A0A3Q0KRG8_SCHMA Loading...

Vacuolar protein sorting-associated protein 54

AlphaFold DB , UniProt , Accession A0A3Q0KRG8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,192 aa.

						>A0A3Q0KRG8_SCHMA|A0A3Q0KRG8
MDHVWFCEYCSLAEGNESRKLFPTQRDFVSHIRAHHLVRKFRNDVETFICRYGPNNSCLLSNGLDSVEKSYSSHDSLFTSQRDYERHLVGFHLLKHPVYKHPDVKSPLPIPPVSSHYNEKPSRKWSVYQSVVNLPAVLNDPNYREKDIFTKLWGDKFENAEVLPSPHLPVITEKHFIEYLNKIGVRKLDTESCRSSPNCQINSSNSVTDISLSVKSSNKVLKNEPSLDISTNSIPALYFDQNFNLKDEKTFCQVIPLHTRRSRFQNVRNLFEKIVSPSSKTDSVNISNQLNYPSEGFLQKEAFHNQHNQLVNYLDIIELNIVEQVSRKSSTFFEAIQCHDVIREELSQAIRQIKDFRCKLHQINTFTIIDKMKLLRVVRRRENYKLVVNKLKLIASLQATQPTIQTLLRNNDFCAALDLVSTTKELLHSHLMANSSSSDLSSDNVMDQPDSRNLTSRLKKNSTTFLCLRDFDAQLSGISNFVHKMVESEFDISLCRFLDPPIEEYGGFSDPDILSCFLGLIRINRLDFVSGFHAEMLKRVKEIFCQHITSVTQPPGNDSVTDSSTIIGPNATKLSTSDQLRNMPCENWMTFLVNLCNDIKYLLIRGQDVVDIFENNLCSNHQLNETVENGIVISSTQQPLTTISVHKAKELAKCMHKTLWNTANVSQKRLCSIVSSRFRLGSIQSMEPTVDLSVNSPNLQQRHLSATSIMDISCITMFSDYVFDKFTWSNFRELVKIMSIFQVYVLRAWLKFSDIPIQTIICHQSNDSENCSQSNLHSFNKSKSCVKKSTIPLNKKTPNDVIPSSIISSNTNDCISNNQCISNIQSDLLLRNLALDMIILIIDRFHRENYDKLNMLLDQERWQAAICPEQVQQMINDISIEVGHCKMKSPQLTNEHSPCTPNHNKLIQSTDSVVFAPNYIFLNNEEYTVVRTVILLLPMINDYVKLDEKLPGQPLTTEFVSDRLADLLNHFNSRVCQLVLGAEACKRVDLQRISAKNLALTLRSLQLVVQFLPCIQFLLNRISKTEFNKVSSTNVDNFLIASLYHPNSQGINRITLNGLHHIEKLFNEHIESILQKLVQLLSDPIGPMFSNWYGRPPIPSRQMDEICRNLSKLIGMTKHVLPPKTLTSILLRVHNELKVQLRHRISELGIIADGGPQQSLIDSEILYYIDHFKTLTPQLQKFVDDCSDIWPS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	60.9	Low	220 Å²	220	97.8 Å²	97.8	100%	1.084	50%	0.497	S	S	*	.				0	111.6	0	-80.6	-171.4	175.4	0	0	107.3	H3	M1-H3 PolarHBondContact O-N 3.41Å; M1-H3 VanDerWaalsContact O-N 3.13Å
2	D	46.2	Very low	59.6	Low	144 Å²	144	100.6 Å²	100.6	77%	0.77	51%	0.512	S	S	*	.			trans	-79.8	96.6	-179.3	-51.1	-71.3	0	0	0	108.2	V4	D2-V4 VanDerWaalsContact C-N 3.33Å; D2-V4 PolarHBondContact O-N 3.37Å
3	H	53.8	Low	58.2	Low	147 Å²	147	99.6 Å²	99.6	68%	0.681	53%	0.529	S	S	*	.			trans	-67.9	96	172.5	-93.5	-63.8	0	0	0	108.5	M1 W5	M1-H3 PolarHBondContact O-N 3.41Å; M1-H3 VanDerWaalsContact O-N 3.13Å; H3-W5 PolarHBondContact O-N 3.21Å; H3-W5 PolarHBondContact O-NE1 3.23Å; H3-W5 VanDerWaalsContact O-NE1 3.15Å
4	V	63	Low	56.9	Low	72 Å²	72	106.9 Å²	106.9	44%	0.436	56%	0.559	S	S	.	*			trans	-73.4	111.2	174	-171.1	0	0	0	0	108.6	D2 L21 F22	D2-V4 VanDerWaalsContact C-N 3.33Å; D2-V4 PolarHBondContact O-N 3.37Å; V4-L21 HydrophobicContact CG1-CB 3.59Å; V4-L21 HydrophobicContact CG1-CD2 3.59Å; V4-L21 HydrophobicContact CG1-CG 4.08Å; V4-F22 WeakPolarHBondContact CA-O 3.39Å
5	W	66	Low	55.6	Low	68 Å²	68	103.9 Å²	103.9	26%	0.258	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.4	154.2	177.3	-53.2	75.2	0	0	0	109.5	H3 F22 Q25 F28 L93	H3-W5 PolarHBondContact O-N 3.21Å; H3-W5 PolarHBondContact O-NE1 3.23Å; H3-W5 VanDerWaalsContact O-NE1 3.15Å; W5-F22 HydrophobicContact CB-CB 4.26Å; W5-F22 PolarHBondContact N-O 3.36Å; W5-F22 PolarHBondContact O-N 3.11Å; W5-Q25 HydrophobicContact CH2-CG 4.33Å; W5-Q25 HydrophobicContact CZ2-CB 4.04Å; W5-Q25 HydrophobicContact CZ2-CG 3.79Å; W5-F28 HydrophobicContact CB-CB 3.69Å; W5-F28 HydrophobicContact CB-CD1 3.71Å; W5-F28 HydrophobicContact CB-CD2 3.93Å; W5-F28 HydrophobicContact CB-CE1 4.26Å; W5-F28 HydrophobicContact CB-CE2 4.46Å; W5-F28 HydrophobicContact CB-CG 3.51Å; W5-F28 AromaticContact CD2-CD1 3.78Å; W5-F28 HydrophobicContact CD2-CD1 3.78Å; W5-F28 HydrophobicContact CD2-CE1 4.3Å; W5-F28 HydrophobicContact CD2-CG 4.4Å; W5-F28 AromaticContact CE3-CD1 3.48Å; W5-F28 HydrophobicContact CE3-CD1 3.48Å; W5-F28 VanDerWaalsContact CE3-CD1 3.48Å; W5-F28 AromaticContact CE3-CE1 3.58Å; W5-F28 HydrophobicContact CE3-CE1 3.58Å; W5-F28 HydrophobicContact CE3-CG 4.47Å; W5-F28 HydrophobicContact CG-CB 3.99Å; W5-F28 AromaticContact CG-CD1 3.89Å; W5-F28 HydrophobicContact CG-CD1 3.89Å; W5-F28 HydrophobicContact CG-CG 4.03Å; W5-F28 HydrophobicContact CZ3-CD1 4.38Å; W5-F28 HydrophobicContact CZ3-CE1 4.35Å; W5-L93 HydrophobicContact CE3-CD2 4.17Å; W5-L93 HydrophobicContact CH2-CB 4.44Å; W5-L93 HydrophobicContact CH2-CD2 4.39Å; W5-L93 HydrophobicContact CZ3-CB 4.37Å; W5-L93 HydrophobicContact CZ3-CD2 3.77Å
6	F	72.2	Confident	54.5	Low	92 Å²	92	108.3 Å²	108.3	40%	0.404	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-143.9	153.9	172.1	61.3	-89.4	0	0	0	109.7	E8 L21 F28	F6-E8 HydrophobicContact CE2-CG 4.1Å; F6-L21 HydrophobicContact CB-CD2 4.24Å; F6-F28 VanDerWaalsContact O-CE2 3.27Å; F6-F28 WeakPolarHBondContact O-CE2 3.49Å; F6-F28 WeakPolarHBondContact O-CZ 3.43Å
7	C	72.7	Confident	53.7	Low	11 Å²	11	112.2 Å²	112.2	7%	0.074	60%	0.6	C	S	.	*			trans	-90.4	124.7	175.3	-175	0	0	0	0	110.3	Y9 C10 F28 H31 H36	C7-Y9 VanDerWaalsContact C-N 3.33Å; C7-Y9 PolarHBondContact SG-N 2.94Å; C7-C10 HydrophobicContact CB-CB 4.06Å; C7-C10 PolarHBondContact SG-N 2.78Å; C7-F28 HydrophobicContact CB-CE2 4.22Å; C7-H31 WeakPolarHBondContact CB-NE2 3.27Å; C7-H36 PolarHBondContact SG-NE2 3.12Å
8	E	68.4	Low	53.5	Low	100 Å²	100	111.9 Å²	111.9	47%	0.467	61%	0.608	S	S	.	*	S	Bend	trans	-71.5	-31.2	175.6	-54.4	-178.9	129.7	0	0	111.8	F6	F6-E8 HydrophobicContact CE2-CG 4.1Å
9	Y	67.3	Low	53.5	Low	82 Å²	82	115.6 Å²	115.6	32%	0.322	61%	0.612	S	S	.	*	S	Bend	trans	-97.4	-13.1	-168.7	-52.2	-76.4	0	0	0	113.6	C7 S11 Y52 G53	C7-Y9 VanDerWaalsContact C-N 3.33Å; C7-Y9 PolarHBondContact SG-N 2.94Å; Y9-S11 PolarHBondContact O-N 3.04Å; Y9-Y52 HydrophobicContact CD2-CD1 4.17Å; Y9-Y52 HydrophobicContact CD2-CD2 4.17Å; Y9-Y52 AromaticContact CD2-CE1 3.85Å; Y9-Y52 HydrophobicContact CD2-CE1 3.85Å; Y9-Y52 AromaticContact CD2-CE2 3.85Å; Y9-Y52 HydrophobicContact CD2-CE2 3.85Å; Y9-Y52 HydrophobicContact CD2-CG 4.33Å; Y9-Y52 AromaticContact CD2-CZ 3.66Å; Y9-Y52 HydrophobicContact CE2-CD1 4.1Å; Y9-Y52 AromaticContact CE2-CE1 3.61Å; Y9-Y52 HydrophobicContact CE2-CE1 3.61Å; Y9-Y52 HydrophobicContact CE2-CE2 4.43Å; Y9-Y52 AromaticContact CE2-CZ 3.79Å; Y9-G53 VanDerWaalsContact CD1-C 3.43Å; Y9-G53 WeakPolarHBondContact CD1-O 3.47Å; Y9-G53 VanDerWaalsContact CE1-C 3.44Å
10	C	66	Low	53.9	Low	46 Å²	46	117 Å²	117	31%	0.311	61%	0.613	S	S	.	*			trans	-92.7	64.8	168.4	-81.3	0	0	0	0	111.5	C7 H31 H36	C7-C10 HydrophobicContact CB-CB 4.06Å; C7-C10 PolarHBondContact SG-N 2.78Å; C10-H31 VanDerWaalsContact SG-CE1 3.54Å; C10-H36 PolarHBondContact SG-NE2 3.48Å
11	S	55.2	Low	54.7	Low	94 Å²	94	116.9 Å²	116.9	66%	0.657	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-77.7	127.9	159.4	-65.7	0	0	0	0	108.9	Y9	Y9-S11 PolarHBondContact O-N 3.04Å
12	L	45.4	Very low	56.5	Low	131 Å²	131	107.6 Å²	107.6	69%	0.686	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-63.6	137.3	170.9	-76.2	163.1	0	0	0	109.1
13	A	41.3	Very low	57.7	Low	88 Å²	88	104.8 Å²	104.8	73%	0.727	56%	0.555	S	S	*	*	S	Bend	trans	-70.8	139.9	166.4	0	0	0	0	0	109.1
14	E	39.3	Very low	58.6	Low	202 Å²	202	100.9 Å²	100.9	94%	0.944	54%	0.542	S	S	*	.	S	Bend	trans	57.3	75.2	164.3	-59.6	177.2	-175.7	0	0	116.5
15	G	37.6	Very low	59	Low	61 Å²	61	101.8 Å²	101.8	63%	0.629	54%	0.541	S	S	*	.	S	Bend	trans	147.2	153.5	162.1	0	0	0	0	0	115.7	E17	G15-E17 PolarHBondContact O-N 2.64Å
16	N	37.5	Very low	59.3	Low	174 Å²	174	108.6 Å²	108.6	93%	0.93	57%	0.567	S	S	*	*			trans	-87.4	86	178.3	-79.1	-30.6	0	0	0	111.9
17	E	42.4	Very low	59.6	Low	176 Å²	176	107.2 Å²	107.2	82%	0.822	56%	0.564	S	S	*	*			trans	-129.9	164.4	158.7	-73.1	-158	152.8	0	0	111.6	G15	G15-E17 PolarHBondContact O-N 2.64Å
18	S	48.5	Very low	59.8	Low	107 Å²	107	107.1 Å²	107.1	75%	0.748	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-70.9	140.8	-164	51.6	0	0	0	0	114	K20	S18-K20 PolarHBondContact O-N 2.86Å
19	R	54.2	Low	60.2	Low	182 Å²	182	103.3 Å²	103.3	69%	0.687	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-55.5	133.9	173.3	-68.4	179.9	177.7	170.8	-1.2	109.9	L21	R19-L21 PolarHBondContact O-N 2.86Å; R19-L21 VanDerWaalsContact O-N 3.14Å
20	K	62	Low	60.7	Low	143 Å²	143	103 Å²	103	62%	0.622	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-64.5	116.3	175.1	-73.6	-172.9	176.4	-180	0	110.4	S18 F22	S18-K20 PolarHBondContact O-N 2.86Å; K20-F22 HydrophobicContact CB-CE1 4.46Å; K20-F22 HydrophobicContact CB-CE2 4.09Å; K20-F22 HydrophobicContact CB-CZ 3.74Å; K20-F22 WeakPolarHBondContact O-CE2 3.35Å
21	L	70.9	Confident	61.5	Low	114 Å²	114	101.4 Å²	101.4	60%	0.597	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.8	178.4	-73.3	167	0	0	0	108.9	V4 F6 R19	V4-L21 HydrophobicContact CG1-CB 3.59Å; V4-L21 HydrophobicContact CG1-CD2 3.59Å; V4-L21 HydrophobicContact CG1-CG 4.08Å; F6-L21 HydrophobicContact CB-CD2 4.24Å; R19-L21 PolarHBondContact O-N 2.86Å; R19-L21 VanDerWaalsContact O-N 3.14Å
22	F	76.8	Confident	62.5	Low	25 Å²	25	97 Å²	97	11%	0.11	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	110.5	-174.3	-60.5	-74.2	0	0	0	109.4	V4 W5 K20 T24 D27 F28 H31	V4-F22 WeakPolarHBondContact CA-O 3.39Å; W5-F22 HydrophobicContact CB-CB 4.26Å; W5-F22 PolarHBondContact N-O 3.36Å; W5-F22 PolarHBondContact O-N 3.11Å; K20-F22 HydrophobicContact CB-CE1 4.46Å; K20-F22 HydrophobicContact CB-CE2 4.09Å; K20-F22 HydrophobicContact CB-CZ 3.74Å; K20-F22 WeakPolarHBondContact O-CE2 3.35Å; F22-T24 VanDerWaalsContact C-N 3.3Å; F22-T24 PolarHBondContact O-N 2.86Å; F22-D27 HydrophobicContact CB-CB 4.13Å; F22-D27 HydrophobicContact CD1-CB 4.01Å; F22-F28 HydrophobicContact CB-CB 3.96Å; F22-F28 HydrophobicContact CD2-CB 4.45Å; F22-F28 AromaticContact CD2-CD2 3.72Å; F22-F28 HydrophobicContact CD2-CD2 3.72Å; F22-F28 HydrophobicContact CE2-CD2 4.24Å; F22-F28 HydrophobicContact CG-CB 4.25Å; F22-F28 HydrophobicContact CG-CD2 4.35Å; F22-H31 HydrophobicContact CD1-CB 4.26Å; F22-H31 HydrophobicContact CE1-CB 3.56Å; F22-H31 AromaticContact CE1-CG 3.84Å; F22-H31 HydrophobicContact CE2-CB 4.1Å; F22-H31 AromaticContact CE2-CD2 3.61Å; F22-H31 AromaticContact CE2-CG 3.73Å; F22-H31 HydrophobicContact CZ-CB 3.48Å; F22-H31 VanDerWaalsContact CZ-CB 3.48Å; F22-H31 AromaticContact CZ-CD2 3.58Å; F22-H31 AromaticContact CZ-CG 3.2Å; F22-H31 AromaticContact CZ-ND1 3.5Å
23	P	70.9	Confident	64	Low	85 Å²	85	94.8 Å²	94.8	55%	0.552	50%	0.495	S	S	*	.	S	Bend	trans	-71.1	-25	-172.5	28.4	-34.5	0	0	0	112.8
24	T	72.2	Confident	65.7	Low	65 Å²	65	94 Å²	94	40%	0.399	49%	0.488	S	S	.	.	S	Bend	trans	-120.2	154.5	173.3	84.4	0	0	0	0	112.8	F22 R26 D27 F28	F22-T24 VanDerWaalsContact C-N 3.3Å; F22-T24 PolarHBondContact O-N 2.86Å; T24-R26 PolarHBondContact O-N 3.08Å; T24-R26 PolarHBondContact OG1-N 3.43Å; T24-D27 VanDerWaalsContact CB-OD2 3.27Å; T24-D27 WeakPolarHBondContact CB-OD2 3.45Å; T24-D27 WeakPolarHBondContact CG2-OD2 3.4Å; T24-D27 PolarHBondContact N-OD2 3.31Å; T24-D27 PolarHBondContact O-N 3.43Å; T24-D27 VanDerWaalsContact O-N 3.15Å; T24-D27 PolarHBondContact OG1-N 3.04Å; T24-D27 PolarHBondContact OG1-OD2 3.15Å; T24-F28 PolarHBondContact O-N 2.95Å
25	Q	71.2	Confident	67.4	Low	91 Å²	91	89.7 Å²	89.7	43%	0.425	47%	0.468	S	S	.	.	H	α-helix	trans	-58.7	-27.6	171.8	-168.8	-175.5	20.3	0	0	112.3	W5 V29 L93	W5-Q25 HydrophobicContact CH2-CG 4.33Å; W5-Q25 HydrophobicContact CZ2-CB 4.04Å; W5-Q25 HydrophobicContact CZ2-CG 3.79Å; Q25-V29 WeakPolarHBondContact O-CB 3.37Å; Q25-V29 VanDerWaalsContact O-CG2 3.3Å; Q25-V29 WeakPolarHBondContact O-CG2 3.48Å; Q25-V29 PolarHBondContact O-N 3.13Å; Q25-L93 HydrophobicContact CG-CD1 4.14Å
26	R	73.5	Confident	69.4	Low	212 Å²	212	87 Å²	87	80%	0.8	44%	0.439	S	S	*	.	H	α-helix	trans	-68.9	-42.5	176.3	-71.3	-177.7	174.4	175.8	-1.3	111.4	T24 F28 V29 S30	T24-R26 PolarHBondContact O-N 3.08Å; T24-R26 PolarHBondContact OG1-N 3.43Å; R26-F28 VanDerWaalsContact C-N 3.33Å; R26-F28 PolarHBondContact O-N 3.25Å; R26-V29 PolarHBondContact O-N 3.23Å; R26-S30 WeakPolarHBondContact O-CB 3.4Å; R26-S30 PolarHBondContact O-N 3.34Å
27	D	77.5	Confident	71.4	Confident	63 Å²	63	79.8 Å²	79.8	34%	0.337	40%	0.4	S	S	.	.	H	α-helix	trans	-65.6	-40.3	179.2	-48	-48.6	0	0	0	110.6	F22 T24 S30 H31	F22-D27 HydrophobicContact CB-CB 4.13Å; F22-D27 HydrophobicContact CD1-CB 4.01Å; T24-D27 VanDerWaalsContact CB-OD2 3.27Å; T24-D27 WeakPolarHBondContact CB-OD2 3.45Å; T24-D27 WeakPolarHBondContact CG2-OD2 3.4Å; T24-D27 PolarHBondContact N-OD2 3.31Å; T24-D27 PolarHBondContact O-N 3.43Å; T24-D27 VanDerWaalsContact O-N 3.15Å; T24-D27 PolarHBondContact OG1-N 3.04Å; T24-D27 PolarHBondContact OG1-OD2 3.15Å; D27-S30 WeakPolarHBondContact O-CB 3.34Å; D27-S30 PolarHBondContact O-N 3.28Å; D27-H31 WeakPolarHBondContact O-CB 3.36Å; D27-H31 PolarHBondContact O-N 3.17Å
28	F	77.6	Confident	73.2	Confident	8 Å²	8	73.3 Å²	73.3	4%	0.035	37%	0.373	C	S	.	.	H	α-helix	trans	-64.6	-46.1	175.4	-174.2	-131.9	0	0	0	112.6	W5 F6 C7 F22 T24 R26 S30 H31 I32 L93	W5-F28 HydrophobicContact CB-CB 3.69Å; W5-F28 HydrophobicContact CB-CD1 3.71Å; W5-F28 HydrophobicContact CB-CD2 3.93Å; W5-F28 HydrophobicContact CB-CE1 4.26Å; W5-F28 HydrophobicContact CB-CE2 4.46Å; W5-F28 HydrophobicContact CB-CG 3.51Å; W5-F28 AromaticContact CD2-CD1 3.78Å; W5-F28 HydrophobicContact CD2-CD1 3.78Å; W5-F28 HydrophobicContact CD2-CE1 4.3Å; W5-F28 HydrophobicContact CD2-CG 4.4Å; W5-F28 AromaticContact CE3-CD1 3.48Å; W5-F28 HydrophobicContact CE3-CD1 3.48Å; W5-F28 VanDerWaalsContact CE3-CD1 3.48Å; W5-F28 AromaticContact CE3-CE1 3.58Å; W5-F28 HydrophobicContact CE3-CE1 3.58Å; W5-F28 HydrophobicContact CE3-CG 4.47Å; W5-F28 HydrophobicContact CG-CB 3.99Å; W5-F28 AromaticContact CG-CD1 3.89Å; W5-F28 HydrophobicContact CG-CD1 3.89Å; W5-F28 HydrophobicContact CG-CG 4.03Å; W5-F28 HydrophobicContact CZ3-CD1 4.38Å; W5-F28 HydrophobicContact CZ3-CE1 4.35Å; F6-F28 VanDerWaalsContact O-CE2 3.27Å; F6-F28 WeakPolarHBondContact O-CE2 3.49Å; F6-F28 WeakPolarHBondContact O-CZ 3.43Å; C7-F28 HydrophobicContact CB-CE2 4.22Å; F22-F28 HydrophobicContact CB-CB 3.96Å; F22-F28 HydrophobicContact CD2-CB 4.45Å; F22-F28 AromaticContact CD2-CD2 3.72Å; F22-F28 HydrophobicContact CD2-CD2 3.72Å; F22-F28 HydrophobicContact CE2-CD2 4.24Å; F22-F28 HydrophobicContact CG-CB 4.25Å; F22-F28 HydrophobicContact CG-CD2 4.35Å; T24-F28 PolarHBondContact O-N 2.95Å; R26-F28 VanDerWaalsContact C-N 3.33Å; R26-F28 PolarHBondContact O-N 3.25Å; F28-S30 VanDerWaalsContact C-N 3.28Å; F28-S30 PolarHBondContact O-N 3.42Å; F28-H31 PolarHBondContact O-N 3.33Å; F28-I32 HydrophobicContact CD1-CD1 4.17Å; F28-I32 HydrophobicContact CD2-CD1 4.36Å; F28-I32 HydrophobicContact CD2-CG1 4.47Å; F28-I32 HydrophobicContact CE1-CD1 3.82Å; F28-I32 HydrophobicContact CE2-CD1 4.01Å; F28-I32 HydrophobicContact CE2-CG1 4.25Å; F28-I32 HydrophobicContact CG-CD1 4.44Å; F28-I32 HydrophobicContact CZ-CD1 3.74Å; F28-I32 HydrophobicContact CZ-CG1 4.46Å; F28-I32 WeakPolarHBondContact O-CG1 3.38Å; F28-I32 PolarHBondContact O-N 3.45Å; F28-L93 HydrophobicContact CD1-CD2 3.69Å; F28-L93 HydrophobicContact CE1-CD2 3.61Å
29	V	76.3	Confident	74.7	Confident	21 Å²	21	74.6 Å²	74.6	13%	0.127	36%	0.361	C	S	.	.	H	α-helix	trans	-62.6	-35.6	174.1	165.7	0	0	0	0	111.5	Q25 R26 R33 L93	Q25-V29 WeakPolarHBondContact O-CB 3.37Å; Q25-V29 VanDerWaalsContact O-CG2 3.3Å; Q25-V29 WeakPolarHBondContact O-CG2 3.48Å; Q25-V29 PolarHBondContact O-N 3.13Å; R26-V29 PolarHBondContact O-N 3.23Å; V29-R33 VanDerWaalsContact CG1-NE 3.34Å; V29-R33 VanDerWaalsContact O-CG 3.25Å; V29-R33 WeakPolarHBondContact O-CG 3.48Å; V29-R33 PolarHBondContact O-N 3.09Å; V29-R33 VanDerWaalsContact O-N 3.11Å; V29-L93 HydrophobicContact CG2-CD1 3.66Å
30	S	78	Confident	75.8	Confident	75 Å²	75	71.1 Å²	71.1	52%	0.524	35%	0.351	S	S	.	.	H	α-helix	trans	-64.4	-45.3	173.2	-166.6	0	0	0	0	111.7	R26 D27 F28 I32 R33 A34	R26-S30 WeakPolarHBondContact O-CB 3.4Å; R26-S30 PolarHBondContact O-N 3.34Å; D27-S30 WeakPolarHBondContact O-CB 3.34Å; D27-S30 PolarHBondContact O-N 3.28Å; F28-S30 VanDerWaalsContact C-N 3.28Å; F28-S30 PolarHBondContact O-N 3.42Å; S30-I32 PolarHBondContact O-N 3.14Å; S30-R33 WeakPolarHBondContact O-CB 3.47Å; S30-R33 PolarHBondContact O-N 3.4Å; S30-A34 WeakPolarHBondContact O-CB 3.43Å; S30-A34 PolarHBondContact O-N 3.47Å
31	H	82.2	Confident	76	Confident	13 Å²	13	71 Å²	71	6%	0.06	35%	0.351	C	S	.	.	H	α-helix	trans	-61	-43.9	175.6	169.4	72.1	0	0	0	112.8	C7 C10 F22 D27 F28 R33 A34 H35	C7-H31 WeakPolarHBondContact CB-NE2 3.27Å; C10-H31 VanDerWaalsContact SG-CE1 3.54Å; F22-H31 HydrophobicContact CD1-CB 4.26Å; F22-H31 HydrophobicContact CE1-CB 3.56Å; F22-H31 AromaticContact CE1-CG 3.84Å; F22-H31 HydrophobicContact CE2-CB 4.1Å; F22-H31 AromaticContact CE2-CD2 3.61Å; F22-H31 AromaticContact CE2-CG 3.73Å; F22-H31 HydrophobicContact CZ-CB 3.48Å; F22-H31 VanDerWaalsContact CZ-CB 3.48Å; F22-H31 AromaticContact CZ-CD2 3.58Å; F22-H31 AromaticContact CZ-CG 3.2Å; F22-H31 AromaticContact CZ-ND1 3.5Å; D27-H31 WeakPolarHBondContact O-CB 3.36Å; D27-H31 PolarHBondContact O-N 3.17Å; F28-H31 PolarHBondContact O-N 3.33Å; H31-R33 VanDerWaalsContact C-N 3.32Å; H31-R33 PolarHBondContact O-N 3.35Å; H31-A34 PolarHBondContact O-N 3.22Å; H31-H35 AromaticContact CE1-CD2 3.34Å; H31-H35 PolarHBondContact CE1-CD2 3.5Å; H31-H35 AromaticContact CE1-CG 3.78Å; H31-H35 AromaticContact CE1-NE2 3.86Å; H31-H35 AromaticContact ND1-CD2 3.09Å; H31-H35 PolarHBondContact ND1-CD2 3.33Å; H31-H35 AromaticContact ND1-CG 3.96Å; H31-H35 AromaticContact ND1-NE2 3.57Å; H31-H35 PolarHBondContact O-CD2 3.41Å; H31-H35 PolarHBondContact O-N 2.92Å
32	I	77.4	Confident	75	Confident	1 Å²	1	75 Å²	75	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-39.6	176.6	-63.3	172.8	0	0	0	110.9	F28 S30 A34 H36 L37 Y52 L88	F28-I32 HydrophobicContact CD1-CD1 4.17Å; F28-I32 HydrophobicContact CD2-CD1 4.36Å; F28-I32 HydrophobicContact CD2-CG1 4.47Å; F28-I32 HydrophobicContact CE1-CD1 3.82Å; F28-I32 HydrophobicContact CE2-CD1 4.01Å; F28-I32 HydrophobicContact CE2-CG1 4.25Å; F28-I32 HydrophobicContact CG-CD1 4.44Å; F28-I32 HydrophobicContact CZ-CD1 3.74Å; F28-I32 HydrophobicContact CZ-CG1 4.46Å; F28-I32 WeakPolarHBondContact O-CG1 3.38Å; F28-I32 PolarHBondContact O-N 3.45Å; S30-I32 PolarHBondContact O-N 3.14Å; I32-A34 VanDerWaalsContact C-N 3.27Å; I32-A34 PolarHBondContact O-N 3.1Å; I32-H36 HydrophobicContact CG2-CB 4.07Å; I32-H36 CarbonylContact O-C 3.52Å; I32-H36 WeakPolarHBondContact O-CA 3.37Å; I32-H36 PolarHBondContact O-N 3.39Å; I32-L37 PolarHBondContact O-N 3.25Å; I32-Y52 HydrophobicContact CD1-CD2 3.97Å; I32-Y52 HydrophobicContact CD1-CE2 3.75Å; I32-Y52 HydrophobicContact CG1-CD2 3.85Å; I32-Y52 HydrophobicContact CG1-CE2 3.79Å; I32-Y52 HydrophobicContact CG2-CD2 3.94Å; I32-Y52 HydrophobicContact CG2-CG 4.38Å; I32-L88 HydrophobicContact CG2-CD1 4.14Å; I32-L88 HydrophobicContact CG2-CD2 3.63Å
33	R	76.5	Confident	74.2	Confident	85 Å²	85	81.2 Å²	81.2	32%	0.321	39%	0.393	S	S	.	.	H	α-helix	trans	-64.6	-27	172.4	-68.8	169.3	-162	-129.3	3.6	113.6	V29 S30 H31 L37 Y84 E85	V29-R33 VanDerWaalsContact CG1-NE 3.34Å; V29-R33 VanDerWaalsContact O-CG 3.25Å; V29-R33 WeakPolarHBondContact O-CG 3.48Å; V29-R33 PolarHBondContact O-N 3.09Å; V29-R33 VanDerWaalsContact O-N 3.11Å; S30-R33 WeakPolarHBondContact O-CB 3.47Å; S30-R33 PolarHBondContact O-N 3.4Å; H31-R33 VanDerWaalsContact C-N 3.32Å; H31-R33 PolarHBondContact O-N 3.35Å; R33-L37 WeakPolarHBondContact O-CB 3.47Å; R33-Y84 HydrophobicContact CG-CE1 4.31Å; R33-E85 IonicContact CZ-OE1 2.66Å; R33-E85 IonicContact CZ-OE2 3.31Å; R33-E85 IonicContact NH1-OE1 2.66Å; R33-E85 PolarHBondContact NH1-OE1 3.31Å; R33-E85 IonicContact NH1-OE2 3.66Å; R33-E85 PolarHBondContact NH1-OE2 3.2Å; R33-E85 IonicContact NH2-OE1 2.77Å; R33-E85 IonicContact NH2-OE2 2.76Å; R33-E85 PolarHBondContact NH2-OE2 3.2Å
34	A	76.1	Confident	73.8	Confident	70 Å²	70	84.6 Å²	84.6	58%	0.579	41%	0.406	S	S	*	.	H	α-helix	trans	-85.9	-33.2	-179.4	0	0	0	0	0	113.4	S30 H31 I32	S30-A34 WeakPolarHBondContact O-CB 3.43Å; S30-A34 PolarHBondContact O-N 3.47Å; H31-A34 PolarHBondContact O-N 3.22Å; I32-A34 VanDerWaalsContact C-N 3.27Å; I32-A34 PolarHBondContact O-N 3.1Å
35	H	75.9	Confident	73.5	Confident	112 Å²	112	85 Å²	85	52%	0.519	41%	0.409	S	S	.	.	H	α-helix	trans	-115	-25.1	-172.2	-66.3	-91.5	0	0	0	115.3	H31	H31-H35 AromaticContact CE1-CD2 3.34Å; H31-H35 PolarHBondContact CE1-CD2 3.5Å; H31-H35 AromaticContact CE1-CG 3.78Å; H31-H35 AromaticContact CE1-NE2 3.86Å; H31-H35 AromaticContact ND1-CD2 3.09Å; H31-H35 PolarHBondContact ND1-CD2 3.33Å; H31-H35 AromaticContact ND1-CG 3.96Å; H31-H35 AromaticContact ND1-NE2 3.57Å; H31-H35 PolarHBondContact O-CD2 3.41Å; H31-H35 PolarHBondContact O-N 2.92Å
36	H	80.2	Confident	73.6	Confident	4 Å²	4	83.6 Å²	83.6	2%	0.019	40%	0.402	C	S	.	.	S	Bend	trans	-120.3	7.7	-174.4	-63.9	-79.8	0	0	0	114.2	C7 C10 I32 R51 Y52	C7-H36 PolarHBondContact SG-NE2 3.12Å; C10-H36 PolarHBondContact SG-NE2 3.48Å; I32-H36 HydrophobicContact CG2-CB 4.07Å; I32-H36 CarbonylContact O-C 3.52Å; I32-H36 WeakPolarHBondContact O-CA 3.37Å; I32-H36 PolarHBondContact O-N 3.39Å; H36-R51 PolarHBondContact ND1-O 3.16Å; H36-R51 VanDerWaalsContact ND1-O 3.15Å; H36-R51 PolarHBondContact O-N 3.36Å; H36-Y52 HydrophobicContact CB-CD2 4.22Å; H36-Y52 AromaticContact CD2-CD2 3.78Å; H36-Y52 AromaticContact CG-CD2 3.85Å
37	L	79.9	Confident	73.9	Confident	23 Å²	23	74.4 Å²	74.4	12%	0.12	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.2	167.3	172.7	58.5	0	0	0	109.3	I32 R33 R39 F48 Y84	I32-L37 PolarHBondContact O-N 3.25Å; R33-L37 WeakPolarHBondContact O-CB 3.47Å; L37-R39 HydrophobicContact CD2-CG 4.44Å; L37-R39 HydrophobicContact CG-CG 4.25Å; L37-F48 HydrophobicContact CD1-CB 3.8Å; L37-F48 HydrophobicContact CD1-CD1 4Å; L37-F48 HydrophobicContact CD1-CG 4.41Å; L37-F48 HydrophobicContact CD2-CD1 4.13Å; L37-Y84 HydrophobicContact CB-CE1 4.21Å; L37-Y84 HydrophobicContact CD1-CD1 4.28Å; L37-Y84 HydrophobicContact CD1-CD2 4.38Å; L37-Y84 HydrophobicContact CD1-CE1 4.02Å; L37-Y84 HydrophobicContact CD1-CE2 4.13Å; L37-Y84 HydrophobicContact CD1-CG 4.46Å; L37-Y84 HydrophobicContact CD2-CD1 4.41Å; L37-Y84 HydrophobicContact CD2-CE1 3.97Å; L37-Y84 HydrophobicContact CG-CE1 4.28Å
38	V	79.6	Confident	73.9	Confident	41 Å²	41	71.9 Å²	71.9	25%	0.248	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.2	167.6	170.5	0	0	0	0	108.9	K40 I49 R51	V38-K40 HydrophobicContact CG1-CG 4.27Å; V38-I49 HydrophobicContact CB-CB 4.35Å; V38-I49 PolarHBondContact N-O 3.34Å; V38-I49 WeakPolarHBondContact O-CB 3.38Å; V38-I49 PolarHBondContact O-N 3.36Å; V38-R51 HydrophobicContact CG2-CG 4.35Å
39	R	80.6	Confident	74	Confident	133 Å²	133	73 Å²	73	50%	0.502	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	138.7	172.5	-47.6	-160	-163.8	-174.2	0.4	110	L37 E46 T47 F48	L37-R39 HydrophobicContact CD2-CG 4.44Å; L37-R39 HydrophobicContact CG-CG 4.25Å; R39-E46 WeakPolarHBondContact CD-OE1 3.34Å; R39-E46 IonicContact CZ-OE1 3.45Å; R39-E46 IonicContact NE-OE1 3.52Å; R39-E46 IonicContact NH1-OE1 3.84Å; R39-E46 PolarHBondContact NH1-OE1 3.42Å; R39-E46 IonicContact NH1-OE2 3.15Å; R39-T47 CarbonylContact C-O 3.55Å; R39-T47 WeakPolarHBondContact CA-O 3.22Å; R39-F48 HydrophobicContact CG-CD1 4.38Å; R39-F48 HydrophobicContact CG-CE1 4.49Å
40	K	75.9	Confident	74.2	Confident	109 Å²	109	72.1 Å²	72.1	47%	0.474	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	125.2	172.1	-69.5	-169.8	-179.4	-178.3	0	110.2	V38 T47 I49	V38-K40 HydrophobicContact CG1-CG 4.27Å; K40-T47 PolarHBondContact N-O 2.95Å; K40-T47 PolarHBondContact O-N 3.42Å; K40-T47 PolarHBondContact O-OG1 3.28Å; K40-I49 HydrophobicContact CD-CD1 3.79Å; K40-I49 HydrophobicContact CG-CD1 4.13Å
41	F	66.3	Low	73.9	Confident	142 Å²	142	73.5 Å²	73.5	62%	0.623	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	132	159.6	-92.6	-98.7	0	0	0	109.6	V45 E46	F41-V45 WeakPolarHBondContact CA-O 3.47Å; F41-E46 HydrophobicContact CD2-CB 4.24Å; F41-E46 HydrophobicContact CD2-CG 4.2Å; F41-E46 HydrophobicContact CE1-CB 4.4Å; F41-E46 HydrophobicContact CE2-CB 3.75Å; F41-E46 HydrophobicContact CE2-CG 3.78Å; F41-E46 HydrophobicContact CZ-CB 3.84Å; F41-E46 HydrophobicContact CZ-CG 4.36Å
42	R	50.7	Low	73.5	Confident	196 Å²	196	73.6 Å²	73.6	74%	0.74	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.5	127.7	163.9	-103.2	-173	169.7	-171.8	-4.7	107.8	D44 V45	R42-D44 VanDerWaalsContact C-N 3.31Å; R42-D44 PolarHBondContact O-N 3.35Å; R42-V45 PolarHBondContact N-O 2.96Å; R42-V45 PolarHBondContact O-N 3.17Å
43	N	59.3	Low	73.1	Confident	156 Å²	156	73.7 Å²	73.7	83%	0.834	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	52.7	176.8	-54	13.1	0	0	0	111.7	V45	N43-V45 PolarHBondContact O-N 3.39Å
44	D	62.3	Low	72.3	Confident	157 Å²	157	72.4 Å²	72.4	84%	0.84	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	8	-178.2	-54.4	-33.5	0	0	0	117.4	R42	R42-D44 VanDerWaalsContact C-N 3.31Å; R42-D44 PolarHBondContact O-N 3.35Å
45	V	65.7	Low	71.5	Confident	74 Å²	74	76.8 Å²	76.8	45%	0.448	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.8	171.6	-177.1	0	0	0	0	110.4	F41 R42 N43 T47	F41-V45 WeakPolarHBondContact CA-O 3.47Å; R42-V45 PolarHBondContact N-O 2.96Å; R42-V45 PolarHBondContact O-N 3.17Å; N43-V45 PolarHBondContact O-N 3.39Å; V45-T47 HydrophobicContact CG1-CG2 4.06Å
46	E	74	Confident	70.7	Confident	60 Å²	60	76.1 Å²	76.1	28%	0.28	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	127.3	167.3	-169	-179.4	-155.6	0	0	109.7	R39 F41 F48	R39-E46 WeakPolarHBondContact CD-OE1 3.34Å; R39-E46 IonicContact CZ-OE1 3.45Å; R39-E46 IonicContact NE-OE1 3.52Å; R39-E46 IonicContact NH1-OE1 3.84Å; R39-E46 PolarHBondContact NH1-OE1 3.42Å; R39-E46 IonicContact NH1-OE2 3.15Å; F41-E46 HydrophobicContact CD2-CB 4.24Å; F41-E46 HydrophobicContact CD2-CG 4.2Å; F41-E46 HydrophobicContact CE1-CB 4.4Å; F41-E46 HydrophobicContact CE2-CB 3.75Å; F41-E46 HydrophobicContact CE2-CG 3.78Å; F41-E46 HydrophobicContact CZ-CB 3.84Å; F41-E46 HydrophobicContact CZ-CG 4.36Å; E46-F48 HydrophobicContact CB-CE2 4.46Å; E46-F48 HydrophobicContact CG-CE2 4.08Å; E46-F48 HydrophobicContact CG-CZ 4.03Å; E46-F48 WeakPolarHBondContact OE2-CZ 3.49Å
47	T	79.4	Confident	69.7	Low	20 Å²	20	78.1 Å²	78.1	12%	0.123	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	140	179.9	60.1	0	0	0	0	111.5	R39 K40 V45 L77	R39-T47 CarbonylContact C-O 3.55Å; R39-T47 WeakPolarHBondContact CA-O 3.22Å; K40-T47 PolarHBondContact N-O 2.95Å; K40-T47 PolarHBondContact O-N 3.42Å; K40-T47 PolarHBondContact O-OG1 3.28Å; V45-T47 HydrophobicContact CG1-CG2 4.06Å; T47-L77 HydrophobicContact CG2-CD1 4.37Å
48	F	78.5	Confident	69	Low	10 Å²	10	77.1 Å²	77.1	4%	0.044	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	112.2	-169.1	-62.1	-98.5	0	0	0	109.6	L37 R39 E46 F78 Q81	L37-F48 HydrophobicContact CD1-CB 3.8Å; L37-F48 HydrophobicContact CD1-CD1 4Å; L37-F48 HydrophobicContact CD1-CG 4.41Å; L37-F48 HydrophobicContact CD2-CD1 4.13Å; R39-F48 HydrophobicContact CG-CD1 4.38Å; R39-F48 HydrophobicContact CG-CE1 4.49Å; E46-F48 HydrophobicContact CB-CE2 4.46Å; E46-F48 HydrophobicContact CG-CE2 4.08Å; E46-F48 HydrophobicContact CG-CZ 4.03Å; E46-F48 WeakPolarHBondContact OE2-CZ 3.49Å; F48-F78 HydrophobicContact CB-CB 4.3Å; F48-F78 PolarHBondContact N-O 2.85Å; F48-F78 WeakPolarHBondContact O-CD2 3.3Å; F48-F78 PolarHBondContact O-N 3.37Å; F48-Q81 HydrophobicContact CD1-CB 4.38Å; F48-Q81 HydrophobicContact CD1-CG 4.26Å; F48-Q81 HydrophobicContact CE1-CB 3.95Å; F48-Q81 HydrophobicContact CE1-CG 3.97Å; F48-Q81 HydrophobicContact CE2-CB 4.47Å; F48-Q81 HydrophobicContact CZ-CB 4.02Å
49	I	79.5	Confident	68	Low	31 Å²	31	80.6 Å²	80.6	16%	0.159	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126	-175.9	-60.3	172.1	0	0	0	110.8	V38 K40 R51 S76 L77	V38-I49 HydrophobicContact CB-CB 4.35Å; V38-I49 PolarHBondContact N-O 3.34Å; V38-I49 WeakPolarHBondContact O-CB 3.38Å; V38-I49 PolarHBondContact O-N 3.36Å; K40-I49 HydrophobicContact CD-CD1 3.79Å; K40-I49 HydrophobicContact CG-CD1 4.13Å; I49-R51 HydrophobicContact CG2-CG 4.39Å; I49-S76 WeakPolarHBondContact CA-O 3.28Å; I49-L77 HydrophobicContact CD1-CD1 3.94Å; I49-L77 HydrophobicContact CG1-CD1 3.46Å; I49-L77 VanDerWaalsContact CG1-CD1 3.46Å
50	C	79.1	Confident	66.6	Low	2 Å²	2	76.5 Å²	76.5	1%	0.014	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.2	173.4	-169.3	0	0	0	0	111.8	C58 S76 F78 Y84 H87 H92	C50-C58 HydrophobicContact CB-CB 4.04Å; C50-C58 WeakPolarHBondContact O-CB 3.5Å; C50-S76 PolarHBondContact N-O 3Å; C50-F78 HydrophobicContact CB-CE2 4.26Å; C50-Y84 HydrophobicContact CB-CD2 4.2Å; C50-Y84 HydrophobicContact CB-CE2 3.76Å; C50-H87 PolarHBondContact SG-NE2 3.06Å; C50-H92 PolarHBondContact SG-NE2 2.85Å
51	R	73	Confident	64.8	Low	104 Å²	104	74 Å²	74	39%	0.392	38%	0.377	S	S	.	.			trans	-119.1	22.8	174.6	-64.3	-166.6	158.3	179.4	-9.9	113.3	H36 V38 I49 G53 N56	H36-R51 PolarHBondContact ND1-O 3.16Å; H36-R51 VanDerWaalsContact ND1-O 3.15Å; H36-R51 PolarHBondContact O-N 3.36Å; V38-R51 HydrophobicContact CG2-CG 4.35Å; I49-R51 HydrophobicContact CG2-CG 4.39Å; R51-G53 PolarHBondContact O-N 3.38Å; R51-N56 WeakPolarHBondContact CB-O 3.23Å; R51-N56 VanDerWaalsContact CG-O 3.23Å; R51-N56 WeakPolarHBondContact CG-O 3.38Å
52	Y	72.8	Confident	63.1	Low	16 Å²	16	74.5 Å²	74.5	6%	0.063	39%	0.387	C	S	.	.			trans	-85.3	99.7	176.8	-165.8	-89.5	0	0	0	109.7	Y9 I32 H36 H92	Y9-Y52 HydrophobicContact CD2-CD1 4.17Å; Y9-Y52 HydrophobicContact CD2-CD2 4.17Å; Y9-Y52 AromaticContact CD2-CE1 3.85Å; Y9-Y52 HydrophobicContact CD2-CE1 3.85Å; Y9-Y52 AromaticContact CD2-CE2 3.85Å; Y9-Y52 HydrophobicContact CD2-CE2 3.85Å; Y9-Y52 HydrophobicContact CD2-CG 4.33Å; Y9-Y52 AromaticContact CD2-CZ 3.66Å; Y9-Y52 HydrophobicContact CE2-CD1 4.1Å; Y9-Y52 AromaticContact CE2-CE1 3.61Å; Y9-Y52 HydrophobicContact CE2-CE1 3.61Å; Y9-Y52 HydrophobicContact CE2-CE2 4.43Å; Y9-Y52 AromaticContact CE2-CZ 3.79Å; I32-Y52 HydrophobicContact CD1-CD2 3.97Å; I32-Y52 HydrophobicContact CD1-CE2 3.75Å; I32-Y52 HydrophobicContact CG1-CD2 3.85Å; I32-Y52 HydrophobicContact CG1-CE2 3.79Å; I32-Y52 HydrophobicContact CG2-CD2 3.94Å; I32-Y52 HydrophobicContact CG2-CG 4.38Å; H36-Y52 HydrophobicContact CB-CD2 4.22Å; H36-Y52 AromaticContact CD2-CD2 3.78Å; H36-Y52 AromaticContact CG-CD2 3.85Å; Y52-H92 HydrophobicContact CD1-CB 4.28Å; Y52-H92 AromaticContact CD1-CG 3.78Å; Y52-H92 AromaticContact CD1-ND1 3.49Å; Y52-H92 WeakPolarHBondContact CD1-ND1 3.37Å; Y52-H92 HydrophobicContact CE1-CB 4.36Å; Y52-H92 PolarHBondContact O-CE1 3.45Å
53	G	69	Low	62.2	Low	2 Å²	2	68.7 Å²	68.7	2%	0.021	39%	0.387	C	S	.	.	S	Bend	trans	158	175	-176.8	0	0	0	0	0	112.8	Y9 R51 N56 S57	Y9-G53 VanDerWaalsContact CD1-C 3.43Å; Y9-G53 WeakPolarHBondContact CD1-O 3.47Å; Y9-G53 VanDerWaalsContact CE1-C 3.44Å; R51-G53 PolarHBondContact O-N 3.38Å; G53-N56 PolarHBondContact O-N 3.12Å; G53-S57 CarbonylContact C-O 3.57Å; G53-S57 WeakPolarHBondContact CA-O 3.38Å
54	P	60.2	Low	60.7	Low	59 Å²	59	68.4 Å²	68.4	38%	0.383	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-59	147.9	178.2	25.7	-34.4	0	0	0	111.6	N56 S57 L59	P54-N56 PolarHBondContact O-N 3.43Å; P54-N56 VanDerWaalsContact O-N 3.11Å; P54-S57 PolarHBondContact O-N 3.15Å; P54-S57 PolarHBondContact O-OG 3.1Å; P54-L59 HydrophobicContact CG-CD2 3.88Å
55	N	59	Low	59	Low	161 Å²	161	67.8 Å²	67.8	86%	0.861	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	54.3	26.5	179.8	-60.4	-10.8	0	0	0	115.4	S57	N55-S57 PolarHBondContact O-N 3.45Å
56	N	60.4	Low	57.2	Low	98 Å²	98	69.9 Å²	69.9	52%	0.524	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	60.2	21.8	-177.9	-71.4	-53.5	0	0	0	114.7	R51 G53 P54	R51-N56 WeakPolarHBondContact CB-O 3.23Å; R51-N56 VanDerWaalsContact CG-O 3.23Å; R51-N56 WeakPolarHBondContact CG-O 3.38Å; G53-N56 PolarHBondContact O-N 3.12Å; P54-N56 PolarHBondContact O-N 3.43Å; P54-N56 VanDerWaalsContact O-N 3.11Å
57	S	59.4	Low	55.1	Low	46 Å²	46	73 Å²	73	32%	0.322	42%	0.422	S	S	.	.	S	Bend	trans	-110.2	142.8	167.9	51.7	0	0	0	0	110.6	G53 P54 N55	G53-S57 CarbonylContact C-O 3.57Å; G53-S57 WeakPolarHBondContact CA-O 3.38Å; P54-S57 PolarHBondContact O-N 3.15Å; P54-S57 PolarHBondContact O-OG 3.1Å; N55-S57 PolarHBondContact O-N 3.45Å
58	C	64.2	Low	52.6	Low	2 Å²	2	80 Å²	80	1%	0.014	45%	0.454	C	S	.	.			trans	-70.4	141.5	168	-172.3	0	0	0	0	109.4	C50 L60 S61 H87 H92	C50-C58 HydrophobicContact CB-CB 4.04Å; C50-C58 WeakPolarHBondContact O-CB 3.5Å; C58-L60 PolarHBondContact O-N 2.83Å; C58-S61 PolarHBondContact O-N 3.23Å; C58-S61 PolarHBondContact O-OG 2.79Å; C58-H87 PolarHBondContact SG-CE1 3.19Å; C58-H87 PolarHBondContact SG-NE2 3.32Å; C58-H87 VanDerWaalsContact SG-NE2 3.44Å; C58-H92 PolarHBondContact SG-NE2 3.24Å
59	L	58	Low	50.2	Low	115 Å²	115	89.6 Å²	89.6	60%	0.602	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-3.5	-177.8	-71.5	165.3	0	0	0	115.3	P54	P54-L59 HydrophobicContact CG-CD2 3.88Å
60	L	51.5	Low	47.7	Very low	47 Å²	47	93.3 Å²	93.3	25%	0.246	52%	0.524	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-26.8	170.4	-77.6	164.2	0	0	0	113.8	C58 N62 G63 F91	C58-L60 PolarHBondContact O-N 2.83Å; L60-N62 PolarHBondContact O-N 3.09Å; L60-G63 PolarHBondContact O-N 3.34Å; L60-F91 HydrophobicContact CD2-CE2 4.3Å; L60-F91 HydrophobicContact CD2-CZ 4.22Å
61	S	38.8	Very low	45.2	Very low	56 Å²	56	103.7 Å²	103.7	39%	0.392	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.9	-2.2	-162.9	-52.4	0	0	0	0	116.3	C58 S76	C58-S61 PolarHBondContact O-N 3.23Å; C58-S61 PolarHBondContact O-OG 2.79Å; S61-S76 WeakPolarHBondContact OG-CB 3.31Å; S61-S76 PolarHBondContact OG-OG 3.23Å
62	N	30.5	Very low	43.2	Very low	153 Å²	153	103.6 Å²	103.6	82%	0.818	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	14.8	-178.6	-72.9	8.9	0	0	0	113.7	L60 L64	L60-N62 PolarHBondContact O-N 3.09Å; N62-L64 PolarHBondContact O-N 3.16Å
63	G	32.6	Very low	41.2	Very low	73 Å²	73	105.8 Å²	105.8	75%	0.753	60%	0.597	S	S	*	*			trans	-87.2	92.7	174.8	0	0	0	0	0	112.7	L60	L60-G63 PolarHBondContact O-N 3.34Å
64	L	25.9	Very low	40	Very low	150 Å²	150	113.5 Å²	113.5	79%	0.785	63%	0.633	S	S	*	*			trans	-84.8	145.8	174.7	-150.9	77.7	0	0	0	111.5	N62	N62-L64 PolarHBondContact O-N 3.16Å
65	D	26.9	Very low	39.5	Very low	145 Å²	145	115.4 Å²	115.4	78%	0.775	64%	0.64	S	S	*	*			trans	51.4	77.1	163.6	-58.1	-24.1	0	0	0	118.3
66	S	29.5	Very low	39.5	Very low	118 Å²	118	108.9 Å²	108.9	83%	0.825	61%	0.607	S	S	*	*			trans	-125.1	107.9	155.5	68.5	0	0	0	0	111.4
67	V	28.9	Very low	39.8	Very low	124 Å²	124	107.6 Å²	107.6	75%	0.752	60%	0.6	S	S	*	*			trans	-74.5	147.1	-178.2	174.2	0	0	0	0	111.6
68	E	27.8	Very low	40.6	Very low	169 Å²	169	106 Å²	106	79%	0.79	59%	0.587	S	S	*	*			trans	55.7	88.1	166	-75.1	162.6	-143.9	0	0	118.4
69	K	27.9	Very low	41	Very low	210 Å²	210	110.8 Å²	110.8	91%	0.913	62%	0.616	S	S	*	*				-155.9	140	120	-109	145.9	-169.8	164.8	0	113.2	Y71	K69-Y71 PolarHBondContact O-N 3.43Å
70	S	26.1	Very low	41.7	Very low	109 Å²	109	107.2 Å²	107.2	76%	0.762	60%	0.601	S	S	*	*			trans	-83.6	89.8	-171.8	37.3	0	0	0	0	112.9
71	Y	27.6	Very low	42.9	Very low	220 Å²	220	108.4 Å²	108.4	86%	0.863	61%	0.605	S	S	*	*	S	Bend	trans	-157.6	103.7	149	-87.7	-61.9	0	0	0	111	K69	K69-Y71 PolarHBondContact O-N 3.43Å
72	S	29.4	Very low	44.6	Very low	103 Å²	103	115.3 Å²	115.3	72%	0.72	62%	0.622	S	S	*	*	S	Bend	trans	27.9	115	160.4	59	0	0	0	0	120.4
73	S	31.3	Very low	46.8	Very low	61 Å²	61	110 Å²	110	43%	0.427	59%	0.594	S	S	.	*			trans	51.6	95.7	153.9	60.4	0	0	0	0	117.4	D75	S73-D75 VanDerWaalsContact C-N 3.31Å
74	H	43.4	Very low	48.9	Very low	164 Å²	164	106.5 Å²	106.5	76%	0.759	56%	0.558	S	S	*	*			trans	-84.3	-3.6	164.2	-105.6	-87	0	0	0	113.6
75	D	51	Low	51.2	Low	99 Å²	99	102.1 Å²	102.1	53%	0.529	53%	0.534	S	S	.	.	S	Bend	trans	-65.3	153.4	-178	-63.9	-75	0	0	0	113.9	S73 L77	S73-D75 VanDerWaalsContact C-N 3.31Å; D75-L77 HydrophobicContact CB-CB 3.88Å; D75-L77 PolarHBondContact O-N 3.41Å
76	S	59	Low	53.3	Low	24 Å²	24	102.7 Å²	102.7	17%	0.168	53%	0.525	C	S	.	.	S	Bend	trans	-72	15.9	161	54.7	0	0	0	0	113.5	I49 C50 S61	I49-S76 WeakPolarHBondContact CA-O 3.28Å; C50-S76 PolarHBondContact N-O 3Å; S61-S76 WeakPolarHBondContact OG-CB 3.31Å; S61-S76 PolarHBondContact OG-OG 3.23Å
77	L	65.8	Low	55.6	Low	72 Å²	72	98 Å²	98	38%	0.377	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	106.3	-174	177.7	76.4	0	0	0	108.2	T47 I49 D75	T47-L77 HydrophobicContact CG2-CD1 4.37Å; I49-L77 HydrophobicContact CD1-CD1 3.94Å; I49-L77 HydrophobicContact CG1-CD1 3.46Å; I49-L77 VanDerWaalsContact CG1-CD1 3.46Å; D75-L77 HydrophobicContact CB-CB 3.88Å; D75-L77 PolarHBondContact O-N 3.41Å
78	F	75.9	Confident	57.6	Low	13 Å²	13	92.3 Å²	92.3	6%	0.057	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	137.6	-177.6	-53.2	-85.1	0	0	0	110.5	F48 C50 D83 Y84 H87	F48-F78 HydrophobicContact CB-CB 4.3Å; F48-F78 PolarHBondContact N-O 2.85Å; F48-F78 WeakPolarHBondContact O-CD2 3.3Å; F48-F78 PolarHBondContact O-N 3.37Å; C50-F78 HydrophobicContact CB-CE2 4.26Å; F78-D83 HydrophobicContact CB-CB 4.39Å; F78-D83 HydrophobicContact CD1-CB 3.89Å; F78-Y84 AromaticContact CD2-CD2 3.77Å; F78-Y84 HydrophobicContact CD2-CD2 3.77Å; F78-Y84 HydrophobicContact CD2-CG 4.24Å; F78-Y84 AromaticContact CE2-CD2 3.92Å; F78-Y84 HydrophobicContact CE2-CD2 3.92Å; F78-H87 HydrophobicContact CE1-CB 3.87Å; F78-H87 HydrophobicContact CE2-CB 4.21Å; F78-H87 AromaticContact CE2-CD2 3.9Å; F78-H87 HydrophobicContact CZ-CB 3.48Å; F78-H87 VanDerWaalsContact CZ-CB 3.48Å; F78-H87 AromaticContact CZ-CD2 3.81Å; F78-H87 AromaticContact CZ-CG 3.5Å; F78-H87 VanDerWaalsContact CZ-CG 3.5Å
79	T	73.6	Confident	59.4	Low	102 Å²	102	87.4 Å²	87.4	63%	0.626	44%	0.437	S	S	*	.	S	Bend	trans	-87.2	-9.4	175.9	50	0	0	0	0	113.3
80	S	72.9	Confident	61.2	Low	40 Å²	40	79.4 Å²	79.4	28%	0.28	41%	0.414	S	S	.	.	S	Bend	trans	-134.4	147.3	169.6	104.6	0	0	0	0	111.7	R82 D83 Y84	S80-R82 PolarHBondContact O-N 3.28Å; S80-R82 PolarHBondContact OG-N 2.92Å; S80-D83 VanDerWaalsContact CB-OD2 3.31Å; S80-D83 WeakPolarHBondContact CB-OD2 3.47Å; S80-D83 PolarHBondContact O-N 2.88Å; S80-D83 PolarHBondContact OG-N 3.38Å; S80-D83 PolarHBondContact OG-OD2 3.02Å; S80-Y84 PolarHBondContact O-N 3.36Å
81	Q	76.6	Confident	62.8	Low	72 Å²	72	77.8 Å²	77.8	34%	0.336	39%	0.393	S	S	.	.	H	α-helix	trans	-62.1	-30.1	176.7	-160.5	-174.3	-74.2	0	0	112.2	F48 D83 Y84 E85	F48-Q81 HydrophobicContact CD1-CB 4.38Å; F48-Q81 HydrophobicContact CD1-CG 4.26Å; F48-Q81 HydrophobicContact CE1-CB 3.95Å; F48-Q81 HydrophobicContact CE1-CG 3.97Å; F48-Q81 HydrophobicContact CE2-CB 4.47Å; F48-Q81 HydrophobicContact CZ-CB 4.02Å; Q81-D83 VanDerWaalsContact C-N 3.31Å; Q81-D83 PolarHBondContact O-N 3.23Å; Q81-Y84 PolarHBondContact O-N 3.27Å; Q81-E85 PolarHBondContact NE2-OE1 2.9Å; Q81-E85 VanDerWaalsContact O-CG 3.29Å; Q81-E85 WeakPolarHBondContact O-CG 3.27Å; Q81-E85 PolarHBondContact O-N 2.93Å
82	R	74.3	Confident	64.8	Low	200 Å²	200	69.1 Å²	69.1	76%	0.755	36%	0.361	S	S	*	.	H	α-helix	trans	-64.2	-33.9	178.2	-84.9	-177	168.9	178.3	-2.4	112.8	S80 E85 R86	S80-R82 PolarHBondContact O-N 3.28Å; S80-R82 PolarHBondContact OG-N 2.92Å; R82-E85 PolarHBondContact O-N 2.91Å; R82-R86 PolarHBondContact O-N 2.99Å; R82-R86 VanDerWaalsContact O-N 3.08Å
83	D	76	Confident	66.5	Low	41 Å²	41	65 Å²	65	22%	0.219	33%	0.33	C	S	.	.	H	α-helix	trans	-77.4	-40.2	-178.1	-54.3	-58.5	0	0	0	110.9	F78 S80 Q81 E85 R86 H87	F78-D83 HydrophobicContact CB-CB 4.39Å; F78-D83 HydrophobicContact CD1-CB 3.89Å; S80-D83 VanDerWaalsContact CB-OD2 3.31Å; S80-D83 WeakPolarHBondContact CB-OD2 3.47Å; S80-D83 PolarHBondContact O-N 2.88Å; S80-D83 PolarHBondContact OG-N 3.38Å; S80-D83 PolarHBondContact OG-OD2 3.02Å; Q81-D83 VanDerWaalsContact C-N 3.31Å; Q81-D83 PolarHBondContact O-N 3.23Å; D83-E85 VanDerWaalsContact C-N 3.31Å; D83-E85 PolarHBondContact O-N 3.21Å; D83-R86 PolarHBondContact O-N 3.46Å; D83-R86 IonicContact OD1-CZ 3.46Å; D83-R86 IonicContact OD1-NH1 3.39Å; D83-R86 PolarHBondContact OD1-NH1 3.47Å; D83-R86 IonicContact OD1-NH2 2.72Å; D83-R86 PolarHBondContact OD1-NH2 3.23Å; D83-H87 PolarHBondContact O-N 3.22Å
84	Y	77.6	Confident	67.8	Low	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-56.5	-42.7	167.9	173.2	-108	0	0	0	112.2	R33 L37 C50 F78 S80 Q81 H87 L88	R33-Y84 HydrophobicContact CG-CE1 4.31Å; L37-Y84 HydrophobicContact CB-CE1 4.21Å; L37-Y84 HydrophobicContact CD1-CD1 4.28Å; L37-Y84 HydrophobicContact CD1-CD2 4.38Å; L37-Y84 HydrophobicContact CD1-CE1 4.02Å; L37-Y84 HydrophobicContact CD1-CE2 4.13Å; L37-Y84 HydrophobicContact CD1-CG 4.46Å; L37-Y84 HydrophobicContact CD2-CD1 4.41Å; L37-Y84 HydrophobicContact CD2-CE1 3.97Å; L37-Y84 HydrophobicContact CG-CE1 4.28Å; C50-Y84 HydrophobicContact CB-CD2 4.2Å; C50-Y84 HydrophobicContact CB-CE2 3.76Å; F78-Y84 AromaticContact CD2-CD2 3.77Å; F78-Y84 HydrophobicContact CD2-CD2 3.77Å; F78-Y84 HydrophobicContact CD2-CG 4.24Å; F78-Y84 AromaticContact CE2-CD2 3.92Å; F78-Y84 HydrophobicContact CE2-CD2 3.92Å; S80-Y84 PolarHBondContact O-N 3.36Å; Q81-Y84 PolarHBondContact O-N 3.27Å; Y84-H87 WeakPolarHBondContact O-CB 3.35Å; Y84-H87 PolarHBondContact O-N 3.46Å; Y84-L88 HydrophobicContact CD1-CD1 4.3Å; Y84-L88 HydrophobicContact CE1-CD1 3.6Å; Y84-L88 HydrophobicContact CE1-CG 4.16Å; Y84-L88 HydrophobicContact CE2-CD1 4.45Å; Y84-L88 HydrophobicContact CE2-CD2 4.24Å; Y84-L88 HydrophobicContact CE2-CG 4.19Å; Y84-L88 PolarHBondContact O-N 3.19Å
85	E	74.7	Confident	67.7	Low	58 Å²	58	66.8 Å²	66.8	27%	0.271	33%	0.334	S	S	.	.	H	α-helix	trans	-66.2	-39.1	177.6	-73.1	-177.4	-142.5	0	0	112.9	R33 Q81 R82 D83 L88 V89	R33-E85 IonicContact CZ-OE1 2.66Å; R33-E85 IonicContact CZ-OE2 3.31Å; R33-E85 IonicContact NH1-OE1 2.66Å; R33-E85 PolarHBondContact NH1-OE1 3.31Å; R33-E85 IonicContact NH1-OE2 3.66Å; R33-E85 PolarHBondContact NH1-OE2 3.2Å; R33-E85 IonicContact NH2-OE1 2.77Å; R33-E85 IonicContact NH2-OE2 2.76Å; R33-E85 PolarHBondContact NH2-OE2 3.2Å; Q81-E85 PolarHBondContact NE2-OE1 2.9Å; Q81-E85 VanDerWaalsContact O-CG 3.29Å; Q81-E85 WeakPolarHBondContact O-CG 3.27Å; Q81-E85 PolarHBondContact O-N 2.93Å; R82-E85 PolarHBondContact O-N 2.91Å; D83-E85 VanDerWaalsContact C-N 3.31Å; D83-E85 PolarHBondContact O-N 3.21Å; E85-L88 PolarHBondContact O-N 3.45Å; E85-V89 PolarHBondContact O-N 3.2Å
86	R	69.8	Low	66.8	Low	158 Å²	158	69.6 Å²	69.6	60%	0.596	34%	0.343	S	S	*	.	H	α-helix	trans	-64.1	-40.4	172.1	-76.3	-165	-113.4	85.8	6.9	111.9	R82 D83 G90	R82-R86 PolarHBondContact O-N 2.99Å; R82-R86 VanDerWaalsContact O-N 3.08Å; D83-R86 PolarHBondContact O-N 3.46Å; D83-R86 IonicContact OD1-CZ 3.46Å; D83-R86 IonicContact OD1-NH1 3.39Å; D83-R86 PolarHBondContact OD1-NH1 3.47Å; D83-R86 IonicContact OD1-NH2 2.72Å; D83-R86 PolarHBondContact OD1-NH2 3.23Å; R86-G90 PolarHBondContact O-N 3.26Å
87	H	78.2	Confident	65.5	Low	20 Å²	20	73.5 Å²	73.5	9%	0.093	37%	0.368	C	S	.	.	H	α-helix	trans	-59.2	-47.8	175	161.7	69.4	0	0	0	112.1	C50 C58 F78 D83 Y84 V89 G90 F91 H92	C50-H87 PolarHBondContact SG-NE2 3.06Å; C58-H87 PolarHBondContact SG-CE1 3.19Å; C58-H87 PolarHBondContact SG-NE2 3.32Å; C58-H87 VanDerWaalsContact SG-NE2 3.44Å; F78-H87 HydrophobicContact CE1-CB 3.87Å; F78-H87 HydrophobicContact CE2-CB 4.21Å; F78-H87 AromaticContact CE2-CD2 3.9Å; F78-H87 HydrophobicContact CZ-CB 3.48Å; F78-H87 VanDerWaalsContact CZ-CB 3.48Å; F78-H87 AromaticContact CZ-CD2 3.81Å; F78-H87 AromaticContact CZ-CG 3.5Å; F78-H87 VanDerWaalsContact CZ-CG 3.5Å; D83-H87 PolarHBondContact O-N 3.22Å; Y84-H87 WeakPolarHBondContact O-CB 3.35Å; Y84-H87 PolarHBondContact O-N 3.46Å; H87-V89 PolarHBondContact O-N 3.37Å; H87-G90 PolarHBondContact O-N 3.29Å; H87-F91 WeakPolarHBondContact O-CB 3.3Å; H87-F91 PolarHBondContact O-N 3.29Å; H87-H92 AromaticContact CD2-NE2 3.67Å; H87-H92 AromaticContact CE1-NE2 2.83Å; H87-H92 PolarHBondContact CE1-NE2 3.12Å; H87-H92 AromaticContact NE2-CD2 3.67Å; H87-H92 AromaticContact NE2-NE2 2.45Å; H87-H92 PolarHBondContact NE2-NE2 3.26Å
88	L	71.3	Confident	63.7	Low	3 Å²	3	76.7 Å²	76.7	2%	0.016	39%	0.39	C	S	.	.	I	π-helix	trans	-55.7	-52.3	178.1	-75.7	-176.7	0	0	0	112.4	I32 Y84 E85 H92 L93	I32-L88 HydrophobicContact CG2-CD1 4.14Å; I32-L88 HydrophobicContact CG2-CD2 3.63Å; Y84-L88 HydrophobicContact CD1-CD1 4.3Å; Y84-L88 HydrophobicContact CE1-CD1 3.6Å; Y84-L88 HydrophobicContact CE1-CG 4.16Å; Y84-L88 HydrophobicContact CE2-CD1 4.45Å; Y84-L88 HydrophobicContact CE2-CD2 4.24Å; Y84-L88 HydrophobicContact CE2-CG 4.19Å; Y84-L88 PolarHBondContact O-N 3.19Å; E85-L88 PolarHBondContact O-N 3.45Å; L88-H92 PolarHBondContact O-N 2.95Å; L88-H92 VanDerWaalsContact O-N 3.07Å; L88-L93 PolarHBondContact O-N 3.36Å
89	V	65.9	Low	61.5	Low	66 Å²	66	86.7 Å²	86.7	40%	0.4	43%	0.429	S	S	.	.	I	π-helix	trans	-65.9	-48.2	-177.7	179.8	0	0	0	0	111	E85 H87 L93 L94	E85-V89 PolarHBondContact O-N 3.2Å; H87-V89 PolarHBondContact O-N 3.37Å; V89-L93 HydrophobicContact CB-CD1 4.43Å; V89-L93 HydrophobicContact CG2-CD1 4.07Å; V89-L94 HydrophobicContact CG1-CD1 4.34Å; V89-L94 WeakPolarHBondContact O-CG 3.48Å; V89-L94 PolarHBondContact O-N 3.37Å
90	G	64.4	Low	59.1	Low	42 Å²	42	91.5 Å²	91.5	43%	0.433	44%	0.441	S	S	.	.	I	π-helix	trans	-67.8	-36.8	-175.3	0	0	0	0	0	114.4	R86 H87	R86-G90 PolarHBondContact O-N 3.26Å; H87-G90 PolarHBondContact O-N 3.29Å
91	F	61	Low	56.8	Low	75 Å²	75	98 Å²	98	33%	0.329	47%	0.467	S	S	.	.	I	π-helix	trans	-102.9	-35.7	-170.5	-137.1	-90.9	0	0	0	114.3	L60 H87	L60-F91 HydrophobicContact CD2-CE2 4.3Å; L60-F91 HydrophobicContact CD2-CZ 4.22Å; H87-F91 WeakPolarHBondContact O-CB 3.3Å; H87-F91 PolarHBondContact O-N 3.29Å
92	H	69	Low	54.5	Low	39 Å²	39	99.4 Å²	99.4	18%	0.181	48%	0.482	C	S	.	.	I	π-helix	trans	-108	-25.7	-172.4	-60.9	-67.6	0	0	0	114.3	C50 Y52 C58 H87 L88	C50-H92 PolarHBondContact SG-NE2 2.85Å; Y52-H92 HydrophobicContact CD1-CB 4.28Å; Y52-H92 AromaticContact CD1-CG 3.78Å; Y52-H92 AromaticContact CD1-ND1 3.49Å; Y52-H92 WeakPolarHBondContact CD1-ND1 3.37Å; Y52-H92 HydrophobicContact CE1-CB 4.36Å; Y52-H92 PolarHBondContact O-CE1 3.45Å; C58-H92 PolarHBondContact SG-NE2 3.24Å; H87-H92 AromaticContact CD2-NE2 3.67Å; H87-H92 AromaticContact CE1-NE2 2.83Å; H87-H92 PolarHBondContact CE1-NE2 3.12Å; H87-H92 AromaticContact NE2-CD2 3.67Å; H87-H92 AromaticContact NE2-NE2 2.45Å; H87-H92 PolarHBondContact NE2-NE2 3.26Å; L88-H92 PolarHBondContact O-N 2.95Å; L88-H92 VanDerWaalsContact O-N 3.07Å
93	L	64.8	Low	52.3	Low	15 Å²	15	96.9 Å²	96.9	8%	0.079	48%	0.484	C	S	.	.	I	π-helix	trans	-94.5	-29.7	-180	-55.6	-178.9	0	0	0	114.1	W5 Q25 F28 V29 L88 V89	W5-L93 HydrophobicContact CE3-CD2 4.17Å; W5-L93 HydrophobicContact CH2-CB 4.44Å; W5-L93 HydrophobicContact CH2-CD2 4.39Å; W5-L93 HydrophobicContact CZ3-CB 4.37Å; W5-L93 HydrophobicContact CZ3-CD2 3.77Å; Q25-L93 HydrophobicContact CG-CD1 4.14Å; F28-L93 HydrophobicContact CD1-CD2 3.69Å; F28-L93 HydrophobicContact CE1-CD2 3.61Å; V29-L93 HydrophobicContact CG2-CD1 3.66Å; L88-L93 PolarHBondContact O-N 3.36Å; V89-L93 HydrophobicContact CB-CD1 4.43Å; V89-L93 HydrophobicContact CG2-CD1 4.07Å
94	L	58.7	Low	50.2	Low	130 Å²	130	101.8 Å²	101.8	68%	0.681	52%	0.515	S	S	*	.	S	Bend	trans	-96	-5.5	-173.6	-70.4	172.8	0	0	0	114.9	V89	V89-L94 HydrophobicContact CG1-CD1 4.34Å; V89-L94 WeakPolarHBondContact O-CG 3.48Å; V89-L94 PolarHBondContact O-N 3.37Å
95	K	42.2	Very low	47.7	Very low	134 Å²	134	111.3 Å²	111.3	58%	0.583	56%	0.556	S	S	*	*			trans	-105.8	72.1	179.3	-77.2	-175.8	176.5	173.7	0	112.4
96	H	31.1	Very low	45.5	Very low	157 Å²	157	114.1 Å²	114.1	73%	0.727	58%	0.583	S	S	*	*			trans	-128.6	114.9	160.5	-130.2	-79.7	0	0	0	110.8	V98	H96-V98 PolarHBondContact O-N 3.15Å
97	P	32.3	Very low	43.9	Very low	107 Å²	107	112.2 Å²	112.2	70%	0.695	59%	0.59	S	S	*	*			trans	-78	110.2	-174.6	29.9	-33.1	0	0	0	111	Y99	P97-Y99 PolarHBondContact O-N 2.97Å
98	V	28.5	Very low	41.6	Very low	138 Å²	138	119.6 Å²	119.6	84%	0.836	63%	0.63	S	S	*	*			trans	-68.2	130.1	176.3	178.7	0	0	0	0	110.4	H96 K100	H96-V98 PolarHBondContact O-N 3.15Å; V98-K100 PolarHBondContact O-N 3.47Å
99	Y	28.1	Very low	39.9	Very low	223 Å²	223	125 Å²	125	88%	0.875	67%	0.665	S	S	*	*			trans	-62.7	129.9	-179.1	-83.3	-112.9	0	0	0	111.6	P97 H101	P97-Y99 PolarHBondContact O-N 2.97Å; Y99-H101 PolarHBondContact O-N 3.09Å
100	K	24.5	Very low	38.2	Very low	203 Å²	203	130 Å²	130	88%	0.883	69%	0.688	S	S	*	*			trans	-81.2	113.4	167.7	-73.4	-172.2	175	-176.1	0	109.8	V98	V98-K100 PolarHBondContact O-N 3.47Å
101	H	23.9	Very low	36.5	Very low	176 Å²	176	133.2 Å²	133.2	82%	0.815	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-65.8	133	171.2	-146.5	-79.4	0	0	0	109.9	Y99	Y99-H101 PolarHBondContact O-N 3.09Å
102	P	29	Very low	35.3	Very low	102 Å²	102	135.5 Å²	135.5	66%	0.662	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-81.1	150.3	179.7	32.1	-34.6	0	0	0	112.4
103	D	27.5	Very low	33.3	Very low	147 Å²	147	140.1 Å²	140.1	79%	0.786	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-71.2	143	-172.3	-46.9	-89.9	0	0	0	114.4
104	V	31	Very low	31.6	Very low	145 Å²	145	144.2 Å²	144.2	88%	0.879	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.1	135.2	168.2	177	0	0	0	0	109.5
105	K	26.3	Very low	30	Very low	199 Å²	199	143.7 Å²	143.7	87%	0.865	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-80.6	125.2	-177.6	-61	176.1	-177.2	175.1	0	111.6
106	S	29.1	Very low	29.3	Very low	118 Å²	118	145.6 Å²	145.6	83%	0.825	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-88.3	135.7	158	48.6	0	0	0	0	110.4
107	P	34.3	Very low	29.3	Very low	117 Å²	117	147.9 Å²	147.9	76%	0.76	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-99.8	130.5	175.5	34.8	-29.7	0	0	0	112.2
108	L	30.9	Very low	29.2	Very low	175 Å²	175	150.5 Å²	150.5	92%	0.916	81%	0.814	S	S	*	*			trans	-169.6	135.4	150.6	-105	157.2	0	0	0	109
109	P	35.2	Very low	29.3	Very low	118 Å²	118	151 Å²	151	77%	0.766	81%	0.807	S	S	*	*			trans	-122.8	119.4	-164.4	36.4	-20	0	0	0	115.3
110	I	29.6	Very low	29.5	Very low	169 Å²	169	148.4 Å²	148.4	87%	0.867	80%	0.8	S	S	*	*			trans	-137.5	143.1	165.3	-63.1	-175	0	0	0	108.4
111	P	30.5	Very low	30.2	Very low	111 Å²	111	145.5 Å²	145.5	72%	0.721	80%	0.802	S	S	*	*			trans	-105.6	-160.6	-155.9	45.1	-37.9	0	0	0	113.5
112	P	35.7	Very low	30.9	Very low	122 Å²	122	142.1 Å²	142.1	79%	0.792	80%	0.798	S	S	*	*				-120.1	130.8	-93.3	34.1	-17.3	0	0	0	113.3
113	V	25.8	Very low	31.5	Very low	136 Å²	136	146.6 Å²	146.6	82%	0.824	80%	0.802	S	S	*	*			trans	-115.3	115.1	175.7	180	0	0	0	0	111.5
114	S	28.4	Very low	32.3	Very low	102 Å²	102	147.9 Å²	147.9	71%	0.713	80%	0.801	S	S	*	*			trans	29	106	151.1	-54.2	0	0	0	0	118.5	H116	S114-H116 PolarHBondContact O-N 3.12Å
115	S	26.1	Very low	33.1	Very low	119 Å²	119	147.2 Å²	147.2	83%	0.832	78%	0.782	S	S	*	*			trans	-39.3	113.7	171.6	52.4	0	0	0	0	115.5
116	H	28.4	Very low	34.2	Very low	173 Å²	173	139.9 Å²	139.9	80%	0.801	76%	0.756	S	S	*	*			trans	-122.6	138.1	156.1	-101.6	-83	0	0	0	111	S114 N118	S114-H116 PolarHBondContact O-N 3.12Å; H116-N118 PolarHBondContact O-N 3.14Å
117	Y	30.1	Very low	35.1	Very low	206 Å²	206	138.9 Å²	138.9	81%	0.808	75%	0.745	S	S	*	*			trans	-57.6	118.5	-163.8	-67.4	-101.2	0	0	0	114.5
118	N	29.2	Very low	35.7	Very low	161 Å²	161	143.8 Å²	143.8	86%	0.861	75%	0.75	S	S	*	*			trans	-131	55.8	165.3	-98.6	-49.2	0	0	0	109.5	H116 K120	H116-N118 PolarHBondContact O-N 3.14Å; N118-K120 PolarHBondContact O-N 2.86Å; N118-K120 VanDerWaalsContact O-N 3.07Å
119	E	31.4	Very low	36.6	Very low	148 Å²	148	140.1 Å²	140.1	69%	0.692	73%	0.728	S	S	*	*			trans	-68.9	104.8	177	-73.8	-156.4	128.8	0	0	111.1
120	K	32.4	Very low	37.3	Very low	170 Å²	170	137.3 Å²	137.3	74%	0.739	71%	0.711	S	S	*	*			trans	-61.9	130.4	161.7	-70.1	-176.1	176.3	-176.9	0	108.2	N118 S122	N118-K120 PolarHBondContact O-N 2.86Å; N118-K120 VanDerWaalsContact O-N 3.07Å; K120-S122 VanDerWaalsContact C-N 3.28Å; K120-S122 PolarHBondContact O-N 2.71Å; K120-S122 PolarHBondContact O-OG 3.02Å
121	P	39.1	Very low	38.4	Very low	141 Å²	141	133.6 Å²	133.6	92%	0.916	70%	0.696	S	S	*	*	S	Bend	trans	-75.6	75.5	-174	30.9	-36.4	0	0	0	111.9
122	S	38.1	Very low	39.4	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	68%	0.675	S	S	*	*			trans	-103.9	-3.8	-176.5	58.7	0	0	0	0	114.5	K120 K124	K120-S122 VanDerWaalsContact C-N 3.28Å; K120-S122 PolarHBondContact O-N 2.71Å; K120-S122 PolarHBondContact O-OG 3.02Å; S122-K124 PolarHBondContact O-N 2.66Å; S122-K124 VanDerWaalsContact O-N 3.11Å
123	R	41.7	Very low	40.4	Very low	196 Å²	196	128.2 Å²	128.2	74%	0.74	66%	0.656	S	S	*	*			trans	-70.9	106.2	173.3	-68.7	-168	-174.8	-157.4	3.6	110.1
124	K	45.9	Very low	41.8	Very low	174 Å²	174	127 Å²	127	76%	0.757	65%	0.645	S	S	*	*			trans	-54.2	143.6	164.1	-107.3	-179.4	174.9	-179.7	0	109.6	S122	S122-K124 PolarHBondContact O-N 2.66Å; S122-K124 VanDerWaalsContact O-N 3.11Å
125	W	46.3	Very low	43.1	Very low	131 Å²	131	125.9 Å²	125.9	50%	0.496	63%	0.634	S	S	.	*			trans	-56.6	143.8	176.6	171.9	93.5	0	0	0	111.4	V127	W125-V127 HydrophobicContact CH2-CG2 3.96Å; W125-V127 HydrophobicContact CZ2-CG2 4.49Å
126	S	50	Low	44.8	Very low	44 Å²	44	121.4 Å²	121.4	31%	0.308	61%	0.605	S	S	.	*			trans	-141.4	158.2	169.9	61.9	0	0	0	0	109.5	Y128 Q129	S126-Y128 PolarHBondContact O-N 3.34Å; S126-Y128 VanDerWaalsContact O-N 3.13Å; S126-Q129 PolarHBondContact O-N 3.29Å
127	V	47.9	Very low	46.2	Very low	97 Å²	97	114.2 Å²	114.2	59%	0.588	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-55	-33	-179.2	177.2	0	0	0	0	112	W125 Q129 S130	W125-V127 HydrophobicContact CH2-CG2 3.96Å; W125-V127 HydrophobicContact CZ2-CG2 4.49Å; V127-Q129 PolarHBondContact O-N 3.36Å; V127-S130 WeakPolarHBondContact O-CB 3.33Å; V127-S130 PolarHBondContact O-N 3.45Å; V127-S130 VanDerWaalsContact O-N 3.15Å; V127-S130 PolarHBondContact O-OG 3.04Å; V127-S130 VanDerWaalsContact O-OG 3.05Å
128	Y	46.4	Very low	47.3	Very low	221 Å²	221	110.7 Å²	110.7	87%	0.867	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-64.3	-4.4	177.5	-50.2	-69.4	0	0	0	115.3	S126	S126-Y128 PolarHBondContact O-N 3.34Å; S126-Y128 VanDerWaalsContact O-N 3.13Å
129	Q	51.1	Low	48.7	Very low	97 Å²	97	109.8 Å²	109.8	45%	0.453	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-113.7	11.9	179	-61.2	-177	-46.6	0	0	112.9	S126 V127 V131	S126-Q129 PolarHBondContact O-N 3.29Å; V127-Q129 PolarHBondContact O-N 3.36Å; Q129-V131 VanDerWaalsContact C-N 3.34Å; Q129-V131 PolarHBondContact O-N 3.13Å
130	S	48.5	Very low	50	Low	60 Å²	60	105.7 Å²	105.7	42%	0.42	55%	0.546	S	S	.	.			trans	-81.1	69.4	-174.9	71.7	0	0	0	0	113.7	V127 V132	V127-S130 WeakPolarHBondContact O-CB 3.33Å; V127-S130 PolarHBondContact O-N 3.45Å; V127-S130 VanDerWaalsContact O-N 3.15Å; V127-S130 PolarHBondContact O-OG 3.04Å; V127-S130 VanDerWaalsContact O-OG 3.05Å; S130-V132 PolarHBondContact O-N 3.19Å
131	V	52.8	Low	51.1	Low	90 Å²	90	101.4 Å²	101.4	55%	0.545	54%	0.535	S	S	.	.			trans	-73.4	80.4	158.8	-178	0	0	0	0	107.5	Q129 F149	Q129-V131 VanDerWaalsContact C-N 3.34Å; Q129-V131 PolarHBondContact O-N 3.13Å; V131-F149 HydrophobicContact CG1-CD2 4.4Å; V131-F149 HydrophobicContact CG1-CE2 3.83Å
132	V	52.6	Low	52	Low	45 Å²	45	100.6 Å²	100.6	27%	0.273	52%	0.523	S	S	.	.			trans	-141.1	120.9	-153.2	159.9	0	0	0	0	112.3	S130 L134 V137	S130-V132 PolarHBondContact O-N 3.19Å; V132-L134 PolarHBondContact O-N 3.18Å; V132-L134 VanDerWaalsContact O-N 3.09Å; V132-V137 HydrophobicContact CB-CG2 4.3Å; V132-V137 HydrophobicContact CG1-CB 3.6Å; V132-V137 HydrophobicContact CG1-CG1 4.25Å; V132-V137 HydrophobicContact CG1-CG2 3.59Å; V132-V137 HydrophobicContact CG2-CB 4.47Å; V132-V137 HydrophobicContact CG2-CG2 3.7Å
133	N	55.4	Low	52.8	Low	75 Å²	75	102.3 Å²	102.3	40%	0.401	51%	0.514	S	S	.	.			trans	-61.4	99	153.8	177.2	0.6	0	0	0	107.7	P135 A136 V137 I148	N133-P135 WeakPolarHBondContact OD1-CD 3.46Å; N133-A136 HydrophobicContact CB-CB 4.14Å; N133-A136 WeakPolarHBondContact O-CB 3.5Å; N133-A136 PolarHBondContact O-N 3.04Å; N133-V137 PolarHBondContact O-N 2.96Å; N133-I148 HydrophobicContact CB-CD1 3.86Å
134	L	55.8	Low	53.6	Low	112 Å²	112	99.6 Å²	99.6	59%	0.586	50%	0.504	S	S	*	.	H	α-helix	trans	-54.8	-44.6	-167.1	-171.3	68	0	0	0	113.9	V132 A136 V137 L138	V132-L134 PolarHBondContact O-N 3.18Å; V132-L134 VanDerWaalsContact O-N 3.09Å; L134-A136 VanDerWaalsContact C-N 3.29Å; L134-A136 PolarHBondContact O-N 3.44Å; L134-V137 PolarHBondContact O-N 3.48Å; L134-L138 HydrophobicContact CG-CD1 3.98Å; L134-L138 HydrophobicContact CG-CG 4.37Å; L134-L138 VanDerWaalsContact O-CG 3.31Å; L134-L138 WeakPolarHBondContact O-CG 3.25Å; L134-L138 PolarHBondContact O-N 3.28Å
135	P	57	Low	54.1	Low	77 Å²	77	94 Å²	94	50%	0.5	48%	0.48	S	S	.	.	H	α-helix	trans	-50.9	-41.4	169.4	-30.2	35.4	0	0	0	115	N133 V137 L138 N139	N133-P135 WeakPolarHBondContact OD1-CD 3.46Å; P135-V137 PolarHBondContact O-N 3.29Å; P135-L138 PolarHBondContact O-N 3.11Å; P135-N139 WeakPolarHBondContact O-CB 3.3Å; P135-N139 PolarHBondContact O-N 3.1Å; P135-N139 PolarHBondContact O-ND2 3.06Å
136	A	60.1	Low	54.7	Low	25 Å²	25	95 Å²	95	21%	0.207	49%	0.488	C	S	.	.	H	α-helix	trans	-67	-39.6	-176.1	0	0	0	0	0	112.6	N133 L134 N139 D140	N133-A136 HydrophobicContact CB-CB 4.14Å; N133-A136 WeakPolarHBondContact O-CB 3.5Å; N133-A136 PolarHBondContact O-N 3.04Å; L134-A136 VanDerWaalsContact C-N 3.29Å; L134-A136 PolarHBondContact O-N 3.44Å; A136-N139 PolarHBondContact O-N 3.1Å; A136-D140 PolarHBondContact O-N 3.2Å
137	V	58.4	Low	55.2	Low	23 Å²	23	97.4 Å²	97.4	14%	0.139	50%	0.498	C	S	.	.	H	α-helix	trans	-82	-24.3	178.4	163.5	0	0	0	0	113	V132 N133 L134 P135 N139 D140	V132-V137 HydrophobicContact CB-CG2 4.3Å; V132-V137 HydrophobicContact CG1-CB 3.6Å; V132-V137 HydrophobicContact CG1-CG1 4.25Å; V132-V137 HydrophobicContact CG1-CG2 3.59Å; V132-V137 HydrophobicContact CG2-CB 4.47Å; V132-V137 HydrophobicContact CG2-CG2 3.7Å; N133-V137 PolarHBondContact O-N 2.96Å; L134-V137 PolarHBondContact O-N 3.48Å; P135-V137 PolarHBondContact O-N 3.29Å; V137-N139 VanDerWaalsContact C-N 3.27Å; V137-D140 CarbonylContact O-C 3.55Å
138	L	52.9	Low	55.8	Low	131 Å²	131	94 Å²	94	69%	0.686	48%	0.476	S	S	*	.	H	α-helix	trans	-66.9	-31.6	165.9	-71.3	171.6	0	0	0	111.6	L134 P135	L134-L138 HydrophobicContact CG-CD1 3.98Å; L134-L138 HydrophobicContact CG-CG 4.37Å; L134-L138 VanDerWaalsContact O-CG 3.31Å; L134-L138 WeakPolarHBondContact O-CG 3.25Å; L134-L138 PolarHBondContact O-N 3.28Å; P135-L138 PolarHBondContact O-N 3.11Å
139	N	59.5	Low	56.5	Low	142 Å²	142	86.8 Å²	86.8	76%	0.759	45%	0.449	S	S	*	.	H	α-helix	trans	-83.5	-39.8	177.8	-68.1	-11.5	0	0	0	113.4	P135 A136 V137	P135-N139 WeakPolarHBondContact O-CB 3.3Å; P135-N139 PolarHBondContact O-N 3.1Å; P135-N139 PolarHBondContact O-ND2 3.06Å; A136-N139 PolarHBondContact O-N 3.1Å; V137-N139 VanDerWaalsContact C-N 3.27Å
140	D	58.4	Low	57.2	Low	63 Å²	63	84 Å²	84	34%	0.337	44%	0.439	S	S	.	.			trans	-147.5	111.7	168.1	178.6	9.5	0	0	0	111.9	A136 V137 N142 Y143	A136-D140 PolarHBondContact O-N 3.2Å; V137-D140 CarbonylContact O-C 3.55Å; D140-N142 PolarHBondContact O-N 3.12Å; D140-N142 VanDerWaalsContact O-N 3.09Å; D140-N142 WeakPolarHBondContact OD1-CB 3.31Å; D140-N142 PolarHBondContact OD1-N 3.31Å; D140-N142 PolarHBondContact OD1-ND2 3.03Å; D140-Y143 PolarHBondContact O-N 2.7Å; D140-Y143 VanDerWaalsContact O-N 3.15Å; D140-Y143 PolarHBondContact OD2-N 3.45Å
141	P	54.6	Low	57.7	Low	79 Å²	79	88.2 Å²	88.2	51%	0.513	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.6	175.6	-24.6	34.9	0	0	0	115.9
142	N	59.2	Low	57.8	Low	124 Å²	124	90 Å²	90	66%	0.663	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-25.4	177	-57.1	-68.2	0	0	0	112.8	D140	D140-N142 PolarHBondContact O-N 3.12Å; D140-N142 VanDerWaalsContact O-N 3.09Å; D140-N142 WeakPolarHBondContact OD1-CB 3.31Å; D140-N142 PolarHBondContact OD1-N 3.31Å; D140-N142 PolarHBondContact OD1-ND2 3.03Å
143	Y	54.2	Low	58	Low	142 Å²	142	95.6 Å²	95.6	56%	0.557	47%	0.471	S	S	*	.			trans	-76.2	124.9	176	-163.7	-99.9	0	0	0	110.5	D140 E145	D140-Y143 PolarHBondContact O-N 2.7Å; D140-Y143 VanDerWaalsContact O-N 3.15Å; D140-Y143 PolarHBondContact OD2-N 3.45Å; Y143-E145 HydrophobicContact CE1-CG 3.82Å
144	R	58.8	Low	58.2	Low	139 Å²	139	93.4 Å²	93.4	53%	0.525	47%	0.467	S	S	.	.			trans	-140.7	93.5	-169.4	-64.5	177	-166	169.4	8.6	111	K146	R144-K146 PolarHBondContact O-N 3.11Å
145	E	56.1	Low	58.6	Low	57 Å²	57	94 Å²	94	27%	0.266	47%	0.471	S	S	.	.			trans	-67.9	100.8	164.6	-64.5	-157.7	105.6	0	0	109.7	Y143 D147 I148 K151	Y143-E145 HydrophobicContact CE1-CG 3.82Å; E145-D147 VanDerWaalsContact C-N 3.33Å; E145-I148 HydrophobicContact CB-CD1 4.04Å; E145-I148 HydrophobicContact CB-CG1 3.62Å; E145-I148 VanDerWaalsContact O-CD1 3.26Å; E145-I148 WeakPolarHBondContact O-CD1 3.46Å; E145-I148 WeakPolarHBondContact O-CG1 3.43Å; E145-K151 IonicContact OE1-NZ 2.75Å; E145-K151 PolarHBondContact OE1-NZ 3Å
146	K	58.5	Low	58.8	Low	153 Å²	153	98 Å²	98	67%	0.665	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-22.2	174.7	-66.8	-176	178.8	-179.3	0	112.9	R144	R144-K146 PolarHBondContact O-N 3.11Å
147	D	60.7	Low	58.8	Low	94 Å²	94	99.6 Å²	99.6	50%	0.503	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	19.7	-170.5	-54.4	-59.6	0	0	0	113.1	E145 F149 T150 K151	E145-D147 VanDerWaalsContact C-N 3.33Å; D147-F149 VanDerWaalsContact C-N 3.31Å; D147-F149 PolarHBondContact O-N 3.19Å; D147-T150 WeakPolarHBondContact O-CB 3.5Å; D147-T150 PolarHBondContact O-N 3.26Å; D147-K151 PolarHBondContact O-N 3.24Å
148	I	60.3	Low	58.9	Low	26 Å²	26	100.8 Å²	100.8	13%	0.133	49%	0.487	C	S	.	.	H	α-helix	trans	-49.1	-51.4	178.9	-68.5	164.2	0	0	0	111	N133 E145 K151 L152	N133-I148 HydrophobicContact CB-CD1 3.86Å; E145-I148 HydrophobicContact CB-CD1 4.04Å; E145-I148 HydrophobicContact CB-CG1 3.62Å; E145-I148 VanDerWaalsContact O-CD1 3.26Å; E145-I148 WeakPolarHBondContact O-CD1 3.46Å; E145-I148 WeakPolarHBondContact O-CG1 3.43Å; I148-K151 PolarHBondContact O-N 3.28Å; I148-L152 HydrophobicContact CG2-CD1 3.76Å; I148-L152 WeakPolarHBondContact O-CB 3.44Å; I148-L152 PolarHBondContact O-N 3.14Å
149	F	61.1	Low	59.3	Low	68 Å²	68	99.8 Å²	99.8	30%	0.298	48%	0.482	S	S	.	.	H	α-helix	trans	-70.4	-32.5	179.6	-63.5	-59.7	0	0	0	113	V131 D147 L152 W153 F157	V131-F149 HydrophobicContact CG1-CD2 4.4Å; V131-F149 HydrophobicContact CG1-CE2 3.83Å; D147-F149 VanDerWaalsContact C-N 3.31Å; D147-F149 PolarHBondContact O-N 3.19Å; F149-L152 PolarHBondContact O-N 3.44Å; F149-W153 HydrophobicContact CB-CE3 4.13Å; F149-W153 HydrophobicContact CB-CZ3 4.4Å; F149-W153 HydrophobicContact CD1-CD2 4.23Å; F149-W153 HydrophobicContact CD1-CE3 4.01Å; F149-W153 AromaticContact CD1-CH2 3.6Å; F149-W153 HydrophobicContact CD1-CH2 3.6Å; F149-W153 AromaticContact CD1-CZ2 3.82Å; F149-W153 HydrophobicContact CD1-CZ2 3.82Å; F149-W153 AromaticContact CD1-CZ3 3.7Å; F149-W153 HydrophobicContact CD1-CZ3 3.7Å; F149-W153 AromaticContact CE1-CH2 3.74Å; F149-W153 HydrophobicContact CE1-CH2 3.74Å; F149-W153 HydrophobicContact CE1-CZ2 4Å; F149-W153 HydrophobicContact CE1-CZ3 4.23Å; F149-W153 HydrophobicContact CG-CE3 4.36Å; F149-W153 HydrophobicContact CG-CH2 4.49Å; F149-W153 HydrophobicContact CG-CZ3 4.18Å; F149-W153 WeakPolarHBondContact O-CA 3.46Å; F149-W153 WeakPolarHBondContact O-CB 3.29Å; F149-W153 PolarHBondContact O-N 3.39Å; F149-F157 HydrophobicContact CB-CD1 3.53Å; F149-F157 HydrophobicContact CB-CD2 4.43Å; F149-F157 HydrophobicContact CB-CE1 3.3Å; F149-F157 HydrophobicContact CB-CE2 4.24Å; F149-F157 HydrophobicContact CB-CG 4.1Å; F149-F157 HydrophobicContact CB-CZ 3.69Å; F149-F157 HydrophobicContact CD2-CE1 4.17Å; F149-F157 HydrophobicContact CD2-CZ 4.08Å; F149-F157 HydrophobicContact CG-CE1 4.09Å; F149-F157 HydrophobicContact CG-CZ 4.07Å
150	T	65.7	Low	59.4	Low	38 Å²	38	95.1 Å²	95.1	23%	0.233	46%	0.463	C	S	.	.	H	α-helix	trans	-66.8	-38	174.5	-33.6	0	0	0	0	111.1	D147 G154	D147-T150 WeakPolarHBondContact O-CB 3.5Å; D147-T150 PolarHBondContact O-N 3.26Å; T150-G154 CarbonylContact O-C 3.5Å; T150-G154 WeakPolarHBondContact O-CA 3.43Å; T150-G154 PolarHBondContact O-N 3.38Å
151	K	59.3	Low	59.5	Low	150 Å²	150	100.4 Å²	100.4	65%	0.652	49%	0.486	S	S	*	.	H	α-helix	trans	-67.2	-44	172.1	-70.9	-178.5	175.5	-174.5	0	112.4	E145 D147 I148	E145-K151 IonicContact OE1-NZ 2.75Å; E145-K151 PolarHBondContact OE1-NZ 3Å; D147-K151 PolarHBondContact O-N 3.24Å; I148-K151 PolarHBondContact O-N 3.28Å
152	L	54.6	Low	59.7	Low	126 Å²	126	103 Å²	103	66%	0.66	50%	0.5	S	S	*	.	H	α-helix	trans	-79.3	-33.9	-174.4	-88.4	157.1	0	0	0	114.4	I148 F149	I148-L152 HydrophobicContact CG2-CD1 3.76Å; I148-L152 WeakPolarHBondContact O-CB 3.44Å; I148-L152 PolarHBondContact O-N 3.14Å; F149-L152 PolarHBondContact O-N 3.44Å
153	W	58.4	Low	59.7	Low	163 Å²	163	104 Å²	104	62%	0.617	50%	0.504	S	S	*	.	H	α-helix	trans	-116.9	2	-174.6	-55.1	-21.8	0	0	0	113.1	F149 F157	F149-W153 HydrophobicContact CB-CE3 4.13Å; F149-W153 HydrophobicContact CB-CZ3 4.4Å; F149-W153 HydrophobicContact CD1-CD2 4.23Å; F149-W153 HydrophobicContact CD1-CE3 4.01Å; F149-W153 AromaticContact CD1-CH2 3.6Å; F149-W153 HydrophobicContact CD1-CH2 3.6Å; F149-W153 AromaticContact CD1-CZ2 3.82Å; F149-W153 HydrophobicContact CD1-CZ2 3.82Å; F149-W153 AromaticContact CD1-CZ3 3.7Å; F149-W153 HydrophobicContact CD1-CZ3 3.7Å; F149-W153 AromaticContact CE1-CH2 3.74Å; F149-W153 HydrophobicContact CE1-CH2 3.74Å; F149-W153 HydrophobicContact CE1-CZ2 4Å; F149-W153 HydrophobicContact CE1-CZ3 4.23Å; F149-W153 HydrophobicContact CG-CE3 4.36Å; F149-W153 HydrophobicContact CG-CH2 4.49Å; F149-W153 HydrophobicContact CG-CZ3 4.18Å; F149-W153 WeakPolarHBondContact O-CA 3.46Å; F149-W153 WeakPolarHBondContact O-CB 3.29Å; F149-W153 PolarHBondContact O-N 3.39Å; W153-F157 HydrophobicContact CB-CB 4.34Å; W153-F157 AromaticContact CE3-CD2 3.53Å; W153-F157 HydrophobicContact CE3-CD2 3.53Å; W153-F157 AromaticContact CE3-CE2 3.74Å; W153-F157 HydrophobicContact CE3-CE2 3.74Å; W153-F157 HydrophobicContact CE3-CG 4.21Å; W153-F157 AromaticContact CZ3-CD2 4Å; W153-F157 HydrophobicContact CZ3-CD2 4Å; W153-F157 AromaticContact CZ3-CE2 3.7Å; W153-F157 HydrophobicContact CZ3-CE2 3.7Å; W153-F157 HydrophobicContact CZ3-CZ 4.43Å
154	G	59.3	Low	59.9	Low	30 Å²	30	102.7 Å²	102.7	31%	0.309	51%	0.513	S	S	.	.			trans	75.3	177.3	174.7	0	0	0	0	0	115.1	T150 K156 F157	T150-G154 CarbonylContact O-C 3.5Å; T150-G154 WeakPolarHBondContact O-CA 3.43Å; T150-G154 PolarHBondContact O-N 3.38Å; G154-K156 PolarHBondContact O-N 3.2Å; G154-F157 WeakPolarHBondContact O-CB 3.45Å; G154-F157 PolarHBondContact O-N 2.77Å
155	D	64	Low	59.6	Low	123 Å²	123	98.6 Å²	98.6	66%	0.658	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-8.4	-176.2	-66.3	-3.7	0	0	0	115.6	F157 R379	D155-F157 VanDerWaalsContact C-N 3.31Å; D155-R379 PolarHBondContact O-NH1 3.45Å
156	K	60.3	Low	60.2	Low	163 Å²	163	101.5 Å²	101.5	71%	0.709	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-15.7	172.6	-65.9	-173.9	-179.7	179.6	0	112.8	G154 N383	G154-K156 PolarHBondContact O-N 3.2Å; K156-N383 PolarHBondContact O-ND2 2.95Å
157	F	60.7	Low	60.5	Low	58 Å²	58	102.2 Å²	102.2	25%	0.254	54%	0.535	S	S	.	.			trans	-72.1	131.3	174.3	-178.1	-109	0	0	0	111.4	F149 W153 G154 D155 N159	F149-F157 HydrophobicContact CB-CD1 3.53Å; F149-F157 HydrophobicContact CB-CD2 4.43Å; F149-F157 HydrophobicContact CB-CE1 3.3Å; F149-F157 HydrophobicContact CB-CE2 4.24Å; F149-F157 HydrophobicContact CB-CG 4.1Å; F149-F157 HydrophobicContact CB-CZ 3.69Å; F149-F157 HydrophobicContact CD2-CE1 4.17Å; F149-F157 HydrophobicContact CD2-CZ 4.08Å; F149-F157 HydrophobicContact CG-CE1 4.09Å; F149-F157 HydrophobicContact CG-CZ 4.07Å; W153-F157 HydrophobicContact CB-CB 4.34Å; W153-F157 AromaticContact CE3-CD2 3.53Å; W153-F157 HydrophobicContact CE3-CD2 3.53Å; W153-F157 AromaticContact CE3-CE2 3.74Å; W153-F157 HydrophobicContact CE3-CE2 3.74Å; W153-F157 HydrophobicContact CE3-CG 4.21Å; W153-F157 AromaticContact CZ3-CD2 4Å; W153-F157 HydrophobicContact CZ3-CD2 4Å; W153-F157 AromaticContact CZ3-CE2 3.7Å; W153-F157 HydrophobicContact CZ3-CE2 3.7Å; W153-F157 HydrophobicContact CZ3-CZ 4.43Å; G154-F157 WeakPolarHBondContact O-CB 3.45Å; G154-F157 PolarHBondContact O-N 2.77Å; D155-F157 VanDerWaalsContact C-N 3.31Å; F157-N159 WeakPolarHBondContact CE1-OD1 3.38Å
158	E	61.6	Low	60.5	Low	47 Å²	47	103.7 Å²	103.7	22%	0.22	54%	0.542	C	S	.	.			trans	-120.1	128.9	173.8	-175.8	-177.2	-160.3	0	0	108.9	A160 R376 R380	E158-A160 PolarHBondContact O-N 3.04Å; E158-R376 WeakPolarHBondContact OE1-CB 3.4Å; E158-R380 WeakPolarHBondContact OE2-CB 3.38Å; E158-R380 WeakPolarHBondContact OE2-CD 3.41Å; E158-R380 WeakPolarHBondContact OE2-CG 3.38Å
159	N	61.1	Low	60.8	Low	111 Å²	111	107.3 Å²	107.3	59%	0.594	57%	0.568	S	S	*	*			trans	-69.2	77.2	167	-81.4	-50	0	0	0	109.7	F157	F157-N159 WeakPolarHBondContact CE1-OD1 3.38Å
160	A	61.7	Low	61.1	Low	43 Å²	43	109.6 Å²	109.6	36%	0.355	59%	0.587	S	S	.	*			trans	-85.1	132.2	-178.3	0	0	0	0	0	111.5	E158 V162	E158-A160 PolarHBondContact O-N 3.04Å; A160-V162 PolarHBondContact O-N 3.1Å
161	E	58.7	Low	61.2	Low	174 Å²	174	113.2 Å²	113.2	81%	0.813	60%	0.604	S	S	*	*			trans	-61.8	125.9	162.9	-68.3	179.4	171.5	0	0	109.6	R380	E161-R380 PolarHBondContact O-NH2 3.4Å
162	V	59.3	Low	62	Low	134 Å²	134	108.9 Å²	108.9	81%	0.812	59%	0.59	S	S	*	*			trans	-87.2	115.2	176.7	-179.2	0	0	0	0	107.7	A160	A160-V162 PolarHBondContact O-N 3.1Å
163	L	59.9	Low	62.8	Low	144 Å²	144	110 Å²	110	75%	0.754	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-63.8	137.3	175	-67.7	168.2	0	0	0	109.7	S165	L163-S165 PolarHBondContact O-N 3.11Å
164	P	57.4	Low	63.6	Low	115 Å²	115	110 Å²	110	75%	0.747	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-62.8	132.3	-179.9	25.6	-33.7	0	0	0	110.8
165	S	53	Low	64.5	Low	53 Å²	53	114.2 Å²	114.2	37%	0.371	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-71.7	129.1	179	177.9	0	0	0	0	110.8	L163 H167 L168	L163-S165 PolarHBondContact O-N 3.11Å; S165-H167 PolarHBondContact O-N 3.25Å; S165-H167 PolarHBondContact OG-N 3.4Å; S165-L168 PolarHBondContact O-N 2.97Å
166	P	68.6	Low	65.1	Low	119 Å²	119	113.2 Å²	113.2	77%	0.773	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-12.6	176.1	30.2	-35.9	0	0	0	113.1
167	H	64.3	Low	66.1	Low	168 Å²	168	109.6 Å²	109.6	78%	0.778	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-3.5	179.8	-55.1	-64.4	0	0	0	113.7	S165	S165-H167 PolarHBondContact O-N 3.25Å; S165-H167 PolarHBondContact OG-N 3.4Å
168	L	62.1	Low	66.8	Low	124 Å²	124	113.1 Å²	113.1	65%	0.649	60%	0.602	S	S	*	*	S	Bend	trans	-108.5	125.8	177	-66.6	176.7	0	0	0	109.6	S165 V170	S165-L168 PolarHBondContact O-N 2.97Å; L168-V170 PolarHBondContact O-N 3.47Å
169	P	66.2	Low	67.3	Low	102 Å²	102	118.2 Å²	118.2	66%	0.662	62%	0.62	S	S	*	*			trans	-63.2	134.7	176.2	27	-33.8	0	0	0	109.8	I171	P169-I171 WeakPolarHBondContact O-CG1 3.05Å; P169-I171 PolarHBondContact O-N 3.32Å
170	V	67.6	Low	67.8	Low	116 Å²	116	116.4 Å²	116.4	70%	0.703	61%	0.61	S	S	*	*			trans	-68.2	100.6	-179.5	-178.5	0	0	0	0	109.1	L168 T172 H175	L168-V170 PolarHBondContact O-N 3.47Å; V170-T172 HydrophobicContact CG1-CG2 4.14Å; V170-T172 PolarHBondContact O-N 3.17Å; V170-T172 VanDerWaalsContact O-N 3.07Å; V170-H175 PolarHBondContact O-CE1 3.34Å
171	I	68.1	Low	68.4	Low	115 Å²	115	120 Å²	120	59%	0.59	62%	0.623	S	S	*	*			trans	-74.3	103	-178.4	-47	-176.1	0	0	0	109	P169 H175 F176	P169-I171 WeakPolarHBondContact O-CG1 3.05Å; P169-I171 PolarHBondContact O-N 3.32Å; I171-H175 HydrophobicContact CG2-CB 4.28Å; I171-F176 HydrophobicContact CG2-CD2 4.47Å; I171-F176 HydrophobicContact CG2-CE2 3.53Å; I171-F176 HydrophobicContact CG2-CZ 3.84Å
172	T	74.8	Confident	69	Low	59 Å²	59	118.8 Å²	118.8	36%	0.362	62%	0.616	S	S	.	*			trans	-96.4	164.2	176.5	67.3	0	0	0	0	111.3	V170 K174 H175	V170-T172 HydrophobicContact CG1-CG2 4.14Å; V170-T172 PolarHBondContact O-N 3.17Å; V170-T172 VanDerWaalsContact O-N 3.07Å; T172-K174 PolarHBondContact O-N 3.33Å; T172-H175 PolarHBondContact O-N 3.44Å
173	E	71.3	Confident	69.2	Low	149 Å²	149	116.2 Å²	116.2	70%	0.696	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-51.6	-27.7	174.9	-171.9	172.8	-165.5	0	0	113.1	H175 F176 I177 L180	E173-H175 PolarHBondContact O-N 3.42Å; E173-F176 WeakPolarHBondContact O-CA 3.44Å; E173-F176 PolarHBondContact O-N 2.95Å; E173-I177 PolarHBondContact O-N 3.12Å; E173-L180 HydrophobicContact CG-CD1 4.08Å
174	K	75.1	Confident	69.1	Low	162 Å²	162	111.1 Å²	111.1	70%	0.704	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-56	-35.3	175.5	-64.9	-172.6	176.8	-175.8	0	113.4	T172 F176 I177	T172-K174 PolarHBondContact O-N 3.33Å; K174-F176 PolarHBondContact O-N 3.03Å; K174-I177 HydrophobicContact CB-CD1 4.31Å; K174-I177 HydrophobicContact CG-CD1 4.41Å; K174-I177 PolarHBondContact O-N 3.17Å
175	H	79	Confident	68.8	Low	120 Å²	120	111.7 Å²	111.7	56%	0.556	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-72.4	-14.6	178.3	-53.7	156.8	0	0	0	112.8	V170 I171 T172 E173	V170-H175 PolarHBondContact O-CE1 3.34Å; I171-H175 HydrophobicContact CG2-CB 4.28Å; T172-H175 PolarHBondContact O-N 3.44Å; E173-H175 PolarHBondContact O-N 3.42Å
176	F	77.1	Confident	68.5	Low	102 Å²	102	119.8 Å²	119.8	45%	0.447	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-103.3	-1.3	178.8	-62.8	-74.2	0	0	0	113.5	I171 E173 K174 E178 Y179 L180	I171-F176 HydrophobicContact CG2-CD2 4.47Å; I171-F176 HydrophobicContact CG2-CE2 3.53Å; I171-F176 HydrophobicContact CG2-CZ 3.84Å; E173-F176 WeakPolarHBondContact O-CA 3.44Å; E173-F176 PolarHBondContact O-N 2.95Å; K174-F176 PolarHBondContact O-N 3.03Å; F176-E178 VanDerWaalsContact C-N 3.29Å; F176-E178 PolarHBondContact O-N 3.01Å; F176-Y179 WeakPolarHBondContact O-CB 3.36Å; F176-Y179 PolarHBondContact O-N 3.27Å; F176-L180 HydrophobicContact CB-CD1 4.16Å; F176-L180 HydrophobicContact CB-CG 4.3Å; F176-L180 WeakPolarHBondContact O-CB 3.3Å; F176-L180 WeakPolarHBondContact O-CG 3.47Å; F176-L180 PolarHBondContact O-N 2.98Å
177	I	80.2	Confident	67.2	Low	86 Å²	86	121.8 Å²	121.8	44%	0.441	60%	0.599	S	S	.	*	H	α-helix	trans	-54	-43.7	-177.1	-71.4	171.6	0	0	0	111.9	E173 K174 Y179 L180 N181	E173-I177 PolarHBondContact O-N 3.12Å; K174-I177 HydrophobicContact CB-CD1 4.31Å; K174-I177 HydrophobicContact CG-CD1 4.41Å; K174-I177 PolarHBondContact O-N 3.17Å; I177-Y179 VanDerWaalsContact C-N 3.34Å; I177-Y179 PolarHBondContact O-N 3.24Å; I177-L180 PolarHBondContact O-N 3.06Å; I177-N181 WeakPolarHBondContact O-CB 3.5Å; I177-N181 PolarHBondContact O-N 2.91Å; I177-N181 PolarHBondContact O-ND2 2.97Å; I177-N181 PolarHBondContact O-OD1 2.99Å
178	E	75	Confident	66	Low	132 Å²	132	121 Å²	121	62%	0.617	60%	0.6	S	S	*	*	H	α-helix	trans	-65.5	-36.7	179.8	-156.1	-153.4	132.1	0	0	112.6	F176 K182	F176-E178 VanDerWaalsContact C-N 3.29Å; F176-E178 PolarHBondContact O-N 3.01Å; E178-K182 WeakPolarHBondContact O-CG 3.39Å; E178-K182 PolarHBondContact O-N 3.47Å; E178-K182 IonicContact OE1-NZ 2.67Å; E178-K182 PolarHBondContact OE1-NZ 3.49Å
179	Y	73.6	Confident	64.9	Low	154 Å²	154	122.4 Å²	122.4	60%	0.604	61%	0.608	S	S	*	*	H	α-helix	trans	-71.1	-44	175.9	179.6	-105.4	0	0	0	111.6	F176 I177 N181 K182 I183	F176-Y179 WeakPolarHBondContact O-CB 3.36Å; F176-Y179 PolarHBondContact O-N 3.27Å; I177-Y179 VanDerWaalsContact C-N 3.34Å; I177-Y179 PolarHBondContact O-N 3.24Å; Y179-N181 PolarHBondContact O-N 3.35Å; Y179-K182 PolarHBondContact O-N 3.38Å; Y179-I183 HydrophobicContact CD1-CD1 3.78Å; Y179-I183 HydrophobicContact CD2-CD1 4.18Å; Y179-I183 HydrophobicContact CE1-CD1 3.4Å; Y179-I183 VanDerWaalsContact CE1-CD1 3.4Å; Y179-I183 HydrophobicContact CE2-CD1 3.84Å; Y179-I183 HydrophobicContact CG-CD1 4.16Å; Y179-I183 VanDerWaalsContact CZ-CD1 3.44Å; Y179-I183 WeakPolarHBondContact O-CD1 3.37Å; Y179-I183 WeakPolarHBondContact O-CG1 3.4Å; Y179-I183 PolarHBondContact O-N 3.42Å
180	L	71.6	Confident	63.6	Low	73 Å²	73	123.1 Å²	123.1	38%	0.382	61%	0.611	S	S	.	*	H	α-helix	trans	-62.6	-42	176.3	-69	169	0	0	0	111.4	E173 F176 I177 K182 I183 G184	E173-L180 HydrophobicContact CG-CD1 4.08Å; F176-L180 HydrophobicContact CB-CD1 4.16Å; F176-L180 HydrophobicContact CB-CG 4.3Å; F176-L180 WeakPolarHBondContact O-CB 3.3Å; F176-L180 WeakPolarHBondContact O-CG 3.47Å; F176-L180 PolarHBondContact O-N 2.98Å; I177-L180 PolarHBondContact O-N 3.06Å; L180-K182 VanDerWaalsContact C-N 3.32Å; L180-K182 PolarHBondContact O-N 3.06Å; L180-I183 PolarHBondContact O-N 3.07Å; L180-I183 VanDerWaalsContact O-N 3.09Å; L180-G184 PolarHBondContact O-N 3.41Å
181	N	74.2	Confident	62.2	Low	118 Å²	118	125.4 Å²	125.4	63%	0.631	61%	0.613	S	S	*	*	H	α-helix	trans	-62	-37.9	176	-72.9	-8.5	0	0	0	112.2	I177 Y179 I183	I177-N181 WeakPolarHBondContact O-CB 3.5Å; I177-N181 PolarHBondContact O-N 2.91Å; I177-N181 PolarHBondContact O-ND2 2.97Å; I177-N181 PolarHBondContact O-OD1 2.99Å; Y179-N181 PolarHBondContact O-N 3.35Å; N181-I183 PolarHBondContact O-N 3.33Å
182	K	70.5	Confident	60.6	Low	150 Å²	150	125.1 Å²	125.1	65%	0.652	62%	0.622	S	S	*	*	H	α-helix	trans	-66.4	-16.5	174.9	-79.1	167.1	172.4	164.2	0	114.1	E178 Y179 L180	E178-K182 WeakPolarHBondContact O-CG 3.39Å; E178-K182 PolarHBondContact O-N 3.47Å; E178-K182 IonicContact OE1-NZ 2.67Å; E178-K182 PolarHBondContact OE1-NZ 3.49Å; Y179-K182 PolarHBondContact O-N 3.38Å; L180-K182 VanDerWaalsContact C-N 3.32Å; L180-K182 PolarHBondContact O-N 3.06Å
183	I	64.8	Low	58.4	Low	79 Å²	79	128.3 Å²	128.3	41%	0.405	65%	0.645	S	S	.	*	H	α-helix	trans	-111.9	-24	-176.7	-57.4	162.9	0	0	0	112.1	Y179 L180 N181 V185 R186	Y179-I183 HydrophobicContact CD1-CD1 3.78Å; Y179-I183 HydrophobicContact CD2-CD1 4.18Å; Y179-I183 HydrophobicContact CE1-CD1 3.4Å; Y179-I183 VanDerWaalsContact CE1-CD1 3.4Å; Y179-I183 HydrophobicContact CE2-CD1 3.84Å; Y179-I183 HydrophobicContact CG-CD1 4.16Å; Y179-I183 VanDerWaalsContact CZ-CD1 3.44Å; Y179-I183 WeakPolarHBondContact O-CD1 3.37Å; Y179-I183 WeakPolarHBondContact O-CG1 3.4Å; Y179-I183 PolarHBondContact O-N 3.42Å; L180-I183 PolarHBondContact O-N 3.07Å; L180-I183 VanDerWaalsContact O-N 3.09Å; N181-I183 PolarHBondContact O-N 3.33Å; I183-V185 PolarHBondContact O-N 3.46Å; I183-R186 PolarHBondContact O-N 2.66Å
184	G	56.3	Low	56.4	Low	38 Å²	38	131.6 Å²	131.6	39%	0.392	65%	0.651	S	S	.	*	G	3₁₀ helix	trans	-57.6	-18.2	-170.1	0	0	0	0	0	116.3	L180 R186 K187	L180-G184 PolarHBondContact O-N 3.41Å; G184-R186 PolarHBondContact O-N 3.42Å; G184-R186 VanDerWaalsContact O-N 3.09Å; G184-K187 VanDerWaalsContact O-CB 3.3Å; G184-K187 WeakPolarHBondContact O-CB 3.49Å; G184-K187 PolarHBondContact O-N 3.15Å
185	V	51.5	Low	54.2	Low	126 Å²	126	128.7 Å²	128.7	76%	0.764	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-52	-31	174.4	-176.1	0	0	0	0	112.4	I183 K187	I183-V185 PolarHBondContact O-N 3.46Å; V185-K187 VanDerWaalsContact C-N 3.3Å; V185-K187 PolarHBondContact O-N 3.09Å
186	R	46.4	Very low	51.8	Low	224 Å²	224	128.9 Å²	128.9	85%	0.845	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-81.5	5.9	179.7	-60.1	-170.8	-175.5	-174.4	2.3	115.4	I183 G184	I183-R186 PolarHBondContact O-N 2.66Å; G184-R186 PolarHBondContact O-N 3.42Å; G184-R186 VanDerWaalsContact O-N 3.09Å
187	K	41.8	Very low	49.8	Very low	161 Å²	161	129.5 Å²	129.5	70%	0.7	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-99.6	-8	-168.9	-152.2	-178.7	177.8	-172.5	0	115.2	G184 V185	G184-K187 VanDerWaalsContact O-CB 3.3Å; G184-K187 WeakPolarHBondContact O-CB 3.49Å; G184-K187 PolarHBondContact O-N 3.15Å; V185-K187 VanDerWaalsContact C-N 3.3Å; V185-K187 PolarHBondContact O-N 3.09Å
188	L	39.6	Very low	47.2	Very low	151 Å²	151	131.5 Å²	131.5	79%	0.791	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-76.2	-33.4	-171.1	-101.8	149.8	0	0	0	114.6	T190	L188-T190 VanDerWaalsContact C-N 3.31Å; L188-T190 PolarHBondContact O-N 2.79Å
