A0A3Q0KV50_SCHMA Loading...

Subfamily C1A unassigned peptidase (C01 family)

AlphaFold DB , UniProt , Accession A0A3Q0KV50, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,335 aa.

						>A0A3Q0KV50_SCHMA|A0A3Q0KV50
MADCKLFMNLSCEELERSVSDLNHKLFSSEIPEESQTVKDDLEEIDVGYLFVRVQYTIKNQIGKSSSNVSCSPEVIDKYVKNVFDLPTKIYDDLRMEACQAEPPVVVLNVSVIEAKNLEAKDLNGFSDPYCILGIIFGRYVGNNEKSTTPDLSINTTTTTFSPNDLETVQTTRNVSGKKGFDNNRVTFTRSSFRRFSQSFNKRTNQSEKLNISHNESFKMSGATSSKSVVNKEGHVPVGIMKSTQVKEQTLNPVWNENFRLELDDISSDKLHLDIWDHDEETSVLEAVRSLNEIRGVKQLGRYFKQVSQSARKNQTGDMDDFLGCVTIDIKDIPSTGLDSWFKLEGRSNRSKVQGEIHLALSLSVQNDLNESERDKTVAIQEHIQLFYLFSLYQLKQENSTGIPWNGNIVEEGEIILHQHAIQNGLTEIQVAMCQWIALIRLNYTRSLDQIILLHTFKQLISLWSDKLLTREELNYLSDSFKVFTEHSLIMICNYNLIFYNAQSENVLDFNHLLECLCMLHNSRLYQFSSPFSNSLQKEFLTSFKKFVLARYEKHKTTVMGKTDKSELIHLEISQLILLIKLLIIDLEKCCEVYSPIIKKYLDLDPFINMYKFYANSLHHDYIQINILQNLVLPIINQELETKSLLSTGKQCLTKSIELKSLFVLYLLLKKFENMFDIKIKSNEPKKLTDFDWYTWFRPVISYWIQQCNFQLLSNMDRDIQNDQLISTNEQLINFIPNKIKMEKYFGLYSISSLQIINNLTRLINTWILIDWSDEQTKYNYIIEIVQIACEVTLSYAKQLHEKLRLQGYCDEEGQFDISNSLSIGLNNLELISKFIQWILLFLNVQTPWSSNNKHVLSSISNTNDTSSNLCGTTTGKSNNTKSNNNNNNSGATDNTNATTKSIDDEETKIPYQHLETLKRLQHKGYGELIRVLNRTIYRMNAKMRPEIRKNVFHLCWSLRSTPVDKAMHDLIVYLDSNIRTLKTNVSSNLLHRCILSIWHECLEQYMEQTIKEGEINSTNVGGPGAFLQIKSNFNADNNSPTIIPLSTHEMHELISNLPMEIDKNQIFRAKSTLERLKKSLGILLEFFLKNGDDQISKGSLETEEYNNVKYLIQLYNSSTPEVIEQYFIEKLNEQELASSSSYGKLTVKIGYQRTSLYLDIQRATNLVPLDSNGLSDPFIIVELLPKHIFSETPKSSRTRIVKNTVDPVFDEHFEFPVTPEELQHPSFCLAFIVMDHDLIMSDDFEGCVFIRPSLLMKSSNKQEINPENSKLVFSNSRLQNRSANEYKQLQLCLPLIRPISKKYGALDILGQRTDSYAQEIFKRWKTLEDSEINQ
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.3	Very low	33.2	Very low	206 Å²	206	67.8 Å²	67.8	100%	1.015	37%	0.373	S	S	*	.				0	-45.9	0	-113.7	-179.8	170.9	0	0	111.9	D3	M1-D3 VanDerWaalsContact C-N 3.28Å
2	A	26.8	Very low	33.3	Very low	78 Å²	78	67.3 Å²	67.3	65%	0.645	38%	0.376	S	S	*	.			trans	-61.4	-35.2	166.1	0	0	0	0	0	112.3	K5	A2-K5 PolarHBondContact O-N 3.11Å
3	D	27.4	Very low	33.4	Very low	98 Å²	98	70.4 Å²	70.4	52%	0.524	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-81.1	-19.6	-174.4	-50.1	-56.8	0	0	0	115.4	M1 K5 L6	M1-D3 VanDerWaalsContact C-N 3.28Å; D3-K5 PolarHBondContact O-N 2.89Å; D3-L6 WeakPolarHBondContact O-CB 3.43Å; D3-L6 PolarHBondContact O-N 2.83Å
4	C	26.4	Very low	33.7	Very low	53 Å²	53	68.8 Å²	68.8	36%	0.358	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-72.8	-15.7	174.8	-56.9	0	0	0	0	112	L6 Q651 Q711	C4-L6 PolarHBondContact O-N 3.2Å; C4-Q651 PolarHBondContact SG-OE1 2.9Å; C4-Q711 PolarHBondContact O-NE2 2.77Å; C4-Q711 PolarHBondContact O-OE1 3.32Å
5	K	32.4	Very low	33.9	Very low	104 Å²	104	66 Å²	66	45%	0.452	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-66.3	-20.9	173.3	-78	-177.1	172.7	-178.6	0	112.4	A2 D3 F7 N9 Q711	A2-K5 PolarHBondContact O-N 3.11Å; D3-K5 PolarHBondContact O-N 2.89Å; K5-F7 PolarHBondContact O-N 3.05Å; K5-N9 WeakPolarHBondContact O-CB 3.11Å; K5-N9 PolarHBondContact O-N 3.09Å; K5-Q711 PolarHBondContact O-NE2 2.84Å
6	L	36	Very low	34	Very low	69 Å²	69	69.4 Å²	69.4	36%	0.361	37%	0.372	S	S	.	.	H	α-helix	trans	-70	-27.1	-168	-129	93.5	0	0	0	115.6	D3 C4 N9 L10	D3-L6 WeakPolarHBondContact O-CB 3.43Å; D3-L6 PolarHBondContact O-N 2.83Å; C4-L6 PolarHBondContact O-N 3.2Å; L6-N9 CarbonylContact O-C 3.54Å; L6-N9 WeakPolarHBondContact O-CA 3.15Å; L6-N9 PolarHBondContact O-N 3.39Å; L6-N9 VanDerWaalsContact O-N 3.15Å; L6-L10 PolarHBondContact O-N 3.04Å
7	F	37.2	Very low	34.2	Very low	27 Å²	27	73.4 Å²	73.4	12%	0.118	38%	0.38	C	S	.	.	H	α-helix	trans	-70.8	-43.1	-171.4	-124.2	-91.2	0	0	0	112.8	K5 N9 K660 Y703 W704 Q707	K5-F7 PolarHBondContact O-N 3.05Å; F7-N9 VanDerWaalsContact C-N 3.34Å; F7-K660 HydrophobicContact CE2-CD 4.43Å; F7-K660 HydrophobicContact CE2-CG 3.95Å; F7-K660 HydrophobicContact CZ-CG 4.31Å; F7-Y703 HydrophobicContact CE2-CE1 4.32Å; F7-Y703 HydrophobicContact CZ-CD1 4.21Å; F7-Y703 AromaticContact CZ-CE1 3.85Å; F7-Y703 HydrophobicContact CZ-CE1 3.85Å; F7-W704 AromaticContact CD1-CD1 3.9Å; F7-W704 HydrophobicContact CE1-CB 4.32Å; F7-W704 AromaticContact CE1-CD1 3.77Å; F7-W704 HydrophobicContact CE1-CG 4.44Å; F7-Q707 HydrophobicContact CD1-CB 4.02Å; F7-Q707 HydrophobicContact CE1-CB 4.19Å; F7-Q707 HydrophobicContact CE1-CG 4.44Å; F7-Q707 HydrophobicContact CG-CB 4.35Å; F7-Q707 HydrophobicContact CZ-CG 4.49Å
8	M	36.4	Very low	34.3	Very low	11 Å²	11	72.7 Å²	72.7	5%	0.054	38%	0.383	C	S	.	.	H	α-helix	trans	-72.8	-28	166.8	-68.9	-78.5	-76.2	0	0	112.1	L10 S11 C708 Q711 L712 N759 R762	M8-L10 VanDerWaalsContact C-N 3.27Å; M8-L10 PolarHBondContact O-N 2.89Å; M8-S11 PolarHBondContact O-N 2.83Å; M8-C708 HydrophobicContact SD-CB 4.48Å; M8-Q711 HydrophobicContact CG-CB 4.42Å; M8-Q711 VanDerWaalsContact CG-CD 3.47Å; M8-Q711 HydrophobicContact CG-CG 4.09Å; M8-L712 HydrophobicContact CE-CD2 3.54Å; M8-L712 HydrophobicContact CE-CG 4.06Å; M8-L712 HydrophobicContact SD-CD2 4.49Å; M8-L712 HydrophobicContact SD-CG 4.39Å; M8-N759 HydrophobicContact CE-CB 3.62Å; M8-N759 WeakPolarHBondContact CE-O 3.34Å; M8-R762 VanDerWaalsContact C-NH2 3.34Å; M8-R762 PolarHBondContact O-NH2 3.19Å
9	N	39.5	Very low	34.4	Very low	51 Å²	51	71.7 Å²	71.7	27%	0.273	38%	0.38	S	S	.	.	H	α-helix	trans	-73.5	-7.5	178.2	-87	6.7	0	0	0	116.3	K5 L6 F7 S11 E14 R762	K5-N9 WeakPolarHBondContact O-CB 3.11Å; K5-N9 PolarHBondContact O-N 3.09Å; L6-N9 CarbonylContact O-C 3.54Å; L6-N9 WeakPolarHBondContact O-CA 3.15Å; L6-N9 PolarHBondContact O-N 3.39Å; L6-N9 VanDerWaalsContact O-N 3.15Å; F7-N9 VanDerWaalsContact C-N 3.34Å; N9-S11 PolarHBondContact O-N 3.37Å; N9-S11 PolarHBondContact O-OG 2.82Å; N9-E14 WeakPolarHBondContact CB-OE2 2.99Å; N9-E14 VanDerWaalsContact O-CB 3.24Å; N9-E14 WeakPolarHBondContact O-CB 3.46Å; N9-E14 WeakPolarHBondContact O-CG 3.21Å; N9-R762 VanDerWaalsContact CA-NH2 3.27Å; N9-R762 PolarHBondContact OD1-NH1 2.94Å; N9-R762 PolarHBondContact OD1-NH2 3.48Å
10	L	39.8	Very low	34.4	Very low	24 Å²	24	71.3 Å²	71.3	13%	0.126	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	26.3	151.8	-69.8	162.8	0	0	0	113.5	L6 M8 L15 K660	L6-L10 PolarHBondContact O-N 3.04Å; M8-L10 VanDerWaalsContact C-N 3.27Å; M8-L10 PolarHBondContact O-N 2.89Å; L10-L15 HydrophobicContact CB-CD1 4.47Å; L10-L15 HydrophobicContact CD2-CD1 4.48Å; L10-L15 HydrophobicContact CD2-CD2 4.48Å; L10-L15 HydrophobicContact CD2-CG 4.07Å; L10-K660 HydrophobicContact CD1-CG 4.37Å
11	S	38.4	Very low	34.5	Very low	25 Å²	25	72.5 Å²	72.5	18%	0.175	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-36.8	143	150.7	59.9	0	0	0	0	109.6	M8 N9 E13 E14 L15	M8-S11 PolarHBondContact O-N 2.83Å; N9-S11 PolarHBondContact O-N 3.37Å; N9-S11 PolarHBondContact O-OG 2.82Å; S11-E13 PolarHBondContact O-N 3.15Å; S11-E14 PolarHBondContact O-N 3.26Å; S11-E14 PolarHBondContact OG-N 3.36Å; S11-L15 PolarHBondContact O-N 3.45Å; S11-L15 VanDerWaalsContact O-N 3.16Å
12	C	34.5	Very low	34.9	Very low	61 Å²	61	66.2 Å²	66.2	41%	0.412	36%	0.36	S	S	.	.	H	α-helix	trans	-43.1	-34.5	172.2	-68.8	0	0	0	0	111.2	L15 E16	C12-L15 PolarHBondContact O-N 3.47Å; C12-E16 WeakPolarHBondContact O-CA 3.33Å; C12-E16 WeakPolarHBondContact O-CB 3.32Å; C12-E16 WeakPolarHBondContact O-CG 3.25Å; C12-E16 PolarHBondContact O-N 3.07Å
13	E	34.3	Very low	35.2	Very low	108 Å²	108	65 Å²	65	51%	0.505	34%	0.342	S	S	.	.	H	α-helix	trans	-62.8	-38.9	174.6	-73	-171.3	-165.4	0	0	116.5	S11 R17	S11-E13 PolarHBondContact O-N 3.15Å; E13-R17 WeakPolarHBondContact O-CA 3.09Å; E13-R17 WeakPolarHBondContact O-CB 3.33Å; E13-R17 WeakPolarHBondContact O-CG 3.47Å; E13-R17 PolarHBondContact O-N 3.1Å; E13-R17 IonicContact OE2-CZ 3.53Å; E13-R17 IonicContact OE2-NH1 3.61Å; E13-R17 IonicContact OE2-NH2 3.41Å; E13-R17 PolarHBondContact OE2-NH2 3.48Å
14	E	36.8	Very low	35.5	Very low	48 Å²	48	67.1 Å²	67.1	22%	0.224	35%	0.349	C	S	.	.	H	α-helix	trans	-81.7	-28.8	175.6	-76.6	-175.7	-179.8	0	0	111.7	N9 S11 S18	N9-E14 WeakPolarHBondContact CB-OE2 2.99Å; N9-E14 VanDerWaalsContact O-CB 3.24Å; N9-E14 WeakPolarHBondContact O-CB 3.46Å; N9-E14 WeakPolarHBondContact O-CG 3.21Å; S11-E14 PolarHBondContact O-N 3.26Å; S11-E14 PolarHBondContact OG-N 3.36Å; E14-S18 WeakPolarHBondContact O-CA 3.24Å; E14-S18 WeakPolarHBondContact O-CB 3.38Å; E14-S18 PolarHBondContact O-N 3.14Å; E14-S18 PolarHBondContact O-OG 2.67Å
15	L	36.8	Very low	35.8	Very low	27 Å²	27	72.3 Å²	72.3	14%	0.141	37%	0.365	C	S	.	.	H	α-helix	trans	-64.8	-45.2	167.3	-91.1	158.3	0	0	0	110	L10 S11 C12 S18 V19 V664 L667	L10-L15 HydrophobicContact CB-CD1 4.47Å; L10-L15 HydrophobicContact CD2-CD1 4.48Å; L10-L15 HydrophobicContact CD2-CD2 4.48Å; L10-L15 HydrophobicContact CD2-CG 4.07Å; S11-L15 PolarHBondContact O-N 3.45Å; S11-L15 VanDerWaalsContact O-N 3.16Å; C12-L15 PolarHBondContact O-N 3.47Å; L15-S18 PolarHBondContact O-N 2.92Å; L15-V19 WeakPolarHBondContact O-CB 3.49Å; L15-V19 WeakPolarHBondContact O-CG2 2.93Å; L15-V19 PolarHBondContact O-N 3.32Å; L15-V664 HydrophobicContact CD2-CG2 3.88Å; L15-L667 HydrophobicContact CD1-CD1 4.07Å
16	E	35.6	Very low	35.7	Very low	120 Å²	120	70 Å²	70	56%	0.561	36%	0.358	S	S	*	.	H	α-helix	trans	-66.9	-39.5	174.9	-76.9	166.5	-168.3	0	0	111.6	C12 V19 S20	C12-E16 WeakPolarHBondContact O-CA 3.33Å; C12-E16 WeakPolarHBondContact O-CB 3.32Å; C12-E16 WeakPolarHBondContact O-CG 3.25Å; C12-E16 PolarHBondContact O-N 3.07Å; E16-V19 CarbonylContact O-C 3.56Å; E16-V19 WeakPolarHBondContact O-CB 3.41Å; E16-V19 PolarHBondContact O-N 3.42Å; E16-S20 WeakPolarHBondContact O-CA 3.39Å; E16-S20 WeakPolarHBondContact O-CB 2.87Å; E16-S20 PolarHBondContact O-N 2.91Å
17	R	37.3	Very low	35.6	Very low	137 Å²	137	74.3 Å²	74.3	52%	0.517	37%	0.374	S	S	.	.	H	α-helix	trans	-72.4	-39.3	173.9	-79.6	179.6	-163.9	133	17.7	111.6	E13 V19 S20 D21	E13-R17 WeakPolarHBondContact O-CA 3.09Å; E13-R17 WeakPolarHBondContact O-CB 3.33Å; E13-R17 WeakPolarHBondContact O-CG 3.47Å; E13-R17 PolarHBondContact O-N 3.1Å; E13-R17 IonicContact OE2-CZ 3.53Å; E13-R17 IonicContact OE2-NH1 3.61Å; E13-R17 IonicContact OE2-NH2 3.41Å; E13-R17 PolarHBondContact OE2-NH2 3.48Å; R17-V19 VanDerWaalsContact C-N 3.26Å; R17-V19 PolarHBondContact O-N 3.01Å; R17-S20 CarbonylContact O-C 3.58Å; R17-S20 PolarHBondContact O-N 2.98Å; R17-D21 WeakPolarHBondContact O-CA 3.4Å; R17-D21 WeakPolarHBondContact O-CB 3.45Å; R17-D21 VanDerWaalsContact O-CG 3.23Å; R17-D21 PolarHBondContact O-N 2.62Å
18	S	36.2	Very low	35.2	Very low	62 Å²	62	77.1 Å²	77.1	43%	0.434	40%	0.397	S	S	.	.	H	α-helix	trans	-65.7	-35.1	172.4	-59.6	0	0	0	0	110.6	E14 L15 L22	E14-S18 WeakPolarHBondContact O-CA 3.24Å; E14-S18 WeakPolarHBondContact O-CB 3.38Å; E14-S18 PolarHBondContact O-N 3.14Å; E14-S18 PolarHBondContact O-OG 2.67Å; L15-S18 PolarHBondContact O-N 2.92Å; S18-L22 VanDerWaalsContact O-CB 3.31Å; S18-L22 WeakPolarHBondContact O-CB 3.28Å; S18-L22 VanDerWaalsContact O-CD1 3.27Å; S18-L22 WeakPolarHBondContact O-CD1 3.32Å; S18-L22 PolarHBondContact O-N 3.34Å; S18-L22 VanDerWaalsContact O-N 3.09Å
19	V	36.2	Very low	34.7	Very low	54 Å²	54	80 Å²	80	33%	0.327	42%	0.418	S	S	.	.	H	α-helix	trans	-67.3	-43.1	170.8	165.7	0	0	0	0	110.7	L15 E16 R17 N23	L15-V19 WeakPolarHBondContact O-CB 3.49Å; L15-V19 WeakPolarHBondContact O-CG2 2.93Å; L15-V19 PolarHBondContact O-N 3.32Å; E16-V19 CarbonylContact O-C 3.56Å; E16-V19 WeakPolarHBondContact O-CB 3.41Å; E16-V19 PolarHBondContact O-N 3.42Å; R17-V19 VanDerWaalsContact C-N 3.26Å; R17-V19 PolarHBondContact O-N 3.01Å; V19-N23 VanDerWaalsContact O-CB 3.24Å; V19-N23 WeakPolarHBondContact O-CB 3.41Å; V19-N23 PolarHBondContact O-N 2.82Å; V19-N23 PolarHBondContact O-ND2 2.79Å; V19-N23 PolarHBondContact O-OD1 2.83Å
20	S	35.2	Very low	34.1	Very low	63 Å²	63	86.5 Å²	86.5	44%	0.441	45%	0.447	S	S	.	.	H	α-helix	trans	-72.4	-41.2	-178.6	-172.6	0	0	0	0	112.1	E16 R17 N23 H24	E16-S20 WeakPolarHBondContact O-CA 3.39Å; E16-S20 WeakPolarHBondContact O-CB 2.87Å; E16-S20 PolarHBondContact O-N 2.91Å; R17-S20 CarbonylContact O-C 3.58Å; R17-S20 PolarHBondContact O-N 2.98Å; S20-N23 CarbonylContact O-C 3.57Å; S20-N23 WeakPolarHBondContact O-CB 3.01Å; S20-N23 PolarHBondContact O-N 2.95Å; S20-H24 WeakPolarHBondContact O-CB 3.49Å; S20-H24 PolarHBondContact O-N 3.14Å
21	D	36.2	Very low	33.3	Very low	97 Å²	97	92.1 Å²	92.1	52%	0.519	48%	0.475	S	S	.	.	H	α-helix	trans	-72.2	-36.1	177.9	-73.5	-15	0	0	0	111	R17 K25	R17-D21 WeakPolarHBondContact O-CA 3.4Å; R17-D21 WeakPolarHBondContact O-CB 3.45Å; R17-D21 VanDerWaalsContact O-CG 3.23Å; R17-D21 PolarHBondContact O-N 2.62Å; D21-K25 WeakPolarHBondContact O-CB 3.16Å; D21-K25 WeakPolarHBondContact O-CG 3.02Å; D21-K25 PolarHBondContact O-N 3.08Å
22	L	33.4	Very low	32.7	Very low	74 Å²	74	95.9 Å²	95.9	39%	0.387	50%	0.499	S	S	.	.	H	α-helix	trans	-68.1	-41.3	167.7	-101.7	102.7	0	0	0	111.6	S18 H24 K25 L26	S18-L22 VanDerWaalsContact O-CB 3.31Å; S18-L22 WeakPolarHBondContact O-CB 3.28Å; S18-L22 VanDerWaalsContact O-CD1 3.27Å; S18-L22 WeakPolarHBondContact O-CD1 3.32Å; S18-L22 PolarHBondContact O-N 3.34Å; S18-L22 VanDerWaalsContact O-N 3.09Å; L22-H24 VanDerWaalsContact C-N 3.3Å; L22-H24 PolarHBondContact O-N 3.21Å; L22-K25 PolarHBondContact O-N 3.37Å; L22-L26 HydrophobicContact CD2-CD1 4.32Å; L22-L26 WeakPolarHBondContact O-CB 3.46Å; L22-L26 WeakPolarHBondContact O-CD1 3.26Å; L22-L26 PolarHBondContact O-N 3.48Å
23	N	33	Very low	32.2	Very low	52 Å²	52	102 Å²	102	28%	0.278	52%	0.522	S	S	.	.	H	α-helix	trans	-57.4	-48	174	-76.5	-13.6	0	0	0	109.5	V19 S20 K25 L26 F27	V19-N23 VanDerWaalsContact O-CB 3.24Å; V19-N23 WeakPolarHBondContact O-CB 3.41Å; V19-N23 PolarHBondContact O-N 2.82Å; V19-N23 PolarHBondContact O-ND2 2.79Å; V19-N23 PolarHBondContact O-OD1 2.83Å; S20-N23 CarbonylContact O-C 3.57Å; S20-N23 WeakPolarHBondContact O-CB 3.01Å; S20-N23 PolarHBondContact O-N 2.95Å; N23-K25 VanDerWaalsContact C-N 3.32Å; N23-K25 PolarHBondContact O-N 3.01Å; N23-L26 PolarHBondContact O-N 2.89Å; N23-L26 VanDerWaalsContact O-N 3.17Å; N23-F27 HydrophobicContact CB-CD2 4.06Å; N23-F27 HydrophobicContact CB-CE2 3.97Å; N23-F27 WeakPolarHBondContact O-CB 3.49Å; N23-F27 WeakPolarHBondContact O-CD2 3.41Å; N23-F27 WeakPolarHBondContact O-CG 3.47Å; N23-F27 PolarHBondContact O-N 2.92Å
24	H	34.2	Very low	31.7	Very low	143 Å²	143	103.7 Å²	103.7	66%	0.662	53%	0.53	S	S	*	.	H	α-helix	trans	-64.5	-33.8	-179.7	-142.7	-62.8	0	0	0	113	S20 L22 S28	S20-H24 WeakPolarHBondContact O-CB 3.49Å; S20-H24 PolarHBondContact O-N 3.14Å; L22-H24 VanDerWaalsContact C-N 3.3Å; L22-H24 PolarHBondContact O-N 3.21Å; H24-S28 PolarHBondContact O-N 3.29Å; H24-S28 PolarHBondContact O-OG 3.37Å
25	K	32.6	Very low	31.1	Very low	162 Å²	162	106.4 Å²	106.4	70%	0.704	55%	0.554	S	S	*	*	H	α-helix	trans	-76.9	-26.9	174.5	-77.7	178.3	178.9	175.8	0	114	D21 L22 N23 S28	D21-K25 WeakPolarHBondContact O-CB 3.16Å; D21-K25 WeakPolarHBondContact O-CG 3.02Å; D21-K25 PolarHBondContact O-N 3.08Å; L22-K25 PolarHBondContact O-N 3.37Å; N23-K25 VanDerWaalsContact C-N 3.32Å; N23-K25 PolarHBondContact O-N 3.01Å; K25-S28 PolarHBondContact O-OG 3.27Å; K25-S28 VanDerWaalsContact O-OG 3.08Å
26	L	30.1	Very low	30.5	Very low	56 Å²	56	112.9 Å²	112.9	29%	0.293	58%	0.584	S	S	.	*	H	α-helix	trans	-82.2	-36.6	174	-100.3	110.1	0	0	0	112.2	L22 N23 S28 S29 L578 L582	L22-L26 HydrophobicContact CD2-CD1 4.32Å; L22-L26 WeakPolarHBondContact O-CB 3.46Å; L22-L26 WeakPolarHBondContact O-CD1 3.26Å; L22-L26 PolarHBondContact O-N 3.48Å; N23-L26 PolarHBondContact O-N 2.89Å; N23-L26 VanDerWaalsContact O-N 3.17Å; L26-S28 PolarHBondContact O-N 3.29Å; L26-S29 PolarHBondContact O-N 3.41Å; L26-S29 PolarHBondContact O-OG 3.16Å; L26-L578 HydrophobicContact CD1-CD1 3.58Å; L26-L578 HydrophobicContact CD2-CD1 3.97Å; L26-L578 HydrophobicContact CG-CD1 4.44Å; L26-L582 HydrophobicContact CD2-CD2 4.34Å
27	F	33.3	Very low	29.9	Very low	158 Å²	158	113.3 Å²	113.3	69%	0.693	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-8.7	177	-70.6	-63.6	0	0	0	113.4	N23	N23-F27 HydrophobicContact CB-CD2 4.06Å; N23-F27 HydrophobicContact CB-CE2 3.97Å; N23-F27 WeakPolarHBondContact O-CB 3.49Å; N23-F27 WeakPolarHBondContact O-CD2 3.41Å; N23-F27 WeakPolarHBondContact O-CG 3.47Å; N23-F27 PolarHBondContact O-N 2.92Å
28	S	29.9	Very low	29.3	Very low	86 Å²	86	111.6 Å²	111.6	60%	0.601	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-3.8	172.1	60.7	0	0	0	0	114.7	H24 K25 L26 E30	H24-S28 PolarHBondContact O-N 3.29Å; H24-S28 PolarHBondContact O-OG 3.37Å; K25-S28 PolarHBondContact O-OG 3.27Å; K25-S28 VanDerWaalsContact O-OG 3.08Å; L26-S28 PolarHBondContact O-N 3.29Å; S28-E30 PolarHBondContact O-N 3.19Å
29	S	25.7	Very low	28.7	Very low	72 Å²	72	117.6 Å²	117.6	50%	0.503	62%	0.617	S	S	.	*	S	Bend	trans	-87.5	107.7	170.3	59.2	0	0	0	0	109.4	L26 I31	L26-S29 PolarHBondContact O-N 3.41Å; L26-S29 PolarHBondContact O-OG 3.16Å; S29-I31 PolarHBondContact O-N 3.01Å
30	E	25.7	Very low	28.3	Very low	187 Å²	187	120.7 Å²	120.7	87%	0.874	63%	0.632	S	S	*	*			trans	-42.1	126.7	173.2	-70.3	170.8	159.9	0	0	111	S28	S28-E30 PolarHBondContact O-N 3.19Å
31	I	24.5	Very low	27.9	Very low	142 Å²	142	125.6 Å²	125.6	73%	0.728	65%	0.653	S	S	*	*			trans	-58.4	123.3	174.6	-62	167.3	0	0	0	106.6	S29 E33	S29-I31 PolarHBondContact O-N 3.01Å; I31-E33 PolarHBondContact O-N 2.77Å; I31-E33 VanDerWaalsContact O-N 3.08Å
32	P	24.5	Very low	27.9	Very low	105 Å²	105	125.3 Å²	125.3	68%	0.682	65%	0.651	S	S	*	*			trans	-64.1	117.3	175.3	-10.2	23.4	0	0	0	107.8	E34	P32-E34 PolarHBondContact O-N 3.4Å
33	E	24.4	Very low	28.5	Very low	188 Å²	188	127.7 Å²	127.7	88%	0.879	66%	0.66	S	S	*	*			trans	-63.3	82.6	168.1	-71.9	-176.4	160.3	0	0	108.6	I31 S35	I31-E33 PolarHBondContact O-N 2.77Å; I31-E33 VanDerWaalsContact O-N 3.08Å; E33-S35 PolarHBondContact O-N 2.71Å
34	E	24.1	Very low	29.4	Very low	145 Å²	145	134.4 Å²	134.4	68%	0.678	69%	0.69	S	S	*	*			trans	-74.7	83.7	165.6	-79.4	-177.9	151.8	0	0	108.1	P32 Q36	P32-E34 PolarHBondContact O-N 3.4Å; E34-Q36 PolarHBondContact O-N 3.1Å
35	S	23.9	Very low	30.7	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	67%	0.672	S	S	*	*			trans	-66.2	84.4	163.7	58.8	0	0	0	0	108.7	E33 T37	E33-S35 PolarHBondContact O-N 2.71Å; S35-T37 VanDerWaalsContact C-N 3.33Å; S35-T37 PolarHBondContact O-N 3.03Å
36	Q	24.2	Very low	32.9	Very low	164 Å²	164	127.3 Å²	127.3	77%	0.766	66%	0.664	S	S	*	*			trans	-67.5	94.1	167.9	-82.4	-178.1	-16	0	0	108.8	E34 V38	E34-Q36 PolarHBondContact O-N 3.1Å; Q36-V38 VanDerWaalsContact C-N 3.25Å; Q36-V38 PolarHBondContact O-N 2.84Å
37	T	23.1	Very low	35.2	Very low	128 Å²	128	127 Å²	127	79%	0.785	67%	0.665	S	S	*	*			trans	-70.7	83.7	164.7	53	0	0	0	0	108.4	S35 K39	S35-T37 VanDerWaalsContact C-N 3.33Å; S35-T37 PolarHBondContact O-N 3.03Å; T37-K39 PolarHBondContact O-N 2.93Å
38	V	25.1	Very low	37.5	Very low	101 Å²	101	120.4 Å²	120.4	61%	0.612	64%	0.641	S	S	*	*			trans	-69	119.1	163.9	178.5	0	0	0	0	106.3	Q36 D40	Q36-V38 VanDerWaalsContact C-N 3.25Å; Q36-V38 PolarHBondContact O-N 2.84Å; V38-D40 PolarHBondContact O-N 2.83Å
39	K	24.2	Very low	40	Very low	189 Å²	189	119.7 Å²	119.7	82%	0.822	63%	0.626	S	S	*	*			trans	-58.5	120.4	179.3	-74.8	177.6	173.4	179.9	0	109.3	T37 D41	T37-K39 PolarHBondContact O-N 2.93Å; K39-D41 PolarHBondContact O-N 3.42Å
40	D	27.1	Very low	42.9	Very low	118 Å²	118	116.3 Å²	116.3	63%	0.631	60%	0.602	S	S	*	*			trans	-60.5	96.5	172.8	-74	-40.7	0	0	0	110.3	V38 L42	V38-D40 PolarHBondContact O-N 2.83Å; D40-L42 HydrophobicContact CB-CB 4.22Å; D40-L42 HydrophobicContact CB-CD1 3.79Å; D40-L42 HydrophobicContact CB-CG 3.92Å; D40-L42 PolarHBondContact O-N 3.04Å; D40-L42 VanDerWaalsContact O-N 3.08Å; D40-L42 WeakPolarHBondContact OD1-CD1 3.49Å
41	D	26.8	Very low	45.8	Very low	167 Å²	167	107.4 Å²	107.4	89%	0.893	56%	0.56	S	S	*	*			trans	-77.4	38.9	157.2	-73.7	-25.1	0	0	0	109.6	K39 E43	K39-D41 PolarHBondContact O-N 3.42Å; D41-E43 PolarHBondContact O-N 3.23Å
42	L	35.5	Very low	48.7	Very low	90 Å²	90	101.1 Å²	101.1	47%	0.471	53%	0.528	S	S	.	.			trans	-69.6	120.1	172.5	-71.4	168.2	0	0	0	106.6	D40 E44	D40-L42 HydrophobicContact CB-CB 4.22Å; D40-L42 HydrophobicContact CB-CD1 3.79Å; D40-L42 HydrophobicContact CB-CG 3.92Å; D40-L42 PolarHBondContact O-N 3.04Å; D40-L42 VanDerWaalsContact O-N 3.08Å; D40-L42 WeakPolarHBondContact OD1-CD1 3.49Å; L42-E44 PolarHBondContact O-N 3.26Å
43	E	46.8	Very low	51.6	Low	124 Å²	124	98.8 Å²	98.8	58%	0.579	51%	0.506	S	S	*	.			trans	-45	113.1	164.3	-73.5	180	149.8	0	0	107.4	D41 I45	D41-E43 PolarHBondContact O-N 3.23Å; E43-I45 PolarHBondContact O-N 3.37Å
44	E	51.9	Low	54.7	Low	194 Å²	194	89.9 Å²	89.9	91%	0.907	46%	0.464	S	S	*	.			trans	-53.5	106	-173	-153.8	173.7	-165	0	0	107.6	L42 D46	L42-E44 PolarHBondContact O-N 3.26Å; E44-D46 PolarHBondContact O-N 2.92Å
45	I	62.4	Low	57.6	Low	55 Å²	55	83.6 Å²	83.6	28%	0.282	44%	0.435	S	S	.	.			trans	-63	112.4	-178.5	-63.5	175.1	0	0	0	105.7	E43 V47 L50 Y388	E43-I45 PolarHBondContact O-N 3.37Å; I45-V47 HydrophobicContact CG2-CG2 4.25Å; I45-V47 WeakPolarHBondContact O-CG2 3.44Å; I45-V47 PolarHBondContact O-N 3.48Å; I45-L50 HydrophobicContact CG2-CD1 3.48Å; I45-L50 VanDerWaalsContact CG2-CD1 3.48Å; I45-Y388 HydrophobicContact CD1-CD1 3.99Å; I45-Y388 HydrophobicContact CD1-CE1 3.92Å
46	D	76.9	Confident	60.6	Low	101 Å²	101	80.7 Å²	80.7	54%	0.54	41%	0.408	S	S	.	.			trans	-72.6	84.2	174.3	-170.8	-18.3	0	0	0	108.8	E44 G48 Y49 L50	E44-D46 PolarHBondContact O-N 2.92Å; D46-G48 PolarHBondContact O-N 3.14Å; D46-G48 PolarHBondContact OD1-N 3.07Å; D46-Y49 VanDerWaalsContact CG-CB 3.43Å; D46-Y49 PolarHBondContact O-N 2.99Å; D46-Y49 PolarHBondContact OD1-N 2.89Å; D46-L50 PolarHBondContact O-N 3.09Å
47	V	79.9	Confident	63.5	Low	50 Å²	50	72.9 Å²	72.9	30%	0.303	37%	0.372	S	S	.	.	H	α-helix	trans	-57.3	-34.4	-178.6	179.6	0	0	0	0	110.7	I45 F51 F84 L86	I45-V47 HydrophobicContact CG2-CG2 4.25Å; I45-V47 WeakPolarHBondContact O-CG2 3.44Å; I45-V47 PolarHBondContact O-N 3.48Å; V47-F51 VanDerWaalsContact O-CB 3.3Å; V47-F51 WeakPolarHBondContact O-CB 3.28Å; V47-F51 PolarHBondContact O-N 3.44Å; V47-F84 HydrophobicContact CG1-CD1 3.59Å; V47-F84 HydrophobicContact CG1-CE1 4.25Å; V47-F84 WeakPolarHBondContact O-CE1 3.42Å; V47-L86 HydrophobicContact CG1-CD2 4.2Å
48	G	80.2	Confident	66.3	Low	19 Å²	19	68.5 Å²	68.5	20%	0.196	34%	0.343	C	S	.	.	H	α-helix	trans	-66.8	-47.1	177.4	0	0	0	0	0	112	D46 L50 F51 V52	D46-G48 PolarHBondContact O-N 3.14Å; D46-G48 PolarHBondContact OD1-N 3.07Å; G48-L50 PolarHBondContact O-N 2.76Å; G48-F51 WeakPolarHBondContact O-CB 2.86Å; G48-F51 PolarHBondContact O-N 3.41Å; G48-V52 WeakPolarHBondContact O-CG2 3.26Å; G48-V52 PolarHBondContact O-N 2.79Å
49	Y	83.6	Confident	68.9	Low	71 Å²	71	68.5 Å²	68.5	28%	0.278	34%	0.335	S	S	.	.	H	α-helix	trans	-59.8	-46.4	175.5	176.3	-100.5	0	0	0	112.6	D46 F51 V52 R53 F188 E382	D46-Y49 VanDerWaalsContact CG-CB 3.43Å; D46-Y49 PolarHBondContact O-N 2.99Å; D46-Y49 PolarHBondContact OD1-N 2.89Å; Y49-F51 VanDerWaalsContact C-N 3.3Å; Y49-F51 PolarHBondContact O-N 3.39Å; Y49-V52 PolarHBondContact O-N 2.79Å; Y49-R53 PolarHBondContact O-N 3.26Å; Y49-R53 PolarHBondContact OH-NH2 3.26Å; Y49-F188 HydrophobicContact CE2-CD1 4.25Å; Y49-E382 HydrophobicContact CE1-CG 4.07Å; Y49-E382 WeakPolarHBondContact CE1-OE1 3.47Å; Y49-E382 PolarHBondContact OH-OE1 2.7Å
50	L	86.8	Confident	71.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-35.7	177.3	-71.7	175.3	0	0	0	112.2	I45 D46 G48 R53 V54 F84 Q385 L386	I45-L50 HydrophobicContact CG2-CD1 3.48Å; I45-L50 VanDerWaalsContact CG2-CD1 3.48Å; D46-L50 PolarHBondContact O-N 3.09Å; G48-L50 PolarHBondContact O-N 2.76Å; L50-R53 WeakPolarHBondContact O-CB 3.37Å; L50-R53 PolarHBondContact O-N 3.12Å; L50-V54 WeakPolarHBondContact O-CG2 3.5Å; L50-V54 PolarHBondContact O-N 3.43Å; L50-F84 HydrophobicContact CB-CE1 3.95Å; L50-F84 HydrophobicContact CB-CZ 4.3Å; L50-Q385 HydrophobicContact CD1-CB 3.72Å; L50-Q385 HydrophobicContact CD2-CB 4.19Å; L50-L386 HydrophobicContact CB-CD2 4.22Å; L50-L386 HydrophobicContact CD2-CD2 4.12Å; L50-L386 HydrophobicContact CD2-CG 4.24Å
51	F	86.7	Confident	74	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-46.8	175.6	177.8	-93.9	0	0	0	111.5	V47 G48 Y49 R53 V54 Q55 V80 F84 L86 Y91 L94 R95	V47-F51 VanDerWaalsContact O-CB 3.3Å; V47-F51 WeakPolarHBondContact O-CB 3.28Å; V47-F51 PolarHBondContact O-N 3.44Å; G48-F51 WeakPolarHBondContact O-CB 2.86Å; G48-F51 PolarHBondContact O-N 3.41Å; Y49-F51 VanDerWaalsContact C-N 3.3Å; Y49-F51 PolarHBondContact O-N 3.39Å; F51-R53 VanDerWaalsContact C-N 3.27Å; F51-R53 PolarHBondContact O-N 3.29Å; F51-V54 PolarHBondContact O-N 3.48Å; F51-Q55 HydrophobicContact CD1-CG 4.11Å; F51-Q55 HydrophobicContact CE1-CG 3.64Å; F51-Q55 HydrophobicContact CE2-CG 4.13Å; F51-Q55 HydrophobicContact CZ-CG 3.66Å; F51-Q55 WeakPolarHBondContact O-CG 3.46Å; F51-Q55 PolarHBondContact O-N 3.01Å; F51-V80 HydrophobicContact CD2-CG1 3.93Å; F51-V80 HydrophobicContact CE2-CG1 3.65Å; F51-F84 HydrophobicContact CB-CD1 3.69Å; F51-F84 HydrophobicContact CB-CE1 3.7Å; F51-F84 HydrophobicContact CB-CG 4.33Å; F51-F84 HydrophobicContact CB-CZ 4.31Å; F51-F84 HydrophobicContact CD2-CB 4.07Å; F51-F84 HydrophobicContact CD2-CD1 4.02Å; F51-F84 HydrophobicContact CD2-CD2 4Å; F51-F84 HydrophobicContact CD2-CE1 4.48Å; F51-F84 HydrophobicContact CD2-CE2 4.44Å; F51-F84 AromaticContact CD2-CG 3.77Å; F51-F84 HydrophobicContact CD2-CG 3.77Å; F51-F84 HydrophobicContact CG-CD1 4.35Å; F51-F84 VanDerWaalsContact N-CE1 3.35Å; F51-L86 HydrophobicContact CB-CD1 4.05Å; F51-L86 HydrophobicContact CD1-CD1 4.26Å; F51-L86 HydrophobicContact CD2-CD1 3.82Å; F51-L86 HydrophobicContact CE2-CD1 4.32Å; F51-L86 HydrophobicContact CG-CD1 3.77Å; F51-Y91 HydrophobicContact CE1-CD2 4.5Å; F51-Y91 AromaticContact CE2-CD2 3.57Å; F51-Y91 HydrophobicContact CE2-CD2 3.57Å; F51-Y91 AromaticContact CE2-CE2 3.27Å; F51-Y91 HydrophobicContact CE2-CE2 3.27Å; F51-Y91 HydrophobicContact CZ-CD1 4.37Å; F51-Y91 AromaticContact CZ-CD2 3.45Å; F51-Y91 HydrophobicContact CZ-CD2 3.45Å; F51-Y91 VanDerWaalsContact CZ-CD2 3.45Å; F51-Y91 HydrophobicContact CZ-CE1 4.25Å; F51-Y91 AromaticContact CZ-CE2 3.31Å; F51-Y91 HydrophobicContact CZ-CE2 3.31Å; F51-Y91 AromaticContact CZ-CG 3.98Å; F51-Y91 HydrophobicContact CZ-CG 3.98Å; F51-Y91 AromaticContact CZ-CZ 3.71Å; F51-L94 HydrophobicContact CB-CD1 4.49Å; F51-L94 HydrophobicContact CD1-CB 3.48Å; F51-L94 VanDerWaalsContact CD1-CB 3.48Å; F51-L94 HydrophobicContact CD1-CD1 3.9Å; F51-L94 HydrophobicContact CD1-CG 4.36Å; F51-L94 HydrophobicContact CE1-CB 3.65Å; F51-L94 HydrophobicContact CG-CD1 4.45Å; F51-R95 HydrophobicContact CE1-CB 4.3Å
52	V	85.3	Confident	76.2	Confident	11 Å²	11	51 Å²	51	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-58.6	-42.3	175.4	173.6	0	0	0	0	110.4	G48 Y49 Q55 Y56 L94 E97 A98	G48-V52 WeakPolarHBondContact O-CG2 3.26Å; G48-V52 PolarHBondContact O-N 2.79Å; Y49-V52 PolarHBondContact O-N 2.79Å; V52-Q55 PolarHBondContact O-N 3.46Å; V52-Y56 WeakPolarHBondContact O-CB 3.12Å; V52-Y56 PolarHBondContact O-N 3.38Å; V52-L94 HydrophobicContact CG2-CB 3.99Å; V52-L94 HydrophobicContact CG2-CD2 3.87Å; V52-L94 HydrophobicContact CG2-CG 4.46Å; V52-E97 HydrophobicContact CG1-CG 4.48Å; V52-A98 HydrophobicContact CG1-CB 4.09Å
53	R	85.1	Confident	78	Confident	56 Å²	56	47.5 Å²	47.5	21%	0.211	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-43.9	175.7	-179.1	63.1	67.3	173.3	10	112.7	Y49 L50 F51 Y56 T57 E382	Y49-R53 PolarHBondContact O-N 3.26Å; Y49-R53 PolarHBondContact OH-NH2 3.26Å; L50-R53 WeakPolarHBondContact O-CB 3.37Å; L50-R53 PolarHBondContact O-N 3.12Å; F51-R53 VanDerWaalsContact C-N 3.27Å; F51-R53 PolarHBondContact O-N 3.29Å; R53-Y56 PolarHBondContact O-N 3.05Å; R53-T57 WeakPolarHBondContact O-CB 3.46Å; R53-T57 PolarHBondContact O-N 3.28Å; R53-T57 PolarHBondContact O-OG1 2.76Å; R53-E382 IonicContact CZ-OE1 2.73Å; R53-E382 IonicContact CZ-OE2 3.32Å; R53-E382 IonicContact NE-OE1 3.7Å; R53-E382 PolarHBondContact NE-OE1 3.19Å; R53-E382 IonicContact NE-OE2 3.86Å; R53-E382 PolarHBondContact NE-OE2 2.8Å; R53-E382 IonicContact NH2-OE1 3.95Å; R53-E382 PolarHBondContact NH2-OE1 3.38Å; R53-E382 IonicContact NH2-OE2 3.12Å; R53-E382 PolarHBondContact NH2-OE2 2.77Å
54	V	88.3	Confident	79.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-46.4	177.6	167.3	0	0	0	0	111	L50 F51 Y56 T57 I58 V80 F84 L386 F390 I416	L50-V54 WeakPolarHBondContact O-CG2 3.5Å; L50-V54 PolarHBondContact O-N 3.43Å; F51-V54 PolarHBondContact O-N 3.48Å; V54-Y56 VanDerWaalsContact C-N 3.31Å; V54-Y56 PolarHBondContact O-N 2.88Å; V54-T57 WeakPolarHBondContact O-CB 3.25Å; V54-T57 PolarHBondContact O-N 3.37Å; V54-T57 VanDerWaalsContact O-N 3.09Å; V54-I58 HydrophobicContact CG1-CD1 3.64Å; V54-I58 HydrophobicContact CG1-CG1 4.39Å; V54-I58 WeakPolarHBondContact O-CG1 3.25Å; V54-I58 PolarHBondContact O-N 2.86Å; V54-V80 HydrophobicContact CG1-CG1 4.04Å; V54-V80 HydrophobicContact CG1-CG2 3.72Å; V54-F84 HydrophobicContact CB-CE2 4.35Å; V54-F84 HydrophobicContact CB-CZ 4.36Å; V54-F84 HydrophobicContact CG1-CE2 4.45Å; V54-F84 HydrophobicContact CG2-CE2 4.05Å; V54-F84 HydrophobicContact CG2-CZ 3.84Å; V54-L386 HydrophobicContact CG2-CD1 4.22Å; V54-L386 HydrophobicContact CG2-CD2 3.4Å; V54-L386 VanDerWaalsContact CG2-CD2 3.4Å; V54-L386 HydrophobicContact CG2-CG 4.46Å; V54-F390 HydrophobicContact CG2-CZ 4.4Å; V54-I416 HydrophobicContact CG1-CD1 4.12Å; V54-I416 HydrophobicContact CG1-CG2 4.01Å; V54-I416 HydrophobicContact CG2-CG2 4.13Å
55	Q	86.9	Confident	79.9	Confident	14 Å²	14	40.1 Å²	40.1	7%	0.065	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-39.6	177.5	-70.1	-66	-18.4	0	0	111.8	F51 V52 T57 I58 K59 Y91 A98	F51-Q55 HydrophobicContact CD1-CG 4.11Å; F51-Q55 HydrophobicContact CE1-CG 3.64Å; F51-Q55 HydrophobicContact CE2-CG 4.13Å; F51-Q55 HydrophobicContact CZ-CG 3.66Å; F51-Q55 WeakPolarHBondContact O-CG 3.46Å; F51-Q55 PolarHBondContact O-N 3.01Å; V52-Q55 PolarHBondContact O-N 3.46Å; Q55-T57 VanDerWaalsContact C-N 3.34Å; Q55-T57 PolarHBondContact O-N 3.05Å; Q55-I58 PolarHBondContact O-N 2.81Å; Q55-K59 WeakPolarHBondContact O-CB 3Å; Q55-K59 PolarHBondContact O-N 3.32Å; Q55-Y91 PolarHBondContact NE2-OH 3.15Å; Q55-A98 HydrophobicContact CB-CB 3.45Å; Q55-A98 VanDerWaalsContact CB-CB 3.45Å
56	Y	85.3	Confident	79.7	Confident	43 Å²	43	41.1 Å²	41.1	17%	0.169	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-43.3	172.3	-176.9	-90.1	0	0	0	111.9	V52 R53 V54 K59 N60 A101 E102 P104	V52-Y56 WeakPolarHBondContact O-CB 3.12Å; V52-Y56 PolarHBondContact O-N 3.38Å; R53-Y56 PolarHBondContact O-N 3.05Å; V54-Y56 VanDerWaalsContact C-N 3.31Å; V54-Y56 PolarHBondContact O-N 2.88Å; Y56-K59 PolarHBondContact O-N 3.06Å; Y56-N60 VanDerWaalsContact CD2-ND2 3.35Å; Y56-N60 WeakPolarHBondContact CD2-ND2 3.43Å; Y56-N60 WeakPolarHBondContact CE2-ND2 3.5Å; Y56-N60 WeakPolarHBondContact O-CB 3.24Å; Y56-N60 PolarHBondContact O-N 3.22Å; Y56-N60 PolarHBondContact O-ND2 3.43Å; Y56-A101 HydrophobicContact CD2-CB 3.76Å; Y56-A101 HydrophobicContact CE2-CB 3.8Å; Y56-E102 WeakPolarHBondContact CE2-O 3.09Å; Y56-E102 PolarHBondContact OH-O 3.28Å; Y56-E102 VanDerWaalsContact OH-O 3.05Å; Y56-P104 VanDerWaalsContact OH-CD 3.28Å; Y56-P104 WeakPolarHBondContact OH-CD 3.17Å
57	T	85.6	Confident	78.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-45.8	179.6	-56.2	0	0	0	0	111.1	R53 V54 Q55 N60 Q419 H420 Q423	R53-T57 WeakPolarHBondContact O-CB 3.46Å; R53-T57 PolarHBondContact O-N 3.28Å; R53-T57 PolarHBondContact O-OG1 2.76Å; V54-T57 WeakPolarHBondContact O-CB 3.25Å; V54-T57 PolarHBondContact O-N 3.37Å; V54-T57 VanDerWaalsContact O-N 3.09Å; Q55-T57 VanDerWaalsContact C-N 3.34Å; Q55-T57 PolarHBondContact O-N 3.05Å; T57-N60 PolarHBondContact O-N 3.36Å; T57-Q419 HydrophobicContact CG2-CB 3.56Å; T57-H420 HydrophobicContact CG2-CB 4.12Å; T57-Q423 PolarHBondContact O-NE2 3.2Å; T57-Q423 VanDerWaalsContact O-NE2 3.15Å
58	I	83.1	Confident	77.1	Confident	35 Å²	35	44.2 Å²	44.2	18%	0.179	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-38.4	179.9	-66.6	163.9	0	0	0	111.6	V54 Q55 Q61 I76 V80 I416	V54-I58 HydrophobicContact CG1-CD1 3.64Å; V54-I58 HydrophobicContact CG1-CG1 4.39Å; V54-I58 WeakPolarHBondContact O-CG1 3.25Å; V54-I58 PolarHBondContact O-N 2.86Å; Q55-I58 PolarHBondContact O-N 2.81Å; I58-Q61 WeakPolarHBondContact O-CG 3.47Å; I58-Q61 PolarHBondContact O-NE2 2.97Å; I58-I76 HydrophobicContact CD1-CG2 3.7Å; I58-I76 HydrophobicContact CG1-CG2 4.13Å; I58-V80 HydrophobicContact CD1-CG2 3.7Å; I58-I416 HydrophobicContact CD1-CD1 4.09Å; I58-I416 HydrophobicContact CD1-CG1 4.17Å; I58-I416 HydrophobicContact CG1-CG1 4.08Å
59	K	79.4	Confident	75.5	Confident	102 Å²	102	47.7 Å²	47.7	44%	0.443	25%	0.251	S	S	.	.	H	α-helix	trans	-68.2	-38.9	178.8	-177	-174.2	170.6	-159.6	0	111.9	Q55 Y56 C99	Q55-K59 WeakPolarHBondContact O-CB 3Å; Q55-K59 PolarHBondContact O-N 3.32Å; Y56-K59 PolarHBondContact O-N 3.06Å; K59-C99 PolarHBondContact NZ-O 3.38Å
60	N	79.8	Confident	74.1	Confident	20 Å²	20	49.5 Å²	49.5	11%	0.107	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	45.5	-171.2	-57.8	-61.1	0	0	0	112.6	Y56 T57 P104 Q423	Y56-N60 VanDerWaalsContact CD2-ND2 3.35Å; Y56-N60 WeakPolarHBondContact CD2-ND2 3.43Å; Y56-N60 WeakPolarHBondContact CE2-ND2 3.5Å; Y56-N60 WeakPolarHBondContact O-CB 3.24Å; Y56-N60 PolarHBondContact O-N 3.22Å; Y56-N60 PolarHBondContact O-ND2 3.43Å; T57-N60 PolarHBondContact O-N 3.36Å; N60-P104 HydrophobicContact CB-CG 4.01Å; N60-Q423 PolarHBondContact O-NE2 3.38Å
61	Q	77.2	Confident	72.7	Confident	84 Å²	84	50.9 Å²	50.9	39%	0.393	28%	0.283	S	S	.	.			trans	-58.3	140.1	-179.2	-70	176.2	31.4	0	0	112.1	I58 Q419	I58-Q61 WeakPolarHBondContact O-CG 3.47Å; I58-Q61 PolarHBondContact O-NE2 2.97Å; Q61-Q419 HydrophobicContact CG-CG 4.16Å
62	I	74.9	Confident	71.9	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	30%	0.299	C	S	.	.			trans	-107.9	126.5	179.9	-59.7	-178	0	0	0	108.7	V106 S335 L363 V365 Q419 I422 Q423	I62-V106 HydrophobicContact CG2-CG1 4.46Å; I62-S335 WeakPolarHBondContact O-CB 3.13Å; I62-L363 HydrophobicContact CG2-CB 3.35Å; I62-L363 HydrophobicContact CG2-CD1 4.03Å; I62-L363 HydrophobicContact CG2-CG 4.33Å; I62-V365 HydrophobicContact CD1-CG2 3.42Å; I62-V365 VanDerWaalsContact CD1-CG2 3.42Å; I62-Q419 PolarHBondContact O-NE2 3.41Å; I62-Q419 VanDerWaalsContact O-NE2 3.15Å; I62-Q419 PolarHBondContact O-OE1 3.22Å; I62-I422 HydrophobicContact CB-CG2 4.32Å; I62-I422 HydrophobicContact CG2-CG2 4.18Å; I62-Q423 HydrophobicContact CD1-CB 4.28Å; I62-Q423 HydrophobicContact CD1-CG 3.52Å; I62-Q423 HydrophobicContact CG1-CG 3.97Å
63	G	73.4	Confident	71.4	Confident	18 Å²	18	57.8 Å²	57.8	19%	0.186	33%	0.329	C	S	.	.	S	Bend	trans	71.7	168.5	178	0	0	0	0	0	114.4	I333	G63-I333 CarbonylContact C-O 3.5Å; G63-I333 WeakPolarHBondContact CA-O 3.12Å
64	K	72.6	Confident	71	Confident	106 Å²	106	62.6 Å²	62.6	46%	0.461	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-72.7	138.4	176.7	-167.8	171.5	-177	172.8	0	110.2	S66 D332 I333 P334 S335	K64-S66 PolarHBondContact O-N 2.84Å; K64-D332 IonicContact NZ-OD1 2.67Å; K64-D332 PolarHBondContact NZ-OD1 3.1Å; K64-I333 PolarHBondContact N-O 3.07Å; K64-P334 WeakPolarHBondContact O-CA 3.34Å; K64-S335 PolarHBondContact O-N 2.87Å
65	S	66	Low	70.7	Confident	56 Å²	56	65.3 Å²	65.3	39%	0.392	37%	0.371	S	S	.	.			trans	-59.9	130.4	171.3	-171.2	0	0	0	0	109.5	S67	S65-S67 VanDerWaalsContact C-N 3.29Å; S65-S67 PolarHBondContact OG-OG 3.23Å
66	S	57.5	Low	70.5	Confident	76 Å²	76	65 Å²	65	53%	0.531	37%	0.369	S	S	.	.			trans	-77.2	-14.1	178.7	48.6	0	0	0	0	113.1	K64	K64-S66 PolarHBondContact O-N 2.84Å
67	S	51.8	Low	70.4	Confident	40 Å²	40	64.2 Å²	64.2	28%	0.28	37%	0.368	S	S	.	.			trans	-75.1	130.2	178.5	59.9	0	0	0	0	111.6	S65 V69	S65-S67 VanDerWaalsContact C-N 3.29Å; S65-S67 PolarHBondContact OG-OG 3.23Å; S67-V69 PolarHBondContact O-N 2.87Å; S67-V69 PolarHBondContact OG-O 3.21Å
68	N	50.4	Low	70.4	Confident	176 Å²	176	70.7 Å²	70.7	94%	0.941	40%	0.396	S	S	*	.	S	Bend	trans	-66.3	0.1	170.6	-76.3	-24.7	0	0	0	113.2
69	V	46.8	Very low	70.6	Confident	93 Å²	93	69.7 Å²	69.7	56%	0.564	39%	0.39	S	S	*	.	S	Bend	trans	-118.9	99.7	177	-174.3	0	0	0	0	106.5	S67 C71	S67-V69 PolarHBondContact O-N 2.87Å; S67-V69 PolarHBondContact OG-O 3.21Å; V69-C71 PolarHBondContact O-N 3.42Å; V69-C71 VanDerWaalsContact O-N 3.08Å
70	S	53.7	Low	71	Confident	109 Å²	109	64.8 Å²	64.8	76%	0.762	37%	0.369	S	S	*	.			trans	-72.6	100.9	175	56.5	0	0	0	0	108.8	S72	S70-S72 PolarHBondContact O-N 3.07Å
71	C	57.6	Low	71.3	Confident	29 Å²	29	68 Å²	68	20%	0.196	38%	0.382	C	S	.	.			trans	-60.1	127	170	-169.5	0	0	0	0	109	V69 I415	V69-C71 PolarHBondContact O-N 3.42Å; V69-C71 VanDerWaalsContact O-N 3.08Å; C71-I415 HydrophobicContact CB-CD1 4Å
72	S	69.5	Low	71.8	Confident	48 Å²	48	67.6 Å²	67.6	34%	0.336	38%	0.383	S	S	.	.			trans	-70.1	144.4	-175.7	72.1	0	0	0	0	110.2	S70 E74 V75 I76	S70-S72 PolarHBondContact O-N 3.07Å; S72-E74 PolarHBondContact O-N 2.97Å; S72-V75 PolarHBondContact O-N 3.46Å; S72-V75 WeakPolarHBondContact OG-CG2 3.47Å; S72-I76 PolarHBondContact O-N 3.41Å
