobicContact CG2-CB 3.82Å; V966-F1001 HydrophobicContact CG2-CD2 4.15Å; V966-F1001 HydrophobicContact CG2-CG 4.48Å; F988-F1001 HydrophobicContact CB-CE2 3.91Å; F988-F1001 HydrophobicContact CB-CZ 3.95Å; F988-F1001 HydrophobicContact CD1-CD2 4.15Å; F988-F1001 AromaticContact CD1-CE2 3.58Å; F988-F1001 HydrophobicContact CD1-CE2 3.58Å; F988-F1001 HydrophobicContact CD1-CZ 4.3Å; F988-F1001 AromaticContact CD2-CE2 3.84Å; F988-F1001 HydrophobicContact CD2-CE2 3.84Å; F988-F1001 HydrophobicContact CE1-CD2 4.09Å; F988-F1001 AromaticContact CE1-CE2 3.92Å; F988-F1001 HydrophobicContact CE1-CE2 3.92Å; F988-F1001 HydrophobicContact CE2-CE2 4.19Å; F988-F1001 HydrophobicContact CG-CD2 4.47Å; F988-F1001 AromaticContact CG-CE2 3.52Å; F988-F1001 HydrophobicContact CG-CE2 3.52Å; F988-F1001 HydrophobicContact CG-CZ 4.09Å; F988-F1001 HydrophobicContact CZ-CD2 4.39Å; F988-F1001 HydrophobicContact CZ-CE2 4.22Å; M992-F1001 HydrophobicContact CG-CE1 4.13Å; M992-F1001 HydrophobicContact CG-CZ 4.37Å; L995-F1001 HydrophobicContact CB-CB 4.4Å; L995-F1001 HydrophobicContact CB-CD1 3.42Å; L995-F1001 VanDerWaalsContact CB-CD1 3.42Å; L995-F1001 HydrophobicContact CB-CD2 4.49Å; L995-F1001 HydrophobicContact CB-CE1 3.59Å; L995-F1001 HydrophobicContact CB-CG 3.88Å; L995-F1001 HydrophobicContact CB-CZ 4.23Å; L995-F1001 HydrophobicContact CD1-CE1 4.44Å; L995-F1001 HydrophobicContact CD1-CE2 4.48Å; L995-F1001 HydrophobicContact CD1-CZ 4.28Å; L995-F1001 WeakPolarHBondContact O-CB 3.46Å; L995-F1001 WeakPolarHBondContact O-CD1 3.22Å; L996-F1001 HydrophobicContact CD2-CD1 4.27Å; L996-F1001 HydrophobicContact CD2-CE1 4.36Å; L996-F1001 HydrophobicContact CG-CD1 4.22Å; L996-F1001 HydrophobicContact CG-CE1 4.14Å; K998-F1001 PolarHBondContact O-N 3.07Å; D999-F1001 VanDerWaalsContact C-N 3.31Å; D999-F1001 PolarHBondContact O-N 3.42Å; F1001-T1003 VanDerWaalsContact C-N 3.3Å; F1001-T1003 PolarHBondContact O-N 3.47Å; F1001-L1004 HydrophobicContact CD2-CD2 4.5Å; F1001-L1004 WeakPolarHBondContact O-CA 3.33Å; F1001-L1004 WeakPolarHBondContact O-CB 3.12Å; F1001-L1004 PolarHBondContact O-N 2.9Å; F1001-L1005 HydrophobicContact CD1-CD1 3.89Å; F1001-L1005 HydrophobicContact CE1-CD1 3.35Å; F1001-L1005 HydrophobicContact CE1-CG 4.2Å; F1001-L1005 HydrophobicContact CE2-CD1 4.23Å; F1001-L1005 HydrophobicContact CE2-CG 4.27Å; F1001-L1005 HydrophobicContact CZ-CD1 3.55Å; F1001-L1005 HydrophobicContact CZ-CD2 4.39Å; F1001-L1005 HydrophobicContact CZ-CG 4.08Å; F1001-L1005 PolarHBondContact O-N 2.89Å
1002	R	78.3	Confident	68.5	Low	72 Å²	72	71.7 Å²	71.7	27%	0.272	39%	0.392	S	S	.	.	H	α-helix	trans	-56.7	-42	175	-171.7	179.7	175	107.9	0.1	112.4	D815 K998 D999 L1004 L1006	D815-R1002 IonicContact OD1-CZ 3.15Å; D815-R1002 IonicContact OD1-NH1 2.71Å; D815-R1002 PolarHBondContact OD1-NH1 3.23Å; D815-R1002 IonicContact OD1-NH2 2.68Å; D815-R1002 PolarHBondContact OD1-NH2 3.45Å; K998-R1002 PolarHBondContact O-N 2.88Å; D999-R1002 PolarHBondContact O-N 2.72Å; R1002-L1004 VanDerWaalsContact C-N 3.33Å; R1002-L1006 HydrophobicContact CG-CD1 4.06Å; R1002-L1006 WeakPolarHBondContact O-CB 3.41Å; R1002-L1006 PolarHBondContact O-N 2.73Å