189	D	38.5	Very low	44.7	Very low	154 Å²	154	131.9 Å²	131.9	82%	0.824	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-79.5	-3.2	-166.7	-58.7	-38.1	0	0	0	115.4
190	T	39.4	Very low	42.3	Very low	117 Å²	117	131.5 Å²	131.5	72%	0.718	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-104.7	-4	-166	-16.2	0	0	0	0	116.3	L188	L188-T190 VanDerWaalsContact C-N 3.31Å; L188-T190 PolarHBondContact O-N 2.79Å
191	E	37.4	Very low	40.1	Very low	163 Å²	163	134.4 Å²	134.4	76%	0.762	73%	0.726	S	S	*	*	S	Bend	trans	-102.9	-10.3	-173	-59.4	-154.7	139.6	0	0	115.3	C193	E191-C193 PolarHBondContact O-N 3.47Å; E191-C193 VanDerWaalsContact O-N 3.1Å
192	S	34.6	Very low	37.6	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	74%	0.736	S	S	*	*	S	Bend	trans	-68.9	-8.3	-174.3	-158.1	0	0	0	0	115.8
193	C	28.8	Very low	35.4	Very low	126 Å²	126	134.4 Å²	134.4	85%	0.851	74%	0.742	S	S	*	*	S	Bend	trans	-103.7	41.3	-172.5	-67.1	0	0	0	0	114.6	E191	E191-C193 PolarHBondContact O-N 3.47Å; E191-C193 VanDerWaalsContact O-N 3.1Å
194	R	28.8	Very low	33.3	Very low	217 Å²	217	135.1 Å²	135.1	82%	0.819	75%	0.754	S	S	*	*			trans	-139.2	50.5	175.2	-68.8	-162.3	-167.9	135.8	18	115.1
195	S	28.9	Very low	31.8	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	78%	0.777	S	S	*	*			trans	-149.6	87.5	176.9	54.9	0	0	0	0	114
196	S	29.3	Very low	30.4	Very low	123 Å²	123	140 Å²	140	86%	0.86	78%	0.775	S	S	*	*			trans	-159.8	116.1	156.4	-88.7	0	0	0	0	110.1
197	P	35	Very low	29.4	Very low	116 Å²	116	135 Å²	135	75%	0.753	77%	0.769	S	S	*	*			trans	-102.2	-172.9	178.7	39.6	-34.7	0	0	0	113.3
198	N	25.1	Very low	28.6	Very low	127 Å²	127	134.1 Å²	134.1	68%	0.679	78%	0.777	S	S	*	*			trans	76.3	97.7	169.6	-63.6	-13.9	0	0	0	118.7
199	C	23	Very low	27.9	Very low	140 Å²	140	133.7 Å²	133.7	95%	0.946	78%	0.775	S	S	*	*				-125.6	144.2	129	-86.6	0	0	0	0	107.7
200	Q	23.6	Very low	27.4	Very low	146 Å²	146	134.1 Å²	134.1	68%	0.682	78%	0.776	S	S	*	*			trans	-132	133.7	-168.7	-77.8	-171.8	-5.6	0	0	113.6
201	I	23.8	Very low	26.7	Very low	134 Å²	134	133.5 Å²	133.5	69%	0.687	78%	0.776	S	S	*	*			trans	71.5	142.8	133.8	-64.5	170.9	0	0	0	119.2
202	N	21.9	Very low	26.1	Very low	158 Å²	158	133.7 Å²	133.7	85%	0.845	78%	0.782	S	S	*	*			trans	69.7	151.6	174.6	-64.1	-20.6	0	0	0	116.5
203	S	24.1	Very low	25.9	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	78%	0.782	S	S	*	*			cis	-136.4	170.4	10.5	59.4	0	0	0	0	114.2
204	S	21.5	Very low	25.8	Very low	94 Å²	94	134.6 Å²	134.6	66%	0.657	78%	0.783	S	S	*	*			trans	-74.1	160.4	165	53.1	0	0	0	0	112.5
205	N	24.9	Very low	25.7	Very low	164 Å²	164	133.1 Å²	133.1	88%	0.877	78%	0.783	S	S	*	*				-172.4	171.9	126	-95.5	-1.6	0	0	0	112.9
206	S	22.9	Very low	25.7	Very low	102 Å²	102	133.5 Å²	133.5	71%	0.713	79%	0.786	S	S	*	*			trans	-123.5	152.3	-158.5	53.8	0	0	0	0	114.7
207	V	24.5	Very low	25.5	Very low	120 Å²	120	133.7 Å²	133.7	73%	0.727	79%	0.787	S	S	*	*			trans	50.7	121	146.8	178.5	0	0	0	0	119.2
208	T	25.9	Very low	25.1	Very low	141 Å²	141	136 Å²	136	87%	0.865	79%	0.793	S	S	*	*			trans	-142.8	114.1	145	52.8	0	0	0	0	110.2
209	D	24.4	Very low	25.3	Very low	142 Å²	142	140.2 Å²	140.2	76%	0.759	81%	0.805	S	S	*	*			trans	-85.2	-153.7	162.8	-73.4	-68.6	0	0	0	110.4
210	I	27.2	Very low	25.4	Very low	163 Å²	163	139.6 Å²	139.6	84%	0.836	80%	0.796	S	S	*	*			trans	95.4	127.4	171.5	-56.7	166.7	0	0	0	114.5
211	S	25.1	Very low	25.4	Very low	104 Å²	104	139.7 Å²	139.7	73%	0.727	80%	0.801	S	S	*	*			cis	-163.4	168.4	-21.3	58.9	0	0	0	0	110.8
212	L	24.3	Very low	25.7	Very low	167 Å²	167	141.9 Å²	141.9	87%	0.874	81%	0.805	S	S	*	*			trans	-142	137.8	165	-77.3	172.9	0	0	0	109.9
213	S	31.1	Very low	25.7	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	80%	0.8	S	S	*	*				148.5	133.5	127.3	62.8	0	0	0	0	116.3
214	V	27.4	Very low	25.9	Very low	146 Å²	146	143.4 Å²	143.4	89%	0.885	80%	0.8	S	S	*	*			trans	63	158.6	133.2	-179.3	0	0	0	0	120.3
215	K	25.7	Very low	26.6	Very low	186 Å²	186	144.3 Å²	144.3	81%	0.809	80%	0.804	S	S	*	*			trans	-106.1	144	-168.3	-62.4	178.2	178.3	178.5	0	113.7
216	S	30	Very low	26.7	Very low	111 Å²	111	140.9 Å²	140.9	78%	0.776	79%	0.792	S	S	*	*			trans	43	119.1	134.3	-50.3	0	0	0	0	121.2
217	S	24.8	Very low	27.3	Very low	126 Å²	126	143.8 Å²	143.8	88%	0.881	80%	0.799	S	S	*	*			trans	-158.3	138.7	139.7	-84.8	0	0	0	0	111.5
218	N	26	Very low	27.9	Very low	164 Å²	164	144.4 Å²	144.4	88%	0.877	80%	0.798	S	S	*	*			trans	-96.6	145	177.5	-70.3	-18.7	0	0	0	111.3
219	K	29	Very low	29	Very low	216 Å²	216	142 Å²	142	94%	0.939	78%	0.779	S	S	*	*			trans	-154.8	155.2	154	-111.3	168.7	-174.6	177.7	0	110.3
220	V	25.3	Very low	30.2	Very low	127 Å²	127	137.9 Å²	137.9	77%	0.77	76%	0.762	S	S	*	*			trans	-133.8	141	-166	-173.4	0	0	0	0	109.1
221	L	23.3	Very low	31.6	Very low	148 Å²	148	133 Å²	133	78%	0.775	74%	0.74	S	S	*	*				169.3	160.1	129	-117	85.1	0	0	0	114.7
222	K	30.1	Very low	33.3	Very low	180 Å²	180	134.9 Å²	134.9	78%	0.783	74%	0.741	S	S	*	*			trans	84.5	83.1	158.7	-70.7	173.5	-177.2	-172.4	0	120.4
223	N	23.2	Very low	35	Very low	135 Å²	135	129.9 Å²	129.9	72%	0.722	72%	0.72	S	S	*	*				28.2	142.7	119	-63.5	40.3	0	0	0	122.9
224	E	26.9	Very low	36.7	Very low	166 Å²	166	125 Å²	125	78%	0.776	69%	0.685	S	S	*	*			trans	71.2	156.1	144.6	-77.5	161	-124.2	0	0	119.7
225	P	36.4	Very low	38.6	Very low	114 Å²	114	120.9 Å²	120.9	74%	0.74	66%	0.662	S	S	*	*			cis	-101.9	154.6	-2.6	38	-31.2	0	0	0	114
226	S	28.2	Very low	40.6	Very low	92 Å²	92	115.8 Å²	115.8	64%	0.643	65%	0.654	S	S	*	*			trans	-95.6	109.1	173.6	49.1	0	0	0	0	111.5
227	L	35.2	Very low	42.5	Very low	163 Å²	163	112.3 Å²	112.3	85%	0.853	63%	0.627	S	S	*	*			trans	-94.8	81.7	158.8	-114.8	169.3	0	0	0	107.5	I229	L227-I229 VanDerWaalsContact C-N 3.34Å; L227-I229 PolarHBondContact O-N 3.47Å
228	D	36.3	Very low	44.7	Very low	133 Å²	133	109.9 Å²	109.9	71%	0.711	60%	0.599	S	S	*	*			trans	-67.9	91.8	179.7	-71.4	-28.7	0	0	0	110	S230	D228-S230 PolarHBondContact O-N 2.92Å
229	I	48.7	Very low	46.9	Very low	90 Å²	90	107 Å²	107	46%	0.462	58%	0.579	S	S	.	*			trans	-69.5	73.8	158.2	-55.6	-179.2	0	0	0	106.4	L227 T231 I316	L227-I229 VanDerWaalsContact C-N 3.34Å; L227-I229 PolarHBondContact O-N 3.47Å; I229-T231 PolarHBondContact O-N 3.13Å; I229-I316 HydrophobicContact CG2-CG2 4.11Å
230	S	50.8	Low	48.9	Very low	56 Å²	56	100.5 Å²	100.5	39%	0.392	55%	0.554	S	S	.	*			trans	-64.1	123.4	-166.8	69.8	0	0	0	0	110.2	D228 N232	D228-S230 PolarHBondContact O-N 2.92Å; S230-N232 WeakPolarHBondContact CB-ND2 3.29Å; S230-N232 PolarHBondContact O-N 2.97Å; S230-N232 PolarHBondContact OG-ND2 3.24Å
231	T	56.7	Low	51	Low	61 Å²	61	103.7 Å²	103.7	37%	0.374	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-63.8	-2	176.9	48	0	0	0	0	113.2	I229 S233 I234 F239	I229-T231 PolarHBondContact O-N 3.13Å; T231-S233 PolarHBondContact O-N 3.47Å; T231-I234 WeakPolarHBondContact O-CA 3.49Å; T231-I234 WeakPolarHBondContact O-CB 3.49Å; T231-I234 PolarHBondContact O-N 3.02Å; T231-I234 VanDerWaalsContact O-O 3.09Å; T231-F239 HydrophobicContact CG2-CZ 4.08Å
232	N	59.4	Low	53.2	Low	142 Å²	142	102.9 Å²	102.9	76%	0.759	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-49.5	-22.7	168.8	-60.9	-17.3	0	0	0	114.7	S230 I234	S230-N232 WeakPolarHBondContact CB-ND2 3.29Å; S230-N232 PolarHBondContact O-N 2.97Å; S230-N232 PolarHBondContact OG-ND2 3.24Å; N232-I234 VanDerWaalsContact C-N 3.32Å
233	S	60.9	Low	55.4	Low	62 Å²	62	97.8 Å²	97.8	43%	0.434	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-73.8	-22	173.7	54.1	0	0	0	0	113.6	T231 Y313	T231-S233 PolarHBondContact O-N 3.47Å; S233-Y313 VanDerWaalsContact O-CE1 3.27Å; S233-Y313 WeakPolarHBondContact O-CE1 3.49Å; S233-Y313 PolarHBondContact O-OH 3.41Å
234	I	65.4	Low	57.8	Low	6 Å²	6	95.3 Å²	95.3	3%	0.031	52%	0.522	C	S	.	.	S	Bend	trans	-95.6	120.9	176.7	-55.1	173.6	0	0	0	107.3	T231 N232 A236 Y238 F239 Y313 I316 I317	T231-I234 WeakPolarHBondContact O-CA 3.49Å; T231-I234 WeakPolarHBondContact O-CB 3.49Å; T231-I234 PolarHBondContact O-N 3.02Å; T231-I234 VanDerWaalsContact O-O 3.09Å; N232-I234 VanDerWaalsContact C-N 3.32Å; I234-A236 PolarHBondContact O-N 3.34Å; I234-Y238 HydrophobicContact CG2-CD2 3.93Å; I234-Y238 HydrophobicContact CG2-CG 4.46Å; I234-F239 HydrophobicContact CB-CE2 3.84Å; I234-F239 HydrophobicContact CB-CZ 3.99Å; I234-F239 HydrophobicContact CD1-CZ 3.91Å; I234-F239 HydrophobicContact CG2-CE2 3.79Å; I234-F239 HydrophobicContact CG2-CZ 3.85Å; I234-Y313 HydrophobicContact CB-CD1 4.36Å; I234-Y313 HydrophobicContact CB-CG 4.38Å; I234-Y313 HydrophobicContact CD1-CG 4.45Å; I234-Y313 HydrophobicContact CG1-CD1 3.6Å; I234-Y313 HydrophobicContact CG1-CE1 4.2Å; I234-Y313 HydrophobicContact CG1-CG 3.78Å; I234-Y313 HydrophobicContact CG2-CD2 4.14Å; I234-Y313 HydrophobicContact CG2-CG 4.18Å; I234-I316 HydrophobicContact CD1-CB 4.41Å; I234-I316 HydrophobicContact CD1-CG2 4.11Å; I234-I317 HydrophobicContact CD1-CD1 4.4Å; I234-I317 HydrophobicContact CD1-CG1 4.28Å
235	P	68.9	Low	59.9	Low	60 Å²	60	91.5 Å²	91.5	39%	0.39	51%	0.506	S	S	.	.			trans	-53.5	127	178	-29.4	35.3	0	0	0	112.1	L237 Y238 Y313	P235-L237 PolarHBondContact O-N 3.34Å; P235-Y238 HydrophobicContact CB-CD2 3.96Å; P235-Y238 HydrophobicContact CB-CE2 3.98Å; P235-Y238 HydrophobicContact CG-CD2 4.22Å; P235-Y238 HydrophobicContact CG-CE2 3.91Å; P235-Y238 WeakPolarHBondContact O-CD2 3.41Å; P235-Y238 PolarHBondContact O-N 3.21Å; P235-Y313 WeakPolarHBondContact CD-OH 3.4Å
236	A	67.3	Low	61.4	Low	79 Å²	79	95.2 Å²	95.2	65%	0.653	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-55.1	-21.8	-174.2	0	0	0	0	0	114.5	I234 Y238 F239 D240	I234-A236 PolarHBondContact O-N 3.34Å; A236-Y238 PolarHBondContact O-N 2.99Å; A236-F239 PolarHBondContact O-N 3.44Å; A236-D240 PolarHBondContact O-N 2.91Å
237	L	70.5	Confident	63.3	Low	39 Å²	39	94 Å²	94	20%	0.204	50%	0.498	C	S	.	.	G	3₁₀ helix	trans	-50.3	-34.2	170	-172.3	67.3	0	0	0	113.4	P235 F239 F243 T250 Q253 V254	P235-L237 PolarHBondContact O-N 3.34Å; L237-F239 VanDerWaalsContact C-N 3.3Å; L237-F239 PolarHBondContact O-N 3.11Å; L237-F243 HydrophobicContact CD1-CD2 4.36Å; L237-F243 HydrophobicContact CD2-CE2 4.24Å; L237-F243 HydrophobicContact CG-CD2 3.94Å; L237-F243 HydrophobicContact CG-CE2 3.97Å; L237-F243 VanDerWaalsContact O-CD2 3.28Å; L237-F243 WeakPolarHBondContact O-CD2 3.43Å; L237-T250 HydrophobicContact CD1-CG2 4.32Å; L237-T250 HydrophobicContact CD2-CG2 4.33Å; L237-Q253 HydrophobicContact CD2-CB 4.24Å; L237-V254 HydrophobicContact CD2-CG2 4.05Å
238	Y	70.5	Confident	64.6	Low	74 Å²	74	93.7 Å²	93.7	29%	0.29	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-77	-11.3	178.4	-63.4	-64.3	0	0	0	114.2	I234 P235 A236 F243 L310 Y313	I234-Y238 HydrophobicContact CG2-CD2 3.93Å; I234-Y238 HydrophobicContact CG2-CG 4.46Å; P235-Y238 HydrophobicContact CB-CD2 3.96Å; P235-Y238 HydrophobicContact CB-CE2 3.98Å; P235-Y238 HydrophobicContact CG-CD2 4.22Å; P235-Y238 HydrophobicContact CG-CE2 3.91Å; P235-Y238 WeakPolarHBondContact O-CD2 3.41Å; P235-Y238 PolarHBondContact O-N 3.21Å; A236-Y238 PolarHBondContact O-N 2.99Å; Y238-F243 HydrophobicContact CD1-CE2 4.27Å; Y238-F243 HydrophobicContact CD1-CZ 4.35Å; Y238-F243 HydrophobicContact CE1-CE2 4.37Å; Y238-F243 HydrophobicContact CE1-CZ 4.29Å; Y238-L310 HydrophobicContact CE1-CD2 4.01Å; Y238-L310 HydrophobicContact CE2-CD2 4.39Å; Y238-Y313 HydrophobicContact CE2-CD2 4.36Å; Y238-Y313 HydrophobicContact CE2-CE2 4.04Å
239	F	72.6	Confident	66.1	Low	103 Å²	103	94.9 Å²	94.9	45%	0.452	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-103.7	-1.4	175.8	-58.7	-63.3	0	0	0	113.2	T231 I234 A236 L237 Q241	T231-F239 HydrophobicContact CG2-CZ 4.08Å; I234-F239 HydrophobicContact CB-CE2 3.84Å; I234-F239 HydrophobicContact CB-CZ 3.99Å; I234-F239 HydrophobicContact CD1-CZ 3.91Å; I234-F239 HydrophobicContact CG2-CE2 3.79Å; I234-F239 HydrophobicContact CG2-CZ 3.85Å; A236-F239 PolarHBondContact O-N 3.44Å; L237-F239 VanDerWaalsContact C-N 3.3Å; L237-F239 PolarHBondContact O-N 3.11Å; F239-Q241 PolarHBondContact O-N 3.39Å
240	D	71.4	Confident	66.9	Low	80 Å²	80	91.4 Å²	91.4	43%	0.428	47%	0.474	S	S	.	.			trans	-73.5	123.7	174.7	-170.7	-13.9	0	0	0	110.4	A236 N242 F243	A236-D240 PolarHBondContact O-N 2.91Å; D240-N242 PolarHBondContact O-N 3.25Å; D240-N242 VanDerWaalsContact O-N 3.12Å; D240-N242 WeakPolarHBondContact OD1-CB 3.42Å; D240-N242 PolarHBondContact OD1-N 2.9Å; D240-N242 PolarHBondContact OD1-ND2 3.15Å; D240-N242 VanDerWaalsContact OD1-ND2 3.14Å; D240-F243 VanDerWaalsContact O-CB 3.31Å; D240-F243 WeakPolarHBondContact O-CB 3.27Å; D240-F243 PolarHBondContact O-N 3.28Å; D240-F243 VanDerWaalsContact O-N 3.09Å
241	Q	68.8	Low	67.8	Low	195 Å²	195	93.4 Å²	93.4	91%	0.911	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.2	176.6	-64.6	-174.9	-3.7	0	0	113.2	F239	F239-Q241 PolarHBondContact O-N 3.39Å
242	N	69.8	Low	68.1	Low	131 Å²	131	93.2 Å²	93.2	70%	0.701	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	10.2	177	-53.8	-76.9	0	0	0	113.6	D240 N244	D240-N242 PolarHBondContact O-N 3.25Å; D240-N242 VanDerWaalsContact O-N 3.12Å; D240-N242 WeakPolarHBondContact OD1-CB 3.42Å; D240-N242 PolarHBondContact OD1-N 2.9Å; D240-N242 PolarHBondContact OD1-ND2 3.15Å; D240-N242 VanDerWaalsContact OD1-ND2 3.14Å; N242-N244 PolarHBondContact O-N 3.05Å; N242-N244 VanDerWaalsContact O-N 3.1Å
243	F	76.3	Confident	68.3	Low	73 Å²	73	92.9 Å²	92.9	32%	0.32	47%	0.47	S	S	.	.			trans	-50.9	115.6	-178.7	176.5	-99.2	0	0	0	112.4	L237 Y238 D240 L245 T250 V254	L237-F243 HydrophobicContact CD1-CD2 4.36Å; L237-F243 HydrophobicContact CD2-CE2 4.24Å; L237-F243 HydrophobicContact CG-CD2 3.94Å; L237-F243 HydrophobicContact CG-CE2 3.97Å; L237-F243 VanDerWaalsContact O-CD2 3.28Å; L237-F243 WeakPolarHBondContact O-CD2 3.43Å; Y238-F243 HydrophobicContact CD1-CE2 4.27Å; Y238-F243 HydrophobicContact CD1-CZ 4.35Å; Y238-F243 HydrophobicContact CE1-CE2 4.37Å; Y238-F243 HydrophobicContact CE1-CZ 4.29Å; D240-F243 VanDerWaalsContact O-CB 3.31Å; D240-F243 WeakPolarHBondContact O-CB 3.27Å; D240-F243 PolarHBondContact O-N 3.28Å; D240-F243 VanDerWaalsContact O-N 3.09Å; F243-L245 HydrophobicContact CE1-CD1 4.15Å; F243-L245 HydrophobicContact CE1-CD2 4.27Å; F243-L245 HydrophobicContact CE1-CG 3.83Å; F243-L245 HydrophobicContact CZ-CD1 4.45Å; F243-L245 HydrophobicContact CZ-CD2 3.8Å; F243-L245 HydrophobicContact CZ-CG 3.88Å; F243-T250 HydrophobicContact CD2-CG2 4.13Å; F243-T250 HydrophobicContact CE2-CG2 3.89Å; F243-V254 HydrophobicContact CE2-CG2 4.16Å; F243-V254 HydrophobicContact CZ-CG2 4.27Å
244	N	72.8	Confident	68.6	Low	82 Å²	82	90.7 Å²	90.7	44%	0.439	45%	0.454	S	S	.	.			trans	-138.5	105	-173.7	-177	3.9	0	0	0	112	N242 K246 D247	N242-N244 PolarHBondContact O-N 3.05Å; N242-N244 VanDerWaalsContact O-N 3.1Å; N244-K246 PolarHBondContact O-N 2.6Å; N244-K246 VanDerWaalsContact OD1-CB 3.31Å; N244-K246 WeakPolarHBondContact OD1-CB 3.4Å; N244-K246 PolarHBondContact OD1-N 3.29Å; N244-D247 PolarHBondContact O-N 3.47Å; N244-D247 VanDerWaalsContact O-N 3.11Å
245	L	71.8	Confident	68.7	Low	86 Å²	86	92.2 Å²	92.2	45%	0.45	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-4.6	177.3	-71.8	165.4	0	0	0	115	F243 V254	F243-L245 HydrophobicContact CE1-CD1 4.15Å; F243-L245 HydrophobicContact CE1-CD2 4.27Å; F243-L245 HydrophobicContact CE1-CG 3.83Å; F243-L245 HydrophobicContact CZ-CD1 4.45Å; F243-L245 HydrophobicContact CZ-CD2 3.8Å; F243-L245 HydrophobicContact CZ-CG 3.88Å; L245-V254 HydrophobicContact CD2-CB 4.3Å; L245-V254 HydrophobicContact CD2-CG1 4.24Å; L245-V254 HydrophobicContact CD2-CG2 4.15Å
246	K	67.9	Low	68.1	Low	192 Å²	192	93 Å²	93	84%	0.835	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-17.1	173.2	-61.9	-178.7	178.6	178.5	0	114.1	N244	N244-K246 PolarHBondContact O-N 2.6Å; N244-K246 VanDerWaalsContact OD1-CB 3.31Å; N244-K246 WeakPolarHBondContact OD1-CB 3.4Å; N244-K246 PolarHBondContact OD1-N 3.29Å
247	D	67.1	Low	67.3	Low	68 Å²	68	94.5 Å²	94.5	36%	0.364	46%	0.463	S	S	.	.	S	Bend	trans	-72.9	130.2	170.5	168.6	45.7	0	0	0	109.7	N244 K249 T250 F251	N244-D247 PolarHBondContact O-N 3.47Å; N244-D247 VanDerWaalsContact O-N 3.11Å; D247-K249 PolarHBondContact O-N 2.93Å; D247-K249 PolarHBondContact OD1-N 3.22Å; D247-K249 VanDerWaalsContact OD2-CB 3.3Å; D247-K249 WeakPolarHBondContact OD2-CB 3.5Å; D247-K249 PolarHBondContact OD2-N 2.83Å; D247-T250 PolarHBondContact O-N 2.95Å; D247-T250 PolarHBondContact OD2-N 3.16Å; D247-T250 PolarHBondContact OD2-OG1 3.11Å; D247-F251 WeakPolarHBondContact O-CB 3.48Å; D247-F251 PolarHBondContact O-N 3.4Å
248	E	63.1	Low	66	Low	156 Å²	156	100.9 Å²	100.9	73%	0.729	49%	0.492	S	S	*	.	H	α-helix	trans	-60.1	-33.8	-178.1	-173	178.4	-173.7	0	0	111.5	C252	E248-C252 VanDerWaalsContact O-CB 3.23Å; E248-C252 WeakPolarHBondContact O-CB 3.48Å; E248-C252 PolarHBondContact O-N 3.48Å; E248-C252 PolarHBondContact O-SG 3.48Å
249	K	67.8	Low	64.7	Low	157 Å²	157	101.5 Å²	101.5	68%	0.683	50%	0.503	S	S	*	.	H	α-helix	trans	-73	-48.9	178.1	-53.8	168.7	-177.8	167	0	110.9	D247 F251 C252 Q253	D247-K249 PolarHBondContact O-N 2.93Å; D247-K249 PolarHBondContact OD1-N 3.22Å; D247-K249 VanDerWaalsContact OD2-CB 3.3Å; D247-K249 WeakPolarHBondContact OD2-CB 3.5Å; D247-K249 PolarHBondContact OD2-N 2.83Å; K249-F251 VanDerWaalsContact C-N 3.33Å; K249-F251 PolarHBondContact O-N 3.16Å; K249-C252 PolarHBondContact O-N 3.09Å; K249-Q253 WeakPolarHBondContact O-CB 3.19Å; K249-Q253 WeakPolarHBondContact O-CG 3.45Å; K249-Q253 PolarHBondContact O-N 3.25Å
250	T	64.8	Low	63	Low	18 Å²	18	109.1 Å²	109.1	11%	0.11	53%	0.529	C	S	.	.	H	α-helix	trans	-55.2	-47.4	173.4	-59.5	0	0	0	0	111.2	L237 F243 D247 Q253 V254	L237-T250 HydrophobicContact CD1-CG2 4.32Å; L237-T250 HydrophobicContact CD2-CG2 4.33Å; F243-T250 HydrophobicContact CD2-CG2 4.13Å; F243-T250 HydrophobicContact CE2-CG2 3.89Å; D247-T250 PolarHBondContact O-N 2.95Å; D247-T250 PolarHBondContact OD2-N 3.16Å; D247-T250 PolarHBondContact OD2-OG1 3.11Å; T250-Q253 PolarHBondContact O-N 3.26Å; T250-V254 WeakPolarHBondContact O-CG2 3.41Å; T250-V254 PolarHBondContact O-N 3.14Å
251	F	69.4	Low	61.3	Low	97 Å²	97	115.8 Å²	115.8	43%	0.425	55%	0.548	S	S	.	.	H	α-helix	trans	-61	-46.5	177.3	-171.5	-90.4	0	0	0	112.4	D247 K249 Q253 V254 I255	D247-F251 WeakPolarHBondContact O-CB 3.48Å; D247-F251 PolarHBondContact O-N 3.4Å; K249-F251 VanDerWaalsContact C-N 3.33Å; K249-F251 PolarHBondContact O-N 3.16Å; F251-Q253 VanDerWaalsContact C-N 3.28Å; F251-Q253 PolarHBondContact O-N 3.31Å; F251-V254 PolarHBondContact O-N 3.12Å; F251-I255 HydrophobicContact CE1-CD1 4.43Å; F251-I255 HydrophobicContact CE2-CD1 3.9Å; F251-I255 HydrophobicContact CZ-CD1 3.8Å; F251-I255 PolarHBondContact O-N 3.08Å
252	C	63.2	Low	59.5	Low	58 Å²	58	112.1 Å²	112.1	39%	0.392	54%	0.544	S	S	.	.	H	α-helix	trans	-71.3	-16.8	178.6	-69.4	0	0	0	0	114.6	E248 K249	E248-C252 VanDerWaalsContact O-CB 3.23Å; E248-C252 WeakPolarHBondContact O-CB 3.48Å; E248-C252 PolarHBondContact O-N 3.48Å; E248-C252 PolarHBondContact O-SG 3.48Å; K249-C252 PolarHBondContact O-N 3.09Å
253	Q	64.7	Low	57.6	Low	135 Å²	135	115.2 Å²	115.2	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-82.7	-35.6	169.7	-76.3	-178.2	-1.5	0	0	111.8	L237 K249 T250 F251	L237-Q253 HydrophobicContact CD2-CB 4.24Å; K249-Q253 WeakPolarHBondContact O-CB 3.19Å; K249-Q253 WeakPolarHBondContact O-CG 3.45Å; K249-Q253 PolarHBondContact O-N 3.25Å; T250-Q253 PolarHBondContact O-N 3.26Å; F251-Q253 VanDerWaalsContact C-N 3.28Å; F251-Q253 PolarHBondContact O-N 3.31Å
254	V	66.8	Low	55.4	Low	15 Å²	15	121.7 Å²	121.7	9%	0.091	57%	0.574	C	S	.	*	H	α-helix	trans	-75.9	-41.1	177.3	175.7	0	0	0	0	111.6	L237 F243 L245 T250 F251 Q306	L237-V254 HydrophobicContact CD2-CG2 4.05Å; F243-V254 HydrophobicContact CE2-CG2 4.16Å; F243-V254 HydrophobicContact CZ-CG2 4.27Å; L245-V254 HydrophobicContact CD2-CB 4.3Å; L245-V254 HydrophobicContact CD2-CG1 4.24Å; L245-V254 HydrophobicContact CD2-CG2 4.15Å; T250-V254 WeakPolarHBondContact O-CG2 3.41Å; T250-V254 PolarHBondContact O-N 3.14Å; F251-V254 PolarHBondContact O-N 3.12Å; V254-Q306 PolarHBondContact O-NE2 3.1Å; V254-Q306 PolarHBondContact O-OE1 3.02Å
255	I	66.6	Low	53.5	Low	38 Å²	38	124.5 Å²	124.5	20%	0.195	59%	0.585	C	S	.	*	S	Bend	trans	-121.5	100	-175.1	-52.7	-177.9	0	0	0	111.4	F251 L257 F303	F251-I255 HydrophobicContact CE1-CD1 4.43Å; F251-I255 HydrophobicContact CE2-CD1 3.9Å; F251-I255 HydrophobicContact CZ-CD1 3.8Å; F251-I255 PolarHBondContact O-N 3.08Å; I255-L257 PolarHBondContact O-N 3.04Å; I255-F303 HydrophobicContact CD1-CE1 4.34Å; I255-F303 HydrophobicContact CG2-CE1 3.68Å; I255-F303 HydrophobicContact CG2-CZ 3.7Å
256	P	56.2	Low	52.2	Low	78 Å²	78	126.4 Å²	126.4	51%	0.506	60%	0.596	S	S	.	*			trans	-92.5	92.6	-177.3	3.1	16.9	0	0	0	112.5
257	L	51.5	Low	51.2	Low	109 Å²	109	124.1 Å²	124.1	57%	0.571	60%	0.597	S	S	*	*			trans	-76.7	131.4	167.1	-67.2	175.5	0	0	0	110.9	I255 Q299 F303	I255-L257 PolarHBondContact O-N 3.04Å; L257-Q299 HydrophobicContact CD2-CG 4.38Å; L257-F303 HydrophobicContact CD2-CE2 4.22Å
258	H	43	Very low	49.4	Very low	173 Å²	173	131 Å²	131	80%	0.801	62%	0.618	S	S	*	*			trans	-79.8	143.9	-172.2	-137.3	-80.8	0	0	0	113.1
259	T	42.8	Very low	48.4	Very low	88 Å²	88	131.2 Å²	131.2	54%	0.54	62%	0.624	S	S	.	*			trans	63.1	64.2	163.2	-33.3	0	0	0	0	118.7	R261	T259-R261 HydrophobicContact CG2-CB 4.45Å; T259-R261 HydrophobicContact CG2-CG 4.14Å
260	R	37.1	Very low	47.1	Very low	262 Å²	262	131.3 Å²	131.3	99%	0.989	63%	0.632	S	S	*	*			trans	-85.7	112.2	133.5	-85.3	-169.6	178	179.9	1.7	108.3
261	R	35.1	Very low	45.4	Very low	220 Å²	220	140 Å²	140	83%	0.83	67%	0.668	S	S	*	*			trans	-102.5	143	174.3	-102.3	-176.5	175	179.2	-0	110.5	T259	T259-R261 HydrophobicContact CG2-CB 4.45Å; T259-R261 HydrophobicContact CG2-CG 4.14Å
262	S	32.4	Very low	43.6	Very low	118 Å²	118	141.4 Å²	141.4	83%	0.825	68%	0.676	S	S	*	*	S	Bend	trans	66.1	165.5	168.9	77.8	0	0	0	0	116.9
263	R	28.3	Very low	42.1	Very low	196 Å²	196	145.9 Å²	145.9	74%	0.74	69%	0.689	S	S	*	*			trans	-61.6	139.7	-169.8	-66.8	177.5	161.8	149.7	-3.1	111	Q265	R263-Q265 HydrophobicContact CB-CG 3.74Å; R263-Q265 HydrophobicContact CG-CB 4.3Å; R263-Q265 HydrophobicContact CG-CG 3.64Å
264	F	32	Very low	41.1	Very low	209 Å²	209	147 Å²	147	92%	0.917	70%	0.697	S	S	*	*	S	Bend	cis	-52.9	146.8	16.5	-53.4	-83.1	0	0	0	116.9
265	Q	32.6	Very low	40	Very low	141 Å²	141	152.7 Å²	152.7	66%	0.659	73%	0.732	S	S	*	*				-104.4	134.3	-124.3	-66.2	150.4	-38.5	0	0	118.1	R263	R263-Q265 HydrophobicContact CB-CG 3.74Å; R263-Q265 HydrophobicContact CG-CB 4.3Å; R263-Q265 HydrophobicContact CG-CG 3.64Å
266	N	43.4	Very low	39.3	Very low	127 Å²	127	156.2 Å²	156.2	68%	0.679	76%	0.76	S	S	*	*			trans	100.7	140.5	146.9	-49.8	-34.7	0	0	0	122.4
267	V	48.3	Very low	39.3	Very low	143 Å²	143	157.9 Å²	157.9	87%	0.867	77%	0.771	S	S	*	*			trans	90.9	129	157.9	-167.7	0	0	0	0	123
268	R	29.4	Very low	38.8	Very low	214 Å²	214	158.3 Å²	158.3	81%	0.808	78%	0.783	S	S	*	*			trans	-169.7	-178.2	151.5	-121.2	172.5	174.2	80.3	-1.3	113.5
269	N	41.7	Very low	38.4	Very low	159 Å²	159	155 Å²	155	85%	0.85	78%	0.779	S	S	*	*			trans	-147.4	-176.3	-170.4	-160.9	14	0	0	0	115.7
270	L	40.5	Very low	37.7	Very low	160 Å²	160	159 Å²	159	84%	0.838	79%	0.789	S	S	*	*			trans	-138.3	177.4	-167.9	-153.4	72	0	0	0	115.6
271	F	28.7	Very low	37.3	Very low	199 Å²	199	150.3 Å²	150.3	87%	0.873	77%	0.765	S	S	*	*			trans	-154.1	170	179.2	-167.2	-99.9	0	0	0	113.7
272	E	32.4	Very low	36.8	Very low	127 Å²	127	146.4 Å²	146.4	59%	0.593	76%	0.761	S	S	*	*			trans	-160.8	168.7	-174.5	-161.3	-113.9	-51	0	0	116.2
273	K	31.5	Very low	36.5	Very low	152 Å²	152	146.1 Å²	146.1	66%	0.661	76%	0.759	S	S	*	*			trans	100.2	164.4	149.5	-145.7	157.4	-132.7	67.6	0	122
274	I	42.3	Very low	36.4	Very low	159 Å²	159	142.6 Å²	142.6	82%	0.815	76%	0.759	S	S	*	*			trans	91.7	145.1	171.3	-57.4	-179.1	0	0	0	117.4
275	V	44.7	Very low	36.2	Very low	134 Å²	134	138.9 Å²	138.9	81%	0.812	75%	0.749	S	S	*	*			trans	-151.8	151.2	-170.8	172.3	0	0	0	0	110.8
276	S	52.3	Low	36.1	Very low	113 Å²	113	139 Å²	139	79%	0.79	75%	0.752	S	S	*	*			trans	-158.1	163.8	161.3	-72	0	0	0	0	113.2
277	P	56.5	Low	35.4	Very low	113 Å²	113	138 Å²	138	73%	0.734	76%	0.755	S	S	*	*			trans	-128.6	146.9	-165.2	38.7	-21.9	0	0	0	117.9
278	S	40.8	Very low	34.5	Very low	118 Å²	118	137.6 Å²	137.6	83%	0.825	75%	0.748	S	S	*	*			trans	64.3	175.8	166.6	89.7	0	0	0	0	115.1
279	S	33	Very low	34.7	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	74%	0.744	S	S	*	*			cis	-165	172.6	-40.4	56.9	0	0	0	0	106.9
280	K	29.9	Very low	34.1	Very low	173 Å²	173	133.7 Å²	133.7	75%	0.752	74%	0.738	S	S	*	*			cis	-146.8	174.1	12.7	-88.9	-148.1	114.6	-122.5	0	107.4
281	T	27.7	Very low	33.7	Very low	78 Å²	78	133.9 Å²	133.9	48%	0.479	74%	0.74	S	S	.	*			cis	-171.6	139.3	-33.6	38	0	0	0	0	104.8
282	D	24.6	Very low	33.8	Very low	138 Å²	138	134.4 Å²	134.4	74%	0.738	74%	0.737	S	S	*	*			cis	-163.7	173.9	1.1	-94	-31.2	0	0	0	111
283	S	25.2	Very low	34.2	Very low	112 Å²	112	133.4 Å²	133.4	78%	0.783	74%	0.742	S	S	*	*			trans	89.8	141.3	154.1	78.2	0	0	0	0	121.6
284	V	26.9	Very low	34.4	Very low	122 Å²	122	131.5 Å²	131.5	74%	0.739	75%	0.748	S	S	*	*			cis	-174.6	162.9	-41.2	125.4	0	0	0	0	112.3
285	N	28.3	Very low	34.7	Very low	132 Å²	132	131.6 Å²	131.6	71%	0.706	74%	0.744	S	S	*	*			trans	74.3	145	168.4	-70.9	-23.8	0	0	0	119.3
286	I	30.2	Very low	35.1	Very low	144 Å²	144	128.3 Å²	128.3	74%	0.738	74%	0.738	S	S	*	*			cis	121	113.3	-3.2	-69.6	167.8	0	0	0	115.2
287	S	27.9	Very low	35.2	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	73%	0.727	S	S	*	*			trans	179.6	125.5	149.1	51.1	0	0	0	0	109
288	N	30.5	Very low	35.1	Very low	133 Å²	133	129 Å²	129	71%	0.711	72%	0.72	S	S	*	*				64.7	133.4	69.3	-69.1	-17	0	0	0	113.9
289	Q	32.4	Very low	35.8	Very low	154 Å²	154	128.7 Å²	128.7	72%	0.72	71%	0.705	S	S	*	*			cis	-160.5	148.3	5.6	-121	171	9.3	0	0	113.9
290	L	30.4	Very low	37.2	Very low	138 Å²	138	131.3 Å²	131.3	72%	0.723	70%	0.704	S	S	*	*			trans	29.7	122.8	147.3	-64.2	166	0	0	0	122.4
291	N	31.4	Very low	38.9	Very low	164 Å²	164	127.8 Å²	127.8	88%	0.877	69%	0.69	S	S	*	*			trans	-155.8	143.4	148.1	-142.2	-10.3	0	0	0	110.9
292	Y	31.8	Very low	40.6	Very low	210 Å²	210	126.4 Å²	126.4	82%	0.824	69%	0.687	S	S	*	*			trans	-112.4	126.4	-169.5	-92	-83.1	0	0	0	114.4
293	P	39.8	Very low	42.8	Very low	106 Å²	106	124.8 Å²	124.8	69%	0.688	67%	0.673	S	S	*	*			trans	-110.7	162.5	159.8	37.1	-28.2	0	0	0	113.1
294	S	36.3	Very low	45	Very low	112 Å²	112	124.8 Å²	124.8	78%	0.783	66%	0.661	S	S	*	*			trans	-68.9	158.3	-170.5	-47	0	0	0	0	115.7	G296	S294-G296 PolarHBondContact O-N 2.8Å
295	E	48.9	Very low	47.4	Very low	160 Å²	160	123.7 Å²	123.7	75%	0.748	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-49.5	-22.8	-166	-63.7	-178.4	114.6	0	0	117.9	F297 L298	E295-F297 PolarHBondContact O-N 3.4Å; E295-F297 VanDerWaalsContact O-N 3.11Å; E295-L298 PolarHBondContact O-N 2.8Å
296	G	51.6	Low	49.4	Very low	65 Å²	65	118.8 Å²	118.8	67%	0.67	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-62.8	-17.7	-174.7	0	0	0	0	0	115.7	S294	S294-G296 PolarHBondContact O-N 2.8Å
297	F	54.5	Low	51.6	Low	130 Å²	130	117.3 Å²	117.3	57%	0.57	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-77.7	-37.2	179.1	-154.1	-93.8	0	0	0	112.7	E295 Q299 K300	E295-F297 PolarHBondContact O-N 3.4Å; E295-F297 VanDerWaalsContact O-N 3.11Å; F297-Q299 PolarHBondContact O-N 3.3Å; F297-Q299 VanDerWaalsContact O-N 3.15Å; F297-K300 PolarHBondContact O-N 3.15Å
298	L	54.3	Low	54.1	Low	112 Å²	112	115.8 Å²	115.8	59%	0.586	60%	0.597	S	S	*	*	H	α-helix	trans	-62.3	-26.6	-171.7	-66.8	169.6	0	0	0	113.8	E295 K300 A302	E295-L298 PolarHBondContact O-N 2.8Å; L298-K300 VanDerWaalsContact C-N 3.31Å; L298-K300 PolarHBondContact O-N 3.21Å; L298-A302 PolarHBondContact O-N 3.21Å
299	Q	56.7	Low	56.3	Low	110 Å²	110	114.6 Å²	114.6	51%	0.514	59%	0.587	S	S	.	*	H	α-helix	trans	-64.3	-33.1	175.6	-76.9	-171.8	-5.2	0	0	112.9	L257 F297 F303	L257-Q299 HydrophobicContact CD2-CG 4.38Å; F297-Q299 PolarHBondContact O-N 3.3Å; F297-Q299 VanDerWaalsContact O-N 3.15Å; Q299-F303 WeakPolarHBondContact O-CD2 3.38Å; Q299-F303 PolarHBondContact O-N 3.5Å
300	K	62.8	Low	58.4	Low	158 Å²	158	110.2 Å²	110.2	69%	0.687	57%	0.568	S	S	*	*	H	α-helix	trans	-70.5	-40.1	-179.6	-73.1	-172.8	174.6	-177.1	0	112.1	F297 L298 F303 H304	F297-K300 PolarHBondContact O-N 3.15Å; L298-K300 VanDerWaalsContact C-N 3.31Å; L298-K300 PolarHBondContact O-N 3.21Å; K300-F303 PolarHBondContact O-N 3.17Å; K300-H304 PolarHBondContact O-N 3.1Å; K300-H304 VanDerWaalsContact O-N 3.08Å
301	E	65.4	Low	60.8	Low	99 Å²	99	106.7 Å²	106.7	46%	0.463	55%	0.552	S	S	.	*	H	α-helix	trans	-65.3	-39.8	177.7	-63.8	-179.2	130.8	0	0	111.5	F303 H304 N305	E301-F303 PolarHBondContact O-N 3.42Å; E301-H304 PolarHBondContact O-N 3.39Å; E301-N305 WeakPolarHBondContact O-CB 3.49Å; E301-N305 VanDerWaalsContact O-CG 3.3Å; E301-N305 PolarHBondContact O-N 3.01Å; E301-N305 PolarHBondContact O-ND2 3.39Å
302	A	63.2	Low	63.3	Low	50 Å²	50	103.2 Å²	103.2	41%	0.413	53%	0.533	S	S	.	.	H	α-helix	trans	-58.1	-47.4	175.5	0	0	0	0	0	112.6	L298 Q306	L298-A302 PolarHBondContact O-N 3.21Å; A302-Q306 PolarHBondContact O-N 3.01Å
303	F	69.6	Low	65.6	Low	103 Å²	103	94.7 Å²	94.7	45%	0.452	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-39	175.5	-87.7	-71.2	0	0	0	112.9	I255 L257 Q299 K300 E301 Q306 H307	I255-F303 HydrophobicContact CD1-CE1 4.34Å; I255-F303 HydrophobicContact CG2-CE1 3.68Å; I255-F303 HydrophobicContact CG2-CZ 3.7Å; L257-F303 HydrophobicContact CD2-CE2 4.22Å; Q299-F303 WeakPolarHBondContact O-CD2 3.38Å; Q299-F303 PolarHBondContact O-N 3.5Å; K300-F303 PolarHBondContact O-N 3.17Å; E301-F303 PolarHBondContact O-N 3.42Å; F303-Q306 PolarHBondContact O-N 3.17Å; F303-H307 PolarHBondContact O-N 2.88Å; F303-H307 VanDerWaalsContact O-N 3.09Å
304	H	73	Confident	67.6	Low	112 Å²	112	95.2 Å²	95.2	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-67.6	-41.7	179.9	-169.5	54.2	0	0	0	112.1	K300 E301 Q306 H307 N308	K300-H304 PolarHBondContact O-N 3.1Å; K300-H304 VanDerWaalsContact O-N 3.08Å; E301-H304 PolarHBondContact O-N 3.39Å; H304-Q306 VanDerWaalsContact C-N 3.33Å; H304-Q306 PolarHBondContact O-N 2.89Å; H304-H307 PolarHBondContact O-N 3.48Å; H304-N308 PolarHBondContact NE2-ND2 3.3Å; H304-N308 PolarHBondContact O-N 2.96Å; H304-N308 VanDerWaalsContact O-N 3.13Å; H304-N308 PolarHBondContact O-ND2 3.41Å
305	N	75.5	Confident	69.9	Low	99 Å²	99	93.8 Å²	93.8	53%	0.529	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-40.1	174.6	-71.3	-29.4	0	0	0	112.3	E301 N308 Q309	E301-N305 WeakPolarHBondContact O-CB 3.49Å; E301-N305 VanDerWaalsContact O-CG 3.3Å; E301-N305 PolarHBondContact O-N 3.01Å; E301-N305 PolarHBondContact O-ND2 3.39Å; N305-N308 PolarHBondContact O-N 3.22Å; N305-Q309 PolarHBondContact O-N 2.94Å
306	Q	70.9	Confident	71.5	Confident	29 Å²	29	87.1 Å²	87.1	14%	0.136	45%	0.45	C	S	.	.	H	α-helix	trans	-64.6	-41.4	175.9	-172.3	-167.1	-25.7	0	0	112.2	V254 A302 F303 H304 N308 Q309 L310	V254-Q306 PolarHBondContact O-NE2 3.1Å; V254-Q306 PolarHBondContact O-OE1 3.02Å; A302-Q306 PolarHBondContact O-N 3.01Å; F303-Q306 PolarHBondContact O-N 3.17Å; H304-Q306 VanDerWaalsContact C-N 3.33Å; H304-Q306 PolarHBondContact O-N 2.89Å; Q306-N308 PolarHBondContact O-N 3.41Å; Q306-Q309 PolarHBondContact O-N 3.33Å; Q306-L310 PolarHBondContact O-N 2.86Å
307	H	76.2	Confident	72.7	Confident	113 Å²	113	87.3 Å²	87.3	52%	0.523	43%	0.434	S	S	.	.	H	α-helix	trans	-60.6	-45.5	176.6	179.3	68.9	0	0	0	111.7	F303 H304 Q309 L310 V311	F303-H307 PolarHBondContact O-N 2.88Å; F303-H307 VanDerWaalsContact O-N 3.09Å; H304-H307 PolarHBondContact O-N 3.48Å; H307-Q309 VanDerWaalsContact C-N 3.28Å; H307-Q309 PolarHBondContact O-N 3.2Å; H307-L310 PolarHBondContact O-N 3.36Å; H307-L310 VanDerWaalsContact O-N 3.1Å; H307-V311 PolarHBondContact O-N 2.92Å; H307-V311 VanDerWaalsContact O-N 3.14Å
308	N	81.1	Confident	74.1	Confident	74 Å²	74	87.4 Å²	87.4	40%	0.396	44%	0.436	S	S	.	.	H	α-helix	trans	-65.2	-30.3	-179.1	-63	-17.4	0	0	0	112.6	H304 N305 Q306 N312	H304-N308 PolarHBondContact NE2-ND2 3.3Å; H304-N308 PolarHBondContact O-N 2.96Å; H304-N308 VanDerWaalsContact O-N 3.13Å; H304-N308 PolarHBondContact O-ND2 3.41Å; N305-N308 PolarHBondContact O-N 3.22Å; Q306-N308 PolarHBondContact O-N 3.41Å; N308-N312 PolarHBondContact O-N 3.07Å
309	Q	77.4	Confident	75.4	Confident	108 Å²	108	87.2 Å²	87.2	51%	0.505	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-44.3	170.7	-72.9	179.2	-11.4	0	0	112.2	N305 Q306 H307 V311 N312 Y313	N305-Q309 PolarHBondContact O-N 2.94Å; Q306-Q309 PolarHBondContact O-N 3.33Å; H307-Q309 VanDerWaalsContact C-N 3.28Å; H307-Q309 PolarHBondContact O-N 3.2Å; Q309-V311 VanDerWaalsContact C-N 3.32Å; Q309-V311 PolarHBondContact O-N 3.41Å; Q309-N312 PolarHBondContact O-N 2.98Å; Q309-Y313 HydrophobicContact CB-CE2 4.29Å; Q309-Y313 WeakPolarHBondContact O-CD1 3.49Å; Q309-Y313 WeakPolarHBondContact O-CD2 3.49Å; Q309-Y313 PolarHBondContact O-N 2.98Å; Q309-Y313 VanDerWaalsContact O-N 3.12Å
310	L	75.7	Confident	76.5	Confident	63 Å²	63	84.9 Å²	84.9	33%	0.33	43%	0.427	S	S	.	.	H	α-helix	trans	-64.9	-33.6	180	-69.6	170.6	0	0	0	113.1	Y238 Q306 H307 Y313 L314	Y238-L310 HydrophobicContact CE1-CD2 4.01Å; Y238-L310 HydrophobicContact CE2-CD2 4.39Å; Q306-L310 PolarHBondContact O-N 2.86Å; H307-L310 PolarHBondContact O-N 3.36Å; H307-L310 VanDerWaalsContact O-N 3.1Å; L310-Y313 HydrophobicContact CD2-CD2 4.23Å; L310-Y313 PolarHBondContact O-N 3.28Å; L310-L314 PolarHBondContact O-N 3.05Å
311	V	81.2	Confident	77.3	Confident	63 Å²	63	82.2 Å²	82.2	38%	0.382	42%	0.419	S	S	.	.	H	α-helix	trans	-65.8	-50.5	174.5	175.9	0	0	0	0	110.8	H307 Q309 Y313 L314 D315	H307-V311 PolarHBondContact O-N 2.92Å; H307-V311 VanDerWaalsContact O-N 3.14Å; Q309-V311 VanDerWaalsContact C-N 3.32Å; Q309-V311 PolarHBondContact O-N 3.41Å; V311-Y313 PolarHBondContact O-N 3Å; V311-Y313 VanDerWaalsContact O-N 3.16Å; V311-L314 WeakPolarHBondContact O-CB 3.42Å; V311-L314 PolarHBondContact O-N 3.28Å; V311-D315 PolarHBondContact O-N 2.85Å
312	N	82.5	Confident	78.1	Confident	91 Å²	91	82 Å²	82	49%	0.487	42%	0.424	S	S	.	.	H	α-helix	trans	-57.3	-32.3	177	-175.8	30.3	0	0	0	112.7	N308 Q309 L314 I316	N308-N312 PolarHBondContact O-N 3.07Å; Q309-N312 PolarHBondContact O-N 2.98Å; N312-L314 VanDerWaalsContact C-N 3.34Å; N312-I316 WeakPolarHBondContact O-CD1 3.3Å; N312-I316 WeakPolarHBondContact O-CG1 3.45Å; N312-I316 PolarHBondContact O-N 3.13Å
313	Y	80.5	Confident	78.9	Confident	32 Å²	32	83.8 Å²	83.8	13%	0.125	42%	0.424	C	S	.	.	H	α-helix	trans	-69.4	-27.4	175	-59.4	-21	0	0	0	113.7	S233 I234 P235 Y238 Q309 L310 V311 I317	S233-Y313 VanDerWaalsContact O-CE1 3.27Å; S233-Y313 WeakPolarHBondContact O-CE1 3.49Å; S233-Y313 PolarHBondContact O-OH 3.41Å; I234-Y313 HydrophobicContact CB-CD1 4.36Å; I234-Y313 HydrophobicContact CB-CG 4.38Å; I234-Y313 HydrophobicContact CD1-CG 4.45Å; I234-Y313 HydrophobicContact CG1-CD1 3.6Å; I234-Y313 HydrophobicContact CG1-CE1 4.2Å; I234-Y313 HydrophobicContact CG1-CG 3.78Å; I234-Y313 HydrophobicContact CG2-CD2 4.14Å; I234-Y313 HydrophobicContact CG2-CG 4.18Å; P235-Y313 WeakPolarHBondContact CD-OH 3.4Å; Y238-Y313 HydrophobicContact CE2-CD2 4.36Å; Y238-Y313 HydrophobicContact CE2-CE2 4.04Å; Q309-Y313 HydrophobicContact CB-CE2 4.29Å; Q309-Y313 WeakPolarHBondContact O-CD1 3.49Å; Q309-Y313 WeakPolarHBondContact O-CD2 3.49Å; Q309-Y313 PolarHBondContact O-N 2.98Å; Q309-Y313 VanDerWaalsContact O-N 3.12Å; L310-Y313 HydrophobicContact CD2-CD2 4.23Å; L310-Y313 PolarHBondContact O-N 3.28Å; V311-Y313 PolarHBondContact O-N 3Å; V311-Y313 VanDerWaalsContact O-N 3.16Å; Y313-I317 WeakPolarHBondContact O-CD1 3.35Å; Y313-I317 WeakPolarHBondContact O-CG1 3.4Å
314	L	82.1	Confident	79.4	Confident	117 Å²	117	85.1 Å²	85.1	61%	0.613	43%	0.431	S	S	*	.	H	α-helix	trans	-73	-44.5	174.1	-77.5	165.2	0	0	0	111.5	L310 V311 N312 I316 I317 E318	L310-L314 PolarHBondContact O-N 3.05Å; V311-L314 WeakPolarHBondContact O-CB 3.42Å; V311-L314 PolarHBondContact O-N 3.28Å; N312-L314 VanDerWaalsContact C-N 3.34Å; L314-I316 VanDerWaalsContact C-N 3.25Å; L314-I316 PolarHBondContact O-N 3.5Å; L314-I317 WeakPolarHBondContact O-CA 3.36Å; L314-I317 WeakPolarHBondContact O-CB 3.35Å; L314-I317 PolarHBondContact O-N 3.07Å; L314-E318 PolarHBondContact O-N 2.95Å
315	D	85.3	Confident	79.7	Confident	82 Å²	82	84.5 Å²	84.5	44%	0.439	44%	0.435	S	S	.	.	H	α-helix	trans	-57.2	-40.6	179.8	-57.2	-29.2	0	0	0	111.5	V311 I317 E318 L319	V311-D315 PolarHBondContact O-N 2.85Å; D315-I317 VanDerWaalsContact C-N 3.31Å; D315-I317 PolarHBondContact O-N 3.35Å; D315-E318 PolarHBondContact O-N 3.49Å; D315-L319 WeakPolarHBondContact O-CG 3.47Å; D315-L319 PolarHBondContact O-N 3.09Å
316	I	81.3	Confident	80.1	Confident	20 Å²	20	83 Å²	83	10%	0.103	43%	0.433	C	S	.	.	H	α-helix	trans	-62	-36.8	175.3	-68.1	166.8	0	0	0	111.9	I229 I234 N312 L314 N320	I229-I316 HydrophobicContact CG2-CG2 4.11Å; I234-I316 HydrophobicContact CD1-CB 4.41Å; I234-I316 HydrophobicContact CD1-CG2 4.11Å; N312-I316 WeakPolarHBondContact O-CD1 3.3Å; N312-I316 WeakPolarHBondContact O-CG1 3.45Å; N312-I316 PolarHBondContact O-N 3.13Å; L314-I316 VanDerWaalsContact C-N 3.25Å; L314-I316 PolarHBondContact O-N 3.5Å; I316-N320 PolarHBondContact O-ND2 3.4Å
317	I	77.8	Confident	80.4	Confident	69 Å²	69	90.1 Å²	90.1	35%	0.354	46%	0.458	S	S	.	.	H	α-helix	trans	-74.9	-40.1	179.2	-67.8	167.6	0	0	0	110.7	I234 Y313 L314 D315 N320 I321	I234-I317 HydrophobicContact CD1-CD1 4.4Å; I234-I317 HydrophobicContact CD1-CG1 4.28Å; Y313-I317 WeakPolarHBondContact O-CD1 3.35Å; Y313-I317 WeakPolarHBondContact O-CG1 3.4Å; L314-I317 WeakPolarHBondContact O-CA 3.36Å; L314-I317 WeakPolarHBondContact O-CB 3.35Å; L314-I317 PolarHBondContact O-N 3.07Å; D315-I317 VanDerWaalsContact C-N 3.31Å; D315-I317 PolarHBondContact O-N 3.35Å; I317-N320 PolarHBondContact O-N 3.21Å; I317-I321 HydrophobicContact CG2-CD1 4.11Å; I317-I321 WeakPolarHBondContact O-CG1 3.14Å; I317-I321 PolarHBondContact O-N 3.29Å
318	E	82.8	Confident	80.4	Confident	131 Å²	131	92.2 Å²	92.2	61%	0.612	47%	0.466	S	S	*	.	H	α-helix	trans	-63.2	-43.7	179.4	-172.6	164.6	-165.5	0	0	111.9	L314 D315 N320 I321 V322	L314-E318 PolarHBondContact O-N 2.95Å; D315-E318 PolarHBondContact O-N 3.49Å; E318-N320 VanDerWaalsContact C-N 3.3Å; E318-N320 PolarHBondContact O-N 2.87Å; E318-I321 PolarHBondContact O-N 3.49Å; E318-I321 VanDerWaalsContact O-N 3.1Å; E318-V322 PolarHBondContact O-N 3.08Å; E318-V322 VanDerWaalsContact O-N 3.15Å
319	L	83.2	Confident	80.5	Confident	109 Å²	109	91.4 Å²	91.4	57%	0.571	47%	0.466	S	S	*	.	H	α-helix	trans	-55.2	-42.7	173.8	-73	170.1	0	0	0	112.7	D315 I321 V322 E323	D315-L319 WeakPolarHBondContact O-CG 3.47Å; D315-L319 PolarHBondContact O-N 3.09Å; L319-I321 VanDerWaalsContact C-N 3.33Å; L319-I321 PolarHBondContact O-N 2.96Å; L319-V322 PolarHBondContact O-N 3.38Å; L319-E323 PolarHBondContact O-N 2.91Å
320	N	78.2	Confident	80.5	Confident	61 Å²	61	90 Å²	90	33%	0.326	47%	0.468	S	S	.	.	H	α-helix	trans	-66	-33.1	178.5	-86.9	-87.2	0	0	0	112.8	I316 I317 E318 Q324	I316-N320 PolarHBondContact O-ND2 3.4Å; I317-N320 PolarHBondContact O-N 3.21Å; E318-N320 VanDerWaalsContact C-N 3.3Å; E318-N320 PolarHBondContact O-N 2.87Å; N320-Q324 PolarHBondContact O-N 3.28Å
321	I	80	Confident	80.7	Confident	102 Å²	102	91.7 Å²	91.7	52%	0.523	48%	0.481	S	S	.	.	H	α-helix	trans	-70.6	-43.3	178	-67.4	168.4	0	0	0	110.6	I317 E318 L319 E323 Q324 V325	I317-I321 HydrophobicContact CG2-CD1 4.11Å; I317-I321 WeakPolarHBondContact O-CG1 3.14Å; I317-I321 PolarHBondContact O-N 3.29Å; E318-I321 PolarHBondContact O-N 3.49Å; E318-I321 VanDerWaalsContact O-N 3.1Å; L319-I321 VanDerWaalsContact C-N 3.33Å; L319-I321 PolarHBondContact O-N 2.96Å; I321-E323 VanDerWaalsContact C-N 3.29Å; I321-E323 PolarHBondContact O-N 2.76Å; I321-Q324 PolarHBondContact O-N 3.31Å; I321-V325 PolarHBondContact O-N 3Å
322	V	83.1	Confident	80.6	Confident	93 Å²	93	95.2 Å²	95.2	56%	0.564	49%	0.492	S	S	*	.	H	α-helix	trans	-58.3	-40.8	179	174	0	0	0	0	111.5	E318 L319 V325 S326	E318-V322 PolarHBondContact O-N 3.08Å; E318-V322 VanDerWaalsContact O-N 3.15Å; L319-V322 PolarHBondContact O-N 3.38Å; V322-V325 PolarHBondContact O-N 2.97Å; V322-S326 PolarHBondContact O-N 3.02Å; V322-S326 VanDerWaalsContact O-N 3.12Å
323	E	79.5	Confident	80.4	Confident	89 Å²	89	96.5 Å²	96.5	42%	0.416	49%	0.493	S	S	.	.	H	α-helix	trans	-68	-38.2	178.2	-161.9	-174.2	167.4	0	0	113	L319 I321 V325 S326 R327	L319-E323 PolarHBondContact O-N 2.91Å; I321-E323 VanDerWaalsContact C-N 3.29Å; I321-E323 PolarHBondContact O-N 2.76Å; E323-V325 VanDerWaalsContact C-N 3.27Å; E323-V325 PolarHBondContact O-N 2.89Å; E323-S326 PolarHBondContact O-N 3.45Å; E323-S326 PolarHBondContact O-OG 3.11Å; E323-R327 HydrophobicContact CG-CG 4.48Å; E323-R327 WeakPolarHBondContact O-CG 3.27Å; E323-R327 PolarHBondContact O-N 3.3Å; E323-R327 VanDerWaalsContact O-N 3.16Å; E323-R327 IonicContact OE1-CZ 2.63Å; E323-R327 IonicContact OE1-NE 2.64Å; E323-R327 PolarHBondContact OE1-NE 2.94Å; E323-R327 IonicContact OE1-NH2 2.89Å; E323-R327 PolarHBondContact OE1-NH2 3.46Å
324	Q	79.2	Confident	80.4	Confident	130 Å²	130	101.6 Å²	101.6	61%	0.607	52%	0.518	S	S	*	.	H	α-helix	trans	-65.6	-31.4	176.7	-70.4	-164.4	27.7	0	0	113	N320 I321	N320-Q324 PolarHBondContact O-N 3.28Å; I321-Q324 PolarHBondContact O-N 3.31Å
325	V	80	Confident	80.3	Confident	100 Å²	100	99 Å²	99	61%	0.606	51%	0.514	S	S	*	.	H	α-helix	trans	-70.8	-45.5	175	175.3	0	0	0	0	110.8	I321 V322 E323 R327 K328	I321-V325 PolarHBondContact O-N 3Å; V322-V325 PolarHBondContact O-N 2.97Å; E323-V325 VanDerWaalsContact C-N 3.27Å; E323-V325 PolarHBondContact O-N 2.89Å; V325-R327 PolarHBondContact O-N 2.97Å; V325-K328 PolarHBondContact O-N 3Å
326	S	83.1	Confident	80.1	Confident	68 Å²	68	98.7 Å²	98.7	48%	0.476	51%	0.511	S	S	.	.	H	α-helix	trans	-60.4	-46.2	-178.7	74.9	0	0	0	0	111.8	V322 E323 K328 S329	V322-S326 PolarHBondContact O-N 3.02Å; V322-S326 VanDerWaalsContact O-N 3.12Å; E323-S326 PolarHBondContact O-N 3.45Å; E323-S326 PolarHBondContact O-OG 3.11Å; S326-K328 PolarHBondContact O-N 2.98Å; S326-K328 VanDerWaalsContact O-N 3.09Å; S326-S329 PolarHBondContact O-N 3.24Å; S326-S329 PolarHBondContact O-OG 3.26Å
327	R	78.5	Confident	80.1	Confident	177 Å²	177	104.5 Å²	104.5	67%	0.668	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-17.6	179.5	-71.4	178.8	178.5	-147	5.4	114.8	E323 V325	E323-R327 HydrophobicContact CG-CG 4.48Å; E323-R327 WeakPolarHBondContact O-CG 3.27Å; E323-R327 PolarHBondContact O-N 3.3Å; E323-R327 VanDerWaalsContact O-N 3.16Å; E323-R327 IonicContact OE1-CZ 2.63Å; E323-R327 IonicContact OE1-NE 2.64Å; E323-R327 PolarHBondContact OE1-NE 2.94Å; E323-R327 IonicContact OE1-NH2 2.89Å; E323-R327 PolarHBondContact OE1-NH2 3.46Å; V325-R327 PolarHBondContact O-N 2.97Å
328	K	76.6	Confident	80.3	Confident	158 Å²	158	105 Å²	105	69%	0.687	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	0.7	-178.6	-74.6	-176.5	177	174.5	0	114.9	V325 S326	V325-K328 PolarHBondContact O-N 3Å; S326-K328 PolarHBondContact O-N 2.98Å; S326-K328 VanDerWaalsContact O-N 3.09Å
329	S	82.2	Confident	80.3	Confident	56 Å²	56	105 Å²	105	39%	0.392	55%	0.546	S	S	.	.			trans	-78.4	-27.3	-167.9	60.8	0	0	0	0	115.9	S326 F332 F333	S326-S329 PolarHBondContact O-N 3.24Å; S326-S329 PolarHBondContact O-OG 3.26Å; S329-F332 WeakPolarHBondContact O-CB 3.32Å; S329-F332 PolarHBondContact O-N 3.08Å; S329-F333 VanDerWaalsContact O-CD2 3.22Å; S329-F333 WeakPolarHBondContact O-CD2 3.44Å
330	S	78	Confident	80.4	Confident	80 Å²	80	103.5 Å²	103.5	56%	0.559	54%	0.539	S	S	*	.	H	α-helix	trans	-66.2	-44.4	-169.1	51.6	0	0	0	0	114.6	F332 F333	S330-F332 PolarHBondContact O-N 3.42Å; S330-F333 PolarHBondContact O-N 3.5Å
331	T	79.8	Confident	80.8	Confident	98 Å²	98	105.1 Å²	105.1	60%	0.601	55%	0.551	S	S	*	*	H	α-helix	trans	-65.5	-20.5	-177	52.3	0	0	0	0	113.6
332	F	77.8	Confident	81	Confident	136 Å²	136	105.5 Å²	105.5	60%	0.596	55%	0.553	S	S	*	*	H	α-helix	trans	-69.5	-36	173.1	178.1	-106.5	0	0	0	112	S329 S330 I336	S329-F332 WeakPolarHBondContact O-CB 3.32Å; S329-F332 PolarHBondContact O-N 3.08Å; S330-F332 PolarHBondContact O-N 3.42Å; F332-I336 HydrophobicContact CD1-CD1 3.97Å; F332-I336 HydrophobicContact CE1-CD1 3.61Å; F332-I336 HydrophobicContact CZ-CD1 3.98Å; F332-I336 WeakPolarHBondContact O-CG1 3.31Å
333	F	79.6	Confident	81.2	Confident	119 Å²	119	107.8 Å²	107.8	52%	0.522	55%	0.551	S	S	.	*	H	α-helix	trans	-78.9	-33.6	-176.4	-66.9	-69.7	0	0	0	113.6	S329 S330 A335 I336 Q337	S329-F333 VanDerWaalsContact O-CD2 3.22Å; S329-F333 WeakPolarHBondContact O-CD2 3.44Å; S330-F333 PolarHBondContact O-N 3.5Å; F333-A335 VanDerWaalsContact C-N 3.32Å; F333-A335 PolarHBondContact O-N 2.99Å; F333-I336 HydrophobicContact CD1-CD1 4.29Å; F333-I336 PolarHBondContact O-N 2.72Å; F333-Q337 PolarHBondContact O-N 3.39Å
334	E	80.4	Confident	81.7	Confident	138 Å²	138	109.2 Å²	109.2	65%	0.645	56%	0.558	S	S	*	*	H	α-helix	trans	-61.5	-41.3	173.3	-67.1	-175.3	140.8	0	0	111.4	I336 Q337	E334-I336 PolarHBondContact O-N 2.74Å; E334-Q337 PolarHBondContact O-N 2.78Å
335	A	79.4	Confident	82.2	Confident	64 Å²	64	109.7 Å²	109.7	53%	0.529	56%	0.56	S	S	.	*	H	α-helix	trans	-64	-26.6	177.6	0	0	0	0	0	113.6	F333	F333-A335 VanDerWaalsContact C-N 3.32Å; F333-A335 PolarHBondContact O-N 2.99Å
336	I	81.3	Confident	82.5	Confident	75 Å²	75	110 Å²	110	39%	0.385	56%	0.558	S	S	.	*	H	α-helix	trans	-72.9	-44.6	176.5	-69.5	169.1	0	0	0	110.8	F332 F333 E334 C338 H339	F332-I336 HydrophobicContact CD1-CD1 3.97Å; F332-I336 HydrophobicContact CE1-CD1 3.61Å; F332-I336 HydrophobicContact CZ-CD1 3.98Å; F332-I336 WeakPolarHBondContact O-CG1 3.31Å; F333-I336 HydrophobicContact CD1-CD1 4.29Å; F333-I336 PolarHBondContact O-N 2.72Å; E334-I336 PolarHBondContact O-N 2.74Å; I336-C338 VanDerWaalsContact C-N 3.33Å; I336-C338 PolarHBondContact O-N 2.74Å; I336-H339 VanDerWaalsContact O-CB 3.27Å; I336-H339 WeakPolarHBondContact O-CB 3.49Å; I336-H339 PolarHBondContact O-N 2.68Å
337	Q	82.5	Confident	82.8	Confident	141 Å²	141	108.8 Å²	108.8	66%	0.659	55%	0.55	S	S	*	.	H	α-helix	trans	-61.2	-39.5	-176.2	-67.2	-175.8	-0.4	0	0	112.8	F333 E334 H339 D340	F333-Q337 PolarHBondContact O-N 3.39Å; E334-Q337 PolarHBondContact O-N 2.78Å; Q337-H339 PolarHBondContact O-N 3.23Å; Q337-D340 PolarHBondContact O-N 3.44Å
338	C	81.5	Confident	83.5	Confident	80 Å²	80	105.8 Å²	105.8	54%	0.541	54%	0.543	S	S	.	.	H	α-helix	trans	-58.7	-29.3	175.5	-67.4	0	0	0	0	113.3	I336 I342	I336-C338 VanDerWaalsContact C-N 3.33Å; I336-C338 PolarHBondContact O-N 2.74Å; C338-I342 PolarHBondContact O-N 3.39Å
339	H	82.3	Confident	84.1	Confident	130 Å²	130	100.3 Å²	100.3	60%	0.602	53%	0.527	S	S	*	.	H	α-helix	trans	-74	-25.2	-176.6	-127	129.8	0	0	0	113.3	I336 Q337	I336-H339 VanDerWaalsContact O-CB 3.27Å; I336-H339 WeakPolarHBondContact O-CB 3.49Å; I336-H339 PolarHBondContact O-N 2.68Å; Q337-H339 PolarHBondContact O-N 3.23Å
340	D	84.7	Confident	84.5	Confident	78 Å²	78	101.4 Å²	101.4	42%	0.417	53%	0.528	S	S	.	.	H	α-helix	trans	-81.5	-37.4	177.5	-67.9	-37.3	0	0	0	111.6	Q337 I342 R343 E344	Q337-D340 PolarHBondContact O-N 3.44Å; D340-I342 PolarHBondContact O-N 3.43Å; D340-R343 VanDerWaalsContact O-CB 3.3Å; D340-R343 WeakPolarHBondContact O-CB 3.4Å; D340-R343 PolarHBondContact O-N 3.48Å; D340-R343 IonicContact OD1-CZ 3.14Å; D340-R343 IonicContact OD1-NH1 2.86Å; D340-R343 PolarHBondContact OD1-NH1 3.43Å; D340-R343 IonicContact OD1-NH2 2.64Å; D340-R343 PolarHBondContact OD1-NH2 3.33Å; D340-E344 PolarHBondContact O-N 2.99Å
341	V	86.5	Confident	85.1	Confident	95 Å²	95	104.9 Å²	104.9	58%	0.576	53%	0.529	S	S	*	.	H	α-helix	trans	-59.1	-46.7	176.1	-179.6	0	0	0	0	111.3	R343 E344 E345	V341-R343 PolarHBondContact O-N 2.88Å; V341-E344 PolarHBondContact O-N 2.82Å; V341-E345 PolarHBondContact O-N 3.31Å
342	I	85.1	Confident	85.7	Confident	110 Å²	110	106.4 Å²	106.4	56%	0.564	53%	0.529	S	S	*	.	H	α-helix	trans	-61.9	-31.8	176.9	-66	164.8	0	0	0	111.4	C338 D340 L346	C338-I342 PolarHBondContact O-N 3.39Å; D340-I342 PolarHBondContact O-N 3.43Å; I342-L346 VanDerWaalsContact O-CB 3.3Å; I342-L346 WeakPolarHBondContact O-CB 3.39Å; I342-L346 PolarHBondContact O-N 3.23Å; I342-L346 VanDerWaalsContact O-N 3.11Å
343	R	87.8	Confident	86.3	Confident	141 Å²	141	104.2 Å²	104.2	53%	0.532	52%	0.523	S	S	.	.	H	α-helix	trans	-69.7	-33.9	178.7	-161.4	-175.6	-57.1	129.6	17.8	112.2	D340 V341 S347	D340-R343 VanDerWaalsContact O-CB 3.3Å; D340-R343 WeakPolarHBondContact O-CB 3.4Å; D340-R343 PolarHBondContact O-N 3.48Å; D340-R343 IonicContact OD1-CZ 3.14Å; D340-R343 IonicContact OD1-NH1 2.86Å; D340-R343 PolarHBondContact OD1-NH1 3.43Å; D340-R343 IonicContact OD1-NH2 2.64Å; D340-R343 PolarHBondContact OD1-NH2 3.33Å; V341-R343 PolarHBondContact O-N 2.88Å; R343-S347 WeakPolarHBondContact O-CB 3.32Å; R343-S347 PolarHBondContact O-N 2.82Å; R343-S347 VanDerWaalsContact O-N 3.12Å; R343-S347 PolarHBondContact O-OG 3.33Å
344	E	89.3	Confident	86.9	Confident	119 Å²	119	105 Å²	105	56%	0.556	53%	0.526	S	S	*	.	H	α-helix	trans	-67.4	-51.2	176.7	-164.6	66.9	-119.7	0	0	111	D340 V341 L346 S347 Q348	D340-E344 PolarHBondContact O-N 2.99Å; V341-E344 PolarHBondContact O-N 2.82Å; E344-L346 PolarHBondContact O-N 3.03Å; E344-S347 WeakPolarHBondContact O-CB 3.48Å; E344-S347 PolarHBondContact O-N 3.05Å; E344-S347 VanDerWaalsContact O-N 3.13Å; E344-Q348 PolarHBondContact O-N 3.15Å
345	E	89.4	Confident	87.4	Confident	140 Å²	140	102.6 Å²	102.6	65%	0.654	52%	0.518	S	S	*	.	H	α-helix	trans	-61.4	-45	178.7	-67	-162.5	151.2	0	0	112.3	V341 S347 Q348 A349	V341-E345 PolarHBondContact O-N 3.31Å; E345-S347 PolarHBondContact O-N 3.15Å; E345-Q348 PolarHBondContact O-N 3.29Å; E345-Q348 VanDerWaalsContact O-N 3.1Å; E345-A349 PolarHBondContact O-N 3.3Å
346	L	85.6	Confident	88	Confident	107 Å²	107	106.3 Å²	106.3	56%	0.56	52%	0.522	S	S	*	.	H	α-helix	trans	-58.3	-39.7	176	-168.7	78.6	0	0	0	111.2	I342 E344 A349 I350	I342-L346 VanDerWaalsContact O-CB 3.3Å; I342-L346 WeakPolarHBondContact O-CB 3.39Å; I342-L346 PolarHBondContact O-N 3.23Å; I342-L346 VanDerWaalsContact O-N 3.11Å; E344-L346 PolarHBondContact O-N 3.03Å; L346-A349 PolarHBondContact O-N 2.96Å; L346-I350 HydrophobicContact CD2-CD1 4.43Å; L346-I350 HydrophobicContact CG-CD1 4.07Å; L346-I350 WeakPolarHBondContact O-CB 3.49Å; L346-I350 WeakPolarHBondContact O-CD1 3.4Å; L346-I350 VanDerWaalsContact O-CG1 3.25Å; L346-I350 WeakPolarHBondContact O-CG1 3.43Å; L346-I350 PolarHBondContact O-N 3.09Å
347	S	91	Very high	88.4	Confident	43 Å²	43	111 Å²	111	30%	0.301	54%	0.535	S	S	.	.	H	α-helix	trans	-65	-38	177	-63.5	0	0	0	0	112.2	R343 E344 E345 R351	R343-S347 WeakPolarHBondContact O-CB 3.32Å; R343-S347 PolarHBondContact O-N 2.82Å; R343-S347 VanDerWaalsContact O-N 3.12Å; R343-S347 PolarHBondContact O-OG 3.33Å; E344-S347 WeakPolarHBondContact O-CB 3.48Å; E344-S347 PolarHBondContact O-N 3.05Å; E344-S347 VanDerWaalsContact O-N 3.13Å; E345-S347 PolarHBondContact O-N 3.15Å; S347-R351 WeakPolarHBondContact O-CG 3.49Å; S347-R351 PolarHBondContact O-N 3.35Å
348	Q	92	Very high	88.7	Confident	113 Å²	113	107.8 Å²	107.8	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-68	-43.7	176.3	-169.1	171.3	4.1	0	0	112	E344 E345 I350 R351 Q352	E344-Q348 PolarHBondContact O-N 3.15Å; E345-Q348 PolarHBondContact O-N 3.29Å; E345-Q348 VanDerWaalsContact O-N 3.1Å; Q348-I350 PolarHBondContact O-N 3.45Å; Q348-R351 WeakPolarHBondContact O-CB 3.25Å; Q348-R351 PolarHBondContact O-N 3.34Å; Q348-Q352 PolarHBondContact O-N 3.24Å
349	A	90.3	Very high	89.1	Confident	43 Å²	43	109.4 Å²	109.4	36%	0.355	53%	0.525	S	S	.	.	H	α-helix	trans	-60.8	-42	175.2	0	0	0	0	0	112.3	E345 L346 R351 Q352 I353	E345-A349 PolarHBondContact O-N 3.3Å; L346-A349 PolarHBondContact O-N 2.96Å; A349-R351 VanDerWaalsContact C-N 3.31Å; A349-R351 PolarHBondContact O-N 3.41Å; A349-Q352 PolarHBondContact O-N 3.34Å; A349-I353 WeakPolarHBondContact O-CG1 3.46Å; A349-I353 PolarHBondContact O-N 2.84Å; A349-I353 VanDerWaalsContact O-N 3.11Å
350	I	90.6	Very high	89.4	Confident	80 Å²	80	108.2 Å²	108.2	41%	0.41	52%	0.523	S	S	.	.	H	α-helix	trans	-62.3	-35.5	176.6	-71.6	166.3	0	0	0	111.9	L346 Q348 K354	L346-I350 HydrophobicContact CD2-CD1 4.43Å; L346-I350 HydrophobicContact CG-CD1 4.07Å; L346-I350 WeakPolarHBondContact O-CB 3.49Å; L346-I350 WeakPolarHBondContact O-CD1 3.4Å; L346-I350 VanDerWaalsContact O-CG1 3.25Å; L346-I350 WeakPolarHBondContact O-CG1 3.43Å; L346-I350 PolarHBondContact O-N 3.09Å; Q348-I350 PolarHBondContact O-N 3.45Å; I350-K354 WeakPolarHBondContact O-CG 3.32Å; I350-K354 PolarHBondContact O-N 3.39Å
351	R	90.3	Very high	89.2	Confident	152 Å²	152	110.3 Å²	110.3	57%	0.574	53%	0.53	S	S	*	.	H	α-helix	trans	-63.1	-48.6	174.3	-68.1	169.6	-162.9	149.2	8.8	111	S347 Q348 A349 I353 K354 D355	S347-R351 WeakPolarHBondContact O-CG 3.49Å; S347-R351 PolarHBondContact O-N 3.35Å; Q348-R351 WeakPolarHBondContact O-CB 3.25Å; Q348-R351 PolarHBondContact O-N 3.34Å; A349-R351 VanDerWaalsContact C-N 3.31Å; A349-R351 PolarHBondContact O-N 3.41Å; R351-I353 PolarHBondContact O-N 2.89Å; R351-K354 WeakPolarHBondContact O-CB 3.29Å; R351-K354 PolarHBondContact O-N 3.24Å; R351-D355 PolarHBondContact O-N 3.38Å; R351-D355 VanDerWaalsContact O-N 3.14Å
352	Q	92.1	Very high	89	Confident	131 Å²	131	111.1 Å²	111.1	61%	0.612	53%	0.527	S	S	*	.	H	α-helix	trans	-60.7	-41	-179.9	-66.5	-179.2	-1.8	0	0	112.8	Q348 A349 K354 D355 F356	Q348-Q352 PolarHBondContact O-N 3.24Å; A349-Q352 PolarHBondContact O-N 3.34Å; Q352-K354 VanDerWaalsContact C-N 3.34Å; Q352-K354 PolarHBondContact O-N 3.45Å; Q352-D355 PolarHBondContact O-N 2.95Å; Q352-F356 PolarHBondContact O-N 2.63Å
353	I	91.3	Very high	88.8	Confident	89 Å²	89	110.7 Å²	110.7	46%	0.456	53%	0.525	S	S	.	.	H	α-helix	trans	-64.7	-36.2	177.9	-67.3	168.8	0	0	0	111.8	A349 R351 R357	A349-I353 WeakPolarHBondContact O-CG1 3.46Å; A349-I353 PolarHBondContact O-N 2.84Å; A349-I353 VanDerWaalsContact O-N 3.11Å; R351-I353 PolarHBondContact O-N 2.89Å; I353-R357 VanDerWaalsContact O-CG 3.29Å; I353-R357 WeakPolarHBondContact O-CG 3.34Å; I353-R357 PolarHBondContact O-N 2.9Å; I353-R357 VanDerWaalsContact O-N 3.17Å
354	K	90.9	Very high	88.6	Confident	135 Å²	135	107.1 Å²	107.1	59%	0.587	52%	0.516	S	S	*	.	H	α-helix	trans	-64.2	-47	174.2	-73.2	174.7	179.3	-179.6	0	110.9	I350 R351 Q352 F356 R357 C358	I350-K354 WeakPolarHBondContact O-CG 3.32Å; I350-K354 PolarHBondContact O-N 3.39Å; R351-K354 WeakPolarHBondContact O-CB 3.29Å; R351-K354 PolarHBondContact O-N 3.24Å; Q352-K354 VanDerWaalsContact C-N 3.34Å; Q352-K354 PolarHBondContact O-N 3.45Å; K354-F356 PolarHBondContact O-N 3.05Å; K354-R357 PolarHBondContact O-N 3.3Å; K354-R357 VanDerWaalsContact O-N 3.17Å; K354-C358 PolarHBondContact O-N 3.45Å; K354-C358 PolarHBondContact O-SG 3.15Å; K354-C358 VanDerWaalsContact O-SG 3.4Å
355	D	92.3	Very high	88.1	Confident	88 Å²	88	103.7 Å²	103.7	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-59.5	-44.2	-179.5	-133.9	61.9	0	0	0	112.6	R351 Q352 C358 K359	R351-D355 PolarHBondContact O-N 3.38Å; R351-D355 VanDerWaalsContact O-N 3.14Å; Q352-D355 PolarHBondContact O-N 2.95Å; D355-C358 PolarHBondContact O-N 2.84Å; D355-K359 PolarHBondContact O-N 2.86Å; D355-K359 VanDerWaalsContact O-N 3.1Å; D355-K359 IonicContact OD2-NZ 3.02Å; D355-K359 PolarHBondContact OD2-NZ 3.43Å
356	F	90.8	Very high	87.5	Confident	142 Å²	142	104.3 Å²	104.3	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-63.2	-42.1	175.4	-176.1	-104.8	0	0	0	112.4	Q352 K354 C358 K359 L360	Q352-F356 PolarHBondContact O-N 2.63Å; K354-F356 PolarHBondContact O-N 3.05Å; F356-C358 VanDerWaalsContact C-N 3.34Å; F356-C358 PolarHBondContact O-N 3.46Å; F356-K359 PolarHBondContact O-N 2.89Å; F356-L360 WeakPolarHBondContact O-CB 3.3Å; F356-L360 PolarHBondContact O-N 3.02Å
357	R	91.2	Very high	87.2	Confident	173 Å²	173	102.4 Å²	102.4	65%	0.653	50%	0.498	S	S	*	.	H	α-helix	trans	-63.5	-37.8	175.8	-73	173	-178.5	-173.3	2.4	112.2	I353 K354 H361	I353-R357 VanDerWaalsContact O-CG 3.29Å; I353-R357 WeakPolarHBondContact O-CG 3.34Å; I353-R357 PolarHBondContact O-N 2.9Å; I353-R357 VanDerWaalsContact O-N 3.17Å; K354-R357 PolarHBondContact O-N 3.3Å; K354-R357 VanDerWaalsContact O-N 3.17Å; R357-H361 WeakPolarHBondContact O-CB 3.45Å; R357-H361 PolarHBondContact O-N 3.44Å
358	C	88.4	Confident	86.7	Confident	75 Å²	75	104.4 Å²	104.4	51%	0.507	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-45.8	175	-70.6	0	0	0	0	112	K354 D355 F356 H361 Q362	K354-C358 PolarHBondContact O-N 3.45Å; K354-C358 PolarHBondContact O-SG 3.15Å; K354-C358 VanDerWaalsContact O-SG 3.4Å; D355-C358 PolarHBondContact O-N 2.84Å; F356-C358 VanDerWaalsContact C-N 3.34Å; F356-C358 PolarHBondContact O-N 3.46Å; C358-H361 PolarHBondContact O-N 2.45Å; C358-Q362 WeakPolarHBondContact O-CG 3.43Å; C358-Q362 PolarHBondContact O-N 2.83Å
359	K	88.7	Confident	86	Confident	114 Å²	114	102.4 Å²	102.4	50%	0.496	50%	0.496	S	S	.	.	H	α-helix	trans	-62.6	-43.3	176.4	-71	165.6	-178.8	153.1	0	111.9	D355 F356 H361 Q362 I363	D355-K359 PolarHBondContact O-N 2.86Å; D355-K359 VanDerWaalsContact O-N 3.1Å; D355-K359 IonicContact OD2-NZ 3.02Å; D355-K359 PolarHBondContact OD2-NZ 3.43Å; F356-K359 PolarHBondContact O-N 2.89Å; K359-H361 VanDerWaalsContact C-N 3.34Å; K359-H361 PolarHBondContact O-N 3.42Å; K359-Q362 PolarHBondContact O-N 2.95Å; K359-I363 WeakPolarHBondContact O-CG1 3.49Å; K359-I363 PolarHBondContact O-N 3.06Å; K359-I363 VanDerWaalsContact O-N 3.12Å
360	L	88.3	Confident	85.3	Confident	104 Å²	104	103.3 Å²	103.3	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-41.1	175	-168.3	75.8	0	0	0	112.2	F356 I363 N364	F356-L360 WeakPolarHBondContact O-CB 3.3Å; F356-L360 PolarHBondContact O-N 3.02Å; L360-I363 PolarHBondContact O-N 2.98Å; L360-N364 PolarHBondContact O-N 3.4Å
361	H	81	Confident	84.8	Confident	123 Å²	123	106.1 Å²	106.1	57%	0.569	50%	0.504	S	S	*	.	H	α-helix	trans	-65.2	-41.9	177.7	-174.1	74.1	0	0	0	112.2	R357 C358 K359 N364 T365	R357-H361 WeakPolarHBondContact O-CB 3.45Å; R357-H361 PolarHBondContact O-N 3.44Å; C358-H361 PolarHBondContact O-N 2.45Å; K359-H361 VanDerWaalsContact C-N 3.34Å; K359-H361 PolarHBondContact O-N 3.42Å; H361-N364 PolarHBondContact O-N 3.31Å; H361-T365 WeakPolarHBondContact O-CB 3.35Å; H361-T365 PolarHBondContact O-N 3.32Å; H361-T365 PolarHBondContact O-OG1 3.48Å; H361-T365 VanDerWaalsContact O-OG1 3.06Å
362	Q	82.4	Confident	84.2	Confident	112 Å²	112	104 Å²	104	52%	0.523	50%	0.502	S	S	.	.	H	α-helix	trans	-59.1	-46.8	174.4	-72.3	171.1	-16.1	0	0	111.7	C358 K359 N364 T365 F366	C358-Q362 WeakPolarHBondContact O-CG 3.43Å; C358-Q362 PolarHBondContact O-N 2.83Å; K359-Q362 PolarHBondContact O-N 2.95Å; Q362-N364 PolarHBondContact O-N 3.46Å; Q362-T365 PolarHBondContact O-N 3.39Å; Q362-F366 WeakPolarHBondContact O-CD2 3.35Å; Q362-F366 PolarHBondContact O-N 3.23Å
363	I	81.9	Confident	83.4	Confident	101 Å²	101	103.4 Å²	103.4	52%	0.518	50%	0.498	S	S	.	.	H	α-helix	trans	-59.4	-48.1	178	-67.2	167.2	0	0	0	110.8	K359 L360 T365 T367	K359-I363 WeakPolarHBondContact O-CG1 3.49Å; K359-I363 PolarHBondContact O-N 3.06Å; K359-I363 VanDerWaalsContact O-N 3.12Å; L360-I363 PolarHBondContact O-N 2.98Å; I363-T365 PolarHBondContact O-N 3.46Å; I363-T367 WeakPolarHBondContact O-CA 3.26Å; I363-T367 WeakPolarHBondContact O-CB 3.37Å; I363-T367 PolarHBondContact O-N 2.54Å; I363-T367 PolarHBondContact O-OG1 2.82Å
364	N	81.9	Confident	82.8	Confident	65 Å²	65	104.4 Å²	104.4	35%	0.348	50%	0.503	S	S	.	.	I	π-helix	trans	-59.2	-47.9	178.2	179.2	57.6	0	0	0	112.3	L360 H361 Q362 I368 I369	L360-N364 PolarHBondContact O-N 3.4Å; H361-N364 PolarHBondContact O-N 3.31Å; Q362-N364 PolarHBondContact O-N 3.46Å; N364-I368 WeakPolarHBondContact O-CB 3.39Å; N364-I368 PolarHBondContact O-N 3.45Å; N364-I368 VanDerWaalsContact O-N 3.09Å; N364-I369 PolarHBondContact O-N 3.24Å; N364-I369 VanDerWaalsContact O-N 3.15Å
365	T	79.7	Confident	82.1	Confident	47 Å²	47	102.9 Å²	102.9	29%	0.288	50%	0.501	S	S	.	.	I	π-helix	trans	-66.2	-51.4	-175.9	-61.3	0	0	0	0	112.2	H361 Q362 I363	H361-T365 WeakPolarHBondContact O-CB 3.35Å; H361-T365 PolarHBondContact O-N 3.32Å; H361-T365 PolarHBondContact O-OG1 3.48Å; H361-T365 VanDerWaalsContact O-OG1 3.06Å; Q362-T365 PolarHBondContact O-N 3.39Å; I363-T365 PolarHBondContact O-N 3.46Å
366	F	77.9	Confident	81.3	Confident	153 Å²	153	106.6 Å²	106.6	67%	0.671	51%	0.508	S	S	*	.	I	π-helix	trans	-79.2	-31.8	-177.7	-70	-67.4	0	0	0	114	Q362	Q362-F366 WeakPolarHBondContact O-CD2 3.35Å; Q362-F366 PolarHBondContact O-N 3.23Å
367	T	78.5	Confident	80.7	Confident	68 Å²	68	104.4 Å²	104.4	42%	0.417	51%	0.506	S	S	.	.	I	π-helix	trans	-95.8	-39.2	-171.2	-46.3	0	0	0	0	113.1	I363 K371	I363-T367 WeakPolarHBondContact O-CA 3.26Å; I363-T367 WeakPolarHBondContact O-CB 3.37Å; I363-T367 PolarHBondContact O-N 2.54Å; I363-T367 PolarHBondContact O-OG1 2.82Å; T367-K371 WeakPolarHBondContact O-CD 3.49Å; T367-K371 VanDerWaalsContact O-CG 3.3Å; T367-K371 WeakPolarHBondContact O-CG 3.39Å
368	I	80.2	Confident	80.1	Confident	84 Å²	84	98.8 Å²	98.8	43%	0.431	49%	0.491	S	S	.	.	I	π-helix	trans	-98	-52.7	-171.1	-55	-179.7	0	0	0	110.3	N364 D370 K371 M372	N364-I368 WeakPolarHBondContact O-CB 3.39Å; N364-I368 PolarHBondContact O-N 3.45Å; N364-I368 VanDerWaalsContact O-N 3.09Å; I368-D370 PolarHBondContact O-N 3.39Å; I368-K371 PolarHBondContact O-N 3.28Å; I368-M372 HydrophobicContact CG2-CG 4.46Å; I368-M372 WeakPolarHBondContact O-CB 3.41Å; I368-M372 VanDerWaalsContact O-CG 3.29Å; I368-M372 WeakPolarHBondContact O-CG 3.36Å; I368-M372 PolarHBondContact O-N 3.29Å
369	I	77.5	Confident	79.4	Confident	71 Å²	71	101.4 Å²	101.4	36%	0.364	49%	0.491	S	S	.	.	I	π-helix	trans	-61.6	-45.6	-174.8	-63.9	-178.5	0	0	0	111.1	N364 M372 K373	N364-I369 PolarHBondContact O-N 3.24Å; N364-I369 VanDerWaalsContact O-N 3.15Å; I369-M372 PolarHBondContact O-N 2.62Å; I369-K373 WeakPolarHBondContact O-CG 3.46Å; I369-K373 PolarHBondContact O-N 3.25Å
370	D	76.2	Confident	78.7	Confident	63 Å²	63	98.9 Å²	98.9	34%	0.337	48%	0.478	S	S	.	.	H	α-helix	trans	-72.5	-33.1	-177.1	-68.9	-25.5	0	0	0	113.4	I368 M372 K373 L374	I368-D370 PolarHBondContact O-N 3.39Å; D370-M372 VanDerWaalsContact C-N 3.33Å; D370-K373 WeakPolarHBondContact O-CB 3.49Å; D370-K373 PolarHBondContact O-N 3.26Å; D370-K373 WeakPolarHBondContact OD1-CD 3.33Å; D370-K373 WeakPolarHBondContact OD1-CE 3.47Å; D370-K373 IonicContact OD1-NZ 2.71Å; D370-K373 PolarHBondContact OD1-NZ 3.23Å; D370-L374 PolarHBondContact O-N 2.95Å
371	K	80	Confident	78.4	Confident	139 Å²	139	101 Å²	101	60%	0.604	48%	0.479	S	S	*	.	H	α-helix	trans	-66	-35.4	169.4	-71.3	-172	-179.4	-176.4	0	112	T367 I368 L374 L375	T367-K371 WeakPolarHBondContact O-CD 3.49Å; T367-K371 VanDerWaalsContact O-CG 3.3Å; T367-K371 WeakPolarHBondContact O-CG 3.39Å; I368-K371 PolarHBondContact O-N 3.28Å; K371-L374 PolarHBondContact O-N 3.27Å; K371-L375 WeakPolarHBondContact O-CG 3.39Å; K371-L375 PolarHBondContact O-N 3.4Å; K371-L375 VanDerWaalsContact O-N 3.09Å
372	M	76.5	Confident	78.2	Confident	107 Å²	107	100.1 Å²	100.1	53%	0.527	48%	0.475	S	S	.	.	H	α-helix	trans	-70.3	-35.3	174.2	-70.1	-66.5	164.7	0	0	112.7	I368 I369 D370 L375 R376	I368-M372 HydrophobicContact CG2-CG 4.46Å; I368-M372 WeakPolarHBondContact O-CB 3.41Å; I368-M372 VanDerWaalsContact O-CG 3.29Å; I368-M372 WeakPolarHBondContact O-CG 3.36Å; I368-M372 PolarHBondContact O-N 3.29Å; I369-M372 PolarHBondContact O-N 2.62Å; D370-M372 VanDerWaalsContact C-N 3.33Å; M372-L375 PolarHBondContact O-N 3.35Å; M372-L375 HydrophobicContact SD-CD1 4.12Å; M372-R376 WeakPolarHBondContact O-CG 3.31Å; M372-R376 PolarHBondContact O-N 3.09Å; M372-R376 VanDerWaalsContact O-N 3.16Å
373	K	76.1	Confident	78	Confident	118 Å²	118	97.2 Å²	97.2	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-59.6	-45.6	168.7	-69.2	173.5	-171	158.3	0	111	I369 D370 L375 R376 V377	I369-K373 WeakPolarHBondContact O-CG 3.46Å; I369-K373 PolarHBondContact O-N 3.25Å; D370-K373 WeakPolarHBondContact O-CB 3.49Å; D370-K373 PolarHBondContact O-N 3.26Å; D370-K373 WeakPolarHBondContact OD1-CD 3.33Å; D370-K373 WeakPolarHBondContact OD1-CE 3.47Å; D370-K373 IonicContact OD1-NZ 2.71Å; D370-K373 PolarHBondContact OD1-NZ 3.23Å; K373-L375 PolarHBondContact O-N 3.42Å; K373-R376 WeakPolarHBondContact O-CB 3.11Å; K373-R376 PolarHBondContact O-N 3.5Å; K373-V377 WeakPolarHBondContact O-CG2 3.42Å; K373-V377 PolarHBondContact O-N 2.84Å
374	L	79.2	Confident	77.9	Confident	111 Å²	111	98.2 Å²	98.2	58%	0.581	46%	0.461	S	S	*	.	H	α-helix	trans	-59.6	-46.3	178.8	-178.4	62.6	0	0	0	112	D370 K371 R376 V377 V378	D370-L374 PolarHBondContact O-N 2.95Å; K371-L374 PolarHBondContact O-N 3.27Å; L374-R376 VanDerWaalsContact C-N 3.32Å; L374-R376 PolarHBondContact O-N 3.09Å; L374-V377 PolarHBondContact O-N 3.02Å; L374-V378 WeakPolarHBondContact O-CG2 3.45Å; L374-V378 PolarHBondContact O-N 3.37Å
375	L	74.7	Confident	77.9	Confident	103 Å²	103	101.1 Å²	101.1	54%	0.539	47%	0.47	S	S	.	.	H	α-helix	trans	-61	-38.6	177.2	-70.5	174.4	0	0	0	112.7	K371 M372 K373 V378 R379	K371-L375 WeakPolarHBondContact O-CG 3.39Å; K371-L375 PolarHBondContact O-N 3.4Å; K371-L375 VanDerWaalsContact O-N 3.09Å; M372-L375 PolarHBondContact O-N 3.35Å; M372-L375 HydrophobicContact SD-CD1 4.12Å; K373-L375 PolarHBondContact O-N 3.42Å; L375-V378 PolarHBondContact O-N 3.02Å; L375-R379 PolarHBondContact O-N 3.02Å; L375-R379 VanDerWaalsContact O-N 3.11Å
376	R	75.7	Confident	77.7	Confident	165 Å²	165	103.7 Å²	103.7	62%	0.623	48%	0.482	S	S	*	.	H	α-helix	trans	-62.8	-49.1	172.6	-74	-176.2	-172.2	-174.7	1.4	111.8	E158 M372 K373 L374 V378 R379 R380	E158-R376 WeakPolarHBondContact OE1-CB 3.4Å; M372-R376 WeakPolarHBondContact O-CG 3.31Å; M372-R376 PolarHBondContact O-N 3.09Å; M372-R376 VanDerWaalsContact O-N 3.16Å; K373-R376 WeakPolarHBondContact O-CB 3.11Å; K373-R376 PolarHBondContact O-N 3.5Å; L374-R376 VanDerWaalsContact C-N 3.32Å; L374-R376 PolarHBondContact O-N 3.09Å; R376-V378 VanDerWaalsContact C-N 3.27Å; R376-V378 PolarHBondContact O-N 3.43Å; R376-R379 PolarHBondContact O-N 3.09Å; R376-R379 VanDerWaalsContact O-N 3.16Å; R376-R380 WeakPolarHBondContact O-CB 3.31Å; R376-R380 PolarHBondContact O-N 3.29Å
377	V	78.3	Confident	77.7	Confident	96 Å²	96	100 Å²	100	58%	0.582	47%	0.472	S	S	*	.	H	α-helix	trans	-59.4	-36.7	178.2	172.2	0	0	0	0	112	K373 L374 R380 R381	K373-V377 WeakPolarHBondContact O-CG2 3.42Å; K373-V377 PolarHBondContact O-N 2.84Å; L374-V377 PolarHBondContact O-N 3.02Å; V377-R380 PolarHBondContact O-N 3.36Å; V377-R381 WeakPolarHBondContact O-CB 3.46Å; V377-R381 PolarHBondContact O-N 2.91Å
378	V	78.6	Confident	77.9	Confident	55 Å²	55	100.2 Å²	100.2	33%	0.333	47%	0.473	S	S	.	.	H	α-helix	trans	-64.3	-50.5	174	172.5	0	0	0	0	111.5	L374 L375 R376 R380 R381 E382	L374-V378 WeakPolarHBondContact O-CG2 3.45Å; L374-V378 PolarHBondContact O-N 3.37Å; L375-V378 PolarHBondContact O-N 3.02Å; R376-V378 VanDerWaalsContact C-N 3.27Å; R376-V378 PolarHBondContact O-N 3.43Å; V378-R380 VanDerWaalsContact C-N 3.31Å; V378-R380 PolarHBondContact O-N 3.44Å; V378-R381 WeakPolarHBondContact O-CB 3.42Å; V378-R381 PolarHBondContact O-N 3.25Å; V378-R381 VanDerWaalsContact O-N 3.17Å; V378-E382 PolarHBondContact O-N 3.11Å; V378-E382 VanDerWaalsContact O-N 3.1Å
379	R	73.5	Confident	77.9	Confident	131 Å²	131	101 Å²	101	49%	0.494	48%	0.478	S	S	.	.	H	α-helix	trans	-58.3	-42.7	175	-70.5	-175.1	-176.4	-172.9	3.6	111.7	D155 L375 R376 R381 E382 N383	D155-R379 PolarHBondContact O-NH1 3.45Å; L375-R379 PolarHBondContact O-N 3.02Å; L375-R379 VanDerWaalsContact O-N 3.11Å; R376-R379 PolarHBondContact O-N 3.09Å; R376-R379 VanDerWaalsContact O-N 3.16Å; R379-R381 VanDerWaalsContact C-N 3.33Å; R379-R381 PolarHBondContact O-N 3.22Å; R379-E382 PolarHBondContact O-N 3.48Å; R379-E382 VanDerWaalsContact O-N 3.17Å; R379-N383 PolarHBondContact O-N 3.49Å
380	R	74.7	Confident	77.7	Confident	60 Å²	60	101.5 Å²	101.5	23%	0.226	48%	0.477	C	S	.	.	H	α-helix	trans	-62.5	-38.2	177.5	-160	171.4	173.5	150.9	-2.1	112	E158 E161 R376 V377 V378 Y384	E158-R380 WeakPolarHBondContact OE2-CB 3.38Å; E158-R380 WeakPolarHBondContact OE2-CD 3.41Å; E158-R380 WeakPolarHBondContact OE2-CG 3.38Å; E161-R380 PolarHBondContact O-NH2 3.4Å; R376-R380 WeakPolarHBondContact O-CB 3.31Å; R376-R380 PolarHBondContact O-N 3.29Å; V377-R380 PolarHBondContact O-N 3.36Å; V378-R380 VanDerWaalsContact C-N 3.31Å; V378-R380 PolarHBondContact O-N 3.44Å; R380-Y384 HydrophobicContact CG-CD2 4.06Å; R380-Y384 HydrophobicContact CG-CE2 3.63Å; R380-Y384 PolarHBondContact NE-OH 2.95Å; R380-Y384 VanDerWaalsContact NE-OH 3.12Å; R380-Y384 PolarHBondContact NH2-OH 3.11Å; R380-Y384 VanDerWaalsContact NH2-OH 3.08Å; R380-Y384 WeakPolarHBondContact O-CB 3.45Å; R380-Y384 WeakPolarHBondContact O-CD2 3.42Å; R380-Y384 PolarHBondContact O-N 2.9Å
381	R	81.3	Confident	77.9	Confident	150 Å²	150	103.3 Å²	103.3	57%	0.566	49%	0.487	S	S	*	.	H	α-helix	trans	-64.2	-38.4	173.7	-169	-176.1	71.6	163.5	0.8	112.3	V377 V378 R379 K385	V377-R381 WeakPolarHBondContact O-CB 3.46Å; V377-R381 PolarHBondContact O-N 2.91Å; V378-R381 WeakPolarHBondContact O-CB 3.42Å; V378-R381 PolarHBondContact O-N 3.25Å; V378-R381 VanDerWaalsContact O-N 3.17Å; R379-R381 VanDerWaalsContact C-N 3.33Å; R379-R381 PolarHBondContact O-N 3.22Å; R381-K385 WeakPolarHBondContact O-CG 3.42Å; R381-K385 PolarHBondContact O-N 3.25Å
382	E	78.5	Confident	77.9	Confident	103 Å²	103	103.5 Å²	103.5	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-70.8	-44.8	176.5	-70.7	172.8	-179.9	0	0	111.8	V378 R379 Y384 K385 L386	V378-E382 PolarHBondContact O-N 3.11Å; V378-E382 VanDerWaalsContact O-N 3.1Å; R379-E382 PolarHBondContact O-N 3.48Å; R379-E382 VanDerWaalsContact O-N 3.17Å; E382-Y384 VanDerWaalsContact C-N 3.3Å; E382-Y384 PolarHBondContact O-N 3.45Å; E382-K385 WeakPolarHBondContact O-CB 3.33Å; E382-K385 PolarHBondContact O-N 3.39Å; E382-K385 VanDerWaalsContact O-N 3.08Å; E382-L386 PolarHBondContact O-N 3.35Å
383	N	78.1	Confident	78	Confident	51 Å²	51	99.8 Å²	99.8	27%	0.273	47%	0.469	S	S	.	.	H	α-helix	trans	-58.2	-41.7	172.3	-73.1	-15.3	0	0	0	111.3	K156 R379 L386 V387	K156-N383 PolarHBondContact O-ND2 2.95Å; R379-N383 PolarHBondContact O-N 3.49Å; N383-L386 PolarHBondContact O-N 2.97Å; N383-V387 WeakPolarHBondContact O-CG2 3.48Å; N383-V387 PolarHBondContact O-N 3.19Å
384	Y	79.8	Confident	78.1	Confident	123 Å²	123	96.3 Å²	96.3	48%	0.482	46%	0.456	S	S	.	.	H	α-helix	trans	-65.1	-37.1	173	-75.4	-44.5	0	0	0	113.4	R380 E382 L386 V387 V388	R380-Y384 HydrophobicContact CG-CD2 4.06Å; R380-Y384 HydrophobicContact CG-CE2 3.63Å; R380-Y384 PolarHBondContact NE-OH 2.95Å; R380-Y384 VanDerWaalsContact NE-OH 3.12Å; R380-Y384 PolarHBondContact NH2-OH 3.11Å; R380-Y384 VanDerWaalsContact NH2-OH 3.08Å; R380-Y384 WeakPolarHBondContact O-CB 3.45Å; R380-Y384 WeakPolarHBondContact O-CD2 3.42Å; R380-Y384 PolarHBondContact O-N 2.9Å; E382-Y384 VanDerWaalsContact C-N 3.3Å; E382-Y384 PolarHBondContact O-N 3.45Å; Y384-L386 PolarHBondContact O-N 3.4Å; Y384-V387 PolarHBondContact O-N 3.41Å; Y384-V388 WeakPolarHBondContact O-CB 3.23Å; Y384-V388 VanDerWaalsContact O-CG2 3.31Å; Y384-V388 WeakPolarHBondContact O-CG2 3.34Å; Y384-V388 PolarHBondContact O-N 2.89Å
385	K	80.4	Confident	78.2	Confident	125 Å²	125	93.7 Å²	93.7	54%	0.543	45%	0.45	S	S	.	.	H	α-helix	trans	-60.6	-43.9	172.3	-77.6	-177.6	174.5	-169.7	0	111.8	R381 E382 V388 N389	R381-K385 WeakPolarHBondContact O-CG 3.42Å; R381-K385 PolarHBondContact O-N 3.25Å; E382-K385 WeakPolarHBondContact O-CB 3.33Å; E382-K385 PolarHBondContact O-N 3.39Å; E382-K385 VanDerWaalsContact O-N 3.08Å; K385-V388 PolarHBondContact O-N 2.93Å; K385-N389 WeakPolarHBondContact O-CB 3.43Å; K385-N389 VanDerWaalsContact O-CG 3.31Å; K385-N389 PolarHBondContact O-N 3.33Å; K385-N389 PolarHBondContact O-OD1 3.08Å
386	L	76.8	Confident	78.5	Confident	102 Å²	102	92 Å²	92	53%	0.534	45%	0.447	S	S	.	.	H	α-helix	trans	-62.7	-43.3	176.7	-67.1	173.8	0	0	0	111.6	E382 N383 Y384 N389 K390	E382-L386 PolarHBondContact O-N 3.35Å; N383-L386 PolarHBondContact O-N 2.97Å; Y384-L386 PolarHBondContact O-N 3.4Å; L386-N389 PolarHBondContact O-N 2.87Å; L386-K390 WeakPolarHBondContact O-CG 3.45Å; L386-K390 PolarHBondContact O-N 2.84Å
387	V	78.1	Confident	78.7	Confident	76 Å²	76	84.3 Å²	84.3	46%	0.461	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-45.3	175.4	171.1	0	0	0	0	111.5	N383 Y384 N389 K390 L391	N383-V387 WeakPolarHBondContact O-CG2 3.48Å; N383-V387 PolarHBondContact O-N 3.19Å; Y384-V387 PolarHBondContact O-N 3.41Å; V387-N389 PolarHBondContact O-N 3Å; V387-K390 PolarHBondContact O-N 3.17Å; V387-L391 HydrophobicContact CG1-CD1 3.79Å; V387-L391 HydrophobicContact CG1-CG 4.25Å; V387-L391 WeakPolarHBondContact O-CB 3.43Å; V387-L391 WeakPolarHBondContact O-CG 3.35Å; V387-L391 PolarHBondContact O-N 3.03Å
388	V	82.2	Confident	78.7	Confident	71 Å²	71	86.7 Å²	86.7	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-61.8	-42.1	177.5	167.2	0	0	0	0	111.6	Y384 K385 L391 K392	Y384-V388 WeakPolarHBondContact O-CB 3.23Å; Y384-V388 VanDerWaalsContact O-CG2 3.31Å; Y384-V388 WeakPolarHBondContact O-CG2 3.34Å; Y384-V388 PolarHBondContact O-N 2.89Å; K385-V388 PolarHBondContact O-N 2.93Å; V388-L391 PolarHBondContact O-N 2.99Å; V388-K392 HydrophobicContact CG1-CD 4.41Å; V388-K392 WeakPolarHBondContact O-CG 3.44Å; V388-K392 PolarHBondContact O-N 3.06Å
389	N	79.1	Confident	78.9	Confident	100 Å²	100	86.5 Å²	86.5	54%	0.535	43%	0.427	S	S	.	.	H	α-helix	trans	-64.2	-41.3	176.4	-71.5	-1.4	0	0	0	111.6	K385 L386 V387 K392 L393	K385-N389 WeakPolarHBondContact O-CB 3.43Å; K385-N389 VanDerWaalsContact O-CG 3.31Å; K385-N389 PolarHBondContact O-N 3.33Å; K385-N389 PolarHBondContact O-OD1 3.08Å; L386-N389 PolarHBondContact O-N 2.87Å; V387-N389 PolarHBondContact O-N 3Å; N389-K392 PolarHBondContact O-N 2.85Å; N389-L393 PolarHBondContact O-N 2.85Å; N389-L393 VanDerWaalsContact O-N 3.11Å
390	K	74.6	Confident	79.4	Confident	83 Å²	83	81 Å²	81	36%	0.361	41%	0.408	S	S	.	.	H	α-helix	trans	-65.3	-39.1	174.6	-75	-166.8	175.3	-163.2	0	112.9	L386 V387 L393 I394 F465	L386-K390 WeakPolarHBondContact O-CG 3.45Å; L386-K390 PolarHBondContact O-N 2.84Å; V387-K390 PolarHBondContact O-N 3.17Å; K390-L393 PolarHBondContact O-N 2.84Å; K390-I394 WeakPolarHBondContact O-CG1 3.38Å; K390-I394 PolarHBondContact O-N 3.42Å; K390-I394 VanDerWaalsContact O-N 3.08Å; K390-F465 HydrophobicContact CB-CE1 3.96Å; K390-F465 HydrophobicContact CB-CZ 3.7Å; K390-F465 HydrophobicContact CD-CE1 4.04Å; K390-F465 HydrophobicContact CD-CZ 3.78Å; K390-F465 HydrophobicContact CG-CE1 4.26Å; K390-F465 HydrophobicContact CG-CZ 3.7Å
391	L	79.9	Confident	79.7	Confident	101 Å²	101	81 Å²	81	53%	0.529	41%	0.411	S	S	.	.	H	α-helix	trans	-68.2	-37.4	175.3	-72.3	172.1	0	0	0	112.4	V387 V388 L393 I394 A395	V387-L391 HydrophobicContact CG1-CD1 3.79Å; V387-L391 HydrophobicContact CG1-CG 4.25Å; V387-L391 WeakPolarHBondContact O-CB 3.43Å; V387-L391 WeakPolarHBondContact O-CG 3.35Å; V387-L391 PolarHBondContact O-N 3.03Å; V388-L391 PolarHBondContact O-N 2.99Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-I394 HydrophobicContact CD2-CD1 4.48Å; L391-I394 PolarHBondContact O-N 2.79Å; L391-A395 WeakPolarHBondContact O-CB 3.36Å; L391-A395 PolarHBondContact O-N 3.2Å
392	K	81	Confident	79.9	Confident	143 Å²	143	76.9 Å²	76.9	62%	0.622	40%	0.403	S	S	*	.	H	α-helix	trans	-61.3	-41.5	172.4	-77.6	-178.7	175	-169.8	0	112.1	V388 N389 A395 S396	V388-K392 HydrophobicContact CG1-CD 4.41Å; V388-K392 WeakPolarHBondContact O-CG 3.44Å; V388-K392 PolarHBondContact O-N 3.06Å; N389-K392 PolarHBondContact O-N 2.85Å; K392-A395 PolarHBondContact O-N 3.43Å; K392-S396 WeakPolarHBondContact O-CB 3.26Å; K392-S396 PolarHBondContact O-N 3.15Å
393	L	77.2	Confident	80.3	Confident	28 Å²	28	75.1 Å²	75.1	15%	0.147	40%	0.4	C	S	.	.	H	α-helix	trans	-62	-48.4	174.3	-176	66.3	0	0	0	111.1	N389 K390 L391 A395 S396 L397 H430 F465	N389-L393 PolarHBondContact O-N 2.85Å; N389-L393 VanDerWaalsContact O-N 3.11Å; K390-L393 PolarHBondContact O-N 2.84Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L393-A395 VanDerWaalsContact C-N 3.34Å; L393-A395 PolarHBondContact O-N 2.73Å; L393-S396 WeakPolarHBondContact O-CB 3.44Å; L393-S396 PolarHBondContact O-N 3.07Å; L393-L397 HydrophobicContact CG-CD1 4.21Å; L393-L397 WeakPolarHBondContact O-CG 2.91Å; L393-L397 PolarHBondContact O-N 3.12Å; L393-H430 HydrophobicContact CD2-CB 3.88Å; L393-F465 HydrophobicContact CD2-CE2 4.11Å
394	I	79.2	Confident	80.6	Confident	46 Å²	46	72.8 Å²	72.8	24%	0.236	39%	0.387	C	S	.	.	H	α-helix	trans	-57.6	-45.3	176.2	-67.5	163.6	0	0	0	111.4	K390 L391 S396 L397 Q398 F465 L468	K390-I394 WeakPolarHBondContact O-CG1 3.38Å; K390-I394 PolarHBondContact O-N 3.42Å; K390-I394 VanDerWaalsContact O-N 3.08Å; L391-I394 HydrophobicContact CD2-CD1 4.48Å; L391-I394 PolarHBondContact O-N 2.79Å; I394-S396 VanDerWaalsContact C-N 3.33Å; I394-S396 PolarHBondContact O-N 2.85Å; I394-L397 PolarHBondContact O-N 3.45Å; I394-Q398 WeakPolarHBondContact O-CB 3.43Å; I394-Q398 PolarHBondContact O-N 3.2Å; I394-F465 HydrophobicContact CD1-CD1 3.99Å; I394-F465 HydrophobicContact CD1-CE1 3.65Å; I394-F465 HydrophobicContact CD1-CZ 4.47Å; I394-F465 HydrophobicContact CG1-CD1 4.41Å; I394-F465 HydrophobicContact CG1-CE1 4.07Å; I394-F465 HydrophobicContact CG1-CZ 4.49Å; I394-L468 HydrophobicContact CG1-CD1 4.25Å
395	A	80.3	Confident	80.8	Confident	56 Å²	56	72 Å²	72	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-63.2	-38.4	178.3	0	0	0	0	0	112.4	L391 K392 L393 Q398 A399	L391-A395 WeakPolarHBondContact O-CB 3.36Å; L391-A395 PolarHBondContact O-N 3.2Å; K392-A395 PolarHBondContact O-N 3.43Å; L393-A395 VanDerWaalsContact C-N 3.34Å; L393-A395 PolarHBondContact O-N 2.73Å; A395-Q398 PolarHBondContact O-N 3.34Å; A395-A399 PolarHBondContact O-N 3.08Å; A395-A399 VanDerWaalsContact O-N 3.07Å
396	S	81.4	Confident	81.1	Confident	67 Å²	67	69.6 Å²	69.6	47%	0.469	38%	0.384	S	S	.	.	H	α-helix	trans	-62.6	-47.1	173.7	-160.8	0	0	0	0	111.4	K392 L393 I394 Q398 A399 T400	K392-S396 WeakPolarHBondContact O-CB 3.26Å; K392-S396 PolarHBondContact O-N 3.15Å; L393-S396 WeakPolarHBondContact O-CB 3.44Å; L393-S396 PolarHBondContact O-N 3.07Å; I394-S396 VanDerWaalsContact C-N 3.33Å; I394-S396 PolarHBondContact O-N 2.85Å; S396-Q398 VanDerWaalsContact C-N 3.33Å; S396-Q398 PolarHBondContact O-N 3.5Å; S396-A399 PolarHBondContact O-N 3.28Å; S396-A399 VanDerWaalsContact O-N 3.15Å; S396-T400 WeakPolarHBondContact O-CG2 3.49Å; S396-T400 PolarHBondContact O-N 3.47Å
397	L	79.3	Confident	81.4	Confident	4 Å²	4	66.4 Å²	66.4	2%	0.021	37%	0.367	C	S	.	.	H	α-helix	trans	-65.7	-33.5	177.2	-63	174.8	0	0	0	112.4	L393 I394 A399 T400 T423 L427 L468 F471	L393-L397 HydrophobicContact CG-CD1 4.21Å; L393-L397 WeakPolarHBondContact O-CG 2.91Å; L393-L397 PolarHBondContact O-N 3.12Å; I394-L397 PolarHBondContact O-N 3.45Å; L397-A399 VanDerWaalsContact C-N 3.31Å; L397-T400 PolarHBondContact O-N 3.41Å; L397-T400 PolarHBondContact O-OG1 3.4Å; L397-T400 VanDerWaalsContact O-OG1 3.08Å; L397-T423 HydrophobicContact CD2-CG2 3.61Å; L397-L427 HydrophobicContact CD1-CD1 4.39Å; L397-L468 HydrophobicContact CD1-CD1 3.67Å; L397-F471 HydrophobicContact CB-CE1 3.99Å; L397-F471 HydrophobicContact CB-CZ 4.2Å; L397-F471 HydrophobicContact CD2-CE1 4.14Å; L397-F471 HydrophobicContact CG-CE1 4.45Å; L397-F471 WeakPolarHBondContact O-CZ 3.48Å