73	P	74.2	Confident	72.4	Confident	107 Å²	107	68.1 Å²	68.1	70%	0.695	39%	0.386	S	S	*	.	H	α-helix	trans	-53.8	-28.2	179.1	-27.2	34.2	0	0	0	113.8	D77	P73-D77 WeakPolarHBondContact O-CB 3.32Å; P73-D77 PolarHBondContact O-N 3.3Å
74	E	77.1	Confident	73.1	Confident	158 Å²	158	67.8 Å²	67.8	74%	0.738	38%	0.379	S	S	*	.	H	α-helix	trans	-66.4	-37.4	176.4	-61.7	177.8	176	0	0	112.8	S72 K78	S72-E74 PolarHBondContact O-N 2.97Å; E74-K78 WeakPolarHBondContact O-CB 3.45Å; E74-K78 PolarHBondContact O-N 3.19Å
75	V	82.6	Confident	73.6	Confident	57 Å²	57	69.4 Å²	69.4	35%	0.345	39%	0.393	S	S	.	.	H	α-helix	trans	-70.9	-40.9	178.8	176	0	0	0	0	110.2	S72 K78 Y79 E412	S72-V75 PolarHBondContact O-N 3.46Å; S72-V75 WeakPolarHBondContact OG-CG2 3.47Å; V75-K78 PolarHBondContact O-N 2.91Å; V75-Y79 PolarHBondContact O-N 3.25Å; V75-E412 HydrophobicContact CG1-CG 3.85Å; V75-E412 WeakPolarHBondContact CG1-OE1 3.44Å
76	I	83.4	Confident	74.4	Confident	7 Å²	7	68.5 Å²	68.5	4%	0.036	38%	0.384	C	S	.	.	H	α-helix	trans	-63.7	-45.7	174.4	-57.8	178.3	0	0	0	110.8	I58 S72 K78 Y79 V80 E412 I415 I416	I58-I76 HydrophobicContact CD1-CG2 3.7Å; I58-I76 HydrophobicContact CG1-CG2 4.13Å; S72-I76 PolarHBondContact O-N 3.41Å; I76-K78 VanDerWaalsContact C-N 3.29Å; I76-K78 PolarHBondContact O-N 3.39Å; I76-Y79 WeakPolarHBondContact O-CB 3.32Å; I76-Y79 PolarHBondContact O-N 3.02Å; I76-Y79 VanDerWaalsContact O-N 3.16Å; I76-V80 HydrophobicContact CG2-CG2 4.47Å; I76-V80 WeakPolarHBondContact O-CG2 3.41Å; I76-V80 PolarHBondContact O-N 2.96Å; I76-E412 HydrophobicContact CG1-CG 4.47Å; I76-I415 HydrophobicContact CD1-CG2 4.36Å; I76-I416 HydrophobicContact CG2-CD1 4.05Å; I76-I416 HydrophobicContact CG2-CG1 4.26Å
77	D	82.4	Confident	75.5	Confident	26 Å²	26	68.8 Å²	68.8	14%	0.139	38%	0.384	C	S	.	.	H	α-helix	trans	-61	-38.7	177.1	-174.6	80.1	0	0	0	111.5	P73 K81 Y91 R95	P73-D77 WeakPolarHBondContact O-CB 3.32Å; P73-D77 PolarHBondContact O-N 3.3Å; D77-K81 WeakPolarHBondContact O-CB 3.49Å; D77-K81 WeakPolarHBondContact O-CG 3.37Å; D77-K81 PolarHBondContact O-N 3.23Å; D77-K81 VanDerWaalsContact OD2-CE 3.24Å; D77-K81 WeakPolarHBondContact OD2-CE 3.28Å; D77-K81 IonicContact OD2-NZ 3.31Å; D77-K81 PolarHBondContact OD2-NZ 3.32Å; D77-Y91 PolarHBondContact OD1-OH 2.68Å; D77-R95 IonicContact OD1-CZ 2.63Å; D77-R95 IonicContact OD1-NH1 3.72Å; D77-R95 PolarHBondContact OD1-NH1 3.06Å; D77-R95 IonicContact OD1-NH2 3.04Å; D77-R95 IonicContact OD2-NH1 2.98Å
78	K	84.4	Confident	76.9	Confident	137 Å²	137	72 Å²	72	60%	0.596	40%	0.402	S	S	*	.	H	α-helix	trans	-64.5	-43.1	174	-173.9	-179.1	179.4	-175.8	0	112.1	E74 V75 I76 K81 N82	E74-K78 WeakPolarHBondContact O-CB 3.45Å; E74-K78 PolarHBondContact O-N 3.19Å; V75-K78 PolarHBondContact O-N 2.91Å; I76-K78 VanDerWaalsContact C-N 3.29Å; I76-K78 PolarHBondContact O-N 3.39Å; K78-K81 PolarHBondContact O-N 3.21Å; K78-N82 PolarHBondContact O-N 3.01Å; K78-N82 VanDerWaalsContact O-N 3.1Å; K78-N82 PolarHBondContact O-OD1 3.17Å
79	Y	88.4	Confident	78.4	Confident	13 Å²	13	71.3 Å²	71.3	5%	0.051	39%	0.391	C	S	.	.	H	α-helix	trans	-60.1	-49.4	176	175.4	-101.5	0	0	0	111.2	V75 I76 K81 N82 V83 F390 Y393 V410 E412 I416	V75-Y79 PolarHBondContact O-N 3.25Å; I76-Y79 WeakPolarHBondContact O-CB 3.32Å; I76-Y79 PolarHBondContact O-N 3.02Å; I76-Y79 VanDerWaalsContact O-N 3.16Å; Y79-K81 VanDerWaalsContact C-N 3.34Å; Y79-K81 PolarHBondContact O-N 2.78Å; Y79-N82 PolarHBondContact O-N 2.98Å; Y79-N82 VanDerWaalsContact O-N 3.13Å; Y79-V83 HydrophobicContact CD1-CG2 4.03Å; Y79-V83 HydrophobicContact CD2-CG2 4.13Å; Y79-V83 HydrophobicContact CE1-CG2 3.63Å; Y79-V83 HydrophobicContact CE2-CG2 3.73Å; Y79-V83 HydrophobicContact CG-CG2 4.26Å; Y79-V83 VanDerWaalsContact CZ-CG2 3.46Å; Y79-V83 VanDerWaalsContact O-CG2 3.29Å; Y79-V83 WeakPolarHBondContact O-CG2 3.39Å; Y79-V83 PolarHBondContact O-N 3.48Å; Y79-F390 HydrophobicContact CE1-CD1 4.31Å; Y79-F390 HydrophobicContact CE1-CE1 4.31Å; Y79-F390 HydrophobicContact CE1-CG 4.47Å; Y79-F390 HydrophobicContact CE1-CZ 4.46Å; Y79-F390 WeakPolarHBondContact OH-CB 3.17Å; Y79-F390 WeakPolarHBondContact OH-CG 3.33Å; Y79-Y393 HydrophobicContact CD2-CD1 4.46Å; Y79-Y393 AromaticContact CD2-CE1 3.92Å; Y79-Y393 HydrophobicContact CD2-CE1 3.92Å; Y79-Y393 AromaticContact CE2-CD1 3.73Å; Y79-Y393 HydrophobicContact CE2-CD1 3.73Å; Y79-Y393 AromaticContact CE2-CE1 3.6Å; Y79-Y393 HydrophobicContact CE2-CE1 3.6Å; Y79-V410 HydrophobicContact CD2-CG2 3.9Å; Y79-V410 HydrophobicContact CE2-CG2 3.3Å; Y79-E412 HydrophobicContact CD1-CB 3.82Å; Y79-E412 HydrophobicContact CD2-CB 4.18Å; Y79-E412 HydrophobicContact CE1-CB 4.44Å; Y79-E412 HydrophobicContact CG-CB 3.67Å; Y79-E412 HydrophobicContact CG-CG 4.37Å; Y79-I416 HydrophobicContact CD1-CD1 4.15Å; Y79-I416 HydrophobicContact CE1-CD1 4.32Å
80	V	87.7	Confident	80.1	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-60.6	-42.3	178.4	177.4	0	0	0	0	111.6	F51 V54 I58 I76 N82 V83 F84 I416	F51-V80 HydrophobicContact CD2-CG1 3.93Å; F51-V80 HydrophobicContact CE2-CG1 3.65Å; V54-V80 HydrophobicContact CG1-CG1 4.04Å; V54-V80 HydrophobicContact CG1-CG2 3.72Å; I58-V80 HydrophobicContact CD1-CG2 3.7Å; I76-V80 HydrophobicContact CG2-CG2 4.47Å; I76-V80 WeakPolarHBondContact O-CG2 3.41Å; I76-V80 PolarHBondContact O-N 2.96Å; V80-N82 VanDerWaalsContact C-N 3.31Å; V80-N82 PolarHBondContact O-N 3.31Å; V80-V83 PolarHBondContact O-N 2.8Å; V80-F84 HydrophobicContact CG1-CD2 3.73Å; V80-F84 HydrophobicContact CG1-CE2 4.02Å; V80-F84 WeakPolarHBondContact O-CD2 3.41Å; V80-F84 PolarHBondContact O-N 3.4Å; V80-F84 VanDerWaalsContact O-N 3.09Å; V80-I416 HydrophobicContact CG2-CD1 3.7Å
81	K	85.6	Confident	81.5	Confident	86 Å²	86	65.9 Å²	65.9	37%	0.374	35%	0.349	S	S	.	.	H	α-helix	trans	-55.1	-46.4	173.9	-81.5	170	174.6	159.4	0	112.2	D77 K78 Y79 D85 Y91	D77-K81 WeakPolarHBondContact O-CB 3.49Å; D77-K81 WeakPolarHBondContact O-CG 3.37Å; D77-K81 PolarHBondContact O-N 3.23Å; D77-K81 VanDerWaalsContact OD2-CE 3.24Å; D77-K81 WeakPolarHBondContact OD2-CE 3.28Å; D77-K81 IonicContact OD2-NZ 3.31Å; D77-K81 PolarHBondContact OD2-NZ 3.32Å; K78-K81 PolarHBondContact O-N 3.21Å; Y79-K81 VanDerWaalsContact C-N 3.34Å; Y79-K81 PolarHBondContact O-N 2.78Å; K81-D85 WeakPolarHBondContact O-CA 3.29Å; K81-D85 PolarHBondContact O-N 2.85Å; K81-Y91 HydrophobicContact CB-CE2 4.23Å; K81-Y91 HydrophobicContact CD-CE1 4.49Å; K81-Y91 HydrophobicContact CD-CE2 4.29Å; K81-Y91 VanDerWaalsContact CE-CE1 3.43Å; K81-Y91 VanDerWaalsContact CE-CZ 3.41Å; K81-Y91 HydrophobicContact CG-CD2 4Å; K81-Y91 HydrophobicContact CG-CE1 4.21Å; K81-Y91 HydrophobicContact CG-CE2 3.22Å; K81-Y91 WeakPolarHBondContact CG-OH 3.49Å
82	N	87.5	Confident	82.8	Confident	77 Å²	77	68.3 Å²	68.3	41%	0.412	36%	0.36	S	S	.	.	H	α-helix	trans	-72.8	-36.4	-176.9	-64.4	-10	0	0	0	112.8	K78 Y79 V80 Y393	K78-N82 PolarHBondContact O-N 3.01Å; K78-N82 VanDerWaalsContact O-N 3.1Å; K78-N82 PolarHBondContact O-OD1 3.17Å; Y79-N82 PolarHBondContact O-N 2.98Å; Y79-N82 VanDerWaalsContact O-N 3.13Å; V80-N82 VanDerWaalsContact C-N 3.31Å; V80-N82 PolarHBondContact O-N 3.31Å; N82-Y393 HydrophobicContact CB-CE2 3.65Å; N82-Y393 WeakPolarHBondContact CB-OH 3.49Å; N82-Y393 PolarHBondContact ND2-OH 2.91Å; N82-Y393 WeakPolarHBondContact O-CE2 3.49Å
83	V	87.7	Confident	83.5	Confident	12 Å²	12	70.8 Å²	70.8	7%	0.073	37%	0.369	C	S	.	.	H	α-helix	trans	-65.8	-48.2	179.1	168	0	0	0	0	111.3	Y79 V80 L389 F390 Y393	Y79-V83 HydrophobicContact CD1-CG2 4.03Å; Y79-V83 HydrophobicContact CD2-CG2 4.13Å; Y79-V83 HydrophobicContact CE1-CG2 3.63Å; Y79-V83 HydrophobicContact CE2-CG2 3.73Å; Y79-V83 HydrophobicContact CG-CG2 4.26Å; Y79-V83 VanDerWaalsContact CZ-CG2 3.46Å; Y79-V83 VanDerWaalsContact O-CG2 3.29Å; Y79-V83 WeakPolarHBondContact O-CG2 3.39Å; Y79-V83 PolarHBondContact O-N 3.48Å; V80-V83 PolarHBondContact O-N 2.8Å; V83-L389 HydrophobicContact CG1-CD2 3.8Å; V83-L389 HydrophobicContact CG1-CG 3.7Å; V83-F390 HydrophobicContact CG1-CD1 3.68Å; V83-F390 HydrophobicContact CG1-CE1 3.87Å; V83-F390 HydrophobicContact CG2-CD1 4.31Å; V83-Y393 HydrophobicContact CB-CG 4.29Å; V83-Y393 HydrophobicContact CG2-CD1 3.47Å; V83-Y393 VanDerWaalsContact CG2-CD1 3.47Å; V83-Y393 HydrophobicContact CG2-CD2 4.17Å; V83-Y393 HydrophobicContact CG2-CE1 3.9Å; V83-Y393 HydrophobicContact CG2-CG 3.61Å
84	F	87.5	Confident	84	Confident	11 Å²	11	67 Å²	67	5%	0.048	34%	0.343	C	S	.	.	H	α-helix	trans	-85.1	-22.6	-173.9	-76	-94.9	0	0	0	113	V47 L50 F51 V54 V80 L86 L386 L389 F390	V47-F84 HydrophobicContact CG1-CD1 3.59Å; V47-F84 HydrophobicContact CG1-CE1 4.25Å; V47-F84 WeakPolarHBondContact O-CE1 3.42Å; L50-F84 HydrophobicContact CB-CE1 3.95Å; L50-F84 HydrophobicContact CB-CZ 4.3Å; F51-F84 HydrophobicContact CB-CD1 3.69Å; F51-F84 HydrophobicContact CB-CE1 3.7Å; F51-F84 HydrophobicContact CB-CG 4.33Å; F51-F84 HydrophobicContact CB-CZ 4.31Å; F51-F84 HydrophobicContact CD2-CB 4.07Å; F51-F84 HydrophobicContact CD2-CD1 4.02Å; F51-F84 HydrophobicContact CD2-CD2 4Å; F51-F84 HydrophobicContact CD2-CE1 4.48Å; F51-F84 HydrophobicContact CD2-CE2 4.44Å; F51-F84 AromaticContact CD2-CG 3.77Å; F51-F84 HydrophobicContact CD2-CG 3.77Å; F51-F84 HydrophobicContact CG-CD1 4.35Å; F51-F84 VanDerWaalsContact N-CE1 3.35Å; V54-F84 HydrophobicContact CB-CE2 4.35Å; V54-F84 HydrophobicContact CB-CZ 4.36Å; V54-F84 HydrophobicContact CG1-CE2 4.45Å; V54-F84 HydrophobicContact CG2-CE2 4.05Å; V54-F84 HydrophobicContact CG2-CZ 3.84Å; V80-F84 HydrophobicContact CG1-CD2 3.73Å; V80-F84 HydrophobicContact CG1-CE2 4.02Å; V80-F84 WeakPolarHBondContact O-CD2 3.41Å; V80-F84 PolarHBondContact O-N 3.4Å; V80-F84 VanDerWaalsContact O-N 3.09Å; F84-L86 HydrophobicContact CB-CD1 4.08Å; F84-L86 HydrophobicContact CB-CG 4.01Å; F84-L86 PolarHBondContact O-N 3.4Å; F84-L86 VanDerWaalsContact O-N 3.15Å; F84-L386 HydrophobicContact CZ-CD2 4.36Å; F84-L389 HydrophobicContact CD1-CD2 3.96Å; F84-L389 HydrophobicContact CD2-CD2 4.38Å; F84-L389 HydrophobicContact CE1-CD2 3.56Å; F84-L389 HydrophobicContact CE2-CD2 4.04Å; F84-L389 HydrophobicContact CG-CD2 4.36Å; F84-L389 HydrophobicContact CZ-CD2 3.61Å; F84-F390 HydrophobicContact CE2-CE1 4.33Å
85	D	83.6	Confident	84.3	Confident	139 Å²	139	63.9 Å²	63.9	74%	0.743	32%	0.324	S	S	*	.			trans	47	43.5	176.3	-163.6	27.7	0	0	0	113.4	K81	K81-D85 WeakPolarHBondContact O-CA 3.29Å; K81-D85 PolarHBondContact O-N 2.85Å
86	L	83.4	Confident	84.3	Confident	37 Å²	37	66.4 Å²	66.4	19%	0.194	33%	0.333	C	S	.	.			trans	-86.2	141.3	-176.7	-66	171.8	0	0	0	111.3	V47 F51 F84 T88 L94	V47-L86 HydrophobicContact CG1-CD2 4.2Å; F51-L86 HydrophobicContact CB-CD1 4.05Å; F51-L86 HydrophobicContact CD1-CD1 4.26Å; F51-L86 HydrophobicContact CD2-CD1 3.82Å; F51-L86 HydrophobicContact CE2-CD1 4.32Å; F51-L86 HydrophobicContact CG-CD1 3.77Å; F84-L86 HydrophobicContact CB-CD1 4.08Å; F84-L86 HydrophobicContact CB-CG 4.01Å; F84-L86 PolarHBondContact O-N 3.4Å; F84-L86 VanDerWaalsContact O-N 3.15Å; L86-T88 PolarHBondContact O-N 3.26Å; L86-L94 HydrophobicContact CD1-CD1 4Å
87	P	80.6	Confident	84.2	Confident	83 Å²	83	70.3 Å²	70.3	54%	0.539	35%	0.352	S	S	.	.			trans	-55	135.5	170.6	-24.5	33.5	0	0	0	111.4	K89 I90 Y91	P87-K89 PolarHBondContact O-N 3.39Å; P87-I90 HydrophobicContact CB-CD1 4.38Å; P87-I90 HydrophobicContact CG-CD1 4.12Å; P87-I90 WeakPolarHBondContact O-CA 3.44Å; P87-I90 PolarHBondContact O-N 2.97Å; P87-Y91 PolarHBondContact O-N 2.76Å
88	T	81	Confident	84.2	Confident	107 Å²	107	69.1 Å²	69.1	66%	0.656	35%	0.345	S	S	*	.	H	α-helix	trans	-49.5	-39.7	-170.9	-45.3	0	0	0	0	113.9	L86 Y91 D92	L86-T88 PolarHBondContact O-N 3.26Å; T88-Y91 WeakPolarHBondContact O-CB 3.48Å; T88-Y91 PolarHBondContact O-N 3.48Å; T88-D92 VanDerWaalsContact O-CG 3.32Å; T88-D92 PolarHBondContact O-N 2.91Å
89	K	81.7	Confident	83.9	Confident	162 Å²	162	65.2 Å²	65.2	70%	0.704	34%	0.335	S	S	*	.	H	α-helix	trans	-63.1	-44.4	178.3	-169	-179.5	178.5	-174.5	0	112.6	P87 D93	P87-K89 PolarHBondContact O-N 3.39Å; K89-D93 VanDerWaalsContact O-CG 3.26Å; K89-D93 PolarHBondContact O-N 3.26Å; K89-D93 VanDerWaalsContact O-N 3.14Å
90	I	82.5	Confident	83.4	Confident	82 Å²	82	71.8 Å²	71.8	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-69.1	-39.6	177.6	-61.5	176.3	0	0	0	109.8	P87 D92 D93 L94	P87-I90 HydrophobicContact CB-CD1 4.38Å; P87-I90 HydrophobicContact CG-CD1 4.12Å; P87-I90 WeakPolarHBondContact O-CA 3.44Å; P87-I90 PolarHBondContact O-N 2.97Å; I90-D92 VanDerWaalsContact C-N 3.35Å; I90-D92 PolarHBondContact O-N 2.9Å; I90-D93 PolarHBondContact O-N 3.38Å; I90-L94 HydrophobicContact CG2-CD1 3.73Å; I90-L94 HydrophobicContact CG2-CG 4.16Å; I90-L94 WeakPolarHBondContact O-CB 3.32Å; I90-L94 WeakPolarHBondContact O-CG 3.46Å; I90-L94 PolarHBondContact O-N 2.62Å
91	Y	84.1	Confident	82.8	Confident	6 Å²	6	73 Å²	73	2%	0.024	38%	0.376	C	S	.	.	H	α-helix	trans	-55.8	-48.9	175.5	-176.1	-83.5	0	0	0	111.7	F51 Q55 D77 K81 P87 T88 R95	F51-Y91 HydrophobicContact CE1-CD2 4.5Å; F51-Y91 AromaticContact CE2-CD2 3.57Å; F51-Y91 HydrophobicContact CE2-CD2 3.57Å; F51-Y91 AromaticContact CE2-CE2 3.27Å; F51-Y91 HydrophobicContact CE2-CE2 3.27Å; F51-Y91 HydrophobicContact CZ-CD1 4.37Å; F51-Y91 AromaticContact CZ-CD2 3.45Å; F51-Y91 HydrophobicContact CZ-CD2 3.45Å; F51-Y91 VanDerWaalsContact CZ-CD2 3.45Å; F51-Y91 HydrophobicContact CZ-CE1 4.25Å; F51-Y91 AromaticContact CZ-CE2 3.31Å; F51-Y91 HydrophobicContact CZ-CE2 3.31Å; F51-Y91 AromaticContact CZ-CG 3.98Å; F51-Y91 HydrophobicContact CZ-CG 3.98Å; F51-Y91 AromaticContact CZ-CZ 3.71Å; Q55-Y91 PolarHBondContact NE2-OH 3.15Å; D77-Y91 PolarHBondContact OD1-OH 2.68Å; K81-Y91 HydrophobicContact CB-CE2 4.23Å; K81-Y91 HydrophobicContact CD-CE1 4.49Å; K81-Y91 HydrophobicContact CD-CE2 4.29Å; K81-Y91 VanDerWaalsContact CE-CE1 3.43Å; K81-Y91 VanDerWaalsContact CE-CZ 3.41Å; K81-Y91 HydrophobicContact CG-CD2 4Å; K81-Y91 HydrophobicContact CG-CE1 4.21Å; K81-Y91 HydrophobicContact CG-CE2 3.22Å; K81-Y91 WeakPolarHBondContact CG-OH 3.49Å; P87-Y91 PolarHBondContact O-N 2.76Å; T88-Y91 WeakPolarHBondContact O-CB 3.48Å; T88-Y91 PolarHBondContact O-N 3.48Å; Y91-R95 WeakPolarHBondContact O-CB 3.2Å; Y91-R95 PolarHBondContact O-N 2.95Å
92	D	83.7	Confident	82.3	Confident	80 Å²	80	76.6 Å²	76.6	43%	0.428	39%	0.394	S	S	.	.	H	α-helix	trans	-68.2	-41.6	-178.7	-67.6	-27.9	0	0	0	112	T88 I90 R95 M96	T88-D92 VanDerWaalsContact O-CG 3.32Å; T88-D92 PolarHBondContact O-N 2.91Å; I90-D92 VanDerWaalsContact C-N 3.35Å; I90-D92 PolarHBondContact O-N 2.9Å; D92-R95 PolarHBondContact O-N 2.88Å; D92-M96 WeakPolarHBondContact O-CB 3.41Å; D92-M96 VanDerWaalsContact O-CG 3.31Å; D92-M96 WeakPolarHBondContact O-CG 3.3Å; D92-M96 PolarHBondContact O-N 3.49Å
93	D	83.5	Confident	81.5	Confident	100 Å²	100	77.1 Å²	77.1	54%	0.535	40%	0.402	S	S	.	.	H	α-helix	trans	-61.6	-48.5	178	-71.8	-21.4	0	0	0	111.4	K89 I90 M96 E97	K89-D93 VanDerWaalsContact O-CG 3.26Å; K89-D93 PolarHBondContact O-N 3.26Å; K89-D93 VanDerWaalsContact O-N 3.14Å; I90-D93 PolarHBondContact O-N 3.38Å; D93-M96 WeakPolarHBondContact O-CB 3.41Å; D93-M96 PolarHBondContact O-N 3.45Å; D93-E97 PolarHBondContact O-N 3.24Å
94	L	85.6	Confident	80.8	Confident	28 Å²	28	77.8 Å²	77.8	15%	0.147	41%	0.406	C	S	.	.	H	α-helix	trans	-69.4	-33.2	178.5	-64.9	174.4	0	0	0	112.4	F51 V52 L86 I90 M96 E97 A98	F51-L94 HydrophobicContact CB-CD1 4.49Å; F51-L94 HydrophobicContact CD1-CB 3.48Å; F51-L94 VanDerWaalsContact CD1-CB 3.48Å; F51-L94 HydrophobicContact CD1-CD1 3.9Å; F51-L94 HydrophobicContact CD1-CG 4.36Å; F51-L94 HydrophobicContact CE1-CB 3.65Å; F51-L94 HydrophobicContact CG-CD1 4.45Å; V52-L94 HydrophobicContact CG2-CB 3.99Å; V52-L94 HydrophobicContact CG2-CD2 3.87Å; V52-L94 HydrophobicContact CG2-CG 4.46Å; L86-L94 HydrophobicContact CD1-CD1 4Å; I90-L94 HydrophobicContact CG2-CD1 3.73Å; I90-L94 HydrophobicContact CG2-CG 4.16Å; I90-L94 WeakPolarHBondContact O-CB 3.32Å; I90-L94 WeakPolarHBondContact O-CG 3.46Å; I90-L94 PolarHBondContact O-N 2.62Å; L94-M96 VanDerWaalsContact C-N 3.33Å; L94-E97 WeakPolarHBondContact O-CB 3.28Å; L94-E97 PolarHBondContact O-N 2.78Å; L94-A98 PolarHBondContact O-N 2.88Å
95	R	83.4	Confident	80.2	Confident	91 Å²	91	81 Å²	81	34%	0.343	43%	0.427	S	S	.	.	H	α-helix	trans	-66.2	-39.3	174.6	-178.6	178.7	-179.4	156.4	9.9	110.9	F51 D77 Y91 D92 A98 C99	F51-R95 HydrophobicContact CE1-CB 4.3Å; D77-R95 IonicContact OD1-CZ 2.63Å; D77-R95 IonicContact OD1-NH1 3.72Å; D77-R95 PolarHBondContact OD1-NH1 3.06Å; D77-R95 IonicContact OD1-NH2 3.04Å; D77-R95 IonicContact OD2-NH1 2.98Å; Y91-R95 WeakPolarHBondContact O-CB 3.2Å; Y91-R95 PolarHBondContact O-N 2.95Å; D92-R95 PolarHBondContact O-N 2.88Å; R95-A98 PolarHBondContact O-N 3.47Å; R95-C99 WeakPolarHBondContact O-CB 3.48Å; R95-C99 PolarHBondContact O-N 3.39Å; R95-C99 PolarHBondContact O-SG 3.23Å
96	M	81.9	Confident	79.9	Confident	110 Å²	110	74.9 Å²	74.9	54%	0.542	39%	0.394	S	S	.	.	H	α-helix	trans	-63.8	-40.7	174	-78.6	-62.2	-58.2	0	0	111.6	D92 D93 L94 C99 Q100	D92-M96 WeakPolarHBondContact O-CB 3.41Å; D92-M96 VanDerWaalsContact O-CG 3.31Å; D92-M96 WeakPolarHBondContact O-CG 3.3Å; D92-M96 PolarHBondContact O-N 3.49Å; D93-M96 WeakPolarHBondContact O-CB 3.41Å; D93-M96 PolarHBondContact O-N 3.45Å; L94-M96 VanDerWaalsContact C-N 3.33Å; M96-C99 WeakPolarHBondContact O-CB 3.33Å; M96-C99 PolarHBondContact O-N 2.85Å; M96-Q100 WeakPolarHBondContact O-CG 3.21Å; M96-Q100 PolarHBondContact O-N 3.42Å
97	E	83.1	Confident	79.9	Confident	90 Å²	90	73.1 Å²	73.1	42%	0.421	39%	0.385	S	S	.	.	H	α-helix	trans	-58.4	-50.1	173.8	-175.2	179.1	168.9	0	0	111.7	V52 D93 L94 C99 Q100 A101	V52-E97 HydrophobicContact CG1-CG 4.48Å; D93-E97 PolarHBondContact O-N 3.24Å; L94-E97 WeakPolarHBondContact O-CB 3.28Å; L94-E97 PolarHBondContact O-N 2.78Å; E97-C99 PolarHBondContact O-N 3.43Å; E97-Q100 PolarHBondContact O-N 2.98Å; E97-Q100 VanDerWaalsContact O-N 3.11Å; E97-A101 PolarHBondContact O-N 2.82Å
98	A	81.5	Confident	80.1	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-60.4	-34.5	175.8	0	0	0	0	0	112.5	V52 Q55 L94 R95 Q100 A101	V52-A98 HydrophobicContact CG1-CB 4.09Å; Q55-A98 HydrophobicContact CB-CB 3.45Å; Q55-A98 VanDerWaalsContact CB-CB 3.45Å; L94-A98 PolarHBondContact O-N 2.88Å; R95-A98 PolarHBondContact O-N 3.47Å; A98-Q100 VanDerWaalsContact C-N 3.35Å; A98-A101 PolarHBondContact O-N 3.3Å
99	C	77.2	Confident	80.3	Confident	55 Å²	55	65.5 Å²	65.5	37%	0.372	34%	0.336	S	S	.	.	H	α-helix	trans	-72.8	-23.7	178.2	-76.9	0	0	0	0	113.6	K59 R95 M96 E97	K59-C99 PolarHBondContact NZ-O 3.38Å; R95-C99 WeakPolarHBondContact O-CB 3.48Å; R95-C99 PolarHBondContact O-N 3.39Å; R95-C99 PolarHBondContact O-SG 3.23Å; M96-C99 WeakPolarHBondContact O-CB 3.33Å; M96-C99 PolarHBondContact O-N 2.85Å; E97-C99 PolarHBondContact O-N 3.43Å
100	Q	78.6	Confident	80.7	Confident	151 Å²	151	57.8 Å²	57.8	71%	0.706	30%	0.303	S	S	*	.	H	α-helix	trans	-85.1	-15.8	176.8	-71.4	176.6	9	0	0	113.4	M96 E97 A98	M96-Q100 WeakPolarHBondContact O-CG 3.21Å; M96-Q100 PolarHBondContact O-N 3.42Å; E97-Q100 PolarHBondContact O-N 2.98Å; E97-Q100 VanDerWaalsContact O-N 3.11Å; A98-Q100 VanDerWaalsContact C-N 3.35Å
101	A	75.9	Confident	81.1	Confident	27 Å²	27	55.6 Å²	55.6	22%	0.223	29%	0.294	C	S	.	.	S	Bend	trans	-65.9	138.8	177.1	0	0	0	0	0	112.1	Y56 E97 A98	Y56-A101 HydrophobicContact CD2-CB 3.76Å; Y56-A101 HydrophobicContact CE2-CB 3.8Å; E97-A101 PolarHBondContact O-N 2.82Å; A98-A101 PolarHBondContact O-N 3.3Å
102	E	73.6	Confident	81.6	Confident	160 Å²	160	55.3 Å²	55.3	75%	0.748	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-64.1	136.5	178.7	-69.2	-179.2	171	0	0	110.8	Y56	Y56-E102 WeakPolarHBondContact CE2-O 3.09Å; Y56-E102 PolarHBondContact OH-O 3.28Å; Y56-E102 VanDerWaalsContact OH-O 3.05Å
103	P	71.4	Confident	82	Confident	89 Å²	89	53 Å²	53	58%	0.578	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-65.6	149.9	178.8	28.5	-34.1	0	0	0	110.8
104	P	74.2	Confident	82.6	Confident	25 Å²	25	51.2 Å²	51.2	16%	0.162	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-69.6	142.1	179.2	29.3	-30.9	0	0	0	110.3	Y56 N60 V106 V365	Y56-P104 VanDerWaalsContact OH-CD 3.28Å; Y56-P104 WeakPolarHBondContact OH-CD 3.17Å; N60-P104 HydrophobicContact CB-CG 4.01Å; P104-V106 PolarHBondContact O-N 3.46Å; P104-V365 HydrophobicContact CB-CB 4.46Å; P104-V365 HydrophobicContact CB-CG1 3.64Å; P104-V365 HydrophobicContact CB-CG2 3.94Å; P104-V365 HydrophobicContact CG-CG2 4.44Å
105	V	73.8	Confident	83.1	Confident	78 Å²	78	50 Å²	50	47%	0.473	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-71	119.5	170.5	178.8	0	0	0	0	107.7	V365 Q366	V105-V365 CarbonylContact O-C 3.45Å; V105-V365 WeakPolarHBondContact O-CA 3.36Å; V105-Q366 HydrophobicContact CB-CB 3.89Å; V105-Q366 HydrophobicContact CG1-CB 3.64Å; V105-Q366 HydrophobicContact CG1-CG 4.36Å; V105-Q366 PolarHBondContact O-N 3.13Å
106	V	77.8	Confident	83.6	Confident	11 Å²	11	48.6 Å²	48.6	7%	0.067	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.4	-177.9	-172.6	0	0	0	0	110.1	I62 P104 L263 I266 L363 S364	I62-V106 HydrophobicContact CG2-CG1 4.46Å; P104-V106 PolarHBondContact O-N 3.46Å; V106-L263 HydrophobicContact CB-CD1 4.35Å; V106-L263 HydrophobicContact CG1-CD1 4Å; V106-L263 WeakPolarHBondContact O-CB 3.48Å; V106-L263 PolarHBondContact O-N 3.47Å; V106-I266 HydrophobicContact CB-CD1 4Å; V106-I266 HydrophobicContact CB-CG1 4.36Å; V106-I266 HydrophobicContact CG1-CD1 4.13Å; V106-I266 HydrophobicContact CG2-CD1 3.69Å; V106-L363 HydrophobicContact CG1-CB 4.36Å; V106-L363 HydrophobicContact CG1-CD2 4.16Å; V106-S364 CarbonylContact C-O 3.39Å
107	V	82	Confident	84.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.9	-178.8	-175.1	0	0	0	0	108.2	R260 L261 E262 S364 Q366	V107-R260 HydrophobicContact CG1-CB 3.87Å; V107-R260 HydrophobicContact CG1-CG 3.92Å; V107-L261 CarbonylContact C-O 3.58Å; V107-L261 WeakPolarHBondContact CA-O 3.49Å; V107-L261 WeakPolarHBondContact CG1-O 3.5Å; V107-E262 HydrophobicContact CG2-CG 4.39Å; V107-S364 PolarHBondContact N-O 2.97Å; V107-S364 PolarHBondContact O-N 3.43Å; V107-Q366 VanDerWaalsContact CG2-CA 3.46Å; V107-Q366 HydrophobicContact CG2-CB 3.26Å; V107-Q366 HydrophobicContact CG2-CG 3.92Å; V107-Q366 VanDerWaalsContact CG2-OE1 3.28Å
108	L	85	Confident	84.5	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	117.2	165.5	-174.4	69.4	0	0	0	109.3	V110 I135 L261 L263 L271 I330 I333 L361 L363	L108-V110 HydrophobicContact CD2-CG2 3.57Å; L108-V110 HydrophobicContact CG-CG2 3.65Å; L108-I135 HydrophobicContact CD2-CD1 4.12Å; L108-L261 HydrophobicContact CB-CB 4.5Å; L108-L261 PolarHBondContact N-O 3.46Å; L108-L261 PolarHBondContact O-N 3.26Å; L108-L263 HydrophobicContact CB-CD1 4.26Å; L108-L263 HydrophobicContact CB-CD2 4.26Å; L108-L263 HydrophobicContact CB-CG 4.38Å; L108-L271 HydrophobicContact CD2-CB 3.93Å; L108-L271 HydrophobicContact CD2-CD1 4.14Å; L108-L271 HydrophobicContact CD2-CD2 3.92Å; L108-L271 HydrophobicContact CD2-CG 4.21Å; L108-I330 HydrophobicContact CD1-CD1 4.44Å; L108-I330 HydrophobicContact CD2-CD1 3.61Å; L108-I333 HydrophobicContact CD1-CD1 3.54Å; L108-L361 HydrophobicContact CD1-CB 4.35Å; L108-L363 HydrophobicContact CB-CD2 4.48Å; L108-L363 HydrophobicContact CD1-CD2 3.77Å; L108-L363 HydrophobicContact CD1-CG 4.49Å
109	N	86.1	Confident	84.8	Confident	30 Å²	30	46.6 Å²	46.6	16%	0.16	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	123.7	163.6	-51.7	-68.8	0	0	0	108	F259 R260 L361 S362 S364	N109-F259 CarbonylContact C-O 3.49Å; N109-F259 WeakPolarHBondContact CA-O 3.3Å; N109-R260 WeakPolarHBondContact OD1-CG 3.44Å; N109-R260 PolarHBondContact OD1-NE 3.17Å; N109-L361 WeakPolarHBondContact O-CA 3.42Å; N109-S362 WeakPolarHBondContact CB-OG 3.47Å; N109-S362 PolarHBondContact N-O 3.48Å; N109-S362 PolarHBondContact ND2-OG 3.2Å; N109-S362 PolarHBondContact O-N 3.24Å; N109-S364 WeakPolarHBondContact ND2-CB 2.86Å; N109-S364 PolarHBondContact ND2-OG 3.32Å
110	V	89.3	Confident	85.2	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	115.3	179.2	-175.7	0	0	0	0	108.2	L108 V112 L133 N258 F259 L261 L271 L361	L108-V110 HydrophobicContact CD2-CG2 3.57Å; L108-V110 HydrophobicContact CG-CG2 3.65Å; V110-V112 HydrophobicContact CG1-CG2 4.18Å; V110-L133 HydrophobicContact CB-CD1 3.98Å; V110-L133 HydrophobicContact CG1-CD1 3.75Å; V110-L133 HydrophobicContact CG2-CD1 4.32Å; V110-N258 CarbonylContact O-C 3.5Å; V110-N258 WeakPolarHBondContact O-CA 3.37Å; V110-F259 HydrophobicContact CB-CB 4.43Å; V110-F259 PolarHBondContact N-O 3.18Å; V110-F259 PolarHBondContact O-N 3.21Å; V110-L261 HydrophobicContact CG2-CD1 4.08Å; V110-L271 HydrophobicContact CG1-CD2 4.33Å; V110-L271 HydrophobicContact CG2-CD1 4.23Å; V110-L271 HydrophobicContact CG2-CD2 4.02Å; V110-L361 HydrophobicContact CB-CD2 4.14Å; V110-L361 HydrophobicContact CG1-CD2 3.71Å; V110-L361 HydrophobicContact CG2-CD2 3.97Å
111	S	91.8	Very high	85.4	Confident	35 Å²	35	39.2 Å²	39.2	25%	0.245	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	111.4	168.7	-63	0	0	0	0	108.5	I113 E257 N258 L359 A360	S111-I113 PolarHBondContact O-N 3.31Å; S111-E257 WeakPolarHBondContact CA-O 3.49Å; S111-N258 WeakPolarHBondContact CB-OD1 3.22Å; S111-N258 PolarHBondContact OG-OD1 3.28Å; S111-L359 WeakPolarHBondContact O-CA 3.41Å; S111-A360 PolarHBondContact N-O 3.09Å; S111-A360 PolarHBondContact O-N 3.34Å
112	V	93.6	Very high	85.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	102.2	171.8	-176.4	0	0	0	0	107.3	V110 L133 T244 W255 N256 E257 F259 L273 I357 L359	V110-V112 HydrophobicContact CG1-CG2 4.18Å; V112-L133 HydrophobicContact CG2-CD1 4.43Å; V112-T244 HydrophobicContact CB-CG2 4.28Å; V112-T244 HydrophobicContact CG1-CG2 4.16Å; V112-T244 HydrophobicContact CG2-CG2 4.39Å; V112-W255 HydrophobicContact CG1-CB 4.34Å; V112-W255 HydrophobicContact CG1-CD2 4.12Å; V112-W255 HydrophobicContact CG1-CE3 3.67Å; V112-W255 HydrophobicContact CG1-CG 4.43Å; V112-W255 HydrophobicContact CG1-CZ3 4.23Å; V112-N256 WeakPolarHBondContact O-CA 3.32Å; V112-N256 PolarHBondContact O-N 2.92Å; V112-E257 PolarHBondContact N-O 3.44Å; V112-E257 PolarHBondContact O-N 3.05Å; V112-F259 HydrophobicContact CB-CE2 4.24Å; V112-F259 HydrophobicContact CG2-CD2 3.9Å; V112-F259 HydrophobicContact CG2-CE2 3.74Å; V112-L273 HydrophobicContact CG2-CD1 4.06Å; V112-I357 HydrophobicContact CG1-CD1 4.23Å; V112-L359 HydrophobicContact CB-CD2 4.26Å; V112-L359 HydrophobicContact CG1-CD2 4.23Å; V112-L359 HydrophobicContact CG2-CD2 3.98Å
113	I	93.2	Very high	85.5	Confident	31 Å²	31	33.1 Å²	33.1	16%	0.159	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-68.3	-171.4	-57.5	173	0	0	0	108.8	S111 W255 N256 H358 A360	S111-I113 PolarHBondContact O-N 3.31Å; I113-W255 PolarHBondContact O-N 3.47Å; I113-N256 WeakPolarHBondContact CG2-OD1 3.47Å; I113-N256 PolarHBondContact O-N 3.18Å; I113-N256 VanDerWaalsContact O-N 3.12Å; I113-H358 HydrophobicContact CB-CB 4.33Å; I113-H358 PolarHBondContact N-O 2.85Å; I113-H358 VanDerWaalsContact N-O 3.16Å; I113-A360 HydrophobicContact CD1-CB 3.92Å
114	E	95.9	Very high	85.7	Confident	64 Å²	64	31.9 Å²	31.9	30%	0.299	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	164.5	-175.8	59.6	179.5	-158.6	0	0	112.6	P253 V254 W341 I357 H358	E114-P253 CarbonylContact C-O 3.52Å; E114-P253 WeakPolarHBondContact CA-O 3.15Å; E114-P253 WeakPolarHBondContact CB-O 3.38Å; E114-V254 HydrophobicContact CB-CB 4.33Å; E114-V254 HydrophobicContact CB-CG1 4.39Å; E114-V254 HydrophobicContact CB-CG2 3.94Å; E114-W341 HydrophobicContact CG-CH2 3.69Å; E114-W341 HydrophobicContact CG-CZ2 4.05Å; E114-W341 WeakPolarHBondContact OE1-CH2 3.33Å; E114-W341 WeakPolarHBondContact OE1-CZ2 3.09Å; E114-I357 WeakPolarHBondContact O-CG1 3.36Å; E114-H358 HydrophobicContact CG-CB 3.87Å; E114-H358 WeakPolarHBondContact O-CB 3.25Å; E114-H358 PolarHBondContact O-N 2.88Å
115	A	94.9	Very high	86	Confident	2 Å²	2	32.2 Å²	32.2	2%	0.017	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	160.4	167	0	0	0	0	0	110.3	L118 N252 P253 W255 I275 E356 I357	A115-L118 HydrophobicContact CB-CD1 4.29Å; A115-L118 HydrophobicContact CB-CD2 4.2Å; A115-L118 HydrophobicContact CB-CG 4.36Å; A115-N252 CarbonylContact O-C 3.45Å; A115-N252 VanDerWaalsContact O-C 3.28Å; A115-N252 WeakPolarHBondContact O-CA 3.2Å; A115-P253 HydrophobicContact CB-CG 3.97Å; A115-P253 PolarHBondContact N-O 3.25Å; A115-P253 WeakPolarHBondContact O-CD 3.19Å; A115-W255 HydrophobicContact CB-CH2 3.98Å; A115-W255 HydrophobicContact CB-CZ3 3.72Å; A115-I275 HydrophobicContact CB-CD1 4.4Å; A115-E356 CarbonylContact C-O 3.57Å; A115-E356 VanDerWaalsContact CA-O 3.25Å; A115-E356 WeakPolarHBondContact CA-O 3.5Å; A115-E356 WeakPolarHBondContact CB-O 3.37Å; A115-I357 HydrophobicContact CB-CB 4.24Å; A115-I357 HydrophobicContact CB-CG1 4.21Å
116	K	94.3	Very high	86.6	Confident	62 Å²	62	32.8 Å²	32.8	27%	0.27	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	152.7	179	72	-171.1	175.8	-159.3	0	112.5	L118 N252 W341 G355 E356	K116-L118 VanDerWaalsContact C-N 3.31Å; K116-L118 PolarHBondContact O-N 2.85Å; K116-N252 WeakPolarHBondContact CA-OD1 3.28Å; K116-N252 WeakPolarHBondContact CB-OD1 3.38Å; K116-W341 HydrophobicContact CB-CH2 4.26Å; K116-W341 HydrophobicContact CB-CZ3 4.12Å; K116-W341 HydrophobicContact CD-CE3 4.05Å; K116-W341 HydrophobicContact CD-CH2 3.63Å; K116-W341 HydrophobicContact CD-CZ2 4.29Å; K116-W341 HydrophobicContact CD-CZ3 3.5Å; K116-W341 HydrophobicContact CG-CE3 4.3Å; K116-W341 HydrophobicContact CG-CH2 4.01Å; K116-W341 HydrophobicContact CG-CZ3 3.57Å; K116-G355 WeakPolarHBondContact O-CA 3.49Å; K116-E356 WeakPolarHBondContact CE-OE2 3.36Å; K116-E356 HydrophobicContact CG-CB 4.43Å; K116-E356 PolarHBondContact N-O 3.22Å; K116-E356 IonicContact NZ-OE2 3.48Å; K116-E356 PolarHBondContact NZ-OE2 2.98Å; K116-E356 PolarHBondContact O-N 3.38Å
117	N	93.1	Very high	87.2	Confident	102 Å²	102	32.2 Å²	32.2	55%	0.545	17%	0.171	S	C	.	.	S	Bend	trans	57.3	37.4	176.2	-57.6	-44.4	0	0	0	114.2	L251 N252 Q354 G355	N117-L251 PolarHBondContact N-O 3.41Å; N117-N252 PolarHBondContact N-OD1 3.32Å; N117-Q354 CarbonylContact O-C 3.45Å; N117-G355 WeakPolarHBondContact O-CA 3.14Å; N117-G355 PolarHBondContact O-N 3.27Å
118	L	92.3	Very high	87.6	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-62.7	157.7	175.2	-61.2	-179.1	0	0	0	111.5	A115 K116 A120 P129 L251 P253 I275 L323 L344 Q354	A115-L118 HydrophobicContact CB-CD1 4.29Å; A115-L118 HydrophobicContact CB-CD2 4.2Å; A115-L118 HydrophobicContact CB-CG 4.36Å; K116-L118 VanDerWaalsContact C-N 3.31Å; K116-L118 PolarHBondContact O-N 2.85Å; L118-A120 PolarHBondContact O-N 3.49Å; L118-P129 HydrophobicContact CD1-CB 3.7Å; L118-P129 HydrophobicContact CD1-CG 3.99Å; L118-L251 HydrophobicContact CB-CB 4.49Å; L118-L251 PolarHBondContact N-O 3.4Å; L118-P253 HydrophobicContact CD1-CG 3.72Å; L118-I275 HydrophobicContact CD1-CG2 4.27Å; L118-I275 HydrophobicContact CD2-CD1 4.12Å; L118-L323 HydrophobicContact CD1-CD1 4.29Å; L118-L344 HydrophobicContact CD2-CD1 3.38Å; L118-Q354 PolarHBondContact O-NE2 3.38Å
119	E	86.8	Confident	87.9	Confident	55 Å²	55	33.2 Å²	33.2	26%	0.257	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-76.8	121.9	173.9	-163.2	-173.8	175.2	0	0	109.9	K121 S127 L323 K352 Q354	E119-K121 IonicContact OE1-NZ 2.68Å; E119-K121 PolarHBondContact OE1-NZ 3.49Å; E119-K121 WeakPolarHBondContact OE2-CE 3.42Å; E119-K121 IonicContact OE2-NZ 3.03Å; E119-K121 PolarHBondContact OE2-NZ 3.49Å; E119-S127 PolarHBondContact O-OG 2.98Å; E119-L323 WeakPolarHBondContact O-CD2 3.49Å; E119-K352 VanDerWaalsContact OE2-O 3.13Å; E119-Q354 HydrophobicContact CB-CG 3.88Å; E119-Q354 HydrophobicContact CG-CG 4.45Å
120	A	85.6	Confident	88.2	Confident	9 Å²	9	33.5 Å²	33.5	7%	0.074	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-66.8	137.3	173.2	0	0	0	0	0	111.1	L118 G125 F126 S127 L251 R302	L118-A120 PolarHBondContact O-N 3.49Å; A120-G125 WeakPolarHBondContact CB-O 3.44Å; A120-F126 CarbonylContact C-O 3.47Å; A120-F126 WeakPolarHBondContact CA-O 3.4Å; A120-F126 WeakPolarHBondContact CB-O 3.24Å; A120-S127 WeakPolarHBondContact CA-OG 3.4Å; A120-L251 HydrophobicContact CB-CD1 3.99Å; A120-L251 HydrophobicContact CB-CD2 3.61Å; A120-L251 HydrophobicContact CB-CG 4.37Å; A120-R302 VanDerWaalsContact C-CZ 3.5Å; A120-R302 VanDerWaalsContact C-NH2 3.34Å; A120-R302 VanDerWaalsContact CB-NH2 3.32Å; A120-R302 PolarHBondContact O-NH1 3.35Å; A120-R302 PolarHBondContact O-NH2 3.48Å
121	K	83.4	Confident	88.2	Confident	42 Å²	42	33.4 Å²	33.4	18%	0.183	18%	0.175	C	C	.	.			trans	-120.1	-23.6	172.8	-47.2	-82	179.4	-175.9	0	114.4	E119 F126 S127 D277 R302 D321 L323	E119-K121 IonicContact OE1-NZ 2.68Å; E119-K121 PolarHBondContact OE1-NZ 3.49Å; E119-K121 WeakPolarHBondContact OE2-CE 3.42Å; E119-K121 IonicContact OE2-NZ 3.03Å; E119-K121 PolarHBondContact OE2-NZ 3.49Å; K121-F126 PolarHBondContact N-O 3.32Å; K121-S127 PolarHBondContact N-OG 3.01Å; K121-D277 WeakPolarHBondContact CB-OD2 3.42Å; K121-D277 HydrophobicContact CG-CB 4.3Å; K121-D277 VanDerWaalsContact CG-OD2 3.26Å; K121-D277 WeakPolarHBondContact CG-OD2 3.4Å; K121-R302 VanDerWaalsContact O-CD 3.28Å; K121-R302 WeakPolarHBondContact O-CD 3.37Å; K121-R302 WeakPolarHBondContact O-CG 3.07Å; K121-D321 HydrophobicContact CB-CB 4.23Å; K121-D321 WeakPolarHBondContact CB-OD2 3.46Å; K121-D321 HydrophobicContact CD-CB 4.22Å; K121-D321 HydrophobicContact CG-CB 3.86Å; K121-L323 HydrophobicContact CD-CD2 4.37Å; K121-L323 HydrophobicContact CG-CD2 3.68Å
122	D	78.9	Confident	88.1	Confident	21 Å²	21	33.5 Å²	33.5	11%	0.112	17%	0.172	C	C	.	.	S	Bend	trans	-76.9	160	-177.1	-63.9	-31.4	0	0	0	114.6	N124 G125 F126 S127 R302	D122-N124 WeakPolarHBondContact CB-OD1 3.48Å; D122-N124 PolarHBondContact O-N 3.06Å; D122-G125 PolarHBondContact O-N 3.35Å; D122-G125 VanDerWaalsContact O-N 3.08Å; D122-F126 WeakPolarHBondContact CB-O 3.23Å; D122-F126 PolarHBondContact N-O 3.21Å; D122-S127 VanDerWaalsContact OD2-CA 3.24Å; D122-S127 WeakPolarHBondContact OD2-CA 3.31Å; D122-R302 WeakPolarHBondContact O-CD 3.38Å; D122-R302 PolarHBondContact O-NH1 3.47Å
123	L	73.1	Confident	87.8	Confident	39 Å²	39	33.5 Å²	33.5	20%	0.204	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.4	178.5	-57.1	-171.6	0	0	0	113.7	G125 R302 Y303 Q306	L123-G125 PolarHBondContact O-N 3.21Å; L123-R302 HydrophobicContact CD2-CB 3.63Å; L123-Y303 HydrophobicContact CD1-CD2 4.03Å; L123-Q306 VanDerWaalsContact CG-OE1 3.27Å
124	N	74.5	Confident	87.5	Confident	63 Å²	63	32.2 Å²	32.2	34%	0.337	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-8.5	-180	62.3	13.3	0	0	0	112.8	D122 F126 Q249	D122-N124 WeakPolarHBondContact CB-OD1 3.48Å; D122-N124 PolarHBondContact O-N 3.06Å; N124-F126 HydrophobicContact CB-CD2 4.39Å; N124-F126 WeakPolarHBondContact OD1-CA 3.39Å; N124-F126 WeakPolarHBondContact OD1-CB 3.25Å; N124-F126 PolarHBondContact OD1-N 3.44Å; N124-Q249 WeakPolarHBondContact ND2-CG 3.38Å
125	G	80.7	Confident	86.8	Confident	31 Å²	31	29.2 Å²	29.2	32%	0.32	15%	0.152	S	C	.	.	S	Bend	trans	87.3	10.1	-176.5	0	0	0	0	0	114.3	A120 D122 L123	A120-G125 WeakPolarHBondContact CB-O 3.44Å; D122-G125 PolarHBondContact O-N 3.35Å; D122-G125 VanDerWaalsContact O-N 3.08Å; L123-G125 PolarHBondContact O-N 3.21Å
126	F	87.2	Confident	86	Confident	90 Å²	90	31 Å²	31	40%	0.395	16%	0.161	S	C	.	.			trans	-117.7	-164.5	175.5	-63.4	-85.5	0	0	0	110.7	A120 K121 D122 N124 Q249 L251	A120-F126 CarbonylContact C-O 3.47Å; A120-F126 WeakPolarHBondContact CA-O 3.4Å; A120-F126 WeakPolarHBondContact CB-O 3.24Å; K121-F126 PolarHBondContact N-O 3.32Å; D122-F126 WeakPolarHBondContact CB-O 3.23Å; D122-F126 PolarHBondContact N-O 3.21Å; N124-F126 HydrophobicContact CB-CD2 4.39Å; N124-F126 WeakPolarHBondContact OD1-CA 3.39Å; N124-F126 WeakPolarHBondContact OD1-CB 3.25Å; N124-F126 PolarHBondContact OD1-N 3.44Å; F126-Q249 HydrophobicContact CB-CB 4.27Å; F126-Q249 WeakPolarHBondContact CD1-O 3.15Å; F126-Q249 HydrophobicContact CG-CB 4.45Å; F126-L251 HydrophobicContact CD1-CG 4.17Å
127	S	89.1	Confident	84.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.			trans	-144.6	160.3	171.5	-77.9	0	0	0	0	107.5	E119 A120 K121 D122 P129 Q249 T250 D277	E119-S127 PolarHBondContact O-OG 2.98Å; A120-S127 WeakPolarHBondContact CA-OG 3.4Å; K121-S127 PolarHBondContact N-OG 3.01Å; D122-S127 VanDerWaalsContact OD2-CA 3.24Å; D122-S127 WeakPolarHBondContact OD2-CA 3.31Å; S127-P129 WeakPolarHBondContact O-CD 3.29Å; S127-Q249 CarbonylContact O-C 3.56Å; S127-Q249 WeakPolarHBondContact O-CA 3.41Å; S127-Q249 PolarHBondContact O-N 3.22Å; S127-T250 PolarHBondContact O-N 3.48Å; S127-T250 VanDerWaalsContact O-O 3.12Å; S127-D277 WeakPolarHBondContact CA-OD1 3.4Å; S127-D277 WeakPolarHBondContact CA-OD2 3.25Å; S127-D277 VanDerWaalsContact CB-CG 3.44Å; S127-D277 WeakPolarHBondContact CB-OD1 3.24Å; S127-D277 WeakPolarHBondContact CB-OD2 3.26Å; S127-D277 PolarHBondContact OG-OD2 2.94Å