1003	T	79.3	Confident	65.7	Low	64 Å²	64	80.9 Å²	80.9	39%	0.393	44%	0.436	S	S	.	.	H	α-helix	trans	-71.7	-22.1	174.7	50.7	0	0	0	0	114.1	D999 G1000 F1001 G1007	D999-T1003 WeakPolarHBondContact O-CB 3.07Å; D999-T1003 WeakPolarHBondContact O-CG2 3.2Å; D999-T1003 PolarHBondContact O-N 3.02Å; D999-T1003 PolarHBondContact O-OG1 3.21Å; G1000-T1003 PolarHBondContact O-OG1 2.86Å; F1001-T1003 VanDerWaalsContact C-N 3.3Å; F1001-T1003 PolarHBondContact O-N 3.47Å; T1003-G1007 CarbonylContact O-C 3.54Å; T1003-G1007 VanDerWaalsContact O-CA 3.3Å; T1003-G1007 WeakPolarHBondContact O-CA 3.3Å; T1003-G1007 PolarHBondContact O-N 3.08Å
1004	L	79.6	Confident	63.2	Low	29 Å²	29	82.7 Å²	82.7	15%	0.152	46%	0.46	C	S	.	.	H	α-helix	trans	-77.6	-38.3	173.9	-178.2	127.5	0	0	0	111.9	V966 Y969 K970 F1001 R1002 P1028	V966-L1004 HydrophobicContact CG1-CD1 4.43Å; Y969-L1004 HydrophobicContact CD1-CD1 3.82Å; Y969-L1004 HydrophobicContact CD1-CD2 4.47Å; Y969-L1004 HydrophobicContact CE1-CD1 3.93Å; Y969-L1004 HydrophobicContact CE1-CD2 4.25Å; K970-L1004 HydrophobicContact CD-CD1 4.47Å; K970-L1004 VanDerWaalsContact CE-CD1 3.5Å; K970-L1004 HydrophobicContact CG-CD1 4.13Å; F1001-L1004 HydrophobicContact CD2-CD2 4.5Å; F1001-L1004 WeakPolarHBondContact O-CA 3.33Å; F1001-L1004 WeakPolarHBondContact O-CB 3.12Å; F1001-L1004 PolarHBondContact O-N 2.9Å; R1002-L1004 VanDerWaalsContact C-N 3.33Å; L1004-P1028 HydrophobicContact CD2-CB 4.12Å; L1004-P1028 HydrophobicContact CD2-CG 4.14Å; L1004-P1028 HydrophobicContact CG-CG 4.47Å
1005	L	76.3	Confident	60.4	Low	10 Å²	10	88.8 Å²	88.8	5%	0.052	49%	0.489	C	S	.	.	H	α-helix	trans	-80.8	-43.4	179	-69.1	178.8	0	0	0	113.9	M992 L996 F1001 L1029 L1032	M992-L1005 HydrophobicContact CE-CD1 3.68Å; L996-L1005 HydrophobicContact CD2-CD1 3.94Å; F1001-L1005 HydrophobicContact CD1-CD1 3.89Å; F1001-L1005 HydrophobicContact CE1-CD1 3.35Å; F1001-L1005 HydrophobicContact CE1-CG 4.2Å; F1001-L1005 HydrophobicContact CE2-CD1 4.23Å; F1001-L1005 HydrophobicContact CE2-CG 4.27Å; F1001-L1005 HydrophobicContact CZ-CD1 3.55Å; F1001-L1005 HydrophobicContact CZ-CD2 4.39Å; F1001-L1005 HydrophobicContact CZ-CG 4.08Å; F1001-L1005 PolarHBondContact O-N 2.89Å; L1005-L1029 HydrophobicContact CD2-CD2 3.88Å; L1005-L1032 HydrophobicContact CD2-CD1 3.69Å
1006	L	70.8	Confident	57.9	Low	68 Å²	68	96.1 Å²	96.1	36%	0.356	53%	0.528	S	S	.	.	H	α-helix	trans	-102.2	-4.2	-171.5	-57.7	176.7	0	0	0	113.6	I818 R1002	I818-L1006 HydrophobicContact CD1-CD1 4.25Å; R1002-L1006 HydrophobicContact CG-CD1 4.06Å; R1002-L1006 WeakPolarHBondContact O-CB 3.41Å; R1002-L1006 PolarHBondContact O-N 2.73Å
1007	G	65	Low	55.1	Low	37 Å²	37	101.8 Å²	101.8	38%	0.381	57%	0.567	S	S	.	*			trans	74	178.7	-174.2	0	0	0	0	0	113.9	T1003	T1003-G1007 CarbonylContact O-C 3.54Å; T1003-G1007 VanDerWaalsContact O-CA 3.3Å; T1003-G1007 WeakPolarHBondContact O-CA 3.3Å; T1003-G1007 PolarHBondContact O-N 3.08Å
