A0A087XCB7_POEFO Loading...

Cilia and flagella associated protein 70

AlphaFold DB , UniProt , Accession A0A087XCB7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,149 aa.

						>A0A087XCB7_POEFO|A0A087XCB7
MSTAHTSEETIKHDKTNVSIDITAKCGRNIQGKKGDNLVSFLQVSIEEINLGESEKKHANPMKHTIDYDFTCTYNSPNDAQAFSDILQKPIIFTVVEVLHEGKKGELKTAVLGQAVVDLFPLLQGQCSFSSTVPLNPVVNPGIKESRQGMSRKQPTLEVFVSVTEPLLTEPELSTCIIMKVTVETAFSVPDTWTLPTGSAHSPFAYFAALEVPLTAENDQALMFSEGHLMPGGLREGKGRRKRRPLQSLLVPGNQFLPGSFCQPEPIDHEDGELTSLEDQAFRDEAEITKNRVRWDTEIRCFLDACAASRLKEKITDSRLWPVELMRTSIPLSRLGDENPEIPFHGLIFVDMGRLLYPGVSRIRGAYTVHPFYESELLNKVSNCHSSIACSTQTYIIYKTIYFHIYKTKRKASVLKEQAKIATVLAKSRASIQQSVPPPKPTTCDEASESASEPETKVNVEGNMYLEAKTYVIIEVSLNRPLVPKTSPEELARRVKALIPPKPKRPAGPTRAEKAVVDFHTQVGNAVAAVSEQFAEIFGANSKLQESLSKEQILAEVMGGLNVSGRYFAFKEQIKRAVVKIVRDKMQRSRPLTDPQEVKEFVSKLYVYLVDEMHVALNKIYSSDVAEDCTDEMKLESSQLRHFAKEAQLTSNYQQAAQYYQELVVRHPDEPLYKFEWGSLYMLIGDYMKAKECYYDAVSIQQTHQPSLMMCGVVAVMFERYNEAQTFLERATSLEPPSVEAWTLMDLYTYTDSRNLSERNKTFREDVYSFYMTMFTEMLQTTAQINYNEAHILKLATLRFTVQKFPLTDGLLHLSLNEAFLPERAFLEAKKIFGEEEANRANADDKTKLSEDNSEEAKAQQDEHETDNSALPHIAEHDPEFPDHDMEESREASLHIDKSWTSPTKLTSSIFTQTLKFLLQNNALQMAEHALSQELLGSKGGCSMAYYYSLAQFQLLKGDYSSAIDSVKEALFYKSQYPDAWALKGHCHYLQGTFTEARECYEWSMVFPEPPSDTHIVHLRLGAIYILEEKFIQAKEVFLQACEQSPSCLTWLGLGKACYRLGELCVAEEALAVATLLNSANAEVWAYLSLISLKSGQLQEGDEYYKNAISFDFQDSSLNEEISEAKRQTRMSKLASCFNASPQAEAETV
					

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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	35.2	Very low	26.5	Very low	249 Å²	249	147.4 Å²	147.4	100%	1.227	82%	0.823	S	S	*	*				0	129	0	-85.7	-178.3	164.4	0	0	107.4
2	S	26.3	Very low	26.6	Very low	105 Å²	105	151.8 Å²	151.8	73%	0.734	83%	0.827	S	S	*	*			trans	-73.1	162.9	-178.2	166.9	0	0	0	0	111.8
3	T	25.2	Very low	27	Very low	134 Å²	134	152.5 Å²	152.5	82%	0.822	82%	0.821	S	S	*	*			trans	87.4	134.5	165.7	74.5	0	0	0	0	115.8
4	A	24.4	Very low	27.5	Very low	87 Å²	87	151.9 Å²	151.9	72%	0.719	82%	0.817	S	S	*	*			cis	-151.1	131.6	16	0	0	0	0	0	111.6
5	H	25.9	Very low	28.7	Very low	200 Å²	200	150 Å²	150	93%	0.926	80%	0.799	S	S	*	*			trans	-79.3	113.9	156	-89.8	-61.3	0	0	0	107.7
6	T	25.2	Very low	30.7	Very low	127 Å²	127	146.4 Å²	146.4	78%	0.779	78%	0.784	S	S	*	*			trans	-91.6	106.1	161.2	40.2	0	0	0	0	108.1	E8	T6-E8 PolarHBondContact O-N 2.8Å
7	S	24.9	Very low	33.2	Very low	106 Å²	106	143.7 Å²	143.7	74%	0.741	77%	0.77	S	S	*	*			trans	-68	99.4	163.4	47.6	0	0	0	0	109.2	E9	S7-E9 PolarHBondContact O-N 3.43Å
8	E	24.7	Very low	35.9	Very low	176 Å²	176	137.3 Å²	137.3	82%	0.822	74%	0.736	S	S	*	*			trans	-78.7	93.4	159.1	-79.8	-176.4	161.2	0	0	107.8	T6 T10	T6-E8 PolarHBondContact O-N 2.8Å; E8-T10 VanDerWaalsContact C-N 3.26Å; E8-T10 PolarHBondContact O-N 3.38Å
9	E	25.4	Very low	38.6	Very low	180 Å²	180	132.3 Å²	132.3	84%	0.841	71%	0.713	S	S	*	*			trans	-61.3	93.2	157.7	-76	-179.3	149.1	0	0	107.8	S7 I11	S7-E9 PolarHBondContact O-N 3.43Å; E9-I11 PolarHBondContact O-N 2.8Å
10	T	27.2	Very low	41.2	Very low	122 Å²	122	125.7 Å²	125.7	75%	0.748	68%	0.677	S	S	*	*			trans	-63.8	106.4	165.6	44.8	0	0	0	0	108.5	E8 K12	E8-T10 VanDerWaalsContact C-N 3.26Å; E8-T10 PolarHBondContact O-N 3.38Å; T10-K12 PolarHBondContact O-N 3Å
11	I	27.6	Very low	43.5	Very low	135 Å²	135	122 Å²	122	69%	0.692	66%	0.658	S	S	*	*			trans	-46.4	107.5	166.5	-63.8	167.1	0	0	0	108.1	E9 H13	E9-I11 PolarHBondContact O-N 2.8Å; I11-H13 VanDerWaalsContact C-N 3.3Å; I11-H13 PolarHBondContact O-N 3.26Å
12	K	27.7	Very low	46.2	Very low	200 Å²	200	110.1 Å²	110.1	87%	0.87	60%	0.599	S	S	*	*			trans	-62.3	93.8	163.8	-80.6	180	173.7	179.8	0	107.7	T10 D14	T10-K12 PolarHBondContact O-N 3Å; K12-D14 PolarHBondContact O-N 2.92Å
13	H	31.6	Very low	49.3	Very low	161 Å²	161	106.1 Å²	106.1	75%	0.745	57%	0.57	S	S	*	*			trans	-72.9	107.7	162.4	-91.4	-64.3	0	0	0	108.3	I11 K15	I11-H13 VanDerWaalsContact C-N 3.3Å; I11-H13 PolarHBondContact O-N 3.26Å; H13-K15 PolarHBondContact O-N 2.82Å
14	D	34.2	Very low	52.3	Low	145 Å²	145	99.7 Å²	99.7	78%	0.775	53%	0.531	S	S	*	.			trans	-56.2	79	162.4	-86.8	-32.5	0	0	0	110.7	K12	K12-D14 PolarHBondContact O-N 2.92Å
15	K	45.8	Very low	55.4	Low	123 Å²	123	100.5 Å²	100.5	54%	0.535	52%	0.518	S	S	.	.			trans	-97.1	71.2	159.1	-83.4	-177.5	171.8	174.1	0	107.9	H13 E165	H13-K15 PolarHBondContact O-N 2.82Å; K15-E165 IonicContact NZ-OE1 3.58Å; K15-E165 PolarHBondContact NZ-OE1 2.86Å; K15-E165 IonicContact NZ-OE2 2.82Å; K15-E165 PolarHBondContact NZ-OE2 2.84Å
16	T	60.1	Low	58.3	Low	93 Å²	93	91.6 Å²	91.6	57%	0.571	48%	0.478	S	S	*	.			trans	-75.1	-23.4	-172.2	46.5	0	0	0	0	113.7
17	N	73.9	Confident	61.2	Low	100 Å²	100	85.5 Å²	85.5	54%	0.535	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.2	178.9	-68.6	-36.5	0	0	0	111.5	S76	N17-S76 CarbonylContact C-O 3.33Å; N17-S76 WeakPolarHBondContact CA-O 3.28Å
18	V	81.6	Confident	64.1	Low	28 Å²	28	85.4 Å²	85.4	17%	0.17	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131	173	-174.1	0	0	0	0	109.6	N75 S76 N78 V163 L167	V18-N75 WeakPolarHBondContact O-CA 3.38Å; V18-S76 PolarHBondContact N-O 3.23Å; V18-S76 PolarHBondContact O-N 2.96Å; V18-N78 HydrophobicContact CG2-CB 3.99Å; V18-V163 HydrophobicContact CG1-CG1 3.6Å; V18-L167 HydrophobicContact CB-CD2 4.24Å; V18-L167 HydrophobicContact CG1-CD2 3.57Å
19	S	86.9	Confident	66.8	Low	42 Å²	42	79.2 Å²	79.2	29%	0.294	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	117.2	177.1	55.8	0	0	0	0	110.8
20	I	89.8	Confident	69.5	Low	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	114.3	176	-56.9	175.1	0	0	0	108.3	I22 T73 Y74 I86 L119 L122 V161 V163	I20-I22 HydrophobicContact CG2-CG1 4.26Å; I20-T73 CarbonylContact O-C 3.59Å; I20-T73 WeakPolarHBondContact O-CA 3.38Å; I20-Y74 HydrophobicContact CD1-CD1 4.21Å; I20-Y74 PolarHBondContact N-O 2.91Å; I20-Y74 PolarHBondContact O-N 3.25Å; I20-I86 HydrophobicContact CD1-CD1 4.26Å; I20-L119 HydrophobicContact CD1-CD1 4.24Å; I20-L119 HydrophobicContact CG2-CD2 4.35Å; I20-L122 HydrophobicContact CD1-CD1 4.15Å; I20-L122 HydrophobicContact CG2-CD1 3.95Å; I20-V161 HydrophobicContact CG2-CG1 3.68Å; I20-V163 HydrophobicContact CB-CG2 4.33Å; I20-V163 HydrophobicContact CG1-CG2 3.93Å; I20-V163 HydrophobicContact CG2-CG2 4.14Å
21	D	90.6	Very high	71.7	Confident	49 Å²	49	71.9 Å²	71.9	26%	0.262	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	124.3	178.4	-70.8	-28.5	0	0	0	110.4	T71 T73 V161 S162	D21-T71 HydrophobicContact CB-CG2 4.38Å; D21-T73 WeakPolarHBondContact OD1-CB 3.41Å; D21-T73 WeakPolarHBondContact OD1-CG2 3.31Å; D21-T73 PolarHBondContact OD1-OG1 3.02Å; D21-V161 CarbonylContact O-C 3.53Å; D21-V161 WeakPolarHBondContact O-CA 3.46Å; D21-S162 PolarHBondContact N-O 3.1Å; D21-S162 PolarHBondContact O-N 3.23Å
22	I	91.9	Very high	73.8	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	114.4	-176.1	-58.8	151.1	0	0	0	107.6	I20 L51 T71 C72 I91 F93 V159 V161	I20-I22 HydrophobicContact CG2-CG1 4.26Å; I22-L51 HydrophobicContact CD1-CD1 4.17Å; I22-T71 CarbonylContact O-C 3.58Å; I22-T71 WeakPolarHBondContact O-CA 3.45Å; I22-C72 PolarHBondContact N-O 2.78Å; I22-C72 PolarHBondContact O-N 3.02Å; I22-I91 HydrophobicContact CD1-CD1 3.38Å; I22-I91 HydrophobicContact CD1-CG1 4.27Å; I22-I91 HydrophobicContact CG1-CD1 3.78Å; I22-I91 HydrophobicContact CG2-CD1 4.38Å; I22-F93 HydrophobicContact CG2-CE1 4.25Å; I22-F93 HydrophobicContact CG2-CE2 4.49Å; I22-F93 HydrophobicContact CG2-CZ 3.54Å; I22-V159 HydrophobicContact CG2-CG1 4.27Å; I22-V161 HydrophobicContact CG1-CG1 4.47Å; I22-V161 HydrophobicContact CG2-CG2 4.49Å
23	T	90.2	Very high	75.8	Confident	20 Å²	20	63.5 Å²	63.5	12%	0.123	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.6	-176.3	-56.3	0	0	0	0	111.2	K25 F70 T71 V159 F160	T23-K25 HydrophobicContact CG2-CG 4.15Å; T23-F70 CarbonylContact C-O 3.59Å; T23-F70 VanDerWaalsContact CA-O 3.27Å; T23-F70 WeakPolarHBondContact CA-O 3.45Å; T23-T71 WeakPolarHBondContact CG2-OG1 3.43Å; T23-T71 WeakPolarHBondContact OG1-CG2 3.38Å; T23-T71 PolarHBondContact OG1-OG1 2.76Å; T23-V159 CarbonylContact O-C 3.54Å; T23-V159 WeakPolarHBondContact O-CA 3.46Å; T23-F160 PolarHBondContact N-O 3.09Å; T23-F160 PolarHBondContact O-N 2.76Å
24	A	89.8	Confident	77.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	111.9	168.3	0	0	0	0	0	109.6	L42 D69 F70 F93	A24-L42 HydrophobicContact CB-CD1 3.42Å; A24-L42 VanDerWaalsContact CB-CD1 3.42Å; A24-D69 WeakPolarHBondContact O-CA 3.24Å; A24-D69 PolarHBondContact O-N 2.73Å; A24-F70 PolarHBondContact N-O 2.82Å; A24-F70 PolarHBondContact O-N 3Å; A24-F93 HydrophobicContact CB-CD1 4.3Å; A24-F93 HydrophobicContact CB-CE1 3.9Å
25	K	87.9	Confident	78.3	Confident	104 Å²	104	58.4 Å²	58.4	45%	0.452	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-67.5	-175.8	-71.7	-170	174.5	-177.1	0	111.9	T23 Y68 D69 E158	T23-K25 HydrophobicContact CG2-CG 4.15Å; K25-Y68 PolarHBondContact O-N 3.48Å; K25-D69 PolarHBondContact O-N 3.03Å; K25-D69 VanDerWaalsContact O-N 3.15Å; K25-E158 PolarHBondContact N-O 3.35Å
26	C	87.4	Confident	78.8	Confident	12 Å²	12	59.8 Å²	59.8	8%	0.081	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	129.1	-167.1	172	0	0	0	0	111.6	I66 E158	C26-I66 CarbonylContact C-O 3.49Å; C26-I66 WeakPolarHBondContact CA-O 3.25Å; C26-E158 PolarHBondContact O-N 3.14Å
27	G	85.6	Confident	79.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	134.8	164.7	0	0	0	0	0	111.1	T65 I66 T156	G27-T65 CarbonylContact O-C 3.52Å; G27-T65 WeakPolarHBondContact O-CA 3.39Å; G27-I66 PolarHBondContact N-O 2.84Å; G27-I66 PolarHBondContact O-N 3.15Å; G27-T156 CarbonylContact C-O 3.57Å; G27-T156 WeakPolarHBondContact CA-O 3.38Å
28	R	85.6	Confident	79.3	Confident	103 Å²	103	58.5 Å²	58.5	39%	0.389	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.5	179.4	-58.3	-170.4	176.6	153.5	5.7	111.4	I30 T65 P155 T156 E158	R28-I30 PolarHBondContact O-N 2.88Å; R28-T65 HydrophobicContact CG-CG2 4Å; R28-P155 VanDerWaalsContact O-CA 3.29Å; R28-P155 WeakPolarHBondContact O-CA 3.48Å; R28-T156 PolarHBondContact N-O 3Å; R28-T156 PolarHBondContact O-N 3.34Å; R28-E158 IonicContact CZ-OE1 2.62Å; R28-E158 IonicContact CZ-OE2 2.76Å; R28-E158 IonicContact NE-OE1 2.91Å; R28-E158 IonicContact NH1-OE1 3.14Å; R28-E158 PolarHBondContact NH1-OE1 3.19Å; R28-E158 VanDerWaalsContact NH1-OE1 3.1Å; R28-E158 IonicContact NH2-OE1 3.81Å; R28-E158 PolarHBondContact NH2-OE1 3.38Å; R28-E158 IonicContact NH2-OE2 2.76Å; R28-E158 PolarHBondContact NH2-OE2 2.87Å; R28-E158 VanDerWaalsContact NH2-OE2 3.14Å
29	N	81	Confident	79.4	Confident	47 Å²	47	58.6 Å²	58.6	25%	0.251	31%	0.307	S	S	.	.	S	Bend	trans	57.4	24.4	176.6	-50	-51.4	0	0	0	115.1	H64 K153	N29-H64 PolarHBondContact N-O 2.85Å; N29-K153 HydrophobicContact CB-CB 4.46Å; N29-K153 WeakPolarHBondContact ND2-CB 3.44Å
30	I	82	Confident	79.5	Confident	19 Å²	19	56.6 Å²	56.6	10%	0.097	29%	0.293	C	S	.	.			trans	-76.8	127.3	178.4	-55.6	177.3	0	0	0	109.4	R28 L38 I66 Y68 V95 L112 L135 P155	R28-I30 PolarHBondContact O-N 2.88Å; I30-L38 HydrophobicContact CB-CD2 4.42Å; I30-L38 HydrophobicContact CG2-CD2 3.91Å; I30-I66 HydrophobicContact CB-CD1 4.13Å; I30-I66 HydrophobicContact CD1-CD1 4.3Å; I30-I66 HydrophobicContact CG2-CD1 4.35Å; I30-Y68 HydrophobicContact CD1-CE2 4.44Å; I30-V95 HydrophobicContact CG2-CG1 4.4Å; I30-L112 HydrophobicContact CG2-CD1 3.79Å; I30-L135 HydrophobicContact CD1-CD2 4.12Å; I30-L135 HydrophobicContact CG1-CD2 4.02Å; I30-L135 HydrophobicContact CG2-CD2 4.3Å; I30-P155 HydrophobicContact CG1-CB 4.33Å
31	Q	75.3	Confident	79.4	Confident	129 Å²	129	57.7 Å²	57.7	60%	0.603	30%	0.298	S	S	*	.			trans	-116.2	131.4	-179.8	-64.9	-176.7	0.7	0	0	110.9
32	G	71.6	Confident	79.4	Confident	17 Å²	17	55.4 Å²	55.4	18%	0.175	29%	0.286	C	S	.	.			trans	-81.9	162.9	176	0	0	0	0	0	112.7	K34 E97	G32-K34 PolarHBondContact O-N 3.23Å; G32-E97 WeakPolarHBondContact CA-OE1 3.29Å
33	K	68.8	Low	79.3	Confident	141 Å²	141	58.3 Å²	58.3	61%	0.613	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21	179.6	-70.6	-177.2	179	178.3	0	113.3	E97 A110 L112	K33-E97 PolarHBondContact N-OE1 2.86Å; K33-E97 PolarHBondContact N-OE2 2.86Å; K33-A110 HydrophobicContact CD-CB 4.23Å; K33-L112 HydrophobicContact CG-CD2 4.47Å
34	K	61.1	Low	79.4	Confident	137 Å²	137	57.3 Å²	57.3	60%	0.596	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	12.4	-177	-78.1	-176.2	175.5	175.9	0	115.7	G32 D36 L99	G32-K34 PolarHBondContact O-N 3.23Å; K34-D36 PolarHBondContact O-N 2.85Å; K34-L99 HydrophobicContact CD-CD2 4.41Å; K34-L99 PolarHBondContact NZ-O 2.82Å
35	G	58.1	Low	79.3	Confident	62 Å²	62	58.2 Å²	58.2	64%	0.639	30%	0.3	S	S	*	.	S	Bend	trans	83.6	-52.8	163.6	0	0	0	0	0	116.9
36	D	56.3	Low	79.2	Confident	152 Å²	152	53.5 Å²	53.5	81%	0.813	28%	0.279	S	S	*	.	S	Bend	trans	-123.5	-13.9	-159.8	-64.9	-28.9	0	0	0	116.9	K34	K34-D36 PolarHBondContact O-N 2.85Å
37	N	66.9	Low	78.7	Confident	151 Å²	151	55.9 Å²	55.9	81%	0.807	29%	0.289	S	S	*	.			trans	-139.2	77.3	176.9	-87.4	-28.3	0	0	0	111.1	V39	N37-V39 PolarHBondContact O-N 3.38Å
38	L	77.8	Confident	78.1	Confident	15 Å²	15	63.8 Å²	63.8	8%	0.079	33%	0.327	C	S	.	.			trans	-79.1	118.8	179.6	173.2	59.3	0	0	0	110.9	I30 A59 I66 E97 L112	I30-L38 HydrophobicContact CB-CD2 4.42Å; I30-L38 HydrophobicContact CG2-CD2 3.91Å; L38-A59 HydrophobicContact CB-CB 3.96Å; L38-A59 HydrophobicContact CD2-CB 4.3Å; L38-A59 HydrophobicContact CG-CB 4.3Å; L38-A59 PolarHBondContact O-N 3.19Å; L38-I66 HydrophobicContact CD2-CD1 3.65Å; L38-I66 HydrophobicContact CG-CD1 4.25Å; L38-E97 HydrophobicContact CD1-CB 4.07Å; L38-E97 HydrophobicContact CD1-CG 3.74Å; L38-L112 HydrophobicContact CD1-CD1 3.83Å; L38-L112 HydrophobicContact CD2-CD1 4.31Å
39	V	83.7	Confident	77.8	Confident	30 Å²	30	63 Å²	63	18%	0.182	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.9	164.9	-177.6	0	0	0	0	108.2	N37 K56 K57 H58 E97 V98	N37-V39 PolarHBondContact O-N 3.38Å; V39-K56 HydrophobicContact CG1-CB 3.97Å; V39-K57 WeakPolarHBondContact CA-O 3.47Å; V39-H58 WeakPolarHBondContact CG2-CE1 3.46Å; V39-H58 WeakPolarHBondContact CG2-ND1 3.41Å; V39-E97 WeakPolarHBondContact O-CA 3.46Å; V39-V98 PolarHBondContact O-N 3.29Å
40	S	87.4	Confident	78	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	160	-179.2	63.5	0	0	0	0	113	K57 I66 Y68 V96	S40-K57 PolarHBondContact N-O 3.49Å; S40-K57 PolarHBondContact O-N 3.29Å; S40-I66 WeakPolarHBondContact OG-CD1 3.11Å; S40-Y68 PolarHBondContact OG-OH 2.96Å; S40-V96 CarbonylContact C-O 3.54Å; S40-V96 WeakPolarHBondContact CA-O 3.22Å; S40-V96 VanDerWaalsContact CB-O 3.25Å; S40-V96 WeakPolarHBondContact CB-O 3.28Å
41	F	89.1	Confident	78.2	Confident	24 Å²	24	65.1 Å²	65.1	11%	0.105	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	160.7	170.9	66.5	-81.8	0	0	0	109.7	S54 K56 V96 V98 T109	F41-S54 WeakPolarHBondContact CA-OG 3.39Å; F41-K56 HydrophobicContact CB-CG 4.38Å; F41-K56 HydrophobicContact CD1-CG 4.28Å; F41-V96 HydrophobicContact CD1-CB 4.2Å; F41-V96 HydrophobicContact CE1-CB 3.71Å; F41-V96 HydrophobicContact CE1-CG1 3.66Å; F41-V96 HydrophobicContact CE2-CB 4.17Å; F41-V96 HydrophobicContact CE2-CG2 4.4Å; F41-V96 HydrophobicContact CZ-CB 3.7Å; F41-V96 HydrophobicContact CZ-CG1 3.71Å; F41-V96 HydrophobicContact CZ-CG2 4.25Å; F41-V96 PolarHBondContact N-O 3.29Å; F41-V96 PolarHBondContact O-N 3.18Å; F41-V98 HydrophobicContact CD1-CG2 4.1Å; F41-V98 HydrophobicContact CE1-CG2 4.09Å; F41-T109 HydrophobicContact CE1-CG2 4.24Å
42	L	90.4	Very high	78.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.3	176.9	-68.1	173.3	0	0	0	110.3	A24 E53 S54 Y68 V95 L157	A24-L42 HydrophobicContact CB-CD1 3.42Å; A24-L42 VanDerWaalsContact CB-CD1 3.42Å; L42-E53 CarbonylContact O-C 3.57Å; L42-E53 VanDerWaalsContact O-CA 3.29Å; L42-E53 WeakPolarHBondContact O-CA 3.47Å; L42-S54 PolarHBondContact N-OG 3.35Å; L42-S54 PolarHBondContact O-N 3.46Å; L42-Y68 HydrophobicContact CD1-CD1 3.96Å; L42-Y68 HydrophobicContact CD1-CD2 3.48Å; L42-Y68 VanDerWaalsContact CD1-CD2 3.48Å; L42-Y68 HydrophobicContact CD1-CE1 4.44Å; L42-Y68 HydrophobicContact CD1-CE2 3.98Å; L42-Y68 HydrophobicContact CD1-CG 3.45Å; L42-Y68 VanDerWaalsContact CD1-CG 3.45Å; L42-Y68 HydrophobicContact CD2-CD2 4.43Å; L42-Y68 HydrophobicContact CD2-CE2 4.08Å; L42-Y68 HydrophobicContact CG-CD1 3.82Å; L42-Y68 HydrophobicContact CG-CD2 3.91Å; L42-Y68 HydrophobicContact CG-CE1 3.89Å; L42-Y68 HydrophobicContact CG-CE2 3.94Å; L42-Y68 HydrophobicContact CG-CG 3.83Å; L42-V95 HydrophobicContact CD2-CB 4.39Å; L42-V95 HydrophobicContact CD2-CG2 3.5Å; L42-V95 VanDerWaalsContact CD2-CG2 3.5Å; L42-L157 HydrophobicContact CD1-CD1 4.28Å; L42-L157 HydrophobicContact CD2-CD1 4.43Å; L42-L157 HydrophobicContact CD2-CD2 4.24Å
43	Q	89.6	Confident	79.5	Confident	61 Å²	61	64.2 Å²	64.2	29%	0.285	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.8	164.7	-175.8	176.8	13.8	0	0	108.4	N50 E53 T94	Q43-N50 PolarHBondContact NE2-ND2 3.23Å; Q43-E53 HydrophobicContact CB-CG 4.23Å; Q43-E53 HydrophobicContact CG-CG 4Å; Q43-T94 PolarHBondContact N-O 2.82Å; Q43-T94 PolarHBondContact O-N 3.03Å
44	V	90.9	Very high	80.6	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.8	-178.1	-170.2	0	0	0	0	109.1	N50 L51 G52 F70 I91 I92 F93	V44-N50 PolarHBondContact O-OD1 3.07Å; V44-N50 VanDerWaalsContact O-OD1 3.11Å; V44-L51 HydrophobicContact CG1-CB 4.5Å; V44-L51 HydrophobicContact CG1-CD1 4.26Å; V44-L51 WeakPolarHBondContact O-CB 3.33Å; V44-L51 PolarHBondContact O-N 3.49Å; V44-G52 PolarHBondContact N-O 2.87Å; V44-G52 PolarHBondContact O-N 2.62Å; V44-F70 HydrophobicContact CG2-CD1 4.12Å; V44-F70 HydrophobicContact CG2-CE1 3.74Å; V44-I91 HydrophobicContact CG1-CG2 3.55Å; V44-I92 WeakPolarHBondContact CA-O 3.4Å; V44-F93 HydrophobicContact CB-CD1 4.47Å; V44-F93 HydrophobicContact CB-CE1 4.41Å; V44-F93 HydrophobicContact CG1-CD1 4.26Å; V44-F93 HydrophobicContact CG1-CE1 3.93Å; V44-F93 HydrophobicContact CG1-CZ 4.16Å; V44-F93 HydrophobicContact CG2-CD1 3.58Å; V44-F93 HydrophobicContact CG2-CE1 3.56Å
45	S	89.1	Confident	81.7	Confident	19 Å²	19	58.1 Å²	58.1	13%	0.133	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	156.3	-179.1	62.5	0	0	0	0	112.6	I49 I92	S45-I49 CarbonylContact C-O 3.56Å; S45-I49 WeakPolarHBondContact CA-O 3.38Å; S45-I49 VanDerWaalsContact CB-O 3.31Å; S45-I49 WeakPolarHBondContact CB-O 3.5Å; S45-I92 PolarHBondContact N-O 2.73Å; S45-I92 PolarHBondContact O-N 2.62Å
46	I	84.6	Confident	83.1	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	123.5	168.3	-165.2	168.4	0	0	0	107.6	E48 I49 L51 Y74 K89	I46-E48 PolarHBondContact O-N 2.84Å; I46-I49 HydrophobicContact CG2-CB 4.27Å; I46-I49 PolarHBondContact N-O 3.46Å; I46-I49 WeakPolarHBondContact O-CB 3.34Å; I46-I49 PolarHBondContact O-N 2.95Å; I46-L51 HydrophobicContact CB-CD1 4.34Å; I46-L51 HydrophobicContact CG2-CD1 4.25Å; I46-L51 HydrophobicContact CG2-CD2 4.07Å; I46-L51 HydrophobicContact CG2-CG 4.28Å; I46-Y74 HydrophobicContact CD1-CE1 4.14Å; I46-Y74 HydrophobicContact CD1-CE2 4.43Å; I46-Y74 HydrophobicContact CG2-CD2 4.33Å; I46-Y74 HydrophobicContact CG2-CE2 3.97Å; I46-K89 HydrophobicContact CD1-CB 4.24Å; I46-K89 HydrophobicContact CG1-CB 4.07Å
47	E	78.4	Confident	84.5	Confident	62 Å²	62	56 Å²	56	29%	0.29	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	-118.9	-164.1	-58.9	-177.9	134.6	0	0	112	K89 L246 L249	E47-K89 VanDerWaalsContact CD-CD 3.41Å; E47-K89 VanDerWaalsContact CD-NZ 3.26Å; E47-K89 HydrophobicContact CG-CB 4.38Å; E47-K89 HydrophobicContact CG-CD 3.82Å; E47-K89 HydrophobicContact CG-CG 4.03Å; E47-K89 VanDerWaalsContact OE1-CD 3.31Å; E47-K89 WeakPolarHBondContact OE1-CD 3.41Å; E47-K89 WeakPolarHBondContact OE1-CE 3.27Å; E47-K89 IonicContact OE1-NZ 2.79Å; E47-K89 PolarHBondContact OE1-NZ 3.4Å; E47-K89 IonicContact OE2-NZ 3.31Å; E47-K89 PolarHBondContact OE2-NZ 3.31Å; E47-L246 HydrophobicContact CG-CD1 4.37Å; E47-L249 HydrophobicContact CB-CD1 4.49Å
48	E	71.9	Confident	85.2	Confident	167 Å²	167	55.5 Å²	55.5	78%	0.78	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	2.5	174.2	-62.4	-175.4	164.8	0	0	113	I46	I46-E48 PolarHBondContact O-N 2.84Å
49	I	80.5	Confident	85.2	Confident	85 Å²	85	56.4 Å²	56.4	44%	0.436	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	114.3	-176.5	-54.8	175.4	0	0	0	108.8	S45 I46 L51	S45-I49 CarbonylContact C-O 3.56Å; S45-I49 WeakPolarHBondContact CA-O 3.38Å; S45-I49 VanDerWaalsContact CB-O 3.31Å; S45-I49 WeakPolarHBondContact CB-O 3.5Å; I46-I49 HydrophobicContact CG2-CB 4.27Å; I46-I49 PolarHBondContact N-O 3.46Å; I46-I49 WeakPolarHBondContact O-CB 3.34Å; I46-I49 PolarHBondContact O-N 2.95Å; I49-L51 PolarHBondContact O-N 3.33Å
50	N	84.1	Confident	84.9	Confident	74 Å²	74	57.6 Å²	57.6	40%	0.396	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	118.8	173.1	-166.7	5.6	0	0	0	109.7	Q43 V44 G52 E53	Q43-N50 PolarHBondContact NE2-ND2 3.23Å; V44-N50 PolarHBondContact O-OD1 3.07Å; V44-N50 VanDerWaalsContact O-OD1 3.11Å; N50-G52 PolarHBondContact OD1-N 2.76Å; N50-G52 PolarHBondContact OD1-O 2.96Å; N50-E53 PolarHBondContact ND2-OE1 2.83Å
51	L	85.4	Confident	83.8	Confident	37 Å²	37	62.9 Å²	62.9	19%	0.194	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-27	178.3	-61.1	178.1	0	0	0	111.8	I22 V44 I46 I49 Y74	I22-L51 HydrophobicContact CD1-CD1 4.17Å; V44-L51 HydrophobicContact CG1-CB 4.5Å; V44-L51 HydrophobicContact CG1-CD1 4.26Å; V44-L51 WeakPolarHBondContact O-CB 3.33Å; V44-L51 PolarHBondContact O-N 3.49Å; I46-L51 HydrophobicContact CB-CD1 4.34Å; I46-L51 HydrophobicContact CG2-CD1 4.25Å; I46-L51 HydrophobicContact CG2-CD2 4.07Å; I46-L51 HydrophobicContact CG2-CG 4.28Å; I49-L51 PolarHBondContact O-N 3.33Å; L51-Y74 HydrophobicContact CD1-CD2 4.48Å; L51-Y74 HydrophobicContact CD2-CD2 3.68Å; L51-Y74 HydrophobicContact CD2-CE2 4.48Å; L51-Y74 HydrophobicContact CD2-CG 4.44Å
52	G	87.1	Confident	82.5	Confident	20 Å²	20	70.2 Å²	70.2	21%	0.206	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.9	167.5	175.1	0	0	0	0	0	114.4	V44 N50	V44-G52 PolarHBondContact N-O 2.87Å; V44-G52 PolarHBondContact O-N 2.62Å; N50-G52 PolarHBondContact OD1-N 2.76Å; N50-G52 PolarHBondContact OD1-O 2.96Å
53	E	89.1	Confident	81.3	Confident	108 Å²	108	77.2 Å²	77.2	51%	0.505	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.3	178.3	-69.9	175.2	-162.3	0	0	110.7	L42 Q43 N50 F70	L42-E53 CarbonylContact O-C 3.57Å; L42-E53 VanDerWaalsContact O-CA 3.29Å; L42-E53 WeakPolarHBondContact O-CA 3.47Å; Q43-E53 HydrophobicContact CB-CG 4.23Å; Q43-E53 HydrophobicContact CG-CG 4Å; N50-E53 PolarHBondContact ND2-OE1 2.83Å; E53-F70 WeakPolarHBondContact O-CE2 3.35Å
54	S	91	Very high	80.5	Confident	11 Å²	11	80.4 Å²	80.4	8%	0.077	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-78.6	163.8	178	83.1	0	0	0	0	112.4	F41 L42	F41-S54 WeakPolarHBondContact CA-OG 3.39Å; L42-S54 PolarHBondContact N-OG 3.35Å; L42-S54 PolarHBondContact O-N 3.46Å
55	E	85.1	Confident	80.1	Confident	138 Å²	138	81.2 Å²	81.2	65%	0.645	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-60.9	153.8	165.3	-64.8	-176	163.2	0	0	111.5	K57	E55-K57 PolarHBondContact O-N 3.46Å; E55-K57 IonicContact OE2-NZ 2.8Å; E55-K57 PolarHBondContact OE2-NZ 3.46Å
56	K	86.9	Confident	79.8	Confident	105 Å²	105	80.5 Å²	80.5	46%	0.457	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-73.1	117.6	173.5	-62.7	171.3	-174.1	169.3	0	109	V39 F41 V98 L107	V39-K56 HydrophobicContact CG1-CB 3.97Å; F41-K56 HydrophobicContact CB-CG 4.38Å; F41-K56 HydrophobicContact CD1-CG 4.28Å; K56-V98 HydrophobicContact CD-CG2 4.28Å; K56-L107 VanDerWaalsContact NZ-CD1 3.26Å
57	K	85.1	Confident	79.8	Confident	66 Å²	66	84 Å²	84	29%	0.287	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	147.7	-179.3	-60.6	-63.4	-164.8	-164.7	0	111.1	V39 S40 E55 I66 Y68	V39-K57 WeakPolarHBondContact CA-O 3.47Å; S40-K57 PolarHBondContact N-O 3.49Å; S40-K57 PolarHBondContact O-N 3.29Å; E55-K57 PolarHBondContact O-N 3.46Å; E55-K57 IonicContact OE2-NZ 2.8Å; E55-K57 PolarHBondContact OE2-NZ 3.46Å; K57-I66 HydrophobicContact CB-CG2 3.99Å; K57-Y68 HydrophobicContact CG-CD1 4.38Å
58	H	81.4	Confident	80.2	Confident	140 Å²	140	81.4 Å²	81.4	65%	0.648	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	140.5	174.3	-72.9	-93.7	0	0	0	110.4	V39	V39-H58 WeakPolarHBondContact CG2-CE1 3.46Å; V39-H58 WeakPolarHBondContact CG2-ND1 3.41Å
59	A	78.6	Confident	80.9	Confident	33 Å²	33	78.9 Å²	78.9	27%	0.273	40%	0.401	S	S	.	.			trans	-68.8	136	174	0	0	0	0	0	111.7	L38 P61 I66	L38-A59 HydrophobicContact CB-CB 3.96Å; L38-A59 HydrophobicContact CD2-CB 4.3Å; L38-A59 HydrophobicContact CG-CB 4.3Å; L38-A59 PolarHBondContact O-N 3.19Å; A59-P61 VanDerWaalsContact O-CD 3.31Å; A59-P61 WeakPolarHBondContact O-CD 3.31Å; A59-I66 HydrophobicContact CB-CD1 3.98Å; A59-I66 HydrophobicContact CB-CG1 3.89Å
60	N	76.9	Confident	81.4	Confident	56 Å²	56	76.4 Å²	76.4	30%	0.299	39%	0.388	S	S	.	.	B	Isolated β-bridge	trans	-81.8	111.6	175.6	-171.8	-24.1	0	0	0	110	M62 H64 T65	N60-M62 VanDerWaalsContact C-N 3.3Å; N60-M62 PolarHBondContact O-N 3.33Å; N60-M62 PolarHBondContact OD1-N 2.88Å; N60-H64 PolarHBondContact O-N 3.44Å; N60-H64 VanDerWaalsContact O-N 3.1Å; N60-T65 WeakPolarHBondContact CB-O 3.41Å; N60-T65 PolarHBondContact N-O 2.84Å
61	P	65	Low	81.6	Confident	110 Å²	110	76.4 Å²	76.4	71%	0.714	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-25.1	-173.6	8.2	-2.6	0	0	0	113.6	A59	A59-P61 VanDerWaalsContact O-CD 3.31Å; A59-P61 WeakPolarHBondContact O-CD 3.31Å
62	M	61.1	Low	81.9	Confident	178 Å²	178	75 Å²	75	88%	0.877	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-35.2	-178.2	-70.3	-85.9	-167	0	0	112.9	N60	N60-M62 VanDerWaalsContact C-N 3.3Å; N60-M62 PolarHBondContact O-N 3.33Å; N60-M62 PolarHBondContact OD1-N 2.88Å
63	K	64.4	Low	82	Confident	147 Å²	147	77.1 Å²	77.1	64%	0.639	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-9.9	-174.8	-68.4	-174.3	178.2	-179.9	0	113.5	T65	K63-T65 HydrophobicContact CB-CG2 4.15Å; K63-T65 WeakPolarHBondContact CB-OG1 3.38Å; K63-T65 WeakPolarHBondContact O-CG2 3.47Å; K63-T65 PolarHBondContact O-N 2.99Å
64	H	73.7	Confident	81.9	Confident	129 Å²	129	73.6 Å²	73.6	60%	0.597	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	36.1	-168.6	-61.4	-63.7	0	0	0	112.7	N29 N60	N29-H64 PolarHBondContact N-O 2.85Å; N60-H64 PolarHBondContact O-N 3.44Å; N60-H64 VanDerWaalsContact O-N 3.1Å
65	T	81.6	Confident	81.7	Confident	17 Å²	17	78.1 Å²	78.1	10%	0.104	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	155	-179.6	63.1	0	0	0	0	112.5	G27 R28 N60 K63	G27-T65 CarbonylContact O-C 3.52Å; G27-T65 WeakPolarHBondContact O-CA 3.39Å; R28-T65 HydrophobicContact CG-CG2 4Å; N60-T65 WeakPolarHBondContact CB-O 3.41Å; N60-T65 PolarHBondContact N-O 2.84Å; K63-T65 HydrophobicContact CB-CG2 4.15Å; K63-T65 WeakPolarHBondContact CB-OG1 3.38Å; K63-T65 WeakPolarHBondContact O-CG2 3.47Å; K63-T65 PolarHBondContact O-N 2.99Å
66	I	83.4	Confident	81.6	Confident	3 Å²	3	71.7 Å²	71.7	2%	0.015	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	113.4	170.3	-45	-173.5	0	0	0	106.8	C26 G27 I30 L38 S40 K57 A59 Y68	C26-I66 CarbonylContact C-O 3.49Å; C26-I66 WeakPolarHBondContact CA-O 3.25Å; G27-I66 PolarHBondContact N-O 2.84Å; G27-I66 PolarHBondContact O-N 3.15Å; I30-I66 HydrophobicContact CB-CD1 4.13Å; I30-I66 HydrophobicContact CD1-CD1 4.3Å; I30-I66 HydrophobicContact CG2-CD1 4.35Å; L38-I66 HydrophobicContact CD2-CD1 3.65Å; L38-I66 HydrophobicContact CG-CD1 4.25Å; S40-I66 WeakPolarHBondContact OG-CD1 3.11Å; K57-I66 HydrophobicContact CB-CG2 3.99Å; A59-I66 HydrophobicContact CB-CD1 3.98Å; A59-I66 HydrophobicContact CB-CG1 3.89Å; I66-Y68 HydrophobicContact CB-CE2 4.01Å; I66-Y68 HydrophobicContact CG2-CD1 4.27Å; I66-Y68 HydrophobicContact CG2-CD2 4.45Å; I66-Y68 HydrophobicContact CG2-CE1 3.78Å; I66-Y68 HydrophobicContact CG2-CE2 4.01Å; I66-Y68 PolarHBondContact O-N 3.45Å
67	D	85.6	Confident	81.4	Confident	79 Å²	79	69.4 Å²	69.4	42%	0.422	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	103.4	179.8	-58.9	-30.9	0	0	0	108.1
68	Y	86.9	Confident	81.2	Confident	6 Å²	6	70 Å²	70	2%	0.024	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-40.9	179.8	-66.8	-72.9	0	0	0	111.4	K25 I30 S40 L42 K57 I66 F70 L157	K25-Y68 PolarHBondContact O-N 3.48Å; I30-Y68 HydrophobicContact CD1-CE2 4.44Å; S40-Y68 PolarHBondContact OG-OH 2.96Å; L42-Y68 HydrophobicContact CD1-CD1 3.96Å; L42-Y68 HydrophobicContact CD1-CD2 3.48Å; L42-Y68 VanDerWaalsContact CD1-CD2 3.48Å; L42-Y68 HydrophobicContact CD1-CE1 4.44Å; L42-Y68 HydrophobicContact CD1-CE2 3.98Å; L42-Y68 HydrophobicContact CD1-CG 3.45Å; L42-Y68 VanDerWaalsContact CD1-CG 3.45Å; L42-Y68 HydrophobicContact CD2-CD2 4.43Å; L42-Y68 HydrophobicContact CD2-CE2 4.08Å; L42-Y68 HydrophobicContact CG-CD1 3.82Å; L42-Y68 HydrophobicContact CG-CD2 3.91Å; L42-Y68 HydrophobicContact CG-CE1 3.89Å; L42-Y68 HydrophobicContact CG-CE2 3.94Å; L42-Y68 HydrophobicContact CG-CG 3.83Å; K57-Y68 HydrophobicContact CG-CD1 4.38Å; I66-Y68 HydrophobicContact CB-CE2 4.01Å; I66-Y68 HydrophobicContact CG2-CD1 4.27Å; I66-Y68 HydrophobicContact CG2-CD2 4.45Å; I66-Y68 HydrophobicContact CG2-CE1 3.78Å; I66-Y68 HydrophobicContact CG2-CE2 4.01Å; I66-Y68 PolarHBondContact O-N 3.45Å; Y68-F70 PolarHBondContact O-N 3.03Å; Y68-F70 VanDerWaalsContact O-N 3.14Å; Y68-L157 HydrophobicContact CD2-CD1 4.16Å; Y68-L157 HydrophobicContact CE2-CD1 4.2Å
69	D	85.8	Confident	81.4	Confident	114 Å²	114	67 Å²	67	61%	0.61	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	38.7	48.9	-173.8	-73	-28.8	0	0	0	112.6	A24 K25	A24-D69 WeakPolarHBondContact O-CA 3.24Å; A24-D69 PolarHBondContact O-N 2.73Å; K25-D69 PolarHBondContact O-N 3.03Å; K25-D69 VanDerWaalsContact O-N 3.15Å
70	F	90.2	Very high	81.6	Confident	34 Å²	34	66.2 Å²	66.2	15%	0.149	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.9	-176.1	173.5	-109.4	0	0	0	110.5	T23 A24 V44 E53 Y68 C72	T23-F70 CarbonylContact C-O 3.59Å; T23-F70 VanDerWaalsContact CA-O 3.27Å; T23-F70 WeakPolarHBondContact CA-O 3.45Å; A24-F70 PolarHBondContact N-O 2.82Å; A24-F70 PolarHBondContact O-N 3Å; V44-F70 HydrophobicContact CG2-CD1 4.12Å; V44-F70 HydrophobicContact CG2-CE1 3.74Å; E53-F70 WeakPolarHBondContact O-CE2 3.35Å; Y68-F70 PolarHBondContact O-N 3.03Å; Y68-F70 VanDerWaalsContact O-N 3.14Å; F70-C72 HydrophobicContact CE1-CB 3.89Å; F70-C72 HydrophobicContact CZ-CB 3.9Å
71	T	89.7	Confident	82	Confident	73 Å²	73	66.9 Å²	66.9	45%	0.448	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131	175.7	-55.7	0	0	0	0	110.2	D21 I22 T23	D21-T71 HydrophobicContact CB-CG2 4.38Å; I22-T71 CarbonylContact O-C 3.58Å; I22-T71 WeakPolarHBondContact O-CA 3.45Å; T23-T71 WeakPolarHBondContact CG2-OG1 3.43Å; T23-T71 WeakPolarHBondContact OG1-CG2 3.38Å; T23-T71 PolarHBondContact OG1-OG1 2.76Å
72	C	90.4	Very high	83	Confident	9 Å²	9	62 Å²	62	6%	0.061	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.2	169	61.9	0	0	0	0	110.2	I22 F70	I22-C72 PolarHBondContact N-O 2.78Å; I22-C72 PolarHBondContact O-N 3.02Å; F70-C72 HydrophobicContact CE1-CB 3.89Å; F70-C72 HydrophobicContact CZ-CB 3.9Å
73	T	89.3	Confident	84.3	Confident	64 Å²	64	54.3 Å²	54.3	39%	0.393	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.9	-178.6	-52.4	0	0	0	0	110.1	I20 D21	I20-T73 CarbonylContact O-C 3.59Å; I20-T73 WeakPolarHBondContact O-CA 3.38Å; D21-T73 WeakPolarHBondContact OD1-CB 3.41Å; D21-T73 WeakPolarHBondContact OD1-CG2 3.31Å; D21-T73 PolarHBondContact OD1-OG1 3.02Å
74	Y	88.2	Confident	85.3	Confident	34 Å²	34	47.3 Å²	47.3	13%	0.133	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116.6	170.9	176	-121.5	0	0	0	109.6	I20 I46 L51	I20-Y74 HydrophobicContact CD1-CD1 4.21Å; I20-Y74 PolarHBondContact N-O 2.91Å; I20-Y74 PolarHBondContact O-N 3.25Å; I46-Y74 HydrophobicContact CD1-CE1 4.14Å; I46-Y74 HydrophobicContact CD1-CE2 4.43Å; I46-Y74 HydrophobicContact CG2-CD2 4.33Å; I46-Y74 HydrophobicContact CG2-CE2 3.97Å; L51-Y74 HydrophobicContact CD1-CD2 4.48Å; L51-Y74 HydrophobicContact CD2-CD2 3.68Å; L51-Y74 HydrophobicContact CD2-CE2 4.48Å; L51-Y74 HydrophobicContact CD2-CG 4.44Å
75	N	86.4	Confident	85.9	Confident	105 Å²	105	42.7 Å²	42.7	56%	0.561	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	109.5	177.2	-66.9	-32.9	0	0	0	109.4	V18	V18-N75 WeakPolarHBondContact O-CA 3.38Å
76	S	82.1	Confident	86.2	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139.3	178	-174.6	0	0	0	0	110.2	N17 V18 A82	N17-S76 CarbonylContact C-O 3.33Å; N17-S76 WeakPolarHBondContact CA-O 3.28Å; V18-S76 PolarHBondContact N-O 3.23Å; V18-S76 PolarHBondContact O-N 2.96Å; S76-A82 WeakPolarHBondContact OG-CB 3.15Å
77	P	82.9	Confident	86.3	Confident	57 Å²	57	42.7 Å²	42.7	37%	0.37	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	152.1	167.1	11	-7.5	0	0	0	110.3	D79 A82	P77-D79 PolarHBondContact O-N 2.95Å; P77-A82 HydrophobicContact CB-CB 4.39Å; P77-A82 HydrophobicContact CG-CB 3.99Å; P77-A82 WeakPolarHBondContact O-CB 3.35Å
78	N	81.7	Confident	86.3	Confident	78 Å²	78	40.7 Å²	40.7	42%	0.417	22%	0.221	S	C	.	.	S	Bend	trans	-95	63	178.7	-161	32.8	0	0	0	111.2	V18 F83	V18-N78 HydrophobicContact CG2-CB 3.99Å; N78-F83 WeakPolarHBondContact OD1-CZ 3.29Å
79	D	84.6	Confident	86.3	Confident	78 Å²	78	41.7 Å²	41.7	42%	0.417	23%	0.226	S	C	.	.	S	Bend	trans	-133.2	165.3	179.4	67.3	9.7	0	0	0	112.5	P77 Q81 A82 F83	P77-D79 PolarHBondContact O-N 2.95Å; D79-Q81 PolarHBondContact O-N 2.95Å; D79-A82 WeakPolarHBondContact O-CB 3.43Å; D79-A82 PolarHBondContact O-N 2.76Å; D79-A82 VanDerWaalsContact O-N 3.16Å; D79-A82 WeakPolarHBondContact OD1-CB 3.44Å; D79-A82 PolarHBondContact OD1-N 2.9Å; D79-F83 WeakPolarHBondContact O-CD2 3.21Å; D79-F83 WeakPolarHBondContact O-CG 3.31Å; D79-F83 PolarHBondContact O-N 2.83Å
80	A	83.6	Confident	86.4	Confident	16 Å²	16	36.9 Å²	36.9	13%	0.132	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-34.7	-177.8	0	0	0	0	0	112.6	F83 S84 L214 T215 F302	A80-F83 PolarHBondContact O-N 2.87Å; A80-S84 PolarHBondContact O-N 2.84Å; A80-L214 HydrophobicContact CB-CD1 4.1Å; A80-L214 HydrophobicContact CB-CD2 4.47Å; A80-L214 HydrophobicContact CB-CG 4.01Å; A80-T215 HydrophobicContact CB-CG2 3.69Å; A80-F302 HydrophobicContact CB-CD1 4.12Å; A80-F302 HydrophobicContact CB-CE1 4.24Å
81	Q	85.5	Confident	86.4	Confident	71 Å²	71	35.2 Å²	35.2	33%	0.332	19%	0.193	S	C	.	.	H	α-helix	trans	-66.9	-42.7	177.2	-176.1	60.3	58	0	0	111.3	D79 F83 S84 D85 L214	D79-Q81 PolarHBondContact O-N 2.95Å; Q81-F83 VanDerWaalsContact C-N 3.34Å; Q81-S84 PolarHBondContact O-N 2.78Å; Q81-D85 PolarHBondContact NE2-OD1 3.35Å; Q81-D85 WeakPolarHBondContact O-CB 3.18Å; Q81-D85 PolarHBondContact O-N 3.3Å; Q81-L214 HydrophobicContact CB-CD2 4.07Å; Q81-L214 VanDerWaalsContact OE1-CD2 3.32Å
82	A	86	Confident	86.5	Confident	6 Å²	6	32.1 Å²	32.1	5%	0.05	17%	0.174	C	C	.	.	H	α-helix	trans	-63	-39.7	175	0	0	0	0	0	112.1	S76 P77 D79 S84 D85 I86	S76-A82 WeakPolarHBondContact OG-CB 3.15Å; P77-A82 HydrophobicContact CB-CB 4.39Å; P77-A82 HydrophobicContact CG-CB 3.99Å; P77-A82 WeakPolarHBondContact O-CB 3.35Å; D79-A82 WeakPolarHBondContact O-CB 3.43Å; D79-A82 PolarHBondContact O-N 2.76Å; D79-A82 VanDerWaalsContact O-N 3.16Å; D79-A82 WeakPolarHBondContact OD1-CB 3.44Å; D79-A82 PolarHBondContact OD1-N 2.9Å; A82-S84 VanDerWaalsContact C-N 3.33Å; A82-S84 PolarHBondContact O-N 2.89Å; A82-D85 WeakPolarHBondContact O-CB 3.16Å; A82-D85 PolarHBondContact O-N 2.94Å; A82-I86 WeakPolarHBondContact O-CB 3.48Å; A82-I86 WeakPolarHBondContact O-CG1 3.43Å; A82-I86 PolarHBondContact O-N 2.98Å
83	F	88.5	Confident	86.5	Confident	17 Å²	17	31.7 Å²	31.7	8%	0.075	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-40.8	173.6	-60.6	-35.3	0	0	0	112.1	N78 D79 A80 Q81 I86 L87 L123 L167 L168 F302	N78-F83 WeakPolarHBondContact OD1-CZ 3.29Å; D79-F83 WeakPolarHBondContact O-CD2 3.21Å; D79-F83 WeakPolarHBondContact O-CG 3.31Å; D79-F83 PolarHBondContact O-N 2.83Å; A80-F83 PolarHBondContact O-N 2.87Å; Q81-F83 VanDerWaalsContact C-N 3.34Å; F83-I86 HydrophobicContact CD1-CD1 4.43Å; F83-I86 PolarHBondContact O-N 3.35Å; F83-L87 WeakPolarHBondContact O-CG 3.22Å; F83-L87 PolarHBondContact O-N 3.43Å; F83-L87 VanDerWaalsContact O-N 3.15Å; F83-L123 HydrophobicContact CB-CD1 4.4Å; F83-L123 HydrophobicContact CB-CD2 4.15Å; F83-L123 HydrophobicContact CD1-CD2 3.71Å; F83-L123 HydrophobicContact CE1-CD2 4.31Å; F83-L123 HydrophobicContact CG-CD2 4.01Å; F83-L167 HydrophobicContact CE1-CB 4.27Å; F83-L167 WeakPolarHBondContact CZ-O 3.47Å; F83-L168 HydrophobicContact CD2-CD2 4.08Å; F83-L168 HydrophobicContact CE2-CD2 3.62Å; F83-L168 HydrophobicContact CZ-CD2 3.87Å; F83-F302 HydrophobicContact CB-CB 4.2Å; F83-F302 HydrophobicContact CB-CD1 4.12Å; F83-F302 HydrophobicContact CB-CD2 4.21Å; F83-F302 HydrophobicContact CB-CG 3.91Å; F83-F302 HydrophobicContact CD2-CD1 4.17Å; F83-F302 AromaticContact CD2-CE1 3.83Å; F83-F302 HydrophobicContact CD2-CE1 3.83Å; F83-F302 HydrophobicContact CD2-CE2 4.37Å; F83-F302 AromaticContact CD2-CZ 3.93Å; F83-F302 HydrophobicContact CD2-CZ 3.93Å
84	S	85.1	Confident	86.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-40.4	173.5	-159.6	0	0	0	0	111.9	A80 Q81 A82 I86 L87 Q88 Q220	A80-S84 PolarHBondContact O-N 2.84Å; Q81-S84 PolarHBondContact O-N 2.78Å; A82-S84 VanDerWaalsContact C-N 3.33Å; A82-S84 PolarHBondContact O-N 2.89Å; S84-I86 PolarHBondContact O-N 2.9Å; S84-L87 WeakPolarHBondContact O-CB 3.41Å; S84-L87 PolarHBondContact O-N 3.37Å; S84-Q88 VanDerWaalsContact O-CG 3.29Å; S84-Q88 WeakPolarHBondContact O-CG 3.47Å; S84-Q88 PolarHBondContact O-N 2.92Å; S84-Q88 VanDerWaalsContact O-N 3.16Å; S84-Q88 PolarHBondContact OG-NE2 3.11Å; S84-Q220 VanDerWaalsContact OG-CD 3.27Å; S84-Q220 PolarHBondContact OG-NE2 2.8Å; S84-Q220 VanDerWaalsContact OG-NE2 3.08Å; S84-Q220 PolarHBondContact OG-OE1 2.73Å
85	D	85.8	Confident	86.5	Confident	33 Å²	33	27.7 Å²	27.7	18%	0.176	15%	0.15	C	C	.	.	H	α-helix	trans	-61.9	-42.1	174.7	-83.5	23.9	0	0	0	111.7	Q81 A82 L87 Q88 K89	Q81-D85 PolarHBondContact NE2-OD1 3.35Å; Q81-D85 WeakPolarHBondContact O-CB 3.18Å; Q81-D85 PolarHBondContact O-N 3.3Å; A82-D85 WeakPolarHBondContact O-CB 3.16Å; A82-D85 PolarHBondContact O-N 2.94Å; D85-L87 VanDerWaalsContact C-N 3.26Å; D85-L87 PolarHBondContact O-N 3.46Å; D85-Q88 PolarHBondContact O-N 3.34Å; D85-Q88 VanDerWaalsContact O-N 3.17Å; D85-K89 HydrophobicContact CB-CD 4.02Å; D85-K89 VanDerWaalsContact O-CB 3.28Å; D85-K89 WeakPolarHBondContact O-CB 3.4Å; D85-K89 WeakPolarHBondContact O-CG 3.37Å; D85-K89 PolarHBondContact O-N 3.1Å; D85-K89 IonicContact OD1-NZ 2.78Å; D85-K89 WeakPolarHBondContact OD2-CE 3.03Å; D85-K89 IonicContact OD2-NZ 2.91Å; D85-K89 PolarHBondContact OD2-NZ 3.43Å
86	I	88.1	Confident	86.5	Confident	5 Å²	5	23 Å²	23	3%	0.026	13%	0.125	C	C	.	.	H	α-helix	trans	-61.3	-33.7	175.6	-73.3	168.6	0	0	0	111.7	I20 A82 F83 S84 L119 L123 L167	I20-I86 HydrophobicContact CD1-CD1 4.26Å; A82-I86 WeakPolarHBondContact O-CB 3.48Å; A82-I86 WeakPolarHBondContact O-CG1 3.43Å; A82-I86 PolarHBondContact O-N 2.98Å; F83-I86 HydrophobicContact CD1-CD1 4.43Å; F83-I86 PolarHBondContact O-N 3.35Å; S84-I86 PolarHBondContact O-N 2.9Å; I86-L119 HydrophobicContact CG2-CB 3.55Å; I86-L119 HydrophobicContact CG2-CD1 4.22Å; I86-L123 HydrophobicContact CB-CD1 4.35Å; I86-L123 HydrophobicContact CG2-CD1 3.89Å; I86-L123 HydrophobicContact CG2-CG 4.39Å; I86-L167 HydrophobicContact CD1-CD1 4.33Å
87	L	86.2	Confident	86.8	Confident	15 Å²	15	23.1 Å²	23.1	8%	0.079	13%	0.125	C	C	.	.	H	α-helix	trans	-74	-29.5	176.7	-71.5	174.2	0	0	0	113.4	F83 S84 D85 F120 L123 I178 R300 F302	F83-L87 WeakPolarHBondContact O-CG 3.22Å; F83-L87 PolarHBondContact O-N 3.43Å; F83-L87 VanDerWaalsContact O-N 3.15Å; S84-L87 WeakPolarHBondContact O-CB 3.41Å; S84-L87 PolarHBondContact O-N 3.37Å; D85-L87 VanDerWaalsContact C-N 3.26Å; D85-L87 PolarHBondContact O-N 3.46Å; L87-F120 HydrophobicContact CD2-CD2 3.35Å; L87-F120 HydrophobicContact CD2-CE2 3.91Å; L87-F120 HydrophobicContact CD2-CG 4.39Å; L87-L123 HydrophobicContact CD1-CD1 4.23Å; L87-L123 HydrophobicContact CD2-CD1 3.56Å; L87-L123 HydrophobicContact CG-CD1 3.54Å; L87-I178 HydrophobicContact CD1-CG2 4.09Å; L87-R300 HydrophobicContact CB-CB 3.96Å; L87-R300 HydrophobicContact CD1-CB 4.43Å; L87-F302 HydrophobicContact CD1-CB 3.91Å
88	Q	85.6	Confident	86.9	Confident	36 Å²	36	21.9 Å²	21.9	17%	0.168	12%	0.116	C	C	.	.	H	α-helix	trans	-99.5	-31.7	-171.7	-65.5	175.9	17.8	0	0	113.1	S84 D85 P90 Q220 P245 I299 R300	S84-Q88 VanDerWaalsContact O-CG 3.29Å; S84-Q88 WeakPolarHBondContact O-CG 3.47Å; S84-Q88 PolarHBondContact O-N 2.92Å; S84-Q88 VanDerWaalsContact O-N 3.16Å; S84-Q88 PolarHBondContact OG-NE2 3.11Å; D85-Q88 PolarHBondContact O-N 3.34Å; D85-Q88 VanDerWaalsContact O-N 3.17Å; Q88-P90 WeakPolarHBondContact O-CD 3.39Å; Q88-Q220 VanDerWaalsContact NE2-NE2 3.2Å; Q88-P245 WeakPolarHBondContact O-CG 3.39Å; Q88-I299 HydrophobicContact CG-CG2 4.07Å; Q88-R300 VanDerWaalsContact CG-O 3.22Å; Q88-R300 WeakPolarHBondContact CG-O 3.38Å; Q88-R300 PolarHBondContact NE2-O 3.34Å; Q88-R300 VanDerWaalsContact NE2-O 3.15Å
89	K	87.4	Confident	86.4	Confident	28 Å²	28	19.8 Å²	19.8	12%	0.122	11%	0.105	C	C	.	.			trans	-107.5	106.2	-170.1	-59.3	170.2	-176.2	-164.4	0	110.5	I46 E47 D85 L246	I46-K89 HydrophobicContact CD1-CB 4.24Å; I46-K89 HydrophobicContact CG1-CB 4.07Å; E47-K89 VanDerWaalsContact CD-CD 3.41Å; E47-K89 VanDerWaalsContact CD-NZ 3.26Å; E47-K89 HydrophobicContact CG-CB 4.38Å; E47-K89 HydrophobicContact CG-CD 3.82Å; E47-K89 HydrophobicContact CG-CG 4.03Å; E47-K89 VanDerWaalsContact OE1-CD 3.31Å; E47-K89 WeakPolarHBondContact OE1-CD 3.41Å; E47-K89 WeakPolarHBondContact OE1-CE 3.27Å; E47-K89 IonicContact OE1-NZ 2.79Å; E47-K89 PolarHBondContact OE1-NZ 3.4Å; E47-K89 IonicContact OE2-NZ 3.31Å; E47-K89 PolarHBondContact OE2-NZ 3.31Å; D85-K89 HydrophobicContact CB-CD 4.02Å; D85-K89 VanDerWaalsContact O-CB 3.28Å; D85-K89 WeakPolarHBondContact O-CB 3.4Å; D85-K89 WeakPolarHBondContact O-CG 3.37Å; D85-K89 PolarHBondContact O-N 3.1Å; D85-K89 IonicContact OD1-NZ 2.78Å; D85-K89 WeakPolarHBondContact OD2-CE 3.03Å; D85-K89 IonicContact OD2-NZ 2.91Å; D85-K89 PolarHBondContact OD2-NZ 3.43Å; K89-L246 HydrophobicContact CG-CD1 4.3Å
90	P	88.3	Confident	85.5	Confident	12 Å²	12	23 Å²	23	8%	0.078	12%	0.117	C	C	.	.			trans	-83.5	159.5	-178	37.4	-38.4	0	0	0	111.6	Q88 V116	Q88-P90 WeakPolarHBondContact O-CD 3.39Å; P90-V116 HydrophobicContact CB-CG1 3.45Å; P90-V116 VanDerWaalsContact CB-CG1 3.45Å; P90-V116 HydrophobicContact CG-CG1 3.83Å
91	I	90	Very high	84.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	128.8	174.3	-61.2	162.8	0	0	0	109	I22 V44 F93 V116 V117 L119	I22-I91 HydrophobicContact CD1-CD1 3.38Å; I22-I91 HydrophobicContact CD1-CG1 4.27Å; I22-I91 HydrophobicContact CG1-CD1 3.78Å; I22-I91 HydrophobicContact CG2-CD1 4.38Å; V44-I91 HydrophobicContact CG1-CG2 3.55Å; I91-F93 HydrophobicContact CB-CE2 4.35Å; I91-F93 HydrophobicContact CG2-CD2 4.14Å; I91-F93 HydrophobicContact CG2-CE2 3.59Å; I91-F93 HydrophobicContact CG2-CZ 3.99Å; I91-V116 VanDerWaalsContact O-CA 3.31Å; I91-V116 WeakPolarHBondContact O-CA 3.47Å; I91-V117 PolarHBondContact N-O 3.19Å; I91-V117 PolarHBondContact O-N 3.14Å; I91-L119 HydrophobicContact CD1-CD1 3.92Å; I91-L119 HydrophobicContact CD1-CD2 3.51Å; I91-L119 HydrophobicContact CD1-CG 3.72Å; I91-L119 HydrophobicContact CG1-CD1 4.35Å; I91-L119 HydrophobicContact CG1-CG 4.32Å
92	I	90.4	Very high	82.3	Confident	7 Å²	7	27.8 Å²	27.8	4%	0.036	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.9	-178.5	-53.5	171.2	0	0	0	108.9	V44 S45 Q114 L249 L250	V44-I92 WeakPolarHBondContact CA-O 3.4Å; S45-I92 PolarHBondContact N-O 2.73Å; S45-I92 PolarHBondContact O-N 2.62Å; I92-Q114 HydrophobicContact CG2-CG 4.44Å; I92-L249 HydrophobicContact CD1-CB 4.29Å; I92-L250 HydrophobicContact CD1-CD2 3.67Å; I92-L250 HydrophobicContact CG1-CD2 3.86Å
93	F	90.5	Very high	80.4	Confident	1 Å²	1	38.2 Å²	38.2	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	119.9	171	-66.7	-95.4	0	0	0	109.1	I22 A24 V44 I91 Q114 A115 V117 L157 V159	I22-F93 HydrophobicContact CG2-CE1 4.25Å; I22-F93 HydrophobicContact CG2-CE2 4.49Å; I22-F93 HydrophobicContact CG2-CZ 3.54Å; A24-F93 HydrophobicContact CB-CD1 4.3Å; A24-F93 HydrophobicContact CB-CE1 3.9Å; V44-F93 HydrophobicContact CB-CD1 4.47Å; V44-F93 HydrophobicContact CB-CE1 4.41Å; V44-F93 HydrophobicContact CG1-CD1 4.26Å; V44-F93 HydrophobicContact CG1-CE1 3.93Å; V44-F93 HydrophobicContact CG1-CZ 4.16Å; V44-F93 HydrophobicContact CG2-CD1 3.58Å; V44-F93 HydrophobicContact CG2-CE1 3.56Å; I91-F93 HydrophobicContact CB-CE2 4.35Å; I91-F93 HydrophobicContact CG2-CD2 4.14Å; I91-F93 HydrophobicContact CG2-CE2 3.59Å; I91-F93 HydrophobicContact CG2-CZ 3.99Å; F93-Q114 CarbonylContact O-C 3.47Å; F93-Q114 VanDerWaalsContact O-CA 3.22Å; F93-Q114 WeakPolarHBondContact O-CA 3.48Å; F93-A115 HydrophobicContact CB-CB 4.33Å; F93-A115 PolarHBondContact N-O 3.29Å; F93-A115 PolarHBondContact O-N 2.92Å; F93-V117 HydrophobicContact CD2-CG2 4.18Å; F93-V117 HydrophobicContact CE2-CB 4.14Å; F93-V117 HydrophobicContact CE2-CG2 3.68Å; F93-L157 HydrophobicContact CB-CD2 3.79Å; F93-L157 HydrophobicContact CD1-CD2 3.85Å; F93-L157 HydrophobicContact CD2-CD2 4.47Å; F93-L157 HydrophobicContact CG-CD2 3.78Å; F93-V159 HydrophobicContact CD2-CG2 4.42Å; F93-V159 HydrophobicContact CE1-CG2 4.34Å; F93-V159 HydrophobicContact CE2-CG1 4.04Å; F93-V159 HydrophobicContact CE2-CG2 3.96Å; F93-V159 HydrophobicContact CZ-CB 4.46Å; F93-V159 HydrophobicContact CZ-CG1 3.64Å; F93-V159 HydrophobicContact CZ-CG2 3.91Å
94	T	89.4	Confident	78.5	Confident	14 Å²	14	46.9 Å²	46.9	9%	0.086	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120	176.2	-57.2	0	0	0	0	109.5	Q43 V96 V111 Q114	Q43-T94 PolarHBondContact N-O 2.82Å; Q43-T94 PolarHBondContact O-N 3.03Å; T94-V96 HydrophobicContact CG2-CG2 4.06Å; T94-V111 HydrophobicContact CG2-CG1 3.45Å; T94-V111 VanDerWaalsContact CG2-CG1 3.45Å; T94-V111 HydrophobicContact CG2-CG2 4.4Å; T94-Q114 HydrophobicContact CG2-CG 4.32Å
95	V	88.1	Confident	77	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	123.6	176.7	-179	0	0	0	0	109	I30 L42 L112 G113 L135	I30-V95 HydrophobicContact CG2-CG1 4.4Å; L42-V95 HydrophobicContact CD2-CB 4.39Å; L42-V95 HydrophobicContact CD2-CG2 3.5Å; L42-V95 VanDerWaalsContact CD2-CG2 3.5Å; V95-L112 HydrophobicContact CB-CB 4.41Å; V95-L112 HydrophobicContact CG1-CB 4.23Å; V95-L112 HydrophobicContact CG1-CD1 4.06Å; V95-L112 PolarHBondContact O-N 2.83Å; V95-G113 PolarHBondContact N-O 2.86Å; V95-L135 HydrophobicContact CB-CD1 4.23Å; V95-L135 HydrophobicContact CB-CD2 4.24Å; V95-L135 HydrophobicContact CG2-CD1 3.48Å; V95-L135 VanDerWaalsContact CG2-CD1 3.48Å; V95-L135 HydrophobicContact CG2-CD2 3.83Å; V95-L135 HydrophobicContact CG2-CG 4.32Å
96	V	87.5	Confident	75.1	Confident	7 Å²	7	55.6 Å²	55.6	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.3	-176	-173.7	0	0	0	0	110.8	S40 F41 T94 T109 V111	S40-V96 CarbonylContact C-O 3.54Å; S40-V96 WeakPolarHBondContact CA-O 3.22Å; S40-V96 VanDerWaalsContact CB-O 3.25Å; S40-V96 WeakPolarHBondContact CB-O 3.28Å; F41-V96 HydrophobicContact CD1-CB 4.2Å; F41-V96 HydrophobicContact CE1-CB 3.71Å; F41-V96 HydrophobicContact CE1-CG1 3.66Å; F41-V96 HydrophobicContact CE2-CB 4.17Å; F41-V96 HydrophobicContact CE2-CG2 4.4Å; F41-V96 HydrophobicContact CZ-CB 3.7Å; F41-V96 HydrophobicContact CZ-CG1 3.71Å; F41-V96 HydrophobicContact CZ-CG2 4.25Å; F41-V96 PolarHBondContact N-O 3.29Å; F41-V96 PolarHBondContact O-N 3.18Å; T94-V96 HydrophobicContact CG2-CG2 4.06Å; V96-T109 HydrophobicContact CG1-CG2 4.07Å; V96-V111 HydrophobicContact CG2-CG2 4.42Å
97	E	88.4	Confident	73.9	Confident	5 Å²	5	58.4 Å²	58.4	2%	0.023	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	144.6	173.1	177.7	177.3	-151.4	0	0	111.4	G32 K33 L38 V39 L99 T109 A110 L112	G32-E97 WeakPolarHBondContact CA-OE1 3.29Å; K33-E97 PolarHBondContact N-OE1 2.86Å; K33-E97 PolarHBondContact N-OE2 2.86Å; L38-E97 HydrophobicContact CD1-CB 4.07Å; L38-E97 HydrophobicContact CD1-CG 3.74Å; V39-E97 WeakPolarHBondContact O-CA 3.46Å; E97-L99 HydrophobicContact CG-CD2 3.93Å; E97-L99 HydrophobicContact CG-CG 4.37Å; E97-T109 CarbonylContact O-C 3.59Å; E97-T109 VanDerWaalsContact O-CA 3.24Å; E97-T109 WeakPolarHBondContact O-CA 3.37Å; E97-A110 PolarHBondContact N-O 2.87Å; E97-A110 PolarHBondContact O-N 3.28Å; E97-L112 HydrophobicContact CB-CD1 3.98Å; E97-L112 HydrophobicContact CB-CD2 3.89Å; E97-L112 HydrophobicContact CB-CG 3.81Å; E97-L112 WeakPolarHBondContact OE2-CD2 3.43Å
98	V	83.7	Confident	73.4	Confident	30 Å²	30	65 Å²	65	18%	0.182	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	119.1	175.7	-176.6	0	0	0	0	110.4	V39 F41 K56 L107	V39-V98 PolarHBondContact O-N 3.29Å; F41-V98 HydrophobicContact CD1-CG2 4.1Å; F41-V98 HydrophobicContact CE1-CG2 4.09Å; K56-V98 HydrophobicContact CD-CG2 4.28Å; V98-L107 HydrophobicContact CG1-CD2 3.61Å
99	L	71.4	Confident	73.2	Confident	34 Å²	34	66.8 Å²	66.8	18%	0.178	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	9	-167.5	-67.8	176.7	0	0	0	116.9	K34 E97 K108 A110	K34-L99 HydrophobicContact CD-CD2 4.41Å; K34-L99 PolarHBondContact NZ-O 2.82Å; E97-L99 HydrophobicContact CG-CD2 3.93Å; E97-L99 HydrophobicContact CG-CG 4.37Å; L99-K108 WeakPolarHBondContact CA-O 3.31Å; L99-K108 WeakPolarHBondContact CB-O 3.41Å; L99-K108 PolarHBondContact N-O 2.88Å; L99-A110 HydrophobicContact CD1-CB 3.4Å; L99-A110 VanDerWaalsContact CD1-CB 3.4Å; L99-A110 HydrophobicContact CG-CB 4.09Å
100	H	65.2	Low	72.9	Confident	145 Å²	145	66 Å²	66	67%	0.671	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	113.8	148.9	-177.4	-70.6	-31.8	0	0	0	113.9	K108	H100-K108 PolarHBondContact O-N 2.86Å
101	E	54.9	Low	72.7	Confident	147 Å²	147	68.2 Å²	68.2	69%	0.687	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	123.2	173.8	-73.2	-179.6	169.1	0	0	110.8	L107	E101-L107 HydrophobicContact CG-CD2 3.52Å; E101-L107 HydrophobicContact CG-CG 4.07Å
102	G	48.8	Very low	72.3	Confident	41 Å²	41	69.4 Å²	69.4	42%	0.423	36%	0.36	S	S	.	.			trans	-73.9	162.8	173.5	0	0	0	0	0	112.3	K104 G105 E106	G102-K104 PolarHBondContact O-N 2.91Å; G102-G105 PolarHBondContact O-N 2.81Å; G102-E106 PolarHBondContact N-O 3.42Å; G102-E106 VanDerWaalsContact N-O 3.07Å
103	K	45.2	Very low	72.2	Confident	226 Å²	226	69 Å²	69	98%	0.983	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	0.4	-179.9	-71.5	-175.9	175.2	-178.8	0	116
104	K	47.7	Very low	72.2	Confident	198 Å²	198	70.4 Å²	70.4	86%	0.861	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	7.8	176.9	-79.6	-172.1	174.7	-176.4	0	114.3	G102 E106	G102-K104 PolarHBondContact O-N 2.91Å; K104-E106 VanDerWaalsContact C-N 3.28Å; K104-E106 PolarHBondContact O-N 2.84Å
105	G	53.5	Low	72.2	Confident	60 Å²	60	69.7 Å²	69.7	62%	0.619	36%	0.36	S	S	*	.	S	Bend	trans	80.6	-0.4	-177.6	0	0	0	0	0	115	G102 L107	G102-G105 PolarHBondContact O-N 2.81Å; G105-L107 PolarHBondContact O-N 2.82Å
106	E	47.4	Very low	72.3	Confident	156 Å²	156	70.4 Å²	70.4	73%	0.729	36%	0.364	S	S	*	.			trans	-76.1	115.8	169.2	-77	177.5	170.9	0	0	110.1	G102 K104 K108	G102-E106 PolarHBondContact N-O 3.42Å; G102-E106 VanDerWaalsContact N-O 3.07Å; K104-E106 VanDerWaalsContact C-N 3.28Å; K104-E106 PolarHBondContact O-N 2.84Å; E106-K108 PolarHBondContact O-N 2.81Å
107	L	61.5	Low	72.4	Confident	64 Å²	64	70.2 Å²	70.2	34%	0.335	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	116.8	171.8	-79	152	0	0	0	109	K56 V98 E101 G105 T109	K56-L107 VanDerWaalsContact NZ-CD1 3.26Å; V98-L107 HydrophobicContact CG1-CD2 3.61Å; E101-L107 HydrophobicContact CG-CD2 3.52Å; E101-L107 HydrophobicContact CG-CG 4.07Å; G105-L107 PolarHBondContact O-N 2.82Å; L107-T109 PolarHBondContact O-N 3.3Å
108	K	76	Confident	72.4	Confident	154 Å²	154	71.6 Å²	71.6	67%	0.67	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	110.3	172.8	-163.8	170.2	-175.2	174	0	108.3	L99 H100 E106	L99-K108 WeakPolarHBondContact CA-O 3.31Å; L99-K108 WeakPolarHBondContact CB-O 3.41Å; L99-K108 PolarHBondContact N-O 2.88Å; H100-K108 PolarHBondContact O-N 2.86Å; E106-K108 PolarHBondContact O-N 2.81Å
109	T	80.9	Confident	72.6	Confident	73 Å²	73	70.2 Å²	70.2	45%	0.448	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	157.9	178.3	55.5	0	0	0	0	111.5	F41 V96 E97 L107	F41-T109 HydrophobicContact CE1-CG2 4.24Å; V96-T109 HydrophobicContact CG1-CG2 4.07Å; E97-T109 CarbonylContact O-C 3.59Å; E97-T109 VanDerWaalsContact O-CA 3.24Å; E97-T109 WeakPolarHBondContact O-CA 3.37Å; L107-T109 PolarHBondContact O-N 3.3Å
110	A	81.9	Confident	73.4	Confident	11 Å²	11	70.1 Å²	70.1	9%	0.091	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	129.2	171.5	0	0	0	0	0	110.8	K33 E97 L99 L112	K33-A110 HydrophobicContact CD-CB 4.23Å; E97-A110 PolarHBondContact N-O 2.87Å; E97-A110 PolarHBondContact O-N 3.28Å; L99-A110 HydrophobicContact CD1-CB 3.4Å; L99-A110 VanDerWaalsContact CD1-CB 3.4Å; L99-A110 HydrophobicContact CG-CB 4.09Å; A110-L112 PolarHBondContact O-N 2.94Å
111	V	83.8	Confident	74.4	Confident	59 Å²	59	64.4 Å²	64.4	36%	0.358	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	125.5	175.3	-172.4	0	0	0	0	109.7	T94 V96 V138	T94-V111 HydrophobicContact CG2-CG1 3.45Å; T94-V111 VanDerWaalsContact CG2-CG1 3.45Å; T94-V111 HydrophobicContact CG2-CG2 4.4Å; V96-V111 HydrophobicContact CG2-CG2 4.42Å; V111-V138 HydrophobicContact CG1-CB 4.12Å; V111-V138 HydrophobicContact CG1-CG1 4.49Å; V111-V138 HydrophobicContact CG1-CG2 3.61Å
112	L	82.8	Confident	76	Confident	25 Å²	25	57.4 Å²	57.4	13%	0.131	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-42.2	178.7	-66.9	-175	0	0	0	111.7	I30 K33 L38 V95 E97 A110	I30-L112 HydrophobicContact CG2-CD1 3.79Å; K33-L112 HydrophobicContact CG-CD2 4.47Å; L38-L112 HydrophobicContact CD1-CD1 3.83Å; L38-L112 HydrophobicContact CD2-CD1 4.31Å; V95-L112 HydrophobicContact CB-CB 4.41Å; V95-L112 HydrophobicContact CG1-CB 4.23Å; V95-L112 HydrophobicContact CG1-CD1 4.06Å; V95-L112 PolarHBondContact O-N 2.83Å; E97-L112 HydrophobicContact CB-CD1 3.98Å; E97-L112 HydrophobicContact CB-CD2 3.89Å; E97-L112 HydrophobicContact CB-CG 3.81Å; E97-L112 WeakPolarHBondContact OE2-CD2 3.43Å; A110-L112 PolarHBondContact O-N 2.94Å
113	G	86.8	Confident	77.7	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	171.5	-179	0	0	0	0	0	113.3	V95 N136	V95-G113 PolarHBondContact N-O 2.86Å; G113-N136 CarbonylContact C-O 3.53Å; G113-N136 WeakPolarHBondContact CA-O 2.86Å
114	Q	90.4	Very high	79.5	Confident	29 Å²	29	49.8 Å²	49.8	14%	0.136	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142	176.2	-74.8	-178	-20.4	0	0	110.7	I92 F93 T94 N136 V138 V251 N254	I92-Q114 HydrophobicContact CG2-CG 4.44Å; F93-Q114 CarbonylContact O-C 3.47Å; F93-Q114 VanDerWaalsContact O-CA 3.22Å; F93-Q114 WeakPolarHBondContact O-CA 3.48Å; T94-Q114 HydrophobicContact CG2-CG 4.32Å; Q114-N136 PolarHBondContact N-O 3.37Å; Q114-N136 PolarHBondContact O-N 2.97Å; Q114-V138 HydrophobicContact CG-CG2 3.83Å; Q114-V251 HydrophobicContact CB-CG1 4.42Å; Q114-V251 HydrophobicContact CB-CG2 3.87Å; Q114-V251 HydrophobicContact CG-CG1 4.42Å; Q114-V251 VanDerWaalsContact OE1-N 3.14Å; Q114-N254 VanDerWaalsContact C-ND2 3.3Å; Q114-N254 PolarHBondContact O-ND2 3.17Å
115	A	89.9	Confident	81.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	153.1	170.3	0	0	0	0	0	109.6	F93 V133 P134 L135	F93-A115 HydrophobicContact CB-CB 4.33Å; F93-A115 PolarHBondContact N-O 3.29Å; F93-A115 PolarHBondContact O-N 2.92Å; A115-V133 HydrophobicContact CB-CB 4.43Å; A115-V133 HydrophobicContact CB-CG2 3.73Å; A115-P134 WeakPolarHBondContact CB-O 3.49Å; A115-L135 HydrophobicContact CB-CD1 4.07Å
116	V	90.1	Very high	82.7	Confident	14 Å²	14	43.1 Å²	43.1	9%	0.085	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	135.9	-172.9	177.7	0	0	0	0	110.9	P90 I91 V133 L250 N254	P90-V116 HydrophobicContact CB-CG1 3.45Å; P90-V116 VanDerWaalsContact CB-CG1 3.45Å; P90-V116 HydrophobicContact CG-CG1 3.83Å; I91-V116 VanDerWaalsContact O-CA 3.31Å; I91-V116 WeakPolarHBondContact O-CA 3.47Å; V116-V133 WeakPolarHBondContact O-CG1 3.31Å; V116-L250 HydrophobicContact CG2-CD2 3.75Å; V116-N254 HydrophobicContact CB-CB 4.44Å; V116-N254 HydrophobicContact CG2-CB 3.7Å
117	V	89.8	Confident	84.7	Confident	4 Å²	4	38 Å²	38	2%	0.024	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.1	178.1	177	0	0	0	0	110.4	I91 F93 F129 V133 V159 V161	I91-V117 PolarHBondContact N-O 3.19Å; I91-V117 PolarHBondContact O-N 3.14Å; F93-V117 HydrophobicContact CD2-CG2 4.18Å; F93-V117 HydrophobicContact CE2-CB 4.14Å; F93-V117 HydrophobicContact CE2-CG2 3.68Å; V117-F129 HydrophobicContact CG1-CE2 4.15Å; V117-F129 HydrophobicContact CG1-CZ 4.27Å; V117-V133 HydrophobicContact CG2-CG1 3.82Å; V117-V133 HydrophobicContact CG2-CG2 4.09Å; V117-V159 HydrophobicContact CG2-CB 4.03Å; V117-V159 HydrophobicContact CG2-CG1 4.1Å; V117-V159 HydrophobicContact CG2-CG2 3.97Å; V117-V161 HydrophobicContact CG1-CG2 4.35Å
118	D	87.9	Confident	86	Confident	34 Å²	34	37.9 Å²	37.9	18%	0.182	21%	0.21	C	C	.	.			trans	-93.2	137.2	175	-67.4	-45.1	0	0	0	111.4	F120 P121 F129 R244	D118-F120 VanDerWaalsContact C-N 3.3Å; D118-F120 HydrophobicContact CB-CB 4.47Å; D118-P121 WeakPolarHBondContact O-CD 3.49Å; D118-F129 VanDerWaalsContact O-CZ 3.29Å; D118-F129 WeakPolarHBondContact O-CZ 3.45Å; D118-R244 IonicContact OD1-CZ 3.09Å; D118-R244 IonicContact OD1-NH1 2.82Å; D118-R244 PolarHBondContact OD1-NH1 2.7Å; D118-R244 IonicContact OD1-NH2 3.92Å; D118-R244 IonicContact OD2-CZ 2.62Å; D118-R244 IonicContact OD2-NH1 3.02Å; D118-R244 PolarHBondContact OD2-NH1 2.95Å; D118-R244 IonicContact OD2-NH2 3.69Å; D118-R244 PolarHBondContact OD2-NH2 3.27Å
119	L	88.8	Confident	86.8	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	18%	0.184	C	C	.	.			trans	-88.1	2.3	174.5	-67.3	-177.6	0	0	0	113.5	I20 I86 I91 P121 L122 V161	I20-L119 HydrophobicContact CD1-CD1 4.24Å; I20-L119 HydrophobicContact CG2-CD2 4.35Å; I86-L119 HydrophobicContact CG2-CB 3.55Å; I86-L119 HydrophobicContact CG2-CD1 4.22Å; I91-L119 HydrophobicContact CD1-CD1 3.92Å; I91-L119 HydrophobicContact CD1-CD2 3.51Å; I91-L119 HydrophobicContact CD1-CG 3.72Å; I91-L119 HydrophobicContact CG1-CD1 4.35Å; I91-L119 HydrophobicContact CG1-CG 4.32Å; L119-P121 VanDerWaalsContact C-N 3.32Å; L119-L122 HydrophobicContact CB-CD1 4.44Å; L119-L122 HydrophobicContact CD2-CD1 4.01Å; L119-L122 WeakPolarHBondContact O-CB 3.22Å; L119-L122 PolarHBondContact O-N 2.92Å; L119-V161 HydrophobicContact CD2-CG1 3.81Å; L119-V161 HydrophobicContact CD2-CG2 4.44Å
120	F	87.4	Confident	87.2	Confident	31 Å²	31	32.4 Å²	32.4	14%	0.136	19%	0.192	C	C	.	.	H	α-helix	trans	-48.4	-40.5	178.9	-179.6	-127.7	0	0	0	115.1	L87 D118 L122 L123 Q124 I178	L87-F120 HydrophobicContact CD2-CD2 3.35Å; L87-F120 HydrophobicContact CD2-CE2 3.91Å; L87-F120 HydrophobicContact CD2-CG 4.39Å; D118-F120 VanDerWaalsContact C-N 3.3Å; D118-F120 HydrophobicContact CB-CB 4.47Å; F120-L122 PolarHBondContact O-N 2.85Å; F120-L122 VanDerWaalsContact O-N 3.15Å; F120-L123 PolarHBondContact O-N 3.39Å; F120-L123 VanDerWaalsContact O-N 3.1Å; F120-Q124 HydrophobicContact CE1-CG 4.28Å; F120-Q124 VanDerWaalsContact CE1-NE2 3.28Å; F120-Q124 HydrophobicContact CE2-CG 4.27Å; F120-Q124 HydrophobicContact CZ-CG 4.1Å; F120-Q124 PolarHBondContact O-N 3.05Å; F120-I178 HydrophobicContact CE2-CD1 3.73Å; F120-I178 HydrophobicContact CE2-CG2 4.3Å
121	P	87.6	Confident	87.6	Confident	26 Å²	26	33.9 Å²	33.9	17%	0.169	20%	0.201	C	C	.	.	H	α-helix	trans	-58.9	-27.5	179.4	-24.9	35.4	0	0	0	114.3	D118 L119 L123 Q124 Q126 F129	D118-P121 WeakPolarHBondContact O-CD 3.49Å; L119-P121 VanDerWaalsContact C-N 3.32Å; P121-L123 VanDerWaalsContact C-N 3.35Å; P121-Q124 WeakPolarHBondContact O-CB 3.42Å; P121-Q124 PolarHBondContact O-N 2.83Å; P121-Q124 VanDerWaalsContact O-N 3.15Å; P121-Q126 WeakPolarHBondContact O-CB 3.49Å; P121-Q126 PolarHBondContact O-N 3.24Å; P121-F129 HydrophobicContact CB-CD1 3.83Å; P121-F129 HydrophobicContact CB-CE1 4.08Å; P121-F129 HydrophobicContact CB-CG 4.12Å; P121-F129 HydrophobicContact CG-CD1 4.22Å; P121-F129 HydrophobicContact CG-CD2 4.28Å; P121-F129 HydrophobicContact CG-CE1 4.16Å; P121-F129 HydrophobicContact CG-CE2 4.22Å; P121-F129 HydrophobicContact CG-CG 4.29Å; P121-F129 HydrophobicContact CG-CZ 4.17Å
122	L	87.4	Confident	87.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-37.3	178.1	-57.9	178.5	0	0	0	111.9	I20 L119 F120 Q124 G125 Q126 F129 V161 V163 L167	I20-L122 HydrophobicContact CD1-CD1 4.15Å; I20-L122 HydrophobicContact CG2-CD1 3.95Å; L119-L122 HydrophobicContact CB-CD1 4.44Å; L119-L122 HydrophobicContact CD2-CD1 4.01Å; L119-L122 WeakPolarHBondContact O-CB 3.22Å; L119-L122 PolarHBondContact O-N 2.92Å; F120-L122 PolarHBondContact O-N 2.85Å; F120-L122 VanDerWaalsContact O-N 3.15Å; L122-Q124 PolarHBondContact O-N 3.48Å; L122-G125 PolarHBondContact O-N 3.38Å; L122-G125 VanDerWaalsContact O-N 3.17Å; L122-Q126 WeakPolarHBondContact CA-O 3.4Å; L122-Q126 VanDerWaalsContact CD2-O 3.28Å; L122-Q126 WeakPolarHBondContact CD2-O 3.45Å; L122-F129 HydrophobicContact CD2-CD1 3.95Å; L122-F129 HydrophobicContact CD2-CE1 3.87Å; L122-F129 HydrophobicContact CG-CD1 4.43Å; L122-F129 HydrophobicContact CG-CE1 3.91Å; L122-V161 HydrophobicContact CD1-CG1 4.08Å; L122-V163 HydrophobicContact CD1-CG2 3.77Å; L122-V163 HydrophobicContact CD2-CG2 4.01Å; L122-V163 HydrophobicContact CG-CG2 4.47Å; L122-L167 HydrophobicContact CB-CD1 3.51Å; L122-L167 HydrophobicContact CB-CG 4.12Å; L122-L167 HydrophobicContact CD1-CD1 4.14Å; L122-L167 HydrophobicContact CG-CD1 4.48Å
123	L	85.6	Confident	88.2	Confident	3 Å²	3	34 Å²	34	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-77.7	-5.7	175.6	-67.5	172	0	0	0	112.9	F83 I86 L87 F120 P121 G125 L167 L168	F83-L123 HydrophobicContact CB-CD1 4.4Å; F83-L123 HydrophobicContact CB-CD2 4.15Å; F83-L123 HydrophobicContact CD1-CD2 3.71Å; F83-L123 HydrophobicContact CE1-CD2 4.31Å; F83-L123 HydrophobicContact CG-CD2 4.01Å; I86-L123 HydrophobicContact CB-CD1 4.35Å; I86-L123 HydrophobicContact CG2-CD1 3.89Å; I86-L123 HydrophobicContact CG2-CG 4.39Å; L87-L123 HydrophobicContact CD1-CD1 4.23Å; L87-L123 HydrophobicContact CD2-CD1 3.56Å; L87-L123 HydrophobicContact CG-CD1 3.54Å; F120-L123 PolarHBondContact O-N 3.39Å; F120-L123 VanDerWaalsContact O-N 3.1Å; P121-L123 VanDerWaalsContact C-N 3.35Å; L123-G125 VanDerWaalsContact C-N 3.32Å; L123-L167 HydrophobicContact CD2-CB 4.26Å; L123-L167 HydrophobicContact CD2-CD1 4.09Å; L123-L167 HydrophobicContact CG-CD1 4.37Å; L123-L168 HydrophobicContact CD2-CD1 4.08Å; L123-L168 HydrophobicContact CD2-CG 4.16Å
124	Q	83.4	Confident	88.2	Confident	103 Å²	103	36.4 Å²	36.4	48%	0.481	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	5.4	168.2	-61.3	-174.7	-48.4	0	0	112.6	F120 P121 L122	F120-Q124 HydrophobicContact CE1-CG 4.28Å; F120-Q124 VanDerWaalsContact CE1-NE2 3.28Å; F120-Q124 HydrophobicContact CE2-CG 4.27Å; F120-Q124 HydrophobicContact CZ-CG 4.1Å; F120-Q124 PolarHBondContact O-N 3.05Å; P121-Q124 WeakPolarHBondContact O-CB 3.42Å; P121-Q124 PolarHBondContact O-N 2.83Å; P121-Q124 VanDerWaalsContact O-N 3.15Å; L122-Q124 PolarHBondContact O-N 3.48Å
125	G	81.2	Confident	88.1	Confident	32 Å²	32	35.4 Å²	35.4	33%	0.33	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	5.2	177.5	0	0	0	0	0	114.7	L122 L123 L173	L122-G125 PolarHBondContact O-N 3.38Å; L122-G125 VanDerWaalsContact O-N 3.17Å; L123-G125 VanDerWaalsContact C-N 3.32Å; G125-L173 VanDerWaalsContact CA-CD1 3.45Å
126	Q	86.7	Confident	88	Confident	86 Å²	86	36.6 Å²	36.6	40%	0.402	22%	0.221	S	C	.	.			trans	-79.4	131.8	175.9	-58.4	-176.5	9.7	0	0	110.7	P121 L122	P121-Q126 WeakPolarHBondContact O-CB 3.49Å; P121-Q126 PolarHBondContact O-N 3.24Å; L122-Q126 WeakPolarHBondContact CA-O 3.4Å; L122-Q126 VanDerWaalsContact CD2-O 3.28Å; L122-Q126 WeakPolarHBondContact CD2-O 3.45Å
127	C	88.3	Confident	87.6	Confident	48 Å²	48	40.3 Å²	40.3	32%	0.324	25%	0.245	S	C	.	.	S	Bend	trans	-84.9	-22.1	174.2	-64.2	0	0	0	0	112.9	S162 V163 P166	C127-S162 CarbonylContact O-C 3.43Å; C127-S162 WeakPolarHBondContact O-CA 3.24Å; C127-V163 PolarHBondContact O-N 3.06Å; C127-P166 VanDerWaalsContact SG-CG 3.6Å
128	S	90.2	Very high	86.6	Confident	62 Å²	62	42.8 Å²	42.8	43%	0.434	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	149.7	174	63.8	0	0	0	0	111.6	V161	S128-V161 CarbonylContact C-O 3.48Å; S128-V161 WeakPolarHBondContact CA-O 3.29Å; S128-V161 WeakPolarHBondContact CB-O 3.22Å
129	F	91.8	Very high	85.1	Confident	25 Å²	25	46.8 Å²	46.8	11%	0.11	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	154.6	174.8	68	-85.6	0	0	0	111.3	V117 D118 P121 L122 F160 V161	V117-F129 HydrophobicContact CG1-CE2 4.15Å; V117-F129 HydrophobicContact CG1-CZ 4.27Å; D118-F129 VanDerWaalsContact O-CZ 3.29Å; D118-F129 WeakPolarHBondContact O-CZ 3.45Å; P121-F129 HydrophobicContact CB-CD1 3.83Å; P121-F129 HydrophobicContact CB-CE1 4.08Å; P121-F129 HydrophobicContact CB-CG 4.12Å; P121-F129 HydrophobicContact CG-CD1 4.22Å; P121-F129 HydrophobicContact CG-CD2 4.28Å; P121-F129 HydrophobicContact CG-CE1 4.16Å; P121-F129 HydrophobicContact CG-CE2 4.22Å; P121-F129 HydrophobicContact CG-CG 4.29Å; P121-F129 HydrophobicContact CG-CZ 4.17Å; L122-F129 HydrophobicContact CD2-CD1 3.95Å; L122-F129 HydrophobicContact CD2-CE1 3.87Å; L122-F129 HydrophobicContact CG-CD1 4.43Å; L122-F129 HydrophobicContact CG-CE1 3.91Å; F129-F160 WeakPolarHBondContact O-CD2 3.49Å; F129-V161 HydrophobicContact CD1-CB 4.16Å; F129-V161 HydrophobicContact CE1-CB 3.63Å; F129-V161 HydrophobicContact CE1-CG1 3.91Å; F129-V161 HydrophobicContact CE1-CG2 4.18Å; F129-V161 HydrophobicContact CE2-CB 4.38Å; F129-V161 HydrophobicContact CE2-CG2 4.22Å; F129-V161 HydrophobicContact CZ-CB 3.76Å; F129-V161 HydrophobicContact CZ-CG1 4.27Å; F129-V161 HydrophobicContact CZ-CG2 3.77Å; F129-V161 PolarHBondContact N-O 3.03Å; F129-V161 PolarHBondContact O-N 3.47Å
130	S	90.4	Very high	82.7	Confident	88 Å²	88	52.6 Å²	52.6	62%	0.615	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.7	172.9	-169.3	0	0	0	0	110.1	V159	S130-V159 CarbonylContact C-O 3.49Å; S130-V159 WeakPolarHBondContact CA-O 3.49Å; S130-V159 PolarHBondContact OG-O 3.48Å
131	S	89.5	Confident	80.3	Confident	41 Å²	41	57.3 Å²	57.3	29%	0.287	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135.5	179.1	-172	0	0	0	0	110.9	V159	S131-V159 PolarHBondContact N-O 3.02Å; S131-V159 PolarHBondContact O-N 3.29Å
132	T	89.6	Confident	77.6	Confident	77 Å²	77	58.7 Å²	58.7	47%	0.472	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	108.3	170.6	-57.1	0	0	0	0	108.3	T156 L157 E158	T132-T156 HydrophobicContact CG2-CG2 4.26Å; T132-L157 WeakPolarHBondContact CA-O 3.49Å; T132-E158 HydrophobicContact CG2-CG 4.29Å
133	V	88.7	Confident	75.2	Confident	10 Å²	10	65.3 Å²	65.3	6%	0.061	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	142.1	-173.1	-68.2	0	0	0	0	111.9	A115 V116 V117 T156 L157 V159	A115-V133 HydrophobicContact CB-CB 4.43Å; A115-V133 HydrophobicContact CB-CG2 3.73Å; V116-V133 WeakPolarHBondContact O-CG1 3.31Å; V117-V133 HydrophobicContact CG2-CG1 3.82Å; V117-V133 HydrophobicContact CG2-CG2 4.09Å; V133-T156 CarbonylContact O-C 3.42Å; V133-T156 VanDerWaalsContact O-CA 3.24Å; V133-T156 WeakPolarHBondContact O-CA 3.37Å; V133-T156 WeakPolarHBondContact O-CB 3.48Å; V133-L157 HydrophobicContact CG2-CB 4.08Å; V133-L157 WeakPolarHBondContact CG2-O 3.19Å; V133-L157 PolarHBondContact N-O 2.92Å; V133-L157 PolarHBondContact O-N 3Å; V133-V159 HydrophobicContact CG2-CG2 4.17Å
134	P	88.6	Confident	72.5	Confident	50 Å²	50	74 Å²	74	33%	0.325	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	139.8	177.3	29.6	-33.8	0	0	0	111.1	A115	A115-P134 WeakPolarHBondContact CB-O 3.49Å
135	L	87.4	Confident	70.1	Confident	9 Å²	9	78.8 Å²	78.8	5%	0.047	46%	0.463	C	S	.	.			trans	-94	112.5	173.9	-173.1	73.7	0	0	0	109.6	I30 V95 A115 P155	I30-L135 HydrophobicContact CD1-CD2 4.12Å; I30-L135 HydrophobicContact CG1-CD2 4.02Å; I30-L135 HydrophobicContact CG2-CD2 4.3Å; V95-L135 HydrophobicContact CB-CD1 4.23Å; V95-L135 HydrophobicContact CB-CD2 4.24Å; V95-L135 HydrophobicContact CG2-CD1 3.48Å; V95-L135 VanDerWaalsContact CG2-CD1 3.48Å; V95-L135 HydrophobicContact CG2-CD2 3.83Å; V95-L135 HydrophobicContact CG2-CG 4.32Å; A115-L135 HydrophobicContact CB-CD1 4.07Å; L135-P155 HydrophobicContact CB-CB 4.08Å; L135-P155 HydrophobicContact CB-CG 4.16Å; L135-P155 HydrophobicContact CD2-CB 4.28Å; L135-P155 PolarHBondContact N-O 2.92Å; L135-P155 WeakPolarHBondContact O-CG 3.03Å
136	N	87	Confident	67.9	Low	24 Å²	24	81.8 Å²	81.8	13%	0.128	48%	0.479	C	S	.	.	B	Isolated β-bridge	trans	-100.9	133.8	-176.3	-72.8	-46.8	0	0	0	111.7	G113 Q114 V251 G253 N254	G113-N136 CarbonylContact C-O 3.53Å; G113-N136 WeakPolarHBondContact CA-O 2.86Å; Q114-N136 PolarHBondContact N-O 3.37Å; Q114-N136 PolarHBondContact O-N 2.97Å; N136-V251 HydrophobicContact CB-CG2 3.7Å; N136-G253 PolarHBondContact ND2-O 2.79Å; N136-N254 PolarHBondContact ND2-OD1 2.71Å
137	P	82.4	Confident	65.3	Low	93 Å²	93	89.7 Å²	89.7	60%	0.604	51%	0.505	S	S	*	.			trans	-73.2	147.8	-173.5	28.8	-34.8	0	0	0	113.8
138	V	69.4	Low	62.7	Low	55 Å²	55	97 Å²	97	33%	0.333	54%	0.535	S	S	.	.	S	Bend	trans	-87.5	-14.1	-172.4	174.6	0	0	0	0	115.3	V111 Q114 V251	V111-V138 HydrophobicContact CG1-CB 4.12Å; V111-V138 HydrophobicContact CG1-CG1 4.49Å; V111-V138 HydrophobicContact CG1-CG2 3.61Å; Q114-V138 HydrophobicContact CG-CG2 3.83Å; V138-V251 HydrophobicContact CB-CG1 4.07Å; V138-V251 HydrophobicContact CG1-CG1 4.46Å; V138-V251 HydrophobicContact CG2-CG1 3.53Å
139	V	56.2	Low	59.9	Low	119 Å²	119	97.9 Å²	97.9	72%	0.721	55%	0.554	S	S	*	*	S	Bend	trans	155.7	123.7	158.9	157.5	0	0	0	0	110.5
140	N	37.8	Very low	57.1	Low	123 Å²	123	105.2 Å²	105.2	66%	0.658	59%	0.591	S	S	*	*				-167.3	117.9	114.7	-142.5	0.6	0	0	0	111.2	G142	N140-G142 PolarHBondContact O-N 3.22Å
141	P	36.7	Very low	54.7	Low	130 Å²	130	106.3 Å²	106.3	84%	0.844	60%	0.598	S	S	*	*			trans	-77.1	10.1	168.5	31	-32.3	0	0	0	113.4
142	G	30.5	Very low	53.1	Low	55 Å²	55	114.2 Å²	114.2	57%	0.567	62%	0.622	S	S	*	*			trans	-99.7	18.7	-173.3	0	0	0	0	0	116.7	N140 K144	N140-G142 PolarHBondContact O-N 3.22Å; G142-K144 PolarHBondContact O-N 3.16Å
143	I	37.1	Very low	52.1	Low	139 Å²	139	117.9 Å²	117.9	71%	0.713	63%	0.631	S	S	*	*			trans	-87.6	105.3	166.4	-60.9	177	0	0	0	106.5	E145	I143-E145 PolarHBondContact O-N 3.27Å
144	K	30.3	Very low	51.7	Low	186 Å²	186	123 Å²	123	81%	0.809	66%	0.655	S	S	*	*			trans	-44.1	117.8	163	-77.1	-179.4	174.6	-180	0	107.7	G142 S146	G142-K144 PolarHBondContact O-N 3.16Å; K144-S146 PolarHBondContact O-N 2.79Å
145	E	32.2	Very low	51.6	Low	202 Å²	202	122.5 Å²	122.5	94%	0.944	65%	0.651	S	S	*	*			trans	-60	85.5	169.4	-71	-179.3	153.7	0	0	108.6	I143	I143-E145 PolarHBondContact O-N 3.27Å
146	S	34.3	Very low	51.7	Low	96 Å²	96	123.4 Å²	123.4	67%	0.671	66%	0.657	S	S	*	*			trans	-136.7	80.6	165.9	59.5	0	0	0	0	108.5	K144	K144-S146 PolarHBondContact O-N 2.79Å
147	R	33.3	Very low	51.9	Low	251 Å²	251	122.3 Å²	122.3	95%	0.947	65%	0.651	S	S	*	*			trans	-166.5	118.7	141.1	-100.1	158.3	-163.4	-145.9	6	109
148	Q	33.8	Very low	52.3	Low	202 Å²	202	119.9 Å²	119.9	94%	0.944	63%	0.632	S	S	*	*			trans	-58.2	142.6	-177.7	-67.5	156.3	-36.2	0	0	112.6
149	G	31.4	Very low	53.4	Low	81 Å²	81	117.3 Å²	117.3	84%	0.835	62%	0.616	S	S	*	*				99.5	13	127.7	0	0	0	0	0	122.7
150	M	32.4	Very low	55.1	Low	179 Å²	179	114.6 Å²	114.6	88%	0.882	60%	0.595	S	S	*	*			trans	-137.2	131.3	170.5	-93.6	167	92.6	0	0	111.9	R152	M150-R152 PolarHBondContact O-N 3.25Å
151	S	39.5	Very low	57.6	Low	111 Å²	111	108.7 Å²	108.7	78%	0.776	56%	0.564	S	S	*	*			trans	-56.6	104.3	175	66.6	0	0	0	0	109.9	K153	S151-K153 PolarHBondContact O-N 2.81Å; S151-K153 VanDerWaalsContact O-N 3.17Å
152	R	57.2	Low	60.2	Low	206 Å²	206	103.9 Å²	103.9	78%	0.777	53%	0.533	S	S	*	.			trans	-70.7	109.9	173.2	-79.4	-178.3	170.8	177.9	-4.5	108.5	M150	M150-R152 PolarHBondContact O-N 3.25Å
153	K	67.8	Low	63.1	Low	155 Å²	155	101.9 Å²	101.9	67%	0.674	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-64.8	136.2	172.3	-66.6	-176.4	178.6	179.3	0	109.3	N29 S151	N29-K153 HydrophobicContact CB-CB 4.46Å; N29-K153 WeakPolarHBondContact ND2-CB 3.44Å; S151-K153 PolarHBondContact O-N 2.81Å; S151-K153 VanDerWaalsContact O-N 3.17Å
154	Q	80.4	Confident	65.3	Low	118 Å²	118	100.7 Å²	100.7	55%	0.551	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-60.4	134.2	179.1	-171.4	174.1	14.9	0	0	110.4
155	P	86.4	Confident	67.8	Low	39 Å²	39	96.8 Å²	96.8	25%	0.253	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-70.2	137.7	175	27.8	-32.8	0	0	0	110.7	R28 I30 L135	R28-P155 VanDerWaalsContact O-CA 3.29Å; R28-P155 WeakPolarHBondContact O-CA 3.48Å; I30-P155 HydrophobicContact CG1-CB 4.33Å; L135-P155 HydrophobicContact CB-CB 4.08Å; L135-P155 HydrophobicContact CB-CG 4.16Å; L135-P155 HydrophobicContact CD2-CB 4.28Å; L135-P155 PolarHBondContact N-O 2.92Å; L135-P155 WeakPolarHBondContact O-CG 3.03Å
156	T	89.8	Confident	70.2	Confident	28 Å²	28	90.5 Å²	90.5	17%	0.172	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	158.1	-178	62.8	0	0	0	0	111.7	G27 R28 T132 V133	G27-T156 CarbonylContact C-O 3.57Å; G27-T156 WeakPolarHBondContact CA-O 3.38Å; R28-T156 PolarHBondContact N-O 3Å; R28-T156 PolarHBondContact O-N 3.34Å; T132-T156 HydrophobicContact CG2-CG2 4.26Å; V133-T156 CarbonylContact O-C 3.42Å; V133-T156 VanDerWaalsContact O-CA 3.24Å; V133-T156 WeakPolarHBondContact O-CA 3.37Å; V133-T156 WeakPolarHBondContact O-CB 3.48Å
157	L	90.6	Very high	72.6	Confident	1 Å²	1	86.4 Å²	86.4	1%	0.005	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	129.1	175.2	-173.9	68.8	0	0	0	109.5	L42 Y68 F93 T132 V133 V159	L42-L157 HydrophobicContact CD1-CD1 4.28Å; L42-L157 HydrophobicContact CD2-CD1 4.43Å; L42-L157 HydrophobicContact CD2-CD2 4.24Å; Y68-L157 HydrophobicContact CD2-CD1 4.16Å; Y68-L157 HydrophobicContact CE2-CD1 4.2Å; F93-L157 HydrophobicContact CB-CD2 3.79Å; F93-L157 HydrophobicContact CD1-CD2 3.85Å; F93-L157 HydrophobicContact CD2-CD2 4.47Å; F93-L157 HydrophobicContact CG-CD2 3.78Å; T132-L157 WeakPolarHBondContact CA-O 3.49Å; V133-L157 HydrophobicContact CG2-CB 4.08Å; V133-L157 WeakPolarHBondContact CG2-O 3.19Å; V133-L157 PolarHBondContact N-O 2.92Å; V133-L157 PolarHBondContact O-N 3Å; L157-V159 HydrophobicContact CD2-CG2 3.97Å; L157-V159 HydrophobicContact CG-CG2 4.01Å
158	E	91.2	Very high	75	Confident	42 Å²	42	74.7 Å²	74.7	20%	0.196	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116.9	173.8	-66.3	-172.8	153.1	0	0	110.1	K25 C26 R28 T132	K25-E158 PolarHBondContact N-O 3.35Å; C26-E158 PolarHBondContact O-N 3.14Å; R28-E158 IonicContact CZ-OE1 2.62Å; R28-E158 IonicContact CZ-OE2 2.76Å; R28-E158 IonicContact NE-OE1 2.91Å; R28-E158 IonicContact NH1-OE1 3.14Å; R28-E158 PolarHBondContact NH1-OE1 3.19Å; R28-E158 VanDerWaalsContact NH1-OE1 3.1Å; R28-E158 IonicContact NH2-OE1 3.81Å; R28-E158 PolarHBondContact NH2-OE1 3.38Å; R28-E158 IonicContact NH2-OE2 2.76Å; R28-E158 PolarHBondContact NH2-OE2 2.87Å; R28-E158 VanDerWaalsContact NH2-OE2 3.14Å; T132-E158 HydrophobicContact CG2-CG 4.29Å
159	V	91.7	Very high	77.4	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.6	-179.2	-174.9	0	0	0	0	109.4	I22 T23 F93 V117 S130 S131 V133 L157 V161	I22-V159 HydrophobicContact CG2-CG1 4.27Å; T23-V159 CarbonylContact O-C 3.54Å; T23-V159 WeakPolarHBondContact O-CA 3.46Å; F93-V159 HydrophobicContact CD2-CG2 4.42Å; F93-V159 HydrophobicContact CE1-CG2 4.34Å; F93-V159 HydrophobicContact CE2-CG1 4.04Å; F93-V159 HydrophobicContact CE2-CG2 3.96Å; F93-V159 HydrophobicContact CZ-CB 4.46Å; F93-V159 HydrophobicContact CZ-CG1 3.64Å; F93-V159 HydrophobicContact CZ-CG2 3.91Å; V117-V159 HydrophobicContact CG2-CB 4.03Å; V117-V159 HydrophobicContact CG2-CG1 4.1Å; V117-V159 HydrophobicContact CG2-CG2 3.97Å; S130-V159 CarbonylContact C-O 3.49Å; S130-V159 WeakPolarHBondContact CA-O 3.49Å; S130-V159 PolarHBondContact OG-O 3.48Å; S131-V159 PolarHBondContact N-O 3.02Å; S131-V159 PolarHBondContact O-N 3.29Å; V133-V159 HydrophobicContact CG2-CG2 4.17Å; L157-V159 HydrophobicContact CD2-CG2 3.97Å; L157-V159 HydrophobicContact CG-CG2 4.01Å; V159-V161 HydrophobicContact CG1-CG2 4.22Å
160	F	91.9	Very high	79.9	Confident	61 Å²	61	73.2 Å²	73.2	27%	0.268	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.2	174.1	-178.2	-100.9	0	0	0	108.7	T23 F129	T23-F160 PolarHBondContact N-O 3.09Å; T23-F160 PolarHBondContact O-N 2.76Å; F129-F160 WeakPolarHBondContact O-CD2 3.49Å
161	V	91.9	Very high	82.3	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.6	178.4	-177.9	0	0	0	0	108.3	I20 D21 I22 V117 L119 L122 S128 F129 V159	I20-V161 HydrophobicContact CG2-CG1 3.68Å; D21-V161 CarbonylContact O-C 3.53Å; D21-V161 WeakPolarHBondContact O-CA 3.46Å; I22-V161 HydrophobicContact CG1-CG1 4.47Å; I22-V161 HydrophobicContact CG2-CG2 4.49Å; V117-V161 HydrophobicContact CG1-CG2 4.35Å; L119-V161 HydrophobicContact CD2-CG1 3.81Å; L119-V161 HydrophobicContact CD2-CG2 4.44Å; L122-V161 HydrophobicContact CD1-CG1 4.08Å; S128-V161 CarbonylContact C-O 3.48Å; S128-V161 WeakPolarHBondContact CA-O 3.29Å; S128-V161 WeakPolarHBondContact CB-O 3.22Å; F129-V161 HydrophobicContact CD1-CB 4.16Å; F129-V161 HydrophobicContact CE1-CB 3.63Å; F129-V161 HydrophobicContact CE1-CG1 3.91Å; F129-V161 HydrophobicContact CE1-CG2 4.18Å; F129-V161 HydrophobicContact CE2-CB 4.38Å; F129-V161 HydrophobicContact CE2-CG2 4.22Å; F129-V161 HydrophobicContact CZ-CB 3.76Å; F129-V161 HydrophobicContact CZ-CG1 4.27Å; F129-V161 HydrophobicContact CZ-CG2 3.77Å; F129-V161 PolarHBondContact N-O 3.03Å; F129-V161 PolarHBondContact O-N 3.47Å; V159-V161 HydrophobicContact CG1-CG2 4.22Å
162	S	91.1	Very high	84.4	Confident	28 Å²	28	67.8 Å²	67.8	20%	0.196	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.1	178.8	53	0	0	0	0	112.8	D21 C127	D21-S162 PolarHBondContact N-O 3.1Å; D21-S162 PolarHBondContact O-N 3.23Å; C127-S162 CarbonylContact O-C 3.43Å; C127-S162 WeakPolarHBondContact O-CA 3.24Å
163	V	91.4	Very high	85.7	Confident	14 Å²	14	60 Å²	60	9%	0.085	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	147.2	172.9	-167.7	0	0	0	0	108.1	V18 I20 L122 C127 E165 L167	V18-V163 HydrophobicContact CG1-CG1 3.6Å; I20-V163 HydrophobicContact CB-CG2 4.33Å; I20-V163 HydrophobicContact CG1-CG2 3.93Å; I20-V163 HydrophobicContact CG2-CG2 4.14Å; L122-V163 HydrophobicContact CD1-CG2 3.77Å; L122-V163 HydrophobicContact CD2-CG2 4.01Å; L122-V163 HydrophobicContact CG-CG2 4.47Å; C127-V163 PolarHBondContact O-N 3.06Å; V163-E165 VanDerWaalsContact C-N 3.33Å; V163-E165 WeakPolarHBondContact CG1-O 3.4Å; V163-E165 PolarHBondContact O-N 2.83Å; V163-L167 HydrophobicContact CG1-CD2 4.13Å; V163-L167 HydrophobicContact CG2-CD2 4.44Å
164	T	83.7	Confident	86.3	Confident	114 Å²	114	56.1 Å²	56.1	70%	0.699	31%	0.307	S	S	*	.	S	Bend	trans	-67.1	-33.7	-178.2	51.8	0	0	0	0	113.2
165	E	82.6	Confident	86.5	Confident	104 Å²	104	53.8 Å²	53.8	49%	0.486	30%	0.301	S	S	.	.	S	Bend	trans	-136.2	156.3	178.3	-69.4	178.4	-168	0	0	109.4	K15 V163	K15-E165 IonicContact NZ-OE1 3.58Å; K15-E165 PolarHBondContact NZ-OE1 2.86Å; K15-E165 IonicContact NZ-OE2 2.82Å; K15-E165 PolarHBondContact NZ-OE2 2.84Å; V163-E165 VanDerWaalsContact C-N 3.33Å; V163-E165 WeakPolarHBondContact CG1-O 3.4Å; V163-E165 PolarHBondContact O-N 2.83Å
166	P	82.2	Confident	86.6	Confident	69 Å²	69	52.2 Å²	52.2	45%	0.448	29%	0.29	S	S	.	.			trans	-55.6	139	173.2	-18.9	28.2	0	0	0	111.5	C127 L168	C127-P166 VanDerWaalsContact SG-CG 3.6Å; P166-L168 WeakPolarHBondContact CB-O 3.05Å; P166-L168 PolarHBondContact O-N 2.86Å
167	L	84.1	Confident	86.6	Confident	11 Å²	11	51.4 Å²	51.4	6%	0.058	29%	0.285	C	S	.	.	S	Bend	trans	-64.3	-29.6	177.3	-65.9	-175.5	0	0	0	112.9	V18 F83 I86 L122 L123 V163	V18-L167 HydrophobicContact CB-CD2 4.24Å; V18-L167 HydrophobicContact CG1-CD2 3.57Å; F83-L167 HydrophobicContact CE1-CB 4.27Å; F83-L167 WeakPolarHBondContact CZ-O 3.47Å; I86-L167 HydrophobicContact CD1-CD1 4.33Å; L122-L167 HydrophobicContact CB-CD1 3.51Å; L122-L167 HydrophobicContact CB-CG 4.12Å; L122-L167 HydrophobicContact CD1-CD1 4.14Å; L122-L167 HydrophobicContact CG-CD1 4.48Å; L123-L167 HydrophobicContact CD2-CB 4.26Å; L123-L167 HydrophobicContact CD2-CD1 4.09Å; L123-L167 HydrophobicContact CG-CD1 4.37Å; V163-L167 HydrophobicContact CG1-CD2 4.13Å; V163-L167 HydrophobicContact CG2-CD2 4.44Å
168	L	84.4	Confident	86.6	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.026	29%	0.286	C	S	.	.	S	Bend	trans	-120.9	137.4	177.9	-62.7	172.2	0	0	0	108.8	F83 L123 P166 E172 L173 F302	F83-L168 HydrophobicContact CD2-CD2 4.08Å; F83-L168 HydrophobicContact CE2-CD2 3.62Å; F83-L168 HydrophobicContact CZ-CD2 3.87Å; L123-L168 HydrophobicContact CD2-CD1 4.08Å; L123-L168 HydrophobicContact CD2-CG 4.16Å; P166-L168 WeakPolarHBondContact CB-O 3.05Å; P166-L168 PolarHBondContact O-N 2.86Å; L168-E172 HydrophobicContact CB-CB 4.48Å; L168-L173 HydrophobicContact CB-CB 4.26Å; L168-F302 HydrophobicContact CD1-CE2 4.04Å; L168-F302 HydrophobicContact CD2-CE2 4.1Å; L168-F302 HydrophobicContact CD2-CZ 4.01Å