128	D	89.9	Confident	83.4	Confident	21 Å²	21	24.8 Å²	24.8	11%	0.112	13%	0.134	C	C	.	.			trans	-106.5	68.3	172.1	-63	-20.6	0	0	0	110.1	V246 K247 E248 Q249 D277 H278	D128-V246 HydrophobicContact CB-CG1 3.97Å; D128-K247 CarbonylContact C-O 3.56Å; D128-K247 WeakPolarHBondContact CA-O 3.16Å; D128-E248 WeakPolarHBondContact OD1-CA 3.46Å; D128-Q249 PolarHBondContact OD1-N 3.47Å; D128-D277 WeakPolarHBondContact CA-OD1 3.39Å; D128-D277 PolarHBondContact N-OD1 3.23Å; D128-H278 HydrophobicContact CB-CB 4.11Å; D128-H278 PolarHBondContact O-N 3Å
129	P	92.2	Very high	81.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	140.3	-170.1	27.2	-39.9	0	0	0	114.9	L118 S127 K247 T250 P253 W255 I275 W276 L323	L118-P129 HydrophobicContact CD1-CB 3.7Å; L118-P129 HydrophobicContact CD1-CG 3.99Å; S127-P129 WeakPolarHBondContact O-CD 3.29Å; P129-K247 WeakPolarHBondContact CD-O 3.24Å; P129-K247 PolarHBondContact O-N 3.17Å; P129-T250 VanDerWaalsContact CD-O 3.27Å; P129-T250 WeakPolarHBondContact CD-O 3.21Å; P129-T250 HydrophobicContact CG-CG2 3.96Å; P129-T250 WeakPolarHBondContact CG-O 3.04Å; P129-P253 HydrophobicContact CB-CB 4.47Å; P129-P253 HydrophobicContact CB-CG 4.04Å; P129-P253 HydrophobicContact CG-CB 3.65Å; P129-P253 HydrophobicContact CG-CG 3.53Å; P129-W255 HydrophobicContact CB-CZ2 4.12Å; P129-I275 HydrophobicContact CB-CG2 4.14Å; P129-W276 CarbonylContact C-O 3.58Å; P129-W276 WeakPolarHBondContact CA-O 3.3Å; P129-L323 HydrophobicContact CB-CD1 3.89Å
130	Y	92.1	Very high	79.9	Confident	35 Å²	35	37.4 Å²	37.4	14%	0.137	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	154.7	163.3	72	-80.9	0	0	0	111.1	I132 V246 I275 W276 H278 D320	Y130-I132 HydrophobicContact CD2-CG1 4.09Å; Y130-I132 HydrophobicContact CE2-CD1 3.79Å; Y130-I132 HydrophobicContact CE2-CG1 3.64Å; Y130-V246 HydrophobicContact CD1-CG2 4.09Å; Y130-V246 HydrophobicContact CG-CG2 4.15Å; Y130-I275 CarbonylContact O-C 3.47Å; Y130-I275 WeakPolarHBondContact O-CA 3.3Å; Y130-W276 HydrophobicContact CD1-CB 3.91Å; Y130-W276 WeakPolarHBondContact CD1-O 3.3Å; Y130-W276 HydrophobicContact CE1-CB 3.38Å; Y130-W276 HydrophobicContact CE1-CG 4.42Å; Y130-W276 HydrophobicContact CE2-CB 4.07Å; Y130-W276 HydrophobicContact CE2-CG 4.42Å; Y130-W276 HydrophobicContact CG-CB 4.46Å; Y130-W276 VanDerWaalsContact CZ-CB 3.47Å; Y130-W276 PolarHBondContact N-O 3.34Å; Y130-W276 PolarHBondContact O-N 3.43Å; Y130-H278 HydrophobicContact CD1-CB 4.04Å; Y130-H278 HydrophobicContact CE1-CB 4.07Å; Y130-D320 HydrophobicContact CE1-CB 4.36Å; Y130-D320 WeakPolarHBondContact CE1-OD2 3.31Å; Y130-D320 VanDerWaalsContact CZ-OD2 3.24Å; Y130-D320 PolarHBondContact OH-OD2 3.47Å
131	C	90.7	Very high	78	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	145.3	178.5	-58	0	0	0	0	111.1	S243 T244 W255 L273 D274	C131-S243 CarbonylContact O-C 3.42Å; C131-S243 WeakPolarHBondContact O-CA 3.39Å; C131-T244 HydrophobicContact CB-CG2 3.77Å; C131-T244 PolarHBondContact N-OG1 2.84Å; C131-T244 PolarHBondContact O-N 3.46Å; C131-W255 WeakPolarHBondContact SG-CH2 3.5Å; C131-L273 HydrophobicContact CB-CD1 4.33Å; C131-L273 HydrophobicContact CB-CD2 4.11Å; C131-L273 HydrophobicContact CB-CG 4.22Å; C131-D274 CarbonylContact C-O 3.5Å; C131-D274 WeakPolarHBondContact CA-O 3.49Å
132	I	87.9	Confident	75.8	Confident	36 Å²	36	43 Å²	43	19%	0.185	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.1	165.1	-56.5	-179.8	0	0	0	107.3	Y130 M241 K242 L273 D274	Y130-I132 HydrophobicContact CD2-CG1 4.09Å; Y130-I132 HydrophobicContact CE2-CD1 3.79Å; Y130-I132 HydrophobicContact CE2-CG1 3.64Å; I132-M241 HydrophobicContact CG2-CB 3.96Å; I132-M241 HydrophobicContact CG2-CG 4.23Å; I132-M241 HydrophobicContact CG2-SD 3.79Å; I132-K242 CarbonylContact C-O 3.51Å; I132-K242 WeakPolarHBondContact CA-O 3.26Å; I132-L273 CarbonylContact O-C 3.52Å; I132-L273 WeakPolarHBondContact O-CA 3.48Å; I132-D274 PolarHBondContact N-O 3.39Å; I132-D274 PolarHBondContact O-N 3.4Å
133	L	89	Confident	73.6	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	148.2	-178.8	65	158.1	0	0	0	112.8	V110 V112 M241 K242 F259 L261 H272 L273	V110-L133 HydrophobicContact CB-CD1 3.98Å; V110-L133 HydrophobicContact CG1-CD1 3.75Å; V110-L133 HydrophobicContact CG2-CD1 4.32Å; V112-L133 HydrophobicContact CG2-CD1 4.43Å; L133-M241 WeakPolarHBondContact O-CA 3.38Å; L133-K242 HydrophobicContact CD2-CB 4.37Å; L133-K242 WeakPolarHBondContact CD2-O 3.45Å; L133-K242 PolarHBondContact N-O 2.95Å; L133-K242 PolarHBondContact O-N 2.79Å; L133-F259 HydrophobicContact CD1-CB 3.95Å; L133-F259 HydrophobicContact CD1-CD2 3.8Å; L133-F259 HydrophobicContact CD1-CG 3.91Å; L133-F259 HydrophobicContact CD2-CD1 4.21Å; L133-F259 HydrophobicContact CD2-CD2 3.86Å; L133-F259 HydrophobicContact CD2-CE1 4.2Å; L133-F259 HydrophobicContact CD2-CE2 3.86Å; L133-F259 HydrophobicContact CD2-CG 4.04Å; L133-F259 HydrophobicContact CD2-CZ 4.04Å; L133-F259 HydrophobicContact CG-CD2 4.43Å; L133-F259 HydrophobicContact CG-CG 4.41Å; L133-L261 HydrophobicContact CD1-CD1 4.18Å; L133-H272 WeakPolarHBondContact CA-O 3.31Å; L133-L273 HydrophobicContact CB-CB 3.99Å; L133-L273 HydrophobicContact CB-CD1 4.04Å; L133-L273 HydrophobicContact CB-CG 4Å
134	G	85.4	Confident	71.6	Confident	3 Å²	3	55 Å²	55	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	174.8	177.9	0	0	0	0	0	113.1	H272	G134-H272 PolarHBondContact N-O 3.45Å; G134-H272 PolarHBondContact O-N 3.34Å
135	I	81.6	Confident	69.4	Low	1 Å²	1	61.5 Å²	61.5	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.5	178	-57.5	-60.1	0	0	0	109.8	L108 F137 V236 L261 L263 D269 K270 L271 I330	L108-I135 HydrophobicContact CD2-CD1 4.12Å; I135-F137 HydrophobicContact CB-CE1 4.24Å; I135-F137 HydrophobicContact CB-CE2 4.49Å; I135-F137 HydrophobicContact CB-CZ 4.14Å; I135-F137 HydrophobicContact CG2-CD1 3.87Å; I135-F137 HydrophobicContact CG2-CE1 3.77Å; I135-F137 HydrophobicContact CG2-CG 4.38Å; I135-F137 HydrophobicContact CG2-CZ 4.16Å; I135-V236 WeakPolarHBondContact O-CG1 3.19Å; I135-L261 HydrophobicContact CD1-CB 3.98Å; I135-L261 HydrophobicContact CD1-CD1 3.85Å; I135-L261 HydrophobicContact CG1-CB 3.78Å; I135-L261 HydrophobicContact CG1-CD1 4.13Å; I135-L263 HydrophobicContact CD1-CD2 3.58Å; I135-L263 HydrophobicContact CG1-CD2 3.92Å; I135-L263 HydrophobicContact CG2-CD2 4.11Å; I135-D269 HydrophobicContact CG2-CB 3.93Å; I135-K270 WeakPolarHBondContact CA-O 3.47Å; I135-L271 HydrophobicContact CD1-CB 4.48Å; I135-L271 HydrophobicContact CD1-CD1 4.34Å; I135-I330 HydrophobicContact CD1-CD1 4.48Å
136	I	79.1	Confident	66.9	Low	40 Å²	40	68.7 Å²	68.7	21%	0.205	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	109	164.7	-58.5	168.6	0	0	0	106.9	G138 V141 V236 D269 K270 H272 T327	I136-G138 PolarHBondContact O-N 2.89Å; I136-V141 HydrophobicContact CG2-CG2 4.24Å; I136-V236 HydrophobicContact CB-CG2 4.31Å; I136-V236 HydrophobicContact CD1-CG2 4.49Å; I136-V236 HydrophobicContact CG1-CG2 3.42Å; I136-V236 VanDerWaalsContact CG1-CG2 3.42Å; I136-D269 WeakPolarHBondContact O-CA 3.41Å; I136-K270 HydrophobicContact CB-CB 4.31Å; I136-K270 PolarHBondContact N-O 3.35Å; I136-K270 PolarHBondContact O-N 3.33Å; I136-H272 HydrophobicContact CD1-CB 3.56Å; I136-H272 HydrophobicContact CG1-CB 3.82Å; I136-T327 HydrophobicContact CD1-CG2 4.34Å
137	F	71.1	Confident	64	Low	18 Å²	18	69.2 Å²	69.2	8%	0.079	36%	0.359	C	S	.	.			trans	-76.5	123.3	179.4	-62.1	-74	0	0	0	111.6	I135 R139 Y140 I240 D264 D269	I135-F137 HydrophobicContact CB-CE1 4.24Å; I135-F137 HydrophobicContact CB-CE2 4.49Å; I135-F137 HydrophobicContact CB-CZ 4.14Å; I135-F137 HydrophobicContact CG2-CD1 3.87Å; I135-F137 HydrophobicContact CG2-CE1 3.77Å; I135-F137 HydrophobicContact CG2-CG 4.38Å; I135-F137 HydrophobicContact CG2-CZ 4.16Å; F137-R139 HydrophobicContact CB-CG 4.3Å; F137-R139 PolarHBondContact O-N 2.88Å; F137-Y140 HydrophobicContact CB-CD2 3.93Å; F137-Y140 HydrophobicContact CB-CE2 4.43Å; F137-Y140 PolarHBondContact O-N 2.88Å; F137-Y140 VanDerWaalsContact O-N 3.13Å; F137-I240 HydrophobicContact CE2-CD1 3.58Å; F137-I240 HydrophobicContact CE2-CG2 4.43Å; F137-I240 HydrophobicContact CZ-CD1 4.1Å; F137-I240 HydrophobicContact CZ-CG2 4.46Å; F137-D264 HydrophobicContact CD1-CB 3.7Å; F137-D264 WeakPolarHBondContact CD1-OD2 3.39Å; F137-D264 HydrophobicContact CE1-CB 3.98Å; F137-D264 WeakPolarHBondContact CE1-OD2 3.48Å; F137-D269 WeakPolarHBondContact CA-OD1 3.42Å
138	G	60.9	Low	60.9	Low	16 Å²	16	75.7 Å²	75.7	17%	0.165	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-62.7	-29.3	-173	0	0	0	0	0	113.8	I136 Y140 V141 S268 D269	I136-G138 PolarHBondContact O-N 2.89Å; G138-Y140 PolarHBondContact O-N 2.85Å; G138-V141 PolarHBondContact O-N 3.03Å; G138-S268 WeakPolarHBondContact CA-O 3.42Å; G138-S268 WeakPolarHBondContact CA-OG 3.43Å; G138-D269 PolarHBondContact N-OD1 3.49Å
139	R	58	Low	57.7	Low	165 Å²	165	81 Å²	81	62%	0.623	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-60.3	-14.5	176.2	66.1	-177.7	173.1	160.3	-1	115.1	F137 D264	F137-R139 HydrophobicContact CB-CG 4.3Å; F137-R139 PolarHBondContact O-N 2.88Å; R139-D264 IonicContact CZ-OD2 3.89Å; R139-D264 IonicContact NE-OD2 3.16Å; R139-D264 PolarHBondContact NE-OD2 2.67Å; R139-D264 IonicContact NH2-OD1 2.65Å; R139-D264 IonicContact NH2-OD2 2.61Å; R139-D264 PolarHBondContact NH2-OD2 2.74Å
140	Y	47.9	Very low	54.5	Low	155 Å²	155	86.5 Å²	86.5	61%	0.608	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-102.8	-3.1	177.8	-67.5	-78.9	0	0	0	114	F137 G138 G142	F137-Y140 HydrophobicContact CB-CD2 3.93Å; F137-Y140 HydrophobicContact CB-CE2 4.43Å; F137-Y140 PolarHBondContact O-N 2.88Å; F137-Y140 VanDerWaalsContact O-N 3.13Å; G138-Y140 PolarHBondContact O-N 2.85Å; Y140-G142 VanDerWaalsContact C-N 3.27Å; Y140-G142 PolarHBondContact O-N 2.7Å
141	V	45.5	Very low	51.2	Low	106 Å²	106	91.8 Å²	91.8	64%	0.642	50%	0.498	S	S	*	.			trans	-87.5	70.4	176	-167.5	0	0	0	0	109	I136 G138 N143	I136-V141 HydrophobicContact CG2-CG2 4.24Å; G138-V141 PolarHBondContact O-N 3.03Å; V141-N143 PolarHBondContact O-N 3.16Å
142	G	36.8	Very low	48	Very low	61 Å²	61	99.7 Å²	99.7	63%	0.629	54%	0.54	S	S	*	.			trans	-75.9	117.9	-176.9	0	0	0	0	0	114.1	Y140 N144	Y140-G142 VanDerWaalsContact C-N 3.27Å; Y140-G142 PolarHBondContact O-N 2.7Å; G142-N144 PolarHBondContact O-N 3.26Å
143	N	32.3	Very low	44.9	Very low	163 Å²	163	102.5 Å²	102.5	87%	0.872	56%	0.562	S	S	*	*			trans	13.7	93.5	150.6	-64.6	-13.5	0	0	0	117.2	V141	V141-N143 PolarHBondContact O-N 3.16Å
144	N	31	Very low	41.8	Very low	149 Å²	149	110.1 Å²	110.1	80%	0.797	60%	0.601	S	S	*	*			trans	-140.9	32.7	168.7	-105.9	-10.9	0	0	0	113.9	G142 K146	G142-N144 PolarHBondContact O-N 3.26Å; N144-K146 PolarHBondContact O-N 3.34Å
145	E	29.1	Very low	38.9	Very low	200 Å²	200	117 Å²	117	94%	0.935	64%	0.637	S	S	*	*			trans	-87.3	82	164.2	-69.5	-169.2	172.4	0	0	109.8	S147	E145-S147 VanDerWaalsContact C-N 3.33Å; E145-S147 PolarHBondContact O-N 3.33Å; E145-S147 VanDerWaalsContact O-N 3.07Å
146	K	27.9	Very low	36.1	Very low	182 Å²	182	123.2 Å²	123.2	79%	0.791	68%	0.676	S	S	*	*			trans	-72.9	94.9	160.6	-83.5	-172.6	177.5	-178.6	0	108.8	N144 T148	N144-K146 PolarHBondContact O-N 3.34Å; K146-T148 PolarHBondContact O-N 3.21Å
147	S	25.8	Very low	33.3	Very low	102 Å²	102	127 Å²	127	71%	0.713	70%	0.701	S	S	*	*			trans	24.8	83.3	136.1	63	0	0	0	0	115.5	E145	E145-S147 VanDerWaalsContact C-N 3.33Å; E145-S147 PolarHBondContact O-N 3.33Å; E145-S147 VanDerWaalsContact O-N 3.07Å
148	T	24.2	Very low	31.1	Very low	136 Å²	136	132.9 Å²	132.9	83%	0.834	74%	0.738	S	S	*	*			trans	-109.9	96.6	146.9	27.7	0	0	0	0	107	K146 P150	K146-T148 PolarHBondContact O-N 3.21Å; T148-P150 VanDerWaalsContact O-CD 3.3Å; T148-P150 WeakPolarHBondContact O-CD 3.33Å
149	T	23.9	Very low	29.2	Very low	132 Å²	132	138 Å²	138	81%	0.81	77%	0.767	S	S	*	*			trans	-62	131.7	167.7	46.3	0	0	0	0	109.7
150	P	24.6	Very low	27.5	Very low	115 Å²	115	136.8 Å²	136.8	75%	0.747	78%	0.778	S	S	*	*				-124.1	124.6	129.4	32.9	-23.1	0	0	0	109.9	T148	T148-P150 VanDerWaalsContact O-CD 3.3Å; T148-P150 WeakPolarHBondContact O-CD 3.33Å
151	D	21.7	Very low	26.4	Very low	146 Å²	146	139 Å²	139	78%	0.781	79%	0.791	S	S	*	*			trans	10.8	123	149.6	-59.7	-34.7	0	0	0	117.4
152	L	24.3	Very low	25.3	Very low	167 Å²	167	138.9 Å²	138.9	87%	0.874	80%	0.795	S	S	*	*				-173.2	127.6	110.6	-93.4	153.4	0	0	0	110.8
153	S	22.5	Very low	25	Very low	94 Å²	94	141.9 Å²	141.9	66%	0.657	80%	0.803	S	S	*	*			trans	-49.6	125.3	167	50.6	0	0	0	0	113.6
154	I	25	Very low	24.6	Very low	161 Å²	161	140.8 Å²	140.8	83%	0.826	80%	0.797	S	S	*	*			trans	-143.8	100.8	132.2	-58.6	-173.5	0	0	0	107.3
155	N	22.9	Very low	24.3	Very low	147 Å²	147	140 Å²	140	79%	0.786	79%	0.793	S	S	*	*			trans	-77.9	120.3	170	-77.4	-25.4	0	0	0	109.4
156	T	23.1	Very low	24	Very low	133 Å²	133	137.5 Å²	137.5	82%	0.816	79%	0.786	S	S	*	*			trans	-132.6	95.5	147.3	16.5	0	0	0	0	108.1
157	T	21.3	Very low	23.7	Very low	119 Å²	119	136.1 Å²	136.1	73%	0.73	78%	0.782	S	S	*	*			trans	-60.6	128.1	171.5	40.6	0	0	0	0	111.7
158	T	23.8	Very low	23.5	Very low	142 Å²	142	136.9 Å²	136.9	87%	0.871	78%	0.782	S	S	*	*			trans	-146.3	113.8	141.3	5.9	0	0	0	0	108.7
159	T	22.2	Very low	23.5	Very low	124 Å²	124	135.8 Å²	135.8	76%	0.761	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-64.5	134.3	-172.4	33.8	0	0	0	0	113.4
160	T	21.8	Very low	23.3	Very low	139 Å²	139	137.3 Å²	137.3	85%	0.853	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-64.2	131.8	166.2	40.2	0	0	0	0	111.6
161	F	24.2	Very low	23.3	Very low	200 Å²	200	139 Å²	139	88%	0.877	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-103.7	123.6	160.1	-89	-84.3	0	0	0	108.6
162	S	23.1	Very low	23.3	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-84.9	126.9	177.3	-164.6	0	0	0	0	110
163	P	30.2	Very low	23.2	Very low	124 Å²	124	140.8 Å²	140.8	81%	0.805	78%	0.778	S	S	*	*			trans	-93.8	113	170.4	26.8	-14.8	0	0	0	110
164	N	24.5	Very low	23.2	Very low	139 Å²	139	143.6 Å²	143.6	74%	0.743	79%	0.786	S	S	*	*			trans	-72.1	134.6	170.9	-79.1	-8.7	0	0	0	111.2
165	D	24.4	Very low	23.3	Very low	133 Å²	133	143 Å²	143	71%	0.711	79%	0.79	S	S	*	*			trans	33.2	112.9	130.9	-59.6	-32.9	0	0	0	118.7
166	L	22.6	Very low	23.3	Very low	148 Å²	148	141.5 Å²	141.5	78%	0.775	79%	0.79	S	S	*	*				93.3	138.3	77.2	-135.2	84.4	0	0	0	111.6
167	E	22	Very low	23.3	Very low	153 Å²	153	138.9 Å²	138.9	72%	0.715	79%	0.79	S	S	*	*			trans	99.4	105.1	151.7	-65	-164.3	159.8	0	0	121.3
168	T	21.8	Very low	23.3	Very low	118 Å²	118	143.1 Å²	143.1	72%	0.724	80%	0.798	S	S	*	*				108.3	143.6	107.2	53.5	0	0	0	0	121.4
169	V	22.9	Very low	23.2	Very low	113 Å²	113	145.7 Å²	145.7	69%	0.685	80%	0.797	S	S	*	*			trans	113.2	87.9	145	-165.2	0	0	0	0	116.8
170	Q	21.5	Very low	23.2	Very low	164 Å²	164	143.6 Å²	143.6	77%	0.766	80%	0.801	S	S	*	*				46	118.4	122	-58.6	174	-3.3	0	0	119.3
171	T	23.9	Very low	23.3	Very low	151 Å²	151	146.4 Å²	146.4	93%	0.926	80%	0.801	S	S	*	*			trans	-135.2	108.1	131.4	28.6	0	0	0	0	110.4
172	T	22.1	Very low	23.3	Very low	112 Å²	112	143.9 Å²	143.9	69%	0.687	80%	0.797	S	S	*	*			trans	-71.1	138.3	172.4	48	0	0	0	0	111.7
173	R	22.3	Very low	23.4	Very low	237 Å²	237	146.6 Å²	146.6	89%	0.894	80%	0.804	S	S	*	*				-169.1	101.5	127.2	-107.8	173.6	-176	178.3	2	112.8
174	N	22.3	Very low	23.1	Very low	153 Å²	153	147.5 Å²	147.5	82%	0.818	80%	0.802	S	S	*	*			trans	-10.9	120.7	150.4	-59.7	-23.1	0	0	0	117.2
175	V	25.8	Very low	23.1	Very low	149 Å²	149	150.4 Å²	150.4	90%	0.903	80%	0.802	S	S	*	*			trans	-125	105.7	140.1	179.3	0	0	0	0	107.6
176	S	22.7	Very low	23.1	Very low	115 Å²	115	149.9 Å²	149.9	80%	0.804	80%	0.803	S	S	*	*			trans	-78.2	135.6	177.1	49.8	0	0	0	0	111.4
177	G	23.2	Very low	23.2	Very low	78 Å²	78	147.2 Å²	147.2	80%	0.804	79%	0.793	S	S	*	*			trans	176.1	53.6	170	0	0	0	0	0	113.6	K179	G177-K179 PolarHBondContact O-N 2.95Å
178	K	22.6	Very low	23.6	Very low	209 Å²	209	145.3 Å²	145.3	91%	0.909	78%	0.783	S	S	*	*			trans	-58.3	122.7	177.4	-74.7	176.2	172.2	179.1	0	112
179	K	22.1	Very low	23.8	Very low	195 Å²	195	144.8 Å²	144.8	85%	0.848	78%	0.78	S	S	*	*			trans	-124	134.7	146.4	-83.4	-172.3	175.4	-179.2	0	107.7	G177	G177-K179 PolarHBondContact O-N 2.95Å
180	G	22.2	Very low	24.1	Very low	81 Å²	81	146.1 Å²	146.1	84%	0.835	77%	0.773	S	S	*	*			trans	-57.1	131.5	-166.6	0	0	0	0	0	113.6
181	F	24	Very low	24.5	Very low	197 Å²	197	143.4 Å²	143.4	86%	0.864	77%	0.771	S	S	*	*			trans	-85.7	104.5	164.5	-89.9	-95.1	0	0	0	107.5
182	D	22.3	Very low	24.8	Very low	148 Å²	148	140.6 Å²	140.6	79%	0.791	76%	0.758	S	S	*	*			trans	-73.4	143.6	157.5	-84.5	-37.3	0	0	0	108.9	N184	D182-N184 PolarHBondContact O-N 3.48Å
183	N	25.8	Very low	25.1	Very low	162 Å²	162	141.5 Å²	141.5	87%	0.866	75%	0.753	S	S	*	*			trans	-55	95.3	-172.1	-67.5	-32.9	0	0	0	113	R185	N183-R185 PolarHBondContact O-N 2.82Å; N183-R185 VanDerWaalsContact O-N 3.07Å
184	N	24	Very low	25.3	Very low	143 Å²	143	139.7 Å²	139.7	77%	0.765	75%	0.746	S	S	*	*			trans	-75.2	94.2	167	-81.7	-11.3	0	0	0	109.2	D182 V186	D182-N184 PolarHBondContact O-N 3.48Å; N184-V186 PolarHBondContact O-N 2.7Å; N184-V186 VanDerWaalsContact O-N 3.16Å
185	R	24.4	Very low	25.6	Very low	199 Å²	199	143.7 Å²	143.7	75%	0.751	75%	0.75	S	S	*	*			trans	-54.9	114.5	156.9	-161	176.2	-172	-178.2	-0.3	106.2	N183 T187	N183-R185 PolarHBondContact O-N 2.82Å; N183-R185 VanDerWaalsContact O-N 3.07Å; R185-T187 PolarHBondContact O-N 3.45Å
186	V	25	Very low	25.7	Very low	122 Å²	122	145.7 Å²	145.7	74%	0.739	75%	0.747	S	S	*	*			trans	-69.1	80.6	177.1	-177.8	0	0	0	0	107.5	N184	N184-V186 PolarHBondContact O-N 2.7Å; N184-V186 VanDerWaalsContact O-N 3.16Å
187	T	25.3	Very low	25.9	Very low	92 Å²	92	144.6 Å²	144.6	56%	0.564	74%	0.739	S	S	*	*			trans	-80	122.3	162	46.8	0	0	0	0	105.9	R185 T189	R185-T187 PolarHBondContact O-N 3.45Å; T187-T189 VanDerWaalsContact C-N 3.26Å; T187-T189 PolarHBondContact O-N 2.91Å
188	F	29.3	Very low	26.1	Very low	113 Å²	113	150.1 Å²	150.1	50%	0.496	74%	0.744	S	S	.	*			trans	-58.4	96.8	168	-75.4	-83.6	0	0	0	107.4	Y49 R190	Y49-F188 HydrophobicContact CE2-CD1 4.25Å; F188-R190 PolarHBondContact O-N 3.48Å
189	T	25.8	Very low	26.4	Very low	107 Å²	107	144.3 Å²	144.3	66%	0.656	73%	0.729	S	S	*	*			trans	-68.4	108.3	-177.6	47.4	0	0	0	0	107.9	T187 S191	T187-T189 VanDerWaalsContact C-N 3.26Å; T187-T189 PolarHBondContact O-N 2.91Å; T189-S191 PolarHBondContact O-N 3.37Å; T189-S191 PolarHBondContact O-OG 2.85Å
190	R	29.6	Very low	26.5	Very low	142 Å²	142	144 Å²	144	54%	0.536	73%	0.728	S	S	.	*			trans	-56.9	52.3	170.9	-93.8	178.5	162.9	-168.8	-7.5	113	F188 D375	F188-R190 PolarHBondContact O-N 3.48Å; R190-D375 PolarHBondContact NH2-O 3.33Å
191	S	29.4	Very low	26.7	Very low	106 Å²	106	147.8 Å²	147.8	74%	0.741	73%	0.73	S	S	*	*			trans	-91.3	-5	-166.4	57.3	0	0	0	0	116.4	T189	T189-S191 PolarHBondContact O-N 3.37Å; T189-S191 PolarHBondContact O-OG 2.85Å
192	S	30.5	Very low	26.8	Very low	93 Å²	93	147.8 Å²	147.8	65%	0.65	73%	0.729	S	S	*	*	S	Bend	trans	-102.2	-17.5	178.2	41.8	0	0	0	0	115.7
193	F	28.8	Very low	27	Very low	131 Å²	131	152.2 Å²	152.2	58%	0.575	74%	0.735	S	S	*	*	S	Bend	trans	-104.7	8.1	-166	-65.4	-75.4	0	0	0	117
194	R	25.5	Very low	27	Very low	199 Å²	199	151.4 Å²	151.4	75%	0.751	74%	0.736	S	S	*	*			trans	-95.4	20.9	-172	-93.1	-163	-172.6	-160.8	3.7	117.6
195	R	29.6	Very low	27	Very low	237 Å²	237	152.2 Å²	152.2	89%	0.894	74%	0.74	S	S	*	*	S	Bend	trans	-86.9	1.6	-174.3	-86	-165.8	-162.9	164.5	8.9	118.3
196	F	28.5	Very low	27	Very low	191 Å²	191	151.9 Å²	151.9	84%	0.838	75%	0.747	S	S	*	*	S	Bend	trans	-136.6	12.8	-179.4	-108.7	-83.9	0	0	0	119.1
197	S	26.7	Very low	27	Very low	92 Å²	92	151.5 Å²	151.5	64%	0.643	75%	0.75	S	S	*	*	S	Bend	trans	-96.3	1	178.8	70.1	0	0	0	0	116.4
198	Q	26.6	Very low	26.9	Very low	194 Å²	194	156 Å²	156	91%	0.907	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	4.2	-174.2	-82.7	-170.2	-9.5	0	0	116.9
199	S	28.3	Very low	26.6	Very low	86 Å²	86	160.2 Å²	160.2	60%	0.601	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-1.4	-176	38.3	0	0	0	0	116.7
200	F	25.8	Very low	26.5	Very low	188 Å²	188	162.9 Å²	162.9	83%	0.825	79%	0.792	S	S	*	*			trans	-114.1	1.6	-174.9	-89.1	-81.7	0	0	0	117.9	K202	F200-K202 VanDerWaalsContact C-N 3.28Å; F200-K202 PolarHBondContact O-N 3.48Å
201	N	26.2	Very low	26.2	Very low	162 Å²	162	163.8 Å²	163.8	87%	0.866	81%	0.808	S	S	*	*			trans	-85.3	54.9	176.7	-80.7	-12.3	0	0	0	113.9
202	K	26.5	Very low	26	Very low	197 Å²	197	165.9 Å²	165.9	86%	0.857	81%	0.809	S	S	*	*	S	Bend	trans	-151.7	86.1	161	-88.9	-171.3	-178.2	169.9	0	110.4	F200	F200-K202 VanDerWaalsContact C-N 3.28Å; F200-K202 PolarHBondContact O-N 3.48Å
203	R	25.1	Very low	25.6	Very low	240 Å²	240	166.3 Å²	166.3	91%	0.906	81%	0.812	S	S	*	*	S	Bend	trans	143.2	85.1	145.6	-81.8	170.4	173.5	-178.6	-1.4	111.6
204	T	25.7	Very low	25.3	Very low	145 Å²	145	167.8 Å²	167.8	89%	0.89	82%	0.82	S	S	*	*			trans	-160.6	57.7	150.7	43	0	0	0	0	109.1
205	N	24.4	Very low	25.3	Very low	161 Å²	161	165.6 Å²	165.6	86%	0.861	82%	0.823	S	S	*	*			trans	-104.4	95	163.8	-86.4	-12.6	0	0	0	107.3
206	Q	24.5	Very low	24.9	Very low	191 Å²	191	162 Å²	162	89%	0.893	82%	0.817	S	S	*	*			trans	172.1	91.8	152.8	-96.6	163.3	33.2	0	0	109.6
207	S	24.7	Very low	24.7	Very low	114 Å²	114	158.3 Å²	158.3	80%	0.797	82%	0.815	S	S	*	*	S	Bend	trans	-166.9	105.1	144.3	6.9	0	0	0	0	109.7
208	E	23.7	Very low	24.5	Very low	188 Å²	188	163.1 Å²	163.1	88%	0.879	82%	0.824	S	S	*	*			trans	53.7	95.3	137.6	-65.7	178.3	166.5	0	0	119.1	L210	E208-L210 PolarHBondContact O-N 3.25Å; E208-L210 VanDerWaalsContact O-N 3.14Å
209	K	23.8	Very low	24.2	Very low	200 Å²	200	164.1 Å²	164.1	87%	0.87	83%	0.826	S	S	*	*			trans	-48.8	105.4	157.2	-65.5	173.7	174.6	-179	0	110.8
210	L	22.9	Very low	23.9	Very low	163 Å²	163	168.2 Å²	168.2	85%	0.853	84%	0.838	S	S	*	*			trans	-83.1	117.7	157.9	-86	161.7	0	0	0	108.3	E208 I212	E208-L210 PolarHBondContact O-N 3.25Å; E208-L210 VanDerWaalsContact O-N 3.14Å; L210-I212 PolarHBondContact O-N 3.49Å
211	N	22.8	Very low	23.8	Very low	162 Å²	162	164.4 Å²	164.4	87%	0.866	83%	0.834	S	S	*	*			trans	-61	99.1	179.2	-69.1	-37.8	0	0	0	110.4
212	I	25.3	Very low	23.6	Very low	150 Å²	150	160.6 Å²	160.6	77%	0.769	83%	0.833	S	S	*	*			trans	-89.2	114.8	161.9	-61.5	175.4	0	0	0	106	L210 H214	L210-I212 PolarHBondContact O-N 3.49Å; I212-H214 PolarHBondContact O-N 2.93Å; I212-H214 VanDerWaalsContact O-N 3.08Å
213	S	22.7	Very low	23.5	Very low	102 Å²	102	155.8 Å²	155.8	71%	0.713	83%	0.83	S	S	*	*			trans	-56.2	109.8	179.9	52	0	0	0	0	110.8	N215	S213-N215 PolarHBondContact O-N 3.01Å; S213-N215 VanDerWaalsContact O-N 3.12Å
214	H	23	Very low	23.4	Very low	161 Å²	161	150.8 Å²	150.8	75%	0.745	83%	0.826	S	S	*	*			trans	-60.4	104.5	168.5	-93.8	-84.5	0	0	0	110.1	I212 E216	I212-H214 PolarHBondContact O-N 2.93Å; I212-H214 VanDerWaalsContact O-N 3.08Å; H214-E216 VanDerWaalsContact C-N 3.31Å; H214-E216 HydrophobicContact CB-CG 4.39Å; H214-E216 PolarHBondContact O-N 3.19Å
215	N	24.3	Very low	23.4	Very low	153 Å²	153	149.8 Å²	149.8	82%	0.818	83%	0.825	S	S	*	*			trans	-84.6	81.8	156.5	-84.4	-9.8	0	0	0	108.1	S213 S217	S213-N215 PolarHBondContact O-N 3.01Å; S213-N215 VanDerWaalsContact O-N 3.12Å; N215-S217 PolarHBondContact O-N 3.35Å
216	E	21.9	Very low	23.4	Very low	163 Å²	163	147.5 Å²	147.5	76%	0.762	82%	0.822	S	S	*	*			trans	-73.5	93.2	166.1	-75	-172.4	154.9	0	0	109.5	H214	H214-E216 VanDerWaalsContact C-N 3.31Å; H214-E216 HydrophobicContact CB-CG 4.39Å; H214-E216 PolarHBondContact O-N 3.19Å
217	S	23.4	Very low	23.4	Very low	113 Å²	113	148.4 Å²	148.4	79%	0.79	82%	0.823	S	S	*	*			trans	-96.6	92.5	160.6	42.9	0	0	0	0	109.1	N215	N215-S217 PolarHBondContact O-N 3.35Å
218	F	22.2	Very low	23.5	Very low	193 Å²	193	148.2 Å²	148.2	85%	0.846	82%	0.821	S	S	*	*			trans	27.8	101.8	155.1	-85.4	-97.5	0	0	0	118.5	M220	F218-M220 PolarHBondContact O-N 3.01Å; F218-M220 VanDerWaalsContact O-N 3.12Å
219	K	21.7	Very low	23.7	Very low	214 Å²	214	145.7 Å²	145.7	93%	0.93	82%	0.818	S	S	*	*			trans	-57.5	106.8	155.9	-79.7	176.4	174.4	172.4	0	110.1
220	M	21.9	Very low	24	Very low	173 Å²	173	140.3 Å²	140.3	85%	0.852	80%	0.802	S	S	*	*			trans	-85.2	108.3	159.1	-80.4	-68	-72.6	0	0	109	F218 G222	F218-M220 PolarHBondContact O-N 3.01Å; F218-M220 VanDerWaalsContact O-N 3.12Å; M220-G222 PolarHBondContact O-N 2.93Å
221	S	22.6	Very low	24.4	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	80%	0.798	S	S	*	*			trans	-66.1	123.9	174.3	50.9	0	0	0	0	111.5
222	G	22.5	Very low	25	Very low	81 Å²	81	141.6 Å²	141.6	84%	0.835	80%	0.8	S	S	*	*			trans	31.2	97.5	148.8	0	0	0	0	0	118.8	M220	M220-G222 PolarHBondContact O-N 2.93Å
223	A	24.1	Very low	25.5	Very low	96 Å²	96	142.1 Å²	142.1	79%	0.793	80%	0.799	S	S	*	*			trans	-145.9	115.3	146.2	0	0	0	0	0	109
224	T	23.9	Very low	26.3	Very low	136 Å²	136	140.5 Å²	140.5	83%	0.834	80%	0.799	S	S	*	*			trans	-17.3	124	171.9	44.3	0	0	0	0	117.9	S226	T224-S226 PolarHBondContact O-N 2.74Å
225	S	25.8	Very low	27	Very low	123 Å²	123	139.3 Å²	139.3	86%	0.86	79%	0.794	S	S	*	*			trans	-59.2	108.2	177.6	57.8	0	0	0	0	113.1
226	S	23.3	Very low	28	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	76%	0.759	S	S	*	*			trans	-84.2	123.3	164.8	-62.1	0	0	0	0	109.1	T224 S228	T224-S226 PolarHBondContact O-N 2.74Å; S226-S228 PolarHBondContact O-N 3.15Å
227	K	25.7	Very low	29.1	Very low	209 Å²	209	127.6 Å²	127.6	91%	0.909	74%	0.739	S	S	*	*			trans	-50.7	110.3	-179.2	-68.1	170.1	174.9	176	0	111.7
228	S	26.2	Very low	29.8	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-84.8	122.1	170.4	48.4	0	0	0	0	110.4	S226	S226-S228 PolarHBondContact O-N 3.15Å
229	V	27.2	Very low	31	Very low	135 Å²	135	122.9 Å²	122.9	82%	0.818	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-80.3	119.7	174.3	175.5	0	0	0	0	107.9
230	V	31.4	Very low	32.8	Very low	88 Å²	88	116.2 Å²	116.2	53%	0.533	71%	0.711	S	S	.	*	P	Polyproline II helix	trans	-87.9	135.8	179.9	178.6	0	0	0	0	110.6
231	N	29.5	Very low	35.3	Very low	141 Å²	141	111.4 Å²	111.4	75%	0.754	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-82.8	155.7	-177.4	-80.1	-25.3	0	0	0	113.5	E233	N231-E233 VanDerWaalsContact C-N 3.27Å; N231-E233 PolarHBondContact O-N 3.41Å
232	K	35.5	Very low	38.2	Very low	211 Å²	211	110.5 Å²	110.5	92%	0.917	67%	0.67	S	S	*	*	S	Bend	trans	-64.6	15.3	-165.3	-71.6	-178.6	172.2	179.1	0	118.8
233	E	36.2	Very low	41.1	Very low	160 Å²	160	110.1 Å²	110.1	75%	0.748	65%	0.654	S	S	*	*	S	Bend	trans	-110.2	20	-172.4	-72.8	-173.8	162.2	0	0	115.1	N231 H235	N231-E233 VanDerWaalsContact C-N 3.27Å; N231-E233 PolarHBondContact O-N 3.41Å; E233-H235 PolarHBondContact O-N 2.97Å; E233-H235 VanDerWaalsContact O-N 3.12Å
234	G	39.1	Very low	44.2	Very low	69 Å²	69	106 Å²	106	71%	0.711	62%	0.62	S	S	*	*			trans	67.6	14.1	172.6	0	0	0	0	0	114.4	V236	G234-V236 PolarHBondContact O-N 2.84Å
235	H	39.2	Very low	47.3	Very low	136 Å²	136	105.4 Å²	105.4	63%	0.63	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-71.4	118.7	174.1	-75.3	-73.1	0	0	0	110.3	E233	E233-H235 PolarHBondContact O-N 2.97Å; E233-H235 VanDerWaalsContact O-N 3.12Å
236	V	45.5	Very low	50.4	Low	15 Å²	15	102.2 Å²	102.2	9%	0.091	58%	0.582	C	S	.	*	P	Polyproline II helix	trans	-55.2	136.3	171.4	175.5	0	0	0	0	109	I135 I136 G234 V238 M241	I135-V236 WeakPolarHBondContact O-CG1 3.19Å; I136-V236 HydrophobicContact CB-CG2 4.31Å; I136-V236 HydrophobicContact CD1-CG2 4.49Å; I136-V236 HydrophobicContact CG1-CG2 3.42Å; I136-V236 VanDerWaalsContact CG1-CG2 3.42Å; G234-V236 PolarHBondContact O-N 2.84Å; V236-V238 PolarHBondContact O-N 3.44Å; V236-M241 HydrophobicContact CB-CE 3.55Å; V236-M241 HydrophobicContact CG1-CE 4.01Å; V236-M241 HydrophobicContact CG1-CG 4.44Å
237	P	43.9	Very low	53.5	Low	54 Å²	54	99.4 Å²	99.4	35%	0.351	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-57.2	123.4	179.4	-22.3	31.7	0	0	0	111.6	G239 I240	P237-G239 PolarHBondContact O-N 3.05Å; P237-I240 PolarHBondContact O-N 3.17Å; P237-I240 VanDerWaalsContact O-N 3.14Å
238	V	39.3	Very low	56.5	Low	128 Å²	128	96.2 Å²	96.2	78%	0.776	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-52.3	-26.9	-174.8	179.1	0	0	0	0	113.5	V236 I240	V236-V238 PolarHBondContact O-N 3.44Å; V238-I240 PolarHBondContact O-N 3.39Å
239	G	46.1	Very low	59.3	Low	80 Å²	80	96.5 Å²	96.5	83%	0.825	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-69.8	-7.1	-179.3	0	0	0	0	0	116.4	P237	P237-G239 PolarHBondContact O-N 3.05Å
240	I	59.7	Low	62.4	Low	73 Å²	73	91.6 Å²	91.6	37%	0.374	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-118.1	-2	-173.7	-57.9	170.2	0	0	0	112	F137 P237 V238	F137-I240 HydrophobicContact CE2-CD1 3.58Å; F137-I240 HydrophobicContact CE2-CG2 4.43Å; F137-I240 HydrophobicContact CZ-CD1 4.1Å; F137-I240 HydrophobicContact CZ-CG2 4.46Å; P237-I240 PolarHBondContact O-N 3.17Å; P237-I240 VanDerWaalsContact O-N 3.14Å; V238-I240 PolarHBondContact O-N 3.39Å
241	M	74.3	Confident	65.3	Low	72 Å²	72	89.3 Å²	89.3	36%	0.355	49%	0.488	S	S	.	.			trans	-80	141.2	179.1	-66.2	-178.2	175.2	0	0	111.7	I132 L133 V236	I132-M241 HydrophobicContact CG2-CB 3.96Å; I132-M241 HydrophobicContact CG2-CG 4.23Å; I132-M241 HydrophobicContact CG2-SD 3.79Å; L133-M241 WeakPolarHBondContact O-CA 3.38Å; V236-M241 HydrophobicContact CB-CE 3.55Å; V236-M241 HydrophobicContact CG1-CE 4.01Å; V236-M241 HydrophobicContact CG1-CG 4.44Å
242	K	83.1	Confident	68.4	Low	89 Å²	89	86.6 Å²	86.6	39%	0.387	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	151.8	168.9	-62.5	-170.5	176.4	178.3	0	108.9	I132 L133 F259 R260 L261	I132-K242 CarbonylContact C-O 3.51Å; I132-K242 WeakPolarHBondContact CA-O 3.26Å; L133-K242 HydrophobicContact CD2-CB 4.37Å; L133-K242 WeakPolarHBondContact CD2-O 3.45Å; L133-K242 PolarHBondContact N-O 2.95Å; L133-K242 PolarHBondContact O-N 2.79Å; K242-F259 HydrophobicContact CB-CD1 3.62Å; K242-F259 HydrophobicContact CB-CE1 3.95Å; K242-F259 HydrophobicContact CD-CB 4.34Å; K242-F259 HydrophobicContact CD-CD1 3.78Å; K242-F259 HydrophobicContact CG-CD1 4.32Å; K242-R260 PolarHBondContact NZ-O 3.41Å; K242-L261 HydrophobicContact CD-CD2 4.12Å; K242-L261 HydrophobicContact CG-CD2 4.33Å
243	S	83.3	Confident	71.2	Confident	73 Å²	73	76.6 Å²	76.6	51%	0.51	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	149.9	177.2	63.1	0	0	0	0	111.2	C131 F259	C131-S243 CarbonylContact O-C 3.42Å; C131-S243 WeakPolarHBondContact O-CA 3.39Å; S243-F259 WeakPolarHBondContact O-CE1 3.39Å
244	T	90.3	Very high	74	Confident	10 Å²	10	72.3 Å²	72.3	6%	0.061	42%	0.415	C	S	.	.			trans	-79	174.6	169.2	64.7	0	0	0	0	111.2	V112 C131 W255 E257 F259	V112-T244 HydrophobicContact CB-CG2 4.28Å; V112-T244 HydrophobicContact CG1-CG2 4.16Å; V112-T244 HydrophobicContact CG2-CG2 4.39Å; C131-T244 HydrophobicContact CB-CG2 3.77Å; C131-T244 PolarHBondContact N-OG1 2.84Å; C131-T244 PolarHBondContact O-N 3.46Å; T244-W255 HydrophobicContact CG2-CG 4.23Å; T244-W255 PolarHBondContact OG1-NE1 3.26Å; T244-E257 WeakPolarHBondContact CA-OE2 3.38Å; T244-E257 HydrophobicContact CG2-CB 4.48Å; T244-F259 HydrophobicContact CG2-CE2 3.71Å; T244-F259 HydrophobicContact CG2-CZ 3.61Å
245	Q	89.1	Confident	76.6	Confident	124 Å²	124	69.7 Å²	69.7	58%	0.579	38%	0.384	S	S	*	.			trans	-67.2	152.8	161.9	-61.5	-177.5	-10	0	0	111.3	W255 E257	Q245-W255 PolarHBondContact O-NE1 3.21Å; Q245-E257 WeakPolarHBondContact CB-OE1 3.22Å; Q245-E257 WeakPolarHBondContact CG-OE1 3.31Å; Q245-E257 PolarHBondContact N-OE1 2.86Å; Q245-E257 PolarHBondContact N-OE2 2.78Å
246	V	90.3	Very high	79	Confident	55 Å²	55	68.2 Å²	68.2	33%	0.333	38%	0.381	S	S	.	.			trans	-74.1	135.9	169.1	-178	0	0	0	0	109	D128 Y130 H278	D128-V246 HydrophobicContact CB-CG1 3.97Å; Y130-V246 HydrophobicContact CD1-CG2 4.09Å; Y130-V246 HydrophobicContact CG-CG2 4.15Å; V246-H278 HydrophobicContact CG1-CB 3.67Å; V246-H278 HydrophobicContact CG2-CB 4.03Å
247	K	89	Confident	81.2	Confident	56 Å²	56	69.2 Å²	69.2	24%	0.243	38%	0.384	C	S	.	.			trans	-114.5	107.3	174.3	-61.6	-61.3	176.9	-172.5	0	108.7	D128 P129 T250 P253 V254	D128-K247 CarbonylContact C-O 3.56Å; D128-K247 WeakPolarHBondContact CA-O 3.16Å; P129-K247 WeakPolarHBondContact CD-O 3.24Å; P129-K247 PolarHBondContact O-N 3.17Å; K247-T250 HydrophobicContact CB-CG2 3.87Å; K247-P253 HydrophobicContact CB-CB 3.97Å; K247-P253 HydrophobicContact CG-CB 4.1Å; K247-V254 VanDerWaalsContact CE-O 3.25Å; K247-V254 WeakPolarHBondContact CE-O 3.48Å
248	E	87.9	Confident	83.3	Confident	141 Å²	141	72.3 Å²	72.3	66%	0.659	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	144.3	-174.9	-63.4	169.4	-156.1	0	0	112.9	D128 T250	D128-E248 WeakPolarHBondContact OD1-CA 3.46Å; E248-T250 PolarHBondContact O-N 2.96Å
249	Q	85.9	Confident	85.6	Confident	117 Å²	117	67.2 Å²	67.2	55%	0.547	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	47	168.3	-50.6	-169.7	-4.1	0	0	114.6	N124 F126 S127 D128	N124-Q249 WeakPolarHBondContact ND2-CG 3.38Å; F126-Q249 HydrophobicContact CB-CB 4.27Å; F126-Q249 WeakPolarHBondContact CD1-O 3.15Å; F126-Q249 HydrophobicContact CG-CB 4.45Å; S127-Q249 CarbonylContact O-C 3.56Å; S127-Q249 WeakPolarHBondContact O-CA 3.41Å; S127-Q249 PolarHBondContact O-N 3.22Å; D128-Q249 PolarHBondContact OD1-N 3.47Å
250	T	92.1	Very high	87.3	Confident	32 Å²	32	69.7 Å²	69.7	20%	0.196	35%	0.35	C	S	.	.			trans	-140.5	139.5	-179.4	-175.5	0	0	0	0	113.6	S127 P129 K247 E248 N252 P253	S127-T250 PolarHBondContact O-N 3.48Å; S127-T250 VanDerWaalsContact O-O 3.12Å; P129-T250 VanDerWaalsContact CD-O 3.27Å; P129-T250 WeakPolarHBondContact CD-O 3.21Å; P129-T250 HydrophobicContact CG-CG2 3.96Å; P129-T250 WeakPolarHBondContact CG-O 3.04Å; K247-T250 HydrophobicContact CB-CG2 3.87Å; E248-T250 PolarHBondContact O-N 2.96Å; T250-N252 VanDerWaalsContact OG1-C 3.26Å; T250-N252 PolarHBondContact OG1-N 2.67Å; T250-N252 PolarHBondContact OG1-O 3.11Å; T250-P253 HydrophobicContact CG2-CB 3.81Å
251	L	92.1	Very high	88.4	Confident	40 Å²	40	66.4 Å²	66.4	21%	0.209	33%	0.333	C	S	.	.	S	Bend	trans	-97.8	-3.1	168.7	-54.7	-179.2	0	0	0	112.7	N117 L118 A120 F126 P253	N117-L251 PolarHBondContact N-O 3.41Å; L118-L251 HydrophobicContact CB-CB 4.49Å; L118-L251 PolarHBondContact N-O 3.4Å; A120-L251 HydrophobicContact CB-CD1 3.99Å; A120-L251 HydrophobicContact CB-CD2 3.61Å; A120-L251 HydrophobicContact CB-CG 4.37Å; F126-L251 HydrophobicContact CD1-CG 4.17Å; L251-P253 VanDerWaalsContact C-CD 3.48Å
252	N	94.5	Very high	88.7	Confident	84 Å²	84	68.2 Å²	68.2	45%	0.449	34%	0.341	S	S	.	.	S	Bend	trans	-132.2	65.8	178.2	-50.3	-71.5	0	0	0	109.6	A115 K116 N117 T250	A115-N252 CarbonylContact O-C 3.45Å; A115-N252 VanDerWaalsContact O-C 3.28Å; A115-N252 WeakPolarHBondContact O-CA 3.2Å; K116-N252 WeakPolarHBondContact CA-OD1 3.28Å; K116-N252 WeakPolarHBondContact CB-OD1 3.38Å; N117-N252 PolarHBondContact N-OD1 3.32Å; T250-N252 VanDerWaalsContact OG1-C 3.26Å; T250-N252 PolarHBondContact OG1-N 2.67Å; T250-N252 PolarHBondContact OG1-O 3.11Å
253	P	94.9	Very high	88.6	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.006	33%	0.325	C	S	.	.			trans	-68.2	145.7	-178.1	28.9	-37	0	0	0	112.4	E114 A115 L118 P129 K247 T250 L251 W255	E114-P253 CarbonylContact C-O 3.52Å; E114-P253 WeakPolarHBondContact CA-O 3.15Å; E114-P253 WeakPolarHBondContact CB-O 3.38Å; A115-P253 HydrophobicContact CB-CG 3.97Å; A115-P253 PolarHBondContact N-O 3.25Å; A115-P253 WeakPolarHBondContact O-CD 3.19Å; L118-P253 HydrophobicContact CD1-CG 3.72Å; P129-P253 HydrophobicContact CB-CB 4.47Å; P129-P253 HydrophobicContact CB-CG 4.04Å; P129-P253 HydrophobicContact CG-CB 3.65Å; P129-P253 HydrophobicContact CG-CG 3.53Å; K247-P253 HydrophobicContact CB-CB 3.97Å; K247-P253 HydrophobicContact CG-CB 4.1Å; T250-P253 HydrophobicContact CG2-CB 3.81Å; L251-P253 VanDerWaalsContact C-CD 3.48Å; P253-W255 HydrophobicContact CB-CD2 4.32Å; P253-W255 HydrophobicContact CB-CE3 4.34Å; P253-W255 HydrophobicContact CB-CH2 3.71Å; P253-W255 HydrophobicContact CB-CZ2 3.61Å; P253-W255 HydrophobicContact CB-CZ3 4.06Å; P253-W255 HydrophobicContact CG-CE3 4.35Å; P253-W255 HydrophobicContact CG-CH2 3.12Å; P253-W255 HydrophobicContact CG-CZ2 3.5Å; P253-W255 VanDerWaalsContact CG-CZ2 3.5Å; P253-W255 HydrophobicContact CG-CZ3 3.6Å
254	V	93.5	Very high	88.1	Confident	69 Å²	69	65.3 Å²	65.3	42%	0.418	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.1	171.7	-177.6	0	0	0	0	108	E114 K247 N256	E114-V254 HydrophobicContact CB-CB 4.33Å; E114-V254 HydrophobicContact CB-CG1 4.39Å; E114-V254 HydrophobicContact CB-CG2 3.94Å; K247-V254 VanDerWaalsContact CE-O 3.25Å; K247-V254 WeakPolarHBondContact CE-O 3.48Å; V254-N256 WeakPolarHBondContact CG1-ND2 3.45Å