398	Q	79.5	Confident	81.5	Confident	146 Å²	146	64 Å²	64	68%	0.682	35%	0.352	S	S	*	.	H	α-helix	trans	-68.1	-31.4	173.7	-173.4	177.7	-2.2	0	0	112.1	I394 A395 S396 P402	I394-Q398 WeakPolarHBondContact O-CB 3.43Å; I394-Q398 PolarHBondContact O-N 3.2Å; A395-Q398 PolarHBondContact O-N 3.34Å; S396-Q398 VanDerWaalsContact C-N 3.33Å; S396-Q398 PolarHBondContact O-N 3.5Å; Q398-P402 VanDerWaalsContact O-CD 3.26Å; Q398-P402 WeakPolarHBondContact O-CD 3.42Å
399	A	82.6	Confident	81.3	Confident	51 Å²	51	70.5 Å²	70.5	42%	0.421	37%	0.369	S	S	.	.	H	α-helix	trans	-76.5	-19.7	179.2	0	0	0	0	0	113.9	A395 S396 L397 P402 T403	A395-A399 PolarHBondContact O-N 3.08Å; A395-A399 VanDerWaalsContact O-N 3.07Å; S396-A399 PolarHBondContact O-N 3.28Å; S396-A399 VanDerWaalsContact O-N 3.15Å; L397-A399 VanDerWaalsContact C-N 3.31Å; A399-P402 WeakPolarHBondContact O-CD 3.29Å; A399-P402 WeakPolarHBondContact O-CG 3.4Å; A399-T403 WeakPolarHBondContact O-CB 3.44Å; A399-T403 PolarHBondContact O-N 2.98Å; A399-T403 PolarHBondContact O-OG1 3.22Å
400	T	82.6	Confident	81.3	Confident	14 Å²	14	71.4 Å²	71.4	9%	0.086	37%	0.373	C	S	.	.	H	α-helix	trans	-69.3	-36.3	178.4	69.3	0	0	0	0	111.8	S396 L397 T403 I404 L419 T423	S396-T400 WeakPolarHBondContact O-CG2 3.49Å; S396-T400 PolarHBondContact O-N 3.47Å; L397-T400 PolarHBondContact O-N 3.41Å; L397-T400 PolarHBondContact O-OG1 3.4Å; L397-T400 VanDerWaalsContact O-OG1 3.08Å; T400-T403 WeakPolarHBondContact O-CB 3.42Å; T400-T403 PolarHBondContact O-N 3.1Å; T400-T403 VanDerWaalsContact O-N 3.14Å; T400-I404 VanDerWaalsContact O-CG1 3.28Å; T400-I404 WeakPolarHBondContact O-CG1 3.25Å; T400-I404 PolarHBondContact O-N 2.81Å; T400-L419 HydrophobicContact CG2-CD1 4.1Å; T400-T423 HydrophobicContact CG2-CG2 4.28Å; T400-T423 WeakPolarHBondContact CG2-OG1 3.46Å
401	Q	81.5	Confident	81.2	Confident	60 Å²	60	69.4 Å²	69.4	28%	0.28	37%	0.367	S	S	.	.	H	α-helix	trans	-55.5	-55.1	179.6	-174.4	64.5	23	0	0	114.5	T403 I404 Q405	Q401-T403 VanDerWaalsContact C-N 3.28Å; Q401-T403 PolarHBondContact O-N 3.4Å; Q401-I404 PolarHBondContact O-N 2.83Å; Q401-Q405 WeakPolarHBondContact O-CG 3.32Å; Q401-Q405 PolarHBondContact O-N 3.32Å; Q401-Q405 VanDerWaalsContact O-N 3.1Å
402	P	86.3	Confident	81.2	Confident	64 Å²	64	67.6 Å²	67.6	42%	0.416	36%	0.357	S	S	.	.	H	α-helix	trans	-68.9	-26.6	176.1	28.1	-36	0	0	0	112.6	Q398 A399 Q405 T406	Q398-P402 VanDerWaalsContact O-CD 3.26Å; Q398-P402 WeakPolarHBondContact O-CD 3.42Å; A399-P402 WeakPolarHBondContact O-CD 3.29Å; A399-P402 WeakPolarHBondContact O-CG 3.4Å; P402-Q405 PolarHBondContact O-N 3.46Å; P402-T406 PolarHBondContact O-N 2.71Å; P402-T406 PolarHBondContact O-OG1 3Å
403	T	86.7	Confident	81.2	Confident	66 Å²	66	60.8 Å²	60.8	41%	0.405	33%	0.328	S	S	.	.	H	α-helix	trans	-68	-46.7	176.1	-54.2	0	0	0	0	110.8	A399 T400 Q401 Q405 T406 L407 L419	A399-T403 WeakPolarHBondContact O-CB 3.44Å; A399-T403 PolarHBondContact O-N 2.98Å; A399-T403 PolarHBondContact O-OG1 3.22Å; T400-T403 WeakPolarHBondContact O-CB 3.42Å; T400-T403 PolarHBondContact O-N 3.1Å; T400-T403 VanDerWaalsContact O-N 3.14Å; Q401-T403 VanDerWaalsContact C-N 3.28Å; Q401-T403 PolarHBondContact O-N 3.4Å; T403-Q405 VanDerWaalsContact C-N 3.34Å; T403-Q405 PolarHBondContact O-N 3.1Å; T403-T406 WeakPolarHBondContact O-CA 3.15Å; T403-T406 WeakPolarHBondContact O-CB 3.46Å; T403-T406 PolarHBondContact O-N 3.31Å; T403-L407 HydrophobicContact CG2-CD1 4.36Å; T403-L407 WeakPolarHBondContact O-CG 3.26Å; T403-L407 PolarHBondContact O-N 2.81Å; T403-L419 HydrophobicContact CG2-CD2 3.56Å
404	I	84.6	Confident	81.3	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-56.9	-48.5	171.9	-65	160	0	0	0	109.8	T400 Q401 T406 L407 L408 A416 L419 V420 I478	T400-I404 VanDerWaalsContact O-CG1 3.28Å; T400-I404 WeakPolarHBondContact O-CG1 3.25Å; T400-I404 PolarHBondContact O-N 2.81Å; Q401-I404 PolarHBondContact O-N 2.83Å; I404-T406 PolarHBondContact O-N 2.88Å; I404-T406 VanDerWaalsContact O-N 3.13Å; I404-L407 PolarHBondContact O-N 2.88Å; I404-L408 HydrophobicContact CG2-CD1 3.78Å; I404-L408 HydrophobicContact CG2-CG 4.07Å; I404-L408 WeakPolarHBondContact O-CB 3.44Å; I404-L408 VanDerWaalsContact O-CG 3.27Å; I404-L408 WeakPolarHBondContact O-CG 3.5Å; I404-L408 PolarHBondContact O-N 2.84Å; I404-A416 HydrophobicContact CG2-CB 4.46Å; I404-L419 HydrophobicContact CG1-CB 4.49Å; I404-L419 HydrophobicContact CG1-CD2 3.77Å; I404-L419 HydrophobicContact CG1-CG 4.08Å; I404-V420 HydrophobicContact CD1-CG2 3.63Å; I404-V420 HydrophobicContact CG1-CG2 4.29Å; I404-I478 HydrophobicContact CG2-CG2 3.98Å
405	Q	83.5	Confident	81.4	Confident	106 Å²	106	59.6 Å²	59.6	50%	0.495	33%	0.328	S	S	.	.	H	α-helix	trans	-61	-22.2	176.8	-72.2	178.8	-17.9	0	0	114	Q401 P402 T403 R409	Q401-Q405 WeakPolarHBondContact O-CG 3.32Å; Q401-Q405 PolarHBondContact O-N 3.32Å; Q401-Q405 VanDerWaalsContact O-N 3.1Å; P402-Q405 PolarHBondContact O-N 3.46Å; T403-Q405 VanDerWaalsContact C-N 3.34Å; T403-Q405 PolarHBondContact O-N 3.1Å; Q405-R409 WeakPolarHBondContact O-CD 3.28Å; Q405-R409 VanDerWaalsContact O-CG 3.25Å; Q405-R409 WeakPolarHBondContact O-CG 3.46Å
406	T	87	Confident	81.6	Confident	76 Å²	76	57 Å²	57	47%	0.466	31%	0.306	S	S	.	.	H	α-helix	trans	-83.9	-43.3	174.8	-54	0	0	0	0	111.2	P402 T403 I404 L408 R409 N410	P402-T406 PolarHBondContact O-N 2.71Å; P402-T406 PolarHBondContact O-OG1 3Å; T403-T406 WeakPolarHBondContact O-CA 3.15Å; T403-T406 WeakPolarHBondContact O-CB 3.46Å; T403-T406 PolarHBondContact O-N 3.31Å; I404-T406 PolarHBondContact O-N 2.88Å; I404-T406 VanDerWaalsContact O-N 3.13Å; T406-L408 VanDerWaalsContact C-N 3.35Å; T406-L408 PolarHBondContact O-N 3.47Å; T406-R409 WeakPolarHBondContact O-CB 3.45Å; T406-R409 PolarHBondContact O-N 3.1Å; T406-R409 VanDerWaalsContact O-N 3.15Å; T406-N410 PolarHBondContact O-N 3.23Å; T406-N410 PolarHBondContact O-OD1 3.06Å
407	L	82.9	Confident	81.6	Confident	35 Å²	35	54.5 Å²	54.5	18%	0.183	29%	0.287	C	S	.	.	H	α-helix	trans	-61	-42.9	175.2	-66.1	169.3	0	0	0	111.8	T403 I404 R409 N410 N411 D412 A415 A416 L419	T403-L407 HydrophobicContact CG2-CD1 4.36Å; T403-L407 WeakPolarHBondContact O-CG 3.26Å; T403-L407 PolarHBondContact O-N 2.81Å; I404-L407 PolarHBondContact O-N 2.88Å; L407-R409 VanDerWaalsContact C-N 3.26Å; L407-R409 PolarHBondContact O-N 3.38Å; L407-N410 CarbonylContact O-C 3.6Å; L407-N410 PolarHBondContact O-N 3.38Å; L407-N411 PolarHBondContact O-N 2.93Å; L407-D412 HydrophobicContact CD2-CB 4.37Å; L407-D412 PolarHBondContact O-N 2.84Å; L407-A415 HydrophobicContact CD1-CB 4.01Å; L407-A415 HydrophobicContact CD2-CB 4.12Å; L407-A416 HydrophobicContact CB-CB 4.09Å; L407-L419 HydrophobicContact CD1-CD2 4.04Å
408	L	81.3	Confident	81.8	Confident	26 Å²	26	56.3 Å²	56.3	14%	0.136	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.8	176.2	-63.8	-176.8	0	0	0	114.1	I404 T406 F413 A416 V482 M485	I404-L408 HydrophobicContact CG2-CD1 3.78Å; I404-L408 HydrophobicContact CG2-CG 4.07Å; I404-L408 WeakPolarHBondContact O-CB 3.44Å; I404-L408 VanDerWaalsContact O-CG 3.27Å; I404-L408 WeakPolarHBondContact O-CG 3.5Å; I404-L408 PolarHBondContact O-N 2.84Å; T406-L408 VanDerWaalsContact C-N 3.35Å; T406-L408 PolarHBondContact O-N 3.47Å; L408-F413 HydrophobicContact CD2-CD1 3.98Å; L408-A416 HydrophobicContact CD2-CB 3.47Å; L408-A416 VanDerWaalsContact CD2-CB 3.47Å; L408-A416 HydrophobicContact CG-CB 4.06Å; L408-V482 HydrophobicContact CD1-CG2 3.58Å; L408-V482 HydrophobicContact CD2-CG1 4.11Å; L408-V482 HydrophobicContact CD2-CG2 3.64Å; L408-V482 HydrophobicContact CG-CG2 4.23Å; L408-M485 HydrophobicContact CB-CE 4.05Å; L408-M485 HydrophobicContact CD1-CE 4.21Å; L408-M485 HydrophobicContact CD2-CE 3.73Å; L408-M485 HydrophobicContact CG-CE 4.19Å
409	R	77.5	Confident	82	Confident	207 Å²	207	51.3 Å²	51.3	78%	0.781	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-15.4	169.9	-78.5	172.5	177	-167.6	-1.3	113.2	Q405 T406 L407	Q405-R409 WeakPolarHBondContact O-CD 3.28Å; Q405-R409 VanDerWaalsContact O-CG 3.25Å; Q405-R409 WeakPolarHBondContact O-CG 3.46Å; T406-R409 WeakPolarHBondContact O-CB 3.45Å; T406-R409 PolarHBondContact O-N 3.1Å; T406-R409 VanDerWaalsContact O-N 3.15Å; L407-R409 VanDerWaalsContact C-N 3.26Å; L407-R409 PolarHBondContact O-N 3.38Å
410	N	78	Confident	82.1	Confident	118 Å²	118	49 Å²	49	63%	0.631	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	15.1	179.8	-61.8	0.4	0	0	0	111.4	T406 L407 D412	T406-N410 PolarHBondContact O-N 3.23Å; T406-N410 PolarHBondContact O-OD1 3.06Å; L407-N410 CarbonylContact O-C 3.6Å; L407-N410 PolarHBondContact O-N 3.38Å; N410-D412 PolarHBondContact O-N 2.89Å
411	N	72.4	Confident	82.2	Confident	41 Å²	41	50.5 Å²	50.5	22%	0.219	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	15.2	-175.7	-63	-16.8	0	0	0	115.9	L407 F413 D512 S515	L407-N411 PolarHBondContact O-N 2.93Å; N411-F413 VanDerWaalsContact C-N 3.32Å; N411-F413 HydrophobicContact CB-CE1 4.48Å; N411-F413 HydrophobicContact CB-CE2 4.21Å; N411-F413 HydrophobicContact CB-CZ 3.9Å; N411-F413 VanDerWaalsContact O-CD2 3.28Å; N411-F413 WeakPolarHBondContact O-CD2 3.22Å; N411-F413 WeakPolarHBondContact O-CE2 3.17Å; N411-F413 PolarHBondContact O-N 3.05Å; N411-D512 PolarHBondContact ND2-OD1 3.07Å; N411-S515 WeakPolarHBondContact O-CB 3.42Å
412	D	80.8	Confident	82.3	Confident	63 Å²	63	50.7 Å²	50.7	34%	0.337	27%	0.272	S	S	.	.			trans	-84.6	76.4	176.8	-169.5	-10.3	0	0	0	111	L407 N410 C414 A415 A416	L407-D412 HydrophobicContact CD2-CB 4.37Å; L407-D412 PolarHBondContact O-N 2.84Å; N410-D412 PolarHBondContact O-N 2.89Å; D412-C414 VanDerWaalsContact C-N 3.28Å; D412-C414 PolarHBondContact O-N 3.39Å; D412-C414 PolarHBondContact OD1-N 2.93Å; D412-A415 VanDerWaalsContact CG-CB 3.41Å; D412-A415 WeakPolarHBondContact OD1-CB 3.46Å; D412-A415 PolarHBondContact OD1-N 3.15Å; D412-A415 WeakPolarHBondContact OD2-CB 3.48Å; D412-A416 VanDerWaalsContact O-CB 3.3Å; D412-A416 WeakPolarHBondContact O-CB 3.5Å; D412-A416 PolarHBondContact O-N 3.18Å
413	F	80.5	Confident	82.2	Confident	1 Å²	1	47.7 Å²	47.7	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-68.6	-27.8	179	-46.2	-56.2	0	0	0	112.5	L408 N411 L417 V482 M485 V486 E489	L408-F413 HydrophobicContact CD2-CD1 3.98Å; N411-F413 VanDerWaalsContact C-N 3.32Å; N411-F413 HydrophobicContact CB-CE1 4.48Å; N411-F413 HydrophobicContact CB-CE2 4.21Å; N411-F413 HydrophobicContact CB-CZ 3.9Å; N411-F413 VanDerWaalsContact O-CD2 3.28Å; N411-F413 WeakPolarHBondContact O-CD2 3.22Å; N411-F413 WeakPolarHBondContact O-CE2 3.17Å; N411-F413 PolarHBondContact O-N 3.05Å; F413-L417 WeakPolarHBondContact O-CB 3.48Å; F413-L417 VanDerWaalsContact O-CG 3.27Å; F413-L417 WeakPolarHBondContact O-CG 3.33Å; F413-L417 PolarHBondContact O-N 3.02Å; F413-V482 HydrophobicContact CB-CG1 4.47Å; F413-M485 HydrophobicContact CD1-CE 3.96Å; F413-M485 HydrophobicContact CE1-CE 3.6Å; F413-V486 HydrophobicContact CB-CG2 3.56Å; F413-V486 HydrophobicContact CD1-CG2 3.85Å; F413-V486 HydrophobicContact CD2-CG2 3.72Å; F413-V486 HydrophobicContact CE2-CG2 4.37Å; F413-V486 HydrophobicContact CG-CG2 3.41Å; F413-V486 VanDerWaalsContact CG-CG2 3.41Å; F413-E489 HydrophobicContact CZ-CB 4.27Å; F413-E489 HydrophobicContact CZ-CG 4.35Å
414	C	79.7	Confident	82	Confident	15 Å²	15	46.9 Å²	46.9	10%	0.101	24%	0.243	C	C	.	.	H	α-helix	trans	-71.5	-53.1	179.9	-70.8	0	0	0	0	111.5	D412 A416 L417 D418 L518	D412-C414 VanDerWaalsContact C-N 3.28Å; D412-C414 PolarHBondContact O-N 3.39Å; D412-C414 PolarHBondContact OD1-N 2.93Å; C414-A416 PolarHBondContact O-N 3.47Å; C414-L417 PolarHBondContact O-N 3Å; C414-D418 WeakPolarHBondContact O-CB 3.23Å; C414-D418 PolarHBondContact O-N 3.45Å; C414-L518 VanDerWaalsContact SG-CB 3.57Å; C414-L518 PolarHBondContact SG-O 2.77Å
415	A	80.3	Confident	81.8	Confident	34 Å²	34	53 Å²	53	28%	0.281	27%	0.272	S	S	.	.	H	α-helix	trans	-63.8	-31.7	175.8	0	0	0	0	0	111.6	L407 D412 L419	L407-A415 HydrophobicContact CD1-CB 4.01Å; L407-A415 HydrophobicContact CD2-CB 4.12Å; D412-A415 VanDerWaalsContact CG-CB 3.41Å; D412-A415 WeakPolarHBondContact OD1-CB 3.46Å; D412-A415 PolarHBondContact OD1-N 3.15Å; D412-A415 WeakPolarHBondContact OD2-CB 3.48Å; A415-L419 WeakPolarHBondContact O-CB 3.43Å; A415-L419 PolarHBondContact O-N 3.5Å
416	A	84.9	Confident	81.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.6	-45.6	173.7	0	0	0	0	0	112.5	I404 L407 L408 D412 C414 V420	I404-A416 HydrophobicContact CG2-CB 4.46Å; L407-A416 HydrophobicContact CB-CB 4.09Å; L408-A416 HydrophobicContact CD2-CB 3.47Å; L408-A416 VanDerWaalsContact CD2-CB 3.47Å; L408-A416 HydrophobicContact CG-CB 4.06Å; D412-A416 VanDerWaalsContact O-CB 3.3Å; D412-A416 WeakPolarHBondContact O-CB 3.5Å; D412-A416 PolarHBondContact O-N 3.18Å; C414-A416 PolarHBondContact O-N 3.47Å; A416-V420 WeakPolarHBondContact O-CG2 3.24Å; A416-V420 PolarHBondContact O-N 3.28Å
417	L	81.6	Confident	80.9	Confident	15 Å²	15	48.4 Å²	48.4	8%	0.079	25%	0.248	C	C	.	.	H	α-helix	trans	-68.2	-37.4	176.9	-72.6	171	0	0	0	112.3	F413 C414 V420 S421 V482 R522 I523	F413-L417 WeakPolarHBondContact O-CB 3.48Å; F413-L417 VanDerWaalsContact O-CG 3.27Å; F413-L417 WeakPolarHBondContact O-CG 3.33Å; F413-L417 PolarHBondContact O-N 3.02Å; C414-L417 PolarHBondContact O-N 3Å; L417-V420 PolarHBondContact O-N 3.14Å; L417-S421 PolarHBondContact O-N 3.44Å; L417-S421 PolarHBondContact O-OG 3.13Å; L417-V482 HydrophobicContact CD1-CG1 4.33Å; L417-V482 HydrophobicContact CD2-CB 4.19Å; L417-V482 HydrophobicContact CD2-CG1 3.89Å; L417-V482 HydrophobicContact CG-CG1 3.93Å; L417-R522 HydrophobicContact CD1-CB 4.34Å; L417-R522 HydrophobicContact CD1-CG 4.18Å; L417-I523 HydrophobicContact CD1-CD1 4.24Å; L417-I523 HydrophobicContact CD1-CG1 3.76Å
418	D	82.8	Confident	80.4	Confident	43 Å²	43	51.7 Å²	51.7	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-73.1	-31.6	177.8	-72.4	-10.1	0	0	0	112.4	C414 S421 T422 R522	C414-D418 WeakPolarHBondContact O-CB 3.23Å; C414-D418 PolarHBondContact O-N 3.45Å; D418-S421 WeakPolarHBondContact CA-OG 3.49Å; D418-S421 PolarHBondContact O-OG 3.44Å; D418-S421 VanDerWaalsContact O-OG 3.07Å; D418-T422 WeakPolarHBondContact O-CB 3.39Å; D418-T422 VanDerWaalsContact O-CG2 3.32Å; D418-T422 WeakPolarHBondContact O-CG2 3.25Å; D418-T422 PolarHBondContact O-N 3.1Å; D418-T422 PolarHBondContact O-OG1 3.34Å; D418-R522 IonicContact OD1-CZ 2.96Å; D418-R522 IonicContact OD1-NE 2.97Å; D418-R522 PolarHBondContact OD1-NE 2.81Å; D418-R522 IonicContact OD1-NH2 3.15Å; D418-R522 PolarHBondContact OD1-NH2 2.84Å; D418-R522 IonicContact OD2-CZ 3.88Å; D418-R522 IonicContact OD2-NE 2.69Å; D418-R522 IonicContact OD2-NH2 2.74Å
419	L	84.8	Confident	79.8	Confident	40 Å²	40	53.2 Å²	53.2	21%	0.209	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-38	167.9	-176.9	55.9	0	0	0	111.3	T400 T403 I404 L407 A415 T422 T423	T400-L419 HydrophobicContact CG2-CD1 4.1Å; T403-L419 HydrophobicContact CG2-CD2 3.56Å; I404-L419 HydrophobicContact CG1-CB 4.49Å; I404-L419 HydrophobicContact CG1-CD2 3.77Å; I404-L419 HydrophobicContact CG1-CG 4.08Å; L407-L419 HydrophobicContact CD1-CD2 4.04Å; A415-L419 WeakPolarHBondContact O-CB 3.43Å; A415-L419 PolarHBondContact O-N 3.5Å; L419-T422 WeakPolarHBondContact CA-OG1 3.5Å; L419-T422 PolarHBondContact O-OG1 2.89Å; L419-T423 VanDerWaalsContact O-CB 3.23Å; L419-T423 WeakPolarHBondContact O-CB 3.44Å; L419-T423 PolarHBondContact O-N 3.4Å; L419-T423 PolarHBondContact O-OG1 3.41Å
420	V	84.1	Confident	79.2	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.024	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-44.3	174.5	167.7	0	0	0	0	111.9	I404 A416 L417 T423 K424 L475 I478	I404-V420 HydrophobicContact CD1-CG2 3.63Å; I404-V420 HydrophobicContact CG1-CG2 4.29Å; A416-V420 WeakPolarHBondContact O-CG2 3.24Å; A416-V420 PolarHBondContact O-N 3.28Å; L417-V420 PolarHBondContact O-N 3.14Å; V420-T423 PolarHBondContact O-N 3Å; V420-K424 WeakPolarHBondContact O-CG 3.27Å; V420-K424 PolarHBondContact O-N 3.32Å; V420-L475 HydrophobicContact CG1-CB 4.38Å; V420-I478 HydrophobicContact CG2-CG2 4.06Å
421	S	84.4	Confident	78.2	Confident	44 Å²	44	44.4 Å²	44.4	31%	0.308	24%	0.24	S	C	.	.	H	α-helix	trans	-67.1	-49	-179.5	64.9	0	0	0	0	111.9	L417 D418 T423 K424 E425	L417-S421 PolarHBondContact O-N 3.44Å; L417-S421 PolarHBondContact O-OG 3.13Å; D418-S421 WeakPolarHBondContact CA-OG 3.49Å; D418-S421 PolarHBondContact O-OG 3.44Å; D418-S421 VanDerWaalsContact O-OG 3.07Å; S421-T423 VanDerWaalsContact C-N 3.28Å; S421-T423 PolarHBondContact O-N 2.59Å; S421-K424 WeakPolarHBondContact O-CB 3.25Å; S421-K424 PolarHBondContact O-N 3.23Å; S421-E425 PolarHBondContact O-N 3.46Å
422	T	84.8	Confident	77	Confident	64 Å²	64	48 Å²	48	39%	0.393	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-34.6	174.9	53.6	0	0	0	0	112.4	D418 L419 E425 L426	D418-T422 WeakPolarHBondContact O-CB 3.39Å; D418-T422 VanDerWaalsContact O-CG2 3.32Å; D418-T422 WeakPolarHBondContact O-CG2 3.25Å; D418-T422 PolarHBondContact O-N 3.1Å; D418-T422 PolarHBondContact O-OG1 3.34Å; L419-T422 WeakPolarHBondContact CA-OG1 3.5Å; L419-T422 PolarHBondContact O-OG1 2.89Å; T422-E425 PolarHBondContact O-N 3.24Å; T422-L426 WeakPolarHBondContact O-CB 3.46Å; T422-L426 VanDerWaalsContact O-CG 3.29Å; T422-L426 WeakPolarHBondContact O-CG 3.48Å; T422-L426 PolarHBondContact O-N 3.48Å
423	T	83.7	Confident	75.5	Confident	1 Å²	1	48 Å²	48	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-40.9	172.7	-57.8	0	0	0	0	111.9	L397 T400 L419 V420 S421 L426 L427 F471 L475	L397-T423 HydrophobicContact CD2-CG2 3.61Å; T400-T423 HydrophobicContact CG2-CG2 4.28Å; T400-T423 WeakPolarHBondContact CG2-OG1 3.46Å; L419-T423 VanDerWaalsContact O-CB 3.23Å; L419-T423 WeakPolarHBondContact O-CB 3.44Å; L419-T423 PolarHBondContact O-N 3.4Å; L419-T423 PolarHBondContact O-OG1 3.41Å; V420-T423 PolarHBondContact O-N 3Å; S421-T423 VanDerWaalsContact C-N 3.28Å; S421-T423 PolarHBondContact O-N 2.59Å; T423-L426 PolarHBondContact O-N 3.02Å; T423-L427 WeakPolarHBondContact O-CB 3.43Å; T423-L427 PolarHBondContact O-N 3.11Å; T423-F471 HydrophobicContact CG2-CE1 3.83Å; T423-F471 HydrophobicContact CG2-CZ 4.37Å; T423-L475 HydrophobicContact CG2-CD1 3.66Å; T423-L475 HydrophobicContact CG2-CD2 4.03Å; T423-L475 HydrophobicContact CG2-CG 4.5Å
424	K	81.7	Confident	73.9	Confident	50 Å²	50	52.3 Å²	52.3	22%	0.217	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-42.1	174.1	-74.6	174.7	168.1	-98	0	111.9	V420 S421 L427 H428 D472 L475 S476	V420-K424 WeakPolarHBondContact O-CG 3.27Å; V420-K424 PolarHBondContact O-N 3.32Å; S421-K424 WeakPolarHBondContact O-CB 3.25Å; S421-K424 PolarHBondContact O-N 3.23Å; K424-L427 WeakPolarHBondContact O-CB 3.3Å; K424-L427 PolarHBondContact O-N 3.35Å; K424-H428 PolarHBondContact O-CD2 3Å; K424-H428 VanDerWaalsContact O-CD2 3.29Å; K424-H428 PolarHBondContact O-N 2.71Å; K424-D472 WeakPolarHBondContact CE-OD1 3.42Å; K424-D472 IonicContact NZ-OD1 3.49Å; K424-D472 PolarHBondContact NZ-OD1 3.37Å; K424-L475 HydrophobicContact CG-CB 4.21Å; K424-L475 HydrophobicContact CG-CD1 3.84Å; K424-S476 PolarHBondContact NZ-OG 3.4Å
425	E	80.3	Confident	72.1	Confident	129 Å²	129	55.6 Å²	55.6	60%	0.603	31%	0.311	S	S	*	.	H	α-helix	trans	-64.6	-40.7	176.3	-70.6	-179.6	-178.2	0	0	112.3	S421 T422 L427 H428 S429	S421-E425 PolarHBondContact O-N 3.46Å; T422-E425 PolarHBondContact O-N 3.24Å; E425-L427 VanDerWaalsContact C-N 3.32Å; E425-L427 PolarHBondContact O-N 2.99Å; E425-H428 PolarHBondContact O-N 3.05Å; E425-S429 VanDerWaalsContact O-CB 3.25Å; E425-S429 WeakPolarHBondContact O-CB 3.35Å; E425-S429 PolarHBondContact O-N 3.04Å; E425-S429 PolarHBondContact O-OG 2.92Å
426	L	77.3	Confident	69.8	Low	74 Å²	74	58 Å²	58	39%	0.387	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-39	172.6	-76.1	170.3	0	0	0	112.1	T422 T423 S429 H430	T422-L426 WeakPolarHBondContact O-CB 3.46Å; T422-L426 VanDerWaalsContact O-CG 3.29Å; T422-L426 WeakPolarHBondContact O-CG 3.48Å; T422-L426 PolarHBondContact O-N 3.48Å; T423-L426 PolarHBondContact O-N 3.02Å; L426-S429 WeakPolarHBondContact CA-OG 3.44Å; L426-S429 PolarHBondContact O-OG 3.29Å; L426-S429 VanDerWaalsContact O-OG 3.1Å; L426-H430 PolarHBondContact O-N 2.87Å; L426-H430 PolarHBondContact O-ND1 3.32Å
427	L	75	Confident	67.2	Low	13 Å²	13	63 Å²	63	7%	0.068	36%	0.361	C	S	.	.	H	α-helix	trans	-66.6	-50.1	175.2	-173.8	66.7	0	0	0	111.4	L397 T423 K424 E425 L431 F471 D472	L397-L427 HydrophobicContact CD1-CD1 4.39Å; T423-L427 WeakPolarHBondContact O-CB 3.43Å; T423-L427 PolarHBondContact O-N 3.11Å; K424-L427 WeakPolarHBondContact O-CB 3.3Å; K424-L427 PolarHBondContact O-N 3.35Å; E425-L427 VanDerWaalsContact C-N 3.32Å; E425-L427 PolarHBondContact O-N 2.99Å; L427-L431 HydrophobicContact CD1-CD1 4.34Å; L427-L431 HydrophobicContact CG-CD1 4.11Å; L427-L431 WeakPolarHBondContact O-CB 3.34Å; L427-L431 VanDerWaalsContact O-CG 3.24Å; L427-L431 WeakPolarHBondContact O-CG 3.42Å; L427-L431 PolarHBondContact O-N 3.38Å; L427-L431 VanDerWaalsContact O-N 3.11Å; L427-F471 HydrophobicContact CD2-CD1 4.43Å; L427-D472 HydrophobicContact CD2-CB 3.92Å
428	H	72.7	Confident	65	Low	104 Å²	104	67 Å²	67	48%	0.481	39%	0.39	S	S	.	.	H	α-helix	trans	-63.8	-45.8	179.7	-84.5	-73.1	0	0	0	112.9	K424 E425 H430 L431 M432	K424-H428 PolarHBondContact O-CD2 3Å; K424-H428 VanDerWaalsContact O-CD2 3.29Å; K424-H428 PolarHBondContact O-N 2.71Å; E425-H428 PolarHBondContact O-N 3.05Å; H428-H430 PolarHBondContact O-N 2.89Å; H428-L431 PolarHBondContact O-N 3.05Å; H428-M432 WeakPolarHBondContact O-CB 3.3Å; H428-M432 WeakPolarHBondContact O-CG 3.16Å; H428-M432 PolarHBondContact O-N 2.89Å
429	S	69.3	Low	62.4	Low	58 Å²	58	71.8 Å²	71.8	41%	0.406	42%	0.416	S	S	.	.	H	α-helix	trans	-60	-45.4	-180	53.1	0	0	0	0	112.3	E425 L426 L431 M432 A433	E425-S429 VanDerWaalsContact O-CB 3.25Å; E425-S429 WeakPolarHBondContact O-CB 3.35Å; E425-S429 PolarHBondContact O-N 3.04Å; E425-S429 PolarHBondContact O-OG 2.92Å; L426-S429 WeakPolarHBondContact CA-OG 3.44Å; L426-S429 PolarHBondContact O-OG 3.29Å; L426-S429 VanDerWaalsContact O-OG 3.1Å; S429-L431 VanDerWaalsContact C-N 3.34Å; S429-L431 PolarHBondContact O-N 2.86Å; S429-M432 PolarHBondContact O-N 3.42Å; S429-A433 VanDerWaalsContact O-CB 3.26Å; S429-A433 WeakPolarHBondContact O-CB 3.43Å; S429-A433 PolarHBondContact O-N 3.38Å
430	H	63.9	Low	59.7	Low	85 Å²	85	78.3 Å²	78.3	39%	0.394	45%	0.45	S	S	.	.	H	α-helix	trans	-72.1	-25.4	178.1	-72.1	81.8	0	0	0	113.5	L393 L426 H428 N434	L393-H430 HydrophobicContact CD2-CB 3.88Å; L426-H430 PolarHBondContact O-N 2.87Å; L426-H430 PolarHBondContact O-ND1 3.32Å; H428-H430 PolarHBondContact O-N 2.89Å; H430-N434 PolarHBondContact O-ND2 3.02Å
431	L	57.3	Low	57.1	Low	54 Å²	54	83.6 Å²	83.6	28%	0.283	49%	0.487	S	S	.	.	H	α-helix	trans	-74	-39.2	170.3	-71.5	171.4	0	0	0	112	L427 H428 S429 T464	L427-L431 HydrophobicContact CD1-CD1 4.34Å; L427-L431 HydrophobicContact CG-CD1 4.11Å; L427-L431 WeakPolarHBondContact O-CB 3.34Å; L427-L431 VanDerWaalsContact O-CG 3.24Å; L427-L431 WeakPolarHBondContact O-CG 3.42Å; L427-L431 PolarHBondContact O-N 3.38Å; L427-L431 VanDerWaalsContact O-N 3.11Å; H428-L431 PolarHBondContact O-N 3.05Å; S429-L431 VanDerWaalsContact C-N 3.34Å; S429-L431 PolarHBondContact O-N 2.86Å; L431-T464 HydrophobicContact CD2-CG2 3.95Å
432	M	47.2	Very low	54.5	Low	118 Å²	118	87 Å²	87	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-79.9	-42.8	-177.5	-66.6	-62	97.2	0	0	113.4	H428 S429 N434 S435	H428-M432 WeakPolarHBondContact O-CB 3.3Å; H428-M432 WeakPolarHBondContact O-CG 3.16Å; H428-M432 PolarHBondContact O-N 2.89Å; S429-M432 PolarHBondContact O-N 3.42Å; M432-N434 PolarHBondContact O-N 3.3Å; M432-N434 VanDerWaalsContact O-N 3.1Å; M432-S435 WeakPolarHBondContact O-CB 3.5Å; M432-S435 PolarHBondContact O-N 3.32Å; M432-S435 PolarHBondContact O-OG 3.33Å
433	A	48.4	Very low	51.6	Low	63 Å²	63	90.7 Å²	90.7	52%	0.521	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-61.5	-24.5	-172.8	0	0	0	0	0	114.6	S429 S435	S429-A433 VanDerWaalsContact O-CB 3.26Å; S429-A433 WeakPolarHBondContact O-CB 3.43Å; S429-A433 PolarHBondContact O-N 3.38Å; A433-S435 PolarHBondContact O-N 3.02Å
434	N	47.6	Very low	48.9	Very low	90 Å²	90	98 Å²	98	48%	0.481	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-79.2	0.5	175	-67.9	-70.9	0	0	0	113.5	H430 M432	H430-N434 PolarHBondContact O-ND2 3.02Å; M432-N434 PolarHBondContact O-N 3.3Å; M432-N434 VanDerWaalsContact O-N 3.1Å
435	S	41.9	Very low	46.3	Very low	84 Å²	84	101.8 Å²	101.8	59%	0.587	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-95.9	-17.6	-175.7	-49.5	0	0	0	0	114.6	M432 A433	M432-S435 WeakPolarHBondContact O-CB 3.5Å; M432-S435 PolarHBondContact O-N 3.32Å; M432-S435 PolarHBondContact O-OG 3.33Å; A433-S435 PolarHBondContact O-N 3.02Å
436	S	32.4	Very low	43.7	Very low	86 Å²	86	103.6 Å²	103.6	60%	0.601	61%	0.605	S	S	*	*	S	Bend	trans	-121.3	-2.1	-166.8	52.3	0	0	0	0	114.9	S438	S436-S438 PolarHBondContact O-N 2.91Å; S436-S438 VanDerWaalsContact O-N 3.12Å
437	S	30.3	Very low	41.3	Very low	104 Å²	104	107 Å²	107	73%	0.727	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	39.1	-176.5	74.2	0	0	0	0	113.7
438	S	34.7	Very low	39.2	Very low	98 Å²	98	115.5 Å²	115.5	69%	0.685	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.1	23	-173.8	65.5	0	0	0	0	115.9	S436	S436-S438 PolarHBondContact O-N 2.91Å; S436-S438 VanDerWaalsContact O-N 3.12Å
439	D	29.6	Very low	37.5	Very low	145 Å²	145	116.2 Å²	116.2	78%	0.775	68%	0.677	S	S	*	*			trans	-122	73.9	175.8	-74.5	-53.7	0	0	0	111.5
440	L	28	Very low	35.5	Very low	176 Å²	176	121.6 Å²	121.6	92%	0.921	70%	0.701	S	S	*	*			trans	-150.3	67.9	169.9	-81.4	-173.6	0	0	0	112.9
441	S	28.8	Very low	33.9	Very low	115 Å²	115	122 Å²	122	80%	0.804	71%	0.713	S	S	*	*	S	Bend	trans	-174.2	145.3	148.7	56.8	0	0	0	0	113.2
442	S	28.9	Very low	32.9	Very low	116 Å²	116	130.5 Å²	130.5	81%	0.811	74%	0.742	S	S	*	*			trans	72.3	99.5	169.7	72.9	0	0	0	0	119
443	D	24.3	Very low	32.3	Very low	142 Å²	142	131.9 Å²	131.9	76%	0.759	75%	0.751	S	S	*	*			trans	-65.8	162	158	-57.1	-79.8	0	0	0	113.2
444	N	26.7	Very low	31.5	Very low	154 Å²	154	135.6 Å²	135.6	82%	0.824	76%	0.762	S	S	*	*			trans	70.9	125.3	170.6	-38.3	-77.8	0	0	0	114.2
445	V	28.6	Very low	31	Very low	130 Å²	130	136.2 Å²	136.2	79%	0.788	77%	0.769	S	S	*	*				-165.9	138.8	59.5	156.1	0	0	0	0	111
446	M	25.8	Very low	30.9	Very low	167 Å²	167	135.9 Å²	135.9	82%	0.823	77%	0.767	S	S	*	*			trans	49	127.5	160	-74.8	-81	98.2	0	0	121.6
447	D	26.5	Very low	31	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	78%	0.777	S	S	*	*			trans	-66.4	130	168.1	-53.9	-96.4	0	0	0	114
448	Q	29.6	Very low	31.3	Very low	191 Å²	191	143.8 Å²	143.8	89%	0.893	78%	0.777	S	S	*	*			trans	-139.1	123	140.3	-91.1	-168.7	-1	0	0	109.8
449	P	37	Very low	31.6	Very low	118 Å²	118	148.2 Å²	148.2	77%	0.766	78%	0.784	S	S	*	*			trans	-93.6	108.5	-175.6	33.7	-31.7	0	0	0	112.5
450	D	29.1	Very low	32.1	Very low	171 Å²	171	149.9 Å²	149.9	91%	0.914	78%	0.784	S	S	*	*			trans	-165.1	57.9	153.9	-108.7	-22.8	0	0	0	114.4
451	S	30.4	Very low	32.6	Very low	93 Å²	93	148.6 Å²	148.6	65%	0.65	78%	0.778	S	S	*	*			trans	-128.4	13.6	-177.2	63.6	0	0	0	0	115.6	N453	S451-N453 PolarHBondContact O-N 3.05Å
452	R	35.5	Very low	33	Very low	234 Å²	234	147 Å²	147	88%	0.883	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-7.8	-169.8	-81.5	-174.3	172.3	174.3	-0.4	117
453	N	34.5	Very low	33.9	Very low	146 Å²	146	145.5 Å²	145.5	78%	0.781	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-6	-174	-83.6	-26.5	0	0	0	116.6	S451	S451-N453 PolarHBondContact O-N 3.05Å
454	L	32.2	Very low	35.1	Very low	141 Å²	141	142 Å²	142	74%	0.738	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-32.4	-176.8	-136.8	72	0	0	0	114.4	S456	L454-S456 VanDerWaalsContact C-N 3.29Å; L454-S456 PolarHBondContact O-N 2.82Å
455	T	35.9	Very low	36.5	Very low	103 Å²	103	136.5 Å²	136.5	63%	0.632	71%	0.706	S	S	*	*	H	α-helix	trans	-68.7	-23.5	-177	52	0	0	0	0	113.9
456	S	41	Very low	38	Very low	78 Å²	78	137.2 Å²	137.2	55%	0.545	71%	0.705	S	S	.	*	H	α-helix	trans	-71.3	-29.3	-177.4	63.2	0	0	0	0	114	L454	L454-S456 VanDerWaalsContact C-N 3.29Å; L454-S456 PolarHBondContact O-N 2.82Å
457	R	34.1	Very low	39.8	Very low	218 Å²	218	134.2 Å²	134.2	82%	0.823	70%	0.699	S	S	*	*	H	α-helix	trans	-84.9	-37.7	-178.2	-80.8	-173.3	167.4	-170.9	-3.1	113.8	K459	R457-K459 VanDerWaalsContact C-N 3.27Å; R457-K459 PolarHBondContact O-N 3.11Å
458	L	36.7	Very low	41.6	Very low	137 Å²	137	128.3 Å²	128.3	72%	0.717	67%	0.667	S	S	*	*	H	α-helix	trans	-68	-27.3	-179.6	-78.2	165.1	0	0	0	112.9	K460 N461	L458-K460 PolarHBondContact O-N 3.33Å; L458-N461 PolarHBondContact O-N 3.09Å
459	K	40.3	Very low	43.4	Very low	192 Å²	192	127.2 Å²	127.2	84%	0.835	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-4.7	-177.7	-138.7	173.6	-172.5	177.1	0	115.4	R457	R457-K459 VanDerWaalsContact C-N 3.27Å; R457-K459 PolarHBondContact O-N 3.11Å
460	K	41.2	Very low	45	Very low	180 Å²	180	125.5 Å²	125.5	78%	0.783	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-16.7	178.7	-90.1	-170.9	172.8	-177	0	116.2	L458	L458-K460 PolarHBondContact O-N 3.33Å
461	N	37.5	Very low	47.4	Very low	148 Å²	148	118.2 Å²	118.2	79%	0.791	60%	0.6	S	S	*	*	S	Bend	trans	-110.9	3.7	-168.8	-72.8	8.2	0	0	0	114.9	L458 T463	L458-N461 PolarHBondContact O-N 3.09Å; N461-T463 PolarHBondContact O-N 3.15Å
462	S	36.9	Very low	49.6	Very low	83 Å²	83	116.3 Å²	116.3	58%	0.58	58%	0.582	S	S	*	*	S	Bend	trans	-89.1	104	-174.3	-161.2	0	0	0	0	113.5	T464	S462-T464 VanDerWaalsContact C-N 3.35Å; S462-T464 PolarHBondContact O-N 3.38Å; S462-T464 VanDerWaalsContact O-N 3.1Å
463	T	47.1	Very low	51.7	Low	83 Å²	83	108.3 Å²	108.3	51%	0.509	57%	0.566	S	S	.	*	S	Bend	trans	66.9	2.9	158.2	73	0	0	0	0	120.5	N461 F465	N461-T463 PolarHBondContact O-N 3.15Å; T463-F465 PolarHBondContact O-N 3.16Å
464	T	50.5	Low	54	Low	69 Å²	69	106.6 Å²	106.6	42%	0.423	55%	0.553	S	S	.	*			trans	-54.3	135	171	-42.8	0	0	0	0	112	L431 S462 L466	L431-T464 HydrophobicContact CD2-CG2 3.95Å; S462-T464 VanDerWaalsContact C-N 3.35Å; S462-T464 PolarHBondContact O-N 3.38Å; S462-T464 VanDerWaalsContact O-N 3.1Å; T464-L466 PolarHBondContact O-N 3.47Å
465	F	56.8	Low	56.4	Low	39 Å²	39	99.9 Å²	99.9	17%	0.171	52%	0.518	C	S	.	.			trans	-67.1	98.1	167.3	-71.9	-81.2	0	0	0	109.7	K390 L393 I394 T463 C467 L468 R469	K390-F465 HydrophobicContact CB-CE1 3.96Å; K390-F465 HydrophobicContact CB-CZ 3.7Å; K390-F465 HydrophobicContact CD-CE1 4.04Å; K390-F465 HydrophobicContact CD-CZ 3.78Å; K390-F465 HydrophobicContact CG-CE1 4.26Å; K390-F465 HydrophobicContact CG-CZ 3.7Å; L393-F465 HydrophobicContact CD2-CE2 4.11Å; I394-F465 HydrophobicContact CD1-CD1 3.99Å; I394-F465 HydrophobicContact CD1-CE1 3.65Å; I394-F465 HydrophobicContact CD1-CZ 4.47Å; I394-F465 HydrophobicContact CG1-CD1 4.41Å; I394-F465 HydrophobicContact CG1-CE1 4.07Å; I394-F465 HydrophobicContact CG1-CZ 4.49Å; T463-F465 PolarHBondContact O-N 3.16Å; F465-C467 PolarHBondContact O-N 3.02Å; F465-L468 HydrophobicContact CB-CB 3.89Å; F465-L468 HydrophobicContact CB-CD1 3.87Å; F465-L468 HydrophobicContact CB-CG 3.92Å; F465-L468 HydrophobicContact CD2-CD1 4.08Å; F465-L468 HydrophobicContact CG-CD1 3.97Å; F465-L468 HydrophobicContact CG-CG 4.49Å; F465-L468 CarbonylContact O-C 3.42Å; F465-L468 PolarHBondContact O-N 3.33Å; F465-R469 PolarHBondContact O-N 3.04Å
466	L	59	Low	58.6	Low	145 Å²	145	96.7 Å²	96.7	76%	0.759	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-57.5	-33.2	179.3	-72.4	170.9	0	0	0	112.7	T464 L468 R469	T464-L466 PolarHBondContact O-N 3.47Å; L466-L468 PolarHBondContact O-N 3.44Å; L466-R469 PolarHBondContact O-N 3.18Å
467	C	63.3	Low	60.6	Low	103 Å²	103	94.9 Å²	94.9	70%	0.696	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-69.1	-13.2	173.9	52.9	0	0	0	0	114.9	F465	F465-C467 PolarHBondContact O-N 3.02Å
468	L	65.8	Low	63	Low	23 Å²	23	85.7 Å²	85.7	12%	0.12	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-112.9	2.8	177.2	-59.8	178.5	0	0	0	112.9	I394 L397 F465 L466 D470 F471	I394-L468 HydrophobicContact CG1-CD1 4.25Å; L397-L468 HydrophobicContact CD1-CD1 3.67Å; F465-L468 HydrophobicContact CB-CB 3.89Å; F465-L468 HydrophobicContact CB-CD1 3.87Å; F465-L468 HydrophobicContact CB-CG 3.92Å; F465-L468 HydrophobicContact CD2-CD1 4.08Å; F465-L468 HydrophobicContact CG-CD1 3.97Å; F465-L468 HydrophobicContact CG-CG 4.49Å; F465-L468 CarbonylContact O-C 3.42Å; F465-L468 PolarHBondContact O-N 3.33Å; L466-L468 PolarHBondContact O-N 3.44Å; L468-D470 PolarHBondContact O-N 3.44Å; L468-D470 VanDerWaalsContact O-N 3.16Å; L468-F471 HydrophobicContact CB-CB 4.26Å; L468-F471 HydrophobicContact CD2-CB 4.37Å; L468-F471 HydrophobicContact CD2-CG 4.44Å; L468-F471 VanDerWaalsContact O-CB 3.22Å; L468-F471 WeakPolarHBondContact O-CB 3.39Å; L468-F471 PolarHBondContact O-N 2.86Å
469	R	66.3	Low	65.2	Low	167 Å²	167	80.4 Å²	80.4	63%	0.63	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-38.2	-179.4	-172.6	-163	67	-164.1	-9.8	112	F465 L466	F465-R469 PolarHBondContact O-N 3.04Å; L466-R469 PolarHBondContact O-N 3.18Å
470	D	70.6	Confident	67.3	Low	82 Å²	82	76 Å²	76	44%	0.439	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	0.4	-175.7	-53.1	-22.2	0	0	0	111.9	L468 A473 Q474	L468-D470 PolarHBondContact O-N 3.44Å; L468-D470 VanDerWaalsContact O-N 3.16Å; D470-A473 WeakPolarHBondContact O-CB 3.32Å; D470-A473 PolarHBondContact O-N 2.68Å; D470-Q474 WeakPolarHBondContact O-CG 3.47Å; D470-Q474 PolarHBondContact O-N 2.99Å; D470-Q474 VanDerWaalsContact O-N 3.09Å
471	F	78.8	Confident	69.4	Low	19 Å²	19	73.4 Å²	73.4	8%	0.083	41%	0.41	C	S	.	.	H	α-helix	trans	-73.5	-35.3	-178.1	-169.9	-114.9	0	0	0	112.8	L397 T423 L427 L468 A473 Q474 L475	L397-F471 HydrophobicContact CB-CE1 3.99Å; L397-F471 HydrophobicContact CB-CZ 4.2Å; L397-F471 HydrophobicContact CD2-CE1 4.14Å; L397-F471 HydrophobicContact CG-CE1 4.45Å; L397-F471 WeakPolarHBondContact O-CZ 3.48Å; T423-F471 HydrophobicContact CG2-CE1 3.83Å; T423-F471 HydrophobicContact CG2-CZ 4.37Å; L427-F471 HydrophobicContact CD2-CD1 4.43Å; L468-F471 HydrophobicContact CB-CB 4.26Å; L468-F471 HydrophobicContact CD2-CB 4.37Å; L468-F471 HydrophobicContact CD2-CG 4.44Å; L468-F471 VanDerWaalsContact O-CB 3.22Å; L468-F471 WeakPolarHBondContact O-CB 3.39Å; L468-F471 PolarHBondContact O-N 2.86Å; F471-A473 VanDerWaalsContact C-N 3.29Å; F471-A473 PolarHBondContact O-N 2.86Å; F471-Q474 WeakPolarHBondContact O-CB 3.42Å; F471-Q474 PolarHBondContact O-N 2.88Å; F471-Q474 VanDerWaalsContact O-N 3.15Å; F471-L475 HydrophobicContact CD1-CD1 3.88Å; F471-L475 HydrophobicContact CD1-CG 4.28Å; F471-L475 HydrophobicContact CE1-CD1 3.72Å; F471-L475 HydrophobicContact CE1-CD2 4.3Å; F471-L475 HydrophobicContact CE1-CG 4.06Å; F471-L475 HydrophobicContact CZ-CD1 4.44Å; F471-L475 HydrophobicContact CZ-CD2 4.23Å; F471-L475 HydrophobicContact CZ-CG 4.34Å; F471-L475 WeakPolarHBondContact O-CG 3.39Å; F471-L475 PolarHBondContact O-N 3.42Å
472	D	77.7	Confident	71.5	Confident	52 Å²	52	66.4 Å²	66.4	28%	0.278	37%	0.372	S	S	.	.	H	α-helix	trans	-65.9	-33.6	172.1	-179.9	53.7	0	0	0	112	K424 L427 Q474 L475 S476	K424-D472 WeakPolarHBondContact CE-OD1 3.42Å; K424-D472 IonicContact NZ-OD1 3.49Å; K424-D472 PolarHBondContact NZ-OD1 3.37Å; L427-D472 HydrophobicContact CD2-CB 3.92Å; D472-Q474 VanDerWaalsContact C-N 3.34Å; D472-L475 PolarHBondContact O-N 2.72Å; D472-S476 VanDerWaalsContact O-CB 3.3Å; D472-S476 WeakPolarHBondContact O-CB 3.49Å; D472-S476 PolarHBondContact O-N 2.87Å; D472-S476 PolarHBondContact O-OG 2.85Å
473	A	80.3	Confident	73.7	Confident	67 Å²	67	65.1 Å²	65.1	55%	0.554	36%	0.357	S	S	*	.	H	α-helix	trans	-66.2	-37.3	171.8	0	0	0	0	0	111.5	D470 F471 S476 G477	D470-A473 WeakPolarHBondContact O-CB 3.32Å; D470-A473 PolarHBondContact O-N 2.68Å; F471-A473 VanDerWaalsContact C-N 3.29Å; F471-A473 PolarHBondContact O-N 2.86Å; A473-S476 PolarHBondContact O-N 2.9Å; A473-G477 PolarHBondContact O-N 3.22Å
474	Q	81.1	Confident	75.4	Confident	110 Å²	110	68.3 Å²	68.3	51%	0.514	36%	0.364	S	S	.	.	H	α-helix	trans	-64.6	-49.3	171.9	-69.2	172.2	4.1	0	0	111.8	D470 F471 D472 S476 G477 I478	D470-Q474 WeakPolarHBondContact O-CG 3.47Å; D470-Q474 PolarHBondContact O-N 2.99Å; D470-Q474 VanDerWaalsContact O-N 3.09Å; F471-Q474 WeakPolarHBondContact O-CB 3.42Å; F471-Q474 PolarHBondContact O-N 2.88Å; F471-Q474 VanDerWaalsContact O-N 3.15Å; D472-Q474 VanDerWaalsContact C-N 3.34Å; Q474-S476 VanDerWaalsContact C-N 3.27Å; Q474-S476 PolarHBondContact O-N 3.24Å; Q474-G477 CarbonylContact O-C 3.52Å; Q474-G477 PolarHBondContact O-N 3.07Å; Q474-G477 VanDerWaalsContact O-N 3.11Å; Q474-I478 WeakPolarHBondContact O-CD1 3.36Å; Q474-I478 VanDerWaalsContact O-CG1 3.25Å; Q474-I478 WeakPolarHBondContact O-CG1 3.41Å; Q474-I478 PolarHBondContact O-N 3.02Å
475	L	83	Confident	77	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59.2	-37.4	175.8	-68.5	172.3	0	0	0	112.3	V420 T423 K424 F471 D472 I478 S479	V420-L475 HydrophobicContact CG1-CB 4.38Å; T423-L475 HydrophobicContact CG2-CD1 3.66Å; T423-L475 HydrophobicContact CG2-CD2 4.03Å; T423-L475 HydrophobicContact CG2-CG 4.5Å; K424-L475 HydrophobicContact CG-CB 4.21Å; K424-L475 HydrophobicContact CG-CD1 3.84Å; F471-L475 HydrophobicContact CD1-CD1 3.88Å; F471-L475 HydrophobicContact CD1-CG 4.28Å; F471-L475 HydrophobicContact CE1-CD1 3.72Å; F471-L475 HydrophobicContact CE1-CD2 4.3Å; F471-L475 HydrophobicContact CE1-CG 4.06Å; F471-L475 HydrophobicContact CZ-CD1 4.44Å; F471-L475 HydrophobicContact CZ-CD2 4.23Å; F471-L475 HydrophobicContact CZ-CG 4.34Å; F471-L475 WeakPolarHBondContact O-CG 3.39Å; F471-L475 PolarHBondContact O-N 3.42Å; D472-L475 PolarHBondContact O-N 2.72Å; L475-I478 PolarHBondContact O-N 2.76Å; L475-S479 PolarHBondContact O-N 2.84Å
476	S	82.2	Confident	78.3	Confident	36 Å²	36	64.7 Å²	64.7	25%	0.252	34%	0.343	S	S	.	.	H	α-helix	trans	-68.3	-41.1	174.2	-54.8	0	0	0	0	112.2	K424 D472 A473 Q474 I478 S479 N480	K424-S476 PolarHBondContact NZ-OG 3.4Å; D472-S476 VanDerWaalsContact O-CB 3.3Å; D472-S476 WeakPolarHBondContact O-CB 3.49Å; D472-S476 PolarHBondContact O-N 2.87Å; D472-S476 PolarHBondContact O-OG 2.85Å; A473-S476 PolarHBondContact O-N 2.9Å; Q474-S476 VanDerWaalsContact C-N 3.27Å; Q474-S476 PolarHBondContact O-N 3.24Å; S476-I478 VanDerWaalsContact C-N 3.34Å; S476-S479 PolarHBondContact O-N 3.47Å; S476-N480 WeakPolarHBondContact O-CB 3.31Å; S476-N480 VanDerWaalsContact O-CG 3.29Å; S476-N480 PolarHBondContact O-N 2.69Å; S476-N480 PolarHBondContact O-ND2 2.86Å
477	G	84.1	Confident	79.4	Confident	40 Å²	40	60.7 Å²	60.7	41%	0.412	32%	0.32	S	S	.	.	H	α-helix	trans	-62.6	-40.1	173.3	0	0	0	0	0	112.5	A473 Q474 N480 F481	A473-G477 PolarHBondContact O-N 3.22Å; Q474-G477 CarbonylContact O-C 3.52Å; Q474-G477 PolarHBondContact O-N 3.07Å; Q474-G477 VanDerWaalsContact O-N 3.11Å; G477-N480 PolarHBondContact O-N 2.84Å; G477-F481 WeakPolarHBondContact O-CB 3.46Å; G477-F481 PolarHBondContact O-N 2.95Å
478	I	83.5	Confident	80.4	Confident	25 Å²	25	58.1 Å²	58.1	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-65.6	-46.9	175	-67.9	158.8	0	0	0	110.5	I404 V420 Q474 L475 S476 N480 F481 V482	I404-I478 HydrophobicContact CG2-CG2 3.98Å; V420-I478 HydrophobicContact CG2-CG2 4.06Å; Q474-I478 WeakPolarHBondContact O-CD1 3.36Å; Q474-I478 VanDerWaalsContact O-CG1 3.25Å; Q474-I478 WeakPolarHBondContact O-CG1 3.41Å; Q474-I478 PolarHBondContact O-N 3.02Å; L475-I478 PolarHBondContact O-N 2.76Å; S476-I478 VanDerWaalsContact C-N 3.34Å; I478-N480 VanDerWaalsContact C-N 3.33Å; I478-N480 PolarHBondContact O-N 3.23Å; I478-F481 WeakPolarHBondContact O-CB 3.4Å; I478-F481 PolarHBondContact O-N 3.49Å; I478-F481 VanDerWaalsContact O-N 3.12Å; I478-V482 HydrophobicContact CG2-CG2 4.4Å; I478-V482 WeakPolarHBondContact O-CG2 3.28Å; I478-V482 PolarHBondContact O-N 3.03Å
479	S	83.2	Confident	81.2	Confident	25 Å²	25	60 Å²	60	18%	0.175	31%	0.312	C	S	.	.	H	α-helix	trans	-55.3	-49.1	174.3	-158.4	0	0	0	0	111	L475 S476 F481 V482 H483	L475-S479 PolarHBondContact O-N 2.84Å; S476-S479 PolarHBondContact O-N 3.47Å; S479-F481 VanDerWaalsContact C-N 3.3Å; S479-F481 PolarHBondContact O-N 3.11Å; S479-V482 PolarHBondContact O-N 3.07Å; S479-H483 PolarHBondContact O-CD2 3.44Å; S479-H483 VanDerWaalsContact O-CG 3.24Å; S479-H483 PolarHBondContact O-N 2.89Å; S479-H483 PolarHBondContact OG-NE2 2.88Å
480	N	84	Confident	82.1	Confident	99 Å²	99	52.2 Å²	52.2	53%	0.529	28%	0.282	S	S	.	.	H	α-helix	trans	-65.3	-30.3	178.5	-70.7	-22.3	0	0	0	113.5	S476 G477 I478 K484	S476-N480 WeakPolarHBondContact O-CB 3.31Å; S476-N480 VanDerWaalsContact O-CG 3.29Å; S476-N480 PolarHBondContact O-N 2.69Å; S476-N480 PolarHBondContact O-ND2 2.86Å; G477-N480 PolarHBondContact O-N 2.84Å; I478-N480 VanDerWaalsContact C-N 3.33Å; I478-N480 PolarHBondContact O-N 3.23Å; N480-K484 PolarHBondContact O-N 3Å
481	F	85.1	Confident	82.7	Confident	127 Å²	127	52.3 Å²	52.3	56%	0.557	28%	0.283	S	S	*	.	H	α-helix	trans	-69.9	-47.7	172.2	176.9	-95.6	0	0	0	111.1	G477 I478 S479 H483 K484 M485	G477-F481 WeakPolarHBondContact O-CB 3.46Å; G477-F481 PolarHBondContact O-N 2.95Å; I478-F481 WeakPolarHBondContact O-CB 3.4Å; I478-F481 PolarHBondContact O-N 3.49Å; I478-F481 VanDerWaalsContact O-N 3.12Å; S479-F481 VanDerWaalsContact C-N 3.3Å; S479-F481 PolarHBondContact O-N 3.11Å; F481-H483 VanDerWaalsContact C-N 3.3Å; F481-H483 PolarHBondContact O-N 3.08Å; F481-K484 PolarHBondContact O-N 3.25Å; F481-M485 HydrophobicContact CE1-CB 4.49Å; F481-M485 HydrophobicContact CE1-SD 3.65Å; F481-M485 HydrophobicContact CZ-SD 4.07Å; F481-M485 WeakPolarHBondContact O-CB 3.27Å; F481-M485 PolarHBondContact O-N 3.42Å
482	V	83.4	Confident	83	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-59.6	-40.6	175.9	176.2	0	0	0	0	111	L408 F413 L417 I478 S479 K484 M485 V486	L408-V482 HydrophobicContact CD1-CG2 3.58Å; L408-V482 HydrophobicContact CD2-CG1 4.11Å; L408-V482 HydrophobicContact CD2-CG2 3.64Å; L408-V482 HydrophobicContact CG-CG2 4.23Å; F413-V482 HydrophobicContact CB-CG1 4.47Å; L417-V482 HydrophobicContact CD1-CG1 4.33Å; L417-V482 HydrophobicContact CD2-CB 4.19Å; L417-V482 HydrophobicContact CD2-CG1 3.89Å; L417-V482 HydrophobicContact CG-CG1 3.93Å; I478-V482 HydrophobicContact CG2-CG2 4.4Å; I478-V482 WeakPolarHBondContact O-CG2 3.28Å; I478-V482 PolarHBondContact O-N 3.03Å; S479-V482 PolarHBondContact O-N 3.07Å; V482-K484 PolarHBondContact O-N 2.91Å; V482-M485 PolarHBondContact O-N 2.91Å; V482-V486 HydrophobicContact CG1-CG2 4.1Å; V482-V486 WeakPolarHBondContact O-CB 3.43Å; V482-V486 VanDerWaalsContact O-CG2 3.25Å; V482-V486 WeakPolarHBondContact O-CG2 3.29Å; V482-V486 PolarHBondContact O-N 2.8Å
483	H	81.7	Confident	83.2	Confident	56 Å²	56	54.2 Å²	54.2	26%	0.259	30%	0.295	S	S	.	.	H	α-helix	trans	-57.9	-48.5	177	-66.1	-172.4	0	0	0	111.8	S479 F481 V486 E487 I523	S479-H483 PolarHBondContact O-CD2 3.44Å; S479-H483 VanDerWaalsContact O-CG 3.24Å; S479-H483 PolarHBondContact O-N 2.89Å; S479-H483 PolarHBondContact OG-NE2 2.88Å; F481-H483 VanDerWaalsContact C-N 3.3Å; F481-H483 PolarHBondContact O-N 3.08Å; H483-V486 PolarHBondContact O-N 3.5Å; H483-E487 WeakPolarHBondContact O-CG 3.35Å; H483-E487 PolarHBondContact O-N 3.4Å; H483-I523 HydrophobicContact CB-CD1 4.3Å; H483-I523 HydrophobicContact CB-CG2 4.43Å
484	K	83.5	Confident	83.5	Confident	150 Å²	150	51.1 Å²	51.1	65%	0.652	27%	0.269	S	S	*	.	H	α-helix	trans	-67.8	-35.8	178	-71.1	-175.2	174.8	-168.3	0	113.2	N480 F481 V482 E487 S488	N480-K484 PolarHBondContact O-N 3Å; F481-K484 PolarHBondContact O-N 3.25Å; V482-K484 PolarHBondContact O-N 2.91Å; K484-E487 PolarHBondContact O-N 2.87Å; K484-S488 PolarHBondContact O-N 3.36Å; K484-S488 PolarHBondContact O-OG 3.37Å
485	M	83.7	Confident	83.6	Confident	32 Å²	32	47.7 Å²	47.7	16%	0.158	26%	0.256	C	S	.	.	H	α-helix	trans	-69.7	-39.3	179.1	-164.8	-178.9	67.9	0	0	110.9	L408 F413 F481 V482 E487 S488 E489	L408-M485 HydrophobicContact CB-CE 4.05Å; L408-M485 HydrophobicContact CD1-CE 4.21Å; L408-M485 HydrophobicContact CD2-CE 3.73Å; L408-M485 HydrophobicContact CG-CE 4.19Å; F413-M485 HydrophobicContact CD1-CE 3.96Å; F413-M485 HydrophobicContact CE1-CE 3.6Å; F481-M485 HydrophobicContact CE1-CB 4.49Å; F481-M485 HydrophobicContact CE1-SD 3.65Å; F481-M485 HydrophobicContact CZ-SD 4.07Å; F481-M485 WeakPolarHBondContact O-CB 3.27Å; F481-M485 PolarHBondContact O-N 3.42Å; V482-M485 PolarHBondContact O-N 2.91Å; M485-E487 VanDerWaalsContact C-N 3.33Å; M485-E487 PolarHBondContact O-N 3.39Å; M485-S488 WeakPolarHBondContact CA-OG 3.46Å; M485-S488 PolarHBondContact O-N 3.35Å; M485-S488 PolarHBondContact O-OG 2.98Å; M485-S488 VanDerWaalsContact O-OG 3.08Å; M485-E489 HydrophobicContact CG-CG 4.19Å; M485-E489 WeakPolarHBondContact O-CB 3.35Å; M485-E489 VanDerWaalsContact O-CG 3.29Å; M485-E489 WeakPolarHBondContact O-CG 3.37Å; M485-E489 PolarHBondContact O-N 2.78Å
486	V	85	Confident	83.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-40.1	172.4	169.3	0	0	0	0	111.6	F413 V482 H483 F490 L520 I523	F413-V486 HydrophobicContact CB-CG2 3.56Å; F413-V486 HydrophobicContact CD1-CG2 3.85Å; F413-V486 HydrophobicContact CD2-CG2 3.72Å; F413-V486 HydrophobicContact CE2-CG2 4.37Å; F413-V486 HydrophobicContact CG-CG2 3.41Å; F413-V486 VanDerWaalsContact CG-CG2 3.41Å; V482-V486 HydrophobicContact CG1-CG2 4.1Å; V482-V486 WeakPolarHBondContact O-CB 3.43Å; V482-V486 VanDerWaalsContact O-CG2 3.25Å; V482-V486 WeakPolarHBondContact O-CG2 3.29Å; V482-V486 PolarHBondContact O-N 2.8Å; H483-V486 PolarHBondContact O-N 3.5Å; V486-F490 VanDerWaalsContact O-CB 3.28Å; V486-F490 WeakPolarHBondContact O-CB 3.13Å; V486-F490 PolarHBondContact O-N 2.9Å; V486-L520 HydrophobicContact CG1-CD2 3.88Å; V486-L520 HydrophobicContact CG1-CG 3.74Å; V486-I523 HydrophobicContact CB-CD1 3.93Å; V486-I523 HydrophobicContact CG1-CD1 3.89Å; V486-I523 HydrophobicContact CG2-CD1 4.14Å
487	E	81.3	Confident	83.7	Confident	60 Å²	60	53.4 Å²	53.4	28%	0.28	27%	0.273	S	S	.	.	H	α-helix	trans	-61.2	-49.9	173.2	-69.2	173.2	142.1	0	0	111.3	H483 K484 M485 F490 D491 L520 R525	H483-E487 WeakPolarHBondContact O-CG 3.35Å; H483-E487 PolarHBondContact O-N 3.4Å; K484-E487 PolarHBondContact O-N 2.87Å; M485-E487 VanDerWaalsContact C-N 3.33Å; M485-E487 PolarHBondContact O-N 3.39Å; E487-F490 PolarHBondContact O-N 3.49Å; E487-D491 PolarHBondContact O-N 3.17Å; E487-L520 HydrophobicContact CG-CD2 4.42Å; E487-R525 IonicContact OE1-CZ 3.75Å; E487-R525 IonicContact OE1-NH1 3.2Å; E487-R525 PolarHBondContact OE1-NH1 3.19Å; E487-R525 IonicContact OE1-NH2 3.6Å; E487-R525 PolarHBondContact OE1-NH2 3.36Å
488	S	83.6	Confident	83.8	Confident	50 Å²	50	51.6 Å²	51.6	35%	0.35	25%	0.254	S	S	.	.	H	α-helix	trans	-69.7	-40.1	-178.4	58.3	0	0	0	0	113.9	K484 M485 F490 D491 I492	K484-S488 PolarHBondContact O-N 3.36Å; K484-S488 PolarHBondContact O-OG 3.37Å; M485-S488 WeakPolarHBondContact CA-OG 3.46Å; M485-S488 PolarHBondContact O-N 3.35Å; M485-S488 PolarHBondContact O-OG 2.98Å; M485-S488 VanDerWaalsContact O-OG 3.08Å; S488-F490 VanDerWaalsContact C-N 3.32Å; S488-D491 PolarHBondContact O-N 2.78Å; S488-I492 WeakPolarHBondContact O-CB 3.28Å; S488-I492 WeakPolarHBondContact O-CD1 3.42Å; S488-I492 VanDerWaalsContact O-CG1 3.22Å; S488-I492 WeakPolarHBondContact O-CG1 3.43Å; S488-I492 PolarHBondContact O-N 2.83Å
489	E	83.5	Confident	83.5	Confident	61 Å²	61	53.3 Å²	53.3	29%	0.285	26%	0.264	S	S	.	.	H	α-helix	trans	-70.2	-29.1	177.5	-65.7	-53.6	146.4	0	0	111.7	F413 M485 S493	F413-E489 HydrophobicContact CZ-CB 4.27Å; F413-E489 HydrophobicContact CZ-CG 4.35Å; M485-E489 HydrophobicContact CG-CG 4.19Å; M485-E489 WeakPolarHBondContact O-CB 3.35Å; M485-E489 VanDerWaalsContact O-CG 3.29Å; M485-E489 WeakPolarHBondContact O-CG 3.37Å; M485-E489 PolarHBondContact O-N 2.78Å; E489-S493 WeakPolarHBondContact O-CB 3.44Å; E489-S493 PolarHBondContact O-N 2.82Å; E489-S493 PolarHBondContact O-OG 3.3Å
490	F	85.5	Confident	82.8	Confident	4 Å²	4	55 Å²	55	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-50.7	169.1	177	-100.9	0	0	0	111.4	V486 E487 S488 I492 S493 L494 I513 C516 F517 L520 F528	V486-F490 VanDerWaalsContact O-CB 3.28Å; V486-F490 WeakPolarHBondContact O-CB 3.13Å; V486-F490 PolarHBondContact O-N 2.9Å; E487-F490 PolarHBondContact O-N 3.49Å; S488-F490 VanDerWaalsContact C-N 3.32Å; F490-I492 VanDerWaalsContact C-N 3.34Å; F490-I492 PolarHBondContact O-N 2.72Å; F490-S493 PolarHBondContact O-N 3.08Å; F490-L494 HydrophobicContact CE1-CD2 3.91Å; F490-L494 HydrophobicContact CZ-CD2 4.07Å; F490-L494 WeakPolarHBondContact O-CB 3.49Å; F490-L494 PolarHBondContact O-N 3.48Å; F490-I513 HydrophobicContact CE2-CG1 4.42Å; F490-C516 HydrophobicContact CB-CB 3.97Å; F490-C516 HydrophobicContact CD2-CB 3.87Å; F490-C516 HydrophobicContact CG-CB 4.42Å; F490-F517 AromaticContact CE2-CD1 3.97Å; F490-F517 HydrophobicContact CE2-CD1 3.97Å; F490-F517 AromaticContact CE2-CE1 3.59Å; F490-F517 HydrophobicContact CE2-CE1 3.59Å; F490-F517 HydrophobicContact CE2-CZ 4.07Å; F490-F517 HydrophobicContact CZ-CE1 4.09Å; F490-L520 HydrophobicContact CB-CD1 3.98Å; F490-L520 HydrophobicContact CD1-CD1 4.12Å; F490-L520 HydrophobicContact CD2-CD1 3.68Å; F490-L520 HydrophobicContact CE2-CD1 4.2Å; F490-L520 HydrophobicContact CG-CD1 3.63Å; F490-F528 HydrophobicContact CD1-CB 4.45Å; F490-F528 HydrophobicContact CE1-CB 3.9Å; F490-F528 HydrophobicContact CZ-CB 4.09Å; F490-F528 HydrophobicContact CZ-CD2 4.23Å
491	D	83.5	Confident	81.4	Confident	85 Å²	85	53.9 Å²	53.9	46%	0.455	27%	0.272	S	S	.	.	H	α-helix	trans	-61.8	-41.3	-179.9	-75	-17.4	0	0	0	111.7	E487 S488 C495	E487-D491 PolarHBondContact O-N 3.17Å; S488-D491 PolarHBondContact O-N 2.78Å; D491-C495 WeakPolarHBondContact O-CB 3.25Å; D491-C495 PolarHBondContact O-N 3.21Å; D491-C495 PolarHBondContact O-SG 2.69Å
492	I	83.2	Confident	79.7	Confident	93 Å²	93	55.3 Å²	55.3	48%	0.477	28%	0.284	S	S	.	.	H	α-helix	trans	-64.8	-48.8	175.9	-68.5	164.6	0	0	0	111.1	S488 F490 L494 C495 R496	S488-I492 WeakPolarHBondContact O-CB 3.28Å; S488-I492 WeakPolarHBondContact O-CD1 3.42Å; S488-I492 VanDerWaalsContact O-CG1 3.22Å; S488-I492 WeakPolarHBondContact O-CG1 3.43Å; S488-I492 PolarHBondContact O-N 2.83Å; F490-I492 VanDerWaalsContact C-N 3.34Å; F490-I492 PolarHBondContact O-N 2.72Å; I492-L494 VanDerWaalsContact C-N 3.34Å; I492-L494 PolarHBondContact O-N 2.9Å; I492-C495 PolarHBondContact O-N 2.7Å; I492-R496 WeakPolarHBondContact O-CB 3.33Å; I492-R496 PolarHBondContact O-N 3.26Å
493	S	82.3	Confident	77.9	Confident	18 Å²	18	62.8 Å²	62.8	13%	0.126	32%	0.319	C	S	.	.	H	α-helix	trans	-62.9	-41.2	179.5	-62.3	0	0	0	0	111.6	E489 F490 R496 F497	E489-S493 WeakPolarHBondContact O-CB 3.44Å; E489-S493 PolarHBondContact O-N 2.82Å; E489-S493 PolarHBondContact O-OG 3.3Å; F490-S493 PolarHBondContact O-N 3.08Å; S493-R496 PolarHBondContact O-N 3.24Å; S493-F497 VanDerWaalsContact O-CB 3.31Å; S493-F497 WeakPolarHBondContact O-CB 3.19Å; S493-F497 PolarHBondContact O-N 3.36Å
494	L	86.3	Confident	76	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.01	35%	0.351	C	S	.	.	H	α-helix	trans	-64.5	-45.8	177.4	175.2	60.8	0	0	0	111.6	F490 I492 F497 L498 I513 F532 E535	F490-L494 HydrophobicContact CE1-CD2 3.91Å; F490-L494 HydrophobicContact CZ-CD2 4.07Å; F490-L494 WeakPolarHBondContact O-CB 3.49Å; F490-L494 PolarHBondContact O-N 3.48Å; I492-L494 VanDerWaalsContact C-N 3.34Å; I492-L494 PolarHBondContact O-N 2.9Å; L494-F497 PolarHBondContact O-N 3.12Å; L494-L498 HydrophobicContact CD1-CD1 3.73Å; L494-L498 HydrophobicContact CD1-CG 4.07Å; L494-L498 HydrophobicContact CG-CD1 4.17Å; L494-L498 WeakPolarHBondContact O-CG 3.37Å; L494-L498 PolarHBondContact O-N 2.84Å; L494-L498 VanDerWaalsContact O-N 3.14Å; L494-I513 HydrophobicContact CD1-CD1 4.49Å; L494-F532 HydrophobicContact CD1-CD2 3.88Å; L494-F532 HydrophobicContact CD1-CE2 4.34Å; L494-F532 HydrophobicContact CD2-CB 4.45Å; L494-F532 HydrophobicContact CD2-CD2 4.38Å; L494-E535 HydrophobicContact CD2-CB 4.19Å; L494-E535 HydrophobicContact CG-CG 4.47Å
495	C	84.9	Confident	73.6	Confident	37 Å²	37	73 Å²	73	25%	0.25	36%	0.361	C	S	.	.	H	α-helix	trans	-56.7	-54.3	173.6	-69.5	0	0	0	0	110.5	D491 I492 F497 L498 D499	D491-C495 WeakPolarHBondContact O-CB 3.25Å; D491-C495 PolarHBondContact O-N 3.21Å; D491-C495 PolarHBondContact O-SG 2.69Å; I492-C495 PolarHBondContact O-N 2.7Å; C495-F497 VanDerWaalsContact C-N 3.26Å; C495-F497 PolarHBondContact O-N 3.17Å; C495-L498 PolarHBondContact O-N 3.43Å; C495-L498 VanDerWaalsContact O-N 3.08Å; C495-D499 PolarHBondContact O-N 3.49Å
496	R	83	Confident	71.2	Confident	117 Å²	117	74.6 Å²	74.6	44%	0.442	39%	0.386	S	S	.	.	H	α-helix	trans	-59.1	-32.8	-178.5	-178.1	173.9	171	-114.1	-13.1	113.3	I492 S493 D510	I492-R496 WeakPolarHBondContact O-CB 3.33Å; I492-R496 PolarHBondContact O-N 3.26Å; S493-R496 PolarHBondContact O-N 3.24Å; R496-D510 IonicContact CZ-OD2 2.68Å; R496-D510 IonicContact NH1-OD2 3.36Å; R496-D510 PolarHBondContact NH1-OD2 3.39Å; R496-D510 IonicContact NH2-OD2 2.74Å; R496-D510 PolarHBondContact NH2-OD2 3.38Å
497	F	83.7	Confident	69	Low	39 Å²	39	78 Å²	78	17%	0.171	42%	0.422	C	S	.	.	H	α-helix	trans	-74.9	-34	177.4	-164.4	-81.5	0	0	0	112.8	S493 L494 C495 R605 D608 V609 I612	S493-F497 VanDerWaalsContact O-CB 3.31Å; S493-F497 WeakPolarHBondContact O-CB 3.19Å; S493-F497 PolarHBondContact O-N 3.36Å; L494-F497 PolarHBondContact O-N 3.12Å; C495-F497 VanDerWaalsContact C-N 3.26Å; C495-F497 PolarHBondContact O-N 3.17Å; F497-R605 HydrophobicContact CD1-CB 4.37Å; F497-R605 HydrophobicContact CE1-CB 4.19Å; F497-R605 HydrophobicContact CE1-CG 4.44Å; F497-D608 HydrophobicContact CE1-CB 4Å; F497-D608 HydrophobicContact CZ-CB 4.06Å; F497-V609 HydrophobicContact CD1-CG2 3.41Å; F497-V609 VanDerWaalsContact CD1-CG2 3.41Å; F497-V609 HydrophobicContact CE1-CG2 3.58Å; F497-V609 HydrophobicContact CG-CG2 4.18Å; F497-V609 HydrophobicContact CZ-CG2 4.44Å; F497-I612 HydrophobicContact CE2-CD1 4.16Å; F497-I612 HydrophobicContact CZ-CD1 3.98Å
498	L	85.5	Confident	67.2	Low	3 Å²	3	79.8 Å²	79.8	2%	0.016	43%	0.429	C	S	.	.	H	α-helix	trans	-82.7	-19.7	178	-62.7	177.1	0	0	0	113	L494 C495 E535 M536 L602 R605	L494-L498 HydrophobicContact CD1-CD1 3.73Å; L494-L498 HydrophobicContact CD1-CG 4.07Å; L494-L498 HydrophobicContact CG-CD1 4.17Å; L494-L498 WeakPolarHBondContact O-CG 3.37Å; L494-L498 PolarHBondContact O-N 2.84Å; L494-L498 VanDerWaalsContact O-N 3.14Å; C495-L498 PolarHBondContact O-N 3.43Å; C495-L498 VanDerWaalsContact O-N 3.08Å; L498-E535 HydrophobicContact CD1-CB 4.48Å; L498-E535 HydrophobicContact CD1-CG 3.97Å; L498-M536 HydrophobicContact CD1-CG 4.4Å; L498-M536 HydrophobicContact CD1-SD 3.7Å; L498-M536 HydrophobicContact CD2-SD 3.7Å; L498-M536 HydrophobicContact CG-SD 4.37Å; L498-L602 HydrophobicContact CB-CD1 4.14Å; L498-L602 HydrophobicContact CD2-CD1 4.08Å; L498-L602 HydrophobicContact CG-CD1 4.49Å; L498-R605 HydrophobicContact CD2-CB 4.22Å; L498-R605 PolarHBondContact O-NH1 3.35Å
499	D	78	Confident	65.3	Low	61 Å²	61	82.6 Å²	82.6	33%	0.326	45%	0.448	S	S	.	.	S	Bend	trans	-62.7	126.4	-179	-77.2	-11	0	0	0	113.8	C495 R539 R605	C495-D499 PolarHBondContact O-N 3.49Å; D499-R539 IonicContact OD1-CZ 2.77Å; D499-R539 IonicContact OD1-NE 2.71Å; D499-R539 PolarHBondContact OD1-NE 3.21Å; D499-R539 IonicContact OD1-NH2 2.63Å; D499-R539 PolarHBondContact OD1-NH2 3.45Å; D499-R605 PolarHBondContact O-NH1 2.99Å; D499-R605 PolarHBondContact O-NH2 2.99Å
500	P	67.7	Low	64	Low	60 Å²	60	82.5 Å²	82.5	39%	0.39	45%	0.449	S	S	.	.			trans	-45.5	137.6	-178.2	-31.9	37	0	0	0	113.7	I502 R539 R605	P500-I502 PolarHBondContact O-N 3.39Å; P500-R539 VanDerWaalsContact CD-NH2 3.35Å; P500-R605 VanDerWaalsContact CA-NH1 3.32Å
501	P	55.2	Low	62.8	Low	76 Å²	76	86.4 Å²	86.4	49%	0.494	48%	0.475	S	S	.	.			trans	-66	124	-174.2	28.7	-33.2	0	0	0	109.9	E503	P501-E503 PolarHBondContact O-N 3.04Å
502	I	50.1	Low	62.2	Low	156 Å²	156	84.1 Å²	84.1	80%	0.8	46%	0.463	S	S	*	.	S	Bend	trans	-81.7	101.7	169.3	-56.1	175.1	0	0	0	106	P500	P500-I502 PolarHBondContact O-N 3.39Å
503	E	43.9	Very low	62.1	Low	159 Å²	159	79.9 Å²	79.9	74%	0.743	44%	0.441	S	S	*	.	S	Bend	trans	74.5	153.8	180	-55.2	174.8	-176.8	0	0	115.8	P501 Y505	P501-E503 PolarHBondContact O-N 3.04Å; E503-Y505 PolarHBondContact O-N 3.48Å
504	E	41.9	Very low	62.1	Low	199 Å²	199	80.8 Å²	80.8	93%	0.93	45%	0.445	S	S	*	.	S	Bend	trans	-81.7	13.5	-170.4	-64.6	-172.4	121.7	0	0	114.5
505	Y	33.2	Very low	61.7	Low	220 Å²	220	82.3 Å²	82.3	86%	0.863	46%	0.455	S	S	*	.			trans	-114.8	114.9	-172.8	-79	-84.4	0	0	0	113.4	E503	E503-Y505 PolarHBondContact O-N 3.48Å
506	G	33.8	Very low	61.6	Low	67 Å²	67	80.6 Å²	80.6	69%	0.691	44%	0.444	S	S	*	.			trans	101.4	113	170.9	0	0	0	0	0	113
507	G	38.7	Very low	61.6	Low	72 Å²	72	75 Å²	75	74%	0.742	42%	0.423	S	S	*	.			trans	-68	137.9	167.1	0	0	0	0	0	110.2	S509	G507-S509 VanDerWaalsContact C-N 3.28Å; G507-S509 PolarHBondContact O-N 2.85Å
508	F	44.5	Very low	61.3	Low	97 Å²	97	75.4 Å²	75.4	43%	0.425	43%	0.426	S	S	.	.			trans	-68.5	83	175.7	-73.3	-91.3	0	0	0	110.8	D510	F508-D510 PolarHBondContact O-N 3.42Å; F508-D510 VanDerWaalsContact O-N 3.11Å
509	S	43.2	Very low	60.9	Low	108 Å²	108	75.3 Å²	75.3	76%	0.755	43%	0.426	S	S	*	.			trans	-83.5	46.9	172.6	60.6	0	0	0	0	111.7	G507 P511	G507-S509 VanDerWaalsContact C-N 3.28Å; G507-S509 PolarHBondContact O-N 2.85Å; S509-P511 VanDerWaalsContact O-CD 3.31Å; S509-P511 WeakPolarHBondContact O-CD 3.15Å
510	D	55.8	Low	61.1	Low	59 Å²	59	72.7 Å²	72.7	32%	0.316	41%	0.412	S	S	.	.			trans	-98.4	104.4	179.1	-75.2	-10.5	0	0	0	109.4	R496 F508 D512	R496-D510 IonicContact CZ-OD2 2.68Å; R496-D510 IonicContact NH1-OD2 3.36Å; R496-D510 PolarHBondContact NH1-OD2 3.39Å; R496-D510 IonicContact NH2-OD2 2.74Å; R496-D510 PolarHBondContact NH2-OD2 3.38Å; F508-D510 PolarHBondContact O-N 3.42Å; F508-D510 VanDerWaalsContact O-N 3.11Å; D510-D512 PolarHBondContact O-N 2.94Å; D510-D512 VanDerWaalsContact O-N 3.08Å
511	P	59.8	Low	61.6	Low	86 Å²	86	70.1 Å²	70.1	56%	0.558	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	4.7	-179.8	30.8	-36.1	0	0	0	113.8	S509 I513 L514 S515	S509-P511 VanDerWaalsContact O-CD 3.31Å; S509-P511 WeakPolarHBondContact O-CD 3.15Å; P511-I513 VanDerWaalsContact C-N 3.3Å; P511-I513 PolarHBondContact O-N 3.17Å; P511-L514 WeakPolarHBondContact O-CB 3.46Å; P511-L514 PolarHBondContact O-N 2.92Å; P511-S515 PolarHBondContact O-N 3.48Å; P511-S515 VanDerWaalsContact O-N 3.07Å; P511-S515 PolarHBondContact O-OG 3.25Å
512	D	70.8	Confident	62.4	Low	37 Å²	37	71 Å²	71	20%	0.198	39%	0.388	C	S	.	.	H	α-helix	trans	-53.5	-42.6	-176.9	-64	-40.3	0	0	0	113	N411 D510 L514 S515 C516	N411-D512 PolarHBondContact ND2-OD1 3.07Å; D510-D512 PolarHBondContact O-N 2.94Å; D510-D512 VanDerWaalsContact O-N 3.08Å; D512-L514 VanDerWaalsContact C-N 3.31Å; D512-L514 PolarHBondContact O-N 3.39Å; D512-S515 WeakPolarHBondContact O-CB 3.14Å; D512-S515 PolarHBondContact O-N 2.89Å; D512-C516 PolarHBondContact O-N 3.43Å; D512-C516 PolarHBondContact O-SG 3.48Å
513	I	82.3	Confident	63.7	Low	5 Å²	5	65.2 Å²	65.2	3%	0.026	36%	0.359	C	S	.	.	H	α-helix	trans	-67.5	-30.9	-179.9	-161.2	169.8	0	0	0	112.4	F490 L494 P511 C516 F517 V609 I612	F490-I513 HydrophobicContact CE2-CG1 4.42Å; L494-I513 HydrophobicContact CD1-CD1 4.49Å; P511-I513 VanDerWaalsContact C-N 3.3Å; P511-I513 PolarHBondContact O-N 3.17Å; I513-C516 PolarHBondContact O-N 3.27Å; I513-F517 HydrophobicContact CD1-CE2 4.4Å; I513-F517 HydrophobicContact CG1-CD2 4.36Å; I513-F517 HydrophobicContact CG1-CE2 3.99Å; I513-F517 HydrophobicContact CG1-CZ 4.46Å; I513-F517 WeakPolarHBondContact O-CD2 3.37Å; I513-F517 WeakPolarHBondContact O-CG 3.48Å; I513-F517 PolarHBondContact O-N 2.95Å; I513-V609 HydrophobicContact CD1-CG1 4.01Å; I513-V609 HydrophobicContact CD1-CG2 4.01Å; I513-I612 HydrophobicContact CG2-CD1 4.41Å; I513-I612 HydrophobicContact CG2-CG2 4.48Å
514	L	81.9	Confident	65.1	Low	37 Å²	37	62.2 Å²	62.2	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-69.9	-43.3	172.5	175.9	60.4	0	0	0	110.8	P511 D512 C516 F517 L518 I612 N616	P511-L514 WeakPolarHBondContact O-CB 3.46Å; P511-L514 PolarHBondContact O-N 2.92Å; D512-L514 VanDerWaalsContact C-N 3.31Å; D512-L514 PolarHBondContact O-N 3.39Å; L514-C516 VanDerWaalsContact C-N 3.29Å; L514-C516 PolarHBondContact O-N 2.9Å; L514-F517 PolarHBondContact O-N 3.31Å; L514-L518 HydrophobicContact CD1-CD1 4.15Å; L514-L518 HydrophobicContact CD1-CG 4.2Å; L514-L518 HydrophobicContact CG-CD1 4.07Å; L514-L518 WeakPolarHBondContact O-CG 3.25Å; L514-L518 PolarHBondContact O-N 2.96Å; L514-I612 HydrophobicContact CB-CG2 4.46Å; L514-N616 HydrophobicContact CD1-CB 3.63Å
515	S	78.4	Confident	66.9	Low	33 Å²	33	57.4 Å²	57.4	23%	0.231	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-39.7	173.9	-56.7	0	0	0	0	111.8	N411 P511 D512 L518 G519	N411-S515 WeakPolarHBondContact O-CB 3.42Å; P511-S515 PolarHBondContact O-N 3.48Å; P511-S515 VanDerWaalsContact O-N 3.07Å; P511-S515 PolarHBondContact O-OG 3.25Å; D512-S515 WeakPolarHBondContact O-CB 3.14Å; D512-S515 PolarHBondContact O-N 2.89Å; S515-L518 PolarHBondContact O-N 3.31Å; S515-G519 PolarHBondContact O-N 2.99Å
516	C	82.3	Confident	69	Low	1 Å²	1	48.3 Å²	48.3	1%	0.007	29%	0.287	C	S	.	.	H	α-helix	trans	-64.1	-46.6	173.3	-66.5	0	0	0	0	112.2	F490 D512 I513 L514 L518 G519 L520	F490-C516 HydrophobicContact CB-CB 3.97Å; F490-C516 HydrophobicContact CD2-CB 3.87Å; F490-C516 HydrophobicContact CG-CB 4.42Å; D512-C516 PolarHBondContact O-N 3.43Å; D512-C516 PolarHBondContact O-SG 3.48Å; I513-C516 PolarHBondContact O-N 3.27Å; L514-C516 VanDerWaalsContact C-N 3.29Å; L514-C516 PolarHBondContact O-N 2.9Å; C516-L518 PolarHBondContact O-N 3Å; C516-G519 PolarHBondContact O-N 3.42Å; C516-L520 WeakPolarHBondContact O-CB 3.26Å; C516-L520 WeakPolarHBondContact O-CG 3.45Å; C516-L520 PolarHBondContact O-N 3.37Å
517	F	82.5	Confident	71.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.7	-48.7	174.8	-77.7	-51.2	0	0	0	111.6	F490 I513 L514 G519 L520 I521 F528 V609 F613 M655	F490-F517 AromaticContact CE2-CD1 3.97Å; F490-F517 HydrophobicContact CE2-CD1 3.97Å; F490-F517 AromaticContact CE2-CE1 3.59Å; F490-F517 HydrophobicContact CE2-CE1 3.59Å; F490-F517 HydrophobicContact CE2-CZ 4.07Å; F490-F517 HydrophobicContact CZ-CE1 4.09Å; I513-F517 HydrophobicContact CD1-CE2 4.4Å; I513-F517 HydrophobicContact CG1-CD2 4.36Å; I513-F517 HydrophobicContact CG1-CE2 3.99Å; I513-F517 HydrophobicContact CG1-CZ 4.46Å; I513-F517 WeakPolarHBondContact O-CD2 3.37Å; I513-F517 WeakPolarHBondContact O-CG 3.48Å; I513-F517 PolarHBondContact O-N 2.95Å; L514-F517 PolarHBondContact O-N 3.31Å; F517-G519 VanDerWaalsContact C-N 3.32Å; F517-G519 PolarHBondContact O-N 3.24Å; F517-L520 PolarHBondContact O-N 2.86Å; F517-I521 VanDerWaalsContact O-CB 3.26Å; F517-I521 WeakPolarHBondContact O-CB 3.33Å; F517-I521 WeakPolarHBondContact O-CD1 3.25Å; F517-I521 WeakPolarHBondContact O-CG1 3.48Å; F517-I521 PolarHBondContact O-N 3.44Å; F517-F528 HydrophobicContact CD1-CD2 4.27Å; F517-F528 HydrophobicContact CD1-CE2 4.05Å; F517-F528 HydrophobicContact CD1-CZ 4.42Å; F517-F528 AromaticContact CE1-CD2 3.83Å; F517-F528 HydrophobicContact CE1-CD2 3.83Å; F517-F528 AromaticContact CE1-CE2 3.66Å; F517-F528 HydrophobicContact CE1-CE2 3.66Å; F517-F528 HydrophobicContact CE1-CZ 4.43Å; F517-V609 HydrophobicContact CE2-CG1 4.23Å; F517-V609 HydrophobicContact CZ-CG1 3.81Å; F517-F613 AromaticContact CD1-CD2 3.75Å; F517-F613 HydrophobicContact CD1-CD2 3.75Å; F517-F613 HydrophobicContact CD1-CE2 4.26Å; F517-F613 HydrophobicContact CD2-CD2 4.28Å; F517-F613 AromaticContact CE1-CD2 3.85Å; F517-F613 HydrophobicContact CE1-CD2 3.85Å; F517-F613 HydrophobicContact CE2-CB 4.11Å; F517-F613 HydrophobicContact CE2-CD2 4.36Å; F517-F613 AromaticContact CG-CD2 3.99Å; F517-F613 HydrophobicContact CG-CD2 3.99Å; F517-F613 HydrophobicContact CZ-CB 4.24Å; F517-F613 HydrophobicContact CZ-CD2 4.16Å; F517-M655 HydrophobicContact CE1-CE 4.31Å; F517-M655 HydrophobicContact CZ-CE 3.99Å
518	L	78.2	Confident	73.5	Confident	48 Å²	48	45.9 Å²	45.9	25%	0.251	24%	0.241	S	C	.	.	H	α-helix	trans	-62	-39.5	178.5	-67.8	169.1	0	0	0	111.7	C414 L514 S515 C516 I521 R522 L617	C414-L518 VanDerWaalsContact SG-CB 3.57Å; C414-L518 PolarHBondContact SG-O 2.77Å; L514-L518 HydrophobicContact CD1-CD1 4.15Å; L514-L518 HydrophobicContact CD1-CG 4.2Å; L514-L518 HydrophobicContact CG-CD1 4.07Å; L514-L518 WeakPolarHBondContact O-CG 3.25Å; L514-L518 PolarHBondContact O-N 2.96Å; S515-L518 PolarHBondContact O-N 3.31Å; C516-L518 PolarHBondContact O-N 3Å; L518-I521 PolarHBondContact O-N 2.76Å; L518-R522 WeakPolarHBondContact O-CB 3.33Å; L518-R522 PolarHBondContact O-N 2.82Å; L518-L617 HydrophobicContact CD2-CD2 4.01Å
519	G	77.2	Confident	75.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-54.1	173.4	0	0	0	0	0	113	S515 C516 F517 I521 R522 I523	S515-G519 PolarHBondContact O-N 2.99Å; C516-G519 PolarHBondContact O-N 3.42Å; F517-G519 VanDerWaalsContact C-N 3.32Å; F517-G519 PolarHBondContact O-N 3.24Å; G519-I521 VanDerWaalsContact C-N 3.26Å; G519-I521 PolarHBondContact O-N 3.18Å; G519-R522 WeakPolarHBondContact O-CB 3.48Å; G519-R522 PolarHBondContact O-N 3.01Å; G519-I523 WeakPolarHBondContact O-CD1 3.49Å; G519-I523 VanDerWaalsContact O-CG1 3.25Å; G519-I523 WeakPolarHBondContact O-CG1 3.34Å; G519-I523 PolarHBondContact O-N 3.36Å
520	L	81.4	Confident	77.6	Confident	7 Å²	7	40.8 Å²	40.8	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-56.8	-40.8	177.5	-72.5	167	0	0	0	111.9	V486 E487 F490 C516 F517 I523 N524 R525 F528	V486-L520 HydrophobicContact CG1-CD2 3.88Å; V486-L520 HydrophobicContact CG1-CG 3.74Å; E487-L520 HydrophobicContact CG-CD2 4.42Å; F490-L520 HydrophobicContact CB-CD1 3.98Å; F490-L520 HydrophobicContact CD1-CD1 4.12Å; F490-L520 HydrophobicContact CD2-CD1 3.68Å; F490-L520 HydrophobicContact CE2-CD1 4.2Å; F490-L520 HydrophobicContact CG-CD1 3.63Å; C516-L520 WeakPolarHBondContact O-CB 3.26Å; C516-L520 WeakPolarHBondContact O-CG 3.45Å; C516-L520 PolarHBondContact O-N 3.37Å; F517-L520 PolarHBondContact O-N 2.86Å; L520-I523 CarbonylContact O-C 3.54Å; L520-I523 PolarHBondContact O-N 2.92Å; L520-N524 PolarHBondContact O-N 3.33Å; L520-R525 HydrophobicContact CD2-CB 4.5Å; L520-R525 PolarHBondContact O-N 3.27Å; L520-F528 HydrophobicContact CD1-CB 3.85Å; L520-F528 HydrophobicContact CD1-CD1 4.31Å; L520-F528 HydrophobicContact CD1-CG 4.2Å
521	I	78.5	Confident	79	Confident	6 Å²	6	39 Å²	39	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-42	175.4	-74.6	173.5	0	0	0	111.7	F517 L518 G519 I523 N524 F613 L617 I643	F517-I521 VanDerWaalsContact O-CB 3.26Å; F517-I521 WeakPolarHBondContact O-CB 3.33Å; F517-I521 WeakPolarHBondContact O-CD1 3.25Å; F517-I521 WeakPolarHBondContact O-CG1 3.48Å; F517-I521 PolarHBondContact O-N 3.44Å; L518-I521 PolarHBondContact O-N 2.76Å; G519-I521 VanDerWaalsContact C-N 3.26Å; G519-I521 PolarHBondContact O-N 3.18Å; I521-I523 VanDerWaalsContact C-N 3.28Å; I521-I523 PolarHBondContact O-N 3.22Å; I521-N524 WeakPolarHBondContact O-CA 3.27Å; I521-N524 PolarHBondContact O-N 3.44Å; I521-F613 HydrophobicContact CD1-CE2 4.22Å; I521-L617 HydrophobicContact CD1-CD1 3.34Å; I521-L617 HydrophobicContact CD1-CD2 3.75Å; I521-L617 HydrophobicContact CD1-CG 4.2Å; I521-I643 HydrophobicContact CB-CD1 4.01Å; I521-I643 HydrophobicContact CD1-CD1 4.23Å; I521-I643 HydrophobicContact CG1-CD1 3.64Å; I521-I643 HydrophobicContact CG2-CD1 3.61Å; I521-I643 HydrophobicContact CG2-CG1 3.95Å
522	R	72.2	Confident	80.5	Confident	95 Å²	95	34.9 Å²	34.9	36%	0.358	19%	0.185	S	C	.	.	H	α-helix	trans	-65.6	-32.4	176	-166.1	60	171.5	161.8	-1.6	112.3	L417 D418 L518 G519 N524 T642	L417-R522 HydrophobicContact CD1-CB 4.34Å; L417-R522 HydrophobicContact CD1-CG 4.18Å; D418-R522 IonicContact OD1-CZ 2.96Å; D418-R522 IonicContact OD1-NE 2.97Å; D418-R522 PolarHBondContact OD1-NE 2.81Å; D418-R522 IonicContact OD1-NH2 3.15Å; D418-R522 PolarHBondContact OD1-NH2 2.84Å; D418-R522 IonicContact OD2-CZ 3.88Å; D418-R522 IonicContact OD2-NE 2.69Å; D418-R522 IonicContact OD2-NH2 2.74Å; L518-R522 WeakPolarHBondContact O-CB 3.33Å; L518-R522 PolarHBondContact O-N 2.82Å; G519-R522 WeakPolarHBondContact O-CB 3.48Å; G519-R522 PolarHBondContact O-N 3.01Å; R522-N524 VanDerWaalsContact C-N 3.27Å; R522-T642 PolarHBondContact NH1-OG1 3.24Å
523	I	76.5	Confident	81.4	Confident	34 Å²	34	37 Å²	37	17%	0.174	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.5	173.7	-55.7	157.1	0	0	0	111.5	L417 H483 V486 G519 L520 I521 R525	L417-I523 HydrophobicContact CD1-CD1 4.24Å; L417-I523 HydrophobicContact CD1-CG1 3.76Å; H483-I523 HydrophobicContact CB-CD1 4.3Å; H483-I523 HydrophobicContact CB-CG2 4.43Å; V486-I523 HydrophobicContact CB-CD1 3.93Å; V486-I523 HydrophobicContact CG1-CD1 3.89Å; V486-I523 HydrophobicContact CG2-CD1 4.14Å; G519-I523 WeakPolarHBondContact O-CD1 3.49Å; G519-I523 VanDerWaalsContact O-CG1 3.25Å; G519-I523 WeakPolarHBondContact O-CG1 3.34Å; G519-I523 PolarHBondContact O-N 3.36Å; L520-I523 CarbonylContact O-C 3.54Å; L520-I523 PolarHBondContact O-N 2.92Å; I521-I523 VanDerWaalsContact C-N 3.28Å; I521-I523 PolarHBondContact O-N 3.22Å; I523-R525 HydrophobicContact CG2-CG 3.9Å; I523-R525 PolarHBondContact O-N 3.38Å
524	N	75.1	Confident	81.8	Confident	96 Å²	96	39.7 Å²	39.7	51%	0.513	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	34.2	-174.2	-178.5	53.1	0	0	0	113.2	L520 I521 R522	L520-N524 PolarHBondContact O-N 3.33Å; I521-N524 WeakPolarHBondContact O-CA 3.27Å; I521-N524 PolarHBondContact O-N 3.44Å; R522-N524 VanDerWaalsContact C-N 3.27Å
525	R	78.5	Confident	82.2	Confident	97 Å²	97	39 Å²	39	37%	0.366	21%	0.213	S	C	.	.			trans	-98.6	107.1	171.4	-74.8	-69.9	-62.8	-68.8	-10.9	109.3	E487 L520 I523 D527	E487-R525 IonicContact OE1-CZ 3.75Å; E487-R525 IonicContact OE1-NH1 3.2Å; E487-R525 PolarHBondContact OE1-NH1 3.19Å; E487-R525 IonicContact OE1-NH2 3.6Å; E487-R525 PolarHBondContact OE1-NH2 3.36Å; L520-R525 HydrophobicContact CD2-CB 4.5Å; L520-R525 PolarHBondContact O-N 3.27Å; I523-R525 HydrophobicContact CG2-CG 3.9Å; I523-R525 PolarHBondContact O-N 3.38Å; R525-D527 IonicContact CZ-OD1 3.62Å; R525-D527 IonicContact CZ-OD2 3.61Å; R525-D527 IonicContact NE-OD1 3.87Å; R525-D527 PolarHBondContact NE-OD1 3.47Å; R525-D527 IonicContact NE-OD2 3.94Å; R525-D527 PolarHBondContact NE-OD2 2.88Å; R525-D527 VanDerWaalsContact NE-OD2 3.16Å; R525-D527 IonicContact NH2-OD1 2.79Å; R525-D527 IonicContact NH2-OD2 3.68Å; R525-D527 PolarHBondContact NH2-OD2 3.34Å
526	L	77.3	Confident	82.8	Confident	29 Å²	29	37.5 Å²	37.5	15%	0.152	20%	0.202	C	C	.	.			trans	-113.2	5.8	-168.2	-48.1	-179.2	0	0	0	112.3	F528 I643 K647 L651	L526-F528 VanDerWaalsContact C-N 3.25Å; L526-F528 HydrophobicContact CD2-CE1 4.4Å; L526-F528 PolarHBondContact O-N 3.38Å; L526-I643 HydrophobicContact CD1-CD1 4.24Å; L526-I643 HydrophobicContact CD2-CD1 3.44Å; L526-I643 VanDerWaalsContact CD2-CD1 3.44Å; L526-K647 HydrophobicContact CD1-CD 4.07Å; L526-L651 HydrophobicContact CB-CD1 4.3Å; L526-L651 HydrophobicContact CB-CD2 4.2Å; L526-L651 HydrophobicContact CD1-CD1 4.42Å; L526-L651 HydrophobicContact CD2-CD1 4.29Å
527	D	82.3	Confident	83.3	Confident	76 Å²	76	39.5 Å²	39.5	41%	0.406	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-6	176.1	45.1	-54.6	0	0	0	113.3	R525 V529 S530	R525-D527 IonicContact CZ-OD1 3.62Å; R525-D527 IonicContact CZ-OD2 3.61Å; R525-D527 IonicContact NE-OD1 3.87Å; R525-D527 PolarHBondContact NE-OD1 3.47Å; R525-D527 IonicContact NE-OD2 3.94Å; R525-D527 PolarHBondContact NE-OD2 2.88Å; R525-D527 VanDerWaalsContact NE-OD2 3.16Å; R525-D527 IonicContact NH2-OD1 2.79Å; R525-D527 IonicContact NH2-OD2 3.68Å; R525-D527 PolarHBondContact NH2-OD2 3.34Å; D527-V529 PolarHBondContact O-N 2.97Å; D527-V529 VanDerWaalsContact O-N 3.07Å; D527-S530 WeakPolarHBondContact O-CB 3.22Å; D527-S530 PolarHBondContact O-N 2.99Å; D527-S530 PolarHBondContact O-OG 2.82Å
528	F	85.5	Confident	83.7	Confident	12 Å²	12	43.7 Å²	43.7	5%	0.053	23%	0.23	C	C	.	.	H	α-helix	trans	-54.8	-26.6	175.9	68.5	-98.1	0	0	0	113.9	F490 F517 L520 L526 S530 G531 F532 F613 L651 M655	F490-F528 HydrophobicContact CD1-CB 4.45Å; F490-F528 HydrophobicContact CE1-CB 3.9Å; F490-F528 HydrophobicContact CZ-CB 4.09Å; F490-F528 HydrophobicContact CZ-CD2 4.23Å; F517-F528 HydrophobicContact CD1-CD2 4.27Å; F517-F528 HydrophobicContact CD1-CE2 4.05Å; F517-F528 HydrophobicContact CD1-CZ 4.42Å; F517-F528 AromaticContact CE1-CD2 3.83Å; F517-F528 HydrophobicContact CE1-CD2 3.83Å; F517-F528 AromaticContact CE1-CE2 3.66Å; F517-F528 HydrophobicContact CE1-CE2 3.66Å; F517-F528 HydrophobicContact CE1-CZ 4.43Å; L520-F528 HydrophobicContact CD1-CB 3.85Å; L520-F528 HydrophobicContact CD1-CD1 4.31Å; L520-F528 HydrophobicContact CD1-CG 4.2Å; L526-F528 VanDerWaalsContact C-N 3.25Å; L526-F528 HydrophobicContact CD2-CE1 4.4Å; L526-F528 PolarHBondContact O-N 3.38Å; F528-S530 PolarHBondContact O-N 3.43Å; F528-G531 PolarHBondContact O-N 3.01Å; F528-G531 VanDerWaalsContact O-N 3.08Å; F528-F532 PolarHBondContact O-N 3.17Å; F528-F613 HydrophobicContact CE1-CE2 4.46Å; F528-F613 HydrophobicContact CE2-CD2 4.4Å; F528-F613 HydrophobicContact CE2-CE2 4.05Å; F528-F613 HydrophobicContact CZ-CD2 4.27Å; F528-F613 AromaticContact CZ-CE2 3.51Å; F528-F613 HydrophobicContact CZ-CE2 3.51Å; F528-F613 HydrophobicContact CZ-CZ 4Å; F528-L651 HydrophobicContact CE1-CD1 4.36Å; F528-L651 HydrophobicContact CZ-CD1 4.25Å; F528-M655 HydrophobicContact CE2-SD 4.12Å
529	V	86.7	Confident	84.2	Confident	18 Å²	18	42.7 Å²	42.7	11%	0.109	22%	0.223	C	C	.	.	H	α-helix	trans	-62	-27.5	174.6	-175.4	0	0	0	0	111.6	D527 H533 L651 C654 M655	D527-V529 PolarHBondContact O-N 2.97Å; D527-V529 VanDerWaalsContact O-N 3.07Å; V529-H533 WeakPolarHBondContact O-CB 3.43Å; V529-H533 PolarHBondContact O-N 3.29Å; V529-L651 HydrophobicContact CG2-CD2 3.87Å; V529-C654 HydrophobicContact CG1-CB 3.9Å; V529-M655 HydrophobicContact CG1-CG 3.9Å; V529-M655 HydrophobicContact CG2-CG 3.98Å; V529-M655 HydrophobicContact CG2-SD 4.5Å
530	S	86.1	Confident	84.9	Confident	81 Å²	81	42.8 Å²	42.8	57%	0.566	22%	0.224	S	C	*	.	H	α-helix	trans	-74.3	-35.3	173.3	71.1	0	0	0	0	112.8	D527 F528 H533 A534	D527-S530 WeakPolarHBondContact O-CB 3.22Å; D527-S530 PolarHBondContact O-N 2.99Å; D527-S530 PolarHBondContact O-OG 2.82Å; F528-S530 PolarHBondContact O-N 3.43Å; S530-H533 PolarHBondContact O-N 3.15Å; S530-A534 WeakPolarHBondContact O-CB 3.4Å; S530-A534 PolarHBondContact O-N 3.44Å
531	G	86.6	Confident	85.3	Confident	21 Å²	21	48.6 Å²	48.6	22%	0.216	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-46	170	0	0	0	0	0	111.5	F528 H533 A534 E535	F528-G531 PolarHBondContact O-N 3.01Å; F528-G531 VanDerWaalsContact O-N 3.08Å; G531-H533 VanDerWaalsContact C-N 3.32Å; G531-H533 PolarHBondContact O-N 3.35Å; G531-A534 PolarHBondContact O-N 3.4Å; G531-E535 PolarHBondContact O-N 2.63Å
532	F	90.7	Very high	85.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-54	-45.2	171.9	-178	-113	0	0	0	112.6	L494 F528 M536 V609 V610 M655 T658 L659	L494-F532 HydrophobicContact CD1-CD2 3.88Å; L494-F532 HydrophobicContact CD1-CE2 4.34Å; L494-F532 HydrophobicContact CD2-CB 4.45Å; L494-F532 HydrophobicContact CD2-CD2 4.38Å; F528-F532 PolarHBondContact O-N 3.17Å; F532-M536 HydrophobicContact CD2-CG 4.26Å; F532-M536 HydrophobicContact CE1-CG 4.39Å; F532-M536 HydrophobicContact CE2-CG 3.99Å; F532-M536 HydrophobicContact CE2-SD 4.15Å; F532-M536 HydrophobicContact CZ-CG 4.07Å; F532-M536 HydrophobicContact CZ-SD 4.32Å; F532-M536 WeakPolarHBondContact O-CB 3.31Å; F532-M536 WeakPolarHBondContact O-CG 3.46Å; F532-M536 PolarHBondContact O-N 3.39Å; F532-V609 HydrophobicContact CD2-CG1 4.22Å; F532-V609 HydrophobicContact CE2-CB 4.07Å; F532-V609 HydrophobicContact CE2-CG1 3.82Å; F532-V610 HydrophobicContact CE1-CG2 4.28Å; F532-V610 HydrophobicContact CZ-CG2 4.14Å; F532-M655 HydrophobicContact CD1-CB 4.14Å; F532-M655 HydrophobicContact CD1-CE 4.21Å; F532-M655 HydrophobicContact CD1-CG 4.11Å; F532-M655 HydrophobicContact CD2-CE 4.46Å; F532-M655 HydrophobicContact CE1-CB 3.89Å; F532-M655 HydrophobicContact CE1-CE 4.29Å; F532-M655 HydrophobicContact CE1-CG 4.32Å; F532-M655 HydrophobicContact CG-CE 4.3Å; F532-M655 HydrophobicContact CZ-CE 4.45Å; F532-T658 HydrophobicContact CD1-CG2 3.62Å; F532-T658 HydrophobicContact CE1-CG2 3.75Å; F532-L659 HydrophobicContact CE1-CD2 4.32Å; F532-L659 HydrophobicContact CZ-CD2 3.97Å
533	H	89.8	Confident	86.5	Confident	82 Å²	82	46.8 Å²	46.8	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-66.5	-41.3	176.4	-178.1	-86.3	0	0	0	113.4	V529 S530 G531 L537 T658 N661	V529-H533 WeakPolarHBondContact O-CB 3.43Å; V529-H533 PolarHBondContact O-N 3.29Å; S530-H533 PolarHBondContact O-N 3.15Å; G531-H533 VanDerWaalsContact C-N 3.32Å; G531-H533 PolarHBondContact O-N 3.35Å; H533-L537 WeakPolarHBondContact CE1-CD1 3.41Å; H533-L537 WeakPolarHBondContact O-CG 3.5Å; H533-L537 PolarHBondContact O-N 3.31Å; H533-T658 VanDerWaalsContact CA-CG2 3.47Å; H533-T658 HydrophobicContact CB-CG2 3.73Å; H533-N661 WeakPolarHBondContact NE2-CB 3.49Å; H533-N661 PolarHBondContact NE2-ND2 3.02Å
534	A	89.3	Confident	87.1	Confident	61 Å²	61	45.2 Å²	45.2	50%	0.504	24%	0.236	S	C	.	.	H	α-helix	trans	-62.9	-46.2	176	0	0	0	0	0	111.7	S530 G531 L537 K538	S530-A534 WeakPolarHBondContact O-CB 3.4Å; S530-A534 PolarHBondContact O-N 3.44Å; G531-A534 PolarHBondContact O-N 3.4Å; A534-L537 PolarHBondContact O-N 2.87Å; A534-K538 VanDerWaalsContact O-CB 3.31Å; A534-K538 WeakPolarHBondContact O-CB 3.18Å; A534-K538 PolarHBondContact O-N 2.98Å
535	E	90.4	Very high	87.6	Confident	23 Å²	23	43.3 Å²	43.3	11%	0.107	23%	0.23	C	C	.	.	H	α-helix	trans	-71.3	-42.3	-176.8	-168.7	51.4	-130.9	0	0	112.2	L494 L498 G531 L537 K538 R539	L494-E535 HydrophobicContact CD2-CB 4.19Å; L494-E535 HydrophobicContact CG-CG 4.47Å; L498-E535 HydrophobicContact CD1-CB 4.48Å; L498-E535 HydrophobicContact CD1-CG 3.97Å; G531-E535 PolarHBondContact O-N 2.63Å; E535-L537 VanDerWaalsContact C-N 3.3Å; E535-L537 PolarHBondContact O-N 3.48Å; E535-K538 PolarHBondContact O-N 3Å; E535-K538 IonicContact OE1-NZ 3.8Å; E535-K538 PolarHBondContact OE1-NZ 2.83Å; E535-K538 WeakPolarHBondContact OE2-CD 3.41Å; E535-K538 IonicContact OE2-NZ 3.97Å; E535-K538 PolarHBondContact OE2-NZ 3.36Å; E535-R539 WeakPolarHBondContact O-CB 3.35Å; E535-R539 PolarHBondContact O-N 3.2Å
536	M	92.7	Very high	88	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.3	-41.7	174.1	-72.1	-65.7	-58.3	0	0	112.1	L498 F532 V540 L602 T658 L659 T662	L498-M536 HydrophobicContact CD1-CG 4.4Å; L498-M536 HydrophobicContact CD1-SD 3.7Å; L498-M536 HydrophobicContact CD2-SD 3.7Å; L498-M536 HydrophobicContact CG-SD 4.37Å; F532-M536 HydrophobicContact CD2-CG 4.26Å; F532-M536 HydrophobicContact CE1-CG 4.39Å; F532-M536 HydrophobicContact CE2-CG 3.99Å; F532-M536 HydrophobicContact CE2-SD 4.15Å; F532-M536 HydrophobicContact CZ-CG 4.07Å; F532-M536 HydrophobicContact CZ-SD 4.32Å; F532-M536 WeakPolarHBondContact O-CB 3.31Å; F532-M536 WeakPolarHBondContact O-CG 3.46Å; F532-M536 PolarHBondContact O-N 3.39Å; M536-V540 WeakPolarHBondContact O-CG2 3.5Å; M536-V540 PolarHBondContact O-N 2.99Å; M536-V540 VanDerWaalsContact O-N 3.1Å; M536-L602 HydrophobicContact CE-CD1 3.97Å; M536-L602 HydrophobicContact CE-CG 3.84Å; M536-L602 HydrophobicContact SD-CD1 3.98Å; M536-L602 HydrophobicContact SD-CG 4.5Å; M536-T658 HydrophobicContact CB-CG2 4.48Å; M536-T658 HydrophobicContact CG-CG2 4.41Å; M536-L659 HydrophobicContact CE-CD2 3.85Å; M536-T662 HydrophobicContact CB-CG2 4.16Å; M536-T662 HydrophobicContact CE-CG2 4Å