1008	T	47.7	Very low	52.7	Low	118 Å²	118	101 Å²	101	72%	0.724	57%	0.573	S	S	*	*			trans	-79.5	122.3	177.3	34.2	0	0	0	0	111.9	C1010	T1008-C1010 PolarHBondContact O-N 3.41Å
1009	N	37.4	Very low	49.9	Very low	148 Å²	148	102.1 Å²	102.1	79%	0.791	59%	0.59	S	S	*	*			trans	-63.1	102.4	166.9	-80.9	-43.9	0	0	0	110.4	T1011	N1009-T1011 PolarHBondContact O-N 2.99Å
1010	C	30.2	Very low	47.5	Very low	126 Å²	126	102.8 Å²	102.8	85%	0.851	59%	0.593	S	S	*	*			trans	-69.9	86	175.9	-81.3	0	0	0	0	112.5	T1008	T1008-C1010 PolarHBondContact O-N 3.41Å
1011	T	29	Very low	45.3	Very low	113 Å²	113	106.1 Å²	106.1	69%	0.693	62%	0.617	S	S	*	*			trans	-138.7	120.7	168.4	52.1	0	0	0	0	112.5	N1009	N1009-T1011 PolarHBondContact O-N 2.99Å
1012	R	31.5	Very low	42.7	Very low	248 Å²	248	113.4 Å²	113.4	94%	0.936	65%	0.651	S	S	*	*	S	Bend	trans	64.3	110.8	172.8	-53.9	173.4	174.1	-178.4	-2.6	113.8
1013	Q	28.5	Very low	40.2	Very low	195 Å²	195	114.6 Å²	114.6	91%	0.911	67%	0.671	S	S	*	*			cis	-131.4	167.5	25.1	-68.7	173.3	-29.9	0	0	112.1
1014	G	31.7	Very low	38	Very low	74 Å²	74	123.9 Å²	123.9	76%	0.763	70%	0.698	S	S	*	*			trans	-80.4	124.8	-177.6	0	0	0	0	0	113.5
1015	N	25.2	Very low	35.8	Very low	158 Å²	158	126.2 Å²	126.2	85%	0.845	72%	0.717	S	S	*	*			trans	-157.9	156.7	146.5	-105.6	-26.6	0	0	0	109.9	C1017	N1015-C1017 PolarHBondContact O-N 2.81Å
1016	N	30.7	Very low	34.5	Very low	155 Å²	155	131.1 Å²	131.1	83%	0.829	74%	0.744	S	S	*	*			trans	-80.4	119.9	-166.8	-61.2	-30	0	0	0	112.9
1017	C	24	Very low	34.4	Very low	125 Å²	125	129.5 Å²	129.5	85%	0.845	74%	0.738	S	S	*	*			trans	-131.3	85	164.4	-74.1	0	0	0	0	110.9	N1015	N1015-C1017 PolarHBondContact O-N 2.81Å
1018	T	29.2	Very low	35	Very low	142 Å²	142	129 Å²	129	87%	0.871	73%	0.728	S	S	*	*			trans	-97.4	93.4	169	49.3	0	0	0	0	110.4
1019	S	23.9	Very low	36.6	Very low	99 Å²	99	124 Å²	124	69%	0.692	70%	0.697	S	S	*	*			trans	-157.4	157.4	166.1	60.7	0	0	0	0	112.7
1020	L	25.3	Very low	38.7	Very low	143 Å²	143	121.5 Å²	121.5	75%	0.749	68%	0.68	S	S	*	*			trans	61.9	56.1	161.3	-66	160.8	0	0	0	117.6	H1022	L1020-H1022 VanDerWaalsContact C-N 3.28Å; L1020-H1022 PolarHBondContact O-N 3.02Å; L1020-H1022 VanDerWaalsContact O-N 3.1Å
1021	A	26	Very low	41.2	Very low	104 Å²	104	117.9 Å²	117.9	86%	0.86	65%	0.651	S	S	*	*			trans	-73.1	84.2	148.1	0	0	0	0	0	109.7
1022	H	26.3	Very low	43.8	Very low	154 Å²	154	112.7 Å²	112.7	71%	0.713	62%	0.619	S	S	*	*			trans	-132.5	161.6	173.5	-86.7	27.9	0	0	0	109.9	L1020	L1020-H1022 VanDerWaalsContact C-N 3.28Å; L1020-H1022 PolarHBondContact O-N 3.02Å; L1020-H1022 VanDerWaalsContact O-N 3.1Å
1023	S	27.3	Very low	46.4	Very low	97 Å²	97	102.9 Å²	102.9	68%	0.678	58%	0.584	S	S	*	*			trans	51.1	93.2	-173.3	47.4	0	0	0	0	114.8	S1025	S1023-S1025 VanDerWaalsContact C-N 3.26Å; S1023-S1025 PolarHBondContact O-N 3.46Å
1024	R	31.6	Very low	49.1	Very low	258 Å²	258	96.4 Å²	96.4	97%	0.974	56%	0.563	S	S	*	*	S	Bend	trans	-93.4	36.6	177.3	-161.6	-172.4	-171.8	177.5	2.5	111.3
1025	S	33.2	Very low	51.6	Low	79 Å²	79	94 Å²	94	55%	0.552	53%	0.533	S	S	*	.	S	Bend	trans	-129.6	-19.5	-154.9	37	0	0	0	0	115.6	S1023	S1023-S1025 VanDerWaalsContact C-N 3.26Å; S1023-S1025 PolarHBondContact O-N 3.46Å