255	W	94	Very high	87.5	Confident	14 Å²	14	68 Å²	68	5%	0.053	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-49.7	-178.2	-65.7	-83.7	0	0	0	112.1	V112 I113 A115 P129 C131 T244 Q245 P253 E257 I357	V112-W255 HydrophobicContact CG1-CB 4.34Å; V112-W255 HydrophobicContact CG1-CD2 4.12Å; V112-W255 HydrophobicContact CG1-CE3 3.67Å; V112-W255 HydrophobicContact CG1-CG 4.43Å; V112-W255 HydrophobicContact CG1-CZ3 4.23Å; I113-W255 PolarHBondContact O-N 3.47Å; A115-W255 HydrophobicContact CB-CH2 3.98Å; A115-W255 HydrophobicContact CB-CZ3 3.72Å; P129-W255 HydrophobicContact CB-CZ2 4.12Å; C131-W255 WeakPolarHBondContact SG-CH2 3.5Å; T244-W255 HydrophobicContact CG2-CG 4.23Å; T244-W255 PolarHBondContact OG1-NE1 3.26Å; Q245-W255 PolarHBondContact O-NE1 3.21Å; P253-W255 HydrophobicContact CB-CD2 4.32Å; P253-W255 HydrophobicContact CB-CE3 4.34Å; P253-W255 HydrophobicContact CB-CH2 3.71Å; P253-W255 HydrophobicContact CB-CZ2 3.61Å; P253-W255 HydrophobicContact CB-CZ3 4.06Å; P253-W255 HydrophobicContact CG-CE3 4.35Å; P253-W255 HydrophobicContact CG-CH2 3.12Å; P253-W255 HydrophobicContact CG-CZ2 3.5Å; P253-W255 VanDerWaalsContact CG-CZ2 3.5Å; P253-W255 HydrophobicContact CG-CZ3 3.6Å; W255-E257 HydrophobicContact CB-CB 4.3Å; W255-E257 HydrophobicContact CB-CG 4.06Å; W255-E257 PolarHBondContact O-N 3.22Å; W255-I357 HydrophobicContact CZ3-CD1 4.47Å
256	N	90.7	Very high	86.8	Confident	106 Å²	106	64.4 Å²	64.4	57%	0.567	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	50.7	42.6	-169.7	-64.8	-44.7	0	0	0	112.7	V112 I113 V254	V112-N256 WeakPolarHBondContact O-CA 3.32Å; V112-N256 PolarHBondContact O-N 2.92Å; I113-N256 WeakPolarHBondContact CG2-OD1 3.47Å; I113-N256 PolarHBondContact O-N 3.18Å; I113-N256 VanDerWaalsContact O-N 3.12Å; V254-N256 WeakPolarHBondContact CG1-ND2 3.45Å
257	E	91.7	Very high	86	Confident	36 Å²	36	65.4 Å²	65.4	17%	0.168	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.8	-177.1	-69.9	-177.5	-136.1	0	0	111.2	S111 V112 T244 Q245 W255 F259	S111-E257 WeakPolarHBondContact CA-O 3.49Å; V112-E257 PolarHBondContact N-O 3.44Å; V112-E257 PolarHBondContact O-N 3.05Å; T244-E257 WeakPolarHBondContact CA-OE2 3.38Å; T244-E257 HydrophobicContact CG2-CB 4.48Å; Q245-E257 WeakPolarHBondContact CB-OE1 3.22Å; Q245-E257 WeakPolarHBondContact CG-OE1 3.31Å; Q245-E257 PolarHBondContact N-OE1 2.86Å; Q245-E257 PolarHBondContact N-OE2 2.78Å; W255-E257 HydrophobicContact CB-CB 4.3Å; W255-E257 HydrophobicContact CB-CG 4.06Å; W255-E257 PolarHBondContact O-N 3.22Å; E257-F259 HydrophobicContact CB-CE2 3.75Å; E257-F259 HydrophobicContact CB-CZ 3.92Å
258	N	88.2	Confident	85.5	Confident	119 Å²	119	64.7 Å²	64.7	64%	0.636	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	130	-174.8	-64	-42.6	0	0	0	111.3	V110 S111	V110-N258 CarbonylContact O-C 3.5Å; V110-N258 WeakPolarHBondContact O-CA 3.37Å; S111-N258 WeakPolarHBondContact CB-OD1 3.22Å; S111-N258 PolarHBondContact OG-OD1 3.28Å
259	F	86.3	Confident	85.3	Confident	21 Å²	21	58.1 Å²	58.1	9%	0.092	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	144	-179.3	-56.5	-84.6	0	0	0	110.8	N109 V110 V112 L133 K242 S243 T244 E257	N109-F259 CarbonylContact C-O 3.49Å; N109-F259 WeakPolarHBondContact CA-O 3.3Å; V110-F259 HydrophobicContact CB-CB 4.43Å; V110-F259 PolarHBondContact N-O 3.18Å; V110-F259 PolarHBondContact O-N 3.21Å; V112-F259 HydrophobicContact CB-CE2 4.24Å; V112-F259 HydrophobicContact CG2-CD2 3.9Å; V112-F259 HydrophobicContact CG2-CE2 3.74Å; L133-F259 HydrophobicContact CD1-CB 3.95Å; L133-F259 HydrophobicContact CD1-CD2 3.8Å; L133-F259 HydrophobicContact CD1-CG 3.91Å; L133-F259 HydrophobicContact CD2-CD1 4.21Å; L133-F259 HydrophobicContact CD2-CD2 3.86Å; L133-F259 HydrophobicContact CD2-CE1 4.2Å; L133-F259 HydrophobicContact CD2-CE2 3.86Å; L133-F259 HydrophobicContact CD2-CG 4.04Å; L133-F259 HydrophobicContact CD2-CZ 4.04Å; L133-F259 HydrophobicContact CG-CD2 4.43Å; L133-F259 HydrophobicContact CG-CG 4.41Å; K242-F259 HydrophobicContact CB-CD1 3.62Å; K242-F259 HydrophobicContact CB-CE1 3.95Å; K242-F259 HydrophobicContact CD-CB 4.34Å; K242-F259 HydrophobicContact CD-CD1 3.78Å; K242-F259 HydrophobicContact CG-CD1 4.32Å; S243-F259 WeakPolarHBondContact O-CE1 3.39Å; T244-F259 HydrophobicContact CG2-CE2 3.71Å; T244-F259 HydrophobicContact CG2-CZ 3.61Å; E257-F259 HydrophobicContact CB-CE2 3.75Å; E257-F259 HydrophobicContact CB-CZ 3.92Å
260	R	82.5	Confident	85.2	Confident	131 Å²	131	56.1 Å²	56.1	49%	0.494	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.5	170.7	-86.4	-174.3	164.7	-162.8	1.9	110.3	V107 N109 K242	V107-R260 HydrophobicContact CG1-CB 3.87Å; V107-R260 HydrophobicContact CG1-CG 3.92Å; N109-R260 WeakPolarHBondContact OD1-CG 3.44Å; N109-R260 PolarHBondContact OD1-NE 3.17Å; K242-R260 PolarHBondContact NZ-O 3.41Å
261	L	83.1	Confident	85	Confident	5 Å²	5	54.6 Å²	54.6	3%	0.026	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	119.9	-177.8	-56.3	176.7	0	0	0	109.6	V107 L108 V110 L133 I135 K242 L271	V107-L261 CarbonylContact C-O 3.58Å; V107-L261 WeakPolarHBondContact CA-O 3.49Å; V107-L261 WeakPolarHBondContact CG1-O 3.5Å; L108-L261 HydrophobicContact CB-CB 4.5Å; L108-L261 PolarHBondContact N-O 3.46Å; L108-L261 PolarHBondContact O-N 3.26Å; V110-L261 HydrophobicContact CG2-CD1 4.08Å; L133-L261 HydrophobicContact CD1-CD1 4.18Å; I135-L261 HydrophobicContact CD1-CB 3.98Å; I135-L261 HydrophobicContact CD1-CD1 3.85Å; I135-L261 HydrophobicContact CG1-CB 3.78Å; I135-L261 HydrophobicContact CG1-CD1 4.13Å; K242-L261 HydrophobicContact CD-CD2 4.12Å; K242-L261 HydrophobicContact CG-CD2 4.33Å; L261-L271 HydrophobicContact CD1-CD1 3.73Å
262	E	80.5	Confident	84.9	Confident	110 Å²	110	54.4 Å²	54.4	51%	0.514	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.1	176.5	-67.4	176	-176.9	0	0	110.2	V107 Q366	V107-E262 HydrophobicContact CG2-CG 4.39Å; E262-Q366 HydrophobicContact CG-CG 4.39Å; E262-Q366 PolarHBondContact OE1-NE2 3.16Å
263	L	80.1	Confident	84.7	Confident	12 Å²	12	50.4 Å²	50.4	6%	0.063	26%	0.259	C	S	.	.			trans	-106.6	142.1	-178.8	-57.9	171.1	0	0	0	110	V106 L108 I135 I330 L363	V106-L263 HydrophobicContact CB-CD1 4.35Å; V106-L263 HydrophobicContact CG1-CD1 4Å; V106-L263 WeakPolarHBondContact O-CB 3.48Å; V106-L263 PolarHBondContact O-N 3.47Å; L108-L263 HydrophobicContact CB-CD1 4.26Å; L108-L263 HydrophobicContact CB-CD2 4.26Å; L108-L263 HydrophobicContact CB-CG 4.38Å; I135-L263 HydrophobicContact CD1-CD2 3.58Å; I135-L263 HydrophobicContact CG1-CD2 3.92Å; I135-L263 HydrophobicContact CG2-CD2 4.11Å; L263-I330 HydrophobicContact CD1-CG2 3.75Å; L263-I330 HydrophobicContact CD2-CD1 4.25Å; L263-I330 HydrophobicContact CD2-CG1 4.13Å; L263-I330 HydrophobicContact CD2-CG2 4.45Å; L263-L363 HydrophobicContact CD1-CD2 3.8Å
264	D	73.5	Confident	84.4	Confident	88 Å²	88	51 Å²	51	47%	0.471	26%	0.262	S	S	.	.	S	Bend	trans	-90.5	-48.4	172.7	-76.6	-30.3	0	0	0	110.4	F137 R139 D269	F137-D264 HydrophobicContact CD1-CB 3.7Å; F137-D264 WeakPolarHBondContact CD1-OD2 3.39Å; F137-D264 HydrophobicContact CE1-CB 3.98Å; F137-D264 WeakPolarHBondContact CE1-OD2 3.48Å; R139-D264 IonicContact CZ-OD2 3.89Å; R139-D264 IonicContact NE-OD2 3.16Å; R139-D264 PolarHBondContact NE-OD2 2.67Å; R139-D264 IonicContact NH2-OD1 2.65Å; R139-D264 IonicContact NH2-OD2 2.61Å; R139-D264 PolarHBondContact NH2-OD2 2.74Å; D264-D269 PolarHBondContact N-OD2 3.1Å
265	D	77	Confident	84.4	Confident	68 Å²	68	47.7 Å²	47.7	36%	0.364	24%	0.242	S	C	.	.			trans	-144.1	104.8	-175.2	175.3	14.7	0	0	0	111.6	S267 S268 D269	D265-S267 VanDerWaalsContact CG-OG 3.24Å; D265-S267 PolarHBondContact O-N 3.3Å; D265-S267 WeakPolarHBondContact OD1-CB 3.21Å; D265-S267 PolarHBondContact OD1-N 2.91Å; D265-S267 PolarHBondContact OD1-OG 3.43Å; D265-S267 PolarHBondContact OD2-OG 3.47Å; D265-S267 VanDerWaalsContact OD2-OG 3.06Å; D265-S268 VanDerWaalsContact CG-OG 3.31Å; D265-S268 PolarHBondContact O-N 2.93Å; D265-S268 VanDerWaalsContact O-N 3.15Å; D265-S268 WeakPolarHBondContact OD2-CB 3.17Å; D265-S268 PolarHBondContact OD2-OG 3.12Å; D265-D269 PolarHBondContact N-OD2 3.45Å; D265-D269 WeakPolarHBondContact O-CB 3.49Å; D265-D269 PolarHBondContact O-N 3.25Å
266	I	74.8	Confident	84.2	Confident	48 Å²	48	49.3 Å²	49.3	25%	0.246	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-30.1	179.3	-59.7	169.9	0	0	0	112.4	V106 I330 K331	V106-I266 HydrophobicContact CB-CD1 4Å; V106-I266 HydrophobicContact CB-CG1 4.36Å; V106-I266 HydrophobicContact CG1-CD1 4.13Å; V106-I266 HydrophobicContact CG2-CD1 3.69Å; I266-I330 HydrophobicContact CG2-CG2 4.17Å; I266-K331 PolarHBondContact O-N 2.83Å
267	S	74	Confident	84	Confident	76 Å²	76	44.2 Å²	44.2	53%	0.531	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-25.8	-174.9	74.2	0	0	0	0	113.7	D265	D265-S267 VanDerWaalsContact CG-OG 3.24Å; D265-S267 PolarHBondContact O-N 3.3Å; D265-S267 WeakPolarHBondContact OD1-CB 3.21Å; D265-S267 PolarHBondContact OD1-N 2.91Å; D265-S267 PolarHBondContact OD1-OG 3.43Å; D265-S267 PolarHBondContact OD2-OG 3.47Å; D265-S267 VanDerWaalsContact OD2-OG 3.06Å
268	S	77.7	Confident	83.5	Confident	40 Å²	40	45.9 Å²	45.9	28%	0.28	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.8	-20.9	-171.9	69.8	0	0	0	0	114.2	G138 D265	G138-S268 WeakPolarHBondContact CA-O 3.42Å; G138-S268 WeakPolarHBondContact CA-OG 3.43Å; D265-S268 VanDerWaalsContact CG-OG 3.31Å; D265-S268 PolarHBondContact O-N 2.93Å; D265-S268 VanDerWaalsContact O-N 3.15Å; D265-S268 WeakPolarHBondContact OD2-CB 3.17Å; D265-S268 PolarHBondContact OD2-OG 3.12Å
269	D	83.5	Confident	82.9	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	21%	0.207	C	C	.	.			trans	-70.2	149.9	178.8	-68.6	-8	0	0	0	112.3	I135 I136 F137 G138 D264 D265 I330	I135-D269 HydrophobicContact CG2-CB 3.93Å; I136-D269 WeakPolarHBondContact O-CA 3.41Å; F137-D269 WeakPolarHBondContact CA-OD1 3.42Å; G138-D269 PolarHBondContact N-OD1 3.49Å; D264-D269 PolarHBondContact N-OD2 3.1Å; D265-D269 PolarHBondContact N-OD2 3.45Å; D265-D269 WeakPolarHBondContact O-CB 3.49Å; D265-D269 PolarHBondContact O-N 3.25Å; D269-I330 HydrophobicContact CB-CG1 4.22Å; D269-I330 WeakPolarHBondContact O-CB 3.34Å; D269-I330 VanDerWaalsContact O-CG1 3.24Å; D269-I330 WeakPolarHBondContact O-CG1 3.18Å; D269-I330 PolarHBondContact O-N 3.03Å
270	K	84.1	Confident	81.8	Confident	76 Å²	76	47.3 Å²	47.3	33%	0.33	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.2	178.1	-52.2	-176.7	-179.5	-125.6	0	110.7	I135 I136 T327 I328 D329	I135-K270 WeakPolarHBondContact CA-O 3.47Å; I136-K270 HydrophobicContact CB-CB 4.31Å; I136-K270 PolarHBondContact N-O 3.35Å; I136-K270 PolarHBondContact O-N 3.33Å; K270-T327 HydrophobicContact CB-CG2 3.97Å; K270-T327 HydrophobicContact CD-CG2 4.06Å; K270-I328 CarbonylContact C-O 3.42Å; K270-I328 WeakPolarHBondContact CA-O 3.33Å; K270-D329 VanDerWaalsContact CD-OD1 3.24Å; K270-D329 WeakPolarHBondContact CD-OD1 3.22Å; K270-D329 WeakPolarHBondContact CE-OD1 3.41Å; K270-D329 WeakPolarHBondContact CG-OD1 3.39Å; K270-D329 IonicContact NZ-OD1 3.91Å; K270-D329 PolarHBondContact NZ-OD1 2.86Å; K270-D329 IonicContact NZ-OD2 3.02Å
271	L	87.8	Confident	80.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	129.3	165.7	171.5	64.7	0	0	0	108.4	L108 V110 I135 L261 T327 I328 I330 L361	L108-L271 HydrophobicContact CD2-CB 3.93Å; L108-L271 HydrophobicContact CD2-CD1 4.14Å; L108-L271 HydrophobicContact CD2-CD2 3.92Å; L108-L271 HydrophobicContact CD2-CG 4.21Å; V110-L271 HydrophobicContact CG1-CD2 4.33Å; V110-L271 HydrophobicContact CG2-CD1 4.23Å; V110-L271 HydrophobicContact CG2-CD2 4.02Å; I135-L271 HydrophobicContact CD1-CB 4.48Å; I135-L271 HydrophobicContact CD1-CD1 4.34Å; L261-L271 HydrophobicContact CD1-CD1 3.73Å; L271-T327 CarbonylContact O-C 3.6Å; L271-T327 VanDerWaalsContact O-CA 3.25Å; L271-T327 WeakPolarHBondContact O-CA 3.21Å; L271-I328 HydrophobicContact CB-CB 4.38Å; L271-I328 HydrophobicContact CD2-CD1 4.36Å; L271-I328 PolarHBondContact N-O 2.69Å; L271-I328 PolarHBondContact O-N 3.3Å; L271-I330 HydrophobicContact CB-CD1 3.91Å; L271-L361 HydrophobicContact CD2-CD1 4.32Å; L271-L361 HydrophobicContact CD2-CD2 3.84Å
272	H	89.4	Confident	79.1	Confident	35 Å²	35	51.1 Å²	51.1	16%	0.162	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.7	170.6	-169.6	68.4	0	0	0	109.9	L133 G134 I136 D274 T327	L133-H272 WeakPolarHBondContact CA-O 3.31Å; G134-H272 PolarHBondContact N-O 3.45Å; G134-H272 PolarHBondContact O-N 3.34Å; I136-H272 HydrophobicContact CD1-CB 3.56Å; I136-H272 HydrophobicContact CG1-CB 3.82Å; H272-D274 IonicContact CD2-OD2 3.51Å; H272-D274 IonicContact NE2-OD1 4Å; H272-D274 PolarHBondContact NE2-OD1 2.79Å; H272-D274 IonicContact NE2-OD2 2.85Å; H272-T327 PolarHBondContact CE1-OG1 3.36Å; H272-T327 PolarHBondContact ND1-OG1 2.93Å
273	L	91.9	Very high	77.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	128.8	177.6	180	158.9	0	0	0	109.2	V112 C131 I132 L133 I275 C325 V326 I357 L359	V112-L273 HydrophobicContact CG2-CD1 4.06Å; C131-L273 HydrophobicContact CB-CD1 4.33Å; C131-L273 HydrophobicContact CB-CD2 4.11Å; C131-L273 HydrophobicContact CB-CG 4.22Å; I132-L273 CarbonylContact O-C 3.52Å; I132-L273 WeakPolarHBondContact O-CA 3.48Å; L133-L273 HydrophobicContact CB-CB 3.99Å; L133-L273 HydrophobicContact CB-CD1 4.04Å; L133-L273 HydrophobicContact CB-CG 4Å; L273-I275 HydrophobicContact CD2-CG1 3.82Å; L273-C325 CarbonylContact O-C 3.54Å; L273-C325 WeakPolarHBondContact O-CA 3.37Å; L273-C325 VanDerWaalsContact O-CB 3.27Å; L273-C325 WeakPolarHBondContact O-CB 3.45Å; L273-V326 HydrophobicContact CB-CG1 3.85Å; L273-V326 HydrophobicContact CD2-CG1 4.22Å; L273-V326 PolarHBondContact N-O 3.38Å; L273-V326 PolarHBondContact O-N 2.96Å; L273-I357 HydrophobicContact CD1-CD1 4.06Å; L273-I357 HydrophobicContact CD2-CD1 3.69Å; L273-L359 HydrophobicContact CD1-CD1 4.38Å; L273-L359 HydrophobicContact CD1-CD2 4.07Å
274	D	88.6	Confident	76.4	Confident	13 Å²	13	52.5 Å²	52.5	7%	0.07	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	145.4	172.8	-67.9	-59.8	0	0	0	110.5	C131 I132 H272 F322 G324 C325 R347	C131-D274 CarbonylContact C-O 3.5Å; C131-D274 WeakPolarHBondContact CA-O 3.49Å; I132-D274 PolarHBondContact N-O 3.39Å; I132-D274 PolarHBondContact O-N 3.4Å; H272-D274 IonicContact CD2-OD2 3.51Å; H272-D274 IonicContact NE2-OD1 4Å; H272-D274 PolarHBondContact NE2-OD1 2.79Å; H272-D274 IonicContact NE2-OD2 2.85Å; D274-F322 HydrophobicContact CB-CE2 4.35Å; D274-F322 WeakPolarHBondContact OD1-CE2 3.48Å; D274-G324 CarbonylContact C-O 3.55Å; D274-C325 WeakPolarHBondContact OD1-CB 3.44Å; D274-R347 IonicContact OD1-CZ 3.6Å; D274-R347 IonicContact OD1-NE 2.74Å; D274-R347 PolarHBondContact OD1-NE 2.52Å; D274-R347 VanDerWaalsContact OD1-NE 3.16Å; D274-R347 IonicContact OD1-NH2 3.61Å; D274-R347 PolarHBondContact OD1-NH2 2.96Å; D274-R347 IonicContact OD2-CZ 2.73Å; D274-R347 IonicContact OD2-NE 2.73Å; D274-R347 IonicContact OD2-NH2 3.4Å; D274-R347 PolarHBondContact OD2-NH2 2.93Å
275	I	92.1	Very high	75.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.9	170.5	-47.6	-174.9	0	0	0	108.1	A115 L118 P129 Y130 L273 L323 G324 L344 I357	A115-I275 HydrophobicContact CB-CD1 4.4Å; L118-I275 HydrophobicContact CD1-CG2 4.27Å; L118-I275 HydrophobicContact CD2-CD1 4.12Å; P129-I275 HydrophobicContact CB-CG2 4.14Å; Y130-I275 CarbonylContact O-C 3.47Å; Y130-I275 WeakPolarHBondContact O-CA 3.3Å; L273-I275 HydrophobicContact CD2-CG1 3.82Å; I275-L323 HydrophobicContact CB-CB 4.09Å; I275-L323 HydrophobicContact CG2-CB 3.98Å; I275-L323 HydrophobicContact CG2-CD1 3.99Å; I275-L323 WeakPolarHBondContact O-CB 3.37Å; I275-L323 PolarHBondContact O-N 3.03Å; I275-G324 PolarHBondContact N-O 3.24Å; I275-G324 PolarHBondContact O-N 3.2Å; I275-L344 HydrophobicContact CD1-CD1 3.74Å; I275-L344 HydrophobicContact CD1-CD2 3.65Å; I275-L344 HydrophobicContact CD1-CG 4.34Å; I275-L344 HydrophobicContact CG1-CD2 4.27Å; I275-I357 HydrophobicContact CD1-CB 4.4Å; I275-I357 HydrophobicContact CD1-CD1 3.95Å; I275-I357 HydrophobicContact CG1-CD1 4.48Å
276	W	89.9	Confident	74.3	Confident	48 Å²	48	57.1 Å²	57.1	18%	0.182	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151.8	-176	-65	93.7	0	0	0	110.4	P129 Y130 D320 D321 F322	P129-W276 CarbonylContact C-O 3.58Å; P129-W276 WeakPolarHBondContact CA-O 3.3Å; Y130-W276 HydrophobicContact CD1-CB 3.91Å; Y130-W276 WeakPolarHBondContact CD1-O 3.3Å; Y130-W276 HydrophobicContact CE1-CB 3.38Å; Y130-W276 HydrophobicContact CE1-CG 4.42Å; Y130-W276 HydrophobicContact CE2-CB 4.07Å; Y130-W276 HydrophobicContact CE2-CG 4.42Å; Y130-W276 HydrophobicContact CG-CB 4.46Å; Y130-W276 VanDerWaalsContact CZ-CB 3.47Å; Y130-W276 PolarHBondContact N-O 3.34Å; Y130-W276 PolarHBondContact O-N 3.43Å; W276-D320 HydrophobicContact CB-CB 4.49Å; W276-D320 HydrophobicContact CE3-CB 4.24Å; W276-D320 VanDerWaalsContact CZ3-O 3.3Å; W276-D320 WeakPolarHBondContact CZ3-O 3.3Å; W276-D321 CarbonylContact C-O 3.59Å; W276-D321 WeakPolarHBondContact CA-O 3.31Å; W276-F322 HydrophobicContact CE3-CB 4.02Å; W276-F322 HydrophobicContact CZ3-CB 3.93Å
277	D	87.6	Confident	73.3	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.1	175.6	-164.9	-1.9	0	0	0	109.3	K121 S127 D128 D279 D320 D321 L323	K121-D277 WeakPolarHBondContact CB-OD2 3.42Å; K121-D277 HydrophobicContact CG-CB 4.3Å; K121-D277 VanDerWaalsContact CG-OD2 3.26Å; K121-D277 WeakPolarHBondContact CG-OD2 3.4Å; S127-D277 WeakPolarHBondContact CA-OD1 3.4Å; S127-D277 WeakPolarHBondContact CA-OD2 3.25Å; S127-D277 VanDerWaalsContact CB-CG 3.44Å; S127-D277 WeakPolarHBondContact CB-OD1 3.24Å; S127-D277 WeakPolarHBondContact CB-OD2 3.26Å; S127-D277 PolarHBondContact OG-OD2 2.94Å; D128-D277 WeakPolarHBondContact CA-OD1 3.39Å; D128-D277 PolarHBondContact N-OD1 3.23Å; D277-D279 PolarHBondContact O-N 2.99Å; D277-D320 WeakPolarHBondContact O-CA 3.23Å; D277-D320 WeakPolarHBondContact O-CB 3.32Å; D277-D321 HydrophobicContact CB-CB 3.85Å; D277-D321 WeakPolarHBondContact CB-O 3.46Å; D277-D321 PolarHBondContact N-O 2.78Å; D277-D321 PolarHBondContact O-N 3.26Å; D277-D321 VanDerWaalsContact O-N 3.07Å; D277-L323 HydrophobicContact CB-CD1 3.9Å; D277-L323 HydrophobicContact CB-CD2 4.05Å; D277-L323 HydrophobicContact CB-CG 3.9Å
278	H	81	Confident	72.3	Confident	71 Å²	71	55.6 Å²	55.6	33%	0.329	29%	0.289	S	S	.	.			trans	-81.9	114	-174.3	-173.5	55.9	0	0	0	111.8	D128 Y130 V246 D320	D128-H278 HydrophobicContact CB-CB 4.11Å; D128-H278 PolarHBondContact O-N 3Å; Y130-H278 HydrophobicContact CD1-CB 4.04Å; Y130-H278 HydrophobicContact CE1-CB 4.07Å; V246-H278 HydrophobicContact CG1-CB 3.67Å; V246-H278 HydrophobicContact CG2-CB 4.03Å; H278-D320 IonicContact ND1-OD1 2.6Å; H278-D320 IonicContact ND1-OD2 3.69Å
279	D	74.6	Confident	71.1	Confident	32 Å²	32	62.8 Å²	62.8	17%	0.171	31%	0.31	C	S	.	.			trans	-94.1	106.7	-179.6	-74.8	-50.5	0	0	0	111.1	D277 D320	D277-D279 PolarHBondContact O-N 2.99Å; D279-D320 PolarHBondContact N-OD1 2.97Å
280	E	63.6	Low	69.8	Low	137 Å²	137	64 Å²	64	64%	0.64	32%	0.318	S	S	*	.			trans	-61.4	147.9	175.2	-80.6	-163.8	157.4	0	0	113.3	T282	E280-T282 PolarHBondContact O-N 3.35Å; E280-T282 PolarHBondContact O-OG1 3.07Å
281	E	56.2	Low	68.1	Low	165 Å²	165	64.4 Å²	64.4	77%	0.771	32%	0.324	S	S	*	.			trans	-60	89.3	176.4	-76.1	-166.5	151	0	0	112.6	S283	E281-S283 PolarHBondContact O-N 3.31Å
282	T	52.9	Low	66.6	Low	52 Å²	52	71.9 Å²	71.9	32%	0.319	36%	0.364	S	S	.	.			trans	-86.2	110.3	169.7	22.5	0	0	0	0	110.2	E280 V284 Q306	E280-T282 PolarHBondContact O-N 3.35Å; E280-T282 PolarHBondContact O-OG1 3.07Å; T282-V284 PolarHBondContact O-N 3.44Å; T282-Q306 PolarHBondContact OG1-NE2 2.89Å
283	S	51.7	Low	65	Low	67 Å²	67	77.6 Å²	77.6	47%	0.469	39%	0.391	S	S	.	.			trans	-54.8	133.8	168.4	174.8	0	0	0	0	109.7	E281 L285 E286 A287	E281-S283 PolarHBondContact O-N 3.31Å; S283-L285 PolarHBondContact O-N 3.18Å; S283-E286 WeakPolarHBondContact O-CA 3.45Å; S283-E286 WeakPolarHBondContact O-CB 3.3Å; S283-E286 PolarHBondContact O-N 2.92Å; S283-A287 PolarHBondContact O-N 3Å; S283-A287 VanDerWaalsContact O-N 3.1Å
284	V	52.9	Low	63.1	Low	83 Å²	83	79 Å²	79	50%	0.503	40%	0.398	S	S	.	.	H	α-helix	trans	-50.4	-32.1	-178	178.6	0	0	0	0	112	T282 V288	T282-V284 PolarHBondContact O-N 3.44Å; V284-V288 VanDerWaalsContact O-CG2 3.31Å; V284-V288 WeakPolarHBondContact O-CG2 3.23Å; V284-V288 PolarHBondContact O-N 2.99Å; V284-V288 VanDerWaalsContact O-N 3.17Å
285	L	51.8	Low	61.6	Low	128 Å²	128	90 Å²	90	67%	0.67	44%	0.438	S	S	*	.	H	α-helix	trans	-70.6	-32	177.4	-92.2	149.1	0	0	0	114	S283 R289	S283-L285 PolarHBondContact O-N 3.18Å; L285-R289 WeakPolarHBondContact O-CG 3.44Å
286	E	54.7	Low	59.7	Low	125 Å²	125	91.3 Å²	91.3	58%	0.584	45%	0.452	S	S	*	.	H	α-helix	trans	-77.9	-40.3	174.4	-109.8	166.9	169.5	0	0	111.4	S283 V288 R289 S290	S283-E286 WeakPolarHBondContact O-CA 3.45Å; S283-E286 WeakPolarHBondContact O-CB 3.3Å; S283-E286 PolarHBondContact O-N 2.92Å; E286-V288 VanDerWaalsContact C-N 3.26Å; E286-V288 PolarHBondContact O-N 3.46Å; E286-R289 WeakPolarHBondContact O-CB 3.47Å; E286-R289 PolarHBondContact O-N 3.42Å; E286-S290 PolarHBondContact O-N 3.5Å
287	A	53.2	Low	58.2	Low	4 Å²	4	95.2 Å²	95.2	3%	0.033	48%	0.481	C	S	.	.	H	α-helix	trans	-60.6	-33.7	174.6	0	0	0	0	0	112.5	S283 R289 S290 Y303 V307	S283-A287 PolarHBondContact O-N 3Å; S283-A287 VanDerWaalsContact O-N 3.1Å; A287-R289 VanDerWaalsContact C-N 3.3Å; A287-R289 PolarHBondContact O-N 2.84Å; A287-S290 PolarHBondContact O-OG 3.08Å; A287-Y303 WeakPolarHBondContact O-CE2 3.26Å; A287-Y303 PolarHBondContact O-OH 3.31Å; A287-V307 HydrophobicContact CB-CG2 4.4Å
288	V	53.4	Low	56.7	Low	88 Å²	88	104 Å²	104	53%	0.533	52%	0.519	S	S	.	.	H	α-helix	trans	-71.7	-24.7	174.9	173.6	0	0	0	0	112.2	V284 E286	V284-V288 VanDerWaalsContact O-CG2 3.31Å; V284-V288 WeakPolarHBondContact O-CG2 3.23Å; V284-V288 PolarHBondContact O-N 2.99Å; V284-V288 VanDerWaalsContact O-N 3.17Å; E286-V288 VanDerWaalsContact C-N 3.26Å; E286-V288 PolarHBondContact O-N 3.46Å
289	R	53	Low	55.4	Low	191 Å²	191	103.9 Å²	103.9	72%	0.721	52%	0.519	S	S	*	.	H	α-helix	trans	-80.6	-32.1	179.4	-72.1	176.8	178.5	-179.2	0.9	113.3	L285 E286 A287 L291	L285-R289 WeakPolarHBondContact O-CG 3.44Å; E286-R289 WeakPolarHBondContact O-CB 3.47Å; E286-R289 PolarHBondContact O-N 3.42Å; A287-R289 VanDerWaalsContact C-N 3.3Å; A287-R289 PolarHBondContact O-N 2.84Å; R289-L291 PolarHBondContact O-N 3.45Å
290	S	54.8	Low	54.2	Low	28 Å²	28	105.5 Å²	105.5	20%	0.196	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-73.2	-3.3	178.1	62.7	0	0	0	0	114.3	E286 A287 N292 E293	E286-S290 PolarHBondContact O-N 3.5Å; A287-S290 PolarHBondContact O-OG 3.08Å; S290-N292 PolarHBondContact O-N 2.98Å; S290-N292 VanDerWaalsContact O-N 3.12Å; S290-E293 WeakPolarHBondContact O-CB 3.3Å; S290-E293 PolarHBondContact O-N 3.17Å
291	L	49.7	Very low	53.8	Low	86 Å²	86	101 Å²	101	45%	0.45	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-56.7	-30	178.1	-140.6	160.9	0	0	0	112.5	R289 E293 Y303	R289-L291 PolarHBondContact O-N 3.45Å; L291-E293 PolarHBondContact O-N 3.42Å; L291-Y303 HydrophobicContact CD1-CE1 3.82Å; L291-Y303 VanDerWaalsContact CD1-OH 3.25Å; L291-Y303 WeakPolarHBondContact CD1-OH 3.3Å; L291-Y303 HydrophobicContact CG-CE1 3.67Å; L291-Y303 HydrophobicContact CG-CE2 4.43Å; L291-Y303 WeakPolarHBondContact CG-OH 3.43Å
292	N	55.9	Low	54.1	Low	156 Å²	156	96.1 Å²	96.1	83%	0.834	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-72.5	-13	177.8	-73.9	-16.4	0	0	0	114	S290	S290-N292 PolarHBondContact O-N 2.98Å; S290-N292 VanDerWaalsContact O-N 3.12Å
293	E	56.5	Low	54.2	Low	156 Å²	156	94.1 Å²	94.1	73%	0.729	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-93.2	-6.9	-174.9	-61.2	-177	169.4	0	0	113	S290 L291	S290-E293 WeakPolarHBondContact O-CB 3.3Å; S290-E293 PolarHBondContact O-N 3.17Å; L291-E293 PolarHBondContact O-N 3.42Å
294	I	51.4	Low	54.3	Low	29 Å²	29	97.5 Å²	97.5	15%	0.149	49%	0.485	C	S	.	.			trans	-93.5	110.8	-171.7	-57.2	158.7	0	0	0	110.6	Q299 L300 Y303	I294-Q299 HydrophobicContact CG2-CB 3.7Å; I294-L300 HydrophobicContact CG2-CB 4.22Å; I294-L300 HydrophobicContact CG2-CG 3.77Å; I294-Y303 VanDerWaalsContact CD1-CB 3.46Å; I294-Y303 HydrophobicContact CD1-CD1 3.9Å; I294-Y303 HydrophobicContact CD1-CD2 3.25Å; I294-Y303 HydrophobicContact CD1-CE1 4.48Å; I294-Y303 HydrophobicContact CD1-CE2 3.88Å; I294-Y303 HydrophobicContact CD1-CG 3.23Å
295	R	56.7	Low	54.7	Low	243 Å²	243	97.3 Å²	97.3	92%	0.917	48%	0.478	S	S	*	.			trans	-101.1	-8.6	-177.9	-67	-172.3	179.9	-168.7	1.5	114.9
296	G	51.7	Low	54.9	Low	28 Å²	28	93.2 Å²	93.2	29%	0.289	46%	0.455	S	S	.	.	S	Bend	trans	-134.8	150.3	-172.3	0	0	0	0	0	116	K298 Q299 L300	G296-K298 VanDerWaalsContact C-N 3.33Å; G296-K298 PolarHBondContact O-N 3.16Å; G296-Q299 WeakPolarHBondContact O-CB 2.99Å; G296-Q299 PolarHBondContact O-N 3.23Å; G296-Q299 VanDerWaalsContact O-N 3.11Å; G296-L300 PolarHBondContact O-N 2.96Å
297	V	59.1	Low	54.9	Low	130 Å²	130	89.4 Å²	89.4	79%	0.788	44%	0.44	S	S	*	.	H	α-helix	trans	-60	-36.6	-175.8	-172.1	0	0	0	0	113.1	L300 G301	V297-L300 WeakPolarHBondContact O-CB 3.46Å; V297-L300 PolarHBondContact O-N 3.48Å; V297-G301 PolarHBondContact O-N 3.2Å
298	K	56.7	Low	54.9	Low	184 Å²	184	91.5 Å²	91.5	80%	0.8	46%	0.455	S	S	*	.	H	α-helix	trans	-67.7	-41.4	175.4	-73.7	-173	178.2	-177.5	0	112.1	G296 L300 G301 R302	G296-K298 VanDerWaalsContact C-N 3.33Å; G296-K298 PolarHBondContact O-N 3.16Å; K298-L300 VanDerWaalsContact C-N 3.34Å; K298-G301 PolarHBondContact O-N 3.24Å; K298-R302 PolarHBondContact O-N 3.2Å
299	Q	52.9	Low	55.2	Low	70 Å²	70	89.9 Å²	89.9	33%	0.327	44%	0.441	S	S	.	.	H	α-helix	trans	-67.6	-36.7	175.5	-67.7	174.8	-31.4	0	0	111	I294 G296 G301 R302 Y303	I294-Q299 HydrophobicContact CG2-CB 3.7Å; G296-Q299 WeakPolarHBondContact O-CB 2.99Å; G296-Q299 PolarHBondContact O-N 3.23Å; G296-Q299 VanDerWaalsContact O-N 3.11Å; Q299-G301 VanDerWaalsContact C-N 3.35Å; Q299-G301 PolarHBondContact O-N 3.19Å; Q299-R302 PolarHBondContact O-N 2.78Å; Q299-Y303 WeakPolarHBondContact O-CB 3.15Å; Q299-Y303 PolarHBondContact O-N 2.71Å
300	L	50	Low	55.3	Low	65 Å²	65	81.7 Å²	81.7	34%	0.34	41%	0.414	S	S	.	.	H	α-helix	trans	-59.8	-42.1	170.5	-104	155.7	0	0	0	112	I294 G296 V297 K298 Y303 F304	I294-L300 HydrophobicContact CG2-CB 4.22Å; I294-L300 HydrophobicContact CG2-CG 3.77Å; G296-L300 PolarHBondContact O-N 2.96Å; V297-L300 WeakPolarHBondContact O-CB 3.46Å; V297-L300 PolarHBondContact O-N 3.48Å; K298-L300 VanDerWaalsContact C-N 3.34Å; L300-Y303 WeakPolarHBondContact O-CB 3.23Å; L300-Y303 PolarHBondContact O-N 3.47Å; L300-F304 HydrophobicContact CD2-CD2 4.13Å; L300-F304 HydrophobicContact CD2-CE2 3.72Å; L300-F304 VanDerWaalsContact O-CD2 3.3Å; L300-F304 WeakPolarHBondContact O-CD2 3.19Å; L300-F304 PolarHBondContact O-N 2.94Å
301	G	55.2	Low	55.3	Low	44 Å²	44	84 Å²	84	45%	0.454	44%	0.435	S	S	.	.	H	α-helix	trans	-60.4	-43.2	175	0	0	0	0	0	112.8	V297 K298 Q299 K305	V297-G301 PolarHBondContact O-N 3.2Å; K298-G301 PolarHBondContact O-N 3.24Å; Q299-G301 VanDerWaalsContact C-N 3.35Å; Q299-G301 PolarHBondContact O-N 3.19Å; G301-K305 PolarHBondContact O-N 3.43Å; G301-K305 VanDerWaalsContact O-N 3.12Å
302	R	62.1	Low	55.4	Low	62 Å²	62	88.8 Å²	88.8	23%	0.234	45%	0.446	C	S	.	.	H	α-helix	trans	-67.1	-38.1	175.4	-63.8	175.7	-175.6	-146.8	-6	111.8	A120 K121 D122 L123 K298 Q299 K305 Q306	A120-R302 VanDerWaalsContact C-CZ 3.5Å; A120-R302 VanDerWaalsContact C-NH2 3.34Å; A120-R302 VanDerWaalsContact CB-NH2 3.32Å; A120-R302 PolarHBondContact O-NH1 3.35Å; A120-R302 PolarHBondContact O-NH2 3.48Å; K121-R302 VanDerWaalsContact O-CD 3.28Å; K121-R302 WeakPolarHBondContact O-CD 3.37Å; K121-R302 WeakPolarHBondContact O-CG 3.07Å; D122-R302 WeakPolarHBondContact O-CD 3.38Å; D122-R302 PolarHBondContact O-NH1 3.47Å; L123-R302 HydrophobicContact CD2-CB 3.63Å; K298-R302 PolarHBondContact O-N 3.2Å; Q299-R302 PolarHBondContact O-N 2.78Å; R302-K305 WeakPolarHBondContact O-CB 3.24Å; R302-K305 PolarHBondContact O-N 3.5Å; R302-Q306 PolarHBondContact O-N 2.82Å
303	Y	54.8	Low	55.2	Low	10 Å²	10	84.8 Å²	84.8	4%	0.039	42%	0.422	C	S	.	.	H	α-helix	trans	-61	-50.2	174.8	177.6	-100.6	0	0	0	112.8	L123 A287 L291 I294 Q299 L300 K305 Q306 V307	L123-Y303 HydrophobicContact CD1-CD2 4.03Å; A287-Y303 WeakPolarHBondContact O-CE2 3.26Å; A287-Y303 PolarHBondContact O-OH 3.31Å; L291-Y303 HydrophobicContact CD1-CE1 3.82Å; L291-Y303 VanDerWaalsContact CD1-OH 3.25Å; L291-Y303 WeakPolarHBondContact CD1-OH 3.3Å; L291-Y303 HydrophobicContact CG-CE1 3.67Å; L291-Y303 HydrophobicContact CG-CE2 4.43Å; L291-Y303 WeakPolarHBondContact CG-OH 3.43Å; I294-Y303 VanDerWaalsContact CD1-CB 3.46Å; I294-Y303 HydrophobicContact CD1-CD1 3.9Å; I294-Y303 HydrophobicContact CD1-CD2 3.25Å; I294-Y303 HydrophobicContact CD1-CE1 4.48Å; I294-Y303 HydrophobicContact CD1-CE2 3.88Å; I294-Y303 HydrophobicContact CD1-CG 3.23Å; Q299-Y303 WeakPolarHBondContact O-CB 3.15Å; Q299-Y303 PolarHBondContact O-N 2.71Å; L300-Y303 WeakPolarHBondContact O-CB 3.23Å; L300-Y303 PolarHBondContact O-N 3.47Å; Y303-K305 PolarHBondContact O-N 2.85Å; Y303-Q306 PolarHBondContact O-N 3.39Å; Y303-V307 HydrophobicContact CD1-CG2 4.24Å; Y303-V307 HydrophobicContact CD2-CG2 4.32Å; Y303-V307 HydrophobicContact CE1-CG2 3.77Å; Y303-V307 HydrophobicContact CE2-CG2 3.9Å; Y303-V307 HydrophobicContact CG-CG2 4.49Å; Y303-V307 WeakPolarHBondContact O-CG2 3.3Å; Y303-V307 PolarHBondContact O-N 3.07Å
304	F	54.8	Low	54.9	Low	137 Å²	137	85.1 Å²	85.1	60%	0.601	43%	0.428	S	S	*	.	H	α-helix	trans	-60.9	-34.3	176.1	-87.8	-71.1	0	0	0	111.8	L300 S308	L300-F304 HydrophobicContact CD2-CD2 4.13Å; L300-F304 HydrophobicContact CD2-CE2 3.72Å; L300-F304 VanDerWaalsContact O-CD2 3.3Å; L300-F304 WeakPolarHBondContact O-CD2 3.19Å; L300-F304 PolarHBondContact O-N 2.94Å; F304-S308 WeakPolarHBondContact O-CB 3.48Å; F304-S308 PolarHBondContact O-N 3.19Å; F304-S308 PolarHBondContact O-OG 2.85Å
305	K	59.8	Low	54.8	Low	79 Å²	79	92.5 Å²	92.5	34%	0.343	46%	0.463	S	S	.	.	H	α-helix	trans	-65.7	-50.8	174.2	-166.4	-171.9	171.8	-166.9	0	111.1	G301 R302 Y303 V307 S308 Q309 D321	G301-K305 PolarHBondContact O-N 3.43Å; G301-K305 VanDerWaalsContact O-N 3.12Å; R302-K305 WeakPolarHBondContact O-CB 3.24Å; R302-K305 PolarHBondContact O-N 3.5Å; Y303-K305 PolarHBondContact O-N 2.85Å; K305-V307 PolarHBondContact O-N 2.74Å; K305-S308 WeakPolarHBondContact CA-OG 3.35Å; K305-S308 CarbonylContact O-C 3.43Å; K305-S308 WeakPolarHBondContact O-CA 3.47Å; K305-S308 PolarHBondContact O-N 2.97Å; K305-S308 PolarHBondContact O-OG 2.75Å; K305-Q309 PolarHBondContact O-N 3.44Å; K305-Q309 PolarHBondContact O-OE1 3.17Å; K305-D321 IonicContact NZ-OD1 2.71Å; K305-D321 PolarHBondContact NZ-OD1 3.4Å; K305-D321 IonicContact NZ-OD2 3.21Å; K305-D321 PolarHBondContact NZ-OD2 3Å
306	Q	56.8	Low	54.3	Low	43 Å²	43	85.2 Å²	85.2	20%	0.201	45%	0.445	C	S	.	.	H	α-helix	trans	-56.9	-50.1	178.5	-162	177.9	16.5	0	0	110.8	L123 T282 R302 Y303 S308 Q309 S310	L123-Q306 VanDerWaalsContact CG-OE1 3.27Å; T282-Q306 PolarHBondContact OG1-NE2 2.89Å; R302-Q306 PolarHBondContact O-N 2.82Å; Y303-Q306 PolarHBondContact O-N 3.39Å; Q306-S308 VanDerWaalsContact C-N 3.31Å; Q306-S308 PolarHBondContact O-N 3Å; Q306-Q309 PolarHBondContact O-N 2.83Å; Q306-Q309 VanDerWaalsContact O-N 3.17Å; Q306-S310 PolarHBondContact O-N 3.28Å; Q306-S310 PolarHBondContact O-OG 2.84Å
307	V	54.4	Low	54.1	Low	44 Å²	44	86.7 Å²	86.7	27%	0.267	46%	0.46	S	S	.	.	H	α-helix	trans	-60.4	-38.1	175.7	175.3	0	0	0	0	112	A287 Y303 K305 S310 A311	A287-V307 HydrophobicContact CB-CG2 4.4Å; Y303-V307 HydrophobicContact CD1-CG2 4.24Å; Y303-V307 HydrophobicContact CD2-CG2 4.32Å; Y303-V307 HydrophobicContact CE1-CG2 3.77Å; Y303-V307 HydrophobicContact CE2-CG2 3.9Å; Y303-V307 HydrophobicContact CG-CG2 4.49Å; Y303-V307 WeakPolarHBondContact O-CG2 3.3Å; Y303-V307 PolarHBondContact O-N 3.07Å; K305-V307 PolarHBondContact O-N 2.74Å; V307-S310 WeakPolarHBondContact CA-OG 3.28Å; V307-A311 WeakPolarHBondContact O-CB 3.37Å; V307-A311 PolarHBondContact O-N 3.09Å
308	S	53.9	Low	53.7	Low	49 Å²	49	85.2 Å²	85.2	34%	0.343	45%	0.448	S	S	.	.	H	α-helix	trans	-70	-35.2	176.9	79.1	0	0	0	0	113.1	F304 K305 Q306 R312	F304-S308 WeakPolarHBondContact O-CB 3.48Å; F304-S308 PolarHBondContact O-N 3.19Å; F304-S308 PolarHBondContact O-OG 2.85Å; K305-S308 WeakPolarHBondContact CA-OG 3.35Å; K305-S308 CarbonylContact O-C 3.43Å; K305-S308 WeakPolarHBondContact O-CA 3.47Å; K305-S308 PolarHBondContact O-N 2.97Å; K305-S308 PolarHBondContact O-OG 2.75Å; Q306-S308 VanDerWaalsContact C-N 3.31Å; Q306-S308 PolarHBondContact O-N 3Å; S308-R312 WeakPolarHBondContact O-CG 3.5Å; S308-R312 PolarHBondContact O-N 3.19Å
309	Q	59.2	Low	54.1	Low	53 Å²	53	83.5 Å²	83.5	25%	0.248	45%	0.445	C	S	.	.	H	α-helix	trans	-68.8	-45.4	173.2	-85.8	162.8	-47.1	0	0	110.2	K305 Q306 A311 R312 K313	K305-Q309 PolarHBondContact O-N 3.44Å; K305-Q309 PolarHBondContact O-OE1 3.17Å; Q306-Q309 PolarHBondContact O-N 2.83Å; Q306-Q309 VanDerWaalsContact O-N 3.17Å; Q309-A311 VanDerWaalsContact C-N 3.28Å; Q309-A311 PolarHBondContact O-N 2.81Å; Q309-R312 PolarHBondContact O-N 3.48Å; Q309-K313 PolarHBondContact O-N 3.18Å; Q309-K313 VanDerWaalsContact O-N 3.1Å
310	S	55.5	Low	55.3	Low	20 Å²	20	81.7 Å²	81.7	14%	0.14	44%	0.437	C	S	.	.	H	α-helix	trans	-61.9	-35.2	176.6	-1	0	0	0	0	112.2	Q306 V307 R312	Q306-S310 PolarHBondContact O-N 3.28Å; Q306-S310 PolarHBondContact O-OG 2.84Å; V307-S310 WeakPolarHBondContact CA-OG 3.28Å; S310-R312 VanDerWaalsContact C-N 3.32Å; S310-R312 PolarHBondContact O-N 2.83Å
311	A	53.1	Low	56.9	Low	77 Å²	77	79.5 Å²	79.5	64%	0.636	43%	0.426	S	S	*	.	H	α-helix	trans	-70.2	-25.8	176	0	0	0	0	0	113.7	V307 Q309	V307-A311 WeakPolarHBondContact O-CB 3.37Å; V307-A311 PolarHBondContact O-N 3.09Å; Q309-A311 VanDerWaalsContact C-N 3.28Å; Q309-A311 PolarHBondContact O-N 2.81Å
312	R	52.6	Low	58.3	Low	185 Å²	185	78.9 Å²	78.9	70%	0.698	41%	0.411	S	S	*	.	H	α-helix	trans	-93.3	-14.4	-178.9	-71.2	177.4	-177.3	-169.4	2.5	114	S308 Q309 S310 N314 Q315	S308-R312 WeakPolarHBondContact O-CG 3.5Å; S308-R312 PolarHBondContact O-N 3.19Å; Q309-R312 PolarHBondContact O-N 3.48Å; S310-R312 VanDerWaalsContact C-N 3.32Å; S310-R312 PolarHBondContact O-N 2.83Å; R312-N314 PolarHBondContact O-N 3.19Å; R312-Q315 PolarHBondContact O-N 3.14Å
313	K	51.7	Low	59.5	Low	72 Å²	72	75.9 Å²	75.9	31%	0.313	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-23.6	-177.9	-96.7	-166.8	-174.4	-167.1	0	114.8	Q309 Q315 D318	Q309-K313 PolarHBondContact O-N 3.18Å; Q309-K313 VanDerWaalsContact O-N 3.1Å; K313-Q315 PolarHBondContact O-N 2.87Å; K313-D318 WeakPolarHBondContact CE-OD1 3.21Å; K313-D318 IonicContact NZ-OD1 3.84Å; K313-D318 PolarHBondContact NZ-OD1 3.03Å
314	N	50.8	Low	61.1	Low	163 Å²	163	75.4 Å²	75.4	87%	0.872	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.8	176.9	-77.2	-5.9	0	0	0	114.9	R312	R312-N314 PolarHBondContact O-N 3.19Å
315	Q	49	Very low	62.9	Low	185 Å²	185	69.2 Å²	69.2	86%	0.864	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.8	-20.2	-179.6	-67.8	-177.3	3	0	0	114.3	R312 K313	R312-Q315 PolarHBondContact O-N 3.14Å; K313-Q315 PolarHBondContact O-N 2.87Å
316	T	46.4	Very low	64.3	Low	89 Å²	89	65.9 Å²	65.9	55%	0.546	36%	0.357	S	S	.	.	S	Bend	trans	-143.3	108.1	179.9	49.4	0	0	0	0	107
317	G	46.5	Very low	65.9	Low	59 Å²	59	66.6 Å²	66.6	61%	0.608	37%	0.365	S	S	*	.			trans	-57.2	161.3	-180	0	0	0	0	0	113.1	M319	G317-M319 PolarHBondContact O-N 2.83Å
318	D	52.4	Low	67.5	Low	100 Å²	100	65.2 Å²	65.2	54%	0.535	36%	0.356	S	S	.	.			trans	-14.8	114.7	-179.6	-73.8	-22	0	0	0	115.7	K313	K313-D318 WeakPolarHBondContact CE-OD1 3.21Å; K313-D318 IonicContact NZ-OD1 3.84Å; K313-D318 PolarHBondContact NZ-OD1 3.03Å
319	M	63.7	Low	69.1	Low	148 Å²	148	64.7 Å²	64.7	73%	0.729	35%	0.349	S	S	*	.			trans	-127.5	98.7	171.1	-74.2	-158.1	134.7	0	0	109.9	G317	G317-M319 PolarHBondContact O-N 2.83Å
320	D	78.6	Confident	70.3	Confident	31 Å²	31	62.2 Å²	62.2	17%	0.166	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-54.8	152.2	165.8	-73.9	-9.3	0	0	0	111.5	Y130 W276 D277 H278 D279	Y130-D320 HydrophobicContact CE1-CB 4.36Å; Y130-D320 WeakPolarHBondContact CE1-OD2 3.31Å; Y130-D320 VanDerWaalsContact CZ-OD2 3.24Å; Y130-D320 PolarHBondContact OH-OD2 3.47Å; W276-D320 HydrophobicContact CB-CB 4.49Å; W276-D320 HydrophobicContact CE3-CB 4.24Å; W276-D320 VanDerWaalsContact CZ3-O 3.3Å; W276-D320 WeakPolarHBondContact CZ3-O 3.3Å; D277-D320 WeakPolarHBondContact O-CA 3.23Å; D277-D320 WeakPolarHBondContact O-CB 3.32Å; H278-D320 IonicContact ND1-OD1 2.6Å; H278-D320 IonicContact ND1-OD2 3.69Å; D279-D320 PolarHBondContact N-OD1 2.97Å