169	T	84.4	Confident	86.7	Confident	73 Å²	73	49.6 Å²	49.6	45%	0.448	28%	0.276	S	S	.	.			trans	-69.1	158.5	172.1	62.3	0	0	0	0	110.9	E172 L173	T169-E172 WeakPolarHBondContact CB-OE2 3.47Å; T169-E172 WeakPolarHBondContact CG2-OE2 3.49Å; T169-E172 PolarHBondContact N-OE2 2.78Å; T169-E172 PolarHBondContact O-N 2.64Å; T169-E172 WeakPolarHBondContact OG1-CB 3.32Å; T169-E172 VanDerWaalsContact OG1-CG 3.22Å; T169-E172 WeakPolarHBondContact OG1-CG 3.23Å; T169-E172 PolarHBondContact OG1-OE2 3.05Å; T169-L173 WeakPolarHBondContact O-CB 3.49Å; T169-L173 PolarHBondContact O-N 3.15Å
170	E	83.3	Confident	86.8	Confident	178 Å²	178	52 Å²	52	83%	0.832	29%	0.287	S	S	*	.	H	α-helix	trans	-51.1	-45.2	176.4	-70.6	-169.1	166.3	0	0	114.8	L173 S174	E170-L173 PolarHBondContact O-N 3.1Å; E170-S174 PolarHBondContact O-N 3.23Å; E170-S174 VanDerWaalsContact O-N 3.08Å
171	P	82.5	Confident	87	Confident	84 Å²	84	49.1 Å²	49.1	55%	0.545	27%	0.274	S	S	.	.	H	α-helix	trans	-65	-45.6	176.3	24.5	-33.7	0	0	0	111.9	L173 S174 T175	P171-L173 VanDerWaalsContact C-N 3.31Å; P171-L173 PolarHBondContact O-N 2.94Å; P171-S174 WeakPolarHBondContact O-CB 3.23Å; P171-S174 PolarHBondContact O-N 2.67Å; P171-S174 PolarHBondContact O-OG 3.2Å; P171-T175 PolarHBondContact O-N 3.1Å; P171-T175 VanDerWaalsContact O-N 3.1Å; P171-T175 PolarHBondContact O-OG1 3.15Å
172	E	83.1	Confident	87.1	Confident	93 Å²	93	49.1 Å²	49.1	44%	0.435	27%	0.274	S	S	.	.	H	α-helix	trans	-60.9	-42	178.4	-71.1	166.1	154.7	0	0	111.5	L168 T169 S174 T175 C176	L168-E172 HydrophobicContact CB-CB 4.48Å; T169-E172 WeakPolarHBondContact CB-OE2 3.47Å; T169-E172 WeakPolarHBondContact CG2-OE2 3.49Å; T169-E172 PolarHBondContact N-OE2 2.78Å; T169-E172 PolarHBondContact O-N 2.64Å; T169-E172 WeakPolarHBondContact OG1-CB 3.32Å; T169-E172 VanDerWaalsContact OG1-CG 3.22Å; T169-E172 WeakPolarHBondContact OG1-CG 3.23Å; T169-E172 PolarHBondContact OG1-OE2 3.05Å; E172-S174 PolarHBondContact O-N 2.81Å; E172-T175 PolarHBondContact O-N 3.33Å; E172-T175 PolarHBondContact O-OG1 2.93Å; E172-C176 VanDerWaalsContact O-CB 3.23Å; E172-C176 WeakPolarHBondContact O-CB 3.44Å; E172-C176 PolarHBondContact O-N 3.04Å; E172-C176 PolarHBondContact O-SG 3.41Å; E172-C176 VanDerWaalsContact O-SG 3.34Å
173	L	84.7	Confident	87.2	Confident	43 Å²	43	47.8 Å²	47.8	23%	0.225	27%	0.265	C	S	.	.	H	α-helix	trans	-65.3	-26.7	176.8	-171.7	136.8	0	0	0	112.2	G125 L168 T169 E170 P171 R480	G125-L173 VanDerWaalsContact CA-CD1 3.45Å; L168-L173 HydrophobicContact CB-CB 4.26Å; T169-L173 WeakPolarHBondContact O-CB 3.49Å; T169-L173 PolarHBondContact O-N 3.15Å; E170-L173 PolarHBondContact O-N 3.1Å; P171-L173 VanDerWaalsContact C-N 3.31Å; P171-L173 PolarHBondContact O-N 2.94Å; L173-R480 PolarHBondContact O-NH1 3.15Å; L173-R480 PolarHBondContact O-NH2 3.37Å
174	S	81.8	Confident	87.2	Confident	73 Å²	73	47.2 Å²	47.2	51%	0.51	26%	0.261	S	S	.	.	H	α-helix	trans	-78.9	-30	175	77.1	0	0	0	0	113.1	E170 P171 E172 R480	E170-S174 PolarHBondContact O-N 3.23Å; E170-S174 VanDerWaalsContact O-N 3.08Å; P171-S174 WeakPolarHBondContact O-CB 3.23Å; P171-S174 PolarHBondContact O-N 2.67Å; P171-S174 PolarHBondContact O-OG 3.2Å; E172-S174 PolarHBondContact O-N 2.81Å; S174-R480 PolarHBondContact O-NH1 2.82Å; S174-R480 VanDerWaalsContact O-NH1 3.09Å
175	T	84.2	Confident	87.6	Confident	69 Å²	69	41.8 Å²	41.8	42%	0.423	23%	0.228	S	C	.	.	H	α-helix	trans	-99.3	-25.1	-175.2	55.2	0	0	0	0	114.5	P171 E172	P171-T175 PolarHBondContact O-N 3.1Å; P171-T175 VanDerWaalsContact O-N 3.1Å; P171-T175 PolarHBondContact O-OG1 3.15Å; E172-T175 PolarHBondContact O-N 3.33Å; E172-T175 PolarHBondContact O-OG1 2.93Å
176	C	87.6	Confident	88.1	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.034	21%	0.205	C	C	.	.			trans	-69.8	148.3	-177.3	70.5	0	0	0	0	112	E172 F302 L303 R480	E172-C176 VanDerWaalsContact O-CB 3.23Å; E172-C176 WeakPolarHBondContact O-CB 3.44Å; E172-C176 PolarHBondContact O-N 3.04Å; E172-C176 PolarHBondContact O-SG 3.41Å; E172-C176 VanDerWaalsContact O-SG 3.34Å; C176-F302 HydrophobicContact CB-CE2 3.69Å; C176-F302 HydrophobicContact CB-CZ 3.89Å; C176-L303 WeakPolarHBondContact CA-O 3.45Å; C176-R480 PolarHBondContact O-NH1 3.2Å
177	I	90	Very high	88.5	Confident	12 Å²	12	33.5 Å²	33.5	6%	0.062	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134	174.7	-60.8	-178.3	0	0	0	108.5	L303 A308 L478 N479 L482	I177-L303 HydrophobicContact CB-CB 4.3Å; I177-L303 PolarHBondContact N-O 3.45Å; I177-L303 PolarHBondContact O-N 3.05Å; I177-A308 HydrophobicContact CD1-CB 3.65Å; I177-A308 HydrophobicContact CG1-CB 4.18Å; I177-L478 HydrophobicContact CG2-CB 4.03Å; I177-L478 HydrophobicContact CG2-CD2 3.94Å; I177-L478 HydrophobicContact CG2-CG 4.38Å; I177-N479 WeakPolarHBondContact CA-OD1 3.37Å; I177-L482 HydrophobicContact CD1-CD1 3.71Å
178	I	91.8	Very high	88.7	Confident	4 Å²	4	33 Å²	33	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	108.6	170	-57.3	178.5	0	0	0	106.4	L87 F120 C301 N479	L87-I178 HydrophobicContact CD1-CG2 4.09Å; F120-I178 HydrophobicContact CE2-CD1 3.73Å; F120-I178 HydrophobicContact CE2-CG2 4.3Å; I178-C301 WeakPolarHBondContact CA-O 3.18Å; I178-N479 HydrophobicContact CB-CB 4.19Å; I178-N479 VanDerWaalsContact N-CG 3.3Å; I178-N479 PolarHBondContact N-OD1 3.08Å; I178-N479 PolarHBondContact O-N 2.87Å; I178-N479 PolarHBondContact O-OD1 3.1Å
179	M	93.4	Very high	89	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	140.7	176.8	175.6	-174	-168.2	0	0	108.9	V181 V212 R300 C301 L303 M352 V476 S477 L478	M179-V181 HydrophobicContact CE-CG2 3.86Å; M179-V181 HydrophobicContact CG-CG2 4.15Å; M179-V181 HydrophobicContact SD-CG2 4.38Å; M179-V212 HydrophobicContact CE-CG1 4.11Å; M179-V212 HydrophobicContact SD-CG1 4.11Å; M179-R300 CarbonylContact O-C 3.58Å; M179-R300 WeakPolarHBondContact O-CA 3.34Å; M179-C301 VanDerWaalsContact CB-SG 3.53Å; M179-C301 PolarHBondContact N-O 3.41Å; M179-C301 PolarHBondContact O-N 3.1Å; M179-C301 PolarHBondContact O-SG 2.66Å; M179-C301 VanDerWaalsContact O-SG 3.38Å; M179-L303 HydrophobicContact CB-CD1 3.34Å; M179-L303 HydrophobicContact CG-CD1 4.41Å; M179-L303 HydrophobicContact SD-CD1 4.23Å; M179-M352 HydrophobicContact CE-CE 3.97Å; M179-V476 HydrophobicContact CE-CG1 3.37Å; M179-V476 HydrophobicContact CG-CG1 4.19Å; M179-S477 CarbonylContact C-O 3.59Å; M179-S477 WeakPolarHBondContact CA-O 3.12Å; M179-L478 HydrophobicContact CB-CD2 3.63Å; M179-L478 HydrophobicContact CG-CD2 3.68Å
180	K	93.9	Very high	89.2	Confident	52 Å²	52	29.5 Å²	29.5	23%	0.226	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	123.4	176.6	-44.3	178.9	-179.2	167.4	0	107.2	E298 I299 R300 V476 S477	K180-E298 HydrophobicContact CB-CG 4.13Å; K180-I299 WeakPolarHBondContact CA-O 3.16Å; K180-R300 HydrophobicContact CG-CG 4.16Å; K180-V476 WeakPolarHBondContact O-CA 3.29Å; K180-S477 WeakPolarHBondContact CB-OG 3.44Å; K180-S477 PolarHBondContact N-O 2.8Å; K180-S477 PolarHBondContact O-N 3.13Å
181	V	94.3	Very high	89.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120.9	176.4	-172.8	0	0	0	0	108.1	M179 L210 L222 F224 E298 I299 I474 V476	M179-V181 HydrophobicContact CE-CG2 3.86Å; M179-V181 HydrophobicContact CG-CG2 4.15Å; M179-V181 HydrophobicContact SD-CG2 4.38Å; V181-L210 HydrophobicContact CG1-CD2 3.76Å; V181-L222 HydrophobicContact CB-CD1 4.16Å; V181-L222 HydrophobicContact CG2-CD1 3.78Å; V181-F224 HydrophobicContact CB-CZ 4.22Å; V181-F224 HydrophobicContact CG1-CZ 4.01Å; V181-E298 WeakPolarHBondContact O-CA 3.43Å; V181-I299 PolarHBondContact N-O 3.06Å; V181-I299 PolarHBondContact O-N 3.03Å; V181-I474 HydrophobicContact CG1-CG2 4.44Å; V181-V476 HydrophobicContact CG1-CG2 4.29Å; V181-V476 HydrophobicContact CG2-CG2 4.43Å
182	T	93.8	Very high	89	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	121.7	176.9	-47.5	0	0	0	0	109	E184 K242 T297 E298 I474 E475	T182-E184 HydrophobicContact CG2-CG 4.15Å; T182-K242 HydrophobicContact CG2-CD 4Å; T182-K242 HydrophobicContact CG2-CG 4.48Å; T182-K242 PolarHBondContact OG1-NZ 2.82Å; T182-T297 WeakPolarHBondContact CA-O 3.49Å; T182-E298 HydrophobicContact CG2-CB 4.49Å; T182-I474 WeakPolarHBondContact O-CA 3.41Å; T182-E475 PolarHBondContact N-O 3.18Å; T182-E475 PolarHBondContact O-N 3.38Å
183	V	94.3	Very high	89	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	113.9	167.2	179.4	0	0	0	0	106.8	A208 F224 W295 D296 T297 V472	V183-A208 HydrophobicContact CG1-CB 4.45Å; V183-F224 HydrophobicContact CB-CD1 3.93Å; V183-F224 HydrophobicContact CB-CE1 4.1Å; V183-F224 HydrophobicContact CB-CG 4.19Å; V183-F224 HydrophobicContact CG2-CD1 3.85Å; V183-F224 HydrophobicContact CG2-CD2 3.78Å; V183-F224 HydrophobicContact CG2-CE1 3.75Å; V183-F224 HydrophobicContact CG2-CE2 3.69Å; V183-F224 HydrophobicContact CG2-CG 3.87Å; V183-F224 HydrophobicContact CG2-CZ 3.68Å; V183-W295 HydrophobicContact CG1-CB 4.47Å; V183-W295 HydrophobicContact CG1-CD2 4.17Å; V183-W295 HydrophobicContact CG1-CE3 3.92Å; V183-W295 HydrophobicContact CG1-CG 4.43Å; V183-W295 WeakPolarHBondContact O-CB 3.33Å; V183-D296 WeakPolarHBondContact O-CA 3.31Å; V183-D296 PolarHBondContact O-N 3.49Å; V183-D296 VanDerWaalsContact O-N 3.1Å; V183-T297 PolarHBondContact N-O 3.25Å; V183-T297 VanDerWaalsContact N-O 3.16Å; V183-T297 PolarHBondContact O-N 3.01Å; V183-T297 VanDerWaalsContact O-N 3.15Å; V183-V472 HydrophobicContact CG1-CG1 4.06Å
184	E	91.9	Very high	88.7	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-87.2	-175	-67.2	-173.8	-157.4	0	0	110.9	T182 R240 W295 D296 R364 I473	T182-E184 HydrophobicContact CG2-CG 4.15Å; E184-R240 IonicContact OE2-NH2 3.42Å; E184-R240 PolarHBondContact OE2-NH2 3.09Å; E184-W295 PolarHBondContact O-N 3.1Å; E184-D296 PolarHBondContact O-N 3.4Å; E184-R364 IonicContact OE1-CZ 3.51Å; E184-R364 IonicContact OE1-NE 3.86Å; E184-R364 PolarHBondContact OE1-NE 2.72Å; E184-R364 IonicContact OE1-NH2 2.72Å; E184-R364 PolarHBondContact OE1-NH2 3.24Å; E184-R364 IonicContact OE2-CZ 3.51Å; E184-R364 IonicContact OE2-NE 4Å; E184-R364 IonicContact OE2-NH2 2.63Å; E184-R364 PolarHBondContact OE2-NH2 3.34Å; E184-I473 HydrophobicContact CB-CB 4.07Å; E184-I473 HydrophobicContact CB-CG2 4.07Å; E184-I473 HydrophobicContact CG-CG2 4.1Å; E184-I473 PolarHBondContact N-O 3.49Å
185	T	91.3	Very high	88.1	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.7	-172.6	-53.9	0	0	0	0	110	F187 E236 R240 R292 V293 V472 I473	T185-F187 HydrophobicContact CG2-CD1 4.14Å; T185-F187 HydrophobicContact CG2-CD2 4.1Å; T185-F187 HydrophobicContact CG2-CE1 3.81Å; T185-F187 HydrophobicContact CG2-CE2 3.79Å; T185-F187 HydrophobicContact CG2-CG 4.28Å; T185-F187 HydrophobicContact CG2-CZ 3.65Å; T185-E236 PolarHBondContact OG1-OE1 3.02Å; T185-R240 PolarHBondContact OG1-NH1 2.98Å; T185-R292 HydrophobicContact CG2-CB 3.92Å; T185-R292 HydrophobicContact CG2-CG 4.1Å; T185-V293 CarbonylContact C-O 3.59Å; T185-V293 WeakPolarHBondContact CA-O 3.28Å; T185-V293 WeakPolarHBondContact CG2-O 3.26Å; T185-V472 WeakPolarHBondContact O-CA 3.43Å; T185-I473 PolarHBondContact O-N 3.15Å
186	A	92.3	Very high	87.2	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	117.5	162.8	0	0	0	0	0	109.5	V189 R292 V293 W295 Y471 V472	A186-V189 HydrophobicContact CB-CG1 4.07Å; A186-R292 CarbonylContact O-C 3.48Å; A186-R292 VanDerWaalsContact O-CA 3.24Å; A186-R292 WeakPolarHBondContact O-CA 3.44Å; A186-R292 VanDerWaalsContact O-CB 3.23Å; A186-R292 WeakPolarHBondContact O-CB 3.42Å; A186-V293 HydrophobicContact CB-CB 4.47Å; A186-V293 PolarHBondContact N-O 2.83Å; A186-V293 PolarHBondContact O-N 3.13Å; A186-W295 HydrophobicContact CB-CH2 4.18Å; A186-W295 HydrophobicContact CB-CZ3 3.7Å; A186-Y471 CarbonylContact C-O 3.5Å; A186-Y471 VanDerWaalsContact CA-O 3.3Å; A186-Y471 WeakPolarHBondContact CA-O 3.39Å; A186-V472 HydrophobicContact CB-CG2 3.74Å
187	F	90.5	Very high	85.4	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	157.2	180	-67.7	-81.8	0	0	0	111.3	T185 V189 E287 R292 T470 Y471 I473	T185-F187 HydrophobicContact CG2-CD1 4.14Å; T185-F187 HydrophobicContact CG2-CD2 4.1Å; T185-F187 HydrophobicContact CG2-CE1 3.81Å; T185-F187 HydrophobicContact CG2-CE2 3.79Å; T185-F187 HydrophobicContact CG2-CG 4.28Å; T185-F187 HydrophobicContact CG2-CZ 3.65Å; F187-V189 VanDerWaalsContact C-N 3.33Å; F187-V189 PolarHBondContact O-N 2.84Å; F187-E287 HydrophobicContact CD1-CB 4.42Å; F187-E287 HydrophobicContact CD1-CG 3.82Å; F187-E287 HydrophobicContact CE1-CB 4.22Å; F187-E287 HydrophobicContact CE1-CG 3.61Å; F187-E287 HydrophobicContact CG-CG 4.42Å; F187-E287 HydrophobicContact CZ-CG 4.03Å; F187-R292 HydrophobicContact CD1-CB 4.17Å; F187-T470 WeakPolarHBondContact O-CA 3.22Å; F187-T470 WeakPolarHBondContact O-CG2 3.38Å; F187-Y471 HydrophobicContact CB-CD1 4.1Å; F187-Y471 HydrophobicContact CB-CD2 4.36Å; F187-Y471 HydrophobicContact CB-CE1 3.53Å; F187-Y471 HydrophobicContact CB-CE2 3.83Å; F187-Y471 HydrophobicContact CB-CG 4.48Å; F187-Y471 HydrophobicContact CD2-CD2 4.21Å; F187-Y471 AromaticContact CD2-CE2 3.45Å; F187-Y471 HydrophobicContact CD2-CE2 3.45Å; F187-Y471 VanDerWaalsContact CD2-CE2 3.45Å; F187-Y471 AromaticContact CD2-CZ 3.73Å; F187-Y471 HydrophobicContact CE2-CE2 4.33Å; F187-Y471 HydrophobicContact CG-CE1 4.39Å; F187-Y471 AromaticContact CG-CE2 3.96Å; F187-Y471 HydrophobicContact CG-CE2 3.96Å; F187-Y471 AromaticContact CG-CZ 3.74Å; F187-Y471 PolarHBondContact N-O 3.49Å; F187-Y471 PolarHBondContact O-N 3.19Å; F187-I473 HydrophobicContact CD2-CD1 4.43Å; F187-I473 HydrophobicContact CD2-CG1 4.45Å; F187-I473 HydrophobicContact CE2-CD1 3.7Å; F187-I473 HydrophobicContact CE2-CG1 4.1Å
188	S	90.3	Very high	83.6	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	54.5	48.1	179.4	-157	0	0	0	0	112.1	K290 A468 T470	S188-K290 WeakPolarHBondContact OG-CD 3.46Å; S188-K290 PolarHBondContact OG-NZ 3.15Å; S188-A468 WeakPolarHBondContact CB-O 3.07Å; S188-A468 VanDerWaalsContact O-CB 3.28Å; S188-A468 WeakPolarHBondContact O-CB 3.4Å; S188-A468 PolarHBondContact OG-O 3.36Å; S188-T470 WeakPolarHBondContact O-CA 3.29Å; S188-T470 WeakPolarHBondContact O-CB 3.3Å; S188-T470 PolarHBondContact O-OG1 3.2Å
189	V	89.8	Confident	81.8	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.012	23%	0.232	C	C	.	.			trans	-71.1	156.9	178.8	-58.7	0	0	0	0	111.1	A186 F187 W193 L229 N291 V293 T470	A186-V189 HydrophobicContact CB-CG1 4.07Å; F187-V189 VanDerWaalsContact C-N 3.33Å; F187-V189 PolarHBondContact O-N 2.84Å; V189-W193 HydrophobicContact CB-CD2 4.15Å; V189-W193 HydrophobicContact CB-CE3 3.65Å; V189-W193 HydrophobicContact CB-CZ3 4.13Å; V189-W193 HydrophobicContact CG1-CE3 3.97Å; V189-W193 HydrophobicContact CG1-CZ3 4.02Å; V189-W193 HydrophobicContact CG2-CB 4.02Å; V189-W193 HydrophobicContact CG2-CD2 4.31Å; V189-W193 HydrophobicContact CG2-CE3 3.84Å; V189-W193 HydrophobicContact CG2-CG 4.41Å; V189-L229 HydrophobicContact CG2-CD1 4.23Å; V189-N291 HydrophobicContact CG2-CB 3.93Å; V189-N291 PolarHBondContact N-O 3.16Å; V189-V293 HydrophobicContact CG1-CG2 4.23Å; V189-T470 HydrophobicContact CG1-CG2 4.24Å
190	P	88.4	Confident	79.9	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.013	27%	0.267	C	S	.	.			trans	-53.8	140.5	-176.7	-28.1	35.4	0	0	0	113.8	T192 W193 M464 Y465 A468	P190-T192 PolarHBondContact O-N 2.84Å; P190-W193 WeakPolarHBondContact O-CB 3.32Å; P190-W193 PolarHBondContact O-N 3.17Å; P190-M464 HydrophobicContact CB-CB 3.99Å; P190-M464 HydrophobicContact CB-CE 4.29Å; P190-M464 HydrophobicContact CG-CB 3.98Å; P190-Y465 HydrophobicContact CG-CD1 3.93Å; P190-Y465 HydrophobicContact CG-CE1 4.1Å; P190-A468 HydrophobicContact CG-CB 4.44Å
191	D	82.6	Confident	78.3	Confident	135 Å²	135	44.7 Å²	44.7	72%	0.722	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-19	-176.3	-70.3	-27.5	0	0	0	113.9	W193 T194	D191-W193 PolarHBondContact O-N 2.62Å; D191-T194 WeakPolarHBondContact O-CG2 3.37Å
192	T	79.8	Confident	76.9	Confident	68 Å²	68	46 Å²	46	42%	0.417	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.2	171.7	55.5	0	0	0	0	113.1	P190 T194 M464	P190-T192 PolarHBondContact O-N 2.84Å; T192-T194 PolarHBondContact O-N 3.21Å; T192-M464 HydrophobicContact CG2-CE 3.45Å; T192-M464 VanDerWaalsContact CG2-CE 3.45Å; T192-M464 HydrophobicContact CG2-SD 4.39Å
193	W	82.8	Confident	75.6	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.008	32%	0.321	C	S	.	.			trans	-89.6	78.3	178.9	-63.6	32.6	0	0	0	108.9	V189 P190 D191 Y206 L229 N291 V293 R327 F344 Y465	V189-W193 HydrophobicContact CB-CD2 4.15Å; V189-W193 HydrophobicContact CB-CE3 3.65Å; V189-W193 HydrophobicContact CB-CZ3 4.13Å; V189-W193 HydrophobicContact CG1-CE3 3.97Å; V189-W193 HydrophobicContact CG1-CZ3 4.02Å; V189-W193 HydrophobicContact CG2-CB 4.02Å; V189-W193 HydrophobicContact CG2-CD2 4.31Å; V189-W193 HydrophobicContact CG2-CE3 3.84Å; V189-W193 HydrophobicContact CG2-CG 4.41Å; P190-W193 WeakPolarHBondContact O-CB 3.32Å; P190-W193 PolarHBondContact O-N 3.17Å; D191-W193 PolarHBondContact O-N 2.62Å; W193-Y206 HydrophobicContact CD2-CD1 4.41Å; W193-Y206 AromaticContact CD2-CE1 3.68Å; W193-Y206 HydrophobicContact CD2-CE1 3.68Å; W193-Y206 AromaticContact CE3-CD1 3.7Å; W193-Y206 HydrophobicContact CE3-CD1 3.7Å; W193-Y206 AromaticContact CE3-CE1 3.21Å; W193-Y206 HydrophobicContact CE3-CE1 3.21Å; W193-Y206 HydrophobicContact CG-CE1 4.47Å; W193-Y206 AromaticContact CH2-CD1 3.58Å; W193-Y206 HydrophobicContact CH2-CD1 3.58Å; W193-Y206 AromaticContact CH2-CE1 3.86Å; W193-Y206 HydrophobicContact CH2-CE1 3.86Å; W193-Y206 HydrophobicContact CZ2-CD1 4.32Å; W193-Y206 HydrophobicContact CZ2-CE1 4.28Å; W193-Y206 AromaticContact CZ3-CD1 3.26Å; W193-Y206 HydrophobicContact CZ3-CD1 3.26Å; W193-Y206 AromaticContact CZ3-CE1 3.33Å; W193-Y206 HydrophobicContact CZ3-CE1 3.33Å; W193-Y206 HydrophobicContact CZ3-CG 4.36Å; W193-L229 HydrophobicContact CB-CD1 4.22Å; W193-N291 PolarHBondContact O-ND2 3.14Å; W193-V293 HydrophobicContact CE3-CG2 3.54Å; W193-V293 HydrophobicContact CZ3-CB 4.36Å; W193-V293 HydrophobicContact CZ3-CG2 3.5Å; W193-R327 HydrophobicContact CH2-CB 4.08Å; W193-R327 HydrophobicContact CZ2-CB 3.64Å; W193-R327 HydrophobicContact CZ2-CG 4.21Å; W193-R327 VanDerWaalsContact NE1-NH1 3.12Å; W193-F344 HydrophobicContact CZ2-CB 4.25Å; W193-F344 HydrophobicContact CZ2-CD1 4.05Å; W193-F344 HydrophobicContact CZ2-CG 4.27Å; W193-F344 AromaticContact NE1-CD1 3.38Å; W193-F344 AromaticContact NE1-CE1 3.37Å; W193-Y465 HydrophobicContact CH2-CE1 4.14Å; W193-Y465 WeakPolarHBondContact CH2-OH 3.43Å; W193-Y465 HydrophobicContact CZ2-CE1 4.03Å; W193-Y465 VanDerWaalsContact CZ2-OH 3.29Å; W193-Y465 WeakPolarHBondContact CZ2-OH 3.41Å
194	T	77.1	Confident	74.9	Confident	82 Å²	82	52.9 Å²	52.9	50%	0.503	33%	0.334	S	S	.	.			trans	-113.2	152	178.6	50.4	0	0	0	0	112.2	D191 T192	D191-T194 WeakPolarHBondContact O-CG2 3.37Å; T192-T194 PolarHBondContact O-N 3.21Å
195	L	69.4	Low	74.3	Confident	56 Å²	56	54.5 Å²	54.5	29%	0.293	35%	0.348	S	S	.	.			trans	-80.4	130.6	171	-77.9	160.8	0	0	0	109.5	T197 L229 P231	L195-T197 PolarHBondContact O-N 3.01Å; L195-L229 HydrophobicContact CD2-CD2 4.42Å; L195-L229 HydrophobicContact CG-CD2 4Å; L195-L229 HydrophobicContact CG-CG 4.44Å; L195-P231 HydrophobicContact CD1-CG 4.43Å
196	P	66.2	Low	74	Confident	60 Å²	60	54.5 Å²	54.5	39%	0.39	35%	0.348	S	S	.	.			trans	-58.3	135.4	171.6	-21.5	31.7	0	0	0	110.9	G198 S199 P203	P196-G198 PolarHBondContact O-N 3.08Å; P196-S199 PolarHBondContact O-N 3.09Å; P196-S199 VanDerWaalsContact O-N 3.11Å; P196-P203 HydrophobicContact CG-CG 4.19Å
197	T	49.7	Very low	73.7	Confident	155 Å²	155	55 Å²	55	95%	0.951	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	113.6	179.1	21	0	0	0	0	110.9	L195	L195-T197 PolarHBondContact O-N 3.01Å
198	G	51.3	Low	73.6	Confident	90 Å²	90	55.1 Å²	55.1	93%	0.928	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.8	-0.1	177.5	0	0	0	0	0	116.4	P196	P196-G198 PolarHBondContact O-N 3.08Å
199	S	54.7	Low	73.4	Confident	56 Å²	56	55.1 Å²	55.1	39%	0.392	35%	0.351	S	S	.	.			trans	-103.2	135.5	173.6	-177.3	0	0	0	0	112.2	P196 H201	P196-S199 PolarHBondContact O-N 3.09Å; P196-S199 VanDerWaalsContact O-N 3.11Å; S199-H201 VanDerWaalsContact C-N 3.27Å; S199-H201 PolarHBondContact OG-N 2.68Å; S199-H201 VanDerWaalsContact OG-N 3.14Å; S199-H201 PolarHBondContact OG-O 3.11Å
200	A	54.5	Low	73.3	Confident	90 Å²	90	55.1 Å²	55.1	74%	0.744	35%	0.351	S	S	*	.	S	Bend	trans	-78.5	-9.5	171.1	0	0	0	0	0	113.3
201	H	59.8	Low	73.2	Confident	138 Å²	138	57.1 Å²	57.1	64%	0.639	36%	0.36	S	S	*	.	S	Bend	trans	-130.6	138.3	-175	-60.3	-60.6	0	0	0	111.6	S199	S199-H201 VanDerWaalsContact C-N 3.27Å; S199-H201 PolarHBondContact OG-N 2.68Å; S199-H201 VanDerWaalsContact OG-N 3.14Å; S199-H201 PolarHBondContact OG-O 3.11Å
202	S	64.4	Low	73.4	Confident	28 Å²	28	50.8 Å²	50.8	20%	0.196	33%	0.326	C	S	.	.			trans	-70	140.5	173.2	-178.6	0	0	0	0	110.3	F204 Y206	S202-F204 PolarHBondContact O-N 3.33Å; S202-F204 PolarHBondContact OG-N 3.37Å; S202-Y206 PolarHBondContact OG-OH 2.88Å
203	P	67.6	Low	73.8	Confident	82 Å²	82	47.5 Å²	47.5	53%	0.532	31%	0.306	S	S	.	.	S	Bend	trans	-75.4	-6	171.7	32.3	-34.3	0	0	0	112.8	P196	P196-P203 HydrophobicContact CG-CG 4.19Å
204	F	78.3	Confident	73.8	Confident	63 Å²	63	47.8 Å²	47.8	28%	0.276	31%	0.308	S	S	.	.	S	Bend	trans	-103.7	146.7	179.9	-56.7	-81.5	0	0	0	111.1	S202 Y206 R327 T328	S202-F204 PolarHBondContact O-N 3.33Å; S202-F204 PolarHBondContact OG-N 3.37Å; F204-Y206 HydrophobicContact CB-CE2 4.5Å; F204-R327 HydrophobicContact CB-CG 4Å; F204-R327 HydrophobicContact CD1-CG 4.45Å; F204-R327 HydrophobicContact CG-CG 4.42Å; F204-T328 WeakPolarHBondContact CA-O 3.34Å
205	A	78.6	Confident	74.1	Confident	35 Å²	35	45 Å²	45	29%	0.289	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	140.1	171.2	0	0	0	0	0	110.1	F207 R327 T328	A205-F207 HydrophobicContact CB-CD2 4.44Å; A205-F207 HydrophobicContact CB-CE2 3.39Å; A205-F207 HydrophobicContact CB-CZ 3.58Å; A205-R327 WeakPolarHBondContact O-CA 3.37Å; A205-T328 PolarHBondContact N-O 3.05Å; A205-T328 PolarHBondContact O-N 2.86Å
206	Y	86.4	Confident	74.5	Confident	1 Å²	1	44.9 Å²	44.9	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.3	-175.1	-52.4	-85	0	0	0	109.6	W193 S202 F204 G227 L229 V293 W295 R327	W193-Y206 HydrophobicContact CD2-CD1 4.41Å; W193-Y206 AromaticContact CD2-CE1 3.68Å; W193-Y206 HydrophobicContact CD2-CE1 3.68Å; W193-Y206 AromaticContact CE3-CD1 3.7Å; W193-Y206 HydrophobicContact CE3-CD1 3.7Å; W193-Y206 AromaticContact CE3-CE1 3.21Å; W193-Y206 HydrophobicContact CE3-CE1 3.21Å; W193-Y206 HydrophobicContact CG-CE1 4.47Å; W193-Y206 AromaticContact CH2-CD1 3.58Å; W193-Y206 HydrophobicContact CH2-CD1 3.58Å; W193-Y206 AromaticContact CH2-CE1 3.86Å; W193-Y206 HydrophobicContact CH2-CE1 3.86Å; W193-Y206 HydrophobicContact CZ2-CD1 4.32Å; W193-Y206 HydrophobicContact CZ2-CE1 4.28Å; W193-Y206 AromaticContact CZ3-CD1 3.26Å; W193-Y206 HydrophobicContact CZ3-CD1 3.26Å; W193-Y206 AromaticContact CZ3-CE1 3.33Å; W193-Y206 HydrophobicContact CZ3-CE1 3.33Å; W193-Y206 HydrophobicContact CZ3-CG 4.36Å; S202-Y206 PolarHBondContact OG-OH 2.88Å; F204-Y206 HydrophobicContact CB-CE2 4.5Å; Y206-G227 WeakPolarHBondContact CD2-O 3.48Å; Y206-L229 HydrophobicContact CE2-CB 3.95Å; Y206-V293 HydrophobicContact CD1-CG1 4.34Å; Y206-V293 HydrophobicContact CD1-CG2 3.92Å; Y206-V293 HydrophobicContact CD2-CG1 3.92Å; Y206-V293 HydrophobicContact CD2-CG2 4.2Å; Y206-V293 HydrophobicContact CE1-CG2 3.94Å; Y206-V293 HydrophobicContact CE2-CG2 4.23Å; Y206-V293 HydrophobicContact CG-CG1 3.73Å; Y206-V293 HydrophobicContact CG-CG2 4.04Å; Y206-W295 PolarHBondContact O-NE1 2.92Å; Y206-R327 HydrophobicContact CD1-CB 4.12Å; Y206-R327 HydrophobicContact CD1-CG 3.83Å; Y206-R327 HydrophobicContact CE1-CB 4.36Å; Y206-R327 HydrophobicContact CE1-CG 3.66Å
207	F	85.3	Confident	75	Confident	10 Å²	10	50 Å²	50	4%	0.044	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	138.7	-172.7	-57.7	-94.3	0	0	0	110.6	A205 M223 F224 S225 L325 M326 T328 L332	A205-F207 HydrophobicContact CB-CD2 4.44Å; A205-F207 HydrophobicContact CB-CE2 3.39Å; A205-F207 HydrophobicContact CB-CZ 3.58Å; F207-M223 HydrophobicContact CD1-SD 4.47Å; F207-F224 VanDerWaalsContact CA-O 3.3Å; F207-F224 WeakPolarHBondContact CA-O 3.42Å; F207-S225 VanDerWaalsContact CD1-CA 3.48Å; F207-S225 VanDerWaalsContact CE1-CB 3.41Å; F207-L325 WeakPolarHBondContact O-CA 3.42Å; F207-L325 WeakPolarHBondContact O-CD1 3.32Å; F207-M326 HydrophobicContact CB-CE 3.72Å; F207-M326 HydrophobicContact CB-CG 3.76Å; F207-M326 HydrophobicContact CD1-CE 4.17Å; F207-M326 HydrophobicContact CD2-CE 3.38Å; F207-M326 HydrophobicContact CD2-CG 4.1Å; F207-M326 HydrophobicContact CE2-CE 4.04Å; F207-M326 HydrophobicContact CG-CE 3.47Å; F207-M326 VanDerWaalsContact CG-CE 3.47Å; F207-M326 HydrophobicContact CG-CG 4.31Å; F207-M326 PolarHBondContact N-O 2.77Å; F207-M326 PolarHBondContact O-N 3.04Å; F207-T328 HydrophobicContact CD2-CG2 4.05Å; F207-T328 HydrophobicContact CE2-CG2 3.41Å; F207-T328 VanDerWaalsContact CE2-CG2 3.41Å; F207-T328 HydrophobicContact CZ-CG2 4.32Å; F207-L332 HydrophobicContact CD1-CD1 4.01Å; F207-L332 HydrophobicContact CD1-CD2 4.49Å; F207-L332 HydrophobicContact CE1-CD1 3.26Å; F207-L332 HydrophobicContact CE1-CD2 4.15Å; F207-L332 HydrophobicContact CE1-CG 3.84Å; F207-L332 HydrophobicContact CZ-CD1 3.73Å; F207-L332 HydrophobicContact CZ-CD2 4.16Å; F207-L332 HydrophobicContact CZ-CG 3.8Å
208	A	87.6	Confident	76.3	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.017	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.2	161.2	0	0	0	0	0	109.4	V183 F224 E324 L325	V183-A208 HydrophobicContact CG1-CB 4.45Å; A208-F224 HydrophobicContact CB-CB 4.15Å; A208-F224 HydrophobicContact CB-CD2 4.33Å; A208-F224 PolarHBondContact N-O 3.17Å; A208-F224 VanDerWaalsContact N-O 3.09Å; A208-F224 WeakPolarHBondContact O-CD2 3.24Å; A208-F224 PolarHBondContact O-N 3.23Å; A208-E324 CarbonylContact C-O 3.54Å; A208-E324 VanDerWaalsContact CA-O 3.23Å; A208-E324 WeakPolarHBondContact CA-O 3.49Å; A208-L325 HydrophobicContact CB-CD1 4.11Å
209	A	86.9	Confident	77.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	147.8	175.4	0	0	0	0	0	112.8	L222 V323 E324 I396 I397	A209-L222 WeakPolarHBondContact CA-O 3.47Å; A209-V323 CarbonylContact O-C 3.59Å; A209-V323 WeakPolarHBondContact O-CA 3.26Å; A209-V323 WeakPolarHBondContact O-CG1 2.95Å; A209-E324 PolarHBondContact N-O 3.22Å; A209-E324 PolarHBondContact O-N 3.4Å; A209-I396 HydrophobicContact CB-CG2 4.31Å; A209-I397 HydrophobicContact CB-CD1 4.21Å; A209-I397 HydrophobicContact CB-CG1 3.52Å
210	L	88.7	Confident	79.1	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	155.8	169.4	68.9	130.5	0	0	0	110.7	V181 V212 L222 F224 V323	V181-L210 HydrophobicContact CG1-CD2 3.76Å; L210-V212 HydrophobicContact CD1-CG1 3.49Å; L210-V212 VanDerWaalsContact CD1-CG1 3.49Å; L210-L222 HydrophobicContact CD1-CD1 4.34Å; L210-L222 HydrophobicContact CD2-CB 4.48Å; L210-L222 HydrophobicContact CG-CB 4.36Å; L210-L222 HydrophobicContact CG-CD1 4.35Å; L210-L222 PolarHBondContact N-O 3.35Å; L210-L222 VanDerWaalsContact N-O 3.13Å; L210-L222 PolarHBondContact O-N 3.07Å; L210-F224 HydrophobicContact CD2-CE2 3.76Å; L210-F224 HydrophobicContact CD2-CZ 4.45Å; L210-V323 HydrophobicContact CB-CB 4.44Å; L210-V323 HydrophobicContact CB-CG1 4.34Å; L210-V323 HydrophobicContact CB-CG2 4Å; L210-V323 HydrophobicContact CD2-CG1 4.45Å; L210-V323 HydrophobicContact CD2-CG2 4.46Å
211	E	85.8	Confident	80.6	Confident	44 Å²	44	40.4 Å²	40.4	21%	0.206	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.4	177	-171.8	164.2	-140.1	0	0	109.4	D219 Q220 W321 I396 K399	E211-D219 HydrophobicContact CG-CB 3.57Å; E211-D219 WeakPolarHBondContact OE1-CB 3.24Å; E211-Q220 WeakPolarHBondContact CA-O 3.39Å; E211-W321 VanDerWaalsContact O-CE2 3.28Å; E211-W321 VanDerWaalsContact O-CZ2 3.22Å; E211-W321 WeakPolarHBondContact O-CZ2 3.4Å; E211-W321 PolarHBondContact O-NE1 3.39Å; E211-I396 HydrophobicContact CB-CD1 3.99Å; E211-I396 HydrophobicContact CB-CG1 4.42Å; E211-I396 HydrophobicContact CB-CG2 4.41Å; E211-K399 IonicContact OE1-NZ 3.56Å; E211-K399 PolarHBondContact OE1-NZ 3.08Å
212	V	87.2	Confident	81.9	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	147.4	178.4	-64.6	0	0	0	0	110.7	M179 L210 L214 D219 Q220 L222 C301	M179-V212 HydrophobicContact CE-CG1 4.11Å; M179-V212 HydrophobicContact SD-CG1 4.11Å; L210-V212 HydrophobicContact CD1-CG1 3.49Å; L210-V212 VanDerWaalsContact CD1-CG1 3.49Å; V212-L214 PolarHBondContact O-N 3.4Å; V212-D219 CarbonylContact O-C 3.59Å; V212-D219 WeakPolarHBondContact O-CA 3.45Å; V212-Q220 PolarHBondContact N-O 3.29Å; V212-Q220 PolarHBondContact O-N 2.73Å; V212-L222 HydrophobicContact CG1-CD1 4.05Å; V212-L222 HydrophobicContact CG2-CD1 3.97Å; V212-L222 HydrophobicContact CG2-CD2 4.08Å; V212-L222 HydrophobicContact CG2-CG 3.93Å; V212-C301 HydrophobicContact CG2-CB 4.38Å
213	P	86.6	Confident	82.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	133.4	174.5	-20.8	33.7	0	0	0	111.5	D219 A307 L311 K314 W321	P213-D219 WeakPolarHBondContact CA-OD1 3.44Å; P213-A307 HydrophobicContact CB-CB 4.2Å; P213-L311 HydrophobicContact CG-CB 4.2Å; P213-L311 HydrophobicContact CG-CD1 4.33Å; P213-K314 HydrophobicContact CG-CD 4.36Å; P213-W321 HydrophobicContact CG-CH2 4.4Å
214	L	83.6	Confident	83.9	Confident	7 Å²	7	30.9 Å²	30.9	4%	0.037	17%	0.171	C	C	.	.			trans	-103.8	-40.7	173.7	179.6	67.4	0	0	0	111.4	A80 Q81 V212 N218 Q220 F302 A307	A80-L214 HydrophobicContact CB-CD1 4.1Å; A80-L214 HydrophobicContact CB-CD2 4.47Å; A80-L214 HydrophobicContact CB-CG 4.01Å; Q81-L214 HydrophobicContact CB-CD2 4.07Å; Q81-L214 VanDerWaalsContact OE1-CD2 3.32Å; V212-L214 PolarHBondContact O-N 3.4Å; L214-N218 PolarHBondContact N-O 3.08Å; L214-Q220 HydrophobicContact CB-CB 4.19Å; L214-F302 WeakPolarHBondContact CD1-O 3.49Å; L214-A307 WeakPolarHBondContact O-CB 3.46Å
215	T	83.8	Confident	83.9	Confident	25 Å²	25	29.8 Å²	29.8	15%	0.153	17%	0.171	C	C	.	.	S	Bend	trans	-140.3	-176.9	178.3	58.9	0	0	0	0	109.5	A80 E217 N218 R310	A80-T215 HydrophobicContact CB-CG2 3.69Å; T215-E217 PolarHBondContact O-N 2.84Å; T215-N218 PolarHBondContact N-O 3.43Å; T215-N218 VanDerWaalsContact N-O 3.11Å; T215-N218 VanDerWaalsContact OG1-CB 3.32Å; T215-N218 WeakPolarHBondContact OG1-CB 3.22Å; T215-N218 PolarHBondContact OG1-N 3.03Å; T215-N218 PolarHBondContact OG1-ND2 3.01Å; T215-R310 PolarHBondContact O-NH1 3Å
216	A	77.3	Confident	84	Confident	52 Å²	52	29.6 Å²	29.6	43%	0.43	16%	0.164	S	C	.	.	S	Bend	trans	-52.3	-37.7	173.8	0	0	0	0	0	113.5	C306 R310	A216-C306 HydrophobicContact CB-CB 3.86Å; A216-R310 WeakPolarHBondContact O-CD 3.44Å; A216-R310 PolarHBondContact O-NE 3.49Å; A216-R310 PolarHBondContact O-NH1 3.18Å
217	E	76.4	Confident	83.9	Confident	168 Å²	168	30 Å²	30	79%	0.785	17%	0.169	S	C	*	.	S	Bend	trans	-113.1	-28	-172.5	-63.1	-179.9	-178.6	0	0	113.5	T215	T215-E217 PolarHBondContact O-N 2.84Å
218	N	78.1	Confident	83.9	Confident	99 Å²	99	32.9 Å²	32.9	53%	0.529	18%	0.182	S	C	.	.			trans	-102.9	140.6	-174.1	-56.3	-61.7	0	0	0	112.6	L214 T215	L214-N218 PolarHBondContact N-O 3.08Å; T215-N218 PolarHBondContact N-O 3.43Å; T215-N218 VanDerWaalsContact N-O 3.11Å; T215-N218 VanDerWaalsContact OG1-CB 3.32Å; T215-N218 WeakPolarHBondContact OG1-CB 3.22Å; T215-N218 PolarHBondContact OG1-N 3.03Å; T215-N218 PolarHBondContact OG1-ND2 3.01Å
219	D	81.4	Confident	83.8	Confident	48 Å²	48	33.4 Å²	33.4	26%	0.257	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	149.9	172.7	-64	-21.8	0	0	0	110	E211 V212 P213 R310 K314	E211-D219 HydrophobicContact CG-CB 3.57Å; E211-D219 WeakPolarHBondContact OE1-CB 3.24Å; V212-D219 CarbonylContact O-C 3.59Å; V212-D219 WeakPolarHBondContact O-CA 3.45Å; P213-D219 WeakPolarHBondContact CA-OD1 3.44Å; D219-R310 IonicContact OD1-CZ 3.52Å; D219-R310 VanDerWaalsContact OD1-CZ 3.25Å; D219-R310 IonicContact OD1-NH1 2.64Å; D219-R310 PolarHBondContact OD1-NH1 3.19Å; D219-R310 IonicContact OD1-NH2 3.94Å; D219-R310 PolarHBondContact OD1-NH2 3.17Å; D219-R310 IonicContact OD2-CZ 3.59Å; D219-R310 IonicContact OD2-NH2 3.06Å; D219-R310 PolarHBondContact OD2-NH2 3.28Å; D219-R310 VanDerWaalsContact OD2-NH2 3.17Å; D219-K314 IonicContact OD1-NZ 4Å; D219-K314 IonicContact OD2-NZ 3.1Å; D219-K314 PolarHBondContact OD2-NZ 3.1Å
220	Q	83.6	Confident	83.7	Confident	14 Å²	14	36.4 Å²	36.4	7%	0.065	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132.2	176.6	-179.1	179.3	17.5	0	0	110	S84 Q88 E211 V212 L214 L222	S84-Q220 VanDerWaalsContact OG-CD 3.27Å; S84-Q220 PolarHBondContact OG-NE2 2.8Å; S84-Q220 VanDerWaalsContact OG-NE2 3.08Å; S84-Q220 PolarHBondContact OG-OE1 2.73Å; Q88-Q220 VanDerWaalsContact NE2-NE2 3.2Å; E211-Q220 WeakPolarHBondContact CA-O 3.39Å; V212-Q220 PolarHBondContact N-O 3.29Å; V212-Q220 PolarHBondContact O-N 2.73Å; L214-Q220 HydrophobicContact CB-CB 4.19Å; Q220-L222 HydrophobicContact CG-CD2 4.31Å
221	A	84.6	Confident	83.4	Confident	29 Å²	29	39.1 Å²	39.1	24%	0.24	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	126.7	171.3	0	0	0	0	0	111	I396 T400	A221-I396 HydrophobicContact CB-CG2 4.02Å; A221-T400 HydrophobicContact CB-CG2 4.28Å; A221-T400 VanDerWaalsContact CB-OG1 3.24Å; A221-T400 WeakPolarHBondContact CB-OG1 3.49Å
222	L	87	Confident	82.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124.7	172.7	-50.4	-176.9	0	0	0	108.5	V181 A209 L210 V212 Q220 F224 I299 C301	V181-L222 HydrophobicContact CB-CD1 4.16Å; V181-L222 HydrophobicContact CG2-CD1 3.78Å; A209-L222 WeakPolarHBondContact CA-O 3.47Å; L210-L222 HydrophobicContact CD1-CD1 4.34Å; L210-L222 HydrophobicContact CD2-CB 4.48Å; L210-L222 HydrophobicContact CG-CB 4.36Å; L210-L222 HydrophobicContact CG-CD1 4.35Å; L210-L222 PolarHBondContact N-O 3.35Å; L210-L222 VanDerWaalsContact N-O 3.13Å; L210-L222 PolarHBondContact O-N 3.07Å; V212-L222 HydrophobicContact CG1-CD1 4.05Å; V212-L222 HydrophobicContact CG2-CD1 3.97Å; V212-L222 HydrophobicContact CG2-CD2 4.08Å; V212-L222 HydrophobicContact CG2-CG 3.93Å; Q220-L222 HydrophobicContact CG-CD2 4.31Å; L222-F224 HydrophobicContact CB-CE2 4.22Å; L222-I299 HydrophobicContact CB-CD1 4.37Å; L222-I299 HydrophobicContact CB-CG2 4.47Å; L222-I299 HydrophobicContact CD2-CG2 3.93Å; L222-C301 HydrophobicContact CD2-CB 4.12Å
223	M	85.1	Confident	82.2	Confident	45 Å²	45	40.9 Å²	40.9	22%	0.222	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.1	-175.3	-169.3	-177.8	-46	0	0	112.3	F207 I299 L332 T400	F207-M223 HydrophobicContact CD1-SD 4.47Å; M223-I299 VanDerWaalsContact O-CD1 3.28Å; M223-I299 WeakPolarHBondContact O-CD1 3.5Å; M223-L332 HydrophobicContact SD-CD1 4.18Å; M223-T400 VanDerWaalsContact CE-CB 3.49Å; M223-T400 HydrophobicContact CE-CG2 3.11Å
224	F	88.7	Confident	81.3	Confident	1 Å²	1	46.4 Å²	46.4	0%	0.004	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	88.7	179.3	-57.7	-94.7	0	0	0	109.3	V181 V183 F207 A208 L210 L222 W295 T297 I299	V181-F224 HydrophobicContact CB-CZ 4.22Å; V181-F224 HydrophobicContact CG1-CZ 4.01Å; V183-F224 HydrophobicContact CB-CD1 3.93Å; V183-F224 HydrophobicContact CB-CE1 4.1Å; V183-F224 HydrophobicContact CB-CG 4.19Å; V183-F224 HydrophobicContact CG2-CD1 3.85Å; V183-F224 HydrophobicContact CG2-CD2 3.78Å; V183-F224 HydrophobicContact CG2-CE1 3.75Å; V183-F224 HydrophobicContact CG2-CE2 3.69Å; V183-F224 HydrophobicContact CG2-CG 3.87Å; V183-F224 HydrophobicContact CG2-CZ 3.68Å; F207-F224 VanDerWaalsContact CA-O 3.3Å; F207-F224 WeakPolarHBondContact CA-O 3.42Å; A208-F224 HydrophobicContact CB-CB 4.15Å; A208-F224 HydrophobicContact CB-CD2 4.33Å; A208-F224 PolarHBondContact N-O 3.17Å; A208-F224 VanDerWaalsContact N-O 3.09Å; A208-F224 WeakPolarHBondContact O-CD2 3.24Å; A208-F224 PolarHBondContact O-N 3.23Å; L210-F224 HydrophobicContact CD2-CE2 3.76Å; L210-F224 HydrophobicContact CD2-CZ 4.45Å; L222-F224 HydrophobicContact CB-CE2 4.22Å; F224-W295 PolarHBondContact O-NE1 3.43Å; F224-W295 VanDerWaalsContact O-NE1 3.14Å; F224-T297 HydrophobicContact CD1-CG2 4.02Å; F224-T297 HydrophobicContact CE1-CG2 4.43Å; F224-T297 WeakPolarHBondContact CE1-O 3.4Å; F224-I299 HydrophobicContact CD1-CD1 3.8Å; F224-I299 HydrophobicContact CD1-CG1 4.14Å; F224-I299 HydrophobicContact CD2-CD1 4.21Å; F224-I299 HydrophobicContact CE1-CB 4.21Å; F224-I299 HydrophobicContact CE1-CD1 3.57Å; F224-I299 HydrophobicContact CE1-CG1 3.6Å; F224-I299 HydrophobicContact CE2-CD1 3.98Å; F224-I299 HydrophobicContact CG-CD1 4.12Å; F224-I299 HydrophobicContact CZ-CB 4.17Å; F224-I299 HydrophobicContact CZ-CD1 3.66Å; F224-I299 HydrophobicContact CZ-CG1 3.92Å
225	S	80.1	Confident	80.6	Confident	41 Å²	41	54.4 Å²	54.4	29%	0.287	31%	0.306	S	S	.	.			trans	-95	-9.1	-167.2	48.1	0	0	0	0	116.3	F207	F207-S225 VanDerWaalsContact CD1-CA 3.48Å; F207-S225 VanDerWaalsContact CE1-CB 3.41Å
226	E	79.3	Confident	79.9	Confident	31 Å²	31	55.1 Å²	55.1	15%	0.145	31%	0.308	C	S	.	.			trans	-113.8	47.7	-166.8	-66.8	168.9	158.4	0	0	112.2	H228 Q247 S248	E226-H228 PolarHBondContact O-CD2 3.48Å; E226-Q247 VanDerWaalsContact CD-CB 3.48Å; E226-Q247 WeakPolarHBondContact OE1-CA 3.3Å; E226-Q247 PolarHBondContact OE1-N 2.82Å; E226-Q247 WeakPolarHBondContact OE2-CA 3.33Å; E226-Q247 WeakPolarHBondContact OE2-CB 3.49Å; E226-Q247 WeakPolarHBondContact OE2-CG 3.34Å; E226-Q247 PolarHBondContact OE2-N 3.39Å; E226-Q247 PolarHBondContact OE2-NE2 3.15Å; E226-S248 PolarHBondContact OE1-N 2.77Å; E226-S248 PolarHBondContact OE1-OG 2.83Å
227	G	84	Confident	79.3	Confident	10 Å²	10	55.1 Å²	55.1	10%	0.103	31%	0.313	C	S	.	.			trans	-71.9	135.5	175.3	0	0	0	0	0	112.1	Y206 W295	Y206-G227 WeakPolarHBondContact CD2-O 3.48Å; G227-W295 VanDerWaalsContact CA-CD1 3.45Å; G227-W295 VanDerWaalsContact CA-NE1 3.35Å; G227-W295 VanDerWaalsContact N-CD1 3.34Å
228	H	85.5	Confident	78.9	Confident	69 Å²	69	56.9 Å²	56.9	32%	0.319	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127	177.5	-62.4	-77.5	0	0	0	111.6	E226 R243 V293 R294	E226-H228 PolarHBondContact O-CD2 3.48Å; H228-R243 PolarHBondContact CD2-NH1 2.81Å; H228-R243 PolarHBondContact NE2-NH1 2.88Å; H228-V293 WeakPolarHBondContact O-CA 3.49Å; H228-R294 PolarHBondContact N-O 3.24Å; H228-R294 PolarHBondContact O-N 2.86Å
229	L	86.3	Confident	78.5	Confident	14 Å²	14	54.3 Å²	54.3	7%	0.073	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.3	173.7	-174.6	67.8	0	0	0	110.5	V189 W193 L195 Y206 N291 V293	V189-L229 HydrophobicContact CG2-CD1 4.23Å; W193-L229 HydrophobicContact CB-CD1 4.22Å; L195-L229 HydrophobicContact CD2-CD2 4.42Å; L195-L229 HydrophobicContact CG-CD2 4Å; L195-L229 HydrophobicContact CG-CG 4.44Å; Y206-L229 HydrophobicContact CE2-CB 3.95Å; L229-N291 HydrophobicContact CD1-CB 4.36Å; L229-V293 HydrophobicContact CB-CG2 4.49Å; L229-V293 HydrophobicContact CD1-CG2 3.75Å
230	M	85.2	Confident	78.7	Confident	64 Å²	64	53 Å²	53	32%	0.315	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.9	178.1	-57.5	-61.2	-62.5	0	0	109.6	N291 R292 R294	M230-N291 WeakPolarHBondContact O-CA 3.37Å; M230-R292 HydrophobicContact CB-CG 3.83Å; M230-R292 PolarHBondContact N-O 3.18Å; M230-R292 PolarHBondContact O-N 2.96Å; M230-R294 HydrophobicContact CG-CB 4.21Å
231	P	81.9	Confident	78.9	Confident	58 Å²	58	57.1 Å²	57.1	38%	0.377	32%	0.321	S	S	.	.			trans	-71.1	152.7	177.9	29.8	-33.9	0	0	0	111.9	L195 N291 R292	L195-P231 HydrophobicContact CD1-CG 4.43Å; P231-N291 WeakPolarHBondContact CA-OD1 3.14Å; P231-R292 PolarHBondContact O-NH1 3.39Å
232	G	76.1	Confident	79.1	Confident	26 Å²	26	56.1 Å²	56.1	27%	0.268	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	159.1	167.5	0	0	0	0	0	113	T289 K290 N291	G232-T289 WeakPolarHBondContact CA-O 3.41Å; G232-K290 VanDerWaalsContact CA-O 3.24Å; G232-K290 WeakPolarHBondContact CA-O 3.43Å; G232-N291 PolarHBondContact N-OD1 3.09Å
233	G	70.8	Confident	79.2	Confident	56 Å²	56	57.7 Å²	57.7	58%	0.577	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	106	-7.5	174.2	0	0	0	0	0	116	I288	G233-I288 WeakPolarHBondContact CA-O 3.48Å; G233-I288 PolarHBondContact N-O 3.33Å
234	L	67.9	Low	79.3	Confident	117 Å²	117	56.4 Å²	56.4	61%	0.613	31%	0.31	S	S	*	.			trans	-122	112.6	-178.7	-72.3	167.9	0	0	0	110.6	R292	L234-R292 PolarHBondContact O-NH2 2.8Å
235	R	69.2	Low	79	Confident	174 Å²	174	57.3 Å²	57.3	66%	0.657	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-62.4	146.8	174.4	-161.4	173.7	-168	178.3	7.3	110.8
236	E	69.8	Low	78.9	Confident	40 Å²	40	58.3 Å²	58.3	19%	0.187	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-66.7	137.9	178.9	-64	-159.9	145.2	0	0	112.4	T185 R240 R292	T185-E236 PolarHBondContact OG1-OE1 3.02Å; E236-R240 IonicContact OE1-CZ 3.58Å; E236-R240 IonicContact OE1-NH1 3.2Å; E236-R240 PolarHBondContact OE1-NH1 3.19Å; E236-R240 IonicContact OE2-CZ 2.66Å; E236-R240 IonicContact OE2-NE 2.63Å; E236-R240 PolarHBondContact OE2-NE 2.83Å; E236-R240 VanDerWaalsContact OE2-NE 3.09Å; E236-R240 IonicContact OE2-NH1 3.99Å; E236-R240 PolarHBondContact OE2-NH1 3.24Å; E236-R240 IonicContact OE2-NH2 3Å; E236-R240 PolarHBondContact OE2-NH2 3.25Å; E236-R292 IonicContact OE1-NE 2.74Å
237	G	64.4	Low	78.6	Confident	53 Å²	53	57.1 Å²	57.1	55%	0.546	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-73.7	138.7	175.4	0	0	0	0	0	111.6	R240	G237-R240 VanDerWaalsContact O-CG 3.22Å; G237-R240 WeakPolarHBondContact O-CG 3.35Å
238	K	67.7	Low	78.1	Confident	205 Å²	205	61.4 Å²	61.4	89%	0.891	34%	0.341	S	S	*	.	S	Bend	trans	-63.4	139.2	174.3	-65.3	-174.5	178.1	-174.8	0	110.7
239	G	70.8	Confident	77.7	Confident	44 Å²	44	61.1 Å²	61.1	45%	0.454	34%	0.341	S	S	.	.	S	Bend	trans	80.7	43.2	176.6	0	0	0	0	0	114.5
240	R	84.6	Confident	77.5	Confident	22 Å²	22	61 Å²	61	8%	0.083	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	134.1	176.2	-55.7	-172.4	-62.7	154.2	2.5	109.8	E184 T185 E236 G237 F261 C262 D296	E184-R240 IonicContact OE2-NH2 3.42Å; E184-R240 PolarHBondContact OE2-NH2 3.09Å; T185-R240 PolarHBondContact OG1-NH1 2.98Å; E236-R240 IonicContact OE1-CZ 3.58Å; E236-R240 IonicContact OE1-NH1 3.2Å; E236-R240 PolarHBondContact OE1-NH1 3.19Å; E236-R240 IonicContact OE2-CZ 2.66Å; E236-R240 IonicContact OE2-NE 2.63Å; E236-R240 PolarHBondContact OE2-NE 2.83Å; E236-R240 VanDerWaalsContact OE2-NE 3.09Å; E236-R240 IonicContact OE2-NH1 3.99Å; E236-R240 PolarHBondContact OE2-NH1 3.24Å; E236-R240 IonicContact OE2-NH2 3Å; E236-R240 PolarHBondContact OE2-NH2 3.25Å; G237-R240 VanDerWaalsContact O-CG 3.22Å; G237-R240 WeakPolarHBondContact O-CG 3.35Å; R240-F261 CarbonylContact O-C 3.49Å; R240-F261 WeakPolarHBondContact O-CA 3.48Å; R240-C262 HydrophobicContact CB-CB 4.23Å; R240-C262 PolarHBondContact O-N 3.49Å; R240-D296 IonicContact CZ-OD1 2.76Å; R240-D296 IonicContact NH1-OD1 3.85Å; R240-D296 PolarHBondContact NH1-OD1 2.87Å; R240-D296 IonicContact NH1-OD2 2.64Å; R240-D296 IonicContact NH2-OD1 3.3Å
241	R	87.5	Confident	77.4	Confident	100 Å²	100	58.4 Å²	58.4	38%	0.377	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	134.2	179.2	-68.7	179.4	67.3	-166.6	-0.2	110.5	F256 L257 F261	R241-F256 HydrophobicContact CB-CB 4.46Å; R241-F256 HydrophobicContact CB-CD1 3.54Å; R241-F256 HydrophobicContact CB-CE1 4.12Å; R241-F256 HydrophobicContact CB-CG 4.24Å; R241-F256 VanDerWaalsContact CZ-CB 3.43Å; R241-F256 VanDerWaalsContact NH2-CB 3.28Å; R241-L257 PolarHBondContact NH2-O 2.98Å; R241-F261 HydrophobicContact CG-CD1 3.74Å; R241-F261 HydrophobicContact CG-CE1 3.53Å; R241-F261 HydrophobicContact CG-CZ 4.44Å
242	K	89.3	Confident	77.4	Confident	8 Å²	8	60 Å²	60	4%	0.035	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	142.5	174.3	-61	-169.4	178.2	-166.9	0	110.4	T182 F256 L257 S260 D296 E298 E475	T182-K242 HydrophobicContact CG2-CD 4Å; T182-K242 HydrophobicContact CG2-CG 4.48Å; T182-K242 PolarHBondContact OG1-NZ 2.82Å; K242-F256 WeakPolarHBondContact O-CA 3.26Å; K242-L257 HydrophobicContact CB-CD1 4.25Å; K242-L257 PolarHBondContact O-N 2.73Å; K242-S260 PolarHBondContact N-O 3.31Å; K242-D296 CarbonylContact C-O 3.54Å; K242-D296 WeakPolarHBondContact CA-O 3.44Å; K242-E298 HydrophobicContact CB-CB 4.4Å; K242-E298 HydrophobicContact CD-CB 4.12Å; K242-E298 VanDerWaalsContact CD-OE2 3.3Å; K242-E298 WeakPolarHBondContact CD-OE2 3.43Å; K242-E298 IonicContact NZ-OE2 3.42Å; K242-E298 PolarHBondContact NZ-OE2 3.22Å; K242-E475 IonicContact NZ-OE1 3.71Å; K242-E475 IonicContact NZ-OE2 3.06Å; K242-E475 PolarHBondContact NZ-OE2 2.82Å
243	R	88.9	Confident	77.5	Confident	34 Å²	34	60.5 Å²	60.5	13%	0.128	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	156.2	-179.3	-57.9	-172.2	-174.5	-168.7	5.5	111.5	H228 Q255 F256 D296 T297 E298	H228-R243 PolarHBondContact CD2-NH1 2.81Å; H228-R243 PolarHBondContact NE2-NH1 2.88Å; R243-Q255 CarbonylContact C-O 3.56Å; R243-Q255 VanDerWaalsContact CA-O 3.26Å; R243-Q255 WeakPolarHBondContact CA-O 3.26Å; R243-F256 HydrophobicContact CG-CD1 4.14Å; R243-F256 HydrophobicContact CG-CE1 4.16Å; R243-D296 HydrophobicContact CG-CB 4.33Å; R243-D296 PolarHBondContact N-O 3.15Å; R243-T297 WeakPolarHBondContact O-CA 3.48Å; R243-E298 PolarHBondContact O-N 3.46Å
244	R	87.4	Confident	78.2	Confident	17 Å²	17	58.3 Å²	58.3	6%	0.064	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-82	156.6	175.1	-62.1	172.9	177.5	-79.8	4.3	110.4	D118 Q247 L250 N254 Q255 F256 L257 P258	D118-R244 IonicContact OD1-CZ 3.09Å; D118-R244 IonicContact OD1-NH1 2.82Å; D118-R244 PolarHBondContact OD1-NH1 2.7Å; D118-R244 IonicContact OD1-NH2 3.92Å; D118-R244 IonicContact OD2-CZ 2.62Å; D118-R244 IonicContact OD2-NH1 3.02Å; D118-R244 PolarHBondContact OD2-NH1 2.95Å; D118-R244 IonicContact OD2-NH2 3.69Å; D118-R244 PolarHBondContact OD2-NH2 3.27Å; R244-Q247 VanDerWaalsContact O-CG 3.26Å; R244-Q247 WeakPolarHBondContact O-CG 3.49Å; R244-Q247 PolarHBondContact O-NE2 2.81Å; R244-Q247 VanDerWaalsContact O-NE2 3.12Å; R244-L250 HydrophobicContact CB-CD1 4.42Å; R244-N254 VanDerWaalsContact CD-O 3.26Å; R244-N254 WeakPolarHBondContact CD-O 3.49Å; R244-N254 PolarHBondContact NE-O 2.99Å; R244-Q255 PolarHBondContact N-O 2.91Å; R244-F256 PolarHBondContact NE-O 3.49Å; R244-F256 VanDerWaalsContact NE-O 3.17Å; R244-L257 HydrophobicContact CG-CD2 3.8Å; R244-L257 HydrophobicContact CG-CG 3.84Å; R244-P258 VanDerWaalsContact NH2-CD 3.31Å
245	P	83.4	Confident	79	Confident	21 Å²	21	54.5 Å²	54.5	14%	0.136	30%	0.298	C	S	.	.	S	Bend	trans	-67.5	164	161.6	31.1	-34.8	0	0	0	110.9	Q88 Q247 I299	Q88-P245 WeakPolarHBondContact O-CG 3.39Å; P245-Q247 PolarHBondContact O-N 3.31Å; P245-I299 HydrophobicContact CB-CG1 4.32Å
246	L	76.1	Confident	79.9	Confident	61 Å²	61	49 Å²	49	32%	0.319	28%	0.279	S	S	.	.			trans	59.9	39.6	175.7	-55.1	166.9	0	0	0	114.3	E47 K89 S248 L249	E47-L246 HydrophobicContact CG-CD1 4.37Å; K89-L246 HydrophobicContact CG-CD1 4.3Å; L246-S248 PolarHBondContact O-N 2.95Å; L246-L249 PolarHBondContact O-N 3.39Å
247	Q	73.9	Confident	80.5	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.033	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-60.3	-25.6	179.9	-57.6	160.9	39.2	0	0	113.2	E226 R244 P245 L249 L250 Q255 T297	E226-Q247 VanDerWaalsContact CD-CB 3.48Å; E226-Q247 WeakPolarHBondContact OE1-CA 3.3Å; E226-Q247 PolarHBondContact OE1-N 2.82Å; E226-Q247 WeakPolarHBondContact OE2-CA 3.33Å; E226-Q247 WeakPolarHBondContact OE2-CB 3.49Å; E226-Q247 WeakPolarHBondContact OE2-CG 3.34Å; E226-Q247 PolarHBondContact OE2-N 3.39Å; E226-Q247 PolarHBondContact OE2-NE2 3.15Å; R244-Q247 VanDerWaalsContact O-CG 3.26Å; R244-Q247 WeakPolarHBondContact O-CG 3.49Å; R244-Q247 PolarHBondContact O-NE2 2.81Å; R244-Q247 VanDerWaalsContact O-NE2 3.12Å; P245-Q247 PolarHBondContact O-N 3.31Å; Q247-L249 PolarHBondContact O-N 2.87Å; Q247-L249 VanDerWaalsContact O-N 3.15Å; Q247-L250 PolarHBondContact O-N 2.93Å; Q247-L250 VanDerWaalsContact O-O 3.05Å; Q247-Q255 HydrophobicContact CB-CB 4.48Å; Q247-Q255 HydrophobicContact CB-CG 3.86Å; Q247-Q255 HydrophobicContact CG-CB 4.14Å; Q247-Q255 HydrophobicContact CG-CG 4.07Å; Q247-T297 PolarHBondContact NE2-OG1 3.35Å
248	S	74.3	Confident	81.1	Confident	100 Å²	100	48.9 Å²	48.9	70%	0.699	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-56.3	-26.1	176.3	52.3	0	0	0	0	114.2	E226 L246	E226-S248 PolarHBondContact OE1-N 2.77Å; E226-S248 PolarHBondContact OE1-OG 2.83Å; L246-S248 PolarHBondContact O-N 2.95Å
249	L	75.4	Confident	81.5	Confident	62 Å²	62	42.2 Å²	42.2	33%	0.325	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-89.4	-8.5	176.8	-59.8	177.6	0	0	0	113.4	E47 I92 L246 Q247	E47-L249 HydrophobicContact CB-CD1 4.49Å; I92-L249 HydrophobicContact CD1-CB 4.29Å; L246-L249 PolarHBondContact O-N 3.39Å; Q247-L249 PolarHBondContact O-N 2.87Å; Q247-L249 VanDerWaalsContact O-N 3.15Å
250	L	82	Confident	82.1	Confident	12 Å²	12	41.1 Å²	41.1	6%	0.063	25%	0.246	C	C	.	.	S	Bend	trans	-114.7	138.9	-169.3	-58.9	-179	0	0	0	112.3	I92 V116 R244 Q247 N254 Q255	I92-L250 HydrophobicContact CD1-CD2 3.67Å; I92-L250 HydrophobicContact CG1-CD2 3.86Å; V116-L250 HydrophobicContact CG2-CD2 3.75Å; R244-L250 HydrophobicContact CB-CD1 4.42Å; Q247-L250 PolarHBondContact O-N 2.93Å; Q247-L250 VanDerWaalsContact O-O 3.05Å; L250-N254 HydrophobicContact CB-CB 4.38Å; L250-Q255 HydrophobicContact CB-CG 4.11Å; L250-Q255 PolarHBondContact O-NE2 3.44Å
251	V	84.9	Confident	82.1	Confident	10 Å²	10	44.8 Å²	44.8	6%	0.061	26%	0.263	C	S	.	.			trans	-61.2	150.3	166.5	-71.8	0	0	0	0	112.4	Q114 N136 V138 G253 N254 Q255	Q114-V251 HydrophobicContact CB-CG1 4.42Å; Q114-V251 HydrophobicContact CB-CG2 3.87Å; Q114-V251 HydrophobicContact CG-CG1 4.42Å; Q114-V251 VanDerWaalsContact OE1-N 3.14Å; N136-V251 HydrophobicContact CB-CG2 3.7Å; V138-V251 HydrophobicContact CB-CG1 4.07Å; V138-V251 HydrophobicContact CG1-CG1 4.46Å; V138-V251 HydrophobicContact CG2-CG1 3.53Å; V251-G253 PolarHBondContact O-N 2.87Å; V251-N254 HydrophobicContact CG2-CB 3.98Å; V251-N254 WeakPolarHBondContact CG2-ND2 3.3Å; V251-N254 PolarHBondContact O-N 2.8Å; V251-Q255 PolarHBondContact O-N 3.18Å
252	P	81.8	Confident	81.8	Confident	90 Å²	90	40.3 Å²	40.3	58%	0.584	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-49.9	-37	-176.3	-30.6	35.6	0	0	0	115.4	N254 Q255	P252-N254 VanDerWaalsContact C-N 3.26Å; P252-N254 PolarHBondContact O-N 3.43Å; P252-Q255 PolarHBondContact O-N 3.17Å
253	G	78.4	Confident	81	Confident	37 Å²	37	46.2 Å²	46.2	38%	0.381	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-67.6	-22	178.2	0	0	0	0	0	114.7	N136 V251	N136-G253 PolarHBondContact ND2-O 2.79Å; V251-G253 PolarHBondContact O-N 2.87Å
254	N	84.1	Confident	79.9	Confident	10 Å²	10	49.4 Å²	49.4	5%	0.053	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-99.9	-6.2	-177.6	-73.3	-22.7	0	0	0	113.8	Q114 V116 N136 R244 L250 V251 P252 F256	Q114-N254 VanDerWaalsContact C-ND2 3.3Å; Q114-N254 PolarHBondContact O-ND2 3.17Å; V116-N254 HydrophobicContact CB-CB 4.44Å; V116-N254 HydrophobicContact CG2-CB 3.7Å; N136-N254 PolarHBondContact ND2-OD1 2.71Å; R244-N254 VanDerWaalsContact CD-O 3.26Å; R244-N254 WeakPolarHBondContact CD-O 3.49Å; R244-N254 PolarHBondContact NE-O 2.99Å; L250-N254 HydrophobicContact CB-CB 4.38Å; V251-N254 HydrophobicContact CG2-CB 3.98Å; V251-N254 WeakPolarHBondContact CG2-ND2 3.3Å; V251-N254 PolarHBondContact O-N 2.8Å; P252-N254 VanDerWaalsContact C-N 3.26Å; P252-N254 PolarHBondContact O-N 3.43Å; N254-F256 PolarHBondContact O-N 3.06Å
255	Q	85.4	Confident	79.2	Confident	38 Å²	38	51.7 Å²	51.7	18%	0.178	31%	0.311	C	S	.	.	S	Bend	trans	-69.5	-14.3	-178.2	-68	175.1	-8.3	0	0	113.3	R243 R244 Q247 L250 V251 P252	R243-Q255 CarbonylContact C-O 3.56Å; R243-Q255 VanDerWaalsContact CA-O 3.26Å; R243-Q255 WeakPolarHBondContact CA-O 3.26Å; R244-Q255 PolarHBondContact N-O 2.91Å; Q247-Q255 HydrophobicContact CB-CB 4.48Å; Q247-Q255 HydrophobicContact CB-CG 3.86Å; Q247-Q255 HydrophobicContact CG-CB 4.14Å; Q247-Q255 HydrophobicContact CG-CG 4.07Å; L250-Q255 HydrophobicContact CB-CG 4.11Å; L250-Q255 PolarHBondContact O-NE2 3.44Å; V251-Q255 PolarHBondContact O-N 3.18Å; P252-Q255 PolarHBondContact O-N 3.17Å
256	F	86.9	Confident	78.8	Confident	59 Å²	59	54.5 Å²	54.5	26%	0.259	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	144.5	-177	-59	-77.6	0	0	0	112.7	R241 K242 R243 R244 N254	R241-F256 HydrophobicContact CB-CB 4.46Å; R241-F256 HydrophobicContact CB-CD1 3.54Å; R241-F256 HydrophobicContact CB-CE1 4.12Å; R241-F256 HydrophobicContact CB-CG 4.24Å; R241-F256 VanDerWaalsContact CZ-CB 3.43Å; R241-F256 VanDerWaalsContact NH2-CB 3.28Å; K242-F256 WeakPolarHBondContact O-CA 3.26Å; R243-F256 HydrophobicContact CG-CD1 4.14Å; R243-F256 HydrophobicContact CG-CE1 4.16Å; R244-F256 PolarHBondContact NE-O 3.49Å; R244-F256 VanDerWaalsContact NE-O 3.17Å; N254-F256 PolarHBondContact O-N 3.06Å
257	L	83	Confident	78.8	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.026	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	138.9	168.2	-73.6	165.3	0	0	0	110.3	R241 K242 R244 E298	R241-L257 PolarHBondContact NH2-O 2.98Å; K242-L257 HydrophobicContact CB-CD1 4.25Å; K242-L257 PolarHBondContact O-N 2.73Å; R244-L257 HydrophobicContact CG-CD2 3.8Å; R244-L257 HydrophobicContact CG-CG 3.84Å; L257-E298 HydrophobicContact CD1-CB 3.72Å; L257-E298 HydrophobicContact CD1-CG 4.24Å
258	P	78.1	Confident	78.6	Confident	84 Å²	84	56.6 Å²	56.6	55%	0.545	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	129.2	176.8	27.9	-32.6	0	0	0	110.4	R244 S260	R244-P258 VanDerWaalsContact NH2-CD 3.31Å; P258-S260 PolarHBondContact O-N 3.08Å; P258-S260 VanDerWaalsContact O-N 3.15Å
259	G	74.4	Confident	78.4	Confident	66 Å²	66	58.5 Å²	58.5	68%	0.68	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	72	-0.9	176	0	0	0	0	0	116.3	F261	G259-F261 WeakPolarHBondContact O-CD2 2.94Å
260	S	83.8	Confident	78.7	Confident	20 Å²	20	56 Å²	56	14%	0.14	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.1	178.9	-63.9	0	0	0	0	112	K242 P258	K242-S260 PolarHBondContact N-O 3.31Å; P258-S260 PolarHBondContact O-N 3.08Å; P258-S260 VanDerWaalsContact O-N 3.15Å
261	F	85.6	Confident	78.6	Confident	99 Å²	99	57 Å²	57	43%	0.434	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147	-179.9	-58.4	-92.5	0	0	0	110.9	R240 R241 G259 Q263	R240-F261 CarbonylContact O-C 3.49Å; R240-F261 WeakPolarHBondContact O-CA 3.48Å; R241-F261 HydrophobicContact CG-CD1 3.74Å; R241-F261 HydrophobicContact CG-CE1 3.53Å; R241-F261 HydrophobicContact CG-CZ 4.44Å; G259-F261 WeakPolarHBondContact O-CD2 2.94Å; F261-Q263 PolarHBondContact O-N 3.33Å
262	C	81.3	Confident	78.3	Confident	6 Å²	6	57.3 Å²	57.3	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	114	166.1	-48.3	0	0	0	0	107.5	R240	R240-C262 HydrophobicContact CB-CB 4.23Å; R240-C262 PolarHBondContact O-N 3.49Å
263	Q	71.8	Confident	78.4	Confident	132 Å²	132	57.2 Å²	57.2	62%	0.617	33%	0.327	S	S	*	.			trans	-90.4	130.3	178.6	-66.3	-172.1	-1.8	0	0	109.5	F261	F261-Q263 PolarHBondContact O-N 3.33Å
264	P	66.2	Low	78.5	Confident	102 Å²	102	56.3 Å²	56.3	66%	0.662	31%	0.314	S	S	*	.			trans	-73.5	127.1	173.2	29	-30.6	0	0	0	109.7
265	E	71.7	Confident	78.3	Confident	65 Å²	65	58.1 Å²	58.1	30%	0.304	33%	0.326	S	S	.	.			trans	-105.7	149.3	169.5	-80.3	170.2	145.2	0	0	109.7	R362 R364	E265-R362 IonicContact OE1-CZ 3.25Å; E265-R362 IonicContact OE1-NH1 2.71Å; E265-R362 PolarHBondContact OE1-NH1 2.79Å; E265-R362 IonicContact OE1-NH2 2.91Å; E265-R362 IonicContact OE2-CZ 4Å; E265-R362 IonicContact OE2-NH1 3.18Å; E265-R362 PolarHBondContact OE2-NH1 2.84Å; E265-R362 IonicContact OE2-NH2 3.17Å; E265-R362 PolarHBondContact OE2-NH2 3.37Å; E265-R364 WeakPolarHBondContact OE2-CD 3.22Å
266	P	75.4	Confident	77.7	Confident	79 Å²	79	58.8 Å²	58.8	51%	0.513	33%	0.334	S	S	.	.			trans	-59.8	137.7	171.2	-20.5	33.6	0	0	0	110.3	D268 H269	P266-D268 PolarHBondContact O-N 3.01Å; P266-H269 PolarHBondContact O-N 3.22Å
267	I	77.1	Confident	77.1	Confident	19 Å²	19	62.8 Å²	62.8	10%	0.097	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-55.3	-38.4	-175.1	-70.4	167.6	0	0	0	111.6	H269 E270 T275 Q280 R283	I267-H269 PolarHBondContact O-N 2.92Å; I267-H269 VanDerWaalsContact O-N 3.13Å; I267-E270 PolarHBondContact O-N 3.34Å; I267-T275 WeakPolarHBondContact O-CG2 3.08Å; I267-Q280 HydrophobicContact CD1-CG 3.91Å; I267-R283 HydrophobicContact CD1-CB 4.43Å
268	D	68.9	Low	76.8	Confident	94 Å²	94	70.4 Å²	70.4	50%	0.503	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-65.3	-15.8	-179.3	-46.6	-19.7	0	0	0	114	P266	P266-D268 PolarHBondContact O-N 3.01Å
269	H	70.5	Confident	77.1	Confident	139 Å²	139	68.3 Å²	68.3	64%	0.644	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-106.4	0.1	-179	-66.2	-52.1	0	0	0	113.5	P266 I267	P266-H269 PolarHBondContact O-N 3.22Å; I267-H269 PolarHBondContact O-N 2.92Å; I267-H269 VanDerWaalsContact O-N 3.13Å
270	E	81.9	Confident	77.5	Confident	11 Å²	11	68.1 Å²	68.1	5%	0.051	36%	0.359	C	S	.	.			trans	-73.2	154.8	177.5	-67	-172.2	167.7	0	0	111.9	I267 G272 T275 R283 R364	I267-E270 PolarHBondContact O-N 3.34Å; E270-G272 VanDerWaalsContact C-N 3.27Å; E270-G272 PolarHBondContact O-N 3.02Å; E270-T275 HydrophobicContact CB-CG2 4.23Å; E270-R283 IonicContact OE1-NH2 3.73Å; E270-R283 PolarHBondContact OE1-NH2 3.37Å; E270-R283 IonicContact OE2-CZ 2.85Å; E270-R283 VanDerWaalsContact OE2-CZ 3.31Å; E270-R283 IonicContact OE2-NH1 3.12Å; E270-R283 PolarHBondContact OE2-NH1 2.8Å; E270-R283 IonicContact OE2-NH2 3.88Å; E270-R283 PolarHBondContact OE2-NH2 2.94Å; E270-R364 IonicContact OE1-CZ 2.85Å; E270-R364 IonicContact OE1-NH1 3.21Å; E270-R364 PolarHBondContact OE1-NH1 2.75Å
271	D	79.3	Confident	77.4	Confident	32 Å²	32	70.1 Å²	70.1	17%	0.171	38%	0.377	C	S	.	.	S	Bend	trans	-90	15	179	-50.6	-73.5	0	0	0	112.9	R354 I363 R364 Y367	D271-R354 WeakPolarHBondContact OD1-CD 3.39Å; D271-R354 IonicContact OD1-CZ 3.56Å; D271-R354 IonicContact OD1-NE 3.67Å; D271-R354 IonicContact OD1-NH1 3.62Å; D271-R354 PolarHBondContact OD1-NH1 3.39Å; D271-I363 HydrophobicContact CB-CB 4.26Å; D271-I363 WeakPolarHBondContact OD2-CA 3.48Å; D271-R364 PolarHBondContact N-O 3.14Å; D271-R364 PolarHBondContact OD2-N 2.99Å; D271-Y367 PolarHBondContact O-OH 3.45Å
272	G	79.8	Confident	77.6	Confident	16 Å²	16	67.4 Å²	67.4	17%	0.165	37%	0.365	C	S	.	.	S	Bend	trans	-98	-176.2	-174.4	0	0	0	0	0	114.1	E270 A366	E270-G272 VanDerWaalsContact C-N 3.27Å; E270-G272 PolarHBondContact O-N 3.02Å; G272-A366 CarbonylContact C-O 3.53Å; G272-A366 WeakPolarHBondContact CA-O 3.41Å
273	E	82.3	Confident	77.8	Confident	88 Å²	88	67.2 Å²	67.2	41%	0.411	36%	0.363	S	S	.	.	S	Bend	trans	-82.3	-28.4	-177.1	-61.8	172.7	159.8	0	0	112.8	T275 A366 T368	E273-T275 PolarHBondContact O-N 3.03Å; E273-A366 PolarHBondContact N-O 2.99Å; E273-T368 WeakPolarHBondContact OE2-CB 3.38Å; E273-T368 WeakPolarHBondContact OE2-CG2 3.37Å; E273-T368 PolarHBondContact OE2-N 3.47Å; E273-T368 VanDerWaalsContact OE2-N 3.1Å; E273-T368 PolarHBondContact OE2-OG1 3Å
274	L	81.3	Confident	78.5	Confident	18 Å²	18	64 Å²	64	9%	0.094	35%	0.35	C	S	.	.			trans	-100.8	65.5	-169	-62.2	177.5	0	0	0	112.2	D279 R283 A366 T368 Y471	L274-D279 HydrophobicContact CB-CB 4.05Å; L274-D279 HydrophobicContact CD2-CB 4.39Å; L274-R283 PolarHBondContact O-NH1 3.3Å; L274-R283 VanDerWaalsContact O-NH1 3.14Å; L274-A366 HydrophobicContact CB-CB 4.34Å; L274-T368 HydrophobicContact CD1-CG2 4.07Å; L274-T368 HydrophobicContact CD2-CG2 4.03Å; L274-T368 HydrophobicContact CG-CG2 4.08Å; L274-Y471 HydrophobicContact CD1-CD1 3.85Å; L274-Y471 HydrophobicContact CD1-CD2 4.18Å; L274-Y471 HydrophobicContact CD1-CG 3.62Å
275	T	79.3	Confident	79.4	Confident	49 Å²	49	64.7 Å²	64.7	30%	0.301	34%	0.344	S	S	.	.			trans	-119.1	0.5	-176.7	67.8	0	0	0	0	114.3	I267 E270 E273	I267-T275 WeakPolarHBondContact O-CG2 3.08Å; E270-T275 HydrophobicContact CB-CG2 4.23Å; E273-T275 PolarHBondContact O-N 3.03Å
276	S	73.8	Confident	80.1	Confident	52 Å²	52	61.6 Å²	61.6	36%	0.364	33%	0.33	S	S	.	.	S	Bend	trans	-73.7	164.4	178.1	77.3	0	0	0	0	112	E278 D279 Q280	S276-E278 PolarHBondContact O-N 2.66Å; S276-D279 VanDerWaalsContact CB-OD2 3.27Å; S276-D279 WeakPolarHBondContact CB-OD2 3.49Å; S276-D279 PolarHBondContact N-OD2 3.28Å; S276-D279 VanDerWaalsContact N-OD2 3.14Å; S276-D279 PolarHBondContact O-N 2.96Å; S276-D279 VanDerWaalsContact O-N 3.12Å; S276-D279 PolarHBondContact OG-N 3.45Å; S276-D279 PolarHBondContact OG-OD2 3.03Å; S276-Q280 PolarHBondContact O-N 2.74Å
277	L	73.4	Confident	80.5	Confident	142 Å²	142	59.3 Å²	59.3	74%	0.743	31%	0.313	S	S	*	.	H	α-helix	trans	-60	-32.8	175.8	-70.9	173	0	0	0	112.4
278	E	77.1	Confident	80.8	Confident	166 Å²	166	61.9 Å²	61.9	78%	0.776	33%	0.326	S	S	*	.	H	α-helix	trans	-71	-40.7	175.5	-63.9	-177.1	-176.6	0	0	111.2	S276 Q280 A281 F282	S276-E278 PolarHBondContact O-N 2.66Å; E278-Q280 VanDerWaalsContact C-N 3.31Å; E278-Q280 PolarHBondContact O-N 2.88Å; E278-A281 PolarHBondContact O-N 3.12Å; E278-F282 PolarHBondContact O-N 2.72Å
279	D	83.3	Confident	81.4	Confident	40 Å²	40	61 Å²	61	21%	0.214	32%	0.324	C	S	.	.	H	α-helix	trans	-66.1	-35.1	176.9	-61	-45.6	0	0	0	111.9	L274 S276 A281 F282 R283	L274-D279 HydrophobicContact CB-CB 4.05Å; L274-D279 HydrophobicContact CD2-CB 4.39Å; S276-D279 VanDerWaalsContact CB-OD2 3.27Å; S276-D279 WeakPolarHBondContact CB-OD2 3.49Å; S276-D279 PolarHBondContact N-OD2 3.28Å; S276-D279 VanDerWaalsContact N-OD2 3.14Å; S276-D279 PolarHBondContact O-N 2.96Å; S276-D279 VanDerWaalsContact O-N 3.12Å; S276-D279 PolarHBondContact OG-N 3.45Å; S276-D279 PolarHBondContact OG-OD2 3.03Å; D279-A281 PolarHBondContact O-N 3.01Å; D279-F282 PolarHBondContact O-N 3.48Å; D279-R283 WeakPolarHBondContact O-CB 3.45Å; D279-R283 VanDerWaalsContact O-CG 3.28Å; D279-R283 WeakPolarHBondContact O-CG 3.28Å; D279-R283 PolarHBondContact O-N 3.15Å
280	Q	83	Confident	82.1	Confident	61 Å²	61	57.5 Å²	57.5	29%	0.285	31%	0.307	S	S	.	.	H	α-helix	trans	-60	-46.9	178.4	-172.9	170.4	33.1	0	0	111.5	I267 S276 E278 F282 R283 D284	I267-Q280 HydrophobicContact CD1-CG 3.91Å; S276-Q280 PolarHBondContact O-N 2.74Å; E278-Q280 VanDerWaalsContact C-N 3.31Å; E278-Q280 PolarHBondContact O-N 2.88Å; Q280-F282 PolarHBondContact O-N 3Å; Q280-R283 PolarHBondContact O-N 3.42Å; Q280-D284 PolarHBondContact O-N 2.82Å
281	A	83.1	Confident	82.4	Confident	63 Å²	63	58.9 Å²	58.9	52%	0.521	32%	0.315	S	S	.	.	H	α-helix	trans	-62	-43	176.1	0	0	0	0	0	111.8	E278 D279 E285	E278-A281 PolarHBondContact O-N 3.12Å; D279-A281 PolarHBondContact O-N 3.01Å; A281-E285 PolarHBondContact O-N 2.63Å; A281-E285 VanDerWaalsContact O-N 3.16Å
282	F	88.4	Confident	82.9	Confident	41 Å²	41	57.9 Å²	57.9	18%	0.18	31%	0.308	C	S	.	.	H	α-helix	trans	-62.1	-43.4	175.8	165	-107.6	0	0	0	112.4	E278 D279 Q280 E285 A286 K469 Y471	E278-F282 PolarHBondContact O-N 2.72Å; D279-F282 PolarHBondContact O-N 3.48Å; Q280-F282 PolarHBondContact O-N 3Å; F282-E285 PolarHBondContact O-N 3.21Å; F282-A286 HydrophobicContact CE2-CB 4.37Å; F282-A286 HydrophobicContact CZ-CB 4.31Å; F282-A286 VanDerWaalsContact O-CB 3.3Å; F282-A286 WeakPolarHBondContact O-CB 3.29Å; F282-A286 PolarHBondContact O-N 2.98Å; F282-K469 HydrophobicContact CE1-CB 4.33Å; F282-K469 HydrophobicContact CE2-CB 4.09Å; F282-K469 HydrophobicContact CE2-CD 4.1Å; F282-K469 HydrophobicContact CZ-CB 3.56Å; F282-K469 HydrophobicContact CZ-CD 4.22Å; F282-K469 WeakPolarHBondContact CZ-O 3.22Å; F282-Y471 AromaticContact CE1-CD1 3.92Å; F282-Y471 HydrophobicContact CE1-CD1 3.92Å; F282-Y471 AromaticContact CE1-CE1 3.87Å; F282-Y471 HydrophobicContact CE1-CE1 3.87Å; F282-Y471 HydrophobicContact CZ-CD1 4.46Å; F282-Y471 HydrophobicContact CZ-CE1 4.42Å
283	R	86.8	Confident	83.4	Confident	3 Å²	3	57.1 Å²	57.1	1%	0.011	30%	0.301	C	S	.	.	H	α-helix	trans	-65.5	-44.9	-179.9	-74.2	179.7	65	173.4	-0.7	111.5	I267 E270 L274 D279 Q280 E285 A286 E287 Y471	I267-R283 HydrophobicContact CD1-CB 4.43Å; E270-R283 IonicContact OE1-NH2 3.73Å; E270-R283 PolarHBondContact OE1-NH2 3.37Å; E270-R283 IonicContact OE2-CZ 2.85Å; E270-R283 VanDerWaalsContact OE2-CZ 3.31Å; E270-R283 IonicContact OE2-NH1 3.12Å; E270-R283 PolarHBondContact OE2-NH1 2.8Å; E270-R283 IonicContact OE2-NH2 3.88Å; E270-R283 PolarHBondContact OE2-NH2 2.94Å; L274-R283 PolarHBondContact O-NH1 3.3Å; L274-R283 VanDerWaalsContact O-NH1 3.14Å; D279-R283 WeakPolarHBondContact O-CB 3.45Å; D279-R283 VanDerWaalsContact O-CG 3.28Å; D279-R283 WeakPolarHBondContact O-CG 3.28Å; D279-R283 PolarHBondContact O-N 3.15Å; Q280-R283 PolarHBondContact O-N 3.42Å; R283-E285 VanDerWaalsContact C-N 3.28Å; R283-E285 PolarHBondContact O-N 3.32Å; R283-A286 PolarHBondContact O-N 3.37Å; R283-E287 WeakPolarHBondContact O-CB 3.47Å; R283-E287 VanDerWaalsContact O-CG 3.29Å; R283-E287 WeakPolarHBondContact O-CG 3.22Å; R283-E287 PolarHBondContact O-N 2.87Å; R283-Y471 HydrophobicContact CG-CE1 4.12Å; R283-Y471 HydrophobicContact CG-CE2 4.38Å
284	D	85.1	Confident	83.7	Confident	64 Å²	64	55.3 Å²	55.3	34%	0.342	29%	0.29	S	S	.	.	H	α-helix	trans	-57.8	-41.6	175.9	-82.5	-31.6	0	0	0	111.7	Q280 I288	Q280-D284 PolarHBondContact O-N 2.82Å; D284-I288 WeakPolarHBondContact O-CD1 3.42Å; D284-I288 VanDerWaalsContact O-CG1 3.29Å; D284-I288 WeakPolarHBondContact O-CG1 3.2Å; D284-I288 PolarHBondContact O-N 2.88Å
285	E	85.9	Confident	84.2	Confident	116 Å²	116	54.4 Å²	54.4	54%	0.542	29%	0.285	S	S	.	.	H	α-helix	trans	-66.3	-47.6	174.9	-172.6	-174.2	168.2	0	0	112	A281 F282 R283 E287 I288 T289	A281-E285 PolarHBondContact O-N 2.63Å; A281-E285 VanDerWaalsContact O-N 3.16Å; F282-E285 PolarHBondContact O-N 3.21Å; R283-E285 VanDerWaalsContact C-N 3.28Å; R283-E285 PolarHBondContact O-N 3.32Å; E285-E287 PolarHBondContact O-N 3.38Å; E285-I288 PolarHBondContact O-N 2.89Å; E285-T289 HydrophobicContact CG-CG2 4.19Å; E285-T289 WeakPolarHBondContact O-CB 3.46Å; E285-T289 WeakPolarHBondContact O-CG2 3.3Å; E285-T289 PolarHBondContact O-N 2.81Å; E285-T289 PolarHBondContact O-OG1 3.49Å
286	A	85.6	Confident	84.7	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-38.1	-177	0	0	0	0	0	112.8	F282 R283 I288 K290 Y471	F282-A286 HydrophobicContact CE2-CB 4.37Å; F282-A286 HydrophobicContact CZ-CB 4.31Å; F282-A286 VanDerWaalsContact O-CB 3.3Å; F282-A286 WeakPolarHBondContact O-CB 3.29Å; F282-A286 PolarHBondContact O-N 2.98Å; R283-A286 PolarHBondContact O-N 3.37Å; A286-I288 VanDerWaalsContact C-N 3.29Å; A286-I288 PolarHBondContact O-N 3.37Å; A286-K290 PolarHBondContact O-N 2.72Å; A286-Y471 HydrophobicContact CB-CE1 4.2Å
287	E	85.5	Confident	85.5	Confident	30 Å²	30	49.8 Å²	49.8	14%	0.14	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-30.7	177.7	-73.7	-172	-169.5	0	0	112.7	F187 R283 E285	F187-E287 HydrophobicContact CD1-CB 4.42Å; F187-E287 HydrophobicContact CD1-CG 3.82Å; F187-E287 HydrophobicContact CE1-CB 4.22Å; F187-E287 HydrophobicContact CE1-CG 3.61Å; F187-E287 HydrophobicContact CG-CG 4.42Å; F187-E287 HydrophobicContact CZ-CG 4.03Å; R283-E287 WeakPolarHBondContact O-CB 3.47Å; R283-E287 VanDerWaalsContact O-CG 3.29Å; R283-E287 WeakPolarHBondContact O-CG 3.22Å; R283-E287 PolarHBondContact O-N 2.87Å; E285-E287 PolarHBondContact O-N 3.38Å
288	I	82.9	Confident	86.5	Confident	73 Å²	73	43.4 Å²	43.4	37%	0.374	22%	0.221	S	C	.	.	H	α-helix	trans	-91.5	-44.5	-176.5	-63.6	171.3	0	0	0	111.3	G233 D284 E285 A286	G233-I288 WeakPolarHBondContact CA-O 3.48Å; G233-I288 PolarHBondContact N-O 3.33Å; D284-I288 WeakPolarHBondContact O-CD1 3.42Å; D284-I288 VanDerWaalsContact O-CG1 3.29Å; D284-I288 WeakPolarHBondContact O-CG1 3.2Å; D284-I288 PolarHBondContact O-N 2.88Å; E285-I288 PolarHBondContact O-N 2.89Å; A286-I288 VanDerWaalsContact C-N 3.29Å; A286-I288 PolarHBondContact O-N 3.37Å
289	T	81.7	Confident	87.1	Confident	76 Å²	76	35.7 Å²	35.7	47%	0.466	19%	0.185	S	C	.	.	H	α-helix	trans	-96.9	-33	-163.8	61.6	0	0	0	0	114	G232 E285	G232-T289 WeakPolarHBondContact CA-O 3.41Å; E285-T289 HydrophobicContact CG-CG2 4.19Å; E285-T289 WeakPolarHBondContact O-CB 3.46Å; E285-T289 WeakPolarHBondContact O-CG2 3.3Å; E285-T289 PolarHBondContact O-N 2.81Å; E285-T289 PolarHBondContact O-OG1 3.49Å
290	K	85.3	Confident	87.5	Confident	65 Å²	65	35 Å²	35	28%	0.283	18%	0.18	S	C	.	.	S	Bend	trans	-99.1	160.3	-168.9	-66.5	-172.8	177	-171.5	0	113.9	S188 G232 A286	S188-K290 WeakPolarHBondContact OG-CD 3.46Å; S188-K290 PolarHBondContact OG-NZ 3.15Å; G232-K290 VanDerWaalsContact CA-O 3.24Å; G232-K290 WeakPolarHBondContact CA-O 3.43Å; A286-K290 PolarHBondContact O-N 2.72Å
291	N	88.3	Confident	87.8	Confident	40 Å²	40	32.1 Å²	32.1	21%	0.214	17%	0.166	C	C	.	.			trans	-65.6	154.9	171.2	-67.2	-15.7	0	0	0	110.4	V189 W193 L229 M230 P231 G232	V189-N291 HydrophobicContact CG2-CB 3.93Å; V189-N291 PolarHBondContact N-O 3.16Å; W193-N291 PolarHBondContact O-ND2 3.14Å; L229-N291 HydrophobicContact CD1-CB 4.36Å; M230-N291 WeakPolarHBondContact O-CA 3.37Å; P231-N291 WeakPolarHBondContact CA-OD1 3.14Å; G232-N291 PolarHBondContact N-OD1 3.09Å
292	R	89.4	Confident	88.2	Confident	11 Å²	11	29.5 Å²	29.5	4%	0.042	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	152.5	-178.5	63.7	-168	-180	-77.5	5.5	111.9	T185 A186 F187 M230 P231 L234 E236	T185-R292 HydrophobicContact CG2-CB 3.92Å; T185-R292 HydrophobicContact CG2-CG 4.1Å; A186-R292 CarbonylContact O-C 3.48Å; A186-R292 VanDerWaalsContact O-CA 3.24Å; A186-R292 WeakPolarHBondContact O-CA 3.44Å; A186-R292 VanDerWaalsContact O-CB 3.23Å; A186-R292 WeakPolarHBondContact O-CB 3.42Å; F187-R292 HydrophobicContact CD1-CB 4.17Å; M230-R292 HydrophobicContact CB-CG 3.83Å; M230-R292 PolarHBondContact N-O 3.18Å; M230-R292 PolarHBondContact O-N 2.96Å; P231-R292 PolarHBondContact O-NH1 3.39Å; L234-R292 PolarHBondContact O-NH2 2.8Å; E236-R292 IonicContact OE1-NE 2.74Å
293	V	90.1	Very high	88.2	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.1	173.7	176.5	0	0	0	0	109.8	T185 A186 V189 W193 Y206 H228 L229 W295	T185-V293 CarbonylContact C-O 3.59Å; T185-V293 WeakPolarHBondContact CA-O 3.28Å; T185-V293 WeakPolarHBondContact CG2-O 3.26Å; A186-V293 HydrophobicContact CB-CB 4.47Å; A186-V293 PolarHBondContact N-O 2.83Å; A186-V293 PolarHBondContact O-N 3.13Å; V189-V293 HydrophobicContact CG1-CG2 4.23Å; W193-V293 HydrophobicContact CE3-CG2 3.54Å; W193-V293 HydrophobicContact CZ3-CB 4.36Å; W193-V293 HydrophobicContact CZ3-CG2 3.5Å; Y206-V293 HydrophobicContact CD1-CG1 4.34Å; Y206-V293 HydrophobicContact CD1-CG2 3.92Å; Y206-V293 HydrophobicContact CD2-CG1 3.92Å; Y206-V293 HydrophobicContact CD2-CG2 4.2Å; Y206-V293 HydrophobicContact CE1-CG2 3.94Å; Y206-V293 HydrophobicContact CE2-CG2 4.23Å; Y206-V293 HydrophobicContact CG-CG1 3.73Å; Y206-V293 HydrophobicContact CG-CG2 4.04Å; H228-V293 WeakPolarHBondContact O-CA 3.49Å; L229-V293 HydrophobicContact CB-CG2 4.49Å; L229-V293 HydrophobicContact CD1-CG2 3.75Å; V293-W295 HydrophobicContact CB-CH2 3.95Å; V293-W295 HydrophobicContact CB-CZ3 3.99Å; V293-W295 HydrophobicContact CG1-CD2 4.31Å; V293-W295 HydrophobicContact CG1-CE3 4.09Å; V293-W295 HydrophobicContact CG1-CH2 3.41Å; V293-W295 VanDerWaalsContact CG1-CH2 3.41Å; V293-W295 HydrophobicContact CG1-CZ2 3.68Å; V293-W295 HydrophobicContact CG1-CZ3 3.64Å; V293-W295 WeakPolarHBondContact O-CZ3 3.46Å
294	R	89.1	Confident	88.3	Confident	50 Å²	50	29.4 Å²	29.4	19%	0.189	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.4	-171.9	-177.1	175.6	175.5	177.6	-1.1	110.9	H228 M230 D296	H228-R294 PolarHBondContact N-O 3.24Å; H228-R294 PolarHBondContact O-N 2.86Å; M230-R294 HydrophobicContact CG-CB 4.21Å; R294-D296 IonicContact CZ-OD2 2.65Å; R294-D296 IonicContact NE-OD1 3.39Å; R294-D296 IonicContact NE-OD2 2.72Å; R294-D296 PolarHBondContact NE-OD2 3.44Å; R294-D296 IonicContact NH2-OD2 2.9Å; R294-D296 PolarHBondContact NH2-OD2 2.95Å
295	W	90.8	Very high	88.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-46.3	171.5	-68.6	-95.8	0	0	0	111.4	V183 E184 A186 Y206 F224 G227 V293 T297 L325	V183-W295 HydrophobicContact CG1-CB 4.47Å; V183-W295 HydrophobicContact CG1-CD2 4.17Å; V183-W295 HydrophobicContact CG1-CE3 3.92Å; V183-W295 HydrophobicContact CG1-CG 4.43Å; V183-W295 WeakPolarHBondContact O-CB 3.33Å; E184-W295 PolarHBondContact O-N 3.1Å; A186-W295 HydrophobicContact CB-CH2 4.18Å; A186-W295 HydrophobicContact CB-CZ3 3.7Å; Y206-W295 PolarHBondContact O-NE1 2.92Å; F224-W295 PolarHBondContact O-NE1 3.43Å; F224-W295 VanDerWaalsContact O-NE1 3.14Å; G227-W295 VanDerWaalsContact CA-CD1 3.45Å; G227-W295 VanDerWaalsContact CA-NE1 3.35Å; G227-W295 VanDerWaalsContact N-CD1 3.34Å; V293-W295 HydrophobicContact CB-CH2 3.95Å; V293-W295 HydrophobicContact CB-CZ3 3.99Å; V293-W295 HydrophobicContact CG1-CD2 4.31Å; V293-W295 HydrophobicContact CG1-CE3 4.09Å; V293-W295 HydrophobicContact CG1-CH2 3.41Å; V293-W295 VanDerWaalsContact CG1-CH2 3.41Å; V293-W295 HydrophobicContact CG1-CZ2 3.68Å; V293-W295 HydrophobicContact CG1-CZ3 3.64Å; V293-W295 WeakPolarHBondContact O-CZ3 3.46Å; W295-T297 PolarHBondContact O-N 3.3Å; W295-T297 PolarHBondContact O-OG1 3.02Å; W295-L325 HydrophobicContact CH2-CD1 3.67Å; W295-L325 HydrophobicContact CZ2-CD1 3.98Å
296	D	90.4	Very high	88.3	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	43.7	28.3	-168.9	-68.1	-11	0	0	0	113.9	V183 E184 R240 K242 R243 R294	V183-D296 WeakPolarHBondContact O-CA 3.31Å; V183-D296 PolarHBondContact O-N 3.49Å; V183-D296 VanDerWaalsContact O-N 3.1Å; E184-D296 PolarHBondContact O-N 3.4Å; R240-D296 IonicContact CZ-OD1 2.76Å; R240-D296 IonicContact NH1-OD1 3.85Å; R240-D296 PolarHBondContact NH1-OD1 2.87Å; R240-D296 IonicContact NH1-OD2 2.64Å; R240-D296 IonicContact NH2-OD1 3.3Å; K242-D296 CarbonylContact C-O 3.54Å; K242-D296 WeakPolarHBondContact CA-O 3.44Å; R243-D296 HydrophobicContact CG-CB 4.33Å; R243-D296 PolarHBondContact N-O 3.15Å; R294-D296 IonicContact CZ-OD2 2.65Å; R294-D296 IonicContact NE-OD1 3.39Å; R294-D296 IonicContact NE-OD2 2.72Å; R294-D296 PolarHBondContact NE-OD2 3.44Å; R294-D296 IonicContact NH2-OD2 2.9Å; R294-D296 PolarHBondContact NH2-OD2 2.95Å
297	T	90.8	Very high	88.4	Confident	4 Å²	4	26.2 Å²	26.2	3%	0.025	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	129	-168.9	-63.4	0	0	0	0	109.3	T182 V183 F224 R243 Q247 W295 I299	T182-T297 WeakPolarHBondContact CA-O 3.49Å; V183-T297 PolarHBondContact N-O 3.25Å; V183-T297 VanDerWaalsContact N-O 3.16Å; V183-T297 PolarHBondContact O-N 3.01Å; V183-T297 VanDerWaalsContact O-N 3.15Å; F224-T297 HydrophobicContact CD1-CG2 4.02Å; F224-T297 HydrophobicContact CE1-CG2 4.43Å; F224-T297 WeakPolarHBondContact CE1-O 3.4Å; R243-T297 WeakPolarHBondContact O-CA 3.48Å; Q247-T297 PolarHBondContact NE2-OG1 3.35Å; W295-T297 PolarHBondContact O-N 3.3Å; W295-T297 PolarHBondContact O-OG1 3.02Å; T297-I299 HydrophobicContact CG2-CG1 4.29Å
298	E	92.9	Very high	88.5	Confident	8 Å²	8	25.2 Å²	25.2	4%	0.037	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	120.3	174.1	178.1	-177.1	102.2	0	0	109.1	K180 V181 T182 K242 R243 L257 R300	K180-E298 HydrophobicContact CB-CG 4.13Å; V181-E298 WeakPolarHBondContact O-CA 3.43Å; T182-E298 HydrophobicContact CG2-CB 4.49Å; K242-E298 HydrophobicContact CB-CB 4.4Å; K242-E298 HydrophobicContact CD-CB 4.12Å; K242-E298 VanDerWaalsContact CD-OE2 3.3Å; K242-E298 WeakPolarHBondContact CD-OE2 3.43Å; K242-E298 IonicContact NZ-OE2 3.42Å; K242-E298 PolarHBondContact NZ-OE2 3.22Å; R243-E298 PolarHBondContact O-N 3.46Å; L257-E298 HydrophobicContact CD1-CB 3.72Å; L257-E298 HydrophobicContact CD1-CG 4.24Å; E298-R300 IonicContact OE1-CZ 2.97Å; E298-R300 IonicContact OE1-NE 2.81Å; E298-R300 PolarHBondContact OE1-NE 3.23Å; E298-R300 IonicContact OE1-NH2 3.07Å; E298-R300 PolarHBondContact OE1-NH2 3.4Å
299	I	91.5	Very high	88.6	Confident	4 Å²	4	25 Å²	25	2%	0.021	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.8	171.7	-60.3	179.8	0	0	0	108.2	Q88 K180 V181 L222 M223 F224 P245 T297	Q88-I299 HydrophobicContact CG-CG2 4.07Å; K180-I299 WeakPolarHBondContact CA-O 3.16Å; V181-I299 PolarHBondContact N-O 3.06Å; V181-I299 PolarHBondContact O-N 3.03Å; L222-I299 HydrophobicContact CB-CD1 4.37Å; L222-I299 HydrophobicContact CB-CG2 4.47Å; L222-I299 HydrophobicContact CD2-CG2 3.93Å; M223-I299 VanDerWaalsContact O-CD1 3.28Å; M223-I299 WeakPolarHBondContact O-CD1 3.5Å; F224-I299 HydrophobicContact CD1-CD1 3.8Å; F224-I299 HydrophobicContact CD1-CG1 4.14Å; F224-I299 HydrophobicContact CD2-CD1 4.21Å; F224-I299 HydrophobicContact CE1-CB 4.21Å; F224-I299 HydrophobicContact CE1-CD1 3.57Å; F224-I299 HydrophobicContact CE1-CG1 3.6Å; F224-I299 HydrophobicContact CE2-CD1 3.98Å; F224-I299 HydrophobicContact CG-CD1 4.12Å; F224-I299 HydrophobicContact CZ-CB 4.17Å; F224-I299 HydrophobicContact CZ-CD1 3.66Å; F224-I299 HydrophobicContact CZ-CG1 3.92Å; P245-I299 HydrophobicContact CB-CG1 4.32Å; T297-I299 HydrophobicContact CG2-CG1 4.29Å
300	R	91.2	Very high	88.8	Confident	24 Å²	24	23.9 Å²	23.9	9%	0.091	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.3	177.5	-60.5	178.1	-178.4	163.4	1.6	108.6	L87 Q88 M179 K180 E298	L87-R300 HydrophobicContact CB-CB 3.96Å; L87-R300 HydrophobicContact CD1-CB 4.43Å; Q88-R300 VanDerWaalsContact CG-O 3.22Å; Q88-R300 WeakPolarHBondContact CG-O 3.38Å; Q88-R300 PolarHBondContact NE2-O 3.34Å; Q88-R300 VanDerWaalsContact NE2-O 3.15Å; M179-R300 CarbonylContact O-C 3.58Å; M179-R300 WeakPolarHBondContact O-CA 3.34Å; K180-R300 HydrophobicContact CG-CG 4.16Å; E298-R300 IonicContact OE1-CZ 2.97Å; E298-R300 IonicContact OE1-NE 2.81Å; E298-R300 PolarHBondContact OE1-NE 3.23Å; E298-R300 IonicContact OE1-NH2 3.07Å; E298-R300 PolarHBondContact OE1-NH2 3.4Å
301	C	89.3	Confident	88.8	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.007	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.1	176.7	49.4	0	0	0	0	110.6	I178 M179 V212 L222	I178-C301 WeakPolarHBondContact CA-O 3.18Å; M179-C301 VanDerWaalsContact CB-SG 3.53Å; M179-C301 PolarHBondContact N-O 3.41Å; M179-C301 PolarHBondContact O-N 3.1Å; M179-C301 PolarHBondContact O-SG 2.66Å; M179-C301 VanDerWaalsContact O-SG 3.38Å; V212-C301 HydrophobicContact CG2-CB 4.38Å; L222-C301 HydrophobicContact CD2-CB 4.12Å
302	F	90.8	Very high	88.5	Confident	9 Å²	9	23.4 Å²	23.4	4%	0.039	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134.1	176.2	179.1	-97.1	0	0	0	109.3	A80 F83 L87 L168 C176 L214 D304	A80-F302 HydrophobicContact CB-CD1 4.12Å; A80-F302 HydrophobicContact CB-CE1 4.24Å; F83-F302 HydrophobicContact CB-CB 4.2Å; F83-F302 HydrophobicContact CB-CD1 4.12Å; F83-F302 HydrophobicContact CB-CD2 4.21Å; F83-F302 HydrophobicContact CB-CG 3.91Å; F83-F302 HydrophobicContact CD2-CD1 4.17Å; F83-F302 AromaticContact CD2-CE1 3.83Å; F83-F302 HydrophobicContact CD2-CE1 3.83Å; F83-F302 HydrophobicContact CD2-CE2 4.37Å; F83-F302 AromaticContact CD2-CZ 3.93Å; F83-F302 HydrophobicContact CD2-CZ 3.93Å; L87-F302 HydrophobicContact CD1-CB 3.91Å; L168-F302 HydrophobicContact CD1-CE2 4.04Å; L168-F302 HydrophobicContact CD2-CE2 4.1Å; L168-F302 HydrophobicContact CD2-CZ 4.01Å; C176-F302 HydrophobicContact CB-CE2 3.69Å; C176-F302 HydrophobicContact CB-CZ 3.89Å; L214-F302 WeakPolarHBondContact CD1-O 3.49Å; F302-D304 HydrophobicContact CE1-CB 4.06Å
303	L	89.7	Confident	88	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122	169.9	-64.9	94.3	0	0	0	108.5	C176 I177 M179 A307 L311	C176-L303 WeakPolarHBondContact CA-O 3.45Å; I177-L303 HydrophobicContact CB-CB 4.3Å; I177-L303 PolarHBondContact N-O 3.45Å; I177-L303 PolarHBondContact O-N 3.05Å; M179-L303 HydrophobicContact CB-CD1 3.34Å; M179-L303 HydrophobicContact CG-CD1 4.41Å; M179-L303 HydrophobicContact SD-CD1 4.23Å; L303-A307 HydrophobicContact CB-CB 4.01Å; L303-A307 HydrophobicContact CD2-CB 4.34Å; L303-A307 HydrophobicContact CG-CB 4.45Å; L303-L311 HydrophobicContact CD2-CB 4.31Å; L303-L311 HydrophobicContact CD2-CD2 3.76Å
304	D	87.9	Confident	87.4	Confident	41 Å²	41	31.4 Å²	31.4	22%	0.219	16%	0.164	C	C	.	.			trans	-70	174.3	168.4	72.4	16.3	0	0	0	111.2	F302 C306 A307 A308	F302-D304 HydrophobicContact CE1-CB 4.06Å; D304-C306 PolarHBondContact O-N 3.49Å; D304-C306 PolarHBondContact OD1-N 2.92Å; D304-C306 VanDerWaalsContact OD1-N 3.09Å; D304-A307 PolarHBondContact O-N 3.03Å; D304-A307 WeakPolarHBondContact OD1-CB 3.38Å; D304-A307 PolarHBondContact OD1-N 3.43Å; D304-A308 PolarHBondContact O-N 3.22Å
305	A	85.9	Confident	86.9	Confident	42 Å²	42	29 Å²	29	35%	0.347	16%	0.155	S	C	.	.	H	α-helix	trans	-59.1	-37.6	-178.5	0	0	0	0	0	112.4	S309	A305-S309 PolarHBondContact O-N 3.07Å; A305-S309 VanDerWaalsContact O-N 3.15Å; A305-S309 PolarHBondContact O-OG 3.08Å
306	C	86.4	Confident	85.9	Confident	72 Å²	72	32.1 Å²	32.1	49%	0.486	17%	0.174	S	C	.	.	H	α-helix	trans	-73	-37.1	179.9	-62.6	0	0	0	0	112.1	A216 D304 S309 R310	A216-C306 HydrophobicContact CB-CB 3.86Å; D304-C306 PolarHBondContact O-N 3.49Å; D304-C306 PolarHBondContact OD1-N 2.92Å; D304-C306 VanDerWaalsContact OD1-N 3.09Å; C306-S309 PolarHBondContact O-N 3.37Å; C306-R310 WeakPolarHBondContact O-CB 3.4Å; C306-R310 PolarHBondContact O-N 2.71Å