537	L	91.5	Very high	88.4	Confident	43 Å²	43	43.1 Å²	43.1	23%	0.225	23%	0.232	C	C	.	.	H	α-helix	trans	-74.4	-34.6	176.8	-69.3	-177	0	0	0	113.2	H533 A534 E535 K541 T662 V665	H533-L537 WeakPolarHBondContact CE1-CD1 3.41Å; H533-L537 WeakPolarHBondContact O-CG 3.5Å; H533-L537 PolarHBondContact O-N 3.31Å; A534-L537 PolarHBondContact O-N 2.87Å; E535-L537 VanDerWaalsContact C-N 3.3Å; E535-L537 PolarHBondContact O-N 3.48Å; L537-K541 WeakPolarHBondContact O-CB 3.42Å; L537-K541 PolarHBondContact O-N 3.1Å; L537-T662 HydrophobicContact CD2-CG2 4.47Å; L537-V665 HydrophobicContact CD2-CB 4.26Å; L537-V665 HydrophobicContact CD2-CG1 4.32Å; L537-V665 HydrophobicContact CD2-CG2 4.16Å
538	K	90.9	Very high	88.4	Confident	88 Å²	88	41.1 Å²	41.1	38%	0.383	22%	0.221	S	C	.	.	H	α-helix	trans	-60.4	-48.7	170.9	165.7	166.7	156.8	-82	0	110.6	A534 E535 V540 K541 E542	A534-K538 VanDerWaalsContact O-CB 3.31Å; A534-K538 WeakPolarHBondContact O-CB 3.18Å; A534-K538 PolarHBondContact O-N 2.98Å; E535-K538 PolarHBondContact O-N 3Å; E535-K538 IonicContact OE1-NZ 3.8Å; E535-K538 PolarHBondContact OE1-NZ 2.83Å; E535-K538 WeakPolarHBondContact OE2-CD 3.41Å; E535-K538 IonicContact OE2-NZ 3.97Å; E535-K538 PolarHBondContact OE2-NZ 3.36Å; K538-V540 PolarHBondContact O-N 2.81Å; K538-K541 WeakPolarHBondContact O-CA 3.35Å; K538-K541 WeakPolarHBondContact O-CB 3.18Å; K538-K541 PolarHBondContact O-N 3.34Å; K538-E542 WeakPolarHBondContact CE-OE1 3.4Å; K538-E542 VanDerWaalsContact CG-OE1 3.27Å; K538-E542 WeakPolarHBondContact CG-OE1 3.37Å; K538-E542 IonicContact NZ-OE1 3.26Å; K538-E542 WeakPolarHBondContact O-CG 3.44Å; K538-E542 PolarHBondContact O-N 3Å
539	R	89.8	Confident	88.2	Confident	27 Å²	27	43.6 Å²	43.6	10%	0.102	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-38.8	179.6	-144.2	70.7	175.9	111.8	-4.5	112.5	D499 P500 E535 E542 I543 L602	D499-R539 IonicContact OD1-CZ 2.77Å; D499-R539 IonicContact OD1-NE 2.71Å; D499-R539 PolarHBondContact OD1-NE 3.21Å; D499-R539 IonicContact OD1-NH2 2.63Å; D499-R539 PolarHBondContact OD1-NH2 3.45Å; P500-R539 VanDerWaalsContact CD-NH2 3.35Å; E535-R539 WeakPolarHBondContact O-CB 3.35Å; E535-R539 PolarHBondContact O-N 3.2Å; R539-E542 WeakPolarHBondContact CD-OE2 3.43Å; R539-E542 IonicContact CZ-OE2 2.72Å; R539-E542 IonicContact NE-OE2 2.69Å; R539-E542 IonicContact NH1-OE2 3.51Å; R539-E542 PolarHBondContact NH1-OE2 2.75Å; R539-E542 PolarHBondContact O-N 2.97Å; R539-I543 VanDerWaalsContact O-CG1 3.28Å; R539-I543 WeakPolarHBondContact O-CG1 3.43Å; R539-I543 PolarHBondContact O-N 3.42Å; R539-L602 HydrophobicContact CB-CD1 3.97Å; R539-L602 HydrophobicContact CB-CD2 3.86Å; R539-L602 HydrophobicContact CG-CD1 4.02Å; R539-L602 HydrophobicContact CG-CD2 4.34Å
540	V	91	Very high	87.7	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.018	26%	0.258	C	S	.	.	H	α-helix	trans	-57.5	-49.5	167.7	167.3	0	0	0	0	111.2	M536 K538 E542 I543 F544 L602 T662 S666	M536-V540 WeakPolarHBondContact O-CG2 3.5Å; M536-V540 PolarHBondContact O-N 2.99Å; M536-V540 VanDerWaalsContact O-N 3.1Å; K538-V540 PolarHBondContact O-N 2.81Å; V540-E542 VanDerWaalsContact C-N 3.27Å; V540-E542 PolarHBondContact O-N 3.21Å; V540-I543 PolarHBondContact O-N 3.06Å; V540-F544 HydrophobicContact CG1-CD2 3.79Å; V540-F544 HydrophobicContact CG1-CE2 3.83Å; V540-F544 WeakPolarHBondContact O-CD2 3.41Å; V540-F544 PolarHBondContact O-N 2.84Å; V540-F544 VanDerWaalsContact O-N 3.14Å; V540-L602 HydrophobicContact CG2-CD2 3.61Å; V540-T662 HydrophobicContact CG2-CG2 3.4Å; V540-T662 VanDerWaalsContact CG2-CG2 3.4Å; V540-S666 WeakPolarHBondContact CG1-OG 3.19Å; V540-S666 WeakPolarHBondContact CG2-OG 3.18Å
541	K	89.3	Confident	87	Confident	129 Å²	129	44.4 Å²	44.4	56%	0.561	24%	0.242	S	C	*	.	H	α-helix	trans	-57.6	-43	179.9	-176.3	-177.7	176.7	-177.1	0	111.4	L537 K538 C545	L537-K541 WeakPolarHBondContact O-CB 3.42Å; L537-K541 PolarHBondContact O-N 3.1Å; K538-K541 WeakPolarHBondContact O-CA 3.35Å; K538-K541 WeakPolarHBondContact O-CB 3.18Å; K538-K541 PolarHBondContact O-N 3.34Å; K541-C545 WeakPolarHBondContact O-CB 3.39Å; K541-C545 PolarHBondContact O-N 2.95Å; K541-C545 PolarHBondContact O-SG 3.28Å; K541-C545 VanDerWaalsContact O-SG 3.35Å
542	E	88.7	Confident	86	Confident	59 Å²	59	45.6 Å²	45.6	28%	0.276	25%	0.245	S	C	.	.	H	α-helix	trans	-65.2	-48.8	178.5	-72.4	170.5	-175.3	0	0	112.8	K538 R539 V540 F544 C545 Q546	K538-E542 WeakPolarHBondContact CE-OE1 3.4Å; K538-E542 VanDerWaalsContact CG-OE1 3.27Å; K538-E542 WeakPolarHBondContact CG-OE1 3.37Å; K538-E542 IonicContact NZ-OE1 3.26Å; K538-E542 WeakPolarHBondContact O-CG 3.44Å; K538-E542 PolarHBondContact O-N 3Å; R539-E542 WeakPolarHBondContact CD-OE2 3.43Å; R539-E542 IonicContact CZ-OE2 2.72Å; R539-E542 IonicContact NE-OE2 2.69Å; R539-E542 IonicContact NH1-OE2 3.51Å; R539-E542 PolarHBondContact NH1-OE2 2.75Å; R539-E542 PolarHBondContact O-N 2.97Å; V540-E542 VanDerWaalsContact C-N 3.27Å; V540-E542 PolarHBondContact O-N 3.21Å; E542-F544 PolarHBondContact O-N 2.65Å; E542-C545 CarbonylContact O-C 3.59Å; E542-C545 WeakPolarHBondContact O-CA 3.44Å; E542-C545 WeakPolarHBondContact O-CB 3.32Å; E542-C545 PolarHBondContact O-N 3.43Å; E542-Q546 WeakPolarHBondContact O-CG 3.47Å; E542-Q546 PolarHBondContact O-N 2.68Å
543	I	88.6	Confident	84.4	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-56.7	-48.5	177.7	-68.8	165.6	0	0	0	110.6	R539 V540 C545 Q546 H547 L595 D598 I599 L602	R539-I543 VanDerWaalsContact O-CG1 3.28Å; R539-I543 WeakPolarHBondContact O-CG1 3.43Å; R539-I543 PolarHBondContact O-N 3.42Å; V540-I543 PolarHBondContact O-N 3.06Å; I543-C545 VanDerWaalsContact C-N 3.3Å; I543-C545 PolarHBondContact O-N 3.2Å; I543-Q546 PolarHBondContact O-N 3.07Å; I543-H547 PolarHBondContact O-CD2 2.99Å; I543-H547 PolarHBondContact O-N 3.14Å; I543-L595 HydrophobicContact CG2-CD1 4.01Å; I543-D598 HydrophobicContact CD1-CB 4.42Å; I543-D598 HydrophobicContact CG2-CB 3.79Å; I543-I599 HydrophobicContact CG2-CG1 4.05Å; I543-L602 HydrophobicContact CD1-CB 4.17Å; I543-L602 HydrophobicContact CD1-CD2 3.83Å
544	F	87.9	Confident	82.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61	-38.1	174.8	-86.1	-83.2	0	0	0	112.5	V540 E542 I548 L595 I599 R669 L670 I673	V540-F544 HydrophobicContact CG1-CD2 3.79Å; V540-F544 HydrophobicContact CG1-CE2 3.83Å; V540-F544 WeakPolarHBondContact O-CD2 3.41Å; V540-F544 PolarHBondContact O-N 2.84Å; V540-F544 VanDerWaalsContact O-N 3.14Å; E542-F544 PolarHBondContact O-N 2.65Å; F544-I548 WeakPolarHBondContact O-CB 3.35Å; F544-I548 WeakPolarHBondContact O-CD1 3.44Å; F544-I548 WeakPolarHBondContact O-CG1 3.45Å; F544-I548 PolarHBondContact O-N 3.37Å; F544-L595 HydrophobicContact CD1-CD1 3.94Å; F544-L595 HydrophobicContact CD1-CD2 4.02Å; F544-L595 HydrophobicContact CE1-CD1 4.12Å; F544-L595 HydrophobicContact CE1-CD2 3.78Å; F544-L595 HydrophobicContact CE1-CG 4.29Å; F544-L595 HydrophobicContact CG-CD1 4.17Å; F544-L595 HydrophobicContact CZ-CD1 4.5Å; F544-I599 HydrophobicContact CD2-CD1 4.14Å; F544-I599 HydrophobicContact CE2-CD1 3.42Å; F544-I599 VanDerWaalsContact CE2-CD1 3.42Å; F544-I599 HydrophobicContact CE2-CG1 4.47Å; F544-I599 HydrophobicContact CZ-CD1 3.64Å; F544-R669 VanDerWaalsContact CB-CZ 3.45Å; F544-R669 VanDerWaalsContact CB-NH1 3.28Å; F544-R669 HydrophobicContact CD1-CG 3.89Å; F544-R669 HydrophobicContact CE1-CB 3.84Å; F544-R669 HydrophobicContact CE1-CG 3.59Å; F544-R669 HydrophobicContact CE2-CB 4.11Å; F544-R669 HydrophobicContact CE2-CG 4.3Å; F544-R669 HydrophobicContact CG-CG 4.37Å; F544-R669 HydrophobicContact CZ-CB 3.59Å; F544-R669 HydrophobicContact CZ-CG 3.83Å; F544-L670 HydrophobicContact CE1-CD2 4.33Å; F544-L670 HydrophobicContact CZ-CD2 4.29Å; F544-L670 HydrophobicContact CZ-CG 4.11Å; F544-I673 HydrophobicContact CD1-CD1 4.07Å; F544-I673 HydrophobicContact CE1-CD1 3.76Å
545	C	86.9	Confident	80.4	Confident	57 Å²	57	56.3 Å²	56.3	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-69.4	-38	177.1	-79.6	0	0	0	0	112.5	K541 E542 I543 T549	K541-C545 WeakPolarHBondContact O-CB 3.39Å; K541-C545 PolarHBondContact O-N 2.95Å; K541-C545 PolarHBondContact O-SG 3.28Å; K541-C545 VanDerWaalsContact O-SG 3.35Å; E542-C545 CarbonylContact O-C 3.59Å; E542-C545 WeakPolarHBondContact O-CA 3.44Å; E542-C545 WeakPolarHBondContact O-CB 3.32Å; E542-C545 PolarHBondContact O-N 3.43Å; I543-C545 VanDerWaalsContact C-N 3.3Å; I543-C545 PolarHBondContact O-N 3.2Å; C545-T549 VanDerWaalsContact O-CB 3.25Å; C545-T549 WeakPolarHBondContact O-CB 3.42Å; C545-T549 PolarHBondContact O-N 2.85Å; C545-T549 PolarHBondContact O-OG1 2.85Å
546	Q	85.7	Confident	78.1	Confident	99 Å²	99	58.5 Å²	58.5	46%	0.463	33%	0.334	S	S	.	.	H	α-helix	trans	-63.2	-52.1	176.1	-72.4	167.3	-10.3	0	0	110.9	E542 I543 I548 T549 S550	E542-Q546 WeakPolarHBondContact O-CG 3.47Å; E542-Q546 PolarHBondContact O-N 2.68Å; I543-Q546 PolarHBondContact O-N 3.07Å; Q546-I548 PolarHBondContact O-N 3.25Å; Q546-T549 PolarHBondContact O-N 2.97Å; Q546-T549 VanDerWaalsContact O-N 3.12Å; Q546-S550 PolarHBondContact O-N 3.08Å; Q546-S550 PolarHBondContact O-OG 2.96Å
547	H	85.4	Confident	75.6	Confident	23 Å²	23	65.5 Å²	65.5	11%	0.106	37%	0.372	C	S	.	.	H	α-helix	trans	-63.9	-36.8	178	-79.9	-70.9	0	0	0	113.4	I543 S550 V551 F591 L595 D598	I543-H547 PolarHBondContact O-CD2 2.99Å; I543-H547 PolarHBondContact O-N 3.14Å; H547-S550 PolarHBondContact O-OG 3.15Å; H547-V551 WeakPolarHBondContact O-CG2 3.27Å; H547-V551 PolarHBondContact O-N 2.82Å; H547-F591 HydrophobicContact CB-CD2 4.24Å; H547-F591 HydrophobicContact CB-CE2 3.83Å; H547-L595 HydrophobicContact CB-CD1 4.17Å; H547-D598 IonicContact CD2-OD2 3.66Å; H547-D598 IonicContact CE1-OD2 3.51Å; H547-D598 IonicContact NE2-OD2 3.55Å; H547-D598 PolarHBondContact NE2-OD2 3.05Å
548	I	82.9	Confident	73	Confident	33 Å²	33	71.8 Å²	71.8	17%	0.169	41%	0.406	C	S	.	.	H	α-helix	trans	-70.8	-34.3	173.9	-67.5	167.8	0	0	0	110.8	F544 Q546 V551 T552 T576	F544-I548 WeakPolarHBondContact O-CB 3.35Å; F544-I548 WeakPolarHBondContact O-CD1 3.44Å; F544-I548 WeakPolarHBondContact O-CG1 3.45Å; F544-I548 PolarHBondContact O-N 3.37Å; Q546-I548 PolarHBondContact O-N 3.25Å; I548-V551 PolarHBondContact O-N 3.35Å; I548-T552 HydrophobicContact CG2-CG2 4.48Å; I548-T552 VanDerWaalsContact O-CG2 3.28Å; I548-T552 WeakPolarHBondContact O-CG2 3.4Å; I548-T552 PolarHBondContact O-N 2.99Å; I548-T552 PolarHBondContact O-OG1 3.07Å; I548-T576 HydrophobicContact CG2-CG2 4.39Å
549	T	80.6	Confident	70.6	Confident	64 Å²	64	71.9 Å²	71.9	39%	0.393	42%	0.417	S	S	.	.	H	α-helix	trans	-69.3	-42.8	178.2	-57.5	0	0	0	0	111.6	C545 Q546 V551 T552 Q553	C545-T549 VanDerWaalsContact O-CB 3.25Å; C545-T549 WeakPolarHBondContact O-CB 3.42Å; C545-T549 PolarHBondContact O-N 2.85Å; C545-T549 PolarHBondContact O-OG1 2.85Å; Q546-T549 PolarHBondContact O-N 2.97Å; Q546-T549 VanDerWaalsContact O-N 3.12Å; T549-V551 PolarHBondContact O-N 3.46Å; T549-T552 WeakPolarHBondContact CA-OG1 3.21Å; T549-T552 PolarHBondContact O-N 3.25Å; T549-T552 PolarHBondContact O-OG1 2.91Å; T549-Q553 HydrophobicContact CG2-CG 4.3Å; T549-Q553 PolarHBondContact O-N 3.48Å; T549-Q553 VanDerWaalsContact O-N 3.11Å
550	S	76.4	Confident	68.1	Low	77 Å²	77	77.5 Å²	77.5	54%	0.538	45%	0.454	S	S	.	.	H	α-helix	trans	-63.1	-26.8	178.3	63.3	0	0	0	0	113.5	Q546 H547	Q546-S550 PolarHBondContact O-N 3.08Å; Q546-S550 PolarHBondContact O-OG 2.96Å; H547-S550 PolarHBondContact O-OG 3.15Å
551	V	71.5	Confident	65.4	Low	39 Å²	39	83.1 Å²	83.1	24%	0.236	49%	0.489	C	S	.	.	H	α-helix	trans	-82.5	-19.3	174.2	175.6	0	0	0	0	113.2	H547 I548 T549 L580 M583 F591	H547-V551 WeakPolarHBondContact O-CG2 3.27Å; H547-V551 PolarHBondContact O-N 2.82Å; I548-V551 PolarHBondContact O-N 3.35Å; T549-V551 PolarHBondContact O-N 3.46Å; V551-L580 HydrophobicContact CG1-CD2 4.22Å; V551-M583 HydrophobicContact CB-CE 4.38Å; V551-M583 HydrophobicContact CG1-CE 3.82Å; V551-M583 HydrophobicContact CG1-SD 3.87Å; V551-M583 HydrophobicContact CG2-CE 3.59Å; V551-M583 HydrophobicContact CG2-SD 4.36Å; V551-F591 HydrophobicContact CG2-CD2 3.58Å; V551-F591 HydrophobicContact CG2-CE2 4.03Å; V551-F591 HydrophobicContact CG2-CG 4.35Å
552	T	65.8	Low	62.7	Low	46 Å²	46	84.4 Å²	84.4	28%	0.282	50%	0.502	S	S	.	.	H	α-helix	trans	-105	-10.4	-174.1	54	0	0	0	0	114.6	I548 T549 T576	I548-T552 HydrophobicContact CG2-CG2 4.48Å; I548-T552 VanDerWaalsContact O-CG2 3.28Å; I548-T552 WeakPolarHBondContact O-CG2 3.4Å; I548-T552 PolarHBondContact O-N 2.99Å; I548-T552 PolarHBondContact O-OG1 3.07Å; T549-T552 WeakPolarHBondContact CA-OG1 3.21Å; T549-T552 PolarHBondContact O-N 3.25Å; T549-T552 PolarHBondContact O-OG1 2.91Å; T552-T576 HydrophobicContact CG2-CG2 4.43Å
553	Q	57.8	Low	60	Low	133 Å²	133	86.4 Å²	86.4	62%	0.621	52%	0.523	S	S	*	.	S	Bend	trans	-72.7	130.4	168.8	-71.6	179.2	1.7	0	0	110.4	T549	T549-Q553 HydrophobicContact CG2-CG 4.3Å; T549-Q553 PolarHBondContact O-N 3.48Å; T549-Q553 VanDerWaalsContact O-N 3.11Å
554	P	48.5	Very low	57.2	Low	111 Å²	111	92.3 Å²	92.3	72%	0.721	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-67.2	147.6	168.2	30.3	-33.7	0	0	0	109.6	G556	P554-G556 PolarHBondContact O-N 2.65Å
555	P	45.2	Very low	54.5	Low	125 Å²	125	97.9 Å²	97.9	81%	0.812	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-59.5	123.7	174.9	25.5	-33.5	0	0	0	109.7	N557	P555-N557 PolarHBondContact O-N 2.87Å
556	G	43.8	Very low	52	Low	69 Å²	69	103.1 Å²	103.1	71%	0.711	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-70	123.2	-178	0	0	0	0	0	111.5	P554 D558	P554-G556 PolarHBondContact O-N 2.65Å; G556-D558 PolarHBondContact O-N 2.72Å
557	N	39.1	Very low	49.6	Very low	147 Å²	147	105.6 Å²	105.6	79%	0.786	64%	0.636	S	S	*	*			trans	-79.8	110.9	165.7	-77	-13.8	0	0	0	108.9	P555 S559	P555-N557 PolarHBondContact O-N 2.87Å; N557-S559 VanDerWaalsContact C-N 3.25Å; N557-S559 PolarHBondContact O-N 3.16Å
558	D	37.7	Very low	47	Very low	175 Å²	175	106.6 Å²	106.6	94%	0.936	65%	0.652	S	S	*	*			trans	-71	77	171.4	-73.8	-42.1	0	0	0	111.3	G556	G556-D558 PolarHBondContact O-N 2.72Å
559	S	40.1	Very low	45.1	Very low	89 Å²	89	111.3 Å²	111.3	62%	0.622	69%	0.685	S	S	*	*			trans	-150.4	109.2	169.7	64	0	0	0	0	112.1	N557 T561	N557-S559 VanDerWaalsContact C-N 3.25Å; N557-S559 PolarHBondContact O-N 3.16Å; S559-T561 PolarHBondContact O-N 2.83Å
560	V	37.1	Very low	42.9	Very low	145 Å²	145	115.4 Å²	115.4	88%	0.879	70%	0.704	S	S	*	*			trans	-75.9	112.3	173.9	176.8	0	0	0	0	110.4
561	T	33.9	Very low	40.9	Very low	122 Å²	122	115.3 Å²	115.3	75%	0.748	71%	0.708	S	S	*	*			trans	-153.4	128.8	155	44.8	0	0	0	0	110.4	S559	S559-T561 PolarHBondContact O-N 2.83Å
562	D	32.7	Very low	39.3	Very low	155 Å²	155	119.5 Å²	119.5	83%	0.829	73%	0.734	S	S	*	*			trans	-65.8	131.2	173.7	-61.5	-77.9	0	0	0	112.3
563	S	32.1	Very low	38.1	Very low	102 Å²	102	127.2 Å²	127.2	71%	0.713	76%	0.764	S	S	*	*			trans	-160.7	88.1	163.9	-82.5	0	0	0	0	111	T565	S563-T565 PolarHBondContact O-N 3.28Å; S563-T565 PolarHBondContact O-OG1 2.74Å; S563-T565 VanDerWaalsContact O-OG1 3.11Å
564	S	31	Very low	37.5	Very low	128 Å²	128	125.2 Å²	125.2	90%	0.895	76%	0.757	S	S	*	*			trans	-62.8	97.1	177.6	56.1	0	0	0	0	111.4
565	T	30.7	Very low	38	Very low	116 Å²	116	122.9 Å²	122.9	71%	0.712	74%	0.743	S	S	*	*			trans	-117.5	123.3	-179.7	-39.6	0	0	0	0	109.6	S563 I567	S563-T565 PolarHBondContact O-N 3.28Å; S563-T565 PolarHBondContact O-OG1 2.74Å; S563-T565 VanDerWaalsContact O-OG1 3.11Å; T565-I567 PolarHBondContact O-N 3.27Å; T565-I567 VanDerWaalsContact O-N 3.15Å
566	I	33.6	Very low	38.6	Very low	168 Å²	168	120.5 Å²	120.5	86%	0.862	73%	0.726	S	S	*	*			trans	-77.8	102.6	-168.9	-58.8	169.6	0	0	0	110.2
567	I	35.3	Very low	39.7	Very low	151 Å²	151	118.7 Å²	118.7	77%	0.774	70%	0.702	S	S	*	*			trans	-81.7	119.9	170.5	-60.1	178.3	0	0	0	108.7	T565	T565-I567 PolarHBondContact O-N 3.27Å; T565-I567 VanDerWaalsContact O-N 3.15Å
568	G	31.2	Very low	41	Very low	43 Å²	43	114.4 Å²	114.4	44%	0.443	68%	0.679	S	S	.	*			trans	-70.9	162.3	-176.4	0	0	0	0	0	114.4	N570	G568-N570 PolarHBondContact O-N 2.75Å
569	P	43	Very low	42.6	Very low	133 Å²	133	109.2 Å²	109.2	86%	0.864	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-1.2	-163.6	-22.8	35.5	0	0	0	117.6	A571	P569-A571 PolarHBondContact O-N 2.86Å
570	N	33.8	Very low	44.1	Very low	150 Å²	150	105.6 Å²	105.6	80%	0.802	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	9.7	-169	-67.2	6.1	0	0	0	114.1	G568 T572	G568-N570 PolarHBondContact O-N 2.75Å; N570-T572 VanDerWaalsContact C-N 3.26Å; N570-T572 PolarHBondContact O-N 2.97Å
571	A	35.4	Very low	45.8	Very low	75 Å²	75	103.2 Å²	103.2	62%	0.62	60%	0.598	S	S	*	*			trans	-73.1	80.6	167.3	0	0	0	0	0	110	P569 K573	P569-A571 PolarHBondContact O-N 2.86Å; A571-K573 PolarHBondContact O-N 3.31Å
572	T	37.9	Very low	47.6	Very low	127 Å²	127	103.2 Å²	103.2	78%	0.779	59%	0.594	S	S	*	*			trans	-59.5	107.1	174.9	38.8	0	0	0	0	110.1	N570 L574	N570-T572 VanDerWaalsContact C-N 3.26Å; N570-T572 PolarHBondContact O-N 2.97Å; T572-L574 PolarHBondContact O-N 3.26Å
573	K	40.9	Very low	49.9	Very low	208 Å²	208	97 Å²	97	90%	0.904	56%	0.56	S	S	*	*			trans	-57.2	113.7	171	-74.5	-172.5	175.9	-176	0	108.4	A571	A571-K573 PolarHBondContact O-N 3.31Å
574	L	44.8	Very low	52.3	Low	91 Å²	91	95.9 Å²	95.9	48%	0.476	55%	0.55	S	S	.	*			trans	-57.6	143.1	177.5	-146.5	79.1	0	0	0	109.3	T572 D578 Q579	T572-L574 PolarHBondContact O-N 3.26Å; L574-D578 HydrophobicContact CD2-CB 3.7Å; L574-D578 HydrophobicContact CG-CB 3.77Å; L574-Q579 HydrophobicContact CB-CG 4.16Å; L574-Q579 HydrophobicContact CD2-CG 4.24Å
575	S	57.7	Low	54.8	Low	62 Å²	62	91 Å²	91	43%	0.434	52%	0.516	S	S	.	.			trans	-61.6	147.6	179.9	-173.4	0	0	0	0	110.6	S577 D578 Q579	S575-S577 PolarHBondContact O-N 3.06Å; S575-D578 VanDerWaalsContact CB-OD2 3.26Å; S575-D578 WeakPolarHBondContact CB-OD2 3.4Å; S575-D578 WeakPolarHBondContact O-CA 3.1Å; S575-D578 WeakPolarHBondContact O-CB 3.29Å; S575-D578 PolarHBondContact O-N 3.42Å; S575-Q579 PolarHBondContact O-N 3.05Å
576	T	59.4	Low	57.3	Low	75 Å²	75	92.8 Å²	92.8	46%	0.46	52%	0.516	S	S	.	.	H	α-helix	trans	-58.8	-31.7	176.5	53.9	0	0	0	0	111.8	I548 T552 L580	I548-T576 HydrophobicContact CG2-CG2 4.39Å; T552-T576 HydrophobicContact CG2-CG2 4.43Å; T576-L580 WeakPolarHBondContact O-CG 3.46Å; T576-L580 PolarHBondContact O-N 3.36Å
577	S	65.4	Low	59.8	Low	30 Å²	30	88.8 Å²	88.8	21%	0.21	50%	0.497	C	S	.	.	H	α-helix	trans	-66.2	-36.3	171.7	-166.1	0	0	0	0	112.2	S575 L580 R581	S575-S577 PolarHBondContact O-N 3.06Å; S577-L580 PolarHBondContact O-N 2.71Å; S577-R581 WeakPolarHBondContact O-CB 3.36Å; S577-R581 WeakPolarHBondContact O-CD 3.47Å; S577-R581 WeakPolarHBondContact O-CG 3.28Å; S577-R581 PolarHBondContact O-N 2.69Å; S577-R581 PolarHBondContact O-NE 3.01Å; S577-R581 PolarHBondContact OG-NE 3.41Å; S577-R581 VanDerWaalsContact OG-NE 3.09Å; S577-R581 PolarHBondContact OG-NH2 2.81Å
578	D	68	Low	62.3	Low	57 Å²	57	81.6 Å²	81.6	31%	0.305	46%	0.46	S	S	.	.	H	α-helix	trans	-75	-34.3	178.9	-62	-41.3	0	0	0	112.2	L574 S575 R581 N582	L574-D578 HydrophobicContact CD2-CB 3.7Å; L574-D578 HydrophobicContact CG-CB 3.77Å; S575-D578 VanDerWaalsContact CB-OD2 3.26Å; S575-D578 WeakPolarHBondContact CB-OD2 3.4Å; S575-D578 WeakPolarHBondContact O-CA 3.1Å; S575-D578 WeakPolarHBondContact O-CB 3.29Å; S575-D578 PolarHBondContact O-N 3.42Å; D578-R581 PolarHBondContact O-N 2.92Å; D578-R581 IonicContact OD1-CZ 3.63Å; D578-R581 IonicContact OD1-NE 3.62Å; D578-R581 IonicContact OD1-NH1 3.28Å; D578-R581 PolarHBondContact OD1-NH1 3.2Å; D578-N582 WeakPolarHBondContact O-CB 3.24Å; D578-N582 PolarHBondContact O-N 2.69Å; D578-N582 PolarHBondContact O-ND2 3.39Å
579	Q	69.8	Low	65	Low	67 Å²	67	80.5 Å²	80.5	31%	0.313	44%	0.444	S	S	.	.	H	α-helix	trans	-63	-46	170.8	-66.1	178.7	-63.7	0	0	111	L574 S575 R581 N582 M583	L574-Q579 HydrophobicContact CB-CG 4.16Å; L574-Q579 HydrophobicContact CD2-CG 4.24Å; S575-Q579 PolarHBondContact O-N 3.05Å; Q579-R581 VanDerWaalsContact C-N 3.34Å; Q579-R581 PolarHBondContact O-N 2.98Å; Q579-N582 PolarHBondContact O-N 2.64Å; Q579-M583 PolarHBondContact O-N 3.27Å; Q579-M583 VanDerWaalsContact O-N 3.14Å
580	L	72	Confident	67.2	Low	12 Å²	12	78 Å²	78	6%	0.063	43%	0.426	C	S	.	.	H	α-helix	trans	-64.4	-33.7	174.4	-71.5	169.4	0	0	0	113.2	V551 T576 S577 M583 F591	V551-L580 HydrophobicContact CG1-CD2 4.22Å; T576-L580 WeakPolarHBondContact O-CG 3.46Å; T576-L580 PolarHBondContact O-N 3.36Å; S577-L580 PolarHBondContact O-N 2.71Å; L580-M583 HydrophobicContact CD2-SD 4.45Å; L580-M583 WeakPolarHBondContact O-CB 3.31Å; L580-F591 HydrophobicContact CD2-CD1 4.45Å; L580-F591 HydrophobicContact CD2-CE1 3.86Å; L580-F591 HydrophobicContact CD2-CE2 4.17Å; L580-F591 HydrophobicContact CD2-CZ 3.7Å
581	R	72.7	Confident	69.9	Low	95 Å²	95	71.3 Å²	71.3	36%	0.358	39%	0.389	S	S	.	.	H	α-helix	trans	-67.2	-39.5	174.3	-74.7	163.2	-155.4	-161.3	-3.3	112.8	S577 D578 Q579 M583 S676 R677	S577-R581 WeakPolarHBondContact O-CB 3.36Å; S577-R581 WeakPolarHBondContact O-CD 3.47Å; S577-R581 WeakPolarHBondContact O-CG 3.28Å; S577-R581 PolarHBondContact O-N 2.69Å; S577-R581 PolarHBondContact O-NE 3.01Å; S577-R581 PolarHBondContact OG-NE 3.41Å; S577-R581 VanDerWaalsContact OG-NE 3.09Å; S577-R581 PolarHBondContact OG-NH2 2.81Å; D578-R581 PolarHBondContact O-N 2.92Å; D578-R581 IonicContact OD1-CZ 3.63Å; D578-R581 IonicContact OD1-NE 3.62Å; D578-R581 IonicContact OD1-NH1 3.28Å; D578-R581 PolarHBondContact OD1-NH1 3.2Å; Q579-R581 VanDerWaalsContact C-N 3.34Å; Q579-R581 PolarHBondContact O-N 2.98Å; R581-M583 VanDerWaalsContact C-N 3.33Å; R581-S676 WeakPolarHBondContact CG-O 3.21Å; R581-R677 VanDerWaalsContact O-CZ 3.25Å; R581-R677 PolarHBondContact O-NE 3.37Å; R581-R677 PolarHBondContact O-NH2 3.5Å
582	N	72.4	Confident	72.5	Confident	122 Å²	122	67.9 Å²	67.9	65%	0.652	36%	0.361	S	S	*	.	H	α-helix	trans	-85.8	-5.4	-176.1	-66.6	-23.1	0	0	0	113.4	D578 Q579	D578-N582 WeakPolarHBondContact O-CB 3.24Å; D578-N582 PolarHBondContact O-N 2.69Å; D578-N582 PolarHBondContact O-ND2 3.39Å; Q579-N582 PolarHBondContact O-N 2.64Å
583	M	80.1	Confident	75.1	Confident	25 Å²	25	64.2 Å²	64.2	12%	0.123	34%	0.338	C	S	.	.	S	Bend	trans	-60.4	135.4	177.6	-163.1	173.2	-166.7	0	0	111.9	V551 Q579 L580 R581 N587 W588 F591 R677	V551-M583 HydrophobicContact CB-CE 4.38Å; V551-M583 HydrophobicContact CG1-CE 3.82Å; V551-M583 HydrophobicContact CG1-SD 3.87Å; V551-M583 HydrophobicContact CG2-CE 3.59Å; V551-M583 HydrophobicContact CG2-SD 4.36Å; Q579-M583 PolarHBondContact O-N 3.27Å; Q579-M583 VanDerWaalsContact O-N 3.14Å; L580-M583 HydrophobicContact CD2-SD 4.45Å; L580-M583 WeakPolarHBondContact O-CB 3.31Å; R581-M583 VanDerWaalsContact C-N 3.33Å; M583-N587 HydrophobicContact CE-CB 3.89Å; M583-N587 WeakPolarHBondContact CE-O 3.35Å; M583-N587 HydrophobicContact CG-CB 4.22Å; M583-W588 HydrophobicContact CB-CB 4.19Å; M583-W588 HydrophobicContact CG-CB 4.02Å; M583-W588 HydrophobicContact SD-CB 3.96Å; M583-W588 HydrophobicContact SD-CG 4.42Å; M583-F591 HydrophobicContact CE-CB 3.98Å; M583-F591 HydrophobicContact SD-CB 4.43Å; M583-R677 PolarHBondContact O-NH2 2.94Å; M583-R677 VanDerWaalsContact O-NH2 3.13Å
584	P	82.5	Confident	77.4	Confident	78 Å²	78	58.1 Å²	58.1	51%	0.506	32%	0.316	S	S	.	.			trans	-54.6	147	172.9	-26.3	35	0	0	0	112	E586 N587 W588	P584-E586 PolarHBondContact O-N 3.46Å; P584-N587 HydrophobicContact CB-CB 4.42Å; P584-N587 PolarHBondContact O-N 3.34Å; P584-W588 WeakPolarHBondContact O-CB 3.2Å; P584-W588 PolarHBondContact O-N 2.85Å
585	C	83.7	Confident	79.6	Confident	27 Å²	27	53.8 Å²	53.8	18%	0.182	29%	0.293	C	S	.	.	H	α-helix	trans	-59.4	-44.4	-170.8	-170.9	0	0	0	0	113.1	W588 M589 F726 N730	C585-W588 PolarHBondContact O-N 3.14Å; C585-M589 WeakPolarHBondContact O-CB 3.45Å; C585-M589 WeakPolarHBondContact O-CG 3.39Å; C585-M589 PolarHBondContact O-N 2.94Å; C585-F726 WeakPolarHBondContact SG-CE2 3.43Å; C585-N730 PolarHBondContact SG-ND2 3.35Å
586	E	83.7	Confident	81.2	Confident	152 Å²	152	51.5 Å²	51.5	71%	0.71	28%	0.277	S	S	*	.	H	α-helix	trans	-65.9	-49.3	-178.7	-63.2	177.6	163.4	0	0	110.8	P584 W588 M589 T590	P584-E586 PolarHBondContact O-N 3.46Å; E586-W588 VanDerWaalsContact C-N 3.29Å; E586-W588 PolarHBondContact O-N 3.28Å; E586-M589 WeakPolarHBondContact O-CB 3.21Å; E586-M589 PolarHBondContact O-N 2.82Å; E586-M589 VanDerWaalsContact O-N 3.12Å; E586-T590 PolarHBondContact O-N 3.19Å; E586-T590 PolarHBondContact O-OG1 3.32Å
587	N	86	Confident	82.7	Confident	84 Å²	84	50.5 Å²	50.5	45%	0.449	27%	0.268	S	S	.	.	H	α-helix	trans	-59.9	-38.2	176.8	-54.9	28.1	0	0	0	112	M583 P584 T590 F591	M583-N587 HydrophobicContact CE-CB 3.89Å; M583-N587 WeakPolarHBondContact CE-O 3.35Å; M583-N587 HydrophobicContact CG-CB 4.22Å; P584-N587 HydrophobicContact CB-CB 4.42Å; P584-N587 PolarHBondContact O-N 3.34Å; N587-T590 WeakPolarHBondContact CA-OG1 3.2Å; N587-T590 PolarHBondContact O-OG1 2.97Å; N587-F591 WeakPolarHBondContact O-CB 3.36Å; N587-F591 PolarHBondContact O-N 3.02Å
588	W	88.5	Confident	83.8	Confident	1 Å²	1	51.5 Å²	51.5	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-69	-36.6	176.9	-176.1	78.7	0	0	0	112.2	M583 P584 C585 E586 L592 V674 R677 F678 F726 L734	M583-W588 HydrophobicContact CB-CB 4.19Å; M583-W588 HydrophobicContact CG-CB 4.02Å; M583-W588 HydrophobicContact SD-CB 3.96Å; M583-W588 HydrophobicContact SD-CG 4.42Å; P584-W588 WeakPolarHBondContact O-CB 3.2Å; P584-W588 PolarHBondContact O-N 2.85Å; C585-W588 PolarHBondContact O-N 3.14Å; E586-W588 VanDerWaalsContact C-N 3.29Å; E586-W588 PolarHBondContact O-N 3.28Å; W588-L592 HydrophobicContact CD2-CD1 4.25Å; W588-L592 HydrophobicContact CE3-CD1 4.07Å; W588-L592 HydrophobicContact CH2-CD1 3.4Å; W588-L592 VanDerWaalsContact CH2-CD1 3.4Å; W588-L592 HydrophobicContact CZ2-CD1 3.58Å; W588-L592 HydrophobicContact CZ2-CG 4.31Å; W588-L592 HydrophobicContact CZ3-CD1 3.66Å; W588-L592 PolarHBondContact O-N 3.22Å; W588-V674 HydrophobicContact CH2-CG1 4.46Å; W588-V674 HydrophobicContact CH2-CG2 4.29Å; W588-V674 HydrophobicContact CZ2-CG2 4.38Å; W588-R677 HydrophobicContact CD2-CG 4.11Å; W588-R677 HydrophobicContact CE3-CG 4.44Å; W588-R677 HydrophobicContact CH2-CB 4.07Å; W588-R677 HydrophobicContact CH2-CG 3.92Å; W588-R677 HydrophobicContact CZ2-CB 3.47Å; W588-R677 VanDerWaalsContact CZ2-CB 3.47Å; W588-R677 HydrophobicContact CZ2-CG 3.53Å; W588-R677 HydrophobicContact CZ3-CG 4.36Å; W588-F678 AromaticContact CH2-CE2 3.9Å; W588-F678 HydrophobicContact CH2-CE2 3.9Å; W588-F678 HydrophobicContact CZ3-CE2 4.27Å; W588-F726 HydrophobicContact CZ3-CE2 4.35Å; W588-F726 HydrophobicContact CZ3-CZ 4.18Å; W588-L734 HydrophobicContact CH2-CD1 4.05Å; W588-L734 HydrophobicContact CH2-CD2 4.34Å; W588-L734 HydrophobicContact CZ3-CD1 3.99Å; W588-L734 HydrophobicContact CZ3-CD2 4.26Å
589	M	88.2	Confident	85	Confident	20 Å²	20	48.8 Å²	48.8	10%	0.099	26%	0.257	C	S	.	.	H	α-helix	trans	-68.3	-43.1	174.1	-70.2	-71.2	-74.6	0	0	111.6	C585 E586 L592 V593 F726 E733 L734 I737	C585-M589 WeakPolarHBondContact O-CB 3.45Å; C585-M589 WeakPolarHBondContact O-CG 3.39Å; C585-M589 PolarHBondContact O-N 2.94Å; E586-M589 WeakPolarHBondContact O-CB 3.21Å; E586-M589 PolarHBondContact O-N 2.82Å; E586-M589 VanDerWaalsContact O-N 3.12Å; M589-L592 PolarHBondContact O-N 3.44Å; M589-V593 WeakPolarHBondContact O-CG2 3.42Å; M589-V593 PolarHBondContact O-N 2.93Å; M589-F726 HydrophobicContact SD-CZ 4.19Å; M589-E733 HydrophobicContact CE-CB 3.85Å; M589-E733 HydrophobicContact CE-CG 3.84Å; M589-L734 HydrophobicContact CE-CB 4.07Å; M589-L734 HydrophobicContact SD-CB 4.12Å; M589-L734 HydrophobicContact SD-CD1 4.24Å; M589-I737 HydrophobicContact CE-CD1 3.62Å; M589-I737 HydrophobicContact SD-CD1 4.46Å
590	T	88.2	Confident	85.9	Confident	80 Å²	80	47.7 Å²	47.7	49%	0.491	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-38.6	175.7	56.6	0	0	0	0	112.1	E586 N587 L592 V593 N594	E586-T590 PolarHBondContact O-N 3.19Å; E586-T590 PolarHBondContact O-OG1 3.32Å; N587-T590 WeakPolarHBondContact CA-OG1 3.2Å; N587-T590 PolarHBondContact O-OG1 2.97Å; T590-L592 PolarHBondContact O-N 2.93Å; T590-V593 PolarHBondContact O-N 3.42Å; T590-N594 WeakPolarHBondContact O-CB 3.36Å; T590-N594 PolarHBondContact O-N 2.9Å; T590-N594 PolarHBondContact O-OD1 3.35Å
591	F	90.3	Very high	86.7	Confident	9 Å²	9	52.8 Å²	52.8	4%	0.039	27%	0.27	C	S	.	.	H	α-helix	trans	-55.6	-47.6	169.5	160.9	-93	0	0	0	112.1	H547 V551 L580 M583 N587 L595 I673	H547-F591 HydrophobicContact CB-CD2 4.24Å; H547-F591 HydrophobicContact CB-CE2 3.83Å; V551-F591 HydrophobicContact CG2-CD2 3.58Å; V551-F591 HydrophobicContact CG2-CE2 4.03Å; V551-F591 HydrophobicContact CG2-CG 4.35Å; L580-F591 HydrophobicContact CD2-CD1 4.45Å; L580-F591 HydrophobicContact CD2-CE1 3.86Å; L580-F591 HydrophobicContact CD2-CE2 4.17Å; L580-F591 HydrophobicContact CD2-CZ 3.7Å; M583-F591 HydrophobicContact CE-CB 3.98Å; M583-F591 HydrophobicContact SD-CB 4.43Å; N587-F591 WeakPolarHBondContact O-CB 3.36Å; N587-F591 PolarHBondContact O-N 3.02Å; F591-L595 HydrophobicContact CE1-CD2 4.23Å; F591-L595 HydrophobicContact CZ-CD2 4.02Å; F591-L595 WeakPolarHBondContact O-CB 3.48Å; F591-L595 PolarHBondContact O-N 2.87Å; F591-I673 HydrophobicContact CE1-CG2 4.14Å; F591-I673 HydrophobicContact CZ-CD1 4.48Å
592	L	90.8	Very high	87.6	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-65.8	-40.7	176.7	-78.9	-176.6	0	0	0	113.1	W588 M589 T590 C596 L670 I673 V674 L734	W588-L592 HydrophobicContact CD2-CD1 4.25Å; W588-L592 HydrophobicContact CE3-CD1 4.07Å; W588-L592 HydrophobicContact CH2-CD1 3.4Å; W588-L592 VanDerWaalsContact CH2-CD1 3.4Å; W588-L592 HydrophobicContact CZ2-CD1 3.58Å; W588-L592 HydrophobicContact CZ2-CG 4.31Å; W588-L592 HydrophobicContact CZ3-CD1 3.66Å; W588-L592 PolarHBondContact O-N 3.22Å; M589-L592 PolarHBondContact O-N 3.44Å; T590-L592 PolarHBondContact O-N 2.93Å; L592-C596 VanDerWaalsContact O-CB 3.23Å; L592-C596 WeakPolarHBondContact O-CB 3.48Å; L592-C596 PolarHBondContact O-N 3.08Å; L592-C596 PolarHBondContact O-SG 3.18Å; L592-L670 HydrophobicContact CD2-CD2 4.39Å; L592-I673 HydrophobicContact CD2-CG2 4.12Å; L592-V674 HydrophobicContact CD1-CG2 4.1Å; L592-L734 HydrophobicContact CD1-CD1 3.81Å
593	V	91.1	Very high	88.4	Confident	49 Å²	49	43.2 Å²	43.2	30%	0.297	23%	0.226	S	C	.	.	H	α-helix	trans	-59.9	-49.3	176.8	169.2	0	0	0	0	110.6	M589 T590 C596 N597 I737	M589-V593 WeakPolarHBondContact O-CG2 3.42Å; M589-V593 PolarHBondContact O-N 2.93Å; T590-V593 PolarHBondContact O-N 3.42Å; V593-C596 PolarHBondContact O-N 3.39Å; V593-N597 WeakPolarHBondContact O-CB 3.3Å; V593-N597 VanDerWaalsContact O-CG 3.27Å; V593-N597 PolarHBondContact O-N 3Å; V593-N597 PolarHBondContact O-ND2 2.93Å; V593-I737 HydrophobicContact CG2-CD1 3.48Å; V593-I737 VanDerWaalsContact CG2-CD1 3.48Å; V593-I737 HydrophobicContact CG2-CG1 3.92Å
594	N	90	Very high	88.8	Confident	81 Å²	81	44.9 Å²	44.9	43%	0.433	24%	0.235	S	C	.	.	H	α-helix	trans	-66	-46.1	-177.9	-63.5	-7.4	0	0	0	111.2	T590 C596 N597 D598	T590-N594 WeakPolarHBondContact O-CB 3.36Å; T590-N594 PolarHBondContact O-N 2.9Å; T590-N594 PolarHBondContact O-OD1 3.35Å; N594-C596 PolarHBondContact O-N 3.17Å; N594-N597 PolarHBondContact O-N 2.94Å; N594-N597 VanDerWaalsContact O-N 3.16Å; N594-D598 PolarHBondContact O-N 2.97Å
595	L	91.1	Very high	89	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-43.6	176.1	179.4	61	0	0	0	112.4	I543 F544 H547 F591 I599 L670 I673	I543-L595 HydrophobicContact CG2-CD1 4.01Å; F544-L595 HydrophobicContact CD1-CD1 3.94Å; F544-L595 HydrophobicContact CD1-CD2 4.02Å; F544-L595 HydrophobicContact CE1-CD1 4.12Å; F544-L595 HydrophobicContact CE1-CD2 3.78Å; F544-L595 HydrophobicContact CE1-CG 4.29Å; F544-L595 HydrophobicContact CG-CD1 4.17Å; F544-L595 HydrophobicContact CZ-CD1 4.5Å; H547-L595 HydrophobicContact CB-CD1 4.17Å; F591-L595 HydrophobicContact CE1-CD2 4.23Å; F591-L595 HydrophobicContact CZ-CD2 4.02Å; F591-L595 WeakPolarHBondContact O-CB 3.48Å; F591-L595 PolarHBondContact O-N 2.87Å; L595-I599 HydrophobicContact CD1-CD1 3.85Å; L595-I599 HydrophobicContact CG-CD1 4.1Å; L595-I599 WeakPolarHBondContact O-CD1 3.47Å; L595-I599 VanDerWaalsContact O-CG1 3.22Å; L595-I599 WeakPolarHBondContact O-CG1 3.32Å; L595-I599 PolarHBondContact O-N 2.69Å; L595-L670 HydrophobicContact CD2-CD2 3.75Å; L595-L670 HydrophobicContact CG-CD2 4.02Å; L595-I673 HydrophobicContact CD2-CD1 4.01Å
596	C	92.1	Very high	89.4	Confident	14 Å²	14	41.4 Å²	41.4	10%	0.095	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-37.3	175.2	-76.4	0	0	0	0	112.4	L592 V593 N594 K600 I737 F741	L592-C596 VanDerWaalsContact O-CB 3.23Å; L592-C596 WeakPolarHBondContact O-CB 3.48Å; L592-C596 PolarHBondContact O-N 3.08Å; L592-C596 PolarHBondContact O-SG 3.18Å; V593-C596 PolarHBondContact O-N 3.39Å; N594-C596 PolarHBondContact O-N 3.17Å; C596-K600 VanDerWaalsContact O-CB 3.24Å; C596-K600 WeakPolarHBondContact O-CB 3.34Å; C596-K600 PolarHBondContact O-N 2.88Å; C596-I737 HydrophobicContact CB-CG2 4.47Å; C596-F741 HydrophobicContact CB-CD2 4.07Å
597	N	89.5	Confident	89.6	Confident	53 Å²	53	35.5 Å²	35.5	28%	0.283	18%	0.18	S	C	.	.	H	α-helix	trans	-67.3	-46.1	178	-80	-28.8	0	0	0	112.1	V593 N594 I599 K600 Y601	V593-N597 WeakPolarHBondContact O-CB 3.3Å; V593-N597 VanDerWaalsContact O-CG 3.27Å; V593-N597 PolarHBondContact O-N 3Å; V593-N597 PolarHBondContact O-ND2 2.93Å; N594-N597 PolarHBondContact O-N 2.94Å; N594-N597 VanDerWaalsContact O-N 3.16Å; N597-I599 PolarHBondContact O-N 3.03Å; N597-K600 CarbonylContact O-C 3.46Å; N597-K600 WeakPolarHBondContact O-CA 3.44Å; N597-K600 VanDerWaalsContact O-CB 3.29Å; N597-K600 WeakPolarHBondContact O-CB 3.39Å; N597-K600 PolarHBondContact O-N 2.71Å; N597-K600 VanDerWaalsContact O-N 3.14Å; N597-Y601 HydrophobicContact CB-CE2 4.29Å; N597-Y601 WeakPolarHBondContact O-CD2 3.45Å; N597-Y601 PolarHBondContact O-N 2.75Å
598	D	89.9	Confident	89.7	Confident	52 Å²	52	34.7 Å²	34.7	28%	0.278	18%	0.176	S	C	.	.	H	α-helix	trans	-65.6	-40.4	-178.8	-68.3	-7.2	0	0	0	111.7	I543 H547 N594 K600 Y601 L602	I543-D598 HydrophobicContact CD1-CB 4.42Å; I543-D598 HydrophobicContact CG2-CB 3.79Å; H547-D598 IonicContact CD2-OD2 3.66Å; H547-D598 IonicContact CE1-OD2 3.51Å; H547-D598 IonicContact NE2-OD2 3.55Å; H547-D598 PolarHBondContact NE2-OD2 3.05Å; N594-D598 PolarHBondContact O-N 2.97Å; D598-K600 VanDerWaalsContact C-N 3.34Å; D598-Y601 PolarHBondContact O-N 3.38Å; D598-L602 PolarHBondContact O-N 3.13Å
599	I	91.8	Very high	89.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.8	-37.2	173.8	-61.4	166.2	0	0	0	110.7	I543 F544 L595 N597 L602 L603 F741	I543-I599 HydrophobicContact CG2-CG1 4.05Å; F544-I599 HydrophobicContact CD2-CD1 4.14Å; F544-I599 HydrophobicContact CE2-CD1 3.42Å; F544-I599 VanDerWaalsContact CE2-CD1 3.42Å; F544-I599 HydrophobicContact CE2-CG1 4.47Å; F544-I599 HydrophobicContact CZ-CD1 3.64Å; L595-I599 HydrophobicContact CD1-CD1 3.85Å; L595-I599 HydrophobicContact CG-CD1 4.1Å; L595-I599 WeakPolarHBondContact O-CD1 3.47Å; L595-I599 VanDerWaalsContact O-CG1 3.22Å; L595-I599 WeakPolarHBondContact O-CG1 3.32Å; L595-I599 PolarHBondContact O-N 2.69Å; N597-I599 PolarHBondContact O-N 3.03Å; I599-L602 PolarHBondContact O-N 3.38Å; I599-L603 HydrophobicContact CG2-CD1 4.36Å; I599-L603 WeakPolarHBondContact O-CG 3.5Å; I599-L603 PolarHBondContact O-N 3.05Å; I599-F741 HydrophobicContact CB-CE2 3.9Å; I599-F741 HydrophobicContact CB-CZ 4.42Å; I599-F741 HydrophobicContact CG2-CE2 3.57Å; I599-F741 HydrophobicContact CG2-CZ 3.64Å
600	K	89.4	Confident	89.7	Confident	44 Å²	44	33.7 Å²	33.7	19%	0.191	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-46.7	170.9	152.5	-170.7	167.4	176	0	111.3	C596 N597 D598 L602 L603 I604 Y744	C596-K600 VanDerWaalsContact O-CB 3.24Å; C596-K600 WeakPolarHBondContact O-CB 3.34Å; C596-K600 PolarHBondContact O-N 2.88Å; N597-K600 CarbonylContact O-C 3.46Å; N597-K600 WeakPolarHBondContact O-CA 3.44Å; N597-K600 VanDerWaalsContact O-CB 3.29Å; N597-K600 WeakPolarHBondContact O-CB 3.39Å; N597-K600 PolarHBondContact O-N 2.71Å; N597-K600 VanDerWaalsContact O-N 3.14Å; D598-K600 VanDerWaalsContact C-N 3.34Å; K600-L602 VanDerWaalsContact C-N 3.34Å; K600-L603 PolarHBondContact O-N 3.08Å; K600-I604 HydrophobicContact CG-CD1 3.78Å; K600-I604 VanDerWaalsContact O-CG1 3.31Å; K600-I604 WeakPolarHBondContact O-CG1 3.46Å; K600-I604 PolarHBondContact O-N 3.24Å; K600-Y744 HydrophobicContact CB-CD2 4.42Å; K600-Y744 HydrophobicContact CB-CE2 4.47Å; K600-Y744 HydrophobicContact CD-CD2 4.41Å; K600-Y744 HydrophobicContact CD-CE1 4.36Å; K600-Y744 HydrophobicContact CD-CE2 3.66Å; K600-Y744 WeakPolarHBondContact CE-OH 3.47Å; K600-Y744 HydrophobicContact CG-CD1 4.43Å; K600-Y744 HydrophobicContact CG-CD2 4.32Å; K600-Y744 HydrophobicContact CG-CE1 4.09Å; K600-Y744 HydrophobicContact CG-CE2 3.97Å; K600-Y744 PolarHBondContact NZ-OH 3.29Å
601	Y	89.2	Confident	89.6	Confident	118 Å²	118	32 Å²	32	46%	0.463	16%	0.159	S	C	.	.	H	α-helix	trans	-65.4	-37.9	179.1	-71.5	-57.6	0	0	0	112	N597 D598 I604 R605	N597-Y601 HydrophobicContact CB-CE2 4.29Å; N597-Y601 WeakPolarHBondContact O-CD2 3.45Å; N597-Y601 PolarHBondContact O-N 2.75Å; D598-Y601 PolarHBondContact O-N 3.38Å; Y601-I604 HydrophobicContact CD1-CD1 4.45Å; Y601-I604 PolarHBondContact O-N 3.04Å; Y601-R605 PolarHBondContact O-N 3.18Å
602	L	90.8	Very high	89.3	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-43.6	171.1	177.1	61.7	0	0	0	112	L498 M536 R539 V540 I543 D598 I599 K600 G606	L498-L602 HydrophobicContact CB-CD1 4.14Å; L498-L602 HydrophobicContact CD2-CD1 4.08Å; L498-L602 HydrophobicContact CG-CD1 4.49Å; M536-L602 HydrophobicContact CE-CD1 3.97Å; M536-L602 HydrophobicContact CE-CG 3.84Å; M536-L602 HydrophobicContact SD-CD1 3.98Å; M536-L602 HydrophobicContact SD-CG 4.5Å; R539-L602 HydrophobicContact CB-CD1 3.97Å; R539-L602 HydrophobicContact CB-CD2 3.86Å; R539-L602 HydrophobicContact CG-CD1 4.02Å; R539-L602 HydrophobicContact CG-CD2 4.34Å; V540-L602 HydrophobicContact CG2-CD2 3.61Å; I543-L602 HydrophobicContact CD1-CB 4.17Å; I543-L602 HydrophobicContact CD1-CD2 3.83Å; D598-L602 PolarHBondContact O-N 3.13Å; I599-L602 PolarHBondContact O-N 3.38Å; K600-L602 VanDerWaalsContact C-N 3.34Å; L602-G606 PolarHBondContact O-N 3.27Å
603	L	90.3	Very high	89	Confident	13 Å²	13	33.7 Å²	33.7	7%	0.068	17%	0.168	C	C	.	.	H	α-helix	trans	-67.5	-35.4	176.9	-71.6	173.9	0	0	0	112.7	I599 K600 Q607 T662 A663 F741	I599-L603 HydrophobicContact CG2-CD1 4.36Å; I599-L603 WeakPolarHBondContact O-CG 3.5Å; I599-L603 PolarHBondContact O-N 3.05Å; K600-L603 PolarHBondContact O-N 3.08Å; L603-Q607 WeakPolarHBondContact O-CB 3.22Å; L603-Q607 PolarHBondContact O-N 3.32Å; L603-T662 HydrophobicContact CD2-CG2 4.28Å; L603-A663 HydrophobicContact CD1-CB 3.88Å; L603-A663 HydrophobicContact CD2-CB 4.01Å; L603-F741 HydrophobicContact CD1-CZ 4.39Å
604	I	88.2	Confident	88.7	Confident	60 Å²	60	33.9 Å²	33.9	31%	0.308	17%	0.166	S	C	.	.	H	α-helix	trans	-64.4	-51.4	174.5	-70	164.4	0	0	0	110.1	K600 Y601 G606 Q607 D608 Y744	K600-I604 HydrophobicContact CG-CD1 3.78Å; K600-I604 VanDerWaalsContact O-CG1 3.31Å; K600-I604 WeakPolarHBondContact O-CG1 3.46Å; K600-I604 PolarHBondContact O-N 3.24Å; Y601-I604 HydrophobicContact CD1-CD1 4.45Å; Y601-I604 PolarHBondContact O-N 3.04Å; I604-G606 PolarHBondContact O-N 2.96Å; I604-Q607 CarbonylContact O-C 3.6Å; I604-Q607 VanDerWaalsContact O-CA 3.32Å; I604-Q607 WeakPolarHBondContact O-CA 3.39Å; I604-Q607 WeakPolarHBondContact O-CB 3.33Å; I604-Q607 PolarHBondContact O-N 3.32Å; I604-D608 VanDerWaalsContact O-CG 3.29Å; I604-D608 PolarHBondContact O-N 2.94Å; I604-Y744 HydrophobicContact CD1-CE1 4.3Å; I604-Y744 HydrophobicContact CG1-CE1 4.5Å
605	R	86.9	Confident	88.2	Confident	31 Å²	31	35.1 Å²	35.1	12%	0.117	17%	0.172	C	C	.	.	H	α-helix	trans	-67.1	-36.9	178.8	-76	155.4	148.6	-159.1	-16.9	113.6	F497 L498 D499 P500 Y601 Q607 D608 V609	F497-R605 HydrophobicContact CD1-CB 4.37Å; F497-R605 HydrophobicContact CE1-CB 4.19Å; F497-R605 HydrophobicContact CE1-CG 4.44Å; L498-R605 HydrophobicContact CD2-CB 4.22Å; L498-R605 PolarHBondContact O-NH1 3.35Å; D499-R605 PolarHBondContact O-NH1 2.99Å; D499-R605 PolarHBondContact O-NH2 2.99Å; P500-R605 VanDerWaalsContact CA-NH1 3.32Å; Y601-R605 PolarHBondContact O-N 3.18Å; R605-Q607 PolarHBondContact O-N 3.01Å; R605-D608 WeakPolarHBondContact CA-OD2 3.36Å; R605-D608 PolarHBondContact O-N 3.12Å; R605-D608 VanDerWaalsContact O-N 3.15Å; R605-V609 WeakPolarHBondContact O-CG2 3.37Å; R605-V609 PolarHBondContact O-N 3.34Å
606	G	90.6	Very high	87.5	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.1	-39.6	168.4	0	0	0	0	0	111.1	L602 I604 V610	L602-G606 PolarHBondContact O-N 3.27Å; I604-G606 PolarHBondContact O-N 2.96Å; G606-V610 WeakPolarHBondContact O-CG2 3.33Å; G606-V610 PolarHBondContact O-N 3.4Å
607	Q	89	Confident	86.6	Confident	28 Å²	28	39.3 Å²	39.3	13%	0.131	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-43.6	172.9	-166.6	65.5	75	0	0	112.5	L603 I604 R605 V609 V610 D611 H656 L659 K751	L603-Q607 WeakPolarHBondContact O-CB 3.22Å; L603-Q607 PolarHBondContact O-N 3.32Å; I604-Q607 CarbonylContact O-C 3.6Å; I604-Q607 VanDerWaalsContact O-CA 3.32Å; I604-Q607 WeakPolarHBondContact O-CA 3.39Å; I604-Q607 WeakPolarHBondContact O-CB 3.33Å; I604-Q607 PolarHBondContact O-N 3.32Å; R605-Q607 PolarHBondContact O-N 3.01Å; Q607-V609 VanDerWaalsContact C-N 3.25Å; Q607-V609 PolarHBondContact O-N 2.94Å; Q607-V610 PolarHBondContact O-N 3.21Å; Q607-D611 PolarHBondContact NE2-OD1 3.14Å; Q607-D611 PolarHBondContact O-N 3.31Å; Q607-H656 PolarHBondContact NE2-CE1 3.45Å; Q607-H656 VanDerWaalsContact NE2-CE1 3.28Å; Q607-H656 PolarHBondContact NE2-ND1 3.4Å; Q607-L659 HydrophobicContact CB-CD1 4.1Å; Q607-L659 HydrophobicContact CG-CD1 4.47Å; Q607-L659 VanDerWaalsContact OE1-CD1 3.28Å; Q607-K751 VanDerWaalsContact CD-CD 3.4Å; Q607-K751 HydrophobicContact CG-CD 4.3Å
608	D	87.4	Confident	85.5	Confident	67 Å²	67	37.6 Å²	37.6	36%	0.358	19%	0.186	S	C	.	.	H	α-helix	trans	-58.1	-38.1	177.7	-58.3	-37.7	0	0	0	111.3	F497 I604 R605 V610 D611 I612	F497-D608 HydrophobicContact CE1-CB 4Å; F497-D608 HydrophobicContact CZ-CB 4.06Å; I604-D608 VanDerWaalsContact O-CG 3.29Å; I604-D608 PolarHBondContact O-N 2.94Å; R605-D608 WeakPolarHBondContact CA-OD2 3.36Å; R605-D608 PolarHBondContact O-N 3.12Å; R605-D608 VanDerWaalsContact O-N 3.15Å; D608-V610 PolarHBondContact O-N 2.93Å; D608-D611 PolarHBondContact O-N 3.19Å; D608-I612 WeakPolarHBondContact O-CB 3.49Å; D608-I612 WeakPolarHBondContact O-CD1 3.31Å; D608-I612 WeakPolarHBondContact O-CG1 3.48Å; D608-I612 PolarHBondContact O-N 3.23Å
609	V	88.3	Confident	83.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-39.4	173.2	174.6	0	0	0	0	112.2	F497 I513 F517 F532 R605 Q607 F613 M655	F497-V609 HydrophobicContact CD1-CG2 3.41Å; F497-V609 VanDerWaalsContact CD1-CG2 3.41Å; F497-V609 HydrophobicContact CE1-CG2 3.58Å; F497-V609 HydrophobicContact CG-CG2 4.18Å; F497-V609 HydrophobicContact CZ-CG2 4.44Å; I513-V609 HydrophobicContact CD1-CG1 4.01Å; I513-V609 HydrophobicContact CD1-CG2 4.01Å; F517-V609 HydrophobicContact CE2-CG1 4.23Å; F517-V609 HydrophobicContact CZ-CG1 3.81Å; F532-V609 HydrophobicContact CD2-CG1 4.22Å; F532-V609 HydrophobicContact CE2-CB 4.07Å; F532-V609 HydrophobicContact CE2-CG1 3.82Å; R605-V609 WeakPolarHBondContact O-CG2 3.37Å; R605-V609 PolarHBondContact O-N 3.34Å; Q607-V609 VanDerWaalsContact C-N 3.25Å; Q607-V609 PolarHBondContact O-N 2.94Å; V609-F613 PolarHBondContact O-N 3.37Å; V609-M655 HydrophobicContact CG1-CE 4Å
610	V	89.2	Confident	81.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-71.5	-42.1	175.3	-171.1	0	0	0	0	111.2	F532 G606 Q607 D608 I612 F613 E614 M655 H656 L659	F532-V610 HydrophobicContact CE1-CG2 4.28Å; F532-V610 HydrophobicContact CZ-CG2 4.14Å; G606-V610 WeakPolarHBondContact O-CG2 3.33Å; G606-V610 PolarHBondContact O-N 3.4Å; Q607-V610 PolarHBondContact O-N 3.21Å; D608-V610 PolarHBondContact O-N 2.93Å; V610-I612 VanDerWaalsContact C-N 3.31Å; V610-I612 PolarHBondContact O-N 3.47Å; V610-F613 WeakPolarHBondContact O-CB 3.41Å; V610-F613 PolarHBondContact O-N 3.3Å; V610-F613 VanDerWaalsContact O-N 3.1Å; V610-E614 HydrophobicContact CG1-CG 4.24Å; V610-E614 PolarHBondContact O-N 2.61Å; V610-M655 HydrophobicContact CB-CB 4.46Å; V610-M655 HydrophobicContact CG1-CB 4.1Å; V610-M655 HydrophobicContact CG2-CB 3.54Å; V610-M655 HydrophobicContact CG2-CE 4.17Å; V610-H656 WeakPolarHBondContact CG1-CE1 3.05Å; V610-L659 HydrophobicContact CG2-CD1 3.86Å; V610-L659 HydrophobicContact CG2-CG 4.46Å
611	D	85.9	Confident	79.5	Confident	45 Å²	45	47.1 Å²	47.1	24%	0.241	24%	0.239	C	C	.	.	H	α-helix	trans	-69.4	-31.8	-178	-68.4	22.9	0	0	0	110.1	Q607 D608 N615 K751	Q607-D611 PolarHBondContact NE2-OD1 3.14Å; Q607-D611 PolarHBondContact O-N 3.31Å; D608-D611 PolarHBondContact O-N 3.19Å; D611-N615 VanDerWaalsContact O-CB 3.25Å; D611-N615 WeakPolarHBondContact O-CB 3.44Å; D611-N615 VanDerWaalsContact O-CG 3.3Å; D611-N615 PolarHBondContact O-N 3.14Å; D611-N615 PolarHBondContact O-ND2 2.86Å; D611-K751 IonicContact OD1-NZ 2.62Å; D611-K751 PolarHBondContact OD1-NZ 3.27Å; D611-K751 IonicContact OD2-NZ 2.67Å; D611-K751 PolarHBondContact OD2-NZ 3.46Å
612	I	83.6	Confident	77	Confident	47 Å²	47	49.9 Å²	49.9	24%	0.241	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-45.7	167.3	-73.1	163.2	0	0	0	111	F497 I513 L514 D608 V610 N616	F497-I612 HydrophobicContact CE2-CD1 4.16Å; F497-I612 HydrophobicContact CZ-CD1 3.98Å; I513-I612 HydrophobicContact CG2-CD1 4.41Å; I513-I612 HydrophobicContact CG2-CG2 4.48Å; L514-I612 HydrophobicContact CB-CG2 4.46Å; D608-I612 WeakPolarHBondContact O-CB 3.49Å; D608-I612 WeakPolarHBondContact O-CD1 3.31Å; D608-I612 WeakPolarHBondContact O-CG1 3.48Å; D608-I612 PolarHBondContact O-N 3.23Å; V610-I612 VanDerWaalsContact C-N 3.31Å; V610-I612 PolarHBondContact O-N 3.47Å; I612-N616 PolarHBondContact O-N 3.39Å; I612-N616 PolarHBondContact O-ND2 3.48Å
613	F	85.4	Confident	74.4	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-49.2	178.5	179.3	-88.9	0	0	0	111.6	F517 I521 F528 V609 V610 L617 L651 A652 M655	F517-F613 AromaticContact CD1-CD2 3.75Å; F517-F613 HydrophobicContact CD1-CD2 3.75Å; F517-F613 HydrophobicContact CD1-CE2 4.26Å; F517-F613 HydrophobicContact CD2-CD2 4.28Å; F517-F613 AromaticContact CE1-CD2 3.85Å; F517-F613 HydrophobicContact CE1-CD2 3.85Å; F517-F613 HydrophobicContact CE2-CB 4.11Å; F517-F613 HydrophobicContact CE2-CD2 4.36Å; F517-F613 AromaticContact CG-CD2 3.99Å; F517-F613 HydrophobicContact CG-CD2 3.99Å; F517-F613 HydrophobicContact CZ-CB 4.24Å; F517-F613 HydrophobicContact CZ-CD2 4.16Å; I521-F613 HydrophobicContact CD1-CE2 4.22Å; F528-F613 HydrophobicContact CE1-CE2 4.46Å; F528-F613 HydrophobicContact CE2-CD2 4.4Å; F528-F613 HydrophobicContact CE2-CE2 4.05Å; F528-F613 HydrophobicContact CZ-CD2 4.27Å; F528-F613 AromaticContact CZ-CE2 3.51Å; F528-F613 HydrophobicContact CZ-CE2 3.51Å; F528-F613 HydrophobicContact CZ-CZ 4Å; V609-F613 PolarHBondContact O-N 3.37Å; V610-F613 WeakPolarHBondContact O-CB 3.41Å; V610-F613 PolarHBondContact O-N 3.3Å; V610-F613 VanDerWaalsContact O-N 3.1Å; F613-L617 HydrophobicContact CD1-CD1 4.41Å; F613-L617 HydrophobicContact CD2-CD1 3.45Å; F613-L617 VanDerWaalsContact CD2-CD1 3.45Å; F613-L617 HydrophobicContact CE1-CD1 4.32Å; F613-L617 HydrophobicContact CE2-CD1 3.34Å; F613-L617 HydrophobicContact CG-CD1 4Å; F613-L617 HydrophobicContact CZ-CD1 3.81Å; F613-L617 WeakPolarHBondContact O-CB 3.47Å; F613-L617 PolarHBondContact O-N 3.29Å; F613-L651 HydrophobicContact CE1-CB 4.05Å; F613-L651 HydrophobicContact CZ-CB 3.85Å; F613-L651 HydrophobicContact CZ-CD1 4.17Å; F613-A652 HydrophobicContact CD1-CB 4.04Å; F613-A652 HydrophobicContact CE1-CB 4.07Å; F613-M655 HydrophobicContact CB-SD 4.44Å; F613-M655 HydrophobicContact CD1-SD 4.17Å; F613-M655 HydrophobicContact CD2-SD 4.45Å; F613-M655 HydrophobicContact CG-SD 4.11Å
614	E	83.8	Confident	71.7	Confident	54 Å²	54	62.2 Å²	62.2	25%	0.252	32%	0.322	S	S	.	.	H	α-helix	trans	-63	-50.1	179.8	-74.3	-173	145.8	0	0	112.3	V610 N616 L617 C618 A652 H656	V610-E614 HydrophobicContact CG1-CG 4.24Å; V610-E614 PolarHBondContact O-N 2.61Å; E614-N616 VanDerWaalsContact C-N 3.26Å; E614-N616 PolarHBondContact O-N 2.88Å; E614-L617 PolarHBondContact O-N 3.03Å; E614-C618 WeakPolarHBondContact O-CA 3.08Å; E614-C618 VanDerWaalsContact O-CB 3.27Å; E614-C618 WeakPolarHBondContact O-CB 3.45Å; E614-C618 PolarHBondContact O-N 2.92Å; E614-A652 HydrophobicContact CG-CB 3.51Å; E614-A652 WeakPolarHBondContact OE1-CB 3.35Å; E614-H656 VanDerWaalsContact CD-NE2 3.29Å; E614-H656 IonicContact OE1-CD2 2.84Å; E614-H656 IonicContact OE1-CE1 3.77Å; E614-H656 IonicContact OE1-NE2 3.78Å; E614-H656 PolarHBondContact OE1-NE2 2.88Å; E614-H656 IonicContact OE2-CE1 3.72Å; E614-H656 IonicContact OE2-NE2 3.49Å; E614-H656 PolarHBondContact OE2-NE2 3.3Å
615	N	80.5	Confident	69.1	Low	106 Å²	106	68.3 Å²	68.3	57%	0.567	35%	0.348	S	S	*	.	H	α-helix	trans	-63.4	-30.9	-174.1	-77.6	-55.5	0	0	0	113.3	D611 S619	D611-N615 VanDerWaalsContact O-CB 3.25Å; D611-N615 WeakPolarHBondContact O-CB 3.44Å; D611-N615 VanDerWaalsContact O-CG 3.3Å; D611-N615 PolarHBondContact O-N 3.14Å; D611-N615 PolarHBondContact O-ND2 2.86Å; N615-S619 WeakPolarHBondContact O-CB 3.48Å; N615-S619 PolarHBondContact O-OG 3.12Å
616	N	76.3	Confident	66.4	Low	73 Å²	73	72.3 Å²	72.3	39%	0.39	38%	0.377	S	S	.	.	H	α-helix	trans	-89.1	-26.4	-179.7	-71	-79.9	0	0	0	113.9	L514 I612 E614 N620	L514-N616 HydrophobicContact CD1-CB 3.63Å; I612-N616 PolarHBondContact O-N 3.39Å; I612-N616 PolarHBondContact O-ND2 3.48Å; E614-N616 VanDerWaalsContact C-N 3.26Å; E614-N616 PolarHBondContact O-N 2.88Å; N616-N620 PolarHBondContact O-ND2 3.44Å
617	L	73.7	Confident	63.7	Low	29 Å²	29	77.9 Å²	77.9	15%	0.152	41%	0.41	C	S	.	.	H	α-helix	trans	-114.8	-26.4	-169.8	-62	164.4	0	0	0	114.3	L518 I521 F613 E614 A648	L518-L617 HydrophobicContact CD2-CD2 4.01Å; I521-L617 HydrophobicContact CD1-CD1 3.34Å; I521-L617 HydrophobicContact CD1-CD2 3.75Å; I521-L617 HydrophobicContact CD1-CG 4.2Å; F613-L617 HydrophobicContact CD1-CD1 4.41Å; F613-L617 HydrophobicContact CD2-CD1 3.45Å; F613-L617 VanDerWaalsContact CD2-CD1 3.45Å; F613-L617 HydrophobicContact CE1-CD1 4.32Å; F613-L617 HydrophobicContact CE2-CD1 3.34Å; F613-L617 HydrophobicContact CG-CD1 4Å; F613-L617 HydrophobicContact CZ-CD1 3.81Å; F613-L617 WeakPolarHBondContact O-CB 3.47Å; F613-L617 PolarHBondContact O-N 3.29Å; E614-L617 PolarHBondContact O-N 3.03Å; L617-A648 HydrophobicContact CB-CB 4.4Å
618	C	65.3	Low	61	Low	18 Å²	18	85.6 Å²	85.6	12%	0.122	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-24.6	179.1	-65.7	0	0	0	0	113.2	E614 K649	E614-C618 WeakPolarHBondContact O-CA 3.08Å; E614-C618 VanDerWaalsContact O-CB 3.27Å; E614-C618 WeakPolarHBondContact O-CB 3.45Å; E614-C618 PolarHBondContact O-N 2.92Å; C618-K649 HydrophobicContact CB-CG 4.42Å
619	S	54.1	Low	58.4	Low	63 Å²	63	89.5 Å²	89.5	44%	0.441	47%	0.467	S	S	.	.			trans	-87	-2.4	-167.7	-57.7	0	0	0	0	116.3	N615 H621	N615-S619 WeakPolarHBondContact O-CB 3.48Å; N615-S619 PolarHBondContact O-OG 3.12Å; S619-H621 PolarHBondContact O-N 3.45Å
620	N	47.8	Very low	55.6	Low	93 Å²	93	93.2 Å²	93.2	50%	0.497	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	20.9	-176.8	-77.9	-44.1	0	0	0	115.8	N616	N616-N620 PolarHBondContact O-ND2 3.44Å
621	H	43	Very low	52.7	Low	140 Å²	140	100.1 Å²	100.1	65%	0.648	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-13.7	-176	-142.8	-58.2	0	0	0	114.5	S619	S619-H621 PolarHBondContact O-N 3.45Å
622	Q	37.9	Very low	49.8	Very low	176 Å²	176	104.8 Å²	104.8	82%	0.822	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-11.7	-173	-73.7	-171.8	-20.5	0	0	115.6
623	L	36.3	Very low	47.1	Very low	135 Å²	135	109 Å²	109	71%	0.707	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-5	-176.5	-80	168.4	0	0	0	115.1
624	N	33.6	Very low	44.3	Very low	141 Å²	141	113.9 Å²	113.9	75%	0.754	63%	0.627	S	S	*	*	S	Bend	trans	-96.4	-3.7	-170.7	-77.7	-1.2	0	0	0	115.7
625	E	33	Very low	41.5	Very low	187 Å²	187	115.6 Å²	115.6	87%	0.874	64%	0.644	S	S	*	*	S	Bend	trans	-110.1	7	-176.4	-66.8	-168.3	149.9	0	0	114.6
626	T	31	Very low	38.9	Very low	115 Å²	115	117 Å²	117	71%	0.706	66%	0.657	S	S	*	*			trans	-127.1	35.8	-173.1	48.5	0	0	0	0	115.1
627	V	33.2	Very low	36.5	Very low	117 Å²	117	121.9 Å²	121.9	71%	0.709	68%	0.677	S	S	*	*			trans	-131.1	49.5	168.8	-157.6	0	0	0	0	113	N629	V627-N629 PolarHBondContact O-N 3.41Å
628	E	32.4	Very low	34.5	Very low	191 Å²	191	129 Å²	129	89%	0.893	71%	0.71	S	S	*	*			trans	-71	84.1	145.1	-82.9	-156.7	140.4	0	0	108.6
629	N	32.8	Very low	33.2	Very low	149 Å²	149	133.3 Å²	133.3	80%	0.797	74%	0.738	S	S	*	*	S	Bend	trans	172.3	113.8	148.8	-94.2	-58.1	0	0	0	108.5	V627 I631	V627-N629 PolarHBondContact O-N 3.41Å; N629-I631 PolarHBondContact O-N 3.32Å
630	G	29.5	Very low	32.6	Very low	77 Å²	77	135 Å²	135	79%	0.794	74%	0.742	S	S	*	*			trans	-81	117.2	-165.8	0	0	0	0	0	115.1
631	I	28.3	Very low	32.6	Very low	146 Å²	146	134.4 Å²	134.4	75%	0.749	74%	0.741	S	S	*	*			trans	-131.7	111	150.6	-82.9	165.7	0	0	0	107.1	N629 I633	N629-I631 PolarHBondContact O-N 3.32Å; I631-I633 HydrophobicContact CG2-CD1 4.06Å; I631-I633 HydrophobicContact CG2-CG1 3.86Å; I631-I633 PolarHBondContact O-N 3.48Å
632	V	25.3	Very low	33.3	Very low	143 Å²	143	130.7 Å²	130.7	87%	0.867	73%	0.729	S	S	*	*			trans	-86.7	88.8	-178.6	-177.9	0	0	0	0	109.6
633	I	27	Very low	34.8	Very low	135 Å²	135	123.4 Å²	123.4	69%	0.692	70%	0.695	S	S	*	*			trans	-84.8	112.5	166.3	-68.5	168.9	0	0	0	108	I631 S635	I631-I633 HydrophobicContact CG2-CD1 4.06Å; I631-I633 HydrophobicContact CG2-CG1 3.86Å; I631-I633 PolarHBondContact O-N 3.48Å; I633-S635 VanDerWaalsContact C-N 3.25Å; I633-S635 PolarHBondContact O-N 2.95Å
634	S	24.8	Very low	36.6	Very low	104 Å²	104	120.6 Å²	120.6	73%	0.727	69%	0.687	S	S	*	*			trans	-79.5	63.8	-176.4	61.1	0	0	0	0	112.8	T636	S634-T636 PolarHBondContact O-N 3.04Å
635	S	25.4	Very low	38.7	Very low	89 Å²	89	116.1 Å²	116.1	62%	0.622	66%	0.664	S	S	*	*			trans	-85.4	91.7	166.3	53.5	0	0	0	0	109.6	I633 Q637	I633-S635 VanDerWaalsContact C-N 3.25Å; I633-S635 PolarHBondContact O-N 2.95Å; S635-Q637 PolarHBondContact O-N 3.33Å
636	T	25.9	Very low	40.8	Very low	136 Å²	136	113.4 Å²	113.4	83%	0.834	65%	0.651	S	S	*	*			trans	-75.8	63.3	-179	54	0	0	0	0	112.7	S634	S634-T636 PolarHBondContact O-N 3.04Å
637	Q	27.3	Very low	43.2	Very low	175 Å²	175	112.3 Å²	112.3	82%	0.818	64%	0.637	S	S	*	*			trans	-86.9	105.1	155.6	-72.6	-178.5	-21.1	0	0	107.1	S635	S635-Q637 PolarHBondContact O-N 3.33Å
638	Q	30.1	Very low	45.5	Very low	178 Å²	178	107 Å²	107	83%	0.832	61%	0.605	S	S	*	*			trans	-66	128.1	169.3	-71.6	-178.8	-21.6	0	0	108	L640	Q638-L640 PolarHBondContact O-N 3.28Å
639	P	38.6	Very low	48	Very low	109 Å²	109	103.7 Å²	103.7	71%	0.708	59%	0.588	S	S	*	*			trans	-62.9	134.1	-176.3	23.9	-32.8	0	0	0	110.8	T641	P639-T641 PolarHBondContact O-N 3.37Å
640	L	41.8	Very low	50.5	Low	100 Å²	100	101.3 Å²	101.3	52%	0.524	57%	0.572	S	S	.	*			trans	-69	15.9	-168.1	-79	159.6	0	0	0	115.6	Q638 T642	Q638-L640 PolarHBondContact O-N 3.28Å; L640-T642 PolarHBondContact O-N 3.4Å; L640-T642 PolarHBondContact O-OG1 3.14Å
641	T	47.7	Very low	53.2	Low	80 Å²	80	98.7 Å²	98.7	49%	0.491	54%	0.54	S	S	.	.			trans	-74.2	69.3	-177.5	57.2	0	0	0	0	112	P639 I643	P639-T641 PolarHBondContact O-N 3.37Å; T641-I643 PolarHBondContact O-N 2.78Å
642	T	56.8	Low	56.1	Low	62 Å²	62	91.8 Å²	91.8	38%	0.38	50%	0.504	S	S	.	.			trans	-66.9	-8.6	172.5	-41.5	0	0	0	0	111.7	R522 L640	R522-T642 PolarHBondContact NH1-OG1 3.24Å; L640-T642 PolarHBondContact O-N 3.4Å; L640-T642 PolarHBondContact O-OG1 3.14Å
643	I	69.6	Low	59.1	Low	22 Å²	22	88.3 Å²	88.3	11%	0.113	48%	0.477	C	S	.	.	S	Bend	trans	-128.4	142.3	179.4	-69.9	176.9	0	0	0	109.1	I521 L526 T641 K647 A648	I521-I643 HydrophobicContact CB-CD1 4.01Å; I521-I643 HydrophobicContact CD1-CD1 4.23Å; I521-I643 HydrophobicContact CG1-CD1 3.64Å; I521-I643 HydrophobicContact CG2-CD1 3.61Å; I521-I643 HydrophobicContact CG2-CG1 3.95Å; L526-I643 HydrophobicContact CD1-CD1 4.24Å; L526-I643 HydrophobicContact CD2-CD1 3.44Å; L526-I643 VanDerWaalsContact CD2-CD1 3.44Å; T641-I643 PolarHBondContact O-N 2.78Å; I643-K647 HydrophobicContact CG2-CB 3.81Å; I643-K647 HydrophobicContact CG2-CD 4.21Å; I643-K647 HydrophobicContact CG2-CG 4.16Å; I643-A648 HydrophobicContact CG2-CB 4.41Å
644	S	74.8	Confident	62.1	Low	77 Å²	77	84.6 Å²	84.6	54%	0.538	46%	0.463	S	S	.	.			trans	-71.8	143.1	173.8	60.8	0	0	0	0	111.7	H646 K647 A648	S644-H646 PolarHBondContact O-N 3.38Å; S644-H646 VanDerWaalsContact O-N 3.07Å; S644-K647 WeakPolarHBondContact O-CA 3.24Å; S644-K647 PolarHBondContact O-N 2.93Å; S644-A648 PolarHBondContact O-N 2.89Å
645	V	77.9	Confident	65.3	Low	46 Å²	46	79.6 Å²	79.6	28%	0.279	43%	0.428	S	S	.	.	H	α-helix	trans	-53.4	-34.9	-178.4	180	0	0	0	0	112.4	A648 K649	V645-A648 PolarHBondContact O-N 3.33Å; V645-K649 HydrophobicContact CG1-CD 4.48Å; V645-K649 WeakPolarHBondContact O-CG 3.4Å; V645-K649 PolarHBondContact O-N 3.43Å
646	H	77.2	Confident	68.5	Low	130 Å²	130	75.9 Å²	75.9	60%	0.602	40%	0.4	S	S	*	.	H	α-helix	trans	-60.6	-45.3	173.2	-171.6	-30.2	0	0	0	112.4	S644 A648 K649 E650	S644-H646 PolarHBondContact O-N 3.38Å; S644-H646 VanDerWaalsContact O-N 3.07Å; H646-A648 VanDerWaalsContact C-N 3.35Å; H646-K649 PolarHBondContact O-N 3.42Å; H646-E650 IonicContact CE1-OE1 3.96Å; H646-E650 PolarHBondContact CE1-OE1 3.46Å; H646-E650 IonicContact ND1-OE1 2.68Å; H646-E650 WeakPolarHBondContact O-CG 3.35Å; H646-E650 PolarHBondContact O-N 2.92Å
647	K	80.6	Confident	71.5	Confident	92 Å²	92	74 Å²	74	40%	0.4	38%	0.381	S	S	.	.	H	α-helix	trans	-72.8	-29	-178.9	-169.9	-177.4	-167.4	-168.1	0	111.9	L526 I643 S644 L651	L526-K647 HydrophobicContact CD1-CD 4.07Å; I643-K647 HydrophobicContact CG2-CB 3.81Å; I643-K647 HydrophobicContact CG2-CD 4.21Å; I643-K647 HydrophobicContact CG2-CG 4.16Å; S644-K647 WeakPolarHBondContact O-CA 3.24Å; S644-K647 PolarHBondContact O-N 2.93Å; K647-L651 WeakPolarHBondContact O-CG 3.49Å; K647-L651 PolarHBondContact O-N 3.01Å
648	A	82.9	Confident	74.6	Confident	6 Å²	6	66 Å²	66	5%	0.05	34%	0.344	C	S	.	.	H	α-helix	trans	-63.8	-47.2	167.7	0	0	0	0	0	111.4	L617 I643 S644 V645 H646 E650 L651 A652	L617-A648 HydrophobicContact CB-CB 4.4Å; I643-A648 HydrophobicContact CG2-CB 4.41Å; S644-A648 PolarHBondContact O-N 2.89Å; V645-A648 PolarHBondContact O-N 3.33Å; H646-A648 VanDerWaalsContact C-N 3.35Å; A648-E650 PolarHBondContact O-N 3.35Å; A648-L651 PolarHBondContact O-N 3.16Å; A648-A652 PolarHBondContact O-N 2.91Å
649	K	83.3	Confident	77.6	Confident	122 Å²	122	57.7 Å²	57.7	53%	0.53	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-39.6	176.3	-72.5	-178.3	177	-171	0	113.4	C618 V645 H646 A652 K653	C618-K649 HydrophobicContact CB-CG 4.42Å; V645-K649 HydrophobicContact CG1-CD 4.48Å; V645-K649 WeakPolarHBondContact O-CG 3.4Å; V645-K649 PolarHBondContact O-N 3.43Å; H646-K649 PolarHBondContact O-N 3.42Å; K649-A652 PolarHBondContact O-N 2.69Å; K649-K653 WeakPolarHBondContact O-CB 3.21Å; K649-K653 PolarHBondContact O-N 3.23Å
650	E	85.4	Confident	80.1	Confident	98 Å²	98	54.7 Å²	54.7	46%	0.458	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-43.4	173.6	-71.6	-59.2	136.3	0	0	112.6	H646 A648 K653 C654	H646-E650 IonicContact CE1-OE1 3.96Å; H646-E650 PolarHBondContact CE1-OE1 3.46Å; H646-E650 IonicContact ND1-OE1 2.68Å; H646-E650 WeakPolarHBondContact O-CG 3.35Å; H646-E650 PolarHBondContact O-N 2.92Å; A648-E650 PolarHBondContact O-N 3.35Å; E650-K653 PolarHBondContact O-N 3.31Å; E650-C654 PolarHBondContact O-N 3.27Å; E650-C654 PolarHBondContact O-SG 3.1Å
651	L	86.9	Confident	82.4	Confident	23 Å²	23	51.9 Å²	51.9	12%	0.12	27%	0.265	C	S	.	.	H	α-helix	trans	-63.1	-46.5	175.7	-70.4	167.6	0	0	0	111.7	L526 F528 V529 F613 K647 A648 K653 C654 M655	L526-L651 HydrophobicContact CB-CD1 4.3Å; L526-L651 HydrophobicContact CB-CD2 4.2Å; L526-L651 HydrophobicContact CD1-CD1 4.42Å; L526-L651 HydrophobicContact CD2-CD1 4.29Å; F528-L651 HydrophobicContact CE1-CD1 4.36Å; F528-L651 HydrophobicContact CZ-CD1 4.25Å; V529-L651 HydrophobicContact CG2-CD2 3.87Å; F613-L651 HydrophobicContact CE1-CB 4.05Å; F613-L651 HydrophobicContact CZ-CB 3.85Å; F613-L651 HydrophobicContact CZ-CD1 4.17Å; K647-L651 WeakPolarHBondContact O-CG 3.49Å; K647-L651 PolarHBondContact O-N 3.01Å; A648-L651 PolarHBondContact O-N 3.16Å; L651-K653 VanDerWaalsContact C-N 3.33Å; L651-K653 PolarHBondContact O-N 3.06Å; L651-C654 WeakPolarHBondContact O-CA 3.4Å; L651-C654 WeakPolarHBondContact O-CB 3.42Å; L651-C654 PolarHBondContact O-N 2.97Å; L651-M655 WeakPolarHBondContact O-CG 3.15Å; L651-M655 PolarHBondContact O-N 2.89Å
652	A	88.4	Confident	84.5	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.3	-43.2	176.4	0	0	0	0	0	111.9	F613 E614 A648 K649 C654 M655 H656	F613-A652 HydrophobicContact CD1-CB 4.04Å; F613-A652 HydrophobicContact CE1-CB 4.07Å; E614-A652 HydrophobicContact CG-CB 3.51Å; E614-A652 WeakPolarHBondContact OE1-CB 3.35Å; A648-A652 PolarHBondContact O-N 2.91Å; K649-A652 PolarHBondContact O-N 2.69Å; A652-C654 VanDerWaalsContact C-N 3.26Å; A652-C654 PolarHBondContact O-N 2.63Å; A652-M655 CarbonylContact O-C 3.55Å; A652-M655 WeakPolarHBondContact O-CA 3.46Å; A652-M655 WeakPolarHBondContact O-CB 3.38Å; A652-M655 PolarHBondContact O-N 2.78Å; A652-H656 PolarHBondContact O-CD2 3.03Å; A652-H656 VanDerWaalsContact O-CD2 3.26Å; A652-H656 PolarHBondContact O-N 3.24Å
653	K	88.4	Confident	86.2	Confident	71 Å²	71	45.1 Å²	45.1	31%	0.309	22%	0.224	S	C	.	.	H	α-helix	trans	-61.1	-33.4	174.3	-171.2	159.9	-171.6	160.7	0	113	K649 E650 L651 K657 F752 D754	K649-K653 WeakPolarHBondContact O-CB 3.21Å; K649-K653 PolarHBondContact O-N 3.23Å; E650-K653 PolarHBondContact O-N 3.31Å; L651-K653 VanDerWaalsContact C-N 3.33Å; L651-K653 PolarHBondContact O-N 3.06Å; K653-K657 WeakPolarHBondContact O-CB 3.32Å; K653-K657 PolarHBondContact O-N 3.35Å; K653-F752 WeakPolarHBondContact CE-O 3.34Å; K653-F752 HydrophobicContact CG-CD2 4.45Å; K653-F752 HydrophobicContact CG-CE2 4.46Å; K653-D754 IonicContact NZ-OD2 3.38Å; K653-D754 PolarHBondContact NZ-OD2 3.39Å
654	C	89.9	Confident	87.2	Confident	56 Å²	56	44.8 Å²	44.8	38%	0.378	22%	0.222	S	C	.	.	H	α-helix	trans	-72.5	-27.3	172.8	-66.7	0	0	0	0	113	V529 E650 L651 A652 T658	V529-C654 HydrophobicContact CG1-CB 3.9Å; E650-C654 PolarHBondContact O-N 3.27Å; E650-C654 PolarHBondContact O-SG 3.1Å; L651-C654 WeakPolarHBondContact O-CA 3.4Å; L651-C654 WeakPolarHBondContact O-CB 3.42Å; L651-C654 PolarHBondContact O-N 2.97Å; A652-C654 VanDerWaalsContact C-N 3.26Å; A652-C654 PolarHBondContact O-N 2.63Å; C654-T658 PolarHBondContact O-N 2.71Å; C654-T658 PolarHBondContact O-OG1 2.77Å
655	M	92.2	Very high	87.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-76	-42.8	170.8	-59.2	170.2	79.3	0	0	111.9	F517 F528 V529 F532 V609 V610 F613 L651 A652 K657 T658 L659	F517-M655 HydrophobicContact CE1-CE 4.31Å; F517-M655 HydrophobicContact CZ-CE 3.99Å; F528-M655 HydrophobicContact CE2-SD 4.12Å; V529-M655 HydrophobicContact CG1-CG 3.9Å; V529-M655 HydrophobicContact CG2-CG 3.98Å; V529-M655 HydrophobicContact CG2-SD 4.5Å; F532-M655 HydrophobicContact CD1-CB 4.14Å; F532-M655 HydrophobicContact CD1-CE 4.21Å; F532-M655 HydrophobicContact CD1-CG 4.11Å; F532-M655 HydrophobicContact CD2-CE 4.46Å; F532-M655 HydrophobicContact CE1-CB 3.89Å; F532-M655 HydrophobicContact CE1-CE 4.29Å; F532-M655 HydrophobicContact CE1-CG 4.32Å; F532-M655 HydrophobicContact CG-CE 4.3Å; F532-M655 HydrophobicContact CZ-CE 4.45Å; V609-M655 HydrophobicContact CG1-CE 4Å; V610-M655 HydrophobicContact CB-CB 4.46Å; V610-M655 HydrophobicContact CG1-CB 4.1Å; V610-M655 HydrophobicContact CG2-CB 3.54Å; V610-M655 HydrophobicContact CG2-CE 4.17Å; F613-M655 HydrophobicContact CB-SD 4.44Å; F613-M655 HydrophobicContact CD1-SD 4.17Å; F613-M655 HydrophobicContact CD2-SD 4.45Å; F613-M655 HydrophobicContact CG-SD 4.11Å; L651-M655 WeakPolarHBondContact O-CG 3.15Å; L651-M655 PolarHBondContact O-N 2.89Å; A652-M655 CarbonylContact O-C 3.55Å; A652-M655 WeakPolarHBondContact O-CA 3.46Å; A652-M655 WeakPolarHBondContact O-CB 3.38Å; A652-M655 PolarHBondContact O-N 2.78Å; M655-K657 VanDerWaalsContact C-N 3.29Å; M655-K657 PolarHBondContact O-N 3.23Å; M655-T658 WeakPolarHBondContact O-CA 3.45Å; M655-T658 WeakPolarHBondContact O-CB 3.38Å; M655-T658 PolarHBondContact O-N 2.95Å; M655-L659 PolarHBondContact O-N 2.91Å
656	H	92.1	Very high	88.6	Confident	10 Å²	10	42 Å²	42	5%	0.046	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-39.9	171.3	-64.5	-61.2	0	0	0	111.7	Q607 V610 E614 A652 T658 L659 W660 F752	Q607-H656 PolarHBondContact NE2-CE1 3.45Å; Q607-H656 VanDerWaalsContact NE2-CE1 3.28Å; Q607-H656 PolarHBondContact NE2-ND1 3.4Å; V610-H656 WeakPolarHBondContact CG1-CE1 3.05Å; E614-H656 VanDerWaalsContact CD-NE2 3.29Å; E614-H656 IonicContact OE1-CD2 2.84Å; E614-H656 IonicContact OE1-CE1 3.77Å; E614-H656 IonicContact OE1-NE2 3.78Å; E614-H656 PolarHBondContact OE1-NE2 2.88Å; E614-H656 IonicContact OE2-CE1 3.72Å; E614-H656 IonicContact OE2-NE2 3.49Å; E614-H656 PolarHBondContact OE2-NE2 3.3Å; A652-H656 PolarHBondContact O-CD2 3.03Å; A652-H656 VanDerWaalsContact O-CD2 3.26Å; A652-H656 PolarHBondContact O-N 3.24Å; H656-T658 PolarHBondContact O-N 3.38Å; H656-L659 PolarHBondContact O-N 3.1Å; H656-W660 PolarHBondContact O-N 3.42Å; H656-F752 HydrophobicContact CB-CB 4.12Å
657	K	90.4	Very high	89.4	Confident	98 Å²	98	35.9 Å²	35.9	43%	0.426	17%	0.174	S	C	.	.	H	α-helix	trans	-57.8	-36.5	171	-169.4	178.8	179.5	-178.6	0	112.6	K653 M655 N661 F752	K653-K657 WeakPolarHBondContact O-CB 3.32Å; K653-K657 PolarHBondContact O-N 3.35Å; M655-K657 VanDerWaalsContact C-N 3.29Å; M655-K657 PolarHBondContact O-N 3.23Å; K657-N661 WeakPolarHBondContact O-CB 3.23Å; K657-N661 PolarHBondContact O-N 2.84Å; K657-N661 PolarHBondContact O-ND2 3.22Å; K657-F752 HydrophobicContact CB-CD2 3.52Å; K657-F752 HydrophobicContact CB-CE2 3.48Å; K657-F752 VanDerWaalsContact CB-CE2 3.48Å; K657-F752 HydrophobicContact CB-CG 4.32Å; K657-F752 HydrophobicContact CB-CZ 4.22Å; K657-F752 HydrophobicContact CD-CE2 3.93Å; K657-F752 HydrophobicContact CD-CZ 4.1Å; K657-F752 HydrophobicContact CG-CD2 4.07Å; K657-F752 HydrophobicContact CG-CE1 4.48Å; K657-F752 HydrophobicContact CG-CE2 3.63Å; K657-F752 HydrophobicContact CG-CZ 3.86Å
658	T	91.8	Very high	89.8	Confident	7 Å²	7	36.9 Å²	36.9	4%	0.043	18%	0.178	C	C	.	.	H	α-helix	trans	-68.4	-40	176.9	-67.3	0	0	0	0	111.6	F532 H533 M536 C654 M655 H656 N661 T662	F532-T658 HydrophobicContact CD1-CG2 3.62Å; F532-T658 HydrophobicContact CE1-CG2 3.75Å; H533-T658 VanDerWaalsContact CA-CG2 3.47Å; H533-T658 HydrophobicContact CB-CG2 3.73Å; M536-T658 HydrophobicContact CB-CG2 4.48Å; M536-T658 HydrophobicContact CG-CG2 4.41Å; C654-T658 PolarHBondContact O-N 2.71Å; C654-T658 PolarHBondContact O-OG1 2.77Å; M655-T658 WeakPolarHBondContact O-CA 3.45Å; M655-T658 WeakPolarHBondContact O-CB 3.38Å; M655-T658 PolarHBondContact O-N 2.95Å; H656-T658 PolarHBondContact O-N 3.38Å; T658-N661 PolarHBondContact O-N 3.45Å; T658-T662 WeakPolarHBondContact O-CB 3.36Å; T658-T662 PolarHBondContact O-N 2.99Å; T658-T662 PolarHBondContact O-OG1 3.34Å
659	L	93.2	Very high	90.1	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-63.2	-46.1	172.8	-60.5	177.8	0	0	0	111.6	F532 M536 Q607 V610 M655 H656 T662 A663	F532-L659 HydrophobicContact CE1-CD2 4.32Å; F532-L659 HydrophobicContact CZ-CD2 3.97Å; M536-L659 HydrophobicContact CE-CD2 3.85Å; Q607-L659 HydrophobicContact CB-CD1 4.1Å; Q607-L659 HydrophobicContact CG-CD1 4.47Å; Q607-L659 VanDerWaalsContact OE1-CD1 3.28Å; V610-L659 HydrophobicContact CG2-CD1 3.86Å; V610-L659 HydrophobicContact CG2-CG 4.46Å; M655-L659 PolarHBondContact O-N 2.91Å; H656-L659 PolarHBondContact O-N 3.1Å; L659-T662 PolarHBondContact O-N 3.4Å; L659-A663 WeakPolarHBondContact O-CB 3.28Å; L659-A663 PolarHBondContact O-N 3.46Å
660	W	91.6	Very high	90.5	Very high	46 Å²	46	35.1 Å²	35.1	17%	0.174	17%	0.167	C	C	.	.	H	α-helix	trans	-60.8	-45.7	175.1	172.1	65.1	0	0	0	112.7	H656 T662 A663 N664 W749 F752	H656-W660 PolarHBondContact O-N 3.42Å; W660-T662 VanDerWaalsContact C-N 3.3Å; W660-T662 PolarHBondContact O-N 2.93Å; W660-A663 PolarHBondContact O-N 2.92Å; W660-N664 VanDerWaalsContact O-CB 3.26Å; W660-N664 WeakPolarHBondContact O-CB 3.45Å; W660-N664 PolarHBondContact O-N 3.01Å; W660-W749 AromaticContact CD1-CD1 3.86Å; W660-W749 AromaticContact CE2-CD1 3.94Å; W660-W749 AromaticContact NE1-CD1 3.5Å; W660-F752 HydrophobicContact CB-CB 4.33Å; W660-F752 HydrophobicContact CD2-CD1 4.26Å; W660-F752 HydrophobicContact CE3-CD1 4.09Å; W660-F752 HydrophobicContact CE3-CE1 4.07Å; W660-F752 HydrophobicContact CG-CD1 4.45Å; W660-F752 HydrophobicContact CZ3-CE1 4.31Å
661	N	90.4	Very high	90.7	Very high	41 Å²	41	30.9 Å²	30.9	22%	0.219	15%	0.148	C	C	.	.	H	α-helix	trans	-55.2	-46.5	173.6	-78.3	-17.5	0	0	0	111.5	H533 K657 T658 N664 V665	H533-N661 WeakPolarHBondContact NE2-CB 3.49Å; H533-N661 PolarHBondContact NE2-ND2 3.02Å; K657-N661 WeakPolarHBondContact O-CB 3.23Å; K657-N661 PolarHBondContact O-N 2.84Å; K657-N661 PolarHBondContact O-ND2 3.22Å; T658-N661 PolarHBondContact O-N 3.45Å; N661-N664 PolarHBondContact O-N 3.27Å; N661-V665 WeakPolarHBondContact O-CG2 3.49Å; N661-V665 PolarHBondContact O-N 3.17Å
662	T	91.9	Very high	90.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.4	-41.6	-177.8	-56.8	0	0	0	0	111.6	M536 L537 V540 L603 T658 L659 W660 S666	M536-T662 HydrophobicContact CB-CG2 4.16Å; M536-T662 HydrophobicContact CE-CG2 4Å; L537-T662 HydrophobicContact CD2-CG2 4.47Å; V540-T662 HydrophobicContact CG2-CG2 3.4Å; V540-T662 VanDerWaalsContact CG2-CG2 3.4Å; L603-T662 HydrophobicContact CD2-CG2 4.28Å; T658-T662 WeakPolarHBondContact O-CB 3.36Å; T658-T662 PolarHBondContact O-N 2.99Å; T658-T662 PolarHBondContact O-OG1 3.34Å; L659-T662 PolarHBondContact O-N 3.4Å; W660-T662 VanDerWaalsContact C-N 3.3Å; W660-T662 PolarHBondContact O-N 2.93Å; T662-S666 WeakPolarHBondContact O-CB 3.47Å; T662-S666 PolarHBondContact O-N 3.33Å; T662-S666 PolarHBondContact O-OG 2.88Å
663	A	92.3	Very high	90.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-45.4	173.7	0	0	0	0	0	111.5	L603 L659 W660 S666 Q667 V745 A748	L603-A663 HydrophobicContact CD1-CB 3.88Å; L603-A663 HydrophobicContact CD2-CB 4.01Å; L659-A663 WeakPolarHBondContact O-CB 3.28Å; L659-A663 PolarHBondContact O-N 3.46Å; W660-A663 PolarHBondContact O-N 2.92Å; A663-S666 WeakPolarHBondContact O-CB 3.32Å; A663-S666 PolarHBondContact O-N 3.36Å; A663-Q667 WeakPolarHBondContact O-CB 3.34Å; A663-Q667 PolarHBondContact O-N 2.75Å; A663-V745 HydrophobicContact CB-CB 4.48Å; A663-V745 HydrophobicContact CB-CG1 4.44Å; A663-V745 HydrophobicContact CB-CG2 4.21Å; A663-A748 HydrophobicContact CB-CB 4.46Å
664	N	89.2	Confident	90.6	Very high	15 Å²	15	30.9 Å²	30.9	8%	0.08	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-43.6	178.9	-171.7	-31	0	0	0	112.2	W660 N661 S666 Q667 K668	W660-N664 VanDerWaalsContact O-CB 3.26Å; W660-N664 WeakPolarHBondContact O-CB 3.45Å; W660-N664 PolarHBondContact O-N 3.01Å; N661-N664 PolarHBondContact O-N 3.27Å; N664-S666 PolarHBondContact O-N 2.66Å; N664-Q667 PolarHBondContact O-N 3.15Å; N664-K668 WeakPolarHBondContact O-CB 3.47Å; N664-K668 WeakPolarHBondContact O-CG 3.41Å; N664-K668 PolarHBondContact O-N 3.49Å; N664-K668 WeakPolarHBondContact OD1-CD 3.28Å; N664-K668 WeakPolarHBondContact OD1-CE 3.25Å; N664-K668 PolarHBondContact OD1-NZ 3.21Å
665	V	90.7	Very high	90.4	Very high	65 Å²	65	28.8 Å²	28.8	39%	0.394	14%	0.144	S	C	.	.	H	α-helix	trans	-60.6	-44.5	173.3	168.3	0	0	0	0	111.3	L537 N661 K668 R669	L537-V665 HydrophobicContact CD2-CB 4.26Å; L537-V665 HydrophobicContact CD2-CG1 4.32Å; L537-V665 HydrophobicContact CD2-CG2 4.16Å; N661-V665 WeakPolarHBondContact O-CG2 3.49Å; N661-V665 PolarHBondContact O-N 3.17Å; V665-K668 PolarHBondContact O-N 3.25Å; V665-R669 PolarHBondContact O-N 2.88Å
666	S	92.5	Very high	89.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-47.2	178.2	-58.1	0	0	0	0	112	V540 T662 A663 N664 K668 R669 L670	V540-S666 WeakPolarHBondContact CG1-OG 3.19Å; V540-S666 WeakPolarHBondContact CG2-OG 3.18Å; T662-S666 WeakPolarHBondContact O-CB 3.47Å; T662-S666 PolarHBondContact O-N 3.33Å; T662-S666 PolarHBondContact O-OG 2.88Å; A663-S666 WeakPolarHBondContact O-CB 3.32Å; A663-S666 PolarHBondContact O-N 3.36Å; N664-S666 PolarHBondContact O-N 2.66Å; S666-K668 PolarHBondContact O-N 3.21Å; S666-R669 PolarHBondContact O-N 2.96Å; S666-R669 VanDerWaalsContact O-N 3.13Å; S666-L670 WeakPolarHBondContact O-CG 3.41Å; S666-L670 PolarHBondContact O-N 3.4Å
667	Q	93	Very high	89.4	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-60.4	-42.1	177.8	-176.4	-163.9	0.7	0	0	112.5	A663 N664 R669 L670 C671 F741 V745 D827 L829 L830	A663-Q667 WeakPolarHBondContact O-CB 3.34Å; A663-Q667 PolarHBondContact O-N 2.75Å; N664-Q667 PolarHBondContact O-N 3.15Å; Q667-R669 VanDerWaalsContact C-N 3.32Å; Q667-R669 PolarHBondContact O-N 3.42Å; Q667-L670 PolarHBondContact O-N 3.13Å; Q667-C671 WeakPolarHBondContact O-CB 3.38Å; Q667-C671 PolarHBondContact O-N 3.4Å; Q667-F741 HydrophobicContact CB-CE1 4.16Å; Q667-V745 HydrophobicContact CB-CG2 4.22Å; Q667-V745 HydrophobicContact CG-CG2 4.25Å; Q667-D827 PolarHBondContact NE2-O 3.13Å; Q667-L829 HydrophobicContact CG-CB 4.31Å; Q667-L830 HydrophobicContact CG-CD1 4.05Å; Q667-L830 HydrophobicContact CG-CG 3.9Å
668	K	89.8	Confident	88.9	Confident	114 Å²	114	26.7 Å²	26.7	50%	0.496	14%	0.136	S	C	.	.	H	α-helix	trans	-58.8	-43.2	172.2	-80.3	167.9	172.1	149.6	0	111.8	N664 V665 S666 C671 S672 L829	N664-K668 WeakPolarHBondContact O-CB 3.47Å; N664-K668 WeakPolarHBondContact O-CG 3.41Å; N664-K668 PolarHBondContact O-N 3.49Å; N664-K668 WeakPolarHBondContact OD1-CD 3.28Å; N664-K668 WeakPolarHBondContact OD1-CE 3.25Å; N664-K668 PolarHBondContact OD1-NZ 3.21Å; V665-K668 PolarHBondContact O-N 3.25Å; S666-K668 PolarHBondContact O-N 3.21Å; K668-C671 WeakPolarHBondContact O-CB 3.5Å; K668-C671 PolarHBondContact O-N 3.34Å; K668-S672 PolarHBondContact O-N 3.26Å; K668-L829 HydrophobicContact CB-CD1 4.41Å; K668-L829 HydrophobicContact CD-CD1 4.41Å; K668-L829 HydrophobicContact CG-CD1 3.37Å
669	R	88.7	Confident	87.9	Confident	87 Å²	87	32.5 Å²	32.5	33%	0.328	16%	0.157	S	C	.	.	H	α-helix	trans	-73.4	-37.3	-178.6	-160.6	170.5	-176.7	-168.9	-2.4	112.3	F544 V665 S666 Q667 S672 I673	F544-R669 VanDerWaalsContact CB-CZ 3.45Å; F544-R669 VanDerWaalsContact CB-NH1 3.28Å; F544-R669 HydrophobicContact CD1-CG 3.89Å; F544-R669 HydrophobicContact CE1-CB 3.84Å; F544-R669 HydrophobicContact CE1-CG 3.59Å; F544-R669 HydrophobicContact CE2-CB 4.11Å; F544-R669 HydrophobicContact CE2-CG 4.3Å; F544-R669 HydrophobicContact CG-CG 4.37Å; F544-R669 HydrophobicContact CZ-CB 3.59Å; F544-R669 HydrophobicContact CZ-CG 3.83Å; V665-R669 PolarHBondContact O-N 2.88Å; S666-R669 PolarHBondContact O-N 2.96Å; S666-R669 VanDerWaalsContact O-N 3.13Å; Q667-R669 VanDerWaalsContact C-N 3.32Å; Q667-R669 PolarHBondContact O-N 3.42Å; R669-S672 PolarHBondContact O-N 3.11Å; R669-I673 WeakPolarHBondContact O-CG1 3.23Å; R669-I673 PolarHBondContact O-N 3.25Å; R669-I673 VanDerWaalsContact O-N 3.08Å
670	L	91.9	Very high	86.8	Confident	3 Å²	3	33.5 Å²	33.5	2%	0.016	16%	0.163	C	C	.	.	H	α-helix	trans	-60.9	-45.9	167.7	-71.6	172	0	0	0	111.7	F544 L592 L595 S666 Q667 S672 I673 V674 F741 L830	F544-L670 HydrophobicContact CE1-CD2 4.33Å; F544-L670 HydrophobicContact CZ-CD2 4.29Å; F544-L670 HydrophobicContact CZ-CG 4.11Å; L592-L670 HydrophobicContact CD2-CD2 4.39Å; L595-L670 HydrophobicContact CD2-CD2 3.75Å; L595-L670 HydrophobicContact CG-CD2 4.02Å; S666-L670 WeakPolarHBondContact O-CG 3.41Å; S666-L670 PolarHBondContact O-N 3.4Å; Q667-L670 PolarHBondContact O-N 3.13Å; L670-S672 VanDerWaalsContact C-N 3.32Å; L670-S672 PolarHBondContact O-N 3.33Å; L670-I673 PolarHBondContact O-N 3.38Å; L670-V674 WeakPolarHBondContact O-CG2 3.44Å; L670-V674 PolarHBondContact O-N 3.11Å; L670-F741 HydrophobicContact CD1-CD1 3.71Å; L670-F741 HydrophobicContact CD1-CD2 4.05Å; L670-F741 HydrophobicContact CD1-CE1 3.71Å; L670-F741 HydrophobicContact CD1-CE2 4.06Å; L670-F741 HydrophobicContact CD1-CG 3.88Å; L670-F741 HydrophobicContact CD1-CZ 3.89Å; L670-L830 HydrophobicContact CB-CD1 4.32Å; L670-L830 HydrophobicContact CB-CD2 4.12Å; L670-L830 HydrophobicContact CD1-CD1 4.2Å
671	C	89.5	Confident	84.9	Confident	10 Å²	10	33.3 Å²	33.3	7%	0.068	17%	0.174	C	C	.	.	H	α-helix	trans	-59.5	-42.1	177.6	-179.4	0	0	0	0	111.6	Q667 K668 V674 S675 L830	Q667-C671 WeakPolarHBondContact O-CB 3.38Å; Q667-C671 PolarHBondContact O-N 3.4Å; K668-C671 WeakPolarHBondContact O-CB 3.5Å; K668-C671 PolarHBondContact O-N 3.34Å; C671-V674 PolarHBondContact O-N 3.49Å; C671-S675 WeakPolarHBondContact O-CB 3.3Å; C671-S675 PolarHBondContact O-N 3.42Å; C671-S675 PolarHBondContact O-OG 3.11Å; C671-L830 HydrophobicContact CB-CD2 3.92Å
672	S	85.4	Confident	82.5	Confident	78 Å²	78	36.2 Å²	36.2	55%	0.545	20%	0.198	S	C	.	.	H	α-helix	trans	-61.8	-45.1	173.4	-178.6	0	0	0	0	112.6	K668 R669 L670 S675 S676	K668-S672 PolarHBondContact O-N 3.26Å; R669-S672 PolarHBondContact O-N 3.11Å; L670-S672 VanDerWaalsContact C-N 3.32Å; L670-S672 PolarHBondContact O-N 3.33Å; S672-S675 PolarHBondContact O-N 2.95Å; S672-S676 WeakPolarHBondContact O-CB 3.49Å; S672-S676 PolarHBondContact O-N 3.03Å
673	I	87	Confident	80	Confident	12 Å²	12	41 Å²	41	6%	0.062	22%	0.222	C	C	.	.	H	α-helix	trans	-58.7	-51.7	176.3	-70.3	169.7	0	0	0	111.1	F544 F591 L592 L595 R669 L670 S676 R677	F544-I673 HydrophobicContact CD1-CD1 4.07Å; F544-I673 HydrophobicContact CE1-CD1 3.76Å; F591-I673 HydrophobicContact CE1-CG2 4.14Å; F591-I673 HydrophobicContact CZ-CD1 4.48Å; L592-I673 HydrophobicContact CD2-CG2 4.12Å; L595-I673 HydrophobicContact CD2-CD1 4.01Å; R669-I673 WeakPolarHBondContact O-CG1 3.23Å; R669-I673 PolarHBondContact O-N 3.25Å; R669-I673 VanDerWaalsContact O-N 3.08Å; L670-I673 PolarHBondContact O-N 3.38Å; I673-S676 PolarHBondContact O-N 2.98Å; I673-S676 PolarHBondContact O-OG 3.37Å; I673-R677 PolarHBondContact O-N 3.29Å
674	V	89	Confident	77	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-46.6	-180	178.1	0	0	0	0	110.8	W588 L592 L670 C671 S676 R677 F678 M738 L833 M837	W588-V674 HydrophobicContact CH2-CG1 4.46Å; W588-V674 HydrophobicContact CH2-CG2 4.29Å; W588-V674 HydrophobicContact CZ2-CG2 4.38Å; L592-V674 HydrophobicContact CD1-CG2 4.1Å; L670-V674 WeakPolarHBondContact O-CG2 3.44Å; L670-V674 PolarHBondContact O-N 3.11Å; C671-V674 PolarHBondContact O-N 3.49Å; V674-S676 VanDerWaalsContact C-N 3.27Å; V674-S676 PolarHBondContact O-N 3Å; V674-R677 WeakPolarHBondContact O-CB 3.4Å; V674-R677 PolarHBondContact O-N 3.19Å; V674-F678 HydrophobicContact CG1-CD2 4.02Å; V674-F678 HydrophobicContact CG1-CE2 4.24Å; V674-F678 WeakPolarHBondContact O-CD2 3.48Å; V674-F678 PolarHBondContact O-N 3.31Å; V674-M738 HydrophobicContact CG1-SD 4.13Å; V674-M738 HydrophobicContact CG2-SD 4.33Å; V674-L833 HydrophobicContact CB-CD2 3.72Å; V674-L833 HydrophobicContact CG1-CD2 3.63Å; V674-M837 HydrophobicContact CG1-SD 4.26Å