321	D	83.4	Confident	71.5	Confident	20 Å²	20	66.1 Å²	66.1	11%	0.107	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	125.3	-174.7	-97.4	-19.3	0	0	0	112	K121 W276 D277 K305 L323	K121-D321 HydrophobicContact CB-CB 4.23Å; K121-D321 WeakPolarHBondContact CB-OD2 3.46Å; K121-D321 HydrophobicContact CD-CB 4.22Å; K121-D321 HydrophobicContact CG-CB 3.86Å; W276-D321 CarbonylContact C-O 3.59Å; W276-D321 WeakPolarHBondContact CA-O 3.31Å; D277-D321 HydrophobicContact CB-CB 3.85Å; D277-D321 WeakPolarHBondContact CB-O 3.46Å; D277-D321 PolarHBondContact N-O 2.78Å; D277-D321 PolarHBondContact O-N 3.26Å; D277-D321 VanDerWaalsContact O-N 3.07Å; K305-D321 IonicContact NZ-OD1 2.71Å; K305-D321 PolarHBondContact NZ-OD1 3.4Å; K305-D321 IonicContact NZ-OD2 3.21Å; K305-D321 PolarHBondContact NZ-OD2 3Å; D321-L323 PolarHBondContact O-N 3.12Å
322	F	84.7	Confident	73	Confident	30 Å²	30	66 Å²	66	13%	0.132	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	126.4	177.7	176.5	-103.7	0	0	0	111.8	D274 W276 G324 C325 R347 V353	D274-F322 HydrophobicContact CB-CE2 4.35Å; D274-F322 WeakPolarHBondContact OD1-CE2 3.48Å; W276-F322 HydrophobicContact CE3-CB 4.02Å; W276-F322 HydrophobicContact CZ3-CB 3.93Å; F322-G324 VanDerWaalsContact CE2-C 3.44Å; F322-G324 VanDerWaalsContact CE2-O 3.25Å; F322-G324 WeakPolarHBondContact CE2-O 3.5Å; F322-C325 HydrophobicContact CE2-CB 3.98Å; F322-C325 HydrophobicContact CZ-CB 3.83Å; F322-R347 HydrophobicContact CE1-CB 4.47Å; F322-R347 HydrophobicContact CE1-CG 4.06Å; F322-R347 HydrophobicContact CE2-CG 3.94Å; F322-R347 HydrophobicContact CZ-CB 4.44Å; F322-R347 HydrophobicContact CZ-CG 3.59Å; F322-V353 HydrophobicContact CD1-CG2 4.3Å; F322-V353 HydrophobicContact CE1-CG2 3.74Å
323	L	87.5	Confident	74.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-28.9	-178.9	-66.2	-178.9	0	0	0	113.6	L118 E119 K121 P129 I275 D277 D321 V353	L118-L323 HydrophobicContact CD1-CD1 4.29Å; E119-L323 WeakPolarHBondContact O-CD2 3.49Å; K121-L323 HydrophobicContact CD-CD2 4.37Å; K121-L323 HydrophobicContact CG-CD2 3.68Å; P129-L323 HydrophobicContact CB-CD1 3.89Å; I275-L323 HydrophobicContact CB-CB 4.09Å; I275-L323 HydrophobicContact CG2-CB 3.98Å; I275-L323 HydrophobicContact CG2-CD1 3.99Å; I275-L323 WeakPolarHBondContact O-CB 3.37Å; I275-L323 PolarHBondContact O-N 3.03Å; D277-L323 HydrophobicContact CB-CD1 3.9Å; D277-L323 HydrophobicContact CB-CD2 4.05Å; D277-L323 HydrophobicContact CB-CG 3.9Å; D321-L323 PolarHBondContact O-N 3.12Å; L323-V353 VanDerWaalsContact O-CG1 3.25Å; L323-V353 WeakPolarHBondContact O-CG1 3.43Å
324	G	89.3	Confident	75.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.6	167.2	179.9	0	0	0	0	0	112.8	D274 I275 F322	D274-G324 CarbonylContact C-O 3.55Å; I275-G324 PolarHBondContact N-O 3.24Å; I275-G324 PolarHBondContact O-N 3.2Å; F322-G324 VanDerWaalsContact CE2-C 3.44Å; F322-G324 VanDerWaalsContact CE2-O 3.25Å; F322-G324 WeakPolarHBondContact CE2-O 3.5Å
325	C	90.7	Very high	77.2	Confident	7 Å²	7	47.8 Å²	47.8	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	163.1	175.2	68.5	0	0	0	0	112.9	L273 D274 F322 E345	L273-C325 CarbonylContact O-C 3.54Å; L273-C325 WeakPolarHBondContact O-CA 3.37Å; L273-C325 VanDerWaalsContact O-CB 3.27Å; L273-C325 WeakPolarHBondContact O-CB 3.45Å; D274-C325 WeakPolarHBondContact OD1-CB 3.44Å; F322-C325 HydrophobicContact CE2-CB 3.98Å; F322-C325 HydrophobicContact CZ-CB 3.83Å; C325-E345 PolarHBondContact N-O 3.46Å; C325-E345 PolarHBondContact O-N 3.06Å; C325-E345 PolarHBondContact SG-O 3.36Å
326	V	90.9	Very high	78.5	Confident	9 Å²	9	43.4 Å²	43.4	6%	0.055	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.1	172.2	63.3	0	0	0	0	109.3	L273 I328 F342 I357 L359	L273-V326 HydrophobicContact CB-CG1 3.85Å; L273-V326 HydrophobicContact CD2-CG1 4.22Å; L273-V326 PolarHBondContact N-O 3.38Å; L273-V326 PolarHBondContact O-N 2.96Å; V326-I328 HydrophobicContact CG2-CD1 4.24Å; V326-I328 HydrophobicContact CG2-CG1 3.98Å; V326-F342 HydrophobicContact CG2-CB 3.66Å; V326-F342 HydrophobicContact CG2-CD1 4.19Å; V326-F342 HydrophobicContact CG2-CG 4.07Å; V326-I357 HydrophobicContact CG1-CG2 4.08Å; V326-L359 HydrophobicContact CG1-CD1 4.14Å
327	T	89.2	Confident	80.1	Confident	58 Å²	58	40 Å²	40	36%	0.356	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.1	174.4	-49	0	0	0	0	109.7	I136 K270 L271 H272	I136-T327 HydrophobicContact CD1-CG2 4.34Å; K270-T327 HydrophobicContact CB-CG2 3.97Å; K270-T327 HydrophobicContact CD-CG2 4.06Å; L271-T327 CarbonylContact O-C 3.6Å; L271-T327 VanDerWaalsContact O-CA 3.25Å; L271-T327 WeakPolarHBondContact O-CA 3.21Å; H272-T327 PolarHBondContact CE1-OG1 3.36Å; H272-T327 PolarHBondContact ND1-OG1 2.93Å
328	I	88.4	Confident	81.9	Confident	14 Å²	14	39.4 Å²	39.4	7%	0.072	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.2	-175.4	-57.1	172.7	0	0	0	109.1	K270 L271 V326 I330 I333 F342 L359 L361	K270-I328 CarbonylContact C-O 3.42Å; K270-I328 WeakPolarHBondContact CA-O 3.33Å; L271-I328 HydrophobicContact CB-CB 4.38Å; L271-I328 HydrophobicContact CD2-CD1 4.36Å; L271-I328 PolarHBondContact N-O 2.69Å; L271-I328 PolarHBondContact O-N 3.3Å; V326-I328 HydrophobicContact CG2-CD1 4.24Å; V326-I328 HydrophobicContact CG2-CG1 3.98Å; I328-I330 PolarHBondContact O-N 3.31Å; I328-I333 HydrophobicContact CG2-CG1 4.39Å; I328-F342 HydrophobicContact CD1-CD1 3.73Å; I328-F342 HydrophobicContact CD1-CD2 4.18Å; I328-F342 HydrophobicContact CD1-CE1 3.39Å; I328-F342 HydrophobicContact CD1-CE2 3.89Å; I328-F342 HydrophobicContact CD1-CG 4.11Å; I328-F342 HydrophobicContact CD1-CZ 3.47Å; I328-F342 VanDerWaalsContact CD1-CZ 3.47Å; I328-F342 HydrophobicContact CG1-CD1 4.13Å; I328-F342 HydrophobicContact CG1-CE1 3.93Å; I328-F342 HydrophobicContact CG1-CZ 4.46Å; I328-L359 HydrophobicContact CD1-CD1 4.14Å; I328-L361 HydrophobicContact CD1-CD1 3.68Å; I328-L361 HydrophobicContact CG2-CD1 4.2Å
329	D	86.8	Confident	83.8	Confident	39 Å²	39	39.8 Å²	39.8	21%	0.209	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	121.3	175.2	-81.9	9.1	0	0	0	109.7	K270 K331 D332	K270-D329 VanDerWaalsContact CD-OD1 3.24Å; K270-D329 WeakPolarHBondContact CD-OD1 3.22Å; K270-D329 WeakPolarHBondContact CE-OD1 3.41Å; K270-D329 WeakPolarHBondContact CG-OD1 3.39Å; K270-D329 IonicContact NZ-OD1 3.91Å; K270-D329 PolarHBondContact NZ-OD1 2.86Å; K270-D329 IonicContact NZ-OD2 3.02Å; D329-K331 VanDerWaalsContact C-N 3.28Å; D329-K331 HydrophobicContact CB-CG 4.2Å; D329-K331 PolarHBondContact O-N 3.18Å; D329-K331 VanDerWaalsContact OD2-CE 3.29Å; D329-K331 WeakPolarHBondContact OD2-CE 3.45Å; D329-K331 IonicContact OD2-NZ 3.95Å; D329-K331 PolarHBondContact OD2-NZ 3.27Å; D329-D332 PolarHBondContact O-N 2.91Å; D329-D332 VanDerWaalsContact O-N 3.07Å
330	I	85.6	Confident	85.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-63.4	-36.3	-173.7	-60.4	-59.1	0	0	0	111.8	L108 I135 L263 I266 D269 L271 I328 D332 I333 L363	L108-I330 HydrophobicContact CD1-CD1 4.44Å; L108-I330 HydrophobicContact CD2-CD1 3.61Å; I135-I330 HydrophobicContact CD1-CD1 4.48Å; L263-I330 HydrophobicContact CD1-CG2 3.75Å; L263-I330 HydrophobicContact CD2-CD1 4.25Å; L263-I330 HydrophobicContact CD2-CG1 4.13Å; L263-I330 HydrophobicContact CD2-CG2 4.45Å; I266-I330 HydrophobicContact CG2-CG2 4.17Å; D269-I330 HydrophobicContact CB-CG1 4.22Å; D269-I330 WeakPolarHBondContact O-CB 3.34Å; D269-I330 VanDerWaalsContact O-CG1 3.24Å; D269-I330 WeakPolarHBondContact O-CG1 3.18Å; D269-I330 PolarHBondContact O-N 3.03Å; L271-I330 HydrophobicContact CB-CD1 3.91Å; I328-I330 PolarHBondContact O-N 3.31Å; I330-D332 PolarHBondContact O-N 3.19Å; I330-D332 VanDerWaalsContact O-N 3.11Å; I330-I333 HydrophobicContact CD1-CD1 4.01Å; I330-I333 WeakPolarHBondContact O-CB 3.3Å; I330-I333 PolarHBondContact O-N 2.81Å; I330-I333 VanDerWaalsContact O-N 3.14Å; I330-L363 HydrophobicContact CG2-CD2 4.11Å
331	K	81.1	Confident	85.9	Confident	103 Å²	103	37.1 Å²	37.1	45%	0.448	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-57.7	-20.8	175.3	69.1	-174.2	177.4	-169.9	0	114.6	I266 D329	I266-K331 PolarHBondContact O-N 2.83Å; D329-K331 VanDerWaalsContact C-N 3.28Å; D329-K331 HydrophobicContact CB-CG 4.2Å; D329-K331 PolarHBondContact O-N 3.18Å; D329-K331 VanDerWaalsContact OD2-CE 3.29Å; D329-K331 WeakPolarHBondContact OD2-CE 3.45Å; D329-K331 IonicContact OD2-NZ 3.95Å; D329-K331 PolarHBondContact OD2-NZ 3.27Å
332	D	83.7	Confident	86.3	Confident	74 Å²	74	37.7 Å²	37.7	40%	0.396	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-92.6	-5.2	-177.9	-75.5	-50.8	0	0	0	113.3	K64 D329 I330 P334	K64-D332 IonicContact NZ-OD1 2.67Å; K64-D332 PolarHBondContact NZ-OD1 3.1Å; D329-D332 PolarHBondContact O-N 2.91Å; D329-D332 VanDerWaalsContact O-N 3.07Å; I330-D332 PolarHBondContact O-N 3.19Å; I330-D332 VanDerWaalsContact O-N 3.11Å; D332-P334 WeakPolarHBondContact O-CD 3.4Å
333	I	84.3	Confident	86.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.229	C	C	.	.	S	Bend	trans	-74.6	120.7	177.4	-58.4	176.1	0	0	0	109.1	G63 K64 L108 I328 I330 L338 L361 L363	G63-I333 CarbonylContact C-O 3.5Å; G63-I333 WeakPolarHBondContact CA-O 3.12Å; K64-I333 PolarHBondContact N-O 3.07Å; L108-I333 HydrophobicContact CD1-CD1 3.54Å; I328-I333 HydrophobicContact CG2-CG1 4.39Å; I330-I333 HydrophobicContact CD1-CD1 4.01Å; I330-I333 WeakPolarHBondContact O-CB 3.3Å; I330-I333 PolarHBondContact O-N 2.81Å; I330-I333 VanDerWaalsContact O-N 3.14Å; I333-L338 HydrophobicContact CG2-CB 4.31Å; I333-L361 HydrophobicContact CD1-CB 4.35Å; I333-L361 HydrophobicContact CD1-CD1 4.04Å; I333-L361 HydrophobicContact CG1-CD1 4.48Å; I333-L363 HydrophobicContact CB-CD1 4.28Å; I333-L363 HydrophobicContact CG2-CD1 4.28Å; I333-L363 HydrophobicContact CG2-CG 4.24Å
334	P	81.8	Confident	86.9	Confident	31 Å²	31	44.2 Å²	44.2	20%	0.201	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-61.2	150.1	175.3	-21.8	34.4	0	0	0	112	K64 D332 T336 G337	K64-P334 WeakPolarHBondContact O-CA 3.34Å; D332-P334 WeakPolarHBondContact O-CD 3.4Å; P334-T336 PolarHBondContact O-N 2.79Å; P334-G337 PolarHBondContact O-N 3.1Å
335	S	76.3	Confident	86.8	Confident	7 Å²	7	50.2 Å²	50.2	5%	0.049	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.8	175.7	62.2	0	0	0	0	113	I62 K64 G337 H418 I422	I62-S335 WeakPolarHBondContact O-CB 3.13Å; K64-S335 PolarHBondContact O-N 2.87Å; S335-G337 PolarHBondContact O-N 2.92Å; S335-H418 PolarHBondContact OG-CD2 2.84Å; S335-H418 PolarHBondContact OG-NE2 2.99Å; S335-I422 WeakPolarHBondContact O-CD1 3.48Å
336	T	76.8	Confident	86.5	Confident	93 Å²	93	51.4 Å²	51.4	57%	0.571	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.4	174.7	52.3	0	0	0	0	114.4	P334	P334-T336 PolarHBondContact O-N 2.79Å
337	G	81.5	Confident	85.7	Confident	18 Å²	18	56.3 Å²	56.3	19%	0.186	29%	0.29	C	S	.	.			trans	89.9	165.1	-170.1	0	0	0	0	0	113.3	P334 S335 L361	P334-G337 PolarHBondContact O-N 3.1Å; S335-G337 PolarHBondContact O-N 2.92Å; G337-L361 CarbonylContact C-O 3.58Å; G337-L361 WeakPolarHBondContact CA-O 3.35Å
338	L	84	Confident	85	Confident	46 Å²	46	56.3 Å²	56.3	24%	0.241	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	111.1	-178.9	179.9	61.3	0	0	0	109.2	I333 F342 A360 L361	I333-L338 HydrophobicContact CG2-CB 4.31Å; L338-F342 HydrophobicContact CD2-CE1 4.2Å; L338-F342 HydrophobicContact CD2-CZ 3.7Å; L338-F342 HydrophobicContact CG-CZ 4.15Å; L338-A360 CarbonylContact O-C 3.58Å; L338-A360 WeakPolarHBondContact O-CA 2.81Å; L338-L361 HydrophobicContact CB-CB 4.32Å; L338-L361 HydrophobicContact CD2-CD1 4.33Å; L338-L361 PolarHBondContact N-O 3.46Å; L338-L361 PolarHBondContact O-N 3.29Å
339	D	90.9	Very high	84	Confident	107 Å²	107	64.2 Å²	64.2	57%	0.572	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	104.3	175.3	-174.4	-3.6	0	0	0	108.8	H358 A360	D339-H358 IonicContact OD1-CD2 3.51Å; D339-H358 PolarHBondContact OD1-CD2 3.44Å; D339-H358 IonicContact OD1-CE1 2.68Å; D339-H358 IonicContact OD1-NE2 3.68Å; D339-H358 PolarHBondContact OD1-NE2 3.22Å; D339-A360 HydrophobicContact CB-CB 4.25Å
340	S	91.8	Very high	83.1	Confident	34 Å²	34	73.5 Å²	73.5	24%	0.238	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	163	-172.2	61	0	0	0	0	114.8	F342 H358 L359	S340-F342 WeakPolarHBondContact O-CD2 3.38Å; S340-F342 VanDerWaalsContact O-CE2 3.28Å; S340-F342 WeakPolarHBondContact O-CE2 3.37Å; S340-F342 VanDerWaalsContact OG-CE2 3.22Å; S340-F342 WeakPolarHBondContact OG-CE2 3.46Å; S340-F342 WeakPolarHBondContact OG-CZ 3.38Å; S340-H358 PolarHBondContact O-CD2 3.16Å; S340-L359 PolarHBondContact N-O 2.91Å; S340-L359 VanDerWaalsContact N-O 3.1Å; S340-L359 PolarHBondContact O-N 3.17Å; S340-L359 VanDerWaalsContact O-N 3.08Å
341	W	95	Very high	82.3	Confident	89 Å²	89	75.5 Å²	75.5	34%	0.337	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	130.2	172	-73.1	84.4	0	0	0	110.8	E114 K116 E356 I357 H358	E114-W341 HydrophobicContact CG-CH2 3.69Å; E114-W341 HydrophobicContact CG-CZ2 4.05Å; E114-W341 WeakPolarHBondContact OE1-CH2 3.33Å; E114-W341 WeakPolarHBondContact OE1-CZ2 3.09Å; K116-W341 HydrophobicContact CB-CH2 4.26Å; K116-W341 HydrophobicContact CB-CZ3 4.12Å; K116-W341 HydrophobicContact CD-CE3 4.05Å; K116-W341 HydrophobicContact CD-CH2 3.63Å; K116-W341 HydrophobicContact CD-CZ2 4.29Å; K116-W341 HydrophobicContact CD-CZ3 3.5Å; K116-W341 HydrophobicContact CG-CE3 4.3Å; K116-W341 HydrophobicContact CG-CH2 4.01Å; K116-W341 HydrophobicContact CG-CZ3 3.57Å; W341-E356 HydrophobicContact CE3-CB 3.81Å; W341-E356 HydrophobicContact CZ3-CB 4.4Å; W341-I357 CarbonylContact C-O 3.51Å; W341-I357 WeakPolarHBondContact CA-O 3.49Å; W341-H358 HydrophobicContact CD2-CB 3.8Å; W341-H358 AromaticContact CE2-CG 3.88Å; W341-H358 HydrophobicContact CE3-CB 3.91Å; W341-H358 HydrophobicContact CG-CB 4.45Å; W341-H358 HydrophobicContact CH2-CB 3.93Å; W341-H358 HydrophobicContact CZ2-CB 3.82Å; W341-H358 HydrophobicContact CZ3-CB 3.95Å; W341-H358 AromaticContact NE1-CG 3.91Å
342	F	92.3	Very high	81.9	Confident	33 Å²	33	79.3 Å²	79.3	15%	0.145	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.4	178.8	-60.2	-90	0	0	0	110.6	V326 I328 L338 S340 E356 I357 L359 L361	V326-F342 HydrophobicContact CG2-CB 3.66Å; V326-F342 HydrophobicContact CG2-CD1 4.19Å; V326-F342 HydrophobicContact CG2-CG 4.07Å; I328-F342 HydrophobicContact CD1-CD1 3.73Å; I328-F342 HydrophobicContact CD1-CD2 4.18Å; I328-F342 HydrophobicContact CD1-CE1 3.39Å; I328-F342 HydrophobicContact CD1-CE2 3.89Å; I328-F342 HydrophobicContact CD1-CG 4.11Å; I328-F342 HydrophobicContact CD1-CZ 3.47Å; I328-F342 VanDerWaalsContact CD1-CZ 3.47Å; I328-F342 HydrophobicContact CG1-CD1 4.13Å; I328-F342 HydrophobicContact CG1-CE1 3.93Å; I328-F342 HydrophobicContact CG1-CZ 4.46Å; L338-F342 HydrophobicContact CD2-CE1 4.2Å; L338-F342 HydrophobicContact CD2-CZ 3.7Å; L338-F342 HydrophobicContact CG-CZ 4.15Å; S340-F342 WeakPolarHBondContact O-CD2 3.38Å; S340-F342 VanDerWaalsContact O-CE2 3.28Å; S340-F342 WeakPolarHBondContact O-CE2 3.37Å; S340-F342 VanDerWaalsContact OG-CE2 3.22Å; S340-F342 WeakPolarHBondContact OG-CE2 3.46Å; S340-F342 WeakPolarHBondContact OG-CZ 3.38Å; F342-E356 CarbonylContact O-C 3.51Å; F342-E356 WeakPolarHBondContact O-CA 3.46Å; F342-E356 WeakPolarHBondContact O-CB 3.37Å; F342-I357 HydrophobicContact CB-CG2 4.1Å; F342-I357 PolarHBondContact N-O 2.99Å; F342-I357 PolarHBondContact O-N 3.37Å; F342-L359 HydrophobicContact CD2-CB 4.07Å; F342-L359 HydrophobicContact CD2-CD1 4.01Å; F342-L359 HydrophobicContact CD2-CG 4.12Å; F342-L359 HydrophobicContact CE2-CB 3.84Å; F342-L359 HydrophobicContact CE2-CD1 4.29Å; F342-L359 HydrophobicContact CE2-CG 4.36Å; F342-L361 HydrophobicContact CZ-CD1 4.38Å
343	K	92.4	Very high	81.9	Confident	158 Å²	158	77.4 Å²	77.4	69%	0.687	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	134.7	176.8	-171.5	177.1	-180	-178.4	0	110.6
344	L	92.3	Very high	82	Confident	9 Å²	9	82.5 Å²	82.5	5%	0.047	41%	0.412	C	S	.	.			trans	-76.4	139.9	178.8	-62.2	172.8	0	0	0	111.5	L118 I275 V353 G355 I357	L118-L344 HydrophobicContact CD2-CD1 3.38Å; I275-L344 HydrophobicContact CD1-CD1 3.74Å; I275-L344 HydrophobicContact CD1-CD2 3.65Å; I275-L344 HydrophobicContact CD1-CG 4.34Å; I275-L344 HydrophobicContact CG1-CD2 4.27Å; L344-V353 HydrophobicContact CB-CG1 3.57Å; L344-G355 PolarHBondContact N-O 3Å; L344-I357 HydrophobicContact CD2-CB 4.25Å; L344-I357 HydrophobicContact CD2-CG2 3.89Å
345	E	87.8	Confident	82.5	Confident	125 Å²	125	81.7 Å²	81.7	58%	0.584	41%	0.41	S	S	*	.	B	Isolated β-bridge	trans	-114.5	155.9	-180	-60.6	-172.7	166.4	0	0	111.3	C325	C325-E345 PolarHBondContact N-O 3.46Å; C325-E345 PolarHBondContact O-N 3.06Å; C325-E345 PolarHBondContact SG-O 3.36Å
346	G	82.8	Confident	83.4	Confident	32 Å²	32	84.7 Å²	84.7	33%	0.33	42%	0.423	S	S	.	.			trans	-88.4	138.8	172.7	0	0	0	0	0	111.4	S348	G346-S348 PolarHBondContact O-N 3.1Å; G346-S348 VanDerWaalsContact O-N 3.13Å
347	R	75.6	Confident	84.3	Confident	112 Å²	112	80.2 Å²	80.2	42%	0.423	40%	0.395	S	S	.	.	S	Bend	trans	-59.9	-21.7	174.2	-73.3	178.2	-178.2	161.9	0.8	114.6	D274 F322	D274-R347 IonicContact OD1-CZ 3.6Å; D274-R347 IonicContact OD1-NE 2.74Å; D274-R347 PolarHBondContact OD1-NE 2.52Å; D274-R347 VanDerWaalsContact OD1-NE 3.16Å; D274-R347 IonicContact OD1-NH2 3.61Å; D274-R347 PolarHBondContact OD1-NH2 2.96Å; D274-R347 IonicContact OD2-CZ 2.73Å; D274-R347 IonicContact OD2-NE 2.73Å; D274-R347 IonicContact OD2-NH2 3.4Å; D274-R347 PolarHBondContact OD2-NH2 2.93Å; F322-R347 HydrophobicContact CE1-CB 4.47Å; F322-R347 HydrophobicContact CE1-CG 4.06Å; F322-R347 HydrophobicContact CE2-CG 3.94Å; F322-R347 HydrophobicContact CZ-CB 4.44Å; F322-R347 HydrophobicContact CZ-CG 3.59Å
348	S	73.2	Confident	85	Confident	58 Å²	58	80.8 Å²	80.8	41%	0.406	39%	0.393	S	S	.	.	S	Bend	trans	-150.4	163.5	179.9	73.4	0	0	0	0	110.2	G346 R350 S351	G346-S348 PolarHBondContact O-N 3.1Å; G346-S348 VanDerWaalsContact O-N 3.13Å; S348-R350 PolarHBondContact O-N 3.37Å; S348-R350 PolarHBondContact OG-N 3.47Å; S348-S351 PolarHBondContact O-N 3.27Å; S348-S351 PolarHBondContact OG-OG 3.45Å
349	N	69.2	Low	85.5	Confident	180 Å²	180	78.6 Å²	78.6	96%	0.963	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-11.6	172.8	-64	-11.6	0	0	0	113.7
350	R	67.3	Low	85.5	Confident	234 Å²	234	74.6 Å²	74.6	88%	0.883	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-18	176	-62.2	-176	177.3	-173.8	-0.1	113.2	S348 K352	S348-R350 PolarHBondContact O-N 3.37Å; S348-R350 PolarHBondContact OG-N 3.47Å; R350-K352 PolarHBondContact O-N 3.46Å
351	S	68.1	Low	85.4	Confident	42 Å²	42	73.1 Å²	73.1	29%	0.294	35%	0.353	S	S	.	.			trans	-85.7	98.4	-178.9	-57.1	0	0	0	0	109.5	S348 V353	S348-S351 PolarHBondContact O-N 3.27Å; S348-S351 PolarHBondContact OG-OG 3.45Å; S351-V353 PolarHBondContact O-N 2.99Å
352	K	73.6	Confident	84.9	Confident	184 Å²	184	71.2 Å²	71.2	80%	0.8	35%	0.353	S	S	*	.			trans	-73.6	120.8	166	-73.3	-176.2	178.6	-179.2	0	107.8	E119 R350	E119-K352 VanDerWaalsContact OE2-O 3.13Å; R350-K352 PolarHBondContact O-N 3.46Å
353	V	83.2	Confident	84.4	Confident	33 Å²	33	70.1 Å²	70.1	20%	0.2	35%	0.349	C	S	.	.			trans	-130.4	146.5	-177.3	166.6	0	0	0	0	108.1	F322 L323 L344 S351	F322-V353 HydrophobicContact CD1-CG2 4.3Å; F322-V353 HydrophobicContact CE1-CG2 3.74Å; L323-V353 VanDerWaalsContact O-CG1 3.25Å; L323-V353 WeakPolarHBondContact O-CG1 3.43Å; L344-V353 HydrophobicContact CB-CG1 3.57Å; S351-V353 PolarHBondContact O-N 2.99Å
354	Q	87	Confident	83.5	Confident	108 Å²	108	63.6 Å²	63.6	51%	0.505	32%	0.323	S	S	.	.			trans	-143.1	156.5	172.9	59.9	172.4	30.8	0	0	109.9	N117 L118 E119	N117-Q354 CarbonylContact O-C 3.45Å; L118-Q354 PolarHBondContact O-NE2 3.38Å; E119-Q354 HydrophobicContact CB-CG 3.88Å; E119-Q354 HydrophobicContact CG-CG 4.45Å
355	G	91.2	Very high	82.6	Confident	14 Å²	14	64 Å²	64	14%	0.144	33%	0.326	C	S	.	.			trans	113.8	173.7	178	0	0	0	0	0	113.5	K116 N117 L344	K116-G355 WeakPolarHBondContact O-CA 3.49Å; N117-G355 WeakPolarHBondContact O-CA 3.14Å; N117-G355 PolarHBondContact O-N 3.27Å; L344-G355 PolarHBondContact N-O 3Å
356	E	95.4	Very high	81.6	Confident	69 Å²	69	60.5 Å²	60.5	32%	0.322	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	151.9	177.8	-56.5	-179.8	160.3	0	0	109.2	A115 K116 W341 F342	A115-E356 CarbonylContact C-O 3.57Å; A115-E356 VanDerWaalsContact CA-O 3.25Å; A115-E356 WeakPolarHBondContact CA-O 3.5Å; A115-E356 WeakPolarHBondContact CB-O 3.37Å; K116-E356 WeakPolarHBondContact CE-OE2 3.36Å; K116-E356 HydrophobicContact CG-CB 4.43Å; K116-E356 PolarHBondContact N-O 3.22Å; K116-E356 IonicContact NZ-OE2 3.48Å; K116-E356 PolarHBondContact NZ-OE2 2.98Å; K116-E356 PolarHBondContact O-N 3.38Å; W341-E356 HydrophobicContact CE3-CB 3.81Å; W341-E356 HydrophobicContact CZ3-CB 4.4Å; F342-E356 CarbonylContact O-C 3.51Å; F342-E356 WeakPolarHBondContact O-CA 3.46Å; F342-E356 WeakPolarHBondContact O-CB 3.37Å
357	I	95.3	Very high	80.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.2	176.9	-171.1	169.5	0	0	0	110.7	V112 E114 A115 W255 L273 I275 V326 W341 F342 L344 L359	V112-I357 HydrophobicContact CG1-CD1 4.23Å; E114-I357 WeakPolarHBondContact O-CG1 3.36Å; A115-I357 HydrophobicContact CB-CB 4.24Å; A115-I357 HydrophobicContact CB-CG1 4.21Å; W255-I357 HydrophobicContact CZ3-CD1 4.47Å; L273-I357 HydrophobicContact CD1-CD1 4.06Å; L273-I357 HydrophobicContact CD2-CD1 3.69Å; I275-I357 HydrophobicContact CD1-CB 4.4Å; I275-I357 HydrophobicContact CD1-CD1 3.95Å; I275-I357 HydrophobicContact CG1-CD1 4.48Å; V326-I357 HydrophobicContact CG1-CG2 4.08Å; W341-I357 CarbonylContact C-O 3.51Å; W341-I357 WeakPolarHBondContact CA-O 3.49Å; F342-I357 HydrophobicContact CB-CG2 4.1Å; F342-I357 PolarHBondContact N-O 2.99Å; F342-I357 PolarHBondContact O-N 3.37Å; L344-I357 HydrophobicContact CD2-CB 4.25Å; L344-I357 HydrophobicContact CD2-CG2 3.89Å; I357-L359 HydrophobicContact CD1-CD2 3.85Å; I357-L359 HydrophobicContact CD1-CG 4.48Å; I357-L359 HydrophobicContact CG1-CD2 3.92Å; I357-L359 HydrophobicContact CG1-CG 4.22Å; I357-L359 HydrophobicContact CG2-CD1 4.35Å; I357-L359 HydrophobicContact CG2-CG 4.34Å
358	H	97.1	Very high	78.6	Confident	30 Å²	30	63 Å²	63	14%	0.139	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.6	177.1	-173	-163.9	0	0	0	109.8	I113 E114 D339 S340 W341	I113-H358 HydrophobicContact CB-CB 4.33Å; I113-H358 PolarHBondContact N-O 2.85Å; I113-H358 VanDerWaalsContact N-O 3.16Å; E114-H358 HydrophobicContact CG-CB 3.87Å; E114-H358 WeakPolarHBondContact O-CB 3.25Å; E114-H358 PolarHBondContact O-N 2.88Å; D339-H358 IonicContact OD1-CD2 3.51Å; D339-H358 PolarHBondContact OD1-CD2 3.44Å; D339-H358 IonicContact OD1-CE1 2.68Å; D339-H358 IonicContact OD1-NE2 3.68Å; D339-H358 PolarHBondContact OD1-NE2 3.22Å; S340-H358 PolarHBondContact O-CD2 3.16Å; W341-H358 HydrophobicContact CD2-CB 3.8Å; W341-H358 AromaticContact CE2-CG 3.88Å; W341-H358 HydrophobicContact CE3-CB 3.91Å; W341-H358 HydrophobicContact CG-CB 4.45Å; W341-H358 HydrophobicContact CH2-CB 3.93Å; W341-H358 HydrophobicContact CZ2-CB 3.82Å; W341-H358 HydrophobicContact CZ3-CB 3.95Å; W341-H358 AromaticContact NE1-CG 3.91Å
359	L	94.6	Very high	77.1	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.8	179.6	-54.9	173.9	0	0	0	110	S111 V112 L273 V326 I328 S340 F342 I357 L361	S111-L359 WeakPolarHBondContact O-CA 3.41Å; V112-L359 HydrophobicContact CB-CD2 4.26Å; V112-L359 HydrophobicContact CG1-CD2 4.23Å; V112-L359 HydrophobicContact CG2-CD2 3.98Å; L273-L359 HydrophobicContact CD1-CD1 4.38Å; L273-L359 HydrophobicContact CD1-CD2 4.07Å; V326-L359 HydrophobicContact CG1-CD1 4.14Å; I328-L359 HydrophobicContact CD1-CD1 4.14Å; S340-L359 PolarHBondContact N-O 2.91Å; S340-L359 VanDerWaalsContact N-O 3.1Å; S340-L359 PolarHBondContact O-N 3.17Å; S340-L359 VanDerWaalsContact O-N 3.08Å; F342-L359 HydrophobicContact CD2-CB 4.07Å; F342-L359 HydrophobicContact CD2-CD1 4.01Å; F342-L359 HydrophobicContact CD2-CG 4.12Å; F342-L359 HydrophobicContact CE2-CB 3.84Å; F342-L359 HydrophobicContact CE2-CD1 4.29Å; F342-L359 HydrophobicContact CE2-CG 4.36Å; I357-L359 HydrophobicContact CD1-CD2 3.85Å; I357-L359 HydrophobicContact CD1-CG 4.48Å; I357-L359 HydrophobicContact CG1-CD2 3.92Å; I357-L359 HydrophobicContact CG1-CG 4.22Å; I357-L359 HydrophobicContact CG2-CD1 4.35Å; I357-L359 HydrophobicContact CG2-CG 4.34Å; L359-L361 HydrophobicContact CB-CD2 4.14Å; L359-L361 HydrophobicContact CB-CG 4.43Å
360	A	90.8	Very high	75.4	Confident	22 Å²	22	67 Å²	67	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121	164.2	0	0	0	0	0	109.7	S111 I113 L338 D339	S111-A360 PolarHBondContact N-O 3.09Å; S111-A360 PolarHBondContact O-N 3.34Å; I113-A360 HydrophobicContact CD1-CB 3.92Å; L338-A360 CarbonylContact O-C 3.58Å; L338-A360 WeakPolarHBondContact O-CA 2.81Å; D339-A360 HydrophobicContact CB-CB 4.25Å
361	L	89.1	Confident	74.1	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.016	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.1	-174.1	-51.6	179.9	0	0	0	109.1	L108 N109 V110 L271 I328 I333 G337 L338 F342 L359	L108-L361 HydrophobicContact CD1-CB 4.35Å; N109-L361 WeakPolarHBondContact O-CA 3.42Å; V110-L361 HydrophobicContact CB-CD2 4.14Å; V110-L361 HydrophobicContact CG1-CD2 3.71Å; V110-L361 HydrophobicContact CG2-CD2 3.97Å; L271-L361 HydrophobicContact CD2-CD1 4.32Å; L271-L361 HydrophobicContact CD2-CD2 3.84Å; I328-L361 HydrophobicContact CD1-CD1 3.68Å; I328-L361 HydrophobicContact CG2-CD1 4.2Å; I333-L361 HydrophobicContact CD1-CB 4.35Å; I333-L361 HydrophobicContact CD1-CD1 4.04Å; I333-L361 HydrophobicContact CG1-CD1 4.48Å; G337-L361 CarbonylContact C-O 3.58Å; G337-L361 WeakPolarHBondContact CA-O 3.35Å; L338-L361 HydrophobicContact CB-CB 4.32Å; L338-L361 HydrophobicContact CD2-CD1 4.33Å; L338-L361 PolarHBondContact N-O 3.46Å; L338-L361 PolarHBondContact O-N 3.29Å; F342-L361 HydrophobicContact CZ-CD1 4.38Å; L359-L361 HydrophobicContact CB-CD2 4.14Å; L359-L361 HydrophobicContact CB-CG 4.43Å
362	S	83.7	Confident	73.1	Confident	50 Å²	50	68 Å²	68	35%	0.35	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144	170.8	58.5	0	0	0	0	110.8	N109	N109-S362 WeakPolarHBondContact CB-OG 3.47Å; N109-S362 PolarHBondContact N-O 3.48Å; N109-S362 PolarHBondContact ND2-OG 3.2Å; N109-S362 PolarHBondContact O-N 3.24Å
363	L	82.3	Confident	71.9	Confident	9 Å²	9	67.7 Å²	67.7	5%	0.047	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	136	175.1	-64.9	169.1	0	0	0	109.1	I62 V106 L108 L263 I330 I333	I62-L363 HydrophobicContact CG2-CB 3.35Å; I62-L363 HydrophobicContact CG2-CD1 4.03Å; I62-L363 HydrophobicContact CG2-CG 4.33Å; V106-L363 HydrophobicContact CG1-CB 4.36Å; V106-L363 HydrophobicContact CG1-CD2 4.16Å; L108-L363 HydrophobicContact CB-CD2 4.48Å; L108-L363 HydrophobicContact CD1-CD2 3.77Å; L108-L363 HydrophobicContact CD1-CG 4.49Å; L263-L363 HydrophobicContact CD1-CD2 3.8Å; I330-L363 HydrophobicContact CG2-CD2 4.11Å; I333-L363 HydrophobicContact CB-CD1 4.28Å; I333-L363 HydrophobicContact CG2-CD1 4.28Å; I333-L363 HydrophobicContact CG2-CG 4.24Å
364	S	74.3	Confident	70.4	Confident	21 Å²	21	73.7 Å²	73.7	15%	0.147	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	165.8	177.3	64.2	0	0	0	0	110.1	V106 V107 N109	V106-S364 CarbonylContact C-O 3.39Å; V107-S364 PolarHBondContact N-O 2.97Å; V107-S364 PolarHBondContact O-N 3.43Å; N109-S364 WeakPolarHBondContact ND2-CB 2.86Å; N109-S364 PolarHBondContact ND2-OG 3.32Å
365	V	73.9	Confident	69.4	Low	18 Å²	18	72.1 Å²	72.1	11%	0.109	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	130.3	176.9	178	0	0	0	0	110.4	I62 P104 V105 N367 Q423	I62-V365 HydrophobicContact CD1-CG2 3.42Å; I62-V365 VanDerWaalsContact CD1-CG2 3.42Å; P104-V365 HydrophobicContact CB-CB 4.46Å; P104-V365 HydrophobicContact CB-CG1 3.64Å; P104-V365 HydrophobicContact CB-CG2 3.94Å; P104-V365 HydrophobicContact CG-CG2 4.44Å; V105-V365 CarbonylContact O-C 3.45Å; V105-V365 WeakPolarHBondContact O-CA 3.36Å; V365-N367 PolarHBondContact O-N 3.34Å; V365-N367 PolarHBondContact O-ND2 3.38Å; V365-Q423 WeakPolarHBondContact CG2-O 3.43Å
366	Q	65.3	Low	68.7	Low	51 Å²	51	75.1 Å²	75.1	24%	0.238	39%	0.387	C	S	.	.			trans	-65.8	129	171.9	-166.6	62.9	-30.2	0	0	108	V105 V107 E262	V105-Q366 HydrophobicContact CB-CB 3.89Å; V105-Q366 HydrophobicContact CG1-CB 3.64Å; V105-Q366 HydrophobicContact CG1-CG 4.36Å; V105-Q366 PolarHBondContact O-N 3.13Å; V107-Q366 VanDerWaalsContact CG2-CA 3.46Å; V107-Q366 HydrophobicContact CG2-CB 3.26Å; V107-Q366 HydrophobicContact CG2-CG 3.92Å; V107-Q366 VanDerWaalsContact CG2-OE1 3.28Å; E262-Q366 HydrophobicContact CG-CG 4.39Å; E262-Q366 PolarHBondContact OE1-NE2 3.16Å
367	N	54.6	Low	67.9	Low	67 Å²	67	72.7 Å²	72.7	36%	0.358	38%	0.377	S	S	.	.			trans	-119.8	109.4	-178.6	-69.3	-54.7	0	0	0	107.3	V365 L369 R374	V365-N367 PolarHBondContact O-N 3.34Å; V365-N367 PolarHBondContact O-ND2 3.38Å; N367-L369 PolarHBondContact O-N 2.8Å; N367-R374 PolarHBondContact ND2-NH2 3.5Å; N367-R374 PolarHBondContact OD1-NH1 2.95Å; N367-R374 PolarHBondContact OD1-NH2 2.88Å
368	D	42.1	Very low	67.2	Low	130 Å²	130	74.4 Å²	74.4	70%	0.695	39%	0.388	S	S	*	.			trans	-46.2	121.3	179.2	-81.3	-28.4	0	0	0	111.5
369	L	40.1	Very low	66.6	Low	158 Å²	158	73.5 Å²	73.5	83%	0.827	39%	0.385	S	S	*	.	S	Bend	trans	79.4	131.9	152	-55.4	168.4	0	0	0	119.5	N367 E371	N367-L369 PolarHBondContact O-N 2.8Å; L369-E371 PolarHBondContact O-N 2.81Å; L369-E371 VanDerWaalsContact O-N 3.1Å
370	N	33.7	Very low	66.3	Low	165 Å²	165	73.5 Å²	73.5	88%	0.882	39%	0.385	S	S	*	.			trans	-45.4	97.8	164.1	-64.7	-35.2	0	0	0	113.7
371	E	41.7	Very low	66.2	Low	176 Å²	176	74.3 Å²	74.3	82%	0.822	39%	0.385	S	S	*	.	S	Bend	trans	-149.5	134.6	138.4	-77.2	-165.3	162.5	0	0	105.7	L369 E373	L369-E371 PolarHBondContact O-N 2.81Å; L369-E371 VanDerWaalsContact O-N 3.1Å; E371-E373 PolarHBondContact O-N 3.27Å
372	S	46	Very low	66.2	Low	119 Å²	119	74.4 Å²	74.4	83%	0.832	39%	0.386	S	S	*	.	S	Bend	trans	-35.4	109.7	-176	53	0	0	0	0	114.1
373	E	48.8	Very low	66.6	Low	179 Å²	179	72.1 Å²	72.1	84%	0.836	37%	0.37	S	S	*	.			trans	48.1	85.6	159.3	-64.3	179.1	164.5	0	0	115.1	E371 D375	E371-E373 PolarHBondContact O-N 3.27Å; E373-D375 PolarHBondContact O-N 3.19Å
374	R	52.3	Low	67	Low	158 Å²	158	71.7 Å²	71.7	60%	0.596	37%	0.368	S	S	*	.			trans	-44.5	120.6	169.7	-71.5	-173.1	-51.9	170.8	22	110	N367 K376	N367-R374 PolarHBondContact ND2-NH2 3.5Å; N367-R374 PolarHBondContact OD1-NH1 2.95Å; N367-R374 PolarHBondContact OD1-NH2 2.88Å; R374-K376 PolarHBondContact O-N 2.92Å
375	D	64.1	Low	67.8	Low	75 Å²	75	72.3 Å²	72.3	40%	0.401	37%	0.368	S	S	.	.			trans	-43.8	101.2	170.5	177	15.3	0	0	0	111.2	R190 E373 T377	R190-D375 PolarHBondContact NH2-O 3.33Å; E373-D375 PolarHBondContact O-N 3.19Å; D375-T377 PolarHBondContact O-N 3.47Å; D375-T377 WeakPolarHBondContact OD1-CB 3.43Å; D375-T377 PolarHBondContact OD1-N 2.88Å; D375-T377 PolarHBondContact OD1-OG1 2.86Å
376	K	77.7	Confident	68.6	Low	77 Å²	77	71.5 Å²	71.5	34%	0.335	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-2.4	177.8	-68.8	-175.2	-177	-175.8	0	112.2	R374 V378 A379 I380 G425 L426	R374-K376 PolarHBondContact O-N 2.92Å; K376-V378 VanDerWaalsContact C-N 3.26Å; K376-V378 PolarHBondContact O-N 3.28Å; K376-V378 VanDerWaalsContact O-N 3.15Å; K376-A379 PolarHBondContact O-N 3.35Å; K376-I380 HydrophobicContact CB-CD1 4.08Å; K376-I380 HydrophobicContact CB-CG1 4.43Å; K376-I380 WeakPolarHBondContact O-CG1 3.42Å; K376-I380 PolarHBondContact O-N 3.34Å; K376-G425 PolarHBondContact NZ-O 3.43Å; K376-L426 HydrophobicContact CD-CD2 4.47Å
377	T	78.7	Confident	69.9	Low	18 Å²	18	69.5 Å²	69.5	11%	0.11	35%	0.354	C	S	.	.	H	α-helix	trans	-52.4	-40.1	-175.8	-65.6	0	0	0	0	113.2	D375 I380 Q381 Y476	D375-T377 PolarHBondContact O-N 3.47Å; D375-T377 WeakPolarHBondContact OD1-CB 3.43Å; D375-T377 PolarHBondContact OD1-N 2.88Å; D375-T377 PolarHBondContact OD1-OG1 2.86Å; T377-I380 PolarHBondContact O-N 3.25Å; T377-Q381 HydrophobicContact CG2-CG 4.4Å; T377-Q381 WeakPolarHBondContact O-CB 3.45Å; T377-Q381 VanDerWaalsContact O-CG 3.29Å; T377-Q381 WeakPolarHBondContact O-CG 3.1Å; T377-Q381 PolarHBondContact O-N 3.37Å; T377-Y476 HydrophobicContact CG2-CE2 3.92Å; T377-Y476 WeakPolarHBondContact CG2-OH 3.45Å
378	V	80.8	Confident	71.7	Confident	37 Å²	37	67.5 Å²	67.5	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-47.2	178.2	178.4	0	0	0	0	111.5	K376 I380 Q381 E382	K376-V378 VanDerWaalsContact C-N 3.26Å; K376-V378 PolarHBondContact O-N 3.28Å; K376-V378 VanDerWaalsContact O-N 3.15Å; V378-I380 VanDerWaalsContact C-N 3.29Å; V378-I380 PolarHBondContact O-N 2.95Å; V378-Q381 PolarHBondContact O-N 2.88Å; V378-E382 HydrophobicContact CG1-CG 4.38Å; V378-E382 VanDerWaalsContact O-CG 3.32Å; V378-E382 WeakPolarHBondContact O-CG 3.25Å; V378-E382 PolarHBondContact O-N 3.39Å
379	A	84.9	Confident	73.9	Confident	10 Å²	10	62.3 Å²	62.3	8%	0.083	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-36	178.9	0	0	0	0	0	111.6	K376 H383 N424 L426	K376-A379 PolarHBondContact O-N 3.35Å; A379-H383 VanDerWaalsContact O-CB 3.24Å; A379-H383 WeakPolarHBondContact O-CB 3.47Å; A379-H383 PolarHBondContact O-N 2.79Å; A379-N424 HydrophobicContact CB-CB 3.69Å; A379-L426 HydrophobicContact CB-CD2 4.24Å
380	I	88	Confident	76.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-47.9	173.4	-71.6	170	0	0	0	110.3	K376 T377 V378 H383 I384 L426 M433 E473	K376-I380 HydrophobicContact CB-CD1 4.08Å; K376-I380 HydrophobicContact CB-CG1 4.43Å; K376-I380 WeakPolarHBondContact O-CG1 3.42Å; K376-I380 PolarHBondContact O-N 3.34Å; T377-I380 PolarHBondContact O-N 3.25Å; V378-I380 VanDerWaalsContact C-N 3.29Å; V378-I380 PolarHBondContact O-N 2.95Å; I380-H383 PolarHBondContact O-N 3.06Å; I380-I384 HydrophobicContact CG2-CD1 3.83Å; I380-I384 VanDerWaalsContact O-CG1 3.26Å; I380-I384 WeakPolarHBondContact O-CG1 3.5Å; I380-I384 PolarHBondContact O-N 3.41Å; I380-L426 HydrophobicContact CG1-CD2 3.96Å; I380-M433 HydrophobicContact CD1-CE 4.2Å; I380-M433 HydrophobicContact CG2-CE 3.93Å; I380-E473 HydrophobicContact CD1-CG 3.87Å; I380-E473 WeakPolarHBondContact CD1-OE1 3.19Å
381	Q	87.1	Confident	79	Confident	39 Å²	39	47 Å²	47	18%	0.182	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-46.6	177.4	-76.2	179.7	-15	0	0	112.3	T377 V378 H383 I384 Q385 Y476	T377-Q381 HydrophobicContact CG2-CG 4.4Å; T377-Q381 WeakPolarHBondContact O-CB 3.45Å; T377-Q381 VanDerWaalsContact O-CG 3.29Å; T377-Q381 WeakPolarHBondContact O-CG 3.1Å; T377-Q381 PolarHBondContact O-N 3.37Å; V378-Q381 PolarHBondContact O-N 2.88Å; Q381-H383 VanDerWaalsContact C-N 3.3Å; Q381-H383 PolarHBondContact O-N 3.19Å; Q381-I384 PolarHBondContact O-N 2.8Å; Q381-Q385 VanDerWaalsContact O-CG 3.32Å; Q381-Q385 WeakPolarHBondContact O-CG 3.5Å; Q381-Q385 PolarHBondContact O-N 3.07Å; Q381-Y476 PolarHBondContact NE2-OH 3.49Å
382	E	89.2	Confident	81.2	Confident	5 Å²	5	40 Å²	40	2%	0.023	20%	0.2	C	C	.	.	H	α-helix	trans	-57.1	-45.9	174.6	-72.7	171.9	163.7	0	0	110.6	Y49 R53 V378 I384 Q385 L386 H420	Y49-E382 HydrophobicContact CE1-CG 4.07Å; Y49-E382 WeakPolarHBondContact CE1-OE1 3.47Å; Y49-E382 PolarHBondContact OH-OE1 2.7Å; R53-E382 IonicContact CZ-OE1 2.73Å; R53-E382 IonicContact CZ-OE2 3.32Å; R53-E382 IonicContact NE-OE1 3.7Å; R53-E382 PolarHBondContact NE-OE1 3.19Å; R53-E382 IonicContact NE-OE2 3.86Å; R53-E382 PolarHBondContact NE-OE2 2.8Å; R53-E382 IonicContact NH2-OE1 3.95Å; R53-E382 PolarHBondContact NH2-OE1 3.38Å; R53-E382 IonicContact NH2-OE2 3.12Å; R53-E382 PolarHBondContact NH2-OE2 2.77Å; V378-E382 HydrophobicContact CG1-CG 4.38Å; V378-E382 VanDerWaalsContact O-CG 3.32Å; V378-E382 WeakPolarHBondContact O-CG 3.25Å; V378-E382 PolarHBondContact O-N 3.39Å; E382-I384 PolarHBondContact O-N 3.23Å; E382-Q385 PolarHBondContact O-N 3.11Å; E382-L386 VanDerWaalsContact O-CG 3.31Å; E382-L386 WeakPolarHBondContact O-CG 3.29Å; E382-L386 PolarHBondContact O-N 3.34Å; E382-H420 IonicContact OE2-NE2 3.61Å
383	H	92.6	Very high	83.1	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.009	17%	0.167	C	C	.	.	H	α-helix	trans	-65.9	-40.2	-179.4	-161.1	70.1	0	0	0	112.7	A379 I380 Q381 Q385 L386 F387 L417 H420 L426	A379-H383 VanDerWaalsContact O-CB 3.24Å; A379-H383 WeakPolarHBondContact O-CB 3.47Å; A379-H383 PolarHBondContact O-N 2.79Å; I380-H383 PolarHBondContact O-N 3.06Å; Q381-H383 VanDerWaalsContact C-N 3.3Å; Q381-H383 PolarHBondContact O-N 3.19Å; H383-Q385 VanDerWaalsContact C-N 3.34Å; H383-L386 PolarHBondContact O-N 3.37Å; H383-F387 WeakPolarHBondContact O-CB 3.43Å; H383-F387 PolarHBondContact O-N 3.27Å; H383-L417 PolarHBondContact CE1-O 2.83Å; H383-L417 VanDerWaalsContact CE1-O 3.31Å; H383-H420 AromaticContact CG-ND1 3.92Å; H383-H420 AromaticContact ND1-ND1 3.25Å; H383-H420 PolarHBondContact ND1-ND1 3.39Å; H383-L426 HydrophobicContact CB-CD1 3.81Å
384	I	91	Very high	84.9	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-58.5	-46.9	172	-69.7	163.1	0	0	0	110.3	I380 Q381 E382 F387 Y388 C434 I437 A438	I380-I384 HydrophobicContact CG2-CD1 3.83Å; I380-I384 VanDerWaalsContact O-CG1 3.26Å; I380-I384 WeakPolarHBondContact O-CG1 3.5Å; I380-I384 PolarHBondContact O-N 3.41Å; Q381-I384 PolarHBondContact O-N 2.8Å; E382-I384 PolarHBondContact O-N 3.23Å; I384-F387 PolarHBondContact O-N 3.06Å; I384-Y388 WeakPolarHBondContact O-CB 3.32Å; I384-Y388 PolarHBondContact O-N 2.91Å; I384-C434 HydrophobicContact CG1-CB 3.7Å; I384-I437 HydrophobicContact CD1-CB 4.28Å; I384-I437 HydrophobicContact CD1-CD1 4Å; I384-I437 HydrophobicContact CD1-CG2 4.04Å; I384-I437 HydrophobicContact CG1-CB 4.43Å; I384-I437 HydrophobicContact CG1-CG2 4.45Å; I384-I437 HydrophobicContact CG2-CG2 4.04Å; I384-A438 HydrophobicContact CG2-CB 4.18Å; I384-A438 WeakPolarHBondContact O-CB 3.41Å