307	A	86.8	Confident	84.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.6	-37.9	174.8	0	0	0	0	0	111.3	P213 L214 L303 D304 R310 L311	P213-A307 HydrophobicContact CB-CB 4.2Å; L214-A307 WeakPolarHBondContact O-CB 3.46Å; L303-A307 HydrophobicContact CB-CB 4.01Å; L303-A307 HydrophobicContact CD2-CB 4.34Å; L303-A307 HydrophobicContact CG-CB 4.45Å; D304-A307 PolarHBondContact O-N 3.03Å; D304-A307 WeakPolarHBondContact OD1-CB 3.38Å; D304-A307 PolarHBondContact OD1-N 3.43Å; A307-R310 PolarHBondContact O-N 3.34Å; A307-L311 VanDerWaalsContact O-CB 3.24Å; A307-L311 WeakPolarHBondContact O-CB 3.5Å; A307-L311 PolarHBondContact O-N 3.4Å
308	A	87.9	Confident	84.1	Confident	10 Å²	10	36.8 Å²	36.8	8%	0.083	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-45.7	172	0	0	0	0	0	111.5	I177 D304 L311 K312 L482	I177-A308 HydrophobicContact CD1-CB 3.65Å; I177-A308 HydrophobicContact CG1-CB 4.18Å; D304-A308 PolarHBondContact O-N 3.22Å; A308-L311 PolarHBondContact O-N 3.11Å; A308-K312 WeakPolarHBondContact O-CB 3.36Å; A308-K312 PolarHBondContact O-N 2.97Å; A308-L482 HydrophobicContact CB-CD1 4.26Å
309	S	84.6	Confident	83.2	Confident	67 Å²	67	38.9 Å²	38.9	47%	0.469	21%	0.208	S	C	.	.	H	α-helix	trans	-60.3	-45.4	173.5	-68.5	0	0	0	0	112.3	A305 C306 L311 K312 E313	A305-S309 PolarHBondContact O-N 3.07Å; A305-S309 VanDerWaalsContact O-N 3.15Å; A305-S309 PolarHBondContact O-OG 3.08Å; C306-S309 PolarHBondContact O-N 3.37Å; S309-L311 PolarHBondContact O-N 3.06Å; S309-K312 VanDerWaalsContact O-CB 3.29Å; S309-K312 WeakPolarHBondContact O-CB 3.36Å; S309-K312 PolarHBondContact O-N 3.17Å; S309-E313 WeakPolarHBondContact O-CG 3.44Å; S309-E313 PolarHBondContact O-N 3.01Å
310	R	85.8	Confident	82.7	Confident	54 Å²	54	41.2 Å²	41.2	20%	0.204	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-35.9	178.4	-175.4	169.2	172.7	-128.5	-7.3	112.8	T215 A216 D219 C306 A307 K312 E313 K314	T215-R310 PolarHBondContact O-NH1 3Å; A216-R310 WeakPolarHBondContact O-CD 3.44Å; A216-R310 PolarHBondContact O-NE 3.49Å; A216-R310 PolarHBondContact O-NH1 3.18Å; D219-R310 IonicContact OD1-CZ 3.52Å; D219-R310 VanDerWaalsContact OD1-CZ 3.25Å; D219-R310 IonicContact OD1-NH1 2.64Å; D219-R310 PolarHBondContact OD1-NH1 3.19Å; D219-R310 IonicContact OD1-NH2 3.94Å; D219-R310 PolarHBondContact OD1-NH2 3.17Å; D219-R310 IonicContact OD2-CZ 3.59Å; D219-R310 IonicContact OD2-NH2 3.06Å; D219-R310 PolarHBondContact OD2-NH2 3.28Å; D219-R310 VanDerWaalsContact OD2-NH2 3.17Å; C306-R310 WeakPolarHBondContact O-CB 3.4Å; C306-R310 PolarHBondContact O-N 2.71Å; A307-R310 PolarHBondContact O-N 3.34Å; R310-K312 VanDerWaalsContact C-N 3.32Å; R310-E313 PolarHBondContact O-N 2.77Å; R310-K314 WeakPolarHBondContact O-CB 3.28Å; R310-K314 WeakPolarHBondContact O-CG 3.46Å; R310-K314 PolarHBondContact O-N 2.99Å
311	L	86.1	Confident	82.5	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.5	-43.9	172	178.8	63.6	0	0	0	110	P213 L303 A307 A308 S309 K314 I315 W321	P213-L311 HydrophobicContact CG-CB 4.2Å; P213-L311 HydrophobicContact CG-CD1 4.33Å; L303-L311 HydrophobicContact CD2-CB 4.31Å; L303-L311 HydrophobicContact CD2-CD2 3.76Å; A307-L311 VanDerWaalsContact O-CB 3.24Å; A307-L311 WeakPolarHBondContact O-CB 3.5Å; A307-L311 PolarHBondContact O-N 3.4Å; A308-L311 PolarHBondContact O-N 3.11Å; S309-L311 PolarHBondContact O-N 3.06Å; L311-K314 PolarHBondContact O-N 2.99Å; L311-I315 HydrophobicContact CD1-CD1 3.9Å; L311-I315 HydrophobicContact CD1-CG1 4.19Å; L311-I315 HydrophobicContact CG-CD1 3.81Å; L311-I315 HydrophobicContact CG-CG1 4.48Å; L311-I315 WeakPolarHBondContact O-CG1 3.37Å; L311-I315 PolarHBondContact O-N 3.47Å; L311-W321 HydrophobicContact CD1-CH2 3.85Å; L311-W321 HydrophobicContact CD1-CZ2 4.48Å; L311-W321 HydrophobicContact CD1-CZ3 3.99Å
312	K	82.3	Confident	82.3	Confident	95 Å²	95	42 Å²	42	41%	0.413	23%	0.226	S	C	.	.	H	α-helix	trans	-59.5	-46.8	175.7	-166.8	-169.5	175.7	-177	0	111.9	A308 S309 R310 T316 L356 L482	A308-K312 WeakPolarHBondContact O-CB 3.36Å; A308-K312 PolarHBondContact O-N 2.97Å; S309-K312 VanDerWaalsContact O-CB 3.29Å; S309-K312 WeakPolarHBondContact O-CB 3.36Å; S309-K312 PolarHBondContact O-N 3.17Å; R310-K312 VanDerWaalsContact C-N 3.32Å; K312-T316 WeakPolarHBondContact O-CB 3.41Å; K312-T316 PolarHBondContact O-N 3.35Å; K312-T316 PolarHBondContact O-OG1 2.9Å; K312-L356 HydrophobicContact CB-CD2 4.28Å; K312-L356 HydrophobicContact CG-CD2 3.4Å; K312-L482 HydrophobicContact CB-CD1 4.44Å; K312-L482 HydrophobicContact CB-CD2 3.98Å; K312-L482 HydrophobicContact CB-CG 4.22Å; K312-L482 HydrophobicContact CG-CD2 4.23Å; K312-L482 HydrophobicContact CG-CG 4.37Å
313	E	78.8	Confident	82.2	Confident	121 Å²	121	41.8 Å²	41.8	57%	0.565	23%	0.225	S	C	*	.	H	α-helix	trans	-61.5	-50.4	176.1	-72.6	169.7	-173.8	0	0	111.3	S309 R310 I315 T316 D317	S309-E313 WeakPolarHBondContact O-CG 3.44Å; S309-E313 PolarHBondContact O-N 3.01Å; R310-E313 PolarHBondContact O-N 2.77Å; E313-I315 VanDerWaalsContact C-N 3.34Å; E313-I315 PolarHBondContact O-N 2.91Å; E313-T316 WeakPolarHBondContact O-CA 3.47Å; E313-T316 WeakPolarHBondContact O-CB 3.45Å; E313-T316 PolarHBondContact O-N 2.89Å; E313-D317 PolarHBondContact O-N 2.74Å
314	K	77.3	Confident	82.1	Confident	57 Å²	57	42.2 Å²	42.2	25%	0.248	23%	0.227	C	C	.	.	H	α-helix	trans	-59.1	-40.6	178.5	-77.4	-173.8	172.6	-178.3	0	112.9	P213 D219 R310 L311 T316 D317 S318 W321	P213-K314 HydrophobicContact CG-CD 4.36Å; D219-K314 IonicContact OD1-NZ 4Å; D219-K314 IonicContact OD2-NZ 3.1Å; D219-K314 PolarHBondContact OD2-NZ 3.1Å; R310-K314 WeakPolarHBondContact O-CB 3.28Å; R310-K314 WeakPolarHBondContact O-CG 3.46Å; R310-K314 PolarHBondContact O-N 2.99Å; L311-K314 PolarHBondContact O-N 2.99Å; K314-T316 VanDerWaalsContact C-N 3.29Å; K314-D317 PolarHBondContact O-N 3.1Å; K314-S318 PolarHBondContact O-N 3.4Å; K314-S318 VanDerWaalsContact O-O 3.1Å; K314-W321 HydrophobicContact CB-CH2 4.02Å; K314-W321 HydrophobicContact CB-CZ3 3.73Å; K314-W321 HydrophobicContact CD-CH2 3.69Å; K314-W321 HydrophobicContact CD-CZ3 4.24Å
315	I	77.9	Confident	82.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.9	-33.2	176	-62.6	165.2	0	0	0	111	L311 E313 S318 R319 W321 M352 L356 L482	L311-I315 HydrophobicContact CD1-CD1 3.9Å; L311-I315 HydrophobicContact CD1-CG1 4.19Å; L311-I315 HydrophobicContact CG-CD1 3.81Å; L311-I315 HydrophobicContact CG-CG1 4.48Å; L311-I315 WeakPolarHBondContact O-CG1 3.37Å; L311-I315 PolarHBondContact O-N 3.47Å; E313-I315 VanDerWaalsContact C-N 3.34Å; E313-I315 PolarHBondContact O-N 2.91Å; I315-S318 WeakPolarHBondContact CA-O 3.34Å; I315-S318 CarbonylContact O-C 3.5Å; I315-R319 PolarHBondContact O-N 3.41Å; I315-W321 HydrophobicContact CG1-CZ3 4.37Å; I315-M352 HydrophobicContact CD1-CB 3.97Å; I315-M352 HydrophobicContact CD1-SD 4.38Å; I315-M352 HydrophobicContact CG1-CB 3.91Å; I315-M352 HydrophobicContact CG1-SD 4.46Å; I315-M352 HydrophobicContact CG2-CB 4.12Å; I315-L356 HydrophobicContact CB-CD1 4.1Å; I315-L356 HydrophobicContact CB-CG 4.34Å; I315-L356 HydrophobicContact CG2-CD1 3.54Å; I315-L356 HydrophobicContact CG2-CD2 4.48Å; I315-L356 HydrophobicContact CG2-CG 3.81Å; I315-L482 HydrophobicContact CD1-CD2 4.03Å
316	T	69.8	Low	82	Confident	65 Å²	65	38.6 Å²	38.6	40%	0.399	20%	0.202	S	C	.	.	H	α-helix	trans	-67.4	-42.3	176.8	-54.8	0	0	0	0	110.7	K312 E313 K314 F820	K312-T316 WeakPolarHBondContact O-CB 3.41Å; K312-T316 PolarHBondContact O-N 3.35Å; K312-T316 PolarHBondContact O-OG1 2.9Å; E313-T316 WeakPolarHBondContact O-CA 3.47Å; E313-T316 WeakPolarHBondContact O-CB 3.45Å; E313-T316 PolarHBondContact O-N 2.89Å; K314-T316 VanDerWaalsContact C-N 3.29Å; T316-F820 HydrophobicContact CG2-CE2 3.82Å; T316-F820 HydrophobicContact CG2-CZ 4.35Å
317	D	69.8	Low	81.9	Confident	87 Å²	87	36.5 Å²	36.5	47%	0.465	18%	0.184	S	C	.	.	H	α-helix	trans	-73	-37.7	178.8	-67.4	-13	0	0	0	112.7	E313 K314	E313-D317 PolarHBondContact O-N 2.74Å; K314-D317 PolarHBondContact O-N 3.1Å
318	S	73.6	Confident	81.4	Confident	16 Å²	16	37 Å²	37	11%	0.112	19%	0.187	C	C	.	.			trans	-146.3	115.4	176.2	-175.2	0	0	0	0	111	K314 I315 L320	K314-S318 PolarHBondContact O-N 3.4Å; K314-S318 VanDerWaalsContact O-O 3.1Å; I315-S318 WeakPolarHBondContact CA-O 3.34Å; I315-S318 CarbonylContact O-C 3.5Å; S318-L320 PolarHBondContact O-N 3.25Å
319	R	74.2	Confident	80.3	Confident	52 Å²	52	40.3 Å²	40.3	20%	0.196	21%	0.209	C	C	.	.	S	Bend	trans	-64.4	-31.9	176.8	-70	-172.7	179.7	-156.4	-0.8	112.7	I315 W321 D351 M352 A819 F820 E823	I315-R319 PolarHBondContact O-N 3.41Å; R319-W321 PolarHBondContact O-N 2.92Å; R319-D351 WeakPolarHBondContact O-CA 3.43Å; R319-M352 PolarHBondContact O-N 3.25Å; R319-A819 PolarHBondContact NH2-O 3.4Å; R319-F820 HydrophobicContact CG-CE1 3.9Å; R319-F820 HydrophobicContact CG-CZ 4.32Å; R319-E823 IonicContact NH1-OE2 3.93Å
320	L	81.4	Confident	79.3	Confident	53 Å²	53	40.9 Å²	40.9	28%	0.277	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	109	-170.2	-63.4	-177.5	0	0	0	110.6	S318 F349 D351 K380	S318-L320 PolarHBondContact O-N 3.25Å; L320-F349 HydrophobicContact CB-CB 4.12Å; L320-F349 HydrophobicContact CB-CD1 4.01Å; L320-F349 HydrophobicContact CB-CG 4.43Å; L320-F349 HydrophobicContact CD1-CB 4.39Å; L320-F349 HydrophobicContact CD2-CB 4.19Å; L320-F349 HydrophobicContact CG-CB 4.46Å; L320-D351 HydrophobicContact CD2-CB 4.36Å; L320-K380 HydrophobicContact CD1-CB 4.44Å
321	W	85.9	Confident	77.9	Confident	19 Å²	19	42.1 Å²	42.1	7%	0.072	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	119.4	178.1	-153.6	-87.2	0	0	0	111.2	E211 P213 L311 K314 I315 R319 V350 M352	E211-W321 VanDerWaalsContact O-CE2 3.28Å; E211-W321 VanDerWaalsContact O-CZ2 3.22Å; E211-W321 WeakPolarHBondContact O-CZ2 3.4Å; E211-W321 PolarHBondContact O-NE1 3.39Å; P213-W321 HydrophobicContact CG-CH2 4.4Å; L311-W321 HydrophobicContact CD1-CH2 3.85Å; L311-W321 HydrophobicContact CD1-CZ2 4.48Å; L311-W321 HydrophobicContact CD1-CZ3 3.99Å; K314-W321 HydrophobicContact CB-CH2 4.02Å; K314-W321 HydrophobicContact CB-CZ3 3.73Å; K314-W321 HydrophobicContact CD-CH2 3.69Å; K314-W321 HydrophobicContact CD-CZ3 4.24Å; I315-W321 HydrophobicContact CG1-CZ3 4.37Å; R319-W321 PolarHBondContact O-N 2.92Å; W321-V350 HydrophobicContact CB-CB 4.41Å; W321-V350 PolarHBondContact N-O 3.4Å; W321-V350 PolarHBondContact O-N 3.21Å; W321-M352 HydrophobicContact CB-CE 3.63Å; W321-M352 HydrophobicContact CB-CG 3.9Å; W321-M352 HydrophobicContact CB-SD 3.84Å; W321-M352 HydrophobicContact CD2-CE 3.9Å; W321-M352 HydrophobicContact CD2-SD 3.75Å; W321-M352 HydrophobicContact CE3-SD 3.86Å; W321-M352 HydrophobicContact CG-CE 3.41Å; W321-M352 VanDerWaalsContact CG-CE 3.41Å; W321-M352 HydrophobicContact CG-CG 4.47Å; W321-M352 HydrophobicContact CG-SD 3.76Å
322	P	86.6	Confident	76.4	Confident	23 Å²	23	44.2 Å²	44.2	15%	0.149	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	136.8	-176.9	28.7	-33.4	0	0	0	112.2	L347 I348 F349 L377 V381	P322-L347 HydrophobicContact CB-CD1 3.93Å; P322-I348 CarbonylContact C-O 3.5Å; P322-I348 WeakPolarHBondContact CA-O 3.46Å; P322-F349 HydrophobicContact CB-CE1 4.46Å; P322-L377 HydrophobicContact CB-CD1 3.86Å; P322-L377 HydrophobicContact CG-CD1 4.23Å; P322-V381 HydrophobicContact CG-CG2 4.47Å
323	V	88	Confident	74.8	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.018	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.8	171.1	-175	0	0	0	0	108.2	A209 L210 I348 V350 I474	A209-V323 CarbonylContact O-C 3.59Å; A209-V323 WeakPolarHBondContact O-CA 3.26Å; A209-V323 WeakPolarHBondContact O-CG1 2.95Å; L210-V323 HydrophobicContact CB-CB 4.44Å; L210-V323 HydrophobicContact CB-CG1 4.34Å; L210-V323 HydrophobicContact CB-CG2 4Å; L210-V323 HydrophobicContact CD2-CG1 4.45Å; L210-V323 HydrophobicContact CD2-CG2 4.46Å; V323-I348 HydrophobicContact CB-CB 4.17Å; V323-I348 PolarHBondContact N-O 3.12Å; V323-I348 PolarHBondContact O-N 3.02Å; V323-V350 HydrophobicContact CG2-CG2 3.78Å; V323-I474 HydrophobicContact CB-CD1 4.43Å; V323-I474 HydrophobicContact CG1-CD1 4.3Å; V323-I474 HydrophobicContact CG2-CD1 4.15Å
324	E	88.2	Confident	73.3	Confident	9 Å²	9	47.6 Å²	47.6	4%	0.042	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	138.2	178.9	-66.6	179.1	-176.1	0	0	110.3	A208 A209 L347 I396 I397	A208-E324 CarbonylContact C-O 3.54Å; A208-E324 VanDerWaalsContact CA-O 3.23Å; A208-E324 WeakPolarHBondContact CA-O 3.49Å; A209-E324 PolarHBondContact N-O 3.22Å; A209-E324 PolarHBondContact O-N 3.4Å; E324-L347 HydrophobicContact CG-CD1 4.36Å; E324-I396 PolarHBondContact OE1-N 3.03Å; E324-I396 PolarHBondContact OE2-N 3.47Å; E324-I397 HydrophobicContact CB-CD1 3.53Å; E324-I397 HydrophobicContact CB-CG1 4.1Å; E324-I397 VanDerWaalsContact OE2-CG1 3.26Å; E324-I397 WeakPolarHBondContact OE2-CG1 3.4Å; E324-I397 PolarHBondContact OE2-N 3.41Å
325	L	86.4	Confident	72.1	Confident	2 Å²	2	47 Å²	47	1%	0.01	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.2	175.4	-173	74.7	0	0	0	109.6	F207 A208 W295 G346 I348 V369 Y465	F207-L325 WeakPolarHBondContact O-CA 3.42Å; F207-L325 WeakPolarHBondContact O-CD1 3.32Å; A208-L325 HydrophobicContact CB-CD1 4.11Å; W295-L325 HydrophobicContact CH2-CD1 3.67Å; W295-L325 HydrophobicContact CZ2-CD1 3.98Å; L325-G346 PolarHBondContact N-O 3.2Å; L325-G346 PolarHBondContact O-N 3.39Å; L325-I348 HydrophobicContact CB-CD1 4.43Å; L325-V369 HydrophobicContact CD2-CG1 4.08Å; L325-V369 HydrophobicContact CD2-CG2 4.15Å; L325-Y465 HydrophobicContact CD2-CE1 3.91Å
326	M	84.5	Confident	70.4	Confident	6 Å²	6	49.8 Å²	49.8	3%	0.03	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	163.5	174	73	166.7	-175	0	0	114.3	F207 L332 I342 F344 I397 I401	F207-M326 HydrophobicContact CB-CE 3.72Å; F207-M326 HydrophobicContact CB-CG 3.76Å; F207-M326 HydrophobicContact CD1-CE 4.17Å; F207-M326 HydrophobicContact CD2-CE 3.38Å; F207-M326 HydrophobicContact CD2-CG 4.1Å; F207-M326 HydrophobicContact CE2-CE 4.04Å; F207-M326 HydrophobicContact CG-CE 3.47Å; F207-M326 VanDerWaalsContact CG-CE 3.47Å; F207-M326 HydrophobicContact CG-CG 4.31Å; F207-M326 PolarHBondContact N-O 2.77Å; F207-M326 PolarHBondContact O-N 3.04Å; M326-L332 HydrophobicContact CE-CD2 3.61Å; M326-I342 HydrophobicContact CB-CG2 3.62Å; M326-I342 HydrophobicContact CG-CG2 4.26Å; M326-I342 HydrophobicContact SD-CG2 3.66Å; M326-F344 WeakPolarHBondContact CA-O 3.49Å; M326-I397 HydrophobicContact CB-CD1 4.42Å; M326-I397 HydrophobicContact CE-CG2 3.38Å; M326-I397 HydrophobicContact CG-CD1 3.96Å; M326-I397 HydrophobicContact SD-CD1 4.23Å; M326-I397 HydrophobicContact SD-CG2 3.61Å; M326-I401 HydrophobicContact CE-CD1 4.34Å
327	R	84.2	Confident	69.1	Low	28 Å²	28	51.4 Å²	51.4	11%	0.106	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	128.7	171.9	-179.4	-169.3	79.3	168	14.5	110.8	W193 F204 A205 Y206 P343 F344	W193-R327 HydrophobicContact CH2-CB 4.08Å; W193-R327 HydrophobicContact CZ2-CB 3.64Å; W193-R327 HydrophobicContact CZ2-CG 4.21Å; W193-R327 VanDerWaalsContact NE1-NH1 3.12Å; F204-R327 HydrophobicContact CB-CG 4Å; F204-R327 HydrophobicContact CD1-CG 4.45Å; F204-R327 HydrophobicContact CG-CG 4.42Å; A205-R327 WeakPolarHBondContact O-CA 3.37Å; Y206-R327 HydrophobicContact CD1-CB 4.12Å; Y206-R327 HydrophobicContact CD1-CG 3.83Å; Y206-R327 HydrophobicContact CE1-CB 4.36Å; Y206-R327 HydrophobicContact CE1-CG 3.66Å; R327-P343 PolarHBondContact N-O 2.72Å; R327-P343 VanDerWaalsContact O-CG 3.29Å; R327-P343 WeakPolarHBondContact O-CG 3.44Å; R327-F344 HydrophobicContact CB-CB 3.99Å; R327-F344 HydrophobicContact CB-CD2 4.44Å; R327-F344 HydrophobicContact CB-CG 4.29Å; R327-F344 VanDerWaalsContact NH2-CZ 3.32Å
328	T	75.7	Confident	67.7	Low	11 Å²	11	55.5 Å²	55.5	7%	0.067	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149.9	174.2	178.2	0	0	0	0	113.2	F204 A205 F207 I330	F204-T328 WeakPolarHBondContact CA-O 3.34Å; A205-T328 PolarHBondContact N-O 3.05Å; A205-T328 PolarHBondContact O-N 2.86Å; F207-T328 HydrophobicContact CD2-CG2 4.05Å; F207-T328 HydrophobicContact CE2-CG2 3.41Å; F207-T328 VanDerWaalsContact CE2-CG2 3.41Å; F207-T328 HydrophobicContact CZ-CG2 4.32Å; T328-I330 WeakPolarHBondContact CG2-O 3.41Å; T328-I330 PolarHBondContact OG1-N 2.85Å; T328-I330 VanDerWaalsContact OG1-N 3.1Å; T328-I330 PolarHBondContact OG1-O 2.78Å
329	S	66.6	Low	66.5	Low	78 Å²	78	61.2 Å²	61.2	55%	0.545	33%	0.33	S	S	.	.	S	Bend	trans	-90.1	-11.1	171.9	56.7	0	0	0	0	113.4
330	I	61.7	Low	65.6	Low	79 Å²	79	60 Å²	60	41%	0.405	33%	0.329	S	S	.	.	S	Bend	trans	-111.8	134.5	-175	-54.9	176.8	0	0	0	109.3	T328 L332 R334	T328-I330 WeakPolarHBondContact CG2-O 3.41Å; T328-I330 PolarHBondContact OG1-N 2.85Å; T328-I330 VanDerWaalsContact OG1-N 3.1Å; T328-I330 PolarHBondContact OG1-O 2.78Å; I330-L332 PolarHBondContact O-N 2.9Å; I330-R334 HydrophobicContact CG2-CB 3.78Å
331	P	56.8	Low	64.5	Low	81 Å²	81	64.5 Å²	64.5	53%	0.526	35%	0.349	S	S	.	.			trans	-57.5	133.9	172.1	-22.7	32.5	0	0	0	111.7	S333 R334	P331-S333 PolarHBondContact O-N 2.98Å; P331-R334 PolarHBondContact O-N 3.16Å
332	L	55.3	Low	63.7	Low	43 Å²	43	64.6 Å²	64.6	23%	0.225	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-43.5	-36.3	-175.2	-68.1	159.5	0	0	0	114.1	F207 M223 M326 I330 R334 L335 I401	F207-L332 HydrophobicContact CD1-CD1 4.01Å; F207-L332 HydrophobicContact CD1-CD2 4.49Å; F207-L332 HydrophobicContact CE1-CD1 3.26Å; F207-L332 HydrophobicContact CE1-CD2 4.15Å; F207-L332 HydrophobicContact CE1-CG 3.84Å; F207-L332 HydrophobicContact CZ-CD1 3.73Å; F207-L332 HydrophobicContact CZ-CD2 4.16Å; F207-L332 HydrophobicContact CZ-CG 3.8Å; M223-L332 HydrophobicContact SD-CD1 4.18Å; M326-L332 HydrophobicContact CE-CD2 3.61Å; I330-L332 PolarHBondContact O-N 2.9Å; L332-R334 PolarHBondContact O-N 3.15Å; L332-L335 PolarHBondContact O-N 3Å; L332-I401 HydrophobicContact CB-CG1 4.44Å; L332-I401 HydrophobicContact CD2-CD1 3.32Å; L332-I401 HydrophobicContact CD2-CG1 3.44Å; L332-I401 VanDerWaalsContact CD2-CG1 3.44Å; L332-I401 HydrophobicContact CG-CG1 4.42Å
333	S	49.3	Very low	62.9	Low	86 Å²	86	65.6 Å²	65.6	60%	0.601	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-57.4	-13.6	178.5	60.9	0	0	0	0	116.7	P331	P331-S333 PolarHBondContact O-N 2.98Å
334	R	47.3	Very low	62.4	Low	201 Å²	201	65.7 Å²	65.7	76%	0.758	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-114.1	3.4	-175.8	-66.9	-174.6	-179	178.5	0.7	114.6	I330 P331 L332 G336	I330-R334 HydrophobicContact CG2-CB 3.78Å; P331-R334 PolarHBondContact O-N 3.16Å; L332-R334 PolarHBondContact O-N 3.15Å; R334-G336 PolarHBondContact O-N 3.1Å
335	L	51.4	Low	62.2	Low	45 Å²	45	65.5 Å²	65.5	24%	0.236	36%	0.356	C	S	.	.			trans	-77.3	108.9	171	-122	78	0	0	0	108.4	L332 P340	L332-L335 PolarHBondContact O-N 3Å; L335-P340 HydrophobicContact CD2-CB 3.94Å; L335-P340 HydrophobicContact CD2-CG 3.82Å; L335-P340 HydrophobicContact CG-CB 4.26Å; L335-P340 HydrophobicContact CG-CG 4.4Å
336	G	41.1	Very low	62.1	Low	58 Å²	58	65.4 Å²	65.4	60%	0.598	36%	0.355	S	S	*	.			trans	-111.4	131.2	-170	0	0	0	0	0	115.5	R334 E338	R334-G336 PolarHBondContact O-N 3.1Å; G336-E338 PolarHBondContact O-N 2.88Å
337	D	42.8	Very low	62.3	Low	100 Å²	100	65.1 Å²	65.1	54%	0.535	35%	0.354	S	S	.	.	S	Bend	trans	48.6	-8.5	146.6	-74.2	-29.8	0	0	0	125
338	E	41.6	Very low	62.5	Low	173 Å²	173	63.9 Å²	63.9	81%	0.808	35%	0.35	S	S	*	.	S	Bend	trans	-140	128.7	164.5	-71.5	-155.5	178.1	0	0	112	G336 P340	G336-E338 PolarHBondContact O-N 2.88Å; E338-P340 VanDerWaalsContact O-CD 3.3Å; E338-P340 WeakPolarHBondContact O-CD 3.2Å
339	N	48.6	Very low	63.1	Low	135 Å²	135	63.5 Å²	63.5	72%	0.722	35%	0.347	S	S	*	.			trans	-4.3	81.4	-178.6	-77.1	-12.3	0	0	0	115.3	E341	N339-E341 PolarHBondContact O-N 2.85Å
340	P	54.2	Low	64.1	Low	28 Å²	28	59.9 Å²	59.9	18%	0.182	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-75	122.3	-179.7	28.5	-30.3	0	0	0	108.9	L335 E338 I342 Y398	L335-P340 HydrophobicContact CD2-CB 3.94Å; L335-P340 HydrophobicContact CD2-CG 3.82Å; L335-P340 HydrophobicContact CG-CB 4.26Å; L335-P340 HydrophobicContact CG-CG 4.4Å; E338-P340 VanDerWaalsContact O-CD 3.3Å; E338-P340 WeakPolarHBondContact O-CD 3.2Å; P340-I342 PolarHBondContact O-N 3.14Å; P340-Y398 HydrophobicContact CG-CD2 3.74Å; P340-Y398 HydrophobicContact CG-CE2 3.44Å; P340-Y398 VanDerWaalsContact CG-CE2 3.44Å
341	E	59.3	Low	65.2	Low	146 Å²	146	58.7 Å²	58.7	68%	0.682	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-58.4	121.4	166.5	-74.2	173.4	-177.3	0	0	108.3	N339 P343 K457	N339-E341 PolarHBondContact O-N 2.85Å; E341-P343 VanDerWaalsContact O-CD 3.27Å; E341-P343 WeakPolarHBondContact O-CD 3.23Å; E341-K457 IonicContact OE1-NZ 3.31Å; E341-K457 PolarHBondContact OE1-NZ 3.37Å
342	I	67.8	Low	66.5	Low	21 Å²	21	55 Å²	55	11%	0.108	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-80.4	116.2	-177.7	-60.9	174.6	0	0	0	107.9	M326 P340 H345 Y395	M326-I342 HydrophobicContact CB-CG2 3.62Å; M326-I342 HydrophobicContact CG-CG2 4.26Å; M326-I342 HydrophobicContact SD-CG2 3.66Å; P340-I342 PolarHBondContact O-N 3.14Å; I342-H345 HydrophobicContact CB-CB 4.03Å; I342-H345 HydrophobicContact CG2-CB 3.96Å; I342-Y395 HydrophobicContact CD1-CD1 3.92Å; I342-Y395 HydrophobicContact CD1-CG 3.96Å
343	P	71.3	Confident	67.5	Low	44 Å²	44	53 Å²	53	29%	0.286	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	139.9	179.2	22.1	-26.8	0	0	0	111.5	R327 E341 H345 E461	R327-P343 PolarHBondContact N-O 2.72Å; R327-P343 VanDerWaalsContact O-CG 3.29Å; R327-P343 WeakPolarHBondContact O-CG 3.44Å; E341-P343 VanDerWaalsContact O-CD 3.27Å; E341-P343 WeakPolarHBondContact O-CD 3.23Å; P343-H345 VanDerWaalsContact C-N 3.31Å; P343-H345 PolarHBondContact O-N 3.01Å; P343-E461 WeakPolarHBondContact CA-OE2 3.38Å; P343-E461 VanDerWaalsContact CB-OE2 3.26Å; P343-E461 WeakPolarHBondContact CB-OE2 3.21Å
344	F	77.2	Confident	68.8	Low	5 Å²	5	52.1 Å²	52.1	2%	0.022	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	48.5	-175.4	-67.1	-100.7	0	0	0	112.8	W193 M326 R327 G346 E461 M464 Y465	W193-F344 HydrophobicContact CZ2-CB 4.25Å; W193-F344 HydrophobicContact CZ2-CD1 4.05Å; W193-F344 HydrophobicContact CZ2-CG 4.27Å; W193-F344 AromaticContact NE1-CD1 3.38Å; W193-F344 AromaticContact NE1-CE1 3.37Å; M326-F344 WeakPolarHBondContact CA-O 3.49Å; R327-F344 HydrophobicContact CB-CB 3.99Å; R327-F344 HydrophobicContact CB-CD2 4.44Å; R327-F344 HydrophobicContact CB-CG 4.29Å; R327-F344 VanDerWaalsContact NH2-CZ 3.32Å; F344-G346 PolarHBondContact O-N 3.45Å; F344-E461 HydrophobicContact CD1-CB 4.4Å; F344-E461 HydrophobicContact CD2-CB 4.1Å; F344-E461 HydrophobicContact CD2-CG 4.44Å; F344-E461 WeakPolarHBondContact CD2-OE2 3.41Å; F344-E461 HydrophobicContact CE1-CB 4.44Å; F344-E461 HydrophobicContact CE2-CB 4.06Å; F344-E461 VanDerWaalsContact CE2-CD 3.44Å; F344-E461 HydrophobicContact CE2-CG 4.05Å; F344-E461 WeakPolarHBondContact CE2-OE2 3.5Å; F344-E461 HydrophobicContact CG-CB 4.23Å; F344-E461 HydrophobicContact CZ-CB 4.26Å; F344-E461 HydrophobicContact CZ-CG 4.4Å; F344-E461 PolarHBondContact N-OE2 2.74Å; F344-M464 HydrophobicContact CE1-SD 3.68Å; F344-M464 HydrophobicContact CZ-SD 3.93Å; F344-Y465 HydrophobicContact CB-CE2 4.26Å; F344-Y465 WeakPolarHBondContact O-CE2 3.42Å; F344-Y465 PolarHBondContact O-OH 3.29Å; F344-Y465 VanDerWaalsContact O-OH 3.1Å
345	H	83.3	Confident	70.4	Confident	5 Å²	5	42.5 Å²	42.5	2%	0.023	23%	0.229	C	C	.	.			trans	-77	111.7	179.3	-166.8	-168.8	0	0	0	110.8	I342 P343 F372 Y395 N459	I342-H345 HydrophobicContact CB-CB 4.03Å; I342-H345 HydrophobicContact CG2-CB 3.96Å; P343-H345 VanDerWaalsContact C-N 3.31Å; P343-H345 PolarHBondContact O-N 3.01Å; H345-F372 HydrophobicContact CB-CB 4Å; H345-F372 AromaticContact CE1-CD1 3.62Å; H345-F372 AromaticContact CE1-CD2 3.15Å; H345-F372 WeakPolarHBondContact CE1-CD2 3.42Å; H345-F372 AromaticContact CE1-CE1 3.92Å; H345-F372 AromaticContact CE1-CE2 3.48Å; H345-F372 VanDerWaalsContact CE1-CE2 3.48Å; H345-F372 WeakPolarHBondContact CE1-CE2 3.25Å; H345-F372 AromaticContact CE1-CG 3.22Å; H345-F372 WeakPolarHBondContact CE1-CG 3.43Å; H345-F372 AromaticContact CE1-CZ 3.85Å; H345-F372 AromaticContact CG-CG 3.83Å; H345-F372 WeakPolarHBondContact ND1-CB 3.33Å; H345-F372 AromaticContact ND1-CD1 3.43Å; H345-F372 WeakPolarHBondContact ND1-CD1 3.34Å; H345-F372 AromaticContact ND1-CD2 3.7Å; H345-F372 AromaticContact ND1-CG 3.23Å; H345-F372 WeakPolarHBondContact ND1-CG 3.21Å; H345-F372 AromaticContact NE2-CD2 3.52Å; H345-F372 AromaticContact NE2-CG 3.83Å; H345-F372 WeakPolarHBondContact O-CB 3.46Å; H345-F372 PolarHBondContact O-N 3.42Å; H345-Y395 AromaticContact CE1-CD1 3.79Å; H345-N459 PolarHBondContact O-ND2 3.22Å
346	G	85.3	Confident	71.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	157.6	176.3	0	0	0	0	0	112.7	L325 F344 H370	L325-G346 PolarHBondContact N-O 3.2Å; L325-G346 PolarHBondContact O-N 3.39Å; F344-G346 PolarHBondContact O-N 3.45Å; G346-H370 CarbonylContact C-O 3.56Å; G346-H370 WeakPolarHBondContact CA-O 3.46Å
347	L	87.3	Confident	72.9	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.4	-179.4	-168.5	66.9	0	0	0	109.6	P322 E324 F349 H370 L377	P322-L347 HydrophobicContact CB-CD1 3.93Å; E324-L347 HydrophobicContact CG-CD1 4.36Å; L347-F349 HydrophobicContact CD2-CE1 3.89Å; L347-F349 HydrophobicContact CD2-CE2 3.71Å; L347-F349 HydrophobicContact CD2-CZ 3.22Å; L347-F349 HydrophobicContact CG-CE1 4.36Å; L347-F349 HydrophobicContact CG-CE2 4.07Å; L347-F349 HydrophobicContact CG-CZ 3.9Å; L347-H370 PolarHBondContact N-O 3.18Å; L347-H370 PolarHBondContact O-N 2.84Å; L347-L377 HydrophobicContact CD1-CD1 4.27Å; L347-L377 HydrophobicContact CD2-CB 4.13Å; L347-L377 HydrophobicContact CD2-CD1 3.86Å
348	I	89.3	Confident	74.2	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.7	177.7	-58.7	156.4	0	0	0	107.2	P322 V323 L325 V350 Y367 V369 V472 I474	P322-I348 CarbonylContact C-O 3.5Å; P322-I348 WeakPolarHBondContact CA-O 3.46Å; V323-I348 HydrophobicContact CB-CB 4.17Å; V323-I348 PolarHBondContact N-O 3.12Å; V323-I348 PolarHBondContact O-N 3.02Å; L325-I348 HydrophobicContact CB-CD1 4.43Å; I348-V350 HydrophobicContact CG2-CG2 4.38Å; I348-Y367 HydrophobicContact CG2-CG 4.26Å; I348-V369 HydrophobicContact CD1-CG2 4.08Å; I348-V369 HydrophobicContact CG1-CB 4.35Å; I348-V369 HydrophobicContact CG1-CG1 4.41Å; I348-V369 HydrophobicContact CG1-CG2 3.83Å; I348-V472 HydrophobicContact CD1-CB 3.97Å; I348-V472 HydrophobicContact CD1-CG2 3.56Å; I348-I474 HydrophobicContact CG2-CD1 4.16Å
349	F	87.6	Confident	75.6	Confident	3 Å²	3	28.4 Å²	28.4	1%	0.013	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	111.2	176.4	-66.5	-77.1	0	0	0	109.7	L320 P322 L347 Y367 H370 K380 V381	L320-F349 HydrophobicContact CB-CB 4.12Å; L320-F349 HydrophobicContact CB-CD1 4.01Å; L320-F349 HydrophobicContact CB-CG 4.43Å; L320-F349 HydrophobicContact CD1-CB 4.39Å; L320-F349 HydrophobicContact CD2-CB 4.19Å; L320-F349 HydrophobicContact CG-CB 4.46Å; P322-F349 HydrophobicContact CB-CE1 4.46Å; L347-F349 HydrophobicContact CD2-CE1 3.89Å; L347-F349 HydrophobicContact CD2-CE2 3.71Å; L347-F349 HydrophobicContact CD2-CZ 3.22Å; L347-F349 HydrophobicContact CG-CE1 4.36Å; L347-F349 HydrophobicContact CG-CE2 4.07Å; L347-F349 HydrophobicContact CG-CZ 3.9Å; F349-Y367 WeakPolarHBondContact O-CD1 3.45Å; F349-H370 AromaticContact CD2-CD2 3.99Å; F349-K380 HydrophobicContact CD2-CD 3.9Å; F349-K380 HydrophobicContact CE1-CB 3.9Å; F349-K380 HydrophobicContact CE1-CD 4.12Å; F349-K380 HydrophobicContact CE2-CD 3.39Å; F349-K380 HydrophobicContact CG-CD 4.44Å; F349-K380 HydrophobicContact CZ-CB 3.93Å; F349-K380 HydrophobicContact CZ-CD 3.49Å; F349-K380 VanDerWaalsContact CZ-CD 3.49Å; F349-K380 HydrophobicContact CZ-CG 4.31Å; F349-V381 HydrophobicContact CE1-CG2 4.27Å
350	V	88	Confident	77	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.018	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	117.7	178.2	177.7	0	0	0	0	108.8	W321 V323 I348 M352 I363 Y367 I474	W321-V350 HydrophobicContact CB-CB 4.41Å; W321-V350 PolarHBondContact N-O 3.4Å; W321-V350 PolarHBondContact O-N 3.21Å; V323-V350 HydrophobicContact CG2-CG2 3.78Å; I348-V350 HydrophobicContact CG2-CG2 4.38Å; V350-M352 HydrophobicContact CG1-CG 4.33Å; V350-M352 PolarHBondContact O-N 3.05Å; V350-M352 VanDerWaalsContact O-N 3.13Å; V350-I363 HydrophobicContact CG1-CD1 4.32Å; V350-Y367 HydrophobicContact CG1-CE1 4.3Å; V350-Y367 HydrophobicContact CG1-CE2 4.02Å; V350-Y367 HydrophobicContact CG2-CD2 4.09Å; V350-Y367 HydrophobicContact CG2-CE2 4.17Å; V350-Y367 HydrophobicContact CG2-CG 4.34Å; V350-I474 HydrophobicContact CG2-CB 4.46Å; V350-I474 HydrophobicContact CG2-CD1 3.74Å; V350-I474 HydrophobicContact CG2-CG2 4.37Å
351	D	84.4	Confident	78.7	Confident	54 Å²	54	24.6 Å²	24.6	29%	0.289	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	105.7	172.6	-170.7	-15.2	0	0	0	110.4	R319 L320 G353 I363	R319-D351 WeakPolarHBondContact O-CA 3.43Å; L320-D351 HydrophobicContact CD2-CB 4.36Å; D351-G353 WeakPolarHBondContact OD1-CA 3.44Å; D351-G353 PolarHBondContact OD1-N 2.96Å; D351-I363 WeakPolarHBondContact O-CD1 3.15Å
352	M	83.4	Confident	80.2	Confident	3 Å²	3	21.1 Å²	21.1	2%	0.015	12%	0.118	C	C	.	.			trans	-89.3	-0.5	176.5	-70.7	-165	179.8	0	0	113.5	M179 I315 R319 W321 V350 R354 L355 I363 V476	M179-M352 HydrophobicContact CE-CE 3.97Å; I315-M352 HydrophobicContact CD1-CB 3.97Å; I315-M352 HydrophobicContact CD1-SD 4.38Å; I315-M352 HydrophobicContact CG1-CB 3.91Å; I315-M352 HydrophobicContact CG1-SD 4.46Å; I315-M352 HydrophobicContact CG2-CB 4.12Å; R319-M352 PolarHBondContact O-N 3.25Å; W321-M352 HydrophobicContact CB-CE 3.63Å; W321-M352 HydrophobicContact CB-CG 3.9Å; W321-M352 HydrophobicContact CB-SD 3.84Å; W321-M352 HydrophobicContact CD2-CE 3.9Å; W321-M352 HydrophobicContact CD2-SD 3.75Å; W321-M352 HydrophobicContact CE3-SD 3.86Å; W321-M352 HydrophobicContact CG-CE 3.41Å; W321-M352 VanDerWaalsContact CG-CE 3.41Å; W321-M352 HydrophobicContact CG-CG 4.47Å; W321-M352 HydrophobicContact CG-SD 3.76Å; V350-M352 HydrophobicContact CG1-CG 4.33Å; V350-M352 PolarHBondContact O-N 3.05Å; V350-M352 VanDerWaalsContact O-N 3.13Å; M352-R354 VanDerWaalsContact C-N 3.27Å; M352-R354 PolarHBondContact O-N 2.9Å; M352-L355 HydrophobicContact CB-CD1 4.4Å; M352-L355 WeakPolarHBondContact O-CB 3.44Å; M352-L355 PolarHBondContact O-N 2.69Å; M352-I363 HydrophobicContact CG-CD1 4.2Å; M352-V476 HydrophobicContact CE-CG2 4.3Å
353	G	76.2	Confident	81.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-55.7	-37.2	-172.5	0	0	0	0	0	114	D351 L355 L356	D351-G353 WeakPolarHBondContact OD1-CA 3.44Å; D351-G353 PolarHBondContact OD1-N 2.96Å; G353-L355 PolarHBondContact O-N 2.99Å; G353-L356 WeakPolarHBondContact O-CB 3.27Å; G353-L356 PolarHBondContact O-N 3.47Å
354	R	77.3	Confident	82.2	Confident	68 Å²	68	18.5 Å²	18.5	26%	0.257	10%	0.101	S	C	.	.	G	3₁₀ helix	trans	-62.8	-22.6	178.4	-73.8	-173.7	174.5	-173.4	6.3	114	D271 M352 L356 Y357 V360 I363	D271-R354 WeakPolarHBondContact OD1-CD 3.39Å; D271-R354 IonicContact OD1-CZ 3.56Å; D271-R354 IonicContact OD1-NE 3.67Å; D271-R354 IonicContact OD1-NH1 3.62Å; D271-R354 PolarHBondContact OD1-NH1 3.39Å; M352-R354 VanDerWaalsContact C-N 3.27Å; M352-R354 PolarHBondContact O-N 2.9Å; R354-L356 PolarHBondContact O-N 2.98Å; R354-Y357 HydrophobicContact CB-CD2 4.37Å; R354-Y357 HydrophobicContact CB-CE2 4.3Å; R354-Y357 HydrophobicContact CG-CD2 4.29Å; R354-Y357 HydrophobicContact CG-CE2 3.77Å; R354-Y357 VanDerWaalsContact O-CB 3.3Å; R354-Y357 WeakPolarHBondContact O-CB 3.29Å; R354-Y357 PolarHBondContact O-N 3.32Å; R354-Y357 VanDerWaalsContact O-N 3.1Å; R354-V360 WeakPolarHBondContact O-CB 3.2Å; R354-V360 WeakPolarHBondContact O-CG1 3.17Å; R354-I363 HydrophobicContact CB-CG2 3.79Å
355	L	80.9	Confident	82.8	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-68.4	-18	175.4	-65.9	174.2	0	0	0	113	M352 G353 Y357 I363 V476 L478 L482	M352-L355 HydrophobicContact CB-CD1 4.4Å; M352-L355 WeakPolarHBondContact O-CB 3.44Å; M352-L355 PolarHBondContact O-N 2.69Å; G353-L355 PolarHBondContact O-N 2.99Å; L355-Y357 PolarHBondContact O-N 3.03Å; L355-I363 HydrophobicContact CD1-CD1 3.98Å; L355-I363 HydrophobicContact CD1-CG1 4.32Å; L355-I363 HydrophobicContact CD2-CG1 4.29Å; L355-I363 HydrophobicContact CD2-CG2 3.94Å; L355-I363 HydrophobicContact CG-CD1 4.09Å; L355-I363 HydrophobicContact CG-CG1 4.24Å; L355-I363 HydrophobicContact CG-CG2 4.01Å; L355-V476 HydrophobicContact CD1-CG1 4.02Å; L355-L478 HydrophobicContact CD2-CD1 4.2Å; L355-L478 HydrophobicContact CD2-CG 4.39Å; L355-L482 WeakPolarHBondContact O-CB 3.35Å
356	L	75.2	Confident	83.1	Confident	11 Å²	11	18 Å²	18	6%	0.058	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-77	-8.3	173.3	-64.2	174.5	0	0	0	112.8	K312 I315 G353 R354 L482 V483 F820	K312-L356 HydrophobicContact CB-CD2 4.28Å; K312-L356 HydrophobicContact CG-CD2 3.4Å; I315-L356 HydrophobicContact CB-CD1 4.1Å; I315-L356 HydrophobicContact CB-CG 4.34Å; I315-L356 HydrophobicContact CG2-CD1 3.54Å; I315-L356 HydrophobicContact CG2-CD2 4.48Å; I315-L356 HydrophobicContact CG2-CG 3.81Å; G353-L356 WeakPolarHBondContact O-CB 3.27Å; G353-L356 PolarHBondContact O-N 3.47Å; R354-L356 PolarHBondContact O-N 2.98Å; L356-L482 HydrophobicContact CD2-CD2 3.86Å; L356-V483 WeakPolarHBondContact O-CG2 3.17Å; L356-F820 HydrophobicContact CB-CB 4.46Å; L356-F820 HydrophobicContact CB-CD1 4.27Å; L356-F820 HydrophobicContact CD1-CD1 3.39Å; L356-F820 HydrophobicContact CD1-CD2 4.34Å; L356-F820 HydrophobicContact CD1-CE1 3.42Å; L356-F820 VanDerWaalsContact CD1-CE1 3.42Å; L356-F820 HydrophobicContact CD1-CE2 4.38Å; L356-F820 HydrophobicContact CD1-CG 3.87Å; L356-F820 HydrophobicContact CD1-CZ 3.96Å; L356-F820 HydrophobicContact CG-CD1 4.41Å
357	Y	69.9	Low	83.5	Confident	9 Å²	9	18.1 Å²	18.1	4%	0.035	10%	0.099	C	C	.	.	S	Bend	trans	-75.6	134	-177.9	-64.5	0.2	0	0	0	110.5	R354 L355 G359 V360 F820 E823 R824	R354-Y357 HydrophobicContact CB-CD2 4.37Å; R354-Y357 HydrophobicContact CB-CE2 4.3Å; R354-Y357 HydrophobicContact CG-CD2 4.29Å; R354-Y357 HydrophobicContact CG-CE2 3.77Å; R354-Y357 VanDerWaalsContact O-CB 3.3Å; R354-Y357 WeakPolarHBondContact O-CB 3.29Å; R354-Y357 PolarHBondContact O-N 3.32Å; R354-Y357 VanDerWaalsContact O-N 3.1Å; L355-Y357 PolarHBondContact O-N 3.03Å; Y357-G359 PolarHBondContact O-N 3.42Å; Y357-V360 HydrophobicContact CD2-CG2 4.5Å; Y357-V360 PolarHBondContact O-N 3.39Å; Y357-F820 WeakPolarHBondContact CD1-O 3.18Å; Y357-F820 HydrophobicContact CE1-CB 4.46Å; Y357-F820 WeakPolarHBondContact CE1-O 3.5Å; Y357-E823 WeakPolarHBondContact OH-CB 3.26Å; Y357-E823 PolarHBondContact OH-OE2 2.92Å; Y357-R824 HydrophobicContact CD2-CB 3.85Å; Y357-R824 HydrophobicContact CD2-CG 4.43Å; Y357-R824 HydrophobicContact CE2-CB 4.05Å; Y357-R824 HydrophobicContact CG-CB 4.33Å
358	P	69.3	Low	83.6	Confident	25 Å²	25	19.8 Å²	19.8	16%	0.162	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	114.2	-175.6	-26.3	31.5	0	0	0	113.7	V483 L821 R824	P358-V483 CarbonylContact C-O 3.6Å; P358-V483 WeakPolarHBondContact CA-O 3.3Å; P358-V483 HydrophobicContact CB-CG1 4.09Å; P358-V483 HydrophobicContact CG-CG1 3.89Å; P358-L821 HydrophobicContact CG-CD2 3.99Å; P358-R824 PolarHBondContact O-NH1 2.9Å; P358-R824 PolarHBondContact O-NH2 2.87Å
359	G	71.5	Confident	83.7	Confident	35 Å²	35	19.8 Å²	19.8	36%	0.361	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	-4.8	-179.3	0	0	0	0	0	115.3	Y357 V483	Y357-G359 PolarHBondContact O-N 3.42Å; G359-V483 PolarHBondContact N-O 2.91Å
360	V	79.4	Confident	83.6	Confident	39 Å²	39	21.3 Å²	21.3	24%	0.236	12%	0.117	C	C	.	.			trans	-77.4	129.7	171.2	178.1	0	0	0	0	109	R354 Y357 P481	R354-V360 WeakPolarHBondContact O-CB 3.2Å; R354-V360 WeakPolarHBondContact O-CG1 3.17Å; Y357-V360 HydrophobicContact CD2-CG2 4.5Å; Y357-V360 PolarHBondContact O-N 3.39Å; V360-P481 WeakPolarHBondContact O-CA 3.39Å; V360-P481 VanDerWaalsContact O-CB 3.28Å; V360-P481 WeakPolarHBondContact O-CB 3.3Å
361	S	88.5	Confident	83.5	Confident	43 Å²	43	21.3 Å²	21.3	30%	0.301	12%	0.117	S	C	.	.			trans	-133.7	8	-178.2	71.2	0	0	0	0	112.7	S477 L478	S361-S477 CarbonylContact O-C 3.56Å; S361-S477 WeakPolarHBondContact O-CA 3.15Å; S361-L478 PolarHBondContact O-N 2.85Å
362	R	90.9	Very high	83.3	Confident	73 Å²	73	20.1 Å²	20.1	28%	0.275	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	137.4	-179.2	179.7	175.1	174	-86.4	0.4	109.6	E265 R364 E475 V476	E265-R362 IonicContact OE1-CZ 3.25Å; E265-R362 IonicContact OE1-NH1 2.71Å; E265-R362 PolarHBondContact OE1-NH1 2.79Å; E265-R362 IonicContact OE1-NH2 2.91Å; E265-R362 IonicContact OE2-CZ 4Å; E265-R362 IonicContact OE2-NH1 3.18Å; E265-R362 PolarHBondContact OE2-NH1 2.84Å; E265-R362 IonicContact OE2-NH2 3.17Å; E265-R362 PolarHBondContact OE2-NH2 3.37Å; R362-R364 VanDerWaalsContact NH2-CD 3.26Å; R362-E475 HydrophobicContact CG-CG 4.48Å; R362-E475 IonicContact CZ-OE1 2.87Å; R362-E475 IonicContact NE-OE1 3.37Å; R362-E475 PolarHBondContact NE-OE1 2.78Å; R362-E475 IonicContact NH2-OE1 3.71Å; R362-V476 CarbonylContact C-O 3.48Å; R362-V476 WeakPolarHBondContact CA-O 3.47Å
363	I	90.6	Very high	82.9	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	144.2	167.4	58.9	173.1	0	0	0	109.3	D271 V350 D351 M352 R354 L355 E475 V476	D271-I363 HydrophobicContact CB-CB 4.26Å; D271-I363 WeakPolarHBondContact OD2-CA 3.48Å; V350-I363 HydrophobicContact CG1-CD1 4.32Å; D351-I363 WeakPolarHBondContact O-CD1 3.15Å; M352-I363 HydrophobicContact CG-CD1 4.2Å; R354-I363 HydrophobicContact CB-CG2 3.79Å; L355-I363 HydrophobicContact CD1-CD1 3.98Å; L355-I363 HydrophobicContact CD1-CG1 4.32Å; L355-I363 HydrophobicContact CD2-CG1 4.29Å; L355-I363 HydrophobicContact CD2-CG2 3.94Å; L355-I363 HydrophobicContact CG-CD1 4.09Å; L355-I363 HydrophobicContact CG-CG1 4.24Å; L355-I363 HydrophobicContact CG-CG2 4.01Å; I363-E475 CarbonylContact O-C 3.57Å; I363-E475 WeakPolarHBondContact O-CA 3.41Å; I363-V476 HydrophobicContact CD1-CB 4.13Å; I363-V476 HydrophobicContact CD1-CG2 4.49Å; I363-V476 HydrophobicContact CG1-CB 3.74Å; I363-V476 HydrophobicContact CG1-CG2 4.46Å; I363-V476 PolarHBondContact N-O 2.89Å; I363-V476 PolarHBondContact O-N 2.83Å
364	R	91.3	Very high	82.4	Confident	10 Å²	10	28.9 Å²	28.9	4%	0.038	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	125.4	174.4	-178.8	175.3	176.1	-75.2	-1.4	109.6	E184 E265 E270 D271 R362 I473 I474 E475	E184-R364 IonicContact OE1-CZ 3.51Å; E184-R364 IonicContact OE1-NE 3.86Å; E184-R364 PolarHBondContact OE1-NE 2.72Å; E184-R364 IonicContact OE1-NH2 2.72Å; E184-R364 PolarHBondContact OE1-NH2 3.24Å; E184-R364 IonicContact OE2-CZ 3.51Å; E184-R364 IonicContact OE2-NE 4Å; E184-R364 IonicContact OE2-NH2 2.63Å; E184-R364 PolarHBondContact OE2-NH2 3.34Å; E265-R364 WeakPolarHBondContact OE2-CD 3.22Å; E270-R364 IonicContact OE1-CZ 2.85Å; E270-R364 IonicContact OE1-NH1 3.21Å; E270-R364 PolarHBondContact OE1-NH1 2.75Å; D271-R364 PolarHBondContact N-O 3.14Å; D271-R364 PolarHBondContact OD2-N 2.99Å; R362-R364 VanDerWaalsContact NH2-CD 3.26Å; R364-I473 HydrophobicContact CG-CG2 4.38Å; R364-I474 WeakPolarHBondContact CA-O 3.43Å; R364-E475 HydrophobicContact CB-CB 4.11Å; R364-E475 HydrophobicContact CB-CG 4.13Å; R364-E475 HydrophobicContact CG-CB 3.99Å; R364-E475 HydrophobicContact CG-CG 4.43Å
365	G	89.1	Confident	81.7	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	159.5	-177.2	0	0	0	0	0	113.7	Y367 I473 I474	G365-Y367 VanDerWaalsContact C-CE2 3.48Å; G365-Y367 VanDerWaalsContact O-CD2 3.3Å; G365-Y367 WeakPolarHBondContact O-CD2 3.23Å; G365-Y367 VanDerWaalsContact O-CE2 3.24Å; G365-Y367 WeakPolarHBondContact O-CE2 3.41Å; G365-I473 WeakPolarHBondContact O-CA 3.33Å; G365-I474 PolarHBondContact N-O 3.07Å; G365-I474 VanDerWaalsContact N-O 3.08Å; G365-I474 PolarHBondContact O-N 2.83Å
366	A	90.9	Very high	81	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	120.2	163.9	0	0	0	0	0	109.8	G272 E273 L274 Y471 I473	G272-A366 CarbonylContact C-O 3.53Å; G272-A366 WeakPolarHBondContact CA-O 3.41Å; E273-A366 PolarHBondContact N-O 2.99Å; L274-A366 HydrophobicContact CB-CB 4.34Å; A366-Y471 HydrophobicContact CB-CD2 3.89Å; A366-Y471 HydrophobicContact CB-CE2 4.26Å; A366-I473 HydrophobicContact CB-CG1 4.44Å
367	Y	91.8	Very high	80.5	Confident	2 Å²	2	31.7 Å²	31.7	1%	0.008	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.2	-175.3	-56.9	-81	0	0	0	110.7	D271 I348 F349 V350 G365 Y471 V472 I474	D271-Y367 PolarHBondContact O-OH 3.45Å; I348-Y367 HydrophobicContact CG2-CG 4.26Å; F349-Y367 WeakPolarHBondContact O-CD1 3.45Å; V350-Y367 HydrophobicContact CG1-CE1 4.3Å; V350-Y367 HydrophobicContact CG1-CE2 4.02Å; V350-Y367 HydrophobicContact CG2-CD2 4.09Å; V350-Y367 HydrophobicContact CG2-CE2 4.17Å; V350-Y367 HydrophobicContact CG2-CG 4.34Å; G365-Y367 VanDerWaalsContact C-CE2 3.48Å; G365-Y367 VanDerWaalsContact O-CD2 3.3Å; G365-Y367 WeakPolarHBondContact O-CD2 3.23Å; G365-Y367 VanDerWaalsContact O-CE2 3.24Å; G365-Y367 WeakPolarHBondContact O-CE2 3.41Å; Y367-Y471 CarbonylContact O-C 3.59Å; Y367-Y471 WeakPolarHBondContact O-CA 3.46Å; Y367-Y471 WeakPolarHBondContact O-CB 3.1Å; Y367-V472 PolarHBondContact N-O 3.4Å; Y367-V472 PolarHBondContact O-N 3.08Å; Y367-I474 HydrophobicContact CD2-CB 4.12Å; Y367-I474 HydrophobicContact CD2-CG1 4.42Å; Y367-I474 HydrophobicContact CE2-CB 4.13Å
368	T	91.1	Very high	80.1	Confident	35 Å²	35	34.3 Å²	34.3	22%	0.215	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	150	-179.2	61.3	0	0	0	0	112.1	E273 L274 H370	E273-T368 WeakPolarHBondContact OE2-CB 3.38Å; E273-T368 WeakPolarHBondContact OE2-CG2 3.37Å; E273-T368 PolarHBondContact OE2-N 3.47Å; E273-T368 VanDerWaalsContact OE2-N 3.1Å; E273-T368 PolarHBondContact OE2-OG1 3Å; L274-T368 HydrophobicContact CD1-CG2 4.07Å; L274-T368 HydrophobicContact CD2-CG2 4.03Å; L274-T368 HydrophobicContact CG-CG2 4.08Å; T368-H370 PolarHBondContact OG1-NE2 2.92Å
369	V	90.1	Very high	79.7	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-98.2	119.7	176.2	-173.9	0	0	0	0	109.2	L325 I348 Y465 T470 V472	L325-V369 HydrophobicContact CD2-CG1 4.08Å; L325-V369 HydrophobicContact CD2-CG2 4.15Å; I348-V369 HydrophobicContact CD1-CG2 4.08Å; I348-V369 HydrophobicContact CG1-CB 4.35Å; I348-V369 HydrophobicContact CG1-CG1 4.41Å; I348-V369 HydrophobicContact CG1-CG2 3.83Å; V369-Y465 HydrophobicContact CB-CD1 4.34Å; V369-Y465 HydrophobicContact CB-CG 4.23Å; V369-Y465 HydrophobicContact CG1-CD1 3.92Å; V369-Y465 HydrophobicContact CG1-CD2 3.79Å; V369-Y465 HydrophobicContact CG1-CE1 4.33Å; V369-Y465 HydrophobicContact CG1-CE2 4.22Å; V369-Y465 HydrophobicContact CG1-CG 3.62Å; V369-T470 HydrophobicContact CB-CG2 4.36Å; V369-T470 HydrophobicContact CG2-CG2 3.8Å; V369-T470 PolarHBondContact N-O 2.98Å; V369-V472 HydrophobicContact CG2-CG2 3.71Å
370	H	86.7	Confident	79.3	Confident	35 Å²	35	41.3 Å²	41.3	16%	0.162	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	150.7	172.9	-58.7	-70.2	0	0	0	111.1	G346 L347 F349 T368	G346-H370 CarbonylContact C-O 3.56Å; G346-H370 WeakPolarHBondContact CA-O 3.46Å; L347-H370 PolarHBondContact N-O 3.18Å; L347-H370 PolarHBondContact O-N 2.84Å; F349-H370 AromaticContact CD2-CD2 3.99Å; T368-H370 PolarHBondContact OG1-NE2 2.92Å
371	P	84.8	Confident	78.2	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.019	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	140.8	164.2	24.5	-36.4	0	0	0	110.2	Y373 L466	P371-Y373 HydrophobicContact CB-CD2 4.31Å; P371-Y373 HydrophobicContact CB-CE2 3.73Å; P371-Y373 HydrophobicContact CG-CD2 3.99Å; P371-Y373 HydrophobicContact CG-CE2 3.32Å; P371-Y373 PolarHBondContact O-N 3.43Å; P371-L466 VanDerWaalsContact CD-CD1 3.48Å; P371-L466 HydrophobicContact CG-CD1 3.72Å; P371-L466 HydrophobicContact CG-CG 4.3Å
372	F	80.1	Confident	76.3	Confident	29 Å²	29	42.2 Å²	42.2	13%	0.127	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-69.2	120.2	174	179.5	-91.1	0	0	0	111	H345 L377 Y395 N459	H345-F372 HydrophobicContact CB-CB 4Å; H345-F372 AromaticContact CE1-CD1 3.62Å; H345-F372 AromaticContact CE1-CD2 3.15Å; H345-F372 WeakPolarHBondContact CE1-CD2 3.42Å; H345-F372 AromaticContact CE1-CE1 3.92Å; H345-F372 AromaticContact CE1-CE2 3.48Å; H345-F372 VanDerWaalsContact CE1-CE2 3.48Å; H345-F372 WeakPolarHBondContact CE1-CE2 3.25Å; H345-F372 AromaticContact CE1-CG 3.22Å; H345-F372 WeakPolarHBondContact CE1-CG 3.43Å; H345-F372 AromaticContact CE1-CZ 3.85Å; H345-F372 AromaticContact CG-CG 3.83Å; H345-F372 WeakPolarHBondContact ND1-CB 3.33Å; H345-F372 AromaticContact ND1-CD1 3.43Å; H345-F372 WeakPolarHBondContact ND1-CD1 3.34Å; H345-F372 AromaticContact ND1-CD2 3.7Å; H345-F372 AromaticContact ND1-CG 3.23Å; H345-F372 WeakPolarHBondContact ND1-CG 3.21Å; H345-F372 AromaticContact NE2-CD2 3.52Å; H345-F372 AromaticContact NE2-CG 3.83Å; H345-F372 WeakPolarHBondContact O-CB 3.46Å; H345-F372 PolarHBondContact O-N 3.42Å; F372-L377 HydrophobicContact CE2-CD2 4.26Å; F372-Y395 HydrophobicContact CE1-CD1 4.41Å; F372-Y395 AromaticContact CE1-CE1 3.95Å; F372-Y395 HydrophobicContact CE1-CE1 3.95Å; F372-Y395 HydrophobicContact CZ-CD1 4.23Å; F372-Y395 HydrophobicContact CZ-CE1 4.16Å; F372-N459 PolarHBondContact N-ND2 2.88Å; F372-N459 PolarHBondContact O-ND2 3.44Å
373	Y	76.5	Confident	74	Confident	72 Å²	72	44 Å²	44	28%	0.282	23%	0.232	S	C	.	.			trans	-129	129	165.9	-63.1	-64.6	0	0	0	109.6	P371 S375 E376 L377 N463	P371-Y373 HydrophobicContact CB-CD2 4.31Å; P371-Y373 HydrophobicContact CB-CE2 3.73Å; P371-Y373 HydrophobicContact CG-CD2 3.99Å; P371-Y373 HydrophobicContact CG-CE2 3.32Å; P371-Y373 PolarHBondContact O-N 3.43Å; Y373-S375 VanDerWaalsContact C-N 3.3Å; Y373-S375 PolarHBondContact O-N 2.99Å; Y373-E376 PolarHBondContact O-N 3.39Å; Y373-E376 VanDerWaalsContact O-N 3.12Å; Y373-L377 PolarHBondContact O-N 2.92Å; Y373-L377 VanDerWaalsContact O-N 3.09Å; Y373-N463 PolarHBondContact OH-OD1 2.86Å
374	E	64.8	Low	71.3	Confident	115 Å²	115	46.8 Å²	46.8	54%	0.537	25%	0.251	S	S	.	.	H	α-helix	trans	-62.4	-37.6	-177.6	-172.5	173.8	-168.9	0	0	112.2	E376 L377 L378	E374-E376 VanDerWaalsContact C-N 3.33Å; E374-E376 PolarHBondContact O-N 2.86Å; E374-L377 PolarHBondContact O-N 3.23Å; E374-L378 HydrophobicContact CG-CD1 4.33Å; E374-L378 WeakPolarHBondContact O-CG 3.47Å; E374-L378 PolarHBondContact O-N 3.37Å
375	S	61.7	Low	68.7	Low	75 Å²	75	54.9 Å²	54.9	52%	0.524	29%	0.288	S	S	.	.	H	α-helix	trans	-64.6	-34.4	174.9	51.7	0	0	0	0	113.1	Y373 N379	Y373-S375 VanDerWaalsContact C-N 3.3Å; Y373-S375 PolarHBondContact O-N 2.99Å; S375-N379 VanDerWaalsContact O-CB 3.28Å; S375-N379 WeakPolarHBondContact O-CB 3.24Å; S375-N379 PolarHBondContact O-N 3.17Å; S375-N379 PolarHBondContact O-ND2 3.33Å
376	E	66.5	Low	65.8	Low	45 Å²	45	58.9 Å²	58.9	21%	0.21	32%	0.316	C	S	.	.	H	α-helix	trans	-74.8	-39.6	178.5	-171.5	173.8	177.6	0	0	111.5	Y373 E374 N379 K380	Y373-E376 PolarHBondContact O-N 3.39Å; Y373-E376 VanDerWaalsContact O-N 3.12Å; E374-E376 VanDerWaalsContact C-N 3.33Å; E374-E376 PolarHBondContact O-N 2.86Å; E376-N379 PolarHBondContact O-N 3.02Å; E376-K380 HydrophobicContact CG-CD 3.98Å; E376-K380 WeakPolarHBondContact O-CB 3.47Å; E376-K380 PolarHBondContact O-N 3.38Å; E376-K380 WeakPolarHBondContact OE1-CE 3.43Å; E376-K380 IonicContact OE1-NZ 2.77Å; E376-K380 PolarHBondContact OE1-NZ 3.31Å
377	L	65.4	Low	62.8	Low	18 Å²	18	65 Å²	65	9%	0.094	36%	0.359	C	S	.	.	H	α-helix	trans	-59.7	-47.7	171.4	-179.6	69.5	0	0	0	110.6	P322 L347 F372 Y373 E374 V381	P322-L377 HydrophobicContact CB-CD1 3.86Å; P322-L377 HydrophobicContact CG-CD1 4.23Å; L347-L377 HydrophobicContact CD1-CD1 4.27Å; L347-L377 HydrophobicContact CD2-CB 4.13Å; L347-L377 HydrophobicContact CD2-CD1 3.86Å; F372-L377 HydrophobicContact CE2-CD2 4.26Å; Y373-L377 PolarHBondContact O-N 2.92Å; Y373-L377 VanDerWaalsContact O-N 3.09Å; E374-L377 PolarHBondContact O-N 3.23Å; L377-V381 HydrophobicContact CD1-CG2 3.87Å; L377-V381 WeakPolarHBondContact O-CB 3.27Å; L377-V381 WeakPolarHBondContact O-CG2 3.46Å; L377-V381 PolarHBondContact O-N 2.96Å
378	L	60.8	Low	59.8	Low	63 Å²	63	72.1 Å²	72.1	33%	0.33	40%	0.396	S	S	.	.	H	α-helix	trans	-62.7	-53	177.1	-71.2	168.9	0	0	0	110.6	E374 K380 V381 S382	E374-L378 HydrophobicContact CG-CD1 4.33Å; E374-L378 WeakPolarHBondContact O-CG 3.47Å; E374-L378 PolarHBondContact O-N 3.37Å; L378-K380 VanDerWaalsContact C-N 3.32Å; L378-K380 PolarHBondContact O-N 3.46Å; L378-V381 PolarHBondContact O-N 3.31Å; L378-S382 WeakPolarHBondContact O-CA 3.49Å; L378-S382 WeakPolarHBondContact O-CB 3.44Å; L378-S382 PolarHBondContact O-N 2.74Å; L378-S382 PolarHBondContact O-OG 3.43Å
379	N	61.6	Low	56.7	Low	130 Å²	130	74.3 Å²	74.3	70%	0.695	42%	0.417	S	S	*	.	H	α-helix	trans	-59.8	-37.1	-177.8	-73.6	-20.2	0	0	0	114.1	S375 E376	S375-N379 VanDerWaalsContact O-CB 3.28Å; S375-N379 WeakPolarHBondContact O-CB 3.24Å; S375-N379 PolarHBondContact O-N 3.17Å; S375-N379 PolarHBondContact O-ND2 3.33Å; E376-N379 PolarHBondContact O-N 3.02Å
380	K	62.6	Low	53.7	Low	77 Å²	77	78.5 Å²	78.5	34%	0.335	45%	0.445	S	S	.	.	H	α-helix	trans	-83.2	-22.4	-179.5	-72.2	179.5	170.5	174.1	0	113.5	L320 F349 E376 L378	L320-K380 HydrophobicContact CD1-CB 4.44Å; F349-K380 HydrophobicContact CD2-CD 3.9Å; F349-K380 HydrophobicContact CE1-CB 3.9Å; F349-K380 HydrophobicContact CE1-CD 4.12Å; F349-K380 HydrophobicContact CE2-CD 3.39Å; F349-K380 HydrophobicContact CG-CD 4.44Å; F349-K380 HydrophobicContact CZ-CB 3.93Å; F349-K380 HydrophobicContact CZ-CD 3.49Å; F349-K380 VanDerWaalsContact CZ-CD 3.49Å; F349-K380 HydrophobicContact CZ-CG 4.31Å; E376-K380 HydrophobicContact CG-CD 3.98Å; E376-K380 WeakPolarHBondContact O-CB 3.47Å; E376-K380 PolarHBondContact O-N 3.38Å; E376-K380 WeakPolarHBondContact OE1-CE 3.43Å; E376-K380 IonicContact OE1-NZ 2.77Å; E376-K380 PolarHBondContact OE1-NZ 3.31Å; L378-K380 VanDerWaalsContact C-N 3.32Å; L378-K380 PolarHBondContact O-N 3.46Å
381	V	57.3	Low	50.8	Low	37 Å²	37	82 Å²	82	22%	0.224	47%	0.474	C	S	.	.	H	α-helix	trans	-105.3	-26.3	-177.5	-178.1	0	0	0	0	113	P322 F349 L377 L378 N383	P322-V381 HydrophobicContact CG-CG2 4.47Å; F349-V381 HydrophobicContact CE1-CG2 4.27Å; L377-V381 HydrophobicContact CD1-CG2 3.87Å; L377-V381 WeakPolarHBondContact O-CB 3.27Å; L377-V381 WeakPolarHBondContact O-CG2 3.46Å; L377-V381 PolarHBondContact O-N 2.96Å; L378-V381 PolarHBondContact O-N 3.31Å; V381-N383 PolarHBondContact O-N 3.04Å; V381-N383 VanDerWaalsContact O-N 3.14Å
382	S	47.7	Very low	48.3	Very low	65 Å²	65	87 Å²	87	46%	0.455	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	79.9	-173.7	77.1	0	0	0	0	113	L378	L378-S382 WeakPolarHBondContact O-CA 3.49Å; L378-S382 WeakPolarHBondContact O-CB 3.44Å; L378-S382 PolarHBondContact O-N 2.74Å; L378-S382 PolarHBondContact O-OG 3.43Å
383	N	42.7	Very low	46.6	Very low	110 Å²	110	90.9 Å²	90.9	59%	0.588	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	10.7	138.4	-93.3	-14.9	0	0	0	111.4	V381 H385	V381-N383 PolarHBondContact O-N 3.04Å; V381-N383 VanDerWaalsContact O-N 3.14Å; N383-H385 PolarHBondContact O-N 3.28Å
384	C	34.6	Very low	45.2	Very low	60 Å²	60	90.8 Å²	90.8	41%	0.405	53%	0.53	S	S	.	.			trans	-71.6	99.1	-178.7	-67.7	0	0	0	0	111.5	S386	C384-S386 VanDerWaalsContact C-N 3.26Å; C384-S386 PolarHBondContact O-N 3.47Å
385	H	35.8	Very low	45	Very low	180 Å²	180	89 Å²	89	83%	0.833	52%	0.519	S	S	*	.			trans	-79.1	60.3	174.1	-73.2	-25.6	0	0	0	113.2	N383	N383-H385 PolarHBondContact O-N 3.28Å
386	S	28.1	Very low	45	Very low	84 Å²	84	86.5 Å²	86.5	59%	0.587	50%	0.499	S	S	*	.			trans	-123.2	104.9	160.7	58.2	0	0	0	0	110.6	C384 I388	C384-S386 VanDerWaalsContact C-N 3.26Å; C384-S386 PolarHBondContact O-N 3.47Å; S386-I388 PolarHBondContact O-N 3Å
387	S	27.7	Very low	44.6	Very low	128 Å²	128	84.4 Å²	84.4	90%	0.895	49%	0.49	S	S	*	.			trans	-72.4	28.5	179.4	39.3	0	0	0	0	113.9
388	I	29.4	Very low	44.3	Very low	152 Å²	152	85.1 Å²	85.1	78%	0.779	49%	0.491	S	S	*	.	S	Bend	trans	-142.8	84.8	175.3	-52.9	176.3	0	0	0	107.8	S386	S386-I388 PolarHBondContact O-N 3Å
389	A	26.4	Very low	44.3	Very low	80 Å²	80	87.3 Å²	87.3	66%	0.661	50%	0.498	S	S	*	.	S	Bend	trans	147.1	-0	154.1	0	0	0	0	0	114.9	S391	A389-S391 PolarHBondContact O-N 2.96Å
390	C	27.4	Very low	44	Very low	90 Å²	90	82.2 Å²	82.2	61%	0.608	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	48.4	173.9	-160.5	0	0	0	0	112.3
391	S	24.1	Very low	43.7	Very low	108 Å²	108	79 Å²	79	76%	0.755	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	12	174.8	76.5	0	0	0	0	114.2	A389	A389-S391 PolarHBondContact O-N 2.96Å
392	T	33.3	Very low	43.5	Very low	110 Å²	110	81.8 Å²	81.8	68%	0.675	47%	0.466	S	S	*	.			trans	-149.8	64.4	172.7	49.6	0	0	0	0	110.8	T394	T392-T394 PolarHBondContact O-N 2.91Å
393	Q	44.6	Very low	43.8	Very low	109 Å²	109	84.7 Å²	84.7	51%	0.509	47%	0.47	S	S	.	.			trans	-75.8	87.6	174.6	-142.7	98	5.2	0	0	108.9
394	T	46.1	Very low	44.1	Very low	70 Å²	70	85.3 Å²	85.3	43%	0.429	47%	0.469	S	S	.	.			trans	-97.1	126	172	-35.6	0	0	0	0	108	T392 Y398	T392-T394 PolarHBondContact O-N 2.91Å; T394-Y398 HydrophobicContact CG2-CD1 3.48Å; T394-Y398 VanDerWaalsContact CG2-CD1 3.48Å; T394-Y398 HydrophobicContact CG2-CE1 3.89Å
395	Y	61.7	Low	44.8	Very low	79 Å²	79	84 Å²	84	31%	0.31	46%	0.458	S	S	.	.			trans	-35.8	132.1	-176.4	-40.5	-97.6	0	0	0	113.5	I342 H345 F372 I397 Y398 K399	I342-Y395 HydrophobicContact CD1-CD1 3.92Å; I342-Y395 HydrophobicContact CD1-CG 3.96Å; H345-Y395 AromaticContact CE1-CD1 3.79Å; F372-Y395 HydrophobicContact CE1-CD1 4.41Å; F372-Y395 AromaticContact CE1-CE1 3.95Å; F372-Y395 HydrophobicContact CE1-CE1 3.95Å; F372-Y395 HydrophobicContact CZ-CD1 4.23Å; F372-Y395 HydrophobicContact CZ-CE1 4.16Å; Y395-I397 VanDerWaalsContact C-N 3.27Å; Y395-I397 PolarHBondContact O-N 3.18Å; Y395-Y398 HydrophobicContact CD2-CG 4.33Å; Y395-Y398 CarbonylContact O-C 3.15Å; Y395-Y398 WeakPolarHBondContact O-CA 3.47Å; Y395-Y398 WeakPolarHBondContact O-CB 3.31Å; Y395-Y398 PolarHBondContact O-N 2.8Å; Y395-K399 WeakPolarHBondContact O-CB 3.44Å; Y395-K399 PolarHBondContact O-N 2.81Å
396	I	61	Low	45.2	Very low	21 Å²	21	80.7 Å²	80.7	11%	0.108	44%	0.439	C	S	.	.	H	α-helix	trans	-57.9	-46	-175.2	-63.5	169.6	0	0	0	109.6	A209 E211 A221 E324 Y398 T400	A209-I396 HydrophobicContact CB-CG2 4.31Å; E211-I396 HydrophobicContact CB-CD1 3.99Å; E211-I396 HydrophobicContact CB-CG1 4.42Å; E211-I396 HydrophobicContact CB-CG2 4.41Å; A221-I396 HydrophobicContact CB-CG2 4.02Å; E324-I396 PolarHBondContact OE1-N 3.03Å; E324-I396 PolarHBondContact OE2-N 3.47Å; I396-Y398 PolarHBondContact O-N 3.34Å; I396-T400 WeakPolarHBondContact O-CB 3.34Å; I396-T400 PolarHBondContact O-N 3.34Å; I396-T400 VanDerWaalsContact O-N 3.08Å; I396-T400 PolarHBondContact O-OG1 3.23Å
397	I	57.8	Low	45.8	Very low	1 Å²	1	83 Å²	83	1%	0.005	44%	0.438	C	S	.	.	H	α-helix	trans	-62.1	-44.2	177.3	-67.9	169	0	0	0	110.8	A209 E324 M326 Y395 T400 I401	A209-I397 HydrophobicContact CB-CD1 4.21Å; A209-I397 HydrophobicContact CB-CG1 3.52Å; E324-I397 HydrophobicContact CB-CD1 3.53Å; E324-I397 HydrophobicContact CB-CG1 4.1Å; E324-I397 VanDerWaalsContact OE2-CG1 3.26Å; E324-I397 WeakPolarHBondContact OE2-CG1 3.4Å; E324-I397 PolarHBondContact OE2-N 3.41Å; M326-I397 HydrophobicContact CB-CD1 4.42Å; M326-I397 HydrophobicContact CE-CG2 3.38Å; M326-I397 HydrophobicContact CG-CD1 3.96Å; M326-I397 HydrophobicContact SD-CD1 4.23Å; M326-I397 HydrophobicContact SD-CG2 3.61Å; Y395-I397 VanDerWaalsContact C-N 3.27Å; Y395-I397 PolarHBondContact O-N 3.18Å; I397-T400 PolarHBondContact O-N 3.16Å; I397-I401 HydrophobicContact CG2-CD1 3.54Å; I397-I401 HydrophobicContact CG2-CG1 4.31Å; I397-I401 WeakPolarHBondContact O-CB 3.34Å; I397-I401 WeakPolarHBondContact O-CD1 3.22Å; I397-I401 WeakPolarHBondContact O-CG1 3.42Å; I397-I401 PolarHBondContact O-N 3.18Å
398	Y	59.8	Low	46.1	Very low	33 Å²	33	81.4 Å²	81.4	13%	0.129	42%	0.423	C	S	.	.	H	α-helix	trans	-65.2	-45.8	179	-175.8	-96.6	0	0	0	113	P340 T394 Y395 I396 T400 I401 Y402	P340-Y398 HydrophobicContact CG-CD2 3.74Å; P340-Y398 HydrophobicContact CG-CE2 3.44Å; P340-Y398 VanDerWaalsContact CG-CE2 3.44Å; T394-Y398 HydrophobicContact CG2-CD1 3.48Å; T394-Y398 VanDerWaalsContact CG2-CD1 3.48Å; T394-Y398 HydrophobicContact CG2-CE1 3.89Å; Y395-Y398 HydrophobicContact CD2-CG 4.33Å; Y395-Y398 CarbonylContact O-C 3.15Å; Y395-Y398 WeakPolarHBondContact O-CA 3.47Å; Y395-Y398 WeakPolarHBondContact O-CB 3.31Å; Y395-Y398 PolarHBondContact O-N 2.8Å; I396-Y398 PolarHBondContact O-N 3.34Å; Y398-T400 PolarHBondContact O-N 2.73Å; Y398-I401 PolarHBondContact O-N 3.43Å; Y398-Y402 WeakPolarHBondContact O-CB 3.46Å; Y398-Y402 PolarHBondContact O-N 2.79Å
399	K	59.8	Low	46.3	Very low	109 Å²	109	80 Å²	80	47%	0.474	41%	0.411	S	S	.	.	H	α-helix	trans	-55.1	-42.2	175.1	-177.9	-177.1	173.7	-169.4	0	110.5	E211 Y395 F403	E211-K399 IonicContact OE1-NZ 3.56Å; E211-K399 PolarHBondContact OE1-NZ 3.08Å; Y395-K399 WeakPolarHBondContact O-CB 3.44Å; Y395-K399 PolarHBondContact O-N 2.81Å; K399-F403 WeakPolarHBondContact O-CB 3.3Å; K399-F403 PolarHBondContact O-N 2.89Å; K399-F403 VanDerWaalsContact O-N 3.08Å
400	T	56.9	Low	46.4	Very low	23 Å²	23	86.6 Å²	86.6	14%	0.141	42%	0.419	C	S	.	.	H	α-helix	trans	-73.1	-39.1	-179.7	-44.6	0	0	0	0	112.4	A221 M223 I396 I397 Y398 H404	A221-T400 HydrophobicContact CB-CG2 4.28Å; A221-T400 VanDerWaalsContact CB-OG1 3.24Å; A221-T400 WeakPolarHBondContact CB-OG1 3.49Å; M223-T400 VanDerWaalsContact CE-CB 3.49Å; M223-T400 HydrophobicContact CE-CG2 3.11Å; I396-T400 WeakPolarHBondContact O-CB 3.34Å; I396-T400 PolarHBondContact O-N 3.34Å; I396-T400 VanDerWaalsContact O-N 3.08Å; I396-T400 PolarHBondContact O-OG1 3.23Å; I397-T400 PolarHBondContact O-N 3.16Å; Y398-T400 PolarHBondContact O-N 2.73Å; T400-H404 PolarHBondContact O-N 3.12Å; T400-H404 VanDerWaalsContact O-N 3.08Å
401	I	55.5	Low	46.6	Very low	10 Å²	10	90.5 Å²	90.5	5%	0.051	43%	0.426	C	S	.	.	H	α-helix	trans	-61.4	-50	173.2	-70.2	163.2	0	0	0	110.9	M326 L332 I397 Y398 F403 H404 I405	M326-I401 HydrophobicContact CE-CD1 4.34Å; L332-I401 HydrophobicContact CB-CG1 4.44Å; L332-I401 HydrophobicContact CD2-CD1 3.32Å; L332-I401 HydrophobicContact CD2-CG1 3.44Å; L332-I401 VanDerWaalsContact CD2-CG1 3.44Å; L332-I401 HydrophobicContact CG-CG1 4.42Å; I397-I401 HydrophobicContact CG2-CD1 3.54Å; I397-I401 HydrophobicContact CG2-CG1 4.31Å; I397-I401 WeakPolarHBondContact O-CB 3.34Å; I397-I401 WeakPolarHBondContact O-CD1 3.22Å; I397-I401 WeakPolarHBondContact O-CG1 3.42Å; I397-I401 PolarHBondContact O-N 3.18Å; Y398-I401 PolarHBondContact O-N 3.43Å; I401-F403 VanDerWaalsContact C-N 3.32Å; I401-F403 PolarHBondContact O-N 2.93Å; I401-H404 PolarHBondContact O-N 2.91Å; I401-I405 HydrophobicContact CG2-CD1 3.6Å; I401-I405 HydrophobicContact CG2-CG1 4.39Å; I401-I405 WeakPolarHBondContact O-CG1 3.1Å; I401-I405 PolarHBondContact O-N 3.02Å
402	Y	52.8	Low	46.8	Very low	96 Å²	96	89.5 Å²	89.5	38%	0.376	42%	0.424	S	S	.	.	H	α-helix	trans	-59.7	-44	-179.3	-167.2	-92.2	0	0	0	111.2	Y398 H404 I405 Y406	Y398-Y402 WeakPolarHBondContact O-CB 3.46Å; Y398-Y402 PolarHBondContact O-N 2.79Å; Y402-H404 PolarHBondContact O-N 2.69Å; Y402-I405 PolarHBondContact O-N 2.65Å; Y402-Y406 AromaticContact CD1-CD2 3.87Å; Y402-Y406 HydrophobicContact CD1-CD2 3.87Å; Y402-Y406 HydrophobicContact CD1-CE2 4.2Å; Y402-Y406 HydrophobicContact CD2-CD2 4.45Å; Y402-Y406 HydrophobicContact CD2-CE2 4.33Å; Y402-Y406 AromaticContact CE1-CD2 3.52Å; Y402-Y406 HydrophobicContact CE1-CD2 3.52Å; Y402-Y406 AromaticContact CE1-CE2 3.46Å; Y402-Y406 HydrophobicContact CE1-CE2 3.46Å; Y402-Y406 VanDerWaalsContact CE1-CE2 3.46Å; Y402-Y406 HydrophobicContact CE1-CG 4.32Å; Y402-Y406 HydrophobicContact CE2-CD2 4.16Å; Y402-Y406 AromaticContact CE2-CE2 3.62Å; Y402-Y406 HydrophobicContact CE2-CE2 3.62Å; Y402-Y406 HydrophobicContact CG-CD2 4.33Å; Y402-Y406 AromaticContact CZ-CD2 3.7Å; Y402-Y406 AromaticContact CZ-CE2 3.14Å; Y402-Y406 AromaticContact CZ-CZ 3.83Å; Y402-Y406 WeakPolarHBondContact O-CB 3.42Å; Y402-Y406 PolarHBondContact O-N 2.65Å; Y402-Y406 WeakPolarHBondContact OH-CE2 3.34Å; Y402-Y406 PolarHBondContact OH-OH 2.79Å
403	F	53.6	Low	46.5	Very low	126 Å²	126	89 Å²	89	55%	0.553	43%	0.425	S	S	*	.	H	α-helix	trans	-61.2	-42.9	175.6	-174.7	-100	0	0	0	112.8	K399 I401 Y406 K407	K399-F403 WeakPolarHBondContact O-CB 3.3Å; K399-F403 PolarHBondContact O-N 2.89Å; K399-F403 VanDerWaalsContact O-N 3.08Å; I401-F403 VanDerWaalsContact C-N 3.32Å; I401-F403 PolarHBondContact O-N 2.93Å; F403-Y406 PolarHBondContact O-N 3.19Å; F403-K407 HydrophobicContact CE1-CD 4.27Å; F403-K407 WeakPolarHBondContact O-CB 3.5Å; F403-K407 PolarHBondContact O-N 2.91Å; F403-K407 VanDerWaalsContact O-N 3.09Å
404	H	49.4	Very low	45.8	Very low	123 Å²	123	90 Å²	90	57%	0.569	44%	0.439	S	S	*	.	H	α-helix	trans	-66.4	-40.1	178.5	-117.2	76.2	0	0	0	113	T400 I401 Y402 T408	T400-H404 PolarHBondContact O-N 3.12Å; T400-H404 VanDerWaalsContact O-N 3.08Å; I401-H404 PolarHBondContact O-N 2.91Å; Y402-H404 PolarHBondContact O-N 2.69Å; H404-T408 PolarHBondContact O-N 2.78Å; H404-T408 PolarHBondContact O-OG1 3.01Å
405	I	49.6	Very low	45.2	Very low	31 Å²	31	94.6 Å²	94.6	16%	0.159	46%	0.46	C	S	.	.	H	α-helix	trans	-68.9	-37	178	-65.5	170.7	0	0	0	111.3	I401 Y402 T408 K409	I401-I405 HydrophobicContact CG2-CD1 3.6Å; I401-I405 HydrophobicContact CG2-CG1 4.39Å; I401-I405 WeakPolarHBondContact O-CG1 3.1Å; I401-I405 PolarHBondContact O-N 3.02Å; Y402-I405 PolarHBondContact O-N 2.65Å; I405-T408 PolarHBondContact O-OG1 3.09Å; I405-K409 PolarHBondContact O-N 3.18Å
406	Y	43.2	Very low	43.7	Very low	112 Å²	112	100 Å²	100	44%	0.439	48%	0.484	S	S	.	.	H	α-helix	trans	-73.5	-34.6	178.1	-98.4	-95.1	0	0	0	113.4	Y402 F403 K409 R410	Y402-Y406 AromaticContact CD1-CD2 3.87Å; Y402-Y406 HydrophobicContact CD1-CD2 3.87Å; Y402-Y406 HydrophobicContact CD1-CE2 4.2Å; Y402-Y406 HydrophobicContact CD2-CD2 4.45Å; Y402-Y406 HydrophobicContact CD2-CE2 4.33Å; Y402-Y406 AromaticContact CE1-CD2 3.52Å; Y402-Y406 HydrophobicContact CE1-CD2 3.52Å; Y402-Y406 AromaticContact CE1-CE2 3.46Å; Y402-Y406 HydrophobicContact CE1-CE2 3.46Å; Y402-Y406 VanDerWaalsContact CE1-CE2 3.46Å; Y402-Y406 HydrophobicContact CE1-CG 4.32Å; Y402-Y406 HydrophobicContact CE2-CD2 4.16Å; Y402-Y406 AromaticContact CE2-CE2 3.62Å; Y402-Y406 HydrophobicContact CE2-CE2 3.62Å; Y402-Y406 HydrophobicContact CG-CD2 4.33Å; Y402-Y406 AromaticContact CZ-CD2 3.7Å; Y402-Y406 AromaticContact CZ-CE2 3.14Å; Y402-Y406 AromaticContact CZ-CZ 3.83Å; Y402-Y406 WeakPolarHBondContact O-CB 3.42Å; Y402-Y406 PolarHBondContact O-N 2.65Å; Y402-Y406 WeakPolarHBondContact OH-CE2 3.34Å; Y402-Y406 PolarHBondContact OH-OH 2.79Å; F403-Y406 PolarHBondContact O-N 3.19Å; Y406-K409 PolarHBondContact O-N 3.31Å; Y406-R410 PolarHBondContact O-N 2.76Å
407	K	41.8	Very low	42.3	Very low	133 Å²	133	104.5 Å²	104.5	58%	0.578	51%	0.505	S	S	*	.	H	α-helix	trans	-68.2	-34.3	177.8	-152.7	177.1	-174.6	-179.3	0	112.1	F403	F403-K407 HydrophobicContact CE1-CD 4.27Å; F403-K407 WeakPolarHBondContact O-CB 3.5Å; F403-K407 PolarHBondContact O-N 2.91Å; F403-K407 VanDerWaalsContact O-N 3.09Å
408	T	33.7	Very low	41.1	Very low	94 Å²	94	114.4 Å²	114.4	58%	0.577	55%	0.551	S	S	*	*	H	α-helix	trans	-72.9	-34.9	176.4	43.8	0	0	0	0	112.8	H404 I405 R410 K411	H404-T408 PolarHBondContact O-N 2.78Å; H404-T408 PolarHBondContact O-OG1 3.01Å; I405-T408 PolarHBondContact O-OG1 3.09Å; T408-R410 VanDerWaalsContact C-N 3.33Å; T408-R410 PolarHBondContact O-N 2.91Å; T408-K411 PolarHBondContact O-N 3.39Å
409	K	33.4	Very low	39.7	Very low	121 Å²	121	116.8 Å²	116.8	53%	0.526	58%	0.578	S	S	.	*	H	α-helix	trans	-67.7	-26.1	173.6	-75.8	-179.6	179.4	174.2	0	114	I405 Y406 K411 A412	I405-K409 PolarHBondContact O-N 3.18Å; Y406-K409 PolarHBondContact O-N 3.31Å; K409-K411 VanDerWaalsContact C-N 3.29Å; K409-K411 PolarHBondContact O-N 2.94Å; K409-A412 PolarHBondContact O-N 2.67Å
410	R	29.6	Very low	38.3	Very low	219 Å²	219	118 Å²	118	83%	0.826	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-70.7	-15.4	178.2	-111.8	-173.9	179.7	-179	2.2	114.9	Y406 T408 A412	Y406-R410 PolarHBondContact O-N 2.76Å; T408-R410 VanDerWaalsContact C-N 3.33Å; T408-R410 PolarHBondContact O-N 2.91Å; R410-A412 VanDerWaalsContact C-N 3.27Å; R410-A412 PolarHBondContact O-N 3.24Å
411	K	30.3	Very low	37.3	Very low	172 Å²	172	122.7 Å²	122.7	75%	0.748	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-79.6	-3	173.4	-78.6	-176.5	176.8	176.9	0	113.7	T408 K409	T408-K411 PolarHBondContact O-N 3.39Å; K409-K411 VanDerWaalsContact C-N 3.29Å; K409-K411 PolarHBondContact O-N 2.94Å
412	A	29.7	Very low	36.2	Very low	88 Å²	88	125.9 Å²	125.9	73%	0.727	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-112.5	3.9	-173.9	0	0	0	0	0	116.6	K409 R410	K409-A412 PolarHBondContact O-N 2.67Å; R410-A412 VanDerWaalsContact C-N 3.27Å; R410-A412 PolarHBondContact O-N 3.24Å
413	S	25.3	Very low	35.2	Very low	99 Å²	99	125.5 Å²	125.5	69%	0.692	64%	0.642	S	S	*	*			trans	-152.7	99.5	170.8	53	0	0	0	0	112.5
414	V	31.7	Very low	34.3	Very low	131 Å²	131	124.9 Å²	124.9	79%	0.794	65%	0.648	S	S	*	*			trans	-99.8	127.9	163.3	175.5	0	0	0	0	107
415	L	32.1	Very low	33.4	Very low	166 Å²	166	125 Å²	125	87%	0.869	65%	0.652	S	S	*	*	S	Bend	trans	105.7	113.6	175.7	-63.6	156.9	0	0	0	116
416	K	30.6	Very low	32.6	Very low	191 Å²	191	126.9 Å²	126.9	83%	0.83	67%	0.673	S	S	*	*	S	Bend	trans	87.6	72.2	167.2	-62.8	-177	175.4	177.5	0	118.4
417	E	32.6	Very low	31.9	Very low	117 Å²	117	130.1 Å²	130.1	55%	0.547	69%	0.689	S	S	.	*			trans	-161.4	42.5	145.7	-139.7	93	-144.4	0	0	113.6	A419 K420	E417-A419 VanDerWaalsContact C-N 3.34Å; E417-K420 HydrophobicContact CG-CB 4.5Å; E417-K420 VanDerWaalsContact OE1-CD 3.28Å; E417-K420 WeakPolarHBondContact OE1-CD 3.43Å; E417-K420 WeakPolarHBondContact OE1-CE 3.35Å; E417-K420 IonicContact OE1-NZ 3.73Å; E417-K420 PolarHBondContact OE1-NZ 2.76Å
418	Q	30.8	Very low	31.3	Very low	208 Å²	208	128 Å²	128	97%	0.972	69%	0.691	S	S	*	*	S	Bend	trans	-88.5	7.2	171.7	-91.6	-177.4	-13.7	0	0	114.3
419	A	30.8	Very low	31.1	Very low	83 Å²	83	134.9 Å²	134.9	69%	0.686	71%	0.706	S	S	*	*	S	Bend	trans	-116.3	-3.5	-175.4	0	0	0	0	0	115.7	E417	E417-A419 VanDerWaalsContact C-N 3.34Å
420	K	30.3	Very low	30.8	Very low	135 Å²	135	133.4 Å²	133.4	59%	0.587	72%	0.717	S	S	*	*	S	Bend	trans	-104.2	-20.1	-178.9	-77.8	-167.2	-165.4	136.3	0	115.7	E417	E417-K420 HydrophobicContact CG-CB 4.5Å; E417-K420 VanDerWaalsContact OE1-CD 3.28Å; E417-K420 WeakPolarHBondContact OE1-CD 3.43Å; E417-K420 WeakPolarHBondContact OE1-CE 3.35Å; E417-K420 IonicContact OE1-NZ 3.73Å; E417-K420 PolarHBondContact OE1-NZ 2.76Å
421	I	36.9	Very low	30.6	Very low	121 Å²	121	127.8 Å²	127.8	62%	0.621	71%	0.711	S	S	*	*	H	α-helix	trans	-79.2	-28.7	-175	-60.2	175.3	0	0	0	112	T423 L425	I421-T423 VanDerWaalsContact C-N 3.27Å; I421-T423 PolarHBondContact O-N 2.82Å; I421-L425 HydrophobicContact CG2-CD1 4.41Å
422	A	33	Very low	30.7	Very low	78 Å²	78	127.8 Å²	127.8	65%	0.645	72%	0.717	S	S	*	*	H	α-helix	trans	-68	-25.1	175.5	0	0	0	0	0	113.2
423	T	30.2	Very low	30.6	Very low	87 Å²	87	131.8 Å²	131.8	53%	0.534	72%	0.721	S	S	.	*	H	α-helix	trans	-88.1	-20.5	-172.2	-23.3	0	0	0	0	113.4	I421	I421-T423 VanDerWaalsContact C-N 3.27Å; I421-T423 PolarHBondContact O-N 2.82Å
424	V	34.4	Very low	30.7	Very low	113 Å²	113	135.3 Å²	135.3	69%	0.685	73%	0.727	S	S	*	*	H	α-helix	trans	-87.3	-36.8	179.3	179.5	0	0	0	0	111.3	A426 K427	V424-A426 VanDerWaalsContact C-N 3.32Å; V424-A426 PolarHBondContact O-N 2.85Å; V424-K427 PolarHBondContact O-N 3.06Å
425	L	32	Very low	30.3	Very low	126 Å²	126	134 Å²	134	66%	0.66	72%	0.723	S	S	*	*	H	α-helix	trans	-75.6	-17.5	176.8	-74.2	165.2	0	0	0	113.8	I421	I421-L425 HydrophobicContact CG2-CD1 4.41Å
426	A	31.3	Very low	29.8	Very low	71 Å²	71	132.7 Å²	132.7	59%	0.587	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-17.3	176	0	0	0	0	0	113.9	V424	V424-A426 VanDerWaalsContact C-N 3.32Å; V424-A426 PolarHBondContact O-N 2.85Å
427	K	29.2	Very low	29.6	Very low	180 Å²	180	129.1 Å²	129.1	78%	0.783	72%	0.718	S	S	*	*	S	Bend	trans	-90.1	-15	-178.1	-89	-176.6	174.2	-179	0	114.9	V424	V424-K427 PolarHBondContact O-N 3.06Å
428	S	29.1	Very low	29.6	Very low	88 Å²	88	129 Å²	129	62%	0.615	73%	0.727	S	S	*	*	S	Bend	trans	-90.7	-4.1	179.4	60.9	0	0	0	0	114.5
429	R	28.8	Very low	29.5	Very low	238 Å²	238	125 Å²	125	90%	0.898	72%	0.719	S	S	*	*	S	Bend	trans	-98.9	4.4	-176.9	-102.4	-178.7	177.1	175.8	-0.1	115.7
430	A	27.2	Very low	29.1	Very low	91 Å²	91	130.7 Å²	130.7	75%	0.752	73%	0.729	S	S	*	*	S	Bend	trans	-112.6	11.1	-170.8	0	0	0	0	0	116.2
431	S	27.3	Very low	29.2	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	74%	0.735	S	S	*	*			trans	-135.3	55.6	-175.4	58.4	0	0	0	0	114
432	I	31.7	Very low	28.5	Very low	171 Å²	171	130.5 Å²	130.5	88%	0.877	75%	0.747	S	S	*	*			trans	-133.9	98.2	156.4	-55.8	178.7	0	0	0	108.2
433	Q	28.1	Very low	27.9	Very low	172 Å²	172	132.6 Å²	132.6	80%	0.804	75%	0.752	S	S	*	*			trans	-155	127.1	152	-120.1	176.2	6.7	0	0	110.5
434	Q	25.9	Very low	27.5	Very low	173 Å²	173	133.3 Å²	133.3	81%	0.808	76%	0.759	S	S	*	*			trans	73.7	140	161.4	-61.3	173.1	-5.1	0	0	116.2
435	S	24.4	Very low	26.9	Very low	104 Å²	104	134.6 Å²	134.6	73%	0.727	76%	0.762	S	S	*	*			cis	-179.5	139.5	0.7	46.2	0	0	0	0	107.3
436	V	22.1	Very low	26.5	Very low	139 Å²	139	137.5 Å²	137.5	84%	0.842	77%	0.773	S	S	*	*			trans	-148.4	131.3	158	-175.4	0	0	0	0	110.2
437	P	26	Very low	26.1	Very low	115 Å²	115	138.9 Å²	138.9	75%	0.747	78%	0.784	S	S	*	*				-129.5	173.9	129	38.1	-28.7	0	0	0	110.6
438	P	31.9	Very low	26	Very low	114 Å²	114	136 Å²	136	74%	0.74	79%	0.787	S	S	*	*			cis	-124.5	-174.7	-36.4	37.2	-21.1	0	0	0	111.2
439	P	29.2	Very low	25.8	Very low	124 Å²	124	140.9 Å²	140.9	81%	0.805	80%	0.8	S	S	*	*			trans	-134.1	147.3	154.7	37.6	-23.5	0	0	0	115.1
440	K	21.3	Very low	25.6	Very low	203 Å²	203	135.3 Å²	135.3	88%	0.883	80%	0.797	S	S	*	*			trans	-157.8	164.8	144.6	-86.5	-165.1	-176.6	-178.5	0	106.5
441	P	33.1	Very low	25.6	Very low	109 Å²	109	135.5 Å²	135.5	71%	0.708	80%	0.799	S	S	*	*			cis	-136.2	161.8	-37.1	36.4	-21.3	0	0	0	111.4
442	T	21.8	Very low	25.5	Very low	143 Å²	143	136.4 Å²	136.4	88%	0.877	81%	0.805	S	S	*	*			trans	-164.4	119.1	142.6	7.8	0	0	0	0	112.7
443	T	21.3	Very low	25.2	Very low	122 Å²	122	136.7 Å²	136.7	75%	0.748	80%	0.802	S	S	*	*			trans	-51.4	160.1	150.4	43.6	0	0	0	0	111.4
444	C	21.5	Very low	25.4	Very low	102 Å²	102	134.3 Å²	134.3	69%	0.689	80%	0.802	S	S	*	*			cis	-167.9	173.5	8.4	-119.4	0	0	0	0	108
445	D	20.9	Very low	25.4	Very low	141 Å²	141	135.3 Å²	135.3	75%	0.754	81%	0.807	S	S	*	*			trans	112.8	98.7	149.6	-59.5	-24.5	0	0	0	118.9
446	E	24.9	Very low	25.9	Very low	187 Å²	187	136.3 Å²	136.3	87%	0.874	81%	0.809	S	S	*	*				43.5	108.9	128.8	-60.2	-173.5	166.9	0	0	119.6
447	A	22.2	Very low	27.2	Very low	100 Å²	100	137.9 Å²	137.9	83%	0.826	80%	0.804	S	S	*	*				-174.1	142.2	106.7	0	0	0	0	0	110.8
448	S	28	Very low	28.6	Very low	120 Å²	120	137 Å²	137	84%	0.839	80%	0.796	S	S	*	*			trans	-44.2	128.1	-179	52.1	0	0	0	0	117
449	E	23.6	Very low	30.2	Very low	190 Å²	190	133 Å²	133	89%	0.888	77%	0.769	S	S	*	*			trans	-126.5	124.9	150.8	-91	-173.7	165.9	0	0	109.8	A451	E449-A451 PolarHBondContact O-N 3.42Å
450	S	25.9	Very low	32.3	Very low	121 Å²	121	132 Å²	132	85%	0.846	76%	0.76	S	S	*	*			trans	-59	111.8	164.2	48.9	0	0	0	0	109.8
451	A	26.8	Very low	34.8	Very low	95 Å²	95	126.2 Å²	126.2	79%	0.785	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-87.8	118.4	169.8	0	0	0	0	0	109.4	E449 E453	E449-A451 PolarHBondContact O-N 3.42Å; A451-E453 PolarHBondContact O-N 2.99Å
452	S	25.6	Very low	36.9	Very low	119 Å²	119	121 Å²	121	83%	0.832	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-60.1	127	165.1	29	0	0	0	0	110.3
453	E	25.6	Very low	39.7	Very low	177 Å²	177	116.2 Å²	116.2	83%	0.827	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-60.9	150.8	170.2	-68.5	-178.5	159.1	0	0	111.2	A451 E455	A451-E453 PolarHBondContact O-N 2.99Å; E453-E455 PolarHBondContact O-N 2.84Å
454	P	30.8	Very low	42.8	Very low	123 Å²	123	112.6 Å²	112.6	80%	0.799	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-71.8	119.3	173.4	29.6	-30.5	0	0	0	109.7	T456	P454-T456 PolarHBondContact O-N 2.79Å; P454-T456 VanDerWaalsContact O-N 3.14Å
455	E	25.7	Very low	45.9	Very low	193 Å²	193	107.8 Å²	107.8	90%	0.902	61%	0.614	S	S	*	*			trans	-59.8	113.1	178.8	-67.9	-179.9	164.4	0	0	111.8	E453 K457	E453-E455 PolarHBondContact O-N 2.84Å; E455-K457 PolarHBondContact O-N 3.11Å
456	T	36.1	Very low	49	Very low	125 Å²	125	105.3 Å²	105.3	77%	0.767	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-65.6	119.1	165.1	35.5	0	0	0	0	110.2	P454 V458	P454-T456 PolarHBondContact O-N 2.79Å; P454-T456 VanDerWaalsContact O-N 3.14Å; T456-V458 PolarHBondContact O-N 2.78Å
457	K	48.2	Very low	51.9	Low	172 Å²	172	103.8 Å²	103.8	75%	0.748	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-63.4	117.1	172.4	-69.2	-174.6	170.9	-157.4	0	110.4	E341 E455	E341-K457 IonicContact OE1-NZ 3.31Å; E341-K457 PolarHBondContact OE1-NZ 3.37Å; E455-K457 PolarHBondContact O-N 3.11Å
458	V	55.6	Low	54.9	Low	96 Å²	96	99.5 Å²	99.5	58%	0.582	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-88.4	122.4	-176.4	-176.8	0	0	0	0	111	T456 V460	T456-V458 PolarHBondContact O-N 2.78Å; V458-V460 VanDerWaalsContact C-N 3.3Å; V458-V460 HydrophobicContact CB-CG2 4.31Å; V458-V460 HydrophobicContact CG1-CG2 3.96Å; V458-V460 PolarHBondContact O-N 3.34Å
459	N	67.2	Low	57.8	Low	31 Å²	31	100.4 Å²	100.4	17%	0.166	55%	0.547	C	S	.	.			trans	-76.8	74.7	173	-177.5	3.9	0	0	0	110.9	H345 F372 E461 G462 N463	H345-N459 PolarHBondContact O-ND2 3.22Å; F372-N459 PolarHBondContact N-ND2 2.88Å; F372-N459 PolarHBondContact O-ND2 3.44Å; N459-E461 VanDerWaalsContact C-N 3.32Å; N459-E461 PolarHBondContact O-N 3.06Å; N459-G462 PolarHBondContact O-N 3.44Å; N459-G462 PolarHBondContact OD1-N 2.97Å; N459-N463 PolarHBondContact O-N 3.08Å
460	V	71.4	Confident	61.1	Low	103 Å²	103	91.4 Å²	91.4	62%	0.624	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-37.7	-175.1	-175.9	0	0	0	0	112.3	V458 N463	V458-V460 VanDerWaalsContact C-N 3.3Å; V458-V460 HydrophobicContact CB-CG2 4.31Å; V458-V460 HydrophobicContact CG1-CG2 3.96Å; V458-V460 PolarHBondContact O-N 3.34Å; V460-N463 PolarHBondContact O-N 3.19Å
461	E	75.6	Confident	64.3	Low	81 Å²	81	85.7 Å²	85.7	38%	0.379	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-33.2	179.6	-63.7	-171.2	155.8	0	0	112.9	P343 F344 N459 N463 M464	P343-E461 WeakPolarHBondContact CA-OE2 3.38Å; P343-E461 VanDerWaalsContact CB-OE2 3.26Å; P343-E461 WeakPolarHBondContact CB-OE2 3.21Å; F344-E461 HydrophobicContact CD1-CB 4.4Å; F344-E461 HydrophobicContact CD2-CB 4.1Å; F344-E461 HydrophobicContact CD2-CG 4.44Å; F344-E461 WeakPolarHBondContact CD2-OE2 3.41Å; F344-E461 HydrophobicContact CE1-CB 4.44Å; F344-E461 HydrophobicContact CE2-CB 4.06Å; F344-E461 VanDerWaalsContact CE2-CD 3.44Å; F344-E461 HydrophobicContact CE2-CG 4.05Å; F344-E461 WeakPolarHBondContact CE2-OE2 3.5Å; F344-E461 HydrophobicContact CG-CB 4.23Å; F344-E461 HydrophobicContact CZ-CB 4.26Å; F344-E461 HydrophobicContact CZ-CG 4.4Å; F344-E461 PolarHBondContact N-OE2 2.74Å; N459-E461 VanDerWaalsContact C-N 3.32Å; N459-E461 PolarHBondContact O-N 3.06Å; E461-N463 VanDerWaalsContact C-N 3.3Å; E461-N463 PolarHBondContact O-N 3.34Å; E461-M464 WeakPolarHBondContact O-CB 3.35Å; E461-M464 VanDerWaalsContact O-CG 3.31Å; E461-M464 WeakPolarHBondContact O-CG 3.48Å; E461-M464 PolarHBondContact O-N 3.47Å
462	G	75.3	Confident	67.5	Low	0 Å²	0	81.2 Å²	81.2	0%	0	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-31.5	176.6	0	0	0	0	0	113.1	N459 M464 Y465	N459-G462 PolarHBondContact O-N 3.44Å; N459-G462 PolarHBondContact OD1-N 2.97Å; G462-M464 PolarHBondContact O-N 2.77Å; G462-M464 VanDerWaalsContact O-N 3.14Å; G462-Y465 WeakPolarHBondContact O-CB 3.41Å; G462-Y465 WeakPolarHBondContact O-CD2 3.35Å; G462-Y465 PolarHBondContact O-N 3.19Å; G462-Y465 VanDerWaalsContact O-N 3.09Å
463	N	82.4	Confident	70.7	Confident	43 Å²	43	75.8 Å²	75.8	23%	0.23	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.5	178.1	-72.9	-28.3	0	0	0	112.8	Y373 N459 V460 E461 Y465 L466 E467	Y373-N463 PolarHBondContact OH-OD1 2.86Å; N459-N463 PolarHBondContact O-N 3.08Å; V460-N463 PolarHBondContact O-N 3.19Å; E461-N463 VanDerWaalsContact C-N 3.3Å; E461-N463 PolarHBondContact O-N 3.34Å; N463-Y465 PolarHBondContact O-N 3.01Å; N463-L466 PolarHBondContact O-N 3.08Å; N463-L466 VanDerWaalsContact O-N 3.09Å; N463-E467 PolarHBondContact O-N 3.28Å
464	M	85.5	Confident	73.9	Confident	45 Å²	45	67.5 Å²	67.5	22%	0.222	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-22.4	176.5	-54.9	-170.4	71.3	0	0	113	P190 T192 F344 E461 G462 A468	P190-M464 HydrophobicContact CB-CB 3.99Å; P190-M464 HydrophobicContact CB-CE 4.29Å; P190-M464 HydrophobicContact CG-CB 3.98Å; T192-M464 HydrophobicContact CG2-CE 3.45Å; T192-M464 VanDerWaalsContact CG2-CE 3.45Å; T192-M464 HydrophobicContact CG2-SD 4.39Å; F344-M464 HydrophobicContact CE1-SD 3.68Å; F344-M464 HydrophobicContact CZ-SD 3.93Å; E461-M464 WeakPolarHBondContact O-CB 3.35Å; E461-M464 VanDerWaalsContact O-CG 3.31Å; E461-M464 WeakPolarHBondContact O-CG 3.48Å; E461-M464 PolarHBondContact O-N 3.47Å; G462-M464 PolarHBondContact O-N 2.77Å; G462-M464 VanDerWaalsContact O-N 3.14Å; M464-A468 VanDerWaalsContact O-CB 3.27Å; M464-A468 WeakPolarHBondContact O-CB 3.47Å; M464-A468 PolarHBondContact O-N 3.1Å
465	Y	87.2	Confident	76.9	Confident	1 Å²	1	62.3 Å²	62.3	0%	0.004	32%	0.316	C	S	.	.	H	α-helix	trans	-67.7	-37.3	173.6	-69.9	-59.4	0	0	0	112.5	P190 W193 L325 F344 V369 G462 N463 K469 T470	P190-Y465 HydrophobicContact CG-CD1 3.93Å; P190-Y465 HydrophobicContact CG-CE1 4.1Å; W193-Y465 HydrophobicContact CH2-CE1 4.14Å; W193-Y465 WeakPolarHBondContact CH2-OH 3.43Å; W193-Y465 HydrophobicContact CZ2-CE1 4.03Å; W193-Y465 VanDerWaalsContact CZ2-OH 3.29Å; W193-Y465 WeakPolarHBondContact CZ2-OH 3.41Å; L325-Y465 HydrophobicContact CD2-CE1 3.91Å; F344-Y465 HydrophobicContact CB-CE2 4.26Å; F344-Y465 WeakPolarHBondContact O-CE2 3.42Å; F344-Y465 PolarHBondContact O-OH 3.29Å; F344-Y465 VanDerWaalsContact O-OH 3.1Å; V369-Y465 HydrophobicContact CB-CD1 4.34Å; V369-Y465 HydrophobicContact CB-CG 4.23Å; V369-Y465 HydrophobicContact CG1-CD1 3.92Å; V369-Y465 HydrophobicContact CG1-CD2 3.79Å; V369-Y465 HydrophobicContact CG1-CE1 4.33Å; V369-Y465 HydrophobicContact CG1-CE2 4.22Å; V369-Y465 HydrophobicContact CG1-CG 3.62Å; G462-Y465 WeakPolarHBondContact O-CB 3.41Å; G462-Y465 WeakPolarHBondContact O-CD2 3.35Å; G462-Y465 PolarHBondContact O-N 3.19Å; G462-Y465 VanDerWaalsContact O-N 3.09Å; N463-Y465 PolarHBondContact O-N 3.01Å; Y465-K469 WeakPolarHBondContact O-CA 3.25Å; Y465-K469 PolarHBondContact O-N 3.05Å; Y465-T470 HydrophobicContact CD1-CG2 3.96Å; Y465-T470 HydrophobicContact CE1-CG2 4.37Å; Y465-T470 PolarHBondContact O-N 3.48Å
466	L	84.9	Confident	80.2	Confident	89 Å²	89	53.2 Å²	53.2	47%	0.466	27%	0.273	S	S	.	.	H	α-helix	trans	-70.1	-43.9	176.8	-66.9	171.3	0	0	0	111	P371 N463 A468 K469	P371-L466 VanDerWaalsContact CD-CD1 3.48Å; P371-L466 HydrophobicContact CG-CD1 3.72Å; P371-L466 HydrophobicContact CG-CG 4.3Å; N463-L466 PolarHBondContact O-N 3.08Å; N463-L466 VanDerWaalsContact O-N 3.09Å; L466-A468 VanDerWaalsContact C-N 3.29Å; L466-A468 PolarHBondContact O-N 3.05Å; L466-K469 PolarHBondContact O-N 2.92Å; L466-K469 VanDerWaalsContact O-N 3.08Å
467	E	85.8	Confident	82.9	Confident	155 Å²	155	48 Å²	48	72%	0.724	24%	0.242	S	C	*	.	H	α-helix	trans	-59.5	-42.9	176.3	-66.7	178	178.5	0	0	111.5	N463 K469	N463-E467 PolarHBondContact O-N 3.28Å; E467-K469 VanDerWaalsContact C-N 3.27Å; E467-K469 PolarHBondContact O-N 3.28Å
468	A	85.2	Confident	85.1	Confident	11 Å²	11	40.3 Å²	40.3	9%	0.091	21%	0.209	C	C	.	.	H	α-helix	trans	-77.6	-11.3	178.4	0	0	0	0	0	113	S188 P190 M464 L466 T470	S188-A468 WeakPolarHBondContact CB-O 3.07Å; S188-A468 VanDerWaalsContact O-CB 3.28Å; S188-A468 WeakPolarHBondContact O-CB 3.4Å; S188-A468 PolarHBondContact OG-O 3.36Å; P190-A468 HydrophobicContact CG-CB 4.44Å; M464-A468 VanDerWaalsContact O-CB 3.27Å; M464-A468 WeakPolarHBondContact O-CB 3.47Å; M464-A468 PolarHBondContact O-N 3.1Å; L466-A468 VanDerWaalsContact C-N 3.29Å; L466-A468 PolarHBondContact O-N 3.05Å; A468-T470 VanDerWaalsContact C-N 3.29Å; A468-T470 PolarHBondContact O-N 2.98Å
469	K	90	Very high	86.7	Confident	138 Å²	138	39 Å²	39	60%	0.6	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.3	48.9	-168.7	-61.8	-174.2	177	-172	0	111.8	F282 Y465 L466 E467	F282-K469 HydrophobicContact CE1-CB 4.33Å; F282-K469 HydrophobicContact CE2-CB 4.09Å; F282-K469 HydrophobicContact CE2-CD 4.1Å; F282-K469 HydrophobicContact CZ-CB 3.56Å; F282-K469 HydrophobicContact CZ-CD 4.22Å; F282-K469 WeakPolarHBondContact CZ-O 3.22Å; Y465-K469 WeakPolarHBondContact O-CA 3.25Å; Y465-K469 PolarHBondContact O-N 3.05Å; L466-K469 PolarHBondContact O-N 2.92Å; L466-K469 VanDerWaalsContact O-N 3.08Å; E467-K469 VanDerWaalsContact C-N 3.27Å; E467-K469 PolarHBondContact O-N 3.28Å