1026	D	50.6	Low	54.4	Low	112 Å²	112	86.5 Å²	86.5	60%	0.599	49%	0.493	S	S	*	.			trans	-132.1	57.6	-162.7	-51.2	-94.2	0	0	0	111.4
1027	S	68.5	Low	57	Low	34 Å²	34	79.8 Å²	79.8	24%	0.238	46%	0.459	C	S	.	.			trans	-88	131.2	170.7	92.7	0	0	0	0	110.5	L1029 E1030	S1027-L1029 PolarHBondContact O-N 2.66Å; S1027-E1030 VanDerWaalsContact CB-OE2 3.26Å; S1027-E1030 WeakPolarHBondContact CB-OE2 3.22Å; S1027-E1030 PolarHBondContact O-N 3.31Å; S1027-E1030 VanDerWaalsContact O-N 3.09Å; S1027-E1030 WeakPolarHBondContact OG-CG 3.41Å; S1027-E1030 PolarHBondContact OG-OE2 3.05Å
1028	P	77.4	Confident	59.9	Low	27 Å²	27	80.8 Å²	80.8	18%	0.175	45%	0.451	C	S	.	.	H	α-helix	trans	-64	-18.8	-176.6	25.8	-34.9	0	0	0	112.8	L1004 L1032	L1004-P1028 HydrophobicContact CD2-CB 4.12Å; L1004-P1028 HydrophobicContact CD2-CG 4.14Å; L1004-P1028 HydrophobicContact CG-CG 4.47Å; P1028-L1032 WeakPolarHBondContact O-CB 3.33Å; P1028-L1032 VanDerWaalsContact O-CD1 3.31Å; P1028-L1032 WeakPolarHBondContact O-CD1 3.27Å; P1028-L1032 WeakPolarHBondContact O-CG 3.41Å; P1028-L1032 PolarHBondContact O-N 3.45Å
1029	L	81.1	Confident	62.4	Low	12 Å²	12	77.5 Å²	77.5	6%	0.063	42%	0.423	C	S	.	.	H	α-helix	trans	-69.7	-39.7	176.1	-69	168.7	0	0	0	112.1	F806 L809 L1005 S1027 E1031 L1032 E1033	F806-L1029 HydrophobicContact CD1-CB 4.44Å; F806-L1029 HydrophobicContact CD1-CD2 4.1Å; F806-L1029 HydrophobicContact CE1-CD2 4.35Å; L809-L1029 HydrophobicContact CD2-CD2 3.85Å; L1005-L1029 HydrophobicContact CD2-CD2 3.88Å; S1027-L1029 PolarHBondContact O-N 2.66Å; L1029-E1031 VanDerWaalsContact C-N 3.34Å; L1029-L1032 PolarHBondContact O-N 3.08Å; L1029-E1033 WeakPolarHBondContact O-CB 3.47Å; L1029-E1033 PolarHBondContact O-N 3.19Å
1030	E	81	Confident	65.1	Low	96 Å²	96	72.8 Å²	72.8	45%	0.449	39%	0.39	S	S	.	.	H	α-helix	trans	-72.3	-30.9	-178.2	-72.5	155.2	156.6	0	0	111.5	R810 S1027 A1034	R810-E1030 IonicContact NH2-OE1 2.65Å; S1027-E1030 VanDerWaalsContact CB-OE2 3.26Å; S1027-E1030 WeakPolarHBondContact CB-OE2 3.22Å; S1027-E1030 PolarHBondContact O-N 3.31Å; S1027-E1030 VanDerWaalsContact O-N 3.09Å; S1027-E1030 WeakPolarHBondContact OG-CG 3.41Å; S1027-E1030 PolarHBondContact OG-OE2 3.05Å; E1030-A1034 WeakPolarHBondContact O-CB 3.32Å; E1030-A1034 PolarHBondContact O-N 2.94Å
1031	E	82.5	Confident	67.8	Low	51 Å²	51	71.2 Å²	71.2	24%	0.238	37%	0.374	C	S	.	.	H	α-helix	trans	-72.5	-43.2	174.4	-57.7	-177.5	127.6	0	0	111.8	Y969 K973 L1029 E1033 A1034 I1035	Y969-E1031 PolarHBondContact OH-OE2 3.35Å; Y969-E1031 VanDerWaalsContact OH-OE2 3.05Å; K973-E1031 WeakPolarHBondContact CE-OE2 3.27Å; K973-E1031 IonicContact NZ-OE1 2.87Å; K973-E1031 PolarHBondContact NZ-OE1 2.87Å; K973-E1031 IonicContact NZ-OE2 2.84Å; K973-E1031 PolarHBondContact NZ-OE2 2.89Å; L1029-E1031 VanDerWaalsContact C-N 3.34Å; E1031-E1033 VanDerWaalsContact C-N 3.34Å; E1031-E1033 PolarHBondContact O-N 3.47Å; E1031-A1034 PolarHBondContact O-N 3.11Å; E1031-I1035 PolarHBondContact O-N 3.04Å