385	Q	90.4	Very high	86.2	Confident	34 Å²	34	22.5 Å²	22.5	16%	0.159	11%	0.111	C	C	.	.	H	α-helix	trans	-67.6	-40.6	-177.8	-71.6	175.2	-12.5	0	0	112.3	L50 Q381 E382 H383 Y388 L389	L50-Q385 HydrophobicContact CD1-CB 3.72Å; L50-Q385 HydrophobicContact CD2-CB 4.19Å; Q381-Q385 VanDerWaalsContact O-CG 3.32Å; Q381-Q385 WeakPolarHBondContact O-CG 3.5Å; Q381-Q385 PolarHBondContact O-N 3.07Å; E382-Q385 PolarHBondContact O-N 3.11Å; H383-Q385 VanDerWaalsContact C-N 3.34Å; Q385-Y388 PolarHBondContact O-N 3.48Å; Q385-L389 WeakPolarHBondContact O-CB 3.49Å; Q385-L389 PolarHBondContact O-N 3.09Å
386	L	91.6	Very high	87.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.2	-46.4	175.2	-70.6	177.5	0	0	0	111.5	L50 V54 F84 E382 H383 Y388 L389 F390 L417	L50-L386 HydrophobicContact CB-CD2 4.22Å; L50-L386 HydrophobicContact CD2-CD2 4.12Å; L50-L386 HydrophobicContact CD2-CG 4.24Å; V54-L386 HydrophobicContact CG2-CD1 4.22Å; V54-L386 HydrophobicContact CG2-CD2 3.4Å; V54-L386 VanDerWaalsContact CG2-CD2 3.4Å; V54-L386 HydrophobicContact CG2-CG 4.46Å; F84-L386 HydrophobicContact CZ-CD2 4.36Å; E382-L386 VanDerWaalsContact O-CG 3.31Å; E382-L386 WeakPolarHBondContact O-CG 3.29Å; E382-L386 PolarHBondContact O-N 3.34Å; H383-L386 PolarHBondContact O-N 3.37Å; L386-Y388 VanDerWaalsContact C-N 3.33Å; L386-Y388 PolarHBondContact O-N 2.91Å; L386-L389 PolarHBondContact O-N 3.16Å; L386-F390 HydrophobicContact CD2-CZ 4.46Å; L386-F390 WeakPolarHBondContact O-CD1 3.22Å; L386-F390 VanDerWaalsContact O-CG 3.25Å; L386-F390 WeakPolarHBondContact O-CG 3.4Å; L386-F390 PolarHBondContact O-N 2.97Å; L386-L417 HydrophobicContact CB-CD2 3.96Å
387	F	92.7	Very high	87.1	Confident	10 Å²	10	24.3 Å²	24.3	4%	0.044	12%	0.117	C	C	.	.	H	α-helix	trans	-61.2	-43.8	177.6	-166	-84.1	0	0	0	111.4	H383 I384 F390 S391 I409 L417 Q435 A438 L439	H383-F387 WeakPolarHBondContact O-CB 3.43Å; H383-F387 PolarHBondContact O-N 3.27Å; I384-F387 PolarHBondContact O-N 3.06Å; F387-F390 PolarHBondContact O-N 3.02Å; F387-S391 WeakPolarHBondContact CD1-OG 3.4Å; F387-S391 VanDerWaalsContact CE1-OG 3.29Å; F387-S391 WeakPolarHBondContact CE1-OG 3.39Å; F387-S391 VanDerWaalsContact O-CB 3.32Å; F387-S391 WeakPolarHBondContact O-CB 3.4Å; F387-S391 PolarHBondContact O-N 3.45Å; F387-S391 PolarHBondContact O-OG 2.87Å; F387-I409 HydrophobicContact CD2-CG1 4.45Å; F387-I409 HydrophobicContact CE2-CD1 4.47Å; F387-I409 HydrophobicContact CE2-CG1 3.79Å; F387-I409 HydrophobicContact CZ-CD1 4.34Å; F387-I409 HydrophobicContact CZ-CG1 4.01Å; F387-L417 HydrophobicContact CB-CD2 4.27Å; F387-L417 HydrophobicContact CD2-CD1 3.57Å; F387-L417 HydrophobicContact CD2-CD2 4.41Å; F387-L417 HydrophobicContact CE2-CD1 4.09Å; F387-Q435 HydrophobicContact CD2-CG 3.79Å; F387-Q435 HydrophobicContact CE1-CB 4.37Å; F387-Q435 HydrophobicContact CE1-CG 4.37Å; F387-Q435 HydrophobicContact CE2-CB 4.41Å; F387-Q435 HydrophobicContact CE2-CG 3.57Å; F387-Q435 HydrophobicContact CG-CG 4.31Å; F387-Q435 HydrophobicContact CZ-CB 4.25Å; F387-Q435 HydrophobicContact CZ-CG 3.87Å; F387-A438 HydrophobicContact CB-CB 4.04Å; F387-A438 HydrophobicContact CD1-CB 3.67Å; F387-A438 HydrophobicContact CG-CB 4.26Å; F387-L439 HydrophobicContact CE1-CD1 4.27Å; F387-L439 HydrophobicContact CE1-CD2 4.03Å; F387-L439 HydrophobicContact CE1-CG 3.88Å
388	Y	91.3	Very high	86.6	Confident	25 Å²	25	25.8 Å²	25.8	10%	0.098	12%	0.122	C	C	.	.	H	α-helix	trans	-58.3	-47.9	174.9	175.4	-92.7	0	0	0	111.8	I45 I384 Q385 L386 F390 S391 L392 R441 L442 T445	I45-Y388 HydrophobicContact CD1-CD1 3.99Å; I45-Y388 HydrophobicContact CD1-CE1 3.92Å; I384-Y388 WeakPolarHBondContact O-CB 3.32Å; I384-Y388 PolarHBondContact O-N 2.91Å; Q385-Y388 PolarHBondContact O-N 3.48Å; L386-Y388 VanDerWaalsContact C-N 3.33Å; L386-Y388 PolarHBondContact O-N 2.91Å; Y388-F390 PolarHBondContact O-N 3.34Å; Y388-S391 PolarHBondContact O-N 3.38Å; Y388-L392 HydrophobicContact CE1-CD2 4.2Å; Y388-L392 VanDerWaalsContact O-CB 3.31Å; Y388-L392 WeakPolarHBondContact O-CB 3.49Å; Y388-L392 PolarHBondContact O-N 3.35Å; Y388-R441 HydrophobicContact CD2-CB 4.23Å; Y388-R441 HydrophobicContact CE2-CB 4.3Å; Y388-L442 HydrophobicContact CD2-CB 4.03Å; Y388-L442 HydrophobicContact CD2-CD1 4.29Å; Y388-L442 HydrophobicContact CE2-CB 3.96Å; Y388-L442 HydrophobicContact CE2-CD1 3.78Å; Y388-L442 HydrophobicContact CE2-CG 4.5Å; Y388-T445 PolarHBondContact OH-OG1 2.97Å
389	L	89	Confident	85.9	Confident	21 Å²	21	30.9 Å²	30.9	11%	0.11	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-42.6	-178.6	-175.4	65.5	0	0	0	111.8	V83 F84 Q385 L386 L392 Y393	V83-L389 HydrophobicContact CG1-CD2 3.8Å; V83-L389 HydrophobicContact CG1-CG 3.7Å; F84-L389 HydrophobicContact CD1-CD2 3.96Å; F84-L389 HydrophobicContact CD2-CD2 4.38Å; F84-L389 HydrophobicContact CE1-CD2 3.56Å; F84-L389 HydrophobicContact CE2-CD2 4.04Å; F84-L389 HydrophobicContact CG-CD2 4.36Å; F84-L389 HydrophobicContact CZ-CD2 3.61Å; Q385-L389 WeakPolarHBondContact O-CB 3.49Å; Q385-L389 PolarHBondContact O-N 3.09Å; L386-L389 PolarHBondContact O-N 3.16Å; L389-L392 PolarHBondContact O-N 3.36Å; L389-Y393 PolarHBondContact O-N 3.34Å
390	F	92.1	Very high	84.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.7	-41.8	178.7	-65.3	-6.3	0	0	0	111.5	V54 Y79 V83 F84 L386 F387 Y388 L392 Y393 Q394 I409 I416 L417	V54-F390 HydrophobicContact CG2-CZ 4.4Å; Y79-F390 HydrophobicContact CE1-CD1 4.31Å; Y79-F390 HydrophobicContact CE1-CE1 4.31Å; Y79-F390 HydrophobicContact CE1-CG 4.47Å; Y79-F390 HydrophobicContact CE1-CZ 4.46Å; Y79-F390 WeakPolarHBondContact OH-CB 3.17Å; Y79-F390 WeakPolarHBondContact OH-CG 3.33Å; V83-F390 HydrophobicContact CG1-CD1 3.68Å; V83-F390 HydrophobicContact CG1-CE1 3.87Å; V83-F390 HydrophobicContact CG2-CD1 4.31Å; F84-F390 HydrophobicContact CE2-CE1 4.33Å; L386-F390 HydrophobicContact CD2-CZ 4.46Å; L386-F390 WeakPolarHBondContact O-CD1 3.22Å; L386-F390 VanDerWaalsContact O-CG 3.25Å; L386-F390 WeakPolarHBondContact O-CG 3.4Å; L386-F390 PolarHBondContact O-N 2.97Å; F387-F390 PolarHBondContact O-N 3.02Å; Y388-F390 PolarHBondContact O-N 3.34Å; F390-L392 PolarHBondContact O-N 3.16Å; F390-Y393 PolarHBondContact O-N 3.33Å; F390-Q394 PolarHBondContact O-N 2.88Å; F390-I409 HydrophobicContact CB-CD1 4.03Å; F390-I409 HydrophobicContact CB-CG2 4.16Å; F390-I409 HydrophobicContact CD2-CG2 4.43Å; F390-I416 HydrophobicContact CE2-CB 4.06Å; F390-I416 HydrophobicContact CE2-CG2 4.01Å; F390-I416 HydrophobicContact CZ-CB 4.28Å; F390-I416 HydrophobicContact CZ-CD1 4.18Å; F390-I416 HydrophobicContact CZ-CG2 3.91Å; F390-L417 HydrophobicContact CD2-CD1 3.88Å; F390-L417 HydrophobicContact CD2-CD2 4.29Å; F390-L417 HydrophobicContact CD2-CG 3.87Å; F390-L417 HydrophobicContact CE2-CD1 4.39Å; F390-L417 HydrophobicContact CE2-CD2 4.26Å; F390-L417 HydrophobicContact CE2-CG 3.88Å
391	S	89.6	Confident	84	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-44	174.2	-57.1	0	0	0	0	111.5	F387 Y388 Y393 Q394 L395 W405 L442	F387-S391 WeakPolarHBondContact CD1-OG 3.4Å; F387-S391 VanDerWaalsContact CE1-OG 3.29Å; F387-S391 WeakPolarHBondContact CE1-OG 3.39Å; F387-S391 VanDerWaalsContact O-CB 3.32Å; F387-S391 WeakPolarHBondContact O-CB 3.4Å; F387-S391 PolarHBondContact O-N 3.45Å; F387-S391 PolarHBondContact O-OG 2.87Å; Y388-S391 PolarHBondContact O-N 3.38Å; S391-Y393 VanDerWaalsContact C-N 3.34Å; S391-Y393 PolarHBondContact O-N 3.41Å; S391-Q394 PolarHBondContact O-N 3.07Å; S391-L395 PolarHBondContact O-N 3.17Å; S391-W405 VanDerWaalsContact CB-CH2 3.49Å; S391-W405 WeakPolarHBondContact OG-CH2 3.48Å; S391-L442 VanDerWaalsContact CB-CD2 3.43Å
392	L	86.8	Confident	83.1	Confident	29 Å²	29	40.9 Å²	40.9	15%	0.152	23%	0.229	C	C	.	.	H	α-helix	trans	-62.7	-40	177.4	-178	66.2	0	0	0	112	Y388 L389 F390 Q394 K396 L442 R446	Y388-L392 HydrophobicContact CE1-CD2 4.2Å; Y388-L392 VanDerWaalsContact O-CB 3.31Å; Y388-L392 WeakPolarHBondContact O-CB 3.49Å; Y388-L392 PolarHBondContact O-N 3.35Å; L389-L392 PolarHBondContact O-N 3.36Å; F390-L392 PolarHBondContact O-N 3.16Å; L392-Q394 VanDerWaalsContact C-N 3.35Å; L392-K396 WeakPolarHBondContact O-CG 3.42Å; L392-K396 PolarHBondContact O-N 3.06Å; L392-K396 VanDerWaalsContact O-N 3.11Å; L392-L442 HydrophobicContact CB-CD1 4.3Å; L392-L442 HydrophobicContact CD1-CD1 4Å; L392-R446 HydrophobicContact CD1-CG 4.46Å
393	Y	86	Confident	82.2	Confident	34 Å²	34	46.3 Å²	46.3	13%	0.133	26%	0.257	C	S	.	.	H	α-helix	trans	-63.7	-40.8	173.9	174.3	-106.9	0	0	0	111.7	Y79 N82 V83 L389 F390 S391 K396 Q397	Y79-Y393 HydrophobicContact CD2-CD1 4.46Å; Y79-Y393 AromaticContact CD2-CE1 3.92Å; Y79-Y393 HydrophobicContact CD2-CE1 3.92Å; Y79-Y393 AromaticContact CE2-CD1 3.73Å; Y79-Y393 HydrophobicContact CE2-CD1 3.73Å; Y79-Y393 AromaticContact CE2-CE1 3.6Å; Y79-Y393 HydrophobicContact CE2-CE1 3.6Å; N82-Y393 HydrophobicContact CB-CE2 3.65Å; N82-Y393 WeakPolarHBondContact CB-OH 3.49Å; N82-Y393 PolarHBondContact ND2-OH 2.91Å; N82-Y393 WeakPolarHBondContact O-CE2 3.49Å; V83-Y393 HydrophobicContact CB-CG 4.29Å; V83-Y393 HydrophobicContact CG2-CD1 3.47Å; V83-Y393 VanDerWaalsContact CG2-CD1 3.47Å; V83-Y393 HydrophobicContact CG2-CD2 4.17Å; V83-Y393 HydrophobicContact CG2-CE1 3.9Å; V83-Y393 HydrophobicContact CG2-CG 3.61Å; L389-Y393 PolarHBondContact O-N 3.34Å; F390-Y393 PolarHBondContact O-N 3.33Å; S391-Y393 VanDerWaalsContact C-N 3.34Å; S391-Y393 PolarHBondContact O-N 3.41Å; Y393-K396 PolarHBondContact O-N 2.97Å; Y393-Q397 HydrophobicContact CE1-CG 4.47Å; Y393-Q397 PolarHBondContact O-N 3.29Å; Y393-Q397 PolarHBondContact OH-NE2 2.86Å; Y393-Q397 VanDerWaalsContact OH-NE2 3.15Å
394	Q	86	Confident	81.2	Confident	37 Å²	37	50.5 Å²	50.5	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-42.4	178.4	-164.6	60.6	25.6	0	0	112.4	F390 S391 L392 K396 Q397 E398 W405	F390-Q394 PolarHBondContact O-N 2.88Å; S391-Q394 PolarHBondContact O-N 3.07Å; L392-Q394 VanDerWaalsContact C-N 3.35Å; Q394-K396 VanDerWaalsContact C-N 3.35Å; Q394-K396 PolarHBondContact O-N 3.15Å; Q394-Q397 WeakPolarHBondContact O-CB 3.46Å; Q394-Q397 PolarHBondContact O-N 3Å; Q394-Q397 VanDerWaalsContact O-N 3.1Å; Q394-E398 PolarHBondContact O-N 3.11Å; Q394-W405 HydrophobicContact CG-CD2 4.22Å; Q394-W405 HydrophobicContact CG-CG 3.85Å
395	L	81.6	Confident	80.6	Confident	19 Å²	19	51 Å²	51	10%	0.099	29%	0.287	C	S	.	.	H	α-helix	trans	-61.9	-39	172.9	-72.2	175.3	0	0	0	112.8	S391 Q397 E398 W405 L442 R446 L448	S391-L395 PolarHBondContact O-N 3.17Å; L395-Q397 PolarHBondContact O-N 3.4Å; L395-E398 WeakPolarHBondContact CD2-OE2 3.48Å; L395-E398 WeakPolarHBondContact O-CB 3.48Å; L395-E398 PolarHBondContact O-N 3.31Å; L395-W405 HydrophobicContact CD2-CB 4.41Å; L395-W405 HydrophobicContact CD2-CD2 4.49Å; L395-W405 HydrophobicContact CD2-CE3 3.73Å; L395-W405 HydrophobicContact CD2-CZ3 4.46Å; L395-W405 HydrophobicContact CG-CE3 4.04Å; L395-W405 HydrophobicContact CG-CZ3 4.42Å; L395-L442 HydrophobicContact CD1-CD1 3.97Å; L395-L442 HydrophobicContact CD1-CD2 3.68Å; L395-L442 HydrophobicContact CD1-CG 3.92Å; L395-R446 HydrophobicContact CD1-CB 4.15Å; L395-R446 HydrophobicContact CD1-CG 4.38Å; L395-L448 HydrophobicContact CD1-CD2 3.73Å; L395-L448 HydrophobicContact CD2-CD2 3.87Å; L395-L448 HydrophobicContact CG-CD2 4.32Å
396	K	81.6	Confident	80.1	Confident	124 Å²	124	54.4 Å²	54.4	54%	0.539	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-30.3	175.1	-74.6	176.1	-178.7	179.4	0	111.8	L392 Y393 Q394	L392-K396 WeakPolarHBondContact O-CG 3.42Å; L392-K396 PolarHBondContact O-N 3.06Å; L392-K396 VanDerWaalsContact O-N 3.11Å; Y393-K396 PolarHBondContact O-N 2.97Å; Q394-K396 VanDerWaalsContact C-N 3.35Å; Q394-K396 PolarHBondContact O-N 3.15Å
397	Q	78.3	Confident	79.6	Confident	66 Å²	66	55 Å²	55	31%	0.308	31%	0.311	S	S	.	.	H	α-helix	trans	-76.5	-28.3	176.4	-71.6	-161.9	61.5	0	0	113.9	Y393 Q394 L395 N399 S400 T401	Y393-Q397 HydrophobicContact CE1-CG 4.47Å; Y393-Q397 PolarHBondContact O-N 3.29Å; Y393-Q397 PolarHBondContact OH-NE2 2.86Å; Y393-Q397 VanDerWaalsContact OH-NE2 3.15Å; Q394-Q397 WeakPolarHBondContact O-CB 3.46Å; Q394-Q397 PolarHBondContact O-N 3Å; Q394-Q397 VanDerWaalsContact O-N 3.1Å; L395-Q397 PolarHBondContact O-N 3.4Å; Q397-N399 PolarHBondContact O-N 2.71Å; Q397-S400 WeakPolarHBondContact O-CA 3.22Å; Q397-S400 VanDerWaalsContact O-CB 3.3Å; Q397-S400 WeakPolarHBondContact O-CB 3.45Å; Q397-S400 PolarHBondContact O-N 2.77Å; Q397-T401 PolarHBondContact O-N 2.92Å; Q397-T401 VanDerWaalsContact O-N 3.12Å
398	E	68.9	Low	79.2	Confident	49 Å²	49	59.2 Å²	59.2	23%	0.229	34%	0.335	C	S	.	.	H	α-helix	trans	-54	-41	174.6	-65.7	178	138.7	0	0	111.9	Q394 L395 S400 T401 G402 W405	Q394-E398 PolarHBondContact O-N 3.11Å; L395-E398 WeakPolarHBondContact CD2-OE2 3.48Å; L395-E398 WeakPolarHBondContact O-CB 3.48Å; L395-E398 PolarHBondContact O-N 3.31Å; E398-S400 PolarHBondContact O-N 3.02Å; E398-T401 PolarHBondContact O-N 3.01Å; E398-T401 VanDerWaalsContact O-N 3.07Å; E398-G402 WeakPolarHBondContact O-CA 3.36Å; E398-G402 PolarHBondContact O-N 3.3Å; E398-W405 HydrophobicContact CG-CB 3.95Å; E398-W405 WeakPolarHBondContact OE1-CA 3.3Å; E398-W405 WeakPolarHBondContact OE1-CB 3.43Å; E398-W405 PolarHBondContact OE1-N 2.95Å
399	N	65	Low	78.9	Confident	143 Å²	143	58.6 Å²	58.6	77%	0.765	33%	0.333	S	S	*	.	H	α-helix	trans	-58.3	-22	176.6	-71.9	-35.9	0	0	0	112.9	Q397	Q397-N399 PolarHBondContact O-N 2.71Å
400	S	62.1	Low	78.7	Confident	107 Å²	107	59.5 Å²	59.5	75%	0.748	34%	0.339	S	S	*	.	H	α-helix	trans	-92.5	-31.8	177.3	-53	0	0	0	0	112.8	Q397 E398	Q397-S400 WeakPolarHBondContact O-CA 3.22Å; Q397-S400 VanDerWaalsContact O-CB 3.3Å; Q397-S400 WeakPolarHBondContact O-CB 3.45Å; Q397-S400 PolarHBondContact O-N 2.77Å; E398-S400 PolarHBondContact O-N 3.02Å
401	T	70.2	Confident	78.2	Confident	85 Å²	85	63.1 Å²	63.1	52%	0.521	36%	0.356	S	S	.	.	H	α-helix	trans	-98.3	-25.8	-174.5	62.3	0	0	0	0	113.8	Q397 E398 I403	Q397-T401 PolarHBondContact O-N 2.92Å; Q397-T401 VanDerWaalsContact O-N 3.12Å; E398-T401 PolarHBondContact O-N 3.01Å; E398-T401 VanDerWaalsContact O-N 3.07Å; T401-I403 PolarHBondContact O-N 2.85Å; T401-I403 PolarHBondContact OG1-N 3.25Å
402	G	68.9	Low	78.1	Confident	68 Å²	68	65.1 Å²	65.1	70%	0.701	37%	0.365	S	S	*	.			trans	72.6	5.9	-173.7	0	0	0	0	0	114.9	E398	E398-G402 WeakPolarHBondContact O-CA 3.36Å; E398-G402 PolarHBondContact O-N 3.3Å
403	I	69.7	Low	78.1	Confident	119 Å²	119	63.7 Å²	63.7	61%	0.61	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-100.4	124.7	-178.9	-56.7	171.6	0	0	0	108.8	T401 W405	T401-I403 PolarHBondContact O-N 2.85Å; T401-I403 PolarHBondContact OG1-N 3.25Å; I403-W405 PolarHBondContact O-N 2.77Å
404	P	71.6	Confident	78.2	Confident	90 Å²	90	66.8 Å²	66.8	58%	0.584	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-60.8	135.1	175	-19.5	30.4	0	0	0	111.6
405	W	80.1	Confident	78	Confident	11 Å²	11	66.3 Å²	66.3	4%	0.042	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-72.6	128.7	177.4	178.2	48.1	0	0	0	108.9	S391 Q394 L395 E398 I403 G407 N408 I409 L439 L442 L448 I452	S391-W405 VanDerWaalsContact CB-CH2 3.49Å; S391-W405 WeakPolarHBondContact OG-CH2 3.48Å; Q394-W405 HydrophobicContact CG-CD2 4.22Å; Q394-W405 HydrophobicContact CG-CG 3.85Å; L395-W405 HydrophobicContact CD2-CB 4.41Å; L395-W405 HydrophobicContact CD2-CD2 4.49Å; L395-W405 HydrophobicContact CD2-CE3 3.73Å; L395-W405 HydrophobicContact CD2-CZ3 4.46Å; L395-W405 HydrophobicContact CG-CE3 4.04Å; L395-W405 HydrophobicContact CG-CZ3 4.42Å; E398-W405 HydrophobicContact CG-CB 3.95Å; E398-W405 WeakPolarHBondContact OE1-CA 3.3Å; E398-W405 WeakPolarHBondContact OE1-CB 3.43Å; E398-W405 PolarHBondContact OE1-N 2.95Å; I403-W405 PolarHBondContact O-N 2.77Å; W405-G407 VanDerWaalsContact C-N 3.27Å; W405-G407 VanDerWaalsContact CE2-C 3.44Å; W405-G407 VanDerWaalsContact CZ2-CA 3.47Å; W405-G407 VanDerWaalsContact CZ2-O 3.24Å; W405-G407 WeakPolarHBondContact CZ2-O 3.18Å; W405-G407 PolarHBondContact O-N 3.12Å; W405-N408 PolarHBondContact NE1-O 3.22Å; W405-I409 HydrophobicContact CZ2-CD1 3.85Å; W405-L439 HydrophobicContact CH2-CD2 3.81Å; W405-L439 HydrophobicContact CZ3-CD2 4.09Å; W405-L442 HydrophobicContact CZ3-CD2 4.18Å; W405-L448 HydrophobicContact CE3-CD2 4.27Å; W405-L448 HydrophobicContact CZ3-CD2 4.1Å; W405-I452 HydrophobicContact CE3-CD1 4.23Å; W405-I452 WeakPolarHBondContact O-CD1 3.14Å
406	N	79.7	Confident	78.3	Confident	106 Å²	106	65.5 Å²	65.5	57%	0.567	37%	0.368	S	S	*	.			trans	-87	7.1	-177	63	-1.4	0	0	0	113.8	N408	N406-N408 WeakPolarHBondContact OD1-CB 3.25Å; N406-N408 PolarHBondContact OD1-N 3.02Å
407	G	81.3	Confident	78.8	Confident	11 Å²	11	60.2 Å²	60.2	11%	0.113	35%	0.345	C	S	.	.	S	Bend	trans	89.4	-7.4	-175.6	0	0	0	0	0	115.2	W405	W405-G407 VanDerWaalsContact C-N 3.27Å; W405-G407 VanDerWaalsContact CE2-C 3.44Å; W405-G407 VanDerWaalsContact CZ2-CA 3.47Å; W405-G407 VanDerWaalsContact CZ2-O 3.24Å; W405-G407 WeakPolarHBondContact CZ2-O 3.18Å; W405-G407 PolarHBondContact O-N 3.12Å
408	N	83.2	Confident	79.1	Confident	100 Å²	100	60.2 Å²	60.2	54%	0.535	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-89.5	130.9	-179.2	-63.1	-13.6	0	0	0	111.2	W405 N406	W405-N408 PolarHBondContact NE1-O 3.22Å; N406-N408 WeakPolarHBondContact OD1-CB 3.25Å; N406-N408 PolarHBondContact OD1-N 3.02Å
409	I	85.1	Confident	79.9	Confident	11 Å²	11	58.2 Å²	58.2	6%	0.056	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-72.6	148.4	173.6	-56	-62.2	0	0	0	108.5	F387 F390 W405 E414 L417	F387-I409 HydrophobicContact CD2-CG1 4.45Å; F387-I409 HydrophobicContact CE2-CD1 4.47Å; F387-I409 HydrophobicContact CE2-CG1 3.79Å; F387-I409 HydrophobicContact CZ-CD1 4.34Å; F387-I409 HydrophobicContact CZ-CG1 4.01Å; F390-I409 HydrophobicContact CB-CD1 4.03Å; F390-I409 HydrophobicContact CB-CG2 4.16Å; F390-I409 HydrophobicContact CD2-CG2 4.43Å; W405-I409 HydrophobicContact CZ2-CD1 3.85Å; I409-E414 HydrophobicContact CB-CG 3.98Å; I409-E414 HydrophobicContact CG2-CG 4.43Å; I409-L417 HydrophobicContact CG1-CD1 4.36Å
410	V	85.8	Confident	81	Confident	40 Å²	40	51.4 Å²	51.4	24%	0.242	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-64.3	156.2	173.8	-66.1	0	0	0	0	111.1	Y79 E412 G413 E414	Y79-V410 HydrophobicContact CD2-CG2 3.9Å; Y79-V410 HydrophobicContact CE2-CG2 3.3Å; V410-E412 WeakPolarHBondContact CG2-OE2 3.46Å; V410-E412 PolarHBondContact O-N 2.76Å; V410-E412 VanDerWaalsContact O-N 3.09Å; V410-G413 PolarHBondContact O-N 3.19Å; V410-E414 PolarHBondContact O-N 2.9Å
411	E	81.1	Confident	82.2	Confident	77 Å²	77	46.7 Å²	46.7	36%	0.36	27%	0.267	S	S	.	.	H	α-helix	trans	-51.3	-40.2	-172.9	-172.9	177.4	-178.2	0	0	112.6	G413 E414 I415	E411-G413 PolarHBondContact O-N 2.97Å; E411-E414 PolarHBondContact O-N 2.83Å; E411-I415 HydrophobicContact CG-CD1 4.08Å; E411-I415 VanDerWaalsContact O-CG1 3.25Å; E411-I415 WeakPolarHBondContact O-CG1 3.47Å; E411-I415 PolarHBondContact O-N 3.28Å
412	E	86.4	Confident	82.6	Confident	41 Å²	41	44 Å²	44	19%	0.192	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-41.4	178.6	-58.9	81.6	179.9	0	0	112.6	V75 I76 Y79 V410 I416	V75-E412 HydrophobicContact CG1-CG 3.85Å; V75-E412 WeakPolarHBondContact CG1-OE1 3.44Å; I76-E412 HydrophobicContact CG1-CG 4.47Å; Y79-E412 HydrophobicContact CD1-CB 3.82Å; Y79-E412 HydrophobicContact CD2-CB 4.18Å; Y79-E412 HydrophobicContact CE1-CB 4.44Å; Y79-E412 HydrophobicContact CG-CB 3.67Å; Y79-E412 HydrophobicContact CG-CG 4.37Å; V410-E412 WeakPolarHBondContact CG2-OE2 3.46Å; V410-E412 PolarHBondContact O-N 2.76Å; V410-E412 VanDerWaalsContact O-N 3.09Å; E412-I416 WeakPolarHBondContact O-CD1 3.47Å; E412-I416 WeakPolarHBondContact O-CG1 3.37Å; E412-I416 PolarHBondContact O-N 3Å
413	G	88.1	Confident	83.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-73	-37.5	178.1	0	0	0	0	0	112.4	V410 E411 I416 L417	V410-G413 PolarHBondContact O-N 3.19Å; E411-G413 PolarHBondContact O-N 2.97Å; G413-I416 PolarHBondContact O-N 2.91Å; G413-L417 WeakPolarHBondContact O-CG 3.41Å; G413-L417 PolarHBondContact O-N 3.46Å
414	E	86.5	Confident	83.6	Confident	99 Å²	99	38 Å²	38	46%	0.463	20%	0.202	S	C	.	.	H	α-helix	trans	-62.6	-42.4	175.1	-70.1	-170.2	153.3	0	0	111.8	I409 V410 E411 I416 L417 H418	I409-E414 HydrophobicContact CB-CG 3.98Å; I409-E414 HydrophobicContact CG2-CG 4.43Å; V410-E414 PolarHBondContact O-N 2.9Å; E411-E414 PolarHBondContact O-N 2.83Å; E414-I416 VanDerWaalsContact C-N 3.33Å; E414-I416 PolarHBondContact O-N 3.28Å; E414-L417 PolarHBondContact O-N 3.41Å; E414-H418 WeakPolarHBondContact O-CB 3.29Å; E414-H418 PolarHBondContact O-N 2.98Å
415	I	83.2	Confident	83.8	Confident	26 Å²	26	35.7 Å²	35.7	13%	0.133	19%	0.194	C	C	.	.	H	α-helix	trans	-58.6	-45.5	175.7	-69.3	164.5	0	0	0	110.7	C71 I76 E411 H418 Q419	C71-I415 HydrophobicContact CB-CD1 4Å; I76-I415 HydrophobicContact CD1-CG2 4.36Å; E411-I415 HydrophobicContact CG-CD1 4.08Å; E411-I415 VanDerWaalsContact O-CG1 3.25Å; E411-I415 WeakPolarHBondContact O-CG1 3.47Å; E411-I415 PolarHBondContact O-N 3.28Å; I415-H418 PolarHBondContact O-N 3.49Å; I415-Q419 HydrophobicContact CG2-CG 4.49Å; I415-Q419 WeakPolarHBondContact O-CB 3.2Å; I415-Q419 VanDerWaalsContact O-CG 3.26Å; I415-Q419 WeakPolarHBondContact O-CG 3.44Å; I415-Q419 PolarHBondContact O-N 3.17Å
416	I	88	Confident	84.1	Confident	3 Å²	3	36 Å²	36	2%	0.015	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-46.1	179.8	-64.8	164.1	0	0	0	110.8	V54 I58 I76 Y79 V80 F390 E412 G413 E414 Q419 H420	V54-I416 HydrophobicContact CG1-CD1 4.12Å; V54-I416 HydrophobicContact CG1-CG2 4.01Å; V54-I416 HydrophobicContact CG2-CG2 4.13Å; I58-I416 HydrophobicContact CD1-CD1 4.09Å; I58-I416 HydrophobicContact CD1-CG1 4.17Å; I58-I416 HydrophobicContact CG1-CG1 4.08Å; I76-I416 HydrophobicContact CG2-CD1 4.05Å; I76-I416 HydrophobicContact CG2-CG1 4.26Å; Y79-I416 HydrophobicContact CD1-CD1 4.15Å; Y79-I416 HydrophobicContact CE1-CD1 4.32Å; V80-I416 HydrophobicContact CG2-CD1 3.7Å; F390-I416 HydrophobicContact CE2-CB 4.06Å; F390-I416 HydrophobicContact CE2-CG2 4.01Å; F390-I416 HydrophobicContact CZ-CB 4.28Å; F390-I416 HydrophobicContact CZ-CD1 4.18Å; F390-I416 HydrophobicContact CZ-CG2 3.91Å; E412-I416 WeakPolarHBondContact O-CD1 3.47Å; E412-I416 WeakPolarHBondContact O-CG1 3.37Å; E412-I416 PolarHBondContact O-N 3Å; G413-I416 PolarHBondContact O-N 2.91Å; E414-I416 VanDerWaalsContact C-N 3.33Å; E414-I416 PolarHBondContact O-N 3.28Å; I416-Q419 PolarHBondContact O-N 2.76Å; I416-H420 VanDerWaalsContact O-CB 3.31Å; I416-H420 WeakPolarHBondContact O-CB 3.38Å; I416-H420 PolarHBondContact O-N 2.83Å
417	L	90.5	Very high	84.3	Confident	12 Å²	12	33.9 Å²	33.9	6%	0.063	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-43.6	178.9	-73.7	166.1	0	0	0	111.6	H383 L386 F387 F390 I409 G413 E414 H420 A421	H383-L417 PolarHBondContact CE1-O 2.83Å; H383-L417 VanDerWaalsContact CE1-O 3.31Å; L386-L417 HydrophobicContact CB-CD2 3.96Å; F387-L417 HydrophobicContact CB-CD2 4.27Å; F387-L417 HydrophobicContact CD2-CD1 3.57Å; F387-L417 HydrophobicContact CD2-CD2 4.41Å; F387-L417 HydrophobicContact CE2-CD1 4.09Å; F390-L417 HydrophobicContact CD2-CD1 3.88Å; F390-L417 HydrophobicContact CD2-CD2 4.29Å; F390-L417 HydrophobicContact CD2-CG 3.87Å; F390-L417 HydrophobicContact CE2-CD1 4.39Å; F390-L417 HydrophobicContact CE2-CD2 4.26Å; F390-L417 HydrophobicContact CE2-CG 3.88Å; I409-L417 HydrophobicContact CG1-CD1 4.36Å; G413-L417 WeakPolarHBondContact O-CG 3.41Å; G413-L417 PolarHBondContact O-N 3.46Å; E414-L417 PolarHBondContact O-N 3.41Å; L417-H420 PolarHBondContact O-N 3.26Å; L417-A421 WeakPolarHBondContact O-CB 3.38Å; L417-A421 PolarHBondContact O-N 2.98Å
418	H	85.9	Confident	84.5	Confident	66 Å²	66	40.4 Å²	40.4	31%	0.306	22%	0.215	S	C	.	.	H	α-helix	trans	-61.5	-48.4	177.6	-179.4	62.8	0	0	0	111.8	S335 E414 I415 H420 A421 I422	S335-H418 PolarHBondContact OG-CD2 2.84Å; S335-H418 PolarHBondContact OG-NE2 2.99Å; E414-H418 WeakPolarHBondContact O-CB 3.29Å; E414-H418 PolarHBondContact O-N 2.98Å; I415-H418 PolarHBondContact O-N 3.49Å; H418-H420 VanDerWaalsContact C-N 3.34Å; H418-H420 PolarHBondContact O-N 3.5Å; H418-A421 PolarHBondContact O-N 3.42Å; H418-I422 WeakPolarHBondContact CE1-CD1 3.39Å; H418-I422 WeakPolarHBondContact NE2-CD1 3.21Å; H418-I422 WeakPolarHBondContact O-CG1 3.32Å; H418-I422 PolarHBondContact O-N 2.91Å
419	Q	85.7	Confident	84.8	Confident	7 Å²	7	36 Å²	36	3%	0.033	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-41.1	176.8	-73.3	-67.8	-17.4	0	0	111.9	T57 Q61 I62 I415 I416 A421 I422 Q423	T57-Q419 HydrophobicContact CG2-CB 3.56Å; Q61-Q419 HydrophobicContact CG-CG 4.16Å; I62-Q419 PolarHBondContact O-NE2 3.41Å; I62-Q419 VanDerWaalsContact O-NE2 3.15Å; I62-Q419 PolarHBondContact O-OE1 3.22Å; I415-Q419 HydrophobicContact CG2-CG 4.49Å; I415-Q419 WeakPolarHBondContact O-CB 3.2Å; I415-Q419 VanDerWaalsContact O-CG 3.26Å; I415-Q419 WeakPolarHBondContact O-CG 3.44Å; I415-Q419 PolarHBondContact O-N 3.17Å; I416-Q419 PolarHBondContact O-N 2.76Å; Q419-A421 PolarHBondContact O-N 3.48Å; Q419-I422 PolarHBondContact O-N 3.26Å; Q419-Q423 WeakPolarHBondContact O-CB 3.48Å; Q419-Q423 VanDerWaalsContact O-CG 3.25Å; Q419-Q423 WeakPolarHBondContact O-CG 3.34Å; Q419-Q423 PolarHBondContact O-N 3.04Å
420	H	88	Confident	85.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-43.3	175.6	179.9	-83.4	0	0	0	112.1	T57 E382 H383 I416 L417 H418 N424	T57-H420 HydrophobicContact CG2-CB 4.12Å; E382-H420 IonicContact OE2-NE2 3.61Å; H383-H420 AromaticContact CG-ND1 3.92Å; H383-H420 AromaticContact ND1-ND1 3.25Å; H383-H420 PolarHBondContact ND1-ND1 3.39Å; I416-H420 VanDerWaalsContact O-CB 3.31Å; I416-H420 WeakPolarHBondContact O-CB 3.38Å; I416-H420 PolarHBondContact O-N 2.83Å; L417-H420 PolarHBondContact O-N 3.26Å; H418-H420 VanDerWaalsContact C-N 3.34Å; H418-H420 PolarHBondContact O-N 3.5Å; H420-N424 PolarHBondContact NE2-ND2 3.1Å; H420-N424 PolarHBondContact O-N 3.17Å; H420-N424 PolarHBondContact O-ND2 2.89Å
421	A	86.5	Confident	85.4	Confident	8 Å²	8	35.3 Å²	35.3	7%	0.066	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-46.8	178.7	0	0	0	0	0	111.3	L417 H418 Q419 N424 G425 L426 V431	L417-A421 WeakPolarHBondContact O-CB 3.38Å; L417-A421 PolarHBondContact O-N 2.98Å; H418-A421 PolarHBondContact O-N 3.42Å; Q419-A421 PolarHBondContact O-N 3.48Å; A421-N424 CarbonylContact O-C 3.53Å; A421-N424 PolarHBondContact O-N 3.04Å; A421-G425 PolarHBondContact O-N 2.85Å; A421-L426 HydrophobicContact CB-CB 4.1Å; A421-L426 HydrophobicContact CB-CD1 4.43Å; A421-L426 PolarHBondContact O-N 3.48Å; A421-V431 HydrophobicContact CB-CG2 3.84Å
422	I	79.4	Confident	85.9	Confident	28 Å²	28	31.7 Å²	31.7	14%	0.144	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-46.6	179.7	-67.5	164.3	0	0	0	111.6	I62 S335 H418 Q419 N424 G425	I62-I422 HydrophobicContact CB-CG2 4.32Å; I62-I422 HydrophobicContact CG2-CG2 4.18Å; S335-I422 WeakPolarHBondContact O-CD1 3.48Å; H418-I422 WeakPolarHBondContact CE1-CD1 3.39Å; H418-I422 WeakPolarHBondContact NE2-CD1 3.21Å; H418-I422 WeakPolarHBondContact O-CG1 3.32Å; H418-I422 PolarHBondContact O-N 2.91Å; Q419-I422 PolarHBondContact O-N 3.26Å; I422-N424 PolarHBondContact O-N 3.24Å; I422-G425 PolarHBondContact O-N 3.29Å
423	Q	78.6	Confident	86.3	Confident	15 Å²	15	29.8 Å²	29.8	7%	0.07	16%	0.162	C	C	.	.	H	α-helix	trans	-56.3	-35.4	179.2	-78.1	174.7	5.8	0	0	112.4	T57 N60 I62 V365 Q419	T57-Q423 PolarHBondContact O-NE2 3.2Å; T57-Q423 VanDerWaalsContact O-NE2 3.15Å; N60-Q423 PolarHBondContact O-NE2 3.38Å; I62-Q423 HydrophobicContact CD1-CB 4.28Å; I62-Q423 HydrophobicContact CD1-CG 3.52Å; I62-Q423 HydrophobicContact CG1-CG 3.97Å; V365-Q423 WeakPolarHBondContact CG2-O 3.43Å; Q419-Q423 WeakPolarHBondContact O-CB 3.48Å; Q419-Q423 VanDerWaalsContact O-CG 3.25Å; Q419-Q423 WeakPolarHBondContact O-CG 3.34Å; Q419-Q423 PolarHBondContact O-N 3.04Å
424	N	81.4	Confident	86.6	Confident	47 Å²	47	29.8 Å²	29.8	25%	0.251	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	0.8	179.3	-68.2	-75.5	0	0	0	114	A379 H420 A421 I422 L426	A379-N424 HydrophobicContact CB-CB 3.69Å; H420-N424 PolarHBondContact NE2-ND2 3.1Å; H420-N424 PolarHBondContact O-N 3.17Å; H420-N424 PolarHBondContact O-ND2 2.89Å; A421-N424 CarbonylContact O-C 3.53Å; A421-N424 PolarHBondContact O-N 3.04Å; I422-N424 PolarHBondContact O-N 3.24Å; N424-L426 HydrophobicContact CB-CG 4.32Å; N424-L426 PolarHBondContact O-N 3.28Å
425	G	76.1	Confident	86.9	Confident	41 Å²	41	27 Å²	27	42%	0.423	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	38.1	-178.8	0	0	0	0	0	113.9	K376 A421 I422	K376-G425 PolarHBondContact NZ-O 3.43Å; A421-G425 PolarHBondContact O-N 2.85Å; I422-G425 PolarHBondContact O-N 3.29Å
426	L	85.2	Confident	87.4	Confident	18 Å²	18	25.8 Å²	25.8	9%	0.094	14%	0.143	C	C	.	.			trans	-73.2	134.6	172.9	-59.3	-175.8	0	0	0	110	K376 A379 I380 H383 A421 N424 V431	K376-L426 HydrophobicContact CD-CD2 4.47Å; A379-L426 HydrophobicContact CB-CD2 4.24Å; I380-L426 HydrophobicContact CG1-CD2 3.96Å; H383-L426 HydrophobicContact CB-CD1 3.81Å; A421-L426 HydrophobicContact CB-CB 4.1Å; A421-L426 HydrophobicContact CB-CD1 4.43Å; A421-L426 PolarHBondContact O-N 3.48Å; N424-L426 HydrophobicContact CB-CG 4.32Å; N424-L426 PolarHBondContact O-N 3.28Å; L426-V431 HydrophobicContact CB-CG2 4.14Å
427	T	84.5	Confident	87.6	Confident	61 Å²	61	25.9 Å²	25.9	37%	0.374	14%	0.143	S	C	.	.			trans	-80.5	161.8	176.6	62.8	0	0	0	0	111.2	I429 Q430 V431	T427-I429 VanDerWaalsContact C-N 3.26Å; T427-I429 PolarHBondContact O-N 2.95Å; T427-I429 WeakPolarHBondContact OG1-CG2 3.34Å; T427-Q430 WeakPolarHBondContact O-CB 3.39Å; T427-Q430 PolarHBondContact O-N 3.34Å; T427-Q430 VanDerWaalsContact OG1-CG 3.25Å; T427-Q430 WeakPolarHBondContact OG1-CG 3.27Å; T427-Q430 PolarHBondContact OG1-N 2.65Å; T427-Q430 PolarHBondContact OG1-OE1 2.96Å; T427-V431 WeakPolarHBondContact O-CG2 3.15Å; T427-V431 PolarHBondContact O-N 2.88Å
428	E	86	Confident	87.7	Confident	148 Å²	148	25.3 Å²	25.3	69%	0.692	14%	0.14	S	C	*	.	H	α-helix	trans	-56.7	-39.4	178	-64.6	-178.5	174.4	0	0	112.8	V431 A432 L463	E428-V431 PolarHBondContact O-N 3.44Å; E428-A432 WeakPolarHBondContact O-CB 3.42Å; E428-A432 PolarHBondContact O-N 3.38Å; E428-L463 HydrophobicContact CB-CD1 4.4Å
429	I	89.6	Confident	88	Confident	7 Å²	7	22.3 Å²	22.3	4%	0.036	13%	0.126	C	C	.	.	H	α-helix	trans	-67.8	-35.8	175.9	-176.2	63.5	0	0	0	112.3	T427 M433 L460 L463 W464 L468 L469	T427-I429 VanDerWaalsContact C-N 3.26Å; T427-I429 PolarHBondContact O-N 2.95Å; T427-I429 WeakPolarHBondContact OG1-CG2 3.34Å; I429-M433 VanDerWaalsContact O-CB 3.26Å; I429-M433 WeakPolarHBondContact O-CB 3.34Å; I429-M433 PolarHBondContact O-N 2.96Å; I429-L460 HydrophobicContact CD1-CD1 3.67Å; I429-L463 HydrophobicContact CB-CB 4.43Å; I429-L463 HydrophobicContact CD1-CB 3.81Å; I429-W464 HydrophobicContact CD1-CB 3.97Å; I429-L468 HydrophobicContact CG2-CB 4.12Å; I429-L469 HydrophobicContact CG1-CD1 4.24Å; I429-L469 HydrophobicContact CG1-CD2 4.06Å; I429-L469 HydrophobicContact CG1-CG 4.15Å; I429-L469 HydrophobicContact CG2-CD2 4.24Å
430	Q	90.9	Very high	88.2	Confident	7 Å²	7	22.2 Å²	22.2	3%	0.033	13%	0.126	C	C	.	.	H	α-helix	trans	-67	-41.1	174.1	-74.4	171.8	-31.4	0	0	110.6	T427 M433 C434 L469 E473	T427-Q430 WeakPolarHBondContact O-CB 3.39Å; T427-Q430 PolarHBondContact O-N 3.34Å; T427-Q430 VanDerWaalsContact OG1-CG 3.25Å; T427-Q430 WeakPolarHBondContact OG1-CG 3.27Å; T427-Q430 PolarHBondContact OG1-N 2.65Å; T427-Q430 PolarHBondContact OG1-OE1 2.96Å; Q430-M433 WeakPolarHBondContact O-CB 3.3Å; Q430-M433 PolarHBondContact O-N 3.32Å; Q430-C434 WeakPolarHBondContact O-CB 3.5Å; Q430-C434 PolarHBondContact O-N 3.4Å; Q430-C434 PolarHBondContact O-SG 3.24Å; Q430-L469 HydrophobicContact CG-CD2 4.16Å; Q430-E473 PolarHBondContact NE2-OE1 2.88Å
431	V	91.6	Very high	88.2	Confident	30 Å²	30	27.1 Å²	27.1	18%	0.182	14%	0.144	C	C	.	.	H	α-helix	trans	-62.7	-48.5	174.9	173.6	0	0	0	0	110.7	A421 L426 T427 E428 M433 C434 Q435	A421-V431 HydrophobicContact CB-CG2 3.84Å; L426-V431 HydrophobicContact CB-CG2 4.14Å; T427-V431 WeakPolarHBondContact O-CG2 3.15Å; T427-V431 PolarHBondContact O-N 2.88Å; E428-V431 PolarHBondContact O-N 3.44Å; V431-M433 VanDerWaalsContact C-N 3.3Å; V431-M433 PolarHBondContact O-N 3.05Å; V431-C434 WeakPolarHBondContact O-CB 3.48Å; V431-C434 PolarHBondContact O-N 3.03Å; V431-C434 VanDerWaalsContact O-N 3.11Å; V431-Q435 HydrophobicContact CG1-CG 4.5Å; V431-Q435 WeakPolarHBondContact O-CG 3.5Å; V431-Q435 PolarHBondContact O-N 2.85Å
432	A	92.5	Very high	88.2	Confident	2 Å²	2	26.7 Å²	26.7	2%	0.017	14%	0.141	C	C	.	.	H	α-helix	trans	-60.6	-38.6	176.5	0	0	0	0	0	112.4	E428 Q435 W436 L460 L463	E428-A432 WeakPolarHBondContact O-CB 3.42Å; E428-A432 PolarHBondContact O-N 3.38Å; A432-Q435 PolarHBondContact O-N 3.17Å; A432-W436 PolarHBondContact O-N 3.08Å; A432-L460 HydrophobicContact CB-CD1 4.11Å; A432-L463 HydrophobicContact CB-CD1 3.88Å
433	M	93.8	Very high	88.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-46.8	172.4	170.3	-176.6	82.9	0	0	111.3	I380 I429 Q430 V431 Q435 W436 I437 L460 L469 E473 L477	I380-M433 HydrophobicContact CD1-CE 4.2Å; I380-M433 HydrophobicContact CG2-CE 3.93Å; I429-M433 VanDerWaalsContact O-CB 3.26Å; I429-M433 WeakPolarHBondContact O-CB 3.34Å; I429-M433 PolarHBondContact O-N 2.96Å; Q430-M433 WeakPolarHBondContact O-CB 3.3Å; Q430-M433 PolarHBondContact O-N 3.32Å; V431-M433 VanDerWaalsContact C-N 3.3Å; V431-M433 PolarHBondContact O-N 3.05Å; M433-Q435 VanDerWaalsContact C-N 3.35Å; M433-Q435 PolarHBondContact O-N 3.36Å; M433-W436 PolarHBondContact O-N 2.86Å; M433-I437 HydrophobicContact CG-CD1 3.7Å; M433-I437 HydrophobicContact CG-CG1 4.5Å; M433-I437 VanDerWaalsContact O-CG1 3.29Å; M433-I437 WeakPolarHBondContact O-CG1 3.39Å; M433-I437 PolarHBondContact O-N 3.05Å; M433-I437 HydrophobicContact SD-CD1 4.49Å; M433-L460 HydrophobicContact CB-CD1 4.17Å; M433-L469 HydrophobicContact SD-CD1 4.44Å; M433-L469 HydrophobicContact SD-CD2 4.2Å; M433-E473 HydrophobicContact CE-CB 4.11Å; M433-E473 HydrophobicContact CE-CG 4.08Å; M433-E473 HydrophobicContact SD-CB 3.96Å; M433-L477 HydrophobicContact CB-CD2 4.37Å; M433-L477 HydrophobicContact CG-CD1 4.02Å; M433-L477 HydrophobicContact CG-CD2 3.66Å; M433-L477 HydrophobicContact CG-CG 3.66Å; M433-L477 HydrophobicContact SD-CD1 3.97Å; M433-L477 HydrophobicContact SD-CD2 4.49Å; M433-L477 HydrophobicContact SD-CG 3.83Å
434	C	93.9	Very high	88.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.4	-42.8	178.3	-69.2	0	0	0	0	112	I384 Q430 V431 I437 A438	I384-C434 HydrophobicContact CG1-CB 3.7Å; Q430-C434 WeakPolarHBondContact O-CB 3.5Å; Q430-C434 PolarHBondContact O-N 3.4Å; Q430-C434 PolarHBondContact O-SG 3.24Å; V431-C434 WeakPolarHBondContact O-CB 3.48Å; V431-C434 PolarHBondContact O-N 3.03Å; V431-C434 VanDerWaalsContact O-N 3.11Å; C434-I437 PolarHBondContact O-N 3.37Å; C434-A438 VanDerWaalsContact O-CB 3.27Å; C434-A438 WeakPolarHBondContact O-CB 3.39Å; C434-A438 PolarHBondContact O-N 2.77Å
435	Q	93.6	Very high	88.3	Confident	42 Å²	42	31.3 Å²	31.3	20%	0.196	16%	0.159	C	C	.	.	H	α-helix	trans	-58.9	-48.9	175.6	-69.8	177.8	-9.2	0	0	111.2	F387 V431 A432 M433 I437 A438 L439 T456	F387-Q435 HydrophobicContact CD2-CG 3.79Å; F387-Q435 HydrophobicContact CE1-CB 4.37Å; F387-Q435 HydrophobicContact CE1-CG 4.37Å; F387-Q435 HydrophobicContact CE2-CB 4.41Å; F387-Q435 HydrophobicContact CE2-CG 3.57Å; F387-Q435 HydrophobicContact CG-CG 4.31Å; F387-Q435 HydrophobicContact CZ-CB 4.25Å; F387-Q435 HydrophobicContact CZ-CG 3.87Å; V431-Q435 HydrophobicContact CG1-CG 4.5Å; V431-Q435 WeakPolarHBondContact O-CG 3.5Å; V431-Q435 PolarHBondContact O-N 2.85Å; A432-Q435 PolarHBondContact O-N 3.17Å; M433-Q435 VanDerWaalsContact C-N 3.35Å; M433-Q435 PolarHBondContact O-N 3.36Å; Q435-I437 PolarHBondContact O-N 2.87Å; Q435-A438 PolarHBondContact O-N 3.23Å; Q435-L439 WeakPolarHBondContact O-CB 3.19Å; Q435-L439 VanDerWaalsContact O-CG 3.32Å; Q435-L439 WeakPolarHBondContact O-CG 3.5Å; Q435-L439 PolarHBondContact O-N 3.19Å; Q435-T456 HydrophobicContact CB-CG2 4.2Å