470	T	91.9	Very high	87.7	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.012	21%	0.207	C	C	.	.			trans	-68.3	135.6	-178.5	-54.8	0	0	0	0	110.7	F187 S188 V189 V369 Y465 A468	F187-T470 WeakPolarHBondContact O-CA 3.22Å; F187-T470 WeakPolarHBondContact O-CG2 3.38Å; S188-T470 WeakPolarHBondContact O-CA 3.29Å; S188-T470 WeakPolarHBondContact O-CB 3.3Å; S188-T470 PolarHBondContact O-OG1 3.2Å; V189-T470 HydrophobicContact CG1-CG2 4.24Å; V369-T470 HydrophobicContact CB-CG2 4.36Å; V369-T470 HydrophobicContact CG2-CG2 3.8Å; V369-T470 PolarHBondContact N-O 2.98Å; Y465-T470 HydrophobicContact CD1-CG2 3.96Å; Y465-T470 HydrophobicContact CE1-CG2 4.37Å; Y465-T470 PolarHBondContact O-N 3.48Å; A468-T470 VanDerWaalsContact C-N 3.29Å; A468-T470 PolarHBondContact O-N 2.98Å
471	Y	93.4	Very high	88.4	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.6	173.9	69.6	-90.5	0	0	0	111.2	A186 F187 L274 F282 R283 A286 A366 Y367 I473	A186-Y471 CarbonylContact C-O 3.5Å; A186-Y471 VanDerWaalsContact CA-O 3.3Å; A186-Y471 WeakPolarHBondContact CA-O 3.39Å; F187-Y471 HydrophobicContact CB-CD1 4.1Å; F187-Y471 HydrophobicContact CB-CD2 4.36Å; F187-Y471 HydrophobicContact CB-CE1 3.53Å; F187-Y471 HydrophobicContact CB-CE2 3.83Å; F187-Y471 HydrophobicContact CB-CG 4.48Å; F187-Y471 HydrophobicContact CD2-CD2 4.21Å; F187-Y471 AromaticContact CD2-CE2 3.45Å; F187-Y471 HydrophobicContact CD2-CE2 3.45Å; F187-Y471 VanDerWaalsContact CD2-CE2 3.45Å; F187-Y471 AromaticContact CD2-CZ 3.73Å; F187-Y471 HydrophobicContact CE2-CE2 4.33Å; F187-Y471 HydrophobicContact CG-CE1 4.39Å; F187-Y471 AromaticContact CG-CE2 3.96Å; F187-Y471 HydrophobicContact CG-CE2 3.96Å; F187-Y471 AromaticContact CG-CZ 3.74Å; F187-Y471 PolarHBondContact N-O 3.49Å; F187-Y471 PolarHBondContact O-N 3.19Å; L274-Y471 HydrophobicContact CD1-CD1 3.85Å; L274-Y471 HydrophobicContact CD1-CD2 4.18Å; L274-Y471 HydrophobicContact CD1-CG 3.62Å; F282-Y471 AromaticContact CE1-CD1 3.92Å; F282-Y471 HydrophobicContact CE1-CD1 3.92Å; F282-Y471 AromaticContact CE1-CE1 3.87Å; F282-Y471 HydrophobicContact CE1-CE1 3.87Å; F282-Y471 HydrophobicContact CZ-CD1 4.46Å; F282-Y471 HydrophobicContact CZ-CE1 4.42Å; R283-Y471 HydrophobicContact CG-CE1 4.12Å; R283-Y471 HydrophobicContact CG-CE2 4.38Å; A286-Y471 HydrophobicContact CB-CE1 4.2Å; A366-Y471 HydrophobicContact CB-CD2 3.89Å; A366-Y471 HydrophobicContact CB-CE2 4.26Å; Y367-Y471 CarbonylContact O-C 3.59Å; Y367-Y471 WeakPolarHBondContact O-CA 3.46Å; Y367-Y471 WeakPolarHBondContact O-CB 3.1Å; Y471-I473 HydrophobicContact CE2-CG1 4.5Å
472	V	93.4	Very high	88.7	Confident	2 Å²	2	36 Å²	36	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.1	-177.9	-170.7	0	0	0	0	110.3	V183 T185 A186 I348 Y367 V369 I474	V183-V472 HydrophobicContact CG1-CG1 4.06Å; T185-V472 WeakPolarHBondContact O-CA 3.43Å; A186-V472 HydrophobicContact CB-CG2 3.74Å; I348-V472 HydrophobicContact CD1-CB 3.97Å; I348-V472 HydrophobicContact CD1-CG2 3.56Å; Y367-V472 PolarHBondContact N-O 3.4Å; Y367-V472 PolarHBondContact O-N 3.08Å; V369-V472 HydrophobicContact CG2-CG2 3.71Å; V472-I474 HydrophobicContact CB-CG1 4.5Å; V472-I474 HydrophobicContact CG1-CD1 4.45Å; V472-I474 HydrophobicContact CG1-CG1 3.99Å
473	I	92.6	Very high	89	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.2	171	-60.6	-175.6	0	0	0	109.5	E184 T185 F187 R364 G365 A366 Y471	E184-I473 HydrophobicContact CB-CB 4.07Å; E184-I473 HydrophobicContact CB-CG2 4.07Å; E184-I473 HydrophobicContact CG-CG2 4.1Å; E184-I473 PolarHBondContact N-O 3.49Å; T185-I473 PolarHBondContact O-N 3.15Å; F187-I473 HydrophobicContact CD2-CD1 4.43Å; F187-I473 HydrophobicContact CD2-CG1 4.45Å; F187-I473 HydrophobicContact CE2-CD1 3.7Å; F187-I473 HydrophobicContact CE2-CG1 4.1Å; R364-I473 HydrophobicContact CG-CG2 4.38Å; G365-I473 WeakPolarHBondContact O-CA 3.33Å; A366-I473 HydrophobicContact CB-CG1 4.44Å; Y471-I473 HydrophobicContact CE2-CG1 4.5Å
474	I	93.8	Very high	88.6	Confident	4 Å²	4	40 Å²	40	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.2	178.5	-57.4	177.6	0	0	0	108.9	V181 T182 V323 I348 V350 R364 G365 Y367 V472 V476	V181-I474 HydrophobicContact CG1-CG2 4.44Å; T182-I474 WeakPolarHBondContact O-CA 3.41Å; V323-I474 HydrophobicContact CB-CD1 4.43Å; V323-I474 HydrophobicContact CG1-CD1 4.3Å; V323-I474 HydrophobicContact CG2-CD1 4.15Å; I348-I474 HydrophobicContact CG2-CD1 4.16Å; V350-I474 HydrophobicContact CG2-CB 4.46Å; V350-I474 HydrophobicContact CG2-CD1 3.74Å; V350-I474 HydrophobicContact CG2-CG2 4.37Å; R364-I474 WeakPolarHBondContact CA-O 3.43Å; G365-I474 PolarHBondContact N-O 3.07Å; G365-I474 VanDerWaalsContact N-O 3.08Å; G365-I474 PolarHBondContact O-N 2.83Å; Y367-I474 HydrophobicContact CD2-CB 4.12Å; Y367-I474 HydrophobicContact CD2-CG1 4.42Å; Y367-I474 HydrophobicContact CE2-CB 4.13Å; V472-I474 HydrophobicContact CB-CG1 4.5Å; V472-I474 HydrophobicContact CG1-CD1 4.45Å; V472-I474 HydrophobicContact CG1-CG1 3.99Å; I474-V476 HydrophobicContact CG2-CG2 4.39Å
475	E	94.1	Very high	88	Confident	13 Å²	13	44.6 Å²	44.6	6%	0.061	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.3	173.5	176.8	-169.8	174	0	0	109.5	T182 K242 R362 I363 R364	T182-E475 PolarHBondContact N-O 3.18Å; T182-E475 PolarHBondContact O-N 3.38Å; K242-E475 IonicContact NZ-OE1 3.71Å; K242-E475 IonicContact NZ-OE2 3.06Å; K242-E475 PolarHBondContact NZ-OE2 2.82Å; R362-E475 HydrophobicContact CG-CG 4.48Å; R362-E475 IonicContact CZ-OE1 2.87Å; R362-E475 IonicContact NE-OE1 3.37Å; R362-E475 PolarHBondContact NE-OE1 2.78Å; R362-E475 IonicContact NH2-OE1 3.71Å; I363-E475 CarbonylContact O-C 3.57Å; I363-E475 WeakPolarHBondContact O-CA 3.41Å; R364-E475 HydrophobicContact CB-CB 4.11Å; R364-E475 HydrophobicContact CB-CG 4.13Å; R364-E475 HydrophobicContact CG-CB 3.99Å; R364-E475 HydrophobicContact CG-CG 4.43Å
476	V	94.3	Very high	87.6	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.4	172.1	178.4	0	0	0	0	108.3	M179 K180 V181 M352 L355 R362 I363 I474	M179-V476 HydrophobicContact CE-CG1 3.37Å; M179-V476 HydrophobicContact CG-CG1 4.19Å; K180-V476 WeakPolarHBondContact O-CA 3.29Å; V181-V476 HydrophobicContact CG1-CG2 4.29Å; V181-V476 HydrophobicContact CG2-CG2 4.43Å; M352-V476 HydrophobicContact CE-CG2 4.3Å; L355-V476 HydrophobicContact CD1-CG1 4.02Å; R362-V476 CarbonylContact C-O 3.48Å; R362-V476 WeakPolarHBondContact CA-O 3.47Å; I363-V476 HydrophobicContact CD1-CB 4.13Å; I363-V476 HydrophobicContact CD1-CG2 4.49Å; I363-V476 HydrophobicContact CG1-CB 3.74Å; I363-V476 HydrophobicContact CG1-CG2 4.46Å; I363-V476 PolarHBondContact N-O 2.89Å; I363-V476 PolarHBondContact O-N 2.83Å; I474-V476 HydrophobicContact CG2-CG2 4.39Å
477	S	93.7	Very high	87.5	Confident	16 Å²	16	44.9 Å²	44.9	11%	0.112	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	143.6	177.7	63.5	0	0	0	0	112	M179 K180 S361	M179-S477 CarbonylContact C-O 3.59Å; M179-S477 WeakPolarHBondContact CA-O 3.12Å; K180-S477 WeakPolarHBondContact CB-OG 3.44Å; K180-S477 PolarHBondContact N-O 2.8Å; K180-S477 PolarHBondContact O-N 3.13Å; S361-S477 CarbonylContact O-C 3.56Å; S361-S477 WeakPolarHBondContact O-CA 3.15Å
478	L	93.1	Very high	87.2	Confident	10 Å²	10	41 Å²	41	5%	0.052	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	140.2	179	-50.5	179.5	0	0	0	108.4	I177 M179 L355 S361 R480 L482	I177-L478 HydrophobicContact CG2-CB 4.03Å; I177-L478 HydrophobicContact CG2-CD2 3.94Å; I177-L478 HydrophobicContact CG2-CG 4.38Å; M179-L478 HydrophobicContact CB-CD2 3.63Å; M179-L478 HydrophobicContact CG-CD2 3.68Å; L355-L478 HydrophobicContact CD2-CD1 4.2Å; L355-L478 HydrophobicContact CD2-CG 4.39Å; S361-L478 PolarHBondContact O-N 2.85Å; L478-R480 WeakPolarHBondContact CB-O 3.24Å; L478-R480 PolarHBondContact O-N 3.25Å; L478-L482 HydrophobicContact CD1-CB 4.08Å
479	N	90.3	Very high	87.2	Confident	68 Å²	68	47.7 Å²	47.7	36%	0.364	25%	0.249	S	C	.	.	S	Bend	trans	-64.5	-23.7	173.1	68.7	-26.3	0	0	0	113	I177 I178	I177-N479 WeakPolarHBondContact CA-OD1 3.37Å; I178-N479 HydrophobicContact CB-CB 4.19Å; I178-N479 VanDerWaalsContact N-CG 3.3Å; I178-N479 PolarHBondContact N-OD1 3.08Å; I178-N479 PolarHBondContact O-N 2.87Å; I178-N479 PolarHBondContact O-OD1 3.1Å
480	R	87.2	Confident	86.9	Confident	91 Å²	91	43.5 Å²	43.5	34%	0.343	23%	0.232	S	C	.	.	S	Bend	trans	-139.7	147.1	174.3	-64.1	-165.6	-173.9	116.8	-4	109.4	L173 S174 C176 L478	L173-R480 PolarHBondContact O-NH1 3.15Å; L173-R480 PolarHBondContact O-NH2 3.37Å; S174-R480 PolarHBondContact O-NH1 2.82Å; S174-R480 VanDerWaalsContact O-NH1 3.09Å; C176-R480 PolarHBondContact O-NH1 3.2Å; L478-R480 WeakPolarHBondContact CB-O 3.24Å; L478-R480 PolarHBondContact O-N 3.25Å
481	P	86.3	Confident	86.6	Confident	43 Å²	43	43.8 Å²	43.8	28%	0.279	23%	0.233	S	C	.	.			trans	-66.3	142.9	178.8	30.8	-37	0	0	0	110.6	V360 V483	V360-P481 WeakPolarHBondContact O-CA 3.39Å; V360-P481 VanDerWaalsContact O-CB 3.28Å; V360-P481 WeakPolarHBondContact O-CB 3.3Å; P481-V483 WeakPolarHBondContact CB-O 3.47Å; P481-V483 PolarHBondContact O-N 3.46Å
482	L	83.2	Confident	86.3	Confident	19 Å²	19	45 Å²	45	10%	0.099	24%	0.243	C	C	.	.	S	Bend	trans	-65	-32	179.7	-169	61.1	0	0	0	111.5	I177 A308 K312 I315 L355 L356 L478	I177-L482 HydrophobicContact CD1-CD1 3.71Å; A308-L482 HydrophobicContact CB-CD1 4.26Å; K312-L482 HydrophobicContact CB-CD1 4.44Å; K312-L482 HydrophobicContact CB-CD2 3.98Å; K312-L482 HydrophobicContact CB-CG 4.22Å; K312-L482 HydrophobicContact CG-CD2 4.23Å; K312-L482 HydrophobicContact CG-CG 4.37Å; I315-L482 HydrophobicContact CD1-CD2 4.03Å; L355-L482 WeakPolarHBondContact O-CB 3.35Å; L356-L482 HydrophobicContact CD2-CD2 3.86Å; L478-L482 HydrophobicContact CD1-CB 4.08Å
483	V	80.4	Confident	86.1	Confident	30 Å²	30	52.3 Å²	52.3	18%	0.182	27%	0.271	C	S	.	.	S	Bend	trans	-116.5	115.7	169.8	-178.1	0	0	0	0	108.4	L356 P358 G359 P481	L356-V483 WeakPolarHBondContact O-CG2 3.17Å; P358-V483 CarbonylContact C-O 3.6Å; P358-V483 WeakPolarHBondContact CA-O 3.3Å; P358-V483 HydrophobicContact CB-CG1 4.09Å; P358-V483 HydrophobicContact CG-CG1 3.89Å; G359-V483 PolarHBondContact N-O 2.91Å; P481-V483 WeakPolarHBondContact CB-O 3.47Å; P481-V483 PolarHBondContact O-N 3.46Å
484	P	74.6	Confident	86	Confident	96 Å²	96	56.7 Å²	56.7	62%	0.623	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-69.1	141.9	179.4	27.1	-32.7	0	0	0	111
485	K	73.4	Confident	85.8	Confident	142 Å²	142	56.5 Å²	56.5	62%	0.617	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-74.8	127.1	172.3	-171	176.4	-177.9	178.8	0	109.4	S487	K485-S487 PolarHBondContact O-N 2.75Å
486	T	79	Confident	85.6	Confident	40 Å²	40	61.4 Å²	61.4	25%	0.245	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-61.5	129.1	174.9	-32.4	0	0	0	0	109.6	E490 L491	T486-E490 HydrophobicContact CG2-CB 4.11Å; T486-E490 HydrophobicContact CG2-CG 3.8Å; T486-L491 HydrophobicContact CG2-CD2 3.76Å; T486-L491 HydrophobicContact CG2-CG 3.87Å
487	S	81.9	Confident	85.5	Confident	56 Å²	56	65.3 Å²	65.3	39%	0.392	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-71.8	148.5	178.5	69.9	0	0	0	0	110.7	K485 E489 E490 L491	K485-S487 PolarHBondContact O-N 2.75Å; S487-E489 PolarHBondContact O-N 3.28Å; S487-E489 VanDerWaalsContact O-N 3.17Å; S487-E490 PolarHBondContact O-N 3.21Å; S487-E490 VanDerWaalsContact O-N 3.08Å; S487-E490 WeakPolarHBondContact OG-CB 3.45Å; S487-E490 PolarHBondContact OG-N 3.03Å; S487-L491 PolarHBondContact O-N 3.24Å
488	P	80.1	Confident	85.4	Confident	74 Å²	74	67.6 Å²	67.6	48%	0.481	35%	0.35	S	S	.	.	H	α-helix	trans	-57.1	-30.7	175.8	-25.5	34.6	0	0	0	113.1	A492	P488-A492 WeakPolarHBondContact O-CB 3.43Å; P488-A492 PolarHBondContact O-N 2.85Å
489	E	84	Confident	85.3	Confident	152 Å²	152	67.5 Å²	67.5	71%	0.71	35%	0.35	S	S	*	.	H	α-helix	trans	-68.6	-40.8	176.3	-63.1	179.7	178.6	0	0	112.6	S487 A492 R493	S487-E489 PolarHBondContact O-N 3.28Å; S487-E489 VanDerWaalsContact O-N 3.17Å; E489-A492 PolarHBondContact O-N 2.95Å; E489-R493 WeakPolarHBondContact O-CB 3.47Å; E489-R493 PolarHBondContact O-N 3.4Å
490	E	85.4	Confident	85.2	Confident	50 Å²	50	68.4 Å²	68.4	23%	0.234	36%	0.359	C	S	.	.	H	α-helix	trans	-66.1	-43.8	174.8	177.9	59.2	-155.6	0	0	110.6	T486 S487 A492 R493 R494	T486-E490 HydrophobicContact CG2-CB 4.11Å; T486-E490 HydrophobicContact CG2-CG 3.8Å; S487-E490 PolarHBondContact O-N 3.21Å; S487-E490 VanDerWaalsContact O-N 3.08Å; S487-E490 WeakPolarHBondContact OG-CB 3.45Å; S487-E490 PolarHBondContact OG-N 3.03Å; E490-A492 PolarHBondContact O-N 3.42Å; E490-R493 WeakPolarHBondContact O-CB 3.48Å; E490-R493 PolarHBondContact O-N 2.97Å; E490-R493 VanDerWaalsContact O-N 3.12Å; E490-R493 IonicContact OE2-CZ 2.98Å; E490-R493 IonicContact OE2-NE 3.45Å; E490-R493 IonicContact OE2-NH1 3.63Å; E490-R493 PolarHBondContact OE2-NH1 3.31Å; E490-R493 IonicContact OE2-NH2 2.73Å; E490-R494 WeakPolarHBondContact O-CG 2.98Å; E490-R494 PolarHBondContact O-N 3.45Å; E490-R494 IonicContact OE1-CZ 3.48Å; E490-R494 IonicContact OE1-NE 2.98Å; E490-R494 PolarHBondContact OE1-NE 3Å; E490-R494 IonicContact OE1-NH2 3.87Å
491	L	85.4	Confident	85.2	Confident	7 Å²	7	66.7 Å²	66.7	4%	0.037	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-44	175	-68.1	173.1	0	0	0	111.9	T486 S487 R493 R494 V495 E729	T486-L491 HydrophobicContact CG2-CD2 3.76Å; T486-L491 HydrophobicContact CG2-CG 3.87Å; S487-L491 PolarHBondContact O-N 3.24Å; L491-R493 VanDerWaalsContact C-N 3.28Å; L491-R493 PolarHBondContact O-N 2.97Å; L491-R494 PolarHBondContact O-N 3.29Å; L491-V495 WeakPolarHBondContact O-CG2 3.29Å; L491-V495 PolarHBondContact O-N 3.38Å; L491-E729 HydrophobicContact CD1-CB 4.09Å; L491-E729 HydrophobicContact CD2-CB 3.81Å; L491-E729 WeakPolarHBondContact CD2-OE2 2.86Å
492	A	86.6	Confident	85	Confident	26 Å²	26	69.5 Å²	69.5	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-37.6	174.4	0	0	0	0	0	111.8	P488 E489 E490 K496	P488-A492 WeakPolarHBondContact O-CB 3.43Å; P488-A492 PolarHBondContact O-N 2.85Å; E489-A492 PolarHBondContact O-N 2.95Å; E490-A492 PolarHBondContact O-N 3.42Å; A492-K496 WeakPolarHBondContact O-CB 3.42Å; A492-K496 PolarHBondContact O-N 3.37Å
493	R	88.8	Confident	84.6	Confident	155 Å²	155	74.4 Å²	74.4	59%	0.585	40%	0.401	S	S	*	.	H	α-helix	trans	-65.6	-42.9	175.3	-164.5	-169.8	-56.3	140.9	11.7	111.9	E489 E490 L491 K496 A497	E489-R493 WeakPolarHBondContact O-CB 3.47Å; E489-R493 PolarHBondContact O-N 3.4Å; E490-R493 WeakPolarHBondContact O-CB 3.48Å; E490-R493 PolarHBondContact O-N 2.97Å; E490-R493 VanDerWaalsContact O-N 3.12Å; E490-R493 IonicContact OE2-CZ 2.98Å; E490-R493 IonicContact OE2-NE 3.45Å; E490-R493 IonicContact OE2-NH1 3.63Å; E490-R493 PolarHBondContact OE2-NH1 3.31Å; E490-R493 IonicContact OE2-NH2 2.73Å; L491-R493 VanDerWaalsContact C-N 3.28Å; L491-R493 PolarHBondContact O-N 2.97Å; R493-K496 PolarHBondContact O-N 2.97Å; R493-A497 WeakPolarHBondContact O-CB 3.32Å; R493-A497 PolarHBondContact O-N 3.35Å
494	R	89.7	Confident	83.8	Confident	96 Å²	96	82.6 Å²	82.6	36%	0.362	43%	0.434	S	S	.	.	H	α-helix	trans	-64.5	-46.5	176.6	-67.3	177.3	-174.5	-169.9	0.5	111.7	E490 L491 K496 A497 L498 T726	E490-R494 WeakPolarHBondContact O-CG 2.98Å; E490-R494 PolarHBondContact O-N 3.45Å; E490-R494 IonicContact OE1-CZ 3.48Å; E490-R494 IonicContact OE1-NE 2.98Å; E490-R494 PolarHBondContact OE1-NE 3Å; E490-R494 IonicContact OE1-NH2 3.87Å; L491-R494 PolarHBondContact O-N 3.29Å; R494-K496 VanDerWaalsContact C-N 3.3Å; R494-K496 PolarHBondContact O-N 3.29Å; R494-A497 WeakPolarHBondContact O-CB 3.5Å; R494-A497 PolarHBondContact O-N 2.81Å; R494-A497 VanDerWaalsContact O-N 3.1Å; R494-L498 WeakPolarHBondContact O-CG 3.15Å; R494-L498 PolarHBondContact O-N 3.23Å; R494-T726 HydrophobicContact CB-CG2 3.54Å
495	V	90.4	Very high	83.2	Confident	1 Å²	1	86.2 Å²	86.2	1%	0.006	44%	0.435	C	S	.	.	H	α-helix	trans	-60.7	-41.3	174.3	172.2	0	0	0	0	111	L491 A497 L498 I499 V698 L708 T726 F727 R730	L491-V495 WeakPolarHBondContact O-CG2 3.29Å; L491-V495 PolarHBondContact O-N 3.38Å; V495-A497 VanDerWaalsContact C-N 3.3Å; V495-A497 PolarHBondContact O-N 3.15Å; V495-L498 PolarHBondContact O-N 2.98Å; V495-I499 PolarHBondContact O-N 3.49Å; V495-V698 HydrophobicContact CG1-CG1 4.06Å; V495-L708 HydrophobicContact CG1-CD2 4.19Å; V495-T726 HydrophobicContact CG2-CG2 3.92Å; V495-F727 HydrophobicContact CG1-CE1 4.36Å; V495-F727 HydrophobicContact CG2-CD1 4.22Å; V495-F727 HydrophobicContact CG2-CE1 4.49Å; V495-R730 HydrophobicContact CG2-CB 3.84Å; V495-R730 HydrophobicContact CG2-CG 3.95Å
496	K	90.6	Very high	82.4	Confident	116 Å²	116	85.2 Å²	85.2	50%	0.504	44%	0.443	S	S	.	.	H	α-helix	trans	-64.8	-31	175.1	-179.6	171.2	-177	-176.3	0	113.5	A492 R493 R494 I499	A492-K496 WeakPolarHBondContact O-CB 3.42Å; A492-K496 PolarHBondContact O-N 3.37Å; R493-K496 PolarHBondContact O-N 2.97Å; R494-K496 VanDerWaalsContact C-N 3.3Å; R494-K496 PolarHBondContact O-N 3.29Å; K496-I499 CarbonylContact O-C 3.59Å
497	A	91.5	Very high	81.2	Confident	83 Å²	83	87.9 Å²	87.9	69%	0.686	47%	0.469	S	S	*	.	H	α-helix	trans	-72	-37.2	174.7	0	0	0	0	0	111.8	R493 R494 V495	R493-A497 WeakPolarHBondContact O-CB 3.32Å; R493-A497 PolarHBondContact O-N 3.35Å; R494-A497 WeakPolarHBondContact O-CB 3.5Å; R494-A497 PolarHBondContact O-N 2.81Å; R494-A497 VanDerWaalsContact O-N 3.1Å; V495-A497 VanDerWaalsContact C-N 3.3Å; V495-A497 PolarHBondContact O-N 3.15Å
498	L	90.7	Very high	80.1	Confident	65 Å²	65	88 Å²	88	34%	0.34	48%	0.479	S	S	.	.	H	α-helix	trans	-74.2	-43.4	175.1	-65.4	175.1	0	0	0	112.2	R494 V495 E723 T726 F727	R494-L498 WeakPolarHBondContact O-CG 3.15Å; R494-L498 PolarHBondContact O-N 3.23Å; V495-L498 PolarHBondContact O-N 2.98Å; L498-E723 HydrophobicContact CD1-CB 4.48Å; L498-E723 HydrophobicContact CD1-CG 4.36Å; L498-E723 HydrophobicContact CD2-CG 4.11Å; L498-T726 HydrophobicContact CD1-CG2 4.02Å; L498-F727 HydrophobicContact CB-CZ 4.12Å; L498-F727 HydrophobicContact CD1-CE1 4.2Å; L498-F727 HydrophobicContact CD1-CE2 4.11Å; L498-F727 HydrophobicContact CD1-CZ 3.77Å
499	I	91.6	Very high	79.2	Confident	7 Å²	7	87.7 Å²	87.7	4%	0.036	48%	0.477	C	S	.	.	S	Bend	trans	-133.8	94	-175.5	-53.6	176.2	0	0	0	109.1	V495 K496 Y695 V698 Q702 F727	V495-I499 PolarHBondContact O-N 3.49Å; K496-I499 CarbonylContact O-C 3.59Å; I499-Y695 HydrophobicContact CD1-CD1 3.8Å; I499-Y695 HydrophobicContact CD1-CD2 3.74Å; I499-Y695 HydrophobicContact CD1-CE1 4.06Å; I499-Y695 HydrophobicContact CD1-CE2 4.02Å; I499-Y695 HydrophobicContact CD1-CG 3.61Å; I499-Y695 HydrophobicContact CG1-CD2 3.76Å; I499-Y695 HydrophobicContact CG1-CE2 3.97Å; I499-Y695 HydrophobicContact CG1-CG 4.14Å; I499-Y695 WeakPolarHBondContact CG2-O 3.37Å; I499-V698 HydrophobicContact CB-CG1 4.36Å; I499-V698 HydrophobicContact CD1-CB 4.01Å; I499-V698 HydrophobicContact CD1-CG1 3.91Å; I499-V698 HydrophobicContact CG2-CB 4.4Å; I499-V698 HydrophobicContact CG2-CG1 4.25Å; I499-Q702 PolarHBondContact O-NE2 3.45Å; I499-F727 HydrophobicContact CD1-CE1 3.63Å; I499-F727 HydrophobicContact CD1-CZ 3.69Å; I499-F727 HydrophobicContact CG1-CE1 4.27Å; I499-F727 HydrophobicContact CG1-CZ 4.18Å
500	P	88.9	Confident	78.7	Confident	88 Å²	88	84 Å²	84	57%	0.571	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-61.7	138	174.7	-23.4	34.4	0	0	0	111.3
501	P	87.6	Confident	78.2	Confident	54 Å²	54	89.3 Å²	89.3	35%	0.351	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-69.4	140.5	178.5	29.4	-32.6	0	0	0	109.6	S699 Q702	P501-S699 CarbonylContact C-O 3.4Å; P501-S699 VanDerWaalsContact CA-O 3.3Å; P501-S699 WeakPolarHBondContact CA-O 3.07Å; P501-Q702 HydrophobicContact CB-CG 4.44Å
502	K	82.1	Confident	77.8	Confident	103 Å²	103	89.8 Å²	89.8	45%	0.448	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-63.6	137.9	176.5	-82.6	-180	177.3	179.9	0	110	K504 D696 S699	K502-K504 PolarHBondContact O-N 2.99Å; K502-D696 WeakPolarHBondContact CE-OD1 3.27Å; K502-D696 IonicContact NZ-OD1 2.96Å; K502-D696 PolarHBondContact NZ-OD1 3.33Å; K502-D696 IonicContact NZ-OD2 2.62Å; K502-D696 PolarHBondContact NZ-OD2 2.92Å; K502-S699 WeakPolarHBondContact CD-OG 3.34Å; K502-S699 WeakPolarHBondContact CE-OG 3.18Å; K502-S699 WeakPolarHBondContact CG-OG 3.33Å; K502-S699 PolarHBondContact N-O 3.41Å
503	P	74	Confident	77.5	Confident	122 Å²	122	92.8 Å²	92.8	79%	0.792	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-59.5	125.1	172.5	24.4	-31	0	0	0	108.2	R505	P503-R505 PolarHBondContact O-N 3.5Å
504	K	62.9	Low	77.2	Confident	201 Å²	201	91.8 Å²	91.8	87%	0.874	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-55.7	128.2	176.5	-67.9	-172.8	177.7	-172.8	0	108	K502	K502-K504 PolarHBondContact O-N 2.99Å
505	R	62	Low	77	Confident	173 Å²	173	87.4 Å²	87.4	65%	0.653	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-54	145	175	-69.8	-178	179.1	-176.1	1.8	108.5	P503 A507	P503-R505 PolarHBondContact O-N 3.5Å; R505-A507 PolarHBondContact O-N 2.88Å; R505-A507 VanDerWaalsContact O-N 3.12Å
506	P	57.2	Low	76.8	Confident	121 Å²	121	88 Å²	88	79%	0.786	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-52	127.5	174.7	22.1	-31.4	0	0	0	107.7	G508	P506-G508 PolarHBondContact O-N 3.09Å
507	A	53.6	Low	76.6	Confident	96 Å²	96	86.4 Å²	86.4	79%	0.793	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-48.4	134.1	179.6	0	0	0	0	0	108.5	R505	R505-A507 PolarHBondContact O-N 2.88Å; R505-A507 VanDerWaalsContact O-N 3.12Å
508	G	58.6	Low	76.4	Confident	57 Å²	57	84.4 Å²	84.4	59%	0.588	46%	0.462	S	S	*	.	S	Bend	trans	-51.5	170	179.2	0	0	0	0	0	112.3	P506 T510	P506-G508 PolarHBondContact O-N 3.09Å; G508-T510 PolarHBondContact O-N 3.12Å; G508-T510 VanDerWaalsContact O-N 3.16Å
509	P	62.2	Low	76.5	Confident	68 Å²	68	81.7 Å²	81.7	44%	0.442	45%	0.448	S	S	.	.	S	Bend	trans	-50.4	126.8	-162.2	16.3	-29.6	0	0	0	111.2	E513 K514	P509-E513 WeakPolarHBondContact CA-OE2 3.41Å; P509-E513 HydrophobicContact CB-CB 3.53Å; P509-K514 HydrophobicContact CB-CG 4.26Å; P509-K514 HydrophobicContact CG-CG 4.18Å; P509-K514 WeakPolarHBondContact O-CE 3.37Å
510	T	72.6	Confident	76.5	Confident	74 Å²	74	82.5 Å²	82.5	45%	0.454	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-51.5	157.7	178	57.8	0	0	0	0	109.6	G508 A512 E513 K514	G508-T510 PolarHBondContact O-N 3.12Å; G508-T510 VanDerWaalsContact O-N 3.16Å; T510-A512 PolarHBondContact O-N 3.26Å; T510-E513 PolarHBondContact N-OE2 3.29Å; T510-E513 WeakPolarHBondContact O-CA 3.31Å; T510-E513 PolarHBondContact O-N 2.98Å; T510-E513 WeakPolarHBondContact OG1-CG 3.35Å; T510-E513 PolarHBondContact OG1-N 3.32Å; T510-E513 PolarHBondContact OG1-OE2 3.24Å; T510-K514 PolarHBondContact O-N 3.46Å
511	R	74.3	Confident	76.5	Confident	162 Å²	162	81.7 Å²	81.7	61%	0.611	45%	0.445	S	S	*	.	H	α-helix	trans	-50.9	-32	176.4	-166.2	-177.8	172.4	165.6	-1.4	112.3	A515 D584	R511-A515 PolarHBondContact O-N 3.27Å; R511-A515 VanDerWaalsContact O-N 3.16Å; R511-D584 HydrophobicContact CG-CB 3.96Å; R511-D584 WeakPolarHBondContact CG-OD2 3.45Å; R511-D584 IonicContact CZ-OD1 3.31Å; R511-D584 VanDerWaalsContact CZ-OD1 3.31Å; R511-D584 IonicContact CZ-OD2 3.78Å; R511-D584 IonicContact NE-OD1 2.67Å; R511-D584 PolarHBondContact NE-OD1 2.99Å; R511-D584 IonicContact NE-OD2 3.25Å; R511-D584 PolarHBondContact NE-OD2 3.32Å; R511-D584 IonicContact NH2-OD1 3.27Å; R511-D584 PolarHBondContact NH2-OD1 3.23Å; R511-D584 IonicContact NH2-OD2 3.99Å
512	A	77.9	Confident	76.7	Confident	17 Å²	17	80.5 Å²	80.5	14%	0.14	44%	0.435	C	S	.	.	H	α-helix	trans	-66.7	-44.5	173	0	0	0	0	0	113.4	T510 A515 V516 D584 K585	T510-A512 PolarHBondContact O-N 3.26Å; A512-A515 PolarHBondContact O-N 3.36Å; A512-V516 WeakPolarHBondContact O-CG2 3.38Å; A512-V516 PolarHBondContact O-N 3.4Å; A512-D584 WeakPolarHBondContact CB-O 3.42Å; A512-K585 HydrophobicContact CB-CB 4.25Å; A512-K585 HydrophobicContact CB-CD 3.71Å
513	E	80.1	Confident	77.1	Confident	90 Å²	90	76 Å²	76	42%	0.421	42%	0.416	S	S	.	.	H	α-helix	trans	-69.1	-38.3	176	-73.3	158.6	172	0	0	112	P509 T510 A515 V516 V517	P509-E513 WeakPolarHBondContact CA-OE2 3.41Å; P509-E513 HydrophobicContact CB-CB 3.53Å; T510-E513 PolarHBondContact N-OE2 3.29Å; T510-E513 WeakPolarHBondContact O-CA 3.31Å; T510-E513 PolarHBondContact O-N 2.98Å; T510-E513 WeakPolarHBondContact OG1-CG 3.35Å; T510-E513 PolarHBondContact OG1-N 3.32Å; T510-E513 PolarHBondContact OG1-OE2 3.24Å; E513-A515 VanDerWaalsContact C-N 3.29Å; E513-A515 PolarHBondContact O-N 3.1Å; E513-V516 PolarHBondContact O-N 3.26Å; E513-V516 VanDerWaalsContact O-N 3.15Å; E513-V517 WeakPolarHBondContact O-CG2 3.48Å; E513-V517 PolarHBondContact O-N 3.09Å
514	K	81.8	Confident	77.8	Confident	133 Å²	133	71.2 Å²	71.2	58%	0.578	39%	0.388	S	S	*	.	H	α-helix	trans	-60.5	-38.3	172.7	-70.7	-175.5	-178.7	-175.9	0	112.3	P509 T510 V516 V517 D518	P509-K514 HydrophobicContact CB-CG 4.26Å; P509-K514 HydrophobicContact CG-CG 4.18Å; P509-K514 WeakPolarHBondContact O-CE 3.37Å; T510-K514 PolarHBondContact O-N 3.46Å; K514-V516 VanDerWaalsContact C-N 3.33Å; K514-V517 PolarHBondContact O-N 3.37Å; K514-D518 WeakPolarHBondContact O-CB 3.44Å; K514-D518 PolarHBondContact O-N 2.86Å
515	A	86.1	Confident	78.9	Confident	4 Å²	4	65.2 Å²	65.2	3%	0.033	37%	0.366	C	S	.	.	H	α-helix	trans	-66.6	-34.5	175.9	0	0	0	0	0	112.6	R511 A512 E513 F519 K580 I581 D584	R511-A515 PolarHBondContact O-N 3.27Å; R511-A515 VanDerWaalsContact O-N 3.16Å; A512-A515 PolarHBondContact O-N 3.36Å; E513-A515 VanDerWaalsContact C-N 3.29Å; E513-A515 PolarHBondContact O-N 3.1Å; A515-F519 WeakPolarHBondContact O-CB 3.28Å; A515-F519 PolarHBondContact O-N 3.02Å; A515-F519 VanDerWaalsContact O-N 3.14Å; A515-K580 HydrophobicContact CB-CB 4.1Å; A515-I581 HydrophobicContact CB-CG1 4.23Å; A515-D584 HydrophobicContact CB-CB 4.29Å
516	V	87.1	Confident	80.2	Confident	14 Å²	14	57.5 Å²	57.5	9%	0.085	34%	0.34	C	S	.	.	H	α-helix	trans	-70.5	-43.7	175.1	174.5	0	0	0	0	111	A512 E513 K514 F519 H520 K585 Y608 E612	A512-V516 WeakPolarHBondContact O-CG2 3.38Å; A512-V516 PolarHBondContact O-N 3.4Å; E513-V516 PolarHBondContact O-N 3.26Å; E513-V516 VanDerWaalsContact O-N 3.15Å; K514-V516 VanDerWaalsContact C-N 3.33Å; V516-F519 WeakPolarHBondContact O-CB 3.41Å; V516-F519 PolarHBondContact O-N 3.11Å; V516-H520 PolarHBondContact O-CD2 3.47Å; V516-H520 PolarHBondContact O-N 3.15Å; V516-K585 HydrophobicContact CG2-CD 4.39Å; V516-Y608 WeakPolarHBondContact CG2-OH 3.45Å; V516-E612 WeakPolarHBondContact CG1-OE2 3.42Å
517	V	85.5	Confident	81.8	Confident	82 Å²	82	53.2 Å²	53.2	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-45.7	176.3	174.2	0	0	0	0	111.2	E513 K514 F519 H520 T521	E513-V517 WeakPolarHBondContact O-CG2 3.48Å; E513-V517 PolarHBondContact O-N 3.09Å; K514-V517 PolarHBondContact O-N 3.37Å; V517-F519 VanDerWaalsContact C-N 3.28Å; V517-F519 PolarHBondContact O-N 3.42Å; V517-H520 WeakPolarHBondContact O-CB 3.47Å; V517-H520 PolarHBondContact O-N 3.16Å; V517-H520 VanDerWaalsContact O-N 3.1Å; V517-T521 PolarHBondContact O-N 3.28Å; V517-T521 PolarHBondContact O-OG1 2.94Å; V517-T521 VanDerWaalsContact O-OG1 3.11Å
518	D	87.5	Confident	83.3	Confident	41 Å²	41	51.3 Å²	51.3	22%	0.219	30%	0.295	C	S	.	.	H	α-helix	trans	-58.2	-41.2	175.6	-172.7	20.5	0	0	0	111.2	K514 T521 Q522 K580	K514-D518 WeakPolarHBondContact O-CB 3.44Å; K514-D518 PolarHBondContact O-N 2.86Å; D518-T521 PolarHBondContact O-N 3.49Å; D518-Q522 WeakPolarHBondContact O-CG 3.4Å; D518-Q522 PolarHBondContact O-N 3.14Å; D518-Q522 PolarHBondContact OD1-NE2 3.35Å; D518-K580 WeakPolarHBondContact OD2-CD 3.19Å; D518-K580 IonicContact OD2-NZ 3.28Å; D518-K580 PolarHBondContact OD2-NZ 3.35Å
519	F	92.4	Very high	84.6	Confident	8 Å²	8	49.5 Å²	49.5	4%	0.035	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-43.8	173.3	178.8	-105.6	0	0	0	112.9	A515 V516 V517 T521 Q522 V523 I574 A577 V578 I581 L609 E612	A515-F519 WeakPolarHBondContact O-CB 3.28Å; A515-F519 PolarHBondContact O-N 3.02Å; A515-F519 VanDerWaalsContact O-N 3.14Å; V516-F519 WeakPolarHBondContact O-CB 3.41Å; V516-F519 PolarHBondContact O-N 3.11Å; V517-F519 VanDerWaalsContact C-N 3.28Å; V517-F519 PolarHBondContact O-N 3.42Å; F519-T521 VanDerWaalsContact C-N 3.31Å; F519-T521 PolarHBondContact O-N 3.41Å; F519-Q522 PolarHBondContact O-N 3.43Å; F519-V523 HydrophobicContact CD1-CG2 4.38Å; F519-V523 HydrophobicContact CE1-CG2 4.01Å; F519-V523 HydrophobicContact CE2-CG2 4.33Å; F519-V523 HydrophobicContact CZ-CG2 3.98Å; F519-V523 WeakPolarHBondContact O-CG2 3.43Å; F519-V523 PolarHBondContact O-N 3.28Å; F519-I574 HydrophobicContact CE2-CG2 4.1Å; F519-A577 HydrophobicContact CB-CB 4.2Å; F519-A577 HydrophobicContact CD2-CB 4.23Å; F519-V578 HydrophobicContact CD2-CG2 4.14Å; F519-V578 HydrophobicContact CE2-CG2 3.86Å; F519-I581 HydrophobicContact CB-CD1 3.44Å; F519-I581 VanDerWaalsContact CB-CD1 3.44Å; F519-I581 HydrophobicContact CB-CG1 4.37Å; F519-I581 HydrophobicContact CD1-CD1 3.92Å; F519-I581 HydrophobicContact CD2-CD1 3.94Å; F519-I581 HydrophobicContact CG-CD1 3.5Å; F519-I581 VanDerWaalsContact CG-CD1 3.5Å; F519-L609 HydrophobicContact CD2-CD2 4.32Å; F519-L609 HydrophobicContact CE1-CD2 4.17Å; F519-L609 HydrophobicContact CE2-CD2 3.86Å; F519-L609 HydrophobicContact CZ-CB 4.15Å; F519-L609 HydrophobicContact CZ-CD2 3.79Å; F519-E612 HydrophobicContact CD1-CB 4.16Å; F519-E612 HydrophobicContact CE1-CB 3.97Å
520	H	91.5	Very high	85.9	Confident	24 Å²	24	48.9 Å²	48.9	11%	0.111	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-41.3	174.8	-68.8	-176.2	0	0	0	111.3	V516 V517 V523 G524 E612 A616	V516-H520 PolarHBondContact O-CD2 3.47Å; V516-H520 PolarHBondContact O-N 3.15Å; V517-H520 WeakPolarHBondContact O-CB 3.47Å; V517-H520 PolarHBondContact O-N 3.16Å; V517-H520 VanDerWaalsContact O-N 3.1Å; H520-V523 PolarHBondContact O-N 2.89Å; H520-G524 PolarHBondContact O-N 2.99Å; H520-E612 IonicContact CE1-OE2 3.89Å; H520-E612 PolarHBondContact CE1-OE2 3.42Å; H520-E612 PolarHBondContact NE2-O 3.11Å; H520-E612 IonicContact NE2-OE2 2.96Å; H520-E612 PolarHBondContact NE2-OE2 3.4Å; H520-A616 HydrophobicContact CB-CB 3.87Å
521	T	89.5	Confident	86.5	Confident	71 Å²	71	48.2 Å²	48.2	44%	0.436	27%	0.268	S	S	.	.	H	α-helix	trans	-61.8	-44.7	174.8	-55.7	0	0	0	0	111.8	V517 D518 F519 V523 G524 N525	V517-T521 PolarHBondContact O-N 3.28Å; V517-T521 PolarHBondContact O-OG1 2.94Å; V517-T521 VanDerWaalsContact O-OG1 3.11Å; D518-T521 PolarHBondContact O-N 3.49Å; F519-T521 VanDerWaalsContact C-N 3.31Å; F519-T521 PolarHBondContact O-N 3.41Å; T521-V523 VanDerWaalsContact C-N 3.32Å; T521-V523 PolarHBondContact O-N 3.49Å; T521-G524 PolarHBondContact O-N 3.42Å; T521-N525 PolarHBondContact O-N 3.41Å
522	Q	91.4	Very high	87	Confident	29 Å²	29	45.1 Å²	45.1	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-33.5	176.9	-60	-43	-43.2	0	0	112.7	D518 F519 N525 A526 I574 A577	D518-Q522 WeakPolarHBondContact O-CG 3.4Å; D518-Q522 PolarHBondContact O-N 3.14Å; D518-Q522 PolarHBondContact OD1-NE2 3.35Å; F519-Q522 PolarHBondContact O-N 3.43Å; Q522-N525 PolarHBondContact O-N 2.82Å; Q522-N525 PolarHBondContact OE1-ND2 3.45Å; Q522-A526 WeakPolarHBondContact O-CB 3.4Å; Q522-A526 PolarHBondContact O-N 3.32Å; Q522-I574 HydrophobicContact CB-CG1 3.94Å; Q522-A577 HydrophobicContact CG-CB 3.95Å
523	V	90.9	Very high	87.4	Confident	10 Å²	10	44.9 Å²	44.9	6%	0.061	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-44.2	171.8	172	0	0	0	0	110.3	F519 H520 T521 A526 V527 M613 A616 L617	F519-V523 HydrophobicContact CD1-CG2 4.38Å; F519-V523 HydrophobicContact CE1-CG2 4.01Å; F519-V523 HydrophobicContact CE2-CG2 4.33Å; F519-V523 HydrophobicContact CZ-CG2 3.98Å; F519-V523 WeakPolarHBondContact O-CG2 3.43Å; F519-V523 PolarHBondContact O-N 3.28Å; H520-V523 PolarHBondContact O-N 2.89Å; T521-V523 VanDerWaalsContact C-N 3.32Å; T521-V523 PolarHBondContact O-N 3.49Å; V523-A526 PolarHBondContact O-N 3.17Å; V523-V527 WeakPolarHBondContact O-CG2 3.48Å; V523-V527 PolarHBondContact O-N 2.92Å; V523-M613 HydrophobicContact CG1-CG 4.02Å; V523-M613 HydrophobicContact CG2-CG 4.34Å; V523-A616 HydrophobicContact CB-CB 4.18Å; V523-A616 HydrophobicContact CG1-CB 4.01Å; V523-L617 HydrophobicContact CG1-CD2 4.14Å; V523-L617 HydrophobicContact CG1-CG 4.28Å
524	G	88.1	Confident	87.5	Confident	20 Å²	20	44 Å²	44	21%	0.206	25%	0.251	C	S	.	.	H	α-helix	trans	-59.1	-46.4	174.4	0	0	0	0	0	113.1	H520 T521 A526 V527 A528	H520-G524 PolarHBondContact O-N 2.99Å; T521-G524 PolarHBondContact O-N 3.42Å; G524-A526 VanDerWaalsContact C-N 3.3Å; G524-A526 PolarHBondContact O-N 3Å; G524-V527 PolarHBondContact O-N 2.94Å; G524-A528 PolarHBondContact O-N 3.37Å
525	N	87.5	Confident	87.6	Confident	75 Å²	75	40.2 Å²	40.2	40%	0.401	25%	0.245	S	C	.	.	H	α-helix	trans	-60.1	-39.4	175.7	-66.8	-16.1	0	0	0	112.3	T521 Q522 A528 A529	T521-N525 PolarHBondContact O-N 3.41Å; Q522-N525 PolarHBondContact O-N 2.82Å; Q522-N525 PolarHBondContact OE1-ND2 3.45Å; N525-A528 PolarHBondContact O-N 2.96Å; N525-A529 WeakPolarHBondContact O-CB 3.22Å; N525-A529 PolarHBondContact O-N 2.8Å
526	A	89.4	Confident	87.4	Confident	12 Å²	12	44.8 Å²	44.8	10%	0.099	27%	0.266	C	S	.	.	H	α-helix	trans	-66.3	-41.4	176.4	0	0	0	0	0	111.8	Q522 V523 G524 A529 V530 F570 I574	Q522-A526 WeakPolarHBondContact O-CB 3.4Å; Q522-A526 PolarHBondContact O-N 3.32Å; V523-A526 PolarHBondContact O-N 3.17Å; G524-A526 VanDerWaalsContact C-N 3.3Å; G524-A526 PolarHBondContact O-N 3Å; A526-A529 PolarHBondContact O-N 3.32Å; A526-V530 WeakPolarHBondContact O-CB 3.41Å; A526-V530 WeakPolarHBondContact O-CG2 3.46Å; A526-V530 PolarHBondContact O-N 3.38Å; A526-F570 HydrophobicContact CB-CB 4.12Å; A526-F570 HydrophobicContact CB-CD2 3.96Å; A526-F570 HydrophobicContact CB-CG 3.99Å; A526-I574 HydrophobicContact CB-CD1 4.07Å
527	V	89.4	Confident	87	Confident	30 Å²	30	47 Å²	47	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-62.1	-44	174.7	172.8	0	0	0	0	111.2	V523 G524 V530 S531 L617	V523-V527 WeakPolarHBondContact O-CG2 3.48Å; V523-V527 PolarHBondContact O-N 2.92Å; G524-V527 PolarHBondContact O-N 2.94Å; V527-V530 PolarHBondContact O-N 3.33Å; V527-S531 VanDerWaalsContact O-CB 3.31Å; V527-S531 WeakPolarHBondContact O-CB 3.35Å; V527-S531 PolarHBondContact O-N 2.87Å; V527-S531 PolarHBondContact O-OG 3.33Å; V527-L617 HydrophobicContact CG2-CD2 3.38Å
528	A	86.4	Confident	86.7	Confident	57 Å²	57	43.6 Å²	43.6	47%	0.471	26%	0.255	S	S	.	.	H	α-helix	trans	-60.2	-48.1	176.2	0	0	0	0	0	111.2	G524 N525 V530 S531 E532	G524-A528 PolarHBondContact O-N 3.37Å; N525-A528 PolarHBondContact O-N 2.96Å; A528-V530 PolarHBondContact O-N 3.22Å; A528-S531 PolarHBondContact O-N 2.91Å; A528-E532 WeakPolarHBondContact O-CB 3.41Å; A528-E532 PolarHBondContact O-N 2.9Å
529	A	85.9	Confident	85.8	Confident	18 Å²	18	44.6 Å²	44.6	15%	0.149	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-38.4	179	0	0	0	0	0	113.2	N525 A526 Q533 F570	N525-A529 WeakPolarHBondContact O-CB 3.22Å; N525-A529 PolarHBondContact O-N 2.8Å; A526-A529 PolarHBondContact O-N 3.32Å; A529-Q533 WeakPolarHBondContact O-CB 3.49Å; A529-Q533 PolarHBondContact O-N 3.45Å; A529-F570 HydrophobicContact CB-CD1 4.31Å
530	V	88.2	Confident	84.2	Confident	56 Å²	56	48.8 Å²	48.8	34%	0.339	31%	0.311	S	S	.	.	H	α-helix	trans	-67.7	-40.5	174.4	172.9	0	0	0	0	110.7	A526 V527 A528 Q533 F534 V557 L561 F570	A526-V530 WeakPolarHBondContact O-CB 3.41Å; A526-V530 WeakPolarHBondContact O-CG2 3.46Å; A526-V530 PolarHBondContact O-N 3.38Å; V527-V530 PolarHBondContact O-N 3.33Å; A528-V530 PolarHBondContact O-N 3.22Å; V530-Q533 PolarHBondContact O-N 2.85Å; V530-F534 VanDerWaalsContact O-CB 3.29Å; V530-F534 WeakPolarHBondContact O-CB 3.27Å; V530-F534 PolarHBondContact O-N 2.92Å; V530-V557 HydrophobicContact CG1-CG1 4.46Å; V530-L561 HydrophobicContact CG2-CD1 3.92Å; V530-F570 HydrophobicContact CG2-CE1 4.43Å
531	S	85.5	Confident	82.6	Confident	59 Å²	59	52.4 Å²	52.4	41%	0.413	33%	0.331	S	S	.	.	H	α-helix	trans	-69.3	-41.1	-180	-56.8	0	0	0	0	112.1	V527 A528 F534 A535	V527-S531 VanDerWaalsContact O-CB 3.31Å; V527-S531 WeakPolarHBondContact O-CB 3.35Å; V527-S531 PolarHBondContact O-N 2.87Å; V527-S531 PolarHBondContact O-OG 3.33Å; A528-S531 PolarHBondContact O-N 2.91Å; S531-F534 WeakPolarHBondContact O-CB 3.42Å; S531-F534 PolarHBondContact O-N 3.47Å; S531-A535 WeakPolarHBondContact O-CB 3.26Å; S531-A535 PolarHBondContact O-N 3.31Å
532	E	85.2	Confident	81	Confident	98 Å²	98	53.3 Å²	53.3	46%	0.458	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-47.4	173.2	-172.7	-171.4	-176.1	0	0	110.6	A528 F534 A535 E536 R566	A528-E532 WeakPolarHBondContact O-CB 3.41Å; A528-E532 PolarHBondContact O-N 2.9Å; E532-F534 VanDerWaalsContact C-N 3.29Å; E532-F534 PolarHBondContact O-N 3.15Å; E532-A535 PolarHBondContact O-N 3.39Å; E532-A535 VanDerWaalsContact O-N 3.15Å; E532-E536 WeakPolarHBondContact O-CG 3.4Å; E532-E536 PolarHBondContact O-N 3.4Å; E532-R566 IonicContact OE1-CZ 3.49Å; E532-R566 IonicContact OE1-NH2 3.01Å; E532-R566 PolarHBondContact OE1-NH2 2.85Å; E532-R566 IonicContact OE2-CZ 3.65Å; E532-R566 IonicContact OE2-NE 3.02Å; E532-R566 IonicContact OE2-NH2 2.69Å; E532-R566 PolarHBondContact OE2-NH2 3.3Å
533	Q	85.7	Confident	79.2	Confident	12 Å²	12	60.5 Å²	60.5	6%	0.056	37%	0.371	C	S	.	.	H	α-helix	trans	-62.6	-37.9	176.9	-168	66.2	68.2	0	0	112.2	A529 V530 E536 I537 L561 S564	A529-Q533 WeakPolarHBondContact O-CB 3.49Å; A529-Q533 PolarHBondContact O-N 3.45Å; V530-Q533 PolarHBondContact O-N 2.85Å; Q533-E536 PolarHBondContact NE2-OE2 2.83Å; Q533-E536 PolarHBondContact O-N 3.24Å; Q533-I537 HydrophobicContact CG-CD1 3.99Å; Q533-I537 WeakPolarHBondContact O-CD1 3.25Å; Q533-I537 VanDerWaalsContact O-CG1 3.27Å; Q533-I537 WeakPolarHBondContact O-CG1 3.46Å; Q533-I537 PolarHBondContact O-N 2.97Å; Q533-I537 VanDerWaalsContact O-N 3.16Å; Q533-L561 HydrophobicContact CB-CD2 3.57Å; Q533-L561 HydrophobicContact CB-CG 4.17Å; Q533-L561 HydrophobicContact CG-CD2 3.7Å; Q533-L561 HydrophobicContact CG-CG 3.87Å; Q533-S564 PolarHBondContact OE1-OG 3.17Å; Q533-S564 VanDerWaalsContact OE1-OG 3.08Å
534	F	83.4	Confident	77.4	Confident	70 Å²	70	64.3 Å²	64.3	31%	0.307	39%	0.391	S	S	.	.	H	α-helix	trans	-63.5	-44.5	174.2	-178	-90.1	0	0	0	111.3	V530 S531 E532 I537 F538 I553 V557	V530-F534 VanDerWaalsContact O-CB 3.29Å; V530-F534 WeakPolarHBondContact O-CB 3.27Å; V530-F534 PolarHBondContact O-N 2.92Å; S531-F534 WeakPolarHBondContact O-CB 3.42Å; S531-F534 PolarHBondContact O-N 3.47Å; E532-F534 VanDerWaalsContact C-N 3.29Å; E532-F534 PolarHBondContact O-N 3.15Å; F534-I537 PolarHBondContact O-N 3.33Å; F534-F538 AromaticContact CD2-CD2 3.78Å; F534-F538 HydrophobicContact CD2-CD2 3.78Å; F534-F538 HydrophobicContact CD2-CE2 4.18Å; F534-F538 AromaticContact CE2-CD2 3.74Å; F534-F538 HydrophobicContact CE2-CD2 3.74Å; F534-F538 HydrophobicContact CE2-CE2 4.18Å; F534-F538 HydrophobicContact CE2-CG 4.49Å; F534-F538 HydrophobicContact CG-CD2 4.27Å; F534-F538 HydrophobicContact CZ-CD2 4.21Å; F534-F538 WeakPolarHBondContact O-CD2 3.46Å; F534-F538 PolarHBondContact O-N 3.24Å; F534-I553 HydrophobicContact CE2-CG2 3.82Å; F534-V557 HydrophobicContact CD2-CG2 3.83Å
535	A	82.8	Confident	75.9	Confident	54 Å²	54	67.6 Å²	67.6	45%	0.446	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-36.3	176.5	0	0	0	0	0	112.7	S531 E532 G539	S531-A535 WeakPolarHBondContact O-CB 3.26Å; S531-A535 PolarHBondContact O-N 3.31Å; E532-A535 PolarHBondContact O-N 3.39Å; E532-A535 VanDerWaalsContact O-N 3.15Å; A535-G539 WeakPolarHBondContact O-CA 3.38Å; A535-G539 PolarHBondContact O-N 3.21Å
536	E	82.3	Confident	74.4	Confident	101 Å²	101	72.8 Å²	72.8	47%	0.472	42%	0.422	S	S	.	.	H	α-helix	trans	-65.2	-40.4	175.3	-75.2	170.4	-171.7	0	0	112.6	E532 Q533 R566	E532-E536 WeakPolarHBondContact O-CG 3.4Å; E532-E536 PolarHBondContact O-N 3.4Å; Q533-E536 PolarHBondContact NE2-OE2 2.83Å; Q533-E536 PolarHBondContact O-N 3.24Å; E536-R566 IonicContact OE1-CZ 2.62Å; E536-R566 VanDerWaalsContact OE1-CZ 3.28Å; E536-R566 IonicContact OE1-NH1 2.6Å; E536-R566 PolarHBondContact OE1-NH1 3.16Å; E536-R566 IonicContact OE1-NH2 2.8Å; E536-R566 PolarHBondContact OE1-NH2 2.9Å; E536-R566 IonicContact OE2-CZ 3.82Å; E536-R566 IonicContact OE2-NH1 3.17Å; E536-R566 PolarHBondContact OE2-NH1 3.31Å
537	I	78.5	Confident	73	Confident	61 Å²	61	76.4 Å²	76.4	31%	0.313	45%	0.447	S	S	.	.	H	α-helix	trans	-78.9	-39.4	-177.4	-61.9	167.1	0	0	0	111	Q533 F534	Q533-I537 HydrophobicContact CG-CD1 3.99Å; Q533-I537 WeakPolarHBondContact O-CD1 3.25Å; Q533-I537 VanDerWaalsContact O-CG1 3.27Å; Q533-I537 WeakPolarHBondContact O-CG1 3.46Å; Q533-I537 PolarHBondContact O-N 2.97Å; Q533-I537 VanDerWaalsContact O-N 3.16Å; F534-I537 PolarHBondContact O-N 3.33Å
538	F	79.1	Confident	71.9	Confident	10 Å²	10	76.9 Å²	76.9	4%	0.044	45%	0.448	C	S	.	.	H	α-helix	trans	-117.3	-13.5	-169.5	-58.9	-73.6	0	0	0	115.2	F534 A540 N541 L548 I553 E556 V557	F534-F538 AromaticContact CD2-CD2 3.78Å; F534-F538 HydrophobicContact CD2-CD2 3.78Å; F534-F538 HydrophobicContact CD2-CE2 4.18Å; F534-F538 AromaticContact CE2-CD2 3.74Å; F534-F538 HydrophobicContact CE2-CD2 3.74Å; F534-F538 HydrophobicContact CE2-CE2 4.18Å; F534-F538 HydrophobicContact CE2-CG 4.49Å; F534-F538 HydrophobicContact CG-CD2 4.27Å; F534-F538 HydrophobicContact CZ-CD2 4.21Å; F534-F538 WeakPolarHBondContact O-CD2 3.46Å; F534-F538 PolarHBondContact O-N 3.24Å; F538-A540 VanDerWaalsContact C-N 3.33Å; F538-A540 PolarHBondContact O-N 3.07Å; F538-N541 PolarHBondContact O-N 2.86Å; F538-L548 HydrophobicContact CE1-CD1 4.09Å; F538-I553 HydrophobicContact CE2-CG2 4.08Å; F538-I553 HydrophobicContact CZ-CG2 4.17Å; F538-E556 HydrophobicContact CZ-CB 4.23Å; F538-E556 WeakPolarHBondContact CZ-OE2 3.44Å; F538-V557 HydrophobicContact CD2-CG2 4.49Å; F538-V557 HydrophobicContact CE2-CG2 3.71Å
539	G	68.4	Low	71.5	Confident	62 Å²	62	76.7 Å²	76.7	64%	0.639	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-22.1	-170.8	0	0	0	0	0	115.5	A535	A535-G539 WeakPolarHBondContact O-CA 3.38Å; A535-G539 PolarHBondContact O-N 3.21Å
540	A	59.6	Low	70.8	Confident	95 Å²	95	85 Å²	85	79%	0.785	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-15.6	177.8	0	0	0	0	0	114.3	F538	F538-A540 VanDerWaalsContact C-N 3.33Å; F538-A540 PolarHBondContact O-N 3.07Å
541	N	58.1	Low	70.4	Confident	100 Å²	100	90.1 Å²	90.1	54%	0.535	50%	0.496	S	S	.	.			trans	-135.8	78.6	-174	-82.1	-30.2	0	0	0	112.4	F538 K543 L544	F538-N541 PolarHBondContact O-N 2.86Å; N541-K543 PolarHBondContact O-N 3.48Å; N541-L544 HydrophobicContact CB-CD1 3.93Å; N541-L544 PolarHBondContact O-N 3.16Å
542	S	54.9	Low	70.1	Confident	90 Å²	90	92 Å²	92	63%	0.629	50%	0.498	S	S	*	.	H	α-helix	trans	-57.4	-21.4	177.1	58.6	0	0	0	0	114.8
543	K	53.8	Low	69.7	Low	181 Å²	181	88.6 Å²	88.6	79%	0.787	48%	0.483	S	S	*	.	H	α-helix	trans	-74.9	-21.2	179.2	-70.1	-179.2	178.7	177.9	0	114.8	N541	N541-K543 PolarHBondContact O-N 3.48Å
544	L	53.6	Low	69.5	Low	90 Å²	90	93.6 Å²	93.6	47%	0.471	51%	0.51	S	S	.	.	H	α-helix	trans	-75.2	-30.4	176.3	-88.9	155.5	0	0	0	111.6	N541 E546 S547	N541-L544 HydrophobicContact CB-CD1 3.93Å; N541-L544 PolarHBondContact O-N 3.16Å; L544-E546 PolarHBondContact O-N 2.63Å; L544-S547 PolarHBondContact O-N 2.97Å; L544-S547 PolarHBondContact O-OG 2.98Å
545	Q	55.7	Low	69.5	Low	89 Å²	89	93.1 Å²	93.1	42%	0.416	52%	0.519	S	S	.	.	H	α-helix	trans	-69.2	-28.9	-173.6	-156.8	175.8	-8.2	0	0	113.6	S547	Q545-S547 VanDerWaalsContact C-N 3.3Å; Q545-S547 PolarHBondContact O-N 3.28Å
546	E	57.5	Low	69.4	Low	184 Å²	184	95 Å²	95	86%	0.86	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-17	176.5	-73	-178	162.6	0	0	113.4	L544	L544-E546 PolarHBondContact O-N 2.63Å
547	S	58.4	Low	69.5	Low	87 Å²	87	90.8 Å²	90.8	61%	0.608	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-10.2	-174.3	70.6	0	0	0	0	115	L544 Q545	L544-S547 PolarHBondContact O-N 2.97Å; L544-S547 PolarHBondContact O-OG 2.98Å; Q545-S547 VanDerWaalsContact C-N 3.3Å; Q545-S547 PolarHBondContact O-N 3.28Å
548	L	67.1	Low	69.6	Low	41 Å²	41	91.2 Å²	91.2	22%	0.215	50%	0.501	C	S	.	.	S	Bend	trans	-108.3	137.9	-172	-69.5	162.2	0	0	0	111.7	F538 Q552 I553	F538-L548 HydrophobicContact CE1-CD1 4.09Å; L548-Q552 HydrophobicContact CB-CB 4.5Å; L548-Q552 HydrophobicContact CD2-CB 4.03Å; L548-I553 HydrophobicContact CB-CD1 4.24Å; L548-I553 HydrophobicContact CB-CG1 3.78Å
549	S	78.8	Confident	69.9	Low	53 Å²	53	92.3 Å²	92.3	37%	0.371	52%	0.515	S	S	.	.			trans	-70.5	154.9	170.8	64.5	0	0	0	0	111.2	E551 Q552 I553	S549-E551 PolarHBondContact O-N 3.15Å; S549-E551 VanDerWaalsContact O-N 3.1Å; S549-Q552 PolarHBondContact O-N 3Å; S549-Q552 VanDerWaalsContact OG-CD 3.27Å; S549-Q552 WeakPolarHBondContact OG-CG 3.11Å; S549-Q552 PolarHBondContact OG-N 3.02Å; S549-Q552 PolarHBondContact OG-OE1 3.28Å; S549-I553 PolarHBondContact O-N 2.79Å
550	K	71.3	Confident	70.6	Confident	192 Å²	192	90.2 Å²	90.2	84%	0.835	49%	0.494	S	S	*	.	H	α-helix	trans	-54.4	-32.5	177.7	-68.3	-175.6	178.5	-177.8	0	113.1	L554	K550-L554 WeakPolarHBondContact O-CB 3.4Å; K550-L554 PolarHBondContact O-N 2.65Å
551	E	79.1	Confident	71.8	Confident	163 Å²	163	85.9 Å²	85.9	76%	0.762	46%	0.457	S	S	*	.	H	α-helix	trans	-71.2	-37.5	178.6	-66.8	171.5	-179	0	0	112.2	S549 A555	S549-E551 PolarHBondContact O-N 3.15Å; S549-E551 VanDerWaalsContact O-N 3.1Å; E551-A555 WeakPolarHBondContact O-CB 3.4Å; E551-A555 PolarHBondContact O-N 3.08Å
552	Q	78.6	Confident	73.1	Confident	98 Å²	98	85.4 Å²	85.4	46%	0.458	46%	0.455	S	S	.	.	H	α-helix	trans	-71	-42.7	176	-72.5	164.7	-35.1	0	0	111.6	L548 S549 L554 A555 E556	L548-Q552 HydrophobicContact CB-CB 4.5Å; L548-Q552 HydrophobicContact CD2-CB 4.03Å; S549-Q552 PolarHBondContact O-N 3Å; S549-Q552 VanDerWaalsContact OG-CD 3.27Å; S549-Q552 WeakPolarHBondContact OG-CG 3.11Å; S549-Q552 PolarHBondContact OG-N 3.02Å; S549-Q552 PolarHBondContact OG-OE1 3.28Å; Q552-L554 VanDerWaalsContact C-N 3.3Å; Q552-L554 PolarHBondContact O-N 2.72Å; Q552-A555 PolarHBondContact O-N 3.25Å; Q552-E556 PolarHBondContact O-N 3.28Å
553	I	77.8	Confident	74.6	Confident	28 Å²	28	87.5 Å²	87.5	14%	0.144	46%	0.464	C	S	.	.	H	α-helix	trans	-58.6	-46.3	174.8	-64.6	172.4	0	0	0	109.8	F534 F538 L548 S549 A555 E556 V557	F534-I553 HydrophobicContact CE2-CG2 3.82Å; F538-I553 HydrophobicContact CE2-CG2 4.08Å; F538-I553 HydrophobicContact CZ-CG2 4.17Å; L548-I553 HydrophobicContact CB-CD1 4.24Å; L548-I553 HydrophobicContact CB-CG1 3.78Å; S549-I553 PolarHBondContact O-N 2.79Å; I553-A555 VanDerWaalsContact C-N 3.35Å; I553-A555 PolarHBondContact O-N 3.28Å; I553-E556 PolarHBondContact O-N 2.9Å; I553-V557 HydrophobicContact CG2-CG2 4.4Å; I553-V557 VanDerWaalsContact O-CG2 3.25Å; I553-V557 WeakPolarHBondContact O-CG2 3.19Å; I553-V557 PolarHBondContact O-N 2.64Å
554	L	81.1	Confident	76	Confident	116 Å²	116	81.7 Å²	81.7	61%	0.607	45%	0.445	S	S	*	.	H	α-helix	trans	-63.8	-39.9	178.3	-171.9	135.1	0	0	0	112.2	K550 Q552 M558	K550-L554 WeakPolarHBondContact O-CB 3.4Å; K550-L554 PolarHBondContact O-N 2.65Å; Q552-L554 VanDerWaalsContact C-N 3.3Å; Q552-L554 PolarHBondContact O-N 2.72Å; L554-M558 HydrophobicContact CD2-CG 4.18Å; L554-M558 HydrophobicContact CG-CG 4.41Å; L554-M558 WeakPolarHBondContact O-CB 3.42Å; L554-M558 WeakPolarHBondContact O-CG 3.37Å; L554-M558 PolarHBondContact O-N 3.3Å
555	A	82.8	Confident	77.5	Confident	61 Å²	61	79 Å²	79	50%	0.504	44%	0.44	S	S	.	.	H	α-helix	trans	-64	-40.5	176.7	0	0	0	0	0	112.5	E551 Q552 I553 G559	E551-A555 WeakPolarHBondContact O-CB 3.4Å; E551-A555 PolarHBondContact O-N 3.08Å; Q552-A555 PolarHBondContact O-N 3.25Å; I553-A555 VanDerWaalsContact C-N 3.35Å; I553-A555 PolarHBondContact O-N 3.28Å; A555-G559 PolarHBondContact O-N 3.47Å
556	E	81.8	Confident	78.9	Confident	93 Å²	93	77.7 Å²	77.7	44%	0.435	43%	0.431	S	S	.	.	H	α-helix	trans	-69.4	-44.6	177.3	-75.5	-174.7	164.8	0	0	112.3	F538 Q552 I553 M558 G559 G560	F538-E556 HydrophobicContact CZ-CB 4.23Å; F538-E556 WeakPolarHBondContact CZ-OE2 3.44Å; Q552-E556 PolarHBondContact O-N 3.28Å; I553-E556 PolarHBondContact O-N 2.9Å; E556-M558 PolarHBondContact O-N 3.47Å; E556-G559 PolarHBondContact O-N 3.05Å; E556-G560 PolarHBondContact O-N 3.01Å
557	V	83.3	Confident	80.3	Confident	12 Å²	12	72.4 Å²	72.4	7%	0.073	40%	0.404	C	S	.	.	H	α-helix	trans	-61.9	-45	175.7	177.1	0	0	0	0	110.6	V530 F534 F538 I553 G559 G560 L561	V530-V557 HydrophobicContact CG1-CG1 4.46Å; F534-V557 HydrophobicContact CD2-CG2 3.83Å; F538-V557 HydrophobicContact CD2-CG2 4.49Å; F538-V557 HydrophobicContact CE2-CG2 3.71Å; I553-V557 HydrophobicContact CG2-CG2 4.4Å; I553-V557 VanDerWaalsContact O-CG2 3.25Å; I553-V557 WeakPolarHBondContact O-CG2 3.19Å; I553-V557 PolarHBondContact O-N 2.64Å; V557-G559 VanDerWaalsContact C-N 3.32Å; V557-G559 PolarHBondContact O-N 2.85Å; V557-G560 PolarHBondContact O-N 2.98Å; V557-L561 HydrophobicContact CG1-CD1 4Å; V557-L561 HydrophobicContact CG1-CG 4.32Å; V557-L561 WeakPolarHBondContact O-CB 3.33Å; V557-L561 VanDerWaalsContact O-CG 3.3Å; V557-L561 WeakPolarHBondContact O-CG 3.43Å; V557-L561 PolarHBondContact O-N 2.99Å
558	M	81.9	Confident	81.7	Confident	71 Å²	71	74.9 Å²	74.9	35%	0.35	40%	0.404	S	S	.	.	H	α-helix	trans	-64.2	-37.1	176.1	-75.6	-65.8	-64.1	0	0	112.1	L554 E556 L561 N562 Y567	L554-M558 HydrophobicContact CD2-CG 4.18Å; L554-M558 HydrophobicContact CG-CG 4.41Å; L554-M558 WeakPolarHBondContact O-CB 3.42Å; L554-M558 WeakPolarHBondContact O-CG 3.37Å; L554-M558 PolarHBondContact O-N 3.3Å; E556-M558 PolarHBondContact O-N 3.47Å; M558-L561 HydrophobicContact SD-CD1 4.47Å; M558-N562 WeakPolarHBondContact O-CB 3.44Å; M558-N562 PolarHBondContact O-N 2.66Å; M558-N562 PolarHBondContact O-ND2 3.09Å; M558-Y567 HydrophobicContact CE-CD2 4.42Å; M558-Y567 HydrophobicContact CE-CE2 4.18Å
559	G	84.1	Confident	82.6	Confident	33 Å²	33	75.3 Å²	75.3	34%	0.34	41%	0.413	S	S	.	.	H	α-helix	trans	-59.9	-50.3	171.4	0	0	0	0	0	111.6	A555 E556 V557 N562 V563	A555-G559 PolarHBondContact O-N 3.47Å; E556-G559 PolarHBondContact O-N 3.05Å; V557-G559 VanDerWaalsContact C-N 3.32Å; V557-G559 PolarHBondContact O-N 2.85Å; G559-N562 PolarHBondContact O-N 3.39Å; G559-V563 WeakPolarHBondContact O-CG2 3.46Å; G559-V563 PolarHBondContact O-N 3.15Å
560	G	83.4	Confident	83.1	Confident	18 Å²	18	74.1 Å²	74.1	19%	0.186	40%	0.401	C	S	.	.	H	α-helix	trans	-59.8	-46.4	178.3	0	0	0	0	0	113.2	E556 V557 N562 V563 S564	E556-G560 PolarHBondContact O-N 3.01Å; V557-G560 PolarHBondContact O-N 2.98Å; G560-N562 VanDerWaalsContact C-N 3.29Å; G560-N562 PolarHBondContact O-N 3.41Å; G560-V563 PolarHBondContact O-N 2.98Å; G560-S564 WeakPolarHBondContact O-CB 3.4Å; G560-S564 PolarHBondContact O-N 3.37Å; G560-S564 PolarHBondContact O-OG 2.66Å
561	L	84.8	Confident	83.9	Confident	3 Å²	3	70 Å²	70	2%	0.016	38%	0.384	C	S	.	.	H	α-helix	trans	-62.8	-32.8	177.8	-71.9	172.4	0	0	0	113.4	V530 Q533 V557 M558 S564 G565 R566 Y567 F570	V530-L561 HydrophobicContact CG2-CD1 3.92Å; Q533-L561 HydrophobicContact CB-CD2 3.57Å; Q533-L561 HydrophobicContact CB-CG 4.17Å; Q533-L561 HydrophobicContact CG-CD2 3.7Å; Q533-L561 HydrophobicContact CG-CG 3.87Å; V557-L561 HydrophobicContact CG1-CD1 4Å; V557-L561 HydrophobicContact CG1-CG 4.32Å; V557-L561 WeakPolarHBondContact O-CB 3.33Å; V557-L561 VanDerWaalsContact O-CG 3.3Å; V557-L561 WeakPolarHBondContact O-CG 3.43Å; V557-L561 PolarHBondContact O-N 2.99Å; M558-L561 HydrophobicContact SD-CD1 4.47Å; L561-S564 PolarHBondContact O-OG 3.22Å; L561-G565 PolarHBondContact O-N 2.9Å; L561-R566 HydrophobicContact CD2-CB 4.14Å; L561-R566 PolarHBondContact O-N 3.16Å; L561-Y567 WeakPolarHBondContact O-CB 3.49Å; L561-Y567 PolarHBondContact O-N 2.93Å; L561-F570 HydrophobicContact CD2-CE1 4.45Å
562	N	86.7	Confident	84.5	Confident	90 Å²	90	65.3 Å²	65.3	48%	0.481	36%	0.362	S	S	.	.	H	α-helix	trans	-76.4	-38.8	177.1	-78.1	-48.9	0	0	0	111.9	M558 G559 G560 G565 Y567	M558-N562 WeakPolarHBondContact O-CB 3.44Å; M558-N562 PolarHBondContact O-N 2.66Å; M558-N562 PolarHBondContact O-ND2 3.09Å; G559-N562 PolarHBondContact O-N 3.39Å; G560-N562 VanDerWaalsContact C-N 3.29Å; G560-N562 PolarHBondContact O-N 3.41Å; N562-G565 PolarHBondContact O-N 3.33Å; N562-Y567 VanDerWaalsContact OD1-CD1 3.27Å; N562-Y567 WeakPolarHBondContact OD1-CD1 3.39Å
563	V	85.2	Confident	84.9	Confident	135 Å²	135	64.7 Å²	64.7	82%	0.818	36%	0.359	S	S	*	.	H	α-helix	trans	-71	-39.2	177.9	174.6	0	0	0	0	111.4	G559 G560 G565	G559-V563 WeakPolarHBondContact O-CG2 3.46Å; G559-V563 PolarHBondContact O-N 3.15Å; G560-V563 PolarHBondContact O-N 2.98Å; V563-G565 PolarHBondContact O-N 3.3Å
564	S	83.8	Confident	85.5	Confident	58 Å²	58	65.4 Å²	65.4	41%	0.406	36%	0.362	S	S	.	.	S	Bend	trans	-74	-10.5	178	66.2	0	0	0	0	113.7	Q533 G560 L561 R566	Q533-S564 PolarHBondContact OE1-OG 3.17Å; Q533-S564 VanDerWaalsContact OE1-OG 3.08Å; G560-S564 WeakPolarHBondContact O-CB 3.4Å; G560-S564 PolarHBondContact O-N 3.37Å; G560-S564 PolarHBondContact O-OG 2.66Å; L561-S564 PolarHBondContact O-OG 3.22Å; S564-R566 PolarHBondContact O-N 2.76Å; S564-R566 VanDerWaalsContact O-N 3.17Å; S564-R566 WeakPolarHBondContact OG-CG 3.41Å
565	G	85.1	Confident	86	Confident	34 Å²	34	65.5 Å²	65.5	35%	0.351	36%	0.358	S	S	.	.	S	Bend	trans	73	-4.4	-175.5	0	0	0	0	0	114.5	L561 N562 V563 Y567 F568 A569	L561-G565 PolarHBondContact O-N 2.9Å; N562-G565 PolarHBondContact O-N 3.33Å; V563-G565 PolarHBondContact O-N 3.3Å; G565-Y567 VanDerWaalsContact C-N 3.3Å; G565-Y567 PolarHBondContact O-N 3.03Å; G565-F568 PolarHBondContact O-N 3.03Å; G565-F568 VanDerWaalsContact O-N 3.11Å; G565-A569 PolarHBondContact O-N 3.38Å; G565-A569 VanDerWaalsContact O-N 3.13Å
566	R	84.8	Confident	86.3	Confident	61 Å²	61	70.6 Å²	70.6	23%	0.23	36%	0.364	C	S	.	.	H	α-helix	trans	-60.3	-37.6	178.7	-70.4	-178.5	173.7	152.8	-12	111.8	E532 E536 L561 S564 F568 A569 F570	E532-R566 IonicContact OE1-CZ 3.49Å; E532-R566 IonicContact OE1-NH2 3.01Å; E532-R566 PolarHBondContact OE1-NH2 2.85Å; E532-R566 IonicContact OE2-CZ 3.65Å; E532-R566 IonicContact OE2-NE 3.02Å; E532-R566 IonicContact OE2-NH2 2.69Å; E532-R566 PolarHBondContact OE2-NH2 3.3Å; E536-R566 IonicContact OE1-CZ 2.62Å; E536-R566 VanDerWaalsContact OE1-CZ 3.28Å; E536-R566 IonicContact OE1-NH1 2.6Å; E536-R566 PolarHBondContact OE1-NH1 3.16Å; E536-R566 IonicContact OE1-NH2 2.8Å; E536-R566 PolarHBondContact OE1-NH2 2.9Å; E536-R566 IonicContact OE2-CZ 3.82Å; E536-R566 IonicContact OE2-NH1 3.17Å; E536-R566 PolarHBondContact OE2-NH1 3.31Å; L561-R566 HydrophobicContact CD2-CB 4.14Å; L561-R566 PolarHBondContact O-N 3.16Å; S564-R566 PolarHBondContact O-N 2.76Å; S564-R566 VanDerWaalsContact O-N 3.17Å; S564-R566 WeakPolarHBondContact OG-CG 3.41Å; R566-F568 VanDerWaalsContact C-N 3.3Å; R566-F568 PolarHBondContact O-N 2.85Å; R566-A569 PolarHBondContact O-N 3.48Å; R566-F570 WeakPolarHBondContact O-CD1 3.39Å; R566-F570 PolarHBondContact O-N 3.35Å; R566-F570 VanDerWaalsContact O-N 3.14Å
567	Y	87.4	Confident	86.7	Confident	73 Å²	73	66.2 Å²	66.2	29%	0.286	34%	0.344	S	S	.	.	H	α-helix	trans	-55.2	-45.2	173.9	178.8	-102.5	0	0	0	112.3	M558 L561 N562 G565 F570 K571	M558-Y567 HydrophobicContact CE-CD2 4.42Å; M558-Y567 HydrophobicContact CE-CE2 4.18Å; L561-Y567 WeakPolarHBondContact O-CB 3.49Å; L561-Y567 PolarHBondContact O-N 2.93Å; N562-Y567 VanDerWaalsContact OD1-CD1 3.27Å; N562-Y567 WeakPolarHBondContact OD1-CD1 3.39Å; G565-Y567 VanDerWaalsContact C-N 3.3Å; G565-Y567 PolarHBondContact O-N 3.03Å; Y567-F570 VanDerWaalsContact CA-CE1 3.46Å; Y567-F570 HydrophobicContact CD2-CE1 4.44Å; Y567-F570 HydrophobicContact CD2-CE2 4.06Å; Y567-F570 AromaticContact CD2-CZ 3.61Å; Y567-F570 HydrophobicContact CD2-CZ 3.61Å; Y567-F570 HydrophobicContact CE2-CE2 4.4Å; Y567-F570 HydrophobicContact CE2-CZ 4.32Å; Y567-F570 HydrophobicContact CG-CZ 4.35Å; Y567-K571 HydrophobicContact CE1-CD 3.8Å; Y567-K571 WeakPolarHBondContact O-CB 3.4Å; Y567-K571 PolarHBondContact O-N 2.95Å; Y567-K571 VanDerWaalsContact O-N 3.14Å
568	F	87.4	Confident	87	Confident	140 Å²	140	66.9 Å²	66.9	61%	0.614	35%	0.348	S	S	*	.	H	α-helix	trans	-69.6	-38.4	-179.2	-172.7	-94.3	0	0	0	111.6	G565 R566 K571 E572	G565-F568 PolarHBondContact O-N 3.03Å; G565-F568 VanDerWaalsContact O-N 3.11Å; R566-F568 VanDerWaalsContact C-N 3.3Å; R566-F568 PolarHBondContact O-N 2.85Å; F568-K571 PolarHBondContact O-N 2.94Å; F568-E572 PolarHBondContact O-N 2.63Å
569	A	85.9	Confident	87.4	Confident	50 Å²	50	67 Å²	67	41%	0.413	35%	0.352	S	S	.	.	H	α-helix	trans	-61.4	-56.1	-180	0	0	0	0	0	112.4	G565 R566 K571 E572 Q573	G565-A569 PolarHBondContact O-N 3.38Å; G565-A569 VanDerWaalsContact O-N 3.13Å; R566-A569 PolarHBondContact O-N 3.48Å; A569-K571 VanDerWaalsContact C-N 3.32Å; A569-K571 PolarHBondContact O-N 3.17Å; A569-E572 PolarHBondContact O-N 3.47Å; A569-Q573 WeakPolarHBondContact O-CG 3.5Å; A569-Q573 PolarHBondContact O-N 2.93Å; A569-Q573 VanDerWaalsContact O-N 3.15Å
570	F	88.8	Confident	87.5	Confident	27 Å²	27	69.5 Å²	69.5	12%	0.118	35%	0.354	C	S	.	.	H	α-helix	trans	-70.1	-29.9	-180	68.9	-113.1	0	0	0	112	A526 A529 V530 L561 R566 Y567 E572 Q573 I574	A526-F570 HydrophobicContact CB-CB 4.12Å; A526-F570 HydrophobicContact CB-CD2 3.96Å; A526-F570 HydrophobicContact CB-CG 3.99Å; A529-F570 HydrophobicContact CB-CD1 4.31Å; V530-F570 HydrophobicContact CG2-CE1 4.43Å; L561-F570 HydrophobicContact CD2-CE1 4.45Å; R566-F570 WeakPolarHBondContact O-CD1 3.39Å; R566-F570 PolarHBondContact O-N 3.35Å; R566-F570 VanDerWaalsContact O-N 3.14Å; Y567-F570 VanDerWaalsContact CA-CE1 3.46Å; Y567-F570 HydrophobicContact CD2-CE1 4.44Å; Y567-F570 HydrophobicContact CD2-CE2 4.06Å; Y567-F570 AromaticContact CD2-CZ 3.61Å; Y567-F570 HydrophobicContact CD2-CZ 3.61Å; Y567-F570 HydrophobicContact CE2-CE2 4.4Å; Y567-F570 HydrophobicContact CE2-CZ 4.32Å; Y567-F570 HydrophobicContact CG-CZ 4.35Å; F570-E572 PolarHBondContact O-N 2.86Å; F570-Q573 PolarHBondContact O-N 3.19Å; F570-I574 HydrophobicContact CD2-CD1 4.15Å; F570-I574 WeakPolarHBondContact O-CB 3.23Å; F570-I574 VanDerWaalsContact O-CG1 3.28Å; F570-I574 WeakPolarHBondContact O-CG1 3.36Å; F570-I574 PolarHBondContact O-N 3.38Å
571	K	88.9	Confident	87.8	Confident	107 Å²	107	68.6 Å²	68.6	47%	0.465	35%	0.345	S	S	.	.	H	α-helix	trans	-61.5	-43.7	174.6	179	178.8	179.5	176.1	0	112.1	Y567 F568 A569 K575	Y567-K571 HydrophobicContact CE1-CD 3.8Å; Y567-K571 WeakPolarHBondContact O-CB 3.4Å; Y567-K571 PolarHBondContact O-N 2.95Å; Y567-K571 VanDerWaalsContact O-N 3.14Å; F568-K571 PolarHBondContact O-N 2.94Å; A569-K571 VanDerWaalsContact C-N 3.32Å; A569-K571 PolarHBondContact O-N 3.17Å; K571-K575 WeakPolarHBondContact O-CB 3.24Å; K571-K575 PolarHBondContact O-N 3.43Å
572	E	90.1	Very high	87.9	Confident	64 Å²	64	69.9 Å²	69.9	30%	0.299	35%	0.353	S	S	.	.	H	α-helix	trans	-71.9	-34.4	178.5	-168.2	61.5	-159.1	0	0	111.8	F568 A569 F570 K575 R576	F568-E572 PolarHBondContact O-N 2.63Å; A569-E572 PolarHBondContact O-N 3.47Å; F570-E572 PolarHBondContact O-N 2.86Å; E572-K575 PolarHBondContact O-N 3.23Å; E572-K575 IonicContact OE1-NZ 3.18Å; E572-K575 PolarHBondContact OE1-NZ 3.22Å; E572-K575 WeakPolarHBondContact OE2-CD 3.42Å; E572-K575 IonicContact OE2-NZ 2.74Å; E572-K575 PolarHBondContact OE2-NZ 3.41Å; E572-R576 WeakPolarHBondContact O-CG 3.49Å; E572-R576 PolarHBondContact O-N 2.93Å
573	Q	87.9	Confident	87.8	Confident	85 Å²	85	71.7 Å²	71.7	40%	0.397	35%	0.353	S	S	.	.	H	α-helix	trans	-65.3	-47.7	173.5	-70.7	172	-9.2	0	0	112.1	A569 F570 K575 R576 A577	A569-Q573 WeakPolarHBondContact O-CG 3.5Å; A569-Q573 PolarHBondContact O-N 2.93Å; A569-Q573 VanDerWaalsContact O-N 3.15Å; F570-Q573 PolarHBondContact O-N 3.19Å; Q573-K575 VanDerWaalsContact C-N 3.3Å; Q573-K575 PolarHBondContact O-N 3.01Å; Q573-R576 WeakPolarHBondContact O-CB 3.48Å; Q573-R576 PolarHBondContact O-N 3.29Å; Q573-R576 VanDerWaalsContact O-N 3.15Å; Q573-A577 PolarHBondContact O-N 3.09Å; Q573-A577 VanDerWaalsContact O-N 3.14Å
574	I	91.2	Very high	87.7	Confident	43 Å²	43	66.6 Å²	66.6	22%	0.221	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-42.4	175.5	-72.3	173.2	0	0	0	110.4	F519 Q522 A526 F570 R576 A577 V578	F519-I574 HydrophobicContact CE2-CG2 4.1Å; Q522-I574 HydrophobicContact CB-CG1 3.94Å; A526-I574 HydrophobicContact CB-CD1 4.07Å; F570-I574 HydrophobicContact CD2-CD1 4.15Å; F570-I574 WeakPolarHBondContact O-CB 3.23Å; F570-I574 VanDerWaalsContact O-CG1 3.28Å; F570-I574 WeakPolarHBondContact O-CG1 3.36Å; F570-I574 PolarHBondContact O-N 3.38Å; I574-R576 VanDerWaalsContact C-N 3.3Å; I574-R576 PolarHBondContact O-N 2.84Å; I574-A577 PolarHBondContact O-N 2.83Å; I574-A577 VanDerWaalsContact O-N 3.13Å; I574-V578 HydrophobicContact CG2-CG2 4.07Å; I574-V578 VanDerWaalsContact O-CG2 3.29Å; I574-V578 WeakPolarHBondContact O-CG2 3.5Å; I574-V578 PolarHBondContact O-N 3.4Å
575	K	91.2	Very high	87.8	Confident	117 Å²	117	67.9 Å²	67.9	51%	0.509	32%	0.319	S	S	.	.	H	α-helix	trans	-57.3	-41.9	176.5	-179.9	-173.6	168.7	-159.8	0	112.1	K571 E572 Q573 V578 V579	K571-K575 WeakPolarHBondContact O-CB 3.24Å; K571-K575 PolarHBondContact O-N 3.43Å; E572-K575 PolarHBondContact O-N 3.23Å; E572-K575 IonicContact OE1-NZ 3.18Å; E572-K575 PolarHBondContact OE1-NZ 3.22Å; E572-K575 WeakPolarHBondContact OE2-CD 3.42Å; E572-K575 IonicContact OE2-NZ 2.74Å; E572-K575 PolarHBondContact OE2-NZ 3.41Å; Q573-K575 VanDerWaalsContact C-N 3.3Å; Q573-K575 PolarHBondContact O-N 3.01Å; K575-V578 PolarHBondContact O-N 3.46Å; K575-V579 WeakPolarHBondContact O-CG2 3.33Å; K575-V579 PolarHBondContact O-N 3.47Å
576	R	88.8	Confident	87.7	Confident	169 Å²	169	69 Å²	69	64%	0.638	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-42.5	175.9	-69.1	175.8	-176.3	-175.9	1.1	111.9	E572 Q573 I574 V579 K580	E572-R576 WeakPolarHBondContact O-CG 3.49Å; E572-R576 PolarHBondContact O-N 2.93Å; Q573-R576 WeakPolarHBondContact O-CB 3.48Å; Q573-R576 PolarHBondContact O-N 3.29Å; Q573-R576 VanDerWaalsContact O-N 3.15Å; I574-R576 VanDerWaalsContact C-N 3.3Å; I574-R576 PolarHBondContact O-N 2.84Å; R576-V579 PolarHBondContact O-N 2.95Å; R576-K580 PolarHBondContact O-N 2.98Å; R576-K580 VanDerWaalsContact O-N 3.14Å
577	A	89.8	Confident	87.4	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.008	34%	0.341	C	S	.	.	H	α-helix	trans	-64.4	-41.7	176.1	0	0	0	0	0	111.9	F519 Q522 Q573 I574 V579 K580 I581	F519-A577 HydrophobicContact CB-CB 4.2Å; F519-A577 HydrophobicContact CD2-CB 4.23Å; Q522-A577 HydrophobicContact CG-CB 3.95Å; Q573-A577 PolarHBondContact O-N 3.09Å; Q573-A577 VanDerWaalsContact O-N 3.14Å; I574-A577 PolarHBondContact O-N 2.83Å; I574-A577 VanDerWaalsContact O-N 3.13Å; A577-V579 VanDerWaalsContact C-N 3.34Å; A577-V579 PolarHBondContact O-N 3.44Å; A577-K580 WeakPolarHBondContact O-CB 3.27Å; A577-K580 PolarHBondContact O-N 3.3Å; A577-K580 VanDerWaalsContact O-N 3.11Å; A577-I581 PolarHBondContact O-N 3.44Å
578	V	90.9	Very high	86.9	Confident	26 Å²	26	77 Å²	77	16%	0.158	35%	0.352	C	S	.	.	H	α-helix	trans	-61.6	-40.7	175.1	171.8	0	0	0	0	111.5	F519 I574 K575 K580 I581 V582 L605 L609	F519-V578 HydrophobicContact CD2-CG2 4.14Å; F519-V578 HydrophobicContact CE2-CG2 3.86Å; I574-V578 HydrophobicContact CG2-CG2 4.07Å; I574-V578 VanDerWaalsContact O-CG2 3.29Å; I574-V578 WeakPolarHBondContact O-CG2 3.5Å; I574-V578 PolarHBondContact O-N 3.4Å; K575-V578 PolarHBondContact O-N 3.46Å; V578-K580 VanDerWaalsContact C-N 3.29Å; V578-K580 PolarHBondContact O-N 2.95Å; V578-I581 WeakPolarHBondContact O-CB 3.33Å; V578-I581 PolarHBondContact O-N 3.16Å; V578-V582 HydrophobicContact CG1-CG2 4.41Å; V578-V582 WeakPolarHBondContact O-CG2 3.06Å; V578-V582 PolarHBondContact O-N 2.72Å; V578-L605 HydrophobicContact CG1-CD2 4.27Å; V578-L609 HydrophobicContact CB-CD1 4.45Å; V578-L609 HydrophobicContact CG1-CD1 3.8Å; V578-L609 HydrophobicContact CG2-CD1 3.75Å; V578-L609 HydrophobicContact CG2-CD2 3.94Å
579	V	88.7	Confident	85.8	Confident	72 Å²	72	75.5 Å²	75.5	44%	0.436	36%	0.359	S	S	.	.	H	α-helix	trans	-61.7	-39	174.8	170.6	0	0	0	0	111.3	K575 R576 A577 V582 R583	K575-V579 WeakPolarHBondContact O-CG2 3.33Å; K575-V579 PolarHBondContact O-N 3.47Å; R576-V579 PolarHBondContact O-N 2.95Å; A577-V579 VanDerWaalsContact C-N 3.34Å; A577-V579 PolarHBondContact O-N 3.44Å; V579-V582 PolarHBondContact O-N 2.93Å; V579-R583 WeakPolarHBondContact O-CB 3.48Å; V579-R583 PolarHBondContact O-N 2.64Å
580	K	86.6	Confident	85.3	Confident	86 Å²	86	83.4 Å²	83.4	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-64.6	-41.8	173.7	-66.9	177.5	-173.8	174.9	0	111.5	A515 D518 R576 A577 V578 V582 R583 D584	A515-K580 HydrophobicContact CB-CB 4.1Å; D518-K580 WeakPolarHBondContact OD2-CD 3.19Å; D518-K580 IonicContact OD2-NZ 3.28Å; D518-K580 PolarHBondContact OD2-NZ 3.35Å; R576-K580 PolarHBondContact O-N 2.98Å; R576-K580 VanDerWaalsContact O-N 3.14Å; A577-K580 WeakPolarHBondContact O-CB 3.27Å; A577-K580 PolarHBondContact O-N 3.3Å; A577-K580 VanDerWaalsContact O-N 3.11Å; V578-K580 VanDerWaalsContact C-N 3.29Å; V578-K580 PolarHBondContact O-N 2.95Å; K580-V582 PolarHBondContact O-N 3.1Å; K580-R583 PolarHBondContact O-N 2.93Å; K580-D584 VanDerWaalsContact O-CB 3.27Å; K580-D584 WeakPolarHBondContact O-CB 3.46Å; K580-D584 PolarHBondContact O-N 2.83Å
581	I	89	Confident	84.5	Confident	0 Å²	0	87.7 Å²	87.7	0%	0	41%	0.409	C	S	.	.	I	π-helix	trans	-59.2	-47.6	173.9	-72.9	175.6	0	0	0	111.1	A515 F519 A577 V578 R583 K585 M586 L605 Y608 L609	A515-I581 HydrophobicContact CB-CG1 4.23Å; F519-I581 HydrophobicContact CB-CD1 3.44Å; F519-I581 VanDerWaalsContact CB-CD1 3.44Å; F519-I581 HydrophobicContact CB-CG1 4.37Å; F519-I581 HydrophobicContact CD1-CD1 3.92Å; F519-I581 HydrophobicContact CD2-CD1 3.94Å; F519-I581 HydrophobicContact CG-CD1 3.5Å; F519-I581 VanDerWaalsContact CG-CD1 3.5Å; A577-I581 PolarHBondContact O-N 3.44Å; V578-I581 WeakPolarHBondContact O-CB 3.33Å; V578-I581 PolarHBondContact O-N 3.16Å; I581-R583 VanDerWaalsContact C-N 3.3Å; I581-R583 PolarHBondContact O-N 2.67Å; I581-K585 HydrophobicContact CG2-CB 4.23Å; I581-K585 WeakPolarHBondContact O-CA 2.92Å; I581-K585 VanDerWaalsContact O-CB 3.31Å; I581-K585 WeakPolarHBondContact O-CB 3.38Å; I581-K585 PolarHBondContact O-N 3.04Å; I581-M586 HydrophobicContact CG2-CG 4.42Å; I581-M586 PolarHBondContact O-N 3.22Å; I581-L605 HydrophobicContact CG2-CD1 4.49Å; I581-Y608 HydrophobicContact CG2-CD1 4.1Å; I581-Y608 HydrophobicContact CG2-CE1 3.79Å; I581-L609 HydrophobicContact CD1-CD2 3.72Å; I581-L609 HydrophobicContact CG2-CD2 4.42Å
582	V	88.6	Confident	84	Confident	30 Å²	30	85.4 Å²	85.4	18%	0.182	40%	0.402	C	S	.	.	I	π-helix	trans	-60.9	-41.5	179.7	170.8	0	0	0	0	111.4	V578 V579 K580 M586 Q587 R588 F601 L605	V578-V582 HydrophobicContact CG1-CG2 4.41Å; V578-V582 WeakPolarHBondContact O-CG2 3.06Å; V578-V582 PolarHBondContact O-N 2.72Å; V579-V582 PolarHBondContact O-N 2.93Å; K580-V582 PolarHBondContact O-N 3.1Å; V582-M586 CarbonylContact O-C 3.49Å; V582-M586 WeakPolarHBondContact O-CB 3.3Å; V582-Q587 PolarHBondContact O-N 3.31Å; V582-R588 HydrophobicContact CG1-CB 4.05Å; V582-R588 PolarHBondContact O-N 3.12Å; V582-F601 HydrophobicContact CG1-CE1 4.33Å; V582-F601 HydrophobicContact CG1-CZ 4.07Å; V582-F601 HydrophobicContact CG2-CZ 4.44Å; V582-L605 HydrophobicContact CG2-CD1 3.83Å; V582-L605 HydrophobicContact CG2-CD2 3.6Å; V582-L605 HydrophobicContact CG2-CG 4.39Å
583	R	83.9	Confident	83.3	Confident	128 Å²	128	89.2 Å²	89.2	48%	0.483	43%	0.429	S	S	.	.	I	π-helix	trans	-72.6	-49.7	179.8	-173.7	-169.1	-65.6	164.4	-3	112.6	V579 K580 I581 Q587	V579-R583 WeakPolarHBondContact O-CB 3.48Å; V579-R583 PolarHBondContact O-N 2.64Å; K580-R583 PolarHBondContact O-N 2.93Å; I581-R583 VanDerWaalsContact C-N 3.3Å; I581-R583 PolarHBondContact O-N 2.67Å; R583-Q587 VanDerWaalsContact O-CA 3.27Å; R583-Q587 WeakPolarHBondContact O-CA 3.42Å; R583-Q587 PolarHBondContact O-N 2.9Å
584	D	83.5	Confident	83.1	Confident	28 Å²	28	88.5 Å²	88.5	15%	0.15	43%	0.428	C	S	.	.	I	π-helix	trans	-100.7	-32.2	-161.7	-62.4	-17.2	0	0	0	112.5	R511 A512 A515 K580	R511-D584 HydrophobicContact CG-CB 3.96Å; R511-D584 WeakPolarHBondContact CG-OD2 3.45Å; R511-D584 IonicContact CZ-OD1 3.31Å; R511-D584 VanDerWaalsContact CZ-OD1 3.31Å; R511-D584 IonicContact CZ-OD2 3.78Å; R511-D584 IonicContact NE-OD1 2.67Å; R511-D584 PolarHBondContact NE-OD1 2.99Å; R511-D584 IonicContact NE-OD2 3.25Å; R511-D584 PolarHBondContact NE-OD2 3.32Å; R511-D584 IonicContact NH2-OD1 3.27Å; R511-D584 PolarHBondContact NH2-OD1 3.23Å; R511-D584 IonicContact NH2-OD2 3.99Å; A512-D584 WeakPolarHBondContact CB-O 3.42Å; A515-D584 HydrophobicContact CB-CB 4.29Å; K580-D584 VanDerWaalsContact O-CB 3.27Å; K580-D584 WeakPolarHBondContact O-CB 3.46Å; K580-D584 PolarHBondContact O-N 2.83Å
585	K	84.6	Confident	82.6	Confident	85 Å²	85	90.9 Å²	90.9	37%	0.37	45%	0.447	S	S	.	.	I	π-helix	trans	-94.6	-43.9	176.6	-175.7	69.7	171.3	-171.1	0	112.1	A512 V516 I581 Y608	A512-K585 HydrophobicContact CB-CB 4.25Å; A512-K585 HydrophobicContact CB-CD 3.71Å; V516-K585 HydrophobicContact CG2-CD 4.39Å; I581-K585 HydrophobicContact CG2-CB 4.23Å; I581-K585 WeakPolarHBondContact O-CA 2.92Å; I581-K585 VanDerWaalsContact O-CB 3.31Å; I581-K585 WeakPolarHBondContact O-CB 3.38Å; I581-K585 PolarHBondContact O-N 3.04Å; K585-Y608 HydrophobicContact CG-CE1 4.4Å
586	M	82.9	Confident	82.1	Confident	56 Å²	56	92.7 Å²	92.7	28%	0.276	46%	0.457	S	S	.	.	S	Bend	trans	-89	-3.6	179.8	-55	-71	-86.1	0	0	112.9	I581 V582 R588 F601	I581-M586 HydrophobicContact CG2-CG 4.42Å; I581-M586 PolarHBondContact O-N 3.22Å; V582-M586 CarbonylContact O-C 3.49Å; V582-M586 WeakPolarHBondContact O-CB 3.3Å; M586-R588 PolarHBondContact O-N 3.21Å; M586-F601 HydrophobicContact CB-CE2 4.48Å; M586-F601 HydrophobicContact CE-CE2 4.04Å
587	Q	80.3	Confident	81.7	Confident	162 Å²	162	89.6 Å²	89.6	76%	0.757	45%	0.45	S	S	*	.			trans	52.9	33	177.5	-59.6	-176.8	12.7	0	0	114.3	V582 R583	V582-Q587 PolarHBondContact O-N 3.31Å; R583-Q587 VanDerWaalsContact O-CA 3.27Å; R583-Q587 WeakPolarHBondContact O-CA 3.42Å; R583-Q587 PolarHBondContact O-N 2.9Å
588	R	75.7	Confident	81.3	Confident	141 Å²	141	92.2 Å²	92.2	53%	0.532	47%	0.465	S	S	.	.			trans	-101.4	107.8	179.5	-67.2	-60.1	178.4	151.2	-3.3	110.9	V582 M586 F601	V582-R588 HydrophobicContact CG1-CB 4.05Å; V582-R588 PolarHBondContact O-N 3.12Å; M586-R588 PolarHBondContact O-N 3.21Å; R588-F601 HydrophobicContact CG-CE2 3.86Å; R588-F601 HydrophobicContact CG-CZ 4.04Å
589	S	65.4	Low	80.9	Confident	109 Å²	109	98.6 Å²	98.6	76%	0.762	49%	0.491	S	S	*	.			trans	-109.1	-9.6	176.7	57.5	0	0	0	0	114
590	R	74.6	Confident	80.8	Confident	215 Å²	215	100 Å²	100	81%	0.811	49%	0.493	S	S	*	.	S	Bend	trans	-111.8	143.7	-177.7	-63.8	-176.3	-177.6	173.5	1.1	112.1
591	P	71.2	Confident	80.8	Confident	118 Å²	118	97.7 Å²	97.7	77%	0.766	48%	0.483	S	S	*	.			trans	-71.2	137.4	176.4	28.9	-32.8	0	0	0	111.5
592	L	78.7	Confident	80.7	Confident	59 Å²	59	101.7 Å²	101.7	31%	0.309	51%	0.507	S	S	.	.			trans	-77.9	134.4	175.4	-67.4	165.4	0	0	0	109.8	E597 V598 F601	L592-E597 HydrophobicContact CD2-CB 4.44Å; L592-V598 HydrophobicContact CB-CG2 3.54Å; L592-V598 HydrophobicContact CD1-CG2 4.17Å; L592-F601 HydrophobicContact CD1-CB 3.83Å; L592-F601 HydrophobicContact CD1-CD1 4.08Å; L592-F601 HydrophobicContact CD1-CG 4Å
593	T	75.2	Confident	80.6	Confident	143 Å²	143	103.2 Å²	103.2	88%	0.877	52%	0.519	S	S	*	.			trans	-103.9	-22.2	-175.3	-17.2	0	0	0	0	112.7
594	D	83.9	Confident	80.8	Confident	70 Å²	70	102.5 Å²	102.5	37%	0.374	52%	0.52	S	S	.	.			trans	-92.3	126.2	179.9	177	47.9	0	0	0	112.3	Q596 E597 V598	D594-Q596 PolarHBondContact O-N 3.28Å; D594-Q596 WeakPolarHBondContact OD2-CB 3.41Å; D594-Q596 PolarHBondContact OD2-N 3.31Å; D594-E597 HydrophobicContact CB-CB 4.16Å; D594-E597 HydrophobicContact CB-CG 4.13Å; D594-E597 PolarHBondContact O-N 3.38Å; D594-E597 WeakPolarHBondContact OD2-CG 3.38Å; D594-E597 PolarHBondContact OD2-N 3.42Å; D594-V598 WeakPolarHBondContact O-CG2 3.41Å; D594-V598 PolarHBondContact O-N 2.91Å; D594-V598 VanDerWaalsContact O-N 3.1Å
595	P	80.8	Confident	81.1	Confident	94 Å²	94	102.3 Å²	102.3	61%	0.61	52%	0.518	S	S	*	.	H	α-helix	trans	-60.1	-27.1	179.4	-25.3	33.7	0	0	0	115.1	K599	P595-K599 WeakPolarHBondContact O-CG 3.38Å; P595-K599 PolarHBondContact O-N 3.1Å
596	Q	81.4	Confident	81.5	Confident	154 Å²	154	105.9 Å²	105.9	72%	0.72	53%	0.531	S	S	*	.	H	α-helix	trans	-79.9	-43.8	-178.6	-163.4	132.5	-27.2	0	0	111	D594 V598 K599 E600	D594-Q596 PolarHBondContact O-N 3.28Å; D594-Q596 WeakPolarHBondContact OD2-CB 3.41Å; D594-Q596 PolarHBondContact OD2-N 3.31Å; Q596-V598 VanDerWaalsContact C-N 3.32Å; Q596-V598 PolarHBondContact O-N 2.8Å; Q596-K599 PolarHBondContact O-N 3.2Å; Q596-E600 PolarHBondContact O-N 3.31Å
597	E	80.6	Confident	81.9	Confident	104 Å²	104	107.2 Å²	107.2	49%	0.486	54%	0.542	S	S	.	.	H	α-helix	trans	-60.2	-38.1	171.9	-72.3	-179	-178.9	0	0	113	L592 D594 E600 F601	L592-E597 HydrophobicContact CD2-CB 4.44Å; D594-E597 HydrophobicContact CB-CB 4.16Å; D594-E597 HydrophobicContact CB-CG 4.13Å; D594-E597 PolarHBondContact O-N 3.38Å; D594-E597 WeakPolarHBondContact OD2-CG 3.38Å; D594-E597 PolarHBondContact OD2-N 3.42Å; E597-E600 PolarHBondContact O-N 3.14Å; E597-F601 VanDerWaalsContact O-CB 3.31Å; E597-F601 WeakPolarHBondContact O-CB 3.46Å; E597-F601 PolarHBondContact O-N 3.12Å
598	V	80.8	Confident	82.4	Confident	56 Å²	56	101.6 Å²	101.6	34%	0.339	51%	0.514	S	S	.	.	H	α-helix	trans	-60.4	-46.1	174.9	172.4	0	0	0	0	110.8	L592 D594 Q596 F601 V602	L592-V598 HydrophobicContact CB-CG2 3.54Å; L592-V598 HydrophobicContact CD1-CG2 4.17Å; D594-V598 WeakPolarHBondContact O-CG2 3.41Å; D594-V598 PolarHBondContact O-N 2.91Å; D594-V598 VanDerWaalsContact O-N 3.1Å; Q596-V598 VanDerWaalsContact C-N 3.32Å; Q596-V598 PolarHBondContact O-N 2.8Å; V598-F601 PolarHBondContact O-N 3.27Å; V598-V602 HydrophobicContact CG1-CG2 4.28Å; V598-V602 WeakPolarHBondContact O-CB 3.17Å; V598-V602 WeakPolarHBondContact O-CG2 3.42Å; V598-V602 PolarHBondContact O-N 3.37Å
599	K	82.9	Confident	83.2	Confident	161 Å²	161	96.3 Å²	96.3	70%	0.7	50%	0.496	S	S	*	.	H	α-helix	trans	-65	-43.3	179.8	-74	177.9	-179	179.1	0	111.9	P595 Q596 V602 S603	P595-K599 WeakPolarHBondContact O-CG 3.38Å; P595-K599 PolarHBondContact O-N 3.1Å; Q596-K599 PolarHBondContact O-N 3.2Å; K599-V602 PolarHBondContact O-N 3.09Å; K599-S603 PolarHBondContact O-N 3.03Å
600	E	86.3	Confident	84.4	Confident	102 Å²	102	92.8 Å²	92.8	48%	0.477	47%	0.47	S	S	.	.	H	α-helix	trans	-63.3	-44.3	177.7	-167.3	-175.7	158.6	0	0	111.1	Q596 E597 S603 K604	Q596-E600 PolarHBondContact O-N 3.31Å; E597-E600 PolarHBondContact O-N 3.14Å; E600-S603 PolarHBondContact O-N 3.48Å; E600-S603 PolarHBondContact O-OG 3.02Å; E600-K604 WeakPolarHBondContact O-CG 3.35Å; E600-K604 PolarHBondContact O-N 3.45Å; E600-K604 VanDerWaalsContact O-N 3.11Å; E600-K604 WeakPolarHBondContact OE1-CE 3.34Å; E600-K604 IonicContact OE1-NZ 3.36Å; E600-K604 PolarHBondContact OE1-NZ 2.72Å
601	F	87.1	Confident	85.1	Confident	37 Å²	37	87 Å²	87	16%	0.162	46%	0.455	C	S	.	.	H	α-helix	trans	-64.5	-44.6	178	-179.5	-101.7	0	0	0	112.7	V582 M586 R588 L592 E597 V598 S603 K604 L605	V582-F601 HydrophobicContact CG1-CE1 4.33Å; V582-F601 HydrophobicContact CG1-CZ 4.07Å; V582-F601 HydrophobicContact CG2-CZ 4.44Å; M586-F601 HydrophobicContact CB-CE2 4.48Å; M586-F601 HydrophobicContact CE-CE2 4.04Å; R588-F601 HydrophobicContact CG-CE2 3.86Å; R588-F601 HydrophobicContact CG-CZ 4.04Å; L592-F601 HydrophobicContact CD1-CB 3.83Å; L592-F601 HydrophobicContact CD1-CD1 4.08Å; L592-F601 HydrophobicContact CD1-CG 4Å; E597-F601 VanDerWaalsContact O-CB 3.31Å; E597-F601 WeakPolarHBondContact O-CB 3.46Å; E597-F601 PolarHBondContact O-N 3.12Å; V598-F601 PolarHBondContact O-N 3.27Å; F601-S603 VanDerWaalsContact C-N 3.28Å; F601-S603 PolarHBondContact O-N 3.46Å; F601-K604 PolarHBondContact O-N 2.85Å; F601-L605 HydrophobicContact CE1-CD2 4.3Å; F601-L605 WeakPolarHBondContact O-CB 3.49Å; F601-L605 PolarHBondContact O-N 2.91Å
602	V	85.9	Confident	86.1	Confident	84 Å²	84	83.1 Å²	83.1	51%	0.509	43%	0.426	S	S	.	.	H	α-helix	trans	-61.3	-39	176.9	171.3	0	0	0	0	110.9	V598 K599 L605 Y606	V598-V602 HydrophobicContact CG1-CG2 4.28Å; V598-V602 WeakPolarHBondContact O-CB 3.17Å; V598-V602 WeakPolarHBondContact O-CG2 3.42Å; V598-V602 PolarHBondContact O-N 3.37Å; K599-V602 PolarHBondContact O-N 3.09Å; V602-L605 PolarHBondContact O-N 3.25Å; V602-Y606 WeakPolarHBondContact O-CB 3.3Å; V602-Y606 PolarHBondContact O-N 3.09Å
603	S	87.5	Confident	86.8	Confident	62 Å²	62	83.4 Å²	83.4	43%	0.434	43%	0.427	S	S	.	.	H	α-helix	trans	-63	-43.9	176.1	78.9	0	0	0	0	112.2	K599 E600 F601 Y606 V607	K599-S603 PolarHBondContact O-N 3.03Å; E600-S603 PolarHBondContact O-N 3.48Å; E600-S603 PolarHBondContact O-OG 3.02Å; F601-S603 VanDerWaalsContact C-N 3.28Å; F601-S603 PolarHBondContact O-N 3.46Å; S603-Y606 PolarHBondContact O-N 3.44Å; S603-V607 WeakPolarHBondContact O-CG2 3.37Å; S603-V607 PolarHBondContact O-N 3.18Å
604	K	87.6	Confident	87.3	Confident	113 Å²	113	81 Å²	81	49%	0.491	41%	0.406	S	S	.	.	H	α-helix	trans	-66.2	-41.4	177.2	-70.8	177.1	-175.1	169.6	0	111.8	E600 F601 Y608	E600-K604 WeakPolarHBondContact O-CG 3.35Å; E600-K604 PolarHBondContact O-N 3.45Å; E600-K604 VanDerWaalsContact O-N 3.11Å; E600-K604 WeakPolarHBondContact OE1-CE 3.34Å; E600-K604 IonicContact OE1-NZ 3.36Å; E600-K604 PolarHBondContact OE1-NZ 2.72Å; F601-K604 PolarHBondContact O-N 2.85Å; K604-Y608 WeakPolarHBondContact O-CB 2.91Å; K604-Y608 PolarHBondContact O-N 2.93Å
605	L	90.7	Very high	87.5	Confident	23 Å²	23	80.8 Å²	80.8	12%	0.12	41%	0.407	C	S	.	.	H	α-helix	trans	-63.4	-43	176	-179.4	61	0	0	0	111.1	V578 I581 V582 F601 V602 Y608 L609	V578-L605 HydrophobicContact CG1-CD2 4.27Å; I581-L605 HydrophobicContact CG2-CD1 4.49Å; V582-L605 HydrophobicContact CG2-CD1 3.83Å; V582-L605 HydrophobicContact CG2-CD2 3.6Å; V582-L605 HydrophobicContact CG2-CG 4.39Å; F601-L605 HydrophobicContact CE1-CD2 4.3Å; F601-L605 WeakPolarHBondContact O-CB 3.49Å; F601-L605 PolarHBondContact O-N 2.91Å; V602-L605 PolarHBondContact O-N 3.25Å; L605-Y608 PolarHBondContact O-N 2.8Å; L605-L609 HydrophobicContact CD1-CD1 4Å; L605-L609 HydrophobicContact CD1-CD2 4.38Å; L605-L609 HydrophobicContact CD1-CG 3.97Å; L605-L609 HydrophobicContact CG-CD1 3.87Å; L605-L609 HydrophobicContact CG-CG 4.27Å; L605-L609 WeakPolarHBondContact O-CB 3.37Å; L605-L609 VanDerWaalsContact O-CG 3.24Å; L605-L609 WeakPolarHBondContact O-CG 3.4Å; L605-L609 PolarHBondContact O-N 3.5Å
606	Y	91	Very high	87.9	Confident	161 Å²	161	76.4 Å²	76.4	63%	0.631	38%	0.378	S	S	*	.	H	α-helix	trans	-60.9	-49.8	177.8	177.2	-98.4	0	0	0	111.8	V602 S603 Y608 L609 V610	V602-Y606 WeakPolarHBondContact O-CB 3.3Å; V602-Y606 PolarHBondContact O-N 3.09Å; S603-Y606 PolarHBondContact O-N 3.44Å; Y606-Y608 VanDerWaalsContact C-N 3.31Å; Y606-Y608 PolarHBondContact O-N 2.9Å; Y606-L609 PolarHBondContact O-N 2.64Å; Y606-V610 HydrophobicContact CD1-CG2 4.33Å; Y606-V610 HydrophobicContact CD2-CG2 4.29Å; Y606-V610 HydrophobicContact CE1-CG2 3.97Å; Y606-V610 HydrophobicContact CE2-CG2 3.91Å; Y606-V610 HydrophobicContact CG-CG2 4.48Å; Y606-V610 WeakPolarHBondContact O-CB 3.36Å; Y606-V610 VanDerWaalsContact O-CG2 3.25Å; Y606-V610 WeakPolarHBondContact O-CG2 3.22Å; Y606-V610 PolarHBondContact O-N 2.65Å
607	V	91.5	Very high	88.1	Confident	83 Å²	83	71 Å²	71	50%	0.503	35%	0.354	S	S	.	.	H	α-helix	trans	-56	-48.4	176.6	173	0	0	0	0	110.5	S603 L609 V610 D611	S603-V607 WeakPolarHBondContact O-CG2 3.37Å; S603-V607 PolarHBondContact O-N 3.18Å; V607-L609 PolarHBondContact O-N 3.41Å; V607-V610 PolarHBondContact O-N 3.15Å; V607-D611 PolarHBondContact O-N 3.1Å
608	Y	91.1	Very high	88.3	Confident	45 Å²	45	71 Å²	71	18%	0.176	36%	0.358	C	S	.	.	H	α-helix	trans	-61	-46.9	-179.8	-178.5	-104.4	0	0	0	113.3	V516 I581 K585 K604 L605 Y606 V610 D611 E612	V516-Y608 WeakPolarHBondContact CG2-OH 3.45Å; I581-Y608 HydrophobicContact CG2-CD1 4.1Å; I581-Y608 HydrophobicContact CG2-CE1 3.79Å; K585-Y608 HydrophobicContact CG-CE1 4.4Å; K604-Y608 WeakPolarHBondContact O-CB 2.91Å; K604-Y608 PolarHBondContact O-N 2.93Å; L605-Y608 PolarHBondContact O-N 2.8Å; Y606-Y608 VanDerWaalsContact C-N 3.31Å; Y606-Y608 PolarHBondContact O-N 2.9Å; Y608-V610 VanDerWaalsContact C-N 3.29Å; Y608-V610 PolarHBondContact O-N 3.05Å; Y608-D611 PolarHBondContact O-N 3.33Å; Y608-E612 HydrophobicContact CD1-CG 4.36Å; Y608-E612 HydrophobicContact CD2-CG 4.41Å; Y608-E612 HydrophobicContact CE1-CG 3.81Å; Y608-E612 HydrophobicContact CE2-CG 3.84Å; Y608-E612 WeakPolarHBondContact CE2-OE1 3.38Å; Y608-E612 VanDerWaalsContact CZ-CG 3.49Å; Y608-E612 WeakPolarHBondContact O-CG 3.2Å; Y608-E612 PolarHBondContact O-N 3.06Å; Y608-E612 PolarHBondContact OH-OE1 2.99Å