675	S	86.1	Confident	74	Confident	13 Å²	13	52.6 Å²	52.6	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-56	-41.9	176.5	-59.9	0	0	0	0	112.1	C671 S672 R677 F678 R679 L680 L833	C671-S675 WeakPolarHBondContact O-CB 3.3Å; C671-S675 PolarHBondContact O-N 3.42Å; C671-S675 PolarHBondContact O-OG 3.11Å; S672-S675 PolarHBondContact O-N 2.95Å; S675-R677 VanDerWaalsContact C-N 3.3Å; S675-R677 PolarHBondContact O-N 3.25Å; S675-F678 PolarHBondContact O-N 3.47Å; S675-R679 PolarHBondContact O-N 2.65Å; S675-L680 PolarHBondContact O-N 3.2Å; S675-L833 WeakPolarHBondContact OG-CD1 3.44Å
676	S	80.9	Confident	70.9	Confident	22 Å²	22	57.2 Å²	57.2	15%	0.154	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-30.3	177.6	82.5	0	0	0	0	113.3	R581 S672 I673 V674	R581-S676 WeakPolarHBondContact CG-O 3.21Å; S672-S676 WeakPolarHBondContact O-CB 3.49Å; S672-S676 PolarHBondContact O-N 3.03Å; I673-S676 PolarHBondContact O-N 2.98Å; I673-S676 PolarHBondContact O-OG 3.37Å; V674-S676 VanDerWaalsContact C-N 3.27Å; V674-S676 PolarHBondContact O-N 3Å
677	R	81.8	Confident	67.6	Low	42 Å²	42	64.7 Å²	64.7	16%	0.158	34%	0.341	C	S	.	.	H	α-helix	trans	-73.4	-34.2	177.6	-172.3	61.2	174	78.4	-10.6	112.8	R581 M583 W588 I673 V674 S675	R581-R677 VanDerWaalsContact O-CZ 3.25Å; R581-R677 PolarHBondContact O-NE 3.37Å; R581-R677 PolarHBondContact O-NH2 3.5Å; M583-R677 PolarHBondContact O-NH2 2.94Å; M583-R677 VanDerWaalsContact O-NH2 3.13Å; W588-R677 HydrophobicContact CD2-CG 4.11Å; W588-R677 HydrophobicContact CE3-CG 4.44Å; W588-R677 HydrophobicContact CH2-CB 4.07Å; W588-R677 HydrophobicContact CH2-CG 3.92Å; W588-R677 HydrophobicContact CZ2-CB 3.47Å; W588-R677 VanDerWaalsContact CZ2-CB 3.47Å; W588-R677 HydrophobicContact CZ2-CG 3.53Å; W588-R677 HydrophobicContact CZ3-CG 4.36Å; I673-R677 PolarHBondContact O-N 3.29Å; V674-R677 WeakPolarHBondContact O-CB 3.4Å; V674-R677 PolarHBondContact O-N 3.19Å; S675-R677 VanDerWaalsContact C-N 3.3Å; S675-R677 PolarHBondContact O-N 3.25Å
678	F	80.9	Confident	64.4	Low	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-98.4	2.5	-179.9	-70.8	-84.2	0	0	0	114.3	W588 V674 S675 L680 V722 F723 F726 L734 M837	W588-F678 AromaticContact CH2-CE2 3.9Å; W588-F678 HydrophobicContact CH2-CE2 3.9Å; W588-F678 HydrophobicContact CZ3-CE2 4.27Å; V674-F678 HydrophobicContact CG1-CD2 4.02Å; V674-F678 HydrophobicContact CG1-CE2 4.24Å; V674-F678 WeakPolarHBondContact O-CD2 3.48Å; V674-F678 PolarHBondContact O-N 3.31Å; S675-F678 PolarHBondContact O-N 3.47Å; F678-L680 HydrophobicContact CB-CD1 4.03Å; F678-L680 HydrophobicContact CB-CG 3.89Å; F678-L680 PolarHBondContact O-N 2.89Å; F678-V722 HydrophobicContact CD1-CG1 3.97Å; F678-V722 HydrophobicContact CE1-CG1 4.41Å; F678-F723 HydrophobicContact CD1-CD1 4.2Å; F678-F723 AromaticContact CD1-CE1 3.72Å; F678-F723 HydrophobicContact CD1-CE1 3.72Å; F678-F723 HydrophobicContact CD1-CE2 4.37Å; F678-F723 AromaticContact CD1-CZ 3.82Å; F678-F723 HydrophobicContact CD1-CZ 3.82Å; F678-F723 HydrophobicContact CE1-CD1 4.15Å; F678-F723 AromaticContact CE1-CE1 3.89Å; F678-F723 HydrophobicContact CE1-CE1 3.89Å; F678-F723 HydrophobicContact CE1-CZ 4.45Å; F678-F726 HydrophobicContact CE1-CD1 4.41Å; F678-F726 HydrophobicContact CE1-CD2 4.3Å; F678-F726 HydrophobicContact CE1-CG 4.21Å; F678-F726 HydrophobicContact CZ-CD1 4.15Å; F678-F726 HydrophobicContact CZ-CD2 4.03Å; F678-F726 AromaticContact CZ-CE1 3.99Å; F678-F726 HydrophobicContact CZ-CE1 3.99Å; F678-F726 AromaticContact CZ-CE2 3.88Å; F678-F726 HydrophobicContact CZ-CE2 3.88Å; F678-F726 HydrophobicContact CZ-CG 4.17Å; F678-F726 AromaticContact CZ-CZ 3.88Å; F678-F726 HydrophobicContact CZ-CZ 3.88Å; F678-L734 HydrophobicContact CE2-CD2 3.53Å; F678-L734 HydrophobicContact CZ-CD2 3.73Å; F678-M837 HydrophobicContact CB-CE 4.34Å; F678-M837 HydrophobicContact CD1-CE 3.62Å; F678-M837 HydrophobicContact CD2-CE 3.44Å; F678-M837 VanDerWaalsContact CD2-CE 3.44Å; F678-M837 HydrophobicContact CD2-SD 4.35Å; F678-M837 HydrophobicContact CE1-CE 3.67Å; F678-M837 HydrophobicContact CE2-CE 3.51Å; F678-M837 HydrophobicContact CG-CE 3.51Å; F678-M837 HydrophobicContact CZ-CE 3.62Å
679	R	70.8	Confident	61.4	Low	129 Å²	129	69.5 Å²	69.5	49%	0.487	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	27.9	-177.7	-57.5	175.2	170.8	-178.9	-6.1	113.8	S675 G681 F718 V722	S675-R679 PolarHBondContact O-N 2.65Å; R679-G681 PolarHBondContact O-N 3.12Å; R679-F718 WeakPolarHBondContact CD-O 3.17Å; R679-V722 HydrophobicContact CG-CG2 4.35Å
680	L	69	Low	58.5	Low	23 Å²	23	71.7 Å²	71.7	12%	0.12	41%	0.405	C	S	.	.			trans	-65.6	130	176.9	-61.7	170.1	0	0	0	108.5	S675 F678 S682 L833 M837 L840	S675-L680 PolarHBondContact O-N 3.2Å; F678-L680 HydrophobicContact CB-CD1 4.03Å; F678-L680 HydrophobicContact CB-CG 3.89Å; F678-L680 PolarHBondContact O-N 2.89Å; L680-S682 PolarHBondContact O-N 3.41Å; L680-L833 HydrophobicContact CD1-CD1 3.59Å; L680-L833 HydrophobicContact CD1-CG 4.37Å; L680-M837 HydrophobicContact CD1-CG 3.67Å; L680-M837 HydrophobicContact CD1-SD 4.15Å; L680-L840 HydrophobicContact CD2-CD1 3.38Å
681	G	53.4	Low	55.3	Low	41 Å²	41	77.7 Å²	77.7	42%	0.423	44%	0.437	S	S	.	.			trans	-56.9	137.3	-176.7	0	0	0	0	0	111	R679 I683	R679-G681 PolarHBondContact O-N 3.12Å; G681-I683 PolarHBondContact O-N 3.33Å
682	S	39.3	Very low	52.4	Low	103 Å²	103	85.6 Å²	85.6	72%	0.72	48%	0.478	S	S	*	.			trans	-56.8	109.2	-167.3	-164.2	0	0	0	0	112.4	L680 Q684	L680-S682 PolarHBondContact O-N 3.41Å; S682-Q684 PolarHBondContact O-N 2.98Å
683	I	38.9	Very low	49.5	Very low	99 Å²	99	86.6 Å²	86.6	51%	0.508	49%	0.485	S	S	.	.			trans	-55.4	125.4	160.3	-59.4	175.3	0	0	0	105.9	G681 S685 L833	G681-I683 PolarHBondContact O-N 3.33Å; I683-S685 PolarHBondContact O-N 2.9Å; I683-L833 HydrophobicContact CD1-CD1 4.47Å
684	Q	29.4	Very low	46.6	Very low	162 Å²	162	92.3 Å²	92.3	76%	0.757	52%	0.52	S	S	*	.			trans	-42.1	131.6	-155.5	-66.6	173.8	-7.2	0	0	114.2	S682 M686	S682-Q684 PolarHBondContact O-N 2.98Å; Q684-M686 PolarHBondContact O-N 3Å
685	S	27	Very low	43.4	Very low	98 Å²	98	99.1 Å²	99.1	69%	0.685	56%	0.557	S	S	*	*			trans	-67.4	74.7	-177.5	56.7	0	0	0	0	112.6	I683 E687	I683-S685 PolarHBondContact O-N 2.9Å; S685-E687 PolarHBondContact O-N 3.03Å
686	M	23.9	Very low	40.5	Very low	161 Å²	161	104.3 Å²	104.3	79%	0.793	59%	0.593	S	S	*	*			trans	-83.8	60.7	161.8	-70.4	-70.5	161	0	0	108.8	Q684 P688	Q684-M686 PolarHBondContact O-N 3Å; M686-P688 WeakPolarHBondContact O-CD 3.48Å
687	E	24.7	Very low	38.3	Very low	157 Å²	157	108.6 Å²	108.6	73%	0.734	62%	0.62	S	S	*	*			trans	-73.6	116.2	158.9	-73.5	-166.5	125.4	0	0	107.8	S685 T689	S685-E687 PolarHBondContact O-N 3.03Å; E687-T689 VanDerWaalsContact C-N 3.3Å; E687-T689 HydrophobicContact CB-CG2 4.47Å; E687-T689 PolarHBondContact O-N 3.23Å
688	P	26	Very low	35.5	Very low	116 Å²	116	113.8 Å²	113.8	75%	0.753	65%	0.651	S	S	*	*			trans	-69.3	97.6	156.9	30.1	-30.2	0	0	0	106.4	M686 V690	M686-P688 WeakPolarHBondContact O-CD 3.48Å; P688-V690 PolarHBondContact O-N 2.99Å
689	T	26	Very low	32.9	Very low	101 Å²	101	122.3 Å²	122.3	62%	0.62	70%	0.696	S	S	*	*			trans	-63.1	97.1	178.8	49.1	0	0	0	0	109.8	E687 D691	E687-T689 VanDerWaalsContact C-N 3.3Å; E687-T689 HydrophobicContact CB-CG2 4.47Å; E687-T689 PolarHBondContact O-N 3.23Å; T689-D691 PolarHBondContact O-N 3.05Å
690	V	28.7	Very low	30.7	Very low	132 Å²	132	125 Å²	125	80%	0.8	71%	0.714	S	S	*	*			trans	-79.6	100.1	166.7	179.2	0	0	0	0	106.4	P688 L692	P688-V690 PolarHBondContact O-N 2.99Å; V690-L692 PolarHBondContact O-N 3.03Å
691	D	24.2	Very low	28.6	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	75%	0.749	S	S	*	*			trans	-56	122.5	-163.5	-65.6	-53.4	0	0	0	114	T689	T689-D691 PolarHBondContact O-N 3.05Å
692	L	27.9	Very low	27.2	Very low	176 Å²	176	142.2 Å²	142.2	92%	0.921	77%	0.772	S	S	*	*			trans	-110.2	44.3	169.9	-82.7	171	0	0	0	111.2	V690	V690-L692 PolarHBondContact O-N 3.03Å
693	S	24.4	Very low	26.4	Very low	99 Å²	99	145.7 Å²	145.7	69%	0.692	78%	0.777	S	S	*	*			trans	-145.1	120	172.1	57.2	0	0	0	0	111.9
694	V	25.8	Very low	25.8	Very low	132 Å²	132	149.4 Å²	149.4	80%	0.8	80%	0.797	S	S	*	*			trans	-77.3	127.7	177.7	173.6	0	0	0	0	110.6
695	N	22.5	Very low	25.5	Very low	146 Å²	146	146.7 Å²	146.7	78%	0.781	80%	0.796	S	S	*	*			trans	44	102.6	160.3	-60.7	-18.2	0	0	0	118.7
696	S	25.7	Very low	25.4	Very low	123 Å²	123	146.9 Å²	146.9	86%	0.86	80%	0.804	S	S	*	*			trans	-153.4	119.7	144.8	-80.1	0	0	0	0	110.3
697	P	33.8	Very low	25.5	Very low	112 Å²	112	145.6 Å²	145.6	73%	0.727	81%	0.805	S	S	*	*			trans	-88.1	161.3	-175.7	34.9	-35.4	0	0	0	113.3
698	N	23.5	Very low	25.6	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	80%	0.803	S	S	*	*			trans	69.7	106.5	170.5	-51.7	-44.5	0	0	0	117.3
699	L	25.7	Very low	25.7	Very low	180 Å²	180	144.8 Å²	144.8	94%	0.942	81%	0.805	S	S	*	*				-148.5	155.9	117.5	-135.2	83.1	0	0	0	110.4
700	Q	25.2	Very low	25.7	Very low	186 Å²	186	147.6 Å²	147.6	87%	0.869	81%	0.814	S	S	*	*			trans	-91.5	159.3	-170.4	-70.7	172.9	-29	0	0	113.5
701	Q	24.2	Very low	25.5	Very low	182 Å²	182	147 Å²	147	85%	0.85	81%	0.806	S	S	*	*			trans	-53.2	134.6	-179.1	-65.8	165.7	-30.5	0	0	112.7
702	R	23.6	Very low	25.9	Very low	242 Å²	242	147 Å²	147	91%	0.913	80%	0.804	S	S	*	*			trans	-118.2	134.6	157.1	-76.6	-172.2	173.2	-177.9	-1.1	109.1
703	H	23.5	Very low	26.2	Very low	177 Å²	177	142 Å²	142	82%	0.819	78%	0.784	S	S	*	*			trans	-72.5	139.6	-174.5	-72.2	-100.3	0	0	0	111.8	S705	H703-S705 PolarHBondContact O-N 3.35Å
704	L	25.6	Very low	26.4	Very low	176 Å²	176	141 Å²	141	92%	0.921	78%	0.777	S	S	*	*			trans	-71.5	111	174.4	-71	158.7	0	0	0	110.2
705	S	23.1	Very low	26.8	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-78.4	153.3	157.9	48.1	0	0	0	0	109.9	H703 T707	H703-S705 PolarHBondContact O-N 3.35Å; S705-T707 PolarHBondContact O-N 2.9Å
706	A	25.6	Very low	27.7	Very low	103 Å²	103	132.6 Å²	132.6	85%	0.851	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-64.5	119.8	-172.8	0	0	0	0	0	111.9	S708	A706-S708 PolarHBondContact O-N 3.29Å
707	T	26.5	Very low	28.2	Very low	133 Å²	133	133 Å²	133	82%	0.816	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-63.5	125.6	169.5	46.4	0	0	0	0	109.8	S705	S705-T707 PolarHBondContact O-N 2.9Å
708	S	25.7	Very low	28.4	Very low	101 Å²	101	133.9 Å²	133.9	71%	0.706	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-57.4	149.8	172.3	49	0	0	0	0	111.4	A706 M710	A706-S708 PolarHBondContact O-N 3.29Å; S708-M710 PolarHBondContact O-N 3.25Å; S708-M710 VanDerWaalsContact O-N 3.1Å
709	I	27.8	Very low	29.5	Very low	155 Å²	155	126.9 Å²	126.9	80%	0.795	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-56.6	116.2	167.2	-61.2	167.9	0	0	0	107.2	D711	I709-D711 PolarHBondContact O-N 2.87Å
710	M	26	Very low	30.7	Very low	161 Å²	161	120.1 Å²	120.1	79%	0.793	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-64.2	130.6	168.6	-84.7	-74.9	-151.5	0	0	108.5	S708 I712	S708-M710 PolarHBondContact O-N 3.25Å; S708-M710 VanDerWaalsContact O-N 3.1Å; M710-I712 PolarHBondContact O-N 3.47Å
711	D	25.7	Very low	31.9	Very low	118 Å²	118	119.4 Å²	119.4	63%	0.631	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-60.1	127.2	-179.5	-75.4	-59	0	0	0	111.5	I709 S713 C714	I709-D711 PolarHBondContact O-N 2.87Å; D711-S713 PolarHBondContact O-N 2.96Å; D711-S713 VanDerWaalsContact O-N 3.1Å; D711-C714 PolarHBondContact O-N 3.49Å; D711-C714 VanDerWaalsContact O-N 3.07Å
712	I	33.1	Very low	33.5	Very low	130 Å²	130	111.4 Å²	111.4	67%	0.667	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	-26.2	-175.2	-65.2	171	0	0	0	111.6	M710 C714 I715 T716	M710-I712 PolarHBondContact O-N 3.47Å; I712-C714 PolarHBondContact O-N 3.37Å; I712-I715 PolarHBondContact O-N 3.47Å; I712-I715 VanDerWaalsContact O-N 3.14Å; I712-T716 PolarHBondContact O-N 3.29Å
713	S	33.4	Very low	35.5	Very low	70 Å²	70	101 Å²	101	49%	0.49	55%	0.553	S	S	.	*	H	α-helix	trans	-57	-30.2	175.4	53	0	0	0	0	114.2	D711 I715 T716 M717	D711-S713 PolarHBondContact O-N 2.96Å; D711-S713 VanDerWaalsContact O-N 3.1Å; S713-I715 VanDerWaalsContact C-N 3.34Å; S713-T716 PolarHBondContact O-OG1 3.44Å; S713-M717 VanDerWaalsContact O-CG 3.32Å; S713-M717 WeakPolarHBondContact O-CG 3.25Å
714	C	29.1	Very low	37.3	Very low	80 Å²	80	97.8 Å²	97.8	54%	0.541	54%	0.542	S	S	.	.	H	α-helix	trans	-72.8	-26	179.2	-72	0	0	0	0	112.9	D711 I712	D711-C714 PolarHBondContact O-N 3.49Å; D711-C714 VanDerWaalsContact O-N 3.07Å; I712-C714 PolarHBondContact O-N 3.37Å
715	I	34.4	Very low	39.4	Very low	77 Å²	77	96.8 Å²	96.8	40%	0.395	53%	0.53	S	S	.	.	H	α-helix	trans	-80	-40.5	179	-60.6	178.1	0	0	0	110.4	I712 S713 M717 F718 S719	I712-I715 PolarHBondContact O-N 3.47Å; I712-I715 VanDerWaalsContact O-N 3.14Å; S713-I715 VanDerWaalsContact C-N 3.34Å; I715-M717 PolarHBondContact O-N 3.05Å; I715-F718 PolarHBondContact O-N 2.84Å; I715-S719 PolarHBondContact O-N 3.13Å
716	T	40.9	Very low	42	Very low	23 Å²	23	93 Å²	93	14%	0.141	50%	0.5	C	S	.	.	H	α-helix	trans	-60	-48.6	-179.1	46.4	0	0	0	0	112	I712 S713 F718 S719 D720	I712-T716 PolarHBondContact O-N 3.29Å; S713-T716 PolarHBondContact O-OG1 3.44Å; T716-F718 PolarHBondContact O-N 2.86Å; T716-S719 WeakPolarHBondContact O-CB 3.09Å; T716-S719 PolarHBondContact O-N 3.48Å; T716-D720 PolarHBondContact O-N 3.49Å
717	M	36.5	Very low	44.7	Very low	132 Å²	132	91.6 Å²	91.6	65%	0.65	48%	0.481	S	S	*	.	H	α-helix	trans	-57.5	-24.6	-174.4	-65.3	-88.6	76.4	0	0	115	S713 I715 D720	S713-M717 VanDerWaalsContact O-CG 3.32Å; S713-M717 WeakPolarHBondContact O-CG 3.25Å; I715-M717 PolarHBondContact O-N 3.05Å; M717-D720 WeakPolarHBondContact CA-OD2 3.29Å; M717-D720 WeakPolarHBondContact CE-OD2 3.42Å
718	F	37.3	Very low	47.4	Very low	130 Å²	130	90.6 Å²	90.6	57%	0.57	46%	0.463	S	S	*	.	H	α-helix	trans	-97.5	-17.6	177.6	-74.2	-70.3	0	0	0	114.3	R679 I715 T716	R679-F718 WeakPolarHBondContact CD-O 3.17Å; I715-F718 PolarHBondContact O-N 2.84Å; T716-F718 PolarHBondContact O-N 2.86Å
719	S	47.4	Very low	50.1	Low	4 Å²	4	90 Å²	90	3%	0.028	46%	0.459	C	S	.	.	H	α-helix	trans	-71.7	-40.6	173.1	131.7	0	0	0	0	111.1	I715 T716 Y721 V722	I715-S719 PolarHBondContact O-N 3.13Å; T716-S719 WeakPolarHBondContact O-CB 3.09Å; T716-S719 PolarHBondContact O-N 3.48Å; S719-Y721 PolarHBondContact O-N 3.04Å; S719-V722 PolarHBondContact O-N 3.17Å
720	D	49.5	Very low	52.9	Low	38 Å²	38	84.8 Å²	84.8	20%	0.203	43%	0.432	C	S	.	.	H	α-helix	trans	-52.6	-39.1	-168.1	-59.9	-30.8	0	0	0	113.3	T716 M717 V722 R844	T716-D720 PolarHBondContact O-N 3.49Å; M717-D720 WeakPolarHBondContact CA-OD2 3.29Å; M717-D720 WeakPolarHBondContact CE-OD2 3.42Å; D720-V722 PolarHBondContact O-N 3.28Å; D720-R844 PolarHBondContact O-NH1 3.45Å
721	Y	52.2	Low	55.9	Low	170 Å²	170	77.4 Å²	77.4	67%	0.667	40%	0.396	S	S	*	.	H	α-helix	trans	-80.4	-8.1	-176.6	-145.2	-90.9	0	0	0	115.2	S719	S719-Y721 PolarHBondContact O-N 3.04Å
722	V	56.5	Low	58.7	Low	15 Å²	15	76.1 Å²	76.1	9%	0.091	38%	0.382	C	S	.	.	H	α-helix	trans	-97.3	-45.9	-174.5	-172.9	0	0	0	0	112	F678 R679 S719 D720 D724 K725	F678-V722 HydrophobicContact CD1-CG1 3.97Å; F678-V722 HydrophobicContact CE1-CG1 4.41Å; R679-V722 HydrophobicContact CG-CG2 4.35Å; S719-V722 PolarHBondContact O-N 3.17Å; D720-V722 PolarHBondContact O-N 3.28Å; V722-D724 VanDerWaalsContact C-N 3.25Å; V722-D724 PolarHBondContact O-N 3.49Å; V722-K725 PolarHBondContact O-N 2.9Å
723	F	65.3	Low	61.3	Low	23 Å²	23	73.2 Å²	73.2	10%	0.101	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-32.1	179.1	-72.9	-76.1	0	0	0	112.4	F678 K725 F726 M837 I841	F678-F723 HydrophobicContact CD1-CD1 4.2Å; F678-F723 AromaticContact CD1-CE1 3.72Å; F678-F723 HydrophobicContact CD1-CE1 3.72Å; F678-F723 HydrophobicContact CD1-CE2 4.37Å; F678-F723 AromaticContact CD1-CZ 3.82Å; F678-F723 HydrophobicContact CD1-CZ 3.82Å; F678-F723 HydrophobicContact CE1-CD1 4.15Å; F678-F723 AromaticContact CE1-CE1 3.89Å; F678-F723 HydrophobicContact CE1-CE1 3.89Å; F678-F723 HydrophobicContact CE1-CZ 4.45Å; F723-K725 PolarHBondContact O-N 2.71Å; F723-F726 PolarHBondContact O-N 3.32Å; F723-M837 HydrophobicContact CE1-CE 3.86Å; F723-M837 HydrophobicContact CZ-CB 4.5Å; F723-M837 HydrophobicContact CZ-CE 4.09Å; F723-M837 HydrophobicContact CZ-CG 4.43Å; F723-I841 HydrophobicContact CD1-CD1 3.93Å; F723-I841 HydrophobicContact CD1-CG1 3.93Å; F723-I841 HydrophobicContact CE1-CD1 3.78Å; F723-I841 HydrophobicContact CE1-CG1 3.92Å; F723-I841 HydrophobicContact CG-CG1 4.4Å; F723-I841 HydrophobicContact CZ-CG1 4.37Å
724	D	62.4	Low	64	Low	109 Å²	109	69.9 Å²	69.9	58%	0.583	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-12.1	178.7	-66.1	1.1	0	0	0	113.7	V722 R844	V722-D724 VanDerWaalsContact C-N 3.25Å; V722-D724 PolarHBondContact O-N 3.49Å; D724-R844 IonicContact OD1-CZ 2.94Å; D724-R844 IonicContact OD1-NH1 2.82Å; D724-R844 PolarHBondContact OD1-NH1 2.89Å; D724-R844 IonicContact OD1-NH2 2.65Å; D724-R844 PolarHBondContact OD1-NH2 2.86Å; D724-R844 IonicContact OD2-CZ 3.04Å; D724-R844 IonicContact OD2-NH1 3.35Å; D724-R844 IonicContact OD2-NH2 3.34Å; D724-R844 PolarHBondContact OD2-NH2 2.72Å
725	K	69.5	Low	66.8	Low	156 Å²	156	66.2 Å²	66.2	68%	0.678	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	3.3	173.9	-62	-171.1	177.9	-172	0	113.6	V722 F723	V722-K725 PolarHBondContact O-N 2.9Å; F723-K725 PolarHBondContact O-N 2.71Å
726	F	77.2	Confident	69.4	Low	24 Å²	24	67.4 Å²	67.4	11%	0.105	32%	0.32	C	S	.	.	S	Bend	trans	-115.8	119.5	-175.7	-142.3	-103.9	0	0	0	109.6	C585 W588 M589 F678 F723 N730 F731 L734	C585-F726 WeakPolarHBondContact SG-CE2 3.43Å; W588-F726 HydrophobicContact CZ3-CE2 4.35Å; W588-F726 HydrophobicContact CZ3-CZ 4.18Å; M589-F726 HydrophobicContact SD-CZ 4.19Å; F678-F726 HydrophobicContact CE1-CD1 4.41Å; F678-F726 HydrophobicContact CE1-CD2 4.3Å; F678-F726 HydrophobicContact CE1-CG 4.21Å; F678-F726 HydrophobicContact CZ-CD1 4.15Å; F678-F726 HydrophobicContact CZ-CD2 4.03Å; F678-F726 AromaticContact CZ-CE1 3.99Å; F678-F726 HydrophobicContact CZ-CE1 3.99Å; F678-F726 AromaticContact CZ-CE2 3.88Å; F678-F726 HydrophobicContact CZ-CE2 3.88Å; F678-F726 HydrophobicContact CZ-CG 4.17Å; F678-F726 AromaticContact CZ-CZ 3.88Å; F678-F726 HydrophobicContact CZ-CZ 3.88Å; F723-F726 PolarHBondContact O-N 3.32Å; F726-N730 HydrophobicContact CD1-CB 3.99Å; F726-N730 VanDerWaalsContact CE1-C 3.41Å; F726-N730 HydrophobicContact CE1-CB 3.73Å; F726-N730 WeakPolarHBondContact CE1-O 3.35Å; F726-N730 HydrophobicContact CZ-CB 4.05Å; F726-F731 HydrophobicContact CD1-CB 4.07Å; F726-F731 HydrophobicContact CE1-CB 4.33Å; F726-L734 HydrophobicContact CE1-CB 4.29Å; F726-L734 HydrophobicContact CE1-CD2 4.07Å; F726-L734 HydrophobicContact CZ-CD2 4.11Å
727	T	82.5	Confident	71.6	Confident	75 Å²	75	67 Å²	67	46%	0.46	32%	0.316	S	S	.	.			trans	-73.7	154	-179.1	75.5	0	0	0	0	111	S729 N730 F731	T727-S729 PolarHBondContact O-N 3.02Å; T727-N730 PolarHBondContact O-N 2.79Å; T727-N730 PolarHBondContact OG1-N 2.93Å; T727-N730 VanDerWaalsContact OG1-N 3.12Å; T727-N730 PolarHBondContact OG1-OD1 2.64Å; T727-F731 PolarHBondContact O-N 3.11Å
728	W	83.8	Confident	74.3	Confident	112 Å²	112	61 Å²	61	42%	0.424	29%	0.287	S	S	.	.	H	α-helix	trans	-56	-35.2	173.6	-63.8	108.7	0	0	0	112.8	F731 R732 I841 L946 K949 L950	W728-F731 PolarHBondContact O-N 3.28Å; W728-R732 PolarHBondContact O-N 2.84Å; W728-I841 HydrophobicContact CH2-CG2 3.67Å; W728-I841 HydrophobicContact CZ3-CG2 3.98Å; W728-L946 HydrophobicContact CH2-CD1 3.53Å; W728-L946 HydrophobicContact CZ2-CD1 4.16Å; W728-L946 HydrophobicContact CZ3-CD1 4.12Å; W728-K949 HydrophobicContact CD2-CB 4.15Å; W728-K949 HydrophobicContact CD2-CD 4.25Å; W728-K949 HydrophobicContact CE3-CB 4.18Å; W728-K949 HydrophobicContact CG-CB 4.35Å; W728-K949 HydrophobicContact CG-CD 4.22Å; W728-L950 HydrophobicContact CZ3-CD2 3.76Å; W728-L950 HydrophobicContact CZ3-CG 4.34Å
729	S	82.3	Confident	76.7	Confident	89 Å²	89	55.1 Å²	55.1	62%	0.622	26%	0.262	S	S	*	.	H	α-helix	trans	-61.7	-48.9	174.1	-167.3	0	0	0	0	111.3	T727 F731 R732 E733	T727-S729 PolarHBondContact O-N 3.02Å; S729-F731 VanDerWaalsContact C-N 3.29Å; S729-F731 PolarHBondContact O-N 2.94Å; S729-R732 PolarHBondContact O-N 2.79Å; S729-E733 PolarHBondContact O-N 2.92Å
730	N	86	Confident	78.6	Confident	44 Å²	44	58 Å²	58	24%	0.235	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-34	179.7	-60.9	9.8	0	0	0	111	C585 F726 T727 L734	C585-N730 PolarHBondContact SG-ND2 3.35Å; F726-N730 HydrophobicContact CD1-CB 3.99Å; F726-N730 VanDerWaalsContact CE1-C 3.41Å; F726-N730 HydrophobicContact CE1-CB 3.73Å; F726-N730 WeakPolarHBondContact CE1-O 3.35Å; F726-N730 HydrophobicContact CZ-CB 4.05Å; T727-N730 PolarHBondContact O-N 2.79Å; T727-N730 PolarHBondContact OG1-N 2.93Å; T727-N730 VanDerWaalsContact OG1-N 3.12Å; T727-N730 PolarHBondContact OG1-OD1 2.64Å; N730-L734 WeakPolarHBondContact O-CB 3.45Å; N730-L734 PolarHBondContact O-N 2.9Å
731	F	88.4	Confident	80.6	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.026	27%	0.267	C	S	.	.	H	α-helix	trans	-67.5	-46.5	174.6	-172.5	-119.5	0	0	0	112.8	F726 T727 W728 S729 E733 L734 V735 M837 I838 I841 L950 P951	F726-F731 HydrophobicContact CD1-CB 4.07Å; F726-F731 HydrophobicContact CE1-CB 4.33Å; T727-F731 PolarHBondContact O-N 3.11Å; W728-F731 PolarHBondContact O-N 3.28Å; S729-F731 VanDerWaalsContact C-N 3.29Å; S729-F731 PolarHBondContact O-N 2.94Å; F731-E733 VanDerWaalsContact C-N 3.29Å; F731-E733 PolarHBondContact O-N 3.19Å; F731-L734 PolarHBondContact O-N 3.17Å; F731-V735 HydrophobicContact CD2-CG2 4.34Å; F731-V735 HydrophobicContact CE1-CG2 4.23Å; F731-V735 HydrophobicContact CE2-CG2 3.85Å; F731-V735 HydrophobicContact CZ-CG2 3.81Å; F731-V735 WeakPolarHBondContact O-CG2 3.26Å; F731-V735 PolarHBondContact O-N 2.85Å; F731-M837 HydrophobicContact CD2-CE 4.42Å; F731-M837 HydrophobicContact CE2-CB 4.12Å; F731-M837 HydrophobicContact CE2-CE 3.86Å; F731-M837 HydrophobicContact CZ-CB 4.16Å; F731-I838 HydrophobicContact CE1-CG1 3.96Å; F731-I838 HydrophobicContact CZ-CG1 3.87Å; F731-I841 HydrophobicContact CD1-CD1 4.16Å; F731-I841 HydrophobicContact CE1-CD1 3.71Å; F731-I841 HydrophobicContact CE2-CD1 4.14Å; F731-I841 HydrophobicContact CZ-CD1 3.7Å; F731-L950 HydrophobicContact CD1-CD2 4.29Å; F731-L950 HydrophobicContact CE1-CD2 3.84Å; F731-P951 HydrophobicContact CD1-CG 4.38Å; F731-P951 HydrophobicContact CE1-CG 4.12Å
732	R	86.1	Confident	82.4	Confident	92 Å²	92	48.1 Å²	48.1	35%	0.347	24%	0.235	S	C	.	.	H	α-helix	trans	-60.9	-39.1	175.5	-177.8	171.4	-100.7	-100.9	-0.1	111.3	W728 S729 K736 L950 P951 E1026	W728-R732 PolarHBondContact O-N 2.84Å; S729-R732 PolarHBondContact O-N 2.79Å; R732-K736 VanDerWaalsContact O-CB 3.28Å; R732-K736 WeakPolarHBondContact O-CB 3.36Å; R732-K736 PolarHBondContact O-N 3.16Å; R732-L950 PolarHBondContact NH2-O 3.13Å; R732-P951 HydrophobicContact CG-CB 4.5Å; R732-E1026 IonicContact CZ-OE2 2.72Å; R732-E1026 VanDerWaalsContact CZ-OE2 3.31Å; R732-E1026 IonicContact NH1-OE2 2.69Å; R732-E1026 PolarHBondContact NH1-OE2 3.38Å; R732-E1026 IonicContact NH2-OE2 3.09Å; R732-E1026 PolarHBondContact NH2-OE2 3.32Å
733	E	86.8	Confident	83.9	Confident	69 Å²	69	47.5 Å²	47.5	32%	0.322	23%	0.231	S	C	.	.	H	α-helix	trans	-69.9	-38.1	175.8	-168.6	56.1	-143	0	0	112.7	M589 S729 F731 K736 I737	M589-E733 HydrophobicContact CE-CB 3.85Å; M589-E733 HydrophobicContact CE-CG 3.84Å; S729-E733 PolarHBondContact O-N 2.92Å; F731-E733 VanDerWaalsContact C-N 3.29Å; F731-E733 PolarHBondContact O-N 3.19Å; E733-K736 WeakPolarHBondContact O-CB 3.37Å; E733-K736 PolarHBondContact O-N 3.13Å; E733-K736 IonicContact OE1-NZ 2.86Å; E733-K736 PolarHBondContact OE1-NZ 3.42Å; E733-K736 IonicContact OE2-NZ 3.19Å; E733-K736 PolarHBondContact OE2-NZ 3.13Å; E733-I737 HydrophobicContact CG-CD1 4.15Å; E733-I737 WeakPolarHBondContact O-CD1 3.47Å; E733-I737 VanDerWaalsContact O-CG1 3.3Å; E733-I737 WeakPolarHBondContact O-CG1 3.3Å; E733-I737 PolarHBondContact O-N 3.3Å
734	L	90	Very high	84.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-48	175.9	174.6	62.1	0	0	0	111.3	W588 M589 L592 F678 F726 N730 F731 K736 I737 M738 M837	W588-L734 HydrophobicContact CH2-CD1 4.05Å; W588-L734 HydrophobicContact CH2-CD2 4.34Å; W588-L734 HydrophobicContact CZ3-CD1 3.99Å; W588-L734 HydrophobicContact CZ3-CD2 4.26Å; M589-L734 HydrophobicContact CE-CB 4.07Å; M589-L734 HydrophobicContact SD-CB 4.12Å; M589-L734 HydrophobicContact SD-CD1 4.24Å; L592-L734 HydrophobicContact CD1-CD1 3.81Å; F678-L734 HydrophobicContact CE2-CD2 3.53Å; F678-L734 HydrophobicContact CZ-CD2 3.73Å; F726-L734 HydrophobicContact CE1-CB 4.29Å; F726-L734 HydrophobicContact CE1-CD2 4.07Å; F726-L734 HydrophobicContact CZ-CD2 4.11Å; N730-L734 WeakPolarHBondContact O-CB 3.45Å; N730-L734 PolarHBondContact O-N 2.9Å; F731-L734 PolarHBondContact O-N 3.17Å; L734-K736 VanDerWaalsContact C-N 3.28Å; L734-K736 PolarHBondContact O-N 3.03Å; L734-I737 PolarHBondContact O-N 3.1Å; L734-M738 HydrophobicContact CD1-CG 4.33Å; L734-M738 HydrophobicContact CD1-SD 3.82Å; L734-M738 HydrophobicContact CG-SD 3.86Å; L734-M738 WeakPolarHBondContact O-CB 3.47Å; L734-M738 WeakPolarHBondContact O-CG 3.37Å; L734-M738 PolarHBondContact O-N 3.42Å; L734-M837 HydrophobicContact CD2-CE 4.16Å
735	V	88.8	Confident	86.2	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-63.3	-36	176.7	175.6	0	0	0	0	111	F731 M738 S739 A834 P951 Y1044	F731-V735 HydrophobicContact CD2-CG2 4.34Å; F731-V735 HydrophobicContact CE1-CG2 4.23Å; F731-V735 HydrophobicContact CE2-CG2 3.85Å; F731-V735 HydrophobicContact CZ-CG2 3.81Å; F731-V735 WeakPolarHBondContact O-CG2 3.26Å; F731-V735 PolarHBondContact O-N 2.85Å; V735-M738 PolarHBondContact O-N 2.97Å; V735-S739 VanDerWaalsContact O-CB 3.29Å; V735-S739 WeakPolarHBondContact O-CB 3.38Å; V735-S739 PolarHBondContact O-N 3.38Å; V735-S739 PolarHBondContact O-OG 3.35Å; V735-A834 HydrophobicContact CG1-CB 4.15Å; V735-A834 HydrophobicContact CG2-CB 4.12Å; V735-P951 HydrophobicContact CB-CB 4.29Å; V735-P951 HydrophobicContact CB-CG 3.73Å; V735-P951 HydrophobicContact CG1-CB 4.01Å; V735-P951 HydrophobicContact CG1-CG 3.76Å; V735-P951 HydrophobicContact CG2-CG 3.75Å; V735-Y1044 WeakPolarHBondContact CG1-OH 3.35Å
736	K	87.4	Confident	86.9	Confident	102 Å²	102	36 Å²	36	44%	0.443	18%	0.176	S	C	.	.	H	α-helix	trans	-63.3	-47.7	173.1	166.3	164.8	160.6	-87.5	0	112.5	R732 E733 L734 M738 S739 I740	R732-K736 VanDerWaalsContact O-CB 3.28Å; R732-K736 WeakPolarHBondContact O-CB 3.36Å; R732-K736 PolarHBondContact O-N 3.16Å; E733-K736 WeakPolarHBondContact O-CB 3.37Å; E733-K736 PolarHBondContact O-N 3.13Å; E733-K736 IonicContact OE1-NZ 2.86Å; E733-K736 PolarHBondContact OE1-NZ 3.42Å; E733-K736 IonicContact OE2-NZ 3.19Å; E733-K736 PolarHBondContact OE2-NZ 3.13Å; L734-K736 VanDerWaalsContact C-N 3.28Å; L734-K736 PolarHBondContact O-N 3.03Å; K736-M738 PolarHBondContact O-N 3.05Å; K736-S739 PolarHBondContact O-N 3.11Å; K736-I740 HydrophobicContact CG-CD1 3.79Å; K736-I740 WeakPolarHBondContact O-CB 3.35Å; K736-I740 WeakPolarHBondContact O-CD1 3.49Å; K736-I740 VanDerWaalsContact O-CG1 3.24Å; K736-I740 WeakPolarHBondContact O-CG1 3.4Å; K736-I740 PolarHBondContact O-N 3.45Å
737	I	89.1	Confident	87.3	Confident	13 Å²	13	39 Å²	39	7%	0.067	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-47.1	175.3	-66.6	158.2	0	0	0	110.7	M589 V593 C596 E733 L734 S739 I740 F741	M589-I737 HydrophobicContact CE-CD1 3.62Å; M589-I737 HydrophobicContact SD-CD1 4.46Å; V593-I737 HydrophobicContact CG2-CD1 3.48Å; V593-I737 VanDerWaalsContact CG2-CD1 3.48Å; V593-I737 HydrophobicContact CG2-CG1 3.92Å; C596-I737 HydrophobicContact CB-CG2 4.47Å; E733-I737 HydrophobicContact CG-CD1 4.15Å; E733-I737 WeakPolarHBondContact O-CD1 3.47Å; E733-I737 VanDerWaalsContact O-CG1 3.3Å; E733-I737 WeakPolarHBondContact O-CG1 3.3Å; E733-I737 PolarHBondContact O-N 3.3Å; L734-I737 PolarHBondContact O-N 3.1Å; I737-S739 PolarHBondContact O-N 2.95Å; I737-I740 PolarHBondContact O-N 3.1Å; I737-F741 PolarHBondContact O-N 3.5Å
738	M	92	Very high	87.5	Confident	8 Å²	8	35.9 Å²	35.9	4%	0.039	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-40.9	178	-73.9	169.6	58.3	0	0	112	V674 L734 V735 K736 Q742 L830 L833 A834	V674-M738 HydrophobicContact CG1-SD 4.13Å; V674-M738 HydrophobicContact CG2-SD 4.33Å; L734-M738 HydrophobicContact CD1-CG 4.33Å; L734-M738 HydrophobicContact CD1-SD 3.82Å; L734-M738 HydrophobicContact CG-SD 3.86Å; L734-M738 WeakPolarHBondContact O-CB 3.47Å; L734-M738 WeakPolarHBondContact O-CG 3.37Å; L734-M738 PolarHBondContact O-N 3.42Å; V735-M738 PolarHBondContact O-N 2.97Å; K736-M738 PolarHBondContact O-N 3.05Å; M738-Q742 VanDerWaalsContact O-CB 3.25Å; M738-Q742 WeakPolarHBondContact O-CB 3.46Å; M738-Q742 PolarHBondContact O-N 3.21Å; M738-L830 HydrophobicContact CB-CB 4.3Å; M738-L830 HydrophobicContact CE-CB 4.17Å; M738-L830 HydrophobicContact CE-CD2 4.16Å; M738-L830 WeakPolarHBondContact CE-O 3.5Å; M738-L830 HydrophobicContact CG-CD2 4.5Å; M738-L833 HydrophobicContact CE-CB 4.05Å; M738-L833 HydrophobicContact CE-CD2 3.96Å; M738-L833 HydrophobicContact CE-CG 4.23Å; M738-A834 HydrophobicContact CE-CB 4.02Å
739	S	87.7	Confident	87.6	Confident	5 Å²	5	32.2 Å²	32.2	4%	0.035	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-47	175.7	-60.3	0	0	0	0	111.9	V735 K736 I737 F741 Q742 V743 Y1044	V735-S739 VanDerWaalsContact O-CB 3.29Å; V735-S739 WeakPolarHBondContact O-CB 3.38Å; V735-S739 PolarHBondContact O-N 3.38Å; V735-S739 PolarHBondContact O-OG 3.35Å; K736-S739 PolarHBondContact O-N 3.11Å; I737-S739 PolarHBondContact O-N 2.95Å; S739-F741 VanDerWaalsContact C-N 3.34Å; S739-F741 PolarHBondContact O-N 3.11Å; S739-Q742 WeakPolarHBondContact O-CB 3.28Å; S739-Q742 PolarHBondContact O-N 3.29Å; S739-Q742 VanDerWaalsContact O-N 3.11Å; S739-V743 WeakPolarHBondContact O-CG2 3.35Å; S739-V743 PolarHBondContact O-N 2.96Å; S739-Y1044 PolarHBondContact OG-OH 3.46Å
740	I	87.3	Confident	87.7	Confident	64 Å²	64	28 Å²	28	33%	0.328	13%	0.125	S	C	.	.	H	α-helix	trans	-58.7	-45.2	178.3	-70.2	163	0	0	0	110.5	K736 I737 V743 Y744 I1040	K736-I740 HydrophobicContact CG-CD1 3.79Å; K736-I740 WeakPolarHBondContact O-CB 3.35Å; K736-I740 WeakPolarHBondContact O-CD1 3.49Å; K736-I740 VanDerWaalsContact O-CG1 3.24Å; K736-I740 WeakPolarHBondContact O-CG1 3.4Å; K736-I740 PolarHBondContact O-N 3.45Å; I737-I740 PolarHBondContact O-N 3.1Å; I740-V743 PolarHBondContact O-N 3.33Å; I740-Y744 HydrophobicContact CG2-CE2 4.19Å; I740-Y744 WeakPolarHBondContact O-CD2 3.41Å; I740-I1040 HydrophobicContact CG1-CD1 4.19Å
741	F	90.8	Very high	87.6	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.009	13%	0.129	C	C	.	.	H	α-helix	trans	-65	-41.2	174.8	-170.3	-89.3	0	0	0	112.1	C596 I599 L603 Q667 L670 I737 S739 V743 Y744 V745 L830	C596-F741 HydrophobicContact CB-CD2 4.07Å; I599-F741 HydrophobicContact CB-CE2 3.9Å; I599-F741 HydrophobicContact CB-CZ 4.42Å; I599-F741 HydrophobicContact CG2-CE2 3.57Å; I599-F741 HydrophobicContact CG2-CZ 3.64Å; L603-F741 HydrophobicContact CD1-CZ 4.39Å; Q667-F741 HydrophobicContact CB-CE1 4.16Å; L670-F741 HydrophobicContact CD1-CD1 3.71Å; L670-F741 HydrophobicContact CD1-CD2 4.05Å; L670-F741 HydrophobicContact CD1-CE1 3.71Å; L670-F741 HydrophobicContact CD1-CE2 4.06Å; L670-F741 HydrophobicContact CD1-CG 3.88Å; L670-F741 HydrophobicContact CD1-CZ 3.89Å; I737-F741 PolarHBondContact O-N 3.5Å; S739-F741 VanDerWaalsContact C-N 3.34Å; S739-F741 PolarHBondContact O-N 3.11Å; F741-V743 PolarHBondContact O-N 3.42Å; F741-Y744 PolarHBondContact O-N 2.9Å; F741-V745 HydrophobicContact CD1-CG2 3.98Å; F741-V745 HydrophobicContact CE1-CG2 3.67Å; F741-V745 PolarHBondContact O-N 2.98Å; F741-L830 HydrophobicContact CB-CD1 4.42Å; F741-L830 HydrophobicContact CD1-CD1 3.71Å; F741-L830 HydrophobicContact CG-CD1 4.41Å
742	Q	89.9	Confident	87.3	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.2	-27	-179.8	-166.3	66	90.6	0	0	112.8	M738 S739 V745 L746 L828 R831 L1043	M738-Q742 VanDerWaalsContact O-CB 3.25Å; M738-Q742 WeakPolarHBondContact O-CB 3.46Å; M738-Q742 PolarHBondContact O-N 3.21Å; S739-Q742 WeakPolarHBondContact O-CB 3.28Å; S739-Q742 PolarHBondContact O-N 3.29Å; S739-Q742 VanDerWaalsContact O-N 3.11Å; Q742-V745 PolarHBondContact O-N 3.34Å; Q742-L746 WeakPolarHBondContact O-CB 3.45Å; Q742-L746 PolarHBondContact O-N 3.24Å; Q742-L828 HydrophobicContact CG-CB 4.33Å; Q742-L828 HydrophobicContact CG-CD2 4.05Å; Q742-L828 VanDerWaalsContact NE2-CD2 3.34Å; Q742-L828 PolarHBondContact OE1-O 2.93Å; Q742-R831 HydrophobicContact CG-CB 4.2Å; Q742-L1043 HydrophobicContact CB-CD1 4.06Å; Q742-L1043 HydrophobicContact CG-CD1 4.13Å; Q742-L1043 HydrophobicContact CG-CD2 3.83Å
743	V	88	Confident	86.9	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-40.2	170.9	172.3	0	0	0	0	112.5	S739 I740 F741 L746 R747 D1036 L1039 I1040	S739-V743 WeakPolarHBondContact O-CG2 3.35Å; S739-V743 PolarHBondContact O-N 2.96Å; I740-V743 PolarHBondContact O-N 3.33Å; F741-V743 PolarHBondContact O-N 3.42Å; V743-L746 PolarHBondContact O-N 3.11Å; V743-R747 HydrophobicContact CG1-CG 4.35Å; V743-R747 WeakPolarHBondContact O-CB 3.33Å; V743-R747 WeakPolarHBondContact O-CG 3.36Å; V743-R747 PolarHBondContact O-N 2.9Å; V743-D1036 HydrophobicContact CG1-CB 4.39Å; V743-D1036 WeakPolarHBondContact CG1-OD1 3.43Å; V743-L1039 HydrophobicContact CG1-CB 3.99Å; V743-L1039 HydrophobicContact CG1-CD1 3.8Å; V743-L1039 HydrophobicContact CG2-CB 3.91Å; V743-I1040 HydrophobicContact CG2-CG1 3.65Å
744	Y	87.5	Confident	86.4	Confident	39 Å²	39	30.5 Å²	30.5	15%	0.153	14%	0.144	C	C	.	.	H	α-helix	trans	-67.7	-36.4	176.9	-67.9	-79.3	0	0	0	112	K600 I604 I740 F741 A748	K600-Y744 HydrophobicContact CB-CD2 4.42Å; K600-Y744 HydrophobicContact CB-CE2 4.47Å; K600-Y744 HydrophobicContact CD-CD2 4.41Å; K600-Y744 HydrophobicContact CD-CE1 4.36Å; K600-Y744 HydrophobicContact CD-CE2 3.66Å; K600-Y744 WeakPolarHBondContact CE-OH 3.47Å; K600-Y744 HydrophobicContact CG-CD1 4.43Å; K600-Y744 HydrophobicContact CG-CD2 4.32Å; K600-Y744 HydrophobicContact CG-CE1 4.09Å; K600-Y744 HydrophobicContact CG-CE2 3.97Å; K600-Y744 PolarHBondContact NZ-OH 3.29Å; I604-Y744 HydrophobicContact CD1-CE1 4.3Å; I604-Y744 HydrophobicContact CG1-CE1 4.5Å; I740-Y744 HydrophobicContact CG2-CE2 4.19Å; I740-Y744 WeakPolarHBondContact O-CD2 3.41Å; F741-Y744 PolarHBondContact O-N 2.9Å; Y744-A748 PolarHBondContact O-N 3.43Å
745	V	88.3	Confident	85.7	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.024	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-46.7	169.7	-177.7	0	0	0	0	110.9	A663 Q667 F741 Q742 A748 W749	A663-V745 HydrophobicContact CB-CB 4.48Å; A663-V745 HydrophobicContact CB-CG1 4.44Å; A663-V745 HydrophobicContact CB-CG2 4.21Å; Q667-V745 HydrophobicContact CB-CG2 4.22Å; Q667-V745 HydrophobicContact CG-CG2 4.25Å; F741-V745 HydrophobicContact CD1-CG2 3.98Å; F741-V745 HydrophobicContact CE1-CG2 3.67Å; F741-V745 PolarHBondContact O-N 2.98Å; Q742-V745 PolarHBondContact O-N 3.34Å; V745-A748 PolarHBondContact O-N 3.29Å; V745-W749 PolarHBondContact O-N 3.12Å
746	L	85.8	Confident	84.9	Confident	4 Å²	4	35.5 Å²	35.5	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-65.6	-41.2	-178.7	-176.9	56.6	0	0	0	111.8	Q742 V743 W749 L750 I760 I824 L1039	Q742-L746 WeakPolarHBondContact O-CB 3.45Å; Q742-L746 PolarHBondContact O-N 3.24Å; V743-L746 PolarHBondContact O-N 3.11Å; L746-W749 HydrophobicContact CD1-CE3 4.47Å; L746-W749 PolarHBondContact O-N 3.06Å; L746-L750 HydrophobicContact CD1-CD1 4.42Å; L746-L750 HydrophobicContact CD1-CG 4.4Å; L746-L750 HydrophobicContact CG-CD1 4.13Å; L746-L750 WeakPolarHBondContact O-CB 3.17Å; L746-L750 VanDerWaalsContact O-CG 3.23Å; L746-L750 WeakPolarHBondContact O-CG 3.43Å; L746-L750 PolarHBondContact O-N 2.9Å; L746-I760 HydrophobicContact CD1-CD1 4.2Å; L746-I760 HydrophobicContact CD2-CD1 4.22Å; L746-I760 HydrophobicContact CG-CD1 4.42Å; L746-I824 HydrophobicContact CD1-CD1 4.44Å; L746-I824 HydrophobicContact CD1-CG2 4.09Å; L746-L1039 HydrophobicContact CD2-CD2 3.91Å
747	R	85.8	Confident	84	Confident	87 Å²	87	33.6 Å²	33.6	33%	0.328	17%	0.168	S	C	.	.	H	α-helix	trans	-57.5	-46.4	171.4	-75.8	167.3	165.8	-111.7	10	111.8	V743 L750 K751 D1036 L1039	V743-R747 HydrophobicContact CG1-CG 4.35Å; V743-R747 WeakPolarHBondContact O-CB 3.33Å; V743-R747 WeakPolarHBondContact O-CG 3.36Å; V743-R747 PolarHBondContact O-N 2.9Å; R747-L750 PolarHBondContact O-N 3.19Å; R747-K751 PolarHBondContact O-N 2.98Å; R747-D1036 IonicContact CZ-OD1 3.73Å; R747-D1036 IonicContact NE-OD1 3.63Å; R747-D1036 PolarHBondContact NE-OD1 3.33Å; R747-D1036 IonicContact NH2-OD1 2.69Å; R747-D1036 PolarHBondContact NH2-OD1 3.22Å; R747-D1036 IonicContact NH2-OD2 2.77Å; R747-D1036 PolarHBondContact NH2-OD2 2.63Å; R747-L1039 HydrophobicContact CG-CD1 4.1Å
748	A	86.1	Confident	82.9	Confident	9 Å²	9	39.6 Å²	39.6	7%	0.074	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-39.2	178.1	0	0	0	0	0	112.6	A663 Y744 V745 F752	A663-A748 HydrophobicContact CB-CB 4.46Å; Y744-A748 PolarHBondContact O-N 3.43Å; V745-A748 PolarHBondContact O-N 3.29Å; A748-F752 WeakPolarHBondContact O-CB 3.48Å; A748-F752 PolarHBondContact O-N 2.97Å; A748-F752 VanDerWaalsContact O-N 3.08Å
749	W	85.6	Confident	81.5	Confident	34 Å²	34	41 Å²	41	13%	0.129	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-42	174.1	-178.4	85.9	0	0	0	112.4	W660 V745 L746 F752 S753 I755 I824	W660-W749 AromaticContact CD1-CD1 3.86Å; W660-W749 AromaticContact CE2-CD1 3.94Å; W660-W749 AromaticContact NE1-CD1 3.5Å; V745-W749 PolarHBondContact O-N 3.12Å; L746-W749 HydrophobicContact CD1-CE3 4.47Å; L746-W749 PolarHBondContact O-N 3.06Å; W749-F752 PolarHBondContact O-N 2.98Å; W749-S753 WeakPolarHBondContact CZ2-OG 3.38Å; W749-S753 VanDerWaalsContact O-CB 3.28Å; W749-S753 WeakPolarHBondContact O-CB 3.3Å; W749-S753 PolarHBondContact O-N 3.32Å; W749-S753 PolarHBondContact O-OG 2.95Å; W749-I755 HydrophobicContact CH2-CD1 3.45Å; W749-I755 VanDerWaalsContact CH2-CD1 3.45Å; W749-I755 HydrophobicContact CZ2-CD1 4.47Å; W749-I755 HydrophobicContact CZ3-CD1 3.72Å; W749-I824 HydrophobicContact CD2-CD1 4.32Å; W749-I824 HydrophobicContact CD2-CG1 4.12Å; W749-I824 HydrophobicContact CD2-CG2 4.28Å; W749-I824 HydrophobicContact CE3-CD1 3.69Å; W749-I824 HydrophobicContact CE3-CG1 4Å; W749-I824 HydrophobicContact CE3-CG2 4.44Å; W749-I824 HydrophobicContact CH2-CD1 3.45Å; W749-I824 VanDerWaalsContact CH2-CD1 3.45Å; W749-I824 HydrophobicContact CH2-CG1 3.49Å; W749-I824 VanDerWaalsContact CH2-CG1 3.49Å; W749-I824 HydrophobicContact CZ2-CD1 4.09Å; W749-I824 HydrophobicContact CZ2-CG1 3.61Å; W749-I824 HydrophobicContact CZ3-CD1 3.21Å; W749-I824 HydrophobicContact CZ3-CG1 3.7Å
750	L	84.2	Confident	80.3	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-47.6	177.7	-76.5	166.3	0	0	0	111.7	L746 R747 S753 D754 I755 I757 I760	L746-L750 HydrophobicContact CD1-CD1 4.42Å; L746-L750 HydrophobicContact CD1-CG 4.4Å; L746-L750 HydrophobicContact CG-CD1 4.13Å; L746-L750 WeakPolarHBondContact O-CB 3.17Å; L746-L750 VanDerWaalsContact O-CG 3.23Å; L746-L750 WeakPolarHBondContact O-CG 3.43Å; L746-L750 PolarHBondContact O-N 2.9Å; R747-L750 PolarHBondContact O-N 3.19Å; L750-S753 PolarHBondContact O-N 3.08Å; L750-D754 PolarHBondContact O-N 3.17Å; L750-I755 HydrophobicContact CD2-CB 3.83Å; L750-I755 HydrophobicContact CD2-CG2 3.6Å; L750-I755 PolarHBondContact O-N 3.44Å; L750-I755 VanDerWaalsContact O-N 3.12Å; L750-I757 HydrophobicContact CD1-CG1 4.09Å; L750-I760 HydrophobicContact CD1-CD1 4.02Å; L750-I760 HydrophobicContact CD2-CD1 4.03Å; L750-I760 HydrophobicContact CD2-CG1 4.5Å; L750-I760 HydrophobicContact CG-CD1 4.48Å
751	K	83.2	Confident	78.8	Confident	76 Å²	76	40.7 Å²	40.7	33%	0.33	20%	0.203	S	C	.	.	H	α-helix	trans	-60.2	-45.4	174.7	-91.4	-169.3	159.8	-168.7	0	112	Q607 D611 R747 S753 D754	Q607-K751 VanDerWaalsContact CD-CD 3.4Å; Q607-K751 HydrophobicContact CG-CD 4.3Å; D611-K751 IonicContact OD1-NZ 2.62Å; D611-K751 PolarHBondContact OD1-NZ 3.27Å; D611-K751 IonicContact OD2-NZ 2.67Å; D611-K751 PolarHBondContact OD2-NZ 3.46Å; R747-K751 PolarHBondContact O-N 2.98Å; K751-S753 VanDerWaalsContact C-N 3.28Å; K751-S753 PolarHBondContact O-N 3.38Å; K751-D754 PolarHBondContact O-N 2.88Å
752	F	83.1	Confident	76.6	Confident	43 Å²	43	43.8 Å²	43.8	19%	0.189	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-31.9	175.9	168.4	-120.4	0	0	0	113.8	K653 H656 K657 W660 A748 W749	K653-F752 WeakPolarHBondContact CE-O 3.34Å; K653-F752 HydrophobicContact CG-CD2 4.45Å; K653-F752 HydrophobicContact CG-CE2 4.46Å; H656-F752 HydrophobicContact CB-CB 4.12Å; K657-F752 HydrophobicContact CB-CD2 3.52Å; K657-F752 HydrophobicContact CB-CE2 3.48Å; K657-F752 VanDerWaalsContact CB-CE2 3.48Å; K657-F752 HydrophobicContact CB-CG 4.32Å; K657-F752 HydrophobicContact CB-CZ 4.22Å; K657-F752 HydrophobicContact CD-CE2 3.93Å; K657-F752 HydrophobicContact CD-CZ 4.1Å; K657-F752 HydrophobicContact CG-CD2 4.07Å; K657-F752 HydrophobicContact CG-CE1 4.48Å; K657-F752 HydrophobicContact CG-CE2 3.63Å; K657-F752 HydrophobicContact CG-CZ 3.86Å; W660-F752 HydrophobicContact CB-CB 4.33Å; W660-F752 HydrophobicContact CD2-CD1 4.26Å; W660-F752 HydrophobicContact CE3-CD1 4.09Å; W660-F752 HydrophobicContact CE3-CE1 4.07Å; W660-F752 HydrophobicContact CG-CD1 4.45Å; W660-F752 HydrophobicContact CZ3-CE1 4.31Å; A748-F752 WeakPolarHBondContact O-CB 3.48Å; A748-F752 PolarHBondContact O-N 2.97Å; A748-F752 VanDerWaalsContact O-N 3.08Å; W749-F752 PolarHBondContact O-N 2.98Å
753	S	77	Confident	74.6	Confident	34 Å²	34	46.9 Å²	46.9	24%	0.238	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	0.8	-175.9	-52.7	0	0	0	0	114.1	W749 L750 K751 I755	W749-S753 WeakPolarHBondContact CZ2-OG 3.38Å; W749-S753 VanDerWaalsContact O-CB 3.28Å; W749-S753 WeakPolarHBondContact O-CB 3.3Å; W749-S753 PolarHBondContact O-N 3.32Å; W749-S753 PolarHBondContact O-OG 2.95Å; L750-S753 PolarHBondContact O-N 3.08Å; K751-S753 VanDerWaalsContact C-N 3.28Å; K751-S753 PolarHBondContact O-N 3.38Å; S753-I755 PolarHBondContact O-N 3Å
754	D	76.9	Confident	72.5	Confident	109 Å²	109	48.7 Å²	48.7	58%	0.583	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	25.9	-172.7	-52.1	-52.1	0	0	0	114.4	K653 L750 K751	K653-D754 IonicContact NZ-OD2 3.38Å; K653-D754 PolarHBondContact NZ-OD2 3.39Å; L750-D754 PolarHBondContact O-N 3.17Å; K751-D754 PolarHBondContact O-N 2.88Å
755	I	74.4	Confident	70	Confident	40 Å²	40	49.6 Å²	49.6	21%	0.205	26%	0.259	C	S	.	.			trans	-96.8	121.8	-176.1	-68	164.9	0	0	0	110.2	W749 L750 S753 I757	W749-I755 HydrophobicContact CH2-CD1 3.45Å; W749-I755 VanDerWaalsContact CH2-CD1 3.45Å; W749-I755 HydrophobicContact CZ2-CD1 4.47Å; W749-I755 HydrophobicContact CZ3-CD1 3.72Å; L750-I755 HydrophobicContact CD2-CB 3.83Å; L750-I755 HydrophobicContact CD2-CG2 3.6Å; L750-I755 PolarHBondContact O-N 3.44Å; L750-I755 VanDerWaalsContact O-N 3.12Å; S753-I755 PolarHBondContact O-N 3Å; I755-I757 PolarHBondContact O-N 3.39Å
756	P	73.1	Confident	67.3	Low	69 Å²	69	55.7 Å²	55.7	45%	0.448	29%	0.291	S	S	.	.			trans	-58.9	135.9	174.4	-24.9	34.8	0	0	0	112.2	Q758 T759	P756-Q758 PolarHBondContact O-N 2.86Å; P756-Q758 VanDerWaalsContact O-N 3.14Å; P756-T759 VanDerWaalsContact O-CB 3.32Å; P756-T759 WeakPolarHBondContact O-CB 3.28Å; P756-T759 PolarHBondContact O-N 3.41Å; P756-T759 PolarHBondContact O-OG1 3.23Å
757	I	68.5	Low	65	Low	61 Å²	61	61.7 Å²	61.7	31%	0.313	32%	0.324	S	S	.	.	H	α-helix	trans	-55.6	-34.6	175.1	-58.9	171.2	0	0	0	110.9	L750 I755 T759 I760 I761 V1035 L1039	L750-I757 HydrophobicContact CD1-CG1 4.09Å; I755-I757 PolarHBondContact O-N 3.39Å; I757-T759 PolarHBondContact O-N 3.48Å; I757-I760 PolarHBondContact O-N 3.02Å; I757-I760 VanDerWaalsContact O-N 3.14Å; I757-I761 HydrophobicContact CG2-CD1 4.28Å; I757-I761 PolarHBondContact O-N 3.41Å; I757-V1035 HydrophobicContact CG2-CG1 3.7Å; I757-L1039 HydrophobicContact CG2-CD1 4.32Å; I757-L1039 HydrophobicContact CG2-CD2 4.22Å
758	Q	64.9	Low	62.3	Low	139 Å²	139	61.8 Å²	61.8	65%	0.65	34%	0.338	S	S	*	.	H	α-helix	trans	-56.8	-28.9	175.7	-69.6	154.3	-27.1	0	0	113.4	P756 I760 I761 C762	P756-Q758 PolarHBondContact O-N 2.86Å; P756-Q758 VanDerWaalsContact O-N 3.14Å; Q758-I760 VanDerWaalsContact C-N 3.33Å; Q758-I760 PolarHBondContact O-N 3.47Å; Q758-I761 PolarHBondContact O-N 2.96Å; Q758-I761 VanDerWaalsContact O-N 3.15Å; Q758-C762 WeakPolarHBondContact O-CB 3.47Å; Q758-C762 PolarHBondContact O-N 3.39Å; Q758-C762 PolarHBondContact O-SG 3.41Å
759	T	64.3	Low	59.6	Low	37 Å²	37	69.6 Å²	69.6	23%	0.227	37%	0.373	C	S	.	.	H	α-helix	trans	-61.8	-40.6	177	-55.5	0	0	0	0	111.3	P756 I757 H763	P756-T759 VanDerWaalsContact O-CB 3.32Å; P756-T759 WeakPolarHBondContact O-CB 3.28Å; P756-T759 PolarHBondContact O-N 3.41Å; P756-T759 PolarHBondContact O-OG1 3.23Å; I757-T759 PolarHBondContact O-N 3.48Å; T759-H763 PolarHBondContact O-CD2 2.76Å; T759-H763 PolarHBondContact O-N 2.95Å
760	I	62.2	Low	56.8	Low	22 Å²	22	75.1 Å²	75.1	11%	0.113	41%	0.405	C	S	.	.	H	α-helix	trans	-66.9	-38.6	175	-63.3	-172	0	0	0	111	L746 L750 I757 Q758 L1039 S1042	L746-I760 HydrophobicContact CD1-CD1 4.2Å; L746-I760 HydrophobicContact CD2-CD1 4.22Å; L746-I760 HydrophobicContact CG-CD1 4.42Å; L750-I760 HydrophobicContact CD1-CD1 4.02Å; L750-I760 HydrophobicContact CD2-CD1 4.03Å; L750-I760 HydrophobicContact CD2-CG1 4.5Å; L750-I760 HydrophobicContact CG-CD1 4.48Å; I757-I760 PolarHBondContact O-N 3.02Å; I757-I760 VanDerWaalsContact O-N 3.14Å; Q758-I760 VanDerWaalsContact C-N 3.33Å; Q758-I760 PolarHBondContact O-N 3.47Å; I760-L1039 HydrophobicContact CD1-CD2 4.26Å; I760-L1039 HydrophobicContact CG2-CD2 4.3Å; I760-S1042 VanDerWaalsContact CG2-CB 3.49Å
761	I	55.7	Low	53.9	Low	42 Å²	42	81.3 Å²	81.3	22%	0.215	45%	0.447	C	S	.	.	H	α-helix	trans	-69.2	-47.6	-178	-57.8	173.6	0	0	0	111	I757 Q758 H763 Q764 S765 F1038	I757-I761 HydrophobicContact CG2-CD1 4.28Å; I757-I761 PolarHBondContact O-N 3.41Å; Q758-I761 PolarHBondContact O-N 2.96Å; Q758-I761 VanDerWaalsContact O-N 3.15Å; I761-H763 PolarHBondContact O-N 3.31Å; I761-Q764 WeakPolarHBondContact O-CB 3.37Å; I761-Q764 PolarHBondContact O-N 3.1Å; I761-S765 PolarHBondContact O-N 2.94Å; I761-F1038 HydrophobicContact CG1-CB 4.2Å; I761-F1038 HydrophobicContact CG2-CD1 4.39Å
762	C	44.8	Very low	51.2	Low	67 Å²	67	82.5 Å²	82.5	45%	0.453	47%	0.465	S	S	.	.	H	α-helix	trans	-64.8	-25.4	-179.3	-66.2	0	0	0	0	113.3	Q758 Q764 S765	Q758-C762 WeakPolarHBondContact O-CB 3.47Å; Q758-C762 PolarHBondContact O-N 3.39Å; Q758-C762 PolarHBondContact O-SG 3.41Å; C762-Q764 PolarHBondContact O-N 3.48Å; C762-S765 PolarHBondContact O-OG 2.75Å
763	H	47.1	Very low	48.3	Very low	64 Å²	64	89.5 Å²	89.5	30%	0.296	50%	0.498	S	S	.	.	H	α-helix	trans	-70.3	-11.3	171.9	-77.2	-51.7	0	0	0	113.9	T759 I761	T759-H763 PolarHBondContact O-CD2 2.76Å; T759-H763 PolarHBondContact O-N 2.95Å; I761-H763 PolarHBondContact O-N 3.31Å
764	Q	43.6	Very low	45.9	Very low	40 Å²	40	93.3 Å²	93.3	19%	0.187	53%	0.525	C	S	.	.	H	α-helix	trans	-101.4	-26.3	175.9	-62.4	178.1	-6.3	0	0	113.5	I761 C762 S1042	I761-Q764 WeakPolarHBondContact O-CB 3.37Å; I761-Q764 PolarHBondContact O-N 3.1Å; C762-Q764 PolarHBondContact O-N 3.48Å; Q764-S1042 VanDerWaalsContact NE2-CA 3.32Å
765	S	36.1	Very low	43.4	Very low	58 Å²	58	95.6 Å²	95.6	41%	0.406	54%	0.537	S	S	.	.	H	α-helix	trans	-80.1	-29.8	-174.9	54.7	0	0	0	0	114.4	I761 C762 D767 S768	I761-S765 PolarHBondContact O-N 2.94Å; C762-S765 PolarHBondContact O-OG 2.75Å; S765-D767 PolarHBondContact O-N 3.1Å; S765-D767 VanDerWaalsContact O-N 3.11Å; S765-S768 PolarHBondContact O-N 2.91Å; S765-S768 PolarHBondContact O-OG 2.85Å; S765-S768 VanDerWaalsContact O-OG 3.13Å
766	N	31.8	Very low	41.1	Very low	132 Å²	132	101.6 Å²	101.6	71%	0.706	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	6.6	-167.5	-69.6	9.5	0	0	0	115	S768	N766-S768 VanDerWaalsContact C-N 3.34Å
767	D	36.1	Very low	38.6	Very low	130 Å²	130	106.6 Å²	106.6	70%	0.695	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-4.6	170.1	-87.1	-29.8	0	0	0	113	S765	S765-D767 PolarHBondContact O-N 3.1Å; S765-D767 VanDerWaalsContact O-N 3.11Å
768	S	30.4	Very low	36.5	Very low	90 Å²	90	108.3 Å²	108.3	63%	0.629	60%	0.603	S	S	*	*	S	Bend	trans	-94.3	119.3	169.5	62.7	0	0	0	0	112.3	S765 N766	S765-S768 PolarHBondContact O-N 2.91Å; S765-S768 PolarHBondContact O-OG 2.85Å; S765-S768 VanDerWaalsContact O-OG 3.13Å; N766-S768 VanDerWaalsContact C-N 3.34Å
769	E	28.4	Very low	34.6	Very low	172 Å²	172	112 Å²	112	80%	0.804	62%	0.617	S	S	*	*	S	Bend	trans	77.6	154.2	171.2	-50.7	-171	163.7	0	0	117.1
770	N	26.6	Very low	32.5	Very low	151 Å²	151	116.7 Å²	116.7	81%	0.807	64%	0.641	S	S	*	*			trans	63.6	52	175.4	-59.1	-38.4	0	0	0	118.8
771	C	24	Very low	30.7	Very low	131 Å²	131	124.8 Å²	124.8	89%	0.885	68%	0.675	S	S	*	*			trans	-107.2	55.9	156.8	-154.2	0	0	0	0	111.5	Q773	C771-Q773 PolarHBondContact O-N 2.98Å
772	S	26.4	Very low	29.3	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	71%	0.707	S	S	*	*			trans	-80.6	93.3	-177.5	54.3	0	0	0	0	112.5	S774	S772-S774 PolarHBondContact O-N 2.87Å
773	Q	23.2	Very low	28.2	Very low	191 Å²	191	135.7 Å²	135.7	89%	0.893	73%	0.729	S	S	*	*			trans	33	70	155.4	-65.5	-177	-21.6	0	0	117.3	C771	C771-Q773 PolarHBondContact O-N 2.98Å
774	S	25.7	Very low	27	Very low	114 Å²	114	137.8 Å²	137.8	80%	0.797	75%	0.751	S	S	*	*			trans	-87.9	119.5	159.7	53.8	0	0	0	0	110.2	S772 L776	S772-S774 PolarHBondContact O-N 2.87Å; S774-L776 PolarHBondContact O-N 3.41Å
775	N	24.5	Very low	26	Very low	157 Å²	157	140.9 Å²	140.9	84%	0.84	78%	0.776	S	S	*	*			trans	-62.9	118.5	-176.4	-71.1	-53.5	0	0	0	112
776	L	24.9	Very low	25.4	Very low	165 Å²	165	145.2 Å²	145.2	86%	0.864	80%	0.8	S	S	*	*			trans	-126.7	88.2	168.3	-146.8	77.5	0	0	0	111	S774	S774-L776 PolarHBondContact O-N 3.41Å
777	H	21.3	Very low	24.9	Very low	175 Å²	175	147.9 Å²	147.9	81%	0.81	81%	0.805	S	S	*	*			trans	-70.5	158.5	169.8	-112.3	-109.1	0	0	0	111.1
778	S	24.5	Very low	24.3	Very low	96 Å²	96	151 Å²	151	67%	0.671	81%	0.812	S	S	*	*			trans	54.1	86.6	167.2	57.8	0	0	0	0	118
779	F	25.3	Very low	23.9	Very low	217 Å²	217	151.9 Å²	151.9	95%	0.952	82%	0.818	S	S	*	*			trans	-126.4	111.3	132.2	-100.7	-82.7	0	0	0	108.8
780	N	20.8	Very low	23.5	Very low	135 Å²	135	150 Å²	150	72%	0.722	82%	0.818	S	S	*	*			trans	-128.3	124.3	-166	-151.5	-15.6	0	0	0	110.4
781	K	23.9	Very low	23.3	Very low	193 Å²	193	149.7 Å²	149.7	84%	0.839	82%	0.815	S	S	*	*			trans	57.5	95	170.2	-62.4	169	-173.8	176.2	0	117.9
782	S	25.2	Very low	23.2	Very low	127 Å²	127	148.9 Å²	148.9	89%	0.888	81%	0.808	S	S	*	*			trans	-134.2	113.9	134.7	53	0	0	0	0	109.8
783	K	22	Very low	23.1	Very low	211 Å²	211	152.1 Å²	152.1	92%	0.917	82%	0.817	S	S	*	*			trans	-95.1	132.8	169.9	-68.3	-177.2	177	-175.5	0	108.2
784	S	22.9	Very low	23.1	Very low	107 Å²	107	150.5 Å²	150.5	75%	0.748	81%	0.814	S	S	*	*			trans	165.5	132.5	135.5	-171.9	0	0	0	0	112.2
785	C	21.8	Very low	23.1	Very low	105 Å²	105	153.9 Å²	153.9	71%	0.709	82%	0.815	S	S	*	*			trans	39.4	96.5	154.2	-64.5	0	0	0	0	119.8	K787	C785-K787 PolarHBondContact O-N 3.5Å
786	V	23.2	Very low	23.1	Very low	150 Å²	150	156.2 Å²	156.2	91%	0.909	82%	0.818	S	S	*	*			trans	-63.1	102.6	154.5	178.6	0	0	0	0	109.1
787	K	22.1	Very low	23.2	Very low	188 Å²	188	154.5 Å²	154.5	82%	0.817	81%	0.814	S	S	*	*			trans	-80.2	128.7	161.7	-75.5	-173.9	175.3	-178.4	0	108.4	C785 S789	C785-K787 PolarHBondContact O-N 3.5Å; K787-S789 PolarHBondContact O-N 3.21Å
788	K	23.2	Very low	23.8	Very low	196 Å²	196	151.5 Å²	151.5	85%	0.852	81%	0.81	S	S	*	*			trans	-53.9	123	175.9	-70.3	-173.7	176	-174.9	0	109.7	T790	K788-T790 PolarHBondContact O-N 2.92Å
789	S	21.8	Very low	23.8	Very low	107 Å²	107	154.3 Å²	154.3	75%	0.748	82%	0.817	S	S	*	*			trans	-79.6	78.8	-176.1	53.7	0	0	0	0	111.7	K787 I791	K787-S789 PolarHBondContact O-N 3.21Å; S789-I791 PolarHBondContact O-N 2.91Å
790	T	21.3	Very low	23.8	Very low	132 Å²	132	151.3 Å²	151.3	81%	0.81	81%	0.811	S	S	*	*			trans	-64.1	99.1	158.7	42.7	0	0	0	0	108.5	K788 P792	K788-T790 PolarHBondContact O-N 2.92Å; T790-P792 WeakPolarHBondContact O-CD 3.46Å
791	I	21.8	Very low	24.1	Very low	145 Å²	145	151.1 Å²	151.1	74%	0.744	82%	0.815	S	S	*	*			trans	-63.7	117.3	178.2	-59.5	173	0	0	0	107.8	S789 L793	S789-I791 PolarHBondContact O-N 2.91Å; I791-L793 PolarHBondContact O-N 3.49Å
792	P	22.3	Very low	24.2	Very low	114 Å²	114	149.2 Å²	149.2	74%	0.74	81%	0.812	S	S	*	*			trans	-71.5	122.3	-179.8	28.5	-32.6	0	0	0	109.4	T790 N794	T790-P792 WeakPolarHBondContact O-CD 3.46Å; P792-N794 PolarHBondContact O-N 2.92Å
793	L	23.1	Very low	24.3	Very low	170 Å²	170	149.1 Å²	149.1	89%	0.89	81%	0.809	S	S	*	*			trans	-61.2	110.9	175.1	-80.3	88.8	0	0	0	109.5	I791 K795	I791-L793 PolarHBondContact O-N 3.49Å; L793-K795 PolarHBondContact O-N 3.33Å
794	N	24.4	Very low	24.3	Very low	156 Å²	156	143.8 Å²	143.8	83%	0.834	80%	0.798	S	S	*	*			trans	-68	128.7	-178.8	-161.3	4.9	0	0	0	109.8	P792 K796	P792-N794 PolarHBondContact O-N 2.92Å; N794-K796 PolarHBondContact O-N 3.14Å
795	K	26	Very low	24.5	Very low	186 Å²	186	143.6 Å²	143.6	81%	0.809	80%	0.797	S	S	*	*			trans	-69.6	120.7	-174.2	-73.1	-177.8	177.4	178.6	0	109.8	L793 T797	L793-K795 PolarHBondContact O-N 3.33Å; K795-T797 PolarHBondContact O-N 3.28Å
796	K	24.5	Very low	24.8	Very low	206 Å²	206	146.2 Å²	146.2	90%	0.896	80%	0.802	S	S	*	*			trans	-63.1	102	171	-71.3	-175.5	176.6	-177.8	0	110.3	N794	N794-K796 PolarHBondContact O-N 3.14Å
797	T	25.5	Very low	24.9	Very low	129 Å²	129	147.2 Å²	147.2	79%	0.791	80%	0.8	S	S	*	*			trans	-82.4	116.9	154.4	48.5	0	0	0	0	108.1	K795	K795-T797 PolarHBondContact O-N 3.28Å
798	P	34.2	Very low	25	Very low	111 Å²	111	142.7 Å²	142.7	72%	0.721	79%	0.792	S	S	*	*			trans	-74.1	138.7	170.7	31.9	-33	0	0	0	110
799	N	24.5	Very low	25.1	Very low	155 Å²	155	137.9 Å²	137.9	83%	0.829	78%	0.784	S	S	*	*			trans	175.7	152.5	137.9	-87.9	-8.3	0	0	0	109.3
800	D	24.7	Very low	25.4	Very low	154 Å²	154	139 Å²	139	82%	0.824	78%	0.781	S	S	*	*			trans	-80	137.5	-169.4	-46.3	-93.6	0	0	0	113.8
801	V	28.5	Very low	25.8	Very low	132 Å²	132	139.2 Å²	139.2	80%	0.8	78%	0.782	S	S	*	*				-151	133.4	127.3	176.7	0	0	0	0	107.5	P803	V801-P803 WeakPolarHBondContact O-CD 3.5Å
802	I	25.2	Very low	26.1	Very low	153 Å²	153	137.7 Å²	137.7	79%	0.785	78%	0.776	S	S	*	*			trans	-85.5	117.2	172.6	-61.2	170.6	0	0	0	109	S804	I802-S804 PolarHBondContact O-N 3.38Å
803	P	26.8	Very low	26.6	Very low	125 Å²	125	137.2 Å²	137.2	81%	0.812	77%	0.767	S	S	*	*			trans	-83.1	104.1	175	-2.8	22.2	0	0	0	110	V801	V801-P803 WeakPolarHBondContact O-CD 3.5Å
804	S	22.6	Very low	26.9	Very low	99 Å²	99	133.7 Å²	133.7	69%	0.692	76%	0.755	S	S	*	*			trans	-76.4	152.9	172.9	56.1	0	0	0	0	112.5	I802	I802-S804 PolarHBondContact O-N 3.38Å
805	S	26.3	Very low	27.2	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	74%	0.741	S	S	*	*			trans	57.1	96.8	164.9	60.4	0	0	0	0	118.1
806	I	27.8	Very low	27.9	Very low	160 Å²	160	124.9 Å²	124.9	82%	0.821	72%	0.72	S	S	*	*			trans	-127.6	119.3	140.3	-61.7	-178.9	0	0	0	107
807	I	26.3	Very low	28.6	Very low	170 Å²	170	117.8 Å²	117.8	87%	0.872	69%	0.692	S	S	*	*			trans	-126	103.2	172.8	-61.6	175.9	0	0	0	107
808	S	24.9	Very low	29.2	Very low	93 Å²	93	113.4 Å²	113.4	65%	0.65	66%	0.664	S	S	*	*			trans	-160.8	88	173.4	59.5	0	0	0	0	112.3
809	S	23.7	Very low	29.8	Very low	96 Å²	96	114.1 Å²	114.1	67%	0.671	66%	0.658	S	S	*	*			trans	20.6	119.4	149.4	59.4	0	0	0	0	121.1
810	N	27.9	Very low	30.9	Very low	131 Å²	131	109.1 Å²	109.1	70%	0.701	63%	0.634	S	S	*	*	S	Bend	trans	77.2	147.3	137	-56.8	-4.7	0	0	0	121
811	T	30.1	Very low	32.2	Very low	135 Å²	135	103.4 Å²	103.4	83%	0.828	60%	0.604	S	S	*	*	S	Bend	trans	79.1	13.9	164.9	69.6	0	0	0	0	119.5
812	N	29.6	Very low	33.5	Very low	113 Å²	113	99.8 Å²	99.8	60%	0.604	58%	0.584	S	S	*	*			trans	-118.6	-4.6	172.5	-85	-50	0	0	0	115.4	C814 I815	N812-C814 VanDerWaalsContact C-N 3.25Å; N812-C814 PolarHBondContact O-N 3.43Å; N812-C814 VanDerWaalsContact O-N 3.11Å; N812-I815 PolarHBondContact O-N 2.82Å
813	D	32.1	Very low	35.2	Very low	105 Å²	105	97.7 Å²	97.7	56%	0.561	57%	0.574	S	S	*	*	H	α-helix	trans	-67.8	-17.5	-166.2	-51	-74	0	0	0	115.1	I815 S816 N817	D813-I815 VanDerWaalsContact C-N 3.31Å; D813-I815 PolarHBondContact O-N 3.4Å; D813-S816 PolarHBondContact O-OG 3.01Å; D813-N817 VanDerWaalsContact O-CG 3.3Å; D813-N817 PolarHBondContact O-N 3.16Å; D813-N817 PolarHBondContact O-ND2 3.44Å
814	C	30.2	Very low	37.1	Very low	95 Å²	95	92.2 Å²	92.2	64%	0.642	54%	0.538	S	S	*	.	H	α-helix	trans	-70.6	-25.2	171.8	-66.4	0	0	0	0	113.2	N812 N818	N812-C814 VanDerWaalsContact C-N 3.25Å; N812-C814 PolarHBondContact O-N 3.43Å; N812-C814 VanDerWaalsContact O-N 3.11Å; C814-N818 PolarHBondContact O-N 3.13Å
815	I	30.2	Very low	39.4	Very low	104 Å²	104	89.7 Å²	89.7	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-82.3	-39.9	-177.3	-58.6	178.9	0	0	0	110.6	N812 D813 Q819	N812-I815 PolarHBondContact O-N 2.82Å; D813-I815 VanDerWaalsContact C-N 3.31Å; D813-I815 PolarHBondContact O-N 3.4Å; I815-Q819 PolarHBondContact O-N 2.96Å
816	S	41	Very low	41.4	Very low	53 Å²	53	88.4 Å²	88.4	37%	0.371	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-45.6	173.6	45.1	0	0	0	0	111.6	D813 N818 Q819 C820	D813-S816 PolarHBondContact O-OG 3.01Å; S816-N818 VanDerWaalsContact C-N 3.34Å; S816-N818 PolarHBondContact O-N 3.24Å; S816-Q819 PolarHBondContact O-N 3.14Å; S816-Q819 VanDerWaalsContact O-N 3.11Å; S816-C820 PolarHBondContact O-N 3.49Å; S816-C820 PolarHBondContact O-SG 3.3Å
817	N	38.9	Very low	43.8	Very low	57 Å²	57	83.8 Å²	83.8	31%	0.305	48%	0.483	S	S	.	.	H	α-helix	trans	-58.6	-41.7	178.7	-74.7	-13	0	0	0	112.9	D813 Q819 C820 I821	D813-N817 VanDerWaalsContact O-CG 3.3Å; D813-N817 PolarHBondContact O-N 3.16Å; D813-N817 PolarHBondContact O-ND2 3.44Å; N817-Q819 PolarHBondContact O-N 3.32Å; N817-C820 WeakPolarHBondContact O-CB 3.2Å; N817-C820 PolarHBondContact O-N 2.74Å; N817-I821 WeakPolarHBondContact O-CG1 3.21Å; N817-I821 PolarHBondContact O-N 3.13Å
818	N	36.7	Very low	46.6	Very low	38 Å²	38	76.2 Å²	76.2	20%	0.203	44%	0.444	C	S	.	.	H	α-helix	trans	-62.8	-39.5	175.7	-86.1	-1.9	0	0	0	112.8	C814 S816 I821 S822 Q1049	C814-N818 PolarHBondContact O-N 3.13Å; S816-N818 VanDerWaalsContact C-N 3.34Å; S816-N818 PolarHBondContact O-N 3.24Å; N818-I821 PolarHBondContact O-N 3.41Å; N818-S822 PolarHBondContact O-N 3.38Å; N818-S822 PolarHBondContact O-OG 3.3Å; N818-Q1049 PolarHBondContact ND2-NE2 3.29Å
819	Q	46.8	Very low	49.6	Very low	125 Å²	125	73.5 Å²	73.5	58%	0.584	42%	0.423	S	S	*	.	H	α-helix	trans	-65.9	-41.2	175.4	-69.7	-175	0.1	0	0	111.9	I815 S816 N817 S822 N823	I815-Q819 PolarHBondContact O-N 2.96Å; S816-Q819 PolarHBondContact O-N 3.14Å; S816-Q819 VanDerWaalsContact O-N 3.11Å; N817-Q819 PolarHBondContact O-N 3.32Å; Q819-S822 WeakPolarHBondContact CA-OG 3.48Å; Q819-S822 PolarHBondContact O-N 3.45Å; Q819-S822 PolarHBondContact O-OG 3.19Å; Q819-N823 PolarHBondContact O-N 3.26Å; Q819-N823 VanDerWaalsContact O-N 3.16Å; Q819-N823 PolarHBondContact O-ND2 3.42Å
820	C	47.9	Very low	52.7	Low	51 Å²	51	69 Å²	69	35%	0.345	39%	0.391	S	S	.	.	H	α-helix	trans	-56.7	-51.8	172.9	-69.1	0	0	0	0	110.8	S816 N817 S822 N823 I824	S816-C820 PolarHBondContact O-N 3.49Å; S816-C820 PolarHBondContact O-SG 3.3Å; N817-C820 WeakPolarHBondContact O-CB 3.2Å; N817-C820 PolarHBondContact O-N 2.74Å; C820-S822 PolarHBondContact O-N 2.83Å; C820-N823 WeakPolarHBondContact O-CB 3.5Å; C820-N823 PolarHBondContact O-N 2.96Å; C820-I824 WeakPolarHBondContact O-CG1 3.49Å; C820-I824 PolarHBondContact O-N 3.47Å
821	I	52.7	Low	55.5	Low	34 Å²	34	63.6 Å²	63.6	17%	0.174	36%	0.361	C	S	.	.	H	α-helix	trans	-59.5	-42.8	-179.1	-66.1	165.9	0	0	0	111.9	N817 N818 N823 I824 Q825	N817-I821 WeakPolarHBondContact O-CG1 3.21Å; N817-I821 PolarHBondContact O-N 3.13Å; N818-I821 PolarHBondContact O-N 3.41Å; I821-N823 VanDerWaalsContact C-N 3.28Å; I821-N823 PolarHBondContact O-N 3.26Å; I821-I824 PolarHBondContact O-N 3.2Å; I821-Q825 PolarHBondContact O-N 3.2Å
822	S	55.4	Low	58.2	Low	55 Å²	55	58.8 Å²	58.8	39%	0.385	33%	0.33	S	S	.	.	H	α-helix	trans	-62.7	-32.2	175.9	50.1	0	0	0	0	113.6	N818 Q819 C820 Q825	N818-S822 PolarHBondContact O-N 3.38Å; N818-S822 PolarHBondContact O-OG 3.3Å; Q819-S822 WeakPolarHBondContact CA-OG 3.48Å; Q819-S822 PolarHBondContact O-N 3.45Å; Q819-S822 PolarHBondContact O-OG 3.19Å; C820-S822 PolarHBondContact O-N 2.83Å; S822-Q825 PolarHBondContact O-N 2.92Å
823	N	60.3	Low	61	Low	110 Å²	110	53.5 Å²	53.5	59%	0.588	30%	0.302	S	S	*	.	H	α-helix	trans	-74.4	-31	178.7	-66.2	-18	0	0	0	112.5	Q819 C820 I821 Q825 S826	Q819-N823 PolarHBondContact O-N 3.26Å; Q819-N823 VanDerWaalsContact O-N 3.16Å; Q819-N823 PolarHBondContact O-ND2 3.42Å; C820-N823 WeakPolarHBondContact O-CB 3.5Å; C820-N823 PolarHBondContact O-N 2.96Å; I821-N823 VanDerWaalsContact C-N 3.28Å; I821-N823 PolarHBondContact O-N 3.26Å; N823-Q825 VanDerWaalsContact C-N 3.25Å; N823-Q825 PolarHBondContact O-N 3.48Å; N823-S826 PolarHBondContact O-OG 3.16Å
824	I	68.5	Low	63.7	Low	10 Å²	10	48.5 Å²	48.5	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-41	172.2	-41.2	166.9	0	0	0	109.8	L746 W749 C820 I821 S826 D827 L828	L746-I824 HydrophobicContact CD1-CD1 4.44Å; L746-I824 HydrophobicContact CD1-CG2 4.09Å; W749-I824 HydrophobicContact CD2-CD1 4.32Å; W749-I824 HydrophobicContact CD2-CG1 4.12Å; W749-I824 HydrophobicContact CD2-CG2 4.28Å; W749-I824 HydrophobicContact CE3-CD1 3.69Å; W749-I824 HydrophobicContact CE3-CG1 4Å; W749-I824 HydrophobicContact CE3-CG2 4.44Å; W749-I824 HydrophobicContact CH2-CD1 3.45Å; W749-I824 VanDerWaalsContact CH2-CD1 3.45Å; W749-I824 HydrophobicContact CH2-CG1 3.49Å; W749-I824 VanDerWaalsContact CH2-CG1 3.49Å; W749-I824 HydrophobicContact CZ2-CD1 4.09Å; W749-I824 HydrophobicContact CZ2-CG1 3.61Å; W749-I824 HydrophobicContact CZ3-CD1 3.21Å; W749-I824 HydrophobicContact CZ3-CG1 3.7Å; C820-I824 WeakPolarHBondContact O-CG1 3.49Å; C820-I824 PolarHBondContact O-N 3.47Å; I821-I824 PolarHBondContact O-N 3.2Å; I824-S826 PolarHBondContact O-N 2.93Å; I824-S826 VanDerWaalsContact O-N 3.13Å; I824-D827 CarbonylContact O-C 3.6Å; I824-D827 WeakPolarHBondContact O-CA 3.42Å; I824-D827 WeakPolarHBondContact O-CB 3.12Å; I824-D827 PolarHBondContact O-N 3.43Å; I824-L828 HydrophobicContact CG2-CD1 4.22Å; I824-L828 HydrophobicContact CG2-CD2 3.98Å; I824-L828 HydrophobicContact CG2-CG 3.99Å; I824-L828 WeakPolarHBondContact O-CG 3.26Å; I824-L828 PolarHBondContact O-N 3.07Å; I824-L828 VanDerWaalsContact O-N 3.14Å
825	Q	69.9	Low	66.4	Low	46 Å²	46	44.7 Å²	44.7	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-29.7	-169.5	-73	-164.8	15.5	0	0	113.7	I821 S822 N823 N832 N1047	I821-Q825 PolarHBondContact O-N 3.2Å; S822-Q825 PolarHBondContact O-N 2.92Å; N823-Q825 VanDerWaalsContact C-N 3.25Å; N823-Q825 PolarHBondContact O-N 3.48Å; Q825-N832 PolarHBondContact O-ND2 3.14Å; Q825-N832 PolarHBondContact O-OD1 3.31Å; Q825-N1047 PolarHBondContact NE2-OD1 2.99Å
826	S	68.8	Low	69.1	Low	75 Å²	75	43.3 Å²	43.3	52%	0.524	24%	0.242	S	C	.	.	H	α-helix	trans	-69.4	-33.2	170.7	36.1	0	0	0	0	113.7	N823 I824 L828 N832	N823-S826 PolarHBondContact O-OG 3.16Å; I824-S826 PolarHBondContact O-N 2.93Å; I824-S826 VanDerWaalsContact O-N 3.13Å; S826-L828 VanDerWaalsContact C-N 3.34Å; S826-N832 PolarHBondContact O-ND2 3.35Å
827	D	77.9	Confident	71.4	Confident	64 Å²	64	40.8 Å²	40.8	34%	0.342	22%	0.224	S	C	.	.	H	α-helix	trans	-80.5	-12.1	179.3	-76.9	-3.7	0	0	0	113	Q667 I824 L829	Q667-D827 PolarHBondContact NE2-O 3.13Å; I824-D827 CarbonylContact O-C 3.6Å; I824-D827 WeakPolarHBondContact O-CA 3.42Å; I824-D827 WeakPolarHBondContact O-CB 3.12Å; I824-D827 PolarHBondContact O-N 3.43Å; D827-L829 PolarHBondContact O-N 2.72Å
828	L	84.9	Confident	73.8	Confident	10 Å²	10	38.1 Å²	38.1	5%	0.052	21%	0.21	C	C	.	.			trans	-79	56	174.6	-58.7	177.7	0	0	0	112.3	Q742 I824 S826 L830 R831 N832 L1043	Q742-L828 HydrophobicContact CG-CB 4.33Å; Q742-L828 HydrophobicContact CG-CD2 4.05Å; Q742-L828 VanDerWaalsContact NE2-CD2 3.34Å; Q742-L828 PolarHBondContact OE1-O 2.93Å; I824-L828 HydrophobicContact CG2-CD1 4.22Å; I824-L828 HydrophobicContact CG2-CD2 3.98Å; I824-L828 HydrophobicContact CG2-CG 3.99Å; I824-L828 WeakPolarHBondContact O-CG 3.26Å; I824-L828 PolarHBondContact O-N 3.07Å; I824-L828 VanDerWaalsContact O-N 3.14Å; S826-L828 VanDerWaalsContact C-N 3.34Å; L828-L830 VanDerWaalsContact C-N 3.29Å; L828-L830 PolarHBondContact O-N 3.22Å; L828-L830 VanDerWaalsContact O-N 3.1Å; L828-R831 HydrophobicContact CB-CB 4.05Å; L828-R831 WeakPolarHBondContact O-CB 3.39Å; L828-R831 PolarHBondContact O-N 3.23Å; L828-R831 VanDerWaalsContact O-N 3.1Å; L828-N832 VanDerWaalsContact O-CG 3.27Å; L828-N832 PolarHBondContact O-N 3.13Å; L828-N832 PolarHBondContact O-ND2 3.31Å; L828-N832 PolarHBondContact O-OD1 2.99Å; L828-L1043 HydrophobicContact CD1-CD2 3.91Å
829	L	87.9	Confident	76.3	Confident	37 Å²	37	38.8 Å²	38.8	19%	0.194	21%	0.213	C	C	.	.	H	α-helix	trans	-49.7	-33.7	-174.9	-57.1	177.3	0	0	0	116.2	Q667 K668 D827 L833	Q667-L829 HydrophobicContact CG-CB 4.31Å; K668-L829 HydrophobicContact CB-CD1 4.41Å; K668-L829 HydrophobicContact CD-CD1 4.41Å; K668-L829 HydrophobicContact CG-CD1 3.37Å; D827-L829 PolarHBondContact O-N 2.72Å; L829-L833 VanDerWaalsContact O-CB 3.26Å; L829-L833 WeakPolarHBondContact O-CB 3.34Å; L829-L833 PolarHBondContact O-N 2.85Å
830	L	88.8	Confident	78.2	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-81.2	-38	179.6	-67.2	173.3	0	0	0	111.5	Q667 L670 C671 M738 F741 L828 N832 L833 A834	Q667-L830 HydrophobicContact CG-CD1 4.05Å; Q667-L830 HydrophobicContact CG-CG 3.9Å; L670-L830 HydrophobicContact CB-CD1 4.32Å; L670-L830 HydrophobicContact CB-CD2 4.12Å; L670-L830 HydrophobicContact CD1-CD1 4.2Å; C671-L830 HydrophobicContact CB-CD2 3.92Å; M738-L830 HydrophobicContact CB-CB 4.3Å; M738-L830 HydrophobicContact CE-CB 4.17Å; M738-L830 HydrophobicContact CE-CD2 4.16Å; M738-L830 WeakPolarHBondContact CE-O 3.5Å; M738-L830 HydrophobicContact CG-CD2 4.5Å; F741-L830 HydrophobicContact CB-CD1 4.42Å; F741-L830 HydrophobicContact CD1-CD1 3.71Å; F741-L830 HydrophobicContact CG-CD1 4.41Å; L828-L830 VanDerWaalsContact C-N 3.29Å; L828-L830 PolarHBondContact O-N 3.22Å; L828-L830 VanDerWaalsContact O-N 3.1Å; L830-N832 VanDerWaalsContact C-N 3.3Å; L830-L833 PolarHBondContact O-N 3.32Å; L830-A834 WeakPolarHBondContact O-CB 3.39Å; L830-A834 PolarHBondContact O-N 3.36Å
831	R	87.4	Confident	80.2	Confident	16 Å²	16	33.1 Å²	33.1	6%	0.06	18%	0.183	C	C	.	.	H	α-helix	trans	-56.8	-48.7	166.6	164.1	-143.2	-176.9	-129.1	11.6	109.9	Q742 L828 A834 L835 L1043	Q742-R831 HydrophobicContact CG-CB 4.2Å; L828-R831 HydrophobicContact CB-CB 4.05Å; L828-R831 WeakPolarHBondContact O-CB 3.39Å; L828-R831 PolarHBondContact O-N 3.23Å; L828-R831 VanDerWaalsContact O-N 3.1Å; R831-A834 WeakPolarHBondContact O-CB 3.41Å; R831-A834 PolarHBondContact O-N 3.45Å; R831-L835 HydrophobicContact CG-CD1 4.09Å; R831-L835 WeakPolarHBondContact O-CG 3.41Å; R831-L835 PolarHBondContact O-N 3.15Å; R831-L1043 HydrophobicContact CB-CD2 4.46Å; R831-L1043 HydrophobicContact CG-CB 4.15Å; R831-L1043 PolarHBondContact NE-O 3.39Å; R831-L1043 PolarHBondContact NH2-O 3.48Å
832	N	86.4	Confident	82	Confident	35 Å²	35	31.6 Å²	31.6	19%	0.187	18%	0.175	C	C	.	.	H	α-helix	trans	-64	-44.9	-177.9	-62	-14.8	0	0	0	110.9	Q825 S826 L828 L830 A834 L835 D836	Q825-N832 PolarHBondContact O-ND2 3.14Å; Q825-N832 PolarHBondContact O-OD1 3.31Å; S826-N832 PolarHBondContact O-ND2 3.35Å; L828-N832 VanDerWaalsContact O-CG 3.27Å; L828-N832 PolarHBondContact O-N 3.13Å; L828-N832 PolarHBondContact O-ND2 3.31Å; L828-N832 PolarHBondContact O-OD1 2.99Å; L830-N832 VanDerWaalsContact C-N 3.3Å; N832-A834 VanDerWaalsContact C-N 3.32Å; N832-A834 PolarHBondContact O-N 3.21Å; N832-L835 CarbonylContact O-C 3.47Å; N832-L835 WeakPolarHBondContact O-CB 3.48Å; N832-L835 PolarHBondContact O-N 2.96Å; N832-L835 VanDerWaalsContact O-N 3.09Å; N832-D836 VanDerWaalsContact O-CG 3.29Å; N832-D836 PolarHBondContact O-N 2.86Å
833	L	89.1	Confident	83.7	Confident	2 Å²	2	31 Å²	31	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-58.3	-41.7	173.4	-171.7	69.9	0	0	0	112.5	V674 S675 L680 I683 M738 L829 L830 D836 M837	V674-L833 HydrophobicContact CB-CD2 3.72Å; V674-L833 HydrophobicContact CG1-CD2 3.63Å; S675-L833 WeakPolarHBondContact OG-CD1 3.44Å; L680-L833 HydrophobicContact CD1-CD1 3.59Å; L680-L833 HydrophobicContact CD1-CG 4.37Å; I683-L833 HydrophobicContact CD1-CD1 4.47Å; M738-L833 HydrophobicContact CE-CB 4.05Å; M738-L833 HydrophobicContact CE-CD2 3.96Å; M738-L833 HydrophobicContact CE-CG 4.23Å; L829-L833 VanDerWaalsContact O-CB 3.26Å; L829-L833 WeakPolarHBondContact O-CB 3.34Å; L829-L833 PolarHBondContact O-N 2.85Å; L830-L833 PolarHBondContact O-N 3.32Å; L833-D836 PolarHBondContact O-N 3.49Å; L833-M837 HydrophobicContact CG-SD 4.39Å; L833-M837 WeakPolarHBondContact O-CB 3.38Å; L833-M837 VanDerWaalsContact O-CG 3.22Å; L833-M837 WeakPolarHBondContact O-CG 3.44Å; L833-M837 PolarHBondContact O-N 3.06Å
834	A	88.5	Confident	85	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.7	-40	175.1	0	0	0	0	0	112	V735 M738 L830 R831 N832 M837 I838	V735-A834 HydrophobicContact CG1-CB 4.15Å; V735-A834 HydrophobicContact CG2-CB 4.12Å; M738-A834 HydrophobicContact CE-CB 4.02Å; L830-A834 WeakPolarHBondContact O-CB 3.39Å; L830-A834 PolarHBondContact O-N 3.36Å; R831-A834 WeakPolarHBondContact O-CB 3.41Å; R831-A834 PolarHBondContact O-N 3.45Å; N832-A834 VanDerWaalsContact C-N 3.32Å; N832-A834 PolarHBondContact O-N 3.21Å; A834-M837 PolarHBondContact O-N 3.35Å; A834-I838 WeakPolarHBondContact O-CD1 3.48Å; A834-I838 WeakPolarHBondContact O-CG1 3.29Å; A834-I838 PolarHBondContact O-N 3.25Å
835	L	86.8	Confident	86.1	Confident	14 Å²	14	29.4 Å²	29.4	7%	0.073	15%	0.154	C	C	.	.	H	α-helix	trans	-66.6	-43.6	174.9	-70.2	171.7	0	0	0	111.9	R831 N832 M837 I838 I839 L955 F959 Y1044	R831-L835 HydrophobicContact CG-CD1 4.09Å; R831-L835 WeakPolarHBondContact O-CG 3.41Å; R831-L835 PolarHBondContact O-N 3.15Å; N832-L835 CarbonylContact O-C 3.47Å; N832-L835 WeakPolarHBondContact O-CB 3.48Å; N832-L835 PolarHBondContact O-N 2.96Å; N832-L835 VanDerWaalsContact O-N 3.09Å; L835-M837 VanDerWaalsContact C-N 3.29Å; L835-M837 PolarHBondContact O-N 3.48Å; L835-I838 HydrophobicContact CD2-CD1 4.43Å; L835-I838 PolarHBondContact O-N 2.91Å; L835-I839 WeakPolarHBondContact O-CB 3.41Å; L835-I839 WeakPolarHBondContact O-CD1 3.41Å; L835-I839 VanDerWaalsContact O-CG1 3.24Å; L835-I839 WeakPolarHBondContact O-CG1 3.3Å; L835-I839 PolarHBondContact O-N 3.09Å; L835-L955 HydrophobicContact CD1-CD2 3.95Å; L835-L955 HydrophobicContact CD2-CD2 3.78Å; L835-L955 HydrophobicContact CD2-CG 4.4Å; L835-F959 HydrophobicContact CD2-CE2 4.43Å; L835-Y1044 HydrophobicContact CD2-CD1 3.93Å; L835-Y1044 HydrophobicContact CD2-CE1 3.93Å; L835-Y1044 HydrophobicContact CG-CE1 4.2Å
836	D	86.5	Confident	87.3	Confident	75 Å²	75	28.1 Å²	28.1	40%	0.401	15%	0.148	S	C	.	.	H	α-helix	trans	-59.3	-41.1	175	-66.8	-33.7	0	0	0	110.9	N832 L833 I839 L840	N832-D836 VanDerWaalsContact O-CG 3.29Å; N832-D836 PolarHBondContact O-N 2.86Å; L833-D836 PolarHBondContact O-N 3.49Å; D836-I839 PolarHBondContact O-N 3.19Å; D836-L840 WeakPolarHBondContact O-CB 3.32Å; D836-L840 VanDerWaalsContact O-CG 3.25Å; D836-L840 WeakPolarHBondContact O-CG 3.45Å; D836-L840 PolarHBondContact O-N 3.44Å
837	M	89.5	Confident	88.5	Confident	1 Å²	1	29 Å²	29	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-64.7	-43.9	173.6	-70.8	174.9	76.8	0	0	112.7	V674 F678 L680 F723 F731 L734 L833 A834 L835 L840 I841	V674-M837 HydrophobicContact CG1-SD 4.26Å; F678-M837 HydrophobicContact CB-CE 4.34Å; F678-M837 HydrophobicContact CD1-CE 3.62Å; F678-M837 HydrophobicContact CD2-CE 3.44Å; F678-M837 VanDerWaalsContact CD2-CE 3.44Å; F678-M837 HydrophobicContact CD2-SD 4.35Å; F678-M837 HydrophobicContact CE1-CE 3.67Å; F678-M837 HydrophobicContact CE2-CE 3.51Å; F678-M837 HydrophobicContact CG-CE 3.51Å; F678-M837 HydrophobicContact CZ-CE 3.62Å; L680-M837 HydrophobicContact CD1-CG 3.67Å; L680-M837 HydrophobicContact CD1-SD 4.15Å; F723-M837 HydrophobicContact CE1-CE 3.86Å; F723-M837 HydrophobicContact CZ-CB 4.5Å; F723-M837 HydrophobicContact CZ-CE 4.09Å; F723-M837 HydrophobicContact CZ-CG 4.43Å; F731-M837 HydrophobicContact CD2-CE 4.42Å; F731-M837 HydrophobicContact CE2-CB 4.12Å; F731-M837 HydrophobicContact CE2-CE 3.86Å; F731-M837 HydrophobicContact CZ-CB 4.16Å; L734-M837 HydrophobicContact CD2-CE 4.16Å; L833-M837 HydrophobicContact CG-SD 4.39Å; L833-M837 WeakPolarHBondContact O-CB 3.38Å; L833-M837 VanDerWaalsContact O-CG 3.22Å; L833-M837 WeakPolarHBondContact O-CG 3.44Å; L833-M837 PolarHBondContact O-N 3.06Å; A834-M837 PolarHBondContact O-N 3.35Å; L835-M837 VanDerWaalsContact C-N 3.29Å; L835-M837 PolarHBondContact O-N 3.48Å; M837-L840 PolarHBondContact O-N 3.24Å; M837-I841 WeakPolarHBondContact O-CD1 3.36Å; M837-I841 VanDerWaalsContact O-CG1 3.27Å; M837-I841 WeakPolarHBondContact O-CG1 3.43Å; M837-I841 PolarHBondContact O-N 2.92Å
838	I	89.2	Confident	89.2	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-48.2	175.3	-71.7	160	0	0	0	110.3	F731 A834 L835 L840 I841 I842 L950 P951 T956	F731-I838 HydrophobicContact CE1-CG1 3.96Å; F731-I838 HydrophobicContact CZ-CG1 3.87Å; A834-I838 WeakPolarHBondContact O-CD1 3.48Å; A834-I838 WeakPolarHBondContact O-CG1 3.29Å; A834-I838 PolarHBondContact O-N 3.25Å; L835-I838 HydrophobicContact CD2-CD1 4.43Å; L835-I838 PolarHBondContact O-N 2.91Å; I838-L840 PolarHBondContact O-N 2.95Å; I838-I841 PolarHBondContact O-N 3Å; I838-I842 HydrophobicContact CG2-CD1 3.66Å; I838-I842 HydrophobicContact CG2-CG1 4.41Å; I838-I842 VanDerWaalsContact O-CG1 3.31Å; I838-I842 WeakPolarHBondContact O-CG1 3.41Å; I838-I842 PolarHBondContact O-N 3.38Å; I838-L950 HydrophobicContact CG2-CD1 4.39Å; I838-P951 HydrophobicContact CD1-CG 4.4Å; I838-P951 WeakPolarHBondContact CD1-O 3.27Å; I838-T956 HydrophobicContact CG2-CG2 3.92Å
839	I	88.1	Confident	89.6	Confident	52 Å²	52	30.6 Å²	30.6	27%	0.267	15%	0.145	S	C	.	.	H	α-helix	trans	-61.3	-44.2	179.3	-67.7	162.5	0	0	0	110.5	L835 D836 I841 I842 D843 F959	L835-I839 WeakPolarHBondContact O-CB 3.41Å; L835-I839 WeakPolarHBondContact O-CD1 3.41Å; L835-I839 VanDerWaalsContact O-CG1 3.24Å; L835-I839 WeakPolarHBondContact O-CG1 3.3Å; L835-I839 PolarHBondContact O-N 3.09Å; D836-I839 PolarHBondContact O-N 3.19Å; I839-I841 VanDerWaalsContact C-N 3.34Å; I839-I841 PolarHBondContact O-N 3.18Å; I839-I842 PolarHBondContact O-N 3.19Å; I839-D843 VanDerWaalsContact O-CB 3.28Å; I839-D843 WeakPolarHBondContact O-CB 3.47Å; I839-D843 PolarHBondContact O-N 3.28Å; I839-F959 HydrophobicContact CD1-CD2 4.34Å; I839-F959 HydrophobicContact CD1-CE1 4.43Å; I839-F959 HydrophobicContact CD1-CE2 3.76Å; I839-F959 HydrophobicContact CD1-CZ 3.82Å; I839-F959 HydrophobicContact CG1-CD2 3.76Å; I839-F959 HydrophobicContact CG1-CE2 3.68Å; I839-F959 HydrophobicContact CG1-CG 4.28Å; I839-F959 HydrophobicContact CG1-CZ 4.15Å
840	L	88.5	Confident	90	Very high	39 Å²	39	32.6 Å²	32.6	20%	0.204	15%	0.151	C	C	.	.	H	α-helix	trans	-61.8	-38.6	176.9	-76.6	167.3	0	0	0	113	L680 D836 M837 I838 R844	L680-L840 HydrophobicContact CD2-CD1 3.38Å; D836-L840 WeakPolarHBondContact O-CB 3.32Å; D836-L840 VanDerWaalsContact O-CG 3.25Å; D836-L840 WeakPolarHBondContact O-CG 3.45Å; D836-L840 PolarHBondContact O-N 3.44Å; M837-L840 PolarHBondContact O-N 3.24Å; I838-L840 PolarHBondContact O-N 2.95Å; L840-R844 WeakPolarHBondContact O-CB 3.44Å; L840-R844 PolarHBondContact O-N 2.97Å
841	I	89.4	Confident	90.2	Very high	19 Å²	19	37 Å²	37	10%	0.097	18%	0.175	C	C	.	.	H	α-helix	trans	-64.9	-47.7	174.7	-69.5	163.6	0	0	0	110.6	F723 W728 F731 M837 I838 I839 R844 F845 L946 L950	F723-I841 HydrophobicContact CD1-CD1 3.93Å; F723-I841 HydrophobicContact CD1-CG1 3.93Å; F723-I841 HydrophobicContact CE1-CD1 3.78Å; F723-I841 HydrophobicContact CE1-CG1 3.92Å; F723-I841 HydrophobicContact CG-CG1 4.4Å; F723-I841 HydrophobicContact CZ-CG1 4.37Å; W728-I841 HydrophobicContact CH2-CG2 3.67Å; W728-I841 HydrophobicContact CZ3-CG2 3.98Å; F731-I841 HydrophobicContact CD1-CD1 4.16Å; F731-I841 HydrophobicContact CE1-CD1 3.71Å; F731-I841 HydrophobicContact CE2-CD1 4.14Å; F731-I841 HydrophobicContact CZ-CD1 3.7Å; M837-I841 WeakPolarHBondContact O-CD1 3.36Å; M837-I841 VanDerWaalsContact O-CG1 3.27Å; M837-I841 WeakPolarHBondContact O-CG1 3.43Å; M837-I841 PolarHBondContact O-N 2.92Å; I838-I841 PolarHBondContact O-N 3Å; I839-I841 VanDerWaalsContact C-N 3.34Å; I839-I841 PolarHBondContact O-N 3.18Å; I841-R844 PolarHBondContact O-N 2.77Å; I841-F845 WeakPolarHBondContact O-CB 3.12Å; I841-F845 PolarHBondContact O-N 3.03Å; I841-L946 HydrophobicContact CG2-CD1 4.39Å; I841-L950 HydrophobicContact CG2-CD2 4.25Å
842	I	91.1	Very high	90.6	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-64.7	-45.2	179.2	-61.3	165.5	0	0	0	110.6	I838 I839 R844 F845 H846 L946 L950 T956 F959 V960 R963	I838-I842 HydrophobicContact CG2-CD1 3.66Å; I838-I842 HydrophobicContact CG2-CG1 4.41Å; I838-I842 VanDerWaalsContact O-CG1 3.31Å; I838-I842 WeakPolarHBondContact O-CG1 3.41Å; I838-I842 PolarHBondContact O-N 3.38Å; I839-I842 PolarHBondContact O-N 3.19Å; I842-R844 VanDerWaalsContact C-N 3.32Å; I842-R844 PolarHBondContact O-N 3.31Å; I842-F845 PolarHBondContact O-N 3.12Å; I842-H846 VanDerWaalsContact O-CB 3.23Å; I842-H846 WeakPolarHBondContact O-CB 3.35Å; I842-H846 PolarHBondContact O-N 3.1Å; I842-L946 HydrophobicContact CG1-CD2 4.24Å; I842-L950 HydrophobicContact CD1-CD1 3.96Å; I842-L950 HydrophobicContact CG1-CD1 3.69Å; I842-T956 HydrophobicContact CD1-CG2 4.41Å; I842-F959 HydrophobicContact CD1-CB 3.75Å; I842-V960 HydrophobicContact CD1-CG2 3.72Å; I842-V960 HydrophobicContact CG1-CG2 4.03Å; I842-V960 HydrophobicContact CG2-CG2 4.35Å; I842-R963 HydrophobicContact CG2-CB 4.05Å; I842-R963 HydrophobicContact CG2-CG 3.82Å
843	D	90.9	Very high	91	Very high	43 Å²	43	39.9 Å²	39.9	23%	0.23	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-36	178.4	-88.3	4.9	0	0	0	112.1	I839 R847 R963	I839-D843 VanDerWaalsContact O-CB 3.28Å; I839-D843 WeakPolarHBondContact O-CB 3.47Å; I839-D843 PolarHBondContact O-N 3.28Å; D843-R847 WeakPolarHBondContact O-CG 3.13Å; D843-R847 PolarHBondContact O-N 2.93Å; D843-R847 PolarHBondContact O-NH1 3.5Å; D843-R963 WeakPolarHBondContact OD1-CD 3.44Å; D843-R963 IonicContact OD1-CZ 3.57Å; D843-R963 IonicContact OD1-NE 2.72Å; D843-R963 PolarHBondContact OD1-NE 3.02Å; D843-R963 IonicContact OD1-NH2 3.41Å