436	W	94.2	Very high	88.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.1	-52.7	175.6	170.2	-100.3	0	0	0	111.7	A432 M433 A438 L439 I440 L453 T456 F457 L460 S480 F481 F484 L520	A432-W436 PolarHBondContact O-N 3.08Å; M433-W436 PolarHBondContact O-N 2.86Å; W436-A438 VanDerWaalsContact C-N 3.32Å; W436-A438 PolarHBondContact O-N 2.84Å; W436-L439 PolarHBondContact O-N 3.19Å; W436-I440 HydrophobicContact CD2-CD1 4.35Å; W436-I440 HydrophobicContact CD2-CG1 3.97Å; W436-I440 HydrophobicContact CE3-CD1 4.31Å; W436-I440 HydrophobicContact CE3-CG1 4.39Å; W436-I440 HydrophobicContact CG-CG1 4.48Å; W436-I440 HydrophobicContact CH2-CD1 3.66Å; W436-I440 HydrophobicContact CH2-CG1 4.21Å; W436-I440 HydrophobicContact CZ2-CD1 3.67Å; W436-I440 HydrophobicContact CZ2-CG1 3.74Å; W436-I440 HydrophobicContact CZ3-CD1 3.96Å; W436-I440 HydrophobicContact CZ3-CG1 4.47Å; W436-I440 WeakPolarHBondContact O-CG1 3.46Å; W436-I440 PolarHBondContact O-N 3.45Å; W436-L453 HydrophobicContact CZ3-CB 4.28Å; W436-T456 HydrophobicContact CB-CG2 4.16Å; W436-T456 HydrophobicContact CE3-CG2 4.46Å; W436-F457 HydrophobicContact CD2-CD2 4.17Å; W436-F457 HydrophobicContact CE3-CB 3.92Å; W436-F457 HydrophobicContact CE3-CD2 4.05Å; W436-F457 HydrophobicContact CE3-CG 4.39Å; W436-F457 HydrophobicContact CH2-CB 4.12Å; W436-F457 AromaticContact CH2-CD2 3.96Å; W436-F457 HydrophobicContact CH2-CD2 3.96Å; W436-F457 HydrophobicContact CH2-CG 4.12Å; W436-F457 HydrophobicContact CZ2-CD2 4.1Å; W436-F457 HydrophobicContact CZ3-CB 3.54Å; W436-F457 AromaticContact CZ3-CD2 3.97Å; W436-F457 HydrophobicContact CZ3-CD2 3.97Å; W436-F457 AromaticContact CZ3-CG 3.99Å; W436-F457 HydrophobicContact CZ3-CG 3.99Å; W436-L460 HydrophobicContact CB-CD2 4.07Å; W436-L460 HydrophobicContact CG-CD2 4.03Å; W436-S480 PolarHBondContact NE1-OG 2.75Å; W436-S480 VanDerWaalsContact NE1-OG 3.08Å; W436-F481 AromaticContact CE2-CE1 3.89Å; W436-F481 HydrophobicContact CZ2-CD1 4.07Å; W436-F481 HydrophobicContact CZ2-CE1 4.22Å; W436-F481 AromaticContact NE1-CD1 3.48Å; W436-F481 AromaticContact NE1-CE1 3.37Å; W436-F484 HydrophobicContact CH2-CD1 4.03Å; W436-F484 HydrophobicContact CH2-CE1 4.11Å; W436-F484 HydrophobicContact CH2-CG 4.21Å; W436-F484 HydrophobicContact CH2-CZ 4.38Å; W436-F484 HydrophobicContact CZ2-CB 4.37Å; W436-F484 HydrophobicContact CZ2-CD1 4.09Å; W436-F484 HydrophobicContact CZ2-CG 4.16Å; W436-L520 HydrophobicContact CH2-CD1 4.05Å; W436-L520 HydrophobicContact CZ2-CD1 3.58Å
437	I	92.9	Very high	87.7	Confident	5 Å²	5	40.6 Å²	40.6	3%	0.026	20%	0.197	C	C	.	.	H	α-helix	trans	-61.2	-42.8	-177.8	-64.9	164.7	0	0	0	111.1	I384 M433 C434 Q435 I440 R441 L477	I384-I437 HydrophobicContact CD1-CB 4.28Å; I384-I437 HydrophobicContact CD1-CD1 4Å; I384-I437 HydrophobicContact CD1-CG2 4.04Å; I384-I437 HydrophobicContact CG1-CB 4.43Å; I384-I437 HydrophobicContact CG1-CG2 4.45Å; I384-I437 HydrophobicContact CG2-CG2 4.04Å; M433-I437 HydrophobicContact CG-CD1 3.7Å; M433-I437 HydrophobicContact CG-CG1 4.5Å; M433-I437 VanDerWaalsContact O-CG1 3.29Å; M433-I437 WeakPolarHBondContact O-CG1 3.39Å; M433-I437 PolarHBondContact O-N 3.05Å; M433-I437 HydrophobicContact SD-CD1 4.49Å; C434-I437 PolarHBondContact O-N 3.37Å; Q435-I437 PolarHBondContact O-N 2.87Å; I437-I440 PolarHBondContact O-N 2.99Å; I437-R441 WeakPolarHBondContact O-CG 3.3Å; I437-R441 PolarHBondContact O-N 2.68Å; I437-R441 VanDerWaalsContact O-N 3.1Å; I437-L477 HydrophobicContact CG1-CD2 4.48Å
438	A	91.2	Very high	87.6	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.5	-44	178.1	0	0	0	0	0	111.9	I384 F387 C434 Q435 W436 R441 L442	I384-A438 HydrophobicContact CG2-CB 4.18Å; I384-A438 WeakPolarHBondContact O-CB 3.41Å; F387-A438 HydrophobicContact CB-CB 4.04Å; F387-A438 HydrophobicContact CD1-CB 3.67Å; F387-A438 HydrophobicContact CG-CB 4.26Å; C434-A438 VanDerWaalsContact O-CB 3.27Å; C434-A438 WeakPolarHBondContact O-CB 3.39Å; C434-A438 PolarHBondContact O-N 2.77Å; Q435-A438 PolarHBondContact O-N 3.23Å; W436-A438 VanDerWaalsContact C-N 3.32Å; W436-A438 PolarHBondContact O-N 2.84Å; A438-R441 PolarHBondContact O-N 3.48Å; A438-L442 WeakPolarHBondContact O-CB 3.38Å; A438-L442 PolarHBondContact O-N 2.9Å
439	L	92	Very high	87.5	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-69.7	-34.3	178.7	-71.7	173.1	0	0	0	112.9	F387 W405 Q435 W436 L442 N443 L448 I452 L453 T456	F387-L439 HydrophobicContact CE1-CD1 4.27Å; F387-L439 HydrophobicContact CE1-CD2 4.03Å; F387-L439 HydrophobicContact CE1-CG 3.88Å; W405-L439 HydrophobicContact CH2-CD2 3.81Å; W405-L439 HydrophobicContact CZ3-CD2 4.09Å; Q435-L439 WeakPolarHBondContact O-CB 3.19Å; Q435-L439 VanDerWaalsContact O-CG 3.32Å; Q435-L439 WeakPolarHBondContact O-CG 3.5Å; Q435-L439 PolarHBondContact O-N 3.19Å; W436-L439 PolarHBondContact O-N 3.19Å; L439-L442 HydrophobicContact CD2-CD2 4.42Å; L439-L442 PolarHBondContact O-N 2.93Å; L439-N443 WeakPolarHBondContact O-CB 3.4Å; L439-N443 PolarHBondContact O-N 3.45Å; L439-L448 HydrophobicContact CD2-CD1 4.14Å; L439-I452 HydrophobicContact CD1-CG2 4.08Å; L439-I452 HydrophobicContact CD2-CG2 4.47Å; L439-L453 HydrophobicContact CB-CD2 3.68Å; L439-T456 HydrophobicContact CD1-CG2 4Å; L439-T456 VanDerWaalsContact CD1-OG1 3.25Å; L439-T456 WeakPolarHBondContact CD1-OG1 3.44Å
440	I	90.6	Very high	87.5	Confident	5 Å²	5	34.5 Å²	34.5	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-63	-44.2	171.8	-68.1	-45.9	0	0	0	111	W436 I437 L442 N443 Y444 L453 V483 F484	W436-I440 HydrophobicContact CD2-CD1 4.35Å; W436-I440 HydrophobicContact CD2-CG1 3.97Å; W436-I440 HydrophobicContact CE3-CD1 4.31Å; W436-I440 HydrophobicContact CE3-CG1 4.39Å; W436-I440 HydrophobicContact CG-CG1 4.48Å; W436-I440 HydrophobicContact CH2-CD1 3.66Å; W436-I440 HydrophobicContact CH2-CG1 4.21Å; W436-I440 HydrophobicContact CZ2-CD1 3.67Å; W436-I440 HydrophobicContact CZ2-CG1 3.74Å; W436-I440 HydrophobicContact CZ3-CD1 3.96Å; W436-I440 HydrophobicContact CZ3-CG1 4.47Å; W436-I440 WeakPolarHBondContact O-CG1 3.46Å; W436-I440 PolarHBondContact O-N 3.45Å; I437-I440 PolarHBondContact O-N 2.99Å; I440-L442 VanDerWaalsContact C-N 3.3Å; I440-L442 PolarHBondContact O-N 2.88Å; I440-N443 PolarHBondContact O-N 3.38Å; I440-Y444 PolarHBondContact O-N 2.82Å; I440-Y444 VanDerWaalsContact O-N 3.16Å; I440-L453 HydrophobicContact CD1-CD1 4.03Å; I440-L453 HydrophobicContact CD1-CD2 4.04Å; I440-V483 HydrophobicContact CG2-CB 4.42Å; I440-V483 HydrophobicContact CG2-CG1 4.06Å; I440-F484 HydrophobicContact CD1-CB 3.8Å; I440-F484 HydrophobicContact CD1-CD2 3.33Å; I440-F484 HydrophobicContact CD1-CE2 4.06Å; I440-F484 HydrophobicContact CD1-CG 3.7Å; I440-F484 HydrophobicContact CG1-CB 4.17Å; I440-F484 HydrophobicContact CG2-CB 4.04Å
441	R	88.1	Confident	87.4	Confident	103 Å²	103	37 Å²	37	39%	0.389	18%	0.18	S	C	.	.	H	α-helix	trans	-61.5	-40.3	175	-72.2	174.8	175.5	-169.5	-4.2	111.5	Y388 I437 A438 Y444 T445	Y388-R441 HydrophobicContact CD2-CB 4.23Å; Y388-R441 HydrophobicContact CE2-CB 4.3Å; I437-R441 WeakPolarHBondContact O-CG 3.3Å; I437-R441 PolarHBondContact O-N 2.68Å; I437-R441 VanDerWaalsContact O-N 3.1Å; A438-R441 PolarHBondContact O-N 3.48Å; R441-Y444 PolarHBondContact O-N 3.33Å; R441-T445 PolarHBondContact O-N 3.23Å; R441-T445 PolarHBondContact O-OG1 2.99Å
442	L	86.4	Confident	87.3	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.8	-42.2	177.4	-170.6	62.8	0	0	0	112.4	Y388 S391 L392 L395 W405 A438 L439 I440 Y444 T445 R446 L448	Y388-L442 HydrophobicContact CD2-CB 4.03Å; Y388-L442 HydrophobicContact CD2-CD1 4.29Å; Y388-L442 HydrophobicContact CE2-CB 3.96Å; Y388-L442 HydrophobicContact CE2-CD1 3.78Å; Y388-L442 HydrophobicContact CE2-CG 4.5Å; S391-L442 VanDerWaalsContact CB-CD2 3.43Å; L392-L442 HydrophobicContact CB-CD1 4.3Å; L392-L442 HydrophobicContact CD1-CD1 4Å; L395-L442 HydrophobicContact CD1-CD1 3.97Å; L395-L442 HydrophobicContact CD1-CD2 3.68Å; L395-L442 HydrophobicContact CD1-CG 3.92Å; W405-L442 HydrophobicContact CZ3-CD2 4.18Å; A438-L442 WeakPolarHBondContact O-CB 3.38Å; A438-L442 PolarHBondContact O-N 2.9Å; L439-L442 HydrophobicContact CD2-CD2 4.42Å; L439-L442 PolarHBondContact O-N 2.93Å; I440-L442 VanDerWaalsContact C-N 3.3Å; I440-L442 PolarHBondContact O-N 2.88Å; L442-Y444 PolarHBondContact O-N 3.47Å; L442-T445 PolarHBondContact O-N 2.98Å; L442-T445 VanDerWaalsContact O-N 3.07Å; L442-T445 PolarHBondContact O-OG1 3.41Å; L442-T445 VanDerWaalsContact O-OG1 3.12Å; L442-R446 HydrophobicContact CD1-CB 4.44Å; L442-R446 HydrophobicContact CD1-CG 4.3Å; L442-R446 PolarHBondContact O-N 3.33Å; L442-L448 HydrophobicContact CB-CD1 4.27Å; L442-L448 HydrophobicContact CD2-CD1 4.25Å; L442-L448 HydrophobicContact CD2-CD2 4.18Å; L442-L448 HydrophobicContact CG-CD1 4.25Å; L442-L448 HydrophobicContact CG-CD2 4.35Å
443	N	85.6	Confident	87.3	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-29.7	177	-169	47.1	0	0	0	112.5	L439 I440 R446 L448 Q450 L453 H487	L439-N443 WeakPolarHBondContact O-CB 3.4Å; L439-N443 PolarHBondContact O-N 3.45Å; I440-N443 PolarHBondContact O-N 3.38Å; N443-R446 CarbonylContact C-O 3.45Å; N443-R446 VanDerWaalsContact C-O 3.28Å; N443-R446 WeakPolarHBondContact CA-O 3.5Å; N443-L448 HydrophobicContact CB-CD1 4.01Å; N443-L448 HydrophobicContact CB-CG 4.32Å; N443-L448 PolarHBondContact OD1-N 3.39Å; N443-Q450 PolarHBondContact OD1-NE2 3.44Å; N443-Q450 VanDerWaalsContact OD1-NE2 3.13Å; N443-L453 HydrophobicContact CB-CD1 3.98Å; N443-L453 WeakPolarHBondContact ND2-CD1 3Å; N443-H487 PolarHBondContact O-CE1 2.79Å
444	Y	78.3	Confident	87.2	Confident	135 Å²	135	36.1 Å²	36.1	53%	0.529	17%	0.174	S	C	.	.	H	α-helix	trans	-72.3	-35.5	175.6	-173.1	-92.6	0	0	0	112.3	I440 R441 L442 H487	I440-Y444 PolarHBondContact O-N 2.82Å; I440-Y444 VanDerWaalsContact O-N 3.16Å; R441-Y444 PolarHBondContact O-N 3.33Å; L442-Y444 PolarHBondContact O-N 3.47Å; Y444-H487 HydrophobicContact CD2-CB 4.28Å; Y444-H487 AromaticContact CD2-CD2 3.53Å; Y444-H487 AromaticContact CE2-CD2 3.98Å
445	T	76.6	Confident	87.1	Confident	49 Å²	49	41.2 Å²	41.2	30%	0.301	20%	0.197	S	C	.	.	H	α-helix	trans	-91.4	-25.2	-179.2	59.1	0	0	0	0	113.5	Y388 R441 L442	Y388-T445 PolarHBondContact OH-OG1 2.97Å; R441-T445 PolarHBondContact O-N 3.23Å; R441-T445 PolarHBondContact O-OG1 2.99Å; L442-T445 PolarHBondContact O-N 2.98Å; L442-T445 VanDerWaalsContact O-N 3.07Å; L442-T445 PolarHBondContact O-OG1 3.41Å; L442-T445 VanDerWaalsContact O-OG1 3.12Å
446	R	75.1	Confident	87.1	Confident	142 Å²	142	39.8 Å²	39.8	54%	0.536	19%	0.192	S	C	.	.	S	Bend	trans	-141.2	133.3	-177.9	-65.6	-68	177.1	164.2	-5.7	108.8	L392 L395 L442 N443 L448	L392-R446 HydrophobicContact CD1-CG 4.46Å; L395-R446 HydrophobicContact CD1-CB 4.15Å; L395-R446 HydrophobicContact CD1-CG 4.38Å; L442-R446 HydrophobicContact CD1-CB 4.44Å; L442-R446 HydrophobicContact CD1-CG 4.3Å; L442-R446 PolarHBondContact O-N 3.33Å; N443-R446 CarbonylContact C-O 3.45Å; N443-R446 VanDerWaalsContact C-O 3.28Å; N443-R446 WeakPolarHBondContact CA-O 3.5Å; R446-L448 PolarHBondContact O-N 2.92Å; R446-L448 VanDerWaalsContact O-N 3.12Å
447	S	74.5	Confident	87.1	Confident	112 Å²	112	39.8 Å²	39.8	78%	0.783	19%	0.192	S	C	*	.			trans	-66.7	112.3	175	57.2	0	0	0	0	110.4
448	L	82.9	Confident	87.1	Confident	7 Å²	7	43.5 Å²	43.5	4%	0.037	21%	0.208	C	C	.	.			trans	-92.9	156.4	172.3	-65	178.7	0	0	0	110.6	L395 W405 L439 L442 N443 R446 Q450 L453	L395-L448 HydrophobicContact CD1-CD2 3.73Å; L395-L448 HydrophobicContact CD2-CD2 3.87Å; L395-L448 HydrophobicContact CG-CD2 4.32Å; W405-L448 HydrophobicContact CE3-CD2 4.27Å; W405-L448 HydrophobicContact CZ3-CD2 4.1Å; L439-L448 HydrophobicContact CD2-CD1 4.14Å; L442-L448 HydrophobicContact CB-CD1 4.27Å; L442-L448 HydrophobicContact CD2-CD1 4.25Å; L442-L448 HydrophobicContact CD2-CD2 4.18Å; L442-L448 HydrophobicContact CG-CD1 4.25Å; L442-L448 HydrophobicContact CG-CD2 4.35Å; N443-L448 HydrophobicContact CB-CD1 4.01Å; N443-L448 HydrophobicContact CB-CG 4.32Å; N443-L448 PolarHBondContact OD1-N 3.39Å; R446-L448 PolarHBondContact O-N 2.92Å; R446-L448 VanDerWaalsContact O-N 3.12Å; L448-Q450 PolarHBondContact O-N 3.47Å; L448-Q450 PolarHBondContact O-NE2 3.48Å; L448-L453 HydrophobicContact CD1-CD2 4.47Å
449	D	84.1	Confident	87	Confident	78 Å²	78	48 Å²	48	42%	0.417	23%	0.229	S	C	.	.			trans	-65.3	126.1	163.4	-81.7	-17.7	0	0	0	109.4	I451 I452	D449-I451 HydrophobicContact CB-CG2 4.18Å; D449-I451 PolarHBondContact O-N 3.25Å; D449-I451 VanDerWaalsContact O-N 3.12Å; D449-I452 HydrophobicContact CB-CD1 4.36Å; D449-I452 HydrophobicContact CB-CG1 4.5Å; D449-I452 WeakPolarHBondContact O-CB 3.2Å; D449-I452 WeakPolarHBondContact O-CG1 3.43Å; D449-I452 PolarHBondContact O-N 3.32Å
450	Q	88	Confident	87.1	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-72.4	-14.1	-167.7	-54	-62.5	-37.2	0	0	112	N443 L448 I452 L453 L454 D509 H512 L513	N443-Q450 PolarHBondContact OD1-NE2 3.44Å; N443-Q450 VanDerWaalsContact OD1-NE2 3.13Å; L448-Q450 PolarHBondContact O-N 3.47Å; L448-Q450 PolarHBondContact O-NE2 3.48Å; Q450-I452 VanDerWaalsContact C-N 3.25Å; Q450-I452 PolarHBondContact O-N 2.63Å; Q450-L453 PolarHBondContact O-N 2.94Å; Q450-L454 PolarHBondContact O-N 3.12Å; Q450-D509 VanDerWaalsContact CB-OD1 3.29Å; Q450-D509 WeakPolarHBondContact CB-OD1 3.38Å; Q450-D509 VanDerWaalsContact CG-OD1 3.32Å; Q450-D509 WeakPolarHBondContact CG-OD1 3.37Å; Q450-D509 WeakPolarHBondContact CG-OD2 3.47Å; Q450-D509 PolarHBondContact N-OD1 2.9Å; Q450-H512 HydrophobicContact CB-CB 4.02Å; Q450-L513 HydrophobicContact CB-CB 4.03Å; Q450-L513 HydrophobicContact CG-CB 3.92Å; Q450-L513 HydrophobicContact CG-CD1 4.4Å
451	I	89	Confident	87.1	Confident	60 Å²	60	50.4 Å²	50.4	31%	0.308	24%	0.241	S	C	.	.	H	α-helix	trans	-62.6	-31.9	170.4	-163	168.5	0	0	0	112.4	D449 L454 H455	D449-I451 HydrophobicContact CB-CG2 4.18Å; D449-I451 PolarHBondContact O-N 3.25Å; D449-I451 VanDerWaalsContact O-N 3.12Å; I451-L454 PolarHBondContact O-N 3.44Å; I451-H455 PolarHBondContact O-N 2.84Å
452	I	90.1	Very high	87.2	Confident	9 Å²	9	49.8 Å²	49.8	5%	0.046	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-50.8	178	-60.2	171.2	0	0	0	108.8	W405 L439 D449 Q450 L454 H455 T456	W405-I452 HydrophobicContact CE3-CD1 4.23Å; W405-I452 WeakPolarHBondContact O-CD1 3.14Å; L439-I452 HydrophobicContact CD1-CG2 4.08Å; L439-I452 HydrophobicContact CD2-CG2 4.47Å; D449-I452 HydrophobicContact CB-CD1 4.36Å; D449-I452 HydrophobicContact CB-CG1 4.5Å; D449-I452 WeakPolarHBondContact O-CB 3.2Å; D449-I452 WeakPolarHBondContact O-CG1 3.43Å; D449-I452 PolarHBondContact O-N 3.32Å; Q450-I452 VanDerWaalsContact C-N 3.25Å; Q450-I452 PolarHBondContact O-N 2.63Å; I452-L454 VanDerWaalsContact C-N 3.32Å; I452-L454 PolarHBondContact O-N 2.81Å; I452-H455 PolarHBondContact O-N 3.35Å; I452-T456 PolarHBondContact O-N 3.33Å; I452-T456 PolarHBondContact O-OG1 3.41Å
453	L	92.1	Very high	87.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-41.3	177.8	-60.9	-173.9	0	0	0	111.8	W436 L439 I440 N443 L448 Q450 H455 T456 F457 F484	W436-L453 HydrophobicContact CZ3-CB 4.28Å; L439-L453 HydrophobicContact CB-CD2 3.68Å; I440-L453 HydrophobicContact CD1-CD1 4.03Å; I440-L453 HydrophobicContact CD1-CD2 4.04Å; N443-L453 HydrophobicContact CB-CD1 3.98Å; N443-L453 WeakPolarHBondContact ND2-CD1 3Å; L448-L453 HydrophobicContact CD1-CD2 4.47Å; Q450-L453 PolarHBondContact O-N 2.94Å; L453-H455 VanDerWaalsContact C-N 3.35Å; L453-H455 PolarHBondContact O-N 3.44Å; L453-T456 PolarHBondContact O-N 2.77Å; L453-F457 WeakPolarHBondContact O-CB 3.29Å; L453-F457 PolarHBondContact O-N 2.71Å; L453-F484 HydrophobicContact CD1-CD2 4.25Å; L453-F484 HydrophobicContact CD1-CE2 3.69Å
454	L	92.6	Very high	87.3	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-59.4	-45.2	177	-177.4	69	0	0	0	111.8	Q450 I451 I452 K458 E515 C516 M519	Q450-L454 PolarHBondContact O-N 3.12Å; I451-L454 PolarHBondContact O-N 3.44Å; I452-L454 VanDerWaalsContact C-N 3.32Å; I452-L454 PolarHBondContact O-N 2.81Å; L454-K458 HydrophobicContact CG-CD 4.46Å; L454-K458 WeakPolarHBondContact O-CG 3.35Å; L454-K458 PolarHBondContact O-N 2.99Å; L454-E515 HydrophobicContact CD1-CB 4.24Å; L454-E515 HydrophobicContact CD1-CG 3.86Å; L454-E515 HydrophobicContact CD2-CG 4.39Å; L454-C516 HydrophobicContact CB-CB 4.17Å; L454-C516 HydrophobicContact CD1-CB 3.77Å; L454-M519 HydrophobicContact CD1-CE 3.5Å; L454-M519 VanDerWaalsContact CD1-CE 3.5Å; L454-M519 HydrophobicContact CD1-SD 4.44Å; L454-M519 HydrophobicContact CG-CE 4.44Å
455	H	92	Very high	87.4	Confident	106 Å²	106	50.3 Å²	50.3	49%	0.491	27%	0.266	S	S	.	.	H	α-helix	trans	-67.5	-46.5	177.9	-74.1	172.6	0	0	0	112.3	I451 I452 L453 F457 K458 Q459	I451-H455 PolarHBondContact O-N 2.84Å; I452-H455 PolarHBondContact O-N 3.35Å; L453-H455 VanDerWaalsContact C-N 3.35Å; L453-H455 PolarHBondContact O-N 3.44Å; H455-F457 VanDerWaalsContact C-N 3.27Å; H455-F457 PolarHBondContact O-N 3.18Å; H455-K458 WeakPolarHBondContact O-CB 3.36Å; H455-K458 PolarHBondContact O-N 2.88Å; H455-Q459 PolarHBondContact O-N 2.87Å
456	T	92.1	Very high	87.1	Confident	13 Å²	13	51.7 Å²	51.7	8%	0.08	27%	0.272	C	S	.	.	H	α-helix	trans	-59.6	-40.5	177.2	-53.2	0	0	0	0	111.2	Q435 W436 L439 I452 L453 Q459 L460	Q435-T456 HydrophobicContact CB-CG2 4.2Å; W436-T456 HydrophobicContact CB-CG2 4.16Å; W436-T456 HydrophobicContact CE3-CG2 4.46Å; L439-T456 HydrophobicContact CD1-CG2 4Å; L439-T456 VanDerWaalsContact CD1-OG1 3.25Å; L439-T456 WeakPolarHBondContact CD1-OG1 3.44Å; I452-T456 PolarHBondContact O-N 3.33Å; I452-T456 PolarHBondContact O-OG1 3.41Å; L453-T456 PolarHBondContact O-N 2.77Å; T456-Q459 PolarHBondContact O-N 2.81Å; T456-L460 WeakPolarHBondContact O-CB 3.45Å; T456-L460 PolarHBondContact O-N 3.27Å
457	F	94	Very high	86.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69	-38.1	177.6	-165.2	-120.4	0	0	0	112.7	W436 L453 H455 Q459 L460 I461 F481 M519 L520	W436-F457 HydrophobicContact CD2-CD2 4.17Å; W436-F457 HydrophobicContact CE3-CB 3.92Å; W436-F457 HydrophobicContact CE3-CD2 4.05Å; W436-F457 HydrophobicContact CE3-CG 4.39Å; W436-F457 HydrophobicContact CH2-CB 4.12Å; W436-F457 AromaticContact CH2-CD2 3.96Å; W436-F457 HydrophobicContact CH2-CD2 3.96Å; W436-F457 HydrophobicContact CH2-CG 4.12Å; W436-F457 HydrophobicContact CZ2-CD2 4.1Å; W436-F457 HydrophobicContact CZ3-CB 3.54Å; W436-F457 AromaticContact CZ3-CD2 3.97Å; W436-F457 HydrophobicContact CZ3-CD2 3.97Å; W436-F457 AromaticContact CZ3-CG 3.99Å; W436-F457 HydrophobicContact CZ3-CG 3.99Å; L453-F457 WeakPolarHBondContact O-CB 3.29Å; L453-F457 PolarHBondContact O-N 2.71Å; H455-F457 VanDerWaalsContact C-N 3.27Å; H455-F457 PolarHBondContact O-N 3.18Å; F457-Q459 VanDerWaalsContact C-N 3.31Å; F457-Q459 PolarHBondContact O-N 2.86Å; F457-L460 HydrophobicContact CD2-CD2 4.16Å; F457-L460 HydrophobicContact CE2-CD2 4.28Å; F457-L460 PolarHBondContact O-N 3.36Å; F457-I461 HydrophobicContact CD1-CD1 3.64Å; F457-I461 HydrophobicContact CD1-CG1 4.45Å; F457-I461 HydrophobicContact CE1-CD1 3.14Å; F457-I461 HydrophobicContact CE1-CG1 3.99Å; F457-I461 HydrophobicContact CE2-CD1 4.32Å; F457-I461 HydrophobicContact CE2-CG1 4.31Å; F457-I461 HydrophobicContact CG-CD1 4.35Å; F457-I461 HydrophobicContact CZ-CD1 3.54Å; F457-I461 HydrophobicContact CZ-CG1 3.9Å; F457-I461 WeakPolarHBondContact O-CG1 3.34Å; F457-I461 PolarHBondContact O-N 2.92Å; F457-F481 AromaticContact CE2-CE1 3.84Å; F457-F481 HydrophobicContact CE2-CE1 3.84Å; F457-F481 HydrophobicContact CE2-CZ 4.09Å; F457-M519 HydrophobicContact CB-CE 4.13Å; F457-M519 HydrophobicContact CD1-CE 3.47Å; F457-M519 VanDerWaalsContact CD1-CE 3.47Å; F457-M519 HydrophobicContact CD1-CG 4.18Å; F457-M519 HydrophobicContact CE1-CE 4.33Å; F457-M519 HydrophobicContact CE1-CG 4.13Å; F457-M519 HydrophobicContact CG-CE 4.28Å; F457-L520 HydrophobicContact CD1-CB 4.34Å; F457-L520 HydrophobicContact CD2-CD1 4.45Å; F457-L520 HydrophobicContact CE1-CB 3.72Å; F457-L520 HydrophobicContact CE1-CD1 4.49Å; F457-L520 HydrophobicContact CE1-CG 4.35Å; F457-L520 HydrophobicContact CE2-CD1 3.98Å; F457-L520 HydrophobicContact CE2-CG 4.44Å; F457-L520 HydrophobicContact CZ-CB 3.9Å; F457-L520 HydrophobicContact CZ-CD1 4.03Å; F457-L520 HydrophobicContact CZ-CG 4Å
458	K	93	Very high	86.8	Confident	83 Å²	83	53.2 Å²	53.2	36%	0.361	27%	0.272	S	S	.	.	H	α-helix	trans	-58.8	-44.1	172.3	-77.2	173.4	-178.8	170	0	111.1	L454 H455 I461 S462 E515 M519	L454-K458 HydrophobicContact CG-CD 4.46Å; L454-K458 WeakPolarHBondContact O-CG 3.35Å; L454-K458 PolarHBondContact O-N 2.99Å; H455-K458 WeakPolarHBondContact O-CB 3.36Å; H455-K458 PolarHBondContact O-N 2.88Å; K458-I461 PolarHBondContact O-N 2.95Å; K458-S462 WeakPolarHBondContact O-CB 3.3Å; K458-S462 PolarHBondContact O-N 2.8Å; K458-E515 IonicContact NZ-OE1 3.94Å; K458-E515 PolarHBondContact NZ-OE1 2.81Å; K458-M519 HydrophobicContact CD-CE 4.29Å; K458-M519 HydrophobicContact CD-SD 4.4Å; K458-M519 HydrophobicContact CG-CE 3.47Å; K458-M519 VanDerWaalsContact CG-CE 3.47Å; K458-M519 HydrophobicContact CG-SD 3.72Å
459	Q	90.5	Very high	86.8	Confident	94 Å²	94	53.8 Å²	53.8	44%	0.439	28%	0.275	S	S	.	.	H	α-helix	trans	-62.9	-47.3	176.7	-174.5	177.9	2.1	0	0	111.5	H455 T456 F457 I461 S462 L463	H455-Q459 PolarHBondContact O-N 2.87Å; T456-Q459 PolarHBondContact O-N 2.81Å; F457-Q459 VanDerWaalsContact C-N 3.31Å; F457-Q459 PolarHBondContact O-N 2.86Å; Q459-I461 VanDerWaalsContact C-N 3.35Å; Q459-I461 PolarHBondContact O-N 2.84Å; Q459-S462 PolarHBondContact O-N 3.36Å; Q459-S462 VanDerWaalsContact O-N 3.15Å; Q459-S462 PolarHBondContact O-OG 2.84Å; Q459-L463 HydrophobicContact CG-CD1 4.36Å; Q459-L463 PolarHBondContact O-N 3.08Å
460	L	92.6	Very high	86.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-56.8	-46.5	177	178.6	63	0	0	0	112	I429 A432 M433 W436 T456 F457 S462 L463 W464 L477 L525	I429-L460 HydrophobicContact CD1-CD1 3.67Å; A432-L460 HydrophobicContact CB-CD1 4.11Å; M433-L460 HydrophobicContact CB-CD1 4.17Å; W436-L460 HydrophobicContact CB-CD2 4.07Å; W436-L460 HydrophobicContact CG-CD2 4.03Å; T456-L460 WeakPolarHBondContact O-CB 3.45Å; T456-L460 PolarHBondContact O-N 3.27Å; F457-L460 HydrophobicContact CD2-CD2 4.16Å; F457-L460 HydrophobicContact CE2-CD2 4.28Å; F457-L460 PolarHBondContact O-N 3.36Å; L460-S462 VanDerWaalsContact C-N 3.34Å; L460-S462 PolarHBondContact O-N 2.91Å; L460-L463 PolarHBondContact O-N 3.46Å; L460-W464 PolarHBondContact O-N 3.35Å; L460-L477 HydrophobicContact CD2-CD2 3.93Å; L460-L525 HydrophobicContact CD2-CD2 4.07Å; L460-L525 HydrophobicContact CG-CD2 4.11Å
461	I	91	Very high	86.4	Confident	57 Å²	57	61.5 Å²	61.5	29%	0.292	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-40.8	177.4	-70.9	167.7	0	0	0	111.3	F457 K458 Q459 L463 W464 M519	F457-I461 HydrophobicContact CD1-CD1 3.64Å; F457-I461 HydrophobicContact CD1-CG1 4.45Å; F457-I461 HydrophobicContact CE1-CD1 3.14Å; F457-I461 HydrophobicContact CE1-CG1 3.99Å; F457-I461 HydrophobicContact CE2-CD1 4.32Å; F457-I461 HydrophobicContact CE2-CG1 4.31Å; F457-I461 HydrophobicContact CG-CD1 4.35Å; F457-I461 HydrophobicContact CZ-CD1 3.54Å; F457-I461 HydrophobicContact CZ-CG1 3.9Å; F457-I461 WeakPolarHBondContact O-CG1 3.34Å; F457-I461 PolarHBondContact O-N 2.92Å; K458-I461 PolarHBondContact O-N 2.95Å; Q459-I461 VanDerWaalsContact C-N 3.35Å; Q459-I461 PolarHBondContact O-N 2.84Å; I461-L463 PolarHBondContact O-N 3.05Å; I461-W464 PolarHBondContact O-N 3.09Å; I461-M519 HydrophobicContact CD1-CG 4.13Å
462	S	90.2	Very high	86.1	Confident	91 Å²	91	63.7 Å²	63.7	64%	0.636	32%	0.315	S	S	*	.	H	α-helix	trans	-63.9	-28.8	-176.6	74	0	0	0	0	113.6	K458 Q459 L460	K458-S462 WeakPolarHBondContact O-CB 3.3Å; K458-S462 PolarHBondContact O-N 2.8Å; Q459-S462 PolarHBondContact O-N 3.36Å; Q459-S462 VanDerWaalsContact O-N 3.15Å; Q459-S462 PolarHBondContact O-OG 2.84Å; L460-S462 VanDerWaalsContact C-N 3.34Å; L460-S462 PolarHBondContact O-N 2.91Å
463	L	88.1	Confident	86	Confident	55 Å²	55	63.6 Å²	63.6	29%	0.288	31%	0.314	S	S	.	.	H	α-helix	trans	-90.4	-13.9	179.9	-65.6	172.9	0	0	0	113.1	E428 I429 A432 Q459 L460 I461 L468	E428-L463 HydrophobicContact CB-CD1 4.4Å; I429-L463 HydrophobicContact CB-CB 4.43Å; I429-L463 HydrophobicContact CD1-CB 3.81Å; A432-L463 HydrophobicContact CB-CD1 3.88Å; Q459-L463 HydrophobicContact CG-CD1 4.36Å; Q459-L463 PolarHBondContact O-N 3.08Å; L460-L463 PolarHBondContact O-N 3.46Å; I461-L463 PolarHBondContact O-N 3.05Å; L463-L468 WeakPolarHBondContact O-CD1 3.39Å
464	W	86.3	Confident	85.7	Confident	34 Å²	34	64.2 Å²	64.2	13%	0.129	32%	0.317	C	S	.	.			trans	-83.6	139	-170	-178.5	73.3	0	0	0	113.4	I429 L460 I461 R524 L525 F528	I429-W464 HydrophobicContact CD1-CB 3.97Å; L460-W464 PolarHBondContact O-N 3.35Å; I461-W464 PolarHBondContact O-N 3.09Å; W464-R524 HydrophobicContact CH2-CB 4.43Å; W464-R524 HydrophobicContact CH2-CG 3.88Å; W464-R524 HydrophobicContact CZ3-CB 3.87Å; W464-R524 HydrophobicContact CZ3-CG 3.7Å; W464-L525 HydrophobicContact CD2-CB 4.07Å; W464-L525 HydrophobicContact CD2-CD1 3.87Å; W464-L525 HydrophobicContact CD2-CG 4.43Å; W464-L525 HydrophobicContact CE3-CB 3.99Å; W464-L525 HydrophobicContact CG-CD1 4.04Å; W464-L525 HydrophobicContact CG-CD2 4.48Å; W464-L525 HydrophobicContact CZ2-CD1 4Å; W464-L525 HydrophobicContact CZ3-CB 4.22Å; W464-F528 HydrophobicContact CH2-CB 4.18Å; W464-F528 HydrophobicContact CH2-CG 4.43Å; W464-F528 HydrophobicContact CZ2-CB 4.25Å; W464-F528 HydrophobicContact CZ2-CD1 4.17Å; W464-F528 HydrophobicContact CZ2-CG 4.23Å
465	S	80	Confident	85.4	Confident	59 Å²	59	67.7 Å²	67.7	41%	0.413	34%	0.336	S	S	.	.			trans	-144.5	159.2	167.4	70.8	0	0	0	0	110.9	K467 L468	S465-K467 PolarHBondContact O-N 2.82Å; S465-L468 PolarHBondContact O-N 3.15Å; S465-L468 WeakPolarHBondContact OG-CD1 3.34Å; S465-L468 VanDerWaalsContact OG-CG 3.26Å; S465-L468 WeakPolarHBondContact OG-CG 3.35Å
466	D	71.9	Confident	85.2	Confident	78 Å²	78	65.3 Å²	65.3	42%	0.417	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-9.3	-164.7	-66.1	-22.9	0	0	0	116.6	R524	D466-R524 VanDerWaalsContact CG-NH2 3.3Å; D466-R524 IonicContact OD1-CZ 3.89Å; D466-R524 IonicContact OD1-NE 2.78Å; D466-R524 PolarHBondContact OD1-NE 2.75Å; D466-R524 IonicContact OD1-NH2 3.63Å; D466-R524 PolarHBondContact OD1-NH2 2.96Å; D466-R524 IonicContact OD2-CZ 2.8Å; D466-R524 IonicContact OD2-NE 3.55Å; D466-R524 IonicContact OD2-NH2 3.85Å; D466-R524 PolarHBondContact OD2-NH2 2.54Å
467	K	68	Low	85.1	Confident	200 Å²	200	64.7 Å²	64.7	87%	0.87	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.4	7.6	-174.8	-65.5	-172.1	179.6	-178.4	0	115.4	S465	S465-K467 PolarHBondContact O-N 2.82Å
468	L	74.8	Confident	84.8	Confident	86 Å²	86	65.9 Å²	65.9	45%	0.45	33%	0.328	S	S	.	.	S	Bend	trans	-90.7	-19.4	-170.7	-70.3	173.8	0	0	0	115.5	I429 L463 S465	I429-L468 HydrophobicContact CG2-CB 4.12Å; L463-L468 WeakPolarHBondContact O-CD1 3.39Å; S465-L468 PolarHBondContact O-N 3.15Å; S465-L468 WeakPolarHBondContact OG-CD1 3.34Å; S465-L468 VanDerWaalsContact OG-CG 3.26Å; S465-L468 WeakPolarHBondContact OG-CG 3.35Å
469	L	82.9	Confident	84.5	Confident	20 Å²	20	66.8 Å²	66.8	11%	0.105	34%	0.336	C	S	.	.	S	Bend	trans	-117.7	140.4	-177.1	-65.8	174.7	0	0	0	111.2	I429 Q430 M433 E473 L474 L477	I429-L469 HydrophobicContact CG1-CD1 4.24Å; I429-L469 HydrophobicContact CG1-CD2 4.06Å; I429-L469 HydrophobicContact CG1-CG 4.15Å; I429-L469 HydrophobicContact CG2-CD2 4.24Å; Q430-L469 HydrophobicContact CG-CD2 4.16Å; M433-L469 HydrophobicContact SD-CD1 4.44Å; M433-L469 HydrophobicContact SD-CD2 4.2Å; L469-E473 VanDerWaalsContact CA-OE2 3.32Å; L469-E473 WeakPolarHBondContact CA-OE2 3.46Å; L469-E473 HydrophobicContact CB-CB 4.26Å; L469-E473 HydrophobicContact CD2-CB 4.32Å; L469-E473 WeakPolarHBondContact CD2-OE2 3.3Å; L469-L474 HydrophobicContact CB-CD2 4.24Å; L469-L474 HydrophobicContact CB-CG 4.11Å; L469-L474 HydrophobicContact CD1-CD2 4.27Å; L469-L477 HydrophobicContact CD1-CD1 3.59Å
470	T	82.8	Confident	84.5	Confident	67 Å²	67	62.7 Å²	62.7	41%	0.411	32%	0.318	S	S	.	.			trans	-72	167.5	175.4	72.4	0	0	0	0	111.3	E472 E473 L474	T470-E472 VanDerWaalsContact C-N 3.31Å; T470-E472 PolarHBondContact O-N 2.8Å; T470-E473 PolarHBondContact N-OE2 3.18Å; T470-E473 PolarHBondContact O-N 2.92Å; T470-E473 VanDerWaalsContact OG1-CD 3.22Å; T470-E473 WeakPolarHBondContact OG1-CG 3.06Å; T470-E473 PolarHBondContact OG1-N 2.8Å; T470-E473 PolarHBondContact OG1-OE2 3.45Å; T470-L474 WeakPolarHBondContact O-CG 3.41Å; T470-L474 PolarHBondContact O-N 2.68Å
471	R	81.4	Confident	84.5	Confident	174 Å²	174	62.7 Å²	62.7	66%	0.657	32%	0.318	S	S	*	.	H	α-helix	trans	-62.7	-38	178.4	-179.2	62.6	71.9	165.8	2.9	112.4	L474 N475	R471-L474 PolarHBondContact O-N 2.78Å; R471-N475 VanDerWaalsContact O-CG 3.23Å; R471-N475 PolarHBondContact O-N 2.8Å; R471-N475 VanDerWaalsContact O-N 3.08Å; R471-N475 PolarHBondContact O-ND2 3.47Å; R471-N475 PolarHBondContact O-OD1 3.34Å
472	E	82.8	Confident	84.4	Confident	106 Å²	106	66 Å²	66	50%	0.495	33%	0.33	S	S	.	.	H	α-helix	trans	-68.8	-40.3	178.7	-67.5	-178.1	171.2	0	0	111.3	T470 L474 N475 Y476	T470-E472 VanDerWaalsContact C-N 3.31Å; T470-E472 PolarHBondContact O-N 2.8Å; E472-L474 PolarHBondContact O-N 3.32Å; E472-N475 WeakPolarHBondContact O-CB 3.3Å; E472-N475 PolarHBondContact O-N 2.61Å; E472-N475 VanDerWaalsContact O-N 3.1Å; E472-Y476 VanDerWaalsContact O-CD2 3.29Å; E472-Y476 WeakPolarHBondContact O-CD2 3.37Å; E472-Y476 PolarHBondContact O-N 3.11Å; E472-Y476 VanDerWaalsContact O-N 3.07Å
473	E	86.8	Confident	84.4	Confident	8 Å²	8	64.7 Å²	64.7	4%	0.037	32%	0.318	C	S	.	.	H	α-helix	trans	-62.6	-41.1	174.1	-68.1	166.3	179.5	0	0	112.2	I380 Q430 M433 L469 T470 N475 Y476 L477	I380-E473 HydrophobicContact CD1-CG 3.87Å; I380-E473 WeakPolarHBondContact CD1-OE1 3.19Å; Q430-E473 PolarHBondContact NE2-OE1 2.88Å; M433-E473 HydrophobicContact CE-CB 4.11Å; M433-E473 HydrophobicContact CE-CG 4.08Å; M433-E473 HydrophobicContact SD-CB 3.96Å; L469-E473 VanDerWaalsContact CA-OE2 3.32Å; L469-E473 WeakPolarHBondContact CA-OE2 3.46Å; L469-E473 HydrophobicContact CB-CB 4.26Å; L469-E473 HydrophobicContact CD2-CB 4.32Å; L469-E473 WeakPolarHBondContact CD2-OE2 3.3Å; T470-E473 PolarHBondContact N-OE2 3.18Å; T470-E473 PolarHBondContact O-N 2.92Å; T470-E473 VanDerWaalsContact OG1-CD 3.22Å; T470-E473 WeakPolarHBondContact OG1-CG 3.06Å; T470-E473 PolarHBondContact OG1-N 2.8Å; T470-E473 PolarHBondContact OG1-OE2 3.45Å; E473-N475 VanDerWaalsContact C-N 3.27Å; E473-N475 PolarHBondContact O-N 2.98Å; E473-Y476 WeakPolarHBondContact O-CB 3.33Å; E473-Y476 PolarHBondContact O-N 2.84Å; E473-L477 PolarHBondContact O-N 2.91Å; E473-L477 VanDerWaalsContact O-N 3.08Å
474	L	86.7	Confident	84.5	Confident	12 Å²	12	62.1 Å²	62.1	6%	0.063	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-31.4	173.2	-73.2	168.9	0	0	0	112.6	L469 T470 R471 E472 L477 S478 L525 F528	L469-L474 HydrophobicContact CB-CD2 4.24Å; L469-L474 HydrophobicContact CB-CG 4.11Å; L469-L474 HydrophobicContact CD1-CD2 4.27Å; T470-L474 WeakPolarHBondContact O-CG 3.41Å; T470-L474 PolarHBondContact O-N 2.68Å; R471-L474 PolarHBondContact O-N 2.78Å; E472-L474 PolarHBondContact O-N 3.32Å; L474-L477 PolarHBondContact O-N 3.08Å; L474-S478 WeakPolarHBondContact O-CB 3.35Å; L474-S478 PolarHBondContact O-N 3.26Å; L474-L525 HydrophobicContact CD2-CD1 4.2Å; L474-F528 HydrophobicContact CD1-CD1 4Å; L474-F528 HydrophobicContact CD1-CE1 3.67Å; L474-F528 HydrophobicContact CD2-CD1 4.34Å
475	N	86.3	Confident	84.7	Confident	78 Å²	78	60.7 Å²	60.7	42%	0.417	30%	0.3	S	S	.	.	H	α-helix	trans	-68.4	-42.9	174	-66.7	-20.7	0	0	0	111.1	R471 E472 E473 L477 S478 D479	R471-N475 VanDerWaalsContact O-CG 3.23Å; R471-N475 PolarHBondContact O-N 2.8Å; R471-N475 VanDerWaalsContact O-N 3.08Å; R471-N475 PolarHBondContact O-ND2 3.47Å; R471-N475 PolarHBondContact O-OD1 3.34Å; E472-N475 WeakPolarHBondContact O-CB 3.3Å; E472-N475 PolarHBondContact O-N 2.61Å; E472-N475 VanDerWaalsContact O-N 3.1Å; E473-N475 VanDerWaalsContact C-N 3.27Å; E473-N475 PolarHBondContact O-N 2.98Å; N475-L477 VanDerWaalsContact C-N 3.29Å; N475-L477 PolarHBondContact O-N 2.79Å; N475-S478 WeakPolarHBondContact O-CB 3.34Å; N475-S478 PolarHBondContact O-N 3.48Å; N475-S478 VanDerWaalsContact O-N 3.15Å; N475-D479 PolarHBondContact O-N 3Å
476	Y	86.6	Confident	85.1	Confident	57 Å²	57	62.8 Å²	62.8	22%	0.224	30%	0.303	C	S	.	.	H	α-helix	trans	-56.6	-43.4	173.2	-79.9	-67.3	0	0	0	112.2	T377 Q381 E472 E473 S480	T377-Y476 HydrophobicContact CG2-CE2 3.92Å; T377-Y476 WeakPolarHBondContact CG2-OH 3.45Å; Q381-Y476 PolarHBondContact NE2-OH 3.49Å; E472-Y476 VanDerWaalsContact O-CD2 3.29Å; E472-Y476 WeakPolarHBondContact O-CD2 3.37Å; E472-Y476 PolarHBondContact O-N 3.11Å; E472-Y476 VanDerWaalsContact O-N 3.07Å; E473-Y476 WeakPolarHBondContact O-CB 3.33Å; E473-Y476 PolarHBondContact O-N 2.84Å; Y476-S480 WeakPolarHBondContact O-CB 3.25Å; Y476-S480 PolarHBondContact O-N 3.26Å
477	L	89.9	Confident	85.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-47.6	174	-81.2	175.1	0	0	0	111.9	M433 I437 L460 L469 E473 L474 N475 D479 S480 F481 L525	M433-L477 HydrophobicContact CB-CD2 4.37Å; M433-L477 HydrophobicContact CG-CD1 4.02Å; M433-L477 HydrophobicContact CG-CD2 3.66Å; M433-L477 HydrophobicContact CG-CG 3.66Å; M433-L477 HydrophobicContact SD-CD1 3.97Å; M433-L477 HydrophobicContact SD-CD2 4.49Å; M433-L477 HydrophobicContact SD-CG 3.83Å; I437-L477 HydrophobicContact CG1-CD2 4.48Å; L460-L477 HydrophobicContact CD2-CD2 3.93Å; L469-L477 HydrophobicContact CD1-CD1 3.59Å; E473-L477 PolarHBondContact O-N 2.91Å; E473-L477 VanDerWaalsContact O-N 3.08Å; L474-L477 PolarHBondContact O-N 3.08Å; N475-L477 VanDerWaalsContact C-N 3.29Å; N475-L477 PolarHBondContact O-N 2.79Å; L477-D479 VanDerWaalsContact C-N 3.3Å; L477-D479 PolarHBondContact O-N 3.08Å; L477-S480 PolarHBondContact O-N 3.32Å; L477-S480 VanDerWaalsContact O-N 3.12Å; L477-S480 PolarHBondContact O-OG 3.21Å; L477-F481 HydrophobicContact CB-CE2 4.08Å; L477-F481 HydrophobicContact CB-CZ 4.03Å; L477-F481 HydrophobicContact CD2-CE1 4.01Å; L477-F481 HydrophobicContact CD2-CZ 3.97Å; L477-F481 HydrophobicContact CG-CZ 4.42Å; L477-F481 WeakPolarHBondContact O-CD1 3.47Å; L477-F481 WeakPolarHBondContact O-CD2 3.49Å; L477-F481 WeakPolarHBondContact O-CG 3.3Å; L477-F481 PolarHBondContact O-N 3.33Å; L477-L525 HydrophobicContact CD1-CD1 4.27Å; L477-L525 HydrophobicContact CD1-CD2 4.43Å
478	S	87.5	Confident	86.8	Confident	25 Å²	25	51.1 Å²	51.1	18%	0.175	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-43.8	178.2	-177.9	0	0	0	0	112	L474 N475 F481 K482 S530	L474-S478 WeakPolarHBondContact O-CB 3.35Å; L474-S478 PolarHBondContact O-N 3.26Å; N475-S478 WeakPolarHBondContact O-CB 3.34Å; N475-S478 PolarHBondContact O-N 3.48Å; N475-S478 VanDerWaalsContact O-N 3.15Å; S478-F481 PolarHBondContact O-N 3.35Å; S478-K482 PolarHBondContact O-N 3.32Å; S478-S530 PolarHBondContact OG-OG 2.93Å
479	D	87.9	Confident	87.5	Confident	102 Å²	102	47.2 Å²	47.2	55%	0.545	23%	0.229	S	C	.	.	H	α-helix	trans	-65	-43.7	177.2	-71.2	-20.4	0	0	0	111.1	N475 L477 F481 K482 V483	N475-D479 PolarHBondContact O-N 3Å; L477-D479 VanDerWaalsContact C-N 3.3Å; L477-D479 PolarHBondContact O-N 3.08Å; D479-F481 VanDerWaalsContact C-N 3.32Å; D479-F481 PolarHBondContact O-N 3.29Å; D479-K482 PolarHBondContact O-N 3.16Å; D479-V483 WeakPolarHBondContact O-CG2 3.23Å; D479-V483 PolarHBondContact O-N 3.08Å
480	S	90.4	Very high	87.6	Confident	8 Å²	8	50.8 Å²	50.8	6%	0.056	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-38.6	175.7	79.6	0	0	0	0	112.7	W436 Y476 L477 K482 V483 F484	W436-S480 PolarHBondContact NE1-OG 2.75Å; W436-S480 VanDerWaalsContact NE1-OG 3.08Å; Y476-S480 WeakPolarHBondContact O-CB 3.25Å; Y476-S480 PolarHBondContact O-N 3.26Å; L477-S480 PolarHBondContact O-N 3.32Å; L477-S480 VanDerWaalsContact O-N 3.12Å; L477-S480 PolarHBondContact O-OG 3.21Å; S480-K482 VanDerWaalsContact C-N 3.35Å; S480-V483 PolarHBondContact O-N 3.42Å; S480-F484 WeakPolarHBondContact O-CB 3.45Å; S480-F484 PolarHBondContact O-N 2.86Å
481	F	92.8	Very high	87.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.8	-38.2	178.2	-64.3	-19.9	0	0	0	111.6	W436 F457 L477 S478 D479 T485 L520 L525 Y526 S529	W436-F481 AromaticContact CE2-CE1 3.89Å; W436-F481 HydrophobicContact CZ2-CD1 4.07Å; W436-F481 HydrophobicContact CZ2-CE1 4.22Å; W436-F481 AromaticContact NE1-CD1 3.48Å; W436-F481 AromaticContact NE1-CE1 3.37Å; F457-F481 AromaticContact CE2-CE1 3.84Å; F457-F481 HydrophobicContact CE2-CE1 3.84Å; F457-F481 HydrophobicContact CE2-CZ 4.09Å; L477-F481 HydrophobicContact CB-CE2 4.08Å; L477-F481 HydrophobicContact CB-CZ 4.03Å; L477-F481 HydrophobicContact CD2-CE1 4.01Å; L477-F481 HydrophobicContact CD2-CZ 3.97Å; L477-F481 HydrophobicContact CG-CZ 4.42Å; L477-F481 WeakPolarHBondContact O-CD1 3.47Å; L477-F481 WeakPolarHBondContact O-CD2 3.49Å; L477-F481 WeakPolarHBondContact O-CG 3.3Å; L477-F481 PolarHBondContact O-N 3.33Å; S478-F481 PolarHBondContact O-N 3.35Å; D479-F481 VanDerWaalsContact C-N 3.32Å; D479-F481 PolarHBondContact O-N 3.29Å; F481-T485 VanDerWaalsContact O-CB 3.26Å; F481-T485 WeakPolarHBondContact O-CB 3.2Å; F481-T485 PolarHBondContact O-N 2.92Å; F481-T485 PolarHBondContact O-OG1 2.86Å; F481-L520 HydrophobicContact CB-CD1 4.31Å; F481-L520 HydrophobicContact CB-CD2 4.35Å; F481-L520 HydrophobicContact CD1-CD1 3.48Å; F481-L520 VanDerWaalsContact CD1-CD1 3.48Å; F481-L520 HydrophobicContact CD1-CG 4.4Å; F481-L520 HydrophobicContact CE1-CD1 3.95Å; F481-L520 HydrophobicContact CG-CD1 3.99Å; F481-L525 HydrophobicContact CE2-CD2 4.48Å; F481-L525 HydrophobicContact CE2-CG 4.08Å; F481-L525 HydrophobicContact CZ-CD2 3.86Å; F481-L525 HydrophobicContact CZ-CG 3.97Å; F481-Y526 HydrophobicContact CB-CD2 3.99Å; F481-Y526 HydrophobicContact CB-CE2 4.02Å; F481-Y526 AromaticContact CD2-CD2 3.75Å; F481-Y526 HydrophobicContact CD2-CD2 3.75Å; F481-Y526 HydrophobicContact CG-CD2 4.11Å; F481-S529 WeakPolarHBondContact CD2-OG 3.27Å; F481-S529 WeakPolarHBondContact CE2-OG 3.38Å