609	L	92.6	Very high	88.4	Confident	29 Å²	29	74.2 Å²	74.2	15%	0.152	37%	0.367	C	S	.	.	H	α-helix	trans	-65.1	-35.6	179.7	-68.5	174.6	0	0	0	111.9	F519 V578 I581 L605 Y606 V607 M613	F519-L609 HydrophobicContact CD2-CD2 4.32Å; F519-L609 HydrophobicContact CE1-CD2 4.17Å; F519-L609 HydrophobicContact CE2-CD2 3.86Å; F519-L609 HydrophobicContact CZ-CB 4.15Å; F519-L609 HydrophobicContact CZ-CD2 3.79Å; V578-L609 HydrophobicContact CB-CD1 4.45Å; V578-L609 HydrophobicContact CG1-CD1 3.8Å; V578-L609 HydrophobicContact CG2-CD1 3.75Å; V578-L609 HydrophobicContact CG2-CD2 3.94Å; I581-L609 HydrophobicContact CD1-CD2 3.72Å; I581-L609 HydrophobicContact CG2-CD2 4.42Å; L605-L609 HydrophobicContact CD1-CD1 4Å; L605-L609 HydrophobicContact CD1-CD2 4.38Å; L605-L609 HydrophobicContact CD1-CG 3.97Å; L605-L609 HydrophobicContact CG-CD1 3.87Å; L605-L609 HydrophobicContact CG-CG 4.27Å; L605-L609 WeakPolarHBondContact O-CB 3.37Å; L605-L609 VanDerWaalsContact O-CG 3.24Å; L605-L609 WeakPolarHBondContact O-CG 3.4Å; L605-L609 PolarHBondContact O-N 3.5Å; Y606-L609 PolarHBondContact O-N 2.64Å; V607-L609 PolarHBondContact O-N 3.41Å; L609-M613 VanDerWaalsContact O-CB 3.22Å; L609-M613 WeakPolarHBondContact O-CB 3.46Å; L609-M613 PolarHBondContact O-N 3.35Å
610	V	91.4	Very high	88.3	Confident	35 Å²	35	69.7 Å²	69.7	21%	0.212	35%	0.35	C	S	.	.	H	α-helix	trans	-67	-44.4	175.9	171.7	0	0	0	0	110.5	Y606 V607 Y608 M613 H614	Y606-V610 HydrophobicContact CD1-CG2 4.33Å; Y606-V610 HydrophobicContact CD2-CG2 4.29Å; Y606-V610 HydrophobicContact CE1-CG2 3.97Å; Y606-V610 HydrophobicContact CE2-CG2 3.91Å; Y606-V610 HydrophobicContact CG-CG2 4.48Å; Y606-V610 WeakPolarHBondContact O-CB 3.36Å; Y606-V610 VanDerWaalsContact O-CG2 3.25Å; Y606-V610 WeakPolarHBondContact O-CG2 3.22Å; Y606-V610 PolarHBondContact O-N 2.65Å; V607-V610 PolarHBondContact O-N 3.15Å; Y608-V610 VanDerWaalsContact C-N 3.29Å; Y608-V610 PolarHBondContact O-N 3.05Å; V610-M613 WeakPolarHBondContact O-CB 3.38Å; V610-M613 PolarHBondContact O-N 3.42Å; V610-H614 VanDerWaalsContact CG1-CE1 3.46Å; V610-H614 WeakPolarHBondContact CG1-CE1 3.31Å; V610-H614 PolarHBondContact O-N 3.38Å; V610-H614 PolarHBondContact O-ND1 3.36Å
611	D	89.9	Confident	87.8	Confident	93 Å²	93	72.3 Å²	72.3	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-60.7	-48.3	177	-68.9	-21.5	0	0	0	111.3	V607 Y608 M613 H614 V615	V607-D611 PolarHBondContact O-N 3.1Å; Y608-D611 PolarHBondContact O-N 3.33Å; D611-M613 VanDerWaalsContact C-N 3.32Å; D611-M613 PolarHBondContact O-N 3.13Å; D611-H614 PolarHBondContact O-N 2.84Å; D611-V615 WeakPolarHBondContact O-CG2 3.09Å; D611-V615 PolarHBondContact O-N 3.14Å
612	E	91.2	Very high	87	Confident	37 Å²	37	75.2 Å²	75.2	17%	0.173	38%	0.381	C	S	.	.	H	α-helix	trans	-65.6	-33.2	177.9	-69.8	-67.1	170.7	0	0	112.9	V516 F519 H520 Y608 V615 A616	V516-E612 WeakPolarHBondContact CG1-OE2 3.42Å; F519-E612 HydrophobicContact CD1-CB 4.16Å; F519-E612 HydrophobicContact CE1-CB 3.97Å; H520-E612 IonicContact CE1-OE2 3.89Å; H520-E612 PolarHBondContact CE1-OE2 3.42Å; H520-E612 PolarHBondContact NE2-O 3.11Å; H520-E612 IonicContact NE2-OE2 2.96Å; H520-E612 PolarHBondContact NE2-OE2 3.4Å; Y608-E612 HydrophobicContact CD1-CG 4.36Å; Y608-E612 HydrophobicContact CD2-CG 4.41Å; Y608-E612 HydrophobicContact CE1-CG 3.81Å; Y608-E612 HydrophobicContact CE2-CG 3.84Å; Y608-E612 WeakPolarHBondContact CE2-OE1 3.38Å; Y608-E612 VanDerWaalsContact CZ-CG 3.49Å; Y608-E612 WeakPolarHBondContact O-CG 3.2Å; Y608-E612 PolarHBondContact O-N 3.06Å; Y608-E612 PolarHBondContact OH-OE1 2.99Å; E612-V615 PolarHBondContact O-N 3.43Å; E612-A616 WeakPolarHBondContact O-CB 3.5Å; E612-A616 PolarHBondContact O-N 3.35Å
613	M	92.9	Very high	85.4	Confident	66 Å²	66	74.7 Å²	74.7	33%	0.325	38%	0.381	S	S	.	.	H	α-helix	trans	-63.1	-44.1	172.6	179.9	-168.1	72.2	0	0	110.9	V523 L609 V610 D611 V615 A616 L617	V523-M613 HydrophobicContact CG1-CG 4.02Å; V523-M613 HydrophobicContact CG2-CG 4.34Å; L609-M613 VanDerWaalsContact O-CB 3.22Å; L609-M613 WeakPolarHBondContact O-CB 3.46Å; L609-M613 PolarHBondContact O-N 3.35Å; V610-M613 WeakPolarHBondContact O-CB 3.38Å; V610-M613 PolarHBondContact O-N 3.42Å; D611-M613 VanDerWaalsContact C-N 3.32Å; D611-M613 PolarHBondContact O-N 3.13Å; M613-V615 VanDerWaalsContact C-N 3.31Å; M613-V615 PolarHBondContact O-N 2.95Å; M613-A616 PolarHBondContact O-N 3.14Å; M613-L617 HydrophobicContact CE-CD1 4.39Å; M613-L617 HydrophobicContact CG-CD1 3.99Å; M613-L617 HydrophobicContact CG-CG 4.34Å; M613-L617 WeakPolarHBondContact O-CB 3.47Å; M613-L617 VanDerWaalsContact O-CG 3.26Å; M613-L617 WeakPolarHBondContact O-CG 3.45Å; M613-L617 PolarHBondContact O-N 3.29Å
614	H	87.3	Confident	83.4	Confident	93 Å²	93	79.4 Å²	79.4	43%	0.431	40%	0.402	S	S	.	.	H	α-helix	trans	-63.4	-38.1	175.6	-72.1	93	0	0	0	111.8	V610 D611 L617 N618	V610-H614 VanDerWaalsContact CG1-CE1 3.46Å; V610-H614 WeakPolarHBondContact CG1-CE1 3.31Å; V610-H614 PolarHBondContact O-N 3.38Å; V610-H614 PolarHBondContact O-ND1 3.36Å; D611-H614 PolarHBondContact O-N 2.84Å; H614-L617 PolarHBondContact O-N 2.97Å; H614-N618 VanDerWaalsContact O-CB 3.25Å; H614-N618 WeakPolarHBondContact O-CB 3.42Å; H614-N618 PolarHBondContact O-N 3.34Å; H614-N618 PolarHBondContact O-ND2 3.1Å
615	V	88.2	Confident	81.5	Confident	64 Å²	64	80.9 Å²	80.9	39%	0.388	42%	0.42	S	S	.	.	H	α-helix	trans	-61.3	-45.3	173.3	174	0	0	0	0	111.1	D611 E612 M613 K619	D611-V615 WeakPolarHBondContact O-CG2 3.09Å; D611-V615 PolarHBondContact O-N 3.14Å; E612-V615 PolarHBondContact O-N 3.43Å; M613-V615 VanDerWaalsContact C-N 3.31Å; M613-V615 PolarHBondContact O-N 2.95Å; V615-K619 WeakPolarHBondContact O-CG 3.33Å; V615-K619 PolarHBondContact O-N 3.22Å; V615-K619 VanDerWaalsContact O-N 3.07Å
616	A	88	Confident	79	Confident	2 Å²	2	83.6 Å²	83.6	2%	0.017	45%	0.445	C	S	.	.	H	α-helix	trans	-62.6	-47.7	177.2	0	0	0	0	0	112	H520 V523 E612 M613 K619 I620	H520-A616 HydrophobicContact CB-CB 3.87Å; V523-A616 HydrophobicContact CB-CB 4.18Å; V523-A616 HydrophobicContact CG1-CB 4.01Å; E612-A616 WeakPolarHBondContact O-CB 3.5Å; E612-A616 PolarHBondContact O-N 3.35Å; M613-A616 PolarHBondContact O-N 3.14Å; A616-K619 WeakPolarHBondContact O-CB 3.42Å; A616-K619 PolarHBondContact O-N 3.35Å; A616-I620 WeakPolarHBondContact O-CD1 3.32Å; A616-I620 VanDerWaalsContact O-CG1 3.31Å; A616-I620 WeakPolarHBondContact O-CG1 3.49Å; A616-I620 PolarHBondContact O-N 2.98Å
617	L	86.4	Confident	76.5	Confident	40 Å²	40	85.4 Å²	85.4	21%	0.209	46%	0.459	C	S	.	.	H	α-helix	trans	-61.7	-45.5	178	-69.2	173.4	0	0	0	111.5	V523 V527 M613 H614 K619 I620 Y621	V523-L617 HydrophobicContact CG1-CD2 4.14Å; V523-L617 HydrophobicContact CG1-CG 4.28Å; V527-L617 HydrophobicContact CG2-CD2 3.38Å; M613-L617 HydrophobicContact CE-CD1 4.39Å; M613-L617 HydrophobicContact CG-CD1 3.99Å; M613-L617 HydrophobicContact CG-CG 4.34Å; M613-L617 WeakPolarHBondContact O-CB 3.47Å; M613-L617 VanDerWaalsContact O-CG 3.26Å; M613-L617 WeakPolarHBondContact O-CG 3.45Å; M613-L617 PolarHBondContact O-N 3.29Å; H614-L617 PolarHBondContact O-N 2.97Å; L617-K619 VanDerWaalsContact C-N 3.26Å; L617-K619 PolarHBondContact O-N 3.14Å; L617-I620 PolarHBondContact O-N 3.11Å; L617-I620 VanDerWaalsContact O-N 3.17Å; L617-Y621 HydrophobicContact CD2-CE2 4.29Å; L617-Y621 WeakPolarHBondContact O-CD2 3.29Å; L617-Y621 PolarHBondContact O-N 3.42Å
618	N	84.8	Confident	73.8	Confident	105 Å²	105	89.1 Å²	89.1	56%	0.561	48%	0.477	S	S	*	.	H	α-helix	trans	-60.3	-37.6	176.8	-75.6	-17.9	0	0	0	111.6	H614 S622	H614-N618 VanDerWaalsContact O-CB 3.25Å; H614-N618 WeakPolarHBondContact O-CB 3.42Å; H614-N618 PolarHBondContact O-N 3.34Å; H614-N618 PolarHBondContact O-ND2 3.1Å; N618-S622 WeakPolarHBondContact O-CB 3.38Å; N618-S622 PolarHBondContact O-N 2.9Å; N618-S622 PolarHBondContact O-OG 3.04Å
619	K	82.4	Confident	70.9	Confident	124 Å²	124	92.2 Å²	92.2	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-46.4	174.1	-74.4	174.3	-177.5	176.7	0	112.2	V615 A616 L617 Y621 S622 S623	V615-K619 WeakPolarHBondContact O-CG 3.33Å; V615-K619 PolarHBondContact O-N 3.22Å; V615-K619 VanDerWaalsContact O-N 3.07Å; A616-K619 WeakPolarHBondContact O-CB 3.42Å; A616-K619 PolarHBondContact O-N 3.35Å; L617-K619 VanDerWaalsContact C-N 3.26Å; L617-K619 PolarHBondContact O-N 3.14Å; K619-Y621 VanDerWaalsContact C-N 3.32Å; K619-Y621 PolarHBondContact O-N 2.96Å; K619-S622 PolarHBondContact O-N 3.17Å; K619-S623 PolarHBondContact O-N 2.97Å
620	I	81.8	Confident	68.1	Low	65 Å²	65	96.2 Å²	96.2	33%	0.333	53%	0.529	S	S	.	.	H	α-helix	trans	-61.4	-41.3	-179.4	-65.9	160.1	0	0	0	111.1	A616 L617 S623	A616-I620 WeakPolarHBondContact O-CD1 3.32Å; A616-I620 VanDerWaalsContact O-CG1 3.31Å; A616-I620 WeakPolarHBondContact O-CG1 3.49Å; A616-I620 PolarHBondContact O-N 2.98Å; L617-I620 PolarHBondContact O-N 3.11Å; L617-I620 VanDerWaalsContact O-N 3.17Å; I620-S623 PolarHBondContact O-OG 3.3Å
621	Y	74.3	Confident	65.4	Low	158 Å²	158	102.4 Å²	102.4	62%	0.62	56%	0.561	S	S	*	*	H	α-helix	trans	-88.2	-5.8	-179.6	-68.4	-69.2	0	0	0	114.3	L617 K619	L617-Y621 HydrophobicContact CD2-CE2 4.29Å; L617-Y621 WeakPolarHBondContact O-CD2 3.29Å; L617-Y621 PolarHBondContact O-N 3.42Å; K619-Y621 VanDerWaalsContact C-N 3.32Å; K619-Y621 PolarHBondContact O-N 2.96Å
622	S	70.2	Confident	63.2	Low	97 Å²	97	104.9 Å²	104.9	68%	0.678	57%	0.57	S	S	*	*	H	α-helix	trans	-100.8	-5.5	175.3	-57	0	0	0	0	113.4	N618 K619 D624	N618-S622 WeakPolarHBondContact O-CB 3.38Å; N618-S622 PolarHBondContact O-N 2.9Å; N618-S622 PolarHBondContact O-OG 3.04Å; K619-S622 PolarHBondContact O-N 3.17Å; S622-D624 VanDerWaalsContact C-N 3.32Å; S622-D624 PolarHBondContact O-N 3.26Å
623	S	52	Low	61.3	Low	73 Å²	73	109.9 Å²	109.9	51%	0.51	60%	0.595	S	S	.	*			trans	-88.6	26.6	-173.9	69	0	0	0	0	115.1	K619 I620 V625	K619-S623 PolarHBondContact O-N 2.97Å; I620-S623 PolarHBondContact O-OG 3.3Å; S623-V625 PolarHBondContact O-N 3.26Å
624	D	47.3	Very low	59.7	Low	162 Å²	162	115 Å²	115	87%	0.866	62%	0.615	S	S	*	*	S	Bend	trans	-68.5	11.3	174.6	-95	-6.6	0	0	0	114.3	S622	S622-D624 VanDerWaalsContact C-N 3.32Å; S622-D624 PolarHBondContact O-N 3.26Å
625	V	47.4	Very low	58.9	Low	144 Å²	144	112.2 Å²	112.2	87%	0.873	60%	0.603	S	S	*	*	S	Bend	trans	-145.9	80.8	165.1	-169.5	0	0	0	0	110.3	S623	S623-V625 PolarHBondContact O-N 3.26Å
626	A	36.7	Very low	58.6	Low	79 Å²	79	115.1 Å²	115.1	65%	0.653	61%	0.613	S	S	*	*	S	Bend	trans	-159	124	148.9	0	0	0	0	0	108.4	D628	A626-D628 PolarHBondContact O-N 3.43Å
627	E	39.4	Very low	58.4	Low	199 Å²	199	116 Å²	116	93%	0.93	62%	0.619	S	S	*	*			trans	-46.2	113.9	178.1	-66.6	163.9	154.2	0	0	111.5	C629	E627-C629 PolarHBondContact O-N 2.93Å
628	D	33.8	Very low	58.3	Low	162 Å²	162	118.1 Å²	118.1	87%	0.866	64%	0.637	S	S	*	*			trans	-70.9	117.8	165.9	-88.9	-33.2	0	0	0	108.9	A626 T630	A626-D628 PolarHBondContact O-N 3.43Å; D628-T630 PolarHBondContact O-N 3.33Å
629	C	32	Very low	58.4	Low	110 Å²	110	117 Å²	117	74%	0.743	63%	0.628	S	S	*	*			trans	-1.3	107.7	154.3	-88.1	0	0	0	0	115.8	E627 D631	E627-C629 PolarHBondContact O-N 2.93Å; C629-D631 PolarHBondContact O-N 3.25Å
630	T	32.9	Very low	58.6	Low	112 Å²	112	111 Å²	111	69%	0.687	60%	0.603	S	S	*	*			trans	-65.9	123.5	140.7	44.4	0	0	0	0	107.2	D628 E632	D628-T630 PolarHBondContact O-N 3.33Å; T630-E632 PolarHBondContact O-N 3.33Å
631	D	35.2	Very low	59	Low	166 Å²	166	112 Å²	112	89%	0.888	60%	0.602	S	S	*	*			trans	-64.8	74.2	166.1	-92.3	-33	0	0	0	108.6	C629	C629-D631 PolarHBondContact O-N 3.25Å
632	E	43.8	Very low	59.6	Low	145 Å²	145	107.2 Å²	107.2	68%	0.678	59%	0.585	S	S	*	*			trans	-68.7	127.8	161.1	-74.1	-176.9	171.1	0	0	107.4	T630 K634	T630-E632 PolarHBondContact O-N 3.33Å; E632-K634 PolarHBondContact O-N 3.49Å
633	M	50.6	Low	60.4	Low	142 Å²	142	102.9 Å²	102.9	70%	0.7	55%	0.554	S	S	*	*			trans	-53.7	103.8	171	-116.1	175.8	113.5	0	0	108.3	L635 L1076	M633-L635 PolarHBondContact O-N 3.17Å; M633-L1076 HydrophobicContact CE-CD2 4.45Å; M633-L1076 HydrophobicContact SD-CD1 3.68Å; M633-L1076 HydrophobicContact SD-CD2 3.68Å; M633-L1076 HydrophobicContact SD-CG 3.76Å
634	K	59.7	Low	62.3	Low	173 Å²	173	99.4 Å²	99.4	75%	0.752	53%	0.53	S	S	*	.			trans	-67	100.5	180	-72.9	178.8	-178.3	171.5	0	108.4	E632 E636	E632-K634 PolarHBondContact O-N 3.49Å; K634-E636 PolarHBondContact O-N 3.03Å
635	L	70.6	Confident	64.2	Low	34 Å²	34	95.8 Å²	95.8	18%	0.178	51%	0.506	C	S	.	.			trans	-47.4	136.6	172.7	-77.8	154	0	0	0	110.6	M633 Q639 L640 F643 R666	M633-L635 PolarHBondContact O-N 3.17Å; L635-Q639 HydrophobicContact CD2-CB 4.28Å; L635-L640 HydrophobicContact CB-CD1 4.47Å; L635-L640 HydrophobicContact CB-CD2 4.07Å; L635-L640 HydrophobicContact CB-CG 3.92Å; L635-L640 HydrophobicContact CD1-CD2 3.98Å; L635-F643 HydrophobicContact CD1-CE2 4.29Å; L635-F643 HydrophobicContact CD2-CD2 4.35Å; L635-F643 HydrophobicContact CD2-CE2 3.53Å; L635-F643 HydrophobicContact CD2-CZ 4.21Å; L635-R666 PolarHBondContact O-NH1 3.37Å
636	E	80.8	Confident	66.2	Low	125 Å²	125	89.6 Å²	89.6	58%	0.584	47%	0.468	S	S	*	.			trans	-68	152.4	176.4	-75.3	-66.8	165.3	0	0	110.9	K634 S638 Q639 L640	K634-E636 PolarHBondContact O-N 3.03Å; E636-S638 PolarHBondContact O-N 3.2Å; E636-Q639 HydrophobicContact CB-CB 4.5Å; E636-Q639 HydrophobicContact CB-CG 4.23Å; E636-Q639 VanDerWaalsContact N-OE1 3.13Å; E636-Q639 WeakPolarHBondContact O-CB 3.46Å; E636-Q639 PolarHBondContact O-N 3.12Å; E636-L640 PolarHBondContact O-N 2.7Å
637	S	84.7	Confident	68.6	Low	20 Å²	20	86 Å²	86	14%	0.14	44%	0.439	C	S	.	.	H	α-helix	trans	-63.6	-28.2	-178.3	-57.5	0	0	0	0	113.3	R641 L663 H667	S637-R641 WeakPolarHBondContact O-CB 3.5Å; S637-R641 PolarHBondContact O-N 2.95Å; S637-L663 WeakPolarHBondContact O-CD2 3.42Å; S637-H667 PolarHBondContact OG-CD2 2.97Å; S637-H667 PolarHBondContact OG-NE2 3.05Å
638	S	84.8	Confident	71	Confident	86 Å²	86	78.4 Å²	78.4	60%	0.601	40%	0.403	S	S	*	.	H	α-helix	trans	-67.4	-40.8	172	52.1	0	0	0	0	112.1	E636 R641 H642	E636-S638 PolarHBondContact O-N 3.2Å; S638-R641 PolarHBondContact O-N 3.31Å; S638-H642 PolarHBondContact O-N 2.75Å
639	Q	85.2	Confident	73.3	Confident	80 Å²	80	74.2 Å²	74.2	37%	0.374	38%	0.38	S	S	.	.	H	α-helix	trans	-68.2	-44.2	178.5	-68.7	174	-28.8	0	0	111.3	L635 E636 R641 H642 F643	L635-Q639 HydrophobicContact CD2-CB 4.28Å; E636-Q639 HydrophobicContact CB-CB 4.5Å; E636-Q639 HydrophobicContact CB-CG 4.23Å; E636-Q639 VanDerWaalsContact N-OE1 3.13Å; E636-Q639 WeakPolarHBondContact O-CB 3.46Å; E636-Q639 PolarHBondContact O-N 3.12Å; Q639-R641 VanDerWaalsContact C-N 3.31Å; Q639-R641 PolarHBondContact O-N 3.38Å; Q639-H642 WeakPolarHBondContact O-CB 3.4Å; Q639-H642 PolarHBondContact O-N 3.15Å; Q639-H642 VanDerWaalsContact O-N 3.12Å; Q639-F643 WeakPolarHBondContact O-CG 3.35Å; Q639-F643 PolarHBondContact O-N 3.32Å
640	L	87.2	Confident	75.7	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-58.7	-41.9	174.7	-76.2	171.1	0	0	0	112.3	L635 E636 H642 F643 A644 Y659 E662 L663	L635-L640 HydrophobicContact CB-CD1 4.47Å; L635-L640 HydrophobicContact CB-CD2 4.07Å; L635-L640 HydrophobicContact CB-CG 3.92Å; L635-L640 HydrophobicContact CD1-CD2 3.98Å; E636-L640 PolarHBondContact O-N 2.7Å; L640-H642 VanDerWaalsContact C-N 3.34Å; L640-F643 PolarHBondContact O-N 3.49Å; L640-A644 WeakPolarHBondContact O-CB 3.37Å; L640-A644 PolarHBondContact O-N 3.28Å; L640-Y659 HydrophobicContact CD2-CD1 3.79Å; L640-Y659 HydrophobicContact CD2-CE1 4.34Å; L640-E662 HydrophobicContact CD1-CG 4.32Å; L640-E662 WeakPolarHBondContact CD2-OE2 3.29Å; L640-L663 HydrophobicContact CB-CD1 4.25Å; L640-L663 HydrophobicContact CB-CD2 3.77Å; L640-L663 HydrophobicContact CB-CG 3.94Å; L640-L663 HydrophobicContact CD1-CD2 4.1Å; L640-L663 HydrophobicContact CD1-CG 4.45Å
641	R	89.6	Confident	78.1	Confident	84 Å²	84	69.3 Å²	69.3	32%	0.317	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-40.7	175.6	-175.8	-177.9	179.1	-157	1.3	111.5	S637 S638 Q639 A644 K645 L663 E676	S637-R641 WeakPolarHBondContact O-CB 3.5Å; S637-R641 PolarHBondContact O-N 2.95Å; S638-R641 PolarHBondContact O-N 3.31Å; Q639-R641 VanDerWaalsContact C-N 3.31Å; Q639-R641 PolarHBondContact O-N 3.38Å; R641-A644 PolarHBondContact O-N 2.92Å; R641-K645 PolarHBondContact O-N 3.05Å; R641-K645 VanDerWaalsContact O-N 3.16Å; R641-L663 HydrophobicContact CB-CD1 4.11Å; R641-E676 WeakPolarHBondContact CD-OE2 3.3Å; R641-E676 WeakPolarHBondContact CG-OE2 3.03Å; R641-E676 IonicContact CZ-OE1 3.89Å; R641-E676 IonicContact CZ-OE2 3.82Å; R641-E676 IonicContact NE-OE1 2.62Å; R641-E676 PolarHBondContact NE-OE1 3.42Å; R641-E676 IonicContact NE-OE2 3.28Å; R641-E676 PolarHBondContact NE-OE2 3.09Å; R641-E676 IonicContact NH2-OE1 2.65Å; R641-E676 PolarHBondContact NH2-OE1 3.29Å; R641-E676 IonicContact NH2-OE2 2.87Å
642	H	87.1	Confident	80.5	Confident	58 Å²	58	65.4 Å²	65.4	27%	0.269	33%	0.329	S	S	.	.	H	α-helix	trans	-62.6	-45.9	175.5	-179.2	70.4	0	0	0	111.5	S638 Q639 L640 A644 K645 E646 H1015	S638-H642 PolarHBondContact O-N 2.75Å; Q639-H642 WeakPolarHBondContact O-CB 3.4Å; Q639-H642 PolarHBondContact O-N 3.15Å; Q639-H642 VanDerWaalsContact O-N 3.12Å; L640-H642 VanDerWaalsContact C-N 3.34Å; H642-A644 VanDerWaalsContact C-N 3.33Å; H642-A644 PolarHBondContact O-N 3.19Å; H642-K645 PolarHBondContact O-N 2.95Å; H642-E646 PolarHBondContact O-N 3.42Å; H642-H1015 AromaticContact CE1-CD2 3.55Å; H642-H1015 AromaticContact CE1-CG 3.76Å; H642-H1015 AromaticContact CE1-NE2 3.78Å; H642-H1015 AromaticContact NE2-CD2 3.67Å; H642-H1015 AromaticContact NE2-CE1 3.59Å; H642-H1015 AromaticContact NE2-CG 3.98Å; H642-H1015 AromaticContact NE2-ND1 3.98Å; H642-H1015 AromaticContact NE2-NE2 3.4Å; H642-H1015 PolarHBondContact NE2-NE2 2.93Å
643	F	88.7	Confident	82.7	Confident	6 Å²	6	62.4 Å²	62.4	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-64.4	-34.9	176.5	-65.5	-9.5	0	0	0	112.8	L635 Q639 L640 K645 E646 A647 Y659 L1077	L635-F643 HydrophobicContact CD1-CE2 4.29Å; L635-F643 HydrophobicContact CD2-CD2 4.35Å; L635-F643 HydrophobicContact CD2-CE2 3.53Å; L635-F643 HydrophobicContact CD2-CZ 4.21Å; Q639-F643 WeakPolarHBondContact O-CG 3.35Å; Q639-F643 PolarHBondContact O-N 3.32Å; L640-F643 PolarHBondContact O-N 3.49Å; F643-K645 PolarHBondContact O-N 2.98Å; F643-E646 PolarHBondContact O-N 3.42Å; F643-A647 VanDerWaalsContact O-CB 3.26Å; F643-A647 WeakPolarHBondContact O-CB 3.38Å; F643-A647 PolarHBondContact O-N 3.19Å; F643-Y659 HydrophobicContact CB-CD2 3.96Å; F643-Y659 HydrophobicContact CB-CE1 4.49Å; F643-Y659 HydrophobicContact CB-CE2 3.68Å; F643-Y659 HydrophobicContact CB-CG 4.46Å; F643-L1077 HydrophobicContact CZ-CB 4.48Å; F643-L1077 HydrophobicContact CZ-CD2 4.41Å
644	A	90	Very high	84.5	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.8	-41.6	173.9	0	0	0	0	0	112.1	L640 R641 H642 Q648 Y659 Y660	L640-A644 WeakPolarHBondContact O-CB 3.37Å; L640-A644 PolarHBondContact O-N 3.28Å; R641-A644 PolarHBondContact O-N 2.92Å; H642-A644 VanDerWaalsContact C-N 3.33Å; H642-A644 PolarHBondContact O-N 3.19Å; A644-Q648 WeakPolarHBondContact O-CB 3.49Å; A644-Q648 PolarHBondContact O-N 3.13Å; A644-Y659 HydrophobicContact CB-CD2 4.43Å; A644-Y660 HydrophobicContact CB-CD1 4.26Å; A644-Y660 HydrophobicContact CB-CD2 3.99Å; A644-Y660 HydrophobicContact CB-CE1 3.9Å; A644-Y660 HydrophobicContact CB-CE2 3.62Å; A644-Y660 HydrophobicContact CB-CG 4.28Å
645	K	87.9	Confident	85.8	Confident	86 Å²	86	58.1 Å²	58.1	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-68.4	-42.1	175.5	-69.9	-177.8	178.9	-172.5	0	112.4	R641 H642 F643 A647 Q648 L649 E676	R641-K645 PolarHBondContact O-N 3.05Å; R641-K645 VanDerWaalsContact O-N 3.16Å; H642-K645 PolarHBondContact O-N 2.95Å; F643-K645 PolarHBondContact O-N 2.98Å; K645-A647 VanDerWaalsContact C-N 3.35Å; K645-Q648 WeakPolarHBondContact O-CB 3.39Å; K645-Q648 PolarHBondContact O-N 2.69Å; K645-L649 WeakPolarHBondContact O-CG 3.19Å; K645-L649 PolarHBondContact O-N 3.01Å; K645-E676 IonicContact NZ-OE1 3.33Å
646	E	88.6	Confident	86.7	Confident	15 Å²	15	56.5 Å²	56.5	7%	0.07	28%	0.284	C	S	.	.	H	α-helix	trans	-59.4	-46.1	173.8	-178.7	-175.9	91.5	0	0	111.3	H642 F643 Q648 L649 T650 H1015 L1019 S1047 L1049	H642-E646 PolarHBondContact O-N 3.42Å; F643-E646 PolarHBondContact O-N 3.42Å; E646-Q648 VanDerWaalsContact C-N 3.3Å; E646-Q648 PolarHBondContact O-N 3.46Å; E646-L649 PolarHBondContact O-N 3.19Å; E646-T650 WeakPolarHBondContact O-CG2 3.47Å; E646-T650 PolarHBondContact O-N 2.99Å; E646-T650 PolarHBondContact O-OG1 3.36Å; E646-H1015 IonicContact OE2-CD2 3.56Å; E646-H1015 IonicContact OE2-CE1 3.75Å; E646-H1015 PolarHBondContact OE2-CE1 3.46Å; E646-H1015 IonicContact OE2-NE2 2.65Å; E646-H1015 PolarHBondContact OE2-NE2 3.33Å; E646-L1019 HydrophobicContact CG-CD1 4.05Å; E646-S1047 PolarHBondContact OE1-OG 3.37Å; E646-S1047 WeakPolarHBondContact OE2-CB 3.28Å; E646-S1047 PolarHBondContact OE2-OG 2.75Å; E646-L1049 HydrophobicContact CG-CD1 4.03Å; E646-L1049 WeakPolarHBondContact OE1-CD1 3.34Å; E646-L1049 WeakPolarHBondContact OE1-CG 3.31Å
647	A	88.6	Confident	87.2	Confident	4 Å²	4	51.3 Å²	51.3	3%	0.033	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-36.4	176.9	0	0	0	0	0	112.1	F643 K645 T650 S651 N652 Q655 A656 Y659	F643-A647 VanDerWaalsContact O-CB 3.26Å; F643-A647 WeakPolarHBondContact O-CB 3.38Å; F643-A647 PolarHBondContact O-N 3.19Å; K645-A647 VanDerWaalsContact C-N 3.35Å; A647-T650 WeakPolarHBondContact CA-OG1 3.13Å; A647-T650 PolarHBondContact O-OG1 3.45Å; A647-S651 PolarHBondContact O-N 3.26Å; A647-N652 HydrophobicContact CB-CB 4.43Å; A647-N652 CarbonylContact O-C 3.35Å; A647-N652 WeakPolarHBondContact O-CA 3.24Å; A647-N652 PolarHBondContact O-N 3.48Å; A647-Q655 HydrophobicContact CB-CB 4.46Å; A647-A656 HydrophobicContact CB-CB 3.76Å; A647-Y659 HydrophobicContact CB-CE2 4.45Å
648	Q	88.6	Confident	87.5	Confident	39 Å²	39	56 Å²	56	18%	0.182	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-44	173.7	-177.5	-178.3	-29.6	0	0	112	A644 K645 E646 T650 S651 L680 L683	A644-Q648 WeakPolarHBondContact O-CB 3.49Å; A644-Q648 PolarHBondContact O-N 3.13Å; K645-Q648 WeakPolarHBondContact O-CB 3.39Å; K645-Q648 PolarHBondContact O-N 2.69Å; E646-Q648 VanDerWaalsContact C-N 3.3Å; E646-Q648 PolarHBondContact O-N 3.46Å; Q648-T650 VanDerWaalsContact C-N 3.33Å; Q648-T650 PolarHBondContact O-N 2.88Å; Q648-S651 PolarHBondContact O-N 3.41Å; Q648-L680 HydrophobicContact CB-CD1 4.31Å; Q648-L680 HydrophobicContact CG-CD1 3.97Å; Q648-L683 HydrophobicContact CG-CD2 3.49Å; Q648-L683 VanDerWaalsContact CG-CD2 3.49Å
649	L	82.6	Confident	87.7	Confident	74 Å²	74	53.3 Å²	53.3	39%	0.387	26%	0.259	S	S	.	.	H	α-helix	trans	-74.3	-22.1	-178.5	-68.1	172.7	0	0	0	113.9	K645 E646 S651 I1016 R1020	K645-L649 WeakPolarHBondContact O-CG 3.19Å; K645-L649 PolarHBondContact O-N 3.01Å; E646-L649 PolarHBondContact O-N 3.19Å; L649-S651 VanDerWaalsContact C-N 3.33Å; L649-I1016 HydrophobicContact CB-CD1 3.8Å; L649-I1016 HydrophobicContact CB-CG1 4.15Å; L649-I1016 HydrophobicContact CD1-CB 3.96Å; L649-I1016 HydrophobicContact CD1-CD1 4.3Å; L649-I1016 HydrophobicContact CD1-CG1 4.08Å; L649-I1016 HydrophobicContact CD1-CG2 4.27Å; L649-R1020 PolarHBondContact O-NH2 3.18Å
650	T	81.7	Confident	88.1	Confident	47 Å²	47	49.7 Å²	49.7	29%	0.288	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	6.3	174.3	52	0	0	0	0	113	E646 A647 Q648 N652 L1049	E646-T650 WeakPolarHBondContact O-CG2 3.47Å; E646-T650 PolarHBondContact O-N 2.99Å; E646-T650 PolarHBondContact O-OG1 3.36Å; A647-T650 WeakPolarHBondContact CA-OG1 3.13Å; A647-T650 PolarHBondContact O-OG1 3.45Å; Q648-T650 VanDerWaalsContact C-N 3.33Å; Q648-T650 PolarHBondContact O-N 2.88Å; T650-N652 PolarHBondContact O-N 3.22Å; T650-L1049 HydrophobicContact CG2-CD1 3.95Å
651	S	85	Confident	88.3	Confident	72 Å²	72	54.8 Å²	54.8	50%	0.503	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	13.9	-177.7	-53.2	0	0	0	0	115.2	A647 Q648 L649 Y653	A647-S651 PolarHBondContact O-N 3.26Å; Q648-S651 PolarHBondContact O-N 3.41Å; L649-S651 VanDerWaalsContact C-N 3.33Å; S651-Y653 VanDerWaalsContact C-N 3.26Å; S651-Y653 WeakPolarHBondContact O-CD2 3.13Å; S651-Y653 PolarHBondContact O-N 2.97Å
652	N	85.8	Confident	88.3	Confident	83 Å²	83	54.1 Å²	54.1	44%	0.444	27%	0.266	S	S	.	.			trans	-85.6	61.9	175.9	-73.2	-24.5	0	0	0	111.3	A647 T650 Q654 Q655 A656	A647-N652 HydrophobicContact CB-CB 4.43Å; A647-N652 CarbonylContact O-C 3.35Å; A647-N652 WeakPolarHBondContact O-CA 3.24Å; A647-N652 PolarHBondContact O-N 3.48Å; T650-N652 PolarHBondContact O-N 3.22Å; N652-Q654 VanDerWaalsContact C-N 3.26Å; N652-Q654 PolarHBondContact O-N 3.45Å; N652-Q655 HydrophobicContact CB-CB 4.49Å; N652-Q655 PolarHBondContact O-N 2.8Å; N652-A656 PolarHBondContact O-N 2.89Å; N652-A656 VanDerWaalsContact O-N 3.13Å
653	Y	89.6	Confident	88.4	Confident	83 Å²	83	51.3 Å²	51.3	33%	0.325	25%	0.254	S	S	.	.	H	α-helix	trans	-61.1	-29.9	-171.8	-55.2	-54.9	0	0	0	114.6	S651 A657 L680 L683 I684	S651-Y653 VanDerWaalsContact C-N 3.26Å; S651-Y653 WeakPolarHBondContact O-CD2 3.13Å; S651-Y653 PolarHBondContact O-N 2.97Å; Y653-A657 WeakPolarHBondContact O-CB 3.49Å; Y653-A657 PolarHBondContact O-N 3.12Å; Y653-L680 HydrophobicContact CD1-CD1 3.98Å; Y653-L683 HydrophobicContact CE1-CD2 3.76Å; Y653-L683 HydrophobicContact CE1-CG 4.42Å; Y653-I684 HydrophobicContact CD1-CG1 4.22Å; Y653-I684 HydrophobicContact CD2-CG1 4.43Å; Y653-I684 HydrophobicContact CG-CD1 4.34Å; Y653-I684 HydrophobicContact CG-CG1 4.02Å
654	Q	87.6	Confident	88.5	Confident	168 Å²	168	52 Å²	52	79%	0.785	26%	0.258	S	S	*	.	H	α-helix	trans	-66.1	-44.4	178.1	-68.4	-176.1	-16.3	0	0	111.7	N652 A657 Q658	N652-Q654 VanDerWaalsContact C-N 3.26Å; N652-Q654 PolarHBondContact O-N 3.45Å; Q654-A657 PolarHBondContact O-N 3.45Å; Q654-Q658 WeakPolarHBondContact O-CG 3.35Å; Q654-Q658 PolarHBondContact O-N 2.98Å; Q654-Q658 VanDerWaalsContact O-N 3.15Å
655	Q	86.6	Confident	88.4	Confident	56 Å²	56	57.2 Å²	57.2	26%	0.262	29%	0.29	S	S	.	.	H	α-helix	trans	-69.3	-39.4	178	-163.5	-178.9	6.6	0	0	111	A647 N652 A657 Q658 Y659 N1078	A647-Q655 HydrophobicContact CB-CB 4.46Å; N652-Q655 HydrophobicContact CB-CB 4.49Å; N652-Q655 PolarHBondContact O-N 2.8Å; Q655-A657 VanDerWaalsContact C-N 3.3Å; Q655-A657 PolarHBondContact O-N 3.42Å; Q655-Q658 WeakPolarHBondContact O-CB 3.25Å; Q655-Q658 PolarHBondContact O-N 2.94Å; Q655-Q658 VanDerWaalsContact O-N 3.15Å; Q655-Y659 HydrophobicContact CG-CD2 4.3Å; Q655-Y659 HydrophobicContact CG-CE2 3.63Å; Q655-Y659 PolarHBondContact NE2-OH 3Å; Q655-Y659 VanDerWaalsContact O-CD2 3.27Å; Q655-Y659 WeakPolarHBondContact O-CD2 3.35Å; Q655-Y659 PolarHBondContact O-N 3.35Å; Q655-Y659 VanDerWaalsContact O-N 3.07Å; Q655-N1078 PolarHBondContact NE2-ND2 3.01Å; Q655-N1078 VanDerWaalsContact NE2-ND2 3.13Å
656	A	90.9	Very high	88.2	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.1	-43.6	173.3	0	0	0	0	0	111.9	A647 N652 Q658 Y659 Y660 L680	A647-A656 HydrophobicContact CB-CB 3.76Å; N652-A656 PolarHBondContact O-N 2.89Å; N652-A656 VanDerWaalsContact O-N 3.13Å; A656-Q658 PolarHBondContact O-N 3.32Å; A656-Y659 PolarHBondContact O-N 3.07Å; A656-Y660 WeakPolarHBondContact O-CD2 3.45Å; A656-Y660 PolarHBondContact O-N 2.89Å; A656-Y660 VanDerWaalsContact O-N 3.1Å; A656-L680 HydrophobicContact CB-CD1 4.21Å; A656-L680 HydrophobicContact CB-CD2 3.8Å
657	A	91.1	Very high	88.1	Confident	16 Å²	16	60 Å²	60	13%	0.132	30%	0.3	C	S	.	.	H	α-helix	trans	-64.7	-37	177.1	0	0	0	0	0	112.7	Y653 Q654 Q655 Y660 Q661 L680	Y653-A657 WeakPolarHBondContact O-CB 3.49Å; Y653-A657 PolarHBondContact O-N 3.12Å; Q654-A657 PolarHBondContact O-N 3.45Å; Q655-A657 VanDerWaalsContact C-N 3.3Å; Q655-A657 PolarHBondContact O-N 3.42Å; A657-Y660 PolarHBondContact O-N 3.34Å; A657-Q661 VanDerWaalsContact O-CB 3.27Å; A657-Q661 WeakPolarHBondContact O-CB 3.39Å; A657-Q661 PolarHBondContact O-N 3.46Å; A657-L680 HydrophobicContact CB-CD2 4.19Å
658	Q	89.6	Confident	87.9	Confident	120 Å²	120	61.3 Å²	61.3	56%	0.561	31%	0.308	S	S	*	.	H	α-helix	trans	-63.3	-44.1	175.2	-70.9	173.1	-4.2	0	0	111.8	Q654 Q655 A656 Q661 E662	Q654-Q658 WeakPolarHBondContact O-CG 3.35Å; Q654-Q658 PolarHBondContact O-N 2.98Å; Q654-Q658 VanDerWaalsContact O-N 3.15Å; Q655-Q658 WeakPolarHBondContact O-CB 3.25Å; Q655-Q658 PolarHBondContact O-N 2.94Å; Q655-Q658 VanDerWaalsContact O-N 3.15Å; A656-Q658 PolarHBondContact O-N 3.32Å; Q658-Q661 WeakPolarHBondContact O-CB 3.33Å; Q658-Q661 PolarHBondContact O-N 2.86Å; Q658-E662 PolarHBondContact O-N 3.16Å
659	Y	90.7	Very high	87.7	Confident	28 Å²	28	65 Å²	65	11%	0.11	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-43.1	176.8	-65.8	-46.1	0	0	0	112.5	L640 F643 A644 A647 Q655 A656 E662 L663	L640-Y659 HydrophobicContact CD2-CD1 3.79Å; L640-Y659 HydrophobicContact CD2-CE1 4.34Å; F643-Y659 HydrophobicContact CB-CD2 3.96Å; F643-Y659 HydrophobicContact CB-CE1 4.49Å; F643-Y659 HydrophobicContact CB-CE2 3.68Å; F643-Y659 HydrophobicContact CB-CG 4.46Å; A644-Y659 HydrophobicContact CB-CD2 4.43Å; A647-Y659 HydrophobicContact CB-CE2 4.45Å; Q655-Y659 HydrophobicContact CG-CD2 4.3Å; Q655-Y659 HydrophobicContact CG-CE2 3.63Å; Q655-Y659 PolarHBondContact NE2-OH 3Å; Q655-Y659 VanDerWaalsContact O-CD2 3.27Å; Q655-Y659 WeakPolarHBondContact O-CD2 3.35Å; Q655-Y659 PolarHBondContact O-N 3.35Å; Q655-Y659 VanDerWaalsContact O-N 3.07Å; A656-Y659 PolarHBondContact O-N 3.07Å; Y659-E662 PolarHBondContact O-N 2.92Å; Y659-L663 WeakPolarHBondContact O-CG 3.4Å; Y659-L663 PolarHBondContact O-N 2.98Å
660	Y	92.4	Very high	88.1	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-66.1	-38.5	174.6	-74.9	-58.3	0	0	0	112.6	A644 A656 A657 E662 L663 V664 E676 W677 L680	A644-Y660 HydrophobicContact CB-CD1 4.26Å; A644-Y660 HydrophobicContact CB-CD2 3.99Å; A644-Y660 HydrophobicContact CB-CE1 3.9Å; A644-Y660 HydrophobicContact CB-CE2 3.62Å; A644-Y660 HydrophobicContact CB-CG 4.28Å; A656-Y660 WeakPolarHBondContact O-CD2 3.45Å; A656-Y660 PolarHBondContact O-N 2.89Å; A656-Y660 VanDerWaalsContact O-N 3.1Å; A657-Y660 PolarHBondContact O-N 3.34Å; Y660-E662 VanDerWaalsContact C-N 3.31Å; Y660-E662 PolarHBondContact O-N 3.38Å; Y660-L663 HydrophobicContact CD1-CD1 4.09Å; Y660-L663 PolarHBondContact O-N 3.12Å; Y660-V664 VanDerWaalsContact O-CG2 3.3Å; Y660-V664 WeakPolarHBondContact O-CG2 3.49Å; Y660-V664 PolarHBondContact O-N 2.52Å; Y660-E676 HydrophobicContact CD1-CB 4.38Å; Y660-E676 HydrophobicContact CE1-CB 3.63Å; Y660-W677 HydrophobicContact CD1-CB 4.45Å; Y660-W677 HydrophobicContact CD2-CB 4.42Å; Y660-W677 HydrophobicContact CD2-CG 4.42Å; Y660-W677 HydrophobicContact CG-CB 4.02Å; Y660-W677 HydrophobicContact CG-CG 4.16Å; Y660-L680 HydrophobicContact CD2-CD2 3.88Å; Y660-L680 HydrophobicContact CE2-CB 4.22Å; Y660-L680 HydrophobicContact CE2-CD2 4.11Å
661	Q	91.4	Very high	88.5	Confident	108 Å²	108	63.2 Å²	63.2	51%	0.505	32%	0.316	S	S	.	.	H	α-helix	trans	-59.4	-44.8	174.4	180	178.7	-8.1	0	0	110.9	A657 Q658 V664 V665 W677	A657-Q661 VanDerWaalsContact O-CB 3.27Å; A657-Q661 WeakPolarHBondContact O-CB 3.39Å; A657-Q661 PolarHBondContact O-N 3.46Å; Q658-Q661 WeakPolarHBondContact O-CB 3.33Å; Q658-Q661 PolarHBondContact O-N 2.86Å; Q661-V664 PolarHBondContact O-N 3.49Å; Q661-V665 VanDerWaalsContact O-CG2 3.29Å; Q661-V665 WeakPolarHBondContact O-CG2 3.45Å; Q661-V665 PolarHBondContact O-N 2.97Å; Q661-W677 HydrophobicContact CB-CH2 4.14Å; Q661-W677 HydrophobicContact CB-CZ2 4.29Å; Q661-W677 HydrophobicContact CG-CH2 4.44Å
662	E	89.4	Confident	88.9	Confident	69 Å²	69	62.2 Å²	62.2	32%	0.322	31%	0.305	S	S	.	.	H	α-helix	trans	-62.7	-44.4	176.7	-169.8	-178.4	174.3	0	0	112.1	L640 Q658 Y659 Y660 V664 V665 R666	L640-E662 HydrophobicContact CD1-CG 4.32Å; L640-E662 WeakPolarHBondContact CD2-OE2 3.29Å; Q658-E662 PolarHBondContact O-N 3.16Å; Y659-E662 PolarHBondContact O-N 2.92Å; Y660-E662 VanDerWaalsContact C-N 3.31Å; Y660-E662 PolarHBondContact O-N 3.38Å; E662-V664 VanDerWaalsContact C-N 3.31Å; E662-V664 PolarHBondContact O-N 3.28Å; E662-V665 PolarHBondContact O-N 3.48Å; E662-R666 HydrophobicContact CG-CG 4.47Å; E662-R666 WeakPolarHBondContact O-CB 3.45Å; E662-R666 VanDerWaalsContact O-CG 3.32Å; E662-R666 WeakPolarHBondContact O-CG 3.48Å; E662-R666 PolarHBondContact O-N 3.07Å; E662-R666 IonicContact OE1-CZ 2.81Å; E662-R666 IonicContact OE1-NE 2.8Å; E662-R666 PolarHBondContact OE1-NE 3.14Å; E662-R666 IonicContact OE1-NH2 3.34Å; E662-R666 PolarHBondContact OE1-NH2 2.88Å
663	L	89.8	Confident	89.3	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.4	-43.8	175.5	-76.5	170.1	0	0	0	112.3	S637 L640 R641 Y659 Y660 R666 H667 Y673	S637-L663 WeakPolarHBondContact O-CD2 3.42Å; L640-L663 HydrophobicContact CB-CD1 4.25Å; L640-L663 HydrophobicContact CB-CD2 3.77Å; L640-L663 HydrophobicContact CB-CG 3.94Å; L640-L663 HydrophobicContact CD1-CD2 4.1Å; L640-L663 HydrophobicContact CD1-CG 4.45Å; R641-L663 HydrophobicContact CB-CD1 4.11Å; Y659-L663 WeakPolarHBondContact O-CG 3.4Å; Y659-L663 PolarHBondContact O-N 2.98Å; Y660-L663 HydrophobicContact CD1-CD1 4.09Å; Y660-L663 PolarHBondContact O-N 3.12Å; L663-R666 PolarHBondContact O-N 2.85Å; L663-H667 PolarHBondContact O-N 3.34Å; L663-Y673 HydrophobicContact CB-CD1 4.18Å; L663-Y673 HydrophobicContact CB-CD2 4.37Å; L663-Y673 HydrophobicContact CB-CG 4.01Å; L663-Y673 HydrophobicContact CD1-CD1 4.02Å; L663-Y673 HydrophobicContact CD1-CE1 4.35Å; L663-Y673 HydrophobicContact CD2-CD1 4.43Å; L663-Y673 HydrophobicContact CD2-CE1 4.17Å; L663-Y673 HydrophobicContact CG-CD1 4.46Å
664	V	89.9	Confident	89.4	Confident	19 Å²	19	56.8 Å²	56.8	12%	0.115	28%	0.278	C	S	.	.	H	α-helix	trans	-68.4	-35.2	178.5	169.4	0	0	0	0	112.1	Y660 Q661 E662 H667 P668 K674 W677	Y660-V664 VanDerWaalsContact O-CG2 3.3Å; Y660-V664 WeakPolarHBondContact O-CG2 3.49Å; Y660-V664 PolarHBondContact O-N 2.52Å; Q661-V664 PolarHBondContact O-N 3.49Å; E662-V664 VanDerWaalsContact C-N 3.31Å; E662-V664 PolarHBondContact O-N 3.28Å; V664-H667 CarbonylContact O-C 3.52Å; V664-P668 WeakPolarHBondContact O-CA 3.24Å; V664-K674 HydrophobicContact CG1-CD 4.48Å; V664-K674 HydrophobicContact CG1-CG 4.26Å; V664-K674 HydrophobicContact CG2-CG 3.75Å; V664-W677 HydrophobicContact CG2-CE3 4.14Å
665	V	88.1	Confident	89.8	Confident	110 Å²	110	49.7 Å²	49.7	67%	0.667	25%	0.245	S	C	*	.	H	α-helix	trans	-69.1	-40.8	175.8	170.4	0	0	0	0	110.9	Q661 E662	Q661-V665 VanDerWaalsContact O-CG2 3.29Å; Q661-V665 WeakPolarHBondContact O-CG2 3.45Å; Q661-V665 PolarHBondContact O-N 2.97Å; E662-V665 PolarHBondContact O-N 3.48Å
666	R	85.4	Confident	90.1	Very high	83 Å²	83	48 Å²	48	31%	0.313	24%	0.237	S	C	.	.	H	α-helix	trans	-68.4	-42	177.7	-70.8	174.7	176	-144.4	13	112.1	L635 E662 L663 P668	L635-R666 PolarHBondContact O-NH1 3.37Å; E662-R666 HydrophobicContact CG-CG 4.47Å; E662-R666 WeakPolarHBondContact O-CB 3.45Å; E662-R666 VanDerWaalsContact O-CG 3.32Å; E662-R666 WeakPolarHBondContact O-CG 3.48Å; E662-R666 PolarHBondContact O-N 3.07Å; E662-R666 IonicContact OE1-CZ 2.81Å; E662-R666 IonicContact OE1-NE 2.8Å; E662-R666 PolarHBondContact OE1-NE 3.14Å; E662-R666 IonicContact OE1-NH2 3.34Å; E662-R666 PolarHBondContact OE1-NH2 2.88Å; L663-R666 PolarHBondContact O-N 2.85Å; R666-P668 WeakPolarHBondContact O-CD 3.41Å
667	H	84.9	Confident	90.2	Very high	77 Å²	77	50.1 Å²	50.1	36%	0.356	25%	0.245	S	C	.	.			trans	-124.5	75	-176.8	-60	-65.9	0	0	0	111.5	S637 L663 V664 D669 E670 Y673	S637-H667 PolarHBondContact OG-CD2 2.97Å; S637-H667 PolarHBondContact OG-NE2 3.05Å; L663-H667 PolarHBondContact O-N 3.34Å; V664-H667 CarbonylContact O-C 3.52Å; H667-D669 PolarHBondContact O-N 3.27Å; H667-E670 HydrophobicContact CB-CB 4.01Å; H667-E670 PolarHBondContact O-N 2.91Å; H667-Y673 HydrophobicContact CB-CD2 3.97Å; H667-Y673 HydrophobicContact CB-CE2 3.67Å; H667-Y673 AromaticContact CD2-CE2 3.69Å; H667-Y673 AromaticContact CG-CE2 3.94Å
668	P	83.9	Confident	90.4	Very high	31 Å²	31	49.4 Å²	49.4	20%	0.201	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-18.4	-174.8	29	-37	0	0	0	114.1	V664 R666 I700	V664-P668 WeakPolarHBondContact O-CA 3.24Å; R666-P668 WeakPolarHBondContact O-CD 3.41Å; P668-I700 WeakPolarHBondContact O-CD1 3.44Å
669	D	85.8	Confident	90.5	Very high	117 Å²	117	44 Å²	44	63%	0.626	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-3.9	-177.7	-62.7	-33.7	0	0	0	112.8	H667 I700	H667-D669 PolarHBondContact O-N 3.27Å; D669-I700 WeakPolarHBondContact O-CG2 3.46Å
670	E	89.6	Confident	90.7	Very high	81 Å²	81	42.7 Å²	42.7	38%	0.379	21%	0.209	S	C	.	.			trans	-95.6	113.4	-179.5	-175.6	57	-133.3	0	0	110.5	H667 L672 Y673	H667-E670 HydrophobicContact CB-CB 4.01Å; H667-E670 PolarHBondContact O-N 2.91Å; E670-L672 VanDerWaalsContact C-N 3.33Å; E670-L672 HydrophobicContact CG-CB 4.13Å; E670-L672 PolarHBondContact O-N 3.47Å; E670-L672 WeakPolarHBondContact OE1-CB 3.47Å; E670-Y673 HydrophobicContact CB-CD2 3.82Å; E670-Y673 HydrophobicContact CB-CE2 3.86Å; E670-Y673 HydrophobicContact CG-CD2 3.68Å; E670-Y673 HydrophobicContact CG-CE2 3.56Å
671	P	91.6	Very high	90.7	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.013	22%	0.215	C	C	.	.	H	α-helix	trans	-74.6	-22.6	-177.5	30.6	-36.1	0	0	0	113.2	Y673 K674 F675 A697 Q701 H704	P671-Y673 VanDerWaalsContact C-N 3.34Å; P671-Y673 PolarHBondContact O-N 3.44Å; P671-K674 PolarHBondContact O-N 3.01Å; P671-F675 PolarHBondContact O-N 3.28Å; P671-A697 HydrophobicContact CB-CB 4.06Å; P671-Q701 HydrophobicContact CB-CB 4.35Å; P671-Q701 HydrophobicContact CG-CB 3.97Å; P671-Q701 VanDerWaalsContact CG-OE1 3.29Å; P671-H704 HydrophobicContact CB-CB 4.3Å; P671-H704 HydrophobicContact CG-CB 4.23Å
672	L	93.1	Very high	90.8	Very high	51 Å²	51	39.1 Å²	39.1	27%	0.267	19%	0.192	S	C	.	.	H	α-helix	trans	-57.1	-44.3	-176.9	-179.9	64.6	0	0	0	112.3	E670 K674 F675 E676	E670-L672 VanDerWaalsContact C-N 3.33Å; E670-L672 HydrophobicContact CG-CB 4.13Å; E670-L672 PolarHBondContact O-N 3.47Å; E670-L672 WeakPolarHBondContact OE1-CB 3.47Å; L672-K674 VanDerWaalsContact C-N 3.33Å; L672-K674 PolarHBondContact O-N 3.22Å; L672-F675 HydrophobicContact CD1-CD1 4.44Å; L672-F675 WeakPolarHBondContact O-CB 3.26Å; L672-F675 PolarHBondContact O-N 3.16Å; L672-E676 HydrophobicContact CD1-CG 4.47Å; L672-E676 PolarHBondContact O-N 2.97Å
673	Y	93.1	Very high	90.8	Very high	34 Å²	34	38.2 Å²	38.2	13%	0.133	19%	0.189	C	C	.	.	H	α-helix	trans	-66.8	-34.5	-178.2	-56.7	-52.2	0	0	0	112.6	L663 H667 E670 P671 W677	L663-Y673 HydrophobicContact CB-CD1 4.18Å; L663-Y673 HydrophobicContact CB-CD2 4.37Å; L663-Y673 HydrophobicContact CB-CG 4.01Å; L663-Y673 HydrophobicContact CD1-CD1 4.02Å; L663-Y673 HydrophobicContact CD1-CE1 4.35Å; L663-Y673 HydrophobicContact CD2-CD1 4.43Å; L663-Y673 HydrophobicContact CD2-CE1 4.17Å; L663-Y673 HydrophobicContact CG-CD1 4.46Å; H667-Y673 HydrophobicContact CB-CD2 3.97Å; H667-Y673 HydrophobicContact CB-CE2 3.67Å; H667-Y673 AromaticContact CD2-CE2 3.69Å; H667-Y673 AromaticContact CG-CE2 3.94Å; E670-Y673 HydrophobicContact CB-CD2 3.82Å; E670-Y673 HydrophobicContact CB-CE2 3.86Å; E670-Y673 HydrophobicContact CG-CD2 3.68Å; E670-Y673 HydrophobicContact CG-CE2 3.56Å; P671-Y673 VanDerWaalsContact C-N 3.34Å; P671-Y673 PolarHBondContact O-N 3.44Å; Y673-W677 WeakPolarHBondContact O-CB 3.12Å; Y673-W677 PolarHBondContact O-N 3.08Å
674	K	93.3	Very high	90.8	Very high	19 Å²	19	41.8 Å²	41.8	8%	0.083	21%	0.207	C	C	.	.	H	α-helix	trans	-71.4	-35.7	173.4	-66.9	-163.8	-174	-176.8	0	112.2	V664 P671 L672 G678 C693 D696 A697 I700	V664-K674 HydrophobicContact CG1-CD 4.48Å; V664-K674 HydrophobicContact CG1-CG 4.26Å; V664-K674 HydrophobicContact CG2-CG 3.75Å; P671-K674 PolarHBondContact O-N 3.01Å; L672-K674 VanDerWaalsContact C-N 3.33Å; L672-K674 PolarHBondContact O-N 3.22Å; K674-G678 PolarHBondContact O-N 3.45Å; K674-C693 WeakPolarHBondContact O-CB 3.45Å; K674-D696 HydrophobicContact CD-CB 3.77Å; K674-D696 VanDerWaalsContact CD-CG 3.46Å; K674-D696 IonicContact NZ-OD1 3.04Å; K674-D696 PolarHBondContact NZ-OD1 3.17Å; K674-D696 IonicContact NZ-OD2 3.14Å; K674-D696 PolarHBondContact NZ-OD2 3.41Å; K674-A697 HydrophobicContact CB-CB 3.99Å; K674-I700 HydrophobicContact CD-CD1 3.75Å
675	F	95.1	Very high	90.7	Very high	18 Å²	18	42.4 Å²	42.4	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-51.5	172.7	169.6	-98.1	0	0	0	111.3	P671 L672 W677 G678 S679 Y694 P706 M710 F917 N921	P671-F675 PolarHBondContact O-N 3.28Å; L672-F675 HydrophobicContact CD1-CD1 4.44Å; L672-F675 WeakPolarHBondContact O-CB 3.26Å; L672-F675 PolarHBondContact O-N 3.16Å; F675-W677 VanDerWaalsContact C-N 3.3Å; F675-W677 PolarHBondContact O-N 3.25Å; F675-G678 WeakPolarHBondContact O-CA 3.09Å; F675-G678 PolarHBondContact O-N 3.08Å; F675-G678 VanDerWaalsContact O-N 3.08Å; F675-S679 PolarHBondContact O-N 3.18Å; F675-S679 PolarHBondContact O-OG 2.98Å; F675-Y694 AromaticContact CD2-CD1 3.91Å; F675-Y694 HydrophobicContact CD2-CD1 3.91Å; F675-Y694 AromaticContact CD2-CE1 3.68Å; F675-Y694 HydrophobicContact CD2-CE1 3.68Å; F675-Y694 HydrophobicContact CE2-CE1 4.07Å; F675-Y694 HydrophobicContact CG-CE1 4.44Å; F675-Y694 WeakPolarHBondContact O-CE1 3.26Å; F675-P706 HydrophobicContact CD2-CB 4.03Å; F675-P706 HydrophobicContact CE1-CB 4.15Å; F675-P706 HydrophobicContact CE2-CB 3.55Å; F675-P706 WeakPolarHBondContact CE2-O 3.34Å; F675-P706 HydrophobicContact CG-CB 4.49Å; F675-P706 HydrophobicContact CZ-CB 3.62Å; F675-M710 HydrophobicContact CE2-CB 4.34Å; F675-M710 HydrophobicContact CE2-CG 3.62Å; F675-M710 HydrophobicContact CZ-CG 4.38Å; F675-F917 HydrophobicContact CZ-CE2 4.24Å; F675-F917 HydrophobicContact CZ-CZ 4.31Å; F675-N921 WeakPolarHBondContact CZ-OD1 3.36Å
676	E	93	Very high	90.9	Very high	20 Å²	20	39.2 Å²	39.2	9%	0.093	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-37.8	178.2	-67.2	-168.3	137.8	0	0	112.5	R641 K645 Y660 L672 G678 S679 L680	R641-E676 WeakPolarHBondContact CD-OE2 3.3Å; R641-E676 WeakPolarHBondContact CG-OE2 3.03Å; R641-E676 IonicContact CZ-OE1 3.89Å; R641-E676 IonicContact CZ-OE2 3.82Å; R641-E676 IonicContact NE-OE1 2.62Å; R641-E676 PolarHBondContact NE-OE1 3.42Å; R641-E676 IonicContact NE-OE2 3.28Å; R641-E676 PolarHBondContact NE-OE2 3.09Å; R641-E676 IonicContact NH2-OE1 2.65Å; R641-E676 PolarHBondContact NH2-OE1 3.29Å; R641-E676 IonicContact NH2-OE2 2.87Å; K645-E676 IonicContact NZ-OE1 3.33Å; Y660-E676 HydrophobicContact CD1-CB 4.38Å; Y660-E676 HydrophobicContact CE1-CB 3.63Å; L672-E676 HydrophobicContact CD1-CG 4.47Å; L672-E676 PolarHBondContact O-N 2.97Å; E676-G678 VanDerWaalsContact C-N 3.33Å; E676-G678 PolarHBondContact O-N 3.27Å; E676-S679 WeakPolarHBondContact O-CB 3.28Å; E676-S679 PolarHBondContact O-N 3.16Å; E676-S679 VanDerWaalsContact O-N 3.15Å; E676-L680 PolarHBondContact O-N 2.99Å
677	W	94	Very high	91.2	Very high	46 Å²	46	39.5 Å²	39.5	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-37.5	173.9	-164.8	14.2	0	0	0	112.5	Y660 Q661 V664 Y673 F675 S679 L680 Y681	Y660-W677 HydrophobicContact CD1-CB 4.45Å; Y660-W677 HydrophobicContact CD2-CB 4.42Å; Y660-W677 HydrophobicContact CD2-CG 4.42Å; Y660-W677 HydrophobicContact CG-CB 4.02Å; Y660-W677 HydrophobicContact CG-CG 4.16Å; Q661-W677 HydrophobicContact CB-CH2 4.14Å; Q661-W677 HydrophobicContact CB-CZ2 4.29Å; Q661-W677 HydrophobicContact CG-CH2 4.44Å; V664-W677 HydrophobicContact CG2-CE3 4.14Å; Y673-W677 WeakPolarHBondContact O-CB 3.12Å; Y673-W677 PolarHBondContact O-N 3.08Å; F675-W677 VanDerWaalsContact C-N 3.3Å; F675-W677 PolarHBondContact O-N 3.25Å; W677-S679 VanDerWaalsContact C-N 3.31Å; W677-S679 PolarHBondContact O-N 3.46Å; W677-L680 WeakPolarHBondContact O-CB 3.39Å; W677-L680 PolarHBondContact O-N 3.25Å; W677-Y681 AromaticContact CD1-CE2 3.74Å; W677-Y681 HydrophobicContact CD2-CE2 4.29Å; W677-Y681 AromaticContact CE2-CE2 3.73Å; W677-Y681 HydrophobicContact CG-CE2 4.31Å; W677-Y681 HydrophobicContact CZ2-CE2 4.26Å; W677-Y681 AromaticContact NE1-CE2 3.34Å; W677-Y681 VanDerWaalsContact NE1-CE2 3.34Å; W677-Y681 AromaticContact NE1-CZ 3.7Å; W677-Y681 WeakPolarHBondContact O-CD2 3.49Å; W677-Y681 PolarHBondContact O-N 3.45Å; W677-Y681 VanDerWaalsContact O-N 3.17Å
678	G	94.4	Very high	91.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.9	-40.9	170.4	0	0	0	0	0	112.2	K674 F675 E676 L680 Y681 M682 A690 Y694	K674-G678 PolarHBondContact O-N 3.45Å; F675-G678 WeakPolarHBondContact O-CA 3.09Å; F675-G678 PolarHBondContact O-N 3.08Å; F675-G678 VanDerWaalsContact O-N 3.08Å; E676-G678 VanDerWaalsContact C-N 3.33Å; E676-G678 PolarHBondContact O-N 3.27Å; G678-L680 VanDerWaalsContact C-N 3.33Å; G678-L680 PolarHBondContact O-N 3.31Å; G678-Y681 PolarHBondContact O-N 2.92Å; G678-Y681 VanDerWaalsContact O-N 3.09Å; G678-M682 WeakPolarHBondContact O-CG 3.48Å; G678-M682 PolarHBondContact O-N 3.34Å; G678-A690 WeakPolarHBondContact O-CB 3.28Å; G678-Y694 VanDerWaalsContact C-OH 3.25Å; G678-Y694 PolarHBondContact O-OH 2.93Å
679	S	92.8	Very high	92	Very high	8 Å²	8	43.7 Å²	43.7	6%	0.056	22%	0.215	C	C	.	.	H	α-helix	trans	-68.4	-29.1	177.9	-56.3	0	0	0	0	113.2	F675 E676 W677 M682 L683 Y694 N921 N922	F675-S679 PolarHBondContact O-N 3.18Å; F675-S679 PolarHBondContact O-OG 2.98Å; E676-S679 WeakPolarHBondContact O-CB 3.28Å; E676-S679 PolarHBondContact O-N 3.16Å; E676-S679 VanDerWaalsContact O-N 3.15Å; W677-S679 VanDerWaalsContact C-N 3.31Å; W677-S679 PolarHBondContact O-N 3.46Å; S679-M682 PolarHBondContact O-N 3.48Å; S679-L683 PolarHBondContact O-N 3.06Å; S679-L683 VanDerWaalsContact O-N 3.14Å; S679-Y694 WeakPolarHBondContact CA-OH 3.26Å; S679-Y694 PolarHBondContact N-OH 3.42Å; S679-Y694 VanDerWaalsContact N-OH 3.16Å; S679-Y694 PolarHBondContact OG-OH 2.95Å; S679-Y694 VanDerWaalsContact OG-OH 3.1Å; S679-N921 PolarHBondContact OG-OD1 3.2Å; S679-N922 PolarHBondContact O-ND2 3.05Å
680	L	93.3	Very high	92.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.7	-45.1	166.8	174.8	66.7	0	0	0	111.1	Q648 Y653 A656 A657 Y660 E676 W677 G678 M682 L683 I684	Q648-L680 HydrophobicContact CB-CD1 4.31Å; Q648-L680 HydrophobicContact CG-CD1 3.97Å; Y653-L680 HydrophobicContact CD1-CD1 3.98Å; A656-L680 HydrophobicContact CB-CD1 4.21Å; A656-L680 HydrophobicContact CB-CD2 3.8Å; A657-L680 HydrophobicContact CB-CD2 4.19Å; Y660-L680 HydrophobicContact CD2-CD2 3.88Å; Y660-L680 HydrophobicContact CE2-CB 4.22Å; Y660-L680 HydrophobicContact CE2-CD2 4.11Å; E676-L680 PolarHBondContact O-N 2.99Å; W677-L680 WeakPolarHBondContact O-CB 3.39Å; W677-L680 PolarHBondContact O-N 3.25Å; G678-L680 VanDerWaalsContact C-N 3.33Å; G678-L680 PolarHBondContact O-N 3.31Å; L680-M682 VanDerWaalsContact C-N 3.33Å; L680-M682 PolarHBondContact O-N 3.14Å; L680-L683 WeakPolarHBondContact O-CB 3.33Å; L680-L683 PolarHBondContact O-N 3.01Å; L680-L683 VanDerWaalsContact O-N 3.13Å; L680-I684 HydrophobicContact CD1-CD1 4.2Å; L680-I684 HydrophobicContact CG-CD1 3.92Å; L680-I684 WeakPolarHBondContact O-CG1 3.26Å; L680-I684 PolarHBondContact O-N 2.99Å
681	Y	93.5	Very high	92.6	Very high	33 Å²	33	35.6 Å²	35.6	13%	0.129	17%	0.173	C	C	.	.	H	α-helix	trans	-68	-31.4	177.1	-75.9	-56.8	0	0	0	113.3	W677 G678 L683 I684 G685 D686 K689	W677-Y681 AromaticContact CD1-CE2 3.74Å; W677-Y681 HydrophobicContact CD2-CE2 4.29Å; W677-Y681 AromaticContact CE2-CE2 3.73Å; W677-Y681 HydrophobicContact CG-CE2 4.31Å; W677-Y681 HydrophobicContact CZ2-CE2 4.26Å; W677-Y681 AromaticContact NE1-CE2 3.34Å; W677-Y681 VanDerWaalsContact NE1-CE2 3.34Å; W677-Y681 AromaticContact NE1-CZ 3.7Å; W677-Y681 WeakPolarHBondContact O-CD2 3.49Å; W677-Y681 PolarHBondContact O-N 3.45Å; W677-Y681 VanDerWaalsContact O-N 3.17Å; G678-Y681 PolarHBondContact O-N 2.92Å; G678-Y681 VanDerWaalsContact O-N 3.09Å; Y681-L683 VanDerWaalsContact C-N 3.31Å; Y681-I684 HydrophobicContact CD1-CD1 4Å; Y681-I684 HydrophobicContact CE1-CD1 4.31Å; Y681-I684 PolarHBondContact O-N 2.98Å; Y681-G685 PolarHBondContact O-N 3.43Å; Y681-D686 HydrophobicContact CD1-CB 4.11Å; Y681-D686 PolarHBondContact O-N 3.49Å; Y681-K689 HydrophobicContact CD1-CB 3.89Å; Y681-K689 HydrophobicContact CD1-CD 4.05Å; Y681-K689 HydrophobicContact CD2-CB 3.7Å; Y681-K689 HydrophobicContact CE1-CB 4.13Å; Y681-K689 HydrophobicContact CE1-CD 3.55Å; Y681-K689 HydrophobicContact CE2-CB 3.91Å; Y681-K689 HydrophobicContact CE2-CD 4.21Å; Y681-K689 HydrophobicContact CG-CB 3.69Å
682	M	92.2	Very high	92.7	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.02	20%	0.201	C	C	.	.	H	α-helix	trans	-59.2	-41.7	168.3	-70.3	-64.7	-64.7	0	0	111.5	G678 S679 L680 G685 Y687 A690 Y694 M710 V714 M717 N921 N922 A923	G678-M682 WeakPolarHBondContact O-CG 3.48Å; G678-M682 PolarHBondContact O-N 3.34Å; S679-M682 PolarHBondContact O-N 3.48Å; L680-M682 VanDerWaalsContact C-N 3.33Å; L680-M682 PolarHBondContact O-N 3.14Å; M682-G685 PolarHBondContact O-N 2.86Å; M682-Y687 HydrophobicContact CE-CD1 4.2Å; M682-Y687 HydrophobicContact CE-CE1 4.29Å; M682-Y687 HydrophobicContact SD-CD1 3.87Å; M682-Y687 HydrophobicContact SD-CE1 4.46Å; M682-A690 HydrophobicContact CG-CB 3.86Å; M682-A690 HydrophobicContact SD-CB 3.75Å; M682-Y694 HydrophobicContact CG-CE2 3.98Å; M682-Y694 VanDerWaalsContact CG-OH 3.24Å; M682-Y694 WeakPolarHBondContact CG-OH 3.34Å; M682-Y694 HydrophobicContact SD-CE2 4.25Å; M682-M710 HydrophobicContact CE-CE 4.06Å; M682-M710 HydrophobicContact CG-CE 4.15Å; M682-M710 HydrophobicContact SD-CE 4.4Å; M682-V714 HydrophobicContact CE-CG2 4.49Å; M682-V714 HydrophobicContact SD-CG2 3.85Å; M682-M717 HydrophobicContact CE-CE 4.36Å; M682-M717 HydrophobicContact CE-SD 3.88Å; M682-N921 WeakPolarHBondContact CB-O 3.37Å; M682-N922 HydrophobicContact CB-CB 4.12Å; M682-A923 HydrophobicContact CE-CB 4.32Å
683	L	89.6	Confident	92.7	Very high	49 Å²	49	39.9 Å²	39.9	26%	0.257	19%	0.193	S	C	.	.	H	α-helix	trans	-64.7	-44.1	175.9	-175.2	63.1	0	0	0	112.4	Q648 Y653 S679 L680 Y681 G685 N922 L956	Q648-L683 HydrophobicContact CG-CD2 3.49Å; Q648-L683 VanDerWaalsContact CG-CD2 3.49Å; Y653-L683 HydrophobicContact CE1-CD2 3.76Å; Y653-L683 HydrophobicContact CE1-CG 4.42Å; S679-L683 PolarHBondContact O-N 3.06Å; S679-L683 VanDerWaalsContact O-N 3.14Å; L680-L683 WeakPolarHBondContact O-CB 3.33Å; L680-L683 PolarHBondContact O-N 3.01Å; L680-L683 VanDerWaalsContact O-N 3.13Å; Y681-L683 VanDerWaalsContact C-N 3.31Å; L683-G685 PolarHBondContact O-N 3.36Å; L683-N922 HydrophobicContact CB-CB 4.31Å; L683-N922 WeakPolarHBondContact CB-ND2 3.35Å; L683-N922 HydrophobicContact CD1-CB 4.41Å; L683-L956 HydrophobicContact CD1-CD2 4.37Å
684	I	90.4	Very high	92.8	Very high	75 Å²	75	38.2 Å²	38.2	39%	0.385	19%	0.187	S	C	.	.	H	α-helix	trans	-66	-22.1	179.6	-64.4	164.9	0	0	0	111.1	Y653 L680 Y681 D686	Y653-I684 HydrophobicContact CD1-CG1 4.22Å; Y653-I684 HydrophobicContact CD2-CG1 4.43Å; Y653-I684 HydrophobicContact CG-CD1 4.34Å; Y653-I684 HydrophobicContact CG-CG1 4.02Å; L680-I684 HydrophobicContact CD1-CD1 4.2Å; L680-I684 HydrophobicContact CG-CD1 3.92Å; L680-I684 WeakPolarHBondContact O-CG1 3.26Å; L680-I684 PolarHBondContact O-N 2.99Å; Y681-I684 HydrophobicContact CD1-CD1 4Å; Y681-I684 HydrophobicContact CE1-CD1 4.31Å; Y681-I684 PolarHBondContact O-N 2.98Å; I684-D686 HydrophobicContact CG2-CB 4.48Å
685	G	87.6	Confident	92.9	Very high	32 Å²	32	39.5 Å²	39.5	33%	0.33	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	10.2	-173.6	0	0	0	0	0	113.9	Y681 M682 L683 Y687	Y681-G685 PolarHBondContact O-N 3.43Å; M682-G685 PolarHBondContact O-N 2.86Å; L683-G685 PolarHBondContact O-N 3.36Å; G685-Y687 VanDerWaalsContact C-N 3.34Å; G685-Y687 WeakPolarHBondContact O-CD2 3.27Å; G685-Y687 PolarHBondContact O-N 3.47Å
686	D	91.7	Very high	92.8	Very high	44 Å²	44	40.6 Å²	40.6	24%	0.235	20%	0.198	C	C	.	.			trans	-88	73.9	173.9	-167.1	-20.1	0	0	0	110.1	Y681 I684 M688 K689 A690	Y681-D686 HydrophobicContact CD1-CB 4.11Å; Y681-D686 PolarHBondContact O-N 3.49Å; I684-D686 HydrophobicContact CG2-CB 4.48Å; D686-M688 PolarHBondContact O-N 3.02Å; D686-M688 VanDerWaalsContact O-N 3.16Å; D686-K689 PolarHBondContact O-N 3.4Å; D686-K689 PolarHBondContact OD1-N 3.15Å; D686-K689 VanDerWaalsContact OD2-CD 3.23Å; D686-K689 WeakPolarHBondContact OD2-CD 3.5Å; D686-K689 VanDerWaalsContact OD2-CE 3.29Å; D686-K689 WeakPolarHBondContact OD2-CE 3.5Å; D686-K689 WeakPolarHBondContact OD2-CG 3.01Å; D686-K689 IonicContact OD2-NZ 2.8Å; D686-K689 PolarHBondContact OD2-NZ 3.18Å; D686-A690 PolarHBondContact O-N 3.37Å
687	Y	92.1	Very high	92.8	Very high	89 Å²	89	39.6 Å²	39.6	35%	0.349	19%	0.193	S	C	.	.	H	α-helix	trans	-62.6	-22.9	-175.8	-51.4	-59.1	0	0	0	113.5	M682 G685 K691 M717	M682-Y687 HydrophobicContact CE-CD1 4.2Å; M682-Y687 HydrophobicContact CE-CE1 4.29Å; M682-Y687 HydrophobicContact SD-CD1 3.87Å; M682-Y687 HydrophobicContact SD-CE1 4.46Å; G685-Y687 VanDerWaalsContact C-N 3.34Å; G685-Y687 WeakPolarHBondContact O-CD2 3.27Å; G685-Y687 PolarHBondContact O-N 3.47Å; Y687-K691 WeakPolarHBondContact O-CB 3.29Å; Y687-K691 PolarHBondContact O-N 3.15Å; Y687-M717 HydrophobicContact CD1-CE 3.65Å; Y687-M717 HydrophobicContact CD2-CE 4.37Å; Y687-M717 HydrophobicContact CE1-CE 3.51Å; Y687-M717 HydrophobicContact CE2-CE 4.24Å; Y687-M717 HydrophobicContact CG-CE 4.09Å
688	M	93.1	Very high	92.8	Very high	106 Å²	106	37.4 Å²	37.4	52%	0.522	19%	0.185	S	C	.	.	H	α-helix	trans	-71.6	-48.3	177.8	-72.2	-61.3	-63.7	0	0	111.1	D686 A690 K691 E692 F718	D686-M688 PolarHBondContact O-N 3.02Å; D686-M688 VanDerWaalsContact O-N 3.16Å; M688-A690 VanDerWaalsContact C-N 3.31Å; M688-A690 PolarHBondContact O-N 3.05Å; M688-K691 WeakPolarHBondContact O-CB 3.23Å; M688-K691 PolarHBondContact O-N 2.94Å; M688-E692 PolarHBondContact O-N 3.01Å; M688-E692 VanDerWaalsContact O-N 3.09Å; M688-F718 HydrophobicContact CG-CZ 4.3Å; M688-F718 HydrophobicContact SD-CE1 3.89Å; M688-F718 HydrophobicContact SD-CE2 4.32Å; M688-F718 HydrophobicContact SD-CZ 3.51Å; M688-F718 VanDerWaalsContact SD-CZ 3.51Å
689	K	92.4	Very high	92.7	Very high	90 Å²	90	37.9 Å²	37.9	39%	0.391	19%	0.188	S	C	.	.	H	α-helix	trans	-66.8	-34.8	174.3	-68.6	-172.4	-169.8	124.2	0	112.2	Y681 D686 K691 E692 C693	Y681-K689 HydrophobicContact CD1-CB 3.89Å; Y681-K689 HydrophobicContact CD1-CD 4.05Å; Y681-K689 HydrophobicContact CD2-CB 3.7Å; Y681-K689 HydrophobicContact CE1-CB 4.13Å; Y681-K689 HydrophobicContact CE1-CD 3.55Å; Y681-K689 HydrophobicContact CE2-CB 3.91Å; Y681-K689 HydrophobicContact CE2-CD 4.21Å; Y681-K689 HydrophobicContact CG-CB 3.69Å; D686-K689 PolarHBondContact O-N 3.4Å; D686-K689 PolarHBondContact OD1-N 3.15Å; D686-K689 VanDerWaalsContact OD2-CD 3.23Å; D686-K689 WeakPolarHBondContact OD2-CD 3.5Å; D686-K689 VanDerWaalsContact OD2-CE 3.29Å; D686-K689 WeakPolarHBondContact OD2-CE 3.5Å; D686-K689 WeakPolarHBondContact OD2-CG 3.01Å; D686-K689 IonicContact OD2-NZ 2.8Å; D686-K689 PolarHBondContact OD2-NZ 3.18Å; K689-K691 VanDerWaalsContact C-N 3.35Å; K689-K691 PolarHBondContact O-N 3.38Å; K689-E692 PolarHBondContact O-N 3.47Å; K689-C693 PolarHBondContact O-N 2.67Å; K689-C693 PolarHBondContact O-SG 2.91Å
690	A	94	Very high	92.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.5	-47.6	172.7	0	0	0	0	0	111.3	G678 M682 D686 M688 E692 C693 Y694	G678-A690 WeakPolarHBondContact O-CB 3.28Å; M682-A690 HydrophobicContact CG-CB 3.86Å; M682-A690 HydrophobicContact SD-CB 3.75Å; D686-A690 PolarHBondContact O-N 3.37Å; M688-A690 VanDerWaalsContact C-N 3.31Å; M688-A690 PolarHBondContact O-N 3.05Å; A690-E692 VanDerWaalsContact C-N 3.35Å; A690-E692 PolarHBondContact O-N 3.39Å; A690-C693 PolarHBondContact O-N 2.73Å; A690-Y694 HydrophobicContact CB-CE2 4.08Å; A690-Y694 WeakPolarHBondContact O-CD2 3.27Å; A690-Y694 PolarHBondContact O-N 2.88Å
691	K	93.9	Very high	92.5	Very high	27 Å²	27	43.5 Å²	43.5	12%	0.117	21%	0.214	C	C	.	.	H	α-helix	trans	-55.3	-48.7	174.8	-173.7	-179.2	176.1	168.6	0	111.8	Y687 M688 K689 C693 Y694 Y695 V714 F718	Y687-K691 WeakPolarHBondContact O-CB 3.29Å; Y687-K691 PolarHBondContact O-N 3.15Å; M688-K691 WeakPolarHBondContact O-CB 3.23Å; M688-K691 PolarHBondContact O-N 2.94Å; K689-K691 VanDerWaalsContact C-N 3.35Å; K689-K691 PolarHBondContact O-N 3.38Å; K691-C693 VanDerWaalsContact C-N 3.33Å; K691-C693 PolarHBondContact O-N 3.45Å; K691-Y694 PolarHBondContact O-N 3.18Å; K691-Y695 HydrophobicContact CD-CE1 4.39Å; K691-Y695 WeakPolarHBondContact CE-OH 3.5Å; K691-Y695 HydrophobicContact CG-CD1 3.87Å; K691-Y695 HydrophobicContact CG-CE1 3.73Å; K691-Y695 HydrophobicContact CG-CG 4.44Å; K691-Y695 WeakPolarHBondContact O-CB 3.45Å; K691-Y695 WeakPolarHBondContact O-CD1 3.4Å; K691-Y695 PolarHBondContact O-N 2.97Å; K691-V714 HydrophobicContact CB-CG1 3.86Å; K691-V714 HydrophobicContact CD-CG1 4.46Å; K691-V714 HydrophobicContact CG-CG1 4.11Å; K691-F718 HydrophobicContact CB-CE2 4.37Å; K691-F718 HydrophobicContact CD-CD2 4.31Å; K691-F718 HydrophobicContact CD-CE2 4Å
692	E	93.9	Very high	92.4	Very high	128 Å²	128	44 Å²	44	60%	0.598	22%	0.218	S	C	*	.	H	α-helix	trans	-59.6	-43.7	179.1	-71.2	178.1	179.7	0	0	111.8	M688 K689 A690 Y695 D696	M688-E692 PolarHBondContact O-N 3.01Å; M688-E692 VanDerWaalsContact O-N 3.09Å; K689-E692 PolarHBondContact O-N 3.47Å; A690-E692 VanDerWaalsContact C-N 3.35Å; A690-E692 PolarHBondContact O-N 3.39Å; E692-Y695 PolarHBondContact O-N 3.36Å; E692-D696 VanDerWaalsContact O-CB 3.27Å; E692-D696 WeakPolarHBondContact O-CB 3.4Å; E692-D696 PolarHBondContact O-N 3.24Å
693	C	94.1	Very high	92.3	Very high	15 Å²	15	47 Å²	47	10%	0.101	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-45.6	178.1	-67.7	0	0	0	0	112.1	K674 K689 A690 K691 D696 A697	K674-C693 WeakPolarHBondContact O-CB 3.45Å; K689-C693 PolarHBondContact O-N 2.67Å; K689-C693 PolarHBondContact O-SG 2.91Å; A690-C693 PolarHBondContact O-N 2.73Å; K691-C693 VanDerWaalsContact C-N 3.33Å; K691-C693 PolarHBondContact O-N 3.45Å; C693-D696 PolarHBondContact O-N 2.94Å; C693-A697 PolarHBondContact O-N 3.5Å
694	Y	95.6	Very high	92.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-39.7	176.6	-60.5	-44.1	0	0	0	112.2	F675 G678 S679 M682 A690 K691 D696 A697 V698 M710 C711 V714	F675-Y694 AromaticContact CD2-CD1 3.91Å; F675-Y694 HydrophobicContact CD2-CD1 3.91Å; F675-Y694 AromaticContact CD2-CE1 3.68Å; F675-Y694 HydrophobicContact CD2-CE1 3.68Å; F675-Y694 HydrophobicContact CE2-CE1 4.07Å; F675-Y694 HydrophobicContact CG-CE1 4.44Å; F675-Y694 WeakPolarHBondContact O-CE1 3.26Å; G678-Y694 VanDerWaalsContact C-OH 3.25Å; G678-Y694 PolarHBondContact O-OH 2.93Å; S679-Y694 WeakPolarHBondContact CA-OH 3.26Å; S679-Y694 PolarHBondContact N-OH 3.42Å; S679-Y694 VanDerWaalsContact N-OH 3.16Å; S679-Y694 PolarHBondContact OG-OH 2.95Å; S679-Y694 VanDerWaalsContact OG-OH 3.1Å; M682-Y694 HydrophobicContact CG-CE2 3.98Å; M682-Y694 VanDerWaalsContact CG-OH 3.24Å; M682-Y694 WeakPolarHBondContact CG-OH 3.34Å; M682-Y694 HydrophobicContact SD-CE2 4.25Å; A690-Y694 HydrophobicContact CB-CE2 4.08Å; A690-Y694 WeakPolarHBondContact O-CD2 3.27Å; A690-Y694 PolarHBondContact O-N 2.88Å; K691-Y694 PolarHBondContact O-N 3.18Å; Y694-D696 VanDerWaalsContact C-N 3.31Å; Y694-D696 PolarHBondContact O-N 3.18Å; Y694-A697 WeakPolarHBondContact O-CB 3.42Å; Y694-A697 PolarHBondContact O-N 3.38Å; Y694-V698 WeakPolarHBondContact O-CG2 3.35Å; Y694-V698 PolarHBondContact O-N 2.91Å; Y694-M710 HydrophobicContact CD1-CB 4.01Å; Y694-M710 HydrophobicContact CD2-CB 3.83Å; Y694-M710 HydrophobicContact CE1-CB 3.88Å; Y694-M710 HydrophobicContact CE1-CG 4.16Å; Y694-M710 HydrophobicContact CE2-CB 3.7Å; Y694-M710 HydrophobicContact CE2-CE 3.99Å; Y694-M710 HydrophobicContact CE2-CG 4.38Å; Y694-M710 HydrophobicContact CG-CB 4Å; Y694-M710 WeakPolarHBondContact OH-CE 3.44Å; Y694-C711 VanDerWaalsContact CB-SG 3.58Å; Y694-V714 HydrophobicContact CD2-CG2 4.07Å; Y694-V714 HydrophobicContact CE2-CG2 4Å
695	Y	94.5	Very high	92.4	Very high	45 Å²	45	43 Å²	43	18%	0.176	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-40.1	177.1	-85.7	39	0	0	0	111.1	I499 K691 E692 V698 S699 C711 E723 F727	I499-Y695 HydrophobicContact CD1-CD1 3.8Å; I499-Y695 HydrophobicContact CD1-CD2 3.74Å; I499-Y695 HydrophobicContact CD1-CE1 4.06Å; I499-Y695 HydrophobicContact CD1-CE2 4.02Å; I499-Y695 HydrophobicContact CD1-CG 3.61Å; I499-Y695 HydrophobicContact CG1-CD2 3.76Å; I499-Y695 HydrophobicContact CG1-CE2 3.97Å; I499-Y695 HydrophobicContact CG1-CG 4.14Å; I499-Y695 WeakPolarHBondContact CG2-O 3.37Å; K691-Y695 HydrophobicContact CD-CE1 4.39Å; K691-Y695 WeakPolarHBondContact CE-OH 3.5Å; K691-Y695 HydrophobicContact CG-CD1 3.87Å; K691-Y695 HydrophobicContact CG-CE1 3.73Å; K691-Y695 HydrophobicContact CG-CG 4.44Å; K691-Y695 WeakPolarHBondContact O-CB 3.45Å; K691-Y695 WeakPolarHBondContact O-CD1 3.4Å; K691-Y695 PolarHBondContact O-N 2.97Å; E692-Y695 PolarHBondContact O-N 3.36Å; Y695-V698 PolarHBondContact O-N 3.11Å; Y695-S699 WeakPolarHBondContact O-CB 3.21Å; Y695-S699 PolarHBondContact O-N 3.41Å; Y695-C711 WeakPolarHBondContact CD1-SG 3.39Å; Y695-C711 HydrophobicContact CE1-CB 4.24Å; Y695-E723 PolarHBondContact OH-OE2 3.29Å; Y695-F727 HydrophobicContact CE1-CE2 4.35Å; Y695-F727 HydrophobicContact CE1-CZ 4.3Å
696	D	92.5	Very high	92.7	Very high	41 Å²	41	43.4 Å²	43.4	22%	0.219	21%	0.212	C	C	.	.	H	α-helix	trans	-65.4	-43.5	176.1	-164.3	-19.4	0	0	0	111.1	K502 K674 E692 C693 Y694 V698 S699 I700	K502-D696 WeakPolarHBondContact CE-OD1 3.27Å; K502-D696 IonicContact NZ-OD1 2.96Å; K502-D696 PolarHBondContact NZ-OD1 3.33Å; K502-D696 IonicContact NZ-OD2 2.62Å; K502-D696 PolarHBondContact NZ-OD2 2.92Å; K674-D696 HydrophobicContact CD-CB 3.77Å; K674-D696 VanDerWaalsContact CD-CG 3.46Å; K674-D696 IonicContact NZ-OD1 3.04Å; K674-D696 PolarHBondContact NZ-OD1 3.17Å; K674-D696 IonicContact NZ-OD2 3.14Å; K674-D696 PolarHBondContact NZ-OD2 3.41Å; E692-D696 VanDerWaalsContact O-CB 3.27Å; E692-D696 WeakPolarHBondContact O-CB 3.4Å; E692-D696 PolarHBondContact O-N 3.24Å; C693-D696 PolarHBondContact O-N 2.94Å; Y694-D696 VanDerWaalsContact C-N 3.31Å; Y694-D696 PolarHBondContact O-N 3.18Å; D696-V698 VanDerWaalsContact C-N 3.34Å; D696-V698 PolarHBondContact O-N 3.32Å; D696-S699 WeakPolarHBondContact CA-OG 3.28Å; D696-S699 WeakPolarHBondContact O-CA 3.18Å; D696-S699 WeakPolarHBondContact O-CB 3.25Å; D696-S699 PolarHBondContact O-N 2.98Å; D696-S699 PolarHBondContact O-OG 3.2Å; D696-S699 PolarHBondContact OD1-OG 2.91Å; D696-I700 WeakPolarHBondContact O-CG1 3.35Å; D696-I700 PolarHBondContact O-N 2.98Å
697	A	93.8	Very high	92.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.6	-45.2	173.3	0	0	0	0	0	112.4	P671 K674 C693 Y694 S699 I700 Q701 S707	P671-A697 HydrophobicContact CB-CB 4.06Å; K674-A697 HydrophobicContact CB-CB 3.99Å; C693-A697 PolarHBondContact O-N 3.5Å; Y694-A697 WeakPolarHBondContact O-CB 3.42Å; Y694-A697 PolarHBondContact O-N 3.38Å; A697-S699 VanDerWaalsContact C-N 3.32Å; A697-S699 PolarHBondContact O-N 3.2Å; A697-I700 PolarHBondContact O-N 3.39Å; A697-Q701 PolarHBondContact O-N 2.97Å; A697-S707 VanDerWaalsContact CB-OG 3.25Å; A697-S707 WeakPolarHBondContact CB-OG 3.32Å
698	V	94.3	Very high	92.8	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-67	-32.5	175.1	176.5	0	0	0	0	112	V495 I499 Y694 Y695 D696 I700 Q701 Q702 L708	V495-V698 HydrophobicContact CG1-CG1 4.06Å; I499-V698 HydrophobicContact CB-CG1 4.36Å; I499-V698 HydrophobicContact CD1-CB 4.01Å; I499-V698 HydrophobicContact CD1-CG1 3.91Å; I499-V698 HydrophobicContact CG2-CB 4.4Å; I499-V698 HydrophobicContact CG2-CG1 4.25Å; Y694-V698 WeakPolarHBondContact O-CG2 3.35Å; Y694-V698 PolarHBondContact O-N 2.91Å; Y695-V698 PolarHBondContact O-N 3.11Å; D696-V698 VanDerWaalsContact C-N 3.34Å; D696-V698 PolarHBondContact O-N 3.32Å; V698-I700 VanDerWaalsContact C-N 3.3Å; V698-I700 PolarHBondContact O-N 3.34Å; V698-Q701 CarbonylContact O-C 3.42Å; V698-Q702 WeakPolarHBondContact O-CA 3.21Å; V698-Q702 WeakPolarHBondContact O-CG 3.48Å; V698-Q702 PolarHBondContact O-N 2.92Å; V698-Q702 VanDerWaalsContact O-N 3.15Å; V698-L708 HydrophobicContact CG1-CD2 3.94Å; V698-L708 HydrophobicContact CG2-CD2 3.96Å; V698-L708 HydrophobicContact CG2-CG 4.18Å
699	S	92.6	Very high	92.8	Very high	9 Å²	9	32.3 Å²	32.3	6%	0.063	16%	0.161	C	C	.	.	H	α-helix	trans	-67.8	-30	176	83.6	0	0	0	0	112.8	P501 K502 Y695 D696 A697	P501-S699 CarbonylContact C-O 3.4Å; P501-S699 VanDerWaalsContact CA-O 3.3Å; P501-S699 WeakPolarHBondContact CA-O 3.07Å; K502-S699 WeakPolarHBondContact CD-OG 3.34Å; K502-S699 WeakPolarHBondContact CE-OG 3.18Å; K502-S699 WeakPolarHBondContact CG-OG 3.33Å; K502-S699 PolarHBondContact N-O 3.41Å; Y695-S699 WeakPolarHBondContact O-CB 3.21Å; Y695-S699 PolarHBondContact O-N 3.41Å; D696-S699 WeakPolarHBondContact CA-OG 3.28Å; D696-S699 WeakPolarHBondContact O-CA 3.18Å; D696-S699 WeakPolarHBondContact O-CB 3.25Å; D696-S699 PolarHBondContact O-N 2.98Å; D696-S699 PolarHBondContact O-OG 3.2Å; D696-S699 PolarHBondContact OD1-OG 2.91Å; A697-S699 VanDerWaalsContact C-N 3.32Å; A697-S699 PolarHBondContact O-N 3.2Å
700	I	90.3	Very high	92.9	Very high	45 Å²	45	28 Å²	28	23%	0.231	14%	0.142	C	C	.	.	H	α-helix	trans	-75.5	-53.5	173.3	-65	164.4	0	0	0	109.3	P668 D669 K674 D696 A697 V698	P668-I700 WeakPolarHBondContact O-CD1 3.44Å; D669-I700 WeakPolarHBondContact O-CG2 3.46Å; K674-I700 HydrophobicContact CD-CD1 3.75Å; D696-I700 WeakPolarHBondContact O-CG1 3.35Å; D696-I700 PolarHBondContact O-N 2.98Å; A697-I700 PolarHBondContact O-N 3.39Å; V698-I700 VanDerWaalsContact C-N 3.3Å; V698-I700 PolarHBondContact O-N 3.34Å
701	Q	90.6	Very high	92.9	Very high	81 Å²	81	28 Å²	28	38%	0.379	14%	0.142	S	C	.	.			trans	-130.7	103.7	-179.8	-173.4	178.2	3.1	0	0	110.9	P671 A697 V698 T703 H704	P671-Q701 HydrophobicContact CB-CB 4.35Å; P671-Q701 HydrophobicContact CG-CB 3.97Å; P671-Q701 VanDerWaalsContact CG-OE1 3.29Å; A697-Q701 PolarHBondContact O-N 2.97Å; V698-Q701 CarbonylContact O-C 3.42Å; Q701-T703 WeakPolarHBondContact CG-OG1 3.48Å; Q701-T703 PolarHBondContact NE2-OG1 2.99Å; Q701-T703 PolarHBondContact O-N 3.3Å; Q701-H704 HydrophobicContact CB-CB 4.13Å; Q701-H704 HydrophobicContact CG-CB 4.22Å; Q701-H704 WeakPolarHBondContact O-CB 3.48Å; Q701-H704 PolarHBondContact O-N 3.35Å; Q701-H704 VanDerWaalsContact O-N 3.08Å
702	Q	90.6	Very high	92.7	Very high	44 Å²	44	26.8 Å²	26.8	21%	0.206	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-5.4	179.2	-67.7	-166.8	-26.6	0	0	114.5	I499 P501 V698	I499-Q702 PolarHBondContact O-NE2 3.45Å; P501-Q702 HydrophobicContact CB-CG 4.44Å; V698-Q702 WeakPolarHBondContact O-CA 3.21Å; V698-Q702 WeakPolarHBondContact O-CG 3.48Å; V698-Q702 PolarHBondContact O-N 2.92Å; V698-Q702 VanDerWaalsContact O-N 3.15Å
703	T	90.3	Very high	92.5	Very high	68 Å²	68	20.7 Å²	20.7	42%	0.417	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	4.2	177.2	68.8	0	0	0	0	112.7	Q701 Q705 L734	Q701-T703 WeakPolarHBondContact CG-OG1 3.48Å; Q701-T703 PolarHBondContact NE2-OG1 2.99Å; Q701-T703 PolarHBondContact O-N 3.3Å; T703-Q705 PolarHBondContact O-N 3.18Å; T703-L734 HydrophobicContact CG2-CD2 3.9Å
704	H	92.3	Very high	92.4	Very high	23 Å²	23	20.1 Å²	20.1	11%	0.106	10%	0.104	C	C	.	.			trans	-74.5	97.6	-178.9	-173.8	-108.8	0	0	0	110.4	P671 Q701 S707 L708	P671-H704 HydrophobicContact CB-CB 4.3Å; P671-H704 HydrophobicContact CG-CB 4.23Å; Q701-H704 HydrophobicContact CB-CB 4.13Å; Q701-H704 HydrophobicContact CG-CB 4.22Å; Q701-H704 WeakPolarHBondContact O-CB 3.48Å; Q701-H704 PolarHBondContact O-N 3.35Å; Q701-H704 VanDerWaalsContact O-N 3.08Å; H704-S707 PolarHBondContact CE1-OG 3.48Å; H704-S707 WeakPolarHBondContact ND1-CB 3.4Å; H704-S707 PolarHBondContact ND1-N 3.21Å; H704-S707 PolarHBondContact ND1-OG 2.9Å; H704-S707 PolarHBondContact O-N 2.92Å; H704-L708 PolarHBondContact O-N 3.41Å; H704-L708 VanDerWaalsContact O-N 3.15Å
705	Q	91.1	Very high	92.1	Very high	15 Å²	15	20.2 Å²	20.2	7%	0.07	11%	0.105	C	C	.	.	H	α-helix	trans	-61.8	-44.8	-170.3	-179.2	177.9	7	0	0	114.6	T703 S707 L708 M709 A731 E735 S738	T703-Q705 PolarHBondContact O-N 3.18Å; Q705-S707 VanDerWaalsContact C-N 3.28Å; Q705-S707 PolarHBondContact O-N 3.46Å; Q705-L708 WeakPolarHBondContact O-CB 3.49Å; Q705-L708 PolarHBondContact O-N 3.22Å; Q705-M709 HydrophobicContact CG-CG 4.34Å; Q705-M709 HydrophobicContact CG-SD 4.15Å; Q705-M709 WeakPolarHBondContact O-CG 3.35Å; Q705-M709 PolarHBondContact O-N 3.01Å; Q705-A731 HydrophobicContact CG-CB 4.27Å; Q705-E735 VanDerWaalsContact OE1-CB 3.28Å; Q705-E735 PolarHBondContact OE1-OE2 2.93Å; Q705-S738 PolarHBondContact NE2-OG 3.36Å
706	P	92.5	Very high	91.6	Very high	41 Å²	41	18.8 Å²	18.8	27%	0.266	10%	0.101	S	C	.	.	H	α-helix	trans	-58	-39.8	178.5	-25.8	35.5	0	0	0	113	F675 M709 M710 F917	F675-P706 HydrophobicContact CD2-CB 4.03Å; F675-P706 HydrophobicContact CE1-CB 4.15Å; F675-P706 HydrophobicContact CE2-CB 3.55Å; F675-P706 WeakPolarHBondContact CE2-O 3.34Å; F675-P706 HydrophobicContact CG-CB 4.49Å; F675-P706 HydrophobicContact CZ-CB 3.62Å; P706-M709 PolarHBondContact O-N 2.97Å; P706-M710 WeakPolarHBondContact O-CG 3.31Å; P706-M710 PolarHBondContact O-N 3.31Å; P706-F917 HydrophobicContact CB-CE2 4.35Å
707	S	93.9	Very high	91.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-69.2	-36.7	175.3	-62.7	0	0	0	0	112.8	A697 H704 Q705 M710 C711	A697-S707 VanDerWaalsContact CB-OG 3.25Å; A697-S707 WeakPolarHBondContact CB-OG 3.32Å; H704-S707 PolarHBondContact CE1-OG 3.48Å; H704-S707 WeakPolarHBondContact ND1-CB 3.4Å; H704-S707 PolarHBondContact ND1-N 3.21Å; H704-S707 PolarHBondContact ND1-OG 2.9Å; H704-S707 PolarHBondContact O-N 2.92Å; Q705-S707 VanDerWaalsContact C-N 3.28Å; Q705-S707 PolarHBondContact O-N 3.46Å; S707-M710 PolarHBondContact O-N 3.45Å; S707-C711 WeakPolarHBondContact O-CB 3.49Å; S707-C711 PolarHBondContact O-N 3.41Å; S707-C711 PolarHBondContact O-SG 3.01Å
708	L	93.4	Very high	90.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.2	-42	174.7	-72.2	167.4	0	0	0	111.4	V495 V698 H704 Q705 C711 G712 F727 R730 A731 L734	V495-L708 HydrophobicContact CG1-CD2 4.19Å; V698-L708 HydrophobicContact CG1-CD2 3.94Å; V698-L708 HydrophobicContact CG2-CD2 3.96Å; V698-L708 HydrophobicContact CG2-CG 4.18Å; H704-L708 PolarHBondContact O-N 3.41Å; H704-L708 VanDerWaalsContact O-N 3.15Å; Q705-L708 WeakPolarHBondContact O-CB 3.49Å; Q705-L708 PolarHBondContact O-N 3.22Å; L708-C711 PolarHBondContact O-N 3.49Å; L708-G712 PolarHBondContact O-N 3.42Å; L708-F727 HydrophobicContact CD2-CD1 3.87Å; L708-R730 HydrophobicContact CD1-CB 4.5Å; L708-R730 HydrophobicContact CD1-CG 3.86Å; L708-A731 HydrophobicContact CB-CB 4.19Å; L708-L734 HydrophobicContact CD1-CD1 3.28Å
709	M	92.4	Very high	90.4	Very high	6 Å²	6	28.1 Å²	28.1	3%	0.03	14%	0.143	C	C	.	.	H	α-helix	trans	-61.5	-46.7	175.1	-66	-175.3	-21.2	0	0	111.1	Q705 P706 G712 V713 A731 E740 A741 L744 F917	Q705-M709 HydrophobicContact CG-CG 4.34Å; Q705-M709 HydrophobicContact CG-SD 4.15Å; Q705-M709 WeakPolarHBondContact O-CG 3.35Å; Q705-M709 PolarHBondContact O-N 3.01Å; P706-M709 PolarHBondContact O-N 2.97Å; M709-G712 WeakPolarHBondContact O-CA 3.36Å; M709-G712 PolarHBondContact O-N 3.24Å; M709-G712 VanDerWaalsContact O-N 3.12Å; M709-V713 WeakPolarHBondContact O-CG2 3.3Å; M709-V713 PolarHBondContact O-N 2.95Å; M709-A731 HydrophobicContact CG-CB 3.8Å; M709-E740 HydrophobicContact CE-CB 4.23Å; M709-E740 HydrophobicContact SD-CB 4.34Å; M709-A741 HydrophobicContact CG-CB 4.43Å; M709-A741 HydrophobicContact SD-CB 3.78Å; M709-L744 HydrophobicContact CB-CD1 3.86Å; M709-L744 HydrophobicContact CE-CD1 4.12Å; M709-L744 HydrophobicContact CG-CD1 4.19Å; M709-L744 HydrophobicContact SD-CD1 4.11Å; M709-F917 HydrophobicContact CB-CE1 4.41Å; M709-F917 HydrophobicContact CB-CZ 4.41Å; M709-F917 HydrophobicContact CE-CD1 3.84Å; M709-F917 HydrophobicContact CE-CD2 3.92Å; M709-F917 HydrophobicContact CE-CE1 3.39Å; M709-F917 HydrophobicContact CE-CE2 3.45Å; M709-F917 VanDerWaalsContact CE-CE2 3.45Å; M709-F917 HydrophobicContact CE-CG 4.1Å; M709-F917 HydrophobicContact CE-CZ 3.17Å
710	M	93.7	Very high	90.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-68.9	-33	177.3	-70	-54.4	-63.6	0	0	113.5	F675 M682 Y694 P706 S707 G712 V713 V714 F917 N921 A923	F675-M710 HydrophobicContact CE2-CB 4.34Å; F675-M710 HydrophobicContact CE2-CG 3.62Å; F675-M710 HydrophobicContact CZ-CG 4.38Å; M682-M710 HydrophobicContact CE-CE 4.06Å; M682-M710 HydrophobicContact CG-CE 4.15Å; M682-M710 HydrophobicContact SD-CE 4.4Å; Y694-M710 HydrophobicContact CD1-CB 4.01Å; Y694-M710 HydrophobicContact CD2-CB 3.83Å; Y694-M710 HydrophobicContact CE1-CB 3.88Å; Y694-M710 HydrophobicContact CE1-CG 4.16Å; Y694-M710 HydrophobicContact CE2-CB 3.7Å; Y694-M710 HydrophobicContact CE2-CE 3.99Å; Y694-M710 HydrophobicContact CE2-CG 4.38Å; Y694-M710 HydrophobicContact CG-CB 4Å; Y694-M710 WeakPolarHBondContact OH-CE 3.44Å; P706-M710 WeakPolarHBondContact O-CG 3.31Å; P706-M710 PolarHBondContact O-N 3.31Å; S707-M710 PolarHBondContact O-N 3.45Å; M710-G712 VanDerWaalsContact C-N 3.28Å; M710-G712 PolarHBondContact O-N 3.35Å; M710-V713 HydrophobicContact CE-CG1 4.42Å; M710-V713 PolarHBondContact O-N 2.89Å; M710-V713 HydrophobicContact SD-CB 4.48Å; M710-V713 HydrophobicContact SD-CG2 4.47Å; M710-V714 WeakPolarHBondContact O-CB 3.29Å; M710-V714 VanDerWaalsContact O-CG2 3.26Å; M710-V714 WeakPolarHBondContact O-CG2 3.3Å; M710-V714 PolarHBondContact O-N 2.88Å; M710-F917 HydrophobicContact CG-CE1 4.35Å; M710-F917 HydrophobicContact CG-CZ 4.07Å; M710-F917 HydrophobicContact SD-CE1 3.82Å; M710-F917 HydrophobicContact SD-CZ 4.1Å; M710-N921 HydrophobicContact CE-CB 3.89Å; M710-N921 HydrophobicContact SD-CB 3.78Å; M710-A923 HydrophobicContact CE-CB 4.22Å
711	C	93.8	Very high	89.7	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-60.8	-39.5	168.4	-76.6	0	0	0	0	111.5	Y694 Y695 S707 L708 A715 F727	Y694-C711 VanDerWaalsContact CB-SG 3.58Å; Y695-C711 WeakPolarHBondContact CD1-SG 3.39Å; Y695-C711 HydrophobicContact CE1-CB 4.24Å; S707-C711 WeakPolarHBondContact O-CB 3.49Å; S707-C711 PolarHBondContact O-N 3.41Å; S707-C711 PolarHBondContact O-SG 3.01Å; L708-C711 PolarHBondContact O-N 3.49Å; C711-A715 WeakPolarHBondContact O-CB 3.32Å; C711-A715 PolarHBondContact O-N 3.48Å; C711-F727 HydrophobicContact CB-CB 4.33Å; C711-F727 HydrophobicContact CB-CD1 4.14Å; C711-F727 HydrophobicContact CB-CD2 3.84Å; C711-F727 HydrophobicContact CB-CE1 4.42Å; C711-F727 HydrophobicContact CB-CE2 4.15Å; C711-F727 HydrophobicContact CB-CG 3.85Å; C711-F727 HydrophobicContact CB-CZ 4.43Å
712	G	90.3	Very high	89.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-53.7	172.3	0	0	0	0	0	112	L708 M709 M710 V714 A715 V716	L708-G712 PolarHBondContact O-N 3.42Å; M709-G712 WeakPolarHBondContact O-CA 3.36Å; M709-G712 PolarHBondContact O-N 3.24Å; M709-G712 VanDerWaalsContact O-N 3.12Å; M710-G712 VanDerWaalsContact C-N 3.28Å; M710-G712 PolarHBondContact O-N 3.35Å; G712-V714 PolarHBondContact O-N 3.16Å; G712-A715 WeakPolarHBondContact O-CB 3.37Å; G712-A715 PolarHBondContact O-N 3.36Å; G712-A715 VanDerWaalsContact O-N 3.16Å; G712-V716 WeakPolarHBondContact O-CG2 3.29Å; G712-V716 PolarHBondContact O-N 3.2Å
713	V	89.7	Confident	89.2	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-56.2	-51	177.9	168.7	0	0	0	0	111.5	M709 M710 A715 V716 M717 L744 L918 A923 M926	M709-V713 WeakPolarHBondContact O-CG2 3.3Å; M709-V713 PolarHBondContact O-N 2.95Å; M710-V713 HydrophobicContact CE-CG1 4.42Å; M710-V713 PolarHBondContact O-N 2.89Å; M710-V713 HydrophobicContact SD-CB 4.48Å; M710-V713 HydrophobicContact SD-CG2 4.47Å; V713-A715 VanDerWaalsContact C-N 3.29Å; V713-A715 PolarHBondContact O-N 2.88Å; V713-V716 WeakPolarHBondContact O-CB 3.26Å; V713-V716 PolarHBondContact O-N 2.91Å; V713-V716 VanDerWaalsContact O-N 3.12Å; V713-M717 HydrophobicContact CG1-SD 4.19Å; V713-M717 WeakPolarHBondContact O-CG 3.42Å; V713-M717 PolarHBondContact O-N 3.37Å; V713-L744 HydrophobicContact CG2-CD2 4.14Å; V713-L918 HydrophobicContact CG2-CD2 4.22Å; V713-A923 HydrophobicContact CG1-CB 3.89Å; V713-M926 HydrophobicContact CG1-CG 3.9Å; V713-M926 HydrophobicContact CG2-CG 4.37Å
714	V	91.6	Very high	89	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-64	-35.7	179.1	172	0	0	0	0	111.3	M682 K691 Y694 M710 G712 M717 F718	M682-V714 HydrophobicContact CE-CG2 4.49Å; M682-V714 HydrophobicContact SD-CG2 3.85Å; K691-V714 HydrophobicContact CB-CG1 3.86Å; K691-V714 HydrophobicContact CD-CG1 4.46Å; K691-V714 HydrophobicContact CG-CG1 4.11Å; Y694-V714 HydrophobicContact CD2-CG2 4.07Å; Y694-V714 HydrophobicContact CE2-CG2 4Å; M710-V714 WeakPolarHBondContact O-CB 3.29Å; M710-V714 VanDerWaalsContact O-CG2 3.26Å; M710-V714 WeakPolarHBondContact O-CG2 3.3Å; M710-V714 PolarHBondContact O-N 2.88Å; G712-V714 PolarHBondContact O-N 3.16Å; V714-M717 PolarHBondContact O-N 2.72Å; V714-F718 HydrophobicContact CG1-CD2 3.56Å; V714-F718 HydrophobicContact CG1-CE2 3.34Å; V714-F718 WeakPolarHBondContact O-CD2 3.49Å; V714-F718 PolarHBondContact O-N 3.28Å
715	A	90.1	Very high	88.7	Confident	3 Å²	3	33.2 Å²	33.2	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-65.4	-37	173.7	0	0	0	0	0	112.6	C711 G712 V713 F718 E719 R720 E723 A724	C711-A715 WeakPolarHBondContact O-CB 3.32Å; C711-A715 PolarHBondContact O-N 3.48Å; G712-A715 WeakPolarHBondContact O-CB 3.37Å; G712-A715 PolarHBondContact O-N 3.36Å; G712-A715 VanDerWaalsContact O-N 3.16Å; V713-A715 VanDerWaalsContact C-N 3.29Å; V713-A715 PolarHBondContact O-N 2.88Å; A715-F718 CarbonylContact O-C 3.54Å; A715-F718 PolarHBondContact O-N 3.01Å; A715-E719 PolarHBondContact O-N 3.08Å; A715-R720 HydrophobicContact CB-CB 4.38Å; A715-R720 PolarHBondContact O-N 2.68Å; A715-E723 HydrophobicContact CB-CB 4.23Å; A715-A724 HydrophobicContact CB-CB 3.78Å
716	V	84.9	Confident	88.6	Confident	15 Å²	15	33.3 Å²	33.3	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-45.5	171.3	177.1	0	0	0	0	111	G712 V713 F718 E719 Y721 A724 Y748 M926	G712-V716 WeakPolarHBondContact O-CG2 3.29Å; G712-V716 PolarHBondContact O-N 3.2Å; V713-V716 WeakPolarHBondContact O-CB 3.26Å; V713-V716 PolarHBondContact O-N 2.91Å; V713-V716 VanDerWaalsContact O-N 3.12Å; V716-F718 PolarHBondContact O-N 3.26Å; V716-E719 WeakPolarHBondContact O-CA 3.15Å; V716-E719 PolarHBondContact O-N 3.49Å; V716-Y721 HydrophobicContact CG1-CE1 4.49Å; V716-A724 HydrophobicContact CG2-CB 3.67Å; V716-Y748 HydrophobicContact CG2-CD2 3.58Å; V716-Y748 HydrophobicContact CG2-CE2 4.36Å; V716-Y748 HydrophobicContact CG2-CG 4.44Å; V716-M926 HydrophobicContact CG1-SD 4.19Å
717	M	83.9	Confident	88.5	Confident	39 Å²	39	31.3 Å²	31.3	19%	0.192	15%	0.147	C	C	.	.	H	α-helix	trans	-60.3	-29.2	177	-63.3	176	65.8	0	0	112.8	M682 Y687 V713 V714	M682-M717 HydrophobicContact CE-CE 4.36Å; M682-M717 HydrophobicContact CE-SD 3.88Å; Y687-M717 HydrophobicContact CD1-CE 3.65Å; Y687-M717 HydrophobicContact CD2-CE 4.37Å; Y687-M717 HydrophobicContact CE1-CE 3.51Å; Y687-M717 HydrophobicContact CE2-CE 4.24Å; Y687-M717 HydrophobicContact CG-CE 4.09Å; V713-M717 HydrophobicContact CG1-SD 4.19Å; V713-M717 WeakPolarHBondContact O-CG 3.42Å; V713-M717 PolarHBondContact O-N 3.37Å; V714-M717 PolarHBondContact O-N 2.72Å
718	F	86.4	Confident	88.2	Confident	70 Å²	70	31.4 Å²	31.4	31%	0.307	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	10.8	173.9	-71.4	-59.1	0	0	0	114.1	M688 K691 V714 A715 V716 R720	M688-F718 HydrophobicContact CG-CZ 4.3Å; M688-F718 HydrophobicContact SD-CE1 3.89Å; M688-F718 HydrophobicContact SD-CE2 4.32Å; M688-F718 HydrophobicContact SD-CZ 3.51Å; M688-F718 VanDerWaalsContact SD-CZ 3.51Å; K691-F718 HydrophobicContact CB-CE2 4.37Å; K691-F718 HydrophobicContact CD-CD2 4.31Å; K691-F718 HydrophobicContact CD-CE2 4Å; V714-F718 HydrophobicContact CG1-CD2 3.56Å; V714-F718 HydrophobicContact CG1-CE2 3.34Å; V714-F718 WeakPolarHBondContact O-CD2 3.49Å; V714-F718 PolarHBondContact O-N 3.28Å; A715-F718 CarbonylContact O-C 3.54Å; A715-F718 PolarHBondContact O-N 3.01Å; V716-F718 PolarHBondContact O-N 3.26Å; F718-R720 HydrophobicContact CB-CG 4.26Å; F718-R720 WeakPolarHBondContact O-CG 3.27Å; F718-R720 PolarHBondContact O-N 3.1Å
719	E	84.3	Confident	87.8	Confident	128 Å²	128	32.8 Å²	32.8	60%	0.598	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	26.4	-178.4	-56	-179.2	-170.9	0	0	114.7	A715 V716 Y721	A715-E719 PolarHBondContact O-N 3.08Å; V716-E719 WeakPolarHBondContact O-CA 3.15Å; V716-E719 PolarHBondContact O-N 3.49Å; E719-Y721 HydrophobicContact CB-CE2 3.89Å; E719-Y721 VanDerWaalsContact O-CD2 3.31Å; E719-Y721 WeakPolarHBondContact O-CD2 3.44Å; E719-Y721 WeakPolarHBondContact O-CE2 3.46Å; E719-Y721 PolarHBondContact O-N 2.78Å