844	R	87.6	Confident	91.2	Very high	42 Å²	42	41.3 Å²	41.3	16%	0.158	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-53.6	172.9	176.5	175.9	168.4	-169	-2.3	111.1	D720 D724 L840 I841 I842 H846 R847 E848	D720-R844 PolarHBondContact O-NH1 3.45Å; D724-R844 IonicContact OD1-CZ 2.94Å; D724-R844 IonicContact OD1-NH1 2.82Å; D724-R844 PolarHBondContact OD1-NH1 2.89Å; D724-R844 IonicContact OD1-NH2 2.65Å; D724-R844 PolarHBondContact OD1-NH2 2.86Å; D724-R844 IonicContact OD2-CZ 3.04Å; D724-R844 IonicContact OD2-NH1 3.35Å; D724-R844 IonicContact OD2-NH2 3.34Å; D724-R844 PolarHBondContact OD2-NH2 2.72Å; L840-R844 WeakPolarHBondContact O-CB 3.44Å; L840-R844 PolarHBondContact O-N 2.97Å; I841-R844 PolarHBondContact O-N 2.77Å; I842-R844 VanDerWaalsContact C-N 3.32Å; I842-R844 PolarHBondContact O-N 3.31Å; R844-H846 PolarHBondContact O-N 3.08Å; R844-R847 PolarHBondContact O-N 3.17Å; R844-R847 VanDerWaalsContact O-N 3.13Å; R844-E848 WeakPolarHBondContact CG-OE1 3.38Å; R844-E848 IonicContact CZ-OE1 2.95Å; R844-E848 IonicContact NE-OE1 3.34Å; R844-E848 PolarHBondContact NE-OE1 2.91Å; R844-E848 IonicContact NH2-OE1 3.13Å; R844-E848 PolarHBondContact NH2-OE1 3.19Å; R844-E848 WeakPolarHBondContact O-CG 3.37Å; R844-E848 PolarHBondContact O-N 3.36Å
845	F	91.9	Very high	91.4	Very high	44 Å²	44	46.8 Å²	46.8	19%	0.193	22%	0.22	C	C	.	.	H	α-helix	trans	-58.4	-35.6	177.8	175.4	-95.1	0	0	0	112.2	I841 I842 N849 D942 Y943 L946	I841-F845 WeakPolarHBondContact O-CB 3.12Å; I841-F845 PolarHBondContact O-N 3.03Å; I842-F845 PolarHBondContact O-N 3.12Å; F845-N849 WeakPolarHBondContact CE1-ND2 3.44Å; F845-N849 WeakPolarHBondContact CE2-ND2 3.44Å; F845-N849 VanDerWaalsContact CZ-ND2 3.27Å; F845-N849 WeakPolarHBondContact CZ-ND2 3.43Å; F845-N849 PolarHBondContact O-N 3.43Å; F845-N849 VanDerWaalsContact O-N 3.13Å; F845-N849 PolarHBondContact O-ND2 3.09Å; F845-D942 HydrophobicContact CE2-CB 4.46Å; F845-D942 HydrophobicContact CZ-CB 3.87Å; F845-Y943 HydrophobicContact CD1-CE1 4.35Å; F845-Y943 HydrophobicContact CD1-CE2 4.34Å; F845-Y943 HydrophobicContact CE1-CD1 4.15Å; F845-Y943 AromaticContact CE1-CD2 3.59Å; F845-Y943 HydrophobicContact CE1-CD2 3.59Å; F845-Y943 HydrophobicContact CE1-CE1 4.23Å; F845-Y943 AromaticContact CE1-CE2 3.66Å; F845-Y943 HydrophobicContact CE1-CE2 3.66Å; F845-Y943 AromaticContact CE1-CG 3.83Å; F845-Y943 HydrophobicContact CE1-CG 3.83Å; F845-Y943 AromaticContact CE1-CZ 4Å; F845-Y943 HydrophobicContact CZ-CD2 4.31Å; F845-Y943 HydrophobicContact CZ-CE2 4.49Å; F845-L946 HydrophobicContact CB-CD2 3.97Å; F845-L946 HydrophobicContact CD1-CD2 3.46Å; F845-L946 VanDerWaalsContact CD1-CD2 3.46Å; F845-L946 HydrophobicContact CD2-CD2 4.44Å; F845-L946 HydrophobicContact CE1-CB 4.48Å; F845-L946 HydrophobicContact CE1-CD2 3.98Å; F845-L946 HydrophobicContact CG-CD2 3.71Å
846	H	95.2	Very high	91.8	Very high	20 Å²	20	47.6 Å²	47.6	9%	0.093	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-49.6	174.2	178.1	71.7	0	0	0	111.9	I842 R844 E848 N849 Y850 Y943 R963	I842-H846 VanDerWaalsContact O-CB 3.23Å; I842-H846 WeakPolarHBondContact O-CB 3.35Å; I842-H846 PolarHBondContact O-N 3.1Å; R844-H846 PolarHBondContact O-N 3.08Å; H846-E848 PolarHBondContact O-N 3.22Å; H846-N849 PolarHBondContact O-N 2.73Å; H846-Y850 WeakPolarHBondContact O-CB 3.35Å; H846-Y850 PolarHBondContact O-N 3.34Å; H846-Y943 WeakPolarHBondContact CA-OH 3.36Å; H846-Y943 PolarHBondContact ND1-OH 3.47Å; H846-R963 HydrophobicContact CB-CB 4.3Å; H846-R963 HydrophobicContact CB-CG 4.43Å; H846-R963 VanDerWaalsContact CD2-CD 3.46Å; H846-R963 WeakPolarHBondContact CD2-CD 3.43Å; H846-R963 PolarHBondContact CE1-O 3.41Å; H846-R963 PolarHBondContact ND1-O 3.16Å
847	R	93.1	Very high	92.1	Very high	92 Å²	92	44.1 Å²	44.1	35%	0.347	21%	0.206	S	C	.	.	H	α-helix	trans	-56.4	-49.5	175.4	-75.8	-172	-61.1	-86	2	111.9	D843 R844 N849 Y850 D851	D843-R847 WeakPolarHBondContact O-CG 3.13Å; D843-R847 PolarHBondContact O-N 2.93Å; D843-R847 PolarHBondContact O-NH1 3.5Å; R844-R847 PolarHBondContact O-N 3.17Å; R844-R847 VanDerWaalsContact O-N 3.13Å; R847-N849 VanDerWaalsContact C-N 3.3Å; R847-N849 PolarHBondContact O-N 2.67Å; R847-Y850 PolarHBondContact O-N 3.44Å; R847-Y850 VanDerWaalsContact O-N 3.12Å; R847-D851 PolarHBondContact O-N 3.15Å
848	E	91.8	Very high	92	Very high	98 Å²	98	45.9 Å²	45.9	46%	0.458	22%	0.215	S	C	.	.	H	α-helix	trans	-57.8	-40.8	-179.8	-70.8	175.9	-173.1	0	0	112.4	R844 H846 K852	R844-E848 WeakPolarHBondContact CG-OE1 3.38Å; R844-E848 IonicContact CZ-OE1 2.95Å; R844-E848 IonicContact NE-OE1 3.34Å; R844-E848 PolarHBondContact NE-OE1 2.91Å; R844-E848 IonicContact NH2-OE1 3.13Å; R844-E848 PolarHBondContact NH2-OE1 3.19Å; R844-E848 WeakPolarHBondContact O-CG 3.37Å; R844-E848 PolarHBondContact O-N 3.36Å; H846-E848 PolarHBondContact O-N 3.22Å; E848-K852 WeakPolarHBondContact O-CB 3.22Å; E848-K852 PolarHBondContact O-N 2.96Å
849	N	94.1	Very high	92.1	Very high	10 Å²	10	51.7 Å²	51.7	5%	0.053	24%	0.243	C	C	.	.	H	α-helix	trans	-76.6	-34.3	175.4	-75.9	-72	0	0	0	113.3	F845 H846 R847 L853 Y943	F845-N849 WeakPolarHBondContact CE1-ND2 3.44Å; F845-N849 WeakPolarHBondContact CE2-ND2 3.44Å; F845-N849 VanDerWaalsContact CZ-ND2 3.27Å; F845-N849 WeakPolarHBondContact CZ-ND2 3.43Å; F845-N849 PolarHBondContact O-N 3.43Å; F845-N849 VanDerWaalsContact O-N 3.13Å; F845-N849 PolarHBondContact O-ND2 3.09Å; H846-N849 PolarHBondContact O-N 2.73Å; R847-N849 VanDerWaalsContact C-N 3.3Å; R847-N849 PolarHBondContact O-N 2.67Å; N849-L853 WeakPolarHBondContact O-CB 3.21Å; N849-L853 PolarHBondContact O-N 2.81Å; N849-Y943 HydrophobicContact CB-CE2 4.36Å
850	Y	95.5	Very high	92.3	Very high	80 Å²	80	49.9 Å²	49.9	31%	0.314	23%	0.233	S	C	.	.	H	α-helix	trans	-64.9	-46.4	177.5	-179.3	-87.3	0	0	0	111.4	H846 R847 L853 N854 L967 H970	H846-Y850 WeakPolarHBondContact O-CB 3.35Å; H846-Y850 PolarHBondContact O-N 3.34Å; R847-Y850 PolarHBondContact O-N 3.44Å; R847-Y850 VanDerWaalsContact O-N 3.12Å; Y850-L853 PolarHBondContact O-N 3.09Å; Y850-N854 WeakPolarHBondContact CD1-ND2 3.16Å; Y850-N854 WeakPolarHBondContact CE1-ND2 3.29Å; Y850-N854 PolarHBondContact O-N 2.95Å; Y850-N854 PolarHBondContact O-ND2 2.87Å; Y850-L967 HydrophobicContact CD2-CD1 4.38Å; Y850-H970 HydrophobicContact CD2-CB 4.37Å; Y850-H970 AromaticContact CD2-CD2 3.84Å; Y850-H970 HydrophobicContact CE2-CB 3.75Å; Y850-H970 AromaticContact CE2-CD2 3.37Å; Y850-H970 WeakPolarHBondContact CE2-CD2 3.41Å; Y850-H970 AromaticContact CE2-CG 3.38Å; Y850-H970 AromaticContact CE2-ND1 3.95Å; Y850-H970 AromaticContact CE2-NE2 3.9Å; Y850-H970 AromaticContact CZ-CD2 3.77Å; Y850-H970 AromaticContact CZ-CE1 3.93Å; Y850-H970 AromaticContact CZ-CG 3.89Å; Y850-H970 AromaticContact CZ-NE2 3.8Å
851	D	94.3	Very high	92.3	Very high	95 Å²	95	55 Å²	55	51%	0.508	25%	0.249	S	C	.	.	H	α-helix	trans	-68.3	-41.9	178.3	-67.2	-24.3	0	0	0	111.4	R847 L853 N854 M855	R847-D851 PolarHBondContact O-N 3.15Å; D851-L853 VanDerWaalsContact C-N 3.31Å; D851-L853 PolarHBondContact O-N 2.78Å; D851-N854 PolarHBondContact O-N 3.47Å; D851-M855 WeakPolarHBondContact O-CG 3.39Å; D851-M855 PolarHBondContact O-N 3.31Å
852	K	94.4	Very high	92.4	Very high	111 Å²	111	54.5 Å²	54.5	48%	0.483	25%	0.246	S	C	.	.	H	α-helix	trans	-59	-40.4	172.1	-175.6	-176.5	-179.3	-172.4	0	112	E848 L856 M939	E848-K852 WeakPolarHBondContact O-CB 3.22Å; E848-K852 PolarHBondContact O-N 2.96Å; K852-L856 WeakPolarHBondContact O-CG 3.22Å; K852-L856 PolarHBondContact O-N 3.01Å; K852-L856 VanDerWaalsContact O-N 3.16Å; K852-M939 HydrophobicContact CD-CE 3.8Å; K852-M939 HydrophobicContact CG-CE 3.88Å
853	L	95.8	Very high	92.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-70.3	-39.8	177.7	-178.1	59.4	0	0	0	112.3	N849 Y850 D851 L856 L857 T932 L936 M939 L967 F971	N849-L853 WeakPolarHBondContact O-CB 3.21Å; N849-L853 PolarHBondContact O-N 2.81Å; Y850-L853 PolarHBondContact O-N 3.09Å; D851-L853 VanDerWaalsContact C-N 3.31Å; D851-L853 PolarHBondContact O-N 2.78Å; L853-L856 PolarHBondContact O-N 2.84Å; L853-L857 HydrophobicContact CD1-CD1 4.11Å; L853-L857 HydrophobicContact CD1-CG 4.23Å; L853-L857 HydrophobicContact CG-CD1 3.88Å; L853-L857 HydrophobicContact CG-CG 4.46Å; L853-L857 WeakPolarHBondContact O-CB 3.32Å; L853-L857 WeakPolarHBondContact O-CG 3.49Å; L853-L857 PolarHBondContact O-N 3.12Å; L853-T932 HydrophobicContact CD1-CG2 4.01Å; L853-L936 HydrophobicContact CD1-CD1 4.04Å; L853-L936 HydrophobicContact CD2-CD1 3.95Å; L853-M939 HydrophobicContact CB-SD 4.46Å; L853-L967 HydrophobicContact CB-CD1 4.48Å; L853-L967 HydrophobicContact CD2-CD1 3.65Å; L853-L967 HydrophobicContact CD2-CD2 4.4Å; L853-L967 HydrophobicContact CD2-CG 3.8Å; L853-F971 HydrophobicContact CD1-CD2 4.25Å; L853-F971 HydrophobicContact CD2-CB 4.23Å
854	N	93.5	Very high	92.3	Very high	31 Å²	31	60.1 Å²	60.1	17%	0.166	28%	0.278	C	S	.	.	H	α-helix	trans	-56.8	-49.9	171.7	-82.7	-65.8	0	0	0	111.4	Y850 D851 L856 L857 D858 H970	Y850-N854 WeakPolarHBondContact CD1-ND2 3.16Å; Y850-N854 WeakPolarHBondContact CE1-ND2 3.29Å; Y850-N854 PolarHBondContact O-N 2.95Å; Y850-N854 PolarHBondContact O-ND2 2.87Å; D851-N854 PolarHBondContact O-N 3.47Å; N854-L856 VanDerWaalsContact C-N 3.27Å; N854-L856 PolarHBondContact O-N 2.97Å; N854-L857 PolarHBondContact O-N 3.25Å; N854-D858 PolarHBondContact O-N 3.44Å; N854-H970 PolarHBondContact ND2-NE2 2.86Å; N854-H970 PolarHBondContact OD1-CE1 3.23Å; N854-H970 PolarHBondContact OD1-NE2 2.87Å
855	M	93	Very high	92.5	Very high	116 Å²	116	59 Å²	59	57%	0.571	28%	0.277	S	S	*	.	H	α-helix	trans	-60.4	-34.1	179.4	-72.3	-65	-68.3	0	0	113.1	D851 Q859	D851-M855 WeakPolarHBondContact O-CG 3.39Å; D851-M855 PolarHBondContact O-N 3.31Å; M855-Q859 WeakPolarHBondContact O-CB 3.22Å; M855-Q859 VanDerWaalsContact O-CG 3.23Å; M855-Q859 WeakPolarHBondContact O-CG 3.47Å
856	L	93.8	Very high	92.3	Very high	31 Å²	31	61.7 Å²	61.7	16%	0.162	29%	0.293	C	S	.	.	H	α-helix	trans	-73.2	-46.5	174.2	-69.6	173.7	0	0	0	112.3	K852 L853 N854 D858 Q859 E860 T932 L935 M939	K852-L856 WeakPolarHBondContact O-CG 3.22Å; K852-L856 PolarHBondContact O-N 3.01Å; K852-L856 VanDerWaalsContact O-N 3.16Å; L853-L856 PolarHBondContact O-N 2.84Å; N854-L856 VanDerWaalsContact C-N 3.27Å; N854-L856 PolarHBondContact O-N 2.97Å; L856-D858 PolarHBondContact O-N 3.46Å; L856-Q859 CarbonylContact O-C 3.52Å; L856-Q859 PolarHBondContact O-N 2.95Å; L856-E860 PolarHBondContact O-N 3.03Å; L856-E860 VanDerWaalsContact O-N 3.11Å; L856-T932 HydrophobicContact CB-CG2 3.87Å; L856-L935 HydrophobicContact CD1-CB 3.85Å; L856-L935 HydrophobicContact CD1-CD1 3.7Å; L856-L935 HydrophobicContact CD1-CG 4.43Å; L856-L935 HydrophobicContact CD2-CD1 3.63Å; L856-L935 HydrophobicContact CG-CD1 4.32Å; L856-M939 HydrophobicContact CD1-CE 3.56Å
857	L	93.2	Very high	92	Very high	1 Å²	1	61 Å²	61	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-42.9	-178.6	-77.7	167.3	0	0	0	112.4	L853 N854 Q859 E860 T932 F971 R974 V975 L978	L853-L857 HydrophobicContact CD1-CD1 4.11Å; L853-L857 HydrophobicContact CD1-CG 4.23Å; L853-L857 HydrophobicContact CG-CD1 3.88Å; L853-L857 HydrophobicContact CG-CG 4.46Å; L853-L857 WeakPolarHBondContact O-CB 3.32Å; L853-L857 WeakPolarHBondContact O-CG 3.49Å; L853-L857 PolarHBondContact O-N 3.12Å; N854-L857 PolarHBondContact O-N 3.25Å; L857-Q859 PolarHBondContact O-N 3.01Å; L857-E860 WeakPolarHBondContact O-CB 3.41Å; L857-E860 PolarHBondContact O-N 3.13Å; L857-T932 HydrophobicContact CD2-CG2 3.79Å; L857-T932 HydrophobicContact CG-CG2 3.91Å; L857-F971 HydrophobicContact CD1-CD2 4.12Å; L857-F971 HydrophobicContact CD2-CD2 3.9Å; L857-F971 HydrophobicContact CD2-CE2 3.85Å; L857-F971 HydrophobicContact CG-CD2 4.45Å; L857-R974 HydrophobicContact CB-CG 4.17Å; L857-R974 HydrophobicContact CD1-CB 3.96Å; L857-R974 HydrophobicContact CD1-CG 3.82Å; L857-V975 HydrophobicContact CD2-CG2 3.76Å; L857-L978 HydrophobicContact CB-CD1 4.05Å; L857-L978 HydrophobicContact CD2-CD1 4.46Å; L857-L978 WeakPolarHBondContact O-CD1 3.48Å
858	D	88.7	Confident	91.9	Very high	39 Å²	39	59.1 Å²	59.1	21%	0.209	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-14.9	179.4	-79.8	-18.6	0	0	0	113.7	N854 L856 R974 R987	N854-D858 PolarHBondContact O-N 3.44Å; L856-D858 PolarHBondContact O-N 3.46Å; D858-R974 IonicContact OD1-CZ 3.39Å; D858-R974 IonicContact OD1-NE 2.8Å; D858-R974 PolarHBondContact OD1-NE 2.71Å; D858-R974 VanDerWaalsContact OD1-NE 3.16Å; D858-R974 IonicContact OD1-NH2 3.66Å; D858-R974 PolarHBondContact OD1-NH2 3.32Å; D858-R987 VanDerWaalsContact CG-NH1 3.28Å; D858-R987 VanDerWaalsContact OD1-CD 3.28Å; D858-R987 WeakPolarHBondContact OD1-CD 3.25Å; D858-R987 IonicContact OD1-CZ 3.33Å; D858-R987 IonicContact OD1-NE 3.2Å; D858-R987 IonicContact OD1-NH1 2.77Å; D858-R987 PolarHBondContact OD1-NH1 3.23Å; D858-R987 IonicContact OD2-CZ 2.66Å; D858-R987 IonicContact OD2-NH1 2.85Å; D858-R987 PolarHBondContact OD2-NH1 3.3Å
859	Q	90	Very high	91.6	Very high	122 Å²	122	60.7 Å²	60.7	57%	0.57	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	0.3	174.9	-65.2	179.9	13.3	0	0	113.2	M855 L856 L857 R861	M855-Q859 WeakPolarHBondContact O-CB 3.22Å; M855-Q859 VanDerWaalsContact O-CG 3.23Å; M855-Q859 WeakPolarHBondContact O-CG 3.47Å; L856-Q859 CarbonylContact O-C 3.52Å; L856-Q859 PolarHBondContact O-N 2.95Å; L857-Q859 PolarHBondContact O-N 3.01Å; Q859-R861 PolarHBondContact O-N 3.22Å
860	E	92.3	Very high	91.4	Very high	13 Å²	13	66.4 Å²	66.4	6%	0.061	32%	0.324	C	S	.	.			trans	-70.6	124.2	-174.4	-176.4	53.1	-94.4	0	0	112	L856 L857 W862 V930 R931 T932	L856-E860 PolarHBondContact O-N 3.03Å; L856-E860 VanDerWaalsContact O-N 3.11Å; L857-E860 WeakPolarHBondContact O-CB 3.41Å; L857-E860 PolarHBondContact O-N 3.13Å; E860-W862 HydrophobicContact CG-CD2 4.17Å; E860-W862 HydrophobicContact CG-CG 4.4Å; E860-W862 HydrophobicContact CG-CZ2 4.17Å; E860-W862 PolarHBondContact O-NE1 3.2Å; E860-W862 PolarHBondContact OE1-N 2.99Å; E860-W862 VanDerWaalsContact OE1-N 3.11Å; E860-V930 HydrophobicContact CG-CB 4.25Å; E860-V930 HydrophobicContact CG-CG2 4.23Å; E860-R931 PolarHBondContact OE2-N 3.26Å; E860-T932 WeakPolarHBondContact OE2-CB 3.24Å; E860-T932 PolarHBondContact OE2-N 2.88Å; E860-T932 PolarHBondContact OE2-OG1 3.02Å
861	R	88.8	Confident	91.2	Very high	146 Å²	146	63.4 Å²	63.4	55%	0.551	31%	0.313	S	S	*	.			trans	-90	-0.8	-177.5	-67.9	-174.6	168.1	-162.5	-8.9	113.3	Q859 Q863 V988	Q859-R861 PolarHBondContact O-N 3.22Å; R861-Q863 VanDerWaalsContact C-N 3.29Å; R861-Q863 HydrophobicContact CB-CG 4.16Å; R861-Q863 PolarHBondContact O-N 3.44Å; R861-V988 HydrophobicContact CG-CG1 3.95Å
862	W	90.7	Very high	91.1	Very high	9 Å²	9	60.3 Å²	60.3	3%	0.034	30%	0.296	C	S	.	.			trans	58.6	41.2	178.7	-59.8	88.4	0	0	0	112.6	E860 V930 V975 L978 V979 L990 N997 L1000 T1001	E860-W862 HydrophobicContact CG-CD2 4.17Å; E860-W862 HydrophobicContact CG-CG 4.4Å; E860-W862 HydrophobicContact CG-CZ2 4.17Å; E860-W862 PolarHBondContact O-NE1 3.2Å; E860-W862 PolarHBondContact OE1-N 2.99Å; E860-W862 VanDerWaalsContact OE1-N 3.11Å; W862-V930 HydrophobicContact CE3-CG1 3.85Å; W862-V930 HydrophobicContact CZ3-CG1 4.21Å; W862-V930 HydrophobicContact CZ3-CG2 4.36Å; W862-V975 HydrophobicContact CH2-CB 4.46Å; W862-V975 HydrophobicContact CH2-CG1 3.84Å; W862-V975 HydrophobicContact CH2-CG2 4.12Å; W862-V975 HydrophobicContact CZ3-CG1 4.43Å; W862-L978 HydrophobicContact CZ2-CB 4.11Å; W862-L978 HydrophobicContact CZ2-CD1 4.28Å; W862-V979 HydrophobicContact CD2-CG2 4Å; W862-V979 HydrophobicContact CE3-CG2 3.92Å; W862-V979 HydrophobicContact CH2-CG2 3.51Å; W862-V979 HydrophobicContact CZ2-CG2 3.55Å; W862-V979 HydrophobicContact CZ3-CG2 3.68Å; W862-L990 HydrophobicContact CG-CD1 4.46Å; W862-N997 HydrophobicContact CB-CB 4.15Å; W862-L1000 VanDerWaalsContact O-CD1 3.25Å; W862-L1000 WeakPolarHBondContact O-CD1 3.25Å; W862-T1001 HydrophobicContact CH2-CG2 4.49Å; W862-T1001 HydrophobicContact CZ3-CG2 3.95Å; W862-T1001 VanDerWaalsContact CZ3-OG1 3.27Å; W862-T1001 WeakPolarHBondContact CZ3-OG1 3.45Å
863	Q	90.4	Very high	90.8	Very high	125 Å²	125	59.2 Å²	59.2	58%	0.584	29%	0.292	S	S	*	.			trans	-107.9	151.4	177.4	-61.5	-176.6	-3.2	0	0	110	R861 A865	R861-Q863 VanDerWaalsContact C-N 3.29Å; R861-Q863 HydrophobicContact CB-CG 4.16Å; R861-Q863 PolarHBondContact O-N 3.44Å; Q863-A865 PolarHBondContact O-N 3.23Å
864	A	91.3	Very high	90.6	Very high	38 Å²	38	60.4 Å²	60.4	31%	0.314	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-66	129.2	172	0	0	0	0	0	109.2	T928 L1000	A864-T928 HydrophobicContact CB-CG2 3.66Å; A864-L1000 HydrophobicContact CB-CD2 3.95Å
865	A	90	Very high	90.5	Very high	18 Å²	18	59 Å²	59	15%	0.149	29%	0.291	C	S	.	.			trans	-107.7	146.1	-178.7	0	0	0	0	0	111.7	Q863 V929 R931 I934	Q863-A865 PolarHBondContact O-N 3.23Å; A865-V929 PolarHBondContact N-O 3.12Å; A865-R931 HydrophobicContact CB-CB 3.93Å; A865-I934 HydrophobicContact CB-CD1 3.55Å
866	I	89.5	Confident	90.3	Very high	100 Å²	100	56.6 Å²	56.6	51%	0.513	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-65.5	134	172.3	-63.3	163.5	0	0	0	108.7	P868 A916 N918 I934	I866-P868 WeakPolarHBondContact O-CD 3.3Å; I866-A916 HydrophobicContact CG2-CB 3.5Å; I866-N918 VanDerWaalsContact CG1-OD1 3.23Å; I866-N918 WeakPolarHBondContact CG1-OD1 3.44Å; I866-I934 WeakPolarHBondContact O-CD1 3.29Å
867	C	88	Confident	90	Very high	6 Å²	6	59.8 Å²	59.8	4%	0.041	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-78.5	121.7	172.1	-173.5	0	0	0	0	110.6	P917 Y919 I920	C867-P917 PolarHBondContact N-O 3Å; C867-Y919 VanDerWaalsContact CB-O 3.25Å; C867-Y919 WeakPolarHBondContact CB-O 3.47Å; C867-I920 HydrophobicContact CB-CG1 4.11Å; C867-I920 VanDerWaalsContact SG-CG1 3.59Å
868	P	89.9	Confident	89.7	Confident	53 Å²	53	60.1 Å²	60.1	34%	0.344	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-68.7	137.3	168.5	-14	29.2	0	0	0	110.1	I866 Q870 V871 Q872 I934	I866-P868 WeakPolarHBondContact O-CD 3.3Å; P868-Q870 PolarHBondContact O-N 2.82Å; P868-Q870 VanDerWaalsContact O-N 3.12Å; P868-V871 HydrophobicContact CB-CG2 4.22Å; P868-V871 HydrophobicContact CG-CG2 4.12Å; P868-V871 WeakPolarHBondContact O-CB 3.42Å; P868-V871 PolarHBondContact O-N 3.38Å; P868-Q872 PolarHBondContact O-N 2.8Å; P868-I934 VanDerWaalsContact CD-CG2 3.46Å; P868-I934 HydrophobicContact CG-CG2 4.16Å
869	E	87.3	Confident	89.5	Confident	131 Å²	131	60.3 Å²	60.3	61%	0.612	30%	0.304	S	S	*	.	H	α-helix	trans	-54.2	-37.5	-176.4	-162.7	-170.4	159.3	0	0	112.6	V871 Q872 Q873	E869-V871 VanDerWaalsContact C-N 3.26Å; E869-V871 PolarHBondContact O-N 3.08Å; E869-Q872 PolarHBondContact O-N 2.65Å; E869-Q872 VanDerWaalsContact O-N 3.15Å; E869-Q873 HydrophobicContact CG-CG 4.37Å; E869-Q873 WeakPolarHBondContact O-CB 3.48Å; E869-Q873 VanDerWaalsContact O-CG 3.31Å; E869-Q873 WeakPolarHBondContact O-CG 3.4Å; E869-Q873 PolarHBondContact O-N 3.45Å; E869-Q873 PolarHBondContact OE1-NE2 3.48Å
870	Q	89.2	Confident	89.2	Confident	130 Å²	130	58.9 Å²	58.9	61%	0.607	30%	0.299	S	S	*	.	H	α-helix	trans	-63.3	-31.2	179.5	-53.9	80.9	7.6	0	0	112.7	P868 M874	P868-Q870 PolarHBondContact O-N 2.82Å; P868-Q870 VanDerWaalsContact O-N 3.12Å; Q870-M874 VanDerWaalsContact O-CB 3.32Å; Q870-M874 WeakPolarHBondContact O-CB 3.33Å; Q870-M874 PolarHBondContact O-N 3.08Å; Q870-M874 VanDerWaalsContact O-N 3.11Å
871	V	90.4	Very high	88.7	Confident	16 Å²	16	61.5 Å²	61.5	10%	0.097	31%	0.311	C	S	.	.	H	α-helix	trans	-76.1	-39	176.6	-177.6	0	0	0	0	110.1	P868 E869 I875 I934 P938	P868-V871 HydrophobicContact CB-CG2 4.22Å; P868-V871 HydrophobicContact CG-CG2 4.12Å; P868-V871 WeakPolarHBondContact O-CB 3.42Å; P868-V871 PolarHBondContact O-N 3.38Å; E869-V871 VanDerWaalsContact C-N 3.26Å; E869-V871 PolarHBondContact O-N 3.08Å; V871-I875 HydrophobicContact CG1-CD1 4.03Å; V871-I875 WeakPolarHBondContact O-CD1 3.28Å; V871-I875 VanDerWaalsContact O-CG1 3.25Å; V871-I875 WeakPolarHBondContact O-CG1 3.35Å; V871-I875 PolarHBondContact O-N 3.01Å; V871-I875 VanDerWaalsContact O-N 3.11Å; V871-I934 HydrophobicContact CG1-CG2 4.28Å; V871-I934 HydrophobicContact CG2-CG2 4.19Å; V871-P938 HydrophobicContact CG1-CG 4.45Å; V871-P938 HydrophobicContact CG2-CG 4.15Å
872	Q	92.3	Very high	88.3	Confident	30 Å²	30	54.9 Å²	54.9	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-66.7	-42.8	174.9	-172.4	59.8	62.6	0	0	112.2	P868 E869 I875 N876 F921	P868-Q872 PolarHBondContact O-N 2.8Å; E869-Q872 PolarHBondContact O-N 2.65Å; E869-Q872 VanDerWaalsContact O-N 3.15Å; Q872-I875 PolarHBondContact O-N 3.41Å; Q872-N876 PolarHBondContact NE2-OD1 3.04Å; Q872-N876 PolarHBondContact O-N 3.02Å; Q872-N876 PolarHBondContact O-ND2 3.49Å; Q872-N876 PolarHBondContact O-OD1 2.83Å; Q872-F921 PolarHBondContact NE2-O 3.13Å
873	Q	88.8	Confident	87.6	Confident	88 Å²	88	56 Å²	56	41%	0.411	30%	0.301	S	S	.	.	H	α-helix	trans	-57.2	-53.5	173.8	-72.2	171	-0.9	0	0	110.4	E869 I875 N876 D877	E869-Q873 HydrophobicContact CG-CG 4.37Å; E869-Q873 WeakPolarHBondContact O-CB 3.48Å; E869-Q873 VanDerWaalsContact O-CG 3.31Å; E869-Q873 WeakPolarHBondContact O-CG 3.4Å; E869-Q873 PolarHBondContact O-N 3.45Å; E869-Q873 PolarHBondContact OE1-NE2 3.48Å; Q873-I875 VanDerWaalsContact C-N 3.27Å; Q873-I875 PolarHBondContact O-N 3.42Å; Q873-N876 WeakPolarHBondContact O-CA 3.38Å; Q873-N876 WeakPolarHBondContact O-CB 3.33Å; Q873-N876 PolarHBondContact O-N 2.95Å; Q873-D877 PolarHBondContact O-N 3.18Å
874	M	91.7	Very high	86.6	Confident	25 Å²	25	56 Å²	56	12%	0.123	30%	0.301	C	S	.	.	H	α-helix	trans	-53.7	-39.6	177.3	-177.1	-162.2	74.5	0	0	113.6	Q870 I878 L937 P938 N941	Q870-M874 VanDerWaalsContact O-CB 3.32Å; Q870-M874 WeakPolarHBondContact O-CB 3.33Å; Q870-M874 PolarHBondContact O-N 3.08Å; Q870-M874 VanDerWaalsContact O-N 3.11Å; M874-I878 HydrophobicContact CG-CD1 4.21Å; M874-I878 WeakPolarHBondContact O-CD1 3.41Å; M874-I878 VanDerWaalsContact O-CG1 3.29Å; M874-I878 WeakPolarHBondContact O-CG1 3.3Å; M874-I878 PolarHBondContact O-N 2.92Å; M874-L937 HydrophobicContact CE-CB 4.34Å; M874-P938 HydrophobicContact CE-CG 4.2Å; M874-P938 HydrophobicContact SD-CB 4.39Å; M874-P938 HydrophobicContact SD-CG 4.37Å; M874-N941 HydrophobicContact CE-CB 4.44Å; M874-N941 VanDerWaalsContact CG-ND2 3.27Å; M874-N941 WeakPolarHBondContact CG-ND2 3.45Å; M874-N941 HydrophobicContact SD-CB 3.93Å; M874-N941 PolarHBondContact SD-ND2 3.24Å
875	I	90.2	Very high	85	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-70.7	-40.6	177.7	-68.6	165.6	0	0	0	111	V871 Q872 Q873 S879 I920 L922 L937 F1011	V871-I875 HydrophobicContact CG1-CD1 4.03Å; V871-I875 WeakPolarHBondContact O-CD1 3.28Å; V871-I875 VanDerWaalsContact O-CG1 3.25Å; V871-I875 WeakPolarHBondContact O-CG1 3.35Å; V871-I875 PolarHBondContact O-N 3.01Å; V871-I875 VanDerWaalsContact O-N 3.11Å; Q872-I875 PolarHBondContact O-N 3.41Å; Q873-I875 VanDerWaalsContact C-N 3.27Å; Q873-I875 PolarHBondContact O-N 3.42Å; I875-S879 WeakPolarHBondContact O-CB 3.5Å; I875-S879 PolarHBondContact O-N 3.25Å; I875-I920 HydrophobicContact CD1-CD1 4.28Å; I875-I920 HydrophobicContact CD1-CG2 3.69Å; I875-L922 HydrophobicContact CG2-CD1 3.88Å; I875-L937 HydrophobicContact CD1-CD1 3.94Å; I875-F1011 HydrophobicContact CG1-CE2 4.32Å
876	N	88.8	Confident	83.5	Confident	65 Å²	65	62 Å²	62	35%	0.348	32%	0.322	S	S	.	.	H	α-helix	trans	-62.7	-46.8	175.3	-64.9	-11.4	0	0	0	111	Q872 Q873 I878 S879 I880	Q872-N876 PolarHBondContact NE2-OD1 3.04Å; Q872-N876 PolarHBondContact O-N 3.02Å; Q872-N876 PolarHBondContact O-ND2 3.49Å; Q872-N876 PolarHBondContact O-OD1 2.83Å; Q873-N876 WeakPolarHBondContact O-CA 3.38Å; Q873-N876 WeakPolarHBondContact O-CB 3.33Å; Q873-N876 PolarHBondContact O-N 2.95Å; N876-I878 PolarHBondContact O-N 3.34Å; N876-S879 WeakPolarHBondContact O-CB 3.26Å; N876-S879 PolarHBondContact O-N 3.34Å; N876-S879 VanDerWaalsContact O-N 3.13Å; N876-I880 WeakPolarHBondContact O-CB 3.41Å; N876-I880 WeakPolarHBondContact O-CD1 3.27Å; N876-I880 VanDerWaalsContact O-CG1 3.25Å; N876-I880 WeakPolarHBondContact O-CG1 3.46Å; N876-I880 PolarHBondContact O-N 3.07Å
877	D	88	Confident	81.1	Confident	99 Å²	99	64.6 Å²	64.6	53%	0.529	33%	0.334	S	S	.	.	H	α-helix	trans	-59.2	-47.2	-179.4	-62.6	-28.9	0	0	0	111.2	Q873 S879 I880 E881	Q873-D877 PolarHBondContact O-N 3.18Å; D877-S879 VanDerWaalsContact C-N 3.35Å; D877-S879 PolarHBondContact O-N 2.92Å; D877-I880 PolarHBondContact O-N 3.48Å; D877-E881 VanDerWaalsContact O-CB 3.29Å; D877-E881 WeakPolarHBondContact O-CB 3.29Å; D877-E881 PolarHBondContact O-N 2.69Å
878	I	87.3	Confident	78.4	Confident	7 Å²	7	73.1 Å²	73.1	4%	0.036	37%	0.37	C	S	.	.	H	α-helix	trans	-60.2	-43.1	174.4	-72.5	168.5	0	0	0	111.2	M874 N876 E881 V882 N941 F1011 C1014 L1018	M874-I878 HydrophobicContact CG-CD1 4.21Å; M874-I878 WeakPolarHBondContact O-CD1 3.41Å; M874-I878 VanDerWaalsContact O-CG1 3.29Å; M874-I878 WeakPolarHBondContact O-CG1 3.3Å; M874-I878 PolarHBondContact O-N 2.92Å; N876-I878 PolarHBondContact O-N 3.34Å; I878-E881 PolarHBondContact O-N 3.47Å; I878-V882 WeakPolarHBondContact O-CB 3.46Å; I878-V882 VanDerWaalsContact O-CG2 3.24Å; I878-V882 WeakPolarHBondContact O-CG2 3.48Å; I878-V882 PolarHBondContact O-N 2.95Å; I878-N941 HydrophobicContact CD1-CB 4.37Å; I878-F1011 HydrophobicContact CD1-CE2 4.22Å; I878-F1011 HydrophobicContact CD1-CZ 3.8Å; I878-F1011 HydrophobicContact CG2-CE2 4.22Å; I878-C1014 HydrophobicContact CG2-CB 3.89Å; I878-L1018 HydrophobicContact CG1-CD1 4.26Å; I878-L1018 HydrophobicContact CG2-CD1 4.07Å
879	S	85	Confident	75.4	Confident	43 Å²	43	74.6 Å²	74.6	30%	0.301	38%	0.381	S	S	.	.	H	α-helix	trans	-64.9	-41.1	178.6	-171.4	0	0	0	0	112	I875 N876 D877 G883	I875-S879 WeakPolarHBondContact O-CB 3.5Å; I875-S879 PolarHBondContact O-N 3.25Å; N876-S879 WeakPolarHBondContact O-CB 3.26Å; N876-S879 PolarHBondContact O-N 3.34Å; N876-S879 VanDerWaalsContact O-N 3.13Å; D877-S879 VanDerWaalsContact C-N 3.35Å; D877-S879 PolarHBondContact O-N 2.92Å; S879-G883 PolarHBondContact O-N 2.97Å
880	I	84.1	Confident	72.8	Confident	93 Å²	93	74.7 Å²	74.7	48%	0.477	39%	0.393	S	S	.	.	H	α-helix	trans	-66.1	-44	177	-72.4	164.4	0	0	0	110.4	N876 D877 G883 H884	N876-I880 WeakPolarHBondContact O-CB 3.41Å; N876-I880 WeakPolarHBondContact O-CD1 3.27Å; N876-I880 VanDerWaalsContact O-CG1 3.25Å; N876-I880 WeakPolarHBondContact O-CG1 3.46Å; N876-I880 PolarHBondContact O-N 3.07Å; D877-I880 PolarHBondContact O-N 3.48Å; I880-G883 PolarHBondContact O-N 2.97Å; I880-H884 VanDerWaalsContact CG2-CD2 3.48Å; I880-H884 WeakPolarHBondContact CG2-CD2 3.21Å; I880-H884 PolarHBondContact O-CD2 3.42Å; I880-H884 VanDerWaalsContact O-CD2 3.28Å; I880-H884 PolarHBondContact O-N 2.82Å
881	E	81.1	Confident	69.8	Low	67 Å²	67	77.2 Å²	77.2	31%	0.313	41%	0.405	S	S	.	.	H	α-helix	trans	-61.9	-48.5	177.5	-179.1	170.8	-134.5	0	0	112.2	D877 I878 G883 H884 C885 L1018 R1021	D877-E881 VanDerWaalsContact O-CB 3.29Å; D877-E881 WeakPolarHBondContact O-CB 3.29Å; D877-E881 PolarHBondContact O-N 2.69Å; I878-E881 PolarHBondContact O-N 3.47Å; E881-G883 VanDerWaalsContact C-N 3.28Å; E881-G883 PolarHBondContact O-N 2.91Å; E881-H884 PolarHBondContact O-N 3.03Å; E881-C885 WeakPolarHBondContact O-CB 3.31Å; E881-C885 PolarHBondContact O-N 3.07Å; E881-C885 PolarHBondContact O-SG 3.46Å; E881-C885 VanDerWaalsContact O-SG 3.38Å; E881-L1018 HydrophobicContact CG-CD2 4.18Å; E881-L1018 VanDerWaalsContact OE2-CD2 3.22Å; E881-L1018 WeakPolarHBondContact OE2-CD2 3.48Å; E881-R1021 VanDerWaalsContact CG-NH1 3.33Å; E881-R1021 IonicContact OE1-CZ 3.16Å; E881-R1021 IonicContact OE1-NH1 2.74Å; E881-R1021 PolarHBondContact OE1-NH1 3.27Å; E881-R1021 IonicContact OE1-NH2 2.63Å; E881-R1021 PolarHBondContact OE1-NH2 2.92Å; E881-R1021 IonicContact OE2-NH2 2.87Å
882	V	81	Confident	66.7	Low	7 Å²	7	84.9 Å²	84.9	4%	0.042	45%	0.445	C	S	.	.	H	α-helix	trans	-61.1	-38	174.4	172.5	0	0	0	0	111	I878 K886 C1014 F1017 L1018	I878-V882 WeakPolarHBondContact O-CB 3.46Å; I878-V882 VanDerWaalsContact O-CG2 3.24Å; I878-V882 WeakPolarHBondContact O-CG2 3.48Å; I878-V882 PolarHBondContact O-N 2.95Å; V882-K886 HydrophobicContact CG1-CD 4.21Å; V882-K886 VanDerWaalsContact O-CG 3.3Å; V882-K886 WeakPolarHBondContact O-CG 3.48Å; V882-K886 PolarHBondContact O-N 3.42Å; V882-C1014 HydrophobicContact CG2-CB 4.13Å; V882-F1017 HydrophobicContact CB-CD1 4.31Å; V882-F1017 HydrophobicContact CG1-CB 4.49Å; V882-F1017 HydrophobicContact CG1-CD1 4.2Å; V882-F1017 HydrophobicContact CG1-CG 4.2Å; V882-F1017 HydrophobicContact CG2-CB 4.36Å; V882-F1017 HydrophobicContact CG2-CD1 3.83Å; V882-F1017 HydrophobicContact CG2-CG 4.33Å; V882-L1018 HydrophobicContact CG2-CD2 4.42Å
883	G	76.4	Confident	63.7	Low	32 Å²	32	90 Å²	90	33%	0.33	48%	0.478	S	S	.	.	H	α-helix	trans	-63.4	-53.3	175.5	0	0	0	0	0	113.1	S879 I880 E881 C885 K886 M887	S879-G883 PolarHBondContact O-N 2.97Å; I880-G883 PolarHBondContact O-N 2.97Å; E881-G883 VanDerWaalsContact C-N 3.28Å; E881-G883 PolarHBondContact O-N 2.91Å; G883-C885 VanDerWaalsContact C-N 3.35Å; G883-C885 PolarHBondContact O-N 3.06Å; G883-K886 PolarHBondContact O-N 3.27Å; G883-M887 WeakPolarHBondContact O-CG 3.45Å; G883-M887 PolarHBondContact O-N 2.94Å
884	H	69.3	Low	60.7	Low	126 Å²	126	92.9 Å²	92.9	58%	0.583	50%	0.497	S	S	*	.	H	α-helix	trans	-62.2	-39.4	179.3	-76.2	-54.8	0	0	0	112.8	I880 E881 K886 M887 K888	I880-H884 VanDerWaalsContact CG2-CD2 3.48Å; I880-H884 WeakPolarHBondContact CG2-CD2 3.21Å; I880-H884 PolarHBondContact O-CD2 3.42Å; I880-H884 VanDerWaalsContact O-CD2 3.28Å; I880-H884 PolarHBondContact O-N 2.82Å; E881-H884 PolarHBondContact O-N 3.03Å; H884-K886 VanDerWaalsContact C-N 3.32Å; H884-K886 PolarHBondContact O-N 3.24Å; H884-M887 PolarHBondContact O-N 3.39Å; H884-K888 PolarHBondContact O-N 3.25Å
885	C	57.2	Low	57.7	Low	46 Å²	46	100.6 Å²	100.6	31%	0.311	53%	0.532	S	S	.	.	H	α-helix	trans	-69	-28.8	177.7	-69.1	0	0	0	0	112.8	E881 G883 F1017	E881-C885 WeakPolarHBondContact O-CB 3.31Å; E881-C885 PolarHBondContact O-N 3.07Å; E881-C885 PolarHBondContact O-SG 3.46Å; E881-C885 VanDerWaalsContact O-SG 3.38Å; G883-C885 VanDerWaalsContact C-N 3.35Å; G883-C885 PolarHBondContact O-N 3.06Å; C885-F1017 HydrophobicContact CB-CE1 3.49Å; C885-F1017 VanDerWaalsContact CB-CE1 3.49Å; C885-F1017 HydrophobicContact CB-CZ 3.46Å; C885-F1017 VanDerWaalsContact CB-CZ 3.46Å
886	K	58	Low	54.7	Low	135 Å²	135	109.6 Å²	109.6	59%	0.587	57%	0.574	S	S	*	*	H	α-helix	trans	-71.3	-26.4	172.3	-76	171.4	-179.3	174.8	0	113.6	V882 G883 H884 F1017	V882-K886 HydrophobicContact CG1-CD 4.21Å; V882-K886 VanDerWaalsContact O-CG 3.3Å; V882-K886 WeakPolarHBondContact O-CG 3.48Å; V882-K886 PolarHBondContact O-N 3.42Å; G883-K886 PolarHBondContact O-N 3.27Å; H884-K886 VanDerWaalsContact C-N 3.32Å; H884-K886 PolarHBondContact O-N 3.24Å; K886-F1017 HydrophobicContact CG-CE2 4.22Å
887	M	38.7	Very low	51.7	Low	155 Å²	155	112 Å²	112	76%	0.764	60%	0.595	S	S	*	*	H	α-helix	trans	-80.6	-14.3	178.6	-63	-107.8	77.5	0	0	113.5	G883 H884 S889	G883-M887 WeakPolarHBondContact O-CG 3.45Å; G883-M887 PolarHBondContact O-N 2.94Å; H884-M887 PolarHBondContact O-N 3.39Å; M887-S889 VanDerWaalsContact C-N 3.26Å; M887-S889 PolarHBondContact O-N 3.5Å; M887-S889 VanDerWaalsContact O-N 3.11Å
888	K	30.8	Very low	49	Very low	186 Å²	186	112.8 Å²	112.8	81%	0.809	61%	0.606	S	S	*	*			trans	-86.8	56	179	-71.7	-171.7	176.5	-177.8	0	112.8	H884	H884-K888 PolarHBondContact O-N 3.25Å
889	S	27.9	Very low	45.9	Very low	83 Å²	83	118.3 Å²	118.3	58%	0.58	64%	0.644	S	S	*	*	S	Bend	trans	-110.1	131.4	162	47.7	0	0	0	0	108.8	M887 Q891	M887-S889 VanDerWaalsContact C-N 3.26Å; M887-S889 PolarHBondContact O-N 3.5Å; M887-S889 VanDerWaalsContact O-N 3.11Å; S889-Q891 PolarHBondContact O-N 3.46Å; S889-Q891 VanDerWaalsContact O-N 3.13Å
890	P	32.8	Very low	43	Very low	133 Å²	133	122.2 Å²	122.2	86%	0.864	67%	0.666	S	S	*	*			trans	-78.3	105.7	-165.9	29.5	-34.5	0	0	0	112.1
891	Q	26.4	Very low	40.6	Very low	184 Å²	184	123 Å²	123	86%	0.86	68%	0.678	S	S	*	*			trans	-118.5	119.1	159.4	-69.7	-168.6	-15.1	0	0	109.4	S889	S889-Q891 PolarHBondContact O-N 3.46Å; S889-Q891 VanDerWaalsContact O-N 3.13Å
892	L	25.5	Very low	38	Very low	177 Å²	177	127.7 Å²	127.7	93%	0.927	71%	0.705	S	S	*	*			trans	-80.6	111.1	176.3	-76.1	161	0	0	0	109.9
893	T	28	Very low	35.4	Very low	137 Å²	137	135.4 Å²	135.4	84%	0.84	74%	0.74	S	S	*	*			trans	-157.9	139.9	146	13.1	0	0	0	0	110.5
894	N	27.1	Very low	33.1	Very low	149 Å²	149	140.2 Å²	140.2	80%	0.797	76%	0.758	S	S	*	*			trans	-73.3	151.6	165.7	-60	-36.8	0	0	0	109.2
895	E	27.2	Very low	31.3	Very low	187 Å²	187	144.6 Å²	144.6	87%	0.874	78%	0.776	S	S	*	*				-172.5	170.1	100.1	-101.5	174.9	-158.4	0	0	112.5
896	H	27.6	Very low	29.7	Very low	191 Å²	191	149.1 Å²	149.1	88%	0.884	80%	0.796	S	S	*	*			trans	-82.4	136.8	-166.1	-67.8	-100.6	0	0	0	113.5
897	S	27.3	Very low	28.3	Very low	114 Å²	114	149.5 Å²	149.5	80%	0.797	80%	0.803	S	S	*	*			trans	-143.2	119	152.3	-170.8	0	0	0	0	109.2
898	P	31.4	Very low	27.8	Very low	116 Å²	116	151.8 Å²	151.8	75%	0.753	81%	0.812	S	S	*	*			trans	-83	148.6	-169.8	32.3	-35.2	0	0	0	113.3
899	C	21.2	Very low	27.6	Very low	123 Å²	123	148 Å²	148	83%	0.831	81%	0.809	S	S	*	*			trans	-67.4	134.1	176	-52.6	0	0	0	0	112.4
900	T	24.6	Very low	27.6	Very low	125 Å²	125	150 Å²	150	77%	0.767	82%	0.817	S	S	*	*			trans	-118.3	95.2	163.5	15	0	0	0	0	110	N902	T900-N902 PolarHBondContact O-N 3.47Å
901	P	32.2	Very low	27.5	Very low	111 Å²	111	151.6 Å²	151.6	72%	0.721	82%	0.819	S	S	*	*			trans	-80.3	98.8	-178.5	31.2	-33	0	0	0	111.1	H903	P901-H903 PolarHBondContact O-N 2.85Å
902	N	27.8	Very low	27.8	Very low	164 Å²	164	147.2 Å²	147.2	88%	0.877	81%	0.808	S	S	*	*			trans	-73.8	69.7	174.5	-83	-18	0	0	0	112.4	T900	T900-N902 PolarHBondContact O-N 3.47Å
903	H	27	Very low	28.4	Very low	169 Å²	169	144.1 Å²	144.1	78%	0.782	80%	0.797	S	S	*	*			trans	-68.7	127.9	155.2	-96.7	-60.1	0	0	0	109.4	P901	P901-H903 PolarHBondContact O-N 2.85Å
904	N	27.7	Very low	29.1	Very low	134 Å²	134	143.7 Å²	143.7	72%	0.717	79%	0.793	S	S	*	*			trans	147.3	82.3	143.1	-74.2	-22.8	0	0	0	112.7
905	K	30.1	Very low	30.3	Very low	218 Å²	218	145.4 Å²	145.4	95%	0.948	79%	0.794	S	S	*	*			trans	-127.8	91	143.7	-80.4	-165.6	173.9	-176.2	0	108.4
906	L	24.4	Very low	31.8	Very low	141 Å²	141	138.8 Å²	138.8	74%	0.738	77%	0.772	S	S	*	*			trans	-85.3	142.2	175	-91.7	164.7	0	0	0	110.4
907	I	28	Very low	33.9	Very low	142 Å²	142	132.5 Å²	132.5	73%	0.728	75%	0.748	S	S	*	*			trans	60.4	105.1	156.5	-53.4	158.3	0	0	0	116.1
908	Q	28.7	Very low	36.5	Very low	203 Å²	203	131.4 Å²	131.4	95%	0.949	73%	0.733	S	S	*	*				-142.4	129.7	127	-111.2	172.1	17.8	0	0	108.8
909	S	27.7	Very low	39.1	Very low	107 Å²	107	129.4 Å²	129.4	75%	0.748	71%	0.711	S	S	*	*			trans	-107.2	119.1	-169.2	52.3	0	0	0	0	111.7
910	T	27.5	Very low	42.4	Very low	124 Å²	124	123.6 Å²	123.6	76%	0.761	67%	0.672	S	S	*	*			trans	-146.5	149	161.1	47.7	0	0	0	0	108.8	S912	T910-S912 PolarHBondContact O-N 3Å
911	D	31	Very low	45.3	Very low	167 Å²	167	121.5 Å²	121.5	89%	0.893	65%	0.652	S	S	*	*			trans	-73.3	69.8	-173.2	-57.7	-78.5	0	0	0	113.4	V913	D911-V913 PolarHBondContact O-N 3.19Å
912	S	31.5	Very low	47.9	Very low	92 Å²	92	116.5 Å²	116.5	64%	0.643	62%	0.619	S	S	*	*			trans	-70.4	94	169.6	62.1	0	0	0	0	109.8	T910 V914	T910-S912 PolarHBondContact O-N 3Å; S912-V914 PolarHBondContact O-N 2.98Å
913	V	38.4	Very low	50.5	Low	112 Å²	112	112.7 Å²	112.7	68%	0.679	60%	0.599	S	S	*	*			trans	-51.7	111.3	162.3	176.7	0	0	0	0	107.4	D911 F915	D911-V913 PolarHBondContact O-N 3.19Å; V913-F915 VanDerWaalsContact O-CD2 3.25Å; V913-F915 WeakPolarHBondContact O-CD2 3.44Å; V913-F915 PolarHBondContact O-N 3.2Å
914	V	42.8	Very low	53.2	Low	128 Å²	128	111.4 Å²	111.4	78%	0.776	60%	0.597	S	S	*	*			trans	-71.7	96	-175.3	-178.2	0	0	0	0	108.4	S912 A916	S912-V914 PolarHBondContact O-N 2.98Å; V914-A916 PolarHBondContact O-N 3.18Å
915	F	51.6	Low	56.1	Low	186 Å²	186	108.2 Å²	108.2	82%	0.816	58%	0.578	S	S	*	*			trans	-63.2	100.6	172.9	-70.1	-82.1	0	0	0	109.1	V913	V913-F915 VanDerWaalsContact O-CD2 3.25Å; V913-F915 WeakPolarHBondContact O-CD2 3.44Å; V913-F915 PolarHBondContact O-N 3.2Å
916	A	59.3	Low	58.9	Low	48 Å²	48	102.7 Å²	102.7	40%	0.397	56%	0.556	S	S	.	*			trans	-56.7	135.6	178.8	0	0	0	0	0	110.8	I866 V914	I866-A916 HydrophobicContact CG2-CB 3.5Å; V914-A916 PolarHBondContact O-N 3.18Å
917	P	72.6	Confident	62.2	Low	59 Å²	59	96.2 Å²	96.2	38%	0.383	52%	0.522	S	S	.	.			trans	-67.7	140.4	-170.7	25.8	-33.9	0	0	0	112.3	C867 Y919	C867-P917 PolarHBondContact N-O 3Å; P917-Y919 HydrophobicContact CB-CD1 4.27Å; P917-Y919 HydrophobicContact CB-CD2 4.14Å; P917-Y919 HydrophobicContact CB-CE1 4.23Å; P917-Y919 HydrophobicContact CB-CE2 4.04Å; P917-Y919 HydrophobicContact CB-CG 4.26Å; P917-Y919 PolarHBondContact O-N 3.33Å; P917-Y919 VanDerWaalsContact O-N 3.14Å
918	N	80.6	Confident	65.4	Low	90 Å²	90	90.4 Å²	90.4	48%	0.481	49%	0.493	S	S	.	.	S	Bend	trans	-80.5	23.8	173.7	-70.4	-48.9	0	0	0	112.8	I866	I866-N918 VanDerWaalsContact CG1-OD1 3.23Å; I866-N918 WeakPolarHBondContact CG1-OD1 3.44Å
919	Y	87.5	Confident	68.5	Low	75 Å²	75	80.8 Å²	80.8	29%	0.294	45%	0.448	S	S	.	.	S	Bend	trans	-146.5	158.2	-178.1	60.3	-114.3	0	0	0	111.5	C867 P917 F921 E926 Y927	C867-Y919 VanDerWaalsContact CB-O 3.25Å; C867-Y919 WeakPolarHBondContact CB-O 3.47Å; P917-Y919 HydrophobicContact CB-CD1 4.27Å; P917-Y919 HydrophobicContact CB-CD2 4.14Å; P917-Y919 HydrophobicContact CB-CE1 4.23Å; P917-Y919 HydrophobicContact CB-CE2 4.04Å; P917-Y919 HydrophobicContact CB-CG 4.26Å; P917-Y919 PolarHBondContact O-N 3.33Å; P917-Y919 VanDerWaalsContact O-N 3.14Å; Y919-F921 HydrophobicContact CE2-CB 4.47Å; Y919-E926 HydrophobicContact CD1-CB 4.27Å; Y919-E926 HydrophobicContact CD1-CG 4.29Å; Y919-E926 HydrophobicContact CD2-CB 4.15Å; Y919-E926 HydrophobicContact CD2-CG 4.05Å; Y919-E926 VanDerWaalsContact CE1-CD 3.44Å; Y919-E926 HydrophobicContact CE1-CG 4.06Å; Y919-E926 VanDerWaalsContact CE1-OE1 3.28Å; Y919-E926 WeakPolarHBondContact CE1-OE1 3.39Å; Y919-E926 HydrophobicContact CE2-CB 4.47Å; Y919-E926 HydrophobicContact CE2-CG 3.86Å; Y919-E926 HydrophobicContact CG-CB 4.04Å; Y919-E926 HydrophobicContact CG-CG 4.26Å; Y919-E926 VanDerWaalsContact CZ-CD 3.48Å; Y919-E926 PolarHBondContact OH-OE1 3.04Å; Y919-Y927 WeakPolarHBondContact CA-O 3.25Å
920	I	89.4	Confident	71.7	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.005	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	137.8	163.3	-71.8	171.1	0	0	0	108.5	C867 I875 Y927 V929 I934 L937 L1007	C867-I920 HydrophobicContact CB-CG1 4.11Å; C867-I920 VanDerWaalsContact SG-CG1 3.59Å; I875-I920 HydrophobicContact CD1-CD1 4.28Å; I875-I920 HydrophobicContact CD1-CG2 3.69Å; I920-Y927 PolarHBondContact N-O 3.08Å; I920-Y927 WeakPolarHBondContact O-CB 3.31Å; I920-Y927 PolarHBondContact O-N 2.83Å; I920-V929 HydrophobicContact CD1-CG2 3.99Å; I920-I934 HydrophobicContact CD1-CG1 4.17Å; I920-L937 HydrophobicContact CD1-CD1 3.81Å; I920-L1007 HydrophobicContact CB-CD2 4.02Å; I920-L1007 HydrophobicContact CD1-CD2 3.64Å; I920-L1007 HydrophobicContact CG1-CD2 4.39Å; I920-L1007 HydrophobicContact CG2-CD1 4.17Å; I920-L1007 HydrophobicContact CG2-CD2 4.04Å
921	F	86.6	Confident	74.9	Confident	80 Å²	80	77.3 Å²	77.3	35%	0.351	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	127.5	173.3	-165.8	-104.6	0	0	0	110.1	Q872 Y919 N924 E926	Q872-F921 PolarHBondContact NE2-O 3.13Å; Y919-F921 HydrophobicContact CE2-CB 4.47Å; F921-N924 HydrophobicContact CZ-CB 4.47Å; F921-E926 HydrophobicContact CD2-CG 4.1Å; F921-E926 HydrophobicContact CE2-CG 4.46Å
922	L	86.6	Confident	78	Confident	7 Å²	7	69.6 Å²	69.6	4%	0.037	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	137.7	176.3	178.8	62.5	0	0	0	109.8	I875 N924 E925 Y927 L1007 Q1010	I875-L922 HydrophobicContact CG2-CD1 3.88Å; L922-N924 PolarHBondContact O-N 3.23Å; L922-N924 VanDerWaalsContact O-N 3.12Å; L922-E925 PolarHBondContact N-O 3.02Å; L922-E925 PolarHBondContact O-N 3.32Å; L922-Y927 HydrophobicContact CB-CD2 4.38Å; L922-Y927 HydrophobicContact CB-CE2 4.33Å; L922-L1007 HydrophobicContact CB-CD1 4.23Å; L922-L1007 HydrophobicContact CD2-CD1 3.7Å; L922-Q1010 HydrophobicContact CD2-CB 3.85Å
923	N	82.2	Confident	81	Confident	84 Å²	84	65.2 Å²	65.2	45%	0.449	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	37.5	175.2	-61.3	-18.1	0	0	0	114.2	E925 Q1010	N923-E925 VanDerWaalsContact C-N 3.33Å; N923-E925 PolarHBondContact O-N 3.21Å; N923-Q1010 PolarHBondContact ND2-OE1 3.46Å
924	N	82.8	Confident	83.6	Confident	141 Å²	141	60.2 Å²	60.2	75%	0.754	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	22.9	-174.9	-57.3	-28.3	0	0	0	115.9	F921 L922	F921-N924 HydrophobicContact CZ-CB 4.47Å; L922-N924 PolarHBondContact O-N 3.23Å; L922-N924 VanDerWaalsContact O-N 3.12Å
925	E	88.2	Confident	86.1	Confident	67 Å²	67	57.2 Å²	57.2	31%	0.313	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.9	173.1	-72	-169.4	159.8	0	0	112.7	L922 N923 Y927 R1003	L922-E925 PolarHBondContact N-O 3.02Å; L922-E925 PolarHBondContact O-N 3.32Å; N923-E925 VanDerWaalsContact C-N 3.33Å; N923-E925 PolarHBondContact O-N 3.21Å; E925-Y927 HydrophobicContact CB-CD2 4.34Å; E925-Y927 HydrophobicContact CB-CE2 3.62Å; E925-Y927 WeakPolarHBondContact O-CD2 3.39Å; E925-Y927 PolarHBondContact OE2-OH 2.86Å; E925-R1003 IonicContact OE2-NH2 3.74Å
926	E	90.5	Very high	88.2	Confident	103 Å²	103	48.3 Å²	48.3	48%	0.481	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126	177.2	-62.5	179.3	159.8	0	0	111.2	Y919 F921 R1003	Y919-E926 HydrophobicContact CD1-CB 4.27Å; Y919-E926 HydrophobicContact CD1-CG 4.29Å; Y919-E926 HydrophobicContact CD2-CB 4.15Å; Y919-E926 HydrophobicContact CD2-CG 4.05Å; Y919-E926 VanDerWaalsContact CE1-CD 3.44Å; Y919-E926 HydrophobicContact CE1-CG 4.06Å; Y919-E926 VanDerWaalsContact CE1-OE1 3.28Å; Y919-E926 WeakPolarHBondContact CE1-OE1 3.39Å; Y919-E926 HydrophobicContact CE2-CB 4.47Å; Y919-E926 HydrophobicContact CE2-CG 3.86Å; Y919-E926 HydrophobicContact CG-CB 4.04Å; Y919-E926 HydrophobicContact CG-CG 4.26Å; Y919-E926 VanDerWaalsContact CZ-CD 3.48Å; Y919-E926 PolarHBondContact OH-OE1 3.04Å; F921-E926 HydrophobicContact CD2-CG 4.1Å; F921-E926 HydrophobicContact CE2-CG 4.46Å; E926-R1003 PolarHBondContact O-NH2 2.98Å
927	Y	93.6	Very high	89.9	Confident	5 Å²	5	46 Å²	46	2%	0.02	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	92.9	-176.8	-72.3	-99	0	0	0	111	Y919 I920 L922 E925 V929 R1003 Q1006 L1007	Y919-Y927 WeakPolarHBondContact CA-O 3.25Å; I920-Y927 PolarHBondContact N-O 3.08Å; I920-Y927 WeakPolarHBondContact O-CB 3.31Å; I920-Y927 PolarHBondContact O-N 2.83Å; L922-Y927 HydrophobicContact CB-CD2 4.38Å; L922-Y927 HydrophobicContact CB-CE2 4.33Å; E925-Y927 HydrophobicContact CB-CD2 4.34Å; E925-Y927 HydrophobicContact CB-CE2 3.62Å; E925-Y927 WeakPolarHBondContact O-CD2 3.39Å; E925-Y927 PolarHBondContact OE2-OH 2.86Å; Y927-V929 PolarHBondContact O-N 3.45Å; Y927-R1003 VanDerWaalsContact CD1-CZ 3.4Å; Y927-R1003 VanDerWaalsContact CD1-NH2 3.33Å; Y927-R1003 VanDerWaalsContact CE1-CZ 3.41Å; Y927-R1003 VanDerWaalsContact CE1-NH2 3.34Å; Y927-Q1006 HydrophobicContact CE1-CB 4.08Å; Y927-L1007 HydrophobicContact CD1-CB 3.59Å; Y927-L1007 HydrophobicContact CD1-CD1 4.03Å; Y927-L1007 HydrophobicContact CD1-CG 4.3Å; Y927-L1007 HydrophobicContact CD2-CD1 4.11Å; Y927-L1007 HydrophobicContact CE1-CB 4.15Å; Y927-L1007 HydrophobicContact CE1-CD1 4.48Å; Y927-L1007 HydrophobicContact CG-CB 4.14Å; Y927-L1007 HydrophobicContact CG-CD1 3.85Å; Y927-L1007 HydrophobicContact CG-CG 4.39Å
928	T	94.1	Very high	90.9	Very high	19 Å²	19	44.7 Å²	44.7	12%	0.117	22%	0.215	C	C	.	.			trans	-71.7	107.2	169.1	-46.8	0	0	0	0	109.6	A864 L1000 R1003 H1119 V1120	A864-T928 HydrophobicContact CB-CG2 3.66Å; T928-L1000 HydrophobicContact CG2-CD2 3.83Å; T928-R1003 WeakPolarHBondContact O-CB 3.39Å; T928-H1119 PolarHBondContact OG1-O 2.92Å; T928-V1120 HydrophobicContact CG2-CG2 4.25Å
929	V	94.6	Very high	91.7	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.006	19%	0.193	C	C	.	.			trans	-127.5	169.9	-171.1	-61.6	0	0	0	0	113.8	A865 I920 Y927 V933 I934 R1003 S1004 L1007	A865-V929 PolarHBondContact N-O 3.12Å; I920-V929 HydrophobicContact CD1-CG2 3.99Å; Y927-V929 PolarHBondContact O-N 3.45Å; V929-V933 HydrophobicContact CG2-CG1 4.46Å; V929-I934 HydrophobicContact CG2-CD1 4.36Å; V929-I934 HydrophobicContact CG2-CG1 3.85Å; V929-R1003 HydrophobicContact CG1-CB 4.4Å; V929-S1004 WeakPolarHBondContact CB-OG 3.45Å; V929-L1007 HydrophobicContact CG1-CB 4.28Å; V929-L1007 HydrophobicContact CG1-CD2 3.81Å; V929-L1007 HydrophobicContact CG2-CD2 4.25Å
930	V	95	Very high	92	Very high	2 Å²	2	37 Å²	37	1%	0.012	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-83	155.4	176.1	-54.7	0	0	0	0	112.4	E860 W862 T932 V933 L1000 S1004	E860-V930 HydrophobicContact CG-CB 4.25Å; E860-V930 HydrophobicContact CG-CG2 4.23Å; W862-V930 HydrophobicContact CE3-CG1 3.85Å; W862-V930 HydrophobicContact CZ3-CG1 4.21Å; W862-V930 HydrophobicContact CZ3-CG2 4.36Å; V930-T932 PolarHBondContact O-N 3.07Å; V930-T932 VanDerWaalsContact O-N 3.15Å; V930-V933 HydrophobicContact CG2-CG2 4.39Å; V930-V933 PolarHBondContact O-N 3.18Å; V930-V933 VanDerWaalsContact O-N 3.07Å; V930-L1000 HydrophobicContact CG1-CB 4.02Å; V930-S1004 PolarHBondContact N-OG 3.14Å
931	R	94.2	Very high	92.2	Very high	157 Å²	157	37.8 Å²	37.8	59%	0.592	18%	0.183	S	C	*	.	H	α-helix	trans	-54.3	-38	-175.5	-174.3	-176.2	-178.9	-147.7	1.3	112.6	E860 A865 V933 I934 L935	E860-R931 PolarHBondContact OE2-N 3.26Å; A865-R931 HydrophobicContact CB-CB 3.93Å; R931-V933 VanDerWaalsContact C-N 3.3Å; R931-V933 PolarHBondContact O-N 3.27Å; R931-I934 WeakPolarHBondContact O-CB 3.47Å; R931-I934 PolarHBondContact O-N 3.4Å; R931-L935 HydrophobicContact CG-CD1 4.23Å; R931-L935 PolarHBondContact O-N 2.99Å
932	T	95.3	Very high	92.6	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.025	18%	0.18	C	C	.	.	H	α-helix	trans	-63.7	-32.8	-178.2	-56.3	0	0	0	0	112.8	L853 L856 L857 E860 V930 L935 L936 F971	L853-T932 HydrophobicContact CD1-CG2 4.01Å; L856-T932 HydrophobicContact CB-CG2 3.87Å; L857-T932 HydrophobicContact CD2-CG2 3.79Å; L857-T932 HydrophobicContact CG-CG2 3.91Å; E860-T932 WeakPolarHBondContact OE2-CB 3.24Å; E860-T932 PolarHBondContact OE2-N 2.88Å; E860-T932 PolarHBondContact OE2-OG1 3.02Å; V930-T932 PolarHBondContact O-N 3.07Å; V930-T932 VanDerWaalsContact O-N 3.15Å; T932-L935 PolarHBondContact O-N 3.41Å; T932-L936 VanDerWaalsContact O-CB 3.31Å; T932-L936 WeakPolarHBondContact O-CB 3.27Å; T932-L936 PolarHBondContact O-N 3.27Å; T932-F971 HydrophobicContact CG2-CE2 4.41Å
933	V	95.5	Very high	93.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-73	-37	174.5	169.5	0	0	0	0	112	V929 V930 R931 L935 L936 L937 F971 L1007 V1008	V929-V933 HydrophobicContact CG2-CG1 4.46Å; V930-V933 HydrophobicContact CG2-CG2 4.39Å; V930-V933 PolarHBondContact O-N 3.18Å; V930-V933 VanDerWaalsContact O-N 3.07Å; R931-V933 VanDerWaalsContact C-N 3.3Å; R931-V933 PolarHBondContact O-N 3.27Å; V933-L935 PolarHBondContact O-N 2.87Å; V933-L936 PolarHBondContact O-N 3.28Å; V933-L936 VanDerWaalsContact O-N 3.16Å; V933-L937 HydrophobicContact CG1-CD1 4.01Å; V933-L937 HydrophobicContact CG1-CG 4.24Å; V933-L937 WeakPolarHBondContact O-CG 3.29Å; V933-L937 PolarHBondContact O-N 2.99Å; V933-F971 HydrophobicContact CG2-CE1 4.43Å; V933-F971 HydrophobicContact CG2-CE2 4.12Å; V933-F971 HydrophobicContact CG2-CZ 3.52Å; V933-L1007 HydrophobicContact CG1-CD2 4.07Å; V933-V1008 HydrophobicContact CG1-CG2 4.16Å; V933-V1008 HydrophobicContact CG2-CG2 4.4Å
934	I	93.7	Very high	93.6	Very high	8 Å²	8	32.6 Å²	32.6	4%	0.041	16%	0.159	C	C	.	.	H	α-helix	trans	-58.9	-32.4	173.9	-54.1	-172	0	0	0	111.1	A865 I866 P868 V871 I920 V929 R931 P938	A865-I934 HydrophobicContact CB-CD1 3.55Å; I866-I934 WeakPolarHBondContact O-CD1 3.29Å; P868-I934 VanDerWaalsContact CD-CG2 3.46Å; P868-I934 HydrophobicContact CG-CG2 4.16Å; V871-I934 HydrophobicContact CG1-CG2 4.28Å; V871-I934 HydrophobicContact CG2-CG2 4.19Å; I920-I934 HydrophobicContact CD1-CG1 4.17Å; V929-I934 HydrophobicContact CG2-CD1 4.36Å; V929-I934 HydrophobicContact CG2-CG1 3.85Å; R931-I934 WeakPolarHBondContact O-CB 3.47Å; R931-I934 PolarHBondContact O-N 3.4Å; I934-P938 WeakPolarHBondContact O-CD 3.45Å
935	L	94.1	Very high	94	Very high	64 Å²	64	29.1 Å²	29.1	34%	0.335	14%	0.137	S	C	.	.	H	α-helix	trans	-87	-28.6	176.5	-63.3	173.4	0	0	0	113.5	L856 R931 T932 V933 M939	L856-L935 HydrophobicContact CD1-CB 3.85Å; L856-L935 HydrophobicContact CD1-CD1 3.7Å; L856-L935 HydrophobicContact CD1-CG 4.43Å; L856-L935 HydrophobicContact CD2-CD1 3.63Å; L856-L935 HydrophobicContact CG-CD1 4.32Å; R931-L935 HydrophobicContact CG-CD1 4.23Å; R931-L935 PolarHBondContact O-N 2.99Å; T932-L935 PolarHBondContact O-N 3.41Å; V933-L935 PolarHBondContact O-N 2.87Å; L935-M939 HydrophobicContact CB-CE 4.47Å; L935-M939 WeakPolarHBondContact O-CG 3.24Å; L935-M939 PolarHBondContact O-N 3.41Å
936	L	95.9	Very high	94.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-70	-37.5	176.3	178.6	65.1	0	0	0	112.4	L853 T932 V933 M939 I940 L967 F971 V1008	L853-L936 HydrophobicContact CD1-CD1 4.04Å; L853-L936 HydrophobicContact CD2-CD1 3.95Å; T932-L936 VanDerWaalsContact O-CB 3.31Å; T932-L936 WeakPolarHBondContact O-CB 3.27Å; T932-L936 PolarHBondContact O-N 3.27Å; V933-L936 PolarHBondContact O-N 3.28Å; V933-L936 VanDerWaalsContact O-N 3.16Å; L936-M939 WeakPolarHBondContact O-CB 3.42Å; L936-M939 PolarHBondContact O-N 2.92Å; L936-I940 HydrophobicContact CD1-CD1 4.26Å; L936-I940 HydrophobicContact CD1-CG1 4.14Å; L936-I940 HydrophobicContact CD2-CD1 4.24Å; L936-I940 HydrophobicContact CG-CD1 3.77Å; L936-I940 HydrophobicContact CG-CG1 4.14Å; L936-I940 WeakPolarHBondContact O-CG1 3.4Å; L936-I940 PolarHBondContact O-N 2.97Å; L936-L967 HydrophobicContact CD1-CD2 4.33Å; L936-F971 HydrophobicContact CD2-CB 4.49Å; L936-F971 HydrophobicContact CD2-CD1 4.03Å; L936-F971 HydrophobicContact CD2-CD2 3.67Å; L936-F971 HydrophobicContact CD2-CE1 4.14Å; L936-F971 HydrophobicContact CD2-CE2 3.79Å; L936-F971 HydrophobicContact CD2-CG 3.79Å; L936-F971 HydrophobicContact CD2-CZ 4.03Å; L936-V1008 HydrophobicContact CD2-CG2 4.26Å
937	L	95.2	Very high	94.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61	-43.8	-178.4	-68.6	165.4	0	0	0	112.6	M874 I875 I920 V933 I940 N941 L1007 F1011	M874-L937 HydrophobicContact CE-CB 4.34Å; I875-L937 HydrophobicContact CD1-CD1 3.94Å; I920-L937 HydrophobicContact CD1-CD1 3.81Å; V933-L937 HydrophobicContact CG1-CD1 4.01Å; V933-L937 HydrophobicContact CG1-CG 4.24Å; V933-L937 WeakPolarHBondContact O-CG 3.29Å; V933-L937 PolarHBondContact O-N 2.99Å; L937-I940 HydrophobicContact CD2-CD1 4.49Å; L937-I940 PolarHBondContact O-N 3.48Å; L937-N941 PolarHBondContact O-N 3.25Å; L937-N941 VanDerWaalsContact O-N 3.13Å; L937-L1007 HydrophobicContact CD1-CD2 3.77Å; L937-L1007 HydrophobicContact CD1-CG 4.21Å; L937-F1011 HydrophobicContact CD2-CB 4.09Å; L937-F1011 HydrophobicContact CD2-CD1 3.38Å; L937-F1011 HydrophobicContact CD2-CD2 4.35Å; L937-F1011 HydrophobicContact CD2-CE1 3.75Å; L937-F1011 HydrophobicContact CD2-CG 3.71Å; L937-F1011 HydrophobicContact CD2-CZ 4.39Å
938	P	94.4	Very high	94	Very high	31 Å²	31	26.8 Å²	26.8	20%	0.201	13%	0.127	C	C	.	.	H	α-helix	trans	-58.8	-43.8	166.6	-28.4	36.3	0	0	0	114	V871 M874 I934 I940 N941 D942	V871-P938 HydrophobicContact CG1-CG 4.45Å; V871-P938 HydrophobicContact CG2-CG 4.15Å; M874-P938 HydrophobicContact CE-CG 4.2Å; M874-P938 HydrophobicContact SD-CB 4.39Å; M874-P938 HydrophobicContact SD-CG 4.37Å; I934-P938 WeakPolarHBondContact O-CD 3.45Å; P938-I940 VanDerWaalsContact C-N 3.34Å; P938-I940 PolarHBondContact O-N 3.36Å; P938-N941 CarbonylContact O-C 3.59Å; P938-N941 WeakPolarHBondContact O-CB 3.46Å; P938-N941 PolarHBondContact O-N 2.83Å; P938-N941 VanDerWaalsContact O-N 3.14Å; P938-D942 VanDerWaalsContact O-CG 3.25Å; P938-D942 PolarHBondContact O-N 2.95Å
939	M	95.6	Very high	93.7	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.02	14%	0.14	C	C	.	.	H	α-helix	trans	-58.2	-46.1	177.3	-65.4	176.8	-160.8	0	0	111.4	K852 L853 L856 L935 L936 N941 D942 Y943	K852-M939 HydrophobicContact CD-CE 3.8Å; K852-M939 HydrophobicContact CG-CE 3.88Å; L853-M939 HydrophobicContact CB-SD 4.46Å; L856-M939 HydrophobicContact CD1-CE 3.56Å; L935-M939 HydrophobicContact CB-CE 4.47Å; L935-M939 WeakPolarHBondContact O-CG 3.24Å; L935-M939 PolarHBondContact O-N 3.41Å; L936-M939 WeakPolarHBondContact O-CB 3.42Å; L936-M939 PolarHBondContact O-N 2.92Å; M939-N941 VanDerWaalsContact C-N 3.31Å; M939-N941 PolarHBondContact O-N 3.07Å; M939-D942 WeakPolarHBondContact O-CB 3.41Å; M939-D942 PolarHBondContact O-N 3.44Å; M939-Y943 WeakPolarHBondContact O-CD2 3.49Å; M939-Y943 PolarHBondContact O-N 2.96Å
940	I	95.5	Very high	93.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.7	-43.4	176.9	-66.5	165.2	0	0	0	110.7	L936 L937 P938 D942 Y943 L964 L968 F1011 I1015	L936-I940 HydrophobicContact CD1-CD1 4.26Å; L936-I940 HydrophobicContact CD1-CG1 4.14Å; L936-I940 HydrophobicContact CD2-CD1 4.24Å; L936-I940 HydrophobicContact CG-CD1 3.77Å; L936-I940 HydrophobicContact CG-CG1 4.14Å; L936-I940 WeakPolarHBondContact O-CG1 3.4Å; L936-I940 PolarHBondContact O-N 2.97Å; L937-I940 HydrophobicContact CD2-CD1 4.49Å; L937-I940 PolarHBondContact O-N 3.48Å; P938-I940 VanDerWaalsContact C-N 3.34Å; P938-I940 PolarHBondContact O-N 3.36Å; I940-D942 VanDerWaalsContact C-N 3.3Å; I940-D942 PolarHBondContact O-N 2.77Å; I940-Y943 PolarHBondContact O-N 2.67Å; I940-L964 HydrophobicContact CB-CD1 4.39Å; I940-L964 HydrophobicContact CG1-CD1 4.14Å; I940-L964 HydrophobicContact CG2-CD1 4.11Å; I940-L964 HydrophobicContact CG2-CD2 4.38Å; I940-L968 HydrophobicContact CD1-CD2 3.77Å; I940-L968 HydrophobicContact CG1-CD2 4.22Å; I940-F1011 HydrophobicContact CB-CE1 4.37Å; I940-F1011 HydrophobicContact CG2-CD1 4.24Å; I940-F1011 HydrophobicContact CG2-CE1 4.02Å; I940-I1015 HydrophobicContact CG2-CB 4.41Å; I940-I1015 HydrophobicContact CG2-CD1 3.83Å; I940-I1015 HydrophobicContact CG2-CG1 3.64Å; I940-I1015 HydrophobicContact CG2-CG2 4.1Å
941	N	93.5	Very high	93	Very high	16 Å²	16	30.5 Å²	30.5	9%	0.086	14%	0.142	C	C	.	.	H	α-helix	trans	-65.4	-33.6	175.4	-171.2	17.6	0	0	0	112.1	M874 I878 L937 P938 M939 Y943 V944 K945	M874-N941 HydrophobicContact CE-CB 4.44Å; M874-N941 VanDerWaalsContact CG-ND2 3.27Å; M874-N941 WeakPolarHBondContact CG-ND2 3.45Å; M874-N941 HydrophobicContact SD-CB 3.93Å; M874-N941 PolarHBondContact SD-ND2 3.24Å; I878-N941 HydrophobicContact CD1-CB 4.37Å; L937-N941 PolarHBondContact O-N 3.25Å; L937-N941 VanDerWaalsContact O-N 3.13Å; P938-N941 CarbonylContact O-C 3.59Å; P938-N941 WeakPolarHBondContact O-CB 3.46Å; P938-N941 PolarHBondContact O-N 2.83Å; P938-N941 VanDerWaalsContact O-N 3.14Å; M939-N941 VanDerWaalsContact C-N 3.31Å; M939-N941 PolarHBondContact O-N 3.07Å; N941-Y943 VanDerWaalsContact C-N 3.26Å; N941-Y943 PolarHBondContact O-N 3.44Å; N941-V944 WeakPolarHBondContact O-CB 3.13Å; N941-V944 PolarHBondContact O-N 2.97Å; N941-K945 VanDerWaalsContact CG-CE 3.46Å; N941-K945 WeakPolarHBondContact ND2-CE 3.49Å; N941-K945 PolarHBondContact ND2-NZ 2.84Å; N941-K945 WeakPolarHBondContact O-CG 3.41Å; N941-K945 PolarHBondContact O-N 3.12Å
942	D	94.7	Very high	92.2	Very high	54 Å²	54	23.5 Å²	23.5	29%	0.289	12%	0.119	S	C	.	.	H	α-helix	trans	-67.4	-22.7	177.1	-65.6	-28.3	0	0	0	113.1	F845 P938 M939 I940 K945 L946	F845-D942 HydrophobicContact CE2-CB 4.46Å; F845-D942 HydrophobicContact CZ-CB 3.87Å; P938-D942 VanDerWaalsContact O-CG 3.25Å; P938-D942 PolarHBondContact O-N 2.95Å; M939-D942 WeakPolarHBondContact O-CB 3.41Å; M939-D942 PolarHBondContact O-N 3.44Å; I940-D942 VanDerWaalsContact C-N 3.3Å; I940-D942 PolarHBondContact O-N 2.77Å; D942-K945 WeakPolarHBondContact OD1-CD 3.39Å; D942-K945 WeakPolarHBondContact OD1-CE 3.35Å; D942-K945 IonicContact OD1-NZ 2.75Å; D942-K945 PolarHBondContact OD1-NZ 3.15Å; D942-L946 WeakPolarHBondContact O-CB 3.43Å; D942-L946 PolarHBondContact O-N 3.3Å
943	Y	95.6	Very high	91.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.4	-41.8	166.1	-79.7	-108.5	0	0	0	111.6	F845 H846 N849 M939 I940 N941 L946 D947 V960 R963 L964 L967	F845-Y943 HydrophobicContact CD1-CE1 4.35Å; F845-Y943 HydrophobicContact CD1-CE2 4.34Å; F845-Y943 HydrophobicContact CE1-CD1 4.15Å; F845-Y943 AromaticContact CE1-CD2 3.59Å; F845-Y943 HydrophobicContact CE1-CD2 3.59Å; F845-Y943 HydrophobicContact CE1-CE1 4.23Å; F845-Y943 AromaticContact CE1-CE2 3.66Å; F845-Y943 HydrophobicContact CE1-CE2 3.66Å; F845-Y943 AromaticContact CE1-CG 3.83Å; F845-Y943 HydrophobicContact CE1-CG 3.83Å; F845-Y943 AromaticContact CE1-CZ 4Å; F845-Y943 HydrophobicContact CZ-CD2 4.31Å; F845-Y943 HydrophobicContact CZ-CE2 4.49Å; H846-Y943 WeakPolarHBondContact CA-OH 3.36Å; H846-Y943 PolarHBondContact ND1-OH 3.47Å; N849-Y943 HydrophobicContact CB-CE2 4.36Å; M939-Y943 WeakPolarHBondContact O-CD2 3.49Å; M939-Y943 PolarHBondContact O-N 2.96Å; I940-Y943 PolarHBondContact O-N 2.67Å; N941-Y943 VanDerWaalsContact C-N 3.26Å; N941-Y943 PolarHBondContact O-N 3.44Å; Y943-L946 WeakPolarHBondContact O-CB 3.15Å; Y943-L946 PolarHBondContact O-N 2.93Å; Y943-L946 VanDerWaalsContact O-N 3.07Å; Y943-D947 PolarHBondContact O-N 2.8Å; Y943-D947 VanDerWaalsContact O-N 3.08Å; Y943-V960 HydrophobicContact CD1-CG1 4.02Å; Y943-V960 WeakPolarHBondContact O-CG1 3.45Å; Y943-R963 HydrophobicContact CE1-CB 4.06Å; Y943-L964 HydrophobicContact CD1-CB 3.81Å; Y943-L964 HydrophobicContact CD1-CD1 4.47Å; Y943-L964 HydrophobicContact CD2-CD1 4.17Å; Y943-L964 HydrophobicContact CE1-CB 4.22Å; Y943-L964 HydrophobicContact CG-CB 4.22Å; Y943-L964 HydrophobicContact CG-CD1 4.13Å; Y943-L967 HydrophobicContact CE2-CD2 3.67Å
944	V	92.7	Very high	90.8	Very high	9 Å²	9	24.6 Å²	24.6	6%	0.055	13%	0.125	C	C	.	.	H	α-helix	trans	-63.5	-43.5	176.6	-175.8	0	0	0	0	110.6	N941 L946 D947 E948 I1015 L1018 L1019 I1022	N941-V944 WeakPolarHBondContact O-CB 3.13Å; N941-V944 PolarHBondContact O-N 2.97Å; V944-L946 PolarHBondContact O-N 3.11Å; V944-D947 PolarHBondContact O-N 3.4Å; V944-E948 PolarHBondContact O-N 2.99Å; V944-E948 VanDerWaalsContact O-N 3.09Å; V944-I1015 HydrophobicContact CG2-CD1 3.91Å; V944-I1015 HydrophobicContact CG2-CG2 3.87Å; V944-L1018 HydrophobicContact CG1-CB 3.79Å; V944-L1018 HydrophobicContact CG1-CD1 4.18Å; V944-L1019 HydrophobicContact CG2-CD2 4.28Å; V944-L1019 HydrophobicContact CG2-CG 4.41Å; V944-I1022 HydrophobicContact CG1-CD1 3.68Å
945	K	92.4	Very high	90.3	Very high	67 Å²	67	25.3 Å²	25.3	29%	0.291	13%	0.128	S	C	.	.	H	α-helix	trans	-69.3	-10.9	173.5	-59	172.3	-155	156.3	0	113.9	N941 D942 K949	N941-K945 VanDerWaalsContact CG-CE 3.46Å; N941-K945 WeakPolarHBondContact ND2-CE 3.49Å; N941-K945 PolarHBondContact ND2-NZ 2.84Å; N941-K945 WeakPolarHBondContact O-CG 3.41Å; N941-K945 PolarHBondContact O-N 3.12Å; D942-K945 WeakPolarHBondContact OD1-CD 3.39Å; D942-K945 WeakPolarHBondContact OD1-CE 3.35Å; D942-K945 IonicContact OD1-NZ 2.75Å; D942-K945 PolarHBondContact OD1-NZ 3.15Å; K945-K949 WeakPolarHBondContact O-CD 3.39Å; K945-K949 WeakPolarHBondContact O-CE 3.32Å; K945-K949 VanDerWaalsContact O-CG 3.29Å; K945-K949 WeakPolarHBondContact O-CG 3.44Å; K945-K949 PolarHBondContact O-NZ 3.26Å
946	L	92.8	Very high	89.9	Confident	5 Å²	5	22.2 Å²	22.2	3%	0.026	11%	0.112	C	C	.	.	H	α-helix	trans	-85.3	-47.9	171.7	176.2	63.8	0	0	0	109.6	W728 I841 I842 F845 D942 Y943 V944 E948 K949 L950	W728-L946 HydrophobicContact CH2-CD1 3.53Å; W728-L946 HydrophobicContact CZ2-CD1 4.16Å; W728-L946 HydrophobicContact CZ3-CD1 4.12Å; I841-L946 HydrophobicContact CG2-CD1 4.39Å; I842-L946 HydrophobicContact CG1-CD2 4.24Å; F845-L946 HydrophobicContact CB-CD2 3.97Å; F845-L946 HydrophobicContact CD1-CD2 3.46Å; F845-L946 VanDerWaalsContact CD1-CD2 3.46Å; F845-L946 HydrophobicContact CD2-CD2 4.44Å; F845-L946 HydrophobicContact CE1-CB 4.48Å; F845-L946 HydrophobicContact CE1-CD2 3.98Å; F845-L946 HydrophobicContact CG-CD2 3.71Å; D942-L946 WeakPolarHBondContact O-CB 3.43Å; D942-L946 PolarHBondContact O-N 3.3Å; Y943-L946 WeakPolarHBondContact O-CB 3.15Å; Y943-L946 PolarHBondContact O-N 2.93Å; Y943-L946 VanDerWaalsContact O-N 3.07Å; V944-L946 PolarHBondContact O-N 3.11Å; L946-E948 VanDerWaalsContact C-N 3.33Å; L946-E948 PolarHBondContact O-N 3.27Å; L946-K949 PolarHBondContact O-N 3.42Å; L946-K949 VanDerWaalsContact O-N 3.1Å; L946-L950 HydrophobicContact CD1-CD1 3.93Å; L946-L950 HydrophobicContact CD1-CG 4.11Å; L946-L950 HydrophobicContact CD2-CD1 4.39Å; L946-L950 HydrophobicContact CG-CD1 3.76Å; L946-L950 HydrophobicContact CG-CG 4.38Å; L946-L950 WeakPolarHBondContact O-CG 3.48Å; L946-L950 PolarHBondContact O-N 3.32Å; L946-L950 VanDerWaalsContact O-N 3.08Å
947	D	90.8	Very high	89.5	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-56.4	-46.3	175.4	-172.8	28.2	0	0	0	111.3	Y943 V944 K949 L950 Q953 T957 V960 L1019 I1022	Y943-D947 PolarHBondContact O-N 2.8Å; Y943-D947 VanDerWaalsContact O-N 3.08Å; V944-D947 PolarHBondContact O-N 3.4Å; D947-K949 PolarHBondContact O-N 2.8Å; D947-K949 VanDerWaalsContact O-N 3.12Å; D947-L950 PolarHBondContact O-N 3.11Å; D947-L950 VanDerWaalsContact O-N 3.16Å; D947-Q953 PolarHBondContact O-NE2 3.14Å; D947-Q953 PolarHBondContact OD1-NE2 3.28Å; D947-T957 VanDerWaalsContact CG-OG1 3.3Å; D947-T957 PolarHBondContact OD1-N 3.35Å; D947-T957 PolarHBondContact OD1-OG1 3Å; D947-T957 WeakPolarHBondContact OD2-CB 3.43Å; D947-T957 VanDerWaalsContact OD2-CG2 3.3Å; D947-T957 WeakPolarHBondContact OD2-CG2 3.42Å; D947-T957 PolarHBondContact OD2-OG1 3.4Å; D947-V960 HydrophobicContact CB-CB 4.41Å; D947-V960 HydrophobicContact CB-CG1 4.26Å; D947-V960 HydrophobicContact CB-CG2 4.18Å; D947-L1019 HydrophobicContact CB-CD2 4.17Å; D947-I1022 HydrophobicContact CB-CD1 4.35Å; D947-I1022 WeakPolarHBondContact OD2-CG2 3.37Å
948	E	88.8	Confident	89.2	Confident	122 Å²	122	23.3 Å²	23.3	57%	0.57	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.1	177.4	-174.9	177.1	-146	0	0	114.1	V944 L946 I1022	V944-E948 PolarHBondContact O-N 2.99Å; V944-E948 VanDerWaalsContact O-N 3.09Å; L946-E948 VanDerWaalsContact C-N 3.33Å; L946-E948 PolarHBondContact O-N 3.27Å; E948-I1022 HydrophobicContact CB-CD1 4.17Å
949	K	87.6	Confident	88.9	Confident	90 Å²	90	24.6 Å²	24.6	39%	0.391	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-29.5	-179.8	-68.7	170.4	-165.8	135	0	113	W728 K945 L946 D947	W728-K949 HydrophobicContact CD2-CB 4.15Å; W728-K949 HydrophobicContact CD2-CD 4.25Å; W728-K949 HydrophobicContact CE3-CB 4.18Å; W728-K949 HydrophobicContact CG-CB 4.35Å; W728-K949 HydrophobicContact CG-CD 4.22Å; K945-K949 WeakPolarHBondContact O-CD 3.39Å; K945-K949 WeakPolarHBondContact O-CE 3.32Å; K945-K949 VanDerWaalsContact O-CG 3.29Å; K945-K949 WeakPolarHBondContact O-CG 3.44Å; K945-K949 PolarHBondContact O-NZ 3.26Å; L946-K949 PolarHBondContact O-N 3.42Å; L946-K949 VanDerWaalsContact O-N 3.1Å; D947-K949 PolarHBondContact O-N 2.8Å; D947-K949 VanDerWaalsContact O-N 3.12Å
950	L	88.9	Confident	88.7	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	-75.4	150.3	-178.4	-71.5	167.3	0	0	0	111	W728 F731 R732 I838 I841 I842 L946 D947 Q953 T956 V960	W728-L950 HydrophobicContact CZ3-CD2 3.76Å; W728-L950 HydrophobicContact CZ3-CG 4.34Å; F731-L950 HydrophobicContact CD1-CD2 4.29Å; F731-L950 HydrophobicContact CE1-CD2 3.84Å; R732-L950 PolarHBondContact NH2-O 3.13Å; I838-L950 HydrophobicContact CG2-CD1 4.39Å; I841-L950 HydrophobicContact CG2-CD2 4.25Å; I842-L950 HydrophobicContact CD1-CD1 3.96Å; I842-L950 HydrophobicContact CG1-CD1 3.69Å; L946-L950 HydrophobicContact CD1-CD1 3.93Å; L946-L950 HydrophobicContact CD1-CG 4.11Å; L946-L950 HydrophobicContact CD2-CD1 4.39Å; L946-L950 HydrophobicContact CG-CD1 3.76Å; L946-L950 HydrophobicContact CG-CG 4.38Å; L946-L950 WeakPolarHBondContact O-CG 3.48Å; L946-L950 PolarHBondContact O-N 3.32Å; L946-L950 VanDerWaalsContact O-N 3.08Å; D947-L950 PolarHBondContact O-N 3.11Å; D947-L950 VanDerWaalsContact O-N 3.16Å; L950-Q953 PolarHBondContact O-NE2 3.45Å; L950-Q953 PolarHBondContact O-OE1 3.46Å; L950-T956 HydrophobicContact CB-CG2 3.6Å; L950-T956 HydrophobicContact CD1-CG2 3.75Å; L950-T956 HydrophobicContact CG-CG2 4.31Å; L950-V960 HydrophobicContact CD1-CG2 4.4Å
951	P	85.1	Confident	88.5	Confident	10 Å²	10	24.6 Å²	24.6	7%	0.065	12%	0.121	C	C	.	.	S	Bend	trans	-86.9	166.3	163.7	36.1	-32.7	0	0	0	110.8	F731 R732 V735 I838 T956	F731-P951 HydrophobicContact CD1-CG 4.38Å; F731-P951 HydrophobicContact CE1-CG 4.12Å; R732-P951 HydrophobicContact CG-CB 4.5Å; V735-P951 HydrophobicContact CB-CB 4.29Å; V735-P951 HydrophobicContact CB-CG 3.73Å; V735-P951 HydrophobicContact CG1-CB 4.01Å; V735-P951 HydrophobicContact CG1-CG 3.76Å; V735-P951 HydrophobicContact CG2-CG 3.75Å; I838-P951 HydrophobicContact CD1-CG 4.4Å; I838-P951 WeakPolarHBondContact CD1-O 3.27Å; P951-T956 PolarHBondContact O-OG1 2.82Å
952	G	78.6	Confident	88.4	Confident	10 Å²	10	26.7 Å²	26.7	10%	0.103	13%	0.132	C	C	.	.	S	Bend	trans	95.8	26.8	168.3	0	0	0	0	0	115.4	L955 T956	G952-L955 PolarHBondContact O-N 3.05Å; G952-T956 WeakPolarHBondContact O-CB 3.35Å; G952-T956 PolarHBondContact O-N 2.86Å; G952-T956 PolarHBondContact O-OG1 3.41Å
953	Q	82	Confident	88.3	Confident	18 Å²	18	27.4 Å²	27.4	8%	0.084	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	148.7	165.9	-68.1	73.8	19.1	0	0	110.8	D947 L950 T957 I1022 E1026	D947-Q953 PolarHBondContact O-NE2 3.14Å; D947-Q953 PolarHBondContact OD1-NE2 3.28Å; L950-Q953 PolarHBondContact O-NE2 3.45Å; L950-Q953 PolarHBondContact O-OE1 3.46Å; Q953-T957 WeakPolarHBondContact CG-OG1 3.45Å; Q953-I1022 HydrophobicContact CG-CG2 4.16Å; Q953-E1026 HydrophobicContact CB-CB 4.03Å; Q953-E1026 HydrophobicContact CB-CG 4.27Å; Q953-E1026 HydrophobicContact CG-CG 4.27Å
954	P	79.9	Confident	88.3	Confident	9 Å²	9	27.4 Å²	27.4	6%	0.058	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	cis	-78.8	-22.9	3.7	32.4	-37.8	0	0	0	114.7	T956 T957 E958 S1023	P954-T956 PolarHBondContact O-N 3.4Å; P954-T956 VanDerWaalsContact O-N 3.13Å; P954-T957 WeakPolarHBondContact O-CA 3.25Å; P954-T957 VanDerWaalsContact O-CB 3.28Å; P954-T957 WeakPolarHBondContact O-CB 3.42Å; P954-T957 PolarHBondContact O-N 2.89Å; P954-E958 PolarHBondContact O-N 3.22Å; P954-S1023 WeakPolarHBondContact CB-OG 3.36Å
955	L	82.2	Confident	88.3	Confident	22 Å²	22	27.3 Å²	27.3	12%	0.115	13%	0.131	C	C	.	.	H	α-helix	trans	-58.2	-31.7	-171.9	-179.6	59.1	0	0	0	113.6	L835 G952 E958 F959 Y1044	L835-L955 HydrophobicContact CD1-CD2 3.95Å; L835-L955 HydrophobicContact CD2-CD2 3.78Å; L835-L955 HydrophobicContact CD2-CG 4.4Å; G952-L955 PolarHBondContact O-N 3.05Å; L955-E958 WeakPolarHBondContact O-CB 3.46Å; L955-E958 PolarHBondContact O-N 2.88Å; L955-F959 HydrophobicContact CD1-CE1 4.15Å; L955-F959 HydrophobicContact CD1-CE2 4.03Å; L955-F959 HydrophobicContact CD1-CZ 3.69Å; L955-F959 HydrophobicContact CD2-CE2 4.29Å; L955-F959 HydrophobicContact CD2-CZ 4.32Å; L955-F959 HydrophobicContact CG-CD2 4.45Å; L955-F959 HydrophobicContact CG-CE2 3.71Å; L955-F959 HydrophobicContact CG-CZ 3.86Å; L955-F959 WeakPolarHBondContact O-CD2 3.34Å; L955-F959 PolarHBondContact O-N 2.87Å; L955-Y1044 VanDerWaalsContact CB-O 3.29Å; L955-Y1044 WeakPolarHBondContact CB-O 3.43Å
956	T	85.5	Confident	88.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66	-42.8	173.7	-63.5	0	0	0	0	112.8	I838 I842 L950 P951 G952 P954 E958 F959 V960	I838-T956 HydrophobicContact CG2-CG2 3.92Å; I842-T956 HydrophobicContact CD1-CG2 4.41Å; L950-T956 HydrophobicContact CB-CG2 3.6Å; L950-T956 HydrophobicContact CD1-CG2 3.75Å; L950-T956 HydrophobicContact CG-CG2 4.31Å; P951-T956 PolarHBondContact O-OG1 2.82Å; G952-T956 WeakPolarHBondContact O-CB 3.35Å; G952-T956 PolarHBondContact O-N 2.86Å; G952-T956 PolarHBondContact O-OG1 3.41Å; P954-T956 PolarHBondContact O-N 3.4Å; P954-T956 VanDerWaalsContact O-N 3.13Å; T956-E958 PolarHBondContact O-N 3.49Å; T956-F959 PolarHBondContact O-N 3.27Å; T956-V960 WeakPolarHBondContact O-CG2 3.28Å; T956-V960 PolarHBondContact O-N 2.71Å
957	T	88.5	Confident	88.6	Confident	11 Å²	11	27.5 Å²	27.5	7%	0.067	14%	0.135	C	C	.	.	H	α-helix	trans	-59.4	-35.5	173.5	-53.6	0	0	0	0	111	D947 Q953 P954 S961 L1019	D947-T957 VanDerWaalsContact CG-OG1 3.3Å; D947-T957 PolarHBondContact OD1-N 3.35Å; D947-T957 PolarHBondContact OD1-OG1 3Å; D947-T957 WeakPolarHBondContact OD2-CB 3.43Å; D947-T957 VanDerWaalsContact OD2-CG2 3.3Å; D947-T957 WeakPolarHBondContact OD2-CG2 3.42Å; D947-T957 PolarHBondContact OD2-OG1 3.4Å; Q953-T957 WeakPolarHBondContact CG-OG1 3.45Å; P954-T957 WeakPolarHBondContact O-CA 3.25Å; P954-T957 VanDerWaalsContact O-CB 3.28Å; P954-T957 WeakPolarHBondContact O-CB 3.42Å; P954-T957 PolarHBondContact O-N 2.89Å; T957-S961 WeakPolarHBondContact O-CB 3.49Å; T957-S961 PolarHBondContact O-N 2.9Å; T957-L1019 HydrophobicContact CG2-CB 3.83Å; T957-L1019 HydrophobicContact CG2-CD2 4.3Å
958	E	87.4	Confident	88.9	Confident	12 Å²	12	27.5 Å²	27.5	6%	0.056	14%	0.135	C	C	.	.	H	α-helix	trans	-63.9	-47.8	175.5	-57.7	-163.7	108.2	0	0	112	P954 L955 T956 V960 S961 D962 N1052 T1055	P954-E958 PolarHBondContact O-N 3.22Å; L955-E958 WeakPolarHBondContact O-CB 3.46Å; L955-E958 PolarHBondContact O-N 2.88Å; T956-E958 PolarHBondContact O-N 3.49Å; E958-V960 PolarHBondContact O-N 2.94Å; E958-S961 WeakPolarHBondContact O-CB 3.33Å; E958-S961 PolarHBondContact O-N 3.48Å; E958-D962 PolarHBondContact O-N 3.31Å; E958-N1052 WeakPolarHBondContact OE1-CA 3.49Å; E958-N1052 PolarHBondContact OE1-N 2.92Å; E958-T1055 HydrophobicContact CB-CG2 3.98Å; E958-T1055 HydrophobicContact CG-CG2 4.31Å; E958-T1055 WeakPolarHBondContact OE1-CG2 3.46Å; E958-T1055 PolarHBondContact OE1-OG1 3.48Å
959	F	89	Confident	89.2	Confident	58 Å²	58	24.4 Å²	24.4	25%	0.254	12%	0.122	S	C	.	.	H	α-helix	trans	-64.2	-38.3	177.1	-61.2	-41.2	0	0	0	113.1	L835 I839 I842 L955 T956 R963	L835-F959 HydrophobicContact CD2-CE2 4.43Å; I839-F959 HydrophobicContact CD1-CD2 4.34Å; I839-F959 HydrophobicContact CD1-CE1 4.43Å; I839-F959 HydrophobicContact CD1-CE2 3.76Å; I839-F959 HydrophobicContact CD1-CZ 3.82Å; I839-F959 HydrophobicContact CG1-CD2 3.76Å; I839-F959 HydrophobicContact CG1-CE2 3.68Å; I839-F959 HydrophobicContact CG1-CG 4.28Å; I839-F959 HydrophobicContact CG1-CZ 4.15Å; I842-F959 HydrophobicContact CD1-CB 3.75Å; L955-F959 HydrophobicContact CD1-CE1 4.15Å; L955-F959 HydrophobicContact CD1-CE2 4.03Å; L955-F959 HydrophobicContact CD1-CZ 3.69Å; L955-F959 HydrophobicContact CD2-CE2 4.29Å; L955-F959 HydrophobicContact CD2-CZ 4.32Å; L955-F959 HydrophobicContact CG-CD2 4.45Å; L955-F959 HydrophobicContact CG-CE2 3.71Å; L955-F959 HydrophobicContact CG-CZ 3.86Å; L955-F959 WeakPolarHBondContact O-CD2 3.34Å; L955-F959 PolarHBondContact O-N 2.87Å; T956-F959 PolarHBondContact O-N 3.27Å; F959-R963 WeakPolarHBondContact O-CB 3.32Å; F959-R963 WeakPolarHBondContact O-CG 3.44Å; F959-R963 PolarHBondContact O-N 3.48Å; F959-R963 VanDerWaalsContact O-N 3.14Å
960	V	92	Very high	89.5	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-66	-40.6	173.8	176.1	0	0	0	0	110.9	I842 Y943 D947 L950 T956 E958 R963 L964 L1019	I842-V960 HydrophobicContact CD1-CG2 3.72Å; I842-V960 HydrophobicContact CG1-CG2 4.03Å; I842-V960 HydrophobicContact CG2-CG2 4.35Å; Y943-V960 HydrophobicContact CD1-CG1 4.02Å; Y943-V960 WeakPolarHBondContact O-CG1 3.45Å; D947-V960 HydrophobicContact CB-CB 4.41Å; D947-V960 HydrophobicContact CB-CG1 4.26Å; D947-V960 HydrophobicContact CB-CG2 4.18Å; L950-V960 HydrophobicContact CD1-CG2 4.4Å; T956-V960 WeakPolarHBondContact O-CG2 3.28Å; T956-V960 PolarHBondContact O-N 2.71Å; E958-V960 PolarHBondContact O-N 2.94Å; V960-R963 PolarHBondContact O-N 3.03Å; V960-L964 VanDerWaalsContact O-CB 3.3Å; V960-L964 WeakPolarHBondContact O-CB 3.35Å; V960-L964 PolarHBondContact O-N 3.1Å; V960-L1019 HydrophobicContact CG1-CD2 4.37Å
961	S	91	Very high	89.9	Confident	4 Å²	4	21.8 Å²	21.8	3%	0.028	11%	0.111	C	C	.	.	H	α-helix	trans	-60.3	-49.7	176.1	170.4	0	0	0	0	112	T957 E958 R963 L964 A965 L1059	T957-S961 WeakPolarHBondContact O-CB 3.49Å; T957-S961 PolarHBondContact O-N 2.9Å; E958-S961 WeakPolarHBondContact O-CB 3.33Å; E958-S961 PolarHBondContact O-N 3.48Å; S961-R963 PolarHBondContact O-N 3.22Å; S961-L964 PolarHBondContact O-N 3.29Å; S961-A965 WeakPolarHBondContact O-CB 3.23Å; S961-A965 PolarHBondContact O-N 3Å; S961-L1059 WeakPolarHBondContact O-CD1 3.3Å; S961-L1059 WeakPolarHBondContact OG-CD1 3.45Å
962	D	90.7	Very high	90.4	Very high	60 Å²	60	21.8 Å²	21.8	32%	0.321	11%	0.111	S	C	.	.	H	α-helix	trans	-62.6	-42.8	178.9	-75.1	-3	0	0	0	111.6	E958 L964 A965 D966	E958-D962 PolarHBondContact O-N 3.31Å; D962-L964 PolarHBondContact O-N 3.09Å; D962-A965 WeakPolarHBondContact O-CB 3.47Å; D962-A965 PolarHBondContact O-N 3Å; D962-D966 PolarHBondContact O-N 3.12Å
963	R	93.5	Very high	91.2	Very high	68 Å²	68	23.7 Å²	23.7	26%	0.257	12%	0.123	S	C	.	.	H	α-helix	trans	-68.5	-33.2	178	-73.4	-87.5	159.1	-85.9	-16.7	112.9	I842 D843 H846 Y943 F959 V960 S961 D966 L967	I842-R963 HydrophobicContact CG2-CB 4.05Å; I842-R963 HydrophobicContact CG2-CG 3.82Å; D843-R963 WeakPolarHBondContact OD1-CD 3.44Å; D843-R963 IonicContact OD1-CZ 3.57Å; D843-R963 IonicContact OD1-NE 2.72Å; D843-R963 PolarHBondContact OD1-NE 3.02Å; D843-R963 IonicContact OD1-NH2 3.41Å; H846-R963 HydrophobicContact CB-CB 4.3Å; H846-R963 HydrophobicContact CB-CG 4.43Å; H846-R963 VanDerWaalsContact CD2-CD 3.46Å; H846-R963 WeakPolarHBondContact CD2-CD 3.43Å; H846-R963 PolarHBondContact CE1-O 3.41Å; H846-R963 PolarHBondContact ND1-O 3.16Å; Y943-R963 HydrophobicContact CE1-CB 4.06Å; F959-R963 WeakPolarHBondContact O-CB 3.32Å; F959-R963 WeakPolarHBondContact O-CG 3.44Å; F959-R963 PolarHBondContact O-N 3.48Å; F959-R963 VanDerWaalsContact O-N 3.14Å; V960-R963 PolarHBondContact O-N 3.03Å; S961-R963 PolarHBondContact O-N 3.22Å; R963-D966 IonicContact CZ-OD2 3.16Å; R963-D966 IonicContact NH1-OD2 2.73Å; R963-D966 PolarHBondContact NH1-OD2 3.08Å; R963-L967 PolarHBondContact O-N 2.83Å; R963-L967 VanDerWaalsContact O-N 3.15Å
964	L	95	Very high	91.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-68.7	-40.8	170.8	176.8	59.5	0	0	0	111.5	I940 Y943 V960 S961 D962 L967 L968 I1015 L1019 L1059	I940-L964 HydrophobicContact CB-CD1 4.39Å; I940-L964 HydrophobicContact CG1-CD1 4.14Å; I940-L964 HydrophobicContact CG2-CD1 4.11Å; I940-L964 HydrophobicContact CG2-CD2 4.38Å; Y943-L964 HydrophobicContact CD1-CB 3.81Å; Y943-L964 HydrophobicContact CD1-CD1 4.47Å; Y943-L964 HydrophobicContact CD2-CD1 4.17Å; Y943-L964 HydrophobicContact CE1-CB 4.22Å; Y943-L964 HydrophobicContact CG-CB 4.22Å; Y943-L964 HydrophobicContact CG-CD1 4.13Å; V960-L964 VanDerWaalsContact O-CB 3.3Å; V960-L964 WeakPolarHBondContact O-CB 3.35Å; V960-L964 PolarHBondContact O-N 3.1Å; S961-L964 PolarHBondContact O-N 3.29Å; D962-L964 PolarHBondContact O-N 3.09Å; L964-L967 PolarHBondContact O-N 3.34Å; L964-L968 HydrophobicContact CD1-CD1 4Å; L964-L968 HydrophobicContact CD1-CG 4.15Å; L964-L968 HydrophobicContact CG-CD1 3.91Å; L964-L968 WeakPolarHBondContact O-CB 3.23Å; L964-L968 WeakPolarHBondContact O-CD1 3.49Å; L964-L968 VanDerWaalsContact O-CG 3.28Å; L964-L968 WeakPolarHBondContact O-CG 3.43Å; L964-L968 PolarHBondContact O-N 3.28Å; L964-I1015 HydrophobicContact CD2-CG2 3.64Å; L964-L1019 HydrophobicContact CD2-CD1 4.27Å; L964-L1059 HydrophobicContact CD2-CD2 4.24Å
965	A	93.7	Very high	92.5	Very high	7 Å²	7	23 Å²	23	6%	0.058	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-44.1	175.4	0	0	0	0	0	111.7	S961 D962 L967 L968 N969 L1059 I1062	S961-A965 WeakPolarHBondContact O-CB 3.23Å; S961-A965 PolarHBondContact O-N 3Å; D962-A965 WeakPolarHBondContact O-CB 3.47Å; D962-A965 PolarHBondContact O-N 3Å; A965-L967 PolarHBondContact O-N 3.09Å; A965-L968 PolarHBondContact O-N 3.37Å; A965-N969 VanDerWaalsContact O-CB 3.29Å; A965-N969 WeakPolarHBondContact O-CB 3.44Å; A965-N969 PolarHBondContact O-N 3.39Å; A965-L1059 HydrophobicContact CB-CD1 4.19Å; A965-I1062 HydrophobicContact CB-CG1 3.84Å
966	D	94.1	Very high	93	Very high	77 Å²	77	24.2 Å²	24.2	41%	0.412	13%	0.128	S	C	.	.	H	α-helix	trans	-61.3	-42.2	175.1	-82.6	-23.1	0	0	0	112.2	D962 R963 L968 N969 H970	D962-D966 PolarHBondContact O-N 3.12Å; R963-D966 IonicContact CZ-OD2 3.16Å; R963-D966 IonicContact NH1-OD2 2.73Å; R963-D966 PolarHBondContact NH1-OD2 3.08Å; D966-L968 PolarHBondContact O-N 2.87Å; D966-N969 PolarHBondContact O-N 3.31Å; D966-H970 WeakPolarHBondContact O-CB 3.43Å; D966-H970 PolarHBondContact O-N 2.79Å
967	L	96.2	Very high	93.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.9	-44.3	176.3	-172.4	78.2	0	0	0	111.9	Y850 L853 L936 Y943 R963 L964 A965 H970 F971	Y850-L967 HydrophobicContact CD2-CD1 4.38Å; L853-L967 HydrophobicContact CB-CD1 4.48Å; L853-L967 HydrophobicContact CD2-CD1 3.65Å; L853-L967 HydrophobicContact CD2-CD2 4.4Å; L853-L967 HydrophobicContact CD2-CG 3.8Å; L936-L967 HydrophobicContact CD1-CD2 4.33Å; Y943-L967 HydrophobicContact CE2-CD2 3.67Å; R963-L967 PolarHBondContact O-N 2.83Å; R963-L967 VanDerWaalsContact O-N 3.15Å; L964-L967 PolarHBondContact O-N 3.34Å; A965-L967 PolarHBondContact O-N 3.09Å; L967-H970 PolarHBondContact O-N 3.48Å; L967-F971 PolarHBondContact O-N 2.98Å
968	L	96.6	Very high	93.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-70	-38.1	179.5	-69.8	165.2	0	0	0	112.2	I940 L964 A965 D966 H970 F971 N972 V1008 L1012 I1062 F1066	I940-L968 HydrophobicContact CD1-CD2 3.77Å; I940-L968 HydrophobicContact CG1-CD2 4.22Å; L964-L968 HydrophobicContact CD1-CD1 4Å; L964-L968 HydrophobicContact CD1-CG 4.15Å; L964-L968 HydrophobicContact CG-CD1 3.91Å; L964-L968 WeakPolarHBondContact O-CB 3.23Å; L964-L968 WeakPolarHBondContact O-CD1 3.49Å; L964-L968 VanDerWaalsContact O-CG 3.28Å; L964-L968 WeakPolarHBondContact O-CG 3.43Å; L964-L968 PolarHBondContact O-N 3.28Å; A965-L968 PolarHBondContact O-N 3.37Å; D966-L968 PolarHBondContact O-N 2.87Å; L968-H970 VanDerWaalsContact C-N 3.33Å; L968-F971 PolarHBondContact O-N 2.97Å; L968-N972 WeakPolarHBondContact O-CB 3.46Å; L968-N972 PolarHBondContact O-N 3.3Å; L968-V1008 HydrophobicContact CD2-CG1 3.95Å; L968-L1012 HydrophobicContact CD1-CD2 3.57Å; L968-L1012 HydrophobicContact CD2-CD2 4.32Å; L968-I1062 HydrophobicContact CB-CG2 3.67Å; L968-I1062 HydrophobicContact CD1-CG2 4.42Å; L968-F1066 HydrophobicContact CB-CE2 4.17Å; L968-F1066 HydrophobicContact CB-CZ 4.38Å; L968-F1066 HydrophobicContact CD2-CZ 4.34Å; L968-F1066 WeakPolarHBondContact O-CE2 3.28Å
969	N	95.2	Very high	93.7	Very high	56 Å²	56	27.4 Å²	27.4	30%	0.299	14%	0.143	S	C	.	.	H	α-helix	trans	-61.7	-44	173.8	-169.8	21.8	0	0	0	111.1	A965 D966 N972 S973 I1062	A965-N969 VanDerWaalsContact O-CB 3.29Å; A965-N969 WeakPolarHBondContact O-CB 3.44Å; A965-N969 PolarHBondContact O-N 3.39Å; D966-N969 PolarHBondContact O-N 3.31Å; N969-N972 PolarHBondContact O-N 2.85Å; N969-S973 VanDerWaalsContact O-CB 3.29Å; N969-S973 WeakPolarHBondContact O-CB 3.48Å; N969-S973 PolarHBondContact O-N 2.96Å; N969-S973 PolarHBondContact O-OG 3.21Å; N969-I1062 HydrophobicContact CB-CD1 3.69Å