1032	L	84.6	Confident	70.3	Confident	3 Å²	3	68.6 Å²	68.6	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-62.1	-39.9	172.4	-71.1	167.3	0	0	0	111.9	F806 E985 F988 L989 L1005 P1028 L1029 L1036	F806-L1032 HydrophobicContact CE1-CB 4.19Å; F806-L1032 HydrophobicContact CZ-CB 4.23Å; E985-L1032 HydrophobicContact CB-CD2 4.05Å; E985-L1032 WeakPolarHBondContact O-CD2 3.44Å; F988-L1032 HydrophobicContact CB-CD2 3.99Å; F988-L1032 HydrophobicContact CD2-CD2 4.46Å; L989-L1032 HydrophobicContact CD1-CD2 4.47Å; L989-L1032 HydrophobicContact CD2-CB 4.28Å; L989-L1032 HydrophobicContact CD2-CD2 3.99Å; L989-L1032 HydrophobicContact CG-CD2 3.78Å; L1005-L1032 HydrophobicContact CD2-CD1 3.69Å; P1028-L1032 WeakPolarHBondContact O-CB 3.33Å; P1028-L1032 VanDerWaalsContact O-CD1 3.31Å; P1028-L1032 WeakPolarHBondContact O-CD1 3.27Å; P1028-L1032 WeakPolarHBondContact O-CG 3.41Å; P1028-L1032 PolarHBondContact O-N 3.45Å; L1029-L1032 PolarHBondContact O-N 3.08Å; L1032-L1036 WeakPolarHBondContact O-CB 3.48Å; L1032-L1036 PolarHBondContact O-N 2.98Å
1033	E	86.1	Confident	72.6	Confident	42 Å²	42	63 Å²	63	20%	0.196	33%	0.325	C	S	.	.	H	α-helix	trans	-62	-45.7	174	-173.3	177.3	151.5	0	0	111.3	L802 P803 F806 L1029 E1031 L1036 A1037	L802-E1033 HydrophobicContact CB-CG 4.39Å; P803-E1033 WeakPolarHBondContact CA-OE1 3.28Å; P803-E1033 WeakPolarHBondContact CG-OE1 3.32Å; F806-E1033 HydrophobicContact CD2-CB 3.74Å; F806-E1033 HydrophobicContact CD2-CG 3.65Å; F806-E1033 HydrophobicContact CE1-CB 4.48Å; F806-E1033 HydrophobicContact CE2-CB 3.7Å; F806-E1033 HydrophobicContact CE2-CG 3.91Å; F806-E1033 HydrophobicContact CG-CB 4.18Å; F806-E1033 HydrophobicContact CG-CG 4.33Å; F806-E1033 HydrophobicContact CZ-CB 4.09Å; L1029-E1033 WeakPolarHBondContact O-CB 3.47Å; L1029-E1033 PolarHBondContact O-N 3.19Å; E1031-E1033 VanDerWaalsContact C-N 3.34Å; E1031-E1033 PolarHBondContact O-N 3.47Å; E1033-L1036 PolarHBondContact O-N 3.35Å; E1033-A1037 WeakPolarHBondContact O-CB 3.33Å; E1033-A1037 PolarHBondContact O-N 3Å
1034	A	85.3	Confident	74.6	Confident	59 Å²	59	61.9 Å²	61.9	49%	0.488	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-43.1	178.7	0	0	0	0	0	113.2	E1030 E1031 A1037 Q1038	E1030-A1034 WeakPolarHBondContact O-CB 3.32Å; E1030-A1034 PolarHBondContact O-N 2.94Å; E1031-A1034 PolarHBondContact O-N 3.11Å; A1034-A1037 PolarHBondContact O-N 3.4Å; A1034-Q1038 WeakPolarHBondContact O-CB 3.47Å; A1034-Q1038 PolarHBondContact O-N 2.96Å
1035	I	83.7	Confident	76.3	Confident	24 Å²	24	54.9 Å²	54.9	12%	0.123	29%	0.287	C	S	.	.	H	α-helix	trans	-66.6	-43.2	177.1	-72.8	175.4	0	0	0	111	F829 E985 L989 E1031 A1037 Q1038 R1039	F829-I1035 HydrophobicContact CE2-CG2 4.07Å; E985-I1035 HydrophobicContact CB-CD1 3.66Å; E985-I1035 HydrophobicContact CG-CD1 4.46Å; E985-I1035 WeakPolarHBondContact OE2-CD1 3.35Å; L989-I1035 HydrophobicContact CD1-CB 4.25Å; L989-I1035 HydrophobicContact CD1-CG2 3.74Å; E1031-I1035 PolarHBondContact O-N 3.04Å; I1035-A1037 VanDerWaalsContact C-N 3.35Å; I1035-Q1038 PolarHBondContact O-N 3.04Å; I1035-R1039 WeakPolarHBondContact O-CB 3.2Å; I1035-R1039 PolarHBondContact O-N 3.09Å