720	R	85.9	Confident	87.6	Confident	117 Å²	117	34 Å²	34	44%	0.442	16%	0.158	S	C	.	.			trans	-97.5	66.1	178.4	-59.7	-167.1	-175.8	-169.2	-2.8	111.2	A715 F718 N722 E723 A724	A715-R720 HydrophobicContact CB-CB 4.38Å; A715-R720 PolarHBondContact O-N 2.68Å; F718-R720 HydrophobicContact CB-CG 4.26Å; F718-R720 WeakPolarHBondContact O-CG 3.27Å; F718-R720 PolarHBondContact O-N 3.1Å; R720-N722 VanDerWaalsContact C-N 3.32Å; R720-N722 PolarHBondContact O-N 2.56Å; R720-E723 HydrophobicContact CB-CB 4.18Å; R720-E723 HydrophobicContact CB-CG 4.36Å; R720-E723 VanDerWaalsContact CD-CD 3.47Å; R720-E723 VanDerWaalsContact CD-OE1 3.3Å; R720-E723 WeakPolarHBondContact CD-OE1 3.37Å; R720-E723 WeakPolarHBondContact CD-OE2 3.05Å; R720-E723 IonicContact CZ-OE1 3.31Å; R720-E723 IonicContact NH1-OE1 3.01Å; R720-E723 PolarHBondContact NH1-OE1 2.91Å; R720-E723 IonicContact NH1-OE2 2.69Å; R720-E723 PolarHBondContact NH1-OE2 2.92Å; R720-E723 PolarHBondContact O-N 2.95Å; R720-E723 VanDerWaalsContact O-N 3.08Å; R720-A724 PolarHBondContact O-N 3.12Å
721	Y	81.9	Confident	87.2	Confident	29 Å²	29	34 Å²	34	11%	0.114	16%	0.158	C	C	.	.	H	α-helix	trans	-57.4	-39	-173.1	-54.2	-76.3	0	0	0	113.6	V716 E719 E723 A724 Q725 Y748 D752 N755	V716-Y721 HydrophobicContact CG1-CE1 4.49Å; E719-Y721 HydrophobicContact CB-CE2 3.89Å; E719-Y721 VanDerWaalsContact O-CD2 3.31Å; E719-Y721 WeakPolarHBondContact O-CD2 3.44Å; E719-Y721 WeakPolarHBondContact O-CE2 3.46Å; E719-Y721 PolarHBondContact O-N 2.78Å; Y721-E723 PolarHBondContact O-N 3.46Å; Y721-A724 WeakPolarHBondContact O-CB 3.45Å; Y721-A724 PolarHBondContact O-N 3.14Å; Y721-Q725 WeakPolarHBondContact O-CB 3.37Å; Y721-Q725 PolarHBondContact O-N 3.46Å; Y721-Y748 HydrophobicContact CD1-CD2 4.46Å; Y721-Y748 AromaticContact CD1-CE2 3.86Å; Y721-Y748 HydrophobicContact CD1-CE2 3.86Å; Y721-Y748 HydrophobicContact CG-CE2 4.39Å; Y721-Y748 PolarHBondContact O-OH 2.95Å; Y721-Y748 VanDerWaalsContact O-OH 3.07Å; Y721-D752 HydrophobicContact CD1-CB 4.03Å; Y721-N755 PolarHBondContact OH-ND2 2.97Å
722	N	82.2	Confident	86.7	Confident	131 Å²	131	34.5 Å²	34.5	70%	0.701	16%	0.161	S	C	*	.	H	α-helix	trans	-62.8	-39.6	176.7	-67.1	-34.1	0	0	0	113.6	R720 T726	R720-N722 VanDerWaalsContact C-N 3.32Å; R720-N722 PolarHBondContact O-N 2.56Å; N722-T726 PolarHBondContact O-N 3.19Å; N722-T726 PolarHBondContact O-OG1 3.48Å
723	E	87.9	Confident	86.3	Confident	42 Å²	42	36.1 Å²	36.1	20%	0.196	17%	0.173	C	C	.	.	H	α-helix	trans	-69.1	-44	174.8	-68.6	178.8	-157.4	0	0	109.5	L498 Y695 A715 R720 Y721 Q725 T726 F727	L498-E723 HydrophobicContact CD1-CB 4.48Å; L498-E723 HydrophobicContact CD1-CG 4.36Å; L498-E723 HydrophobicContact CD2-CG 4.11Å; Y695-E723 PolarHBondContact OH-OE2 3.29Å; A715-E723 HydrophobicContact CB-CB 4.23Å; R720-E723 HydrophobicContact CB-CB 4.18Å; R720-E723 HydrophobicContact CB-CG 4.36Å; R720-E723 VanDerWaalsContact CD-CD 3.47Å; R720-E723 VanDerWaalsContact CD-OE1 3.3Å; R720-E723 WeakPolarHBondContact CD-OE1 3.37Å; R720-E723 WeakPolarHBondContact CD-OE2 3.05Å; R720-E723 IonicContact CZ-OE1 3.31Å; R720-E723 IonicContact NH1-OE1 3.01Å; R720-E723 PolarHBondContact NH1-OE1 2.91Å; R720-E723 IonicContact NH1-OE2 2.69Å; R720-E723 PolarHBondContact NH1-OE2 2.92Å; R720-E723 PolarHBondContact O-N 2.95Å; R720-E723 VanDerWaalsContact O-N 3.08Å; Y721-E723 PolarHBondContact O-N 3.46Å; E723-Q725 PolarHBondContact O-N 2.97Å; E723-T726 WeakPolarHBondContact O-CB 3.24Å; E723-T726 PolarHBondContact O-N 3.23Å; E723-F727 HydrophobicContact CB-CD2 4.5Å; E723-F727 HydrophobicContact CB-CE2 4.14Å; E723-F727 WeakPolarHBondContact O-CD2 3.33Å; E723-F727 PolarHBondContact O-N 3.49Å; E723-F727 VanDerWaalsContact O-N 3.08Å
724	A	87.8	Confident	85.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.5	-48.4	178.6	0	0	0	0	0	112.4	A715 V716 R720 Y721 T726 F727 L728 Y748	A715-A724 HydrophobicContact CB-CB 3.78Å; V716-A724 HydrophobicContact CG2-CB 3.67Å; R720-A724 PolarHBondContact O-N 3.12Å; Y721-A724 WeakPolarHBondContact O-CB 3.45Å; Y721-A724 PolarHBondContact O-N 3.14Å; A724-T726 VanDerWaalsContact C-N 3.29Å; A724-T726 PolarHBondContact O-N 2.9Å; A724-F727 PolarHBondContact O-N 3.09Å; A724-L728 WeakPolarHBondContact O-CB 3.43Å; A724-L728 WeakPolarHBondContact O-CG 3.32Å; A724-L728 PolarHBondContact O-N 3.47Å; A724-Y748 HydrophobicContact CB-CD2 3.99Å; A724-Y748 HydrophobicContact CB-CE2 3.82Å
725	Q	85.3	Confident	84.7	Confident	58 Å²	58	43.4 Å²	43.4	27%	0.271	21%	0.208	S	C	.	.	H	α-helix	trans	-54.3	-46.6	175	-175.6	177	-2.1	0	0	111.3	Y721 E723 F727 L728 E729 M745 Y748	Y721-Q725 WeakPolarHBondContact O-CB 3.37Å; Y721-Q725 PolarHBondContact O-N 3.46Å; E723-Q725 PolarHBondContact O-N 2.97Å; Q725-F727 PolarHBondContact O-N 3.17Å; Q725-L728 PolarHBondContact O-N 2.81Å; Q725-E729 HydrophobicContact CG-CG 4.13Å; Q725-E729 VanDerWaalsContact CG-OE1 3.29Å; Q725-E729 WeakPolarHBondContact CG-OE1 3.28Å; Q725-E729 PolarHBondContact NE2-OE1 3.46Å; Q725-E729 WeakPolarHBondContact O-CB 3.48Å; Q725-E729 VanDerWaalsContact O-CG 3.25Å; Q725-E729 WeakPolarHBondContact O-CG 3.47Å; Q725-E729 PolarHBondContact O-N 3.26Å; Q725-M745 HydrophobicContact CG-CE 4.29Å; Q725-Y748 HydrophobicContact CB-CE1 3.93Å; Q725-Y748 HydrophobicContact CG-CE1 4.3Å
726	T	88.3	Confident	83.3	Confident	16 Å²	16	47.3 Å²	47.3	10%	0.098	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-43.8	-178.8	-59.8	0	0	0	0	111.7	R494 V495 L498 N722 E723 A724 R730	R494-T726 HydrophobicContact CB-CG2 3.54Å; V495-T726 HydrophobicContact CG2-CG2 3.92Å; L498-T726 HydrophobicContact CD1-CG2 4.02Å; N722-T726 PolarHBondContact O-N 3.19Å; N722-T726 PolarHBondContact O-OG1 3.48Å; E723-T726 WeakPolarHBondContact O-CB 3.24Å; E723-T726 PolarHBondContact O-N 3.23Å; A724-T726 VanDerWaalsContact C-N 3.29Å; A724-T726 PolarHBondContact O-N 2.9Å; T726-R730 WeakPolarHBondContact O-CB 3.35Å; T726-R730 PolarHBondContact O-N 3.29Å; T726-R730 VanDerWaalsContact O-N 3.09Å
727	F	90.5	Very high	82.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-70.3	-42.3	180	-66.9	-55.6	0	0	0	112.6	V495 L498 I499 Y695 L708 C711 E723 A724 Q725 R730 A731	V495-F727 HydrophobicContact CG1-CE1 4.36Å; V495-F727 HydrophobicContact CG2-CD1 4.22Å; V495-F727 HydrophobicContact CG2-CE1 4.49Å; L498-F727 HydrophobicContact CB-CZ 4.12Å; L498-F727 HydrophobicContact CD1-CE1 4.2Å; L498-F727 HydrophobicContact CD1-CE2 4.11Å; L498-F727 HydrophobicContact CD1-CZ 3.77Å; I499-F727 HydrophobicContact CD1-CE1 3.63Å; I499-F727 HydrophobicContact CD1-CZ 3.69Å; I499-F727 HydrophobicContact CG1-CE1 4.27Å; I499-F727 HydrophobicContact CG1-CZ 4.18Å; Y695-F727 HydrophobicContact CE1-CE2 4.35Å; Y695-F727 HydrophobicContact CE1-CZ 4.3Å; L708-F727 HydrophobicContact CD2-CD1 3.87Å; C711-F727 HydrophobicContact CB-CB 4.33Å; C711-F727 HydrophobicContact CB-CD1 4.14Å; C711-F727 HydrophobicContact CB-CD2 3.84Å; C711-F727 HydrophobicContact CB-CE1 4.42Å; C711-F727 HydrophobicContact CB-CE2 4.15Å; C711-F727 HydrophobicContact CB-CG 3.85Å; C711-F727 HydrophobicContact CB-CZ 4.43Å; E723-F727 HydrophobicContact CB-CD2 4.5Å; E723-F727 HydrophobicContact CB-CE2 4.14Å; E723-F727 WeakPolarHBondContact O-CD2 3.33Å; E723-F727 PolarHBondContact O-N 3.49Å; E723-F727 VanDerWaalsContact O-N 3.08Å; A724-F727 PolarHBondContact O-N 3.09Å; Q725-F727 PolarHBondContact O-N 3.17Å; F727-R730 PolarHBondContact O-N 2.58Å; F727-A731 PolarHBondContact O-N 3.27Å
728	L	86.9	Confident	82	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-72.2	-39.5	-179.8	-65.5	172.4	0	0	0	112.3	A724 Q725 R730 A731 T732 L744 M745 Y748	A724-L728 WeakPolarHBondContact O-CB 3.43Å; A724-L728 WeakPolarHBondContact O-CG 3.32Å; A724-L728 PolarHBondContact O-N 3.47Å; Q725-L728 PolarHBondContact O-N 2.81Å; L728-R730 VanDerWaalsContact C-N 3.27Å; L728-R730 PolarHBondContact O-N 2.74Å; L728-A731 PolarHBondContact O-N 3.31Å; L728-T732 WeakPolarHBondContact O-CG2 3.19Å; L728-T732 PolarHBondContact O-N 3.36Å; L728-T732 PolarHBondContact O-OG1 3.3Å; L728-L744 HydrophobicContact CD2-CB 4.03Å; L728-M745 HydrophobicContact CB-CB 4.49Å; L728-M745 HydrophobicContact CB-SD 3.55Å; L728-M745 VanDerWaalsContact CB-SD 3.55Å; L728-M745 HydrophobicContact CD1-SD 4.43Å; L728-Y748 VanDerWaalsContact CD1-CB 3.44Å; L728-Y748 HydrophobicContact CD1-CD1 4.16Å; L728-Y748 HydrophobicContact CD1-CD2 4.4Å; L728-Y748 HydrophobicContact CD1-CG 3.73Å
729	E	85.3	Confident	81.5	Confident	28 Å²	28	45.4 Å²	45.4	13%	0.131	23%	0.231	C	C	.	.	H	α-helix	trans	-61.8	-37.4	170.4	-74.7	-177.5	-176.9	0	0	111.3	L491 Q725 T732 S733 M745	L491-E729 HydrophobicContact CD1-CB 4.09Å; L491-E729 HydrophobicContact CD2-CB 3.81Å; L491-E729 WeakPolarHBondContact CD2-OE2 2.86Å; Q725-E729 HydrophobicContact CG-CG 4.13Å; Q725-E729 VanDerWaalsContact CG-OE1 3.29Å; Q725-E729 WeakPolarHBondContact CG-OE1 3.28Å; Q725-E729 PolarHBondContact NE2-OE1 3.46Å; Q725-E729 WeakPolarHBondContact O-CB 3.48Å; Q725-E729 VanDerWaalsContact O-CG 3.25Å; Q725-E729 WeakPolarHBondContact O-CG 3.47Å; Q725-E729 PolarHBondContact O-N 3.26Å; E729-T732 WeakPolarHBondContact CA-OG1 3.42Å; E729-T732 PolarHBondContact O-OG1 3.16Å; E729-S733 WeakPolarHBondContact O-CB 3.12Å; E729-S733 PolarHBondContact O-N 3.45Å; E729-S733 VanDerWaalsContact O-N 3.15Å; E729-M745 HydrophobicContact CG-CE 3.62Å; E729-M745 HydrophobicContact CG-SD 4.31Å
730	R	88.1	Confident	81.4	Confident	31 Å²	31	41.3 Å²	41.3	12%	0.117	21%	0.212	C	C	.	.	H	α-helix	trans	-67.1	-43.5	174.4	-175.6	66.1	-178.3	133.9	-6.5	111.3	V495 L708 T726 F727 L728 S733 L734	V495-R730 HydrophobicContact CG2-CB 3.84Å; V495-R730 HydrophobicContact CG2-CG 3.95Å; L708-R730 HydrophobicContact CD1-CB 4.5Å; L708-R730 HydrophobicContact CD1-CG 3.86Å; T726-R730 WeakPolarHBondContact O-CB 3.35Å; T726-R730 PolarHBondContact O-N 3.29Å; T726-R730 VanDerWaalsContact O-N 3.09Å; F727-R730 PolarHBondContact O-N 2.58Å; L728-R730 VanDerWaalsContact C-N 3.27Å; L728-R730 PolarHBondContact O-N 2.74Å; R730-S733 PolarHBondContact NH1-OG 3.06Å; R730-S733 PolarHBondContact O-N 2.99Å; R730-S733 VanDerWaalsContact O-N 3.16Å; R730-S733 PolarHBondContact O-OG 3.3Å; R730-L734 HydrophobicContact CG-CD1 4.18Å; R730-L734 VanDerWaalsContact CZ-CD2 3.42Å; R730-L734 VanDerWaalsContact NH2-CD2 3.32Å; R730-L734 WeakPolarHBondContact O-CG 3.33Å; R730-L734 PolarHBondContact O-N 3.24Å
731	A	87.1	Confident	81	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.4	-48.2	178.7	0	0	0	0	0	111.7	Q705 L708 M709 F727 L728 S733 L734 A741	Q705-A731 HydrophobicContact CG-CB 4.27Å; L708-A731 HydrophobicContact CB-CB 4.19Å; M709-A731 HydrophobicContact CG-CB 3.8Å; F727-A731 PolarHBondContact O-N 3.27Å; L728-A731 PolarHBondContact O-N 3.31Å; A731-S733 PolarHBondContact O-N 2.99Å; A731-L734 PolarHBondContact O-N 2.97Å; A731-A741 HydrophobicContact CB-CB 4.22Å
732	T	82.6	Confident	80.8	Confident	13 Å²	13	36 Å²	36	8%	0.08	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-26	176.7	54.4	0	0	0	0	113.3	L728 E729 A741 W742 M745	L728-T732 WeakPolarHBondContact O-CG2 3.19Å; L728-T732 PolarHBondContact O-N 3.36Å; L728-T732 PolarHBondContact O-OG1 3.3Å; E729-T732 WeakPolarHBondContact CA-OG1 3.42Å; E729-T732 PolarHBondContact O-OG1 3.16Å; T732-A741 HydrophobicContact CG2-CB 3.92Å; T732-A741 WeakPolarHBondContact CG2-O 3.41Å; T732-W742 HydrophobicContact CG2-CD2 3.7Å; T732-W742 HydrophobicContact CG2-CE3 3.87Å; T732-W742 HydrophobicContact CG2-CG 4.03Å; T732-W742 HydrophobicContact CG2-CZ2 4.48Å; T732-W742 HydrophobicContact CG2-CZ3 4.34Å; T732-M745 HydrophobicContact CG2-CB 4.35Å
733	S	81.6	Confident	80.4	Confident	34 Å²	34	29.8 Å²	29.8	24%	0.238	16%	0.158	C	C	.	.	H	α-helix	trans	-78.5	-19.6	177.5	77.7	0	0	0	0	115.1	E729 R730 A731	E729-S733 WeakPolarHBondContact O-CB 3.12Å; E729-S733 PolarHBondContact O-N 3.45Å; E729-S733 VanDerWaalsContact O-N 3.15Å; R730-S733 PolarHBondContact NH1-OG 3.06Å; R730-S733 PolarHBondContact O-N 2.99Å; R730-S733 VanDerWaalsContact O-N 3.16Å; R730-S733 PolarHBondContact O-OG 3.3Å; A731-S733 PolarHBondContact O-N 2.99Å
734	L	79.1	Confident	80	Confident	43 Å²	43	27.9 Å²	27.9	23%	0.225	15%	0.149	C	C	.	.	H	α-helix	trans	-85.4	-50.9	-172.6	-78.6	167.1	0	0	0	112.2	T703 L708 R730 A731	T703-L734 HydrophobicContact CG2-CD2 3.9Å; L708-L734 HydrophobicContact CD1-CD1 3.28Å; R730-L734 HydrophobicContact CG-CD1 4.18Å; R730-L734 VanDerWaalsContact CZ-CD2 3.42Å; R730-L734 VanDerWaalsContact NH2-CD2 3.32Å; R730-L734 WeakPolarHBondContact O-CG 3.33Å; R730-L734 PolarHBondContact O-N 3.24Å; A731-L734 PolarHBondContact O-N 2.97Å
735	E	67.7	Low	79.5	Confident	112 Å²	112	28.6 Å²	28.6	52%	0.523	15%	0.153	S	C	.	.			trans	-118.3	95	171	-65.1	-170	176.5	0	0	108.3	Q705 P737 S738	Q705-E735 VanDerWaalsContact OE1-CB 3.28Å; Q705-E735 PolarHBondContact OE1-OE2 2.93Å; E735-P737 VanDerWaalsContact O-N 3.11Å; E735-S738 PolarHBondContact O-N 3.35Å; E735-S738 VanDerWaalsContact O-N 3.12Å
736	P	60.6	Low	78.9	Confident	86 Å²	86	26.4 Å²	26.4	56%	0.558	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-31.1	177.2	-27.6	35.4	0	0	0	115.4	W742 I832	P736-W742 PolarHBondContact O-NE1 3.47Å; P736-I832 WeakPolarHBondContact O-CD1 3.48Å
737	P	67.3	Low	78	Confident	74 Å²	74	25.7 Å²	25.7	48%	0.481	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	22.4	178.2	38.4	-35.9	0	0	0	115.2	E735 V739 I832	E735-P737 VanDerWaalsContact O-N 3.11Å; P737-V739 PolarHBondContact O-N 3.26Å; P737-I832 HydrophobicContact CB-CG2 3.89Å; P737-I832 VanDerWaalsContact O-CG2 3.3Å; P737-I832 WeakPolarHBondContact O-CG2 3.4Å
738	S	74.3	Confident	77.4	Confident	9 Å²	9	25.9 Å²	25.9	6%	0.063	14%	0.139	C	C	.	.			trans	-84.5	110	173.6	171.6	0	0	0	0	111.7	Q705 E735 E740 A741 W742	Q705-S738 PolarHBondContact NE2-OG 3.36Å; E735-S738 PolarHBondContact O-N 3.35Å; E735-S738 VanDerWaalsContact O-N 3.12Å; S738-E740 VanDerWaalsContact C-N 3.3Å; S738-E740 PolarHBondContact O-N 3.22Å; S738-E740 PolarHBondContact OG-OE2 3.14Å; S738-A741 PolarHBondContact O-N 3.46Å; S738-A741 PolarHBondContact OG-N 3.09Å; S738-W742 PolarHBondContact O-N 2.66Å
739	V	76.3	Confident	76.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.4	-42.5	175.2	179.3	0	0	0	0	110.6	P737 A741 W742 T743 I832 F833 I910	P737-V739 PolarHBondContact O-N 3.26Å; V739-A741 PolarHBondContact O-N 3.38Å; V739-W742 PolarHBondContact O-N 2.87Å; V739-T743 HydrophobicContact CG1-CG2 4.18Å; V739-T743 VanDerWaalsContact O-CG2 3.32Å; V739-T743 WeakPolarHBondContact O-CG2 3.47Å; V739-T743 PolarHBondContact O-N 2.83Å; V739-T743 PolarHBondContact O-OG1 3.17Å; V739-I832 HydrophobicContact CG2-CG2 3.95Å; V739-F833 HydrophobicContact CG2-CB 4.33Å; V739-F833 HydrophobicContact CG2-CD2 4.5Å; V739-I910 HydrophobicContact CG1-CB 3.74Å; V739-I910 HydrophobicContact CG1-CG2 3.77Å
740	E	81.9	Confident	75.3	Confident	42 Å²	42	28 Å²	28	20%	0.196	15%	0.147	C	C	.	.	H	α-helix	trans	-64.9	-38.9	-177	-52.3	83.3	174.2	0	0	112.7	M709 S738 T743 L744 Q913 F917	M709-E740 HydrophobicContact CE-CB 4.23Å; M709-E740 HydrophobicContact SD-CB 4.34Å; S738-E740 VanDerWaalsContact C-N 3.3Å; S738-E740 PolarHBondContact O-N 3.22Å; S738-E740 PolarHBondContact OG-OE2 3.14Å; E740-T743 WeakPolarHBondContact CA-OG1 3.33Å; E740-T743 PolarHBondContact O-OG1 3.49Å; E740-L744 VanDerWaalsContact O-CB 3.28Å; E740-L744 WeakPolarHBondContact O-CB 3.48Å; E740-L744 WeakPolarHBondContact O-CD1 3.38Å; E740-L744 WeakPolarHBondContact O-CG 3.24Å; E740-L744 PolarHBondContact O-N 3.48Å; E740-Q913 HydrophobicContact CG-CG 4.2Å; E740-Q913 VanDerWaalsContact OE1-CG 3.27Å; E740-Q913 WeakPolarHBondContact OE1-CG 3.36Å; E740-Q913 PolarHBondContact OE1-NE2 3.33Å; E740-F917 HydrophobicContact CG-CB 4.3Å
741	A	78.8	Confident	74.2	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.5	-40	179	0	0	0	0	0	111.6	M709 A731 T732 S738 V739 M745	M709-A741 HydrophobicContact CG-CB 4.43Å; M709-A741 HydrophobicContact SD-CB 3.78Å; A731-A741 HydrophobicContact CB-CB 4.22Å; T732-A741 HydrophobicContact CG2-CB 3.92Å; T732-A741 WeakPolarHBondContact CG2-O 3.41Å; S738-A741 PolarHBondContact O-N 3.46Å; S738-A741 PolarHBondContact OG-N 3.09Å; V739-A741 PolarHBondContact O-N 3.38Å; A741-M745 WeakPolarHBondContact O-CB 3Å; A741-M745 PolarHBondContact O-N 3.15Å
742	W	76.4	Confident	73.1	Confident	35 Å²	35	28.9 Å²	28.9	13%	0.133	16%	0.155	C	C	.	.	H	α-helix	trans	-70.8	-41.5	178.8	-77.4	112	0	0	0	112.3	T732 P736 S738 V739 M745 D746 A825 E828 A829	T732-W742 HydrophobicContact CG2-CD2 3.7Å; T732-W742 HydrophobicContact CG2-CE3 3.87Å; T732-W742 HydrophobicContact CG2-CG 4.03Å; T732-W742 HydrophobicContact CG2-CZ2 4.48Å; T732-W742 HydrophobicContact CG2-CZ3 4.34Å; P736-W742 PolarHBondContact O-NE1 3.47Å; S738-W742 PolarHBondContact O-N 2.66Å; V739-W742 PolarHBondContact O-N 2.87Å; W742-M745 WeakPolarHBondContact O-CB 3.37Å; W742-M745 PolarHBondContact O-N 3.21Å; W742-D746 PolarHBondContact O-N 3.46Å; W742-A825 HydrophobicContact CE3-CB 3.93Å; W742-A825 HydrophobicContact CZ3-CB 4.5Å; W742-E828 HydrophobicContact CD2-CB 4.24Å; W742-E828 HydrophobicContact CD2-CG 4.49Å; W742-E828 HydrophobicContact CE3-CB 4.42Å; W742-E828 HydrophobicContact CH2-CG 4.5Å; W742-E828 HydrophobicContact CZ2-CG 4.09Å; W742-A829 HydrophobicContact CB-CB 3.93Å
743	T	75.1	Confident	71.9	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-68.7	-35.7	175.1	52.4	0	0	0	0	112.7	V739 E740 M745 D746 L747 A829 I910 T914	V739-T743 HydrophobicContact CG1-CG2 4.18Å; V739-T743 VanDerWaalsContact O-CG2 3.32Å; V739-T743 WeakPolarHBondContact O-CG2 3.47Å; V739-T743 PolarHBondContact O-N 2.83Å; V739-T743 PolarHBondContact O-OG1 3.17Å; E740-T743 WeakPolarHBondContact CA-OG1 3.33Å; E740-T743 PolarHBondContact O-OG1 3.49Å; T743-M745 VanDerWaalsContact C-N 3.32Å; T743-D746 WeakPolarHBondContact O-CB 3.27Å; T743-D746 PolarHBondContact O-N 3.03Å; T743-L747 WeakPolarHBondContact O-CB 3.49Å; T743-L747 VanDerWaalsContact O-CG 3.26Å; T743-L747 WeakPolarHBondContact O-CG 3.47Å; T743-L747 PolarHBondContact O-N 3.43Å; T743-A829 HydrophobicContact CG2-CB 4.12Å; T743-I910 HydrophobicContact CG2-CB 3.88Å; T743-I910 HydrophobicContact CG2-CD1 4.15Å; T743-I910 HydrophobicContact CG2-CG1 4.14Å; T743-T914 VanDerWaalsContact CB-OG1 3.24Å; T743-T914 WeakPolarHBondContact CB-OG1 3.49Å; T743-T914 WeakPolarHBondContact CG2-OG1 3.33Å; T743-T914 WeakPolarHBondContact OG1-CB 3.3Å; T743-T914 WeakPolarHBondContact OG1-CG2 3.47Å; T743-T914 PolarHBondContact OG1-OG1 3.3Å
744	L	78.8	Confident	70.8	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-66.4	-36.3	172.6	-73.3	172.8	0	0	0	111.9	M709 V713 L728 E740 D746 L747 Y748 T914 F917 L918 M926	M709-L744 HydrophobicContact CB-CD1 3.86Å; M709-L744 HydrophobicContact CE-CD1 4.12Å; M709-L744 HydrophobicContact CG-CD1 4.19Å; M709-L744 HydrophobicContact SD-CD1 4.11Å; V713-L744 HydrophobicContact CG2-CD2 4.14Å; L728-L744 HydrophobicContact CD2-CB 4.03Å; E740-L744 VanDerWaalsContact O-CB 3.28Å; E740-L744 WeakPolarHBondContact O-CB 3.48Å; E740-L744 WeakPolarHBondContact O-CD1 3.38Å; E740-L744 WeakPolarHBondContact O-CG 3.24Å; E740-L744 PolarHBondContact O-N 3.48Å; L744-D746 VanDerWaalsContact C-N 3.34Å; L744-L747 HydrophobicContact CD2-CD1 4.48Å; L744-Y748 VanDerWaalsContact O-CB 3.3Å; L744-Y748 WeakPolarHBondContact O-CB 3.44Å; L744-Y748 PolarHBondContact O-N 2.84Å; L744-T914 HydrophobicContact CD2-CG2 3.98Å; L744-T914 HydrophobicContact CG-CG2 3.95Å; L744-F917 HydrophobicContact CD1-CD1 4.3Å; L744-F917 HydrophobicContact CD1-CE1 4.21Å; L744-L918 HydrophobicContact CD2-CD1 3.96Å; L744-L918 HydrophobicContact CD2-CD2 3.71Å; L744-L918 HydrophobicContact CD2-CG 4.04Å; L744-M926 HydrophobicContact CD2-CE 4.47Å
745	M	78.6	Confident	69.6	Low	15 Å²	15	33.2 Å²	33.2	7%	0.074	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-42.6	171.8	-173	67.4	-177.3	0	0	111.2	Q725 L728 E729 T732 A741 W742 T743 Y748 T749	Q725-M745 HydrophobicContact CG-CE 4.29Å; L728-M745 HydrophobicContact CB-CB 4.49Å; L728-M745 HydrophobicContact CB-SD 3.55Å; L728-M745 VanDerWaalsContact CB-SD 3.55Å; L728-M745 HydrophobicContact CD1-SD 4.43Å; E729-M745 HydrophobicContact CG-CE 3.62Å; E729-M745 HydrophobicContact CG-SD 4.31Å; T732-M745 HydrophobicContact CG2-CB 4.35Å; A741-M745 WeakPolarHBondContact O-CB 3Å; A741-M745 PolarHBondContact O-N 3.15Å; W742-M745 WeakPolarHBondContact O-CB 3.37Å; W742-M745 PolarHBondContact O-N 3.21Å; T743-M745 VanDerWaalsContact C-N 3.32Å; M745-Y748 HydrophobicContact CE-CD1 4.35Å; M745-Y748 HydrophobicContact CE-CE1 4.42Å; M745-Y748 WeakPolarHBondContact O-CB 3.37Å; M745-Y748 PolarHBondContact O-N 3.34Å; M745-Y748 HydrophobicContact SD-CD1 4.01Å; M745-T749 HydrophobicContact CE-CG2 4.38Å; M745-T749 WeakPolarHBondContact O-CG2 3.43Å; M745-T749 PolarHBondContact O-N 2.88Å; M745-T749 PolarHBondContact O-OG1 3.26Å
746	D	70.9	Confident	68.7	Low	12 Å²	12	32.1 Å²	32.1	6%	0.064	17%	0.168	C	C	.	.	H	α-helix	trans	-59.3	-53.6	174.8	-176.3	46.6	0	0	0	111.7	W742 T743 L744 Y748 T749 Y750 P822 A825	W742-D746 PolarHBondContact O-N 3.46Å; T743-D746 WeakPolarHBondContact O-CB 3.27Å; T743-D746 PolarHBondContact O-N 3.03Å; L744-D746 VanDerWaalsContact C-N 3.34Å; D746-Y748 VanDerWaalsContact C-N 3.32Å; D746-Y748 PolarHBondContact O-N 3.35Å; D746-T749 PolarHBondContact O-N 3.35Å; D746-T749 PolarHBondContact O-OG1 3.11Å; D746-Y750 PolarHBondContact O-N 3.44Å; D746-P822 WeakPolarHBondContact OD1-CA 3.35Å; D746-P822 WeakPolarHBondContact OD1-CB 3.18Å; D746-A825 HydrophobicContact CB-CB 3.98Å
747	L	70	Confident	68	Low	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-59.7	-39.7	177.5	-68.1	168.1	0	0	0	112.5	T743 L744 Y750 T751 F911 T914 M926 H929 A930 Q933	T743-L747 WeakPolarHBondContact O-CB 3.49Å; T743-L747 VanDerWaalsContact O-CG 3.26Å; T743-L747 WeakPolarHBondContact O-CG 3.47Å; T743-L747 PolarHBondContact O-N 3.43Å; L744-L747 HydrophobicContact CD2-CD1 4.48Å; L747-Y750 PolarHBondContact O-N 2.84Å; L747-T751 WeakPolarHBondContact O-CG2 3.41Å; L747-T751 PolarHBondContact O-N 3.22Å; L747-T751 PolarHBondContact O-OG1 3.41Å; L747-F911 HydrophobicContact CD2-CE1 4.33Å; L747-T914 HydrophobicContact CD1-CG2 4.49Å; L747-M926 HydrophobicContact CB-CE 3.83Å; L747-H929 HydrophobicContact CD2-CB 4.22Å; L747-A930 HydrophobicContact CD1-CB 3.75Å; L747-A930 HydrophobicContact CD2-CB 4.46Å; L747-Q933 HydrophobicContact CD2-CG 3.9Å
748	Y	78.5	Confident	67	Low	4 Å²	4	30.2 Å²	30.2	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-58.2	-50.4	171.5	156.9	-105.1	0	0	0	111.3	V716 Y721 A724 Q725 L728 L744 M745 D746 Y750 T751 D752	V716-Y748 HydrophobicContact CG2-CD2 3.58Å; V716-Y748 HydrophobicContact CG2-CE2 4.36Å; V716-Y748 HydrophobicContact CG2-CG 4.44Å; Y721-Y748 HydrophobicContact CD1-CD2 4.46Å; Y721-Y748 AromaticContact CD1-CE2 3.86Å; Y721-Y748 HydrophobicContact CD1-CE2 3.86Å; Y721-Y748 HydrophobicContact CG-CE2 4.39Å; Y721-Y748 PolarHBondContact O-OH 2.95Å; Y721-Y748 VanDerWaalsContact O-OH 3.07Å; A724-Y748 HydrophobicContact CB-CD2 3.99Å; A724-Y748 HydrophobicContact CB-CE2 3.82Å; Q725-Y748 HydrophobicContact CB-CE1 3.93Å; Q725-Y748 HydrophobicContact CG-CE1 4.3Å; L728-Y748 VanDerWaalsContact CD1-CB 3.44Å; L728-Y748 HydrophobicContact CD1-CD1 4.16Å; L728-Y748 HydrophobicContact CD1-CD2 4.4Å; L728-Y748 HydrophobicContact CD1-CG 3.73Å; L744-Y748 VanDerWaalsContact O-CB 3.3Å; L744-Y748 WeakPolarHBondContact O-CB 3.44Å; L744-Y748 PolarHBondContact O-N 2.84Å; M745-Y748 HydrophobicContact CE-CD1 4.35Å; M745-Y748 HydrophobicContact CE-CE1 4.42Å; M745-Y748 WeakPolarHBondContact O-CB 3.37Å; M745-Y748 PolarHBondContact O-N 3.34Å; M745-Y748 HydrophobicContact SD-CD1 4.01Å; D746-Y748 VanDerWaalsContact C-N 3.32Å; D746-Y748 PolarHBondContact O-N 3.35Å; Y748-Y750 VanDerWaalsContact C-N 3.26Å; Y748-Y750 PolarHBondContact O-N 3.48Å; Y748-T751 WeakPolarHBondContact CA-OG1 3.4Å; Y748-T751 PolarHBondContact O-N 3.14Å; Y748-T751 VanDerWaalsContact O-N 3.12Å; Y748-T751 PolarHBondContact O-OG1 3.21Å; Y748-D752 HydrophobicContact CE2-CB 4.27Å; Y748-D752 PolarHBondContact O-N 2.9Å
749	T	65.1	Low	65.2	Low	9 Å²	9	38.1 Å²	38.1	6%	0.055	18%	0.177	C	C	.	.	H	α-helix	trans	-64.7	-32.2	-178.2	55.8	0	0	0	0	112.7	M745 D746 S753 L821 P822	M745-T749 HydrophobicContact CE-CG2 4.38Å; M745-T749 WeakPolarHBondContact O-CG2 3.43Å; M745-T749 PolarHBondContact O-N 2.88Å; M745-T749 PolarHBondContact O-OG1 3.26Å; D746-T749 PolarHBondContact O-N 3.35Å; D746-T749 PolarHBondContact O-OG1 3.11Å; T749-S753 WeakPolarHBondContact O-CB 3.29Å; T749-S753 PolarHBondContact O-N 3.13Å; T749-S753 VanDerWaalsContact O-N 3.1Å; T749-S753 PolarHBondContact O-OG 3.36Å; T749-L821 HydrophobicContact CG2-CB 3.72Å; T749-L821 HydrophobicContact CG2-CD1 4.33Å; T749-P822 WeakPolarHBondContact OG1-CG 3.47Å
750	Y	63.5	Low	63.2	Low	65 Å²	65	43 Å²	43	26%	0.255	20%	0.204	S	C	.	.	H	α-helix	trans	-67.8	-39.8	172.5	179.9	-99.3	0	0	0	112.8	D746 L747 Y748 S753 R754	D746-Y750 PolarHBondContact O-N 3.44Å; L747-Y750 PolarHBondContact O-N 2.84Å; Y748-Y750 VanDerWaalsContact C-N 3.26Å; Y748-Y750 PolarHBondContact O-N 3.48Å; Y750-S753 PolarHBondContact O-OG 3.33Å; Y750-R754 WeakPolarHBondContact O-CB 3.33Å; Y750-R754 PolarHBondContact O-N 3.47Å
751	T	64.5	Low	61.1	Low	8 Å²	8	45.6 Å²	45.6	5%	0.049	21%	0.214	C	C	.	.	H	α-helix	trans	-70.9	-40.8	176.9	52.6	0	0	0	0	112.2	L747 Y748 R754 N755	L747-T751 WeakPolarHBondContact O-CG2 3.41Å; L747-T751 PolarHBondContact O-N 3.22Å; L747-T751 PolarHBondContact O-OG1 3.41Å; Y748-T751 WeakPolarHBondContact CA-OG1 3.4Å; Y748-T751 PolarHBondContact O-N 3.14Å; Y748-T751 VanDerWaalsContact O-N 3.12Å; Y748-T751 PolarHBondContact O-OG1 3.21Å; T751-R754 PolarHBondContact O-N 3.42Å; T751-N755 PolarHBondContact O-N 2.94Å; T751-N755 VanDerWaalsContact O-N 3.09Å; T751-N755 PolarHBondContact O-ND2 3.37Å
752	D	63.7	Low	59	Low	42 Å²	42	50.3 Å²	50.3	23%	0.225	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-44.7	176.2	-171	35.8	0	0	0	111.8	Y721 Y748 R754 N755 L756	Y721-D752 HydrophobicContact CD1-CB 4.03Å; Y748-D752 HydrophobicContact CE2-CB 4.27Å; Y748-D752 PolarHBondContact O-N 2.9Å; D752-R754 PolarHBondContact O-N 3.4Å; D752-N755 PolarHBondContact O-N 2.83Å; D752-L756 WeakPolarHBondContact O-CD1 3.35Å; D752-L756 PolarHBondContact O-N 2.86Å
753	S	57.1	Low	57	Low	32 Å²	32	57 Å²	57	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-64	-40.3	177.6	68	0	0	0	0	112.8	T749 Y750 N755 L756 S757	T749-S753 WeakPolarHBondContact O-CB 3.29Å; T749-S753 PolarHBondContact O-N 3.13Å; T749-S753 VanDerWaalsContact O-N 3.1Å; T749-S753 PolarHBondContact O-OG 3.36Å; Y750-S753 PolarHBondContact O-OG 3.33Å; S753-N755 PolarHBondContact O-N 2.86Å; S753-L756 PolarHBondContact O-N 3.16Å; S753-S757 PolarHBondContact O-N 3.36Å
754	R	57.7	Low	55.1	Low	98 Å²	98	64.3 Å²	64.3	37%	0.37	30%	0.301	S	S	.	.	H	α-helix	trans	-60.6	-44.1	174	-176.8	178.1	173.3	162.7	-1.5	111.7	Y750 T751 D752 S757 E758	Y750-R754 WeakPolarHBondContact O-CB 3.33Å; Y750-R754 PolarHBondContact O-N 3.47Å; T751-R754 PolarHBondContact O-N 3.42Å; D752-R754 PolarHBondContact O-N 3.4Å; R754-S757 CarbonylContact O-C 3.48Å; R754-S757 WeakPolarHBondContact O-CB 3.32Å; R754-S757 PolarHBondContact O-N 2.96Å; R754-S757 VanDerWaalsContact O-N 3.15Å; R754-S757 PolarHBondContact O-OG 3.07Å; R754-E758 IonicContact CZ-OE1 2.63Å; R754-E758 IonicContact NE-OE1 2.89Å; R754-E758 PolarHBondContact NE-OE1 3.27Å; R754-E758 IonicContact NH2-OE1 3.93Å; R754-E758 PolarHBondContact O-N 3.04Å
755	N	54.6	Low	53	Low	52 Å²	52	70.8 Å²	70.8	28%	0.278	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-36.2	179.4	-74	-49.6	0	0	0	113	Y721 T751 D752 S753 S757 E758 R759	Y721-N755 PolarHBondContact OH-ND2 2.97Å; T751-N755 PolarHBondContact O-N 2.94Å; T751-N755 VanDerWaalsContact O-N 3.09Å; T751-N755 PolarHBondContact O-ND2 3.37Å; D752-N755 PolarHBondContact O-N 2.83Å; S753-N755 PolarHBondContact O-N 2.86Å; N755-S757 VanDerWaalsContact C-N 3.3Å; N755-E758 PolarHBondContact O-N 3.17Å; N755-R759 PolarHBondContact O-N 3.47Å
756	L	49.4	Very low	50.9	Low	89 Å²	89	76.5 Å²	76.5	47%	0.466	36%	0.362	S	S	.	.	H	α-helix	trans	-59.6	-41.8	168.2	-80.7	152.4	0	0	0	111.1	D752 S753 N760	D752-L756 WeakPolarHBondContact O-CD1 3.35Å; D752-L756 PolarHBondContact O-N 2.86Å; S753-L756 PolarHBondContact O-N 3.16Å; L756-N760 WeakPolarHBondContact O-CB 3.45Å; L756-N760 VanDerWaalsContact O-CG 3.22Å; L756-N760 PolarHBondContact O-N 3.46Å; L756-N760 PolarHBondContact O-ND2 2.62Å
757	S	44.7	Very low	49.3	Very low	36 Å²	36	79.7 Å²	79.7	25%	0.252	38%	0.382	S	S	.	.	H	α-helix	trans	-67.2	-36	176.6	86.8	0	0	0	0	113.2	S753 R754 N755 N760 K761	S753-S757 PolarHBondContact O-N 3.36Å; R754-S757 CarbonylContact O-C 3.48Å; R754-S757 WeakPolarHBondContact O-CB 3.32Å; R754-S757 PolarHBondContact O-N 2.96Å; R754-S757 VanDerWaalsContact O-N 3.15Å; R754-S757 PolarHBondContact O-OG 3.07Å; N755-S757 VanDerWaalsContact C-N 3.3Å; S757-N760 CarbonylContact O-C 3.59Å; S757-N760 PolarHBondContact O-N 3.03Å; S757-K761 WeakPolarHBondContact O-CB 3.43Å; S757-K761 PolarHBondContact O-N 2.68Å
758	E	47.5	Very low	47.6	Very low	83 Å²	83	87.4 Å²	87.4	39%	0.388	41%	0.412	S	S	.	.	H	α-helix	trans	-72.2	-38.6	177.2	-76.4	-179.1	-170.1	0	0	111.7	R754 N755 N760 K761 T762	R754-E758 IonicContact CZ-OE1 2.63Å; R754-E758 IonicContact NE-OE1 2.89Å; R754-E758 PolarHBondContact NE-OE1 3.27Å; R754-E758 IonicContact NH2-OE1 3.93Å; R754-E758 PolarHBondContact O-N 3.04Å; N755-E758 PolarHBondContact O-N 3.17Å; E758-N760 VanDerWaalsContact C-N 3.32Å; E758-N760 PolarHBondContact O-N 2.99Å; E758-K761 WeakPolarHBondContact O-CB 3.38Å; E758-K761 PolarHBondContact O-N 2.97Å; E758-T762 PolarHBondContact O-N 2.63Å; E758-T762 PolarHBondContact O-OG1 2.74Å; E758-T762 VanDerWaalsContact O-OG1 3.1Å
759	R	36.5	Very low	45.5	Very low	175 Å²	175	91 Å²	91	66%	0.66	44%	0.438	S	S	*	.	H	α-helix	trans	-62.8	-36.8	168.9	-82.1	-176.7	178.1	160.8	4.2	112.7	N755 T762	N755-R759 PolarHBondContact O-N 3.47Å; R759-T762 PolarHBondContact O-OG1 3.44Å
760	N	34.1	Very low	44.2	Very low	104 Å²	104	98 Å²	98	56%	0.556	47%	0.468	S	S	*	.	H	α-helix	trans	-76.8	-24.8	175.6	-71.1	-21	0	0	0	112.4	L756 S757 E758 F763 R764	L756-N760 WeakPolarHBondContact O-CB 3.45Å; L756-N760 VanDerWaalsContact O-CG 3.22Å; L756-N760 PolarHBondContact O-N 3.46Å; L756-N760 PolarHBondContact O-ND2 2.62Å; S757-N760 CarbonylContact O-C 3.59Å; S757-N760 PolarHBondContact O-N 3.03Å; E758-N760 VanDerWaalsContact C-N 3.32Å; E758-N760 PolarHBondContact O-N 2.99Å; N760-F763 WeakPolarHBondContact O-CB 3.42Å; N760-F763 PolarHBondContact O-N 2.85Å; N760-R764 PolarHBondContact O-N 2.85Å
761	K	38.5	Very low	42.7	Very low	96 Å²	96	102.3 Å²	102.3	42%	0.417	48%	0.484	S	S	.	.	H	α-helix	trans	-66.6	-34.8	172.7	-97.9	178.8	175.7	174.6	0	112.8	S757 E758 F763 R764 E765	S757-K761 WeakPolarHBondContact O-CB 3.43Å; S757-K761 PolarHBondContact O-N 2.68Å; E758-K761 WeakPolarHBondContact O-CB 3.38Å; E758-K761 PolarHBondContact O-N 2.97Å; K761-F763 PolarHBondContact O-N 3.49Å; K761-F763 VanDerWaalsContact O-N 3.11Å; K761-R764 WeakPolarHBondContact O-CA 3.47Å; K761-R764 PolarHBondContact O-N 3.47Å; K761-E765 PolarHBondContact O-N 3.15Å; K761-E765 VanDerWaalsContact O-N 3.15Å
762	T	33.9	Very low	41.2	Very low	98 Å²	98	106.9 Å²	106.9	60%	0.601	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.6	175.3	-17.1	0	0	0	0	112.5	E758 R759	E758-T762 PolarHBondContact O-N 2.63Å; E758-T762 PolarHBondContact O-OG1 2.74Å; E758-T762 VanDerWaalsContact O-OG1 3.1Å; R759-T762 PolarHBondContact O-OG1 3.44Å
763	F	34.5	Very low	40.2	Very low	175 Å²	175	109.2 Å²	109.2	77%	0.768	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-15.7	172.3	-148.6	-96.2	0	0	0	113.2	N760 K761	N760-F763 WeakPolarHBondContact O-CB 3.42Å; N760-F763 PolarHBondContact O-N 2.85Å; K761-F763 PolarHBondContact O-N 3.49Å; K761-F763 VanDerWaalsContact O-N 3.11Å
764	R	34.7	Very low	39.1	Very low	155 Å²	155	112.7 Å²	112.7	59%	0.585	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-17	-180	-87.5	179.8	155.3	-177.8	-4	114	N760 K761 D766 V767 Y768	N760-R764 PolarHBondContact O-N 2.85Å; K761-R764 WeakPolarHBondContact O-CA 3.47Å; K761-R764 PolarHBondContact O-N 3.47Å; R764-D766 PolarHBondContact O-N 3.1Å; R764-V767 PolarHBondContact O-N 3.07Å; R764-V767 VanDerWaalsContact O-N 3.09Å; R764-Y768 PolarHBondContact O-N 3.37Å
765	E	34.7	Very low	38	Very low	138 Å²	138	113.4 Å²	113.4	65%	0.645	54%	0.543	S	S	*	.	H	α-helix	trans	-63.5	-29.9	175.8	-74.4	-177.1	164.3	0	0	112.5	K761 V767 S769	K761-E765 PolarHBondContact O-N 3.15Å; K761-E765 VanDerWaalsContact O-N 3.15Å; E765-V767 VanDerWaalsContact C-N 3.31Å; E765-V767 PolarHBondContact O-N 3.15Å; E765-S769 WeakPolarHBondContact O-CB 3.27Å; E765-S769 PolarHBondContact O-N 2.83Å
766	D	35.1	Very low	37.3	Very low	135 Å²	135	114.9 Å²	114.9	72%	0.722	55%	0.553	S	S	*	*	H	α-helix	trans	-67.9	-28.3	172.8	-74.3	-18.6	0	0	0	112.9	R764	R764-D766 PolarHBondContact O-N 3.1Å
767	V	36.8	Very low	36.9	Very low	79 Å²	79	117.5 Å²	117.5	48%	0.479	56%	0.563	S	S	.	*	H	α-helix	trans	-88.1	-35.8	178.9	-177	0	0	0	0	111.2	R764 E765 F770 Y771	R764-V767 PolarHBondContact O-N 3.07Å; R764-V767 VanDerWaalsContact O-N 3.09Å; E765-V767 VanDerWaalsContact C-N 3.31Å; E765-V767 PolarHBondContact O-N 3.15Å; V767-F770 WeakPolarHBondContact O-CB 3.08Å; V767-F770 PolarHBondContact O-N 3.49Å; V767-Y771 HydrophobicContact CG1-CD2 4.15Å; V767-Y771 HydrophobicContact CG1-CE2 4.26Å; V767-Y771 PolarHBondContact O-N 3.47Å; V767-Y771 VanDerWaalsContact O-N 3.16Å
768	Y	34.5	Very low	36.5	Very low	162 Å²	162	120.3 Å²	120.3	64%	0.635	57%	0.574	S	S	*	*	H	α-helix	trans	-68.1	-35.2	174.7	-110.7	-89.8	0	0	0	112.5	R764 F770 Y771 M772	R764-Y768 PolarHBondContact O-N 3.37Å; Y768-F770 VanDerWaalsContact C-N 3.3Å; Y768-F770 PolarHBondContact O-N 3.03Å; Y768-Y771 PolarHBondContact O-N 3.03Å; Y768-M772 HydrophobicContact CE1-CE 4.45Å; Y768-M772 WeakPolarHBondContact O-CB 3.28Å; Y768-M772 WeakPolarHBondContact O-CG 3.09Å; Y768-M772 PolarHBondContact O-N 3.15Å
769	S	34.3	Very low	36.2	Very low	81 Å²	81	121.3 Å²	121.3	57%	0.566	58%	0.581	S	S	*	*	H	α-helix	trans	-60.3	-41.2	171.5	-178.3	0	0	0	0	111.2	E765 T773	E765-S769 WeakPolarHBondContact O-CB 3.27Å; E765-S769 PolarHBondContact O-N 2.83Å; S769-T773 PolarHBondContact O-N 3.2Å; S769-T773 PolarHBondContact O-OG1 3.38Å
770	F	38.2	Very low	36.4	Very low	156 Å²	156	120.6 Å²	120.6	68%	0.684	59%	0.585	S	S	*	*	H	α-helix	trans	-65	-43.4	178	-172.6	-99.5	0	0	0	113	V767 Y768 T773	V767-F770 WeakPolarHBondContact O-CB 3.08Å; V767-F770 PolarHBondContact O-N 3.49Å; Y768-F770 VanDerWaalsContact C-N 3.3Å; Y768-F770 PolarHBondContact O-N 3.03Å; F770-T773 PolarHBondContact O-OG1 3.3Å
771	Y	32.5	Very low	36.8	Very low	154 Å²	154	121 Å²	121	60%	0.604	59%	0.592	S	S	*	*	H	α-helix	trans	-73.4	-33.1	179.3	-90.3	-85.7	0	0	0	113.8	V767 Y768 M774 F775	V767-Y771 HydrophobicContact CG1-CD2 4.15Å; V767-Y771 HydrophobicContact CG1-CE2 4.26Å; V767-Y771 PolarHBondContact O-N 3.47Å; V767-Y771 VanDerWaalsContact O-N 3.16Å; Y768-Y771 PolarHBondContact O-N 3.03Å; Y771-M774 PolarHBondContact O-N 3.27Å; Y771-F775 PolarHBondContact O-N 3.26Å
772	M	33.2	Very low	36.9	Very low	104 Å²	104	121.4 Å²	121.4	51%	0.512	60%	0.602	S	S	.	*	H	α-helix	trans	-70.6	-33.6	178.1	-78.9	-64.3	-177.4	0	0	112.9	Y768 M774 F775 T776	Y768-M772 HydrophobicContact CE1-CE 4.45Å; Y768-M772 WeakPolarHBondContact O-CB 3.28Å; Y768-M772 WeakPolarHBondContact O-CG 3.09Å; Y768-M772 PolarHBondContact O-N 3.15Å; M772-M774 VanDerWaalsContact C-N 3.32Å; M772-M774 PolarHBondContact O-N 3.42Å; M772-F775 PolarHBondContact O-N 3.31Å; M772-T776 WeakPolarHBondContact O-CB 3.46Å; M772-T776 PolarHBondContact O-N 3.37Å; M772-T776 PolarHBondContact O-OG1 3.21Å
773	T	41.8	Very low	37	Very low	92 Å²	92	121 Å²	121	56%	0.564	61%	0.609	S	S	*	*	H	α-helix	trans	-63.2	-38.7	172.4	-2.7	0	0	0	0	112.1	S769 F770 E777	S769-T773 PolarHBondContact O-N 3.2Å; S769-T773 PolarHBondContact O-OG1 3.38Å; F770-T773 PolarHBondContact O-OG1 3.3Å; T773-E777 PolarHBondContact O-N 3.36Å
774	M	33.7	Very low	37.5	Very low	104 Å²	104	121 Å²	121	51%	0.512	61%	0.611	S	S	.	*	H	α-helix	trans	-71.9	-34.6	179.1	-151.5	-151.7	79.4	0	0	112.6	Y771 M772 M778	Y771-M774 PolarHBondContact O-N 3.27Å; M772-M774 VanDerWaalsContact C-N 3.32Å; M772-M774 PolarHBondContact O-N 3.42Å; M774-M778 HydrophobicContact CE-CE 3.97Å; M774-M778 PolarHBondContact O-N 3.19Å
775	F	34.9	Very low	37.6	Very low	114 Å²	114	122 Å²	122	50%	0.5	63%	0.626	S	S	.	*	H	α-helix	trans	-73.6	-30.6	177.7	-154	-98.6	0	0	0	112.4	Y771 M772 M778 L779	Y771-F775 PolarHBondContact O-N 3.26Å; M772-F775 PolarHBondContact O-N 3.31Å; F775-M778 HydrophobicContact CD2-CE 3.94Å; F775-M778 HydrophobicContact CE2-CE 4.32Å; F775-M778 PolarHBondContact O-N 3.27Å; F775-L779 HydrophobicContact CD1-CD1 3.69Å; F775-L779 HydrophobicContact CD1-CG 4.37Å; F775-L779 HydrophobicContact CE1-CD1 3.78Å; F775-L779 HydrophobicContact CE1-CG 4.33Å; F775-L779 PolarHBondContact O-N 3.05Å; F775-L779 VanDerWaalsContact O-N 3.15Å
776	T	40.8	Very low	37.6	Very low	82 Å²	82	122.6 Å²	122.6	50%	0.503	63%	0.634	S	S	.	*	H	α-helix	trans	-74.2	-32.8	178.8	-45	0	0	0	0	112.2	M772 M778	M772-T776 WeakPolarHBondContact O-CB 3.46Å; M772-T776 PolarHBondContact O-N 3.37Å; M772-T776 PolarHBondContact O-OG1 3.21Å; T776-M778 VanDerWaalsContact C-N 3.33Å
777	E	40.9	Very low	37.7	Very low	144 Å²	144	126.2 Å²	126.2	67%	0.673	64%	0.639	S	S	*	*	H	α-helix	trans	-68.9	-30.6	170.7	-76.4	-174.7	155.1	0	0	112.4	T773 T781	T773-E777 PolarHBondContact O-N 3.36Å; E777-T781 PolarHBondContact O-OG1 3.03Å
778	M	35	Very low	37.4	Very low	96 Å²	96	130 Å²	130	47%	0.473	66%	0.656	S	S	.	*	H	α-helix	trans	-75.1	-33.2	178.5	-145.9	-162.3	-40.3	0	0	113	M774 F775 T776 T781	M774-M778 HydrophobicContact CE-CE 3.97Å; M774-M778 PolarHBondContact O-N 3.19Å; F775-M778 HydrophobicContact CD2-CE 3.94Å; F775-M778 HydrophobicContact CE2-CE 4.32Å; F775-M778 PolarHBondContact O-N 3.27Å; T776-M778 VanDerWaalsContact C-N 3.33Å; M778-T781 PolarHBondContact O-N 3.03Å; M778-T781 PolarHBondContact O-OG1 3.13Å; M778-T781 VanDerWaalsContact O-OG1 3.08Å
779	L	41.2	Very low	37.4	Very low	104 Å²	104	129.9 Å²	129.9	55%	0.545	66%	0.662	S	S	.	*	H	α-helix	trans	-75.6	-19.8	178.9	-83.1	163.9	0	0	0	113.9	F775 T781	F775-L779 HydrophobicContact CD1-CD1 3.69Å; F775-L779 HydrophobicContact CD1-CG 4.37Å; F775-L779 HydrophobicContact CE1-CD1 3.78Å; F775-L779 HydrophobicContact CE1-CG 4.33Å; F775-L779 PolarHBondContact O-N 3.05Å; F775-L779 VanDerWaalsContact O-N 3.15Å; L779-T781 VanDerWaalsContact C-N 3.29Å
780	Q	41.9	Very low	37.4	Very low	159 Å²	159	129.2 Å²	129.2	74%	0.743	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-19	174.4	-78.4	-177.4	-14.2	0	0	112.9
781	T	42.2	Very low	37.1	Very low	114 Å²	114	128.8 Å²	128.8	70%	0.699	66%	0.661	S	S	*	*	S	Bend	trans	-90.1	-13.3	-176.7	7.9	0	0	0	0	114.1	E777 M778 L779	E777-T781 PolarHBondContact O-OG1 3.03Å; M778-T781 PolarHBondContact O-N 3.03Å; M778-T781 PolarHBondContact O-OG1 3.13Å; M778-T781 VanDerWaalsContact O-OG1 3.08Å; L779-T781 VanDerWaalsContact C-N 3.29Å
782	T	40	Very low	37.2	Very low	104 Å²	104	128.2 Å²	128.2	64%	0.638	67%	0.667	S	S	*	*			trans	-102.7	8.8	-175.8	52.5	0	0	0	0	114.7	Q784	T782-Q784 PolarHBondContact O-N 3.14Å; T782-Q784 VanDerWaalsContact O-N 3.15Å
783	A	37.3	Very low	37.2	Very low	89 Å²	89	129.2 Å²	129.2	74%	0.736	67%	0.674	S	S	*	*			trans	-78.9	15.1	-179.7	0	0	0	0	0	115.1
784	Q	44.7	Very low	36.6	Very low	174 Å²	174	131.5 Å²	131.5	81%	0.813	68%	0.676	S	S	*	*			trans	-136.3	87.9	174.1	-85.9	166.4	-37.9	0	0	109.4	T782	T782-Q784 PolarHBondContact O-N 3.14Å; T782-Q784 VanDerWaalsContact O-N 3.15Å
785	I	37	Very low	36.4	Very low	177 Å²	177	133 Å²	133	91%	0.908	69%	0.685	S	S	*	*	S	Bend	trans	-172.3	150.2	142.6	-86.8	143.1	0	0	0	108.5
786	N	34.2	Very low	36.1	Very low	151 Å²	151	131 Å²	131	81%	0.807	69%	0.69	S	S	*	*			trans	-54.2	146.6	-151.3	-90.7	-37.1	0	0	0	121.2	N788	N786-N788 PolarHBondContact O-N 3.19Å; N786-N788 VanDerWaalsContact O-N 3.13Å
787	Y	37.6	Very low	35.5	Very low	211 Å²	211	131.1 Å²	131.1	83%	0.827	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-40.2	102.2	149.5	-103.9	-108.3	0	0	0	112.3
788	N	30.4	Very low	34.7	Very low	157 Å²	157	130.3 Å²	130.3	84%	0.84	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.6	-4.4	143.1	-93.8	-17.4	0	0	0	114.3	N786	N786-N788 PolarHBondContact O-N 3.19Å; N786-N788 VanDerWaalsContact O-N 3.13Å
789	E	34.3	Very low	34.3	Very low	161 Å²	161	137.4 Å²	137.4	75%	0.752	71%	0.711	S	S	*	*	S	Bend	trans	-92.7	2.5	172.1	-72.3	-174.9	155.4	0	0	114.4	H791 I792	E789-H791 PolarHBondContact O-N 3.12Å; E789-H791 VanDerWaalsContact O-N 3.14Å; E789-I792 PolarHBondContact O-N 3.07Å
790	A	32.9	Very low	33.6	Very low	67 Å²	67	140.3 Å²	140.3	55%	0.554	72%	0.72	S	S	*	*	H	α-helix	trans	-68	-11.3	179.2	0	0	0	0	0	114.1
791	H	31.8	Very low	32.8	Very low	147 Å²	147	137.3 Å²	137.3	68%	0.681	71%	0.713	S	S	*	*	H	α-helix	trans	-90.2	-23.5	-178.2	-134.9	-72.3	0	0	0	113.6	E789	E789-H791 PolarHBondContact O-N 3.12Å; E789-H791 VanDerWaalsContact O-N 3.14Å
792	I	34.7	Very low	31.9	Very low	141 Å²	141	138.1 Å²	138.1	72%	0.723	72%	0.717	S	S	*	*	H	α-helix	trans	-84.1	-31.5	176.6	-63.5	178.5	0	0	0	110.4	E789 K794	E789-I792 PolarHBondContact O-N 3.07Å; I792-K794 VanDerWaalsContact C-N 3.34Å; I792-K794 PolarHBondContact O-N 3.22Å
793	L	34.5	Very low	31.1	Very low	125 Å²	125	142.2 Å²	142.2	65%	0.654	73%	0.729	S	S	*	*	H	α-helix	trans	-67.1	-31.9	171.2	-107.1	96.5	0	0	0	113.2	L795 A796 T797	L793-L795 VanDerWaalsContact C-N 3.25Å; L793-L795 PolarHBondContact O-N 3.17Å; L793-A796 PolarHBondContact O-N 3.33Å; L793-A796 VanDerWaalsContact O-N 3.09Å; L793-T797 PolarHBondContact O-N 2.85Å; L793-T797 VanDerWaalsContact O-N 3.09Å; L793-T797 PolarHBondContact O-OG1 2.93Å
794	K	28.7	Very low	30.5	Very low	141 Å²	141	147.1 Å²	147.1	61%	0.613	73%	0.734	S	S	*	*	H	α-helix	trans	-66.4	-23.7	-178.8	-117.8	173.7	-178.9	177	0	114	I792	I792-K794 VanDerWaalsContact C-N 3.34Å; I792-K794 PolarHBondContact O-N 3.22Å
795	L	29.2	Very low	29.6	Very low	136 Å²	136	145.6 Å²	145.6	71%	0.712	73%	0.725	S	S	*	*	H	α-helix	trans	-85.1	-22.7	173.7	-81	161.4	0	0	0	112.8	L793	L793-L795 VanDerWaalsContact C-N 3.25Å; L793-L795 PolarHBondContact O-N 3.17Å
796	A	28.4	Very low	28.9	Very low	71 Å²	71	143.4 Å²	143.4	59%	0.587	72%	0.722	S	S	*	*	H	α-helix	trans	-77.1	-30.4	170.9	0	0	0	0	0	112.1	L793	L793-A796 PolarHBondContact O-N 3.33Å; L793-A796 VanDerWaalsContact O-N 3.09Å
797	T	28.5	Very low	28.6	Very low	85 Å²	85	141.2 Å²	141.2	52%	0.521	71%	0.71	S	S	.	*	H	α-helix	trans	-80.7	-18.2	178.8	-16.2	0	0	0	0	113.9	L793 F800	L793-T797 PolarHBondContact O-N 2.85Å; L793-T797 VanDerWaalsContact O-N 3.09Å; L793-T797 PolarHBondContact O-OG1 2.93Å; T797-F800 WeakPolarHBondContact O-CB 3.47Å; T797-F800 PolarHBondContact O-N 3.22Å
798	L	25	Very low	28.1	Very low	126 Å²	126	135.6 Å²	135.6	66%	0.66	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-6.7	179	-110.7	126.9	0	0	0	114.3
799	R	25.5	Very low	27.8	Very low	245 Å²	245	136.3 Å²	136.3	93%	0.925	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-3.7	161.5	-119	-179.7	-168	-179.4	2.9	112.6
800	F	27	Very low	27.5	Very low	165 Å²	165	131.7 Å²	131.7	72%	0.724	70%	0.697	S	S	*	*	S	Bend	trans	-113.7	0.9	-172.5	-134	-89.3	0	0	0	114.1	T797	T797-F800 WeakPolarHBondContact O-CB 3.47Å; T797-F800 PolarHBondContact O-N 3.22Å
801	T	25.8	Very low	27.3	Very low	97 Å²	97	131.4 Å²	131.4	60%	0.595	69%	0.685	S	S	*	*	S	Bend	trans	-133.6	93.7	178	38	0	0	0	0	111
802	V	22.3	Very low	27.1	Very low	130 Å²	130	131.2 Å²	131.2	79%	0.788	69%	0.689	S	S	*	*			trans	140.9	89.7	144.8	176.8	0	0	0	0	109.6
803	Q	22.6	Very low	26.6	Very low	190 Å²	190	133.4 Å²	133.4	89%	0.888	70%	0.696	S	S	*	*				-140.7	105.9	127.2	-118.1	174.6	-2.4	0	0	107.4	F805	Q803-F805 PolarHBondContact O-N 2.91Å
804	K	26.2	Very low	26.3	Very low	192 Å²	192	132.3 Å²	132.3	84%	0.835	69%	0.69	S	S	*	*			trans	-62.2	112.1	-178.2	-80.9	172.5	167.6	177	0	110.1
805	F	24.1	Very low	26.3	Very low	143 Å²	143	130.4 Å²	130.4	63%	0.627	70%	0.695	S	S	*	*			trans	-162.9	138.2	138	-93.8	-75.2	0	0	0	107.2	Q803 L807	Q803-F805 PolarHBondContact O-N 2.91Å; F805-L807 VanDerWaalsContact C-N 3.27Å; F805-L807 PolarHBondContact O-N 3.49Å
806	P	23.1	Very low	26.3	Very low	130 Å²	130	131.4 Å²	131.4	84%	0.844	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	76.3	-179.7	33	-31.2	0	0	0	109.4
807	L	27.6	Very low	26.4	Very low	106 Å²	106	133.6 Å²	133.6	56%	0.555	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.5	2.2	177.6	-109	146.6	0	0	0	114.4	F805	F805-L807 VanDerWaalsContact C-N 3.27Å; F805-L807 PolarHBondContact O-N 3.49Å
808	T	27.7	Very low	26.8	Very low	92 Å²	92	136.6 Å²	136.6	56%	0.564	71%	0.71	S	S	*	*			trans	-122.6	5.9	-162.1	47	0	0	0	0	116.8	G810	T808-G810 VanDerWaalsContact C-N 3.34Å; T808-G810 PolarHBondContact O-N 2.77Å
809	D	23.9	Very low	27.2	Very low	172 Å²	172	131.9 Å²	131.9	92%	0.92	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-1.9	-173.9	-126.7	14.7	0	0	0	115
810	G	27.1	Very low	28.1	Very low	64 Å²	64	122 Å²	122	66%	0.66	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-5.6	178.5	0	0	0	0	0	116.2	T808	T808-G810 VanDerWaalsContact C-N 3.34Å; T808-G810 PolarHBondContact O-N 2.77Å
811	L	30.2	Very low	28.6	Very low	61 Å²	61	117.4 Å²	117.4	32%	0.319	64%	0.635	S	S	.	*	S	Bend	trans	-102.8	-13.4	-159.6	-93.7	153	0	0	0	115.9
812	L	26.6	Very low	29.4	Very low	143 Å²	143	113.8 Å²	113.8	75%	0.749	61%	0.614	S	S	*	*	S	Bend	trans	-92.5	-9.8	-163.5	-84.1	162.5	0	0	0	117
813	H	25.3	Very low	30.7	Very low	188 Å²	188	110.9 Å²	110.9	87%	0.87	59%	0.591	S	S	*	*	S	Bend	trans	-116.3	5.3	-170.3	-113.3	-66	0	0	0	117
814	L	27	Very low	32.2	Very low	101 Å²	101	104 Å²	104	53%	0.529	56%	0.557	S	S	.	*	S	Bend	trans	-123.4	4.5	-176.3	-78.9	159.5	0	0	0	114.5	L816	L814-L816 VanDerWaalsContact C-N 3.31Å; L814-L816 PolarHBondContact O-N 2.56Å
815	S	28.6	Very low	33.4	Very low	102 Å²	102	95 Å²	95	71%	0.713	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	2	-170.5	65	0	0	0	0	116.4
816	L	30	Very low	34.9	Very low	157 Å²	157	91.7 Å²	91.7	82%	0.822	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-2.1	-171.3	-79.4	169.6	0	0	0	116.1	L814	L814-L816 VanDerWaalsContact C-N 3.31Å; L814-L816 PolarHBondContact O-N 2.56Å
817	N	31.4	Very low	36.6	Very low	116 Å²	116	88.7 Å²	88.7	62%	0.62	48%	0.481	S	S	*	.	S	Bend	trans	-152.5	131.6	173.2	-93.6	-34.1	0	0	0	110.2
818	E	35.3	Very low	38	Very low	149 Å²	149	86.7 Å²	86.7	70%	0.696	47%	0.469	S	S	*	.			trans	97.5	91.5	170.8	-55.4	178.7	-165.8	0	0	117.5
819	A	34.2	Very low	39.4	Very low	27 Å²	27	82.3 Å²	82.3	22%	0.223	44%	0.442	C	S	.	.				-175.3	138	117.2	0	0	0	0	0	110.3	R319 P822	R319-A819 PolarHBondContact NH2-O 3.4Å; A819-P822 HydrophobicContact CB-CG 3.64Å
820	F	44.7	Very low	41.2	Very low	37 Å²	37	79.3 Å²	79.3	16%	0.162	42%	0.42	C	S	.	.	S	Bend	trans	-97.4	3.6	-167	-64.2	-86.9	0	0	0	114.9	T316 R319 L356 Y357	T316-F820 HydrophobicContact CG2-CE2 3.82Å; T316-F820 HydrophobicContact CG2-CZ 4.35Å; R319-F820 HydrophobicContact CG-CE1 3.9Å; R319-F820 HydrophobicContact CG-CZ 4.32Å; L356-F820 HydrophobicContact CB-CB 4.46Å; L356-F820 HydrophobicContact CB-CD1 4.27Å; L356-F820 HydrophobicContact CD1-CD1 3.39Å; L356-F820 HydrophobicContact CD1-CD2 4.34Å; L356-F820 HydrophobicContact CD1-CE1 3.42Å; L356-F820 VanDerWaalsContact CD1-CE1 3.42Å; L356-F820 HydrophobicContact CD1-CE2 4.38Å; L356-F820 HydrophobicContact CD1-CG 3.87Å; L356-F820 HydrophobicContact CD1-CZ 3.96Å; L356-F820 HydrophobicContact CG-CD1 4.41Å; Y357-F820 WeakPolarHBondContact CD1-O 3.18Å; Y357-F820 HydrophobicContact CE1-CB 4.46Å; Y357-F820 WeakPolarHBondContact CE1-O 3.5Å
821	L	37.8	Very low	42.9	Very low	68 Å²	68	82 Å²	82	36%	0.356	41%	0.414	S	S	.	.	S	Bend	trans	-115.1	-29.4	-179.9	-66.9	167.2	0	0	0	114.3	P358 T749 E823 A825	P358-L821 HydrophobicContact CG-CD2 3.99Å; T749-L821 HydrophobicContact CG2-CB 3.72Å; T749-L821 HydrophobicContact CG2-CD1 4.33Å; L821-E823 PolarHBondContact O-N 3.07Å; L821-A825 PolarHBondContact O-N 3Å
822	P	42.4	Very low	44.2	Very low	22 Å²	22	79.7 Å²	79.7	14%	0.143	40%	0.402	C	S	.	.	H	α-helix	trans	-56.2	-49.3	178.2	-26.4	32.8	0	0	0	113.1	D746 T749 A819 R824 A825 F826	D746-P822 WeakPolarHBondContact OD1-CA 3.35Å; D746-P822 WeakPolarHBondContact OD1-CB 3.18Å; T749-P822 WeakPolarHBondContact OG1-CG 3.47Å; A819-P822 HydrophobicContact CB-CG 3.64Å; P822-R824 VanDerWaalsContact C-N 3.29Å; P822-R824 PolarHBondContact O-N 3.45Å; P822-A825 PolarHBondContact O-N 3.11Å; P822-A825 VanDerWaalsContact O-N 3.12Å; P822-F826 VanDerWaalsContact O-CB 3.27Å; P822-F826 WeakPolarHBondContact O-CB 3.49Å; P822-F826 PolarHBondContact O-N 3.37Å
823	E	49.5	Very low	45.8	Very low	69 Å²	69	73.7 Å²	73.7	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-33.1	-170.6	-164.7	-175.3	153.4	0	0	113	R319 Y357 L821 L827	R319-E823 IonicContact NH1-OE2 3.93Å; Y357-E823 WeakPolarHBondContact OH-CB 3.26Å; Y357-E823 PolarHBondContact OH-OE2 2.92Å; L821-E823 PolarHBondContact O-N 3.07Å; E823-L827 HydrophobicContact CG-CD1 4.19Å; E823-L827 VanDerWaalsContact O-CB 3.26Å; E823-L827 WeakPolarHBondContact O-CB 3.5Å; E823-L827 WeakPolarHBondContact O-CD1 3.49Å; E823-L827 WeakPolarHBondContact O-CG 3.34Å; E823-L827 PolarHBondContact O-N 3.36Å
824	R	53.8	Low	47.3	Very low	44 Å²	44	66.3 Å²	66.3	17%	0.166	34%	0.344	C	S	.	.	H	α-helix	trans	-70.6	-51.1	173.9	179.1	-173.2	177.4	173	15	111.9	Y357 P358 P822 F826 L827 E828	Y357-R824 HydrophobicContact CD2-CB 3.85Å; Y357-R824 HydrophobicContact CD2-CG 4.43Å; Y357-R824 HydrophobicContact CE2-CB 4.05Å; Y357-R824 HydrophobicContact CG-CB 4.33Å; P358-R824 PolarHBondContact O-NH1 2.9Å; P358-R824 PolarHBondContact O-NH2 2.87Å; P822-R824 VanDerWaalsContact C-N 3.29Å; P822-R824 PolarHBondContact O-N 3.45Å; R824-F826 PolarHBondContact O-N 3.46Å; R824-L827 PolarHBondContact O-N 2.98Å; R824-L827 VanDerWaalsContact O-N 3.16Å; R824-E828 WeakPolarHBondContact O-CB 3.45Å; R824-E828 PolarHBondContact O-N 3.43Å
825	A	50.3	Low	49	Very low	4 Å²	4	66.3 Å²	66.3	3%	0.033	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-39.4	-177.9	0	0	0	0	0	110.2	W742 D746 L821 P822 A829	W742-A825 HydrophobicContact CE3-CB 3.93Å; W742-A825 HydrophobicContact CZ3-CB 4.5Å; D746-A825 HydrophobicContact CB-CB 3.98Å; L821-A825 PolarHBondContact O-N 3Å; P822-A825 PolarHBondContact O-N 3.11Å; P822-A825 VanDerWaalsContact O-N 3.12Å; A825-A829 VanDerWaalsContact O-CB 3.26Å; A825-A829 WeakPolarHBondContact O-CB 3.36Å; A825-A829 PolarHBondContact O-N 2.92Å
826	F	56.9	Low	50.4	Low	73 Å²	73	64 Å²	64	32%	0.32	32%	0.32	S	S	.	.	H	α-helix	trans	-62.1	-48.7	171.2	-175.7	-93.7	0	0	0	113.6	P822 R824 A829 K830 I910 F911	P822-F826 VanDerWaalsContact O-CB 3.27Å; P822-F826 WeakPolarHBondContact O-CB 3.49Å; P822-F826 PolarHBondContact O-N 3.37Å; R824-F826 PolarHBondContact O-N 3.46Å; F826-A829 PolarHBondContact O-N 3.13Å; F826-K830 HydrophobicContact CE1-CD 4.48Å; F826-K830 WeakPolarHBondContact O-CB 3.34Å; F826-K830 PolarHBondContact O-N 3.26Å; F826-I910 HydrophobicContact CD2-CD1 3.67Å; F826-I910 HydrophobicContact CE2-CD1 3.59Å; F826-I910 HydrophobicContact CG-CD1 4.46Å; F826-I910 HydrophobicContact CZ-CD1 4.33Å; F826-F911 HydrophobicContact CD2-CE2 4.37Å; F826-F911 HydrophobicContact CD2-CZ 4.03Å; F826-F911 AromaticContact CE2-CE2 3.8Å; F826-F911 HydrophobicContact CE2-CE2 3.8Å; F826-F911 AromaticContact CE2-CZ 3.92Å; F826-F911 HydrophobicContact CE2-CZ 3.92Å
827	L	58	Low	52	Low	68 Å²	68	59.5 Å²	59.5	36%	0.356	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-41.2	178.2	-79.3	166	0	0	0	112.4	E823 R824 K830 K831	E823-L827 HydrophobicContact CG-CD1 4.19Å; E823-L827 VanDerWaalsContact O-CB 3.26Å; E823-L827 WeakPolarHBondContact O-CB 3.5Å; E823-L827 WeakPolarHBondContact O-CD1 3.49Å; E823-L827 WeakPolarHBondContact O-CG 3.34Å; E823-L827 PolarHBondContact O-N 3.36Å; R824-L827 PolarHBondContact O-N 2.98Å; R824-L827 VanDerWaalsContact O-N 3.16Å; L827-K830 PolarHBondContact O-N 3.37Å; L827-K831 WeakPolarHBondContact O-CB 3.33Å; L827-K831 PolarHBondContact O-N 3.43Å
828	E	58.1	Low	53.2	Low	63 Å²	63	56.2 Å²	56.2	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-67.2	-44.6	177.8	-146.2	84.4	-146	0	0	110.5	W742 R824 K830 K831 I832	W742-E828 HydrophobicContact CD2-CB 4.24Å; W742-E828 HydrophobicContact CD2-CG 4.49Å; W742-E828 HydrophobicContact CE3-CB 4.42Å; W742-E828 HydrophobicContact CH2-CG 4.5Å; W742-E828 HydrophobicContact CZ2-CG 4.09Å; R824-E828 WeakPolarHBondContact O-CB 3.45Å; R824-E828 PolarHBondContact O-N 3.43Å; E828-K830 VanDerWaalsContact C-N 3.33Å; E828-K830 PolarHBondContact O-N 3.1Å; E828-K831 PolarHBondContact O-N 3.25Å; E828-I832 HydrophobicContact CG-CD1 4.4Å; E828-I832 WeakPolarHBondContact O-CD1 3Å; E828-I832 VanDerWaalsContact O-CG1 3.26Å; E828-I832 WeakPolarHBondContact O-CG1 3.43Å; E828-I832 PolarHBondContact O-N 3.21Å
829	A	56.7	Low	54.3	Low	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.6	-45.2	173.7	0	0	0	0	0	111.7	W742 T743 A825 F826 K831 I832 F833 I910	W742-A829 HydrophobicContact CB-CB 3.93Å; T743-A829 HydrophobicContact CG2-CB 4.12Å; A825-A829 VanDerWaalsContact O-CB 3.26Å; A825-A829 WeakPolarHBondContact O-CB 3.36Å; A825-A829 PolarHBondContact O-N 2.92Å; F826-A829 PolarHBondContact O-N 3.13Å; A829-K831 PolarHBondContact O-N 3.03Å; A829-I832 PolarHBondContact O-N 3.28Å; A829-F833 WeakPolarHBondContact O-CB 3.22Å; A829-F833 PolarHBondContact O-N 3.39Å; A829-I910 HydrophobicContact CB-CD1 4.11Å; A829-I910 HydrophobicContact CB-CG2 4.38Å
830	K	61.4	Low	55.3	Low	109 Å²	109	58.9 Å²	58.9	47%	0.474	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-37.4	178.4	-172.3	179.2	-179.8	-176.8	0	112.6	F826 L827 E828 G834	F826-K830 HydrophobicContact CE1-CD 4.48Å; F826-K830 WeakPolarHBondContact O-CB 3.34Å; F826-K830 PolarHBondContact O-N 3.26Å; L827-K830 PolarHBondContact O-N 3.37Å; E828-K830 VanDerWaalsContact C-N 3.33Å; E828-K830 PolarHBondContact O-N 3.1Å; K830-G834 PolarHBondContact O-N 3.34Å
831	K	62.5	Low	55.6	Low	120 Å²	120	59.3 Å²	59.3	52%	0.522	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-51.9	176	-179.7	-173.6	171.5	-169.2	0	111	L827 E828 A829 F833 G834 E835	L827-K831 WeakPolarHBondContact O-CB 3.33Å; L827-K831 PolarHBondContact O-N 3.43Å; E828-K831 PolarHBondContact O-N 3.25Å; A829-K831 PolarHBondContact O-N 3.03Å; K831-F833 VanDerWaalsContact C-N 3.28Å; K831-F833 PolarHBondContact O-N 3.47Å; K831-G834 PolarHBondContact O-N 3.03Å; K831-E835 VanDerWaalsContact CE-OE1 3.24Å; K831-E835 WeakPolarHBondContact CE-OE1 3.25Å; K831-E835 WeakPolarHBondContact O-CG 3.36Å; K831-E835 PolarHBondContact O-N 2.9Å
832	I	58.1	Low	56.2	Low	13 Å²	13	60.6 Å²	60.6	7%	0.067	31%	0.307	C	S	.	.	H	α-helix	trans	-57.4	-46.6	177.5	-67.1	158.5	0	0	0	109.9	P736 P737 V739 E828 A829 G834 E835 E836	P736-I832 WeakPolarHBondContact O-CD1 3.48Å; P737-I832 HydrophobicContact CB-CG2 3.89Å; P737-I832 VanDerWaalsContact O-CG2 3.3Å; P737-I832 WeakPolarHBondContact O-CG2 3.4Å; V739-I832 HydrophobicContact CG2-CG2 3.95Å; E828-I832 HydrophobicContact CG-CD1 4.4Å; E828-I832 WeakPolarHBondContact O-CD1 3Å; E828-I832 VanDerWaalsContact O-CG1 3.26Å; E828-I832 WeakPolarHBondContact O-CG1 3.43Å; E828-I832 PolarHBondContact O-N 3.21Å; A829-I832 PolarHBondContact O-N 3.28Å; I832-G834 VanDerWaalsContact C-N 3.34Å; I832-G834 PolarHBondContact O-N 3.17Å; I832-E835 WeakPolarHBondContact O-CB 3.17Å; I832-E835 PolarHBondContact O-N 3.08Å; I832-E835 VanDerWaalsContact O-N 3.11Å; I832-E836 PolarHBondContact O-N 3.16Å
833	F	60.9	Low	56.4	Low	17 Å²	17	62 Å²	62	8%	0.075	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-43	178.5	-175.5	-97.7	0	0	0	112.4	V739 A829 K831 E835 E836 E837 S908 I910	V739-F833 HydrophobicContact CG2-CB 4.33Å; V739-F833 HydrophobicContact CG2-CD2 4.5Å; A829-F833 WeakPolarHBondContact O-CB 3.22Å; A829-F833 PolarHBondContact O-N 3.39Å; K831-F833 VanDerWaalsContact C-N 3.28Å; K831-F833 PolarHBondContact O-N 3.47Å; F833-E835 VanDerWaalsContact C-N 3.34Å; F833-E835 PolarHBondContact O-N 2.91Å; F833-E836 PolarHBondContact O-N 2.81Å; F833-E837 HydrophobicContact CD1-CG 4.36Å; F833-E837 HydrophobicContact CE1-CG 3.74Å; F833-E837 WeakPolarHBondContact CE1-OE1 3.22Å; F833-E837 HydrophobicContact CE2-CG 4.49Å; F833-E837 HydrophobicContact CZ-CG 3.75Å; F833-E837 WeakPolarHBondContact CZ-OE1 3.49Å; F833-E837 PolarHBondContact O-N 3.28Å; F833-S908 WeakPolarHBondContact CE1-O 3.47Å; F833-S908 VanDerWaalsContact CE2-OG 3.28Å; F833-S908 WeakPolarHBondContact CE2-OG 3.38Å; F833-S908 WeakPolarHBondContact CZ-O 3.25Å; F833-S908 VanDerWaalsContact CZ-OG 3.22Å; F833-S908 WeakPolarHBondContact CZ-OG 3.17Å; F833-I910 HydrophobicContact CB-CG2 3.68Å; F833-I910 HydrophobicContact CD1-CG2 4.33Å; F833-I910 HydrophobicContact CD2-CG2 4.21Å; F833-I910 HydrophobicContact CG-CG2 3.79Å
834	G	55.1	Low	56.1	Low	33 Å²	33	61.9 Å²	61.9	34%	0.34	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-35.6	173.6	0	0	0	0	0	113.7	K830 K831 I832 A838	K830-G834 PolarHBondContact O-N 3.34Å; K831-G834 PolarHBondContact O-N 3.03Å; I832-G834 VanDerWaalsContact C-N 3.34Å; I832-G834 PolarHBondContact O-N 3.17Å; G834-A838 WeakPolarHBondContact O-CB 3.4Å; G834-A838 PolarHBondContact O-N 3.47Å
835	E	62.8	Low	55.9	Low	102 Å²	102	64.4 Å²	64.4	48%	0.477	34%	0.339	S	S	.	.	H	α-helix	trans	-66.8	-40	173.4	-70.6	175.8	-168.5	0	0	111.7	K831 I832 F833 A838 N839	K831-E835 VanDerWaalsContact CE-OE1 3.24Å; K831-E835 WeakPolarHBondContact CE-OE1 3.25Å; K831-E835 WeakPolarHBondContact O-CG 3.36Å; K831-E835 PolarHBondContact O-N 2.9Å; I832-E835 WeakPolarHBondContact O-CB 3.17Å; I832-E835 PolarHBondContact O-N 3.08Å; I832-E835 VanDerWaalsContact O-N 3.11Å; F833-E835 VanDerWaalsContact C-N 3.34Å; F833-E835 PolarHBondContact O-N 2.91Å; E835-A838 PolarHBondContact O-N 2.89Å; E835-N839 WeakPolarHBondContact O-CB 3.5Å; E835-N839 PolarHBondContact O-N 2.87Å; E835-N839 PolarHBondContact O-ND2 3.34Å; E835-N839 VanDerWaalsContact O-ND2 3.16Å
836	E	57.9	Low	55.7	Low	53 Å²	53	71.8 Å²	71.8	25%	0.248	37%	0.37	C	S	.	.	H	α-helix	trans	-65.3	-42.9	174.8	-74	-170.9	-174	0	0	113	I832 F833 N839 R840	I832-E836 PolarHBondContact O-N 3.16Å; F833-E836 PolarHBondContact O-N 2.81Å; E836-N839 PolarHBondContact O-N 3.18Å; E836-R840 WeakPolarHBondContact O-CB 3.49Å; E836-R840 PolarHBondContact O-N 3.29Å; E836-R840 IonicContact OE2-NH2 3.54Å; E836-R840 PolarHBondContact OE2-NH2 2.8Å
837	E	63.3	Low	55	Low	63 Å²	63	71.6 Å²	71.6	29%	0.294	38%	0.376	S	S	.	.	H	α-helix	trans	-63.2	-42.9	175.9	-74.9	-169.1	147.6	0	0	111.2	F833 R840 A841	F833-E837 HydrophobicContact CD1-CG 4.36Å; F833-E837 HydrophobicContact CE1-CG 3.74Å; F833-E837 WeakPolarHBondContact CE1-OE1 3.22Å; F833-E837 HydrophobicContact CE2-CG 4.49Å; F833-E837 HydrophobicContact CZ-CG 3.75Å; F833-E837 WeakPolarHBondContact CZ-OE1 3.49Å; F833-E837 PolarHBondContact O-N 3.28Å; E837-R840 PolarHBondContact O-N 2.75Å; E837-A841 WeakPolarHBondContact O-CB 3.27Å; E837-A841 PolarHBondContact O-N 2.85Å
838	A	56.7	Low	54.3	Low	47 Å²	47	74.5 Å²	74.5	39%	0.388	39%	0.385	S	S	.	.	H	α-helix	trans	-64.2	-40.4	175.8	0	0	0	0	0	112.1	G834 E835 A841 N842	G834-A838 WeakPolarHBondContact O-CB 3.4Å; G834-A838 PolarHBondContact O-N 3.47Å; E835-A838 PolarHBondContact O-N 2.89Å; A838-A841 PolarHBondContact O-N 3.15Å; A838-N842 WeakPolarHBondContact O-CB 3.09Å; A838-N842 PolarHBondContact O-N 3.34Å; A838-N842 PolarHBondContact O-ND2 2.84Å; A838-N842 VanDerWaalsContact O-ND2 3.09Å
839	N	58.7	Low	53.4	Low	106 Å²	106	76.7 Å²	76.7	57%	0.567	40%	0.399	S	S	*	.	H	α-helix	trans	-67.6	-39.6	176.5	-74.7	-27.3	0	0	0	112.4	E835 E836 N842 A843	E835-N839 WeakPolarHBondContact O-CB 3.5Å; E835-N839 PolarHBondContact O-N 2.87Å; E835-N839 PolarHBondContact O-ND2 3.34Å; E835-N839 VanDerWaalsContact O-ND2 3.16Å; E836-N839 PolarHBondContact O-N 3.18Å; N839-N842 PolarHBondContact O-N 3.05Å; N839-A843 WeakPolarHBondContact O-CB 3.5Å; N839-A843 PolarHBondContact O-N 3.46Å
840	R	55.5	Low	52.4	Low	125 Å²	125	80 Å²	80	47%	0.472	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-42.7	173.1	-82.8	-176.6	-108.4	172.5	-5.9	111.8	E836 E837 N842 A843 D844	E836-R840 WeakPolarHBondContact O-CB 3.49Å; E836-R840 PolarHBondContact O-N 3.29Å; E836-R840 IonicContact OE2-NH2 3.54Å; E836-R840 PolarHBondContact OE2-NH2 2.8Å; E837-R840 PolarHBondContact O-N 2.75Å; R840-N842 VanDerWaalsContact C-N 3.34Å; R840-N842 PolarHBondContact O-N 3.47Å; R840-A843 PolarHBondContact O-N 2.91Å; R840-D844 PolarHBondContact O-N 3.4Å
841	A	50.6	Low	51.2	Low	47 Å²	47	80.8 Å²	80.8	39%	0.388	43%	0.427	S	S	.	.	H	α-helix	trans	-60.6	-42.6	174.8	0	0	0	0	0	112.1	E837 A838 D844 D845	E837-A841 WeakPolarHBondContact O-CB 3.27Å; E837-A841 PolarHBondContact O-N 2.85Å; A838-A841 PolarHBondContact O-N 3.15Å; A841-D844 PolarHBondContact O-N 3.39Å; A841-D845 PolarHBondContact O-N 2.98Å; A841-D845 VanDerWaalsContact O-N 3.08Å
842	N	50.4	Low	50.1	Low	95 Å²	95	79.8 Å²	79.8	51%	0.508	43%	0.427	S	S	.	.	H	α-helix	trans	-70.4	-28.8	176.7	-72	-32.9	0	0	0	113.7	A838 N839 R840 K846	A838-N842 WeakPolarHBondContact O-CB 3.09Å; A838-N842 PolarHBondContact O-N 3.34Å; A838-N842 PolarHBondContact O-ND2 2.84Å; A838-N842 VanDerWaalsContact O-ND2 3.09Å; N839-N842 PolarHBondContact O-N 3.05Å; R840-N842 VanDerWaalsContact C-N 3.34Å; R840-N842 PolarHBondContact O-N 3.47Å; N842-K846 WeakPolarHBondContact O-CG 3.4Å; N842-K846 PolarHBondContact O-N 2.77Å
843	A	46.3	Very low	49.2	Very low	52 Å²	52	84.3 Å²	84.3	43%	0.43	45%	0.452	S	S	.	.	H	α-helix	trans	-72.3	-41.5	174.6	0	0	0	0	0	111.1	N839 R840 K846 T847	N839-A843 WeakPolarHBondContact O-CB 3.5Å; N839-A843 PolarHBondContact O-N 3.46Å; R840-A843 PolarHBondContact O-N 2.91Å; A843-K846 WeakPolarHBondContact O-CB 3.38Å; A843-K846 PolarHBondContact O-N 3.25Å; A843-T847 PolarHBondContact O-N 2.92Å; A843-T847 PolarHBondContact O-OG1 2.89Å
844	D	44.7	Very low	47.8	Very low	65 Å²	65	86.7 Å²	86.7	35%	0.348	47%	0.47	S	S	.	.	H	α-helix	trans	-66.6	-35.4	176.7	-75.4	-13.7	0	0	0	112.9	R840 A841 K846 T847 K848 K905	R840-D844 PolarHBondContact O-N 3.4Å; A841-D844 PolarHBondContact O-N 3.39Å; D844-K846 VanDerWaalsContact C-N 3.3Å; D844-T847 VanDerWaalsContact CA-OG1 3.26Å; D844-T847 WeakPolarHBondContact CA-OG1 3.42Å; D844-T847 PolarHBondContact O-N 2.91Å; D844-T847 PolarHBondContact O-OG1 3.36Å; D844-T847 VanDerWaalsContact O-OG1 3.13Å; D844-K848 WeakPolarHBondContact O-CB 3.41Å; D844-K848 WeakPolarHBondContact O-CG 3.46Å; D844-K848 PolarHBondContact O-N 2.88Å; D844-K905 IonicContact OD2-NZ 2.82Å; D844-K905 PolarHBondContact OD2-NZ 3.09Å
845	D	49.2	Very low	46.8	Very low	98 Å²	98	92 Å²	92	52%	0.524	49%	0.486	S	S	.	.	H	α-helix	trans	-67.8	-31.8	172.6	-91.2	-7.2	0	0	0	111.9	A841 L849	A841-D845 PolarHBondContact O-N 2.98Å; A841-D845 VanDerWaalsContact O-N 3.08Å; D845-L849 WeakPolarHBondContact O-CB 3.5Å; D845-L849 WeakPolarHBondContact O-CD1 3.46Å; D845-L849 WeakPolarHBondContact O-CG 3.45Å; D845-L849 PolarHBondContact O-N 3.46Å
846	K	46.4	Very low	45.4	Very low	158 Å²	158	94.4 Å²	94.4	69%	0.687	50%	0.497	S	S	*	.	H	α-helix	trans	-73.8	-36.2	174.8	-81.2	-179	178.8	177.5	0	113	N842 A843 D844 S850	N842-K846 WeakPolarHBondContact O-CG 3.4Å; N842-K846 PolarHBondContact O-N 2.77Å; A843-K846 WeakPolarHBondContact O-CB 3.38Å; A843-K846 PolarHBondContact O-N 3.25Å; D844-K846 VanDerWaalsContact C-N 3.3Å; K846-S850 PolarHBondContact O-N 3.44Å; K846-S850 VanDerWaalsContact O-N 3.09Å
847	T	41.3	Very low	44	Very low	70 Å²	70	95.7 Å²	95.7	43%	0.429	52%	0.517	S	S	.	.	H	α-helix	trans	-69.8	-40	174.2	27	0	0	0	0	111.3	A843 D844 S850 E851	A843-T847 PolarHBondContact O-N 2.92Å; A843-T847 PolarHBondContact O-OG1 2.89Å; D844-T847 VanDerWaalsContact CA-OG1 3.26Å; D844-T847 WeakPolarHBondContact CA-OG1 3.42Å; D844-T847 PolarHBondContact O-N 2.91Å; D844-T847 PolarHBondContact O-OG1 3.36Å; D844-T847 VanDerWaalsContact O-OG1 3.13Å; T847-S850 WeakPolarHBondContact CA-OG 3.41Å; T847-S850 PolarHBondContact O-N 2.99Å; T847-S850 PolarHBondContact O-OG 3.24Å; T847-E851 PolarHBondContact O-N 3.02Å
848	K	43.2	Very low	42.4	Very low	129 Å²	129	101.5 Å²	101.5	56%	0.561	54%	0.541	S	S	*	.	H	α-helix	trans	-62.1	-43	171.9	-75	-179.1	177.1	-173.7	0	113.1	D844 S850 E851 D852	D844-K848 WeakPolarHBondContact O-CB 3.41Å; D844-K848 WeakPolarHBondContact O-CG 3.46Å; D844-K848 PolarHBondContact O-N 2.88Å; K848-S850 PolarHBondContact O-N 3.04Å; K848-E851 PolarHBondContact O-N 3.45Å; K848-D852 WeakPolarHBondContact O-CB 3.37Å; K848-D852 PolarHBondContact O-N 3.16Å
849	L	40	Very low	41.1	Very low	109 Å²	109	103.3 Å²	103.3	57%	0.571	56%	0.556	S	S	*	*	H	α-helix	trans	-63.9	-23.3	172.6	-82.3	159.2	0	0	0	113.2	D845 N853	D845-L849 WeakPolarHBondContact O-CB 3.5Å; D845-L849 WeakPolarHBondContact O-CD1 3.46Å; D845-L849 WeakPolarHBondContact O-CG 3.45Å; D845-L849 PolarHBondContact O-N 3.46Å; L849-N853 PolarHBondContact O-ND2 3.37Å
850	S	36	Very low	39.8	Very low	68 Å²	68	106.6 Å²	106.6	48%	0.476	57%	0.568	S	S	.	*	H	α-helix	trans	-86.5	-30	176	71.6	0	0	0	0	113.4	K846 T847 K848 S854	K846-S850 PolarHBondContact O-N 3.44Å; K846-S850 VanDerWaalsContact O-N 3.09Å; T847-S850 WeakPolarHBondContact CA-OG 3.41Å; T847-S850 PolarHBondContact O-N 2.99Å; T847-S850 PolarHBondContact O-OG 3.24Å; K848-S850 PolarHBondContact O-N 3.04Å; S850-S854 PolarHBondContact O-N 3.38Å
851	E	36.5	Very low	38.7	Very low	126 Å²	126	109 Å²	109	59%	0.589	58%	0.584	S	S	*	*	H	α-helix	trans	-75.7	-40.4	174.2	-74.6	178.4	163.9	0	0	111.1	T847 K848 N853 S854 E855	T847-E851 PolarHBondContact O-N 3.02Å; K848-E851 PolarHBondContact O-N 3.45Å; E851-N853 VanDerWaalsContact C-N 3.31Å; E851-N853 PolarHBondContact O-N 3.2Å; E851-S854 WeakPolarHBondContact O-CA 3.22Å; E851-S854 WeakPolarHBondContact O-CB 2.74Å; E851-S854 PolarHBondContact O-N 2.91Å; E851-S854 PolarHBondContact O-OG 3.37Å; E851-E855 PolarHBondContact O-N 3.12Å; E851-E855 VanDerWaalsContact O-N 3.13Å
852	D	39	Very low	37.6	Very low	99 Å²	99	114.3 Å²	114.3	53%	0.529	61%	0.607	S	S	.	*	H	α-helix	trans	-62.6	-36.1	174.2	-76.7	-20.1	0	0	0	112.2	K848 S854 E855 E856	K848-D852 WeakPolarHBondContact O-CB 3.37Å; K848-D852 PolarHBondContact O-N 3.16Å; D852-S854 PolarHBondContact O-N 2.87Å; D852-E855 PolarHBondContact O-N 3.41Å; D852-E856 PolarHBondContact O-N 3.5Å; D852-E856 VanDerWaalsContact O-N 3.16Å
853	N	37.7	Very low	36.4	Very low	109 Å²	109	118.6 Å²	118.6	58%	0.583	62%	0.623	S	S	*	*	H	α-helix	trans	-71.8	-15.3	174.2	-81.9	-46.5	0	0	0	113.4	L849 E851	L849-N853 PolarHBondContact O-ND2 3.37Å; E851-N853 VanDerWaalsContact C-N 3.31Å; E851-N853 PolarHBondContact O-N 3.2Å
854	S	32.2	Very low	35.5	Very low	66 Å²	66	124.7 Å²	124.7	46%	0.462	64%	0.643	S	S	.	*	H	α-helix	trans	-92.8	-24.6	177.3	78.9	0	0	0	0	112.9	S850 E851 D852	S850-S854 PolarHBondContact O-N 3.38Å; E851-S854 WeakPolarHBondContact O-CA 3.22Å; E851-S854 WeakPolarHBondContact O-CB 2.74Å; E851-S854 PolarHBondContact O-N 2.91Å; E851-S854 PolarHBondContact O-OG 3.37Å; D852-S854 PolarHBondContact O-N 2.87Å
855	E	34.9	Very low	34.6	Very low	145 Å²	145	131 Å²	131	68%	0.678	67%	0.67	S	S	*	*	H	α-helix	trans	-83.6	-31.1	173	-71.2	-165.9	155.7	0	0	112.6	E851 D852 A857 K858	E851-E855 PolarHBondContact O-N 3.12Å; E851-E855 VanDerWaalsContact O-N 3.13Å; D852-E855 PolarHBondContact O-N 3.41Å; E855-A857 VanDerWaalsContact C-N 3.26Å; E855-A857 PolarHBondContact O-N 3Å; E855-K858 PolarHBondContact O-N 2.88Å
856	E	32.2	Very low	33.3	Very low	152 Å²	152	132.2 Å²	132.2	71%	0.71	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-19.9	172	-79	-169.9	155.2	0	0	113.6	D852	D852-E856 PolarHBondContact O-N 3.5Å; D852-E856 VanDerWaalsContact O-N 3.16Å
857	A	29.6	Very low	32.3	Very low	80 Å²	80	131.2 Å²	131.2	66%	0.661	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-8.6	177.3	0	0	0	0	0	114.3	E855	E855-A857 VanDerWaalsContact C-N 3.26Å; E855-A857 PolarHBondContact O-N 3Å
858	K	29.1	Very low	31.5	Very low	186 Å²	186	134 Å²	134	81%	0.809	70%	0.696	S	S	*	*	S	Bend	trans	-107.3	1.1	178.5	-81.9	-177.7	177	175.4	0	114.5	E855	E855-K858 PolarHBondContact O-N 2.88Å
859	A	30.2	Very low	30.6	Very low	84 Å²	84	133 Å²	133	69%	0.694	71%	0.705	S	S	*	*	S	Bend	trans	-97.3	11.5	178.9	0	0	0	0	0	114.4
860	Q	31.7	Very low	29.8	Very low	176 Å²	176	132.6 Å²	132.6	82%	0.822	72%	0.717	S	S	*	*	S	Bend	trans	-129.3	54.3	175.6	-70.2	-173.9	-1.3	0	0	112.1
861	Q	32	Very low	29.3	Very low	174 Å²	174	137.1 Å²	137.1	81%	0.813	74%	0.735	S	S	*	*	S	Bend	trans	-158.8	134.9	157.7	-110.1	159.3	10.8	0	0	107.4
862	D	26.6	Very low	29.3	Very low	160 Å²	160	136 Å²	136	86%	0.856	74%	0.739	S	S	*	*			trans	95.3	63.9	176.5	-51.8	-20.1	0	0	0	117.2
863	E	26.6	Very low	28.6	Very low	184 Å²	184	139.1 Å²	139.1	86%	0.86	75%	0.75	S	S	*	*			trans	-93.1	109.5	135.8	-80.2	-171.8	165.2	0	0	108.3
864	H	26.2	Very low	28	Very low	180 Å²	180	141.1 Å²	141.1	83%	0.833	76%	0.759	S	S	*	*			trans	160.7	103.8	142.4	-89.2	-60.7	0	0	0	109.9
865	E	25.1	Very low	27.6	Very low	198 Å²	198	142.3 Å²	142.3	93%	0.925	77%	0.773	S	S	*	*				175.9	146.3	117.5	-96.7	-179.2	173.8	0	0	111.1
866	T	23.7	Very low	27.1	Very low	124 Å²	124	143.7 Å²	143.7	76%	0.761	78%	0.779	S	S	*	*			trans	-90.8	156.1	-163.8	41.1	0	0	0	0	114.2
867	D	24.1	Very low	26.9	Very low	137 Å²	137	145 Å²	145	73%	0.733	79%	0.785	S	S	*	*			trans	92.7	131.2	137.3	-91.4	-0.7	0	0	0	122.8
868	N	25	Very low	26.7	Very low	129 Å²	129	148.3 Å²	148.3	69%	0.69	79%	0.792	S	S	*	*			trans	94.6	100.4	141.7	-71.6	-29	0	0	0	122.3
869	S	23.4	Very low	26.7	Very low	108 Å²	108	145 Å²	145	76%	0.755	79%	0.789	S	S	*	*				66.3	133.2	115.2	75.9	0	0	0	0	122.1
870	A	24.6	Very low	26.5	Very low	100 Å²	100	150.3 Å²	150.3	83%	0.826	80%	0.8	S	S	*	*			trans	107.3	106.2	145.8	0	0	0	0	0	118.2
871	L	25.3	Very low	26.2	Very low	163 Å²	163	151 Å²	151	85%	0.853	80%	0.8	S	S	*	*			trans	-74.3	162.2	142.8	-82.2	161.7	0	0	0	108.5
872	P	36.3	Very low	26.1	Very low	102 Å²	102	148.8 Å²	148.8	66%	0.662	80%	0.801	S	S	*	*			cis	-158	172.1	41.9	43.1	-20.5	0	0	0	121
873	H	25.1	Very low	26	Very low	165 Å²	165	148.4 Å²	148.4	76%	0.764	80%	0.799	S	S	*	*			trans	84.1	122.8	137.8	-82.8	-46.3	0	0	0	125.2
874	I	24.8	Very low	26	Very low	150 Å²	150	148.7 Å²	148.7	77%	0.769	80%	0.8	S	S	*	*			trans	89	113.7	133.8	-60.3	159.2	0	0	0	120
875	A	22.3	Very low	25.9	Very low	91 Å²	91	146.8 Å²	146.8	75%	0.752	80%	0.796	S	S	*	*				159.3	129.3	109.1	0	0	0	0	0	114.2
876	E	26	Very low	25.9	Very low	174 Å²	174	146.3 Å²	146.3	81%	0.813	80%	0.796	S	S	*	*			trans	-12.9	138.2	154.4	-64	164.4	173.3	0	0	120.2
877	H	26.5	Very low	25.9	Very low	179 Å²	179	148.5 Å²	148.5	83%	0.829	80%	0.798	S	S	*	*				-178.5	123.5	107.2	-118	-73.8	0	0	0	112.6
878	D	25.8	Very low	25.9	Very low	150 Å²	150	150.3 Å²	150.3	80%	0.802	80%	0.802	S	S	*	*			trans	-76.8	157.9	157.1	-74.5	-43.5	0	0	0	110.4
879	P	29.1	Very low	25.9	Very low	116 Å²	116	150.1 Å²	150.1	75%	0.753	81%	0.81	S	S	*	*			trans	-107.8	133.8	150	21.1	-3.5	0	0	0	112.2
880	E	25.7	Very low	25.8	Very low	197 Å²	197	155.7 Å²	155.7	92%	0.921	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-67	142.2	-177.5	-64.3	164	147	0	0	113.8
881	F	26.6	Very low	25.7	Very low	190 Å²	190	158.8 Å²	158.8	83%	0.833	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-92.1	142.9	161	-76.8	-91.2	0	0	0	109.3	D883	F881-D883 PolarHBondContact O-N 3.42Å
882	P	30.5	Very low	25.5	Very low	127 Å²	127	155.9 Å²	155.9	83%	0.825	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-82.9	117.3	172.8	10	5.7	0	0	0	110.9
883	D	24	Very low	24.8	Very low	153 Å²	153	155.9 Å²	155.9	82%	0.818	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-67.8	137	162.5	-79	-38.6	0	0	0	110.3	F881	F881-D883 PolarHBondContact O-N 3.42Å
884	H	26.8	Very low	24.8	Very low	190 Å²	190	156 Å²	156	88%	0.88	82%	0.819	S	S	*	*			trans	-127.3	118.3	156.2	-117.5	-56	0	0	0	109.4
885	D	24.2	Very low	24.8	Very low	140 Å²	140	158 Å²	158	75%	0.749	83%	0.825	S	S	*	*			trans	-56.3	137.3	-177.6	-57.1	-59.5	0	0	0	114.3
886	M	24	Very low	24.9	Very low	187 Å²	187	161.2 Å²	161.2	92%	0.921	83%	0.828	S	S	*	*			trans	-145.4	106.3	141.5	-81.4	-60.9	-80.5	0	0	109.2
887	E	23.6	Very low	24.7	Very low	171 Å²	171	160.4 Å²	160.4	80%	0.799	83%	0.829	S	S	*	*			trans	-71.8	150.5	172.9	-102.2	179.8	157.1	0	0	113.4
888	E	25.2	Very low	24.8	Very low	175 Å²	175	160.9 Å²	160.9	82%	0.818	83%	0.829	S	S	*	*			trans	63.7	102.7	151.7	-70.3	-169.2	145.2	0	0	121.3
889	S	23.6	Very low	24.6	Very low	124 Å²	124	158.6 Å²	158.6	87%	0.867	82%	0.824	S	S	*	*				-161.2	99.9	107	31.7	0	0	0	0	112.1
890	R	22.4	Very low	24.4	Very low	226 Å²	226	164.6 Å²	164.6	85%	0.853	83%	0.832	S	S	*	*			trans	-68.1	148.4	146.9	-66.9	175.6	177.1	170.1	0.5	106.2
891	E	22.1	Very low	24.2	Very low	165 Å²	165	160.9 Å²	160.9	77%	0.771	82%	0.823	S	S	*	*			cis	-176	140	37	-139.2	165.1	-136.3	0	0	107.5
892	A	22.1	Very low	23.9	Very low	102 Å²	102	156.1 Å²	156.1	84%	0.843	81%	0.813	S	S	*	*			trans	-168.5	84.2	145.1	0	0	0	0	0	108.8
893	S	21.6	Very low	23.6	Very low	102 Å²	102	156.4 Å²	156.4	71%	0.713	82%	0.816	S	S	*	*			trans	-61	126.4	174.5	-53.1	0	0	0	0	111.8
894	L	24	Very low	23.6	Very low	168 Å²	168	154.7 Å²	154.7	88%	0.88	81%	0.811	S	S	*	*			trans	-114.8	115.2	150.8	-85.9	163.2	0	0	0	107.4	I896	L894-I896 PolarHBondContact O-N 3.11Å
895	H	24.5	Very low	23.8	Very low	190 Å²	190	152.9 Å²	152.9	88%	0.88	80%	0.8	S	S	*	*			trans	-51.3	117.7	176.8	-81.4	-87.9	0	0	0	111.1
896	I	24.9	Very low	24.4	Very low	159 Å²	159	152.3 Å²	152.3	82%	0.815	80%	0.796	S	S	*	*			trans	-114.7	121.3	155.8	-63.8	177.1	0	0	0	106.3	L894 K898	L894-I896 PolarHBondContact O-N 3.11Å; I896-K898 PolarHBondContact O-N 3.43Å
897	D	22.1	Very low	25.3	Very low	158 Å²	158	148.4 Å²	148.4	85%	0.845	78%	0.783	S	S	*	*			trans	-52.2	125.7	-175.6	-104.2	-35.1	0	0	0	112.2	S899	D897-S899 PolarHBondContact O-N 3.29Å
898	K	27.4	Very low	27	Very low	188 Å²	188	142.3 Å²	142.3	82%	0.817	76%	0.76	S	S	*	*			trans	-83.9	95.4	167.1	-76.8	178.4	176.1	177.5	0	108.6	I896	I896-K898 PolarHBondContact O-N 3.43Å
899	S	21.7	Very low	29.2	Very low	102 Å²	102	135.5 Å²	135.5	71%	0.713	73%	0.731	S	S	*	*			trans	-106.4	103.8	156.1	55.8	0	0	0	0	108.9	D897 T901	D897-S899 PolarHBondContact O-N 3.29Å; S899-T901 PolarHBondContact O-N 3.13Å
900	W	24.7	Very low	31.6	Very low	242 Å²	242	130 Å²	130	92%	0.917	69%	0.692	S	S	*	*			trans	-62.1	120.6	170.6	-78.9	63.7	0	0	0	109.2
901	T	21.8	Very low	34.1	Very low	119 Å²	119	119.7 Å²	119.7	73%	0.73	65%	0.654	S	S	*	*			trans	-130.6	142.4	158.1	47.7	0	0	0	0	108.4	S899	S899-T901 PolarHBondContact O-N 3.13Å
902	S	21.1	Very low	36.8	Very low	90 Å²	90	112.8 Å²	112.8	63%	0.629	62%	0.623	S	S	*	*			trans	-30.7	155.7	180	48.6	0	0	0	0	116.4	T904	S902-T904 PolarHBondContact O-N 3.19Å
903	P	23.5	Very low	39.6	Very low	134 Å²	134	110.2 Å²	110.2	87%	0.87	59%	0.593	S	S	*	*			trans	-57.1	101.3	179.3	25.2	-33.2	0	0	0	109.8	K905	P903-K905 PolarHBondContact O-N 3.06Å
904	T	25.1	Very low	42.5	Very low	116 Å²	116	105.4 Å²	105.4	71%	0.712	56%	0.559	S	S	*	*			trans	-70.6	112.6	173.9	34.9	0	0	0	0	107.1	S902 L906	S902-T904 PolarHBondContact O-N 3.19Å; T904-L906 PolarHBondContact O-N 3.17Å
905	K	31.2	Very low	45.5	Very low	152 Å²	152	97.4 Å²	97.4	66%	0.661	52%	0.518	S	S	*	.			trans	-43.4	122	167.7	-110.1	173	169.4	-177.9	0	108.7	D844 P903 T907	D844-K905 IonicContact OD2-NZ 2.82Å; D844-K905 PolarHBondContact OD2-NZ 3.09Å; P903-K905 PolarHBondContact O-N 3.06Å; K905-T907 PolarHBondContact O-N 3.39Å
906	L	35.4	Very low	48.5	Very low	128 Å²	128	94.4 Å²	94.4	67%	0.67	50%	0.502	S	S	*	.			trans	-58.6	117.2	178.8	-90.6	89.3	0	0	0	109.9	T904 S908 M944	T904-L906 PolarHBondContact O-N 3.17Å; L906-S908 PolarHBondContact O-N 3.36Å; L906-M944 HydrophobicContact CD2-CE 3.86Å
907	T	43.6	Very low	51.6	Low	106 Å²	106	88.1 Å²	88.1	65%	0.65	47%	0.469	S	S	*	.			trans	-79.3	113.3	167.9	42.4	0	0	0	0	108.3	K905	K905-T907 PolarHBondContact O-N 3.39Å
908	S	58.7	Low	54.7	Low	43 Å²	43	80.6 Å²	80.6	30%	0.301	43%	0.428	S	S	.	.			trans	-69.3	141.7	171.7	52.6	0	0	0	0	109.5	F833 L906	F833-S908 WeakPolarHBondContact CE1-O 3.47Å; F833-S908 VanDerWaalsContact CE2-OG 3.28Å; F833-S908 WeakPolarHBondContact CE2-OG 3.38Å; F833-S908 WeakPolarHBondContact CZ-O 3.25Å; F833-S908 VanDerWaalsContact CZ-OG 3.22Å; F833-S908 WeakPolarHBondContact CZ-OG 3.17Å; L906-S908 PolarHBondContact O-N 3.36Å
909	S	71.1	Confident	57.7	Low	31 Å²	31	72 Å²	72	22%	0.217	39%	0.391	C	S	.	.			trans	-83.5	156.6	171.4	174.2	0	0	0	0	110.8	F911 T912 Q913 E934	S909-F911 PolarHBondContact O-N 3.5Å; S909-F911 PolarHBondContact OG-N 2.73Å; S909-T912 WeakPolarHBondContact CB-OG1 3.26Å; S909-T912 PolarHBondContact N-OG1 2.88Å; S909-T912 WeakPolarHBondContact O-CB 3.27Å; S909-T912 PolarHBondContact O-N 3.3Å; S909-Q913 PolarHBondContact O-N 3.34Å; S909-E934 VanDerWaalsContact CB-CD 3.41Å; S909-E934 WeakPolarHBondContact CB-OE1 3.39Å; S909-E934 WeakPolarHBondContact CB-OE2 3.42Å; S909-E934 PolarHBondContact OG-OE2 3.18Å
910	I	73.9	Confident	60.9	Low	10 Å²	10	73 Å²	73	5%	0.051	39%	0.385	C	S	.	.	H	α-helix	trans	-56.4	-35	172.6	58.6	175.3	0	0	0	111.6	V739 T743 F826 A829 F833 T914	V739-I910 HydrophobicContact CG1-CB 3.74Å; V739-I910 HydrophobicContact CG1-CG2 3.77Å; T743-I910 HydrophobicContact CG2-CB 3.88Å; T743-I910 HydrophobicContact CG2-CD1 4.15Å; T743-I910 HydrophobicContact CG2-CG1 4.14Å; F826-I910 HydrophobicContact CD2-CD1 3.67Å; F826-I910 HydrophobicContact CE2-CD1 3.59Å; F826-I910 HydrophobicContact CG-CD1 4.46Å; F826-I910 HydrophobicContact CZ-CD1 4.33Å; A829-I910 HydrophobicContact CB-CD1 4.11Å; A829-I910 HydrophobicContact CB-CG2 4.38Å; F833-I910 HydrophobicContact CB-CG2 3.68Å; F833-I910 HydrophobicContact CD1-CG2 4.33Å; F833-I910 HydrophobicContact CD2-CG2 4.21Å; F833-I910 HydrophobicContact CG-CG2 3.79Å; I910-T914 PolarHBondContact O-N 3.03Å; I910-T914 PolarHBondContact O-OG1 2.95Å
911	F	75.4	Confident	64.1	Low	9 Å²	9	62 Å²	62	4%	0.039	34%	0.344	C	S	.	.	H	α-helix	trans	-74.3	-33.4	176.5	-60.8	-68.9	0	0	0	111.7	L747 F826 S909 Q913 T914 L915 Q933 E934	L747-F911 HydrophobicContact CD2-CE1 4.33Å; F826-F911 HydrophobicContact CD2-CE2 4.37Å; F826-F911 HydrophobicContact CD2-CZ 4.03Å; F826-F911 AromaticContact CE2-CE2 3.8Å; F826-F911 HydrophobicContact CE2-CE2 3.8Å; F826-F911 AromaticContact CE2-CZ 3.92Å; F826-F911 HydrophobicContact CE2-CZ 3.92Å; S909-F911 PolarHBondContact O-N 3.5Å; S909-F911 PolarHBondContact OG-N 2.73Å; F911-Q913 VanDerWaalsContact C-N 3.34Å; F911-Q913 PolarHBondContact O-N 3.1Å; F911-T914 PolarHBondContact O-N 3.35Å; F911-L915 VanDerWaalsContact O-CB 3.25Å; F911-L915 WeakPolarHBondContact O-CB 3.05Å; F911-L915 WeakPolarHBondContact O-CG 3.47Å; F911-L915 PolarHBondContact O-N 3.41Å; F911-Q933 HydrophobicContact CD1-CB 4.1Å; F911-Q933 HydrophobicContact CD2-CB 4.2Å; F911-Q933 HydrophobicContact CE1-CB 3.77Å; F911-Q933 HydrophobicContact CE1-CG 4.32Å; F911-Q933 HydrophobicContact CE2-CB 3.86Å; F911-Q933 HydrophobicContact CG-CB 4.31Å; F911-Q933 HydrophobicContact CZ-CB 3.65Å; F911-Q933 HydrophobicContact CZ-CG 4.34Å; F911-E934 HydrophobicContact CB-CB 4.03Å; F911-E934 WeakPolarHBondContact CB-OE2 3.46Å
912	T	78.9	Confident	67.3	Low	20 Å²	20	57 Å²	57	12%	0.123	31%	0.313	C	S	.	.	H	α-helix	trans	-59.9	-42.7	174.9	-42.8	0	0	0	0	112.1	S909 L915 K916 E934 A945	S909-T912 WeakPolarHBondContact CB-OG1 3.26Å; S909-T912 PolarHBondContact N-OG1 2.88Å; S909-T912 WeakPolarHBondContact O-CB 3.27Å; S909-T912 PolarHBondContact O-N 3.3Å; T912-L915 PolarHBondContact O-N 3.34Å; T912-K916 PolarHBondContact O-N 3.06Å; T912-K916 VanDerWaalsContact O-N 3.11Å; T912-E934 PolarHBondContact OG1-OE1 3.25Å; T912-A945 HydrophobicContact CG2-CB 3.73Å
913	Q	80.4	Confident	70.5	Confident	48 Å²	48	52.8 Å²	52.8	22%	0.224	28%	0.283	C	S	.	.	H	α-helix	trans	-65.6	-42	178	-176.6	169.2	-9.4	0	0	111.6	E740 S909 F911 K916 F917	E740-Q913 HydrophobicContact CG-CG 4.2Å; E740-Q913 VanDerWaalsContact OE1-CG 3.27Å; E740-Q913 WeakPolarHBondContact OE1-CG 3.36Å; E740-Q913 PolarHBondContact OE1-NE2 3.33Å; S909-Q913 PolarHBondContact O-N 3.34Å; F911-Q913 VanDerWaalsContact C-N 3.34Å; F911-Q913 PolarHBondContact O-N 3.1Å; Q913-K916 WeakPolarHBondContact O-CB 3.47Å; Q913-K916 PolarHBondContact O-N 3.28Å; Q913-F917 PolarHBondContact O-N 3.01Å
914	T	83.6	Confident	73.4	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.7	-38.4	177.4	-47.9	0	0	0	0	112.1	T743 L744 L747 I910 F911 K916 F917 L918	T743-T914 VanDerWaalsContact CB-OG1 3.24Å; T743-T914 WeakPolarHBondContact CB-OG1 3.49Å; T743-T914 WeakPolarHBondContact CG2-OG1 3.33Å; T743-T914 WeakPolarHBondContact OG1-CB 3.3Å; T743-T914 WeakPolarHBondContact OG1-CG2 3.47Å; T743-T914 PolarHBondContact OG1-OG1 3.3Å; L744-T914 HydrophobicContact CD2-CG2 3.98Å; L744-T914 HydrophobicContact CG-CG2 3.95Å; L747-T914 HydrophobicContact CD1-CG2 4.49Å; I910-T914 PolarHBondContact O-N 3.03Å; I910-T914 PolarHBondContact O-OG1 2.95Å; F911-T914 PolarHBondContact O-N 3.35Å; T914-K916 VanDerWaalsContact C-N 3.34Å; T914-K916 PolarHBondContact O-N 3.42Å; T914-F917 WeakPolarHBondContact O-CB 3.44Å; T914-F917 PolarHBondContact O-N 3.07Å; T914-L918 HydrophobicContact CG2-CD1 4.04Å; T914-L918 HydrophobicContact CG2-CG 4.46Å; T914-L918 WeakPolarHBondContact O-CG 3.47Å; T914-L918 PolarHBondContact O-N 3.25Å