970	H	95.5	Very high	93.7	Very high	32 Å²	32	27.7 Å²	27.7	15%	0.148	15%	0.147	C	C	.	.	H	α-helix	trans	-62.9	-46.5	175.4	-178.6	56.4	0	0	0	111.9	Y850 N854 D966 L967 L968 N972 S973 R974	Y850-H970 HydrophobicContact CD2-CB 4.37Å; Y850-H970 AromaticContact CD2-CD2 3.84Å; Y850-H970 HydrophobicContact CE2-CB 3.75Å; Y850-H970 AromaticContact CE2-CD2 3.37Å; Y850-H970 WeakPolarHBondContact CE2-CD2 3.41Å; Y850-H970 AromaticContact CE2-CG 3.38Å; Y850-H970 AromaticContact CE2-ND1 3.95Å; Y850-H970 AromaticContact CE2-NE2 3.9Å; Y850-H970 AromaticContact CZ-CD2 3.77Å; Y850-H970 AromaticContact CZ-CE1 3.93Å; Y850-H970 AromaticContact CZ-CG 3.89Å; Y850-H970 AromaticContact CZ-NE2 3.8Å; N854-H970 PolarHBondContact ND2-NE2 2.86Å; N854-H970 PolarHBondContact OD1-CE1 3.23Å; N854-H970 PolarHBondContact OD1-NE2 2.87Å; D966-H970 WeakPolarHBondContact O-CB 3.43Å; D966-H970 PolarHBondContact O-N 2.79Å; L967-H970 PolarHBondContact O-N 3.48Å; L968-H970 VanDerWaalsContact C-N 3.33Å; H970-N972 PolarHBondContact O-N 3Å; H970-S973 PolarHBondContact O-N 3.48Å; H970-R974 WeakPolarHBondContact O-CB 3.4Å; H970-R974 PolarHBondContact O-N 2.79Å
971	F	97	Very high	93.4	Very high	3 Å²	3	30 Å²	30	1%	0.013	17%	0.17	C	C	.	.	H	α-helix	trans	-52.3	-53.8	172.4	175.2	-99.2	0	0	0	111.5	L853 L857 T932 V933 L936 L967 L968 S973 R974 V975 L1005 V1008 F1066	L853-F971 HydrophobicContact CD1-CD2 4.25Å; L853-F971 HydrophobicContact CD2-CB 4.23Å; L857-F971 HydrophobicContact CD1-CD2 4.12Å; L857-F971 HydrophobicContact CD2-CD2 3.9Å; L857-F971 HydrophobicContact CD2-CE2 3.85Å; L857-F971 HydrophobicContact CG-CD2 4.45Å; T932-F971 HydrophobicContact CG2-CE2 4.41Å; V933-F971 HydrophobicContact CG2-CE1 4.43Å; V933-F971 HydrophobicContact CG2-CE2 4.12Å; V933-F971 HydrophobicContact CG2-CZ 3.52Å; L936-F971 HydrophobicContact CD2-CB 4.49Å; L936-F971 HydrophobicContact CD2-CD1 4.03Å; L936-F971 HydrophobicContact CD2-CD2 3.67Å; L936-F971 HydrophobicContact CD2-CE1 4.14Å; L936-F971 HydrophobicContact CD2-CE2 3.79Å; L936-F971 HydrophobicContact CD2-CG 3.79Å; L936-F971 HydrophobicContact CD2-CZ 4.03Å; L967-F971 PolarHBondContact O-N 2.98Å; L968-F971 PolarHBondContact O-N 2.97Å; F971-S973 PolarHBondContact O-N 3.5Å; F971-R974 PolarHBondContact O-N 3.14Å; F971-V975 HydrophobicContact CD1-CG2 4.38Å; F971-V975 HydrophobicContact CD2-CG2 4.1Å; F971-V975 HydrophobicContact CE1-CG2 4.09Å; F971-V975 HydrophobicContact CE2-CG2 3.77Å; F971-V975 HydrophobicContact CG-CG2 4.39Å; F971-V975 HydrophobicContact CZ-CG2 3.77Å; F971-V975 WeakPolarHBondContact O-CB 3.47Å; F971-V975 WeakPolarHBondContact O-CG2 3.41Å; F971-V975 PolarHBondContact O-N 3.47Å; F971-L1005 HydrophobicContact CE1-CD2 3.99Å; F971-V1008 HydrophobicContact CE1-CG2 4.36Å; F971-F1066 AromaticContact CD1-CE1 3.88Å; F971-F1066 HydrophobicContact CD1-CE1 3.88Å; F971-F1066 AromaticContact CD1-CZ 3.73Å; F971-F1066 HydrophobicContact CD1-CZ 3.73Å; F971-F1066 HydrophobicContact CE1-CE1 4.01Å; F971-F1066 HydrophobicContact CE1-CZ 4.34Å
972	N	95.6	Very high	93.1	Very high	11 Å²	11	31.7 Å²	31.7	6%	0.059	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-45.5	-178.2	-166.9	41.1	0	0	0	112	L968 N969 H970 C976 L1065 F1066 H1069	L968-N972 WeakPolarHBondContact O-CB 3.46Å; L968-N972 PolarHBondContact O-N 3.3Å; N969-N972 PolarHBondContact O-N 2.85Å; H970-N972 PolarHBondContact O-N 3Å; N972-C976 WeakPolarHBondContact O-CB 3.4Å; N972-C976 PolarHBondContact O-N 3.13Å; N972-L1065 VanDerWaalsContact ND2-C 3.3Å; N972-L1065 PolarHBondContact ND2-O 2.77Å; N972-F1066 HydrophobicContact CB-CD2 3.89Å; N972-F1066 HydrophobicContact CB-CE2 3.61Å; N972-F1066 HydrophobicContact CB-CZ 3.99Å; N972-H1069 PolarHBondContact O-CE1 2.74Å; N972-H1069 PolarHBondContact OD1-ND1 3.13Å
973	S	95.2	Very high	92.9	Very high	50 Å²	50	31.2 Å²	31.2	35%	0.35	18%	0.18	S	C	.	.	H	α-helix	trans	-65.1	-44	179.5	-60.6	0	0	0	0	112.4	N969 H970 F971 C976 Q977	N969-S973 VanDerWaalsContact O-CB 3.29Å; N969-S973 WeakPolarHBondContact O-CB 3.48Å; N969-S973 PolarHBondContact O-N 2.96Å; N969-S973 PolarHBondContact O-OG 3.21Å; H970-S973 PolarHBondContact O-N 3.48Å; F971-S973 PolarHBondContact O-N 3.5Å; S973-C976 WeakPolarHBondContact O-CB 3.25Å; S973-C976 PolarHBondContact O-N 3.03Å; S973-Q977 WeakPolarHBondContact O-CG 3.5Å; S973-Q977 PolarHBondContact O-N 3.3Å
974	R	94.5	Very high	92.5	Very high	10 Å²	10	28 Å²	28	4%	0.038	17%	0.168	C	C	.	.	H	α-helix	trans	-70.3	-39	179.5	-171.1	74.7	-155.6	118.3	10.6	111.6	L857 D858 H970 F971 C976 Q977 L978 E983	L857-R974 HydrophobicContact CB-CG 4.17Å; L857-R974 HydrophobicContact CD1-CB 3.96Å; L857-R974 HydrophobicContact CD1-CG 3.82Å; D858-R974 IonicContact OD1-CZ 3.39Å; D858-R974 IonicContact OD1-NE 2.8Å; D858-R974 PolarHBondContact OD1-NE 2.71Å; D858-R974 VanDerWaalsContact OD1-NE 3.16Å; D858-R974 IonicContact OD1-NH2 3.66Å; D858-R974 PolarHBondContact OD1-NH2 3.32Å; H970-R974 WeakPolarHBondContact O-CB 3.4Å; H970-R974 PolarHBondContact O-N 2.79Å; F971-R974 PolarHBondContact O-N 3.14Å; R974-C976 VanDerWaalsContact C-N 3.33Å; R974-Q977 PolarHBondContact O-N 3.3Å; R974-L978 HydrophobicContact CG-CD1 4.09Å; R974-L978 WeakPolarHBondContact O-CB 3.36Å; R974-L978 VanDerWaalsContact O-CG 3.3Å; R974-L978 WeakPolarHBondContact O-CG 3.31Å; R974-L978 PolarHBondContact O-N 3.1Å; R974-E983 IonicContact CZ-OE2 2.81Å; R974-E983 IonicContact NH1-OE1 3.36Å; R974-E983 IonicContact NH1-OE2 3.78Å; R974-E983 PolarHBondContact NH1-OE2 3.26Å; R974-E983 IonicContact NH2-OE2 3.65Å; R974-E983 PolarHBondContact NH2-OE2 2.98Å
975	V	95.3	Very high	92.1	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-61.8	-41.1	171.6	170.6	0	0	0	0	111	L857 W862 F971 L978 V979 T1001 L1005	L857-V975 HydrophobicContact CD2-CG2 3.76Å; W862-V975 HydrophobicContact CH2-CB 4.46Å; W862-V975 HydrophobicContact CH2-CG1 3.84Å; W862-V975 HydrophobicContact CH2-CG2 4.12Å; W862-V975 HydrophobicContact CZ3-CG1 4.43Å; F971-V975 HydrophobicContact CD1-CG2 4.38Å; F971-V975 HydrophobicContact CD2-CG2 4.1Å; F971-V975 HydrophobicContact CE1-CG2 4.09Å; F971-V975 HydrophobicContact CE2-CG2 3.77Å; F971-V975 HydrophobicContact CG-CG2 4.39Å; F971-V975 HydrophobicContact CZ-CG2 3.77Å; F971-V975 WeakPolarHBondContact O-CB 3.47Å; F971-V975 WeakPolarHBondContact O-CG2 3.41Å; F971-V975 PolarHBondContact O-N 3.47Å; V975-L978 PolarHBondContact O-N 3.21Å; V975-V979 HydrophobicContact CG1-CG2 4.31Å; V975-V979 WeakPolarHBondContact O-CB 3.49Å; V975-V979 WeakPolarHBondContact O-CG2 3.18Å; V975-V979 PolarHBondContact O-N 3.04Å; V975-T1001 HydrophobicContact CG1-CG2 3.48Å; V975-T1001 VanDerWaalsContact CG1-CG2 3.48Å; V975-L1005 HydrophobicContact CG1-CD2 4.5Å
976	C	92.5	Very high	91.5	Very high	47 Å²	47	38.2 Å²	38.2	32%	0.318	22%	0.216	S	C	.	.	H	α-helix	trans	-59.9	-47	175.1	-176.2	0	0	0	0	111.6	N972 S973 R974 L980 G981 H1069	N972-C976 WeakPolarHBondContact O-CB 3.4Å; N972-C976 PolarHBondContact O-N 3.13Å; S973-C976 WeakPolarHBondContact O-CB 3.25Å; S973-C976 PolarHBondContact O-N 3.03Å; R974-C976 VanDerWaalsContact C-N 3.33Å; C976-L980 WeakPolarHBondContact O-CA 3.03Å; C976-L980 WeakPolarHBondContact O-CB 3.4Å; C976-L980 PolarHBondContact O-N 3.23Å; C976-G981 PolarHBondContact O-N 3.38Å; C976-H1069 VanDerWaalsContact CA-CE1 3.49Å; C976-H1069 WeakPolarHBondContact CA-CE1 3.3Å; C976-H1069 WeakPolarHBondContact CA-NE2 3.18Å; C976-H1069 PolarHBondContact N-CE1 3.16Å
977	Q	92.1	Very high	90.8	Very high	86 Å²	86	40.7 Å²	40.7	40%	0.402	22%	0.22	S	C	.	.	H	α-helix	trans	-61.3	-45.5	175.8	-70.1	165.1	-6.1	0	0	112.7	S973 R974 G981 A982 E983	S973-Q977 WeakPolarHBondContact O-CG 3.5Å; S973-Q977 PolarHBondContact O-N 3.3Å; R974-Q977 PolarHBondContact O-N 3.3Å; Q977-G981 CarbonylContact O-C 3.6Å; Q977-G981 WeakPolarHBondContact O-CA 3.4Å; Q977-G981 PolarHBondContact O-N 3.29Å; Q977-A982 PolarHBondContact O-N 3.1Å; Q977-E983 WeakPolarHBondContact O-CB 3.49Å; Q977-E983 PolarHBondContact O-N 3.06Å; Q977-E983 VanDerWaalsContact O-N 3.09Å
978	L	92	Very high	89.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-41.6	-179.5	-75.7	167.8	0	0	0	112.6	L857 W862 R974 V975 A982 E983 A984	L857-L978 HydrophobicContact CB-CD1 4.05Å; L857-L978 HydrophobicContact CD2-CD1 4.46Å; L857-L978 WeakPolarHBondContact O-CD1 3.48Å; W862-L978 HydrophobicContact CZ2-CB 4.11Å; W862-L978 HydrophobicContact CZ2-CD1 4.28Å; R974-L978 HydrophobicContact CG-CD1 4.09Å; R974-L978 WeakPolarHBondContact O-CB 3.36Å; R974-L978 VanDerWaalsContact O-CG 3.3Å; R974-L978 WeakPolarHBondContact O-CG 3.31Å; R974-L978 PolarHBondContact O-N 3.1Å; V975-L978 PolarHBondContact O-N 3.21Å; L978-A982 CarbonylContact O-C 3.51Å; L978-E983 HydrophobicContact CD2-CB 4.22Å; L978-E983 PolarHBondContact O-N 3.3Å; L978-A984 HydrophobicContact CB-CB 4.26Å; L978-A984 HydrophobicContact CD2-CB 4.11Å; L978-A984 VanDerWaalsContact O-CB 3.27Å; L978-A984 WeakPolarHBondContact O-CB 3.49Å; L978-A984 PolarHBondContact O-N 2.94Å
979	V	91.2	Very high	88.9	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.024	26%	0.264	C	S	.	.	H	α-helix	trans	-100	-53.3	-170.3	-178.9	0	0	0	0	112.9	W862 V975 I993 L998 T1001	W862-V979 HydrophobicContact CD2-CG2 4Å; W862-V979 HydrophobicContact CE3-CG2 3.92Å; W862-V979 HydrophobicContact CH2-CG2 3.51Å; W862-V979 HydrophobicContact CZ2-CG2 3.55Å; W862-V979 HydrophobicContact CZ3-CG2 3.68Å; V975-V979 HydrophobicContact CG1-CG2 4.31Å; V975-V979 WeakPolarHBondContact O-CB 3.49Å; V975-V979 WeakPolarHBondContact O-CG2 3.18Å; V975-V979 PolarHBondContact O-N 3.04Å; V979-I993 HydrophobicContact CG1-CG2 4.07Å; V979-L998 HydrophobicContact CG1-CD2 3.67Å; V979-T1001 HydrophobicContact CB-CG2 4.38Å; V979-T1001 HydrophobicContact CG1-CG2 4.25Å; V979-T1001 HydrophobicContact CG2-CG2 4Å
980	L	88	Confident	88.1	Confident	64 Å²	64	47.8 Å²	47.8	34%	0.335	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-35.9	-179.9	-62.9	-179.3	0	0	0	111.9	C976 A982 L998 I1073 K1076	C976-L980 WeakPolarHBondContact O-CA 3.03Å; C976-L980 WeakPolarHBondContact O-CB 3.4Å; C976-L980 PolarHBondContact O-N 3.23Å; L980-A982 PolarHBondContact O-N 3.16Å; L980-L998 HydrophobicContact CD2-CD2 4.2Å; L980-I1073 HydrophobicContact CD1-CG1 4.16Å; L980-I1073 HydrophobicContact CD2-CG1 4.1Å; L980-I1073 HydrophobicContact CG-CG1 4.29Å; L980-K1076 HydrophobicContact CD2-CB 4.28Å; L980-K1076 HydrophobicContact CD2-CG 4.36Å
981	G	86.6	Confident	87.3	Confident	48 Å²	48	55.6 Å²	55.6	50%	0.495	30%	0.295	S	S	.	.	S	Bend	trans	-76.7	-3	169.4	0	0	0	0	0	114.4	C976 Q977 E983	C976-G981 PolarHBondContact O-N 3.38Å; Q977-G981 CarbonylContact O-C 3.6Å; Q977-G981 WeakPolarHBondContact O-CA 3.4Å; Q977-G981 PolarHBondContact O-N 3.29Å; G981-E983 PolarHBondContact O-N 3.49Å; G981-E983 VanDerWaalsContact O-N 3.12Å
982	A	85.2	Confident	86.7	Confident	40 Å²	40	64.8 Å²	64.8	33%	0.331	33%	0.33	S	S	.	.			trans	53.6	23.1	-178.1	0	0	0	0	0	115.4	Q977 L978 L980 A984 C985 I993	Q977-A982 PolarHBondContact O-N 3.1Å; L978-A982 CarbonylContact O-C 3.51Å; L980-A982 PolarHBondContact O-N 3.16Å; A982-A984 PolarHBondContact O-N 2.8Å; A982-C985 WeakPolarHBondContact O-CB 3.46Å; A982-C985 PolarHBondContact O-N 2.68Å; A982-I993 HydrophobicContact CB-CG1 4.22Å
983	E	86.6	Confident	86.4	Confident	50 Å²	50	66 Å²	66	23%	0.234	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.5	176.2	-81.8	-170.7	-142.4	0	0	113.4	R974 Q977 L978 G981 C985 K986 R987	R974-E983 IonicContact CZ-OE2 2.81Å; R974-E983 IonicContact NH1-OE1 3.36Å; R974-E983 IonicContact NH1-OE2 3.78Å; R974-E983 PolarHBondContact NH1-OE2 3.26Å; R974-E983 IonicContact NH2-OE2 3.65Å; R974-E983 PolarHBondContact NH2-OE2 2.98Å; Q977-E983 WeakPolarHBondContact O-CB 3.49Å; Q977-E983 PolarHBondContact O-N 3.06Å; Q977-E983 VanDerWaalsContact O-N 3.09Å; L978-E983 HydrophobicContact CD2-CB 4.22Å; L978-E983 PolarHBondContact O-N 3.3Å; G981-E983 PolarHBondContact O-N 3.49Å; G981-E983 VanDerWaalsContact O-N 3.12Å; E983-C985 PolarHBondContact O-N 2.76Å; E983-K986 WeakPolarHBondContact O-CA 3.5Å; E983-K986 WeakPolarHBondContact O-CB 3.28Å; E983-K986 PolarHBondContact O-N 2.88Å; E983-R987 PolarHBondContact O-N 2.93Å; E983-R987 IonicContact OE2-CZ 3.65Å; E983-R987 IonicContact OE2-NE 3.55Å; E983-R987 PolarHBondContact OE2-NE 3Å; E983-R987 IonicContact OE2-NH2 3.84Å; E983-R987 PolarHBondContact OE2-NH2 3.34Å
984	A	85.6	Confident	86.1	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-60.4	-28.8	176.9	0	0	0	0	0	111.9	L978 A982 K986 R987 V988 L990 I993	L978-A984 HydrophobicContact CB-CB 4.26Å; L978-A984 HydrophobicContact CD2-CB 4.11Å; L978-A984 VanDerWaalsContact O-CB 3.27Å; L978-A984 WeakPolarHBondContact O-CB 3.49Å; L978-A984 PolarHBondContact O-N 2.94Å; A982-A984 PolarHBondContact O-N 2.8Å; A984-K986 PolarHBondContact O-N 3.06Å; A984-R987 PolarHBondContact O-N 3.07Å; A984-V988 WeakPolarHBondContact O-CB 3.39Å; A984-V988 PolarHBondContact O-N 3.49Å; A984-V988 VanDerWaalsContact O-O 3.07Å; A984-L990 HydrophobicContact CB-CD1 4.29Å; A984-I993 HydrophobicContact CB-CD1 4.06Å
985	C	84.7	Confident	86	Confident	44 Å²	44	65 Å²	65	30%	0.297	33%	0.331	S	S	.	.	H	α-helix	trans	-71.2	-7.7	173.8	-52.5	0	0	0	0	114.1	A982 E983 L990	A982-C985 WeakPolarHBondContact O-CB 3.46Å; A982-C985 PolarHBondContact O-N 2.68Å; E983-C985 PolarHBondContact O-N 2.76Å; C985-L990 VanDerWaalsContact CA-O 3.23Å; C985-L990 WeakPolarHBondContact CA-O 3.44Å; C985-L990 WeakPolarHBondContact CB-O 3.48Å; C985-L990 PolarHBondContact SG-O 3.49Å; C985-L990 VanDerWaalsContact SG-O 3.36Å
986	K	81.5	Confident	85.8	Confident	177 Å²	177	69.6 Å²	69.6	77%	0.77	35%	0.35	S	S	*	.	H	α-helix	trans	-107.7	-25	177.4	-58.4	177.3	-176.7	171.2	0	112.9	E983 A984	E983-K986 WeakPolarHBondContact O-CA 3.5Å; E983-K986 WeakPolarHBondContact O-CB 3.28Å; E983-K986 PolarHBondContact O-N 2.88Å; A984-K986 PolarHBondContact O-N 3.06Å
987	R	80	Confident	85.8	Confident	129 Å²	129	68 Å²	68	49%	0.487	34%	0.339	S	S	.	.	H	α-helix	trans	-101.7	-20.9	-178.8	-60	-166	-169.5	-145.9	2.8	113.7	D858 E983 A984	D858-R987 VanDerWaalsContact CG-NH1 3.28Å; D858-R987 VanDerWaalsContact OD1-CD 3.28Å; D858-R987 WeakPolarHBondContact OD1-CD 3.25Å; D858-R987 IonicContact OD1-CZ 3.33Å; D858-R987 IonicContact OD1-NE 3.2Å; D858-R987 IonicContact OD1-NH1 2.77Å; D858-R987 PolarHBondContact OD1-NH1 3.23Å; D858-R987 IonicContact OD2-CZ 2.66Å; D858-R987 IonicContact OD2-NH1 2.85Å; D858-R987 PolarHBondContact OD2-NH1 3.3Å; E983-R987 PolarHBondContact O-N 2.93Å; E983-R987 IonicContact OE2-CZ 3.65Å; E983-R987 IonicContact OE2-NE 3.55Å; E983-R987 PolarHBondContact OE2-NE 3Å; E983-R987 IonicContact OE2-NH2 3.84Å; E983-R987 PolarHBondContact OE2-NH2 3.34Å; A984-R987 PolarHBondContact O-N 3.07Å
988	V	77.7	Confident	85.9	Confident	21 Å²	21	64.2 Å²	64.2	13%	0.127	32%	0.322	C	S	.	.	S	Bend	trans	-132.3	153.9	-179.4	-176.7	0	0	0	0	108.1	R861 A984 L990	R861-V988 HydrophobicContact CG-CG1 3.95Å; A984-V988 WeakPolarHBondContact O-CB 3.39Å; A984-V988 PolarHBondContact O-N 3.49Å; A984-V988 VanDerWaalsContact O-O 3.07Å; V988-L990 HydrophobicContact CB-CD1 4.36Å; V988-L990 HydrophobicContact CG1-CD1 4.2Å; V988-L990 HydrophobicContact CG1-CG 4.15Å; V988-L990 PolarHBondContact O-N 3.15Å
989	D	74.8	Confident	86.1	Confident	149 Å²	149	64.2 Å²	64.2	80%	0.797	32%	0.321	S	S	*	.	S	Bend	trans	-68.7	31.7	-178	-49.7	-63	0	0	0	114.9	Q991	D989-Q991 PolarHBondContact O-N 3.3Å
990	L	77.6	Confident	86.3	Confident	36 Å²	36	64 Å²	64	19%	0.188	32%	0.32	C	S	.	.			trans	-85.3	100.2	176.7	-75.3	166.9	0	0	0	109.9	W862 A984 C985 V988 R992	W862-L990 HydrophobicContact CG-CD1 4.46Å; A984-L990 HydrophobicContact CB-CD1 4.29Å; C985-L990 VanDerWaalsContact CA-O 3.23Å; C985-L990 WeakPolarHBondContact CA-O 3.44Å; C985-L990 WeakPolarHBondContact CB-O 3.48Å; C985-L990 PolarHBondContact SG-O 3.49Å; C985-L990 VanDerWaalsContact SG-O 3.36Å; V988-L990 HydrophobicContact CB-CD1 4.36Å; V988-L990 HydrophobicContact CG1-CD1 4.2Å; V988-L990 HydrophobicContact CG1-CG 4.15Å; V988-L990 PolarHBondContact O-N 3.15Å; L990-R992 PolarHBondContact O-N 2.96Å
991	Q	79.2	Confident	86.6	Confident	196 Å²	196	61 Å²	61	92%	0.916	30%	0.304	S	S	*	.	S	Bend	trans	-55.1	-27.7	176.9	-65.9	179.9	-10.5	0	0	114.1	D989	D989-Q991 PolarHBondContact O-N 3.3Å
992	R	85.9	Confident	87.1	Confident	196 Å²	196	58.7 Å²	58.7	74%	0.74	28%	0.281	S	S	*	.	S	Bend	trans	-160.4	151.7	176.6	58.4	179.7	177.9	170.9	-2.1	111.9	L990 S994	L990-R992 PolarHBondContact O-N 2.96Å; R992-S994 PolarHBondContact O-N 3.43Å
993	I	87.7	Confident	87.6	Confident	37 Å²	37	57 Å²	57	19%	0.19	27%	0.266	C	S	.	.			trans	-70.9	117	165.4	-51.6	-57.4	0	0	0	108.2	V979 A982 A984 N997 L998	V979-I993 HydrophobicContact CG1-CG2 4.07Å; A982-I993 HydrophobicContact CB-CG1 4.22Å; A984-I993 HydrophobicContact CB-CD1 4.06Å; I993-N997 HydrophobicContact CG2-CB 3.98Å; I993-L998 HydrophobicContact CG2-CD2 4.19Å; I993-L998 HydrophobicContact CG2-CG 4.17Å
994	S	90.3	Very high	88.1	Confident	27 Å²	27	54.8 Å²	54.8	19%	0.189	26%	0.256	C	S	.	.			trans	-90.2	163.3	177.6	90.3	0	0	0	0	112.2	R992 K996 N997 L998	R992-S994 PolarHBondContact O-N 3.43Å; S994-K996 PolarHBondContact O-N 3.41Å; S994-K996 WeakPolarHBondContact OG-CB 3.39Å; S994-K996 PolarHBondContact OG-N 3.32Å; S994-K996 VanDerWaalsContact OG-N 3.12Å; S994-N997 WeakPolarHBondContact CB-OD1 3.29Å; S994-N997 PolarHBondContact N-OD1 3Å; S994-N997 WeakPolarHBondContact O-CA 3.35Å; S994-N997 WeakPolarHBondContact O-CB 3.38Å; S994-N997 PolarHBondContact O-N 3.02Å; S994-N997 PolarHBondContact OG-N 3.43Å; S994-N997 PolarHBondContact OG-OD1 3.2Å; S994-L998 PolarHBondContact O-N 3.39Å
995	A	91.2	Very high	88.6	Confident	11 Å²	11	54.9 Å²	54.9	9%	0.091	26%	0.256	C	S	.	.	H	α-helix	trans	-55.6	-31.2	170.3	0	0	0	0	0	113.4	L998 A999 L1077 L1080 L1113 T1117	A995-L998 PolarHBondContact O-N 2.68Å; A995-A999 WeakPolarHBondContact O-CB 3.46Å; A995-A999 PolarHBondContact O-N 3.38Å; A995-L1077 HydrophobicContact CB-CD2 4.33Å; A995-L1080 HydrophobicContact CB-CD1 4.16Å; A995-L1113 HydrophobicContact CB-CD1 3.38Å; A995-T1117 HydrophobicContact CB-CG2 4.38Å
996	K	91.5	Very high	89.2	Confident	98 Å²	98	54.3 Å²	54.3	43%	0.426	25%	0.249	S	C	.	.	H	α-helix	trans	-69.5	-35.1	174	-173.6	176.5	177.4	179.6	0	111.6	S994 A999 L1000	S994-K996 PolarHBondContact O-N 3.41Å; S994-K996 WeakPolarHBondContact OG-CB 3.39Å; S994-K996 PolarHBondContact OG-N 3.32Å; S994-K996 VanDerWaalsContact OG-N 3.12Å; K996-A999 PolarHBondContact O-N 2.92Å; K996-L1000 HydrophobicContact CG-CD1 4.19Å; K996-L1000 WeakPolarHBondContact O-CB 2.78Å; K996-L1000 VanDerWaalsContact O-CG 3.3Å; K996-L1000 WeakPolarHBondContact O-CG 3.32Å; K996-L1000 PolarHBondContact O-N 3.08Å
997	N	92.4	Very high	89.8	Confident	14 Å²	14	45.9 Å²	45.9	8%	0.075	21%	0.213	C	C	.	.	H	α-helix	trans	-65.8	-46	174.8	-54.7	37.6	0	0	0	109.9	W862 I993 S994 A999 L1000 T1001	W862-N997 HydrophobicContact CB-CB 4.15Å; I993-N997 HydrophobicContact CG2-CB 3.98Å; S994-N997 WeakPolarHBondContact CB-OD1 3.29Å; S994-N997 PolarHBondContact N-OD1 3Å; S994-N997 WeakPolarHBondContact O-CA 3.35Å; S994-N997 WeakPolarHBondContact O-CB 3.38Å; S994-N997 PolarHBondContact O-N 3.02Å; S994-N997 PolarHBondContact OG-N 3.43Å; S994-N997 PolarHBondContact OG-OD1 3.2Å; N997-A999 PolarHBondContact O-N 2.84Å; N997-L1000 PolarHBondContact O-N 2.8Å; N997-T1001 WeakPolarHBondContact O-CB 3.39Å; N997-T1001 PolarHBondContact O-N 3Å; N997-T1001 PolarHBondContact O-OG1 3.24Å
998	L	94.6	Very high	90.5	Very high	7 Å²	7	39.8 Å²	39.8	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-45.4	174.6	-68.7	173.3	0	0	0	111.5	V979 L980 I993 S994 A995 L1000 T1001 L1002 I1073 K1076 L1077 L1080	V979-L998 HydrophobicContact CG1-CD2 3.67Å; L980-L998 HydrophobicContact CD2-CD2 4.2Å; I993-L998 HydrophobicContact CG2-CD2 4.19Å; I993-L998 HydrophobicContact CG2-CG 4.17Å; S994-L998 PolarHBondContact O-N 3.39Å; A995-L998 PolarHBondContact O-N 2.68Å; L998-L1000 PolarHBondContact O-N 3.45Å; L998-T1001 WeakPolarHBondContact O-CB 3.37Å; L998-T1001 PolarHBondContact O-N 3.01Å; L998-L1002 WeakPolarHBondContact O-CB 3.43Å; L998-L1002 PolarHBondContact O-N 3.29Å; L998-I1073 HydrophobicContact CB-CG2 4.24Å; L998-I1073 HydrophobicContact CD2-CG2 4.3Å; L998-K1076 HydrophobicContact CD1-CG 4.32Å; L998-L1077 HydrophobicContact CB-CD1 4.4Å; L998-L1077 HydrophobicContact CB-CD2 3.77Å; L998-L1077 HydrophobicContact CB-CG 3.99Å; L998-L1077 HydrophobicContact CD1-CD2 4.02Å; L998-L1077 HydrophobicContact CD1-CG 4.27Å; L998-L1080 HydrophobicContact CD1-CD1 3.63Å
999	A	95.3	Very high	91.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-42.5	176.8	0	0	0	0	0	113.2	A995 K996 N997 L1002 R1003 T1117 V1120 L1121	A995-A999 WeakPolarHBondContact O-CB 3.46Å; A995-A999 PolarHBondContact O-N 3.38Å; K996-A999 PolarHBondContact O-N 2.92Å; N997-A999 PolarHBondContact O-N 2.84Å; A999-L1002 PolarHBondContact O-N 2.83Å; A999-R1003 PolarHBondContact O-N 2.91Å; A999-R1003 VanDerWaalsContact O-N 3.08Å; A999-T1117 HydrophobicContact CB-CG2 3.87Å; A999-V1120 HydrophobicContact CB-CB 4.19Å; A999-V1120 HydrophobicContact CB-CG1 3.87Å; A999-V1120 WeakPolarHBondContact O-CG1 3.47Å; A999-L1121 HydrophobicContact CB-CD1 4.01Å; A999-L1121 HydrophobicContact CB-CD2 3.87Å; A999-L1121 HydrophobicContact CB-CG 3.79Å
1000	L	95.1	Very high	92.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.2	-38.9	175.5	-74.1	167.5	0	0	0	111.5	W862 A864 T928 V930 K996 N997 L998 S1004 V1120	W862-L1000 VanDerWaalsContact O-CD1 3.25Å; W862-L1000 WeakPolarHBondContact O-CD1 3.25Å; A864-L1000 HydrophobicContact CB-CD2 3.95Å; T928-L1000 HydrophobicContact CG2-CD2 3.83Å; V930-L1000 HydrophobicContact CG1-CB 4.02Å; K996-L1000 HydrophobicContact CG-CD1 4.19Å; K996-L1000 WeakPolarHBondContact O-CB 2.78Å; K996-L1000 VanDerWaalsContact O-CG 3.3Å; K996-L1000 WeakPolarHBondContact O-CG 3.32Å; K996-L1000 PolarHBondContact O-N 3.08Å; N997-L1000 PolarHBondContact O-N 2.8Å; L998-L1000 PolarHBondContact O-N 3.45Å; L1000-S1004 WeakPolarHBondContact O-CB 3.37Å; L1000-S1004 PolarHBondContact O-N 3.25Å; L1000-S1004 PolarHBondContact O-OG 2.95Å; L1000-V1120 HydrophobicContact CD2-CG1 3.8Å; L1000-V1120 HydrophobicContact CD2-CG2 4.03Å; L1000-V1120 HydrophobicContact CG-CG1 4.08Å; L1000-V1120 HydrophobicContact CG-CG2 4.3Å
1001	T	95.6	Very high	92.8	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-61.3	-46.4	174.1	-49.2	0	0	0	0	110.7	W862 V975 V979 N997 L998 S1004 L1005 I1073	W862-T1001 HydrophobicContact CH2-CG2 4.49Å; W862-T1001 HydrophobicContact CZ3-CG2 3.95Å; W862-T1001 VanDerWaalsContact CZ3-OG1 3.27Å; W862-T1001 WeakPolarHBondContact CZ3-OG1 3.45Å; V975-T1001 HydrophobicContact CG1-CG2 3.48Å; V975-T1001 VanDerWaalsContact CG1-CG2 3.48Å; V979-T1001 HydrophobicContact CB-CG2 4.38Å; V979-T1001 HydrophobicContact CG1-CG2 4.25Å; V979-T1001 HydrophobicContact CG2-CG2 4Å; N997-T1001 WeakPolarHBondContact O-CB 3.39Å; N997-T1001 PolarHBondContact O-N 3Å; N997-T1001 PolarHBondContact O-OG1 3.24Å; L998-T1001 WeakPolarHBondContact O-CB 3.37Å; L998-T1001 PolarHBondContact O-N 3.01Å; T1001-S1004 WeakPolarHBondContact O-CB 3.15Å; T1001-S1004 PolarHBondContact O-N 3.07Å; T1001-L1005 HydrophobicContact CG2-CD1 4.22Å; T1001-L1005 WeakPolarHBondContact O-CG 3.28Å; T1001-L1005 PolarHBondContact O-N 2.87Å; T1001-I1073 HydrophobicContact CG2-CD1 3.62Å
1002	L	97	Very high	93.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.8	-50.1	178.9	177.4	57.9	0	0	0	112.3	L998 A999 S1004 L1005 Q1006 I1070 I1073 L1074 L1077 L1121 T1125	L998-L1002 WeakPolarHBondContact O-CB 3.43Å; L998-L1002 PolarHBondContact O-N 3.29Å; A999-L1002 PolarHBondContact O-N 2.83Å; L1002-S1004 VanDerWaalsContact C-N 3.32Å; L1002-S1004 PolarHBondContact O-N 2.9Å; L1002-L1005 PolarHBondContact O-N 3.41Å; L1002-Q1006 HydrophobicContact CD1-CG 4.33Å; L1002-Q1006 WeakPolarHBondContact O-CB 3.38Å; L1002-Q1006 VanDerWaalsContact O-CG 3.23Å; L1002-Q1006 WeakPolarHBondContact O-CG 3.42Å; L1002-Q1006 PolarHBondContact O-N 3.3Å; L1002-I1070 HydrophobicContact CD1-CB 4.33Å; L1002-I1070 HydrophobicContact CD1-CG1 4.36Å; L1002-I1070 HydrophobicContact CD1-CG2 3.78Å; L1002-I1073 HydrophobicContact CB-CG2 3.98Å; L1002-L1074 HydrophobicContact CD1-CD1 4.32Å; L1002-L1074 HydrophobicContact CD1-CD2 4.39Å; L1002-L1074 HydrophobicContact CD1-CG 3.95Å; L1002-L1074 HydrophobicContact CD2-CD2 3.52Å; L1002-L1074 HydrophobicContact CD2-CG 3.92Å; L1002-L1077 HydrophobicContact CD2-CD1 3.92Å; L1002-L1121 HydrophobicContact CB-CD2 4.5Å; L1002-L1121 HydrophobicContact CD2-CD1 4.49Å; L1002-L1121 HydrophobicContact CD2-CD2 3.81Å; L1002-L1121 HydrophobicContact CG-CD2 4.32Å; L1002-T1125 HydrophobicContact CD2-CG2 4.24Å
1003	R	95.4	Very high	93.5	Very high	5 Å²	5	18.9 Å²	18.9	2%	0.019	10%	0.099	C	C	.	.	H	α-helix	trans	-64.3	-36.8	174.7	-65.7	-57.7	-72.3	145	-7.4	112.5	E925 E926 Y927 T928 V929 A999 Q1006 L1007 V1120 L1121	E925-R1003 IonicContact OE2-NH2 3.74Å; E926-R1003 PolarHBondContact O-NH2 2.98Å; Y927-R1003 VanDerWaalsContact CD1-CZ 3.4Å; Y927-R1003 VanDerWaalsContact CD1-NH2 3.33Å; Y927-R1003 VanDerWaalsContact CE1-CZ 3.41Å; Y927-R1003 VanDerWaalsContact CE1-NH2 3.34Å; T928-R1003 WeakPolarHBondContact O-CB 3.39Å; V929-R1003 HydrophobicContact CG1-CB 4.4Å; A999-R1003 PolarHBondContact O-N 2.91Å; A999-R1003 VanDerWaalsContact O-N 3.08Å; R1003-Q1006 PolarHBondContact O-N 3.05Å; R1003-L1007 WeakPolarHBondContact O-CB 3.18Å; R1003-L1007 PolarHBondContact O-N 3.16Å; R1003-V1120 WeakPolarHBondContact CD-O 3.44Å; R1003-V1120 HydrophobicContact CG-CG1 3.83Å; R1003-V1120 WeakPolarHBondContact CG-O 3.17Å; R1003-L1121 HydrophobicContact CG-CD2 4.09Å
1004	S	96	Very high	93.5	Very high	3 Å²	3	17.8 Å²	17.8	2%	0.021	10%	0.095	C	C	.	.	H	α-helix	trans	-63.1	-43.3	178.9	-63.3	0	0	0	0	111.9	V929 V930 L1000 T1001 L1002 V1008	V929-S1004 WeakPolarHBondContact CB-OG 3.45Å; V930-S1004 PolarHBondContact N-OG 3.14Å; L1000-S1004 WeakPolarHBondContact O-CB 3.37Å; L1000-S1004 PolarHBondContact O-N 3.25Å; L1000-S1004 PolarHBondContact O-OG 2.95Å; T1001-S1004 WeakPolarHBondContact O-CB 3.15Å; T1001-S1004 PolarHBondContact O-N 3.07Å; L1002-S1004 VanDerWaalsContact C-N 3.32Å; L1002-S1004 PolarHBondContact O-N 2.9Å; S1004-V1008 WeakPolarHBondContact O-CG2 3.33Å; S1004-V1008 PolarHBondContact O-N 3.12Å
1005	L	97.1	Very high	93.5	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-69	-43.1	174	-66.5	169.7	0	0	0	112	F971 V975 T1001 L1002 L1007 V1008 V1009 F1066 H1069 I1070 I1073	F971-L1005 HydrophobicContact CE1-CD2 3.99Å; V975-L1005 HydrophobicContact CG1-CD2 4.5Å; T1001-L1005 HydrophobicContact CG2-CD1 4.22Å; T1001-L1005 WeakPolarHBondContact O-CG 3.28Å; T1001-L1005 PolarHBondContact O-N 2.87Å; L1002-L1005 PolarHBondContact O-N 3.41Å; L1005-L1007 VanDerWaalsContact C-N 3.3Å; L1005-L1007 PolarHBondContact O-N 2.89Å; L1005-V1008 PolarHBondContact O-N 3.49Å; L1005-V1009 WeakPolarHBondContact O-CG2 3.25Å; L1005-V1009 PolarHBondContact O-N 3.39Å; L1005-F1066 HydrophobicContact CB-CD1 4.36Å; L1005-F1066 HydrophobicContact CD2-CD1 3.7Å; L1005-F1066 HydrophobicContact CD2-CE1 3.8Å; L1005-H1069 HydrophobicContact CD1-CB 4.49Å; L1005-I1070 HydrophobicContact CB-CD1 3.97Å; L1005-I1070 HydrophobicContact CB-CG1 3.7Å; L1005-I1070 HydrophobicContact CD1-CG1 4.23Å; L1005-I1073 HydrophobicContact CD1-CD1 3.41Å; L1005-I1073 VanDerWaalsContact CD1-CD1 3.41Å
1006	Q	96.3	Very high	93.4	Very high	33 Å²	33	17.9 Å²	17.9	15%	0.154	9%	0.09	C	C	.	.	H	α-helix	trans	-59.8	-38.9	177.9	-74.9	172.1	-15.2	0	0	112.4	Y927 L1002 R1003 V1009 Q1010 I1070	Y927-Q1006 HydrophobicContact CE1-CB 4.08Å; L1002-Q1006 HydrophobicContact CD1-CG 4.33Å; L1002-Q1006 WeakPolarHBondContact O-CB 3.38Å; L1002-Q1006 VanDerWaalsContact O-CG 3.23Å; L1002-Q1006 WeakPolarHBondContact O-CG 3.42Å; L1002-Q1006 PolarHBondContact O-N 3.3Å; R1003-Q1006 PolarHBondContact O-N 3.05Å; Q1006-V1009 PolarHBondContact O-N 2.98Å; Q1006-Q1010 WeakPolarHBondContact O-CG 3.48Å; Q1006-Q1010 PolarHBondContact O-N 3.14Å; Q1006-I1070 HydrophobicContact CG-CD1 3.9Å; Q1006-I1070 HydrophobicContact CG-CG1 4.34Å; Q1006-I1070 HydrophobicContact CG-CG2 4.48Å
1007	L	95.1	Very high	93.2	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-62.6	-45	175.5	-177.8	56.2	0	0	0	111.7	I920 L922 Y927 V929 V933 L937 R1003 L1005 Q1010 F1011	I920-L1007 HydrophobicContact CB-CD2 4.02Å; I920-L1007 HydrophobicContact CD1-CD2 3.64Å; I920-L1007 HydrophobicContact CG1-CD2 4.39Å; I920-L1007 HydrophobicContact CG2-CD1 4.17Å; I920-L1007 HydrophobicContact CG2-CD2 4.04Å; L922-L1007 HydrophobicContact CB-CD1 4.23Å; L922-L1007 HydrophobicContact CD2-CD1 3.7Å; Y927-L1007 HydrophobicContact CD1-CB 3.59Å; Y927-L1007 HydrophobicContact CD1-CD1 4.03Å; Y927-L1007 HydrophobicContact CD1-CG 4.3Å; Y927-L1007 HydrophobicContact CD2-CD1 4.11Å; Y927-L1007 HydrophobicContact CE1-CB 4.15Å; Y927-L1007 HydrophobicContact CE1-CD1 4.48Å; Y927-L1007 HydrophobicContact CG-CB 4.14Å; Y927-L1007 HydrophobicContact CG-CD1 3.85Å; Y927-L1007 HydrophobicContact CG-CG 4.39Å; V929-L1007 HydrophobicContact CG1-CB 4.28Å; V929-L1007 HydrophobicContact CG1-CD2 3.81Å; V929-L1007 HydrophobicContact CG2-CD2 4.25Å; V933-L1007 HydrophobicContact CG1-CD2 4.07Å; L937-L1007 HydrophobicContact CD1-CD2 3.77Å; L937-L1007 HydrophobicContact CD1-CG 4.21Å; R1003-L1007 WeakPolarHBondContact O-CB 3.18Å; R1003-L1007 PolarHBondContact O-N 3.16Å; L1005-L1007 VanDerWaalsContact C-N 3.3Å; L1005-L1007 PolarHBondContact O-N 2.89Å; L1007-Q1010 PolarHBondContact O-N 3.38Å; L1007-F1011 PolarHBondContact O-N 3.2Å; L1007-F1011 VanDerWaalsContact O-N 3.1Å
1008	V	95.4	Very high	93	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.7	-44.9	177.9	176.8	0	0	0	0	110.5	V933 L936 L968 F971 S1004 L1005 Q1010 F1011 L1012 F1066	V933-V1008 HydrophobicContact CG1-CG2 4.16Å; V933-V1008 HydrophobicContact CG2-CG2 4.4Å; L936-V1008 HydrophobicContact CD2-CG2 4.26Å; L968-V1008 HydrophobicContact CD2-CG1 3.95Å; F971-V1008 HydrophobicContact CE1-CG2 4.36Å; S1004-V1008 WeakPolarHBondContact O-CG2 3.33Å; S1004-V1008 PolarHBondContact O-N 3.12Å; L1005-V1008 PolarHBondContact O-N 3.49Å; V1008-Q1010 PolarHBondContact O-N 3.17Å; V1008-F1011 WeakPolarHBondContact O-CB 3.17Å; V1008-F1011 PolarHBondContact O-N 3.36Å; V1008-L1012 HydrophobicContact CG1-CD2 4.37Å; V1008-L1012 WeakPolarHBondContact O-CG 3.33Å; V1008-L1012 PolarHBondContact O-N 3.15Å; V1008-L1012 VanDerWaalsContact O-N 3.09Å; V1008-F1066 HydrophobicContact CB-CD1 4.32Å; V1008-F1066 HydrophobicContact CB-CE1 3.73Å; V1008-F1066 HydrophobicContact CG1-CD1 4.22Å; V1008-F1066 HydrophobicContact CG1-CE1 3.43Å; V1008-F1066 VanDerWaalsContact CG1-CE1 3.43Å; V1008-F1066 HydrophobicContact CG1-CZ 3.75Å; V1008-F1066 HydrophobicContact CG2-CE1 4.42Å
1009	V	94.8	Very high	92.7	Very high	14 Å²	14	15.4 Å²	15.4	9%	0.085	8%	0.079	C	C	.	.	H	α-helix	trans	-57.7	-44.5	175.7	172	0	0	0	0	111.9	L1005 Q1006 F1011 L1012 P1013 E1063 F1066 I1070	L1005-V1009 WeakPolarHBondContact O-CG2 3.25Å; L1005-V1009 PolarHBondContact O-N 3.39Å; Q1006-V1009 PolarHBondContact O-N 2.98Å; V1009-F1011 PolarHBondContact O-N 3.07Å; V1009-L1012 PolarHBondContact O-N 2.86Å; V1009-P1013 VanDerWaalsContact O-CD 3.23Å; V1009-P1013 WeakPolarHBondContact O-CD 3.44Å; V1009-E1063 HydrophobicContact CG1-CG 4.42Å; V1009-F1066 HydrophobicContact CG2-CB 3.4Å; V1009-F1066 VanDerWaalsContact CG2-CB 3.4Å; V1009-F1066 HydrophobicContact CG2-CD1 3.99Å; V1009-F1066 HydrophobicContact CG2-CG 4.03Å; V1009-I1070 HydrophobicContact CG2-CD1 3.87Å
1010	Q	91.6	Very high	92.2	Very high	82 Å²	82	17.8 Å²	17.8	38%	0.383	9%	0.092	S	C	.	.	H	α-helix	trans	-65.4	-23.1	176.5	-72.6	-69.6	-33	0	0	113.5	L922 N923 Q1006 L1007 V1008	L922-Q1010 HydrophobicContact CD2-CB 3.85Å; N923-Q1010 PolarHBondContact ND2-OE1 3.46Å; Q1006-Q1010 WeakPolarHBondContact O-CG 3.48Å; Q1006-Q1010 PolarHBondContact O-N 3.14Å; L1007-Q1010 PolarHBondContact O-N 3.38Å; V1008-Q1010 PolarHBondContact O-N 3.17Å
1011	F	90.9	Very high	91.7	Very high	3 Å²	3	21 Å²	21	1%	0.013	10%	0.104	C	C	.	.	H	α-helix	trans	-85	-28.4	178.3	-160.6	-121.6	0	0	0	113.1	I875 I878 L937 I940 L1007 V1008 V1009 C1014 I1015	I875-F1011 HydrophobicContact CG1-CE2 4.32Å; I878-F1011 HydrophobicContact CD1-CE2 4.22Å; I878-F1011 HydrophobicContact CD1-CZ 3.8Å; I878-F1011 HydrophobicContact CG2-CE2 4.22Å; L937-F1011 HydrophobicContact CD2-CB 4.09Å; L937-F1011 HydrophobicContact CD2-CD1 3.38Å; L937-F1011 HydrophobicContact CD2-CD2 4.35Å; L937-F1011 HydrophobicContact CD2-CE1 3.75Å; L937-F1011 HydrophobicContact CD2-CG 3.71Å; L937-F1011 HydrophobicContact CD2-CZ 4.39Å; I940-F1011 HydrophobicContact CB-CE1 4.37Å; I940-F1011 HydrophobicContact CG2-CD1 4.24Å; I940-F1011 HydrophobicContact CG2-CE1 4.02Å; L1007-F1011 PolarHBondContact O-N 3.2Å; L1007-F1011 VanDerWaalsContact O-N 3.1Å; V1008-F1011 WeakPolarHBondContact O-CB 3.17Å; V1008-F1011 PolarHBondContact O-N 3.36Å; V1009-F1011 PolarHBondContact O-N 3.07Å; F1011-C1014 WeakPolarHBondContact O-CB 3.46Å; F1011-C1014 PolarHBondContact O-N 2.92Å; F1011-I1015 HydrophobicContact CD1-CD1 4.22Å; F1011-I1015 HydrophobicContact CD1-CG1 3.78Å; F1011-I1015 HydrophobicContact CE1-CD1 3.63Å; F1011-I1015 HydrophobicContact CE1-CG1 3.74Å; F1011-I1015 HydrophobicContact CG-CG1 4.47Å; F1011-I1015 HydrophobicContact CZ-CD1 3.95Å; F1011-I1015 HydrophobicContact CZ-CG1 4.36Å; F1011-I1015 PolarHBondContact O-N 3.28Å
1012	L	91.2	Very high	91.1	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-54.5	-44.8	-177.8	-61.9	-177.1	0	0	0	114.1	L968 V1008 V1009 C1014 I1015 Q1016 E1063	L968-L1012 HydrophobicContact CD1-CD2 3.57Å; L968-L1012 HydrophobicContact CD2-CD2 4.32Å; V1008-L1012 HydrophobicContact CG1-CD2 4.37Å; V1008-L1012 WeakPolarHBondContact O-CG 3.33Å; V1008-L1012 PolarHBondContact O-N 3.15Å; V1008-L1012 VanDerWaalsContact O-N 3.09Å; V1009-L1012 PolarHBondContact O-N 2.86Å; L1012-C1014 PolarHBondContact O-N 3.33Å; L1012-I1015 PolarHBondContact O-N 2.95Å; L1012-Q1016 WeakPolarHBondContact O-CB 3.42Å; L1012-Q1016 WeakPolarHBondContact O-CG 3.48Å; L1012-Q1016 PolarHBondContact O-N 2.77Å; L1012-E1063 HydrophobicContact CD1-CB 3.9Å; L1012-E1063 HydrophobicContact CD1-CG 4.43Å
1013	P	88	Confident	90.3	Very high	59 Å²	59	22.8 Å²	22.8	38%	0.383	12%	0.115	S	C	.	.	H	α-helix	trans	-63.7	-27.2	178.8	-24.4	35.5	0	0	0	113.8	V1009 F1017	V1009-P1013 VanDerWaalsContact O-CD 3.23Å; V1009-P1013 WeakPolarHBondContact O-CD 3.44Å; P1013-F1017 WeakPolarHBondContact O-CB 3.43Å; P1013-F1017 PolarHBondContact O-N 2.91Å; P1013-F1017 VanDerWaalsContact O-N 3.12Å
1014	C	89.2	Confident	89.3	Confident	15 Å²	15	28.7 Å²	28.7	10%	0.101	14%	0.141	C	C	.	.	H	α-helix	trans	-71.2	-44	175.7	-59.5	0	0	0	0	110.4	I878 V882 F1011 L1012 F1017 L1018	I878-C1014 HydrophobicContact CG2-CB 3.89Å; V882-C1014 HydrophobicContact CG2-CB 4.13Å; F1011-C1014 WeakPolarHBondContact O-CB 3.46Å; F1011-C1014 PolarHBondContact O-N 2.92Å; L1012-C1014 PolarHBondContact O-N 3.33Å; C1014-F1017 WeakPolarHBondContact O-CB 3.23Å; C1014-F1017 PolarHBondContact O-N 3.46Å; C1014-L1018 WeakPolarHBondContact O-CG 3.49Å; C1014-L1018 PolarHBondContact O-N 3.46Å
1015	I	89.5	Confident	88.1	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-70.5	-41.8	179.5	-59.7	-65.5	0	0	0	111.7	I940 V944 L964 F1011 L1012 F1017 L1018 L1019	I940-I1015 HydrophobicContact CG2-CB 4.41Å; I940-I1015 HydrophobicContact CG2-CD1 3.83Å; I940-I1015 HydrophobicContact CG2-CG1 3.64Å; I940-I1015 HydrophobicContact CG2-CG2 4.1Å; V944-I1015 HydrophobicContact CG2-CD1 3.91Å; V944-I1015 HydrophobicContact CG2-CG2 3.87Å; L964-I1015 HydrophobicContact CD2-CG2 3.64Å; F1011-I1015 HydrophobicContact CD1-CD1 4.22Å; F1011-I1015 HydrophobicContact CD1-CG1 3.78Å; F1011-I1015 HydrophobicContact CE1-CD1 3.63Å; F1011-I1015 HydrophobicContact CE1-CG1 3.74Å; F1011-I1015 HydrophobicContact CG-CG1 4.47Å; F1011-I1015 HydrophobicContact CZ-CD1 3.95Å; F1011-I1015 HydrophobicContact CZ-CG1 4.36Å; F1011-I1015 PolarHBondContact O-N 3.28Å; L1012-I1015 PolarHBondContact O-N 2.95Å; I1015-F1017 PolarHBondContact O-N 3.4Å; I1015-L1018 PolarHBondContact O-N 3.45Å; I1015-L1019 HydrophobicContact CG2-CD1 4.12Å; I1015-L1019 HydrophobicContact CG2-CG 4.5Å; I1015-L1019 WeakPolarHBondContact O-CG 3.29Å; I1015-L1019 PolarHBondContact O-N 2.78Å
1016	Q	89.3	Confident	86.6	Confident	39 Å²	39	32.7 Å²	32.7	18%	0.182	16%	0.164	C	C	.	.	H	α-helix	trans	-54.6	-41.7	169.4	-73	174.6	7.6	0	0	111.3	L1012 N1020 L1059	L1012-Q1016 WeakPolarHBondContact O-CB 3.42Å; L1012-Q1016 WeakPolarHBondContact O-CG 3.48Å; L1012-Q1016 PolarHBondContact O-N 2.77Å; Q1016-N1020 WeakPolarHBondContact O-CB 3.29Å; Q1016-N1020 PolarHBondContact O-N 3.38Å; Q1016-N1020 VanDerWaalsContact O-N 3.08Å; Q1016-N1020 PolarHBondContact O-ND2 3Å; Q1016-L1059 HydrophobicContact CG-CB 4.05Å; Q1016-L1059 HydrophobicContact CG-CD2 3.76Å
1017	F	87.3	Confident	84.9	Confident	60 Å²	60	35 Å²	35	26%	0.263	17%	0.173	S	C	.	.	H	α-helix	trans	-65.6	-45	178	-175.7	-87.5	0	0	0	112.5	V882 C885 K886 P1013 C1014 I1015 N1020 R1021	V882-F1017 HydrophobicContact CB-CD1 4.31Å; V882-F1017 HydrophobicContact CG1-CB 4.49Å; V882-F1017 HydrophobicContact CG1-CD1 4.2Å; V882-F1017 HydrophobicContact CG1-CG 4.2Å; V882-F1017 HydrophobicContact CG2-CB 4.36Å; V882-F1017 HydrophobicContact CG2-CD1 3.83Å; V882-F1017 HydrophobicContact CG2-CG 4.33Å; C885-F1017 HydrophobicContact CB-CE1 3.49Å; C885-F1017 VanDerWaalsContact CB-CE1 3.49Å; C885-F1017 HydrophobicContact CB-CZ 3.46Å; C885-F1017 VanDerWaalsContact CB-CZ 3.46Å; K886-F1017 HydrophobicContact CG-CE2 4.22Å; P1013-F1017 WeakPolarHBondContact O-CB 3.43Å; P1013-F1017 PolarHBondContact O-N 2.91Å; P1013-F1017 VanDerWaalsContact O-N 3.12Å; C1014-F1017 WeakPolarHBondContact O-CB 3.23Å; C1014-F1017 PolarHBondContact O-N 3.46Å; I1015-F1017 PolarHBondContact O-N 3.4Å; F1017-N1020 PolarHBondContact O-N 3.19Å; F1017-R1021 WeakPolarHBondContact O-CB 3.23Å; F1017-R1021 PolarHBondContact O-N 2.97Å
1018	L	88.6	Confident	83.2	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-64.4	-45.2	-179.9	-67	177.7	0	0	0	112.4	I878 E881 V882 V944 C1014 I1015 R1021 I1022	I878-L1018 HydrophobicContact CG1-CD1 4.26Å; I878-L1018 HydrophobicContact CG2-CD1 4.07Å; E881-L1018 HydrophobicContact CG-CD2 4.18Å; E881-L1018 VanDerWaalsContact OE2-CD2 3.22Å; E881-L1018 WeakPolarHBondContact OE2-CD2 3.48Å; V882-L1018 HydrophobicContact CG2-CD2 4.42Å; V944-L1018 HydrophobicContact CG1-CB 3.79Å; V944-L1018 HydrophobicContact CG1-CD1 4.18Å; C1014-L1018 WeakPolarHBondContact O-CG 3.49Å; C1014-L1018 PolarHBondContact O-N 3.46Å; I1015-L1018 PolarHBondContact O-N 3.45Å; L1018-R1021 WeakPolarHBondContact O-CB 3.48Å; L1018-R1021 PolarHBondContact O-N 2.96Å; L1018-R1021 VanDerWaalsContact O-N 3.12Å; L1018-I1022 WeakPolarHBondContact O-CG1 3.47Å; L1018-I1022 PolarHBondContact O-N 2.82Å
1019	L	88.8	Confident	81.7	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-46.7	175.5	-67.3	172.9	0	0	0	111.4	V944 D947 T957 V960 L964 I1015 R1021 I1022 S1023	V944-L1019 HydrophobicContact CG2-CD2 4.28Å; V944-L1019 HydrophobicContact CG2-CG 4.41Å; D947-L1019 HydrophobicContact CB-CD2 4.17Å; T957-L1019 HydrophobicContact CG2-CB 3.83Å; T957-L1019 HydrophobicContact CG2-CD2 4.3Å; V960-L1019 HydrophobicContact CG1-CD2 4.37Å; L964-L1019 HydrophobicContact CD2-CD1 4.27Å; I1015-L1019 HydrophobicContact CG2-CD1 4.12Å; I1015-L1019 HydrophobicContact CG2-CG 4.5Å; I1015-L1019 WeakPolarHBondContact O-CG 3.29Å; I1015-L1019 PolarHBondContact O-N 2.78Å; L1019-R1021 PolarHBondContact O-N 3.38Å; L1019-I1022 PolarHBondContact O-N 3.11Å; L1019-S1023 PolarHBondContact O-N 2.83Å; L1019-S1023 VanDerWaalsContact O-N 3.13Å
1020	N	85.1	Confident	79.7	Confident	51 Å²	51	47.4 Å²	47.4	27%	0.273	24%	0.235	S	C	.	.	H	α-helix	trans	-60.5	-30.6	174.1	-86.8	-78.5	0	0	0	113.2	Q1016 F1017 K1024 L1056	Q1016-N1020 WeakPolarHBondContact O-CB 3.29Å; Q1016-N1020 PolarHBondContact O-N 3.38Å; Q1016-N1020 VanDerWaalsContact O-N 3.08Å; Q1016-N1020 PolarHBondContact O-ND2 3Å; F1017-N1020 PolarHBondContact O-N 3.19Å; N1020-K1024 VanDerWaalsContact O-CG 3.3Å; N1020-K1024 WeakPolarHBondContact O-CG 3.36Å; N1020-K1024 PolarHBondContact O-N 3.38Å; N1020-L1056 VanDerWaalsContact ND2-CD1 3.29Å; N1020-L1056 WeakPolarHBondContact ND2-CD1 3.23Å
1021	R	84	Confident	77.8	Confident	66 Å²	66	45.9 Å²	45.9	25%	0.249	23%	0.233	C	C	.	.	H	α-helix	trans	-71.1	-49.2	175.1	-173.4	-171.8	69.8	171.9	-0.8	111.1	E881 F1017 L1018 L1019 S1023 K1024 T1025	E881-R1021 VanDerWaalsContact CG-NH1 3.33Å; E881-R1021 IonicContact OE1-CZ 3.16Å; E881-R1021 IonicContact OE1-NH1 2.74Å; E881-R1021 PolarHBondContact OE1-NH1 3.27Å; E881-R1021 IonicContact OE1-NH2 2.63Å; E881-R1021 PolarHBondContact OE1-NH2 2.92Å; E881-R1021 IonicContact OE2-NH2 2.87Å; F1017-R1021 WeakPolarHBondContact O-CB 3.23Å; F1017-R1021 PolarHBondContact O-N 2.97Å; L1018-R1021 WeakPolarHBondContact O-CB 3.48Å; L1018-R1021 PolarHBondContact O-N 2.96Å; L1018-R1021 VanDerWaalsContact O-N 3.12Å; L1019-R1021 PolarHBondContact O-N 3.38Å; R1021-S1023 PolarHBondContact O-N 3.23Å; R1021-K1024 PolarHBondContact O-N 3Å; R1021-K1024 VanDerWaalsContact O-N 3.16Å; R1021-T1025 HydrophobicContact CG-CG2 4.08Å; R1021-T1025 WeakPolarHBondContact O-CG2 3.43Å; R1021-T1025 PolarHBondContact O-N 3.09Å; R1021-T1025 PolarHBondContact O-OG1 3.46Å
1022	I	82.6	Confident	75.9	Confident	12 Å²	12	48.4 Å²	48.4	6%	0.062	25%	0.251	C	S	.	.	H	α-helix	trans	-54.9	-53.6	-179.3	-68.2	163.9	0	0	0	109.8	V944 D947 E948 Q953 L1018 L1019 K1024 T1025 E1026	V944-I1022 HydrophobicContact CG1-CD1 3.68Å; D947-I1022 HydrophobicContact CB-CD1 4.35Å; D947-I1022 WeakPolarHBondContact OD2-CG2 3.37Å; E948-I1022 HydrophobicContact CB-CD1 4.17Å; Q953-I1022 HydrophobicContact CG-CG2 4.16Å; L1018-I1022 WeakPolarHBondContact O-CG1 3.47Å; L1018-I1022 PolarHBondContact O-N 2.82Å; L1019-I1022 PolarHBondContact O-N 3.11Å; I1022-K1024 PolarHBondContact O-N 3.25Å; I1022-T1025 WeakPolarHBondContact CA-OG1 3.3Å; I1022-T1025 PolarHBondContact O-N 3.01Å; I1022-T1025 PolarHBondContact O-OG1 3Å; I1022-E1026 PolarHBondContact O-N 3.19Å
1023	S	80.3	Confident	74.3	Confident	27 Å²	27	55.3 Å²	55.3	19%	0.189	29%	0.293	C	S	.	.	H	α-helix	trans	-47.9	-50.1	174	169.8	0	0	0	0	113.3	P954 L1019 R1021 F1027	P954-S1023 WeakPolarHBondContact CB-OG 3.36Å; L1019-S1023 PolarHBondContact O-N 2.83Å; L1019-S1023 VanDerWaalsContact O-N 3.13Å; R1021-S1023 PolarHBondContact O-N 3.23Å; S1023-F1027 PolarHBondContact O-N 2.92Å
1024	K	74.4	Confident	73.4	Confident	130 Å²	130	55.9 Å²	55.9	57%	0.565	29%	0.293	S	S	*	.	H	α-helix	trans	-70.4	-32	177.9	-71.1	175.2	-177.4	-177.2	0	113.8	N1020 R1021 I1022 N1028	N1020-K1024 VanDerWaalsContact O-CG 3.3Å; N1020-K1024 WeakPolarHBondContact O-CG 3.36Å; N1020-K1024 PolarHBondContact O-N 3.38Å; R1021-K1024 PolarHBondContact O-N 3Å; R1021-K1024 VanDerWaalsContact O-N 3.16Å; I1022-K1024 PolarHBondContact O-N 3.25Å; K1024-N1028 PolarHBondContact O-N 3.03Å; K1024-N1028 VanDerWaalsContact O-N 3.13Å
1025	T	71.7	Confident	72.6	Confident	59 Å²	59	57.9 Å²	57.9	36%	0.362	31%	0.305	S	S	.	.	H	α-helix	trans	-74.4	-33.2	-177.1	51.4	0	0	0	0	113.7	R1021 I1022 K1029	R1021-T1025 HydrophobicContact CG-CG2 4.08Å; R1021-T1025 WeakPolarHBondContact O-CG2 3.43Å; R1021-T1025 PolarHBondContact O-N 3.09Å; R1021-T1025 PolarHBondContact O-OG1 3.46Å; I1022-T1025 WeakPolarHBondContact CA-OG1 3.3Å; I1022-T1025 PolarHBondContact O-N 3.01Å; I1022-T1025 PolarHBondContact O-OG1 3Å; T1025-K1029 WeakPolarHBondContact O-CG 3.19Å
1026	E	65.1	Low	71.8	Confident	29 Å²	29	59.3 Å²	59.3	14%	0.136	31%	0.313	C	S	.	.	H	α-helix	trans	-72.2	-42.1	171	-70.7	-65.8	97.6	0	0	110.8	R732 Q953 I1022 N1028 K1029 V1030	R732-E1026 IonicContact CZ-OE2 2.72Å; R732-E1026 VanDerWaalsContact CZ-OE2 3.31Å; R732-E1026 IonicContact NH1-OE2 2.69Å; R732-E1026 PolarHBondContact NH1-OE2 3.38Å; R732-E1026 IonicContact NH2-OE2 3.09Å; R732-E1026 PolarHBondContact NH2-OE2 3.32Å; Q953-E1026 HydrophobicContact CB-CB 4.03Å; Q953-E1026 HydrophobicContact CB-CG 4.27Å; Q953-E1026 HydrophobicContact CG-CG 4.27Å; I1022-E1026 PolarHBondContact O-N 3.19Å; E1026-N1028 VanDerWaalsContact C-N 3.32Å; E1026-N1028 PolarHBondContact O-N 3.42Å; E1026-K1029 WeakPolarHBondContact O-CB 3.21Å; E1026-K1029 PolarHBondContact O-N 3.19Å; E1026-K1029 VanDerWaalsContact OE1-CD 3.3Å; E1026-K1029 WeakPolarHBondContact OE1-CD 3.36Å; E1026-K1029 WeakPolarHBondContact OE1-CE 3.48Å; E1026-K1029 IonicContact OE1-NZ 3.11Å; E1026-K1029 PolarHBondContact OE1-NZ 3.31Å; E1026-V1030 WeakPolarHBondContact O-CG2 3.47Å; E1026-V1030 PolarHBondContact O-N 3.01Å
1027	F	59.9	Low	70.9	Confident	81 Å²	81	59.7 Å²	59.7	36%	0.355	32%	0.316	S	S	.	.	H	α-helix	trans	-51.9	-49.2	175.7	-179.2	-113.5	0	0	0	112.5	S1023 K1029 V1030 S1031 H1045	S1023-F1027 PolarHBondContact O-N 2.92Å; F1027-K1029 VanDerWaalsContact C-N 3.26Å; F1027-K1029 PolarHBondContact O-N 3.31Å; F1027-V1030 PolarHBondContact O-N 3.31Å; F1027-S1031 PolarHBondContact O-N 3.44Å; F1027-S1031 PolarHBondContact O-OG 3.03Å; F1027-H1045 AromaticContact CD2-CE1 3.35Å; F1027-H1045 WeakPolarHBondContact CD2-CE1 3.44Å; F1027-H1045 AromaticContact CD2-NE2 3.28Å; F1027-H1045 VanDerWaalsContact CD2-NE2 3.28Å; F1027-H1045 WeakPolarHBondContact CD2-NE2 3.35Å; F1027-H1045 AromaticContact CE2-CE1 3.57Å; F1027-H1045 AromaticContact CE2-NE2 3.38Å; F1027-H1045 WeakPolarHBondContact CE2-NE2 3.27Å
1028	N	60.5	Low	70	Confident	112 Å²	112	59.2 Å²	59.2	60%	0.599	31%	0.314	S	S	*	.	H	α-helix	trans	-69	-16.2	180	-71.7	-3.2	0	0	0	114.5	K1024 E1026	K1024-N1028 PolarHBondContact O-N 3.03Å; K1024-N1028 VanDerWaalsContact O-N 3.13Å; E1026-N1028 VanDerWaalsContact C-N 3.32Å; E1026-N1028 PolarHBondContact O-N 3.42Å
1029	K	63	Low	69.3	Low	125 Å²	125	59.1 Å²	59.1	54%	0.543	31%	0.313	S	S	.	.	H	α-helix	trans	-79.2	-38.6	171.6	-69.1	167.5	-166	174.2	0	110.9	T1025 E1026 F1027 S1032	T1025-K1029 WeakPolarHBondContact O-CG 3.19Å; E1026-K1029 WeakPolarHBondContact O-CB 3.21Å; E1026-K1029 PolarHBondContact O-N 3.19Å; E1026-K1029 VanDerWaalsContact OE1-CD 3.3Å; E1026-K1029 WeakPolarHBondContact OE1-CD 3.36Å; E1026-K1029 WeakPolarHBondContact OE1-CE 3.48Å; E1026-K1029 IonicContact OE1-NZ 3.11Å; E1026-K1029 PolarHBondContact OE1-NZ 3.31Å; F1027-K1029 VanDerWaalsContact C-N 3.26Å; F1027-K1029 PolarHBondContact O-N 3.31Å; K1029-S1032 PolarHBondContact O-OG 3.11Å
1030	V	53.8	Low	68.6	Low	37 Å²	37	60.9 Å²	60.9	22%	0.224	32%	0.322	C	S	.	.	H	α-helix	trans	-84.4	-23.1	-170.2	-173.8	0	0	0	0	112.7	E1026 F1027 S1032 N1037 A1041	E1026-V1030 WeakPolarHBondContact O-CG2 3.47Å; E1026-V1030 PolarHBondContact O-N 3.01Å; F1027-V1030 PolarHBondContact O-N 3.31Å; V1030-S1032 PolarHBondContact O-N 2.83Å; V1030-N1037 HydrophobicContact CG1-CB 4.03Å; V1030-N1037 WeakPolarHBondContact CG1-O 3.44Å; V1030-N1037 WeakPolarHBondContact O-CB 3.38Å; V1030-A1041 HydrophobicContact CB-CB 4.48Å; V1030-A1041 HydrophobicContact CG1-CB 3.75Å
1031	S	51.2	Low	67.9	Low	50 Å²	50	59 Å²	59	35%	0.35	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	9.3	172.9	56.2	0	0	0	0	115.1	F1027 T1033 F1038	F1027-S1031 PolarHBondContact O-N 3.44Å; F1027-S1031 PolarHBondContact O-OG 3.03Å; S1031-T1033 PolarHBondContact O-N 3.23Å; S1031-F1038 WeakPolarHBondContact O-CZ 3.49Å
1032	S	49.9	Very low	67.4	Low	57 Å²	57	56.9 Å²	56.9	40%	0.399	31%	0.309	S	S	.	.	S	Bend	trans	-81	100.9	-179.6	54.2	0	0	0	0	112.9	K1029 V1030 N1034 N1037	K1029-S1032 PolarHBondContact O-OG 3.11Å; V1030-S1032 PolarHBondContact O-N 2.83Å; S1032-N1034 VanDerWaalsContact C-N 3.26Å; S1032-N1034 PolarHBondContact O-N 3.23Å; S1032-N1037 PolarHBondContact O-ND2 2.7Å
1033	T	58.6	Low	67.1	Low	145 Å²	145	56.3 Å²	56.3	89%	0.89	31%	0.306	S	S	*	.	S	Bend	trans	53.2	-27.6	157.7	61.2	0	0	0	0	121.6	S1031	S1031-T1033 PolarHBondContact O-N 3.23Å
1034	N	68.6	Low	67	Low	72 Å²	72	55.6 Å²	55.6	39%	0.385	30%	0.299	S	S	.	.			trans	-98.7	133.1	-177.9	-173.7	2.6	0	0	0	112	S1032 D1036 N1037 F1038	S1032-N1034 VanDerWaalsContact C-N 3.26Å; S1032-N1034 PolarHBondContact O-N 3.23Å; N1034-D1036 PolarHBondContact O-N 2.76Å; N1034-D1036 PolarHBondContact OD1-N 3.11Å; N1034-D1036 VanDerWaalsContact OD1-N 3.13Å; N1034-N1037 WeakPolarHBondContact O-CB 3.43Å; N1034-N1037 PolarHBondContact O-N 2.88Å; N1034-F1038 VanDerWaalsContact O-CD2 3.3Å; N1034-F1038 WeakPolarHBondContact O-CD2 3.49Å; N1034-F1038 PolarHBondContact O-N 2.94Å
1035	V	72.2	Confident	66.7	Low	56 Å²	56	51 Å²	51	34%	0.339	28%	0.28	S	S	.	.	H	α-helix	trans	-51.8	-39.1	172.7	178.3	0	0	0	0	112.1	I757 N1037 F1038 L1039	I757-V1035 HydrophobicContact CG2-CG1 3.7Å; V1035-N1037 VanDerWaalsContact C-N 3.28Å; V1035-N1037 PolarHBondContact O-N 3.36Å; V1035-F1038 PolarHBondContact O-N 3.47Å; V1035-L1039 HydrophobicContact CG1-CD1 4.21Å; V1035-L1039 WeakPolarHBondContact O-CG 3.4Å; V1035-L1039 PolarHBondContact O-N 2.97Å
1036	D	73.6	Confident	66	Low	31 Å²	31	49 Å²	49	17%	0.166	27%	0.268	C	S	.	.	H	α-helix	trans	-66.3	-30.7	178.4	-66.9	-43.3	0	0	0	112.6	V743 R747 N1034 L1039 I1040	V743-D1036 HydrophobicContact CG1-CB 4.39Å; V743-D1036 WeakPolarHBondContact CG1-OD1 3.43Å; R747-D1036 IonicContact CZ-OD1 3.73Å; R747-D1036 IonicContact NE-OD1 3.63Å; R747-D1036 PolarHBondContact NE-OD1 3.33Å; R747-D1036 IonicContact NH2-OD1 2.69Å; R747-D1036 PolarHBondContact NH2-OD1 3.22Å; R747-D1036 IonicContact NH2-OD2 2.77Å; R747-D1036 PolarHBondContact NH2-OD2 2.63Å; N1034-D1036 PolarHBondContact O-N 2.76Å; N1034-D1036 PolarHBondContact OD1-N 3.11Å; N1034-D1036 VanDerWaalsContact OD1-N 3.13Å; D1036-L1039 PolarHBondContact O-N 3.42Å; D1036-I1040 WeakPolarHBondContact O-CG1 3.32Å; D1036-I1040 PolarHBondContact O-N 3.08Å
1037	N	70	Confident	65.4	Low	47 Å²	47	50.2 Å²	50.2	25%	0.251	28%	0.276	S	S	.	.	H	α-helix	trans	-68.5	-45.8	175.3	-61.8	-14.4	0	0	0	110.3	V1030 S1032 N1034 V1035 L1039 I1040 A1041	V1030-N1037 HydrophobicContact CG1-CB 4.03Å; V1030-N1037 WeakPolarHBondContact CG1-O 3.44Å; V1030-N1037 WeakPolarHBondContact O-CB 3.38Å; S1032-N1037 PolarHBondContact O-ND2 2.7Å; N1034-N1037 WeakPolarHBondContact O-CB 3.43Å; N1034-N1037 PolarHBondContact O-N 2.88Å; V1035-N1037 VanDerWaalsContact C-N 3.28Å; V1035-N1037 PolarHBondContact O-N 3.36Å; N1037-L1039 VanDerWaalsContact C-N 3.27Å; N1037-L1039 PolarHBondContact O-N 3.4Å; N1037-I1040 PolarHBondContact O-N 2.92Å; N1037-I1040 VanDerWaalsContact O-N 3.1Å; N1037-A1041 PolarHBondContact O-N 2.83Å
1038	F	68.8	Low	64.5	Low	50 Å²	50	49.6 Å²	49.6	22%	0.219	28%	0.281	C	S	.	.	H	α-helix	trans	-58.3	-38.4	173.5	-70.2	-76	0	0	0	112.6	I761 S1031 N1034 V1035 A1041 S1042	I761-F1038 HydrophobicContact CG1-CB 4.2Å; I761-F1038 HydrophobicContact CG2-CD1 4.39Å; S1031-F1038 WeakPolarHBondContact O-CZ 3.49Å; N1034-F1038 VanDerWaalsContact O-CD2 3.3Å; N1034-F1038 WeakPolarHBondContact O-CD2 3.49Å; N1034-F1038 PolarHBondContact O-N 2.94Å; V1035-F1038 PolarHBondContact O-N 3.47Å; F1038-A1041 PolarHBondContact O-N 3.33Å; F1038-S1042 PolarHBondContact O-N 3.42Å
1039	L	73.9	Confident	63.6	Low	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-68.3	-38.8	174.8	-67.9	176.5	0	0	0	112	V743 L746 R747 I757 I760 V1035 D1036 N1037 S1042 L1043	V743-L1039 HydrophobicContact CG1-CB 3.99Å; V743-L1039 HydrophobicContact CG1-CD1 3.8Å; V743-L1039 HydrophobicContact CG2-CB 3.91Å; L746-L1039 HydrophobicContact CD2-CD2 3.91Å; R747-L1039 HydrophobicContact CG-CD1 4.1Å; I757-L1039 HydrophobicContact CG2-CD1 4.32Å; I757-L1039 HydrophobicContact CG2-CD2 4.22Å; I760-L1039 HydrophobicContact CD1-CD2 4.26Å; I760-L1039 HydrophobicContact CG2-CD2 4.3Å; V1035-L1039 HydrophobicContact CG1-CD1 4.21Å; V1035-L1039 WeakPolarHBondContact O-CG 3.4Å; V1035-L1039 PolarHBondContact O-N 2.97Å; D1036-L1039 PolarHBondContact O-N 3.42Å; N1037-L1039 VanDerWaalsContact C-N 3.27Å; N1037-L1039 PolarHBondContact O-N 3.4Å; L1039-S1042 WeakPolarHBondContact O-CB 3.34Å; L1039-S1042 PolarHBondContact O-N 3.12Å; L1039-S1042 PolarHBondContact O-OG 2.92Å; L1039-L1043 PolarHBondContact O-N 2.91Å
1040	I	73.9	Confident	62.5	Low	41 Å²	41	47.4 Å²	47.4	21%	0.21	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-44	171.3	-69.4	169.8	0	0	0	111.2	I740 V743 D1036 N1037 S1042 L1043	I740-I1040 HydrophobicContact CG1-CD1 4.19Å; V743-I1040 HydrophobicContact CG2-CG1 3.65Å; D1036-I1040 WeakPolarHBondContact O-CG1 3.32Å; D1036-I1040 PolarHBondContact O-N 3.08Å; N1037-I1040 PolarHBondContact O-N 2.92Å; N1037-I1040 VanDerWaalsContact O-N 3.1Å; I1040-S1042 VanDerWaalsContact C-N 3.29Å; I1040-S1042 PolarHBondContact O-N 3.5Å; I1040-L1043 WeakPolarHBondContact O-CB 3.23Å; I1040-L1043 PolarHBondContact O-N 3.32Å; I1040-L1043 VanDerWaalsContact O-N 3.16Å
1041	A	69.7	Low	61.8	Low	12 Å²	12	49.3 Å²	49.3	10%	0.099	29%	0.288	C	S	.	.	H	α-helix	trans	-57.4	-43.5	173.7	0	0	0	0	0	111.3	V1030 N1037 F1038 L1043 Y1044 H1045	V1030-A1041 HydrophobicContact CB-CB 4.48Å; V1030-A1041 HydrophobicContact CG1-CB 3.75Å; N1037-A1041 PolarHBondContact O-N 2.83Å; F1038-A1041 PolarHBondContact O-N 3.33Å; A1041-L1043 PolarHBondContact O-N 3.38Å; A1041-L1043 VanDerWaalsContact O-N 3.1Å; A1041-Y1044 PolarHBondContact O-N 2.88Å; A1041-H1045 PolarHBondContact O-CD2 2.88Å; A1041-H1045 PolarHBondContact O-N 3.27Å; A1041-H1045 VanDerWaalsContact O-N 3.1Å
1042	S	73.4	Confident	61.4	Low	21 Å²	21	50.7 Å²	50.7	15%	0.147	29%	0.292	C	S	.	.	H	α-helix	trans	-61.1	-20.3	-180	81.7	0	0	0	0	114.5	I760 Q764 F1038 L1039 I1040	I760-S1042 VanDerWaalsContact CG2-CB 3.49Å; Q764-S1042 VanDerWaalsContact NE2-CA 3.32Å; F1038-S1042 PolarHBondContact O-N 3.42Å; L1039-S1042 WeakPolarHBondContact O-CB 3.34Å; L1039-S1042 PolarHBondContact O-N 3.12Å; L1039-S1042 PolarHBondContact O-OG 2.92Å; I1040-S1042 VanDerWaalsContact C-N 3.29Å; I1040-S1042 PolarHBondContact O-N 3.5Å
1043	L	77.4	Confident	61.1	Low	1 Å²	1	57.6 Å²	57.6	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-69.3	-32.8	172.9	-58.3	179	0	0	0	112.1	Q742 L828 R831 L1039 I1040 A1041	Q742-L1043 HydrophobicContact CB-CD1 4.06Å; Q742-L1043 HydrophobicContact CG-CD1 4.13Å; Q742-L1043 HydrophobicContact CG-CD2 3.83Å; L828-L1043 HydrophobicContact CD1-CD2 3.91Å; R831-L1043 HydrophobicContact CB-CD2 4.46Å; R831-L1043 HydrophobicContact CG-CB 4.15Å; R831-L1043 PolarHBondContact NE-O 3.39Å; R831-L1043 PolarHBondContact NH2-O 3.48Å; L1039-L1043 PolarHBondContact O-N 2.91Å; I1040-L1043 WeakPolarHBondContact O-CB 3.23Å; I1040-L1043 PolarHBondContact O-N 3.32Å; I1040-L1043 VanDerWaalsContact O-N 3.16Å; A1041-L1043 PolarHBondContact O-N 3.38Å; A1041-L1043 VanDerWaalsContact O-N 3.1Å
1044	Y	76.6	Confident	60.5	Low	11 Å²	11	56.3 Å²	56.3	4%	0.043	30%	0.295	C	S	.	.	H	α-helix	trans	-113.2	-3.1	-169.6	-62.6	-73.9	0	0	0	114.5	V735 S739 L835 L955 A1041	V735-Y1044 WeakPolarHBondContact CG1-OH 3.35Å; S739-Y1044 PolarHBondContact OG-OH 3.46Å; L835-Y1044 HydrophobicContact CD2-CD1 3.93Å; L835-Y1044 HydrophobicContact CD2-CE1 3.93Å; L835-Y1044 HydrophobicContact CG-CE1 4.2Å; L955-Y1044 VanDerWaalsContact CB-O 3.29Å; L955-Y1044 WeakPolarHBondContact CB-O 3.43Å; A1041-Y1044 PolarHBondContact O-N 2.88Å
1045	H	69.3	Low	59.6	Low	33 Å²	33	53.8 Å²	53.8	15%	0.153	28%	0.282	C	S	.	.	S	Bend	trans	-78.7	137.4	167.2	-77.2	-64.2	0	0	0	112.2	F1027 A1041	F1027-H1045 AromaticContact CD2-CE1 3.35Å; F1027-H1045 WeakPolarHBondContact CD2-CE1 3.44Å; F1027-H1045 AromaticContact CD2-NE2 3.28Å; F1027-H1045 VanDerWaalsContact CD2-NE2 3.28Å; F1027-H1045 WeakPolarHBondContact CD2-NE2 3.35Å; F1027-H1045 AromaticContact CE2-CE1 3.57Å; F1027-H1045 AromaticContact CE2-NE2 3.38Å; F1027-H1045 WeakPolarHBondContact CE2-NE2 3.27Å; A1041-H1045 PolarHBondContact O-CD2 2.88Å; A1041-H1045 PolarHBondContact O-N 3.27Å; A1041-H1045 VanDerWaalsContact O-N 3.1Å
1046	P	56.4	Low	58.7	Low	19 Å²	19	54 Å²	54	12%	0.123	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-65.1	146.5	159.3	29.3	-32.7	0	0	0	109.5	S1048 I1051 N1052	P1046-S1048 PolarHBondContact O-N 3.33Å; P1046-I1051 HydrophobicContact CB-CB 3.89Å; P1046-I1051 HydrophobicContact CB-CD1 3.89Å; P1046-I1051 HydrophobicContact CB-CG1 4.15Å; P1046-I1051 HydrophobicContact CG-CB 4.37Å; P1046-N1052 VanDerWaalsContact CG-OD1 3.32Å; P1046-N1052 WeakPolarHBondContact CG-OD1 3.27Å
1047	N	53.4	Low	58.2	Low	54 Å²	54	57.2 Å²	57.2	29%	0.289	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-55.7	141.7	168.4	-66.1	-0.3	0	0	0	108.5	Q825 Q1049	Q825-N1047 PolarHBondContact NE2-OD1 2.99Å; N1047-Q1049 PolarHBondContact O-N 3.05Å
1048	S	40.6	Very low	58.6	Low	68 Å²	68	55.9 Å²	55.9	48%	0.476	30%	0.296	S	S	.	.	S	Bend	trans	-68.6	22.3	-166.1	46.7	0	0	0	0	116.3	P1046	P1046-S1048 PolarHBondContact O-N 3.33Å
1049	Q	40.4	Very low	59.4	Low	151 Å²	151	53.6 Å²	53.6	71%	0.706	29%	0.286	S	S	*	.	S	Bend	trans	-108.3	78.1	172.3	-64	-168.4	-14.2	0	0	111.3	N818 N1047	N818-Q1049 PolarHBondContact ND2-NE2 3.29Å; N1047-Q1049 PolarHBondContact O-N 3.05Å
1050	G	40.4	Very low	59.9	Low	39 Å²	39	58.9 Å²	58.9	40%	0.402	31%	0.311	S	S	.	.	S	Bend	trans	101.1	-27.6	149.6	0	0	0	0	0	119	N1052 R1053 I1054	G1050-N1052 PolarHBondContact O-N 3.34Å; G1050-R1053 PolarHBondContact O-N 2.94Å; G1050-R1053 VanDerWaalsContact O-N 3.08Å; G1050-I1054 WeakPolarHBondContact O-CG1 3.36Å; G1050-I1054 PolarHBondContact O-N 2.95Å
1051	I	39.9	Very low	60.6	Low	78 Å²	78	62 Å²	62	40%	0.4	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-47.8	-167.9	-47.9	-173.4	0	0	0	112.3	P1046 R1053 I1054 T1055	P1046-I1051 HydrophobicContact CB-CB 3.89Å; P1046-I1051 HydrophobicContact CB-CD1 3.89Å; P1046-I1051 HydrophobicContact CB-CG1 4.15Å; P1046-I1051 HydrophobicContact CG-CB 4.37Å; I1051-R1053 PolarHBondContact O-N 3.49Å; I1051-I1054 PolarHBondContact O-N 3.21Å; I1051-T1055 HydrophobicContact CG2-CG2 4.13Å; I1051-T1055 PolarHBondContact O-N 2.73Å; I1051-T1055 PolarHBondContact O-OG1 3.32Å
1052	N	41.9	Very low	61.6	Low	79 Å²	79	61.9 Å²	61.9	42%	0.422	32%	0.322	S	S	.	.	H	α-helix	trans	-48.9	-18	174.9	-75.6	-19.3	0	0	0	115.5	E958 P1046 G1050	E958-N1052 WeakPolarHBondContact OE1-CA 3.49Å; E958-N1052 PolarHBondContact OE1-N 2.92Å; P1046-N1052 VanDerWaalsContact CG-OD1 3.32Å; P1046-N1052 WeakPolarHBondContact CG-OD1 3.27Å; G1050-N1052 PolarHBondContact O-N 3.34Å
1053	R	43.4	Very low	62.4	Low	201 Å²	201	63.1 Å²	63.1	76%	0.758	33%	0.325	S	S	*	.	H	α-helix	trans	-106	-18.7	176.5	-68.2	-171.2	-178.5	-177.4	2.9	113.8	G1050 I1051 N1057	G1050-R1053 PolarHBondContact O-N 2.94Å; G1050-R1053 VanDerWaalsContact O-N 3.08Å; I1051-R1053 PolarHBondContact O-N 3.49Å; R1053-N1057 PolarHBondContact O-ND2 2.91Å; R1053-N1057 PolarHBondContact O-OD1 3.3Å
1054	I	47.5	Very low	63.1	Low	119 Å²	119	68.6 Å²	68.6	61%	0.61	35%	0.349	S	S	*	.	H	α-helix	trans	-84	-39.6	-175.3	-66.2	167.5	0	0	0	111.2	G1050 I1051 N1057	G1050-I1054 WeakPolarHBondContact O-CG1 3.36Å; G1050-I1054 PolarHBondContact O-N 2.95Å; I1051-I1054 PolarHBondContact O-N 3.21Å; I1054-N1057 WeakPolarHBondContact O-CB 3.31Å; I1054-N1057 PolarHBondContact O-N 2.93Å
1055	T	49.7	Very low	63.9	Low	18 Å²	18	70 Å²	70	11%	0.11	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-43.9	-177	52.8	0	0	0	0	111.6	E958 I1051 N1057 G1058	E958-T1055 HydrophobicContact CB-CG2 3.98Å; E958-T1055 HydrophobicContact CG-CG2 4.31Å; E958-T1055 WeakPolarHBondContact OE1-CG2 3.46Å; E958-T1055 PolarHBondContact OE1-OG1 3.48Å; I1051-T1055 HydrophobicContact CG2-CG2 4.13Å; I1051-T1055 PolarHBondContact O-N 2.73Å; I1051-T1055 PolarHBondContact O-OG1 3.32Å; T1055-N1057 PolarHBondContact O-N 3.47Å; T1055-G1058 WeakPolarHBondContact O-CA 3.42Å; T1055-G1058 PolarHBondContact O-N 2.99Å
1056	L	53	Low	65.2	Low	61 Å²	61	68.4 Å²	68.4	32%	0.319	35%	0.35	S	S	.	.	H	α-helix	trans	-65.9	-25.6	175.5	-163.5	70.7	0	0	0	113	N1020 G1058	N1020-L1056 VanDerWaalsContact ND2-CD1 3.29Å; N1020-L1056 WeakPolarHBondContact ND2-CD1 3.23Å; L1056-G1058 PolarHBondContact O-N 3.35Å
1057	N	62.7	Low	67.1	Low	98 Å²	98	70.9 Å²	70.9	52%	0.524	36%	0.362	S	S	.	.	H	α-helix	trans	-64.3	-18.9	169.3	-71.8	-22.3	0	0	0	112.5	R1053 I1054 T1055 H1060 H1061	R1053-N1057 PolarHBondContact O-ND2 2.91Å; R1053-N1057 PolarHBondContact O-OD1 3.3Å; I1054-N1057 WeakPolarHBondContact O-CB 3.31Å; I1054-N1057 PolarHBondContact O-N 2.93Å; T1055-N1057 PolarHBondContact O-N 3.47Å; N1057-H1060 PolarHBondContact O-N 3.49Å; N1057-H1061 WeakPolarHBondContact O-CB 3.47Å; N1057-H1061 PolarHBondContact O-N 3.03Å
1058	G	77.8	Confident	69.1	Low	20 Å²	20	72.9 Å²	72.9	21%	0.206	37%	0.37	C	S	.	.	H	α-helix	trans	-55.8	-58.8	175.7	0	0	0	0	0	111.8	T1055 L1056 H1060 H1061 I1062	T1055-G1058 WeakPolarHBondContact O-CA 3.42Å; T1055-G1058 PolarHBondContact O-N 2.99Å; L1056-G1058 PolarHBondContact O-N 3.35Å; G1058-H1060 VanDerWaalsContact C-N 3.27Å; G1058-H1060 PolarHBondContact O-N 2.7Å; G1058-H1061 WeakPolarHBondContact O-CB 3.47Å; G1058-H1061 PolarHBondContact O-N 3.37Å; G1058-H1061 VanDerWaalsContact O-N 3.08Å; G1058-I1062 WeakPolarHBondContact O-CG1 3.48Å; G1058-I1062 PolarHBondContact O-N 2.81Å
1059	L	85.3	Confident	71.7	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-63.3	-31.3	179.7	-81.9	77.5	0	0	0	112.8	S961 L964 A965 Q1016 I1062 E1063	S961-L1059 WeakPolarHBondContact O-CD1 3.3Å; S961-L1059 WeakPolarHBondContact OG-CD1 3.45Å; L964-L1059 HydrophobicContact CD2-CD2 4.24Å; A965-L1059 HydrophobicContact CB-CD1 4.19Å; Q1016-L1059 HydrophobicContact CG-CB 4.05Å; Q1016-L1059 HydrophobicContact CG-CD2 3.76Å; L1059-I1062 PolarHBondContact O-N 3.43Å; L1059-E1063 WeakPolarHBondContact O-CB 3.16Å; L1059-E1063 PolarHBondContact O-N 3.31Å
1060	H	84.9	Confident	74.4	Confident	111 Å²	111	63.5 Å²	63.5	51%	0.514	32%	0.318	S	S	.	.	H	α-helix	trans	-73.5	-32.4	175	-173.6	54.1	0	0	0	112.5	N1057 G1058 E1063 K1064	N1057-H1060 PolarHBondContact O-N 3.49Å; G1058-H1060 VanDerWaalsContact C-N 3.27Å; G1058-H1060 PolarHBondContact O-N 2.7Å; H1060-E1063 IonicContact CE1-OE2 2.75Å; H1060-E1063 IonicContact CG-OE2 2.94Å; H1060-E1063 IonicContact ND1-OE2 2.93Å; H1060-E1063 PolarHBondContact ND1-OE2 3.5Å; H1060-E1063 WeakPolarHBondContact O-CB 3.15Å; H1060-E1063 PolarHBondContact O-N 3.07Å; H1060-K1064 PolarHBondContact O-N 3.38Å; H1060-K1064 VanDerWaalsContact O-N 3.09Å
1061	H	88	Confident	77.1	Confident	107 Å²	107	66 Å²	66	50%	0.495	32%	0.32	S	S	.	.	H	α-helix	trans	-65	-41.3	168.9	-177.2	19	0	0	0	111.1	N1057 G1058 K1064 L1065	N1057-H1061 WeakPolarHBondContact O-CB 3.47Å; N1057-H1061 PolarHBondContact O-N 3.03Å; G1058-H1061 WeakPolarHBondContact O-CB 3.47Å; G1058-H1061 PolarHBondContact O-N 3.37Å; G1058-H1061 VanDerWaalsContact O-N 3.08Å; H1061-K1064 WeakPolarHBondContact O-CB 3.45Å; H1061-K1064 PolarHBondContact O-N 3.08Å; H1061-L1065 WeakPolarHBondContact O-CG 3.28Å; H1061-L1065 PolarHBondContact O-N 3.33Å
1062	I	90.8	Very high	79.7	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.046	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-47.1	174.2	-61	-39	0	0	0	111.2	A965 L968 N969 G1058 L1059 K1064 L1065 F1066	A965-I1062 HydrophobicContact CB-CG1 3.84Å; L968-I1062 HydrophobicContact CB-CG2 3.67Å; L968-I1062 HydrophobicContact CD1-CG2 4.42Å; N969-I1062 HydrophobicContact CB-CD1 3.69Å; G1058-I1062 WeakPolarHBondContact O-CG1 3.48Å; G1058-I1062 PolarHBondContact O-N 2.81Å; L1059-I1062 PolarHBondContact O-N 3.43Å; I1062-K1064 PolarHBondContact O-N 2.91Å; I1062-L1065 HydrophobicContact CD1-CD1 4.09Å; I1062-L1065 PolarHBondContact O-N 3.26Å; I1062-F1066 HydrophobicContact CG2-CD2 3.65Å; I1062-F1066 HydrophobicContact CG2-CE2 3.44Å; I1062-F1066 VanDerWaalsContact CG2-CE2 3.44Å; I1062-F1066 WeakPolarHBondContact O-CD2 3.33Å; I1062-F1066 PolarHBondContact O-N 3.08Å
1063	E	92	Very high	82.2	Confident	47 Å²	47	61.4 Å²	61.4	22%	0.22	30%	0.3	C	S	.	.	H	α-helix	trans	-51	-44.6	174.2	-176.2	-169.1	177.2	0	0	111.4	V1009 L1012 L1059 H1060 F1066 N1067	V1009-E1063 HydrophobicContact CG1-CG 4.42Å; L1012-E1063 HydrophobicContact CD1-CB 3.9Å; L1012-E1063 HydrophobicContact CD1-CG 4.43Å; L1059-E1063 WeakPolarHBondContact O-CB 3.16Å; L1059-E1063 PolarHBondContact O-N 3.31Å; H1060-E1063 IonicContact CE1-OE2 2.75Å; H1060-E1063 IonicContact CG-OE2 2.94Å; H1060-E1063 IonicContact ND1-OE2 2.93Å; H1060-E1063 PolarHBondContact ND1-OE2 3.5Å; H1060-E1063 WeakPolarHBondContact O-CB 3.15Å; H1060-E1063 PolarHBondContact O-N 3.07Å; E1063-F1066 PolarHBondContact O-N 3.45Å; E1063-N1067 PolarHBondContact O-N 2.84Å; E1063-N1067 VanDerWaalsContact O-N 3.08Å; E1063-N1067 PolarHBondContact O-ND2 3.44Å
1064	K	92.1	Very high	84.6	Confident	116 Å²	116	52.5 Å²	52.5	50%	0.504	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-46.1	174	176.1	173.3	170.5	174	0	112.8	H1060 H1061 I1062 F1066 N1067 E1068	H1060-K1064 PolarHBondContact O-N 3.38Å; H1060-K1064 VanDerWaalsContact O-N 3.09Å; H1061-K1064 WeakPolarHBondContact O-CB 3.45Å; H1061-K1064 PolarHBondContact O-N 3.08Å; I1062-K1064 PolarHBondContact O-N 2.91Å; K1064-F1066 VanDerWaalsContact C-N 3.29Å; K1064-F1066 PolarHBondContact O-N 3.48Å; K1064-N1067 PolarHBondContact O-N 3.36Å; K1064-N1067 VanDerWaalsContact O-N 3.11Å; K1064-E1068 WeakPolarHBondContact CE-OE1 3.45Å; K1064-E1068 HydrophobicContact CG-CG 4.44Å; K1064-E1068 IonicContact NZ-OE1 3.41Å; K1064-E1068 WeakPolarHBondContact O-CG 3.25Å; K1064-E1068 PolarHBondContact O-N 3.35Å
1065	L	93.2	Very high	86.9	Confident	41 Å²	41	50.3 Å²	50.3	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-32.9	178.9	-69.7	171.7	0	0	0	112.8	N972 H1061 I1062 H1069	N972-L1065 VanDerWaalsContact ND2-C 3.3Å; N972-L1065 PolarHBondContact ND2-O 2.77Å; H1061-L1065 WeakPolarHBondContact O-CG 3.28Å; H1061-L1065 PolarHBondContact O-N 3.33Å; I1062-L1065 HydrophobicContact CD1-CD1 4.09Å; I1062-L1065 PolarHBondContact O-N 3.26Å; L1065-H1069 WeakPolarHBondContact O-CB 3.45Å; L1065-H1069 PolarHBondContact O-N 2.88Å
1066	F	96.4	Very high	88.9	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.4	-42.5	171.4	-86.2	-114.9	0	0	0	111.3	L968 F971 N972 L1005 V1008 V1009 I1062 E1063 K1064 H1069 I1070	L968-F1066 HydrophobicContact CB-CE2 4.17Å; L968-F1066 HydrophobicContact CB-CZ 4.38Å; L968-F1066 HydrophobicContact CD2-CZ 4.34Å; L968-F1066 WeakPolarHBondContact O-CE2 3.28Å; F971-F1066 AromaticContact CD1-CE1 3.88Å; F971-F1066 HydrophobicContact CD1-CE1 3.88Å; F971-F1066 AromaticContact CD1-CZ 3.73Å; F971-F1066 HydrophobicContact CD1-CZ 3.73Å; F971-F1066 HydrophobicContact CE1-CE1 4.01Å; F971-F1066 HydrophobicContact CE1-CZ 4.34Å; N972-F1066 HydrophobicContact CB-CD2 3.89Å; N972-F1066 HydrophobicContact CB-CE2 3.61Å; N972-F1066 HydrophobicContact CB-CZ 3.99Å; L1005-F1066 HydrophobicContact CB-CD1 4.36Å; L1005-F1066 HydrophobicContact CD2-CD1 3.7Å; L1005-F1066 HydrophobicContact CD2-CE1 3.8Å; V1008-F1066 HydrophobicContact CB-CD1 4.32Å; V1008-F1066 HydrophobicContact CB-CE1 3.73Å; V1008-F1066 HydrophobicContact CG1-CD1 4.22Å; V1008-F1066 HydrophobicContact CG1-CE1 3.43Å; V1008-F1066 VanDerWaalsContact CG1-CE1 3.43Å; V1008-F1066 HydrophobicContact CG1-CZ 3.75Å; V1008-F1066 HydrophobicContact CG2-CE1 4.42Å; V1009-F1066 HydrophobicContact CG2-CB 3.4Å; V1009-F1066 VanDerWaalsContact CG2-CB 3.4Å; V1009-F1066 HydrophobicContact CG2-CD1 3.99Å; V1009-F1066 HydrophobicContact CG2-CG 4.03Å; I1062-F1066 HydrophobicContact CG2-CD2 3.65Å; I1062-F1066 HydrophobicContact CG2-CE2 3.44Å; I1062-F1066 VanDerWaalsContact CG2-CE2 3.44Å; I1062-F1066 WeakPolarHBondContact O-CD2 3.33Å; I1062-F1066 PolarHBondContact O-N 3.08Å; E1063-F1066 PolarHBondContact O-N 3.45Å; K1064-F1066 VanDerWaalsContact C-N 3.29Å; K1064-F1066 PolarHBondContact O-N 3.48Å; F1066-H1069 PolarHBondContact O-N 3.07Å; F1066-I1070 WeakPolarHBondContact O-CB 3.5Å; F1066-I1070 VanDerWaalsContact O-CG1 3.29Å; F1066-I1070 WeakPolarHBondContact O-CG1 3.37Å; F1066-I1070 PolarHBondContact O-N 3.4Å
1067	N	95.8	Very high	90.8	Very high	70 Å²	70	50.1 Å²	50.1	37%	0.374	25%	0.25	S	C	.	.	H	α-helix	trans	-65.5	-39	178.2	-78.6	-68	0	0	0	112.8	E1063 K1064 H1069 I1070 E1071	E1063-N1067 PolarHBondContact O-N 2.84Å; E1063-N1067 VanDerWaalsContact O-N 3.08Å; E1063-N1067 PolarHBondContact O-ND2 3.44Å; K1064-N1067 PolarHBondContact O-N 3.36Å; K1064-N1067 VanDerWaalsContact O-N 3.11Å; N1067-H1069 VanDerWaalsContact C-N 3.29Å; N1067-H1069 PolarHBondContact O-N 3.2Å; N1067-I1070 PolarHBondContact O-N 3.28Å; N1067-E1071 PolarHBondContact O-N 3.4Å
1068	E	95.4	Very high	92.3	Very high	97 Å²	97	45.8 Å²	45.8	45%	0.453	23%	0.227	S	C	.	.	H	α-helix	trans	-61.9	-36.4	172.9	-71.4	176.5	166	0	0	111.8	K1064 S1072	K1064-E1068 WeakPolarHBondContact CE-OE1 3.45Å; K1064-E1068 HydrophobicContact CG-CG 4.44Å; K1064-E1068 IonicContact NZ-OE1 3.41Å; K1064-E1068 WeakPolarHBondContact O-CG 3.25Å; K1064-E1068 PolarHBondContact O-N 3.35Å; E1068-S1072 WeakPolarHBondContact O-CB 3.36Å; E1068-S1072 PolarHBondContact O-N 2.82Å; E1068-S1072 VanDerWaalsContact O-N 3.07Å; E1068-S1072 PolarHBondContact O-OG 3.33Å
1069	H	95.4	Very high	93.1	Very high	10 Å²	10	47.8 Å²	47.8	5%	0.046	23%	0.231	C	C	.	.	H	α-helix	trans	-74.9	-35.9	175.4	-172.9	-165.9	0	0	0	112.7	N972 C976 L1005 L1065 F1066 N1067 S1072 I1073	N972-H1069 PolarHBondContact O-CE1 2.74Å; N972-H1069 PolarHBondContact OD1-ND1 3.13Å; C976-H1069 VanDerWaalsContact CA-CE1 3.49Å; C976-H1069 WeakPolarHBondContact CA-CE1 3.3Å; C976-H1069 WeakPolarHBondContact CA-NE2 3.18Å; C976-H1069 PolarHBondContact N-CE1 3.16Å; L1005-H1069 HydrophobicContact CD1-CB 4.49Å; L1065-H1069 WeakPolarHBondContact O-CB 3.45Å; L1065-H1069 PolarHBondContact O-N 2.88Å; F1066-H1069 PolarHBondContact O-N 3.07Å; N1067-H1069 VanDerWaalsContact C-N 3.29Å; N1067-H1069 PolarHBondContact O-N 3.2Å; H1069-S1072 WeakPolarHBondContact O-CB 3.4Å; H1069-S1072 PolarHBondContact O-N 3.31Å; H1069-I1073 WeakPolarHBondContact O-CG1 3.33Å; H1069-I1073 PolarHBondContact O-N 2.69Å
1070	I	97.1	Very high	93.3	Very high	12 Å²	12	51.6 Å²	51.6	6%	0.062	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-48	172.9	-79.2	164.2	0	0	0	110.9	L1002 L1005 Q1006 V1009 F1066 N1067 S1072 I1073 L1074	L1002-I1070 HydrophobicContact CD1-CB 4.33Å; L1002-I1070 HydrophobicContact CD1-CG1 4.36Å; L1002-I1070 HydrophobicContact CD1-CG2 3.78Å; L1005-I1070 HydrophobicContact CB-CD1 3.97Å; L1005-I1070 HydrophobicContact CB-CG1 3.7Å; L1005-I1070 HydrophobicContact CD1-CG1 4.23Å; Q1006-I1070 HydrophobicContact CG-CD1 3.9Å; Q1006-I1070 HydrophobicContact CG-CG1 4.34Å; Q1006-I1070 HydrophobicContact CG-CG2 4.48Å; V1009-I1070 HydrophobicContact CG2-CD1 3.87Å; F1066-I1070 WeakPolarHBondContact O-CB 3.5Å; F1066-I1070 VanDerWaalsContact O-CG1 3.29Å; F1066-I1070 WeakPolarHBondContact O-CG1 3.37Å; F1066-I1070 PolarHBondContact O-N 3.4Å; N1067-I1070 PolarHBondContact O-N 3.28Å; I1070-S1072 VanDerWaalsContact C-N 3.33Å; I1070-S1072 PolarHBondContact O-N 3.04Å; I1070-I1073 PolarHBondContact O-N 2.92Å; I1070-L1074 HydrophobicContact CG2-CD1 3.98Å; I1070-L1074 WeakPolarHBondContact O-CG 3.38Å; I1070-L1074 PolarHBondContact O-N 3.1Å
1071	E	96	Very high	93.6	Very high	92 Å²	92	46.9 Å²	46.9	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-67.2	-33.1	174.1	-86.5	-60.5	141.2	0	0	112.5	N1067 I1073 L1074 Q1075 R1132	N1067-E1071 PolarHBondContact O-N 3.4Å; E1071-I1073 VanDerWaalsContact C-N 3.33Å; E1071-I1073 PolarHBondContact O-N 3.37Å; E1071-L1074 PolarHBondContact O-N 2.98Å; E1071-L1074 VanDerWaalsContact OE1-CD1 3.27Å; E1071-L1074 WeakPolarHBondContact OE1-CD1 3.18Å; E1071-Q1075 VanDerWaalsContact O-CB 3.31Å; E1071-Q1075 WeakPolarHBondContact O-CB 3.46Å; E1071-Q1075 PolarHBondContact O-N 2.94Å; E1071-R1132 IonicContact OE1-NH1 2.66Å; E1071-R1132 IonicContact OE2-CZ 3.83Å; E1071-R1132 IonicContact OE2-NH1 2.74Å; E1071-R1132 PolarHBondContact OE2-NH1 3.38Å; E1071-R1132 IonicContact OE2-NH2 2.83Å; E1071-R1132 PolarHBondContact OE2-NH2 2.91Å
1072	S	95	Very high	93.8	Very high	59 Å²	59	42.6 Å²	42.6	41%	0.413	21%	0.211	S	C	.	.	H	α-helix	trans	-60.1	-41.7	172.9	-59.2	0	0	0	0	112.3	E1068 H1069 I1070 K1076	E1068-S1072 WeakPolarHBondContact O-CB 3.36Å; E1068-S1072 PolarHBondContact O-N 2.82Å; E1068-S1072 VanDerWaalsContact O-N 3.07Å; E1068-S1072 PolarHBondContact O-OG 3.33Å; H1069-S1072 WeakPolarHBondContact O-CB 3.4Å; H1069-S1072 PolarHBondContact O-N 3.31Å; I1070-S1072 VanDerWaalsContact C-N 3.33Å; I1070-S1072 PolarHBondContact O-N 3.04Å; S1072-K1076 PolarHBondContact O-N 2.94Å
1073	I	94.6	Very high	93.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-73.8	-38.9	176.8	-67.9	159.1	0	0	0	111.7	L980 L998 T1001 L1002 L1005 H1069 I1070 E1071 K1076 L1077	L980-I1073 HydrophobicContact CD1-CG1 4.16Å; L980-I1073 HydrophobicContact CD2-CG1 4.1Å; L980-I1073 HydrophobicContact CG-CG1 4.29Å; L998-I1073 HydrophobicContact CB-CG2 4.24Å; L998-I1073 HydrophobicContact CD2-CG2 4.3Å; T1001-I1073 HydrophobicContact CG2-CD1 3.62Å; L1002-I1073 HydrophobicContact CB-CG2 3.98Å; L1005-I1073 HydrophobicContact CD1-CD1 3.41Å; L1005-I1073 VanDerWaalsContact CD1-CD1 3.41Å; H1069-I1073 WeakPolarHBondContact O-CG1 3.33Å; H1069-I1073 PolarHBondContact O-N 2.69Å; I1070-I1073 PolarHBondContact O-N 2.92Å; E1071-I1073 VanDerWaalsContact C-N 3.33Å; E1071-I1073 PolarHBondContact O-N 3.37Å; I1073-K1076 PolarHBondContact O-N 3.48Å; I1073-K1076 VanDerWaalsContact O-N 3.15Å; I1073-L1077 HydrophobicContact CG2-CD1 4.42Å; I1073-L1077 PolarHBondContact O-N 2.94Å
1074	L	94	Very high	93.7	Very high	14 Å²	14	46.6 Å²	46.6	7%	0.073	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-46.6	173.4	-79.1	164.1	0	0	0	111.3	L1002 I1070 E1071 K1076 L1077 V1078 T1125 I1129	L1002-L1074 HydrophobicContact CD1-CD1 4.32Å; L1002-L1074 HydrophobicContact CD1-CD2 4.39Å; L1002-L1074 HydrophobicContact CD1-CG 3.95Å; L1002-L1074 HydrophobicContact CD2-CD2 3.52Å; L1002-L1074 HydrophobicContact CD2-CG 3.92Å; I1070-L1074 HydrophobicContact CG2-CD1 3.98Å; I1070-L1074 WeakPolarHBondContact O-CG 3.38Å; I1070-L1074 PolarHBondContact O-N 3.1Å; E1071-L1074 PolarHBondContact O-N 2.98Å; E1071-L1074 VanDerWaalsContact OE1-CD1 3.27Å; E1071-L1074 WeakPolarHBondContact OE1-CD1 3.18Å; L1074-K1076 VanDerWaalsContact C-N 3.27Å; L1074-K1076 PolarHBondContact O-N 3.3Å; L1074-L1077 PolarHBondContact O-N 3.49Å; L1074-V1078 WeakPolarHBondContact O-CG2 3.44Å; L1074-V1078 PolarHBondContact O-N 2.69Å; L1074-T1125 HydrophobicContact CD2-CG2 3.78Å; L1074-I1129 HydrophobicContact CD2-CD1 3.99Å; L1074-I1129 HydrophobicContact CD2-CG1 4.03Å
1075	Q	94.6	Very high	93.7	Very high	73 Å²	73	41.2 Å²	41.2	34%	0.341	21%	0.214	S	C	.	.	H	α-helix	trans	-62.5	-35	174.1	-175.1	59.2	24.4	0	0	111.4	E1071 V1078 Q1079	E1071-Q1075 VanDerWaalsContact O-CB 3.31Å; E1071-Q1075 WeakPolarHBondContact O-CB 3.46Å; E1071-Q1075 PolarHBondContact O-N 2.94Å; Q1075-V1078 PolarHBondContact O-N 3.06Å; Q1075-Q1079 WeakPolarHBondContact O-CB 3.42Å; Q1075-Q1079 WeakPolarHBondContact O-CG 3.41Å; Q1075-Q1079 PolarHBondContact O-N 3.43Å
1076	K	92.9	Very high	93.6	Very high	74 Å²	74	40.1 Å²	40.1	32%	0.322	21%	0.213	S	C	.	.	H	α-helix	trans	-70.6	-32.8	175.2	-162.2	47.7	169	171.5	0	113.3	L980 L998 S1072 I1073 L1074 Q1079 L1080	L980-K1076 HydrophobicContact CD2-CB 4.28Å; L980-K1076 HydrophobicContact CD2-CG 4.36Å; L998-K1076 HydrophobicContact CD1-CG 4.32Å; S1072-K1076 PolarHBondContact O-N 2.94Å; I1073-K1076 PolarHBondContact O-N 3.48Å; I1073-K1076 VanDerWaalsContact O-N 3.15Å; L1074-K1076 VanDerWaalsContact C-N 3.27Å; L1074-K1076 PolarHBondContact O-N 3.3Å; K1076-Q1079 HydrophobicContact CD-CB 4Å; K1076-Q1079 PolarHBondContact O-N 2.94Å; K1076-L1080 WeakPolarHBondContact O-CG 3.46Å; K1076-L1080 PolarHBondContact O-N 2.97Å; K1076-L1080 VanDerWaalsContact O-N 3.15Å
1077	L	93.3	Very high	93.2	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-67.4	-36.9	171	-78.4	167.3	0	0	0	112.4	A995 L998 L1002 I1073 L1074 L1121 I1129	A995-L1077 HydrophobicContact CB-CD2 4.33Å; L998-L1077 HydrophobicContact CB-CD1 4.4Å; L998-L1077 HydrophobicContact CB-CD2 3.77Å; L998-L1077 HydrophobicContact CB-CG 3.99Å; L998-L1077 HydrophobicContact CD1-CD2 4.02Å; L998-L1077 HydrophobicContact CD1-CG 4.27Å; L1002-L1077 HydrophobicContact CD2-CD1 3.92Å; I1073-L1077 HydrophobicContact CG2-CD1 4.42Å; I1073-L1077 PolarHBondContact O-N 2.94Å; L1074-L1077 PolarHBondContact O-N 3.49Å; L1077-L1121 HydrophobicContact CD1-CD1 4.2Å; L1077-I1129 HydrophobicContact CB-CD1 4.31Å; L1077-I1129 HydrophobicContact CD1-CD1 4.2Å
1078	V	94.5	Very high	92.9	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-47	170.7	171	0	0	0	0	110.7	L1074 Q1075 L1080 L1081 S1082 I1129 R1132 V1133	L1074-V1078 WeakPolarHBondContact O-CG2 3.44Å; L1074-V1078 PolarHBondContact O-N 2.69Å; Q1075-V1078 PolarHBondContact O-N 3.06Å; V1078-L1080 VanDerWaalsContact C-N 3.3Å; V1078-L1080 PolarHBondContact O-N 2.77Å; V1078-L1081 CarbonylContact O-C 3.58Å; V1078-L1081 WeakPolarHBondContact O-CA 3.32Å; V1078-L1081 PolarHBondContact O-N 2.71Å; V1078-S1082 PolarHBondContact O-N 3.35Å; V1078-S1082 PolarHBondContact O-OG 2.85Å; V1078-I1129 HydrophobicContact CG2-CB 4.48Å; V1078-I1129 HydrophobicContact CG2-CG2 4.03Å; V1078-R1132 HydrophobicContact CG1-CB 4.16Å; V1078-R1132 HydrophobicContact CG2-CB 3.83Å; V1078-V1133 HydrophobicContact CB-CG2 4.42Å; V1078-V1133 HydrophobicContact CG1-CG2 3.96Å
1079	Q	92.8	Very high	92.6	Very high	62 Å²	62	38.8 Å²	38.8	29%	0.29	21%	0.213	S	C	.	.	H	α-helix	trans	-55.2	-38.8	177.6	-82.4	-178.7	-8.6	0	0	113.9	Q1075 K1076 L1081 S1082 D1083	Q1075-Q1079 WeakPolarHBondContact O-CB 3.42Å; Q1075-Q1079 WeakPolarHBondContact O-CG 3.41Å; Q1075-Q1079 PolarHBondContact O-N 3.43Å; K1076-Q1079 HydrophobicContact CD-CB 4Å; K1076-Q1079 PolarHBondContact O-N 2.94Å; Q1079-L1081 PolarHBondContact O-N 3.43Å; Q1079-S1082 VanDerWaalsContact CA-OG 3.27Å; Q1079-S1082 WeakPolarHBondContact CA-OG 3.47Å; Q1079-S1082 PolarHBondContact O-N 3.35Å; Q1079-D1083 WeakPolarHBondContact CA-OD1 3.17Å; Q1079-D1083 WeakPolarHBondContact CG-OD1 3.43Å; Q1079-D1083 VanDerWaalsContact O-CB 3.26Å; Q1079-D1083 WeakPolarHBondContact O-CB 3.44Å; Q1079-D1083 PolarHBondContact O-N 3.32Å
1080	L	90.9	Very high	92.1	Very high	81 Å²	81	41 Å²	41	42%	0.424	23%	0.229	S	C	.	.	H	α-helix	trans	-60.8	-13.7	174.9	-71.9	178.2	0	0	0	114.4	A995 L998 K1076 V1078	A995-L1080 HydrophobicContact CB-CD1 4.16Å; L998-L1080 HydrophobicContact CD1-CD1 3.63Å; K1076-L1080 WeakPolarHBondContact O-CG 3.46Å; K1076-L1080 PolarHBondContact O-N 2.97Å; K1076-L1080 VanDerWaalsContact O-N 3.15Å; V1078-L1080 VanDerWaalsContact C-N 3.3Å; V1078-L1080 PolarHBondContact O-N 2.77Å
1081	L	90.2	Very high	91.4	Very high	13 Å²	13	46.7 Å²	46.7	7%	0.068	26%	0.259	C	S	.	.	H	α-helix	trans	-113.6	-32.1	173.7	-70.1	175.8	0	0	0	113.9	V1078 Q1079 I1085 N1109 L1110 L1113 V1133	V1078-L1081 CarbonylContact O-C 3.58Å; V1078-L1081 WeakPolarHBondContact O-CA 3.32Å; V1078-L1081 PolarHBondContact O-N 2.71Å; Q1079-L1081 PolarHBondContact O-N 3.43Å; L1081-I1085 VanDerWaalsContact O-CD1 3.23Å; L1081-I1085 WeakPolarHBondContact O-CD1 3.47Å; L1081-I1085 VanDerWaalsContact O-CG1 3.26Å; L1081-I1085 WeakPolarHBondContact O-CG1 3.39Å; L1081-N1109 HydrophobicContact CD2-CB 4.32Å; L1081-L1110 HydrophobicContact CD1-CD2 3.7Å; L1081-L1110 HydrophobicContact CD2-CD2 4.17Å; L1081-L1110 HydrophobicContact CG-CD2 4.38Å; L1081-L1113 HydrophobicContact CD1-CB 4.15Å; L1081-L1113 HydrophobicContact CD1-CD2 3.36Å; L1081-L1113 HydrophobicContact CD1-CG 4.31Å; L1081-L1113 HydrophobicContact CD2-CB 4.15Å; L1081-L1113 HydrophobicContact CG-CB 4.39Å; L1081-L1113 HydrophobicContact CG-CD2 3.88Å; L1081-V1133 HydrophobicContact CB-CB 4.44Å; L1081-V1133 HydrophobicContact CB-CG1 3.8Å; L1081-V1133 HydrophobicContact CB-CG2 3.7Å; L1081-V1133 HydrophobicContact CD1-CG1 4.39Å; L1081-V1133 HydrophobicContact CD1-CG2 3.98Å