1036	L	84.4	Confident	77.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.9	-38.9	177.6	-171.9	59	0	0	0	111.5	L802 F806 F825 C828 F829 L989 L1032 E1033 R1039 I1040	L802-L1036 HydrophobicContact CD1-CB 4.25Å; L802-L1036 HydrophobicContact CD1-CD2 4.38Å; L802-L1036 HydrophobicContact CD1-CG 4.05Å; L802-L1036 HydrophobicContact CD2-CD2 3.67Å; L802-L1036 HydrophobicContact CD2-CG 4.15Å; F806-L1036 HydrophobicContact CE2-CD2 4.34Å; F825-L1036 HydrophobicContact CB-CD2 4.17Å; F825-L1036 HydrophobicContact CD1-CD2 3.48Å; F825-L1036 VanDerWaalsContact CD1-CD2 3.48Å; F825-L1036 HydrophobicContact CE1-CD2 4.18Å; F825-L1036 HydrophobicContact CG-CD2 4.13Å; C828-L1036 HydrophobicContact CB-CD1 4.06Å; F829-L1036 HydrophobicContact CB-CD1 4.12Å; F829-L1036 HydrophobicContact CD2-CD1 4.37Å; L989-L1036 HydrophobicContact CD1-CB 4.04Å; L989-L1036 HydrophobicContact CD2-CB 4.43Å; L989-L1036 HydrophobicContact CD2-CD2 4.44Å; L1032-L1036 WeakPolarHBondContact O-CB 3.48Å; L1032-L1036 PolarHBondContact O-N 2.98Å; E1033-L1036 PolarHBondContact O-N 3.35Å; L1036-R1039 PolarHBondContact O-N 3.13Å; L1036-I1040 HydrophobicContact CD1-CD1 4.44Å; L1036-I1040 HydrophobicContact CD1-CG1 4.46Å; L1036-I1040 HydrophobicContact CG-CD1 4.27Å; L1036-I1040 WeakPolarHBondContact O-CG1 3.44Å; L1036-I1040 PolarHBondContact O-N 3.35Å
1037	A	84.8	Confident	77.9	Confident	14 Å²	14	52.6 Å²	52.6	12%	0.116	28%	0.279	C	S	.	.	H	α-helix	trans	-60.9	-43.4	172.8	0	0	0	0	0	112.5	V798 L802 E1033 A1034 I1035 R1041	V798-A1037 HydrophobicContact CG1-CB 3.62Å; L802-A1037 HydrophobicContact CD1-CB 4Å; E1033-A1037 WeakPolarHBondContact O-CB 3.33Å; E1033-A1037 PolarHBondContact O-N 3Å; A1034-A1037 PolarHBondContact O-N 3.4Å; I1035-A1037 VanDerWaalsContact C-N 3.35Å; A1037-R1041 WeakPolarHBondContact O-CB 3.24Å; A1037-R1041 WeakPolarHBondContact O-CG 3.07Å; A1037-R1041 PolarHBondContact O-N 3.37Å
1038	Q	84.4	Confident	77.2	Confident	146 Å²	146	57.4 Å²	57.4	68%	0.682	30%	0.298	S	S	*	.	H	α-helix	trans	-63.8	-40.4	174.2	-175.2	177.5	-3.1	0	0	111.6	A1034 I1035 R1041 S1042	A1034-Q1038 WeakPolarHBondContact O-CB 3.47Å; A1034-Q1038 PolarHBondContact O-N 2.96Å; I1035-Q1038 PolarHBondContact O-N 3.04Å; Q1038-R1041 PolarHBondContact O-N 2.94Å; Q1038-S1042 PolarHBondContact O-N 2.86Å
1039	R	82.3	Confident	75.6	Confident	73 Å²	73	64.6 Å²	64.6	28%	0.275	34%	0.341	S	S	.	.	H	α-helix	trans	-64.4	-49.1	178	-177.7	59.6	-177.4	137.8	0.7	112	F829 I1035 L1036 R1041 S1042 L1043	F829-R1039 HydrophobicContact CD2-CB 4.26Å; F829-R1039 HydrophobicContact CD2-CG 4Å; F829-R1039 HydrophobicContact CE2-CB 4.45Å; F829-R1039 HydrophobicContact CE2-CG 4.33Å; F829-R1039 PolarHBondContact O-NE 3.43Å; I1035-R1039 WeakPolarHBondContact O-CB 3.2Å; I1035-R1039 PolarHBondContact O-N 3.09Å; L1036-R1039 PolarHBondContact O-N 3.13Å; R1039-R1041 VanDerWaalsContact C-N 3.33Å; R1039-R1041 PolarHBondContact O-N 3.04Å; R1039-S1042 PolarHBondContact NH1-OG 2.89Å; R1039-S1042 WeakPolarHBondContact O-CB 3.45Å; R1039-S1042 PolarHBondContact O-N 3.26Å; R1039-S1042 VanDerWaalsContact O-N 3.09Å; R1039-S1042 PolarHBondContact O-OG 3.24Å; R1039-L1043 PolarHBondContact O-N 3.01Å; R1039-L1043 VanDerWaalsContact O-N 3.12Å