915	L	85.9	Confident	76.1	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-59.7	-45	175.1	-82.4	167.7	0	0	0	111.3	F911 T912 F917 L918 L919 A927 A930 L931	F911-L915 VanDerWaalsContact O-CB 3.25Å; F911-L915 WeakPolarHBondContact O-CB 3.05Å; F911-L915 WeakPolarHBondContact O-CG 3.47Å; F911-L915 PolarHBondContact O-N 3.41Å; T912-L915 PolarHBondContact O-N 3.34Å; L915-F917 VanDerWaalsContact C-N 3.3Å; L915-F917 PolarHBondContact O-N 2.99Å; L915-L918 PolarHBondContact O-N 3.23Å; L915-L919 WeakPolarHBondContact O-CB 3.43Å; L915-L919 WeakPolarHBondContact O-CG 3.22Å; L915-L919 PolarHBondContact O-N 2.79Å; L915-A927 HydrophobicContact CD2-CB 4.23Å; L915-A927 WeakPolarHBondContact CD2-O 3.35Å; L915-A930 HydrophobicContact CD2-CB 3.54Å; L915-A930 HydrophobicContact CG-CB 3.76Å; L915-L931 HydrophobicContact CD1-CD2 3.74Å; L915-L931 HydrophobicContact CD1-CG 4.13Å; L915-L931 HydrophobicContact CD2-CB 4.49Å; L915-L931 HydrophobicContact CD2-CD2 4.13Å; L915-L931 HydrophobicContact CD2-CG 3.68Å
916	K	87.8	Confident	78.4	Confident	127 Å²	127	41.2 Å²	41.2	55%	0.552	21%	0.214	S	C	*	.	H	α-helix	trans	-56	-46.1	175	-173.1	176.1	-178.3	174.4	0	111.3	T912 Q913 T914 Q920	T912-K916 PolarHBondContact O-N 3.06Å; T912-K916 VanDerWaalsContact O-N 3.11Å; Q913-K916 WeakPolarHBondContact O-CB 3.47Å; Q913-K916 PolarHBondContact O-N 3.28Å; T914-K916 VanDerWaalsContact C-N 3.34Å; T914-K916 PolarHBondContact O-N 3.42Å; K916-Q920 WeakPolarHBondContact O-CB 3.42Å; K916-Q920 WeakPolarHBondContact O-CG 3.4Å; K916-Q920 PolarHBondContact O-N 2.71Å
917	F	89.9	Confident	80.7	Confident	26 Å²	26	35.1 Å²	35.1	11%	0.114	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-46.3	176.6	175.6	-92.7	0	0	0	112.6	F675 P706 M709 M710 E740 L744 Q913 T914 L915 Q920 N921	F675-F917 HydrophobicContact CZ-CE2 4.24Å; F675-F917 HydrophobicContact CZ-CZ 4.31Å; P706-F917 HydrophobicContact CB-CE2 4.35Å; M709-F917 HydrophobicContact CB-CE1 4.41Å; M709-F917 HydrophobicContact CB-CZ 4.41Å; M709-F917 HydrophobicContact CE-CD1 3.84Å; M709-F917 HydrophobicContact CE-CD2 3.92Å; M709-F917 HydrophobicContact CE-CE1 3.39Å; M709-F917 HydrophobicContact CE-CE2 3.45Å; M709-F917 VanDerWaalsContact CE-CE2 3.45Å; M709-F917 HydrophobicContact CE-CG 4.1Å; M709-F917 HydrophobicContact CE-CZ 3.17Å; M710-F917 HydrophobicContact CG-CE1 4.35Å; M710-F917 HydrophobicContact CG-CZ 4.07Å; M710-F917 HydrophobicContact SD-CE1 3.82Å; M710-F917 HydrophobicContact SD-CZ 4.1Å; E740-F917 HydrophobicContact CG-CB 4.3Å; L744-F917 HydrophobicContact CD1-CD1 4.3Å; L744-F917 HydrophobicContact CD1-CE1 4.21Å; Q913-F917 PolarHBondContact O-N 3.01Å; T914-F917 WeakPolarHBondContact O-CB 3.44Å; T914-F917 PolarHBondContact O-N 3.07Å; L915-F917 VanDerWaalsContact C-N 3.3Å; L915-F917 PolarHBondContact O-N 2.99Å; F917-Q920 PolarHBondContact O-N 3.24Å; F917-N921 WeakPolarHBondContact CE2-ND2 3.45Å; F917-N921 PolarHBondContact O-N 3.38Å; F917-N921 PolarHBondContact O-ND2 3.43Å
918	L	88.5	Confident	82.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.1	-41.4	-178.8	-74.8	168.6	0	0	0	112.3	V713 L744 T914 L915 N921 N922 A923 M926 A927 A930	V713-L918 HydrophobicContact CG2-CD2 4.22Å; L744-L918 HydrophobicContact CD2-CD1 3.96Å; L744-L918 HydrophobicContact CD2-CD2 3.71Å; L744-L918 HydrophobicContact CD2-CG 4.04Å; T914-L918 HydrophobicContact CG2-CD1 4.04Å; T914-L918 HydrophobicContact CG2-CG 4.46Å; T914-L918 WeakPolarHBondContact O-CG 3.47Å; T914-L918 PolarHBondContact O-N 3.25Å; L915-L918 PolarHBondContact O-N 3.23Å; L918-N921 CarbonylContact O-C 3.56Å; L918-N921 PolarHBondContact O-N 3.09Å; L918-N922 PolarHBondContact O-N 3.14Å; L918-N922 VanDerWaalsContact O-N 3.07Å; L918-A923 HydrophobicContact CB-CB 4.43Å; L918-A923 HydrophobicContact CD2-CB 3.61Å; L918-A923 PolarHBondContact O-N 3.09Å; L918-M926 HydrophobicContact CD1-CB 4.04Å; L918-M926 HydrophobicContact CD2-CB 3.75Å; L918-A927 HydrophobicContact CB-CB 4.03Å; L918-A930 HydrophobicContact CD1-CB 4.15Å
919	L	89.8	Confident	83.1	Confident	8 Å²	8	33.8 Å²	33.8	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-68.4	-42	177.7	-67.4	171.3	0	0	0	111.5	L915 N921 N922 A927 Q952 F953 L956	L915-L919 WeakPolarHBondContact O-CB 3.43Å; L915-L919 WeakPolarHBondContact O-CG 3.22Å; L915-L919 PolarHBondContact O-N 2.79Å; L919-N921 PolarHBondContact O-N 3.46Å; L919-N922 PolarHBondContact O-N 3.09Å; L919-N922 VanDerWaalsContact O-N 3.12Å; L919-A927 HydrophobicContact CD2-CB 3.98Å; L919-A927 HydrophobicContact CG-CB 4.41Å; L919-Q952 HydrophobicContact CD1-CB 3.99Å; L919-F953 HydrophobicContact CD2-CB 3.86Å; L919-F953 HydrophobicContact CD2-CD2 4.27Å; L919-L956 HydrophobicContact CB-CD1 4.46Å; L919-L956 HydrophobicContact CD2-CD1 4.12Å
920	Q	89.3	Confident	83.4	Confident	124 Å²	124	32.3 Å²	32.3	58%	0.579	15%	0.153	S	C	*	.	H	α-helix	trans	-60.1	-28.7	174.5	-76.8	175.7	-13.3	0	0	113.3	K916 F917	K916-Q920 WeakPolarHBondContact O-CB 3.42Å; K916-Q920 WeakPolarHBondContact O-CG 3.4Å; K916-Q920 PolarHBondContact O-N 2.71Å; F917-Q920 PolarHBondContact O-N 3.24Å
921	N	90.6	Very high	83.3	Confident	10 Å²	10	32.3 Å²	32.3	5%	0.053	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	11.7	179.3	-66.5	-74.9	0	0	0	113.5	F675 S679 M682 M710 F917 L918 L919 A923	F675-N921 WeakPolarHBondContact CZ-OD1 3.36Å; S679-N921 PolarHBondContact OG-OD1 3.2Å; M682-N921 WeakPolarHBondContact CB-O 3.37Å; M710-N921 HydrophobicContact CE-CB 3.89Å; M710-N921 HydrophobicContact SD-CB 3.78Å; F917-N921 WeakPolarHBondContact CE2-ND2 3.45Å; F917-N921 PolarHBondContact O-N 3.38Å; F917-N921 PolarHBondContact O-ND2 3.43Å; L918-N921 CarbonylContact O-C 3.56Å; L918-N921 PolarHBondContact O-N 3.09Å; L919-N921 PolarHBondContact O-N 3.46Å; N921-A923 PolarHBondContact O-N 3.28Å
922	N	88.9	Confident	83.1	Confident	14 Å²	14	33.4 Å²	33.4	8%	0.075	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	29.7	176.1	-50.7	-59.8	0	0	0	114.3	S679 M682 L683 L918 L919 L924	S679-N922 PolarHBondContact O-ND2 3.05Å; M682-N922 HydrophobicContact CB-CB 4.12Å; L683-N922 HydrophobicContact CB-CB 4.31Å; L683-N922 WeakPolarHBondContact CB-ND2 3.35Å; L683-N922 HydrophobicContact CD1-CB 4.41Å; L918-N922 PolarHBondContact O-N 3.14Å; L918-N922 VanDerWaalsContact O-N 3.07Å; L919-N922 PolarHBondContact O-N 3.09Å; L919-N922 VanDerWaalsContact O-N 3.12Å; N922-L924 VanDerWaalsContact C-N 3.28Å; N922-L924 PolarHBondContact O-N 3Å
923	A	88.5	Confident	82.8	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.008	16%	0.164	C	C	.	.			trans	-85	65.1	177.1	0	0	0	0	0	111.3	M682 M710 V713 L918 N921 Q925 M926 A927	M682-A923 HydrophobicContact CE-CB 4.32Å; M710-A923 HydrophobicContact CE-CB 4.22Å; V713-A923 HydrophobicContact CG1-CB 3.89Å; L918-A923 HydrophobicContact CB-CB 4.43Å; L918-A923 HydrophobicContact CD2-CB 3.61Å; L918-A923 PolarHBondContact O-N 3.09Å; N921-A923 PolarHBondContact O-N 3.28Å; A923-Q925 PolarHBondContact O-N 3.18Å; A923-M926 PolarHBondContact O-N 3.47Å; A923-A927 WeakPolarHBondContact O-CB 3.46Å; A923-A927 PolarHBondContact O-N 2.99Å
924	L	85.1	Confident	82.3	Confident	54 Å²	54	32.2 Å²	32.2	28%	0.283	16%	0.155	S	C	.	.	H	α-helix	trans	-58.6	-40.8	-168.7	-60	-179.2	0	0	0	113.9	N922 M926 A927 E928 F953 L956	N922-L924 VanDerWaalsContact C-N 3.28Å; N922-L924 PolarHBondContact O-N 3Å; L924-M926 PolarHBondContact O-N 3Å; L924-A927 PolarHBondContact O-N 2.98Å; L924-E928 PolarHBondContact O-N 3.16Å; L924-F953 HydrophobicContact CB-CE2 4.07Å; L924-F953 HydrophobicContact CD2-CD2 4.09Å; L924-F953 HydrophobicContact CD2-CE2 4.32Å; L924-F953 WeakPolarHBondContact O-CE2 3.39Å; L924-L956 HydrophobicContact CD2-CB 3.74Å; L924-L956 HydrophobicContact CD2-CD1 3.99Å
925	Q	81.6	Confident	81.5	Confident	102 Å²	102	36 Å²	36	48%	0.477	17%	0.174	S	C	.	.	H	α-helix	trans	-61.3	-46.4	-179.4	-68	178.9	-8.8	0	0	112.3	A923 E928 H929	A923-Q925 PolarHBondContact O-N 3.18Å; Q925-E928 PolarHBondContact O-N 2.98Å; Q925-H929 PolarHBondContact O-CD2 3.5Å; Q925-H929 PolarHBondContact O-N 3.4Å
926	M	80.2	Confident	80.4	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.02	20%	0.203	C	C	.	.	H	α-helix	trans	-72.5	-31.7	177.6	-69	-64.5	-81.5	0	0	111.7	V713 V716 L744 L747 L918 A923 L924 H929 A930	V713-M926 HydrophobicContact CG1-CG 3.9Å; V713-M926 HydrophobicContact CG2-CG 4.37Å; V716-M926 HydrophobicContact CG1-SD 4.19Å; L744-M926 HydrophobicContact CD2-CE 4.47Å; L747-M926 HydrophobicContact CB-CE 3.83Å; L918-M926 HydrophobicContact CD1-CB 4.04Å; L918-M926 HydrophobicContact CD2-CB 3.75Å; A923-M926 PolarHBondContact O-N 3.47Å; L924-M926 PolarHBondContact O-N 3Å; M926-H929 PolarHBondContact O-N 3.08Å; M926-A930 PolarHBondContact O-N 2.62Å
927	A	82.9	Confident	78.9	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-39.5	174.4	0	0	0	0	0	111.8	L915 L918 L919 A923 L924 H929 A930 L931 F953	L915-A927 HydrophobicContact CD2-CB 4.23Å; L915-A927 WeakPolarHBondContact CD2-O 3.35Å; L918-A927 HydrophobicContact CB-CB 4.03Å; L919-A927 HydrophobicContact CD2-CB 3.98Å; L919-A927 HydrophobicContact CG-CB 4.41Å; A923-A927 WeakPolarHBondContact O-CB 3.46Å; A923-A927 PolarHBondContact O-N 2.99Å; L924-A927 PolarHBondContact O-N 2.98Å; A927-H929 VanDerWaalsContact C-N 3.35Å; A927-H929 PolarHBondContact O-N 2.93Å; A927-A930 PolarHBondContact O-N 3.2Å; A927-L931 WeakPolarHBondContact O-CG 3.17Å; A927-L931 PolarHBondContact O-N 3.44Å; A927-F953 HydrophobicContact CB-CD2 4.24Å
928	E	79.7	Confident	76.8	Confident	71 Å²	71	41.9 Å²	41.9	33%	0.332	23%	0.23	S	C	.	.	H	α-helix	trans	-61.1	-43.4	174.5	-174.3	169.9	-163.4	0	0	111.7	L924 Q925 L931 S932 F953	L924-E928 PolarHBondContact O-N 3.16Å; Q925-E928 PolarHBondContact O-N 2.98Å; E928-L931 PolarHBondContact O-N 3.01Å; E928-S932 PolarHBondContact O-N 2.88Å; E928-F953 HydrophobicContact CB-CE2 4.02Å; E928-F953 HydrophobicContact CB-CZ 3.86Å; E928-F953 HydrophobicContact CG-CZ 4.18Å
929	H	72.9	Confident	74.8	Confident	50 Å²	50	50.7 Å²	50.7	23%	0.231	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-45.1	173.8	-71.2	-56.2	0	0	0	112.1	L747 Q925 M926 A927 L931 S932 Q933	L747-H929 HydrophobicContact CD2-CB 4.22Å; Q925-H929 PolarHBondContact O-CD2 3.5Å; Q925-H929 PolarHBondContact O-N 3.4Å; M926-H929 PolarHBondContact O-N 3.08Å; A927-H929 VanDerWaalsContact C-N 3.35Å; A927-H929 PolarHBondContact O-N 2.93Å; H929-L931 PolarHBondContact O-N 3.19Å; H929-S932 PolarHBondContact O-N 3.42Å; H929-S932 PolarHBondContact O-OG 3.43Å; H929-Q933 WeakPolarHBondContact O-CG 3.47Å; H929-Q933 PolarHBondContact O-N 2.99Å; H929-Q933 VanDerWaalsContact O-N 3.09Å
930	A	76.8	Confident	73	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-37.6	177.4	0	0	0	0	0	112.8	L747 L915 L918 M926 A927 Q933 E934	L747-A930 HydrophobicContact CD1-CB 3.75Å; L747-A930 HydrophobicContact CD2-CB 4.46Å; L915-A930 HydrophobicContact CD2-CB 3.54Å; L915-A930 HydrophobicContact CG-CB 3.76Å; L918-A930 HydrophobicContact CD1-CB 4.15Å; M926-A930 PolarHBondContact O-N 2.62Å; A927-A930 PolarHBondContact O-N 3.2Å; A930-Q933 PolarHBondContact O-N 3.18Å; A930-E934 WeakPolarHBondContact O-CB 3.36Å; A930-E934 PolarHBondContact O-N 3.44Å
931	L	73.3	Confident	71.4	Confident	9 Å²	9	46.6 Å²	46.6	5%	0.047	26%	0.262	C	S	.	.	H	α-helix	trans	-62.3	-42.4	173.1	-79.8	168.8	0	0	0	111.3	L915 A927 E928 H929 Q933 E934 L935 Y946 L950 F953	L915-L931 HydrophobicContact CD1-CD2 3.74Å; L915-L931 HydrophobicContact CD1-CG 4.13Å; L915-L931 HydrophobicContact CD2-CB 4.49Å; L915-L931 HydrophobicContact CD2-CD2 4.13Å; L915-L931 HydrophobicContact CD2-CG 3.68Å; A927-L931 WeakPolarHBondContact O-CG 3.17Å; A927-L931 PolarHBondContact O-N 3.44Å; E928-L931 PolarHBondContact O-N 3.01Å; H929-L931 PolarHBondContact O-N 3.19Å; L931-Q933 VanDerWaalsContact C-N 3.33Å; L931-Q933 PolarHBondContact O-N 3.32Å; L931-E934 PolarHBondContact O-N 2.81Å; L931-L935 PolarHBondContact O-N 3.13Å; L931-L935 VanDerWaalsContact O-N 3.11Å; L931-Y946 HydrophobicContact CD2-CD2 4.1Å; L931-Y946 HydrophobicContact CD2-CE2 3.98Å; L931-L950 HydrophobicContact CD1-CD1 4.03Å; L931-L950 HydrophobicContact CD2-CB 4.37Å; L931-F953 HydrophobicContact CD1-CB 3.85Å; L931-F953 HydrophobicContact CD1-CD1 3.98Å; L931-F953 HydrophobicContact CD1-CD2 4.36Å; L931-F953 HydrophobicContact CD1-CG 3.8Å
932	S	71.4	Confident	70.3	Confident	33 Å²	33	48.6 Å²	48.6	23%	0.231	28%	0.276	C	S	.	.	H	α-helix	trans	-63.4	-39.3	178	73.9	0	0	0	0	112.4	E928 H929 L935 L936	E928-S932 PolarHBondContact O-N 2.88Å; H929-S932 PolarHBondContact O-N 3.42Å; H929-S932 PolarHBondContact O-OG 3.43Å; S932-L935 PolarHBondContact O-N 3.25Å; S932-L936 VanDerWaalsContact O-CG 3.25Å; S932-L936 WeakPolarHBondContact O-CG 3.41Å; S932-L936 PolarHBondContact O-N 3.12Å
933	Q	70.9	Confident	69.6	Low	37 Å²	37	49.9 Å²	49.9	17%	0.173	29%	0.286	C	S	.	.	H	α-helix	trans	-71.4	-36.8	177.9	-66	-61	-18.2	0	0	112.1	L747 F911 H929 A930 L931 L935 L936 G937	L747-Q933 HydrophobicContact CD2-CG 3.9Å; F911-Q933 HydrophobicContact CD1-CB 4.1Å; F911-Q933 HydrophobicContact CD2-CB 4.2Å; F911-Q933 HydrophobicContact CE1-CB 3.77Å; F911-Q933 HydrophobicContact CE1-CG 4.32Å; F911-Q933 HydrophobicContact CE2-CB 3.86Å; F911-Q933 HydrophobicContact CG-CB 4.31Å; F911-Q933 HydrophobicContact CZ-CB 3.65Å; F911-Q933 HydrophobicContact CZ-CG 4.34Å; H929-Q933 WeakPolarHBondContact O-CG 3.47Å; H929-Q933 PolarHBondContact O-N 2.99Å; H929-Q933 VanDerWaalsContact O-N 3.09Å; A930-Q933 PolarHBondContact O-N 3.18Å; L931-Q933 VanDerWaalsContact C-N 3.33Å; L931-Q933 PolarHBondContact O-N 3.32Å; Q933-L935 VanDerWaalsContact C-N 3.3Å; Q933-L935 PolarHBondContact O-N 2.66Å; Q933-L936 PolarHBondContact O-N 3.03Å; Q933-G937 PolarHBondContact O-N 3.25Å; Q933-G937 VanDerWaalsContact O-N 3.1Å
934	E	70.2	Confident	69.3	Low	5 Å²	5	51 Å²	51	2%	0.023	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-39	174.4	-177.5	63.3	180	0	0	111.7	S909 F911 T912 A930 L931 G940 Y946	S909-E934 VanDerWaalsContact CB-CD 3.41Å; S909-E934 WeakPolarHBondContact CB-OE1 3.39Å; S909-E934 WeakPolarHBondContact CB-OE2 3.42Å; S909-E934 PolarHBondContact OG-OE2 3.18Å; F911-E934 HydrophobicContact CB-CB 4.03Å; F911-E934 WeakPolarHBondContact CB-OE2 3.46Å; T912-E934 PolarHBondContact OG1-OE1 3.25Å; A930-E934 WeakPolarHBondContact O-CB 3.36Å; A930-E934 PolarHBondContact O-N 3.44Å; L931-E934 PolarHBondContact O-N 2.81Å; E934-G940 CarbonylContact O-C 3.45Å; E934-G940 VanDerWaalsContact O-CA 3.22Å; E934-G940 WeakPolarHBondContact O-CA 3.34Å; E934-Y946 HydrophobicContact CB-CD2 4.35Å; E934-Y946 HydrophobicContact CG-CD2 4Å
935	L	67.6	Low	69.1	Low	79 Å²	79	49.5 Å²	49.5	41%	0.414	29%	0.287	S	S	.	.	H	α-helix	trans	-70.6	-30.5	177.3	-175.3	65.3	0	0	0	113.4	L931 S932 Q933 G940 Y946	L931-L935 PolarHBondContact O-N 3.13Å; L931-L935 VanDerWaalsContact O-N 3.11Å; S932-L935 PolarHBondContact O-N 3.25Å; Q933-L935 VanDerWaalsContact C-N 3.3Å; Q933-L935 PolarHBondContact O-N 2.66Å; L935-G940 CarbonylContact C-O 3.21Å; L935-Y946 HydrophobicContact CB-CE2 4.08Å; L935-Y946 HydrophobicContact CD1-CE1 4.47Å
936	L	62	Low	69.2	Low	118 Å²	118	45.8 Å²	45.8	62%	0.618	27%	0.269	S	S	*	.	H	α-helix	trans	-87	-9	-178.7	-67.5	171	0	0	0	113.1	S932 Q933	S932-L936 VanDerWaalsContact O-CG 3.25Å; S932-L936 WeakPolarHBondContact O-CG 3.41Å; S932-L936 PolarHBondContact O-N 3.12Å; Q933-L936 PolarHBondContact O-N 3.03Å
937	G	57	Low	69.4	Low	32 Å²	32	47.6 Å²	47.6	33%	0.33	28%	0.275	S	S	.	.	S	Bend	trans	-69.8	144.9	-174.9	0	0	0	0	0	113.7	Q933 K939 G940	Q933-G937 PolarHBondContact O-N 3.25Å; Q933-G937 VanDerWaalsContact O-N 3.1Å; G937-K939 PolarHBondContact O-N 3.38Å; G937-K939 VanDerWaalsContact O-N 3.1Å; G937-G940 PolarHBondContact O-N 3.41Å
938	S	44.8	Very low	69.7	Low	129 Å²	129	49 Å²	49	90%	0.902	28%	0.281	S	S	*	.	S	Bend	trans	-62.7	-20.2	-179.6	59.2	0	0	0	0	115.1
939	K	48.2	Very low	70.1	Confident	184 Å²	184	46 Å²	46	80%	0.8	27%	0.268	S	S	*	.	S	Bend	trans	-113	-14.7	171.3	-64.3	-173.6	176.6	-172.6	0	113	G937 G941	G937-K939 PolarHBondContact O-N 3.38Å; G937-K939 VanDerWaalsContact O-N 3.1Å; K939-G941 PolarHBondContact O-N 2.95Å
940	G	50.5	Low	70.8	Confident	8 Å²	8	45 Å²	45	8%	0.082	26%	0.264	C	S	.	.			trans	-90.8	89.5	-175.5	0	0	0	0	0	109.3	E934 L935 G937	E934-G940 CarbonylContact O-C 3.45Å; E934-G940 VanDerWaalsContact O-CA 3.22Å; E934-G940 WeakPolarHBondContact O-CA 3.34Å; L935-G940 CarbonylContact C-O 3.21Å; G937-G940 PolarHBondContact O-N 3.41Å
941	G	55.9	Low	71.4	Confident	39 Å²	39	45 Å²	45	40%	0.402	26%	0.264	S	S	.	.			trans	-94.4	-172.3	168.7	0	0	0	0	0	111	K939 S943	K939-G941 PolarHBondContact O-N 2.95Å; G941-S943 PolarHBondContact O-N 3.48Å
942	C	67.1	Low	72.3	Confident	52 Å²	52	46.7 Å²	46.7	35%	0.351	27%	0.272	S	S	.	.	S	Bend	trans	-60.7	76.7	163.5	-66.5	0	0	0	0	111	Y947 Y973	C942-Y947 HydrophobicContact CB-CD2 4.48Å; C942-Y947 HydrophobicContact CB-CE2 3.52Å; C942-Y947 WeakPolarHBondContact CB-OH 3.33Å; C942-Y947 PolarHBondContact SG-OH 3.44Å; C942-Y973 PolarHBondContact O-OH 3.13Å
943	S	74.6	Confident	73.2	Confident	40 Å²	40	45.8 Å²	45.8	28%	0.28	26%	0.264	S	S	.	.			trans	-87.5	163.8	178.4	72.2	0	0	0	0	111	G941 A945 Y946 Y947	G941-S943 PolarHBondContact O-N 3.48Å; S943-A945 VanDerWaalsContact C-N 3.25Å; S943-A945 PolarHBondContact O-N 3.2Å; S943-Y946 WeakPolarHBondContact O-CB 3.33Å; S943-Y946 PolarHBondContact O-N 3.47Å; S943-Y946 VanDerWaalsContact O-N 3.16Å; S943-Y946 WeakPolarHBondContact OG-CB 3.45Å; S943-Y946 PolarHBondContact OG-N 3.01Å; S943-Y946 VanDerWaalsContact OG-N 3.1Å; S943-Y947 WeakPolarHBondContact O-CD2 3.45Å; S943-Y947 PolarHBondContact O-N 2.99Å
944	M	82.8	Confident	74.1	Confident	24 Å²	24	44.8 Å²	44.8	12%	0.118	26%	0.259	C	S	.	.	H	α-helix	trans	-54.4	-44.5	172.6	-177.9	-80.6	-68.3	0	0	111.4	L906 Y946 Y947 Y948 A970 Y973 K974 Y977	L906-M944 HydrophobicContact CD2-CE 3.86Å; M944-Y946 VanDerWaalsContact C-N 3.33Å; M944-Y946 PolarHBondContact O-N 3.19Å; M944-Y947 PolarHBondContact O-N 2.86Å; M944-Y948 WeakPolarHBondContact O-CB 3.46Å; M944-Y948 PolarHBondContact O-N 3.01Å; M944-A970 HydrophobicContact CG-CB 4.39Å; M944-Y973 HydrophobicContact CB-CG 4.33Å; M944-K974 HydrophobicContact CG-CB 4.42Å; M944-Y977 HydrophobicContact SD-CD1 3.92Å; M944-Y977 HydrophobicContact SD-CE1 3.84Å
945	A	81.2	Confident	75.1	Confident	23 Å²	23	46.2 Å²	46.2	19%	0.19	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-33.5	-179.6	0	0	0	0	0	112.7	T912 S943 S949	T912-A945 HydrophobicContact CG2-CB 3.73Å; S943-A945 VanDerWaalsContact C-N 3.25Å; S943-A945 PolarHBondContact O-N 3.2Å; A945-S949 WeakPolarHBondContact O-CB 3.39Å; A945-S949 PolarHBondContact O-N 3.1Å; A945-S949 PolarHBondContact O-OG 3.36Å
946	Y	83.7	Confident	76.1	Confident	25 Å²	25	45.2 Å²	45.2	10%	0.098	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-53.9	172	170.6	-94.8	0	0	0	111.2	L931 E934 L935 S943 M944 Y948 S949 L950	L931-Y946 HydrophobicContact CD2-CD2 4.1Å; L931-Y946 HydrophobicContact CD2-CE2 3.98Å; E934-Y946 HydrophobicContact CB-CD2 4.35Å; E934-Y946 HydrophobicContact CG-CD2 4Å; L935-Y946 HydrophobicContact CB-CE2 4.08Å; L935-Y946 HydrophobicContact CD1-CE1 4.47Å; S943-Y946 WeakPolarHBondContact O-CB 3.33Å; S943-Y946 PolarHBondContact O-N 3.47Å; S943-Y946 VanDerWaalsContact O-N 3.16Å; S943-Y946 WeakPolarHBondContact OG-CB 3.45Å; S943-Y946 PolarHBondContact OG-N 3.01Å; S943-Y946 VanDerWaalsContact OG-N 3.1Å; M944-Y946 VanDerWaalsContact C-N 3.33Å; M944-Y946 PolarHBondContact O-N 3.19Å; Y946-Y948 VanDerWaalsContact C-N 3.31Å; Y946-Y948 PolarHBondContact O-N 3.16Å; Y946-S949 PolarHBondContact O-N 3.33Å; Y946-L950 HydrophobicContact CE1-CD2 4.1Å; Y946-L950 WeakPolarHBondContact O-CB 3.36Å; Y946-L950 PolarHBondContact O-N 3.14Å
947	Y	84.4	Confident	77.2	Confident	41 Å²	41	46 Å²	46	16%	0.161	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-36.7	-179.6	-77.2	-60.3	0	0	0	112.8	C942 S943 M944 L950 A951 E969 Y973	C942-Y947 HydrophobicContact CB-CD2 4.48Å; C942-Y947 HydrophobicContact CB-CE2 3.52Å; C942-Y947 WeakPolarHBondContact CB-OH 3.33Å; C942-Y947 PolarHBondContact SG-OH 3.44Å; S943-Y947 WeakPolarHBondContact O-CD2 3.45Å; S943-Y947 PolarHBondContact O-N 2.99Å; M944-Y947 PolarHBondContact O-N 2.86Å; Y947-L950 HydrophobicContact CD1-CD2 4.48Å; Y947-L950 PolarHBondContact O-N 3.37Å; Y947-A951 WeakPolarHBondContact O-CB 3.44Å; Y947-A951 PolarHBondContact O-N 3.02Å; Y947-E969 HydrophobicContact CD1-CB 3.86Å; Y947-E969 HydrophobicContact CD1-CG 4.49Å; Y947-E969 HydrophobicContact CD2-CB 3.92Å; Y947-E969 HydrophobicContact CE1-CB 3.96Å; Y947-E969 HydrophobicContact CE1-CG 4.22Å; Y947-E969 HydrophobicContact CE2-CB 3.97Å; Y947-E969 HydrophobicContact CG-CB 3.85Å; Y947-Y973 HydrophobicContact CD2-CD2 4.37Å; Y947-Y973 AromaticContact CD2-CE2 3.81Å; Y947-Y973 HydrophobicContact CD2-CE2 3.81Å; Y947-Y973 AromaticContact CE2-CE2 3.69Å; Y947-Y973 HydrophobicContact CE2-CE2 3.69Å
948	Y	89.3	Confident	78.7	Confident	30 Å²	30	46.1 Å²	46.1	12%	0.118	26%	0.261	C	S	.	.	H	α-helix	trans	-64	-46.4	173.5	-179.4	-104	0	0	0	112	M944 Y946 L950 A951 Q952 Y977 D979 A980 L983	M944-Y948 WeakPolarHBondContact O-CB 3.46Å; M944-Y948 PolarHBondContact O-N 3.01Å; Y946-Y948 VanDerWaalsContact C-N 3.31Å; Y946-Y948 PolarHBondContact O-N 3.16Å; Y948-L950 VanDerWaalsContact C-N 3.34Å; Y948-L950 PolarHBondContact O-N 2.88Å; Y948-A951 PolarHBondContact O-N 3.31Å; Y948-Q952 HydrophobicContact CE1-CG 4.27Å; Y948-Q952 VanDerWaalsContact CZ-NE2 3.3Å; Y948-Q952 WeakPolarHBondContact O-CG 3.34Å; Y948-Q952 PolarHBondContact O-N 3.48Å; Y948-Q952 PolarHBondContact OH-NE2 2.81Å; Y948-Y977 HydrophobicContact CD1-CE1 4.38Å; Y948-Y977 HydrophobicContact CD2-CD1 4.43Å; Y948-Y977 AromaticContact CD2-CE1 3.59Å; Y948-Y977 HydrophobicContact CD2-CE1 3.59Å; Y948-Y977 AromaticContact CE2-CE1 3.81Å; Y948-Y977 HydrophobicContact CE2-CE1 3.81Å; Y948-Y977 AromaticContact CG-CE1 3.89Å; Y948-Y977 HydrophobicContact CG-CE1 3.89Å; Y948-D979 HydrophobicContact CE2-CB 4.09Å; Y948-A980 HydrophobicContact CD2-CB 4.2Å; Y948-A980 HydrophobicContact CE2-CB 4.45Å; Y948-L983 HydrophobicContact CD2-CD2 4.04Å; Y948-L983 HydrophobicContact CE2-CB 4.34Å; Y948-L983 HydrophobicContact CE2-CD2 3.81Å
949	S	88.1	Confident	80.9	Confident	7 Å²	7	42.7 Å²	42.7	5%	0.049	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-36.1	177.1	-55	0	0	0	0	112	A945 Y946 Q952 F953	A945-S949 WeakPolarHBondContact O-CB 3.39Å; A945-S949 PolarHBondContact O-N 3.1Å; A945-S949 PolarHBondContact O-OG 3.36Å; Y946-S949 PolarHBondContact O-N 3.33Å; S949-Q952 PolarHBondContact O-N 2.91Å; S949-F953 WeakPolarHBondContact O-CB 3.42Å; S949-F953 PolarHBondContact O-N 3.37Å
950	L	86.6	Confident	83	Confident	29 Å²	29	37.3 Å²	37.3	15%	0.152	21%	0.208	C	C	.	.	H	α-helix	trans	-64.9	-42.8	174.3	179.1	62.7	0	0	0	111.5	L931 Y946 Y947 Y948 F953 Q954	L931-L950 HydrophobicContact CD1-CD1 4.03Å; L931-L950 HydrophobicContact CD2-CB 4.37Å; Y946-L950 HydrophobicContact CE1-CD2 4.1Å; Y946-L950 WeakPolarHBondContact O-CB 3.36Å; Y946-L950 PolarHBondContact O-N 3.14Å; Y947-L950 HydrophobicContact CD1-CD2 4.48Å; Y947-L950 PolarHBondContact O-N 3.37Å; Y948-L950 VanDerWaalsContact C-N 3.34Å; Y948-L950 PolarHBondContact O-N 2.88Å; L950-F953 HydrophobicContact CD1-CD1 4.38Å; L950-F953 WeakPolarHBondContact O-CB 3.37Å; L950-F953 PolarHBondContact O-N 3.03Å; L950-Q954 HydrophobicContact CD1-CG 4.34Å; L950-Q954 WeakPolarHBondContact O-CB 3.37Å; L950-Q954 VanDerWaalsContact O-CG 3.29Å; L950-Q954 WeakPolarHBondContact O-CG 3.29Å; L950-Q954 PolarHBondContact O-N 3.35Å
951	A	90.6	Very high	84.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-42.5	175	0	0	0	0	0	112.1	Y947 Y948 Q954 L955 V967 L983	Y947-A951 WeakPolarHBondContact O-CB 3.44Å; Y947-A951 PolarHBondContact O-N 3.02Å; Y948-A951 PolarHBondContact O-N 3.31Å; A951-Q954 PolarHBondContact O-N 2.9Å; A951-L955 WeakPolarHBondContact O-CB 3.39Å; A951-L955 PolarHBondContact O-N 2.88Å; A951-V967 HydrophobicContact CB-CG2 3.38Å; A951-L983 HydrophobicContact CB-CD2 3.66Å
952	Q	91.3	Very high	86.5	Confident	46 Å²	46	39.6 Å²	39.6	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-44.3	174.3	-72.7	-176.4	-32.1	0	0	111.6	L919 Y948 S949 L955 L956 L983	L919-Q952 HydrophobicContact CD1-CB 3.99Å; Y948-Q952 HydrophobicContact CE1-CG 4.27Å; Y948-Q952 VanDerWaalsContact CZ-NE2 3.3Å; Y948-Q952 WeakPolarHBondContact O-CG 3.34Å; Y948-Q952 PolarHBondContact O-N 3.48Å; Y948-Q952 PolarHBondContact OH-NE2 2.81Å; S949-Q952 PolarHBondContact O-N 2.91Å; Q952-L955 PolarHBondContact O-N 3.46Å; Q952-L956 WeakPolarHBondContact O-CG 3.22Å; Q952-L956 PolarHBondContact O-N 3.43Å; Q952-L983 HydrophobicContact CG-CD1 4.28Å; Q952-L983 HydrophobicContact CG-CD2 3.66Å
953	F	89.6	Confident	87.6	Confident	14 Å²	14	37.1 Å²	37.1	6%	0.061	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-47	174.7	172.4	-101.6	0	0	0	112.2	L919 L924 A927 E928 L931 S949 L950 L956 K957	L919-F953 HydrophobicContact CD2-CB 3.86Å; L919-F953 HydrophobicContact CD2-CD2 4.27Å; L924-F953 HydrophobicContact CB-CE2 4.07Å; L924-F953 HydrophobicContact CD2-CD2 4.09Å; L924-F953 HydrophobicContact CD2-CE2 4.32Å; L924-F953 WeakPolarHBondContact O-CE2 3.39Å; A927-F953 HydrophobicContact CB-CD2 4.24Å; E928-F953 HydrophobicContact CB-CE2 4.02Å; E928-F953 HydrophobicContact CB-CZ 3.86Å; E928-F953 HydrophobicContact CG-CZ 4.18Å; L931-F953 HydrophobicContact CD1-CB 3.85Å; L931-F953 HydrophobicContact CD1-CD1 3.98Å; L931-F953 HydrophobicContact CD1-CD2 4.36Å; L931-F953 HydrophobicContact CD1-CG 3.8Å; S949-F953 WeakPolarHBondContact O-CB 3.42Å; S949-F953 PolarHBondContact O-N 3.37Å; L950-F953 HydrophobicContact CD1-CD1 4.38Å; L950-F953 WeakPolarHBondContact O-CB 3.37Å; L950-F953 PolarHBondContact O-N 3.03Å; F953-L956 PolarHBondContact O-N 3.13Å; F953-K957 HydrophobicContact CE1-CD 4.32Å; F953-K957 HydrophobicContact CZ-CD 4.4Å; F953-K957 WeakPolarHBondContact O-CB 3.41Å; F953-K957 PolarHBondContact O-N 2.91Å
954	Q	90.6	Very high	88.5	Confident	16 Å²	16	35.7 Å²	35.7	8%	0.075	19%	0.188	C	C	.	.	H	α-helix	trans	-65.5	-39.9	179.1	-73.3	167.5	-23.9	0	0	112.1	L950 A951 K957 G958 D959 S962 A963 S966	L950-Q954 HydrophobicContact CD1-CG 4.34Å; L950-Q954 WeakPolarHBondContact O-CB 3.37Å; L950-Q954 VanDerWaalsContact O-CG 3.29Å; L950-Q954 WeakPolarHBondContact O-CG 3.29Å; L950-Q954 PolarHBondContact O-N 3.35Å; A951-Q954 PolarHBondContact O-N 2.9Å; Q954-K957 PolarHBondContact O-N 2.74Å; Q954-G958 PolarHBondContact O-N 3.38Å; Q954-G958 VanDerWaalsContact O-N 3.07Å; Q954-D959 PolarHBondContact O-N 3.49Å; Q954-S962 PolarHBondContact OE1-O 3.01Å; Q954-A963 HydrophobicContact CB-CB 3.76Å; Q954-S966 PolarHBondContact OE1-OG 2.82Å
955	L	90.9	Very high	88.9	Confident	34 Å²	34	38.6 Å²	38.6	18%	0.178	21%	0.205	C	C	.	.	H	α-helix	trans	-58.5	-48.6	173.2	179.4	110	0	0	0	111.1	A951 Q952 K957 G958 L983 H986 C987 L990	A951-L955 WeakPolarHBondContact O-CB 3.39Å; A951-L955 PolarHBondContact O-N 2.88Å; Q952-L955 PolarHBondContact O-N 3.46Å; L955-K957 VanDerWaalsContact C-N 3.27Å; L955-K957 PolarHBondContact O-N 3.11Å; L955-G958 PolarHBondContact O-N 3.47Å; L955-L983 HydrophobicContact CB-CD1 4.41Å; L955-L983 HydrophobicContact CD1-CD1 4.11Å; L955-L983 HydrophobicContact CD2-CD1 4.01Å; L955-L983 HydrophobicContact CG-CD1 4.4Å; L955-H986 HydrophobicContact CD1-CB 4.26Å; L955-C987 HydrophobicContact CD1-CB 4.43Å; L955-C987 WeakPolarHBondContact CD1-SG 3.35Å; L955-L990 HydrophobicContact CD1-CD1 4.1Å
956	L	88.4	Confident	89.2	Confident	58 Å²	58	38 Å²	38	30%	0.304	20%	0.198	S	C	.	.	H	α-helix	trans	-66.3	-28.7	178.4	-68.5	174	0	0	0	112.9	L683 L919 L924 Q952 F953 G958	L683-L956 HydrophobicContact CD1-CD2 4.37Å; L919-L956 HydrophobicContact CB-CD1 4.46Å; L919-L956 HydrophobicContact CD2-CD1 4.12Å; L924-L956 HydrophobicContact CD2-CB 3.74Å; L924-L956 HydrophobicContact CD2-CD1 3.99Å; Q952-L956 WeakPolarHBondContact O-CG 3.22Å; Q952-L956 PolarHBondContact O-N 3.43Å; F953-L956 PolarHBondContact O-N 3.13Å; L956-G958 VanDerWaalsContact C-N 3.25Å
957	K	86.9	Confident	89.6	Confident	136 Å²	136	36.8 Å²	36.8	59%	0.591	19%	0.194	S	C	*	.	H	α-helix	trans	-75.1	-14.7	172.5	-166.3	174.1	-179.7	174.8	0	112.8	F953 Q954 L955	F953-K957 HydrophobicContact CE1-CD 4.32Å; F953-K957 HydrophobicContact CZ-CD 4.4Å; F953-K957 WeakPolarHBondContact O-CB 3.41Å; F953-K957 PolarHBondContact O-N 2.91Å; Q954-K957 PolarHBondContact O-N 2.74Å; L955-K957 VanDerWaalsContact C-N 3.27Å; L955-K957 PolarHBondContact O-N 3.11Å
958	G	87.4	Confident	89.9	Confident	34 Å²	34	39.5 Å²	39.5	35%	0.351	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	10.3	-177.1	0	0	0	0	0	114.7	Q954 L955 L956 Y960	Q954-G958 PolarHBondContact O-N 3.38Å; Q954-G958 VanDerWaalsContact O-N 3.07Å; L955-G958 PolarHBondContact O-N 3.47Å; L956-G958 VanDerWaalsContact C-N 3.25Å; G958-Y960 PolarHBondContact O-N 3.03Å
959	D	90.1	Very high	89.8	Confident	57 Å²	57	42.3 Å²	42.3	31%	0.305	22%	0.221	S	C	.	.			trans	-92.1	77.3	176.7	-175.3	-0.3	0	0	0	110.7	Q954 S961 S962 A963	Q954-D959 PolarHBondContact O-N 3.49Å; D959-S961 VanDerWaalsContact C-N 3.33Å; D959-S961 PolarHBondContact O-N 3.3Å; D959-S961 PolarHBondContact OD1-OG 3.19Å; D959-S962 VanDerWaalsContact CG-OG 3.23Å; D959-S962 PolarHBondContact OD1-N 2.99Å; D959-S962 PolarHBondContact OD1-OG 3.2Å; D959-S962 VanDerWaalsContact OD2-CB 3.22Å; D959-S962 WeakPolarHBondContact OD2-CB 3.36Å; D959-S962 PolarHBondContact OD2-OG 2.75Å; D959-A963 WeakPolarHBondContact O-CB 3.26Å; D959-A963 PolarHBondContact O-N 2.67Å; D959-A963 VanDerWaalsContact O-N 3.13Å
960	Y	92.3	Very high	89.8	Confident	71 Å²	71	42 Å²	42	28%	0.278	22%	0.219	S	C	.	.	H	α-helix	trans	-67.4	-31.8	-174.5	-47.9	-53.5	0	0	0	113.2	G958 A963 I964 L990 Q991	G958-Y960 PolarHBondContact O-N 3.03Å; Y960-A963 PolarHBondContact O-N 3.28Å; Y960-I964 WeakPolarHBondContact O-CD1 3.35Å; Y960-I964 VanDerWaalsContact O-CG1 3.3Å; Y960-I964 WeakPolarHBondContact O-CG1 3.47Å; Y960-I964 PolarHBondContact O-N 2.92Å; Y960-L990 HydrophobicContact CD1-CB 4.2Å; Y960-L990 HydrophobicContact CD1-CD1 4.23Å; Y960-L990 HydrophobicContact CD2-CB 4.46Å; Y960-L990 HydrophobicContact CE1-CB 3.86Å; Y960-L990 HydrophobicContact CE1-CD1 3.56Å; Y960-L990 HydrophobicContact CE1-CG 4.35Å; Y960-L990 HydrophobicContact CE2-CB 4.13Å; Y960-L990 HydrophobicContact CG-CB 4.49Å; Y960-Q991 HydrophobicContact CD2-CG 3.92Å; Y960-Q991 HydrophobicContact CG-CG 4.05Å
961	S	91.2	Very high	89.8	Confident	69 Å²	69	41.5 Å²	41.5	48%	0.483	22%	0.216	S	C	.	.	H	α-helix	trans	-64.3	-53.7	178.4	30.9	0	0	0	0	112.1	D959 A963 I964 D965	D959-S961 VanDerWaalsContact C-N 3.33Å; D959-S961 PolarHBondContact O-N 3.3Å; D959-S961 PolarHBondContact OD1-OG 3.19Å; S961-A963 VanDerWaalsContact C-N 3.26Å; S961-A963 PolarHBondContact O-N 2.73Å; S961-I964 PolarHBondContact O-N 3.05Å; S961-D965 PolarHBondContact O-N 3Å
962	S	88.8	Confident	89.7	Confident	26 Å²	26	49.5 Å²	49.5	18%	0.182	25%	0.251	C	S	.	.	H	α-helix	trans	-64.5	-35.2	177.6	-54.5	0	0	0	0	111.2	Q954 D959 I964 D965 S966	Q954-S962 PolarHBondContact OE1-O 3.01Å; D959-S962 VanDerWaalsContact CG-OG 3.23Å; D959-S962 PolarHBondContact OD1-N 2.99Å; D959-S962 PolarHBondContact OD1-OG 3.2Å; D959-S962 VanDerWaalsContact OD2-CB 3.22Å; D959-S962 WeakPolarHBondContact OD2-CB 3.36Å; D959-S962 PolarHBondContact OD2-OG 2.75Å; S962-I964 PolarHBondContact O-N 3.26Å; S962-D965 PolarHBondContact O-N 3.13Å; S962-S966 PolarHBondContact O-N 3.07Å; S962-S966 PolarHBondContact O-OG 3.49Å; S962-S966 VanDerWaalsContact O-OG 3.11Å
963	A	91.6	Very high	89.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-45.5	176.3	0	0	0	0	0	111.8	Q954 D959 Y960 S961 D965 S966 V967	Q954-A963 HydrophobicContact CB-CB 3.76Å; D959-A963 WeakPolarHBondContact O-CB 3.26Å; D959-A963 PolarHBondContact O-N 2.67Å; D959-A963 VanDerWaalsContact O-N 3.13Å; Y960-A963 PolarHBondContact O-N 3.28Å; S961-A963 VanDerWaalsContact C-N 3.26Å; S961-A963 PolarHBondContact O-N 2.73Å; A963-D965 VanDerWaalsContact C-N 3.33Å; A963-D965 PolarHBondContact O-N 2.88Å; A963-S966 PolarHBondContact O-N 3.49Å; A963-V967 VanDerWaalsContact O-CG2 3.32Å; A963-V967 WeakPolarHBondContact O-CG2 3.49Å; A963-V967 PolarHBondContact O-N 3.24Å
964	I	93.3	Very high	88.8	Confident	9 Å²	9	56.9 Å²	56.9	5%	0.046	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-42.6	178	-72.4	161.2	0	0	0	111.3	Y960 S961 S962 V967 K968 C987	Y960-I964 WeakPolarHBondContact O-CD1 3.35Å; Y960-I964 VanDerWaalsContact O-CG1 3.3Å; Y960-I964 WeakPolarHBondContact O-CG1 3.47Å; Y960-I964 PolarHBondContact O-N 2.92Å; S961-I964 PolarHBondContact O-N 3.05Å; S962-I964 PolarHBondContact O-N 3.26Å; I964-V967 PolarHBondContact O-N 3.16Å; I964-K968 HydrophobicContact CG2-CD 4.49Å; I964-K968 WeakPolarHBondContact O-CG 3.37Å; I964-K968 PolarHBondContact O-N 2.94Å; I964-C987 HydrophobicContact CD1-CB 3.86Å; I964-C987 HydrophobicContact CG1-CB 3.51Å
965	D	90.6	Very high	88.4	Confident	86 Å²	86	59.8 Å²	59.8	46%	0.46	30%	0.302	S	S	.	.	H	α-helix	trans	-66	-42.5	178.6	-68.8	-24.3	0	0	0	111.4	S961 S962 A963 V967 K968 E969	S961-D965 PolarHBondContact O-N 3Å; S962-D965 PolarHBondContact O-N 3.13Å; A963-D965 VanDerWaalsContact C-N 3.33Å; A963-D965 PolarHBondContact O-N 2.88Å; D965-V967 VanDerWaalsContact C-N 3.31Å; D965-V967 PolarHBondContact O-N 3.38Å; D965-K968 WeakPolarHBondContact O-CB 3.37Å; D965-K968 PolarHBondContact O-N 3.13Å; D965-K968 IonicContact OD1-NZ 3.91Å; D965-K968 PolarHBondContact OD1-NZ 3.25Å; D965-E969 PolarHBondContact O-N 3.23Å; D965-E969 VanDerWaalsContact O-N 3.08Å
966	S	88.4	Confident	88.1	Confident	9 Å²	9	64.4 Å²	64.4	6%	0.063	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-38.5	172	-59.6	0	0	0	0	112.4	Q954 S962 A963 E969 A970	Q954-S966 PolarHBondContact OE1-OG 2.82Å; S962-S966 PolarHBondContact O-N 3.07Å; S962-S966 PolarHBondContact O-OG 3.49Å; S962-S966 VanDerWaalsContact O-OG 3.11Å; A963-S966 PolarHBondContact O-N 3.49Å; S966-E969 PolarHBondContact O-N 3.17Å; S966-A970 PolarHBondContact O-N 3.27Å
967	V	91.2	Very high	87.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-68.1	-37.9	175.4	178.2	0	0	0	0	111.9	A951 A963 I964 D965 E969 A970 L971 A980 L983 K984	A951-V967 HydrophobicContact CB-CG2 3.38Å; A963-V967 VanDerWaalsContact O-CG2 3.32Å; A963-V967 WeakPolarHBondContact O-CG2 3.49Å; A963-V967 PolarHBondContact O-N 3.24Å; I964-V967 PolarHBondContact O-N 3.16Å; D965-V967 VanDerWaalsContact C-N 3.31Å; D965-V967 PolarHBondContact O-N 3.38Å; V967-E969 VanDerWaalsContact C-N 3.28Å; V967-E969 PolarHBondContact O-N 3.3Å; V967-A970 WeakPolarHBondContact O-CB 3.05Å; V967-A970 PolarHBondContact O-N 2.58Å; V967-A970 VanDerWaalsContact O-N 3.14Å; V967-L971 HydrophobicContact CG1-CD1 3.88Å; V967-L971 HydrophobicContact CG1-CG 4.11Å; V967-L971 WeakPolarHBondContact O-CB 3.43Å; V967-L971 WeakPolarHBondContact O-CG 3.11Å; V967-L971 PolarHBondContact O-N 3.33Å; V967-A980 HydrophobicContact CG1-CB 4.04Å; V967-A980 WeakPolarHBondContact CG1-O 3.4Å; V967-L983 HydrophobicContact CG2-CD2 3.93Å; V967-L983 HydrophobicContact CG2-CG 4.13Å; V967-K984 HydrophobicContact CB-CB 4.48Å; V967-K984 HydrophobicContact CG1-CB 3.86Å; V967-K984 HydrophobicContact CG1-CG 4.45Å
968	K	90.3	Very high	87.9	Confident	99 Å²	99	57.7 Å²	57.7	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-59.6	-42.8	174.7	-70.6	170.7	-168.8	155.3	0	110.9	I964 D965 L971 F972	I964-K968 HydrophobicContact CG2-CD 4.49Å; I964-K968 WeakPolarHBondContact O-CG 3.37Å; I964-K968 PolarHBondContact O-N 2.94Å; D965-K968 WeakPolarHBondContact O-CB 3.37Å; D965-K968 PolarHBondContact O-N 3.13Å; D965-K968 IonicContact OD1-NZ 3.91Å; D965-K968 PolarHBondContact OD1-NZ 3.25Å; K968-L971 PolarHBondContact O-N 3.33Å; K968-F972 PolarHBondContact O-N 3.09Å
969	E	87.9	Confident	88	Confident	89 Å²	89	57.4 Å²	57.4	42%	0.416	28%	0.282	S	S	.	.	H	α-helix	trans	-61.6	-43.7	173.7	-65.1	-60.9	148.1	0	0	111.2	Y947 D965 S966 V967 L971 F972 Y973	Y947-E969 HydrophobicContact CD1-CB 3.86Å; Y947-E969 HydrophobicContact CD1-CG 4.49Å; Y947-E969 HydrophobicContact CD2-CB 3.92Å; Y947-E969 HydrophobicContact CE1-CB 3.96Å; Y947-E969 HydrophobicContact CE1-CG 4.22Å; Y947-E969 HydrophobicContact CE2-CB 3.97Å; Y947-E969 HydrophobicContact CG-CB 3.85Å; D965-E969 PolarHBondContact O-N 3.23Å; D965-E969 VanDerWaalsContact O-N 3.08Å; S966-E969 PolarHBondContact O-N 3.17Å; V967-E969 VanDerWaalsContact C-N 3.28Å; V967-E969 PolarHBondContact O-N 3.3Å; E969-L971 PolarHBondContact O-N 2.95Å; E969-F972 WeakPolarHBondContact O-CB 3.23Å; E969-F972 PolarHBondContact O-N 2.96Å; E969-Y973 WeakPolarHBondContact O-CD2 3.49Å
970	A	87.1	Confident	88	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-60.7	-42.9	175.8	0	0	0	0	0	112.9	M944 S966 V967 F972 Y973 K974	M944-A970 HydrophobicContact CG-CB 4.39Å; S966-A970 PolarHBondContact O-N 3.27Å; V967-A970 WeakPolarHBondContact O-CB 3.05Å; V967-A970 PolarHBondContact O-N 2.58Å; V967-A970 VanDerWaalsContact O-N 3.14Å; A970-F972 VanDerWaalsContact C-N 3.3Å; A970-F972 PolarHBondContact O-N 3.46Å; A970-Y973 PolarHBondContact O-N 3.2Å; A970-K974 PolarHBondContact O-N 3.28Å
971	L	88.3	Confident	88	Confident	17 Å²	17	53.2 Å²	53.2	9%	0.089	26%	0.261	C	S	.	.	H	α-helix	trans	-69.6	-25.7	178.4	-70.7	173.5	0	0	0	112.8	V967 K968 E969 Y973 K974 S975 A980 W981 K984	V967-L971 HydrophobicContact CG1-CD1 3.88Å; V967-L971 HydrophobicContact CG1-CG 4.11Å; V967-L971 WeakPolarHBondContact O-CB 3.43Å; V967-L971 WeakPolarHBondContact O-CG 3.11Å; V967-L971 PolarHBondContact O-N 3.33Å; K968-L971 PolarHBondContact O-N 3.33Å; E969-L971 PolarHBondContact O-N 2.95Å; L971-Y973 VanDerWaalsContact C-N 3.29Å; L971-Y973 PolarHBondContact O-N 2.71Å; L971-K974 CarbonylContact O-C 3.21Å; L971-K974 PolarHBondContact O-N 2.59Å; L971-S975 WeakPolarHBondContact O-CA 3.43Å; L971-S975 PolarHBondContact O-N 3.1Å; L971-S975 VanDerWaalsContact O-N 3.12Å; L971-A980 HydrophobicContact CD2-CB 3.63Å; L971-A980 HydrophobicContact CG-CB 4.05Å; L971-W981 HydrophobicContact CD1-CD2 3.97Å; L971-W981 HydrophobicContact CD1-CE3 4.25Å; L971-W981 HydrophobicContact CD1-CG 4.5Å; L971-W981 HydrophobicContact CD1-CH2 4.32Å; L971-W981 HydrophobicContact CD1-CZ2 4.03Å; L971-W981 HydrophobicContact CD1-CZ3 4.43Å; L971-W981 HydrophobicContact CD2-CD2 4.34Å; L971-W981 HydrophobicContact CD2-CG 4.22Å; L971-K984 HydrophobicContact CD1-CD 4.42Å
972	F	86.9	Confident	88.1	Confident	168 Å²	168	50 Å²	50	74%	0.737	24%	0.239	S	C	*	.	H	α-helix	trans	-61.1	-38.4	171.9	180	-97.3	0	0	0	111.7	K968 E969 A970	K968-F972 PolarHBondContact O-N 3.09Å; E969-F972 WeakPolarHBondContact O-CB 3.23Å; E969-F972 PolarHBondContact O-N 2.96Å; A970-F972 VanDerWaalsContact C-N 3.3Å; A970-F972 PolarHBondContact O-N 3.46Å
973	Y	81.8	Confident	88.3	Confident	126 Å²	126	49.2 Å²	49.2	49%	0.494	23%	0.233	S	C	.	.	H	α-helix	trans	-74.2	-45.1	175.3	-68.8	-85.8	0	0	0	112.8	C942 M944 Y947 E969 A970 L971	C942-Y973 PolarHBondContact O-OH 3.13Å; M944-Y973 HydrophobicContact CB-CG 4.33Å; Y947-Y973 HydrophobicContact CD2-CD2 4.37Å; Y947-Y973 AromaticContact CD2-CE2 3.81Å; Y947-Y973 HydrophobicContact CD2-CE2 3.81Å; Y947-Y973 AromaticContact CE2-CE2 3.69Å; Y947-Y973 HydrophobicContact CE2-CE2 3.69Å; E969-Y973 WeakPolarHBondContact O-CD2 3.49Å; A970-Y973 PolarHBondContact O-N 3.2Å; L971-Y973 VanDerWaalsContact C-N 3.29Å; L971-Y973 PolarHBondContact O-N 2.71Å
974	K	80.8	Confident	88.4	Confident	89 Å²	89	51 Å²	51	39%	0.387	24%	0.24	S	C	.	.			trans	-136.4	98.3	179.4	-169.6	-177.5	-178.3	-167	0	110.2	M944 A970 L971 Q976	M944-K974 HydrophobicContact CG-CB 4.42Å; A970-K974 PolarHBondContact O-N 3.28Å; L971-K974 CarbonylContact O-C 3.21Å; L971-K974 PolarHBondContact O-N 2.59Å; K974-Q976 VanDerWaalsContact C-N 3.3Å; K974-Q976 WeakPolarHBondContact CE-O 3.34Å; K974-Q976 PolarHBondContact O-N 3.21Å
975	S	82.1	Confident	88.4	Confident	78 Å²	78	50.6 Å²	50.6	55%	0.545	24%	0.238	S	C	.	.	S	Bend	trans	-65.3	-32.1	179.7	178.3	0	0	0	0	113	L971 Y977 W981	L971-S975 WeakPolarHBondContact O-CA 3.43Å; L971-S975 PolarHBondContact O-N 3.1Å; L971-S975 VanDerWaalsContact O-N 3.12Å; S975-Y977 PolarHBondContact O-N 2.78Å; S975-W981 PolarHBondContact O-NE1 2.65Å
976	Q	84.1	Confident	88.5	Confident	131 Å²	131	47.2 Å²	47.2	61%	0.612	22%	0.22	S	C	*	.			trans	-92.4	64.4	177.8	-58.6	-180	12.4	0	0	111.1	K974 F1007	K974-Q976 VanDerWaalsContact C-N 3.3Å; K974-Q976 WeakPolarHBondContact CE-O 3.34Å; K974-Q976 PolarHBondContact O-N 3.21Å; Q976-F1007 HydrophobicContact CB-CD1 4.2Å; Q976-F1007 HydrophobicContact CB-CE1 4.02Å; Q976-F1007 HydrophobicContact CG-CD1 4.26Å; Q976-F1007 HydrophobicContact CG-CE1 3.8Å
977	Y	84.6	Confident	88.7	Confident	43 Å²	43	46.8 Å²	46.8	17%	0.169	22%	0.217	C	C	.	.			trans	-126.5	97.7	176.4	-171.1	-137.6	0	0	0	111.1	M944 Y948 S975 D979 A980 W981	M944-Y977 HydrophobicContact SD-CD1 3.92Å; M944-Y977 HydrophobicContact SD-CE1 3.84Å; Y948-Y977 HydrophobicContact CD1-CE1 4.38Å; Y948-Y977 HydrophobicContact CD2-CD1 4.43Å; Y948-Y977 AromaticContact CD2-CE1 3.59Å; Y948-Y977 HydrophobicContact CD2-CE1 3.59Å; Y948-Y977 AromaticContact CE2-CE1 3.81Å; Y948-Y977 HydrophobicContact CE2-CE1 3.81Å; Y948-Y977 AromaticContact CG-CE1 3.89Å; Y948-Y977 HydrophobicContact CG-CE1 3.89Å; S975-Y977 PolarHBondContact O-N 2.78Å; Y977-D979 VanDerWaalsContact C-N 3.31Å; Y977-D979 HydrophobicContact CE1-CB 4.1Å; Y977-D979 HydrophobicContact CE2-CB 3.99Å; Y977-D979 PolarHBondContact O-N 3.45Å; Y977-A980 HydrophobicContact CD1-CB 3.33Å; Y977-A980 HydrophobicContact CE1-CB 3.95Å; Y977-A980 HydrophobicContact CG-CB 4.17Å; Y977-A980 PolarHBondContact O-N 3.47Å; Y977-W981 PolarHBondContact O-N 3.26Å
978	P	87.8	Confident	88.9	Confident	10 Å²	10	47.9 Å²	47.9	7%	0.065	22%	0.222	C	C	.	.	H	α-helix	trans	-54.8	-43.3	-173.6	-24.8	30.8	0	0	0	113.3	A980 W981 A982 S1004 F1007 E1009 P1011	P978-A980 PolarHBondContact O-N 3.33Å; P978-W981 PolarHBondContact O-N 3.04Å; P978-A982 PolarHBondContact O-N 3.1Å; P978-S1004 PolarHBondContact O-OG 3.04Å; P978-F1007 HydrophobicContact CB-CD2 4.47Å; P978-F1007 HydrophobicContact CG-CB 3.89Å; P978-F1007 HydrophobicContact CG-CD2 4.07Å; P978-F1007 HydrophobicContact CG-CG 4.33Å; P978-E1009 WeakPolarHBondContact CG-O 3.49Å; P978-P1011 HydrophobicContact CB-CB 4.31Å
979	D	89.2	Confident	89	Confident	27 Å²	27	46.3 Å²	46.3	14%	0.144	21%	0.214	C	C	.	.	H	α-helix	trans	-65.7	-33.7	-178.1	-78.6	-21.5	0	0	0	113.3	Y948 Y977 L983 P1011 S1012	Y948-D979 HydrophobicContact CE2-CB 4.09Å; Y977-D979 VanDerWaalsContact C-N 3.31Å; Y977-D979 HydrophobicContact CE1-CB 4.1Å; Y977-D979 HydrophobicContact CE2-CB 3.99Å; Y977-D979 PolarHBondContact O-N 3.45Å; D979-L983 VanDerWaalsContact O-CB 3.31Å; D979-L983 WeakPolarHBondContact O-CB 3.26Å; D979-L983 PolarHBondContact O-N 3.49Å; D979-P1011 VanDerWaalsContact OD1-CA 3.26Å; D979-P1011 WeakPolarHBondContact OD1-CA 3.42Å; D979-S1012 PolarHBondContact OD1-N 3.34Å; D979-S1012 PolarHBondContact OD1-OG 2.72Å; D979-S1012 PolarHBondContact OD2-OG 3.13Å
980	A	89.9	Confident	89.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-71.1	-41	173.7	0	0	0	0	0	111.7	Y948 V967 L971 Y977 P978 L983 K984	Y948-A980 HydrophobicContact CD2-CB 4.2Å; Y948-A980 HydrophobicContact CE2-CB 4.45Å; V967-A980 HydrophobicContact CG1-CB 4.04Å; V967-A980 WeakPolarHBondContact CG1-O 3.4Å; L971-A980 HydrophobicContact CD2-CB 3.63Å; L971-A980 HydrophobicContact CG-CB 4.05Å; Y977-A980 HydrophobicContact CD1-CB 3.33Å; Y977-A980 HydrophobicContact CE1-CB 3.95Å; Y977-A980 HydrophobicContact CG-CB 4.17Å; Y977-A980 PolarHBondContact O-N 3.47Å; P978-A980 PolarHBondContact O-N 3.33Å; A980-L983 PolarHBondContact O-N 3.17Å; A980-K984 PolarHBondContact O-N 3.27Å
981	W	92.9	Very high	89.3	Confident	40 Å²	40	49.1 Å²	49.1	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-42.8	174.3	-76.6	107	0	0	0	112	L971 S975 Y977 P978 K984 G985 C1000 W1003 F1007	L971-W981 HydrophobicContact CD1-CD2 3.97Å; L971-W981 HydrophobicContact CD1-CE3 4.25Å; L971-W981 HydrophobicContact CD1-CG 4.5Å; L971-W981 HydrophobicContact CD1-CH2 4.32Å; L971-W981 HydrophobicContact CD1-CZ2 4.03Å; L971-W981 HydrophobicContact CD1-CZ3 4.43Å; L971-W981 HydrophobicContact CD2-CD2 4.34Å; L971-W981 HydrophobicContact CD2-CG 4.22Å; S975-W981 PolarHBondContact O-NE1 2.65Å; Y977-W981 PolarHBondContact O-N 3.26Å; P978-W981 PolarHBondContact O-N 3.04Å; W981-K984 HydrophobicContact CZ3-CD 4.49Å; W981-K984 PolarHBondContact O-N 3.29Å; W981-G985 PolarHBondContact O-N 2.93Å; W981-C1000 HydrophobicContact CE3-CB 4.25Å; W981-W1003 HydrophobicContact CD2-CB 4.07Å; W981-W1003 HydrophobicContact CE3-CB 4.04Å; W981-W1003 HydrophobicContact CG-CB 4.41Å; W981-W1003 HydrophobicContact CZ3-CB 4.45Å; W981-F1007 AromaticContact CD1-CE2 3.59Å; W981-F1007 HydrophobicContact CG-CE2 4.43Å; W981-F1007 AromaticContact NE1-CE2 3.85Å
982	A	93	Very high	89.4	Confident	3 Å²	3	50 Å²	50	3%	0.025	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-45.6	173.8	0	0	0	0	0	111.9	P978 K984 G985 H986 P1011 V1017	P978-A982 PolarHBondContact O-N 3.1Å; A982-K984 PolarHBondContact O-N 3.31Å; A982-G985 CarbonylContact O-C 3.5Å; A982-G985 PolarHBondContact O-N 3.08Å; A982-H986 PolarHBondContact O-CD2 3.36Å; A982-H986 VanDerWaalsContact O-CG 3.24Å; A982-H986 PolarHBondContact O-N 3.36Å; A982-P1011 HydrophobicContact CB-CB 4.02Å; A982-V1017 HydrophobicContact CB-CG2 3.84Å
983	L	92.1	Very high	89.8	Confident	9 Å²	9	44.2 Å²	44.2	5%	0.047	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-41.2	177.7	-176.4	63.7	0	0	0	112.2	Y948 A951 Q952 L955 V967 D979 A980 H986 C987	Y948-L983 HydrophobicContact CD2-CD2 4.04Å; Y948-L983 HydrophobicContact CE2-CB 4.34Å; Y948-L983 HydrophobicContact CE2-CD2 3.81Å; A951-L983 HydrophobicContact CB-CD2 3.66Å; Q952-L983 HydrophobicContact CG-CD1 4.28Å; Q952-L983 HydrophobicContact CG-CD2 3.66Å; L955-L983 HydrophobicContact CB-CD1 4.41Å; L955-L983 HydrophobicContact CD1-CD1 4.11Å; L955-L983 HydrophobicContact CD2-CD1 4.01Å; L955-L983 HydrophobicContact CG-CD1 4.4Å; V967-L983 HydrophobicContact CG2-CD2 3.93Å; V967-L983 HydrophobicContact CG2-CG 4.13Å; D979-L983 VanDerWaalsContact O-CB 3.31Å; D979-L983 WeakPolarHBondContact O-CB 3.26Å; D979-L983 PolarHBondContact O-N 3.49Å; A980-L983 PolarHBondContact O-N 3.17Å; L983-H986 WeakPolarHBondContact O-CB 3.43Å; L983-H986 PolarHBondContact O-N 3.36Å; L983-C987 PolarHBondContact O-N 3.13Å; L983-C987 PolarHBondContact O-SG 3.37Å
984	K	93.8	Very high	90.3	Very high	37 Å²	37	42 Å²	42	16%	0.161	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-44.5	173.2	-167.2	179.9	169.8	-164.1	0	111.5	V967 L971 A980 W981 A982 H986 C987 H988	V967-K984 HydrophobicContact CB-CB 4.48Å; V967-K984 HydrophobicContact CG1-CB 3.86Å; V967-K984 HydrophobicContact CG1-CG 4.45Å; L971-K984 HydrophobicContact CD1-CD 4.42Å; A980-K984 PolarHBondContact O-N 3.27Å; W981-K984 HydrophobicContact CZ3-CD 4.49Å; W981-K984 PolarHBondContact O-N 3.29Å; A982-K984 PolarHBondContact O-N 3.31Å; K984-H986 VanDerWaalsContact C-N 3.3Å; K984-H986 PolarHBondContact O-N 3.32Å; K984-C987 WeakPolarHBondContact O-CB 3.27Å; K984-C987 PolarHBondContact O-N 2.86Å; K984-H988 PolarHBondContact O-CD2 2.72Å; K984-H988 PolarHBondContact O-N 3.23Å
985	G	94	Very high	90.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-39.7	174.6	0	0	0	0	0	112.2	W981 A982 H988 Y989 Y1001	W981-G985 PolarHBondContact O-N 2.93Å; A982-G985 CarbonylContact O-C 3.5Å; A982-G985 PolarHBondContact O-N 3.08Å; G985-H988 PolarHBondContact O-N 3.28Å; G985-Y989 VanDerWaalsContact O-CB 3.28Å; G985-Y989 WeakPolarHBondContact O-CB 3.38Å; G985-Y989 PolarHBondContact O-N 3.25Å; G985-Y1001 VanDerWaalsContact C-CZ 3.41Å; G985-Y1001 PolarHBondContact O-OH 3.49Å; G985-Y1001 VanDerWaalsContact O-OH 3.1Å
986	H	92.6	Very high	91.4	Very high	16 Å²	16	41.3 Å²	41.3	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-63.4	-42.4	175	-66	-24.5	0	0	0	112.5	L955 A982 L983 K984 Y989 L990 Y1001 R1020	L955-H986 HydrophobicContact CD1-CB 4.26Å; A982-H986 PolarHBondContact O-CD2 3.36Å; A982-H986 VanDerWaalsContact O-CG 3.24Å; A982-H986 PolarHBondContact O-N 3.36Å; L983-H986 WeakPolarHBondContact O-CB 3.43Å; L983-H986 PolarHBondContact O-N 3.36Å; K984-H986 VanDerWaalsContact C-N 3.3Å; K984-H986 PolarHBondContact O-N 3.32Å; H986-Y989 PolarHBondContact O-N 3.05Å; H986-L990 VanDerWaalsContact O-CG 3.3Å; H986-L990 WeakPolarHBondContact O-CG 3.3Å; H986-L990 PolarHBondContact O-N 3.28Å; H986-Y1001 WeakPolarHBondContact CA-OH 3.19Å; H986-Y1001 AromaticContact CE1-CE1 3.62Å; H986-Y1001 PolarHBondContact N-OH 3.49Å; H986-Y1001 AromaticContact ND1-CE1 3.38Å; H986-Y1001 WeakPolarHBondContact ND1-CE1 3.46Å; H986-Y1001 AromaticContact ND1-CZ 3.52Å; H986-Y1001 PolarHBondContact ND1-OH 2.91Å; H986-R1020 PolarHBondContact ND1-NH1 3.04Å
987	C	93.4	Very high	91.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.3	-49.7	174.3	-64.1	0	0	0	0	111.6	L955 I964 L983 K984 Y989 L990 Q991	L955-C987 HydrophobicContact CD1-CB 4.43Å; L955-C987 WeakPolarHBondContact CD1-SG 3.35Å; I964-C987 HydrophobicContact CD1-CB 3.86Å; I964-C987 HydrophobicContact CG1-CB 3.51Å; L983-C987 PolarHBondContact O-N 3.13Å; L983-C987 PolarHBondContact O-SG 3.37Å; K984-C987 WeakPolarHBondContact O-CB 3.27Å; K984-C987 PolarHBondContact O-N 2.86Å; C987-Y989 VanDerWaalsContact C-N 3.34Å; C987-Y989 PolarHBondContact O-N 3.3Å; C987-L990 PolarHBondContact O-N 2.99Å; C987-Q991 WeakPolarHBondContact O-CG 3.23Å; C987-Q991 PolarHBondContact O-N 3.17Å
988	H	94.2	Very high	92.4	Very high	23 Å²	23	34.8 Å²	34.8	11%	0.106	18%	0.178	C	C	.	.	H	α-helix	trans	-63.2	-39	178.9	-80.2	-61.6	0	0	0	112.6	K984 G985 L990 Q991 G992 T993 E996 A997	K984-H988 PolarHBondContact O-CD2 2.72Å; K984-H988 PolarHBondContact O-N 3.23Å; G985-H988 PolarHBondContact O-N 3.28Å; H988-L990 PolarHBondContact O-N 3.31Å; H988-Q991 PolarHBondContact O-N 3.45Å; H988-G992 PolarHBondContact O-N 3.17Å; H988-T993 WeakPolarHBondContact CA-OG1 3.35Å; H988-T993 WeakPolarHBondContact CB-OG1 3.32Å; H988-T993 PolarHBondContact ND1-OG1 3.01Å; H988-T993 PolarHBondContact O-N 3.26Å; H988-T993 PolarHBondContact O-OG1 3.25Å; H988-E996 HydrophobicContact CB-CB 4.49Å; H988-A997 HydrophobicContact CB-CB 3.74Å
989	Y	92.8	Very high	92.7	Very high	65 Å²	65	39 Å²	39	26%	0.255	20%	0.196	S	C	.	.	H	α-helix	trans	-61.5	-44	175.2	-176	-90.9	0	0	0	111.6	G985 H986 C987 Q991 G992 F994 Y1001 R1020 I1024	G985-Y989 VanDerWaalsContact O-CB 3.28Å; G985-Y989 WeakPolarHBondContact O-CB 3.38Å; G985-Y989 PolarHBondContact O-N 3.25Å; H986-Y989 PolarHBondContact O-N 3.05Å; C987-Y989 VanDerWaalsContact C-N 3.34Å; C987-Y989 PolarHBondContact O-N 3.3Å; Y989-Q991 VanDerWaalsContact C-N 3.31Å; Y989-Q991 PolarHBondContact O-N 2.84Å; Y989-G992 PolarHBondContact O-N 3.46Å; Y989-G992 VanDerWaalsContact O-N 3.17Å; Y989-F994 HydrophobicContact CD2-CD1 4.07Å; Y989-F994 HydrophobicContact CD2-CE1 4.08Å; Y989-F994 HydrophobicContact CE2-CD1 4.3Å; Y989-F994 HydrophobicContact CE2-CE1 4.07Å; Y989-Y1001 WeakPolarHBondContact CB-OH 3.31Å; Y989-R1020 HydrophobicContact CD1-CG 4.2Å; Y989-R1020 HydrophobicContact CD2-CB 4.04Å; Y989-R1020 HydrophobicContact CD2-CG 4.27Å; Y989-R1020 HydrophobicContact CE1-CG 4.01Å; Y989-R1020 HydrophobicContact CE2-CB 3.96Å; Y989-R1020 HydrophobicContact CE2-CG 4.07Å; Y989-R1020 HydrophobicContact CG-CB 4.47Å; Y989-R1020 HydrophobicContact CG-CG 4.33Å; Y989-I1024 HydrophobicContact CD2-CD1 3.98Å; Y989-I1024 HydrophobicContact CD2-CG1 4.07Å; Y989-I1024 HydrophobicContact CE2-CD1 4.45Å; Y989-I1024 HydrophobicContact CE2-CG1 4.1Å
990	L	90.4	Very high	92.9	Very high	69 Å²	69	37.9 Å²	37.9	36%	0.361	19%	0.191	S	C	.	.	H	α-helix	trans	-70.8	-25.1	177.5	-67.8	173.1	0	0	0	113.1	L955 Y960 H986 C987 H988 G992	L955-L990 HydrophobicContact CD1-CD1 4.1Å; Y960-L990 HydrophobicContact CD1-CB 4.2Å; Y960-L990 HydrophobicContact CD1-CD1 4.23Å; Y960-L990 HydrophobicContact CD2-CB 4.46Å; Y960-L990 HydrophobicContact CE1-CB 3.86Å; Y960-L990 HydrophobicContact CE1-CD1 3.56Å; Y960-L990 HydrophobicContact CE1-CG 4.35Å; Y960-L990 HydrophobicContact CE2-CB 4.13Å; Y960-L990 HydrophobicContact CG-CB 4.49Å; H986-L990 VanDerWaalsContact O-CG 3.3Å; H986-L990 WeakPolarHBondContact O-CG 3.3Å; H986-L990 PolarHBondContact O-N 3.28Å; C987-L990 PolarHBondContact O-N 2.99Å; H988-L990 PolarHBondContact O-N 3.31Å; L990-G992 VanDerWaalsContact C-N 3.33Å
991	Q	91.3	Very high	93.1	Very high	80 Å²	80	37.9 Å²	37.9	37%	0.374	19%	0.191	S	C	.	.	H	α-helix	trans	-77.8	-15.6	170.8	-73.4	178.4	-29.5	0	0	113.5	Y960 C987 H988 Y989	Y960-Q991 HydrophobicContact CD2-CG 3.92Å; Y960-Q991 HydrophobicContact CG-CG 4.05Å; C987-Q991 WeakPolarHBondContact O-CG 3.23Å; C987-Q991 PolarHBondContact O-N 3.17Å; H988-Q991 PolarHBondContact O-N 3.45Å; Y989-Q991 VanDerWaalsContact C-N 3.31Å; Y989-Q991 PolarHBondContact O-N 2.84Å
992	G	90.4	Very high	93	Very high	36 Å²	36	39.1 Å²	39.1	37%	0.371	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	6.6	-175.2	0	0	0	0	0	114.9	H988 Y989 L990 F994	H988-G992 PolarHBondContact O-N 3.17Å; Y989-G992 PolarHBondContact O-N 3.46Å; Y989-G992 VanDerWaalsContact O-N 3.17Å; L990-G992 VanDerWaalsContact C-N 3.33Å; G992-F994 VanDerWaalsContact C-N 3.35Å; G992-F994 VanDerWaalsContact O-CD2 3.31Å; G992-F994 WeakPolarHBondContact O-CD2 3.46Å; G992-F994 WeakPolarHBondContact O-CE2 3.34Å; G992-F994 PolarHBondContact O-N 3.24Å; G992-F994 VanDerWaalsContact O-N 3.11Å
993	T	93.9	Very high	92.8	Very high	47 Å²	47	45.2 Å²	45.2	29%	0.288	22%	0.221	S	C	.	.			trans	-84.3	78.2	174.2	56.9	0	0	0	0	109.5	H988 T995 E996 A997	H988-T993 WeakPolarHBondContact CA-OG1 3.35Å; H988-T993 WeakPolarHBondContact CB-OG1 3.32Å; H988-T993 PolarHBondContact ND1-OG1 3.01Å; H988-T993 PolarHBondContact O-N 3.26Å; H988-T993 PolarHBondContact O-OG1 3.25Å; T993-T995 PolarHBondContact O-N 3.27Å; T993-E996 WeakPolarHBondContact CB-OE2 3.14Å; T993-A997 WeakPolarHBondContact O-CB 3.39Å; T993-A997 PolarHBondContact O-N 3.32Å
994	F	93.4	Very high	92.7	Very high	80 Å²	80	44.8 Å²	44.8	35%	0.351	22%	0.218	S	C	.	.	H	α-helix	trans	-68.8	-30.2	-169.1	-60.7	-61.3	0	0	0	114.3	Y989 G992 A997 R998 I1024 L1027	Y989-F994 HydrophobicContact CD2-CD1 4.07Å; Y989-F994 HydrophobicContact CD2-CE1 4.08Å; Y989-F994 HydrophobicContact CE2-CD1 4.3Å; Y989-F994 HydrophobicContact CE2-CE1 4.07Å; G992-F994 VanDerWaalsContact C-N 3.35Å; G992-F994 VanDerWaalsContact O-CD2 3.31Å; G992-F994 WeakPolarHBondContact O-CD2 3.46Å; G992-F994 WeakPolarHBondContact O-CE2 3.34Å; G992-F994 PolarHBondContact O-N 3.24Å; G992-F994 VanDerWaalsContact O-N 3.11Å; F994-A997 PolarHBondContact O-N 3.45Å; F994-R998 WeakPolarHBondContact O-CB 3.47Å; F994-R998 PolarHBondContact O-N 3.04Å; F994-I1024 HydrophobicContact CB-CG1 4.32Å; F994-I1024 HydrophobicContact CB-CG2 4.14Å; F994-I1024 HydrophobicContact CD1-CG1 4.09Å; F994-L1027 HydrophobicContact CE1-CD1 4.49Å; F994-L1027 HydrophobicContact CE2-CD1 4.43Å; F994-L1027 HydrophobicContact CZ-CD1 4.39Å
995	T	93.1	Very high	92.3	Very high	73 Å²	73	46.1 Å²	46.1	45%	0.448	23%	0.226	S	C	.	.	H	α-helix	trans	-62.5	-50.4	178.7	33.3	0	0	0	0	112.1	T993 R998 E999	T993-T995 PolarHBondContact O-N 3.27Å; T995-R998 PolarHBondContact O-N 2.89Å; T995-E999 PolarHBondContact O-N 3.01Å
996	E	93	Very high	92	Very high	79 Å²	79	51 Å²	51	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-70.6	-34.3	178.2	-64.4	88.7	154.7	0	0	111.3	H988 T993 R998 C1000	H988-E996 HydrophobicContact CB-CB 4.49Å; T993-E996 WeakPolarHBondContact CB-OE2 3.14Å; E996-R998 VanDerWaalsContact C-N 3.35Å; E996-C1000 PolarHBondContact O-N 3.45Å; E996-C1000 VanDerWaalsContact O-N 3.09Å; E996-C1000 PolarHBondContact O-SG 3.23Å
997	A	94.5	Very high	91.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-45.3	175.1	0	0	0	0	0	111.3	H988 T993 F994 C1000 Y1001 I1024	H988-A997 HydrophobicContact CB-CB 3.74Å; T993-A997 WeakPolarHBondContact O-CB 3.39Å; T993-A997 PolarHBondContact O-N 3.32Å; F994-A997 PolarHBondContact O-N 3.45Å; A997-C1000 PolarHBondContact O-N 3.26Å; A997-Y1001 HydrophobicContact CB-CE2 4.21Å; A997-Y1001 WeakPolarHBondContact O-CD2 3.44Å; A997-Y1001 PolarHBondContact O-N 3.14Å; A997-I1024 HydrophobicContact CB-CD1 3.9Å
998	R	94.9	Very high	90.8	Very high	37 Å²	37	58.1 Å²	58.1	14%	0.14	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-51.7	177.6	179.7	-166.4	65.6	177.9	-4.7	111.7	F994 T995 E996 C1000 Y1001 E1002 L1021 I1024 Y1025 E1028	F994-R998 WeakPolarHBondContact O-CB 3.47Å; F994-R998 PolarHBondContact O-N 3.04Å; T995-R998 PolarHBondContact O-N 2.89Å; E996-R998 VanDerWaalsContact C-N 3.35Å; R998-C1000 VanDerWaalsContact C-N 3.26Å; R998-C1000 PolarHBondContact O-N 3.38Å; R998-Y1001 PolarHBondContact O-N 3.23Å; R998-Y1001 VanDerWaalsContact O-N 3.07Å; R998-E1002 WeakPolarHBondContact CD-OE1 3.49Å; R998-E1002 HydrophobicContact CG-CG 4.35Å; R998-E1002 WeakPolarHBondContact CG-OE1 3.44Å; R998-E1002 IonicContact NE-OE1 3.55Å; R998-E1002 WeakPolarHBondContact O-CG 3.3Å; R998-E1002 PolarHBondContact O-N 3.26Å; R998-L1021 HydrophobicContact CB-CD1 4.41Å; R998-L1021 HydrophobicContact CG-CD1 3.75Å; R998-I1024 HydrophobicContact CB-CD1 4.38Å; R998-I1024 HydrophobicContact CB-CG2 4.02Å; R998-Y1025 HydrophobicContact CG-CE1 4.16Å; R998-E1028 IonicContact CZ-OE1 3.23Å; R998-E1028 IonicContact CZ-OE2 3.82Å; R998-E1028 IonicContact NE-OE1 2.58Å; R998-E1028 IonicContact NE-OE2 3.67Å; R998-E1028 IonicContact NH1-OE1 3.92Å; R998-E1028 PolarHBondContact NH1-OE1 3.42Å; R998-E1028 IonicContact NH1-OE2 3.45Å; R998-E1028 PolarHBondContact NH1-OE2 2.98Å
999	E	93.6	Very high	90.1	Very high	97 Å²	97	63.7 Å²	63.7	45%	0.453	33%	0.326	S	S	.	.	H	α-helix	trans	-56.1	-44.7	179.1	-70.7	173.8	-172.4	0	0	110.8	T995 Y1001 E1002 W1003	T995-E999 PolarHBondContact O-N 3.01Å; E999-Y1001 VanDerWaalsContact C-N 3.34Å; E999-Y1001 PolarHBondContact O-N 3.42Å; E999-E1002 PolarHBondContact O-N 2.97Å; E999-W1003 WeakPolarHBondContact O-CB 3.47Å; E999-W1003 PolarHBondContact O-N 3.48Å
1000	C	92.9	Very high	89.4	Confident	5 Å²	5	65 Å²	65	3%	0.034	34%	0.342	C	S	.	.	H	α-helix	trans	-63.1	-37.5	178	-65.8	0	0	0	0	112.9	W981 E996 A997 R998 S1004	W981-C1000 HydrophobicContact CE3-CB 4.25Å; E996-C1000 PolarHBondContact O-N 3.45Å; E996-C1000 VanDerWaalsContact O-N 3.09Å; E996-C1000 PolarHBondContact O-SG 3.23Å; A997-C1000 PolarHBondContact O-N 3.26Å; R998-C1000 VanDerWaalsContact C-N 3.26Å; R998-C1000 PolarHBondContact O-N 3.38Å; C1000-S1004 WeakPolarHBondContact O-CB 3.44Å; C1000-S1004 PolarHBondContact O-N 3.45Å
1001	Y	94	Very high	89.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-70.8	-42.9	176.1	-66.4	-41.7	0	0	0	112.6	G985 H986 Y989 A997 R998 E999 W1003 S1004 M1005 V1017 R1020 L1021 I1024	G985-Y1001 VanDerWaalsContact C-CZ 3.41Å; G985-Y1001 PolarHBondContact O-OH 3.49Å; G985-Y1001 VanDerWaalsContact O-OH 3.1Å; H986-Y1001 WeakPolarHBondContact CA-OH 3.19Å; H986-Y1001 AromaticContact CE1-CE1 3.62Å; H986-Y1001 PolarHBondContact N-OH 3.49Å; H986-Y1001 AromaticContact ND1-CE1 3.38Å; H986-Y1001 WeakPolarHBondContact ND1-CE1 3.46Å; H986-Y1001 AromaticContact ND1-CZ 3.52Å; H986-Y1001 PolarHBondContact ND1-OH 2.91Å; Y989-Y1001 WeakPolarHBondContact CB-OH 3.31Å; A997-Y1001 HydrophobicContact CB-CE2 4.21Å; A997-Y1001 WeakPolarHBondContact O-CD2 3.44Å; A997-Y1001 PolarHBondContact O-N 3.14Å; R998-Y1001 PolarHBondContact O-N 3.23Å; R998-Y1001 VanDerWaalsContact O-N 3.07Å; E999-Y1001 VanDerWaalsContact C-N 3.34Å; E999-Y1001 PolarHBondContact O-N 3.42Å; Y1001-W1003 VanDerWaalsContact C-N 3.34Å; Y1001-W1003 PolarHBondContact O-N 3.39Å; Y1001-S1004 WeakPolarHBondContact O-CB 3.44Å; Y1001-S1004 PolarHBondContact O-N 3.12Å; Y1001-M1005 WeakPolarHBondContact O-CG 3.37Å; Y1001-M1005 PolarHBondContact O-N 3.31Å; Y1001-M1005 VanDerWaalsContact O-N 3.16Å; Y1001-V1017 HydrophobicContact CD1-CB 4.42Å; Y1001-V1017 HydrophobicContact CD1-CG1 3.76Å; Y1001-V1017 HydrophobicContact CD1-CG2 4.18Å; Y1001-V1017 HydrophobicContact CE1-CG2 4.29Å; Y1001-V1017 HydrophobicContact CG-CG1 4.06Å; Y1001-R1020 HydrophobicContact CE2-CB 3.84Å; Y1001-R1020 VanDerWaalsContact OH-CD 3.23Å; Y1001-R1020 WeakPolarHBondContact OH-CD 3.38Å; Y1001-L1021 HydrophobicContact CD2-CB 4.22Å; Y1001-I1024 HydrophobicContact CD2-CD1 3.98Å; Y1001-I1024 HydrophobicContact CE2-CD1 3.85Å
1002	E	91.4	Very high	88.6	Confident	66 Å²	66	62.5 Å²	62.5	31%	0.308	34%	0.34	S	S	.	.	H	α-helix	trans	-58.3	-48.1	174.1	-71.2	172.1	179	0	0	110.1	R998 E999 S1004 M1005 V1006 L1021 Y1025	R998-E1002 WeakPolarHBondContact CD-OE1 3.49Å; R998-E1002 HydrophobicContact CG-CG 4.35Å; R998-E1002 WeakPolarHBondContact CG-OE1 3.44Å; R998-E1002 IonicContact NE-OE1 3.55Å; R998-E1002 WeakPolarHBondContact O-CG 3.3Å; R998-E1002 PolarHBondContact O-N 3.26Å; E999-E1002 PolarHBondContact O-N 2.97Å; E1002-S1004 VanDerWaalsContact C-N 3.33Å; E1002-S1004 PolarHBondContact O-N 3.25Å; E1002-M1005 PolarHBondContact O-N 2.94Å; E1002-M1005 VanDerWaalsContact O-N 3.11Å; E1002-V1006 WeakPolarHBondContact O-CG2 3.37Å; E1002-V1006 PolarHBondContact O-N 3.3Å; E1002-L1021 HydrophobicContact CG-CD1 4.39Å; E1002-Y1025 PolarHBondContact OE1-OH 3.13Å
1003	W	89.2	Confident	88.2	Confident	130 Å²	130	64.9 Å²	64.9	49%	0.492	34%	0.344	S	S	.	.	H	α-helix	trans	-59	-40.6	174.9	-85.1	109.6	0	0	0	113.1	W981 E999 Y1001 M1005 V1006 F1007	W981-W1003 HydrophobicContact CD2-CB 4.07Å; W981-W1003 HydrophobicContact CE3-CB 4.04Å; W981-W1003 HydrophobicContact CG-CB 4.41Å; W981-W1003 HydrophobicContact CZ3-CB 4.45Å; E999-W1003 WeakPolarHBondContact O-CB 3.47Å; E999-W1003 PolarHBondContact O-N 3.48Å; Y1001-W1003 VanDerWaalsContact C-N 3.34Å; Y1001-W1003 PolarHBondContact O-N 3.39Å; W1003-M1005 PolarHBondContact O-N 3.43Å; W1003-V1006 PolarHBondContact O-N 3.46Å; W1003-F1007 HydrophobicContact CE3-CZ 4.35Å; W1003-F1007 WeakPolarHBondContact O-CD2 3.44Å; W1003-F1007 WeakPolarHBondContact O-CE2 3.34Å
1004	S	89.9	Confident	87.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-59.4	-34.8	176.8	-174.6	0	0	0	0	112.3	P978 C1000 Y1001 E1002	P978-S1004 PolarHBondContact O-OG 3.04Å; C1000-S1004 WeakPolarHBondContact O-CB 3.44Å; C1000-S1004 PolarHBondContact O-N 3.45Å; Y1001-S1004 WeakPolarHBondContact O-CB 3.44Å; Y1001-S1004 PolarHBondContact O-N 3.12Å; E1002-S1004 VanDerWaalsContact C-N 3.33Å; E1002-S1004 PolarHBondContact O-N 3.25Å
1005	M	86	Confident	87.7	Confident	65 Å²	65	61 Å²	61	32%	0.32	33%	0.325	S	S	.	.	H	α-helix	trans	-88.5	-13.6	-176.1	-67.5	-178.9	62.2	0	0	114.8	Y1001 E1002 W1003 F1007 V1017 H1018 L1021	Y1001-M1005 WeakPolarHBondContact O-CG 3.37Å; Y1001-M1005 PolarHBondContact O-N 3.31Å; Y1001-M1005 VanDerWaalsContact O-N 3.16Å; E1002-M1005 PolarHBondContact O-N 2.94Å; E1002-M1005 VanDerWaalsContact O-N 3.11Å; W1003-M1005 PolarHBondContact O-N 3.43Å; M1005-F1007 PolarHBondContact O-N 3.27Å; M1005-V1017 HydrophobicContact CG-CG1 4.41Å; M1005-V1017 HydrophobicContact SD-CG1 4.23Å; M1005-H1018 VanDerWaalsContact CE-NE2 3.31Å; M1005-H1018 WeakPolarHBondContact CE-NE2 3.37Å; M1005-L1021 HydrophobicContact SD-CD2 3.89Å
1006	V	87.2	Confident	87.5	Confident	104 Å²	104	57.8 Å²	57.8	63%	0.63	31%	0.305	S	S	*	.	H	α-helix	trans	-70.4	-21.9	178.4	166.8	0	0	0	0	112.2	E1002 W1003	E1002-V1006 WeakPolarHBondContact O-CG2 3.37Å; E1002-V1006 PolarHBondContact O-N 3.3Å; W1003-V1006 PolarHBondContact O-N 3.46Å
1007	F	84.3	Confident	87.4	Confident	34 Å²	34	54 Å²	54	15%	0.149	29%	0.287	C	S	.	.	S	Bend	trans	-81.4	154.6	-175.6	-59.4	-60.5	0	0	0	113.1	Q976 P978 W981 W1003 M1005 E1009	Q976-F1007 HydrophobicContact CB-CD1 4.2Å; Q976-F1007 HydrophobicContact CB-CE1 4.02Å; Q976-F1007 HydrophobicContact CG-CD1 4.26Å; Q976-F1007 HydrophobicContact CG-CE1 3.8Å; P978-F1007 HydrophobicContact CB-CD2 4.47Å; P978-F1007 HydrophobicContact CG-CB 3.89Å; P978-F1007 HydrophobicContact CG-CD2 4.07Å; P978-F1007 HydrophobicContact CG-CG 4.33Å; W981-F1007 AromaticContact CD1-CE2 3.59Å; W981-F1007 HydrophobicContact CG-CE2 4.43Å; W981-F1007 AromaticContact NE1-CE2 3.85Å; W1003-F1007 HydrophobicContact CE3-CZ 4.35Å; W1003-F1007 WeakPolarHBondContact O-CD2 3.44Å; W1003-F1007 WeakPolarHBondContact O-CE2 3.34Å; M1005-F1007 PolarHBondContact O-N 3.27Å; F1007-E1009 VanDerWaalsContact C-N 3.3Å; F1007-E1009 PolarHBondContact O-N 3.27Å
1008	P	77.2	Confident	87.3	Confident	130 Å²	130	54.2 Å²	54.2	84%	0.844	29%	0.288	S	S	*	.	S	Bend	trans	-63.1	-29.9	-176.7	-24.1	34.2	0	0	0	115.2
1009	E	78.8	Confident	87.1	Confident	140 Å²	140	53.2 Å²	53.2	65%	0.654	29%	0.285	S	S	*	.	S	Bend	trans	-96.6	120.6	175.6	-69.7	179.4	174.4	0	0	108.8	P978 F1007	P978-E1009 WeakPolarHBondContact CG-O 3.49Å; F1007-E1009 VanDerWaalsContact C-N 3.3Å; F1007-E1009 PolarHBondContact O-N 3.27Å
1010	P	77.3	Confident	87.1	Confident	92 Å²	92	49.8 Å²	49.8	60%	0.597	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-71.4	152.6	176.9	30.8	-35.1	0	0	0	110.7
1011	P	84	Confident	87.1	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.026	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-62.9	148.5	178	26.6	-34.2	0	0	0	111.7	P978 D979 A982 D1013 T1014 V1017	P978-P1011 HydrophobicContact CB-CB 4.31Å; D979-P1011 VanDerWaalsContact OD1-CA 3.26Å; D979-P1011 WeakPolarHBondContact OD1-CA 3.42Å; A982-P1011 HydrophobicContact CB-CB 4.02Å; P1011-D1013 PolarHBondContact O-N 3.08Å; P1011-D1013 VanDerWaalsContact O-N 3.1Å; P1011-T1014 PolarHBondContact O-N 2.97Å; P1011-T1014 VanDerWaalsContact O-N 3.09Å; P1011-T1014 PolarHBondContact O-OG1 3.44Å; P1011-V1017 HydrophobicContact CG-CG2 4.26Å
1012	S	82.3	Confident	87.1	Confident	94 Å²	94	49.8 Å²	49.8	66%	0.657	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-36	178.4	-64	0	0	0	0	112.2	D979	D979-S1012 PolarHBondContact OD1-N 3.34Å; D979-S1012 PolarHBondContact OD1-OG 2.72Å; D979-S1012 PolarHBondContact OD2-OG 3.13Å
1013	D	80.9	Confident	87.2	Confident	86 Å²	86	48 Å²	48	46%	0.46	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	44.6	-180	-64.7	-36.2	0	0	0	112.2	P1011 H1015 I1016 V1017	P1011-D1013 PolarHBondContact O-N 3.08Å; P1011-D1013 VanDerWaalsContact O-N 3.1Å; D1013-H1015 VanDerWaalsContact C-N 3.25Å; D1013-H1015 PolarHBondContact O-N 3.45Å; D1013-H1015 VanDerWaalsContact O-N 3.17Å; D1013-I1016 HydrophobicContact CB-CG2 3.75Å; D1013-I1016 WeakPolarHBondContact O-CG2 3.48Å; D1013-I1016 PolarHBondContact O-N 3Å; D1013-V1017 WeakPolarHBondContact O-CG2 3.48Å; D1013-V1017 PolarHBondContact O-N 3.37Å
1014	T	88.5	Confident	87.5	Confident	21 Å²	21	41.8 Å²	41.8	13%	0.129	24%	0.241	C	C	.	.	H	α-helix	trans	-52.9	-39.1	-177.9	-68	0	0	0	0	113.6	P1011 V1017 H1018	P1011-T1014 PolarHBondContact O-N 2.97Å; P1011-T1014 VanDerWaalsContact O-N 3.09Å; P1011-T1014 PolarHBondContact O-OG1 3.44Å; T1014-V1017 PolarHBondContact O-N 3.47Å; T1014-H1018 WeakPolarHBondContact CG2-CE1 3.39Å; T1014-H1018 VanDerWaalsContact CG2-ND1 3.29Å; T1014-H1018 WeakPolarHBondContact CG2-ND1 3.06Å; T1014-H1018 PolarHBondContact O-N 3.31Å; T1014-H1018 PolarHBondContact O-ND1 3.31Å
1015	H	89	Confident	87.7	Confident	23 Å²	23	42.8 Å²	42.8	11%	0.106	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-49.5	-178.8	-179.7	61.5	0	0	0	113.4	H642 E646 D1013 V1017 H1018 L1019 S1045	H642-H1015 AromaticContact CE1-CD2 3.55Å; H642-H1015 AromaticContact CE1-CG 3.76Å; H642-H1015 AromaticContact CE1-NE2 3.78Å; H642-H1015 AromaticContact NE2-CD2 3.67Å; H642-H1015 AromaticContact NE2-CE1 3.59Å; H642-H1015 AromaticContact NE2-CG 3.98Å; H642-H1015 AromaticContact NE2-ND1 3.98Å; H642-H1015 AromaticContact NE2-NE2 3.4Å; H642-H1015 PolarHBondContact NE2-NE2 2.93Å; E646-H1015 IonicContact OE2-CD2 3.56Å; E646-H1015 IonicContact OE2-CE1 3.75Å; E646-H1015 PolarHBondContact OE2-CE1 3.46Å; E646-H1015 IonicContact OE2-NE2 2.65Å; E646-H1015 PolarHBondContact OE2-NE2 3.33Å; D1013-H1015 VanDerWaalsContact C-N 3.25Å; D1013-H1015 PolarHBondContact O-N 3.45Å; D1013-H1015 VanDerWaalsContact O-N 3.17Å; H1015-V1017 VanDerWaalsContact C-N 3.32Å; H1015-V1017 PolarHBondContact O-N 2.93Å; H1015-H1018 PolarHBondContact O-N 3.11Å; H1015-L1019 PolarHBondContact O-N 3.39Å; H1015-L1019 VanDerWaalsContact O-N 3.08Å; H1015-S1045 PolarHBondContact CE1-O 2.98Å; H1015-S1045 WeakPolarHBondContact ND1-CB 3.5Å; H1015-S1045 PolarHBondContact ND1-OG 2.95Å
1016	I	88.6	Confident	88.1	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.036	24%	0.238	C	C	.	.	H	α-helix	trans	-72.8	-30	-178.5	-165.8	65.8	0	0	0	111.4	L649 D1013 L1019 R1020	L649-I1016 HydrophobicContact CB-CD1 3.8Å; L649-I1016 HydrophobicContact CB-CG1 4.15Å; L649-I1016 HydrophobicContact CD1-CB 3.96Å; L649-I1016 HydrophobicContact CD1-CD1 4.3Å; L649-I1016 HydrophobicContact CD1-CG1 4.08Å; L649-I1016 HydrophobicContact CD1-CG2 4.27Å; D1013-I1016 HydrophobicContact CB-CG2 3.75Å; D1013-I1016 WeakPolarHBondContact O-CG2 3.48Å; D1013-I1016 PolarHBondContact O-N 3Å; I1016-L1019 HydrophobicContact CD1-CD1 4.27Å; I1016-L1019 PolarHBondContact O-N 3Å; I1016-R1020 HydrophobicContact CG1-CG 4.37Å; I1016-R1020 WeakPolarHBondContact O-CB 3.31Å; I1016-R1020 WeakPolarHBondContact O-CG 3.42Å; I1016-R1020 PolarHBondContact O-N 3.43Å
1017	V	91.6	Very high	88.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.5	-49.5	172.3	172.3	0	0	0	0	110	A982 Y1001 M1005 P1011 D1013 T1014 H1015 L1019 R1020 L1021	A982-V1017 HydrophobicContact CB-CG2 3.84Å; Y1001-V1017 HydrophobicContact CD1-CB 4.42Å; Y1001-V1017 HydrophobicContact CD1-CG1 3.76Å; Y1001-V1017 HydrophobicContact CD1-CG2 4.18Å; Y1001-V1017 HydrophobicContact CE1-CG2 4.29Å; Y1001-V1017 HydrophobicContact CG-CG1 4.06Å; M1005-V1017 HydrophobicContact CG-CG1 4.41Å; M1005-V1017 HydrophobicContact SD-CG1 4.23Å; P1011-V1017 HydrophobicContact CG-CG2 4.26Å; D1013-V1017 WeakPolarHBondContact O-CG2 3.48Å; D1013-V1017 PolarHBondContact O-N 3.37Å; T1014-V1017 PolarHBondContact O-N 3.47Å; H1015-V1017 VanDerWaalsContact C-N 3.32Å; H1015-V1017 PolarHBondContact O-N 2.93Å; V1017-L1019 PolarHBondContact O-N 3.03Å; V1017-R1020 PolarHBondContact O-N 2.9Å; V1017-L1021 WeakPolarHBondContact O-CB 3.2Å; V1017-L1021 PolarHBondContact O-N 2.91Å
1018	H	91.9	Very high	88.7	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.014	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-43.6	177	-74.3	90.6	0	0	0	112.8	M1005 T1014 H1015 R1020 L1021 G1022 V1037 A1041	M1005-H1018 VanDerWaalsContact CE-NE2 3.31Å; M1005-H1018 WeakPolarHBondContact CE-NE2 3.37Å; T1014-H1018 WeakPolarHBondContact CG2-CE1 3.39Å; T1014-H1018 VanDerWaalsContact CG2-ND1 3.29Å; T1014-H1018 WeakPolarHBondContact CG2-ND1 3.06Å; T1014-H1018 PolarHBondContact O-N 3.31Å; T1014-H1018 PolarHBondContact O-ND1 3.31Å; H1015-H1018 PolarHBondContact O-N 3.11Å; H1018-R1020 PolarHBondContact O-N 3.08Å; H1018-L1021 PolarHBondContact O-N 3.43Å; H1018-G1022 PolarHBondContact O-N 2.85Å; H1018-V1037 HydrophobicContact CB-CG1 4.11Å; H1018-V1037 WeakPolarHBondContact O-CG1 3.29Å; H1018-A1041 HydrophobicContact CB-CB 3.74Å
1019	L	91.6	Very high	89.5	Confident	16 Å²	16	43.2 Å²	43.2	8%	0.084	23%	0.232	C	C	.	.	H	α-helix	trans	-59.2	-46.3	177.5	-77.2	176.5	0	0	0	112	E646 H1015 I1016 V1017 A1023 F1038 L1049 T1050	E646-L1019 HydrophobicContact CG-CD1 4.05Å; H1015-L1019 PolarHBondContact O-N 3.39Å; H1015-L1019 VanDerWaalsContact O-N 3.08Å; I1016-L1019 HydrophobicContact CD1-CD1 4.27Å; I1016-L1019 PolarHBondContact O-N 3Å; V1017-L1019 PolarHBondContact O-N 3.03Å; L1019-A1023 VanDerWaalsContact O-CB 3.26Å; L1019-A1023 WeakPolarHBondContact O-CB 3.01Å; L1019-A1023 PolarHBondContact O-N 3.33Å; L1019-F1038 HydrophobicContact CD2-CE1 4.17Å; L1019-L1049 HydrophobicContact CD2-CB 3.9Å; L1019-T1050 HydrophobicContact CD2-CG2 3.58Å; L1019-T1050 HydrophobicContact CG-CG2 4.22Å
1020	R	92.3	Very high	90.2	Very high	26 Å²	26	40.2 Å²	40.2	10%	0.098	22%	0.217	C	C	.	.	H	α-helix	trans	-72	-42.2	-179.5	-70	-178.9	179.8	-165.2	0.8	111.9	L649 H986 Y989 Y1001 I1016 V1017 H1018 A1023 I1024	L649-R1020 PolarHBondContact O-NH2 3.18Å; H986-R1020 PolarHBondContact ND1-NH1 3.04Å; Y989-R1020 HydrophobicContact CD1-CG 4.2Å; Y989-R1020 HydrophobicContact CD2-CB 4.04Å; Y989-R1020 HydrophobicContact CD2-CG 4.27Å; Y989-R1020 HydrophobicContact CE1-CG 4.01Å; Y989-R1020 HydrophobicContact CE2-CB 3.96Å; Y989-R1020 HydrophobicContact CE2-CG 4.07Å; Y989-R1020 HydrophobicContact CG-CB 4.47Å; Y989-R1020 HydrophobicContact CG-CG 4.33Å; Y1001-R1020 HydrophobicContact CE2-CB 3.84Å; Y1001-R1020 VanDerWaalsContact OH-CD 3.23Å; Y1001-R1020 WeakPolarHBondContact OH-CD 3.38Å; I1016-R1020 HydrophobicContact CG1-CG 4.37Å; I1016-R1020 WeakPolarHBondContact O-CB 3.31Å; I1016-R1020 WeakPolarHBondContact O-CG 3.42Å; I1016-R1020 PolarHBondContact O-N 3.43Å; V1017-R1020 PolarHBondContact O-N 2.9Å; H1018-R1020 PolarHBondContact O-N 3.08Å; R1020-A1023 PolarHBondContact O-N 3.11Å; R1020-I1024 VanDerWaalsContact O-CG1 3.26Å; R1020-I1024 WeakPolarHBondContact O-CG1 3.48Å; R1020-I1024 PolarHBondContact O-N 3.4Å
1021	L	93.6	Very high	91	Very high	4 Å²	4	38 Å²	38	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-63.2	-48	177.4	179.5	58.8	0	0	0	111.5	R998 Y1001 E1002 M1005 V1017 H1018 A1023 I1024 Y1025 V1037	R998-L1021 HydrophobicContact CB-CD1 4.41Å; R998-L1021 HydrophobicContact CG-CD1 3.75Å; Y1001-L1021 HydrophobicContact CD2-CB 4.22Å; E1002-L1021 HydrophobicContact CG-CD1 4.39Å; M1005-L1021 HydrophobicContact SD-CD2 3.89Å; V1017-L1021 WeakPolarHBondContact O-CB 3.2Å; V1017-L1021 PolarHBondContact O-N 2.91Å; H1018-L1021 PolarHBondContact O-N 3.43Å; L1021-A1023 VanDerWaalsContact C-N 3.32Å; L1021-A1023 PolarHBondContact O-N 2.96Å; L1021-I1024 PolarHBondContact O-N 3.5Å; L1021-Y1025 HydrophobicContact CD1-CD2 4.24Å; L1021-Y1025 HydrophobicContact CD1-CE2 3.73Å; L1021-Y1025 HydrophobicContact CD2-CE2 4.23Å; L1021-Y1025 HydrophobicContact CG-CD2 4.13Å; L1021-Y1025 HydrophobicContact CG-CE2 3.72Å; L1021-Y1025 WeakPolarHBondContact O-CD2 3.2Å; L1021-Y1025 PolarHBondContact O-N 2.82Å; L1021-V1037 HydrophobicContact CB-CG1 4.38Å; L1021-V1037 HydrophobicContact CD2-CG1 4.34Å; L1021-V1037 HydrophobicContact CD2-CG2 4.18Å; L1021-V1037 HydrophobicContact CG-CG1 4.34Å; L1021-V1037 HydrophobicContact CG-CG2 4.44Å
1022	G	94	Very high	91.5	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-39.9	175.6	0	0	0	0	0	112.4	H1018 Y1025 I1026 F1038	H1018-G1022 PolarHBondContact O-N 2.85Å; G1022-Y1025 PolarHBondContact O-N 3.29Å; G1022-I1026 WeakPolarHBondContact O-CG1 3.45Å; G1022-I1026 PolarHBondContact O-N 2.94Å; G1022-F1038 VanDerWaalsContact C-CZ 3.44Å; G1022-F1038 WeakPolarHBondContact O-CE2 3.42Å
1023	A	92.8	Very high	92.1	Very high	29 Å²	29	42 Å²	42	24%	0.24	21%	0.208	C	C	.	.	H	α-helix	trans	-63.7	-41.3	174	0	0	0	0	0	112.3	L1019 R1020 L1021 I1026 L1027	L1019-A1023 VanDerWaalsContact O-CB 3.26Å; L1019-A1023 WeakPolarHBondContact O-CB 3.01Å; L1019-A1023 PolarHBondContact O-N 3.33Å; R1020-A1023 PolarHBondContact O-N 3.11Å; L1021-A1023 VanDerWaalsContact C-N 3.32Å; L1021-A1023 PolarHBondContact O-N 2.96Å; A1023-I1026 PolarHBondContact O-N 3.11Å; A1023-L1027 WeakPolarHBondContact O-CG 3.45Å; A1023-L1027 PolarHBondContact O-N 2.95Å
1024	I	94.9	Very high	92.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-44.5	174.5	-66.1	160.9	0	0	0	110.5	Y989 F994 A997 R998 Y1001 R1020 L1021 I1026 L1027 E1028	Y989-I1024 HydrophobicContact CD2-CD1 3.98Å; Y989-I1024 HydrophobicContact CD2-CG1 4.07Å; Y989-I1024 HydrophobicContact CE2-CD1 4.45Å; Y989-I1024 HydrophobicContact CE2-CG1 4.1Å; F994-I1024 HydrophobicContact CB-CG1 4.32Å; F994-I1024 HydrophobicContact CB-CG2 4.14Å; F994-I1024 HydrophobicContact CD1-CG1 4.09Å; A997-I1024 HydrophobicContact CB-CD1 3.9Å; R998-I1024 HydrophobicContact CB-CD1 4.38Å; R998-I1024 HydrophobicContact CB-CG2 4.02Å; Y1001-I1024 HydrophobicContact CD2-CD1 3.98Å; Y1001-I1024 HydrophobicContact CE2-CD1 3.85Å; R1020-I1024 VanDerWaalsContact O-CG1 3.26Å; R1020-I1024 WeakPolarHBondContact O-CG1 3.48Å; R1020-I1024 PolarHBondContact O-N 3.4Å; L1021-I1024 PolarHBondContact O-N 3.5Å; I1024-I1026 VanDerWaalsContact C-N 3.31Å; I1024-I1026 PolarHBondContact O-N 3.46Å; I1024-L1027 WeakPolarHBondContact O-CB 3.39Å; I1024-L1027 PolarHBondContact O-N 3.48Å; I1024-L1027 VanDerWaalsContact O-N 3.08Å; I1024-E1028 HydrophobicContact CG2-CG 4.18Å; I1024-E1028 PolarHBondContact O-N 3.38Å
1025	Y	95.6	Very high	93.1	Very high	21 Å²	21	39.1 Å²	39.1	8%	0.082	19%	0.19	C	C	.	.	H	α-helix	trans	-63.1	-35.3	177.8	-74.4	-46.6	0	0	0	113.4	R998 E1002 L1021 G1022 L1027 E1028 E1029 K1030 Q1033 V1037	R998-Y1025 HydrophobicContact CG-CE1 4.16Å; E1002-Y1025 PolarHBondContact OE1-OH 3.13Å; L1021-Y1025 HydrophobicContact CD1-CD2 4.24Å; L1021-Y1025 HydrophobicContact CD1-CE2 3.73Å; L1021-Y1025 HydrophobicContact CD2-CE2 4.23Å; L1021-Y1025 HydrophobicContact CG-CD2 4.13Å; L1021-Y1025 HydrophobicContact CG-CE2 3.72Å; L1021-Y1025 WeakPolarHBondContact O-CD2 3.2Å; L1021-Y1025 PolarHBondContact O-N 2.82Å; G1022-Y1025 PolarHBondContact O-N 3.29Å; Y1025-L1027 VanDerWaalsContact C-N 3.34Å; Y1025-E1028 PolarHBondContact O-N 3.48Å; Y1025-E1029 PolarHBondContact O-N 3.21Å; Y1025-K1030 HydrophobicContact CD1-CB 3.95Å; Y1025-K1030 HydrophobicContact CD1-CD 4.06Å; Y1025-K1030 HydrophobicContact CE1-CD 4.33Å; Y1025-K1030 HydrophobicContact CG-CB 4.45Å; Y1025-K1030 PolarHBondContact O-N 3.29Å; Y1025-Q1033 HydrophobicContact CD1-CB 4.14Å; Y1025-Q1033 HydrophobicContact CD2-CB 3.94Å; Y1025-Q1033 HydrophobicContact CE1-CB 4.15Å; Y1025-Q1033 HydrophobicContact CE2-CB 3.93Å; Y1025-Q1033 HydrophobicContact CG-CB 4.05Å; Y1025-V1037 HydrophobicContact CD2-CG2 4.12Å; Y1025-V1037 HydrophobicContact CE2-CG2 3.8Å
1026	I	93.7	Very high	93.3	Very high	32 Å²	32	43.5 Å²	43.5	16%	0.164	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-42.8	171.8	-70.4	176.9	0	0	0	110.7	G1022 A1023 I1024 E1029 A1034 F1038 K1056	G1022-I1026 WeakPolarHBondContact O-CG1 3.45Å; G1022-I1026 PolarHBondContact O-N 2.94Å; A1023-I1026 PolarHBondContact O-N 3.11Å; I1024-I1026 VanDerWaalsContact C-N 3.31Å; I1024-I1026 PolarHBondContact O-N 3.46Å; I1026-E1029 PolarHBondContact O-N 3.36Å; I1026-A1034 HydrophobicContact CG1-CB 3.82Å; I1026-F1038 HydrophobicContact CD1-CD2 4.49Å; I1026-F1038 HydrophobicContact CD1-CE2 3.63Å; I1026-F1038 HydrophobicContact CD1-CZ 4.33Å; I1026-F1038 HydrophobicContact CG1-CE2 4.25Å; I1026-K1056 HydrophobicContact CD1-CB 3.86Å; I1026-K1056 HydrophobicContact CD1-CD 4.41Å
1027	L	91.9	Very high	93.5	Very high	109 Å²	109	43.8 Å²	43.8	57%	0.571	21%	0.212	S	C	*	.	H	α-helix	trans	-66.1	-35.7	178.4	-69.2	171.3	0	0	0	112.7	F994 A1023 I1024 Y1025 E1029	F994-L1027 HydrophobicContact CE1-CD1 4.49Å; F994-L1027 HydrophobicContact CE2-CD1 4.43Å; F994-L1027 HydrophobicContact CZ-CD1 4.39Å; A1023-L1027 WeakPolarHBondContact O-CG 3.45Å; A1023-L1027 PolarHBondContact O-N 2.95Å; I1024-L1027 WeakPolarHBondContact O-CB 3.39Å; I1024-L1027 PolarHBondContact O-N 3.48Å; I1024-L1027 VanDerWaalsContact O-N 3.08Å; Y1025-L1027 VanDerWaalsContact C-N 3.34Å; L1027-E1029 PolarHBondContact O-N 3.48Å
1028	E	92.8	Very high	93.7	Very high	51 Å²	51	44.1 Å²	44.1	24%	0.238	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	5.2	175.5	-67.7	-172.2	170.3	0	0	113.7	R998 I1024 Y1025 K1030	R998-E1028 IonicContact CZ-OE1 3.23Å; R998-E1028 IonicContact CZ-OE2 3.82Å; R998-E1028 IonicContact NE-OE1 2.58Å; R998-E1028 IonicContact NE-OE2 3.67Å; R998-E1028 IonicContact NH1-OE1 3.92Å; R998-E1028 PolarHBondContact NH1-OE1 3.42Å; R998-E1028 IonicContact NH1-OE2 3.45Å; R998-E1028 PolarHBondContact NH1-OE2 2.98Å; I1024-E1028 HydrophobicContact CG2-CG 4.18Å; I1024-E1028 PolarHBondContact O-N 3.38Å; Y1025-E1028 PolarHBondContact O-N 3.48Å; E1028-K1030 HydrophobicContact CB-CD 4.4Å; E1028-K1030 HydrophobicContact CB-CG 4.18Å; E1028-K1030 PolarHBondContact O-N 3.41Å; E1028-K1030 WeakPolarHBondContact OE2-CE 3.41Å; E1028-K1030 IonicContact OE2-NZ 3.64Å
1029	E	92.5	Very high	93.8	Very high	150 Å²	150	47.2 Å²	47.2	70%	0.701	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	20	-176.2	-53.8	-176.6	167.6	0	0	114.7	Y1025 I1026 L1027 F1031	Y1025-E1029 PolarHBondContact O-N 3.21Å; I1026-E1029 PolarHBondContact O-N 3.36Å; L1027-E1029 PolarHBondContact O-N 3.48Å; E1029-F1031 VanDerWaalsContact C-N 3.34Å; E1029-F1031 HydrophobicContact CB-CE2 4.04Å; E1029-F1031 HydrophobicContact CB-CZ 3.82Å; E1029-F1031 HydrophobicContact CG-CZ 4.13Å; E1029-F1031 WeakPolarHBondContact O-CD2 3.46Å; E1029-F1031 PolarHBondContact O-N 3.28Å; E1029-F1031 VanDerWaalsContact O-N 3.17Å