1082	S	92.7	Very high	91.1	Very high	16 Å²	16	42.3 Å²	42.3	11%	0.112	24%	0.239	C	C	.	.	H	α-helix	trans	-75.3	-42.6	177.1	52.7	0	0	0	0	113.4	V1078 Q1079 P1084 I1085	V1078-S1082 PolarHBondContact O-N 3.35Å; V1078-S1082 PolarHBondContact O-OG 2.85Å; Q1079-S1082 VanDerWaalsContact CA-OG 3.27Å; Q1079-S1082 WeakPolarHBondContact CA-OG 3.47Å; Q1079-S1082 PolarHBondContact O-N 3.35Å; S1082-P1084 VanDerWaalsContact C-CD 3.47Å; S1082-P1084 VanDerWaalsContact C-N 3.29Å; S1082-I1085 WeakPolarHBondContact O-CB 3.35Å; S1082-I1085 PolarHBondContact O-N 3.19Å
1083	D	92.2	Very high	90.5	Very high	87 Å²	87	42.9 Å²	42.9	47%	0.465	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-32.3	-171.4	-54.9	-2.1	0	0	0	112.6	Q1079 P1087	Q1079-D1083 WeakPolarHBondContact CA-OD1 3.17Å; Q1079-D1083 WeakPolarHBondContact CG-OD1 3.43Å; Q1079-D1083 VanDerWaalsContact O-CB 3.26Å; Q1079-D1083 WeakPolarHBondContact O-CB 3.44Å; Q1079-D1083 PolarHBondContact O-N 3.32Å; D1083-P1087 WeakPolarHBondContact O-CD 3.45Å; D1083-P1087 WeakPolarHBondContact O-CG 3.39Å
1084	P	89.2	Confident	89.7	Confident	53 Å²	53	43 Å²	43	34%	0.344	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-23.8	170.9	-20	34.1	0	0	0	115.9	S1082 P1087 M1088	S1082-P1084 VanDerWaalsContact C-CD 3.47Å; S1082-P1084 VanDerWaalsContact C-N 3.29Å; P1084-P1087 WeakPolarHBondContact O-CD 3.48Å; P1084-M1088 HydrophobicContact CB-CE 4.07Å; P1084-M1088 HydrophobicContact CB-SD 4.41Å; P1084-M1088 WeakPolarHBondContact O-CB 3.4Å; P1084-M1088 VanDerWaalsContact O-CG 3.28Å; P1084-M1088 WeakPolarHBondContact O-CG 3.45Å; P1084-M1088 PolarHBondContact O-N 2.97Å
1085	I	91.8	Very high	89	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-67.9	-48.2	-167.3	-73.9	171.9	0	0	0	111.8	L1081 S1082 M1088 F1089 I1106 V1133 L1137 Q1140	L1081-I1085 VanDerWaalsContact O-CD1 3.23Å; L1081-I1085 WeakPolarHBondContact O-CD1 3.47Å; L1081-I1085 VanDerWaalsContact O-CG1 3.26Å; L1081-I1085 WeakPolarHBondContact O-CG1 3.39Å; S1082-I1085 WeakPolarHBondContact O-CB 3.35Å; S1082-I1085 PolarHBondContact O-N 3.19Å; I1085-M1088 PolarHBondContact O-N 3.39Å; I1085-M1088 VanDerWaalsContact O-N 3.17Å; I1085-F1089 HydrophobicContact CG2-CD2 3.53Å; I1085-F1089 HydrophobicContact CG2-CE2 3.45Å; I1085-F1089 VanDerWaalsContact CG2-CE2 3.45Å; I1085-F1089 WeakPolarHBondContact O-CD2 3.33Å; I1085-F1089 PolarHBondContact O-N 3.01Å; I1085-I1106 HydrophobicContact CD1-CG2 4.35Å; I1085-I1106 HydrophobicContact CG1-CD1 4.18Å; I1085-I1106 HydrophobicContact CG1-CG1 4.19Å; I1085-I1106 HydrophobicContact CG1-CG2 4.38Å; I1085-I1106 HydrophobicContact CG2-CD1 4.31Å; I1085-V1133 HydrophobicContact CD1-CG1 3.9Å; I1085-L1137 HydrophobicContact CD1-CB 4.36Å; I1085-Q1140 HydrophobicContact CG2-CB 3.98Å; I1085-Q1140 HydrophobicContact CG2-CG 4.09Å
1086	G	90.1	Very high	88.4	Confident	18 Å²	18	50.8 Å²	50.8	19%	0.186	27%	0.271	C	S	.	.	H	α-helix	trans	-57.1	-52.1	176.2	0	0	0	0	0	112.9	M1088 F1089 S1090	G1086-M1088 VanDerWaalsContact C-N 3.3Å; G1086-M1088 PolarHBondContact O-N 3.15Å; G1086-F1089 PolarHBondContact O-N 2.88Å; G1086-F1089 VanDerWaalsContact O-N 3.15Å; G1086-S1090 PolarHBondContact O-N 2.9Å
1087	P	89.2	Confident	88	Confident	87 Å²	87	52 Å²	52	57%	0.565	29%	0.287	S	S	*	.	H	α-helix	trans	-55.6	-38.1	172.2	-29.2	36.2	0	0	0	114.3	D1083 P1084 S1090	D1083-P1087 WeakPolarHBondContact O-CD 3.45Å; D1083-P1087 WeakPolarHBondContact O-CG 3.39Å; P1084-P1087 WeakPolarHBondContact O-CD 3.48Å; P1087-S1090 PolarHBondContact O-OG 3.15Å
1088	M	89	Confident	87.6	Confident	49 Å²	49	55.2 Å²	55.2	24%	0.241	30%	0.303	C	S	.	.	H	α-helix	trans	-66.1	-42.1	174.8	-74.7	175.4	-178.2	0	0	112.1	P1084 I1085 G1086 E1105 I1106	P1084-M1088 HydrophobicContact CB-CE 4.07Å; P1084-M1088 HydrophobicContact CB-SD 4.41Å; P1084-M1088 WeakPolarHBondContact O-CB 3.4Å; P1084-M1088 VanDerWaalsContact O-CG 3.28Å; P1084-M1088 WeakPolarHBondContact O-CG 3.45Å; P1084-M1088 PolarHBondContact O-N 2.97Å; I1085-M1088 PolarHBondContact O-N 3.39Å; I1085-M1088 VanDerWaalsContact O-N 3.17Å; G1086-M1088 VanDerWaalsContact C-N 3.3Å; G1086-M1088 PolarHBondContact O-N 3.15Å; M1088-E1105 HydrophobicContact CE-CG 3.63Å; M1088-E1105 HydrophobicContact SD-CG 4.2Å; M1088-I1106 HydrophobicContact SD-CG1 3.73Å
1089	F	89.1	Confident	87.3	Confident	3 Å²	3	56.7 Å²	56.7	1%	0.013	31%	0.313	C	S	.	.	H	α-helix	trans	-72.6	-23.6	178	-75.8	-54.1	0	0	0	114.5	I1085 G1086 N1091 W1092 M1103 I1106 L1137 Q1140 L1141 R1144	I1085-F1089 HydrophobicContact CG2-CD2 3.53Å; I1085-F1089 HydrophobicContact CG2-CE2 3.45Å; I1085-F1089 VanDerWaalsContact CG2-CE2 3.45Å; I1085-F1089 WeakPolarHBondContact O-CD2 3.33Å; I1085-F1089 PolarHBondContact O-N 3.01Å; G1086-F1089 PolarHBondContact O-N 2.88Å; G1086-F1089 VanDerWaalsContact O-N 3.15Å; F1089-N1091 PolarHBondContact O-N 3.25Å; F1089-W1092 HydrophobicContact CD1-CB 3.85Å; F1089-W1092 AromaticContact CD1-CD2 3.87Å; F1089-W1092 HydrophobicContact CD1-CD2 3.87Å; F1089-W1092 HydrophobicContact CD1-CE3 4.09Å; F1089-W1092 AromaticContact CD1-CG 3.8Å; F1089-W1092 HydrophobicContact CD1-CG 3.8Å; F1089-W1092 HydrophobicContact CE1-CD2 4.14Å; F1089-W1092 HydrophobicContact CE1-CE3 4.5Å; F1089-W1092 HydrophobicContact CE1-CG 4.25Å; F1089-W1092 WeakPolarHBondContact O-CB 3.48Å; F1089-W1092 PolarHBondContact O-N 3.02Å; F1089-M1103 HydrophobicContact CE1-CE 4.44Å; F1089-M1103 HydrophobicContact CZ-CE 4.33Å; F1089-I1106 HydrophobicContact CE1-CD1 4.36Å; F1089-I1106 HydrophobicContact CE2-CD1 3.96Å; F1089-I1106 HydrophobicContact CZ-CD1 3.82Å; F1089-L1137 HydrophobicContact CE2-CD1 4.25Å; F1089-L1137 HydrophobicContact CE2-CG 4.03Å; F1089-L1137 HydrophobicContact CZ-CD1 4.19Å; F1089-L1137 HydrophobicContact CZ-CG 4.18Å; F1089-Q1140 HydrophobicContact CD2-CB 3.88Å; F1089-Q1140 HydrophobicContact CE2-CB 4.39Å; F1089-L1141 HydrophobicContact CE1-CD1 4.08Å; F1089-L1141 HydrophobicContact CE2-CB 4.38Å; F1089-L1141 HydrophobicContact CZ-CB 4.38Å; F1089-L1141 HydrophobicContact CZ-CD1 4.31Å; F1089-R1144 HydrophobicContact CB-CB 4.4Å; F1089-R1144 HydrophobicContact CB-CG 4.43Å; F1089-R1144 WeakPolarHBondContact O-CD 3.5Å; F1089-R1144 PolarHBondContact O-NE 2.92Å
1090	S	85.7	Confident	87.2	Confident	55 Å²	55	54 Å²	54	39%	0.385	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-29.9	177.7	72	0	0	0	0	114.7	G1086 P1087 R1144	G1086-S1090 PolarHBondContact O-N 2.9Å; P1087-S1090 PolarHBondContact O-OG 3.15Å; S1090-R1144 PolarHBondContact O-NH1 3.18Å; S1090-R1144 PolarHBondContact O-NH2 2.87Å
1091	N	82.3	Confident	87.1	Confident	132 Å²	132	60.2 Å²	60.2	71%	0.706	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	17.1	177.6	-71.6	-78.2	0	0	0	112.4	F1089 Q1102	F1089-N1091 PolarHBondContact O-N 3.25Å; N1091-Q1102 PolarHBondContact O-NE2 3.28Å
1092	W	88.2	Confident	87.2	Confident	1 Å²	1	62 Å²	62	0%	0.004	33%	0.327	C	S	.	.			trans	-90.2	153.7	175	178.9	83.8	0	0	0	111.6	F1089 S1100 Q1102 L1141 R1144 I1161 E1164	F1089-W1092 HydrophobicContact CD1-CB 3.85Å; F1089-W1092 AromaticContact CD1-CD2 3.87Å; F1089-W1092 HydrophobicContact CD1-CD2 3.87Å; F1089-W1092 HydrophobicContact CD1-CE3 4.09Å; F1089-W1092 AromaticContact CD1-CG 3.8Å; F1089-W1092 HydrophobicContact CD1-CG 3.8Å; F1089-W1092 HydrophobicContact CE1-CD2 4.14Å; F1089-W1092 HydrophobicContact CE1-CE3 4.5Å; F1089-W1092 HydrophobicContact CE1-CG 4.25Å; F1089-W1092 WeakPolarHBondContact O-CB 3.48Å; F1089-W1092 PolarHBondContact O-N 3.02Å; W1092-S1100 VanDerWaalsContact CD1-OG 3.3Å; W1092-S1100 PolarHBondContact NE1-OG 2.81Å; W1092-Q1102 HydrophobicContact CB-CB 4.46Å; W1092-Q1102 HydrophobicContact CB-CG 4.23Å; W1092-L1141 HydrophobicContact CE3-CD1 4.28Å; W1092-L1141 HydrophobicContact CH2-CD1 3.54Å; W1092-L1141 HydrophobicContact CZ2-CD1 4.3Å; W1092-L1141 HydrophobicContact CZ3-CD1 3.55Å; W1092-R1144 HydrophobicContact CE3-CG 3.96Å; W1092-R1144 HydrophobicContact CZ3-CG 4.47Å; W1092-R1144 PolarHBondContact O-NE 3.01Å; W1092-R1144 PolarHBondContact O-NH2 3.49Å; W1092-I1161 HydrophobicContact CH2-CG1 3.99Å; W1092-I1161 HydrophobicContact CH2-CG2 4.45Å; W1092-E1164 HydrophobicContact CZ2-CB 4.47Å; W1092-E1164 HydrophobicContact CZ2-CG 4.21Å
1093	Y	82.6	Confident	87.1	Confident	71 Å²	71	61.3 Å²	61.3	28%	0.278	32%	0.322	S	S	.	.			trans	-159.7	135.7	174.4	-171.8	-75.1	0	0	0	108.1	R1095 L1148	Y1093-R1095 HydrophobicContact CD1-CB 4.34Å; Y1093-R1095 HydrophobicContact CD1-CG 3.63Å; Y1093-R1095 HydrophobicContact CE1-CG 3.8Å; Y1093-R1095 PolarHBondContact O-N 3.36Å; Y1093-L1148 HydrophobicContact CD2-CD1 3.77Å; Y1093-L1148 HydrophobicContact CD2-CD2 3.87Å; Y1093-L1148 HydrophobicContact CD2-CG 4.45Å; Y1093-L1148 HydrophobicContact CE2-CD1 4.3Å; Y1093-L1148 HydrophobicContact CE2-CD2 4.18Å; Y1093-L1148 HydrophobicContact CG-CD1 4.44Å
1094	G	77.7	Confident	87.1	Confident	3 Å²	3	59.1 Å²	59.1	3%	0.031	31%	0.31	C	S	.	.	S	Bend	trans	-66.7	93.7	177.6	0	0	0	0	0	113
1095	R	81.1	Confident	87.2	Confident	156 Å²	156	59.6 Å²	59.6	59%	0.589	31%	0.308	S	S	*	.			trans	-144.5	148.1	175.5	-87.3	167.8	-158.2	-179.7	8.9	109.9	Y1093	Y1093-R1095 HydrophobicContact CD1-CB 4.34Å; Y1093-R1095 HydrophobicContact CD1-CG 3.63Å; Y1093-R1095 HydrophobicContact CE1-CG 3.8Å; Y1093-R1095 PolarHBondContact O-N 3.36Å
1096	P	80.8	Confident	87.2	Confident	93 Å²	93	59.7 Å²	59.7	60%	0.604	31%	0.308	S	S	*	.	S	Bend	trans	-56.5	149.9	170.8	-24.4	34.7	0	0	0	112.7	L1160	P1096-L1160 HydrophobicContact CG-CD2 3.86Å
1097	P	85.4	Confident	87.4	Confident	101 Å²	101	58.9 Å²	58.9	66%	0.656	30%	0.3	S	S	*	.	S	Bend	cis	-74.7	149.6	1.9	32.2	-36.4	0	0	0	113.1	P1099 S1100	P1097-P1099 CarbonylContact O-C 3.28Å; P1097-P1099 VanDerWaalsContact O-C 3.28Å; P1097-S1100 PolarHBondContact O-N 2.93Å
1098	I	85.1	Confident	87.6	Confident	67 Å²	67	59.9 Å²	59.9	34%	0.344	29%	0.293	S	S	.	.	S	Bend	trans	-100	131.8	167.3	-64.6	154.4	0	0	0	107.4	L1160 E1164	I1098-L1160 HydrophobicContact CD1-CD2 3.69Å; I1098-E1164 WeakPolarHBondContact CA-OE1 3.36Å; I1098-E1164 HydrophobicContact CG1-CG 4.46Å; I1098-E1164 WeakPolarHBondContact CG1-OE1 3.16Å
1099	P	88.2	Confident	87.7	Confident	38 Å²	38	59.4 Å²	59.4	25%	0.247	29%	0.291	C	S	.	.	S	Bend	cis	-70.7	147.3	-6	32.5	-38.3	0	0	0	112.9	P1097 D1104 E1164 Y1167	P1097-P1099 CarbonylContact O-C 3.28Å; P1097-P1099 VanDerWaalsContact O-C 3.28Å; P1099-D1104 HydrophobicContact CB-CB 4.18Å; P1099-D1104 HydrophobicContact CG-CB 4.05Å; P1099-E1164 VanDerWaalsContact CA-OE1 3.31Å; P1099-E1164 WeakPolarHBondContact CA-OE1 3.32Å; P1099-Y1167 HydrophobicContact CB-CD1 3.59Å; P1099-Y1167 HydrophobicContact CB-CD2 4.31Å; P1099-Y1167 HydrophobicContact CB-CE1 3.59Å; P1099-Y1167 HydrophobicContact CB-CE2 4.31Å; P1099-Y1167 HydrophobicContact CB-CG 3.97Å; P1099-Y1167 HydrophobicContact CG-CD1 4.19Å; P1099-Y1167 HydrophobicContact CG-CD2 4.27Å; P1099-Y1167 HydrophobicContact CG-CE1 3.79Å; P1099-Y1167 HydrophobicContact CG-CE2 3.88Å; P1099-Y1167 HydrophobicContact CG-CG 4.41Å
1100	S	89.9	Confident	87.9	Confident	7 Å²	7	59.3 Å²	59.3	5%	0.049	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-62.2	150	169.2	68	0	0	0	0	110.7	W1092 P1097 Q1102 M1103 D1104 E1164	W1092-S1100 VanDerWaalsContact CD1-OG 3.3Å; W1092-S1100 PolarHBondContact NE1-OG 2.81Å; P1097-S1100 PolarHBondContact O-N 2.93Å; S1100-Q1102 PolarHBondContact O-N 3.33Å; S1100-Q1102 VanDerWaalsContact O-N 3.1Å; S1100-M1103 PolarHBondContact O-N 3.04Å; S1100-M1103 VanDerWaalsContact O-N 3.12Å; S1100-M1103 WeakPolarHBondContact OG-CB 3.46Å; S1100-M1103 PolarHBondContact OG-N 3.08Å; S1100-D1104 VanDerWaalsContact O-CB 3.3Å; S1100-D1104 WeakPolarHBondContact O-CB 3.49Å; S1100-D1104 PolarHBondContact O-N 3.32Å; S1100-E1164 WeakPolarHBondContact CB-OE2 3.25Å; S1100-E1164 VanDerWaalsContact N-CD 3.33Å; S1100-E1164 PolarHBondContact N-OE1 3.45Å; S1100-E1164 PolarHBondContact N-OE2 3.49Å; S1100-E1164 VanDerWaalsContact N-OE2 3.12Å; S1100-E1164 PolarHBondContact OG-OE2 3.26Å
1101	R	89.6	Confident	88.3	Confident	211 Å²	211	58.9 Å²	58.9	80%	0.796	29%	0.287	S	S	*	.	H	α-helix	trans	-56.5	-31.7	-178.6	-68.5	-178.2	177.4	174.8	-0.5	112.8	E1105	R1101-E1105 WeakPolarHBondContact O-CB 3.4Å; R1101-E1105 PolarHBondContact O-N 3.41Å
1102	Q	91.1	Very high	88.8	Confident	51 Å²	51	58.7 Å²	58.7	24%	0.238	28%	0.28	C	S	.	.	H	α-helix	trans	-73.6	-47.7	178.6	-59.1	85.5	-27.9	0	0	111.1	N1091 W1092 S1100 E1105 I1106	N1091-Q1102 PolarHBondContact O-NE2 3.28Å; W1092-Q1102 HydrophobicContact CB-CB 4.46Å; W1092-Q1102 HydrophobicContact CB-CG 4.23Å; S1100-Q1102 PolarHBondContact O-N 3.33Å; S1100-Q1102 VanDerWaalsContact O-N 3.1Å; Q1102-E1105 PolarHBondContact O-N 2.75Å; Q1102-I1106 WeakPolarHBondContact O-CG1 3.24Å; Q1102-I1106 PolarHBondContact O-N 2.93Å
1103	M	90.8	Very high	88.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-42.5	178.8	-169.3	65.6	90.5	0	0	111.6	F1089 S1100 I1106 C1107 L1137 E1164 Y1168	F1089-M1103 HydrophobicContact CE1-CE 4.44Å; F1089-M1103 HydrophobicContact CZ-CE 4.33Å; S1100-M1103 PolarHBondContact O-N 3.04Å; S1100-M1103 VanDerWaalsContact O-N 3.12Å; S1100-M1103 WeakPolarHBondContact OG-CB 3.46Å; S1100-M1103 PolarHBondContact OG-N 3.08Å; M1103-I1106 PolarHBondContact O-N 3.37Å; M1103-C1107 WeakPolarHBondContact O-CB 3.35Å; M1103-C1107 PolarHBondContact O-N 2.94Å; M1103-C1107 PolarHBondContact O-SG 2.61Å; M1103-L1137 HydrophobicContact SD-CD1 4.42Å; M1103-E1164 VanDerWaalsContact CB-OE2 3.27Å; M1103-E1164 WeakPolarHBondContact CB-OE2 3.25Å; M1103-E1164 HydrophobicContact CE-CB 4.16Å; M1103-Y1168 HydrophobicContact SD-CD2 3.9Å; M1103-Y1168 HydrophobicContact SD-CG 3.97Å
1104	D	91.7	Very high	89.2	Confident	42 Å²	42	56.6 Å²	56.6	23%	0.225	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-38	173.4	172.4	35.1	0	0	0	112.3	P1099 S1100 C1107 R1108	P1099-D1104 HydrophobicContact CB-CB 4.18Å; P1099-D1104 HydrophobicContact CG-CB 4.05Å; S1100-D1104 VanDerWaalsContact O-CB 3.3Å; S1100-D1104 WeakPolarHBondContact O-CB 3.49Å; S1100-D1104 PolarHBondContact O-N 3.32Å; D1104-C1107 PolarHBondContact O-N 2.73Å; D1104-R1108 PolarHBondContact O-N 2.98Å; D1104-R1108 IonicContact OD1-CZ 2.69Å; D1104-R1108 IonicContact OD1-NH1 2.69Å; D1104-R1108 PolarHBondContact OD1-NH1 3.18Å; D1104-R1108 IonicContact OD2-CZ 3.84Å; D1104-R1108 IonicContact OD2-NH1 3.57Å; D1104-R1108 PolarHBondContact OD2-NH1 2.62Å; D1104-R1108 IonicContact OD2-NH2 3.05Å; D1104-R1108 PolarHBondContact OD2-NH2 3.45Å
1105	E	91.2	Very high	89.8	Confident	63 Å²	63	58.9 Å²	58.9	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-69.3	-36.9	173	-174.6	58.4	-155.5	0	0	113.1	M1088 R1101 Q1102 R1108 N1109	M1088-E1105 HydrophobicContact CE-CG 3.63Å; M1088-E1105 HydrophobicContact SD-CG 4.2Å; R1101-E1105 WeakPolarHBondContact O-CB 3.4Å; R1101-E1105 PolarHBondContact O-N 3.41Å; Q1102-E1105 PolarHBondContact O-N 2.75Å; E1105-R1108 PolarHBondContact O-N 3.26Å; E1105-R1108 IonicContact OE2-CZ 3.85Å; E1105-R1108 IonicContact OE2-NE 3.19Å; E1105-R1108 PolarHBondContact OE2-NE 3.41Å; E1105-R1108 IonicContact OE2-NH2 2.64Å; E1105-R1108 PolarHBondContact OE2-NH2 3.19Å; E1105-N1109 PolarHBondContact O-N 3.21Å; E1105-N1109 PolarHBondContact O-ND2 2.85Å; E1105-N1109 PolarHBondContact OE1-ND2 3Å
1106	I	92.1	Very high	90.2	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-61.6	-49.3	170.6	-67.2	167.2	0	0	0	109.5	I1085 M1088 F1089 Q1102 M1103 R1108 N1109 L1110 L1137	I1085-I1106 HydrophobicContact CD1-CG2 4.35Å; I1085-I1106 HydrophobicContact CG1-CD1 4.18Å; I1085-I1106 HydrophobicContact CG1-CG1 4.19Å; I1085-I1106 HydrophobicContact CG1-CG2 4.38Å; I1085-I1106 HydrophobicContact CG2-CD1 4.31Å; M1088-I1106 HydrophobicContact SD-CG1 3.73Å; F1089-I1106 HydrophobicContact CE1-CD1 4.36Å; F1089-I1106 HydrophobicContact CE2-CD1 3.96Å; F1089-I1106 HydrophobicContact CZ-CD1 3.82Å; Q1102-I1106 WeakPolarHBondContact O-CG1 3.24Å; Q1102-I1106 PolarHBondContact O-N 2.93Å; M1103-I1106 PolarHBondContact O-N 3.37Å; I1106-R1108 VanDerWaalsContact C-N 3.33Å; I1106-R1108 PolarHBondContact O-N 3.48Å; I1106-N1109 PolarHBondContact O-N 3.27Å; I1106-L1110 HydrophobicContact CG2-CG 4.47Å; I1106-L1110 WeakPolarHBondContact O-CG 3.16Å; I1106-L1110 PolarHBondContact O-N 3.31Å; I1106-L1137 HydrophobicContact CD1-CD1 4.21Å; I1106-L1137 HydrophobicContact CG2-CD1 3.84Å
1107	C	93.9	Very high	90.7	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.007	26%	0.261	C	S	.	.	H	α-helix	trans	-56	-44.4	177.8	-70.6	0	0	0	0	112.2	M1103 D1104 S1111 Y1167 H1171	M1103-C1107 WeakPolarHBondContact O-CB 3.35Å; M1103-C1107 PolarHBondContact O-N 2.94Å; M1103-C1107 PolarHBondContact O-SG 2.61Å; D1104-C1107 PolarHBondContact O-N 2.73Å; C1107-S1111 PolarHBondContact O-N 2.89Å; C1107-S1111 VanDerWaalsContact O-N 3.16Å; C1107-S1111 PolarHBondContact O-OG 3.09Å; C1107-Y1167 HydrophobicContact CB-CE1 4.47Å; C1107-H1171 WeakPolarHBondContact CB-CD2 3.4Å; C1107-H1171 PolarHBondContact O-NE2 2.9Å
1108	R	93.5	Very high	90.9	Very high	109 Å²	109	53.2 Å²	53.2	41%	0.411	26%	0.26	S	S	.	.	H	α-helix	trans	-59.4	-46.2	171.7	-82.6	-168.6	-70.7	-85.3	-3.5	112.8	D1104 E1105 I1106 S1111 K1112	D1104-R1108 PolarHBondContact O-N 2.98Å; D1104-R1108 IonicContact OD1-CZ 2.69Å; D1104-R1108 IonicContact OD1-NH1 2.69Å; D1104-R1108 PolarHBondContact OD1-NH1 3.18Å; D1104-R1108 IonicContact OD2-CZ 3.84Å; D1104-R1108 IonicContact OD2-NH1 3.57Å; D1104-R1108 PolarHBondContact OD2-NH1 2.62Å; D1104-R1108 IonicContact OD2-NH2 3.05Å; D1104-R1108 PolarHBondContact OD2-NH2 3.45Å; E1105-R1108 PolarHBondContact O-N 3.26Å; E1105-R1108 IonicContact OE2-CZ 3.85Å; E1105-R1108 IonicContact OE2-NE 3.19Å; E1105-R1108 PolarHBondContact OE2-NE 3.41Å; E1105-R1108 IonicContact OE2-NH2 2.64Å; E1105-R1108 PolarHBondContact OE2-NH2 3.19Å; I1106-R1108 VanDerWaalsContact C-N 3.33Å; I1106-R1108 PolarHBondContact O-N 3.48Å; R1108-S1111 PolarHBondContact O-N 3.12Å; R1108-K1112 WeakPolarHBondContact O-CB 3.47Å; R1108-K1112 PolarHBondContact O-N 3.2Å
1109	N	92.2	Very high	91	Very high	39 Å²	39	57.4 Å²	57.4	21%	0.209	28%	0.278	C	S	.	.	H	α-helix	trans	-68.9	-34.9	-176.7	-76.5	-60.8	0	0	0	112.6	L1081 E1105 I1106 K1112 L1113	L1081-N1109 HydrophobicContact CD2-CB 4.32Å; E1105-N1109 PolarHBondContact O-N 3.21Å; E1105-N1109 PolarHBondContact O-ND2 2.85Å; E1105-N1109 PolarHBondContact OE1-ND2 3Å; I1106-N1109 PolarHBondContact O-N 3.27Å; N1109-K1112 PolarHBondContact O-N 3.21Å; N1109-L1113 PolarHBondContact O-N 3.2Å
1110	L	93.7	Very high	91.1	Very high	1 Å²	1	56 Å²	56	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-57.1	-56.9	168.1	-64.4	-177	0	0	0	111	L1081 I1106 K1112 L1113 I1114 L1130 V1133 Y1168 F1172 L1175	L1081-L1110 HydrophobicContact CD1-CD2 3.7Å; L1081-L1110 HydrophobicContact CD2-CD2 4.17Å; L1081-L1110 HydrophobicContact CG-CD2 4.38Å; I1106-L1110 HydrophobicContact CG2-CG 4.47Å; I1106-L1110 WeakPolarHBondContact O-CG 3.16Å; I1106-L1110 PolarHBondContact O-N 3.31Å; L1110-K1112 PolarHBondContact O-N 3.12Å; L1110-L1113 PolarHBondContact O-N 3.42Å; L1110-I1114 WeakPolarHBondContact O-CD1 3.27Å; L1110-I1114 WeakPolarHBondContact O-CG1 3.37Å; L1110-I1114 PolarHBondContact O-N 3.46Å; L1110-I1114 VanDerWaalsContact O-N 3.1Å; L1110-L1130 HydrophobicContact CD2-CD2 4.1Å; L1110-V1133 HydrophobicContact CD2-CG1 3.81Å; L1110-Y1168 HydrophobicContact CD1-CE2 3.89Å; L1110-F1172 HydrophobicContact CD1-CD2 4.23Å; L1110-L1175 HydrophobicContact CB-CD1 3.91Å; L1110-L1175 HydrophobicContact CD1-CD1 3.9Å
1111	S	93.8	Very high	91.3	Very high	45 Å²	45	56 Å²	56	32%	0.315	27%	0.267	S	S	.	.	H	α-helix	trans	-58.9	-35.1	-179.9	-61.1	0	0	0	0	112.8	C1107 R1108 G1115 H1171	C1107-S1111 PolarHBondContact O-N 2.89Å; C1107-S1111 VanDerWaalsContact O-N 3.16Å; C1107-S1111 PolarHBondContact O-OG 3.09Å; R1108-S1111 PolarHBondContact O-N 3.12Å; S1111-G1115 PolarHBondContact O-N 2.84Å; S1111-H1171 PolarHBondContact OG-CE1 2.71Å; S1111-H1171 PolarHBondContact OG-NE2 3.07Å
1112	K	92.2	Very high	91.3	Very high	128 Å²	128	47.3 Å²	47.3	56%	0.557	24%	0.238	S	C	*	.	H	α-helix	trans	-68.2	-43.7	177.5	-174.1	178.4	-178.4	-179.2	0	112.3	R1108 N1109 L1110 G1115 M1116	R1108-K1112 WeakPolarHBondContact O-CB 3.47Å; R1108-K1112 PolarHBondContact O-N 3.2Å; N1109-K1112 PolarHBondContact O-N 3.21Å; L1110-K1112 PolarHBondContact O-N 3.12Å; K1112-G1115 PolarHBondContact O-N 3.1Å; K1112-M1116 VanDerWaalsContact O-CG 3.31Å; K1112-M1116 WeakPolarHBondContact O-CG 3.44Å; K1112-M1116 PolarHBondContact O-N 2.87Å; K1112-M1116 VanDerWaalsContact O-N 3.07Å
1113	L	89.9	Confident	91.2	Very high	17 Å²	17	47.9 Å²	47.9	9%	0.089	25%	0.247	C	C	.	.	H	α-helix	trans	-61.4	-46.6	174	-170.6	80.6	0	0	0	110.6	A995 L1081 N1109 L1110 M1116 T1117 I1129	A995-L1113 HydrophobicContact CB-CD1 3.38Å; L1081-L1113 HydrophobicContact CD1-CB 4.15Å; L1081-L1113 HydrophobicContact CD1-CD2 3.36Å; L1081-L1113 HydrophobicContact CD1-CG 4.31Å; L1081-L1113 HydrophobicContact CD2-CB 4.15Å; L1081-L1113 HydrophobicContact CG-CB 4.39Å; L1081-L1113 HydrophobicContact CG-CD2 3.88Å; N1109-L1113 PolarHBondContact O-N 3.2Å; L1110-L1113 PolarHBondContact O-N 3.42Å; L1113-M1116 PolarHBondContact O-N 3.25Å; L1113-T1117 WeakPolarHBondContact O-CB 3.43Å; L1113-T1117 WeakPolarHBondContact O-CG2 3.45Å; L1113-T1117 PolarHBondContact O-N 3Å; L1113-T1117 VanDerWaalsContact O-N 3.1Å; L1113-T1117 PolarHBondContact O-OG1 3Å; L1113-I1129 HydrophobicContact CD2-CG2 4.48Å
1114	I	90.5	Very high	91.1	Very high	12 Å²	12	54.4 Å²	54.4	6%	0.062	28%	0.275	C	S	.	.	H	α-helix	trans	-62.3	-47.8	179.6	-62.4	153.6	0	0	0	110.1	L1110 M1116 T1117 K1118 L1130 L1175	L1110-I1114 WeakPolarHBondContact O-CD1 3.27Å; L1110-I1114 WeakPolarHBondContact O-CG1 3.37Å; L1110-I1114 PolarHBondContact O-N 3.46Å; L1110-I1114 VanDerWaalsContact O-N 3.1Å; I1114-M1116 PolarHBondContact O-N 3.41Å; I1114-T1117 PolarHBondContact O-N 3.21Å; I1114-K1118 HydrophobicContact CG2-CB 4.27Å; I1114-K1118 WeakPolarHBondContact O-CB 3.31Å; I1114-K1118 PolarHBondContact O-N 3.22Å; I1114-L1130 HydrophobicContact CD1-CD1 3.84Å; I1114-L1130 HydrophobicContact CD1-CD2 3.97Å; I1114-L1130 HydrophobicContact CD1-CG 4.49Å; I1114-L1130 HydrophobicContact CG1-CD1 4.22Å; I1114-L1130 HydrophobicContact CG1-CD2 4.35Å; I1114-L1175 HydrophobicContact CD1-CB 3.58Å; I1114-L1175 HydrophobicContact CD1-CD1 3.85Å; I1114-L1175 HydrophobicContact CD1-CD2 3.7Å; I1114-L1175 HydrophobicContact CD1-CG 3.88Å
1115	G	89.7	Confident	91.1	Very high	51 Å²	51	53.5 Å²	53.5	53%	0.526	27%	0.271	S	S	.	.	H	α-helix	trans	-55.6	-36.3	176.3	0	0	0	0	0	113.2	S1111 K1112	S1111-G1115 PolarHBondContact O-N 2.84Å; K1112-G1115 PolarHBondContact O-N 3.1Å
1116	M	89.2	Confident	91.2	Very high	86 Å²	86	51 Å²	51	42%	0.424	26%	0.259	S	S	.	.	H	α-helix	trans	-76.9	-18.3	176.3	-69.8	-179.7	68.8	0	0	114.8	K1112 L1113 I1114	K1112-M1116 VanDerWaalsContact O-CG 3.31Å; K1112-M1116 WeakPolarHBondContact O-CG 3.44Å; K1112-M1116 PolarHBondContact O-N 2.87Å; K1112-M1116 VanDerWaalsContact O-N 3.07Å; L1113-M1116 PolarHBondContact O-N 3.25Å; I1114-M1116 PolarHBondContact O-N 3.41Å
1117	T	92	Very high	91.2	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-124.5	-14.2	-168.8	57.3	0	0	0	0	115.3	A995 A999 L1113 I1114 H1119 V1120 L1121 L1126	A995-T1117 HydrophobicContact CB-CG2 4.38Å; A999-T1117 HydrophobicContact CB-CG2 3.87Å; L1113-T1117 WeakPolarHBondContact O-CB 3.43Å; L1113-T1117 WeakPolarHBondContact O-CG2 3.45Å; L1113-T1117 PolarHBondContact O-N 3Å; L1113-T1117 VanDerWaalsContact O-N 3.1Å; L1113-T1117 PolarHBondContact O-OG1 3Å; I1114-T1117 PolarHBondContact O-N 3.21Å; T1117-H1119 PolarHBondContact O-N 3.34Å; T1117-H1119 VanDerWaalsContact O-N 3.12Å; T1117-V1120 PolarHBondContact O-N 3.16Å; T1117-L1121 PolarHBondContact O-N 3.16Å; T1117-L1126 WeakPolarHBondContact OG1-CD2 3.41Å
1118	K	88	Confident	91.2	Very high	144 Å²	144	54.1 Å²	54.1	63%	0.626	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.1	-178.7	178.4	175.6	177.7	179.1	0	115	I1114 V1120	I1114-K1118 HydrophobicContact CG2-CB 4.27Å; I1114-K1118 WeakPolarHBondContact O-CB 3.31Å; I1114-K1118 PolarHBondContact O-N 3.22Å; K1118-V1120 VanDerWaalsContact C-N 3.32Å
1119	H	87.2	Confident	91.2	Very high	155 Å²	155	49.1 Å²	49.1	72%	0.718	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	7.9	177.3	-58.5	-81.2	0	0	0	113.6	T928 T1117	T928-H1119 PolarHBondContact OG1-O 2.92Å; T1117-H1119 PolarHBondContact O-N 3.34Å; T1117-H1119 VanDerWaalsContact O-N 3.12Å
1120	V	91.9	Very high	91.3	Very high	9 Å²	9	47.4 Å²	47.4	6%	0.055	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-47	-175.9	-177.1	0	0	0	0	111	T928 A999 L1000 R1003 T1117 K1118	T928-V1120 HydrophobicContact CG2-CG2 4.25Å; A999-V1120 HydrophobicContact CB-CB 4.19Å; A999-V1120 HydrophobicContact CB-CG1 3.87Å; A999-V1120 WeakPolarHBondContact O-CG1 3.47Å; L1000-V1120 HydrophobicContact CD2-CG1 3.8Å; L1000-V1120 HydrophobicContact CD2-CG2 4.03Å; L1000-V1120 HydrophobicContact CG-CG1 4.08Å; L1000-V1120 HydrophobicContact CG-CG2 4.3Å; R1003-V1120 WeakPolarHBondContact CD-O 3.44Å; R1003-V1120 HydrophobicContact CG-CG1 3.83Å; R1003-V1120 WeakPolarHBondContact CG-O 3.17Å; T1117-V1120 PolarHBondContact O-N 3.16Å; K1118-V1120 VanDerWaalsContact C-N 3.32Å
1121	L	92.6	Very high	91.3	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.026	27%	0.268	C	S	.	.	S	Bend	trans	-94.1	133.7	-178.1	-58.8	-176.1	0	0	0	111.5	A999 L1002 R1003 L1077 T1117 L1126 I1129	A999-L1121 HydrophobicContact CB-CD1 4.01Å; A999-L1121 HydrophobicContact CB-CD2 3.87Å; A999-L1121 HydrophobicContact CB-CG 3.79Å; L1002-L1121 HydrophobicContact CB-CD2 4.5Å; L1002-L1121 HydrophobicContact CD2-CD1 4.49Å; L1002-L1121 HydrophobicContact CD2-CD2 3.81Å; L1002-L1121 HydrophobicContact CG-CD2 4.32Å; R1003-L1121 HydrophobicContact CG-CD2 4.09Å; L1077-L1121 HydrophobicContact CD1-CD1 4.2Å; T1117-L1121 PolarHBondContact O-N 3.16Å; L1121-L1126 HydrophobicContact CB-CD1 4.33Å; L1121-L1126 HydrophobicContact CB-CD2 3.88Å; L1121-L1126 HydrophobicContact CB-CG 3.81Å; L1121-L1126 HydrophobicContact CD1-CD2 3.93Å; L1121-L1126 HydrophobicContact CG-CD2 4.46Å; L1121-L1126 WeakPolarHBondContact O-CD1 3.38Å; L1121-I1129 HydrophobicContact CD1-CD1 3.99Å
1122	P	91.2	Very high	91.4	Very high	29 Å²	29	51.6 Å²	51.6	19%	0.188	27%	0.266	C	S	.	.			trans	-68.8	155.2	177.1	28.9	-34.4	0	0	0	111.2	K1124 T1125 L1126	P1122-K1124 PolarHBondContact O-N 2.99Å; P1122-K1124 VanDerWaalsContact O-N 3.09Å; P1122-T1125 PolarHBondContact O-N 2.7Å; P1122-L1126 PolarHBondContact O-N 2.9Å
1123	P	88.1	Confident	91.5	Very high	64 Å²	64	45.5 Å²	45.5	42%	0.416	24%	0.24	S	C	.	.	H	α-helix	trans	-56.1	-32.7	-174.1	-28.1	35.4	0	0	0	114.8	T1127 Q1178	P1123-T1127 VanDerWaalsContact O-CB 3.32Å; P1123-T1127 WeakPolarHBondContact O-CB 3.48Å; P1123-T1127 PolarHBondContact O-N 3.01Å; P1123-T1127 PolarHBondContact O-OG1 3.27Å; P1123-Q1178 PolarHBondContact O-OE1 3.15Å
1124	K	89.3	Confident	91.7	Very high	136 Å²	136	44.7 Å²	44.7	59%	0.591	24%	0.236	S	C	*	.	H	α-helix	trans	-59.9	-47	175.8	-63	175.2	-175.5	167.3	0	111.8	P1122 T1127 S1128	P1122-K1124 PolarHBondContact O-N 2.99Å; P1122-K1124 VanDerWaalsContact O-N 3.09Å; K1124-T1127 PolarHBondContact O-N 3.37Å; K1124-S1128 PolarHBondContact O-N 3.43Å
1125	T	92.2	Very high	91.9	Very high	24 Å²	24	48.3 Å²	48.3	15%	0.147	26%	0.255	C	S	.	.	H	α-helix	trans	-70	-41.6	-178.9	-54	0	0	0	0	111.4	L1002 L1074 P1122 T1127 S1128 I1129	L1002-T1125 HydrophobicContact CD2-CG2 4.24Å; L1074-T1125 HydrophobicContact CD2-CG2 3.78Å; P1122-T1125 PolarHBondContact O-N 2.7Å; T1125-T1127 PolarHBondContact O-N 3.41Å; T1125-S1128 PolarHBondContact O-N 2.81Å; T1125-I1129 HydrophobicContact CG2-CD1 4.19Å; T1125-I1129 WeakPolarHBondContact O-CG1 3.26Å; T1125-I1129 PolarHBondContact O-N 3.27Å
1126	L	92.7	Very high	92	Very high	9 Å²	9	48.9 Å²	48.9	5%	0.047	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-45.3	174.3	-70.1	168.9	0	0	0	111.5	T1117 L1121 P1122 S1128 I1129 L1130 T1176	T1117-L1126 WeakPolarHBondContact OG1-CD2 3.41Å; L1121-L1126 HydrophobicContact CB-CD1 4.33Å; L1121-L1126 HydrophobicContact CB-CD2 3.88Å; L1121-L1126 HydrophobicContact CB-CG 3.81Å; L1121-L1126 HydrophobicContact CD1-CD2 3.93Å; L1121-L1126 HydrophobicContact CG-CD2 4.46Å; L1121-L1126 WeakPolarHBondContact O-CD1 3.38Å; P1122-L1126 PolarHBondContact O-N 2.9Å; L1126-S1128 PolarHBondContact O-N 2.87Å; L1126-I1129 PolarHBondContact O-N 3.31Å; L1126-L1130 WeakPolarHBondContact O-CB 3.44Å; L1126-L1130 VanDerWaalsContact O-CG 3.23Å; L1126-L1130 WeakPolarHBondContact O-CG 3.27Å; L1126-L1130 PolarHBondContact O-N 2.66Å; L1126-T1176 HydrophobicContact CB-CG2 4.09Å
1127	T	92.4	Very high	92.2	Very high	13 Å²	13	45 Å²	45	8%	0.08	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-40.3	177.9	-55.5	0	0	0	0	111.6	P1123 K1124 T1125 L1130 L1131 T1176 Q1178 L1179	P1123-T1127 VanDerWaalsContact O-CB 3.32Å; P1123-T1127 WeakPolarHBondContact O-CB 3.48Å; P1123-T1127 PolarHBondContact O-N 3.01Å; P1123-T1127 PolarHBondContact O-OG1 3.27Å; K1124-T1127 PolarHBondContact O-N 3.37Å; T1125-T1127 PolarHBondContact O-N 3.41Å; T1127-L1130 PolarHBondContact O-N 2.94Å; T1127-L1131 HydrophobicContact CG2-CD1 4.06Å; T1127-L1131 HydrophobicContact CG2-CG 4.45Å; T1127-L1131 WeakPolarHBondContact O-CB 3.44Å; T1127-L1131 VanDerWaalsContact O-CG 3.28Å; T1127-L1131 WeakPolarHBondContact O-CG 3.49Å; T1127-L1131 PolarHBondContact O-N 3.47Å; T1127-T1176 PolarHBondContact OG1-OG1 3.15Å; T1127-Q1178 HydrophobicContact CG2-CB 4.15Å; T1127-Q1178 PolarHBondContact OG1-OE1 3.44Å; T1127-L1179 HydrophobicContact CG2-CD2 3.83Å; T1127-L1179 HydrophobicContact CG2-CG 3.95Å
1128	S	92.5	Very high	92.3	Very high	59 Å²	59	45.7 Å²	45.7	41%	0.413	23%	0.228	S	C	.	.	H	α-helix	trans	-61.8	-44.7	173.6	-179.4	0	0	0	0	113.1	K1124 T1125 L1126 L1130 L1131 R1132	K1124-S1128 PolarHBondContact O-N 3.43Å; T1125-S1128 PolarHBondContact O-N 2.81Å; L1126-S1128 PolarHBondContact O-N 2.87Å; S1128-L1130 PolarHBondContact O-N 2.89Å; S1128-L1131 PolarHBondContact O-N 3.37Å; S1128-R1132 WeakPolarHBondContact O-CG 3.41Å; S1128-R1132 PolarHBondContact O-N 2.77Å; S1128-R1132 VanDerWaalsContact O-N 3.08Å
1129	I	93.7	Very high	92.5	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-46.3	174.6	-68.3	164.8	0	0	0	110.3	L1074 L1077 V1078 L1113 L1121 T1125 L1126 L1131 R1132 V1133	L1074-I1129 HydrophobicContact CD2-CD1 3.99Å; L1074-I1129 HydrophobicContact CD2-CG1 4.03Å; L1077-I1129 HydrophobicContact CB-CD1 4.31Å; L1077-I1129 HydrophobicContact CD1-CD1 4.2Å; V1078-I1129 HydrophobicContact CG2-CB 4.48Å; V1078-I1129 HydrophobicContact CG2-CG2 4.03Å; L1113-I1129 HydrophobicContact CD2-CG2 4.48Å; L1121-I1129 HydrophobicContact CD1-CD1 3.99Å; T1125-I1129 HydrophobicContact CG2-CD1 4.19Å; T1125-I1129 WeakPolarHBondContact O-CG1 3.26Å; T1125-I1129 PolarHBondContact O-N 3.27Å; L1126-I1129 PolarHBondContact O-N 3.31Å; I1129-L1131 PolarHBondContact O-N 3.37Å; I1129-R1132 PolarHBondContact O-N 3.48Å; I1129-V1133 WeakPolarHBondContact O-CG2 3.22Å; I1129-V1133 PolarHBondContact O-N 3.04Å
1130	L	94.1	Very high	92.7	Very high	3 Å²	3	38 Å²	38	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-38.7	-178.9	-71.3	167.8	0	0	0	112.6	L1110 I1114 L1126 T1127 S1128 V1133 H1134 F1172 L1175 T1176 L1179	L1110-L1130 HydrophobicContact CD2-CD2 4.1Å; I1114-L1130 HydrophobicContact CD1-CD1 3.84Å; I1114-L1130 HydrophobicContact CD1-CD2 3.97Å; I1114-L1130 HydrophobicContact CD1-CG 4.49Å; I1114-L1130 HydrophobicContact CG1-CD1 4.22Å; I1114-L1130 HydrophobicContact CG1-CD2 4.35Å; L1126-L1130 WeakPolarHBondContact O-CB 3.44Å; L1126-L1130 VanDerWaalsContact O-CG 3.23Å; L1126-L1130 WeakPolarHBondContact O-CG 3.27Å; L1126-L1130 PolarHBondContact O-N 2.66Å; T1127-L1130 PolarHBondContact O-N 2.94Å; S1128-L1130 PolarHBondContact O-N 2.89Å; L1130-V1133 PolarHBondContact O-N 2.95Å; L1130-H1134 WeakPolarHBondContact O-CB 3.37Å; L1130-H1134 PolarHBondContact O-N 3.1Å; L1130-F1172 HydrophobicContact CB-CE2 3.8Å; L1130-F1172 HydrophobicContact CB-CZ 3.92Å; L1130-F1172 HydrophobicContact CD2-CE2 4.45Å; L1130-F1172 WeakPolarHBondContact O-CE2 3.27Å; L1130-F1172 WeakPolarHBondContact O-CZ 3.38Å; L1130-L1175 HydrophobicContact CD1-CB 4.02Å; L1130-L1175 HydrophobicContact CD1-CD1 4.39Å; L1130-L1175 HydrophobicContact CD2-CD1 4.05Å; L1130-T1176 HydrophobicContact CD1-CG2 3.65Å; L1130-L1179 HydrophobicContact CB-CD1 4.2Å; L1130-L1179 HydrophobicContact CD1-CD1 3.81Å
1131	L	94.2	Very high	92.6	Very high	58 Å²	58	37.7 Å²	37.7	30%	0.304	20%	0.198	S	C	.	.	H	α-helix	trans	-66.9	-37.7	174.7	-70.2	169.1	0	0	0	112.2	T1127 S1128 I1129 V1133 H1134 N1135 F1172 L1179 F1182	T1127-L1131 HydrophobicContact CG2-CD1 4.06Å; T1127-L1131 HydrophobicContact CG2-CG 4.45Å; T1127-L1131 WeakPolarHBondContact O-CB 3.44Å; T1127-L1131 VanDerWaalsContact O-CG 3.28Å; T1127-L1131 WeakPolarHBondContact O-CG 3.49Å; T1127-L1131 PolarHBondContact O-N 3.47Å; S1128-L1131 PolarHBondContact O-N 3.37Å; I1129-L1131 PolarHBondContact O-N 3.37Å; L1131-V1133 VanDerWaalsContact C-N 3.35Å; L1131-H1134 PolarHBondContact O-N 2.76Å; L1131-N1135 PolarHBondContact O-N 3.47Å; L1131-N1135 VanDerWaalsContact O-N 3.08Å; L1131-F1172 HydrophobicContact CD2-CE1 4.26Å; L1131-F1172 HydrophobicContact CD2-CZ 4.33Å; L1131-L1179 HydrophobicContact CD2-CD2 4.21Å; L1131-F1182 HydrophobicContact CD2-CD2 3.93Å; L1131-F1182 HydrophobicContact CD2-CE2 3.43Å; L1131-F1182 VanDerWaalsContact CD2-CE2 3.43Å; L1131-F1182 HydrophobicContact CD2-CZ 4.03Å
1132	R	95.2	Very high	92.5	Very high	76 Å²	76	42.1 Å²	42.1	29%	0.287	22%	0.215	S	C	.	.	H	α-helix	trans	-61.2	-42.9	172.1	-72.7	165.4	80.2	154.2	-2.9	111.4	E1071 V1078 S1128 I1129 E1136	E1071-R1132 IonicContact OE1-NH1 2.66Å; E1071-R1132 IonicContact OE2-CZ 3.83Å; E1071-R1132 IonicContact OE2-NH1 2.74Å; E1071-R1132 PolarHBondContact OE2-NH1 3.38Å; E1071-R1132 IonicContact OE2-NH2 2.83Å; E1071-R1132 PolarHBondContact OE2-NH2 2.91Å; V1078-R1132 HydrophobicContact CG1-CB 4.16Å; V1078-R1132 HydrophobicContact CG2-CB 3.83Å; S1128-R1132 WeakPolarHBondContact O-CG 3.41Å; S1128-R1132 PolarHBondContact O-N 2.77Å; S1128-R1132 VanDerWaalsContact O-N 3.08Å; I1129-R1132 PolarHBondContact O-N 3.48Å; R1132-E1136 PolarHBondContact O-N 2.94Å
1133	V	94.4	Very high	92.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-70.9	-35.3	177.3	175.3	0	0	0	0	112.4	V1078 L1081 I1085 L1110 I1129 L1130 L1131 E1136 L1137	V1078-V1133 HydrophobicContact CB-CG2 4.42Å; V1078-V1133 HydrophobicContact CG1-CG2 3.96Å; L1081-V1133 HydrophobicContact CB-CB 4.44Å; L1081-V1133 HydrophobicContact CB-CG1 3.8Å; L1081-V1133 HydrophobicContact CB-CG2 3.7Å; L1081-V1133 HydrophobicContact CD1-CG1 4.39Å; L1081-V1133 HydrophobicContact CD1-CG2 3.98Å; I1085-V1133 HydrophobicContact CD1-CG1 3.9Å; L1110-V1133 HydrophobicContact CD2-CG1 3.81Å; I1129-V1133 WeakPolarHBondContact O-CG2 3.22Å; I1129-V1133 PolarHBondContact O-N 3.04Å; L1130-V1133 PolarHBondContact O-N 2.95Å; L1131-V1133 VanDerWaalsContact C-N 3.35Å; V1133-E1136 PolarHBondContact O-N 3.24Å; V1133-L1137 PolarHBondContact O-N 3.46Å
1134	H	94.8	Very high	92.6	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-47	175.7	173.9	58.2	0	0	0	111.9	L1130 L1131 E1136 L1137 K1138 Y1168 F1172 F1182 D1184	L1130-H1134 WeakPolarHBondContact O-CB 3.37Å; L1130-H1134 PolarHBondContact O-N 3.1Å; L1131-H1134 PolarHBondContact O-N 2.76Å; H1134-E1136 VanDerWaalsContact C-N 3.29Å; H1134-E1136 PolarHBondContact O-N 2.89Å; H1134-L1137 WeakPolarHBondContact O-CA 3.32Å; H1134-L1137 WeakPolarHBondContact O-CB 3.31Å; H1134-L1137 PolarHBondContact O-N 3.25Å; H1134-L1137 VanDerWaalsContact O-N 3.1Å; H1134-K1138 PolarHBondContact O-N 3.01Å; H1134-Y1168 AromaticContact CE1-CE1 3.82Å; H1134-Y1168 AromaticContact ND1-CE1 3.37Å; H1134-Y1168 WeakPolarHBondContact ND1-CE1 3.23Å; H1134-Y1168 AromaticContact ND1-CZ 3.66Å; H1134-Y1168 PolarHBondContact ND1-OH 3.12Å; H1134-F1172 HydrophobicContact CB-CE1 4.35Å; H1134-F1172 HydrophobicContact CB-CE2 3.93Å; H1134-F1172 HydrophobicContact CB-CZ 3.66Å; H1134-F1182 AromaticContact CD2-CZ 3.67Å; H1134-F1182 AromaticContact NE2-CE1 3.92Å; H1134-F1182 AromaticContact NE2-CZ 3.71Å; H1134-D1184 IonicContact NE2-OD2 3.85Å; H1134-D1184 PolarHBondContact NE2-OD2 2.95Å
1135	N	93.6	Very high	92.6	Very high	88 Å²	88	38.5 Å²	38.5	47%	0.471	19%	0.191	S	C	.	.	H	α-helix	trans	-60.6	-40.3	176.9	-68.3	-7	0	0	0	111.7	L1131 K1138 V1139	L1131-N1135 PolarHBondContact O-N 3.47Å; L1131-N1135 VanDerWaalsContact O-N 3.08Å; N1135-K1138 PolarHBondContact O-N 3.08Å; N1135-V1139 WeakPolarHBondContact O-CG2 3.41Å; N1135-V1139 PolarHBondContact O-N 3.42Å
1136	E	92.8	Very high	92.4	Very high	64 Å²	64	39.9 Å²	39.9	30%	0.299	20%	0.201	S	C	.	.	H	α-helix	trans	-65	-38.7	174.6	-171.4	59.8	-142.7	0	0	112	R1132 V1133 H1134 K1138 V1139 Q1140	R1132-E1136 PolarHBondContact O-N 2.94Å; V1133-E1136 PolarHBondContact O-N 3.24Å; H1134-E1136 VanDerWaalsContact C-N 3.29Å; H1134-E1136 PolarHBondContact O-N 2.89Å; E1136-K1138 VanDerWaalsContact C-N 3.35Å; E1136-K1138 PolarHBondContact O-N 3.09Å; E1136-V1139 PolarHBondContact O-N 3.09Å; E1136-Q1140 HydrophobicContact CG-CG 4.41Å; E1136-Q1140 WeakPolarHBondContact O-CG 3.5Å; E1136-Q1140 PolarHBondContact O-N 3.15Å; E1136-Q1140 PolarHBondContact OE1-NE2 3.36Å
1137	L	93.5	Very high	92.2	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-43.8	171.7	179	138.5	0	0	0	111.8	I1085 F1089 M1103 I1106 V1133 H1134 V1139 Q1140 L1141 Y1168	I1085-L1137 HydrophobicContact CD1-CB 4.36Å; F1089-L1137 HydrophobicContact CE2-CD1 4.25Å; F1089-L1137 HydrophobicContact CE2-CG 4.03Å; F1089-L1137 HydrophobicContact CZ-CD1 4.19Å; F1089-L1137 HydrophobicContact CZ-CG 4.18Å; M1103-L1137 HydrophobicContact SD-CD1 4.42Å; I1106-L1137 HydrophobicContact CD1-CD1 4.21Å; I1106-L1137 HydrophobicContact CG2-CD1 3.84Å; V1133-L1137 PolarHBondContact O-N 3.46Å; H1134-L1137 WeakPolarHBondContact O-CA 3.32Å; H1134-L1137 WeakPolarHBondContact O-CB 3.31Å; H1134-L1137 PolarHBondContact O-N 3.25Å; H1134-L1137 VanDerWaalsContact O-N 3.1Å; L1137-V1139 VanDerWaalsContact C-N 3.34Å; L1137-V1139 PolarHBondContact O-N 3.36Å; L1137-Q1140 PolarHBondContact O-N 3.46Å; L1137-L1141 WeakPolarHBondContact O-CB 3.41Å; L1137-L1141 PolarHBondContact O-N 3.04Å; L1137-Y1168 HydrophobicContact CD1-CD2 4.01Å; L1137-Y1168 HydrophobicContact CD1-CE2 3.57Å; L1137-Y1168 HydrophobicContact CD2-CD1 4.22Å; L1137-Y1168 HydrophobicContact CD2-CE1 3.89Å; L1137-Y1168 HydrophobicContact CD2-CE2 4.32Å
1138	K	93.1	Very high	92	Very high	16 Å²	16	47.2 Å²	47.2	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-61.9	-40.3	175.7	-65.1	-152.4	-60.8	174.7	0	111.9	H1134 N1135 E1136 R1142 D1184 C1186 D1188 I1189	H1134-K1138 PolarHBondContact O-N 3.01Å; N1135-K1138 PolarHBondContact O-N 3.08Å; E1136-K1138 VanDerWaalsContact C-N 3.35Å; E1136-K1138 PolarHBondContact O-N 3.09Å; K1138-R1142 VanDerWaalsContact O-CB 3.23Å; K1138-R1142 WeakPolarHBondContact O-CB 3.28Å; K1138-R1142 PolarHBondContact O-N 2.98Å; K1138-D1184 WeakPolarHBondContact CE-OD2 3.43Å; K1138-D1184 IonicContact NZ-OD1 2.72Å; K1138-D1184 PolarHBondContact NZ-OD1 3.05Å; K1138-D1184 IonicContact NZ-OD2 3.67Å; K1138-D1184 PolarHBondContact NZ-OD2 2.91Å; K1138-C1186 HydrophobicContact CD-CB 4.27Å; K1138-D1188 WeakPolarHBondContact CE-OD1 3.32Å; K1138-D1188 VanDerWaalsContact CE-OD2 3.24Å; K1138-D1188 WeakPolarHBondContact CE-OD2 3.23Å; K1138-D1188 IonicContact NZ-OD1 3.79Å; K1138-D1188 PolarHBondContact NZ-OD1 3.16Å; K1138-D1188 IonicContact NZ-OD2 2.71Å; K1138-D1188 PolarHBondContact NZ-OD2 2.74Å; K1138-I1189 HydrophobicContact CB-CG2 3.92Å; K1138-I1189 HydrophobicContact CD-CG2 4.1Å; K1138-I1189 HydrophobicContact CG-CG2 4.09Å
1139	V	92.1	Very high	91.8	Very high	85 Å²	85	47 Å²	47	52%	0.515	24%	0.243	S	C	.	.	H	α-helix	trans	-64.3	-48.4	175.8	170.5	0	0	0	0	112.2	N1135 E1136 L1137 R1142 H1143	N1135-V1139 WeakPolarHBondContact O-CG2 3.41Å; N1135-V1139 PolarHBondContact O-N 3.42Å; E1136-V1139 PolarHBondContact O-N 3.09Å; L1137-V1139 VanDerWaalsContact C-N 3.34Å; L1137-V1139 PolarHBondContact O-N 3.36Å; V1139-R1142 PolarHBondContact O-N 3.06Å; V1139-H1143 PolarHBondContact O-N 3.36Å
1140	Q	91.7	Very high	91.4	Very high	52 Å²	52	47.3 Å²	47.3	24%	0.243	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-38.7	179.8	-63.4	-63.8	-32.2	0	0	111.7	I1085 F1089 E1136 L1137 H1143 R1144	I1085-Q1140 HydrophobicContact CG2-CB 3.98Å; I1085-Q1140 HydrophobicContact CG2-CG 4.09Å; F1089-Q1140 HydrophobicContact CD2-CB 3.88Å; F1089-Q1140 HydrophobicContact CE2-CB 4.39Å; E1136-Q1140 HydrophobicContact CG-CG 4.41Å; E1136-Q1140 WeakPolarHBondContact O-CG 3.5Å; E1136-Q1140 PolarHBondContact O-N 3.15Å; E1136-Q1140 PolarHBondContact OE1-NE2 3.36Å; L1137-Q1140 PolarHBondContact O-N 3.46Å; Q1140-H1143 PolarHBondContact O-N 2.95Å; Q1140-R1144 WeakPolarHBondContact O-CB 3.2Å; Q1140-R1144 PolarHBondContact O-N 2.98Å
1141	L	90.1	Very high	90.9	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-64.2	-45.4	174.7	-177.1	58.8	0	0	0	111.3	F1089 W1092 L1137 H1143 R1144 I1145 I1165 I1189	F1089-L1141 HydrophobicContact CE1-CD1 4.08Å; F1089-L1141 HydrophobicContact CE2-CB 4.38Å; F1089-L1141 HydrophobicContact CZ-CB 4.38Å; F1089-L1141 HydrophobicContact CZ-CD1 4.31Å; W1092-L1141 HydrophobicContact CE3-CD1 4.28Å; W1092-L1141 HydrophobicContact CH2-CD1 3.54Å; W1092-L1141 HydrophobicContact CZ2-CD1 4.3Å; W1092-L1141 HydrophobicContact CZ3-CD1 3.55Å; L1137-L1141 WeakPolarHBondContact O-CB 3.41Å; L1137-L1141 PolarHBondContact O-N 3.04Å; L1141-H1143 VanDerWaalsContact C-N 3.35Å; L1141-H1143 PolarHBondContact O-N 3.47Å; L1141-R1144 PolarHBondContact O-N 2.88Å; L1141-I1145 HydrophobicContact CD1-CD1 4.08Å; L1141-I1145 HydrophobicContact CD1-CG1 4.27Å; L1141-I1145 HydrophobicContact CG-CD1 3.87Å; L1141-I1145 HydrophobicContact CG-CG1 4.47Å; L1141-I1145 WeakPolarHBondContact O-CB 3.24Å; L1141-I1145 VanDerWaalsContact O-CG1 3.29Å; L1141-I1145 WeakPolarHBondContact O-CG1 3.49Å; L1141-I1145 PolarHBondContact O-N 3.35Å; L1141-I1165 HydrophobicContact CD2-CD1 4.16Å; L1141-I1165 HydrophobicContact CD2-CG1 3.92Å; L1141-I1189 HydrophobicContact CD2-CD1 4Å; L1141-I1189 HydrophobicContact CD2-CG2 4.49Å
1142	R	91.2	Very high	90.4	Very high	98 Å²	98	52.2 Å²	52.2	37%	0.37	28%	0.277	S	S	.	.	H	α-helix	trans	-56.8	-46.2	173.7	178.7	163.7	-149.1	-132.4	0.4	112.6	K1138 V1139 R1144 I1145 S1146 D1188 I1189 W1190	K1138-R1142 VanDerWaalsContact O-CB 3.23Å; K1138-R1142 WeakPolarHBondContact O-CB 3.28Å; K1138-R1142 PolarHBondContact O-N 2.98Å; V1139-R1142 PolarHBondContact O-N 3.06Å; R1142-R1144 VanDerWaalsContact C-N 3.33Å; R1142-R1144 PolarHBondContact O-N 2.92Å; R1142-I1145 PolarHBondContact O-N 3.14Å; R1142-S1146 WeakPolarHBondContact O-CB 3.21Å; R1142-S1146 PolarHBondContact O-N 2.88Å; R1142-S1146 PolarHBondContact O-OG 3.38Å; R1142-D1188 VanDerWaalsContact CD-O 3.24Å; R1142-D1188 WeakPolarHBondContact CD-O 3.4Å; R1142-D1188 PolarHBondContact NE-O 2.72Å; R1142-D1188 VanDerWaalsContact NE-O 3.08Å; R1142-I1189 VanDerWaalsContact CA-O 3.25Å; R1142-I1189 WeakPolarHBondContact CA-O 3.46Å; R1142-I1189 HydrophobicContact CB-CB 4.43Å; R1142-I1189 VanDerWaalsContact CB-O 3.25Å; R1142-I1189 WeakPolarHBondContact CB-O 3.18Å; R1142-I1189 WeakPolarHBondContact CG-O 3.25Å; R1142-W1190 PolarHBondContact NE-O 3.41Å; R1142-W1190 VanDerWaalsContact NE-O 3.16Å; R1142-W1190 PolarHBondContact NH2-O 3.43Å
1143	H	90.6	Very high	89.8	Confident	126 Å²	126	54.5 Å²	54.5	58%	0.583	29%	0.294	S	S	*	.	H	α-helix	trans	-60.5	-45	177.4	-174.4	47.9	0	0	0	111	V1139 Q1140 L1141 S1146 E1147	V1139-H1143 PolarHBondContact O-N 3.36Å; Q1140-H1143 PolarHBondContact O-N 2.95Å; L1141-H1143 VanDerWaalsContact C-N 3.35Å; L1141-H1143 PolarHBondContact O-N 3.47Å; H1143-S1146 WeakPolarHBondContact O-CB 3.23Å; H1143-S1146 PolarHBondContact O-N 3.11Å; H1143-E1147 WeakPolarHBondContact O-CB 3.23Å; H1143-E1147 PolarHBondContact O-N 3.25Å
1144	R	90.3	Very high	89.2	Confident	28 Å²	28	57.6 Å²	57.6	11%	0.106	33%	0.326	C	S	.	.	H	α-helix	trans	-68.5	-38.8	179.1	-175.7	54.4	175	-174.5	-3.9	113.8	F1089 S1090 W1092 Q1140 L1141 R1142 S1146 E1147 L1148	F1089-R1144 HydrophobicContact CB-CB 4.4Å; F1089-R1144 HydrophobicContact CB-CG 4.43Å; F1089-R1144 WeakPolarHBondContact O-CD 3.5Å; F1089-R1144 PolarHBondContact O-NE 2.92Å; S1090-R1144 PolarHBondContact O-NH1 3.18Å; S1090-R1144 PolarHBondContact O-NH2 2.87Å; W1092-R1144 HydrophobicContact CE3-CG 3.96Å; W1092-R1144 HydrophobicContact CZ3-CG 4.47Å; W1092-R1144 PolarHBondContact O-NE 3.01Å; W1092-R1144 PolarHBondContact O-NH2 3.49Å; Q1140-R1144 WeakPolarHBondContact O-CB 3.2Å; Q1140-R1144 PolarHBondContact O-N 2.98Å; L1141-R1144 PolarHBondContact O-N 2.88Å; R1142-R1144 VanDerWaalsContact C-N 3.33Å; R1142-R1144 PolarHBondContact O-N 2.92Å; R1144-S1146 VanDerWaalsContact C-N 3.31Å; R1144-E1147 WeakPolarHBondContact CD-OE2 3.37Å; R1144-E1147 IonicContact CZ-OE2 2.88Å; R1144-E1147 IonicContact NE-OE2 2.69Å; R1144-E1147 IonicContact NH1-OE1 2.69Å; R1144-E1147 PolarHBondContact NH1-OE1 3.09Å; R1144-E1147 IonicContact NH1-OE2 2.61Å; R1144-E1147 PolarHBondContact NH1-OE2 3.44Å; R1144-E1147 PolarHBondContact O-N 2.88Å; R1144-L1148 HydrophobicContact CG-CD1 4.2Å; R1144-L1148 WeakPolarHBondContact O-CB 3.19Å; R1144-L1148 VanDerWaalsContact O-CG 3.29Å; R1144-L1148 WeakPolarHBondContact O-CG 3.43Å; R1144-L1148 PolarHBondContact O-N 3.28Å
1145	I	89.4	Confident	88.8	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60.5	-44	173.1	-72.9	170.9	0	0	0	110	L1141 R1142 L1148 G1149 I1150 I1161 I1189 W1190 P1191	L1141-I1145 HydrophobicContact CD1-CD1 4.08Å; L1141-I1145 HydrophobicContact CD1-CG1 4.27Å; L1141-I1145 HydrophobicContact CG-CD1 3.87Å; L1141-I1145 HydrophobicContact CG-CG1 4.47Å; L1141-I1145 WeakPolarHBondContact O-CB 3.24Å; L1141-I1145 VanDerWaalsContact O-CG1 3.29Å; L1141-I1145 WeakPolarHBondContact O-CG1 3.49Å; L1141-I1145 PolarHBondContact O-N 3.35Å; R1142-I1145 PolarHBondContact O-N 3.14Å; I1145-L1148 PolarHBondContact O-N 3.43Å; I1145-G1149 PolarHBondContact O-N 2.97Å; I1145-I1150 HydrophobicContact CG2-CB 4.21Å; I1145-I1150 WeakPolarHBondContact CG2-O 3.26Å; I1145-I1150 PolarHBondContact O-N 2.99Å; I1145-I1150 VanDerWaalsContact O-N 3.08Å; I1145-I1161 HydrophobicContact CD1-CG2 4.02Å; I1145-I1161 HydrophobicContact CG1-CD1 4.44Å; I1145-I1189 HydrophobicContact CD1-CB 4.46Å; I1145-I1189 HydrophobicContact CD1-CD1 3.9Å; I1145-I1189 HydrophobicContact CD1-CG1 3.93Å; I1145-W1190 HydrophobicContact CD1-CE3 4.44Å; I1145-W1190 HydrophobicContact CD1-CH2 4.4Å; I1145-W1190 HydrophobicContact CD1-CZ3 4.24Å; I1145-W1190 HydrophobicContact CG2-CE3 3.71Å; I1145-W1190 HydrophobicContact CG2-CZ3 3.73Å; I1145-P1191 HydrophobicContact CG2-CG 4.35Å
1146	S	88.6	Confident	88.4	Confident	53 Å²	53	59 Å²	59	37%	0.371	34%	0.343	S	S	.	.	H	α-helix	trans	-65.9	-42.9	177.5	-52.4	0	0	0	0	112.4	R1142 H1143 R1144 L1148 G1149	R1142-S1146 WeakPolarHBondContact O-CB 3.21Å; R1142-S1146 PolarHBondContact O-N 2.88Å; R1142-S1146 PolarHBondContact O-OG 3.38Å; H1143-S1146 WeakPolarHBondContact O-CB 3.23Å; H1143-S1146 PolarHBondContact O-N 3.11Å; R1144-S1146 VanDerWaalsContact C-N 3.31Å; S1146-L1148 VanDerWaalsContact C-N 3.32Å; S1146-L1148 PolarHBondContact O-N 3.02Å; S1146-G1149 PolarHBondContact O-N 3.12Å; S1146-G1149 VanDerWaalsContact O-N 3.09Å
1147	E	89	Confident	88	Confident	123 Å²	123	59.9 Å²	59.9	58%	0.575	35%	0.347	S	S	*	.	H	α-helix	trans	-61.7	-38.5	176.3	-170.9	-158.3	164.3	0	0	112.1	H1143 R1144 G1149	H1143-E1147 WeakPolarHBondContact O-CB 3.23Å; H1143-E1147 PolarHBondContact O-N 3.25Å; R1144-E1147 WeakPolarHBondContact CD-OE2 3.37Å; R1144-E1147 IonicContact CZ-OE2 2.88Å; R1144-E1147 IonicContact NE-OE2 2.69Å; R1144-E1147 IonicContact NH1-OE1 2.69Å; R1144-E1147 PolarHBondContact NH1-OE1 3.09Å; R1144-E1147 IonicContact NH1-OE2 2.61Å; R1144-E1147 PolarHBondContact NH1-OE2 3.44Å; R1144-E1147 PolarHBondContact O-N 2.88Å; E1147-G1149 PolarHBondContact O-N 3.42Å
1148	L	87.9	Confident	87.7	Confident	53 Å²	53	61.4 Å²	61.4	28%	0.277	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-5	175.7	-67.6	174.7	0	0	0	113.6	Y1093 R1144 I1145 S1146 I1150	Y1093-L1148 HydrophobicContact CD2-CD1 3.77Å; Y1093-L1148 HydrophobicContact CD2-CD2 3.87Å; Y1093-L1148 HydrophobicContact CD2-CG 4.45Å; Y1093-L1148 HydrophobicContact CE2-CD1 4.3Å; Y1093-L1148 HydrophobicContact CE2-CD2 4.18Å; Y1093-L1148 HydrophobicContact CG-CD1 4.44Å; R1144-L1148 HydrophobicContact CG-CD1 4.2Å; R1144-L1148 WeakPolarHBondContact O-CB 3.19Å; R1144-L1148 VanDerWaalsContact O-CG 3.29Å; R1144-L1148 WeakPolarHBondContact O-CG 3.43Å; R1144-L1148 PolarHBondContact O-N 3.28Å; I1145-L1148 PolarHBondContact O-N 3.43Å; S1146-L1148 VanDerWaalsContact C-N 3.32Å; S1146-L1148 PolarHBondContact O-N 3.02Å; L1148-I1150 VanDerWaalsContact C-N 3.31Å; L1148-I1150 HydrophobicContact CB-CD1 3.85Å; L1148-I1150 HydrophobicContact CB-CG1 3.82Å; L1148-I1150 HydrophobicContact CD1-CD1 4.1Å; L1148-I1150 PolarHBondContact O-N 3.41Å
1149	G	87.2	Confident	87.4	Confident	55 Å²	55	64 Å²	64	57%	0.567	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	25	179.9	0	0	0	0	0	114.5	I1145 S1146 E1147	I1145-G1149 PolarHBondContact O-N 2.97Å; S1146-G1149 PolarHBondContact O-N 3.12Å; S1146-G1149 VanDerWaalsContact O-N 3.09Å; E1147-G1149 PolarHBondContact O-N 3.42Å
1150	I	85.4	Confident	87.2	Confident	9 Å²	9	62 Å²	62	5%	0.046	36%	0.36	C	S	.	.			trans	-88.3	130.4	-176.1	-50.9	176.1	0	0	0	109.4	I1145 L1148 Q1157 I1161 W1190	I1145-I1150 HydrophobicContact CG2-CB 4.21Å; I1145-I1150 WeakPolarHBondContact CG2-O 3.26Å; I1145-I1150 PolarHBondContact O-N 2.99Å; I1145-I1150 VanDerWaalsContact O-N 3.08Å; L1148-I1150 VanDerWaalsContact C-N 3.31Å; L1148-I1150 HydrophobicContact CB-CD1 3.85Å; L1148-I1150 HydrophobicContact CB-CG1 3.82Å; L1148-I1150 HydrophobicContact CD1-CD1 4.1Å; L1148-I1150 PolarHBondContact O-N 3.41Å; I1150-Q1157 HydrophobicContact CG2-CB 4.27Å; I1150-I1161 HydrophobicContact CD1-CD1 3.91Å; I1150-I1161 HydrophobicContact CG2-CD1 4.09Å; I1150-W1190 HydrophobicContact CG2-CZ3 4.08Å
1151	I	83.9	Confident	87.1	Confident	117 Å²	117	59.6 Å²	59.6	60%	0.6	35%	0.349	S	S	*	.			trans	-115.8	150.8	-178.6	-55.9	174.5	0	0	0	108.4	D1153	I1151-D1153 VanDerWaalsContact C-N 3.28Å; I1151-D1153 PolarHBondContact O-N 3.15Å
1152	A	83.3	Confident	87.1	Confident	48 Å²	48	62.5 Å²	62.5	40%	0.397	36%	0.364	S	S	.	.			trans	-74.5	76.1	174.1	0	0	0	0	0	111.5	Q1158 W1190	A1152-Q1158 VanDerWaalsContact C-OE1 3.24Å; A1152-W1190 HydrophobicContact CB-CB 4.44Å; A1152-W1190 HydrophobicContact CB-CD2 3.87Å; A1152-W1190 HydrophobicContact CB-CE3 4.08Å; A1152-W1190 HydrophobicContact CB-CG 4.01Å
1153	D	83.7	Confident	87	Confident	123 Å²	123	60 Å²	60	66%	0.658	36%	0.362	S	S	*	.	S	Bend	trans	-94.7	1.6	-178.8	72.4	-20.8	0	0	0	114.1	I1151 G1155	I1151-D1153 VanDerWaalsContact C-N 3.28Å; I1151-D1153 PolarHBondContact O-N 3.15Å; D1153-G1155 PolarHBondContact O-N 2.82Å; D1153-G1155 VanDerWaalsContact OD1-CA 3.27Å; D1153-G1155 WeakPolarHBondContact OD1-CA 3.45Å; D1153-G1155 PolarHBondContact OD1-N 2.84Å
1154	G	82.3	Confident	87	Confident	65 Å²	65	54 Å²	54	67%	0.67	33%	0.334	S	S	*	.	S	Bend	trans	74.7	6.6	-170.3	0	0	0	0	0	114.1
1155	G	85.7	Confident	87.1	Confident	13 Å²	13	53.4 Å²	53.4	13%	0.134	33%	0.333	C	S	.	.	S	Bend	trans	-76.3	174.8	-176.5	0	0	0	0	0	114.5	D1153 Q1157 Q1158 S1159	D1153-G1155 PolarHBondContact O-N 2.82Å; D1153-G1155 VanDerWaalsContact OD1-CA 3.27Å; D1153-G1155 WeakPolarHBondContact OD1-CA 3.45Å; D1153-G1155 PolarHBondContact OD1-N 2.84Å; G1155-Q1157 PolarHBondContact O-N 3.2Å; G1155-Q1158 PolarHBondContact O-N 3.44Å; G1155-Q1158 VanDerWaalsContact O-N 3.15Å; G1155-S1159 PolarHBondContact O-N 3Å; G1155-S1159 VanDerWaalsContact O-N 3.11Å
1156	P	84.9	Confident	87.2	Confident	105 Å²	105	58.2 Å²	58.2	68%	0.682	36%	0.358	S	S	*	.	H	α-helix	trans	-64.3	-24.5	-177	26.2	-34.8	0	0	0	113.3	L1160	P1156-L1160 VanDerWaalsContact O-CG 3.25Å; P1156-L1160 WeakPolarHBondContact O-CG 3.22Å; P1156-L1160 PolarHBondContact O-N 3.48Å; P1156-L1160 VanDerWaalsContact O-N 3.17Å
1157	Q	84.7	Confident	87.4	Confident	82 Å²	82	59.7 Å²	59.7	38%	0.383	36%	0.356	S	S	.	.	H	α-helix	trans	-70.7	-42.8	174.6	-66.7	-172.9	19.2	0	0	111.7	I1150 G1155 L1160 I1161	I1150-Q1157 HydrophobicContact CG2-CB 4.27Å; G1155-Q1157 PolarHBondContact O-N 3.2Å; Q1157-L1160 PolarHBondContact O-N 2.72Å; Q1157-I1161 WeakPolarHBondContact O-CG1 3.49Å; Q1157-I1161 PolarHBondContact O-N 2.93Å; Q1157-I1161 VanDerWaalsContact O-N 3.14Å
1158	Q	86.6	Confident	87.6	Confident	37 Å²	37	54 Å²	54	17%	0.173	33%	0.329	C	S	.	.	H	α-helix	trans	-58.9	-50.5	172.4	172.3	174.3	-3	0	0	110.5	A1152 G1155 L1160 I1161 D1162 W1190	A1152-Q1158 VanDerWaalsContact C-OE1 3.24Å; G1155-Q1158 PolarHBondContact O-N 3.44Å; G1155-Q1158 VanDerWaalsContact O-N 3.15Å; Q1158-L1160 VanDerWaalsContact C-N 3.26Å; Q1158-L1160 PolarHBondContact O-N 3.46Å; Q1158-I1161 WeakPolarHBondContact O-CA 3.44Å; Q1158-I1161 PolarHBondContact O-N 2.66Å; Q1158-D1162 VanDerWaalsContact CG-OD2 3.23Å; Q1158-D1162 WeakPolarHBondContact CG-OD2 3.29Å; Q1158-D1162 PolarHBondContact NE2-OD2 3.33Å; Q1158-D1162 PolarHBondContact O-N 2.8Å; Q1158-W1190 HydrophobicContact CB-CH2 4.16Å; Q1158-W1190 HydrophobicContact CG-CH2 4.04Å; Q1158-W1190 HydrophobicContact CG-CZ2 3.87Å
1159	S	86.3	Confident	87.9	Confident	71 Å²	71	51.8 Å²	51.8	50%	0.497	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-34.2	-179.2	177.7	0	0	0	0	113.8	G1155 S1163	G1155-S1159 PolarHBondContact O-N 3Å; G1155-S1159 VanDerWaalsContact O-N 3.11Å; S1159-S1163 WeakPolarHBondContact O-CB 3.14Å; S1159-S1163 PolarHBondContact O-N 2.77Å; S1159-S1163 VanDerWaalsContact O-N 3.15Å; S1159-S1163 PolarHBondContact O-OG 2.81Å
1160	L	88.8	Confident	88.1	Confident	42 Å²	42	52.9 Å²	52.9	22%	0.22	31%	0.311	C	S	.	.	H	α-helix	trans	-69.1	-40.2	173.2	-71.7	168.4	0	0	0	112.3	P1096 I1098 P1156 Q1157 Q1158 S1163 E1164	P1096-L1160 HydrophobicContact CG-CD2 3.86Å; I1098-L1160 HydrophobicContact CD1-CD2 3.69Å; P1156-L1160 VanDerWaalsContact O-CG 3.25Å; P1156-L1160 WeakPolarHBondContact O-CG 3.22Å; P1156-L1160 PolarHBondContact O-N 3.48Å; P1156-L1160 VanDerWaalsContact O-N 3.17Å; Q1157-L1160 PolarHBondContact O-N 2.72Å; Q1158-L1160 VanDerWaalsContact C-N 3.26Å; Q1158-L1160 PolarHBondContact O-N 3.46Å; L1160-S1163 PolarHBondContact O-N 3.25Å; L1160-E1164 WeakPolarHBondContact O-CG 3.48Å; L1160-E1164 PolarHBondContact O-N 2.77Å; L1160-E1164 VanDerWaalsContact O-N 3.12Å
1161	I	89.4	Confident	88.5	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-68.9	-46.2	178.4	-68.2	169.4	0	0	0	110.5	W1092 I1145 I1150 Q1157 Q1158 S1163 E1164 I1165 W1190	W1092-I1161 HydrophobicContact CH2-CG1 3.99Å; W1092-I1161 HydrophobicContact CH2-CG2 4.45Å; I1145-I1161 HydrophobicContact CD1-CG2 4.02Å; I1145-I1161 HydrophobicContact CG1-CD1 4.44Å; I1150-I1161 HydrophobicContact CD1-CD1 3.91Å; I1150-I1161 HydrophobicContact CG2-CD1 4.09Å; Q1157-I1161 WeakPolarHBondContact O-CG1 3.49Å; Q1157-I1161 PolarHBondContact O-N 2.93Å; Q1157-I1161 VanDerWaalsContact O-N 3.14Å; Q1158-I1161 WeakPolarHBondContact O-CA 3.44Å; Q1158-I1161 PolarHBondContact O-N 2.66Å; I1161-S1163 PolarHBondContact O-N 2.85Å; I1161-E1164 WeakPolarHBondContact O-CB 3.45Å; I1161-E1164 PolarHBondContact O-N 2.93Å; I1161-E1164 VanDerWaalsContact O-N 3.11Å; I1161-I1165 HydrophobicContact CG2-CD1 3.66Å; I1161-I1165 WeakPolarHBondContact O-CD1 3.33Å; I1161-I1165 VanDerWaalsContact O-CG1 3.29Å; I1161-I1165 WeakPolarHBondContact O-CG1 3.44Å; I1161-I1165 PolarHBondContact O-N 3.05Å; I1161-W1190 HydrophobicContact CB-CH2 3.98Å; I1161-W1190 HydrophobicContact CB-CZ2 4.35Å; I1161-W1190 HydrophobicContact CD1-CH2 3.89Å; I1161-W1190 HydrophobicContact CD1-CZ3 4.33Å; I1161-W1190 HydrophobicContact CG2-CH2 3.72Å; I1161-W1190 HydrophobicContact CG2-CZ2 3.85Å
1162	D	89.3	Confident	89	Confident	63 Å²	63	48.8 Å²	48.8	34%	0.337	29%	0.289	S	S	.	.	H	α-helix	trans	-57.9	-34.6	174.7	-66.8	-16.6	0	0	0	111.5	Q1158 I1165 L1166	Q1158-D1162 VanDerWaalsContact CG-OD2 3.23Å; Q1158-D1162 WeakPolarHBondContact CG-OD2 3.29Å; Q1158-D1162 PolarHBondContact NE2-OD2 3.33Å; Q1158-D1162 PolarHBondContact O-N 2.8Å; D1162-I1165 PolarHBondContact O-N 2.95Å; D1162-L1166 VanDerWaalsContact O-CB 3.31Å; D1162-L1166 WeakPolarHBondContact O-CB 3.29Å; D1162-L1166 PolarHBondContact O-N 2.97Å
1163	S	90.3	Very high	89.5	Confident	45 Å²	45	49.1 Å²	49.1	32%	0.315	28%	0.281	S	S	.	.	H	α-helix	trans	-71.2	-38.7	175.6	-59.7	0	0	0	0	113.4	S1159 L1160 I1161 I1165 Y1167	S1159-S1163 WeakPolarHBondContact O-CB 3.14Å; S1159-S1163 PolarHBondContact O-N 2.77Å; S1159-S1163 VanDerWaalsContact O-N 3.15Å; S1159-S1163 PolarHBondContact O-OG 2.81Å; L1160-S1163 PolarHBondContact O-N 3.25Å; I1161-S1163 PolarHBondContact O-N 2.85Å; S1163-I1165 VanDerWaalsContact C-N 3.34Å; S1163-Y1167 PolarHBondContact O-N 2.75Å; S1163-Y1167 VanDerWaalsContact O-N 3.09Å
1164	E	90.8	Very high	89.9	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-41.6	172.1	-70.4	-80.2	127.4	0	0	111.3	W1092 I1098 P1099 S1100 M1103 L1160 I1161 Y1168	W1092-E1164 HydrophobicContact CZ2-CB 4.47Å; W1092-E1164 HydrophobicContact CZ2-CG 4.21Å; I1098-E1164 WeakPolarHBondContact CA-OE1 3.36Å; I1098-E1164 HydrophobicContact CG1-CG 4.46Å; I1098-E1164 WeakPolarHBondContact CG1-OE1 3.16Å; P1099-E1164 VanDerWaalsContact CA-OE1 3.31Å; P1099-E1164 WeakPolarHBondContact CA-OE1 3.32Å; S1100-E1164 WeakPolarHBondContact CB-OE2 3.25Å; S1100-E1164 VanDerWaalsContact N-CD 3.33Å; S1100-E1164 PolarHBondContact N-OE1 3.45Å; S1100-E1164 PolarHBondContact N-OE2 3.49Å; S1100-E1164 VanDerWaalsContact N-OE2 3.12Å; S1100-E1164 PolarHBondContact OG-OE2 3.26Å; M1103-E1164 VanDerWaalsContact CB-OE2 3.27Å; M1103-E1164 WeakPolarHBondContact CB-OE2 3.25Å; M1103-E1164 HydrophobicContact CE-CB 4.16Å; L1160-E1164 WeakPolarHBondContact O-CG 3.48Å; L1160-E1164 PolarHBondContact O-N 2.77Å; L1160-E1164 VanDerWaalsContact O-N 3.12Å; I1161-E1164 WeakPolarHBondContact O-CB 3.45Å; I1161-E1164 PolarHBondContact O-N 2.93Å; I1161-E1164 VanDerWaalsContact O-N 3.11Å; E1164-Y1168 WeakPolarHBondContact O-CB 3.47Å; E1164-Y1168 PolarHBondContact O-N 2.54Å
1165	I	91.6	Very high	90.3	Very high	15 Å²	15	45.9 Å²	45.9	8%	0.077	25%	0.252	C	S	.	.	H	α-helix	trans	-67.6	-45.1	178.5	-65.4	155.7	0	0	0	110.4	L1141 I1161 D1162 S1163 Y1167 Y1168 I1169 C1186 I1189	L1141-I1165 HydrophobicContact CD2-CD1 4.16Å; L1141-I1165 HydrophobicContact CD2-CG1 3.92Å; I1161-I1165 HydrophobicContact CG2-CD1 3.66Å; I1161-I1165 WeakPolarHBondContact O-CD1 3.33Å; I1161-I1165 VanDerWaalsContact O-CG1 3.29Å; I1161-I1165 WeakPolarHBondContact O-CG1 3.44Å; I1161-I1165 PolarHBondContact O-N 3.05Å; D1162-I1165 PolarHBondContact O-N 2.95Å; S1163-I1165 VanDerWaalsContact C-N 3.34Å; I1165-Y1167 VanDerWaalsContact C-N 3.34Å; I1165-Y1167 PolarHBondContact O-N 3.12Å; I1165-Y1168 PolarHBondContact O-N 3.29Å; I1165-I1169 HydrophobicContact CG2-CG1 3.98Å; I1165-I1169 WeakPolarHBondContact O-CB 3.3Å; I1165-I1169 VanDerWaalsContact O-CG1 3.28Å; I1165-I1169 WeakPolarHBondContact O-CG1 3.28Å; I1165-I1169 PolarHBondContact O-N 2.96Å; I1165-C1186 HydrophobicContact CG2-CB 3.85Å; I1165-C1186 VanDerWaalsContact CG2-SG 3.58Å; I1165-I1189 HydrophobicContact CD1-CD1 3.18Å; I1165-I1189 HydrophobicContact CG1-CD1 4.3Å
1166	L	91.4	Very high	90.4	Very high	101 Å²	101	45.6 Å²	45.6	53%	0.529	25%	0.248	S	C	.	.	H	α-helix	trans	-59	-45.4	177.2	-179.7	60.4	0	0	0	111.3	D1162 Y1168 I1169 D1170	D1162-L1166 VanDerWaalsContact O-CB 3.31Å; D1162-L1166 WeakPolarHBondContact O-CB 3.29Å; D1162-L1166 PolarHBondContact O-N 2.97Å; L1166-Y1168 PolarHBondContact O-N 3.36Å; L1166-I1169 PolarHBondContact O-N 3.15Å; L1166-D1170 WeakPolarHBondContact O-CB 3.47Å; L1166-D1170 PolarHBondContact O-N 2.92Å
1167	Y	92.2	Very high	90.5	Very high	85 Å²	85	45.2 Å²	45.2	33%	0.333	25%	0.245	S	C	.	.	H	α-helix	trans	-57.5	-48.5	173.5	174.3	-89.2	0	0	0	111.9	P1099 C1107 S1163 I1165 D1170 H1171	P1099-Y1167 HydrophobicContact CB-CD1 3.59Å; P1099-Y1167 HydrophobicContact CB-CD2 4.31Å; P1099-Y1167 HydrophobicContact CB-CE1 3.59Å; P1099-Y1167 HydrophobicContact CB-CE2 4.31Å; P1099-Y1167 HydrophobicContact CB-CG 3.97Å; P1099-Y1167 HydrophobicContact CG-CD1 4.19Å; P1099-Y1167 HydrophobicContact CG-CD2 4.27Å; P1099-Y1167 HydrophobicContact CG-CE1 3.79Å; P1099-Y1167 HydrophobicContact CG-CE2 3.88Å; P1099-Y1167 HydrophobicContact CG-CG 4.41Å; C1107-Y1167 HydrophobicContact CB-CE1 4.47Å; S1163-Y1167 PolarHBondContact O-N 2.75Å; S1163-Y1167 VanDerWaalsContact O-N 3.09Å; I1165-Y1167 VanDerWaalsContact C-N 3.34Å; I1165-Y1167 PolarHBondContact O-N 3.12Å; Y1167-D1170 PolarHBondContact O-N 3.33Å; Y1167-H1171 WeakPolarHBondContact O-CB 3.42Å; Y1167-H1171 PolarHBondContact O-N 2.98Å
1168	Y	93.6	Very high	90.6	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-43.9	178.8	162.2	-89.6	0	0	0	112.3	M1103 L1110 H1134 L1137 E1164 I1165 L1166 H1171 F1172	M1103-Y1168 HydrophobicContact SD-CD2 3.9Å; M1103-Y1168 HydrophobicContact SD-CG 3.97Å; L1110-Y1168 HydrophobicContact CD1-CE2 3.89Å; H1134-Y1168 AromaticContact CE1-CE1 3.82Å; H1134-Y1168 AromaticContact ND1-CE1 3.37Å; H1134-Y1168 WeakPolarHBondContact ND1-CE1 3.23Å; H1134-Y1168 AromaticContact ND1-CZ 3.66Å; H1134-Y1168 PolarHBondContact ND1-OH 3.12Å; L1137-Y1168 HydrophobicContact CD1-CD2 4.01Å; L1137-Y1168 HydrophobicContact CD1-CE2 3.57Å; L1137-Y1168 HydrophobicContact CD2-CD1 4.22Å; L1137-Y1168 HydrophobicContact CD2-CE1 3.89Å; L1137-Y1168 HydrophobicContact CD2-CE2 4.32Å; E1164-Y1168 WeakPolarHBondContact O-CB 3.47Å; E1164-Y1168 PolarHBondContact O-N 2.54Å; I1165-Y1168 PolarHBondContact O-N 3.29Å; L1166-Y1168 PolarHBondContact O-N 3.36Å; Y1168-H1171 PolarHBondContact O-N 3.41Å; Y1168-F1172 WeakPolarHBondContact O-CB 3.38Å; Y1168-F1172 PolarHBondContact O-N 2.96Å
1169	I	93.7	Very high	90.8	Very high	8 Å²	8	44.2 Å²	44.2	4%	0.041	24%	0.241	C	C	.	.	H	α-helix	trans	-65.8	-42.2	179.7	-74	-67.3	0	0	0	110.6	I1165 L1166 F1172 K1173 F1182	I1165-I1169 HydrophobicContact CG2-CG1 3.98Å; I1165-I1169 WeakPolarHBondContact O-CB 3.3Å; I1165-I1169 VanDerWaalsContact O-CG1 3.28Å; I1165-I1169 WeakPolarHBondContact O-CG1 3.28Å; I1165-I1169 PolarHBondContact O-N 2.96Å; L1166-I1169 PolarHBondContact O-N 3.15Å; I1169-F1172 WeakPolarHBondContact O-CB 3.22Å; I1169-F1172 PolarHBondContact O-N 3.14Å; I1169-K1173 HydrophobicContact CG2-CD 4.49Å; I1169-K1173 VanDerWaalsContact CG2-CE 3.47Å; I1169-K1173 VanDerWaalsContact O-CG 3.32Å; I1169-K1173 WeakPolarHBondContact O-CG 3.36Å; I1169-K1173 PolarHBondContact O-N 3.19Å; I1169-F1182 HydrophobicContact CD1-CE1 3.97Å
1170	D	93.1	Very high	90.9	Very high	78 Å²	78	47.6 Å²	47.6	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-68.4	-38.7	176.6	-78.5	-11.2	0	0	0	112.1	L1166 Y1167 K1173	L1166-D1170 WeakPolarHBondContact O-CB 3.47Å; L1166-D1170 PolarHBondContact O-N 2.92Å; Y1167-D1170 PolarHBondContact O-N 3.33Å; D1170-K1173 PolarHBondContact O-N 3.38Å; D1170-K1173 IonicContact OD1-NZ 2.97Å; D1170-K1173 PolarHBondContact OD1-NZ 3.17Å
1171	H	93.5	Very high	90.8	Very high	40 Å²	40	55 Å²	55	19%	0.185	28%	0.279	C	S	.	.	H	α-helix	trans	-60	-46.7	168.7	-176.7	73.6	0	0	0	111.2	C1107 S1111 Y1167 Y1168 K1173 T1174	C1107-H1171 WeakPolarHBondContact CB-CD2 3.4Å; C1107-H1171 PolarHBondContact O-NE2 2.9Å; S1111-H1171 PolarHBondContact OG-CE1 2.71Å; S1111-H1171 PolarHBondContact OG-NE2 3.07Å; Y1167-H1171 WeakPolarHBondContact O-CB 3.42Å; Y1167-H1171 PolarHBondContact O-N 2.98Å; Y1168-H1171 PolarHBondContact O-N 3.41Å; H1171-K1173 VanDerWaalsContact C-N 3.33Å; H1171-K1173 PolarHBondContact O-N 3.17Å; H1171-T1174 WeakPolarHBondContact O-CB 3.4Å; H1171-T1174 PolarHBondContact O-N 3.42Å; H1171-T1174 PolarHBondContact O-OG1 3.33Å
1172	F	94	Very high	90.9	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-39.4	179.8	-170.2	-103.1	0	0	0	112.6	L1110 L1130 L1131 H1134 Y1168 I1169 T1174 L1175 L1179 F1182	L1110-F1172 HydrophobicContact CD1-CD2 4.23Å; L1130-F1172 HydrophobicContact CB-CE2 3.8Å; L1130-F1172 HydrophobicContact CB-CZ 3.92Å; L1130-F1172 HydrophobicContact CD2-CE2 4.45Å; L1130-F1172 WeakPolarHBondContact O-CE2 3.27Å; L1130-F1172 WeakPolarHBondContact O-CZ 3.38Å; L1131-F1172 HydrophobicContact CD2-CE1 4.26Å; L1131-F1172 HydrophobicContact CD2-CZ 4.33Å; H1134-F1172 HydrophobicContact CB-CE1 4.35Å; H1134-F1172 HydrophobicContact CB-CE2 3.93Å; H1134-F1172 HydrophobicContact CB-CZ 3.66Å; Y1168-F1172 WeakPolarHBondContact O-CB 3.38Å; Y1168-F1172 PolarHBondContact O-N 2.96Å; I1169-F1172 WeakPolarHBondContact O-CB 3.22Å; I1169-F1172 PolarHBondContact O-N 3.14Å; F1172-T1174 PolarHBondContact O-N 2.88Å; F1172-L1175 HydrophobicContact CD2-CD1 3.81Å; F1172-L1175 HydrophobicContact CG-CD1 4.42Å; F1172-L1175 VanDerWaalsContact O-CB 3.32Å; F1172-L1175 WeakPolarHBondContact O-CB 3.42Å; F1172-L1175 WeakPolarHBondContact O-CG 3.31Å; F1172-L1175 PolarHBondContact O-N 3.02Å; F1172-L1175 VanDerWaalsContact O-N 3.15Å; F1172-L1179 HydrophobicContact CD1-CD1 4.07Å; F1172-L1179 HydrophobicContact CD1-CD2 4.2Å; F1172-L1179 HydrophobicContact CE1-CD1 3.78Å; F1172-L1179 HydrophobicContact CE1-CD2 3.57Å; F1172-L1179 HydrophobicContact CE1-CG 4.26Å; F1172-L1179 HydrophobicContact CE2-CD1 4.33Å; F1172-L1179 HydrophobicContact CG-CD1 4.47Å; F1172-L1179 HydrophobicContact CZ-CD1 3.91Å; F1172-L1179 HydrophobicContact CZ-CD2 4.2Å; F1172-F1182 AromaticContact CD1-CD1 3.64Å; F1172-F1182 HydrophobicContact CD1-CD1 3.64Å; F1172-F1182 AromaticContact CD1-CE1 3.87Å; F1172-F1182 HydrophobicContact CD1-CE1 3.87Å; F1172-F1182 HydrophobicContact CD1-CG 4.31Å; F1172-F1182 AromaticContact CE1-CD1 3.77Å; F1172-F1182 HydrophobicContact CE1-CD1 3.77Å; F1172-F1182 AromaticContact CE1-CE1 3.76Å; F1172-F1182 HydrophobicContact CE1-CE1 3.76Å; F1172-F1182 HydrophobicContact CE1-CG 4.18Å; F1172-F1182 HydrophobicContact CE1-CZ 4.18Å
1173	K	93.2	Very high	90.8	Very high	54 Å²	54	59.8 Å²	59.8	24%	0.235	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-28.9	173.8	-70.8	166	-166.2	158.7	0	113.5	I1169 D1170 H1171 L1179 Q1180 F1182	I1169-K1173 HydrophobicContact CG2-CD 4.49Å; I1169-K1173 VanDerWaalsContact CG2-CE 3.47Å; I1169-K1173 VanDerWaalsContact O-CG 3.32Å; I1169-K1173 WeakPolarHBondContact O-CG 3.36Å; I1169-K1173 PolarHBondContact O-N 3.19Å; D1170-K1173 PolarHBondContact O-N 3.38Å; D1170-K1173 IonicContact OD1-NZ 2.97Å; D1170-K1173 PolarHBondContact OD1-NZ 3.17Å; H1171-K1173 VanDerWaalsContact C-N 3.33Å; H1171-K1173 PolarHBondContact O-N 3.17Å; K1173-L1179 WeakPolarHBondContact CA-O 3.14Å; K1173-L1179 WeakPolarHBondContact CG-O 3.45Å; K1173-L1179 CarbonylContact O-C 3.21Å; K1173-Q1180 PolarHBondContact O-N 3.45Å; K1173-F1182 WeakPolarHBondContact CE-O 3.42Å
1174	T	91.8	Very high	90.7	Very high	102 Å²	102	59.7 Å²	59.7	63%	0.626	30%	0.303	S	S	*	.	H	α-helix	trans	-77.5	-19.1	178.8	73.5	0	0	0	0	114	H1171 F1172 T1176	H1171-T1174 WeakPolarHBondContact O-CB 3.4Å; H1171-T1174 PolarHBondContact O-N 3.42Å; H1171-T1174 PolarHBondContact O-OG1 3.33Å; F1172-T1174 PolarHBondContact O-N 2.88Å; T1174-T1176 PolarHBondContact O-N 3.11Å
1175	L	91.1	Very high	90.3	Very high	19 Å²	19	65.7 Å²	65.7	10%	0.099	34%	0.336	C	S	.	.	S	Bend	trans	-68.4	-35.6	-164.6	-66.8	-174.3	0	0	0	114.2	L1110 I1114 L1130 F1172 L1179	L1110-L1175 HydrophobicContact CB-CD1 3.91Å; L1110-L1175 HydrophobicContact CD1-CD1 3.9Å; I1114-L1175 HydrophobicContact CD1-CB 3.58Å; I1114-L1175 HydrophobicContact CD1-CD1 3.85Å; I1114-L1175 HydrophobicContact CD1-CD2 3.7Å; I1114-L1175 HydrophobicContact CD1-CG 3.88Å; L1130-L1175 HydrophobicContact CD1-CB 4.02Å; L1130-L1175 HydrophobicContact CD1-CD1 4.39Å; L1130-L1175 HydrophobicContact CD2-CD1 4.05Å; F1172-L1175 HydrophobicContact CD2-CD1 3.81Å; F1172-L1175 HydrophobicContact CG-CD1 4.42Å; F1172-L1175 VanDerWaalsContact O-CB 3.32Å; F1172-L1175 WeakPolarHBondContact O-CB 3.42Å; F1172-L1175 WeakPolarHBondContact O-CG 3.31Å; F1172-L1175 PolarHBondContact O-N 3.02Å; F1172-L1175 VanDerWaalsContact O-N 3.15Å; L1175-L1179 HydrophobicContact CB-CD1 4.31Å
1176	T	88.7	Confident	90.1	Very high	7 Å²	7	65.2 Å²	65.2	4%	0.043	33%	0.333	C	S	.	.	S	Bend	trans	-139.5	154	171.1	77.4	0	0	0	0	110.5	L1126 T1127 L1130 T1174 Q1178 L1179	L1126-T1176 HydrophobicContact CB-CG2 4.09Å; T1127-T1176 PolarHBondContact OG1-OG1 3.15Å; L1130-T1176 HydrophobicContact CD1-CG2 3.65Å; T1174-T1176 PolarHBondContact O-N 3.11Å; T1176-Q1178 PolarHBondContact O-N 3.19Å; T1176-Q1178 VanDerWaalsContact O-N 3.08Å; T1176-Q1178 PolarHBondContact OG1-N 3.08Å; T1176-L1179 HydrophobicContact CG2-CD1 4.45Å; T1176-L1179 PolarHBondContact O-N 3.2Å; T1176-L1179 WeakPolarHBondContact OG1-CG 3.48Å; T1176-L1179 PolarHBondContact OG1-N 3.09Å
1177	P	85.9	Confident	89.8	Confident	96 Å²	96	64.1 Å²	64.1	62%	0.623	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.9	176.4	-25.1	35	0	0	0	114.2
1178	Q	87	Confident	89.5	Confident	95 Å²	95	63.9 Å²	63.9	44%	0.444	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-26.1	179	-65.6	177.4	-11.6	0	0	112.1	P1123 T1127 T1176	P1123-Q1178 PolarHBondContact O-OE1 3.15Å; T1127-Q1178 HydrophobicContact CG2-CB 4.15Å; T1127-Q1178 PolarHBondContact OG1-OE1 3.44Å; T1176-Q1178 PolarHBondContact O-N 3.19Å; T1176-Q1178 VanDerWaalsContact O-N 3.08Å; T1176-Q1178 PolarHBondContact OG1-N 3.08Å
1179	L	90.8	Very high	89.3	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.016	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-82.5	-7.3	177.4	-68.3	173.2	0	0	0	113.7	T1127 L1130 L1131 F1172 K1173 L1175 T1176 K1181 F1182	T1127-L1179 HydrophobicContact CG2-CD2 3.83Å; T1127-L1179 HydrophobicContact CG2-CG 3.95Å; L1130-L1179 HydrophobicContact CB-CD1 4.2Å; L1130-L1179 HydrophobicContact CD1-CD1 3.81Å; L1131-L1179 HydrophobicContact CD2-CD2 4.21Å; F1172-L1179 HydrophobicContact CD1-CD1 4.07Å; F1172-L1179 HydrophobicContact CD1-CD2 4.2Å; F1172-L1179 HydrophobicContact CE1-CD1 3.78Å; F1172-L1179 HydrophobicContact CE1-CD2 3.57Å; F1172-L1179 HydrophobicContact CE1-CG 4.26Å; F1172-L1179 HydrophobicContact CE2-CD1 4.33Å; F1172-L1179 HydrophobicContact CG-CD1 4.47Å; F1172-L1179 HydrophobicContact CZ-CD1 3.91Å; F1172-L1179 HydrophobicContact CZ-CD2 4.2Å; K1173-L1179 WeakPolarHBondContact CA-O 3.14Å; K1173-L1179 WeakPolarHBondContact CG-O 3.45Å; K1173-L1179 CarbonylContact O-C 3.21Å; L1175-L1179 HydrophobicContact CB-CD1 4.31Å; T1176-L1179 HydrophobicContact CG2-CD1 4.45Å; T1176-L1179 PolarHBondContact O-N 3.2Å; T1176-L1179 WeakPolarHBondContact OG1-CG 3.48Å; T1176-L1179 PolarHBondContact OG1-N 3.09Å; L1179-K1181 PolarHBondContact O-N 2.78Å; L1179-K1181 VanDerWaalsContact O-N 3.07Å; L1179-F1182 HydrophobicContact CB-CB 4.33Å; L1179-F1182 HydrophobicContact CD2-CB 3.93Å; L1179-F1182 HydrophobicContact CD2-CD2 4.11Å; L1179-F1182 HydrophobicContact CD2-CG 4.03Å; L1179-F1182 WeakPolarHBondContact O-CB 3.33Å; L1179-F1182 PolarHBondContact O-N 3.03Å
1180	Q	89.1	Confident	89	Confident	143 Å²	143	64.9 Å²	64.9	67%	0.668	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-58.8	-23.9	177.4	-70.4	-174.4	-21.6	0	0	114.2	K1173	K1173-Q1180 PolarHBondContact O-N 3.45Å
1181	K	87	Confident	88.1	Confident	198 Å²	198	63.3 Å²	63.3	86%	0.861	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-107.9	14.4	174.8	-62.2	-172.9	178.8	-175.6	0	112.9	L1179 V1183	L1179-K1181 PolarHBondContact O-N 2.78Å; L1179-K1181 VanDerWaalsContact O-N 3.07Å; K1181-V1183 PolarHBondContact O-N 3.1Å
1182	F	90.5	Very high	86.9	Confident	35 Å²	35	69.7 Å²	69.7	15%	0.154	39%	0.385	C	S	.	.			trans	-69.7	128.7	175.8	-175.4	-106.3	0	0	0	109.9	L1131 H1134 I1169 F1172 K1173 L1179 D1184	L1131-F1182 HydrophobicContact CD2-CD2 3.93Å; L1131-F1182 HydrophobicContact CD2-CE2 3.43Å; L1131-F1182 VanDerWaalsContact CD2-CE2 3.43Å; L1131-F1182 HydrophobicContact CD2-CZ 4.03Å; H1134-F1182 AromaticContact CD2-CZ 3.67Å; H1134-F1182 AromaticContact NE2-CE1 3.92Å; H1134-F1182 AromaticContact NE2-CZ 3.71Å; I1169-F1182 HydrophobicContact CD1-CE1 3.97Å; F1172-F1182 AromaticContact CD1-CD1 3.64Å; F1172-F1182 HydrophobicContact CD1-CD1 3.64Å; F1172-F1182 AromaticContact CD1-CE1 3.87Å; F1172-F1182 HydrophobicContact CD1-CE1 3.87Å; F1172-F1182 HydrophobicContact CD1-CG 4.31Å; F1172-F1182 AromaticContact CE1-CD1 3.77Å; F1172-F1182 HydrophobicContact CE1-CD1 3.77Å; F1172-F1182 AromaticContact CE1-CE1 3.76Å; F1172-F1182 HydrophobicContact CE1-CE1 3.76Å; F1172-F1182 HydrophobicContact CE1-CG 4.18Å; F1172-F1182 HydrophobicContact CE1-CZ 4.18Å; K1173-F1182 WeakPolarHBondContact CE-O 3.42Å; L1179-F1182 HydrophobicContact CB-CB 4.33Å; L1179-F1182 HydrophobicContact CD2-CB 3.93Å; L1179-F1182 HydrophobicContact CD2-CD2 4.11Å; L1179-F1182 HydrophobicContact CD2-CG 4.03Å; L1179-F1182 WeakPolarHBondContact O-CB 3.33Å; L1179-F1182 PolarHBondContact O-N 3.03Å; F1182-D1184 HydrophobicContact CE1-CB 3.71Å; F1182-D1184 HydrophobicContact CZ-CB 3.64Å
1183	V	86.9	Confident	86.6	Confident	128 Å²	128	73.2 Å²	73.2	78%	0.776	41%	0.405	S	S	*	.			trans	-135.3	121.9	174.8	-177.9	0	0	0	0	106.6	K1181	K1181-V1183 PolarHBondContact O-N 3.1Å
1184	D	88.7	Confident	86.2	Confident	43 Å²	43	74.2 Å²	74.2	23%	0.23	41%	0.414	C	S	.	.			trans	-138.5	130.2	169.8	-166.3	-45	0	0	0	104.6	H1134 K1138 F1182 C1186	H1134-D1184 IonicContact NE2-OD2 3.85Å; H1134-D1184 PolarHBondContact NE2-OD2 2.95Å; K1138-D1184 WeakPolarHBondContact CE-OD2 3.43Å; K1138-D1184 IonicContact NZ-OD1 2.72Å; K1138-D1184 PolarHBondContact NZ-OD1 3.05Å; K1138-D1184 IonicContact NZ-OD2 3.67Å; K1138-D1184 PolarHBondContact NZ-OD2 2.91Å; F1182-D1184 HydrophobicContact CE1-CB 3.71Å; F1182-D1184 HydrophobicContact CZ-CB 3.64Å; D1184-C1186 VanDerWaalsContact C-N 3.27Å; D1184-C1186 WeakPolarHBondContact OD1-CA 3.29Å; D1184-C1186 PolarHBondContact OD1-N 2.65Å
1185	D	83.4	Confident	85.9	Confident	128 Å²	128	72.7 Å²	72.7	68%	0.684	40%	0.402	S	S	*	.			trans	-84.5	-7	178.9	59.8	30.1	0	0	0	112.3	S1187	D1185-S1187 PolarHBondContact O-N 3.19Å; D1185-S1187 VanDerWaalsContact O-N 3.09Å; D1185-S1187 WeakPolarHBondContact OD1-CB 3.48Å; D1185-S1187 PolarHBondContact OD1-N 3Å; D1185-S1187 PolarHBondContact OD1-OG 3.03Å
1186	C	86.7	Confident	85.6	Confident	4 Å²	4	75.8 Å²	75.8	3%	0.027	42%	0.42	C	S	.	.			trans	53.1	22.3	-176	-62.6	0	0	0	0	113.6	K1138 I1165 D1184 D1188 I1189	K1138-C1186 HydrophobicContact CD-CB 4.27Å; I1165-C1186 HydrophobicContact CG2-CB 3.85Å; I1165-C1186 VanDerWaalsContact CG2-SG 3.58Å; D1184-C1186 VanDerWaalsContact C-N 3.27Å; D1184-C1186 WeakPolarHBondContact OD1-CA 3.29Å; D1184-C1186 PolarHBondContact OD1-N 2.65Å; C1186-D1188 PolarHBondContact O-N 3.17Å; C1186-D1188 VanDerWaalsContact O-N 3.15Å; C1186-I1189 HydrophobicContact CB-CD1 4.28Å; C1186-I1189 HydrophobicContact CB-CG2 4.06Å; C1186-I1189 WeakPolarHBondContact O-CG1 3.39Å; C1186-I1189 WeakPolarHBondContact O-CG2 3.27Å; C1186-I1189 PolarHBondContact O-N 2.91Å; C1186-I1189 VanDerWaalsContact O-N 3.09Å
1187	S	84.3	Confident	85.4	Confident	78 Å²	78	80.1 Å²	80.1	55%	0.545	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-60.2	-25.8	179.4	56.2	0	0	0	0	113	D1185 I1189	D1185-S1187 PolarHBondContact O-N 3.19Å; D1185-S1187 VanDerWaalsContact O-N 3.09Å; D1185-S1187 WeakPolarHBondContact OD1-CB 3.48Å; D1185-S1187 PolarHBondContact OD1-N 3Å; D1185-S1187 PolarHBondContact OD1-OG 3.03Å; S1187-I1189 VanDerWaalsContact C-N 3.27Å; S1187-I1189 PolarHBondContact O-N 3.46Å
1188	D	87.7	Confident	85.4	Confident	81 Å²	81	79.1 Å²	79.1	43%	0.433	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-71.5	-11.8	177.1	66.4	-34.4	0	0	0	114.7	K1138 R1142 C1186 W1190	K1138-D1188 WeakPolarHBondContact CE-OD1 3.32Å; K1138-D1188 VanDerWaalsContact CE-OD2 3.24Å; K1138-D1188 WeakPolarHBondContact CE-OD2 3.23Å; K1138-D1188 IonicContact NZ-OD1 3.79Å; K1138-D1188 PolarHBondContact NZ-OD1 3.16Å; K1138-D1188 IonicContact NZ-OD2 2.71Å; K1138-D1188 PolarHBondContact NZ-OD2 2.74Å; R1142-D1188 VanDerWaalsContact CD-O 3.24Å; R1142-D1188 WeakPolarHBondContact CD-O 3.4Å; R1142-D1188 PolarHBondContact NE-O 2.72Å; R1142-D1188 VanDerWaalsContact NE-O 3.08Å; C1186-D1188 PolarHBondContact O-N 3.17Å; C1186-D1188 VanDerWaalsContact O-N 3.15Å; D1188-W1190 VanDerWaalsContact C-N 3.27Å; D1188-W1190 PolarHBondContact O-N 2.97Å
1189	I	88.5	Confident	85.3	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-73.3	-19.9	176.3	77.6	-169.7	0	0	0	113	K1138 L1141 R1142 I1145 I1165 C1186 S1187	K1138-I1189 HydrophobicContact CB-CG2 3.92Å; K1138-I1189 HydrophobicContact CD-CG2 4.1Å; K1138-I1189 HydrophobicContact CG-CG2 4.09Å; L1141-I1189 HydrophobicContact CD2-CD1 4Å; L1141-I1189 HydrophobicContact CD2-CG2 4.49Å; R1142-I1189 VanDerWaalsContact CA-O 3.25Å; R1142-I1189 WeakPolarHBondContact CA-O 3.46Å; R1142-I1189 HydrophobicContact CB-CB 4.43Å; R1142-I1189 VanDerWaalsContact CB-O 3.25Å; R1142-I1189 WeakPolarHBondContact CB-O 3.18Å; R1142-I1189 WeakPolarHBondContact CG-O 3.25Å; I1145-I1189 HydrophobicContact CD1-CB 4.46Å; I1145-I1189 HydrophobicContact CD1-CD1 3.9Å; I1145-I1189 HydrophobicContact CD1-CG1 3.93Å; I1165-I1189 HydrophobicContact CD1-CD1 3.18Å; I1165-I1189 HydrophobicContact CG1-CD1 4.3Å; C1186-I1189 HydrophobicContact CB-CD1 4.28Å; C1186-I1189 HydrophobicContact CB-CG2 4.06Å; C1186-I1189 WeakPolarHBondContact O-CG1 3.39Å; C1186-I1189 WeakPolarHBondContact O-CG2 3.27Å; C1186-I1189 PolarHBondContact O-N 2.91Å; C1186-I1189 VanDerWaalsContact O-N 3.09Å; S1187-I1189 VanDerWaalsContact C-N 3.27Å; S1187-I1189 PolarHBondContact O-N 3.46Å
1190	W	87.6	Confident	84.8	Confident	29 Å²	29	83.7 Å²	83.7	11%	0.11	46%	0.462	C	S	.	.	S	Bend	trans	-79.1	141.2	-174.2	-64.1	102.6	0	0	0	110.4	R1142 I1145 I1150 A1152 Q1158 I1161 D1188	R1142-W1190 PolarHBondContact NE-O 3.41Å; R1142-W1190 VanDerWaalsContact NE-O 3.16Å; R1142-W1190 PolarHBondContact NH2-O 3.43Å; I1145-W1190 HydrophobicContact CD1-CE3 4.44Å; I1145-W1190 HydrophobicContact CD1-CH2 4.4Å; I1145-W1190 HydrophobicContact CD1-CZ3 4.24Å; I1145-W1190 HydrophobicContact CG2-CE3 3.71Å; I1145-W1190 HydrophobicContact CG2-CZ3 3.73Å; I1150-W1190 HydrophobicContact CG2-CZ3 4.08Å; A1152-W1190 HydrophobicContact CB-CB 4.44Å; A1152-W1190 HydrophobicContact CB-CD2 3.87Å; A1152-W1190 HydrophobicContact CB-CE3 4.08Å; A1152-W1190 HydrophobicContact CB-CG 4.01Å; Q1158-W1190 HydrophobicContact CB-CH2 4.16Å; Q1158-W1190 HydrophobicContact CG-CH2 4.04Å; Q1158-W1190 HydrophobicContact CG-CZ2 3.87Å; I1161-W1190 HydrophobicContact CB-CH2 3.98Å; I1161-W1190 HydrophobicContact CB-CZ2 4.35Å; I1161-W1190 HydrophobicContact CD1-CH2 3.89Å; I1161-W1190 HydrophobicContact CD1-CZ3 4.33Å; I1161-W1190 HydrophobicContact CG2-CH2 3.72Å; I1161-W1190 HydrophobicContact CG2-CZ2 3.85Å; D1188-W1190 VanDerWaalsContact C-N 3.27Å; D1188-W1190 PolarHBondContact O-N 2.97Å
1191	P	74.8	Confident	84.5	Confident	45 Å²	45	78.8 Å²	78.8	29%	0.292	45%	0.445	S	S	.	.			trans	-65.5	136.1	168	26.3	-31.3	0	0	0	109.5	I1145	I1145-P1191 HydrophobicContact CG2-CG 4.35Å
1192	S	67.8	Low	84.3	Confident	175 Å²	175	67.9 Å²	67.9	100%	1.224	41%	0.407	S	S	*	.			trans	-98.3	0	-176.5	57.8	0	0	0	0	112.1

Retrieved 1,192 of 1,192 residues in 1988 ms (Link to these results)

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