1040	I	81.6	Confident	75.3	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-64.4	-38	178.6	-63.6	177.5	0	0	0	111	Y793 L797 V798 L802 C828 L1036 S1042 L1043 Y1044	Y793-I1040 HydrophobicContact CD2-CG2 4.39Å; L797-I1040 HydrophobicContact CD2-CD1 4.33Å; V798-I1040 HydrophobicContact CG2-CB 3.93Å; V798-I1040 HydrophobicContact CG2-CG2 3.55Å; L802-I1040 HydrophobicContact CD1-CD1 4.11Å; L802-I1040 HydrophobicContact CD2-CD1 4.19Å; L802-I1040 HydrophobicContact CG-CD1 4.42Å; C828-I1040 HydrophobicContact CB-CD1 4.03Å; C828-I1040 HydrophobicContact CB-CG1 4.44Å; L1036-I1040 HydrophobicContact CD1-CD1 4.44Å; L1036-I1040 HydrophobicContact CD1-CG1 4.46Å; L1036-I1040 HydrophobicContact CG-CD1 4.27Å; L1036-I1040 WeakPolarHBondContact O-CG1 3.44Å; L1036-I1040 PolarHBondContact O-N 3.35Å; I1040-S1042 VanDerWaalsContact C-N 3.33Å; I1040-S1042 PolarHBondContact O-N 3.14Å; I1040-L1043 PolarHBondContact O-N 3.29Å; I1040-Y1044 WeakPolarHBondContact O-CB 3.4Å; I1040-Y1044 PolarHBondContact O-N 3.38Å
1041	R	81.1	Confident	75	Confident	109 Å²	109	65.7 Å²	65.7	41%	0.411	35%	0.35	S	S	.	.	H	α-helix	trans	-61	-38.1	171.4	-77.6	177.9	171.5	151.9	1.7	113.1	D795 V798 A1037 Q1038 R1039 L1043 I1045	D795-R1041 IonicContact OD1-CZ 2.7Å; D795-R1041 IonicContact OD1-NE 3.75Å; D795-R1041 PolarHBondContact OD1-NE 3.4Å; D795-R1041 VanDerWaalsContact OD1-NE 3.15Å; D795-R1041 IonicContact OD1-NH2 2.71Å; D795-R1041 PolarHBondContact OD1-NH2 3.41Å; V798-R1041 HydrophobicContact CG1-CG 4.18Å; V798-R1041 HydrophobicContact CG2-CG 4.24Å; A1037-R1041 WeakPolarHBondContact O-CB 3.24Å; A1037-R1041 WeakPolarHBondContact O-CG 3.07Å; A1037-R1041 PolarHBondContact O-N 3.37Å; Q1038-R1041 PolarHBondContact O-N 2.94Å; R1039-R1041 VanDerWaalsContact C-N 3.33Å; R1039-R1041 PolarHBondContact O-N 3.04Å; R1041-L1043 VanDerWaalsContact C-N 3.32Å; R1041-L1043 PolarHBondContact O-N 2.87Å; R1041-I1045 WeakPolarHBondContact O-CD1 3.45Å; R1041-I1045 VanDerWaalsContact O-CG1 3.28Å; R1041-I1045 WeakPolarHBondContact O-CG1 3.29Å; R1041-I1045 PolarHBondContact O-N 2.91Å
1042	S	79.5	Confident	74.6	Confident	50 Å²	50	66.5 Å²	66.5	35%	0.35	36%	0.356	S	S	.	.	H	α-helix	trans	-63.5	-38.2	174.9	76.6	0	0	0	0	112.4	Q1038 R1039 I1040 S1046	Q1038-S1042 PolarHBondContact O-N 2.86Å; R1039-S1042 PolarHBondContact NH1-OG 2.89Å; R1039-S1042 WeakPolarHBondContact O-CB 3.45Å; R1039-S1042 PolarHBondContact O-N 3.26Å; R1039-S1042 VanDerWaalsContact O-N 3.09Å; R1039-S1042 PolarHBondContact O-OG 3.24Å; I1040-S1042 VanDerWaalsContact C-N 3.33Å; I1040-S1042 PolarHBondContact O-N 3.14Å; S1042-S1046 PolarHBondContact O-N 3.34Å; S1042-S1046 PolarHBondContact O-OG 3.38Å