1030	K	94.3	Very high	93.7	Very high	77 Å²	77	50.6 Å²	50.6	34%	0.335	25%	0.245	S	C	.	.			trans	-89.3	65.4	177.6	-67.3	-172.2	-176.2	-173.7	0	111.3	Y1025 E1028 I1032 Q1033 A1034	Y1025-K1030 HydrophobicContact CD1-CB 3.95Å; Y1025-K1030 HydrophobicContact CD1-CD 4.06Å; Y1025-K1030 HydrophobicContact CE1-CD 4.33Å; Y1025-K1030 HydrophobicContact CG-CB 4.45Å; Y1025-K1030 PolarHBondContact O-N 3.29Å; E1028-K1030 HydrophobicContact CB-CD 4.4Å; E1028-K1030 HydrophobicContact CB-CG 4.18Å; E1028-K1030 PolarHBondContact O-N 3.41Å; E1028-K1030 WeakPolarHBondContact OE2-CE 3.41Å; E1028-K1030 IonicContact OE2-NZ 3.64Å; K1030-I1032 PolarHBondContact O-N 3.48Å; K1030-Q1033 PolarHBondContact O-N 3.28Å; K1030-Q1033 PolarHBondContact O-OE1 2.88Å; K1030-A1034 PolarHBondContact O-N 2.89Å
1031	F	94.5	Very high	93.6	Very high	45 Å²	45	49.3 Å²	49.3	20%	0.197	24%	0.241	C	C	.	.	H	α-helix	trans	-68.1	-27.9	-168.3	-51.1	-59.7	0	0	0	114.9	E1029 K1035 R1060 L1061	E1029-F1031 VanDerWaalsContact C-N 3.34Å; E1029-F1031 HydrophobicContact CB-CE2 4.04Å; E1029-F1031 HydrophobicContact CB-CZ 3.82Å; E1029-F1031 HydrophobicContact CG-CZ 4.13Å; E1029-F1031 WeakPolarHBondContact O-CD2 3.46Å; E1029-F1031 PolarHBondContact O-N 3.28Å; E1029-F1031 VanDerWaalsContact O-N 3.17Å; F1031-K1035 WeakPolarHBondContact O-CB 3.38Å; F1031-K1035 PolarHBondContact O-N 3.47Å; F1031-R1060 HydrophobicContact CB-CB 4.49Å; F1031-R1060 HydrophobicContact CD1-CB 3.53Å; F1031-R1060 HydrophobicContact CD1-CG 3.98Å; F1031-R1060 HydrophobicContact CD2-CB 3.92Å; F1031-R1060 HydrophobicContact CE1-CB 3.59Å; F1031-R1060 HydrophobicContact CE1-CG 3.68Å; F1031-R1060 HydrophobicContact CE2-CB 3.97Å; F1031-R1060 HydrophobicContact CG-CB 3.7Å; F1031-R1060 HydrophobicContact CZ-CB 3.81Å; F1031-R1060 HydrophobicContact CZ-CG 4.08Å; F1031-L1061 HydrophobicContact CB-CD1 4.33Å; F1031-L1061 HydrophobicContact CB-CD2 3.74Å; F1031-L1061 HydrophobicContact CB-CG 3.71Å
1032	I	94.8	Very high	93.5	Very high	102 Å²	102	49.7 Å²	49.7	52%	0.523	24%	0.243	S	C	.	.	H	α-helix	trans	-67.6	-50.5	177.7	-60.3	175.1	0	0	0	109.8	K1030 A1034 K1035 E1036 L1061	K1030-I1032 PolarHBondContact O-N 3.48Å; I1032-A1034 VanDerWaalsContact C-N 3.32Å; I1032-A1034 PolarHBondContact O-N 2.97Å; I1032-K1035 WeakPolarHBondContact O-CB 3.49Å; I1032-K1035 PolarHBondContact O-N 2.86Å; I1032-E1036 PolarHBondContact O-N 3.04Å; I1032-E1036 VanDerWaalsContact O-N 3.13Å; I1032-L1061 HydrophobicContact CG1-CD2 3.83Å
1033	Q	93.8	Very high	93.2	Very high	79 Å²	79	57.3 Å²	57.3	37%	0.369	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-39.8	176.2	-63.9	90.9	-21.6	0	0	111.5	Y1025 K1030 K1035 E1036 V1037	Y1025-Q1033 HydrophobicContact CD1-CB 4.14Å; Y1025-Q1033 HydrophobicContact CD2-CB 3.94Å; Y1025-Q1033 HydrophobicContact CE1-CB 4.15Å; Y1025-Q1033 HydrophobicContact CE2-CB 3.93Å; Y1025-Q1033 HydrophobicContact CG-CB 4.05Å; K1030-Q1033 PolarHBondContact O-N 3.28Å; K1030-Q1033 PolarHBondContact O-OE1 2.88Å; Q1033-K1035 VanDerWaalsContact C-N 3.32Å; Q1033-K1035 PolarHBondContact O-N 3.49Å; Q1033-E1036 PolarHBondContact O-N 3.37Å; Q1033-V1037 WeakPolarHBondContact O-CG2 3.26Å; Q1033-V1037 PolarHBondContact O-N 2.91Å
1034	A	95.2	Very high	92.9	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.4	-45.5	174.5	0	0	0	0	0	111.8	I1026 K1030 I1032 E1036 V1037 F1038 A1057	I1026-A1034 HydrophobicContact CG1-CB 3.82Å; K1030-A1034 PolarHBondContact O-N 2.89Å; I1032-A1034 VanDerWaalsContact C-N 3.32Å; I1032-A1034 PolarHBondContact O-N 2.97Å; A1034-E1036 PolarHBondContact O-N 2.73Å; A1034-V1037 PolarHBondContact O-N 3.48Å; A1034-F1038 HydrophobicContact CB-CD2 4.48Å; A1034-F1038 WeakPolarHBondContact O-CB 3.35Å; A1034-F1038 WeakPolarHBondContact O-CD2 3.26Å; A1034-F1038 PolarHBondContact O-N 3.24Å; A1034-A1057 HydrophobicContact CB-CB 4.02Å
1035	K	95.1	Very high	92.4	Very high	48 Å²	48	62.6 Å²	62.6	21%	0.209	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-45.9	177.5	-180	-179.3	175.1	179.7	0	111.5	F1031 I1032 Q1033 F1038 L1039 L1054 A1057 L1061 E1063	F1031-K1035 WeakPolarHBondContact O-CB 3.38Å; F1031-K1035 PolarHBondContact O-N 3.47Å; I1032-K1035 WeakPolarHBondContact O-CB 3.49Å; I1032-K1035 PolarHBondContact O-N 2.86Å; Q1033-K1035 VanDerWaalsContact C-N 3.32Å; Q1033-K1035 PolarHBondContact O-N 3.49Å; K1035-F1038 PolarHBondContact O-N 3.46Å; K1035-L1039 HydrophobicContact CG-CD1 4.03Å; K1035-L1039 WeakPolarHBondContact O-CB 3.19Å; K1035-L1039 VanDerWaalsContact O-CG 3.26Å; K1035-L1039 WeakPolarHBondContact O-CG 3.11Å; K1035-L1039 PolarHBondContact O-N 3.43Å; K1035-L1054 HydrophobicContact CB-CD1 4.49Å; K1035-L1054 HydrophobicContact CG-CD1 3.77Å; K1035-A1057 HydrophobicContact CB-CB 4.14Å; K1035-L1061 HydrophobicContact CB-CD1 4.38Å; K1035-L1061 HydrophobicContact CD-CD1 3.95Å; K1035-E1063 VanDerWaalsContact NZ-CD 3.28Å; K1035-E1063 IonicContact NZ-OE1 3.07Å; K1035-E1063 PolarHBondContact NZ-OE1 3.16Å; K1035-E1063 VanDerWaalsContact NZ-OE1 3.07Å; K1035-E1063 IonicContact NZ-OE2 2.66Å; K1035-E1063 PolarHBondContact NZ-OE2 3.12Å
1036	E	94.1	Very high	92	Very high	115 Å²	115	64.4 Å²	64.4	54%	0.537	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-47.6	179.2	-70	174.5	176.4	0	0	112.2	I1032 Q1033 A1034 L1039 Q1040	I1032-E1036 PolarHBondContact O-N 3.04Å; I1032-E1036 VanDerWaalsContact O-N 3.13Å; Q1033-E1036 PolarHBondContact O-N 3.37Å; A1034-E1036 PolarHBondContact O-N 2.73Å; E1036-L1039 PolarHBondContact O-N 3.24Å; E1036-Q1040 WeakPolarHBondContact O-CG 3.15Å; E1036-Q1040 PolarHBondContact O-N 2.62Å; E1036-Q1040 VanDerWaalsContact O-N 3.09Å
1037	V	93.6	Very high	91.8	Very high	13 Å²	13	62.9 Å²	62.9	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-64.6	-42.2	178.7	173.7	0	0	0	0	111.7	H1018 L1021 Y1025 Q1033 A1034 Q1040 A1041	H1018-V1037 HydrophobicContact CB-CG1 4.11Å; H1018-V1037 WeakPolarHBondContact O-CG1 3.29Å; L1021-V1037 HydrophobicContact CB-CG1 4.38Å; L1021-V1037 HydrophobicContact CD2-CG1 4.34Å; L1021-V1037 HydrophobicContact CD2-CG2 4.18Å; L1021-V1037 HydrophobicContact CG-CG1 4.34Å; L1021-V1037 HydrophobicContact CG-CG2 4.44Å; Y1025-V1037 HydrophobicContact CD2-CG2 4.12Å; Y1025-V1037 HydrophobicContact CE2-CG2 3.8Å; Q1033-V1037 WeakPolarHBondContact O-CG2 3.26Å; Q1033-V1037 PolarHBondContact O-N 2.91Å; A1034-V1037 PolarHBondContact O-N 3.48Å; V1037-Q1040 PolarHBondContact O-N 3.01Å; V1037-A1041 WeakPolarHBondContact O-CB 3.32Å; V1037-A1041 PolarHBondContact O-N 3.21Å
1038	F	94.8	Very high	91.6	Very high	6 Å²	6	58 Å²	58	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-70.1	-31.1	177.8	-77.4	-60.8	0	0	0	113	L1019 G1022 I1026 A1034 K1035 A1041 C1042 G1053 L1054	L1019-F1038 HydrophobicContact CD2-CE1 4.17Å; G1022-F1038 VanDerWaalsContact C-CZ 3.44Å; G1022-F1038 WeakPolarHBondContact O-CE2 3.42Å; I1026-F1038 HydrophobicContact CD1-CD2 4.49Å; I1026-F1038 HydrophobicContact CD1-CE2 3.63Å; I1026-F1038 HydrophobicContact CD1-CZ 4.33Å; I1026-F1038 HydrophobicContact CG1-CE2 4.25Å; A1034-F1038 HydrophobicContact CB-CD2 4.48Å; A1034-F1038 WeakPolarHBondContact O-CB 3.35Å; A1034-F1038 WeakPolarHBondContact O-CD2 3.26Å; A1034-F1038 PolarHBondContact O-N 3.24Å; K1035-F1038 PolarHBondContact O-N 3.46Å; F1038-A1041 PolarHBondContact O-N 3.18Å; F1038-C1042 WeakPolarHBondContact O-CB 3.35Å; F1038-C1042 PolarHBondContact O-N 3.06Å; F1038-C1042 PolarHBondContact O-SG 3.18Å; F1038-G1053 WeakPolarHBondContact CD2-O 3.37Å; F1038-L1054 HydrophobicContact CB-CB 3.95Å; F1038-L1054 HydrophobicContact CB-CD1 4.4Å
1039	L	93.6	Very high	91.5	Very high	69 Å²	69	57.6 Å²	57.6	36%	0.361	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-48.1	171.4	-77.7	168.4	0	0	0	111	K1035 E1036 A1041 C1042 E1043 L1054	K1035-L1039 HydrophobicContact CG-CD1 4.03Å; K1035-L1039 WeakPolarHBondContact O-CB 3.19Å; K1035-L1039 VanDerWaalsContact O-CG 3.26Å; K1035-L1039 WeakPolarHBondContact O-CG 3.11Å; K1035-L1039 PolarHBondContact O-N 3.43Å; E1036-L1039 PolarHBondContact O-N 3.24Å; L1039-A1041 VanDerWaalsContact C-N 3.28Å; L1039-A1041 PolarHBondContact O-N 3.29Å; L1039-C1042 PolarHBondContact O-N 3.17Å; L1039-C1042 VanDerWaalsContact O-N 3.12Å; L1039-E1043 WeakPolarHBondContact O-CG 3.32Å; L1039-E1043 PolarHBondContact O-N 2.6Å; L1039-L1054 HydrophobicContact CD2-CD1 3.96Å; L1039-L1054 HydrophobicContact CD2-CD2 3.62Å; L1039-L1054 HydrophobicContact CD2-CG 4.47Å; L1039-L1054 HydrophobicContact CG-CD1 3.77Å; L1039-L1054 HydrophobicContact CG-CD2 4.29Å
1040	Q	89.8	Confident	91.5	Very high	86 Å²	86	50.5 Å²	50.5	40%	0.402	25%	0.248	S	C	.	.	H	α-helix	trans	-58.1	-41.7	174.7	-69.8	176.2	-12.7	0	0	111.7	E1036 V1037 C1042 E1043 Q1044	E1036-Q1040 WeakPolarHBondContact O-CG 3.15Å; E1036-Q1040 PolarHBondContact O-N 2.62Å; E1036-Q1040 VanDerWaalsContact O-N 3.09Å; V1037-Q1040 PolarHBondContact O-N 3.01Å; Q1040-C1042 PolarHBondContact O-N 3.08Å; Q1040-E1043 PolarHBondContact O-N 3.05Å; Q1040-Q1044 WeakPolarHBondContact O-CG 3.4Å; Q1040-Q1044 PolarHBondContact O-N 3.37Å; Q1040-Q1044 VanDerWaalsContact O-N 3.08Å
1041	A	90.2	Very high	91.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-42.3	175.7	0	0	0	0	0	112.4	H1018 V1037 F1038 L1039 E1043 Q1044 S1045 T1050	H1018-A1041 HydrophobicContact CB-CB 3.74Å; V1037-A1041 WeakPolarHBondContact O-CB 3.32Å; V1037-A1041 PolarHBondContact O-N 3.21Å; F1038-A1041 PolarHBondContact O-N 3.18Å; L1039-A1041 VanDerWaalsContact C-N 3.28Å; L1039-A1041 PolarHBondContact O-N 3.29Å; A1041-E1043 VanDerWaalsContact C-N 3.31Å; A1041-E1043 PolarHBondContact O-N 2.84Å; A1041-Q1044 PolarHBondContact O-N 2.93Å; A1041-S1045 CarbonylContact O-C 3.58Å; A1041-S1045 VanDerWaalsContact O-C 3.25Å; A1041-S1045 PolarHBondContact O-N 3.36Å; A1041-T1050 HydrophobicContact CB-CG2 3.69Å
1042	C	91.2	Very high	91.5	Very high	11 Å²	11	47.5 Å²	47.5	7%	0.074	23%	0.234	C	C	.	.	H	α-helix	trans	-67.1	-31.7	178	-67.8	0	0	0	0	112.6	F1038 L1039 Q1040 P1046 T1050 W1051	F1038-C1042 WeakPolarHBondContact O-CB 3.35Å; F1038-C1042 PolarHBondContact O-N 3.06Å; F1038-C1042 PolarHBondContact O-SG 3.18Å; L1039-C1042 PolarHBondContact O-N 3.17Å; L1039-C1042 VanDerWaalsContact O-N 3.12Å; Q1040-C1042 PolarHBondContact O-N 3.08Å; C1042-P1046 WeakPolarHBondContact O-CB 3.49Å; C1042-T1050 PolarHBondContact SG-OG1 2.8Å; C1042-T1050 VanDerWaalsContact SG-OG1 3.4Å; C1042-W1051 HydrophobicContact CB-CD2 4.38Å; C1042-W1051 HydrophobicContact CB-CH2 4.22Å; C1042-W1051 HydrophobicContact CB-CZ2 3.85Å
1043	E	88.6	Confident	91.4	Very high	161 Å²	161	42.9 Å²	42.9	75%	0.752	21%	0.212	S	C	*	.	H	α-helix	trans	-71.8	-40.8	175.8	-72.2	178	-179.8	0	0	112.3	L1039 Q1040 A1041	L1039-E1043 WeakPolarHBondContact O-CG 3.32Å; L1039-E1043 PolarHBondContact O-N 2.6Å; Q1040-E1043 PolarHBondContact O-N 3.05Å; A1041-E1043 VanDerWaalsContact C-N 3.31Å; A1041-E1043 PolarHBondContact O-N 2.84Å
1044	Q	85.5	Confident	91.5	Very high	120 Å²	120	39.4 Å²	39.4	56%	0.561	20%	0.195	S	C	*	.	H	α-helix	trans	-82.4	-47.7	-176.9	-66.8	-178.3	6.1	0	0	112.9	Q1040 A1041	Q1040-Q1044 WeakPolarHBondContact O-CG 3.4Å; Q1040-Q1044 PolarHBondContact O-N 3.37Å; Q1040-Q1044 VanDerWaalsContact O-N 3.08Å; A1041-Q1044 PolarHBondContact O-N 2.93Å
1045	S	83.9	Confident	91.5	Very high	19 Å²	19	39.4 Å²	39.4	13%	0.133	20%	0.195	C	C	.	.	S	Bend	trans	-147.6	80.3	-173	41	0	0	0	0	110.7	H1015 A1041 S1047	H1015-S1045 PolarHBondContact CE1-O 2.98Å; H1015-S1045 WeakPolarHBondContact ND1-CB 3.5Å; H1015-S1045 PolarHBondContact ND1-OG 2.95Å; A1041-S1045 CarbonylContact O-C 3.58Å; A1041-S1045 VanDerWaalsContact O-C 3.25Å; A1041-S1045 PolarHBondContact O-N 3.36Å; S1045-S1047 PolarHBondContact O-N 3.35Å
1046	P	87.7	Confident	91.4	Very high	60 Å²	60	38.8 Å²	38.8	39%	0.39	19%	0.193	S	C	.	.			trans	-65.9	123.1	-177.2	25.1	-32.8	0	0	0	111.1	C1042	C1042-P1046 WeakPolarHBondContact O-CB 3.49Å
1047	S	89.3	Confident	91.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.167	C	C	.	.			trans	-136.1	164.4	174	83.6	0	0	0	0	111.7	E646 S1045 L1049 T1050 W1051	E646-S1047 PolarHBondContact OE1-OG 3.37Å; E646-S1047 WeakPolarHBondContact OE2-CB 3.28Å; E646-S1047 PolarHBondContact OE2-OG 2.75Å; S1045-S1047 PolarHBondContact O-N 3.35Å; S1047-L1049 PolarHBondContact O-N 2.91Å; S1047-L1049 PolarHBondContact OG-N 3.1Å; S1047-T1050 PolarHBondContact N-OG1 3.27Å; S1047-T1050 PolarHBondContact O-N 3.12Å; S1047-T1050 PolarHBondContact O-OG1 3.46Å; S1047-T1050 PolarHBondContact OG-N 2.86Å; S1047-W1051 PolarHBondContact O-N 3.46Å; S1047-W1051 VanDerWaalsContact O-N 3.13Å
1048	C	88.7	Confident	91.6	Very high	6 Å²	6	32.7 Å²	32.7	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-55	-37.8	174.1	170.1	0	0	0	0	111.4	L1052 L1077 N1078 N1081	C1048-L1052 WeakPolarHBondContact O-CB 3.46Å; C1048-L1052 PolarHBondContact O-N 3.4Å; C1048-L1077 HydrophobicContact CB-CB 4.31Å; C1048-N1078 HydrophobicContact CB-CB 3.72Å; C1048-N1081 PolarHBondContact SG-ND2 3.37Å
1049	L	90.9	Very high	91.5	Very high	43 Å²	43	32.7 Å²	32.7	23%	0.225	16%	0.163	C	C	.	.	H	α-helix	trans	-73.2	-36.2	-179.3	-63	-175.2	0	0	0	113	E646 T650 L1019 S1047 L1052 G1053	E646-L1049 HydrophobicContact CG-CD1 4.03Å; E646-L1049 WeakPolarHBondContact OE1-CD1 3.34Å; E646-L1049 WeakPolarHBondContact OE1-CG 3.31Å; T650-L1049 HydrophobicContact CG2-CD1 3.95Å; L1019-L1049 HydrophobicContact CD2-CB 3.9Å; S1047-L1049 PolarHBondContact O-N 2.91Å; S1047-L1049 PolarHBondContact OG-N 3.1Å; L1049-L1052 HydrophobicContact CD2-CD2 4.33Å; L1049-G1053 PolarHBondContact O-N 2.87Å
1050	T	92.7	Very high	91.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-66.6	-45	176.3	61.8	0	0	0	0	111.1	L1019 A1041 C1042 S1047 G1053 L1054	L1019-T1050 HydrophobicContact CD2-CG2 3.58Å; L1019-T1050 HydrophobicContact CG-CG2 4.22Å; A1041-T1050 HydrophobicContact CB-CG2 3.69Å; C1042-T1050 PolarHBondContact SG-OG1 2.8Å; C1042-T1050 VanDerWaalsContact SG-OG1 3.4Å; S1047-T1050 PolarHBondContact N-OG1 3.27Å; S1047-T1050 PolarHBondContact O-N 3.12Å; S1047-T1050 PolarHBondContact O-OG1 3.46Å; S1047-T1050 PolarHBondContact OG-N 2.86Å; T1050-G1053 PolarHBondContact O-N 3.43Å; T1050-L1054 PolarHBondContact O-N 3.34Å
1051	W	94.4	Very high	91.7	Very high	57 Å²	57	32.3 Å²	32.3	22%	0.216	16%	0.157	C	C	.	.	H	α-helix	trans	-68.2	-36.3	177.6	-75.5	108.1	0	0	0	112.6	C1042 S1047 L1054 G1055 A1070 V1073 A1074	C1042-W1051 HydrophobicContact CB-CD2 4.38Å; C1042-W1051 HydrophobicContact CB-CH2 4.22Å; C1042-W1051 HydrophobicContact CB-CZ2 3.85Å; S1047-W1051 PolarHBondContact O-N 3.46Å; S1047-W1051 VanDerWaalsContact O-N 3.13Å; W1051-L1054 HydrophobicContact CE3-CD2 3.86Å; W1051-L1054 HydrophobicContact CZ3-CD2 3.71Å; W1051-L1054 PolarHBondContact O-N 3.04Å; W1051-G1055 PolarHBondContact O-N 2.93Å; W1051-A1070 HydrophobicContact CE3-CB 3.97Å; W1051-A1070 HydrophobicContact CZ3-CB 4.43Å; W1051-V1073 HydrophobicContact CD2-CB 4.17Å; W1051-V1073 HydrophobicContact CD2-CG1 3.83Å; W1051-V1073 HydrophobicContact CE3-CB 4.38Å; W1051-V1073 HydrophobicContact CE3-CG1 4.45Å; W1051-V1073 HydrophobicContact CG-CB 4.41Å; W1051-V1073 HydrophobicContact CG-CG1 3.99Å; W1051-V1073 HydrophobicContact CZ2-CG1 4.22Å; W1051-A1074 HydrophobicContact CB-CB 3.78Å
1052	L	93.8	Very high	91.7	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-62.5	-45.1	170.8	173.6	58.6	0	0	0	111.4	C1048 L1049 L1054 G1055 K1056 L1071 E1083 V1084 Y1087	C1048-L1052 WeakPolarHBondContact O-CB 3.46Å; C1048-L1052 PolarHBondContact O-N 3.4Å; L1049-L1052 HydrophobicContact CD2-CD2 4.33Å; L1052-L1054 VanDerWaalsContact C-N 3.35Å; L1052-L1054 PolarHBondContact O-N 3.17Å; L1052-G1055 PolarHBondContact O-N 2.95Å; L1052-K1056 HydrophobicContact CD1-CD 4.47Å; L1052-K1056 HydrophobicContact CD1-CG 4.24Å; L1052-K1056 VanDerWaalsContact O-CG 3.31Å; L1052-K1056 WeakPolarHBondContact O-CG 3.49Å; L1052-K1056 PolarHBondContact O-N 3.34Å; L1052-L1071 HydrophobicContact CD1-CD2 3.65Å; L1052-E1083 HydrophobicContact CD2-CB 4.25Å; L1052-E1083 HydrophobicContact CD2-CG 4.4Å; L1052-E1083 WeakPolarHBondContact CD2-OE2 3.49Å; L1052-V1084 HydrophobicContact CB-CG2 4.19Å; L1052-V1084 HydrophobicContact CD1-CG2 3.92Å; L1052-V1084 HydrophobicContact CD2-CG2 4.11Å; L1052-V1084 HydrophobicContact CG-CG2 4.29Å; L1052-Y1087 HydrophobicContact CD1-CD2 4.25Å
1053	G	92.6	Very high	91.8	Very high	5 Å²	5	37.6 Å²	37.6	5%	0.052	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-44	175.4	0	0	0	0	0	112.8	F1038 L1049 T1050 K1056 A1057	F1038-G1053 WeakPolarHBondContact CD2-O 3.37Å; L1049-G1053 PolarHBondContact O-N 2.87Å; T1050-G1053 PolarHBondContact O-N 3.43Å; G1053-K1056 PolarHBondContact O-N 3.43Å; G1053-A1057 PolarHBondContact O-N 3.47Å
1054	L	95.4	Very high	91.9	Very high	6 Å²	6	32 Å²	32	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-47.5	174.2	-177.7	58.5	0	0	0	111.9	K1035 F1038 L1039 T1050 W1051 L1052 K1056 A1057 C1058 A1070	K1035-L1054 HydrophobicContact CB-CD1 4.49Å; K1035-L1054 HydrophobicContact CG-CD1 3.77Å; F1038-L1054 HydrophobicContact CB-CB 3.95Å; F1038-L1054 HydrophobicContact CB-CD1 4.4Å; L1039-L1054 HydrophobicContact CD2-CD1 3.96Å; L1039-L1054 HydrophobicContact CD2-CD2 3.62Å; L1039-L1054 HydrophobicContact CD2-CG 4.47Å; L1039-L1054 HydrophobicContact CG-CD1 3.77Å; L1039-L1054 HydrophobicContact CG-CD2 4.29Å; T1050-L1054 PolarHBondContact O-N 3.34Å; W1051-L1054 HydrophobicContact CE3-CD2 3.86Å; W1051-L1054 HydrophobicContact CZ3-CD2 3.71Å; W1051-L1054 PolarHBondContact O-N 3.04Å; L1052-L1054 VanDerWaalsContact C-N 3.35Å; L1052-L1054 PolarHBondContact O-N 3.17Å; L1054-K1056 VanDerWaalsContact C-N 3.34Å; L1054-K1056 PolarHBondContact O-N 3.06Å; L1054-A1057 PolarHBondContact O-N 2.93Å; L1054-C1058 PolarHBondContact O-N 3.4Å; L1054-A1070 HydrophobicContact CB-CB 4.48Å; L1054-A1070 HydrophobicContact CD2-CB 4.21Å; L1054-A1070 HydrophobicContact CG-CB 4.21Å
1055	G	95.1	Very high	92.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.2	-42.3	177.1	0	0	0	0	0	112.7	W1051 L1052 Y1059	W1051-G1055 PolarHBondContact O-N 2.93Å; L1052-G1055 PolarHBondContact O-N 2.95Å; G1055-Y1059 VanDerWaalsContact O-CB 3.31Å; G1055-Y1059 WeakPolarHBondContact O-CB 3.49Å; G1055-Y1059 PolarHBondContact O-N 2.84Å
1056	K	94.4	Very high	92.6	Very high	35 Å²	35	32.7 Å²	32.7	15%	0.152	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-49.1	173.8	-72.5	-179.2	-170.6	179.2	0	111.5	I1026 L1052 G1053 L1054 Y1059 R1060 E1083 Y1087	I1026-K1056 HydrophobicContact CD1-CB 3.86Å; I1026-K1056 HydrophobicContact CD1-CD 4.41Å; L1052-K1056 HydrophobicContact CD1-CD 4.47Å; L1052-K1056 HydrophobicContact CD1-CG 4.24Å; L1052-K1056 VanDerWaalsContact O-CG 3.31Å; L1052-K1056 WeakPolarHBondContact O-CG 3.49Å; L1052-K1056 PolarHBondContact O-N 3.34Å; G1053-K1056 PolarHBondContact O-N 3.43Å; L1054-K1056 VanDerWaalsContact C-N 3.34Å; L1054-K1056 PolarHBondContact O-N 3.06Å; K1056-Y1059 PolarHBondContact O-N 3.16Å; K1056-R1060 VanDerWaalsContact O-CG 3.3Å; K1056-R1060 WeakPolarHBondContact O-CG 3.42Å; K1056-R1060 PolarHBondContact O-N 3.37Å; K1056-E1083 VanDerWaalsContact CE-CD 3.45Å; K1056-E1083 WeakPolarHBondContact CE-OE1 3.11Å; K1056-E1083 IonicContact NZ-OE1 3.9Å; K1056-E1083 PolarHBondContact NZ-OE1 3.37Å; K1056-E1083 IonicContact NZ-OE2 3.97Å; K1056-E1083 PolarHBondContact NZ-OE2 3.3Å; K1056-Y1087 HydrophobicContact CD-CE2 3.95Å; K1056-Y1087 VanDerWaalsContact CE-CE2 3.41Å; K1056-Y1087 HydrophobicContact CG-CD1 4.26Å; K1056-Y1087 HydrophobicContact CG-CD2 4.12Å; K1056-Y1087 HydrophobicContact CG-CE1 3.87Å; K1056-Y1087 HydrophobicContact CG-CE2 3.76Å; K1056-Y1087 HydrophobicContact CG-CG 4.38Å
1057	A	95.6	Very high	92.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-47.8	179.9	0	0	0	0	0	111.7	A1034 K1035 G1053 L1054 Y1059 R1060 L1061	A1034-A1057 HydrophobicContact CB-CB 4.02Å; K1035-A1057 HydrophobicContact CB-CB 4.14Å; G1053-A1057 PolarHBondContact O-N 3.47Å; L1054-A1057 PolarHBondContact O-N 2.93Å; A1057-Y1059 PolarHBondContact O-N 2.94Å; A1057-R1060 PolarHBondContact O-N 3.07Å; A1057-L1061 WeakPolarHBondContact O-CG 3.32Å; A1057-L1061 PolarHBondContact O-N 3.19Å
1058	C	94.8	Very high	93	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-40.4	176.7	-77	0	0	0	0	112.8	L1054 R1060 L1061 G1062 E1063 A1067	L1054-C1058 PolarHBondContact O-N 3.4Å; C1058-R1060 PolarHBondContact O-N 3.03Å; C1058-L1061 PolarHBondContact O-N 3.11Å; C1058-G1062 PolarHBondContact O-N 3.17Å; C1058-G1062 VanDerWaalsContact O-N 3.14Å; C1058-E1063 HydrophobicContact CB-CB 4.3Å; C1058-E1063 PolarHBondContact O-N 3.07Å; C1058-A1067 HydrophobicContact CB-CB 3.79Å
1059	Y	94.4	Very high	93.2	Very high	5 Å²	5	39 Å²	39	2%	0.02	21%	0.208	C	C	.	.	H	α-helix	trans	-60.1	-45.2	175.3	172.3	-88.8	0	0	0	111.7	G1055 K1056 A1057 L1061 G1062 L1064 Y1087 L1090 I1091 K1094 E1121	G1055-Y1059 VanDerWaalsContact O-CB 3.31Å; G1055-Y1059 WeakPolarHBondContact O-CB 3.49Å; G1055-Y1059 PolarHBondContact O-N 2.84Å; K1056-Y1059 PolarHBondContact O-N 3.16Å; A1057-Y1059 PolarHBondContact O-N 2.94Å; Y1059-L1061 VanDerWaalsContact C-N 3.28Å; Y1059-L1061 PolarHBondContact O-N 3.24Å; Y1059-G1062 PolarHBondContact O-N 3.36Å; Y1059-L1064 HydrophobicContact CD2-CD2 3.96Å; Y1059-L1064 HydrophobicContact CE2-CD2 4.29Å; Y1059-Y1087 HydrophobicContact CD1-CE1 4.42Å; Y1059-Y1087 HydrophobicContact CG-CD1 4.47Å; Y1059-L1090 HydrophobicContact CE2-CB 3.82Å; Y1059-I1091 HydrophobicContact CD2-CD1 4.38Å; Y1059-I1091 HydrophobicContact CD2-CG1 3.57Å; Y1059-I1091 HydrophobicContact CE2-CG1 4.09Å; Y1059-K1094 HydrophobicContact CE2-CD 3.82Å; Y1059-K1094 VanDerWaalsContact CZ-NZ 3.28Å; Y1059-K1094 WeakPolarHBondContact OH-CE 3.49Å; Y1059-K1094 PolarHBondContact OH-NZ 3.27Å; Y1059-E1121 VanDerWaalsContact CE1-OE1 3.31Å; Y1059-E1121 WeakPolarHBondContact CE1-OE1 3.44Å; Y1059-E1121 PolarHBondContact OH-OE1 2.82Å
1060	R	93.2	Very high	93.3	Very high	85 Å²	85	37.1 Å²	37.1	32%	0.321	20%	0.199	S	C	.	.	H	α-helix	trans	-68.3	-27.7	179.5	-63.8	-65	-169.5	-123.7	13.4	112.3	F1031 K1056 A1057 C1058 G1062 E1121	F1031-R1060 HydrophobicContact CB-CB 4.49Å; F1031-R1060 HydrophobicContact CD1-CB 3.53Å; F1031-R1060 HydrophobicContact CD1-CG 3.98Å; F1031-R1060 HydrophobicContact CD2-CB 3.92Å; F1031-R1060 HydrophobicContact CE1-CB 3.59Å; F1031-R1060 HydrophobicContact CE1-CG 3.68Å; F1031-R1060 HydrophobicContact CE2-CB 3.97Å; F1031-R1060 HydrophobicContact CG-CB 3.7Å; F1031-R1060 HydrophobicContact CZ-CB 3.81Å; F1031-R1060 HydrophobicContact CZ-CG 4.08Å; K1056-R1060 VanDerWaalsContact O-CG 3.3Å; K1056-R1060 WeakPolarHBondContact O-CG 3.42Å; K1056-R1060 PolarHBondContact O-N 3.37Å; A1057-R1060 PolarHBondContact O-N 3.07Å; C1058-R1060 PolarHBondContact O-N 3.03Å; R1060-G1062 VanDerWaalsContact C-N 3.28Å; R1060-E1121 IonicContact CZ-OE2 3.33Å; R1060-E1121 IonicContact NH1-OE1 3.94Å; R1060-E1121 PolarHBondContact NH1-OE1 2.65Å; R1060-E1121 IonicContact NH1-OE2 2.65Å; R1060-E1121 PolarHBondContact NH1-OE2 3.05Å; R1060-E1121 IonicContact NH2-OE2 3.64Å; R1060-E1121 PolarHBondContact NH2-OE2 3.43Å
1061	L	92.9	Very high	93.3	Very high	62 Å²	62	37.1 Å²	37.1	33%	0.325	20%	0.199	S	C	.	.	H	α-helix	trans	-76.1	-10.1	170.3	-70.1	169.6	0	0	0	113.9	F1031 I1032 K1035 A1057 C1058 Y1059 E1063	F1031-L1061 HydrophobicContact CB-CD1 4.33Å; F1031-L1061 HydrophobicContact CB-CD2 3.74Å; F1031-L1061 HydrophobicContact CB-CG 3.71Å; I1032-L1061 HydrophobicContact CG1-CD2 3.83Å; K1035-L1061 HydrophobicContact CB-CD1 4.38Å; K1035-L1061 HydrophobicContact CD-CD1 3.95Å; A1057-L1061 WeakPolarHBondContact O-CG 3.32Å; A1057-L1061 PolarHBondContact O-N 3.19Å; C1058-L1061 PolarHBondContact O-N 3.11Å; Y1059-L1061 VanDerWaalsContact C-N 3.28Å; Y1059-L1061 PolarHBondContact O-N 3.24Å; L1061-E1063 VanDerWaalsContact C-N 3.34Å; L1061-E1063 HydrophobicContact CB-CG 4.34Å
1062	G	90.3	Very high	93.1	Very high	52 Å²	52	37 Å²	37	54%	0.536	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	7	-176.9	0	0	0	0	0	114.6	C1058 Y1059 R1060 L1064	C1058-G1062 PolarHBondContact O-N 3.17Å; C1058-G1062 VanDerWaalsContact O-N 3.14Å; Y1059-G1062 PolarHBondContact O-N 3.36Å; R1060-G1062 VanDerWaalsContact C-N 3.28Å; G1062-L1064 VanDerWaalsContact C-N 3.27Å; G1062-L1064 PolarHBondContact O-N 3.36Å
1063	E	93.7	Very high	92.9	Very high	71 Å²	71	39.5 Å²	39.5	33%	0.332	23%	0.225	S	C	.	.			trans	-81.3	69.5	176.6	-63.2	179.4	-179.4	0	0	110.6	K1035 C1058 L1061 C1065 V1066 A1067	K1035-E1063 VanDerWaalsContact NZ-CD 3.28Å; K1035-E1063 IonicContact NZ-OE1 3.07Å; K1035-E1063 PolarHBondContact NZ-OE1 3.16Å; K1035-E1063 VanDerWaalsContact NZ-OE1 3.07Å; K1035-E1063 IonicContact NZ-OE2 2.66Å; K1035-E1063 PolarHBondContact NZ-OE2 3.12Å; C1058-E1063 HydrophobicContact CB-CB 4.3Å; C1058-E1063 PolarHBondContact O-N 3.07Å; L1061-E1063 VanDerWaalsContact C-N 3.34Å; L1061-E1063 HydrophobicContact CB-CG 4.34Å; E1063-C1065 PolarHBondContact O-N 3.19Å; E1063-V1066 HydrophobicContact CB-CB 4.4Å; E1063-V1066 PolarHBondContact O-N 3.47Å; E1063-A1067 WeakPolarHBondContact O-CB 3.5Å; E1063-A1067 PolarHBondContact O-N 3.48Å
1064	L	91.7	Very high	92.8	Very high	43 Å²	43	39.2 Å²	39.2	23%	0.225	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-40.6	-169.8	-61.9	179.4	0	0	0	113.8	Y1059 G1062 A1067 E1068 I1091 K1094	Y1059-L1064 HydrophobicContact CD2-CD2 3.96Å; Y1059-L1064 HydrophobicContact CE2-CD2 4.29Å; G1062-L1064 VanDerWaalsContact C-N 3.27Å; G1062-L1064 PolarHBondContact O-N 3.36Å; L1064-A1067 PolarHBondContact O-N 3.26Å; L1064-E1068 WeakPolarHBondContact O-CB 3.45Å; L1064-E1068 PolarHBondContact O-N 3.28Å; L1064-I1091 HydrophobicContact CB-CG2 4.31Å; L1064-I1091 HydrophobicContact CD2-CG1 4.42Å; L1064-K1094 HydrophobicContact CD1-CB 4.18Å
1065	C	90.1	Very high	92.5	Very high	91 Å²	91	40 Å²	40	62%	0.615	23%	0.228	S	C	*	.	H	α-helix	trans	-65.2	-44.6	-179.3	-54.5	0	0	0	0	112.3	E1063 A1067 E1068 E1069	E1063-C1065 PolarHBondContact O-N 3.19Å; C1065-A1067 VanDerWaalsContact C-N 3.32Å; C1065-A1067 PolarHBondContact O-N 3.06Å; C1065-E1068 PolarHBondContact O-N 2.96Å; C1065-E1069 WeakPolarHBondContact O-CG 3.47Å; C1065-E1069 PolarHBondContact O-N 3.09Å
1066	V	92.1	Very high	92	Very high	62 Å²	62	45.1 Å²	45.1	38%	0.376	26%	0.255	S	S	.	.	H	α-helix	trans	-68.1	-37	179.4	-176.4	0	0	0	0	110.4	E1063 E1068 E1069 A1070	E1063-V1066 HydrophobicContact CB-CB 4.4Å; E1063-V1066 PolarHBondContact O-N 3.47Å; V1066-E1068 VanDerWaalsContact C-N 3.35Å; V1066-E1069 PolarHBondContact O-N 3.4Å; V1066-A1070 WeakPolarHBondContact O-CB 3.46Å; V1066-A1070 PolarHBondContact O-N 3.41Å
1067	A	93.6	Very high	91.5	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-41.1	174.4	0	0	0	0	0	112	C1058 E1063 L1064 C1065 L1071 I1091	C1058-A1067 HydrophobicContact CB-CB 3.79Å; E1063-A1067 WeakPolarHBondContact O-CB 3.5Å; E1063-A1067 PolarHBondContact O-N 3.48Å; L1064-A1067 PolarHBondContact O-N 3.26Å; C1065-A1067 VanDerWaalsContact C-N 3.32Å; C1065-A1067 PolarHBondContact O-N 3.06Å; A1067-L1071 WeakPolarHBondContact O-CB 3.49Å; A1067-L1071 WeakPolarHBondContact O-CD1 3.35Å; A1067-L1071 VanDerWaalsContact O-CG 3.22Å; A1067-L1071 WeakPolarHBondContact O-CG 3.31Å; A1067-L1071 PolarHBondContact O-N 3.24Å; A1067-I1091 HydrophobicContact CB-CD1 3.7Å
1068	E	93	Very high	90.9	Very high	67 Å²	67	46.1 Å²	46.1	31%	0.313	26%	0.261	S	S	.	.	H	α-helix	trans	-64	-46.2	177	-168.5	176	174.4	0	0	111.8	L1064 C1065 V1066 A1070 L1071 A1072 L1088 I1091	L1064-E1068 WeakPolarHBondContact O-CB 3.45Å; L1064-E1068 PolarHBondContact O-N 3.28Å; C1065-E1068 PolarHBondContact O-N 2.96Å; V1066-E1068 VanDerWaalsContact C-N 3.35Å; E1068-A1070 PolarHBondContact O-N 3.03Å; E1068-L1071 PolarHBondContact O-N 3.09Å; E1068-A1072 WeakPolarHBondContact O-CB 3.45Å; E1068-A1072 PolarHBondContact O-N 3.34Å; E1068-L1088 HydrophobicContact CG-CD2 4.28Å; E1068-I1091 HydrophobicContact CB-CG2 4.23Å
1069	E	93	Very high	90.4	Very high	132 Å²	132	49.1 Å²	49.1	62%	0.617	28%	0.282	S	S	*	.	H	α-helix	trans	-59.4	-46.9	176.3	-71.5	175	-172.4	0	0	111.8	C1065 V1066 L1071 A1072 V1073	C1065-E1069 WeakPolarHBondContact O-CG 3.47Å; C1065-E1069 PolarHBondContact O-N 3.09Å; V1066-E1069 PolarHBondContact O-N 3.4Å; E1069-L1071 PolarHBondContact O-N 3.33Å; E1069-A1072 PolarHBondContact O-N 2.93Å; E1069-V1073 WeakPolarHBondContact O-CG2 3.43Å; E1069-V1073 PolarHBondContact O-N 3.46Å; E1069-V1073 VanDerWaalsContact O-N 3.11Å
1070	A	92.3	Very high	89.8	Confident	4 Å²	4	51.2 Å²	51.2	3%	0.033	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-42.2	178.6	0	0	0	0	0	112.2	W1051 L1054 V1066 E1068 V1073 A1074	W1051-A1070 HydrophobicContact CE3-CB 3.97Å; W1051-A1070 HydrophobicContact CZ3-CB 4.43Å; L1054-A1070 HydrophobicContact CB-CB 4.48Å; L1054-A1070 HydrophobicContact CD2-CB 4.21Å; L1054-A1070 HydrophobicContact CG-CB 4.21Å; V1066-A1070 WeakPolarHBondContact O-CB 3.46Å; V1066-A1070 PolarHBondContact O-N 3.41Å; E1068-A1070 PolarHBondContact O-N 3.03Å; A1070-V1073 PolarHBondContact O-N 2.94Å; A1070-A1074 PolarHBondContact O-N 3.21Å
1071	L	93.3	Very high	89.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-74.4	-28.9	179	-67.7	168.4	0	0	0	112.9	L1052 A1067 E1068 E1069 A1074 T1075 V1084 L1088 I1091	L1052-L1071 HydrophobicContact CD1-CD2 3.65Å; A1067-L1071 WeakPolarHBondContact O-CB 3.49Å; A1067-L1071 WeakPolarHBondContact O-CD1 3.35Å; A1067-L1071 VanDerWaalsContact O-CG 3.22Å; A1067-L1071 WeakPolarHBondContact O-CG 3.31Å; A1067-L1071 PolarHBondContact O-N 3.24Å; E1068-L1071 PolarHBondContact O-N 3.09Å; E1069-L1071 PolarHBondContact O-N 3.33Å; L1071-A1074 WeakPolarHBondContact O-CB 3.44Å; L1071-A1074 PolarHBondContact O-N 3.09Å; L1071-T1075 PolarHBondContact O-N 2.98Å; L1071-T1075 PolarHBondContact O-OG1 2.99Å; L1071-V1084 HydrophobicContact CB-CG1 4.2Å; L1071-V1084 HydrophobicContact CD2-CG1 4.1Å; L1071-V1084 WeakPolarHBondContact O-CG1 3.22Å; L1071-L1088 HydrophobicContact CB-CD1 4.44Å; L1071-L1088 HydrophobicContact CB-CD2 3.59Å; L1071-L1088 HydrophobicContact CB-CG 3.83Å; L1071-L1088 HydrophobicContact CD1-CD2 4.24Å; L1071-L1088 HydrophobicContact CD1-CG 4.33Å; L1071-I1091 HydrophobicContact CD1-CD1 3.42Å; L1071-I1091 VanDerWaalsContact CD1-CD1 3.42Å
1072	A	90.3	Very high	89.2	Confident	55 Å²	55	46.2 Å²	46.2	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-63.5	-42.7	170.6	0	0	0	0	0	111	E1068 E1069 T1075 L1076	E1068-A1072 WeakPolarHBondContact O-CB 3.45Å; E1068-A1072 PolarHBondContact O-N 3.34Å; E1069-A1072 PolarHBondContact O-N 2.93Å; A1072-T1075 WeakPolarHBondContact O-CB 3.44Å; A1072-T1075 PolarHBondContact O-N 3.45Å; A1072-L1076 PolarHBondContact O-N 3.43Å
1073	V	89.4	Confident	89.2	Confident	54 Å²	54	46.1 Å²	46.1	33%	0.327	27%	0.268	S	S	.	.	H	α-helix	trans	-64.5	-40.4	172.8	178.4	0	0	0	0	111.2	W1051 E1069 A1070 T1075 L1076 L1077	W1051-V1073 HydrophobicContact CD2-CB 4.17Å; W1051-V1073 HydrophobicContact CD2-CG1 3.83Å; W1051-V1073 HydrophobicContact CE3-CB 4.38Å; W1051-V1073 HydrophobicContact CE3-CG1 4.45Å; W1051-V1073 HydrophobicContact CG-CB 4.41Å; W1051-V1073 HydrophobicContact CG-CG1 3.99Å; W1051-V1073 HydrophobicContact CZ2-CG1 4.22Å; E1069-V1073 WeakPolarHBondContact O-CG2 3.43Å; E1069-V1073 PolarHBondContact O-N 3.46Å; E1069-V1073 VanDerWaalsContact O-N 3.11Å; A1070-V1073 PolarHBondContact O-N 2.94Å; V1073-T1075 VanDerWaalsContact C-N 3.29Å; V1073-T1075 PolarHBondContact O-N 3.26Å; V1073-L1076 WeakPolarHBondContact O-CB 3.37Å; V1073-L1076 PolarHBondContact O-N 3.21Å; V1073-L1077 PolarHBondContact O-N 3.4Å; V1073-L1077 VanDerWaalsContact O-N 3.16Å
1074	A	90	Very high	89.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-40.7	175.2	0	0	0	0	0	112.2	W1051 A1070 L1071 L1076 L1077 N1078 V1084	W1051-A1074 HydrophobicContact CB-CB 3.78Å; A1070-A1074 PolarHBondContact O-N 3.21Å; L1071-A1074 WeakPolarHBondContact O-CB 3.44Å; L1071-A1074 PolarHBondContact O-N 3.09Å; A1074-L1076 VanDerWaalsContact C-N 3.32Å; A1074-L1076 PolarHBondContact O-N 3.43Å; A1074-L1077 PolarHBondContact O-N 2.9Å; A1074-N1078 PolarHBondContact O-N 3.23Å; A1074-V1084 HydrophobicContact CB-CG1 3.98Å; A1074-V1084 HydrophobicContact CB-CG2 3.93Å
1075	T	89.2	Confident	89.2	Confident	23 Å²	23	42.4 Å²	42.4	14%	0.141	25%	0.248	C	C	.	.	H	α-helix	trans	-65.8	-35.5	177.1	-53.5	0	0	0	0	111.8	L1071 A1072 V1073 L1077 N1078 S1079 V1084 W1085	L1071-T1075 PolarHBondContact O-N 2.98Å; L1071-T1075 PolarHBondContact O-OG1 2.99Å; A1072-T1075 WeakPolarHBondContact O-CB 3.44Å; A1072-T1075 PolarHBondContact O-N 3.45Å; V1073-T1075 VanDerWaalsContact C-N 3.29Å; V1073-T1075 PolarHBondContact O-N 3.26Å; T1075-L1077 VanDerWaalsContact C-N 3.31Å; T1075-L1077 PolarHBondContact O-N 3.46Å; T1075-N1078 CarbonylContact O-C 3.25Å; T1075-S1079 WeakPolarHBondContact O-CA 3.46Å; T1075-S1079 PolarHBondContact O-N 2.93Å; T1075-S1079 VanDerWaalsContact O-N 3.16Å; T1075-V1084 VanDerWaalsContact OG1-CG1 3.23Å; T1075-V1084 WeakPolarHBondContact OG1-CG1 3.31Å; T1075-W1085 HydrophobicContact CG2-CH2 3.61Å; T1075-W1085 HydrophobicContact CG2-CZ2 3.39Å; T1075-W1085 HydrophobicContact CG2-CZ3 4.39Å
1076	L	85.9	Confident	89.3	Confident	107 Å²	107	38 Å²	38	56%	0.56	22%	0.219	S	C	*	.	H	α-helix	trans	-64.9	-35.3	175.3	-173.3	66	0	0	0	112.2	M633 A1072 V1073 A1074	M633-L1076 HydrophobicContact CE-CD2 4.45Å; M633-L1076 HydrophobicContact SD-CD1 3.68Å; M633-L1076 HydrophobicContact SD-CD2 3.68Å; M633-L1076 HydrophobicContact SD-CG 3.76Å; A1072-L1076 PolarHBondContact O-N 3.43Å; V1073-L1076 WeakPolarHBondContact O-CB 3.37Å; V1073-L1076 PolarHBondContact O-N 3.21Å; A1074-L1076 VanDerWaalsContact C-N 3.32Å; A1074-L1076 PolarHBondContact O-N 3.43Å
1077	L	83.9	Confident	89.3	Confident	32 Å²	32	35.7 Å²	35.7	17%	0.168	20%	0.203	C	C	.	.	H	α-helix	trans	-80.3	-37.4	179.4	-66	175.1	0	0	0	112.9	F643 C1048 V1073 A1074 T1075	F643-L1077 HydrophobicContact CZ-CB 4.48Å; F643-L1077 HydrophobicContact CZ-CD2 4.41Å; C1048-L1077 HydrophobicContact CB-CB 4.31Å; V1073-L1077 PolarHBondContact O-N 3.4Å; V1073-L1077 VanDerWaalsContact O-N 3.16Å; A1074-L1077 PolarHBondContact O-N 2.9Å; T1075-L1077 VanDerWaalsContact C-N 3.31Å; T1075-L1077 PolarHBondContact O-N 3.46Å
1078	N	82.3	Confident	89.3	Confident	23 Å²	23	36.1 Å²	36.1	12%	0.123	21%	0.206	C	C	.	.			trans	-148.7	100.1	174.7	179.4	7.9	0	0	0	110.6	Q655 C1048 A1074 T1075 A1080 N1081	Q655-N1078 PolarHBondContact NE2-ND2 3.01Å; Q655-N1078 VanDerWaalsContact NE2-ND2 3.13Å; C1048-N1078 HydrophobicContact CB-CB 3.72Å; A1074-N1078 PolarHBondContact O-N 3.23Å; T1075-N1078 CarbonylContact O-C 3.25Å; N1078-A1080 PolarHBondContact O-N 3.45Å; N1078-A1080 WeakPolarHBondContact OD1-CB 3.31Å; N1078-A1080 PolarHBondContact OD1-N 3.39Å; N1078-N1081 PolarHBondContact O-N 3.31Å
1079	S	83.4	Confident	89.3	Confident	63 Å²	63	33 Å²	33	44%	0.441	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-16.1	179.4	59.4	0	0	0	0	113.5	T1075 W1085 F1111	T1075-S1079 WeakPolarHBondContact O-CA 3.46Å; T1075-S1079 PolarHBondContact O-N 2.93Å; T1075-S1079 VanDerWaalsContact O-N 3.16Å; S1079-W1085 PolarHBondContact O-NE1 2.97Å; S1079-F1111 WeakPolarHBondContact O-CE2 3.26Å
1080	A	82.7	Confident	89.2	Confident	50 Å²	50	26.7 Å²	26.7	41%	0.413	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-0.4	-179	0	0	0	0	0	113.6	N1078 A1082 F1111	N1078-A1080 PolarHBondContact O-N 3.45Å; N1078-A1080 WeakPolarHBondContact OD1-CB 3.31Å; N1078-A1080 PolarHBondContact OD1-N 3.39Å; A1080-A1082 PolarHBondContact O-N 3.19Å; A1080-A1082 VanDerWaalsContact O-N 3.13Å; A1080-F1111 HydrophobicContact CB-CD1 4.1Å; A1080-F1111 HydrophobicContact CB-CE1 3.99Å
1081	N	86.3	Confident	89.2	Confident	28 Å²	28	26.5 Å²	26.5	15%	0.15	16%	0.16	C	C	.	.			trans	-76	104	178.6	-168.5	-33.5	0	0	0	111.1	C1048 N1078 E1083 V1084 W1085	C1048-N1081 PolarHBondContact SG-ND2 3.37Å; N1078-N1081 PolarHBondContact O-N 3.31Å; N1081-E1083 PolarHBondContact O-N 3.11Å; N1081-E1083 WeakPolarHBondContact OD1-CB 3.49Å; N1081-E1083 PolarHBondContact OD1-N 3.05Å; N1081-V1084 HydrophobicContact CB-CB 4.37Å; N1081-V1084 HydrophobicContact CB-CG2 3.8Å; N1081-V1084 PolarHBondContact O-N 3.16Å; N1081-W1085 VanDerWaalsContact O-CD1 3.27Å
1082	A	87.5	Confident	89.1	Confident	13 Å²	13	26.5 Å²	26.5	11%	0.107	16%	0.16	C	C	.	.	H	α-helix	trans	-59.4	-33.1	-178.2	0	0	0	0	0	113.8	A1080 W1085 A1086 F1111 F1113	A1080-A1082 PolarHBondContact O-N 3.19Å; A1080-A1082 VanDerWaalsContact O-N 3.13Å; A1082-W1085 PolarHBondContact O-N 3.42Å; A1082-A1086 PolarHBondContact O-N 3.39Å; A1082-A1086 VanDerWaalsContact O-N 3.13Å; A1082-F1111 HydrophobicContact CB-CB 3.7Å; A1082-F1111 WeakPolarHBondContact CB-O 3.48Å; A1082-F1113 HydrophobicContact CB-CB 3.96Å; A1082-F1113 HydrophobicContact CB-CD2 4.24Å
1083	E	90.7	Very high	89.1	Confident	50 Å²	50	23.9 Å²	23.9	23%	0.234	14%	0.138	C	C	.	.	H	α-helix	trans	-71.6	-36.2	-177.7	-166.3	176.7	-163.5	0	0	111.7	L1052 K1056 N1081 W1085 A1086 Y1087 F1113	L1052-E1083 HydrophobicContact CD2-CB 4.25Å; L1052-E1083 HydrophobicContact CD2-CG 4.4Å; L1052-E1083 WeakPolarHBondContact CD2-OE2 3.49Å; K1056-E1083 VanDerWaalsContact CE-CD 3.45Å; K1056-E1083 WeakPolarHBondContact CE-OE1 3.11Å; K1056-E1083 IonicContact NZ-OE1 3.9Å; K1056-E1083 PolarHBondContact NZ-OE1 3.37Å; K1056-E1083 IonicContact NZ-OE2 3.97Å; K1056-E1083 PolarHBondContact NZ-OE2 3.3Å; N1081-E1083 PolarHBondContact O-N 3.11Å; N1081-E1083 WeakPolarHBondContact OD1-CB 3.49Å; N1081-E1083 PolarHBondContact OD1-N 3.05Å; E1083-W1085 VanDerWaalsContact C-N 3.34Å; E1083-W1085 PolarHBondContact O-N 3.17Å; E1083-A1086 WeakPolarHBondContact O-CB 3.47Å; E1083-A1086 PolarHBondContact O-N 2.89Å; E1083-Y1087 HydrophobicContact CG-CD2 3.96Å; E1083-Y1087 HydrophobicContact CG-CE2 3.85Å; E1083-Y1087 WeakPolarHBondContact O-CD2 3.5Å; E1083-Y1087 PolarHBondContact O-N 3.19Å; E1083-F1113 HydrophobicContact CG-CE2 4.5Å
1084	V	91.6	Very high	89	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59	-47	175.1	178.1	0	0	0	0	110.4	L1052 L1071 A1074 T1075 N1081 A1086 Y1087 L1088	L1052-V1084 HydrophobicContact CB-CG2 4.19Å; L1052-V1084 HydrophobicContact CD1-CG2 3.92Å; L1052-V1084 HydrophobicContact CD2-CG2 4.11Å; L1052-V1084 HydrophobicContact CG-CG2 4.29Å; L1071-V1084 HydrophobicContact CB-CG1 4.2Å; L1071-V1084 HydrophobicContact CD2-CG1 4.1Å; L1071-V1084 WeakPolarHBondContact O-CG1 3.22Å; A1074-V1084 HydrophobicContact CB-CG1 3.98Å; A1074-V1084 HydrophobicContact CB-CG2 3.93Å; T1075-V1084 VanDerWaalsContact OG1-CG1 3.23Å; T1075-V1084 WeakPolarHBondContact OG1-CG1 3.31Å; N1081-V1084 HydrophobicContact CB-CB 4.37Å; N1081-V1084 HydrophobicContact CB-CG2 3.8Å; N1081-V1084 PolarHBondContact O-N 3.16Å; V1084-A1086 VanDerWaalsContact C-N 3.31Å; V1084-A1086 PolarHBondContact O-N 3.33Å; V1084-Y1087 PolarHBondContact O-N 2.98Å; V1084-L1088 HydrophobicContact CG1-CD1 4.26Å; V1084-L1088 PolarHBondContact O-N 3.07Å
1085	W	92.9	Very high	88.9	Confident	36 Å²	36	29.2 Å²	29.2	14%	0.136	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-36	176.6	-68.6	112.5	0	0	0	113	T1075 S1079 N1081 A1082 E1083 L1088 S1089 Y1104 N1107 A1108 F1111	T1075-W1085 HydrophobicContact CG2-CH2 3.61Å; T1075-W1085 HydrophobicContact CG2-CZ2 3.39Å; T1075-W1085 HydrophobicContact CG2-CZ3 4.39Å; S1079-W1085 PolarHBondContact O-NE1 2.97Å; N1081-W1085 VanDerWaalsContact O-CD1 3.27Å; A1082-W1085 PolarHBondContact O-N 3.42Å; E1083-W1085 VanDerWaalsContact C-N 3.34Å; E1083-W1085 PolarHBondContact O-N 3.17Å; W1085-L1088 HydrophobicContact CE3-CD1 4.07Å; W1085-L1088 HydrophobicContact CZ3-CD1 4.27Å; W1085-L1088 PolarHBondContact O-N 3.02Å; W1085-S1089 WeakPolarHBondContact O-CB 3.03Å; W1085-S1089 PolarHBondContact O-N 3.32Å; W1085-Y1104 AromaticContact CE3-CD1 3.6Å; W1085-Y1104 HydrophobicContact CE3-CD1 3.6Å; W1085-Y1104 HydrophobicContact CE3-CE1 4.25Å; W1085-Y1104 HydrophobicContact CE3-CG 4.28Å; W1085-Y1104 AromaticContact CZ3-CD1 3.48Å; W1085-Y1104 HydrophobicContact CZ3-CD1 3.48Å; W1085-Y1104 VanDerWaalsContact CZ3-CD1 3.48Å; W1085-Y1104 AromaticContact CZ3-CE1 3.69Å; W1085-Y1104 HydrophobicContact CZ3-CE1 3.69Å; W1085-N1107 HydrophobicContact CD2-CB 3.97Å; W1085-N1107 HydrophobicContact CE3-CB 4.23Å; W1085-N1107 HydrophobicContact CG-CB 4.11Å; W1085-A1108 HydrophobicContact CB-CB 3.77Å; W1085-F1111 AromaticContact CD1-CD2 3.78Å; W1085-F1111 AromaticContact NE1-CD2 3.85Å; W1085-F1111 AromaticContact NE1-CE2 3.6Å
1086	A	92.4	Very high	88.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.5	-42.2	176.9	0	0	0	0	0	112	A1082 E1083 V1084 S1089 L1090 A1108 F1113 L1118 I1122	A1082-A1086 PolarHBondContact O-N 3.39Å; A1082-A1086 VanDerWaalsContact O-N 3.13Å; E1083-A1086 WeakPolarHBondContact O-CB 3.47Å; E1083-A1086 PolarHBondContact O-N 2.89Å; V1084-A1086 VanDerWaalsContact C-N 3.31Å; V1084-A1086 PolarHBondContact O-N 3.33Å; A1086-S1089 WeakPolarHBondContact O-CB 3.17Å; A1086-S1089 PolarHBondContact O-N 2.99Å; A1086-L1090 PolarHBondContact O-N 3.38Å; A1086-L1090 VanDerWaalsContact O-N 3.08Å; A1086-A1108 HydrophobicContact CB-CB 4.19Å; A1086-F1113 HydrophobicContact CB-CD1 4.42Å; A1086-F1113 HydrophobicContact CB-CD2 4.05Å; A1086-F1113 HydrophobicContact CB-CE1 4.02Å; A1086-F1113 HydrophobicContact CB-CE2 3.63Å; A1086-F1113 HydrophobicContact CB-CG 4.43Å; A1086-F1113 HydrophobicContact CB-CZ 3.61Å; A1086-L1118 HydrophobicContact CB-CD2 3.77Å; A1086-I1122 HydrophobicContact CB-CD1 4.08Å
1087	Y	92.7	Very high	88.6	Confident	13 Å²	13	28 Å²	28	5%	0.051	16%	0.162	C	C	.	.	H	α-helix	trans	-71.1	-36.3	175.5	-82.7	-84	0	0	0	113	L1052 K1056 Y1059 E1083 V1084 S1089 L1090 I1091 L1118	L1052-Y1087 HydrophobicContact CD1-CD2 4.25Å; K1056-Y1087 HydrophobicContact CD-CE2 3.95Å; K1056-Y1087 VanDerWaalsContact CE-CE2 3.41Å; K1056-Y1087 HydrophobicContact CG-CD1 4.26Å; K1056-Y1087 HydrophobicContact CG-CD2 4.12Å; K1056-Y1087 HydrophobicContact CG-CE1 3.87Å; K1056-Y1087 HydrophobicContact CG-CE2 3.76Å; K1056-Y1087 HydrophobicContact CG-CG 4.38Å; Y1059-Y1087 HydrophobicContact CD1-CE1 4.42Å; Y1059-Y1087 HydrophobicContact CG-CD1 4.47Å; E1083-Y1087 HydrophobicContact CG-CD2 3.96Å; E1083-Y1087 HydrophobicContact CG-CE2 3.85Å; E1083-Y1087 WeakPolarHBondContact O-CD2 3.5Å; E1083-Y1087 PolarHBondContact O-N 3.19Å; V1084-Y1087 PolarHBondContact O-N 2.98Å; Y1087-S1089 VanDerWaalsContact C-N 3.33Å; Y1087-S1089 PolarHBondContact O-N 2.92Å; Y1087-L1090 HydrophobicContact CD1-CD1 4.29Å; Y1087-L1090 HydrophobicContact CE1-CD1 4.5Å; Y1087-L1090 WeakPolarHBondContact O-CB 3.45Å; Y1087-L1090 PolarHBondContact O-N 3.49Å; Y1087-I1091 WeakPolarHBondContact O-CG1 3.35Å; Y1087-I1091 PolarHBondContact O-N 2.93Å; Y1087-L1118 HydrophobicContact CD2-CD2 3.86Å; Y1087-L1118 HydrophobicContact CE1-CD1 4.03Å; Y1087-L1118 HydrophobicContact CE2-CD1 4.14Å; Y1087-L1118 HydrophobicContact CE2-CD2 3.46Å; Y1087-L1118 VanDerWaalsContact CE2-CD2 3.46Å
1088	L	92.5	Very high	88.7	Confident	9 Å²	9	27.8 Å²	27.8	5%	0.047	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-43	171.1	-75.7	172.5	0	0	0	111.4	E1068 L1071 V1084 W1085 L1090 I1091 S1092 Y1104	E1068-L1088 HydrophobicContact CG-CD2 4.28Å; L1071-L1088 HydrophobicContact CB-CD1 4.44Å; L1071-L1088 HydrophobicContact CB-CD2 3.59Å; L1071-L1088 HydrophobicContact CB-CG 3.83Å; L1071-L1088 HydrophobicContact CD1-CD2 4.24Å; L1071-L1088 HydrophobicContact CD1-CG 4.33Å; V1084-L1088 HydrophobicContact CG1-CD1 4.26Å; V1084-L1088 PolarHBondContact O-N 3.07Å; W1085-L1088 HydrophobicContact CE3-CD1 4.07Å; W1085-L1088 HydrophobicContact CZ3-CD1 4.27Å; W1085-L1088 PolarHBondContact O-N 3.02Å; L1088-L1090 VanDerWaalsContact C-N 3.35Å; L1088-L1090 PolarHBondContact O-N 3.41Å; L1088-I1091 PolarHBondContact O-N 3.15Å; L1088-S1092 PolarHBondContact O-N 3.4Å; L1088-S1092 PolarHBondContact O-OG 3.43Å; L1088-Y1104 HydrophobicContact CB-CD2 3.95Å; L1088-Y1104 HydrophobicContact CB-CE2 4.37Å; L1088-Y1104 HydrophobicContact CB-CG 4.19Å
1089	S	92.6	Very high	88.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.4	-47.2	172.5	163.6	0	0	0	0	111.9	W1085 A1086 Y1087 I1091 S1092 L1093 G1101	W1085-S1089 WeakPolarHBondContact O-CB 3.03Å; W1085-S1089 PolarHBondContact O-N 3.32Å; A1086-S1089 WeakPolarHBondContact O-CB 3.17Å; A1086-S1089 PolarHBondContact O-N 2.99Å; Y1087-S1089 VanDerWaalsContact C-N 3.33Å; Y1087-S1089 PolarHBondContact O-N 2.92Å; S1089-I1091 PolarHBondContact O-N 3.23Å; S1089-S1092 PolarHBondContact O-N 3.45Å; S1089-L1093 WeakPolarHBondContact O-CB 3.18Å; S1089-L1093 WeakPolarHBondContact O-CG 3.37Å; S1089-L1093 PolarHBondContact O-N 2.89Å; S1089-G1101 PolarHBondContact OG-O 3.05Å
1090	L	91.9	Very high	89	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-43.7	177.5	-80	173.3	0	0	0	113	Y1059 A1086 Y1087 L1088 L1093 K1094 L1118 E1121 I1122 A1125	Y1059-L1090 HydrophobicContact CE2-CB 3.82Å; A1086-L1090 PolarHBondContact O-N 3.38Å; A1086-L1090 VanDerWaalsContact O-N 3.08Å; Y1087-L1090 HydrophobicContact CD1-CD1 4.29Å; Y1087-L1090 HydrophobicContact CE1-CD1 4.5Å; Y1087-L1090 WeakPolarHBondContact O-CB 3.45Å; Y1087-L1090 PolarHBondContact O-N 3.49Å; L1088-L1090 VanDerWaalsContact C-N 3.35Å; L1088-L1090 PolarHBondContact O-N 3.41Å; L1090-L1093 PolarHBondContact O-N 2.91Å; L1090-K1094 PolarHBondContact O-N 3.01Å; L1090-L1118 HydrophobicContact CD1-CD1 3.4Å; L1090-L1118 HydrophobicContact CD1-CG 4Å; L1090-E1121 HydrophobicContact CD1-CG 4.48Å; L1090-E1121 HydrophobicContact CD2-CB 4.36Å; L1090-E1121 HydrophobicContact CD2-CG 4.07Å; L1090-I1122 HydrophobicContact CD1-CG1 4.13Å; L1090-I1122 HydrophobicContact CD2-CB 4.12Å; L1090-I1122 HydrophobicContact CD2-CG1 3.45Å; L1090-I1122 VanDerWaalsContact CD2-CG1 3.45Å; L1090-I1122 HydrophobicContact CG-CD1 4.36Å; L1090-I1122 HydrophobicContact CG-CG1 3.49Å; L1090-I1122 VanDerWaalsContact CG-CG1 3.49Å; L1090-A1125 HydrophobicContact CD2-CB 4.17Å
1091	I	92.7	Very high	89.2	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.1	-51.1	179	-68.8	161.7	0	0	0	110.2	Y1059 L1064 A1067 E1068 L1071 Y1087 L1088 S1089 L1093 K1094 S1095	Y1059-I1091 HydrophobicContact CD2-CD1 4.38Å; Y1059-I1091 HydrophobicContact CD2-CG1 3.57Å; Y1059-I1091 HydrophobicContact CE2-CG1 4.09Å; L1064-I1091 HydrophobicContact CB-CG2 4.31Å; L1064-I1091 HydrophobicContact CD2-CG1 4.42Å; A1067-I1091 HydrophobicContact CB-CD1 3.7Å; E1068-I1091 HydrophobicContact CB-CG2 4.23Å; L1071-I1091 HydrophobicContact CD1-CD1 3.42Å; L1071-I1091 VanDerWaalsContact CD1-CD1 3.42Å; Y1087-I1091 WeakPolarHBondContact O-CG1 3.35Å; Y1087-I1091 PolarHBondContact O-N 2.93Å; L1088-I1091 PolarHBondContact O-N 3.15Å; S1089-I1091 PolarHBondContact O-N 3.23Å; I1091-L1093 VanDerWaalsContact C-N 3.31Å; I1091-L1093 PolarHBondContact O-N 3.41Å; I1091-K1094 PolarHBondContact O-N 2.99Å; I1091-K1094 VanDerWaalsContact O-N 3.15Å; I1091-S1095 WeakPolarHBondContact O-CB 3.49Å; I1091-S1095 PolarHBondContact O-N 3.27Å; I1091-S1095 PolarHBondContact O-OG 3.5Å; I1091-S1095 VanDerWaalsContact O-OG 3.12Å
1092	S	90.9	Very high	89.3	Confident	1 Å²	1	33 Å²	33	1%	0.007	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-38.5	178.8	-58.9	0	0	0	0	112.5	L1088 S1089 S1095 G1096 Q1097 Y1104	L1088-S1092 PolarHBondContact O-N 3.4Å; L1088-S1092 PolarHBondContact O-OG 3.43Å; S1089-S1092 PolarHBondContact O-N 3.45Å; S1092-S1095 PolarHBondContact O-N 2.88Å; S1092-G1096 PolarHBondContact O-N 3.08Å; S1092-Q1097 WeakPolarHBondContact O-CA 3.46Å; S1092-Q1097 PolarHBondContact O-N 2.98Å; S1092-Y1104 WeakPolarHBondContact OG-CE2 3.38Å
1093	L	90	Very high	89.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-43.5	175.3	-71.8	173.8	0	0	0	111.9	S1089 L1090 I1091 G1096 L1098 I1122 A1125 K1126 T1129	S1089-L1093 WeakPolarHBondContact O-CB 3.18Å; S1089-L1093 WeakPolarHBondContact O-CG 3.37Å; S1089-L1093 PolarHBondContact O-N 2.89Å; L1090-L1093 PolarHBondContact O-N 2.91Å; I1091-L1093 VanDerWaalsContact C-N 3.31Å; I1091-L1093 PolarHBondContact O-N 3.41Å; L1093-G1096 PolarHBondContact O-N 3.07Å; L1093-L1098 HydrophobicContact CD2-CD1 3.77Å; L1093-I1122 HydrophobicContact CD1-CG2 3.97Å; L1093-A1125 HydrophobicContact CB-CB 4.2Å; L1093-A1125 HydrophobicContact CD1-CB 4.36Å; L1093-K1126 HydrophobicContact CD1-CB 4.03Å; L1093-K1126 HydrophobicContact CD2-CB 4.31Å; L1093-K1126 HydrophobicContact CD2-CG 4.46Å; L1093-T1129 WeakPolarHBondContact O-CG2 3.29Å; L1093-T1129 PolarHBondContact O-OG1 2.69Å
1094	K	86.3	Confident	89.4	Confident	105 Å²	105	38.5 Å²	38.5	46%	0.457	19%	0.19	S	C	.	.	H	α-helix	trans	-68.7	-32.8	176.5	-77.9	-171.1	172.1	176.4	0	113.1	Y1059 L1064 L1090 I1091 G1096 E1121	Y1059-K1094 HydrophobicContact CE2-CD 3.82Å; Y1059-K1094 VanDerWaalsContact CZ-NZ 3.28Å; Y1059-K1094 WeakPolarHBondContact OH-CE 3.49Å; Y1059-K1094 PolarHBondContact OH-NZ 3.27Å; L1064-K1094 HydrophobicContact CD1-CB 4.18Å; L1090-K1094 PolarHBondContact O-N 3.01Å; I1091-K1094 PolarHBondContact O-N 2.99Å; I1091-K1094 VanDerWaalsContact O-N 3.15Å; K1094-G1096 PolarHBondContact O-N 2.89Å; K1094-E1121 IonicContact NZ-OE1 3.05Å
1095	S	87.6	Confident	89.3	Confident	60 Å²	60	40.7 Å²	40.7	42%	0.42	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.2	173.4	-61.8	0	0	0	0	113.7	I1091 S1092	I1091-S1095 WeakPolarHBondContact O-CB 3.49Å; I1091-S1095 PolarHBondContact O-N 3.27Å; I1091-S1095 PolarHBondContact O-OG 3.5Å; I1091-S1095 VanDerWaalsContact O-OG 3.12Å; S1092-S1095 PolarHBondContact O-N 2.88Å
1096	G	82.8	Confident	89.1	Confident	28 Å²	28	45.5 Å²	45.5	29%	0.289	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.7	-0.7	176.8	0	0	0	0	0	115.4	S1092 L1093 K1094 L1098 K1133	S1092-G1096 PolarHBondContact O-N 3.08Å; L1093-G1096 PolarHBondContact O-N 3.07Å; K1094-G1096 PolarHBondContact O-N 2.89Å; G1096-L1098 PolarHBondContact O-N 3.43Å; G1096-L1098 VanDerWaalsContact O-N 3.09Å; G1096-K1133 PolarHBondContact O-NZ 3.44Å
1097	Q	86	Confident	88.9	Confident	76 Å²	76	48.5 Å²	48.5	36%	0.355	24%	0.237	S	C	.	.			trans	-84.6	74.7	179.8	-70.1	161.1	-40.5	0	0	111.2	S1092 Q1099 E1100 G1101	S1092-Q1097 WeakPolarHBondContact O-CA 3.46Å; S1092-Q1097 PolarHBondContact O-N 2.98Å; Q1097-Q1099 VanDerWaalsContact C-N 3.28Å; Q1097-Q1099 PolarHBondContact O-N 3.25Å; Q1097-E1100 HydrophobicContact CB-CB 4.33Å; Q1097-E1100 PolarHBondContact NE2-OE2 3.09Å; Q1097-E1100 PolarHBondContact OE1-OE2 2.8Å; Q1097-G1101 PolarHBondContact O-N 2.9Å; Q1097-G1101 VanDerWaalsContact O-N 3.09Å
1098	L	86.4	Confident	88.7	Confident	29 Å²	29	47.9 Å²	47.9	15%	0.152	24%	0.235	C	C	.	.	H	α-helix	trans	-58.5	-33.1	-177.8	-169.1	72.7	0	0	0	114.5	L1093 G1096 D1102 K1126 T1129 R1130	L1093-L1098 HydrophobicContact CD2-CD1 3.77Å; G1096-L1098 PolarHBondContact O-N 3.43Å; G1096-L1098 VanDerWaalsContact O-N 3.09Å; L1098-D1102 WeakPolarHBondContact O-CB 3.23Å; L1098-D1102 PolarHBondContact O-N 3.25Å; L1098-K1126 HydrophobicContact CD1-CG 4.19Å; L1098-T1129 HydrophobicContact CD1-CG2 4.38Å; L1098-R1130 HydrophobicContact CD1-CG 4Å; L1098-R1130 HydrophobicContact CD2-CG 3.83Å
1099	Q	85.4	Confident	88.5	Confident	162 Å²	162	51.7 Å²	51.7	76%	0.757	25%	0.254	S	S	*	.	H	α-helix	trans	-74	-50.7	-176.7	-74.2	-178.8	-29.6	0	0	111.7	Q1097 G1101 D1102 E1103	Q1097-Q1099 VanDerWaalsContact C-N 3.28Å; Q1097-Q1099 PolarHBondContact O-N 3.25Å; Q1099-G1101 VanDerWaalsContact C-N 3.35Å; Q1099-G1101 PolarHBondContact O-N 3.41Å; Q1099-D1102 PolarHBondContact O-N 3.35Å; Q1099-E1103 PolarHBondContact O-N 3.18Å; Q1099-E1103 VanDerWaalsContact O-N 3.13Å
1100	E	86.3	Confident	88.3	Confident	76 Å²	76	55.3 Å²	55.3	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-61.6	-42.4	176.9	-66.9	166.5	-167	0	0	111.2	Q1097 D1102 E1103 Y1104	Q1097-E1100 HydrophobicContact CB-CB 4.33Å; Q1097-E1100 PolarHBondContact NE2-OE2 3.09Å; Q1097-E1100 PolarHBondContact OE1-OE2 2.8Å; E1100-D1102 VanDerWaalsContact C-N 3.33Å; E1100-D1102 PolarHBondContact O-N 3.14Å; E1100-E1103 PolarHBondContact O-N 3.5Å; E1100-E1103 VanDerWaalsContact O-N 3.11Å; E1100-Y1104 HydrophobicContact CB-CE2 4.32Å; E1100-Y1104 WeakPolarHBondContact O-CD2 3.41Å; E1100-Y1104 PolarHBondContact O-N 3.28Å
1101	G	87.3	Confident	87.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-39.7	175	0	0	0	0	0	113.4	S1089 Q1097 Q1099 E1103 Y1105	S1089-G1101 PolarHBondContact OG-O 3.05Å; Q1097-G1101 PolarHBondContact O-N 2.9Å; Q1097-G1101 VanDerWaalsContact O-N 3.09Å; Q1099-G1101 VanDerWaalsContact C-N 3.35Å; Q1099-G1101 PolarHBondContact O-N 3.41Å; G1101-E1103 VanDerWaalsContact C-N 3.31Å; G1101-E1103 PolarHBondContact O-N 3.35Å; G1101-Y1105 WeakPolarHBondContact O-CB 3.43Å; G1101-Y1105 PolarHBondContact O-N 3.13Å
1102	D	87.9	Confident	87.2	Confident	35 Å²	35	65.5 Å²	65.5	19%	0.187	33%	0.33	C	S	.	.	H	α-helix	trans	-69.5	-27.6	176.5	-83.8	-0.2	0	0	0	112.8	L1098 Q1099 E1100 K1106 K1126	L1098-D1102 WeakPolarHBondContact O-CB 3.23Å; L1098-D1102 PolarHBondContact O-N 3.25Å; Q1099-D1102 PolarHBondContact O-N 3.35Å; E1100-D1102 VanDerWaalsContact C-N 3.33Å; E1100-D1102 PolarHBondContact O-N 3.14Å; D1102-K1106 VanDerWaalsContact O-CG 3.27Å; D1102-K1106 WeakPolarHBondContact O-CG 3.35Å; D1102-K1106 PolarHBondContact O-N 3.49Å; D1102-K1126 WeakPolarHBondContact OD1-CE 3.25Å; D1102-K1126 IonicContact OD1-NZ 3.27Å; D1102-K1126 PolarHBondContact OD1-NZ 3.45Å; D1102-K1126 IonicContact OD2-NZ 3.01Å; D1102-K1126 PolarHBondContact OD2-NZ 3.36Å; D1102-K1126 VanDerWaalsContact OD2-NZ 3.17Å
1103	E	89.8	Confident	86.9	Confident	116 Å²	116	66.7 Å²	66.7	54%	0.542	34%	0.335	S	S	.	.	H	α-helix	trans	-75	-48.1	174.2	-71.5	178.3	177.8	0	0	111.5	Q1099 E1100 G1101 Y1105 K1106 N1107	Q1099-E1103 PolarHBondContact O-N 3.18Å; Q1099-E1103 VanDerWaalsContact O-N 3.13Å; E1100-E1103 PolarHBondContact O-N 3.5Å; E1100-E1103 VanDerWaalsContact O-N 3.11Å; G1101-E1103 VanDerWaalsContact C-N 3.31Å; G1101-E1103 PolarHBondContact O-N 3.35Å; E1103-Y1105 VanDerWaalsContact C-N 3.27Å; E1103-Y1105 PolarHBondContact O-N 3.39Å; E1103-K1106 WeakPolarHBondContact O-CB 3.38Å; E1103-K1106 PolarHBondContact O-N 3Å; E1103-K1106 VanDerWaalsContact O-N 3.1Å; E1103-N1107 PolarHBondContact O-N 3.03Å
1104	Y	90.7	Very high	86.4	Confident	62 Å²	62	74.8 Å²	74.8	24%	0.243	37%	0.373	C	S	.	.	H	α-helix	trans	-60.1	-37.8	175.5	-64.2	-34.3	0	0	0	112.3	W1085 L1088 S1092 E1100 K1106 N1107 A1108	W1085-Y1104 AromaticContact CE3-CD1 3.6Å; W1085-Y1104 HydrophobicContact CE3-CD1 3.6Å; W1085-Y1104 HydrophobicContact CE3-CE1 4.25Å; W1085-Y1104 HydrophobicContact CE3-CG 4.28Å; W1085-Y1104 AromaticContact CZ3-CD1 3.48Å; W1085-Y1104 HydrophobicContact CZ3-CD1 3.48Å; W1085-Y1104 VanDerWaalsContact CZ3-CD1 3.48Å; W1085-Y1104 AromaticContact CZ3-CE1 3.69Å; W1085-Y1104 HydrophobicContact CZ3-CE1 3.69Å; L1088-Y1104 HydrophobicContact CB-CD2 3.95Å; L1088-Y1104 HydrophobicContact CB-CE2 4.37Å; L1088-Y1104 HydrophobicContact CB-CG 4.19Å; S1092-Y1104 WeakPolarHBondContact OG-CE2 3.38Å; E1100-Y1104 HydrophobicContact CB-CE2 4.32Å; E1100-Y1104 WeakPolarHBondContact O-CD2 3.41Å; E1100-Y1104 PolarHBondContact O-N 3.28Å; Y1104-K1106 PolarHBondContact O-N 3.45Å; Y1104-N1107 PolarHBondContact O-N 2.89Å; Y1104-A1108 PolarHBondContact O-N 3.22Å
1105	Y	89.8	Confident	86.3	Confident	47 Å²	47	72.8 Å²	72.8	18%	0.184	37%	0.367	C	S	.	.	H	α-helix	trans	-66.1	-36.9	175.5	-172	-120.6	0	0	0	113.1	G1101 E1103 N1107 A1108 I1109 N1119 I1122	G1101-Y1105 WeakPolarHBondContact O-CB 3.43Å; G1101-Y1105 PolarHBondContact O-N 3.13Å; E1103-Y1105 VanDerWaalsContact C-N 3.27Å; E1103-Y1105 PolarHBondContact O-N 3.39Å; Y1105-N1107 VanDerWaalsContact C-N 3.32Å; Y1105-A1108 PolarHBondContact O-N 3.36Å; Y1105-I1109 HydrophobicContact CD1-CD1 3.84Å; Y1105-I1109 HydrophobicContact CE1-CD1 3.43Å; Y1105-I1109 VanDerWaalsContact CE1-CD1 3.43Å; Y1105-I1109 HydrophobicContact CE1-CG1 4.35Å; Y1105-I1109 HydrophobicContact CE2-CD1 4.33Å; Y1105-I1109 HydrophobicContact CE2-CG1 4.43Å; Y1105-I1109 HydrophobicContact CG-CD1 4.46Å; Y1105-I1109 WeakPolarHBondContact O-CG1 3.46Å; Y1105-I1109 PolarHBondContact O-N 3.12Å; Y1105-N1119 VanDerWaalsContact CE2-OD1 3.32Å; Y1105-N1119 WeakPolarHBondContact CE2-OD1 3.46Å; Y1105-N1119 PolarHBondContact OH-OD1 2.99Å; Y1105-I1122 HydrophobicContact CD2-CD1 3.85Å; Y1105-I1122 HydrophobicContact CD2-CG2 3.83Å; Y1105-I1122 HydrophobicContact CE2-CB 4.49Å; Y1105-I1122 HydrophobicContact CE2-CD1 3.81Å; Y1105-I1122 HydrophobicContact CE2-CG2 3.95Å; Y1105-I1122 HydrophobicContact CG-CG2 4.24Å
1106	K	89.4	Confident	86.2	Confident	137 Å²	137	74 Å²	74	60%	0.596	38%	0.375	S	S	*	.	H	α-helix	trans	-63.7	-41	173.2	-73.8	168.3	-172.3	171.8	0	111.2	D1102 E1103 Y1104 I1109 S1110	D1102-K1106 VanDerWaalsContact O-CG 3.27Å; D1102-K1106 WeakPolarHBondContact O-CG 3.35Å; D1102-K1106 PolarHBondContact O-N 3.49Å; E1103-K1106 WeakPolarHBondContact O-CB 3.38Å; E1103-K1106 PolarHBondContact O-N 3Å; E1103-K1106 VanDerWaalsContact O-N 3.1Å; Y1104-K1106 PolarHBondContact O-N 3.45Å; K1106-I1109 PolarHBondContact O-N 3.43Å; K1106-S1110 PolarHBondContact O-N 3.15Å
1107	N	87.9	Confident	86.4	Confident	63 Å²	63	76.4 Å²	76.4	34%	0.337	39%	0.388	S	S	.	.	H	α-helix	trans	-63.2	-43.7	176	-67.5	-7.9	0	0	0	110.9	W1085 E1103 Y1104 Y1105 I1109 S1110 F1111	W1085-N1107 HydrophobicContact CD2-CB 3.97Å; W1085-N1107 HydrophobicContact CE3-CB 4.23Å; W1085-N1107 HydrophobicContact CG-CB 4.11Å; E1103-N1107 PolarHBondContact O-N 3.03Å; Y1104-N1107 PolarHBondContact O-N 2.89Å; Y1105-N1107 VanDerWaalsContact C-N 3.32Å; N1107-I1109 PolarHBondContact O-N 3.18Å; N1107-S1110 WeakPolarHBondContact CA-OG 3.49Å; N1107-S1110 PolarHBondContact O-N 3.36Å; N1107-S1110 VanDerWaalsContact O-N 3.12Å; N1107-S1110 PolarHBondContact O-OG 2.97Å; N1107-F1111 WeakPolarHBondContact O-CD2 3.43Å; N1107-F1111 PolarHBondContact O-N 3.14Å
1108	A	88.7	Confident	86.4	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-56.4	-48.2	174.7	0	0	0	0	0	112	W1085 A1086 Y1104 Y1105 S1110 F1111 F1113	W1085-A1108 HydrophobicContact CB-CB 3.77Å; A1086-A1108 HydrophobicContact CB-CB 4.19Å; Y1104-A1108 PolarHBondContact O-N 3.22Å; Y1105-A1108 PolarHBondContact O-N 3.36Å; A1108-S1110 VanDerWaalsContact C-N 3.29Å; A1108-S1110 PolarHBondContact O-N 3.47Å; A1108-F1111 PolarHBondContact O-N 3.24Å; A1108-F1113 HydrophobicContact CB-CB 4.18Å; A1108-F1113 HydrophobicContact CB-CG 4.37Å; A1108-F1113 WeakPolarHBondContact O-CB 3.44Å; A1108-F1113 PolarHBondContact O-N 3.41Å
1109	I	89	Confident	86.5	Confident	89 Å²	89	73.1 Å²	73.1	46%	0.456	37%	0.373	S	S	.	.	H	α-helix	trans	-62.6	-37.1	177.1	-67.4	168.1	0	0	0	111.6	Y1105 K1106 N1107 F1111 D1112	Y1105-I1109 HydrophobicContact CD1-CD1 3.84Å; Y1105-I1109 HydrophobicContact CE1-CD1 3.43Å; Y1105-I1109 VanDerWaalsContact CE1-CD1 3.43Å; Y1105-I1109 HydrophobicContact CE1-CG1 4.35Å; Y1105-I1109 HydrophobicContact CE2-CD1 4.33Å; Y1105-I1109 HydrophobicContact CE2-CG1 4.43Å; Y1105-I1109 HydrophobicContact CG-CD1 4.46Å; Y1105-I1109 WeakPolarHBondContact O-CG1 3.46Å; Y1105-I1109 PolarHBondContact O-N 3.12Å; K1106-I1109 PolarHBondContact O-N 3.43Å; N1107-I1109 PolarHBondContact O-N 3.18Å; I1109-F1111 PolarHBondContact O-N 3.47Å; I1109-D1112 PolarHBondContact O-N 2.87Å; I1109-D1112 VanDerWaalsContact O-N 3.14Å
1110	S	87.4	Confident	86.7	Confident	76 Å²	76	72.2 Å²	72.2	53%	0.531	37%	0.369	S	S	.	.	H	α-helix	trans	-64.9	-21.9	179.3	75.4	0	0	0	0	113.8	K1106 N1107 A1108	K1106-S1110 PolarHBondContact O-N 3.15Å; N1107-S1110 WeakPolarHBondContact CA-OG 3.49Å; N1107-S1110 PolarHBondContact O-N 3.36Å; N1107-S1110 VanDerWaalsContact O-N 3.12Å; N1107-S1110 PolarHBondContact O-OG 2.97Å; A1108-S1110 VanDerWaalsContact C-N 3.29Å; A1108-S1110 PolarHBondContact O-N 3.47Å
1111	F	83.4	Confident	86.8	Confident	84 Å²	84	71 Å²	71	37%	0.368	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	27.8	175.1	-65.9	-62.9	0	0	0	112.9	S1079 A1080 A1082 W1085 N1107 A1108 I1109 F1113	S1079-F1111 WeakPolarHBondContact O-CE2 3.26Å; A1080-F1111 HydrophobicContact CB-CD1 4.1Å; A1080-F1111 HydrophobicContact CB-CE1 3.99Å; A1082-F1111 HydrophobicContact CB-CB 3.7Å; A1082-F1111 WeakPolarHBondContact CB-O 3.48Å; W1085-F1111 AromaticContact CD1-CD2 3.78Å; W1085-F1111 AromaticContact NE1-CD2 3.85Å; W1085-F1111 AromaticContact NE1-CE2 3.6Å; N1107-F1111 WeakPolarHBondContact O-CD2 3.43Å; N1107-F1111 PolarHBondContact O-N 3.14Å; A1108-F1111 PolarHBondContact O-N 3.24Å; I1109-F1111 PolarHBondContact O-N 3.47Å; F1111-F1113 PolarHBondContact O-N 3.04Å
1112	D	78.6	Confident	86.9	Confident	130 Å²	130	71.1 Å²	71.1	70%	0.695	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	44	176.6	-68.1	-31.2	0	0	0	114.6	I1109 Q1114	I1109-D1112 PolarHBondContact O-N 2.87Å; I1109-D1112 VanDerWaalsContact O-N 3.14Å; D1112-Q1114 PolarHBondContact O-N 3.28Å
1113	F	84.1	Confident	87	Confident	26 Å²	26	72.1 Å²	72.1	11%	0.114	37%	0.374	C	S	.	.			trans	-63.9	123.6	173.4	-175.8	-112.1	0	0	0	113.2	A1082 E1083 A1086 A1108 F1111 D1115 L1118 N1119 I1122	A1082-F1113 HydrophobicContact CB-CB 3.96Å; A1082-F1113 HydrophobicContact CB-CD2 4.24Å; E1083-F1113 HydrophobicContact CG-CE2 4.5Å; A1086-F1113 HydrophobicContact CB-CD1 4.42Å; A1086-F1113 HydrophobicContact CB-CD2 4.05Å; A1086-F1113 HydrophobicContact CB-CE1 4.02Å; A1086-F1113 HydrophobicContact CB-CE2 3.63Å; A1086-F1113 HydrophobicContact CB-CG 4.43Å; A1086-F1113 HydrophobicContact CB-CZ 3.61Å; A1108-F1113 HydrophobicContact CB-CB 4.18Å; A1108-F1113 HydrophobicContact CB-CG 4.37Å; A1108-F1113 WeakPolarHBondContact O-CB 3.44Å; A1108-F1113 PolarHBondContact O-N 3.41Å; F1111-F1113 PolarHBondContact O-N 3.04Å; F1113-D1115 HydrophobicContact CE1-CB 4.39Å; F1113-D1115 HydrophobicContact CE2-CB 3.89Å; F1113-D1115 HydrophobicContact CZ-CB 3.62Å; F1113-L1118 HydrophobicContact CE2-CD2 4.06Å; F1113-L1118 HydrophobicContact CZ-CB 3.9Å; F1113-L1118 HydrophobicContact CZ-CD2 3.6Å; F1113-L1118 HydrophobicContact CZ-CG 4.1Å; F1113-N1119 WeakPolarHBondContact CE1-ND2 3.5Å; F1113-N1119 WeakPolarHBondContact CE1-OD1 3.46Å; F1113-I1122 HydrophobicContact CE1-CD1 4.46Å
1114	Q	78.9	Confident	87	Confident	169 Å²	169	70.5 Å²	70.5	79%	0.79	37%	0.366	S	S	*	.			trans	-123.4	-0.5	-172.8	-70.8	-177.1	11.6	0	0	116.2	D1112 S1116	D1112-Q1114 PolarHBondContact O-N 3.28Å; Q1114-S1116 PolarHBondContact O-N 3.05Å; Q1114-S1116 VanDerWaalsContact O-N 3.12Å
1115	D	85.1	Confident	86.8	Confident	64 Å²	64	67.8 Å²	67.8	34%	0.342	36%	0.357	S	S	.	.			trans	-70.9	110.5	-177.9	-174.5	-19.3	0	0	0	111.3	F1113 S1117 L1118 N1119	F1113-D1115 HydrophobicContact CE1-CB 4.39Å; F1113-D1115 HydrophobicContact CE2-CB 3.89Å; F1113-D1115 HydrophobicContact CZ-CB 3.62Å; D1115-S1117 WeakPolarHBondContact OD1-CB 3.45Å; D1115-S1117 PolarHBondContact OD1-N 3Å; D1115-L1118 HydrophobicContact CB-CB 4.11Å; D1115-L1118 PolarHBondContact OD1-N 3.41Å; D1115-N1119 VanDerWaalsContact O-CB 3.32Å; D1115-N1119 WeakPolarHBondContact O-CB 3.43Å; D1115-N1119 VanDerWaalsContact O-CG 3.28Å; D1115-N1119 PolarHBondContact O-N 3.49Å; D1115-N1119 PolarHBondContact O-ND2 3.09Å
1116	S	85.1	Confident	86.7	Confident	84 Å²	84	67.9 Å²	67.9	59%	0.587	36%	0.358	S	S	*	.	H	α-helix	trans	-67.8	-37.6	-178.4	56.9	0	0	0	0	112.9	Q1114 N1119 E1120	Q1114-S1116 PolarHBondContact O-N 3.05Å; Q1114-S1116 VanDerWaalsContact O-N 3.12Å; S1116-N1119 PolarHBondContact O-N 3.32Å; S1116-E1120 WeakPolarHBondContact O-CG 3.39Å; S1116-E1120 PolarHBondContact O-N 3.2Å
1117	S	86.6	Confident	86.6	Confident	80 Å²	80	67.4 Å²	67.4	56%	0.559	35%	0.352	S	S	*	.	H	α-helix	trans	-66.5	-47	-178.6	-179.3	0	0	0	0	110.4	D1115 N1119 E1120 E1121	D1115-S1117 WeakPolarHBondContact OD1-CB 3.45Å; D1115-S1117 PolarHBondContact OD1-N 3Å; S1117-N1119 VanDerWaalsContact C-N 3.35Å; S1117-N1119 PolarHBondContact O-N 3.13Å; S1117-E1120 WeakPolarHBondContact O-CB 3.43Å; S1117-E1120 PolarHBondContact O-N 2.67Å; S1117-E1121 PolarHBondContact O-N 3.03Å
1118	L	87.1	Confident	86.5	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-70.4	-32.3	179.3	-163.7	70.7	0	0	0	111.9	A1086 Y1087 L1090 F1113 D1115 E1120 E1121 I1122	A1086-L1118 HydrophobicContact CB-CD2 3.77Å; Y1087-L1118 HydrophobicContact CD2-CD2 3.86Å; Y1087-L1118 HydrophobicContact CE1-CD1 4.03Å; Y1087-L1118 HydrophobicContact CE2-CD1 4.14Å; Y1087-L1118 HydrophobicContact CE2-CD2 3.46Å; Y1087-L1118 VanDerWaalsContact CE2-CD2 3.46Å; L1090-L1118 HydrophobicContact CD1-CD1 3.4Å; L1090-L1118 HydrophobicContact CD1-CG 4Å; F1113-L1118 HydrophobicContact CE2-CD2 4.06Å; F1113-L1118 HydrophobicContact CZ-CB 3.9Å; F1113-L1118 HydrophobicContact CZ-CD2 3.6Å; F1113-L1118 HydrophobicContact CZ-CG 4.1Å; D1115-L1118 HydrophobicContact CB-CB 4.11Å; D1115-L1118 PolarHBondContact OD1-N 3.41Å; L1118-E1120 VanDerWaalsContact C-N 3.34Å; L1118-E1120 PolarHBondContact O-N 3.44Å; L1118-E1121 PolarHBondContact O-N 3.02Å; L1118-I1122 HydrophobicContact CG-CD1 4.4Å; L1118-I1122 VanDerWaalsContact O-CG1 3.25Å; L1118-I1122 WeakPolarHBondContact O-CG1 3.3Å; L1118-I1122 PolarHBondContact O-N 3.5Å
1119	N	88.3	Confident	86.4	Confident	34 Å²	34	70.2 Å²	70.2	18%	0.182	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-38.2	171.6	-86.8	-48.7	0	0	0	112.8	Y1105 F1113 D1115 S1116 S1117 S1123	Y1105-N1119 VanDerWaalsContact CE2-OD1 3.32Å; Y1105-N1119 WeakPolarHBondContact CE2-OD1 3.46Å; Y1105-N1119 PolarHBondContact OH-OD1 2.99Å; F1113-N1119 WeakPolarHBondContact CE1-ND2 3.5Å; F1113-N1119 WeakPolarHBondContact CE1-OD1 3.46Å; D1115-N1119 VanDerWaalsContact O-CB 3.32Å; D1115-N1119 WeakPolarHBondContact O-CB 3.43Å; D1115-N1119 VanDerWaalsContact O-CG 3.28Å; D1115-N1119 PolarHBondContact O-N 3.49Å; D1115-N1119 PolarHBondContact O-ND2 3.09Å; S1116-N1119 PolarHBondContact O-N 3.32Å; S1117-N1119 VanDerWaalsContact C-N 3.35Å; S1117-N1119 PolarHBondContact O-N 3.13Å; N1119-S1123 WeakPolarHBondContact O-CB 3.4Å; N1119-S1123 PolarHBondContact O-N 2.52Å; N1119-S1123 PolarHBondContact O-OG 2.94Å
1120	E	88.6	Confident	86.1	Confident	142 Å²	142	71.9 Å²	71.9	66%	0.664	37%	0.365	S	S	*	.	H	α-helix	trans	-65.4	-44.1	172.7	-73.1	178.7	-172.3	0	0	111.1	S1116 S1117 L1118 I1122 S1123 E1124	S1116-E1120 WeakPolarHBondContact O-CG 3.39Å; S1116-E1120 PolarHBondContact O-N 3.2Å; S1117-E1120 WeakPolarHBondContact O-CB 3.43Å; S1117-E1120 PolarHBondContact O-N 2.67Å; L1118-E1120 VanDerWaalsContact C-N 3.34Å; L1118-E1120 PolarHBondContact O-N 3.44Å; E1120-I1122 VanDerWaalsContact C-N 3.35Å; E1120-I1122 PolarHBondContact O-N 2.84Å; E1120-S1123 PolarHBondContact O-N 2.96Å; E1120-E1124 WeakPolarHBondContact O-CB 3.02Å; E1120-E1124 PolarHBondContact O-N 3.24Å
1121	E	90	Very high	85.8	Confident	51 Å²	51	74.1 Å²	74.1	24%	0.238	37%	0.369	C	S	.	.	H	α-helix	trans	-59	-44.2	175.7	-162.9	-175.7	161.5	0	0	111.5	Y1059 R1060 L1090 K1094 S1117 L1118 E1124 A1125	Y1059-E1121 VanDerWaalsContact CE1-OE1 3.31Å; Y1059-E1121 WeakPolarHBondContact CE1-OE1 3.44Å; Y1059-E1121 PolarHBondContact OH-OE1 2.82Å; R1060-E1121 IonicContact CZ-OE2 3.33Å; R1060-E1121 IonicContact NH1-OE1 3.94Å; R1060-E1121 PolarHBondContact NH1-OE1 2.65Å; R1060-E1121 IonicContact NH1-OE2 2.65Å; R1060-E1121 PolarHBondContact NH1-OE2 3.05Å; R1060-E1121 IonicContact NH2-OE2 3.64Å; R1060-E1121 PolarHBondContact NH2-OE2 3.43Å; L1090-E1121 HydrophobicContact CD1-CG 4.48Å; L1090-E1121 HydrophobicContact CD2-CB 4.36Å; L1090-E1121 HydrophobicContact CD2-CG 4.07Å; K1094-E1121 IonicContact NZ-OE1 3.05Å; S1117-E1121 PolarHBondContact O-N 3.03Å; L1118-E1121 PolarHBondContact O-N 3.02Å; E1121-E1124 PolarHBondContact O-N 2.99Å; E1121-A1125 WeakPolarHBondContact O-CB 3.31Å; E1121-A1125 PolarHBondContact O-N 2.83Å
1122	I	89.5	Confident	85.6	Confident	2 Å²	2	73.3 Å²	73.3	1%	0.01	37%	0.373	C	S	.	.	H	α-helix	trans	-63.1	-45.2	176.6	-69.3	163.1	0	0	0	111	A1086 L1090 L1093 Y1105 F1113 L1118 E1120 E1124 A1125 K1126	A1086-I1122 HydrophobicContact CB-CD1 4.08Å; L1090-I1122 HydrophobicContact CD1-CG1 4.13Å; L1090-I1122 HydrophobicContact CD2-CB 4.12Å; L1090-I1122 HydrophobicContact CD2-CG1 3.45Å; L1090-I1122 VanDerWaalsContact CD2-CG1 3.45Å; L1090-I1122 HydrophobicContact CG-CD1 4.36Å; L1090-I1122 HydrophobicContact CG-CG1 3.49Å; L1090-I1122 VanDerWaalsContact CG-CG1 3.49Å; L1093-I1122 HydrophobicContact CD1-CG2 3.97Å; Y1105-I1122 HydrophobicContact CD2-CD1 3.85Å; Y1105-I1122 HydrophobicContact CD2-CG2 3.83Å; Y1105-I1122 HydrophobicContact CE2-CB 4.49Å; Y1105-I1122 HydrophobicContact CE2-CD1 3.81Å; Y1105-I1122 HydrophobicContact CE2-CG2 3.95Å; Y1105-I1122 HydrophobicContact CG-CG2 4.24Å; F1113-I1122 HydrophobicContact CE1-CD1 4.46Å; L1118-I1122 HydrophobicContact CG-CD1 4.4Å; L1118-I1122 VanDerWaalsContact O-CG1 3.25Å; L1118-I1122 WeakPolarHBondContact O-CG1 3.3Å; L1118-I1122 PolarHBondContact O-N 3.5Å; E1120-I1122 VanDerWaalsContact C-N 3.35Å; E1120-I1122 PolarHBondContact O-N 2.84Å; I1122-E1124 VanDerWaalsContact C-N 3.32Å; I1122-E1124 PolarHBondContact O-N 3.21Å; I1122-A1125 PolarHBondContact O-N 3.26Å; I1122-K1126 VanDerWaalsContact O-CB 3.23Å; I1122-K1126 WeakPolarHBondContact O-CB 3.26Å; I1122-K1126 PolarHBondContact O-N 3.44Å
1123	S	88.4	Confident	85.4	Confident	57 Å²	57	71.5 Å²	71.5	40%	0.399	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-39.2	180	-63.3	0	0	0	0	111.9	N1119 E1120 R1127	N1119-S1123 WeakPolarHBondContact O-CB 3.4Å; N1119-S1123 PolarHBondContact O-N 2.52Å; N1119-S1123 PolarHBondContact O-OG 2.94Å; E1120-S1123 PolarHBondContact O-N 2.96Å; S1123-R1127 PolarHBondContact O-N 3.49Å; S1123-R1127 VanDerWaalsContact O-N 3.15Å
1124	E	89.6	Confident	85	Confident	81 Å²	81	74.7 Å²	74.7	38%	0.379	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-53.1	174	-177	59.6	-130.4	0	0	111.6	E1120 E1121 I1122 K1126 R1127 Q1128	E1120-E1124 WeakPolarHBondContact O-CB 3.02Å; E1120-E1124 PolarHBondContact O-N 3.24Å; E1121-E1124 PolarHBondContact O-N 2.99Å; I1122-E1124 VanDerWaalsContact C-N 3.32Å; I1122-E1124 PolarHBondContact O-N 3.21Å; E1124-K1126 VanDerWaalsContact C-N 3.28Å; E1124-K1126 PolarHBondContact O-N 2.97Å; E1124-R1127 WeakPolarHBondContact O-CB 3.48Å; E1124-R1127 PolarHBondContact O-N 3.37Å; E1124-R1127 IonicContact OE1-NH1 3.82Å; E1124-R1127 PolarHBondContact OE1-NH1 3.22Å; E1124-R1127 IonicContact OE2-CZ 2.65Å; E1124-R1127 IonicContact OE2-NH1 3.19Å; E1124-R1127 PolarHBondContact OE2-NH1 3.4Å; E1124-R1127 IonicContact OE2-NH2 3.58Å; E1124-Q1128 WeakPolarHBondContact O-CG 3.34Å; E1124-Q1128 PolarHBondContact O-N 2.65Å; E1124-Q1128 PolarHBondContact OE1-NE2 3.23Å
1125	A	87.5	Confident	84.7	Confident	6 Å²	6	68.9 Å²	68.9	5%	0.05	36%	0.358	C	S	.	.	H	α-helix	trans	-56.1	-43.8	178.2	0	0	0	0	0	111.4	L1090 L1093 E1121 I1122 R1127 Q1128 T1129	L1090-A1125 HydrophobicContact CD2-CB 4.17Å; L1093-A1125 HydrophobicContact CB-CB 4.2Å; L1093-A1125 HydrophobicContact CD1-CB 4.36Å; E1121-A1125 WeakPolarHBondContact O-CB 3.31Å; E1121-A1125 PolarHBondContact O-N 2.83Å; I1122-A1125 PolarHBondContact O-N 3.26Å; A1125-R1127 VanDerWaalsContact C-N 3.32Å; A1125-R1127 PolarHBondContact O-N 3.02Å; A1125-Q1128 PolarHBondContact O-N 3.45Å; A1125-T1129 PolarHBondContact O-N 2.58Å; A1125-T1129 PolarHBondContact O-OG1 3.04Å
1126	K	88.4	Confident	83.9	Confident	48 Å²	48	69 Å²	69	21%	0.209	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-38.6	176.2	-175.5	167.9	179.5	160.9	0	112.8	L1093 L1098 D1102 I1122 E1124 R1130	L1093-K1126 HydrophobicContact CD1-CB 4.03Å; L1093-K1126 HydrophobicContact CD2-CB 4.31Å; L1093-K1126 HydrophobicContact CD2-CG 4.46Å; L1098-K1126 HydrophobicContact CD1-CG 4.19Å; D1102-K1126 WeakPolarHBondContact OD1-CE 3.25Å; D1102-K1126 IonicContact OD1-NZ 3.27Å; D1102-K1126 PolarHBondContact OD1-NZ 3.45Å; D1102-K1126 IonicContact OD2-NZ 3.01Å; D1102-K1126 PolarHBondContact OD2-NZ 3.36Å; D1102-K1126 VanDerWaalsContact OD2-NZ 3.17Å; I1122-K1126 VanDerWaalsContact O-CB 3.23Å; I1122-K1126 WeakPolarHBondContact O-CB 3.26Å; I1122-K1126 PolarHBondContact O-N 3.44Å; E1124-K1126 VanDerWaalsContact C-N 3.28Å; E1124-K1126 PolarHBondContact O-N 2.97Å; K1126-R1130 VanDerWaalsContact CE-NH2 3.27Å; K1126-R1130 WeakPolarHBondContact O-CB 3.45Å; K1126-R1130 WeakPolarHBondContact O-CG 3.47Å; K1126-R1130 PolarHBondContact O-N 3.42Å; K1126-R1130 VanDerWaalsContact O-N 3.13Å
1127	R	85.7	Confident	83	Confident	127 Å²	127	69.1 Å²	69.1	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-68.2	-44.9	176.3	-162.7	-174.6	-49.4	95.1	-0.6	111.1	S1123 E1124 A1125 T1129 R1130 M1131	S1123-R1127 PolarHBondContact O-N 3.49Å; S1123-R1127 VanDerWaalsContact O-N 3.15Å; E1124-R1127 WeakPolarHBondContact O-CB 3.48Å; E1124-R1127 PolarHBondContact O-N 3.37Å; E1124-R1127 IonicContact OE1-NH1 3.82Å; E1124-R1127 PolarHBondContact OE1-NH1 3.22Å; E1124-R1127 IonicContact OE2-CZ 2.65Å; E1124-R1127 IonicContact OE2-NH1 3.19Å; E1124-R1127 PolarHBondContact OE2-NH1 3.4Å; E1124-R1127 IonicContact OE2-NH2 3.58Å; A1125-R1127 VanDerWaalsContact C-N 3.32Å; A1125-R1127 PolarHBondContact O-N 3.02Å; R1127-T1129 PolarHBondContact O-N 3.3Å; R1127-R1130 PolarHBondContact O-N 3.34Å; R1127-M1131 VanDerWaalsContact O-CG 3.29Å; R1127-M1131 WeakPolarHBondContact O-CG 3.46Å; R1127-M1131 PolarHBondContact O-N 3.33Å
1128	Q	85.9	Confident	82	Confident	113 Å²	113	72.9 Å²	72.9	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-61.5	-44	179.1	-68.4	178.2	7.3	0	0	111.7	E1124 A1125 R1130 M1131 S1132	E1124-Q1128 WeakPolarHBondContact O-CG 3.34Å; E1124-Q1128 PolarHBondContact O-N 2.65Å; E1124-Q1128 PolarHBondContact OE1-NE2 3.23Å; A1125-Q1128 PolarHBondContact O-N 3.45Å; Q1128-R1130 PolarHBondContact O-N 3.28Å; Q1128-M1131 PolarHBondContact O-N 3.19Å; Q1128-S1132 PolarHBondContact O-N 3.01Å; Q1128-S1132 PolarHBondContact O-OG 2.87Å
1129	T	86.1	Confident	80.6	Confident	10 Å²	10	79 Å²	79	6%	0.061	40%	0.403	C	S	.	.	H	α-helix	trans	-68.9	-33.5	178.4	-53.5	0	0	0	0	112.8	L1093 L1098 A1125 R1127 S1132 K1133	L1093-T1129 WeakPolarHBondContact O-CG2 3.29Å; L1093-T1129 PolarHBondContact O-OG1 2.69Å; L1098-T1129 HydrophobicContact CD1-CG2 4.38Å; A1125-T1129 PolarHBondContact O-N 2.58Å; A1125-T1129 PolarHBondContact O-OG1 3.04Å; R1127-T1129 PolarHBondContact O-N 3.3Å; T1129-S1132 WeakPolarHBondContact CA-OG 3.49Å; T1129-S1132 PolarHBondContact O-OG 2.66Å; T1129-K1133 PolarHBondContact O-N 3.07Å; T1129-K1133 VanDerWaalsContact O-N 3.09Å
1130	R	83.8	Confident	79	Confident	124 Å²	124	80.8 Å²	80.8	47%	0.468	42%	0.422	S	S	.	.	H	α-helix	trans	-66.4	-42.5	171	-77.9	177.7	178.2	-173.4	-1.7	111.6	L1098 K1126 R1127 Q1128 L1134	L1098-R1130 HydrophobicContact CD1-CG 4Å; L1098-R1130 HydrophobicContact CD2-CG 3.83Å; K1126-R1130 VanDerWaalsContact CE-NH2 3.27Å; K1126-R1130 WeakPolarHBondContact O-CB 3.45Å; K1126-R1130 WeakPolarHBondContact O-CG 3.47Å; K1126-R1130 PolarHBondContact O-N 3.42Å; K1126-R1130 VanDerWaalsContact O-N 3.13Å; R1127-R1130 PolarHBondContact O-N 3.34Å; Q1128-R1130 PolarHBondContact O-N 3.28Å; R1130-L1134 WeakPolarHBondContact O-CB 3.42Å; R1130-L1134 VanDerWaalsContact O-CG 3.26Å; R1130-L1134 WeakPolarHBondContact O-CG 3.48Å; R1130-L1134 PolarHBondContact O-N 3.05Å
1131	M	81.1	Confident	77.2	Confident	123 Å²	123	78.1 Å²	78.1	61%	0.606	42%	0.42	S	S	*	.	H	α-helix	trans	-66.2	-39.4	177.4	-71.1	-63.6	-67.2	0	0	112.2	R1127 Q1128 L1134 A1135	R1127-M1131 VanDerWaalsContact O-CG 3.29Å; R1127-M1131 WeakPolarHBondContact O-CG 3.46Å; R1127-M1131 PolarHBondContact O-N 3.33Å; Q1128-M1131 PolarHBondContact O-N 3.19Å; M1131-L1134 PolarHBondContact O-N 3.41Å; M1131-A1135 WeakPolarHBondContact O-CB 3.41Å; M1131-A1135 PolarHBondContact O-N 3.45Å
1132	S	78.5	Confident	75.3	Confident	67 Å²	67	80.3 Å²	80.3	47%	0.469	44%	0.438	S	S	.	.	H	α-helix	trans	-67.9	-40.9	177	68.7	0	0	0	0	112.4	Q1128 T1129 A1135 S1136	Q1128-S1132 PolarHBondContact O-N 3.01Å; Q1128-S1132 PolarHBondContact O-OG 2.87Å; T1129-S1132 WeakPolarHBondContact CA-OG 3.49Å; T1129-S1132 PolarHBondContact O-OG 2.66Å; S1132-A1135 PolarHBondContact O-N 2.9Å; S1132-S1136 WeakPolarHBondContact O-CB 3.48Å; S1132-S1136 PolarHBondContact O-N 3.48Å
1133	K	75.9	Confident	73.2	Confident	91 Å²	91	88.9 Å²	88.9	40%	0.396	48%	0.478	S	S	.	.	H	α-helix	trans	-61	-46.4	171.3	-94	-179.6	177.5	173.9	0	111.8	G1096 T1129 A1135 S1136 C1137	G1096-K1133 PolarHBondContact O-NZ 3.44Å; T1129-K1133 PolarHBondContact O-N 3.07Å; T1129-K1133 VanDerWaalsContact O-N 3.09Å; K1133-A1135 PolarHBondContact O-N 2.86Å; K1133-S1136 PolarHBondContact O-N 3.39Å; K1133-S1136 PolarHBondContact O-OG 3.24Å; K1133-C1137 PolarHBondContact O-N 2.89Å; K1133-C1137 PolarHBondContact O-SG 2.95Å
1134	L	75.8	Confident	71	Confident	94 Å²	94	90.5 Å²	90.5	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-60.7	-45.2	176.6	-72.9	168	0	0	0	111.6	R1130 M1131 S1136 C1137 F1138	R1130-L1134 WeakPolarHBondContact O-CB 3.42Å; R1130-L1134 VanDerWaalsContact O-CG 3.26Å; R1130-L1134 WeakPolarHBondContact O-CG 3.48Å; R1130-L1134 PolarHBondContact O-N 3.05Å; M1131-L1134 PolarHBondContact O-N 3.41Å; L1134-S1136 VanDerWaalsContact C-N 3.34Å; L1134-S1136 PolarHBondContact O-N 2.99Å; L1134-C1137 WeakPolarHBondContact O-CB 3.32Å; L1134-C1137 PolarHBondContact O-N 3.31Å; L1134-F1138 WeakPolarHBondContact O-CD2 3.15Å; L1134-F1138 PolarHBondContact O-N 3.25Å
1135	A	72.2	Confident	69	Low	47 Å²	47	95.2 Å²	95.2	39%	0.388	52%	0.517	S	S	.	.	H	α-helix	trans	-62.1	-38.2	176.1	0	0	0	0	0	112.7	M1131 S1132 K1133 F1138 N1139	M1131-A1135 WeakPolarHBondContact O-CB 3.41Å; M1131-A1135 PolarHBondContact O-N 3.45Å; S1132-A1135 PolarHBondContact O-N 2.9Å; K1133-A1135 PolarHBondContact O-N 2.86Å; A1135-F1138 PolarHBondContact O-N 3.43Å; A1135-N1139 WeakPolarHBondContact O-CB 3.34Å; A1135-N1139 PolarHBondContact O-N 2.93Å
1136	S	67.7	Low	67.1	Low	65 Å²	65	99.2 Å²	99.2	46%	0.455	55%	0.55	S	S	.	.	H	α-helix	trans	-65.4	-36.6	174.2	74.6	0	0	0	0	112.7	S1132 K1133 L1134 N1139 A1140	S1132-S1136 WeakPolarHBondContact O-CB 3.48Å; S1132-S1136 PolarHBondContact O-N 3.48Å; K1133-S1136 PolarHBondContact O-N 3.39Å; K1133-S1136 PolarHBondContact O-OG 3.24Å; L1134-S1136 VanDerWaalsContact C-N 3.34Å; L1134-S1136 PolarHBondContact O-N 2.99Å; S1136-N1139 PolarHBondContact O-N 3.17Å; S1136-A1140 WeakPolarHBondContact O-CB 3.45Å; S1136-A1140 PolarHBondContact O-N 3.32Å
1137	C	66.4	Low	64.9	Low	88 Å²	88	105.8 Å²	105.8	60%	0.595	58%	0.581	S	S	*	*	H	α-helix	trans	-67.2	-36.2	174.1	-66.2	0	0	0	0	112.3	K1133 L1134	K1133-C1137 PolarHBondContact O-N 2.89Å; K1133-C1137 PolarHBondContact O-SG 2.95Å; L1134-C1137 WeakPolarHBondContact O-CB 3.32Å; L1134-C1137 PolarHBondContact O-N 3.31Å
1138	F	65.1	Low	63.1	Low	158 Å²	158	105.8 Å²	105.8	69%	0.693	60%	0.596	S	S	*	*	H	α-helix	trans	-72.3	-37.1	174.6	-78.9	-71.7	0	0	0	112.6	L1134 A1135 S1141	L1134-F1138 WeakPolarHBondContact O-CD2 3.15Å; L1134-F1138 PolarHBondContact O-N 3.25Å; A1135-F1138 PolarHBondContact O-N 3.43Å; F1138-S1141 VanDerWaalsContact O-CB 3.32Å; F1138-S1141 WeakPolarHBondContact O-CB 3.34Å; F1138-S1141 PolarHBondContact O-N 3.48Å
1139	N	58.3	Low	60.9	Low	131 Å²	131	111 Å²	111	70%	0.701	64%	0.635	S	S	*	*	H	α-helix	trans	-77.7	-18.1	177.3	-74.7	-14.5	0	0	0	114.1	A1135 S1136 S1141 P1142	A1135-N1139 WeakPolarHBondContact O-CB 3.34Å; A1135-N1139 PolarHBondContact O-N 2.93Å; S1136-N1139 PolarHBondContact O-N 3.17Å; N1139-S1141 VanDerWaalsContact C-N 3.28Å; N1139-P1142 WeakPolarHBondContact O-CD 3.03Å
1140	A	54.4	Low	59.7	Low	72 Å²	72	116.1 Å²	116.1	60%	0.595	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-11.2	169.8	0	0	0	0	0	113	S1136	S1136-A1140 WeakPolarHBondContact O-CB 3.45Å; S1136-A1140 PolarHBondContact O-N 3.32Å
1141	S	51.1	Low	58.4	Low	86 Å²	86	115.6 Å²	115.6	60%	0.601	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-11.2	-177.4	-167.6	0	0	0	0	117.9	F1138 N1139	F1138-S1141 VanDerWaalsContact O-CB 3.32Å; F1138-S1141 WeakPolarHBondContact O-CB 3.34Å; F1138-S1141 PolarHBondContact O-N 3.48Å; N1139-S1141 VanDerWaalsContact C-N 3.28Å
1142	P	50.5	Low	57.1	Low	96 Å²	96	115.2 Å²	115.2	62%	0.623	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	3.5	177.5	26.8	-15.4	0	0	0	115.3	N1139	N1139-P1142 WeakPolarHBondContact O-CD 3.03Å
1143	Q	45.7	Very low	55.9	Low	182 Å²	182	118.1 Å²	118.1	85%	0.85	69%	0.69	S	S	*	*	S	Bend	trans	-98.7	-1.3	179.2	-88.1	-175.7	-21.7	0	0	115.3
1144	A	42.3	Very low	54.6	Low	92 Å²	92	119.8 Å²	119.8	76%	0.76	71%	0.708	S	S	*	*	S	Bend	trans	-94.9	0.1	178.9	0	0	0	0	0	114.9
1145	E	45.7	Very low	53.2	Low	179 Å²	179	121.5 Å²	121.5	84%	0.836	72%	0.723	S	S	*	*	S	Bend	trans	-103.8	7.7	-179	-76.5	-172.2	162.7	0	0	114.9
1146	A	47.5	Very low	51.9	Low	90 Å²	90	126.8 Å²	126.8	74%	0.744	75%	0.747	S	S	*	*	S	Bend	trans	-103.7	5.8	-177.4	0	0	0	0	0	116
1147	E	44	Very low	50.6	Low	186 Å²	186	131.5 Å²	131.5	87%	0.869	77%	0.769	S	S	*	*	S	Bend	trans	-125.5	46.5	176.1	-73.4	-169.4	164.5	0	0	113
1148	T	46.4	Very low	49.3	Very low	127 Å²	127	135.2 Å²	135.2	78%	0.779	78%	0.784	S	S	*	*			trans	-158.4	85.3	155.5	45.8	0	0	0	0	110.9
1149	V	40.9	Very low	47.9	Very low	223 Å²	223	133.1 Å²	133.1	100%	1.352	79%	0.792	S	S	*	*			trans	-144.8	0	146.3	178.4	0	0	0	0	108.5

Retrieved 1,149 of 1,149 residues in 700.4 ms (Link to these results)

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