1043	L	74	Confident	74	Confident	36 Å²	36	70.2 Å²	70.2	19%	0.188	38%	0.376	C	S	.	.	H	α-helix	trans	-68.4	-47.9	177.2	-67.2	170	0	0	0	111.5	R1039 I1040 R1041 I1045 S1046 S1047	R1039-L1043 PolarHBondContact O-N 3.01Å; R1039-L1043 VanDerWaalsContact O-N 3.12Å; I1040-L1043 PolarHBondContact O-N 3.29Å; R1041-L1043 VanDerWaalsContact C-N 3.32Å; R1041-L1043 PolarHBondContact O-N 2.87Å; L1043-I1045 VanDerWaalsContact C-N 3.34Å; L1043-I1045 PolarHBondContact O-N 3.21Å; L1043-S1046 WeakPolarHBondContact CA-OG 3.32Å; L1043-S1046 CarbonylContact O-C 3.6Å; L1043-S1046 WeakPolarHBondContact O-CA 3.09Å; L1043-S1046 PolarHBondContact O-N 2.99Å; L1043-S1046 PolarHBondContact O-OG 2.96Å; L1043-S1047 PolarHBondContact O-N 3.2Å
1044	Y	69.8	Low	73.2	Confident	73 Å²	73	72 Å²	72	29%	0.286	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-38.2	177.5	178.1	-108	0	0	0	113.4	Y793 C794 I1040 S1046 S1047 Q1048	Y793-Y1044 WeakPolarHBondContact O-CD2 3.38Å; C794-Y1044 HydrophobicContact CB-CE2 4.47Å; I1040-Y1044 WeakPolarHBondContact O-CB 3.4Å; I1040-Y1044 PolarHBondContact O-N 3.38Å; Y1044-S1046 VanDerWaalsContact C-N 3.33Å; Y1044-S1047 PolarHBondContact O-N 3.32Å; Y1044-S1047 PolarHBondContact O-OG 3.41Å; Y1044-Q1048 VanDerWaalsContact CZ-NE2 3.27Å; Y1044-Q1048 PolarHBondContact OH-NE2 3.21Å
1045	I	65.9	Low	72.4	Confident	112 Å²	112	72.9 Å²	72.9	57%	0.574	38%	0.381	S	S	*	.	H	α-helix	trans	-68	-36.4	174.1	-68.4	166.1	0	0	0	110.6	R1041 L1043 S1047 V1049	R1041-I1045 WeakPolarHBondContact O-CD1 3.45Å; R1041-I1045 VanDerWaalsContact O-CG1 3.28Å; R1041-I1045 WeakPolarHBondContact O-CG1 3.29Å; R1041-I1045 PolarHBondContact O-N 2.91Å; L1043-I1045 VanDerWaalsContact C-N 3.34Å; L1043-I1045 PolarHBondContact O-N 3.21Å; I1045-S1047 VanDerWaalsContact C-N 3.33Å; I1045-S1047 PolarHBondContact O-N 2.54Å; I1045-V1049 WeakPolarHBondContact O-CG2 3.29Å
1046	S	60.5	Low	71.6	Confident	78 Å²	78	76.4 Å²	76.4	55%	0.545	40%	0.399	S	S	.	.	H	α-helix	trans	-77.3	-9.4	177.4	61.5	0	0	0	0	115.5	S1042 L1043 Y1044	S1042-S1046 PolarHBondContact O-N 3.34Å; S1042-S1046 PolarHBondContact O-OG 3.38Å; L1043-S1046 WeakPolarHBondContact CA-OG 3.32Å; L1043-S1046 CarbonylContact O-C 3.6Å; L1043-S1046 WeakPolarHBondContact O-CA 3.09Å; L1043-S1046 PolarHBondContact O-N 2.99Å; L1043-S1046 PolarHBondContact O-OG 2.96Å; Y1044-S1046 VanDerWaalsContact C-N 3.33Å
1047	S	57.4	Low	70.6	Confident	64 Å²	64	82.2 Å²	82.2	45%	0.448	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-0.3	174.5	61.6	0	0	0	0	114.1	L1043 Y1044 I1045	L1043-S1047 PolarHBondContact O-N 3.2Å; Y1044-S1047 PolarHBondContact O-N 3.32Å; Y1044-S1047 PolarHBondContact O-OG 3.41Å; I1045-S1047 VanDerWaalsContact C-N 3.33Å; I1045-S1047 PolarHBondContact O-N 2.54Å
1048	Q	53.7	Low	69.5	Low	135 Å²	135	87.9 Å²	87.9	63%	0.631	46%	0.456	S	S	*	.			trans	-111.3	12.8	174	-64.6	-164.7	-13.5	0	0	113.6	Y1044	Y1044-Q1048 VanDerWaalsContact CZ-NE2 3.27Å; Y1044-Q1048 PolarHBondContact OH-NE2 3.21Å
1049	V	43.3	Very low	68.1	Low	178 Å²	178	82.6 Å²	82.6	100%	1.079	44%	0.436	S	S	*	.			trans	-125.4	0	-177.8	176.5	0	0	0	0	110.3	I1045	I1045-V1049 WeakPolarHBondContact O-CG2 3.29Å

Retrieved 1,049 of 1,049 residues in 1354.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).