482	K	89	Confident	87.9	Confident	126 Å²	126	39.9 Å²	39.9	55%	0.548	20%	0.199	S	C	.	.	H	α-helix	trans	-64.5	-49.7	174.6	-175.2	-178	172.4	-171	0	111.1	S478 D479 S480 F484 T485 E486	S478-K482 PolarHBondContact O-N 3.32Å; D479-K482 PolarHBondContact O-N 3.16Å; S480-K482 VanDerWaalsContact C-N 3.35Å; K482-F484 VanDerWaalsContact C-N 3.34Å; K482-F484 PolarHBondContact O-N 2.82Å; K482-T485 PolarHBondContact O-N 3.42Å; K482-E486 WeakPolarHBondContact CE-OE1 3.44Å; K482-E486 WeakPolarHBondContact O-CG 3.38Å; K482-E486 PolarHBondContact O-N 3.27Å
483	V	88.7	Confident	87.9	Confident	63 Å²	63	35 Å²	35	38%	0.382	18%	0.176	S	C	.	.	H	α-helix	trans	-58.2	-47.1	177.2	172.1	0	0	0	0	110.9	I440 D479 S480 T485 E486 H487	I440-V483 HydrophobicContact CG2-CB 4.42Å; I440-V483 HydrophobicContact CG2-CG1 4.06Å; D479-V483 WeakPolarHBondContact O-CG2 3.23Å; D479-V483 PolarHBondContact O-N 3.08Å; S480-V483 PolarHBondContact O-N 3.42Å; V483-T485 PolarHBondContact O-N 3.36Å; V483-E486 PolarHBondContact O-N 3.23Å; V483-H487 VanDerWaalsContact O-CB 3.32Å; V483-H487 WeakPolarHBondContact O-CB 3.18Å; V483-H487 PolarHBondContact O-N 3.46Å
484	F	91.9	Very high	87.5	Confident	1 Å²	1	36.8 Å²	36.8	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-44.4	177.4	175.5	-113	0	0	0	112.1	W436 I440 L453 S480 K482 H487 S488 L513 C516 L517 L520	W436-F484 HydrophobicContact CH2-CD1 4.03Å; W436-F484 HydrophobicContact CH2-CE1 4.11Å; W436-F484 HydrophobicContact CH2-CG 4.21Å; W436-F484 HydrophobicContact CH2-CZ 4.38Å; W436-F484 HydrophobicContact CZ2-CB 4.37Å; W436-F484 HydrophobicContact CZ2-CD1 4.09Å; W436-F484 HydrophobicContact CZ2-CG 4.16Å; I440-F484 HydrophobicContact CD1-CB 3.8Å; I440-F484 HydrophobicContact CD1-CD2 3.33Å; I440-F484 HydrophobicContact CD1-CE2 4.06Å; I440-F484 HydrophobicContact CD1-CG 3.7Å; I440-F484 HydrophobicContact CG1-CB 4.17Å; I440-F484 HydrophobicContact CG2-CB 4.04Å; L453-F484 HydrophobicContact CD1-CD2 4.25Å; L453-F484 HydrophobicContact CD1-CE2 3.69Å; S480-F484 WeakPolarHBondContact O-CB 3.45Å; S480-F484 PolarHBondContact O-N 2.86Å; K482-F484 VanDerWaalsContact C-N 3.34Å; K482-F484 PolarHBondContact O-N 2.82Å; F484-H487 PolarHBondContact O-N 3.04Å; F484-S488 WeakPolarHBondContact CD2-OG 3.39Å; F484-S488 WeakPolarHBondContact CE2-OG 3.47Å; F484-S488 WeakPolarHBondContact CZ-OG 3.16Å; F484-S488 WeakPolarHBondContact O-CB 3.27Å; F484-S488 PolarHBondContact O-N 3.48Å; F484-S488 PolarHBondContact O-OG 2.96Å; F484-L513 HydrophobicContact CE2-CD1 4.16Å; F484-L513 HydrophobicContact CZ-CD1 4.19Å; F484-C516 HydrophobicContact CZ-CB 4.15Å; F484-L517 HydrophobicContact CD1-CD1 4.46Å; F484-L517 HydrophobicContact CE1-CB 4.46Å; F484-L517 HydrophobicContact CE1-CD1 4.21Å; F484-L520 HydrophobicContact CD1-CD1 3.83Å; F484-L520 HydrophobicContact CE1-CD1 4.26Å
485	T	90.2	Very high	86.8	Confident	5 Å²	5	36.2 Å²	36.2	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-47.5	179.2	-62.6	0	0	0	0	111.1	F481 K482 V483 S488 L489 L517 H521 E539	F481-T485 VanDerWaalsContact O-CB 3.26Å; F481-T485 WeakPolarHBondContact O-CB 3.2Å; F481-T485 PolarHBondContact O-N 2.92Å; F481-T485 PolarHBondContact O-OG1 2.86Å; K482-T485 PolarHBondContact O-N 3.42Å; V483-T485 PolarHBondContact O-N 3.36Å; T485-S488 PolarHBondContact O-N 3.2Å; T485-L489 HydrophobicContact CG2-CD1 4Å; T485-L489 HydrophobicContact CG2-CG 4.43Å; T485-L489 WeakPolarHBondContact O-CB 3.31Å; T485-L489 VanDerWaalsContact O-CG 3.22Å; T485-L489 WeakPolarHBondContact O-CG 3.38Å; T485-L489 PolarHBondContact O-N 2.85Å; T485-L517 HydrophobicContact CG2-CD1 4.18Å; T485-H521 WeakPolarHBondContact CG2-NE2 3.3Å; T485-H521 PolarHBondContact OG1-NE2 2.92Å; T485-E539 WeakPolarHBondContact CG2-OE2 3.48Å
486	E	87.7	Confident	85.9	Confident	103 Å²	103	33.1 Å²	33.1	48%	0.481	17%	0.167	S	C	.	.	H	α-helix	trans	-61.1	-48.3	178.4	-72.5	177.3	-179.3	0	0	111.3	K482 V483 L489 I490	K482-E486 WeakPolarHBondContact CE-OE1 3.44Å; K482-E486 WeakPolarHBondContact O-CG 3.38Å; K482-E486 PolarHBondContact O-N 3.27Å; V483-E486 PolarHBondContact O-N 3.23Å; E486-L489 PolarHBondContact O-N 3.34Å; E486-I490 VanDerWaalsContact O-CG1 3.28Å; E486-I490 WeakPolarHBondContact O-CG1 3.29Å; E486-I490 PolarHBondContact O-N 3.4Å
487	H	86.9	Confident	84.8	Confident	33 Å²	33	35.1 Å²	35.1	15%	0.153	18%	0.181	C	C	.	.	H	α-helix	trans	-63.3	-47	178.4	-173.3	-108	0	0	0	112.2	N443 Y444 V483 F484 L489 I490 M491	N443-H487 PolarHBondContact O-CE1 2.79Å; Y444-H487 HydrophobicContact CD2-CB 4.28Å; Y444-H487 AromaticContact CD2-CD2 3.53Å; Y444-H487 AromaticContact CE2-CD2 3.98Å; V483-H487 VanDerWaalsContact O-CB 3.32Å; V483-H487 WeakPolarHBondContact O-CB 3.18Å; V483-H487 PolarHBondContact O-N 3.46Å; F484-H487 PolarHBondContact O-N 3.04Å; H487-L489 VanDerWaalsContact C-N 3.32Å; H487-L489 PolarHBondContact O-N 2.92Å; H487-I490 WeakPolarHBondContact O-CB 3.45Å; H487-I490 PolarHBondContact O-N 3.27Å; H487-I490 VanDerWaalsContact O-N 3.15Å; H487-M491 PolarHBondContact CE1-SD 3.38Å; H487-M491 WeakPolarHBondContact O-CG 3.47Å; H487-M491 PolarHBondContact O-N 2.93Å
488	S	89.6	Confident	83.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-42.3	178.7	-58.9	0	0	0	0	111.4	F484 T485 M491 I492 L513	F484-S488 WeakPolarHBondContact CD2-OG 3.39Å; F484-S488 WeakPolarHBondContact CE2-OG 3.47Å; F484-S488 WeakPolarHBondContact CZ-OG 3.16Å; F484-S488 WeakPolarHBondContact O-CB 3.27Å; F484-S488 PolarHBondContact O-N 3.48Å; F484-S488 PolarHBondContact O-OG 2.96Å; T485-S488 PolarHBondContact O-N 3.2Å; S488-M491 PolarHBondContact O-N 3.13Å; S488-I492 WeakPolarHBondContact O-CB 3.19Å; S488-I492 WeakPolarHBondContact O-CD1 3.35Å; S488-I492 WeakPolarHBondContact O-CG1 3.23Å; S488-I492 PolarHBondContact O-N 3.13Å; S488-L513 WeakPolarHBondContact OG-CD1 3.49Å
489	L	89.5	Confident	82	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-66	-37.7	176.8	-72.5	178.3	0	0	0	112	T485 E486 H487 C493 L517 E539 F540	T485-L489 HydrophobicContact CG2-CD1 4Å; T485-L489 HydrophobicContact CG2-CG 4.43Å; T485-L489 WeakPolarHBondContact O-CB 3.31Å; T485-L489 VanDerWaalsContact O-CG 3.22Å; T485-L489 WeakPolarHBondContact O-CG 3.38Å; T485-L489 PolarHBondContact O-N 2.85Å; E486-L489 PolarHBondContact O-N 3.34Å; H487-L489 VanDerWaalsContact C-N 3.32Å; H487-L489 PolarHBondContact O-N 2.92Å; L489-C493 VanDerWaalsContact O-CB 3.25Å; L489-C493 WeakPolarHBondContact O-CB 3.38Å; L489-C493 PolarHBondContact O-N 3.18Å; L489-C493 PolarHBondContact O-SG 3.38Å; L489-L517 HydrophobicContact CD2-CD2 3.97Å; L489-L517 HydrophobicContact CG-CD2 4.37Å; L489-E539 HydrophobicContact CD1-CB 3.81Å; L489-F540 HydrophobicContact CD2-CB 3.98Å; L489-F540 HydrophobicContact CD2-CD2 3.96Å; L489-F540 HydrophobicContact CD2-CG 4.49Å
490	I	84.6	Confident	80.7	Confident	94 Å²	94	39 Å²	39	48%	0.482	19%	0.189	S	C	.	.	H	α-helix	trans	-61	-46.6	172.2	-69.5	165.5	0	0	0	109.9	E486 H487 C493 N494	E486-I490 VanDerWaalsContact O-CG1 3.28Å; E486-I490 WeakPolarHBondContact O-CG1 3.29Å; E486-I490 PolarHBondContact O-N 3.4Å; H487-I490 WeakPolarHBondContact O-CB 3.45Å; H487-I490 PolarHBondContact O-N 3.27Å; H487-I490 VanDerWaalsContact O-N 3.15Å; I490-C493 PolarHBondContact O-N 2.73Å; I490-N494 WeakPolarHBondContact CG2-ND2 3.44Å; I490-N494 VanDerWaalsContact O-CB 3.26Å; I490-N494 WeakPolarHBondContact O-CB 3.49Å; I490-N494 PolarHBondContact O-N 3.45Å; I490-N494 PolarHBondContact O-ND2 2.76Å
491	M	83.9	Confident	79.1	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.059	21%	0.208	C	C	.	.	H	α-helix	trans	-63	-47.9	178.7	-69.3	-177.3	75.2	0	0	112.4	H487 S488 C493 N494 Y495 I498 F499 L513	H487-M491 PolarHBondContact CE1-SD 3.38Å; H487-M491 WeakPolarHBondContact O-CG 3.47Å; H487-M491 PolarHBondContact O-N 2.93Å; S488-M491 PolarHBondContact O-N 3.13Å; M491-C493 VanDerWaalsContact C-N 3.33Å; M491-C493 PolarHBondContact O-N 3.09Å; M491-N494 CarbonylContact O-C 3.52Å; M491-N494 PolarHBondContact O-N 3.13Å; M491-Y495 PolarHBondContact O-N 3.39Å; M491-I498 HydrophobicContact CB-CD1 4.1Å; M491-I498 HydrophobicContact CE-CG2 3.92Å; M491-I498 HydrophobicContact CG-CD1 4.06Å; M491-F499 HydrophobicContact CE-CZ 3.98Å; M491-L513 HydrophobicContact CB-CD2 3.81Å; M491-L513 HydrophobicContact CE-CD2 4.38Å; M491-L513 HydrophobicContact SD-CD2 4.18Å
492	I	85.5	Confident	77.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-41.5	179.6	-69.4	160.6	0	0	0	110.3	S488 Y495 F510 L513 L514 L517 F540 I598	S488-I492 WeakPolarHBondContact O-CB 3.19Å; S488-I492 WeakPolarHBondContact O-CD1 3.35Å; S488-I492 WeakPolarHBondContact O-CG1 3.23Å; S488-I492 PolarHBondContact O-N 3.13Å; I492-Y495 WeakPolarHBondContact O-CB 3.22Å; I492-Y495 VanDerWaalsContact O-CD1 3.26Å; I492-Y495 WeakPolarHBondContact O-CD1 3.16Å; I492-F510 HydrophobicContact CB-CE2 4.23Å; I492-F510 HydrophobicContact CG1-CE2 4.21Å; I492-F510 HydrophobicContact CG2-CE2 3.95Å; I492-F510 HydrophobicContact CG2-CZ 3.95Å; I492-L513 HydrophobicContact CD1-CD2 4.4Å; I492-L513 HydrophobicContact CD1-CG 4.27Å; I492-L513 HydrophobicContact CG1-CD2 3.83Å; I492-L513 HydrophobicContact CG1-CG 4.19Å; I492-L514 HydrophobicContact CD1-CD1 3.55Å; I492-L514 HydrophobicContact CG1-CD1 4.27Å; I492-L514 HydrophobicContact CG2-CD1 4.4Å; I492-L517 HydrophobicContact CD1-CD2 3.57Å; I492-F540 HydrophobicContact CG2-CD2 4.36Å; I492-F540 HydrophobicContact CG2-CE2 3.82Å; I492-I598 HydrophobicContact CG2-CD1 4.48Å
493	C	84	Confident	76.1	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.02	24%	0.236	C	C	.	.	H	α-helix	trans	-70.6	-39.7	178.2	-66.2	0	0	0	0	111.4	L489 I490 M491 Y495 F544 F547	L489-C493 VanDerWaalsContact O-CB 3.25Å; L489-C493 WeakPolarHBondContact O-CB 3.38Å; L489-C493 PolarHBondContact O-N 3.18Å; L489-C493 PolarHBondContact O-SG 3.38Å; I490-C493 PolarHBondContact O-N 2.73Å; M491-C493 VanDerWaalsContact C-N 3.33Å; M491-C493 PolarHBondContact O-N 3.09Å; C493-Y495 WeakPolarHBondContact O-CD1 3.36Å; C493-Y495 PolarHBondContact O-N 2.76Å; C493-Y495 VanDerWaalsContact O-N 3.14Å; C493-F544 VanDerWaalsContact SG-CA 3.56Å; C493-F547 HydrophobicContact CB-CB 3.72Å; C493-F547 HydrophobicContact CB-CD1 4.1Å; C493-F547 HydrophobicContact CB-CD2 4.27Å; C493-F547 HydrophobicContact CB-CG 3.75Å; C493-F547 WeakPolarHBondContact O-CD1 3.39Å; C493-F547 WeakPolarHBondContact O-CE1 3.08Å; C493-F547 WeakPolarHBondContact O-CE2 3.41Å; C493-F547 WeakPolarHBondContact O-CZ 3.19Å
494	N	78.6	Confident	75	Confident	45 Å²	45	47.3 Å²	47.3	24%	0.241	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	25.1	177	-74.4	-45.8	0	0	0	113.8	I490 M491 N496 L497 I498 F547	I490-N494 WeakPolarHBondContact CG2-ND2 3.44Å; I490-N494 VanDerWaalsContact O-CB 3.26Å; I490-N494 WeakPolarHBondContact O-CB 3.49Å; I490-N494 PolarHBondContact O-N 3.45Å; I490-N494 PolarHBondContact O-ND2 2.76Å; M491-N494 CarbonylContact O-C 3.52Å; M491-N494 PolarHBondContact O-N 3.13Å; N494-N496 PolarHBondContact O-N 2.57Å; N494-L497 PolarHBondContact O-N 3.37Å; N494-I498 HydrophobicContact CB-CD1 3.69Å; N494-I498 HydrophobicContact CB-CG1 4.33Å; N494-I498 PolarHBondContact O-N 2.93Å; N494-F547 HydrophobicContact CB-CE2 4.47Å; N494-F547 WeakPolarHBondContact OD1-CD2 3.44Å; N494-F547 WeakPolarHBondContact OD1-CE2 3.45Å
495	Y	71.4	Confident	74.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-50.7	-34.8	-172.4	62	-101.3	0	0	0	113.9	M491 I492 C493 L497 F499 F544 C590 Y594 M610	M491-Y495 PolarHBondContact O-N 3.39Å; I492-Y495 WeakPolarHBondContact O-CB 3.22Å; I492-Y495 VanDerWaalsContact O-CD1 3.26Å; I492-Y495 WeakPolarHBondContact O-CD1 3.16Å; C493-Y495 WeakPolarHBondContact O-CD1 3.36Å; C493-Y495 PolarHBondContact O-N 2.76Å; C493-Y495 VanDerWaalsContact O-N 3.14Å; Y495-L497 VanDerWaalsContact C-N 3.28Å; Y495-L497 PolarHBondContact O-N 3.41Å; Y495-F499 CarbonylContact O-C 3.57Å; Y495-F499 WeakPolarHBondContact O-CA 3.38Å; Y495-F499 PolarHBondContact O-N 3.42Å; Y495-F544 HydrophobicContact CE1-CE2 4.5Å; Y495-C590 WeakPolarHBondContact OH-CA 3.47Å; Y495-C590 WeakPolarHBondContact OH-CB 3.3Å; Y495-C590 PolarHBondContact OH-SG 3.39Å; Y495-Y594 HydrophobicContact CD1-CG 4.39Å; Y495-Y594 AromaticContact CD2-CD1 3.98Å; Y495-Y594 HydrophobicContact CD2-CD1 3.98Å; Y495-Y594 AromaticContact CD2-CD2 3.19Å; Y495-Y594 HydrophobicContact CD2-CD2 3.19Å; Y495-Y594 AromaticContact CD2-CE1 3.83Å; Y495-Y594 HydrophobicContact CD2-CE1 3.83Å; Y495-Y594 AromaticContact CD2-CE2 3.03Å; Y495-Y594 HydrophobicContact CD2-CE2 3.03Å; Y495-Y594 AromaticContact CD2-CG 3.67Å; Y495-Y594 HydrophobicContact CD2-CG 3.67Å; Y495-Y594 AromaticContact CD2-CZ 3.35Å; Y495-Y594 AromaticContact CE2-CD2 3.16Å; Y495-Y594 HydrophobicContact CE2-CD2 3.16Å; Y495-Y594 AromaticContact CE2-CE2 3.35Å; Y495-Y594 HydrophobicContact CE2-CE2 3.35Å; Y495-Y594 AromaticContact CE2-CG 3.86Å; Y495-Y594 HydrophobicContact CE2-CG 3.86Å; Y495-Y594 AromaticContact CG-CD1 3.96Å; Y495-Y594 HydrophobicContact CG-CD1 3.96Å; Y495-Y594 AromaticContact CG-CD2 3.95Å; Y495-Y594 HydrophobicContact CG-CD2 3.95Å; Y495-Y594 AromaticContact CG-CE1 3.96Å; Y495-Y594 HydrophobicContact CG-CE1 3.96Å; Y495-Y594 AromaticContact CG-CE2 3.98Å; Y495-Y594 HydrophobicContact CG-CE2 3.98Å; Y495-Y594 AromaticContact CG-CG 3.93Å; Y495-Y594 HydrophobicContact CG-CG 3.93Å; Y495-Y594 AromaticContact CG-CZ 3.95Å; Y495-Y594 AromaticContact CZ-CD2 3.93Å; Y495-M610 WeakPolarHBondContact OH-CE 3.42Å
496	N	66.5	Low	73.5	Confident	14 Å²	14	56.1 Å²	56.1	8%	0.075	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-27.3	-179	-85	-25.1	0	0	0	114.7	N494 K589	N494-N496 PolarHBondContact O-N 2.57Å; N496-K589 WeakPolarHBondContact OD1-CD 2.99Å; N496-K589 WeakPolarHBondContact OD1-CE 3.17Å; N496-K589 PolarHBondContact OD1-NZ 2.97Å
497	L	64.8	Low	73.1	Confident	98 Å²	98	52.6 Å²	52.6	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-94.4	-37.4	-179.3	-67.4	171.3	0	0	0	111.5	N494 Y495	N494-L497 PolarHBondContact O-N 3.37Å; Y495-L497 VanDerWaalsContact C-N 3.28Å; Y495-L497 PolarHBondContact O-N 3.41Å
498	I	55.7	Low	72.9	Confident	66 Å²	66	55.6 Å²	55.6	34%	0.338	30%	0.295	S	S	.	.	H	α-helix	trans	-89.4	-45.6	-171.7	-64	167.1	0	0	0	110.9	M491 N494 Y500	M491-I498 HydrophobicContact CB-CD1 4.1Å; M491-I498 HydrophobicContact CE-CG2 3.92Å; M491-I498 HydrophobicContact CG-CD1 4.06Å; N494-I498 HydrophobicContact CB-CD1 3.69Å; N494-I498 HydrophobicContact CB-CG1 4.33Å; N494-I498 PolarHBondContact O-N 2.93Å; I498-Y500 PolarHBondContact O-N 3.47Å
499	F	63	Low	72.7	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.018	30%	0.302	C	S	.	.	S	Bend	trans	-102.6	60.8	177.4	-54.3	-77.8	0	0	0	108.8	M491 Y495 N506 D509 F510 L513 Y594	M491-F499 HydrophobicContact CE-CZ 3.98Å; Y495-F499 CarbonylContact O-C 3.57Å; Y495-F499 WeakPolarHBondContact O-CA 3.38Å; Y495-F499 PolarHBondContact O-N 3.42Å; F499-N506 HydrophobicContact CB-CB 4.19Å; F499-N506 HydrophobicContact CD1-CB 4.39Å; F499-N506 VanDerWaalsContact CD1-O 3.3Å; F499-N506 WeakPolarHBondContact CD1-O 3.46Å; F499-D509 HydrophobicContact CE1-CB 4.22Å; F499-D509 WeakPolarHBondContact CE1-OD2 3.3Å; F499-F510 HydrophobicContact CD1-CB 4.14Å; F499-F510 HydrophobicContact CD2-CB 4.29Å; F499-F510 AromaticContact CD2-CD2 3.62Å; F499-F510 HydrophobicContact CD2-CD2 3.62Å; F499-F510 HydrophobicContact CD2-CE2 4.49Å; F499-F510 HydrophobicContact CD2-CG 4.42Å; F499-F510 HydrophobicContact CE1-CB 4.23Å; F499-F510 HydrophobicContact CE2-CB 4.39Å; F499-F510 AromaticContact CE2-CD2 3.67Å; F499-F510 HydrophobicContact CE2-CD2 3.67Å; F499-F510 HydrophobicContact CG-CB 4.16Å; F499-F510 HydrophobicContact CG-CD2 4.28Å; F499-F510 HydrophobicContact CZ-CB 4.35Å; F499-F510 HydrophobicContact CZ-CD2 4.33Å; F499-L513 HydrophobicContact CZ-CD2 4.2Å; F499-Y594 PolarHBondContact O-OH 3.01Å
500	Y	60.7	Low	72.5	Confident	138 Å²	138	56.6 Å²	56.6	54%	0.541	30%	0.301	S	S	.	.			trans	-64.9	144.1	-179	68.9	-87.1	0	0	0	110.2	I498 N506	I498-Y500 PolarHBondContact O-N 3.47Å; Y500-N506 PolarHBondContact O-ND2 2.52Å
501	N	56.6	Low	72.7	Confident	87 Å²	87	53.5 Å²	53.5	47%	0.465	29%	0.285	S	S	.	.	S	Bend	trans	62.5	136	-174.4	-55.1	-26.4	0	0	0	114.5	Q503	N501-Q503 HydrophobicContact CB-CG 3.98Å; N501-Q503 PolarHBondContact O-N 2.8Å
502	A	54.6	Low	73	Confident	72 Å²	72	54.4 Å²	54.4	60%	0.595	29%	0.289	S	S	*	.	S	Bend	trans	-71.4	34.3	174.3	0	0	0	0	0	112.7	V593	A502-V593 HydrophobicContact CB-CG1 4.5Å; A502-V593 HydrophobicContact CB-CG2 4.07Å
503	Q	63.4	Low	73.3	Confident	112 Å²	112	54.3 Å²	54.3	52%	0.523	29%	0.289	S	S	.	.			trans	-68.5	143	173.8	-72.9	178.7	-31.1	0	0	109.3	N501 E505 N506 V507	N501-Q503 HydrophobicContact CB-CG 3.98Å; N501-Q503 PolarHBondContact O-N 2.8Å; Q503-E505 PolarHBondContact O-N 3Å; Q503-N506 PolarHBondContact O-N 3.23Å; Q503-V507 WeakPolarHBondContact O-CG2 3.46Å; Q503-V507 PolarHBondContact O-N 3.35Å
504	S	65.8	Low	73.6	Confident	101 Å²	101	54.2 Å²	54.2	71%	0.706	29%	0.288	S	S	*	.	H	α-helix	trans	-59.1	-32.6	-170.3	49.6	0	0	0	0	113.8	L508	S504-L508 VanDerWaalsContact O-CB 3.3Å; S504-L508 WeakPolarHBondContact O-CB 3.2Å; S504-L508 PolarHBondContact O-N 3.43Å
505	E	72.5	Confident	74.3	Confident	155 Å²	155	54.7 Å²	54.7	72%	0.724	29%	0.289	S	S	*	.	H	α-helix	trans	-70.1	-49.6	-178.4	-68.3	173.9	-176.5	0	0	111.8	Q503 V507 L508 D509	Q503-E505 PolarHBondContact O-N 3Å; E505-V507 VanDerWaalsContact C-N 3.29Å; E505-V507 PolarHBondContact O-N 3.3Å; E505-L508 WeakPolarHBondContact O-CB 3.2Å; E505-L508 PolarHBondContact O-N 3.12Å; E505-L508 VanDerWaalsContact O-N 3.07Å; E505-D509 PolarHBondContact O-N 3.02Å
506	N	77.3	Confident	75.4	Confident	36 Å²	36	54.8 Å²	54.8	19%	0.193	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-35.6	178	-68.2	-16.9	0	0	0	112.3	F499 Y500 Q503 F510	F499-N506 HydrophobicContact CB-CB 4.19Å; F499-N506 HydrophobicContact CD1-CB 4.39Å; F499-N506 VanDerWaalsContact CD1-O 3.3Å; F499-N506 WeakPolarHBondContact CD1-O 3.46Å; Y500-N506 PolarHBondContact O-ND2 2.52Å; Q503-N506 PolarHBondContact O-N 3.23Å; N506-F510 WeakPolarHBondContact O-CB 3.47Å; N506-F510 PolarHBondContact O-N 3.11Å
507	V	79.6	Confident	76.7	Confident	29 Å²	29	54.1 Å²	54.1	18%	0.176	29%	0.286	C	S	.	.	H	α-helix	trans	-69.8	-35.6	175	176.7	0	0	0	0	111.3	Q503 E505 N511 V593 I597	Q503-V507 WeakPolarHBondContact O-CG2 3.46Å; Q503-V507 PolarHBondContact O-N 3.35Å; E505-V507 VanDerWaalsContact C-N 3.29Å; E505-V507 PolarHBondContact O-N 3.3Å; V507-N511 PolarHBondContact O-N 3.28Å; V507-N511 VanDerWaalsContact O-N 3.1Å; V507-N511 PolarHBondContact O-ND2 3.19Å; V507-V593 HydrophobicContact CG2-CG1 4.24Å; V507-I597 HydrophobicContact CG1-CD1 3.66Å
508	L	83.3	Confident	78	Confident	96 Å²	96	49.9 Å²	49.9	50%	0.503	26%	0.264	S	S	.	.	H	α-helix	trans	-67.5	-44.3	175.7	-172.6	75.6	0	0	0	111	S504 E505 F510 N511 H512	S504-L508 VanDerWaalsContact O-CB 3.3Å; S504-L508 WeakPolarHBondContact O-CB 3.2Å; S504-L508 PolarHBondContact O-N 3.43Å; E505-L508 WeakPolarHBondContact O-CB 3.2Å; E505-L508 PolarHBondContact O-N 3.12Å; E505-L508 VanDerWaalsContact O-N 3.07Å; L508-F510 PolarHBondContact O-N 3.39Å; L508-N511 WeakPolarHBondContact O-CA 3.48Å; L508-N511 WeakPolarHBondContact O-CB 3.38Å; L508-N511 PolarHBondContact O-N 3.27Å; L508-H512 VanDerWaalsContact CG-CE1 3.5Å; L508-H512 WeakPolarHBondContact CG-CE1 3.27Å; L508-H512 PolarHBondContact O-N 3.22Å; L508-H512 PolarHBondContact O-ND1 2.83Å
509	D	84.7	Confident	79.7	Confident	26 Å²	26	48.9 Å²	48.9	14%	0.139	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-40.8	178.4	-165.6	48.7	0	0	0	112.1	Q450 F499 E505 N511 H512 L513	Q450-D509 VanDerWaalsContact CB-OD1 3.29Å; Q450-D509 WeakPolarHBondContact CB-OD1 3.38Å; Q450-D509 VanDerWaalsContact CG-OD1 3.32Å; Q450-D509 WeakPolarHBondContact CG-OD1 3.37Å; Q450-D509 WeakPolarHBondContact CG-OD2 3.47Å; Q450-D509 PolarHBondContact N-OD1 2.9Å; F499-D509 HydrophobicContact CE1-CB 4.22Å; F499-D509 WeakPolarHBondContact CE1-OD2 3.3Å; E505-D509 PolarHBondContact O-N 3.02Å; D509-N511 VanDerWaalsContact C-N 3.3Å; D509-N511 PolarHBondContact O-N 2.82Å; D509-H512 PolarHBondContact O-N 3.12Å; D509-H512 VanDerWaalsContact O-N 3.16Å; D509-L513 PolarHBondContact O-N 3.14Å
510	F	86.4	Confident	81.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-39.6	169.8	-178.9	-92.1	0	0	0	112.6	I492 F499 N506 L508 L514 Y594 I597 I598	I492-F510 HydrophobicContact CB-CE2 4.23Å; I492-F510 HydrophobicContact CG1-CE2 4.21Å; I492-F510 HydrophobicContact CG2-CE2 3.95Å; I492-F510 HydrophobicContact CG2-CZ 3.95Å; F499-F510 HydrophobicContact CD1-CB 4.14Å; F499-F510 HydrophobicContact CD2-CB 4.29Å; F499-F510 AromaticContact CD2-CD2 3.62Å; F499-F510 HydrophobicContact CD2-CD2 3.62Å; F499-F510 HydrophobicContact CD2-CE2 4.49Å; F499-F510 HydrophobicContact CD2-CG 4.42Å; F499-F510 HydrophobicContact CE1-CB 4.23Å; F499-F510 HydrophobicContact CE2-CB 4.39Å; F499-F510 AromaticContact CE2-CD2 3.67Å; F499-F510 HydrophobicContact CE2-CD2 3.67Å; F499-F510 HydrophobicContact CG-CB 4.16Å; F499-F510 HydrophobicContact CG-CD2 4.28Å; F499-F510 HydrophobicContact CZ-CB 4.35Å; F499-F510 HydrophobicContact CZ-CD2 4.33Å; N506-F510 WeakPolarHBondContact O-CB 3.47Å; N506-F510 PolarHBondContact O-N 3.11Å; L508-F510 PolarHBondContact O-N 3.39Å; F510-L514 HydrophobicContact CE1-CD2 4.44Å; F510-L514 WeakPolarHBondContact O-CB 3.13Å; F510-L514 PolarHBondContact O-N 2.88Å; F510-L514 VanDerWaalsContact O-N 3.11Å; F510-Y594 HydrophobicContact CD1-CD1 4.23Å; F510-Y594 HydrophobicContact CD2-CD1 4.39Å; F510-Y594 HydrophobicContact CD2-CE1 4.27Å; F510-Y594 AromaticContact CE1-CD1 3.91Å; F510-Y594 HydrophobicContact CE1-CD1 3.91Å; F510-Y594 HydrophobicContact CE2-CD1 4.06Å; F510-Y594 HydrophobicContact CE2-CE1 4.31Å; F510-Y594 HydrophobicContact CG-CD1 4.46Å; F510-Y594 HydrophobicContact CG-CE1 4.36Å; F510-Y594 AromaticContact CZ-CD1 3.82Å; F510-Y594 HydrophobicContact CZ-CD1 3.82Å; F510-Y594 HydrophobicContact CZ-CE1 4.48Å; F510-I597 HydrophobicContact CD1-CD1 4.15Å; F510-I597 HydrophobicContact CD1-CG2 3.86Å; F510-I597 HydrophobicContact CE1-CB 4.16Å; F510-I597 HydrophobicContact CE1-CD1 4.44Å; F510-I597 HydrophobicContact CE1-CG2 3.68Å; F510-I598 HydrophobicContact CE1-CG1 4.27Å; F510-I598 HydrophobicContact CZ-CD1 4.09Å; F510-I598 HydrophobicContact CZ-CG1 4.06Å
511	N	88.2	Confident	82.5	Confident	29 Å²	29	42.8 Å²	42.8	16%	0.155	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-42.8	175	-84.1	-72	0	0	0	111.9	V507 L508 D509 L513 L514 E515 I597	V507-N511 PolarHBondContact O-N 3.28Å; V507-N511 VanDerWaalsContact O-N 3.1Å; V507-N511 PolarHBondContact O-ND2 3.19Å; L508-N511 WeakPolarHBondContact O-CA 3.48Å; L508-N511 WeakPolarHBondContact O-CB 3.38Å; L508-N511 PolarHBondContact O-N 3.27Å; D509-N511 VanDerWaalsContact C-N 3.3Å; D509-N511 PolarHBondContact O-N 2.82Å; N511-L513 VanDerWaalsContact C-N 3.35Å; N511-L514 PolarHBondContact O-N 3.22Å; N511-E515 WeakPolarHBondContact O-CB 3.38Å; N511-E515 PolarHBondContact O-N 2.78Å; N511-I597 WeakPolarHBondContact OD1-CG2 3.37Å
512	H	91.2	Very high	84.1	Confident	30 Å²	30	44.7 Å²	44.7	14%	0.139	25%	0.245	C	C	.	.	H	α-helix	trans	-63	-41.4	178	-63.8	148.7	0	0	0	111.8	Q450 L508 D509 L514 E515 C516	Q450-H512 HydrophobicContact CB-CB 4.02Å; L508-H512 VanDerWaalsContact CG-CE1 3.5Å; L508-H512 WeakPolarHBondContact CG-CE1 3.27Å; L508-H512 PolarHBondContact O-N 3.22Å; L508-H512 PolarHBondContact O-ND1 2.83Å; D509-H512 PolarHBondContact O-N 3.12Å; D509-H512 VanDerWaalsContact O-N 3.16Å; H512-L514 PolarHBondContact O-N 3.28Å; H512-E515 PolarHBondContact O-N 3.26Å; H512-C516 VanDerWaalsContact O-CB 3.3Å; H512-C516 WeakPolarHBondContact O-CB 3.4Å; H512-C516 PolarHBondContact O-N 3.09Å
513	L	90.9	Very high	85.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-48.3	174.1	-178.4	54.6	0	0	0	111.5	Q450 F484 S488 M491 I492 F499 D509 N511 C516 L517	Q450-L513 HydrophobicContact CB-CB 4.03Å; Q450-L513 HydrophobicContact CG-CB 3.92Å; Q450-L513 HydrophobicContact CG-CD1 4.4Å; F484-L513 HydrophobicContact CE2-CD1 4.16Å; F484-L513 HydrophobicContact CZ-CD1 4.19Å; S488-L513 WeakPolarHBondContact OG-CD1 3.49Å; M491-L513 HydrophobicContact CB-CD2 3.81Å; M491-L513 HydrophobicContact CE-CD2 4.38Å; M491-L513 HydrophobicContact SD-CD2 4.18Å; I492-L513 HydrophobicContact CD1-CD2 4.4Å; I492-L513 HydrophobicContact CD1-CG 4.27Å; I492-L513 HydrophobicContact CG1-CD2 3.83Å; I492-L513 HydrophobicContact CG1-CG 4.19Å; F499-L513 HydrophobicContact CZ-CD2 4.2Å; D509-L513 PolarHBondContact O-N 3.14Å; N511-L513 VanDerWaalsContact C-N 3.35Å; L513-C516 PolarHBondContact O-N 3.28Å; L513-L517 WeakPolarHBondContact O-CB 3.31Å; L513-L517 PolarHBondContact O-N 3.05Å
514	L	90.5	Very high	86.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.2	-39.4	-177.9	-159.4	69.3	0	0	0	111.6	I492 F510 N511 H512 L517 C518 I597 I598 Y601 L602	I492-L514 HydrophobicContact CD1-CD1 3.55Å; I492-L514 HydrophobicContact CG1-CD1 4.27Å; I492-L514 HydrophobicContact CG2-CD1 4.4Å; F510-L514 HydrophobicContact CE1-CD2 4.44Å; F510-L514 WeakPolarHBondContact O-CB 3.13Å; F510-L514 PolarHBondContact O-N 2.88Å; F510-L514 VanDerWaalsContact O-N 3.11Å; N511-L514 PolarHBondContact O-N 3.22Å; H512-L514 PolarHBondContact O-N 3.28Å; L514-L517 PolarHBondContact O-N 3.41Å; L514-C518 WeakPolarHBondContact O-CB 3.36Å; L514-C518 PolarHBondContact O-N 3.35Å; L514-C518 PolarHBondContact O-SG 3.45Å; L514-I597 HydrophobicContact CD2-CG2 3.89Å; L514-I598 HydrophobicContact CD2-CG1 4.31Å; L514-Y601 HydrophobicContact CD2-CD2 3.61Å; L514-Y601 HydrophobicContact CD2-CG 3.85Å; L514-Y601 HydrophobicContact CG-CD2 4.25Å; L514-Y601 HydrophobicContact CG-CG 4.11Å; L514-L602 HydrophobicContact CD1-CD1 4.45Å
515	E	93.2	Very high	88	Confident	56 Å²	56	39 Å²	39	26%	0.262	19%	0.19	S	C	.	.	H	α-helix	trans	-61.2	-47.2	173	-175.7	-179.9	148.5	0	0	110.9	L454 K458 N511 H512 L517 C518 M519 Y601	L454-E515 HydrophobicContact CD1-CB 4.24Å; L454-E515 HydrophobicContact CD1-CG 3.86Å; L454-E515 HydrophobicContact CD2-CG 4.39Å; K458-E515 IonicContact NZ-OE1 3.94Å; K458-E515 PolarHBondContact NZ-OE1 2.81Å; N511-E515 WeakPolarHBondContact O-CB 3.38Å; N511-E515 PolarHBondContact O-N 2.78Å; H512-E515 PolarHBondContact O-N 3.26Å; E515-L517 PolarHBondContact O-N 2.95Å; E515-C518 PolarHBondContact O-N 3.05Å; E515-M519 VanDerWaalsContact O-CB 3.23Å; E515-M519 WeakPolarHBondContact O-CB 3.31Å; E515-M519 PolarHBondContact O-N 2.92Å; E515-Y601 HydrophobicContact CB-CE1 3.84Å; E515-Y601 HydrophobicContact CG-CE1 4.21Å
516	C	93.7	Very high	88.8	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.007	16%	0.158	C	C	.	.	H	α-helix	trans	-62	-45.1	179.6	-170.2	0	0	0	0	111.1	L454 F484 H512 L513 M519 L520	L454-C516 HydrophobicContact CB-CB 4.17Å; L454-C516 HydrophobicContact CD1-CB 3.77Å; F484-C516 HydrophobicContact CZ-CB 4.15Å; H512-C516 VanDerWaalsContact O-CB 3.3Å; H512-C516 WeakPolarHBondContact O-CB 3.4Å; H512-C516 PolarHBondContact O-N 3.09Å; L513-C516 PolarHBondContact O-N 3.28Å; C516-M519 PolarHBondContact O-N 2.86Å; C516-L520 WeakPolarHBondContact O-CB 3.39Å; C516-L520 PolarHBondContact O-N 2.91Å
517	L	93.6	Very high	89.2	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-43.3	177.6	-175.9	61.5	0	0	0	112.4	F484 T485 L489 I492 L513 L514 E515 L520 H521 L536	F484-L517 HydrophobicContact CD1-CD1 4.46Å; F484-L517 HydrophobicContact CE1-CB 4.46Å; F484-L517 HydrophobicContact CE1-CD1 4.21Å; T485-L517 HydrophobicContact CG2-CD1 4.18Å; L489-L517 HydrophobicContact CD2-CD2 3.97Å; L489-L517 HydrophobicContact CG-CD2 4.37Å; I492-L517 HydrophobicContact CD1-CD2 3.57Å; L513-L517 WeakPolarHBondContact O-CB 3.31Å; L513-L517 PolarHBondContact O-N 3.05Å; L514-L517 PolarHBondContact O-N 3.41Å; E515-L517 PolarHBondContact O-N 2.95Å; L517-L520 PolarHBondContact O-N 3.1Å; L517-H521 PolarHBondContact O-CD2 2.95Å; L517-H521 PolarHBondContact O-N 2.78Å; L517-H521 VanDerWaalsContact O-N 3.11Å; L517-L536 HydrophobicContact CD1-CD1 4.19Å; L517-L536 HydrophobicContact CD2-CD1 3.77Å; L517-L536 HydrophobicContact CG-CD1 3.76Å; L517-L536 HydrophobicContact CG-CD2 4.16Å
518	C	92.3	Very high	89.3	Confident	10 Å²	10	39 Å²	39	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-66.9	-43.5	176.9	-68.1	0	0	0	0	111.8	L514 E515 L520 H521 N522 L536	L514-C518 WeakPolarHBondContact O-CB 3.36Å; L514-C518 PolarHBondContact O-N 3.35Å; L514-C518 PolarHBondContact O-SG 3.45Å; E515-C518 PolarHBondContact O-N 3.05Å; C518-L520 VanDerWaalsContact C-N 3.27Å; C518-L520 PolarHBondContact O-N 2.84Å; C518-H521 PolarHBondContact O-N 2.54Å; C518-N522 VanDerWaalsContact O-CB 3.26Å; C518-N522 WeakPolarHBondContact O-CB 3.41Å; C518-N522 PolarHBondContact O-N 3.41Å; C518-N522 PolarHBondContact O-ND2 2.64Å; C518-N522 VanDerWaalsContact O-ND2 3.16Å; C518-L536 HydrophobicContact CB-CD2 4.41Å
519	M	92.4	Very high	89.2	Confident	44 Å²	44	35.2 Å²	35.2	22%	0.217	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-39	177.2	-175.4	169.3	68.7	0	0	111.1	L454 F457 K458 I461 E515 C516 S523	L454-M519 HydrophobicContact CD1-CE 3.5Å; L454-M519 VanDerWaalsContact CD1-CE 3.5Å; L454-M519 HydrophobicContact CD1-SD 4.44Å; L454-M519 HydrophobicContact CG-CE 4.44Å; F457-M519 HydrophobicContact CB-CE 4.13Å; F457-M519 HydrophobicContact CD1-CE 3.47Å; F457-M519 VanDerWaalsContact CD1-CE 3.47Å; F457-M519 HydrophobicContact CD1-CG 4.18Å; F457-M519 HydrophobicContact CE1-CE 4.33Å; F457-M519 HydrophobicContact CE1-CG 4.13Å; F457-M519 HydrophobicContact CG-CE 4.28Å; K458-M519 HydrophobicContact CD-CE 4.29Å; K458-M519 HydrophobicContact CD-SD 4.4Å; K458-M519 HydrophobicContact CG-CE 3.47Å; K458-M519 VanDerWaalsContact CG-CE 3.47Å; K458-M519 HydrophobicContact CG-SD 3.72Å; I461-M519 HydrophobicContact CD1-CG 4.13Å; E515-M519 VanDerWaalsContact O-CB 3.23Å; E515-M519 WeakPolarHBondContact O-CB 3.31Å; E515-M519 PolarHBondContact O-N 2.92Å; C516-M519 PolarHBondContact O-N 2.86Å; M519-S523 WeakPolarHBondContact O-CB 3.5Å; M519-S523 PolarHBondContact O-N 2.67Å
520	L	92.6	Very high	89.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.1	-57.7	174.6	-178.8	134.5	0	0	0	111.8	W436 F457 F481 F484 C516 L517 C518 N522 S523 Y526	W436-L520 HydrophobicContact CH2-CD1 4.05Å; W436-L520 HydrophobicContact CZ2-CD1 3.58Å; F457-L520 HydrophobicContact CD1-CB 4.34Å; F457-L520 HydrophobicContact CD2-CD1 4.45Å; F457-L520 HydrophobicContact CE1-CB 3.72Å; F457-L520 HydrophobicContact CE1-CD1 4.49Å; F457-L520 HydrophobicContact CE1-CG 4.35Å; F457-L520 HydrophobicContact CE2-CD1 3.98Å; F457-L520 HydrophobicContact CE2-CG 4.44Å; F457-L520 HydrophobicContact CZ-CB 3.9Å; F457-L520 HydrophobicContact CZ-CD1 4.03Å; F457-L520 HydrophobicContact CZ-CG 4Å; F481-L520 HydrophobicContact CB-CD1 4.31Å; F481-L520 HydrophobicContact CB-CD2 4.35Å; F481-L520 HydrophobicContact CD1-CD1 3.48Å; F481-L520 VanDerWaalsContact CD1-CD1 3.48Å; F481-L520 HydrophobicContact CD1-CG 4.4Å; F481-L520 HydrophobicContact CE1-CD1 3.95Å; F481-L520 HydrophobicContact CG-CD1 3.99Å; F484-L520 HydrophobicContact CD1-CD1 3.83Å; F484-L520 HydrophobicContact CE1-CD1 4.26Å; C516-L520 WeakPolarHBondContact O-CB 3.39Å; C516-L520 PolarHBondContact O-N 2.91Å; L517-L520 PolarHBondContact O-N 3.1Å; C518-L520 VanDerWaalsContact C-N 3.27Å; C518-L520 PolarHBondContact O-N 2.84Å; L520-N522 PolarHBondContact O-N 3.03Å; L520-S523 WeakPolarHBondContact O-CB 3.31Å; L520-S523 PolarHBondContact O-N 2.81Å; L520-S523 PolarHBondContact O-OG 3.07Å; L520-Y526 HydrophobicContact CD2-CD2 3.48Å; L520-Y526 VanDerWaalsContact CD2-CD2 3.48Å; L520-Y526 HydrophobicContact CD2-CE2 3.63Å; L520-Y526 HydrophobicContact CD2-CG 4.23Å; L520-Y526 HydrophobicContact CG-CD2 4.05Å; L520-Y526 WeakPolarHBondContact O-CB 3.27Å
521	H	90.3	Very high	88.6	Confident	15 Å²	15	39 Å²	39	7%	0.069	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-31.5	-179.5	-85.7	-103.9	0	0	0	113.6	T485 L517 C518 Y526 L536 E539	T485-H521 WeakPolarHBondContact CG2-NE2 3.3Å; T485-H521 PolarHBondContact OG1-NE2 2.92Å; L517-H521 PolarHBondContact O-CD2 2.95Å; L517-H521 PolarHBondContact O-N 2.78Å; L517-H521 VanDerWaalsContact O-N 3.11Å; C518-H521 PolarHBondContact O-N 2.54Å; H521-Y526 HydrophobicContact CB-CE1 4.45Å; H521-Y526 AromaticContact CE1-CE1 3.88Å; H521-Y526 AromaticContact CE1-CZ 3.56Å; H521-Y526 PolarHBondContact CE1-OH 2.97Å; H521-Y526 AromaticContact CG-CE1 3.96Å; H521-Y526 AromaticContact ND1-CE1 3.55Å; H521-Y526 AromaticContact ND1-CZ 3.73Å; H521-Y526 AromaticContact NE2-CZ 3.89Å; H521-L536 HydrophobicContact CB-CB 4.06Å; H521-L536 HydrophobicContact CB-CD2 4.14Å; H521-E539 IonicContact CE1-OE2 3.68Å; H521-E539 PolarHBondContact CE1-OE2 3.14Å; H521-E539 VanDerWaalsContact CE1-OE2 3.3Å; H521-E539 IonicContact NE2-OE2 3.75Å
522	N	89.2	Confident	88.2	Confident	126 Å²	126	47.2 Å²	47.2	67%	0.674	23%	0.228	S	C	*	.	H	α-helix	trans	-84.4	-8.4	178.4	-67.8	-27.1	0	0	0	113.7	C518 L520	C518-N522 VanDerWaalsContact O-CB 3.26Å; C518-N522 WeakPolarHBondContact O-CB 3.41Å; C518-N522 PolarHBondContact O-N 3.41Å; C518-N522 PolarHBondContact O-ND2 2.64Å; C518-N522 VanDerWaalsContact O-ND2 3.16Å; L520-N522 PolarHBondContact O-N 3.03Å
523	S	89.6	Confident	87.7	Confident	11 Å²	11	48.1 Å²	48.1	8%	0.077	24%	0.238	C	C	.	.	S	Bend	trans	-74.3	143.7	-178.7	73.9	0	0	0	0	111.9	M519 L520 L525 Y526 Q527	M519-S523 WeakPolarHBondContact O-CB 3.5Å; M519-S523 PolarHBondContact O-N 2.67Å; L520-S523 WeakPolarHBondContact O-CB 3.31Å; L520-S523 PolarHBondContact O-N 2.81Å; L520-S523 PolarHBondContact O-OG 3.07Å; S523-L525 PolarHBondContact O-N 2.8Å; S523-Y526 PolarHBondContact O-N 2.89Å; S523-Y526 VanDerWaalsContact OG-CB 3.28Å; S523-Y526 WeakPolarHBondContact OG-CB 3.27Å; S523-Y526 PolarHBondContact OG-N 3.24Å; S523-Y526 VanDerWaalsContact OG-N 3.09Å; S523-Q527 PolarHBondContact O-N 2.75Å
524	R	86.6	Confident	87.3	Confident	153 Å²	153	51.6 Å²	51.6	58%	0.577	26%	0.256	S	S	*	.	H	α-helix	trans	-60.9	-33.1	171.6	-177.3	-178	172.6	140.4	3.5	111.5	W464 D466 Q527 F528	W464-R524 HydrophobicContact CH2-CB 4.43Å; W464-R524 HydrophobicContact CH2-CG 3.88Å; W464-R524 HydrophobicContact CZ3-CB 3.87Å; W464-R524 HydrophobicContact CZ3-CG 3.7Å; D466-R524 VanDerWaalsContact CG-NH2 3.3Å; D466-R524 IonicContact OD1-CZ 3.89Å; D466-R524 IonicContact OD1-NE 2.78Å; D466-R524 PolarHBondContact OD1-NE 2.75Å; D466-R524 IonicContact OD1-NH2 3.63Å; D466-R524 PolarHBondContact OD1-NH2 2.96Å; D466-R524 IonicContact OD2-CZ 2.8Å; D466-R524 IonicContact OD2-NE 3.55Å; D466-R524 IonicContact OD2-NH2 3.85Å; D466-R524 PolarHBondContact OD2-NH2 2.54Å; R524-Q527 PolarHBondContact O-N 3.19Å; R524-F528 VanDerWaalsContact O-CB 3.27Å; R524-F528 WeakPolarHBondContact O-CB 3.47Å; R524-F528 PolarHBondContact O-N 3.38Å
525	L	89.5	Confident	87.1	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-47.5	176.3	175.7	58.7	0	0	0	111.5	L460 W464 L474 L477 F481 S523 F528 S529	L460-L525 HydrophobicContact CD2-CD2 4.07Å; L460-L525 HydrophobicContact CG-CD2 4.11Å; W464-L525 HydrophobicContact CD2-CB 4.07Å; W464-L525 HydrophobicContact CD2-CD1 3.87Å; W464-L525 HydrophobicContact CD2-CG 4.43Å; W464-L525 HydrophobicContact CE3-CB 3.99Å; W464-L525 HydrophobicContact CG-CD1 4.04Å; W464-L525 HydrophobicContact CG-CD2 4.48Å; W464-L525 HydrophobicContact CZ2-CD1 4Å; W464-L525 HydrophobicContact CZ3-CB 4.22Å; L474-L525 HydrophobicContact CD2-CD1 4.2Å; L477-L525 HydrophobicContact CD1-CD1 4.27Å; L477-L525 HydrophobicContact CD1-CD2 4.43Å; F481-L525 HydrophobicContact CE2-CD2 4.48Å; F481-L525 HydrophobicContact CE2-CG 4.08Å; F481-L525 HydrophobicContact CZ-CD2 3.86Å; F481-L525 HydrophobicContact CZ-CG 3.97Å; S523-L525 PolarHBondContact O-N 2.8Å; L525-F528 PolarHBondContact O-N 3.2Å; L525-S529 WeakPolarHBondContact O-CB 3.36Å; L525-S529 PolarHBondContact O-N 2.92Å; L525-S529 PolarHBondContact O-OG 3.18Å
526	Y	88.7	Confident	87	Confident	12 Å²	12	52.9 Å²	52.9	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-44	177.8	-179.9	-97.4	0	0	0	112.5	F481 L520 H521 S523 F528 S529 S530 S533	F481-Y526 HydrophobicContact CB-CD2 3.99Å; F481-Y526 HydrophobicContact CB-CE2 4.02Å; F481-Y526 AromaticContact CD2-CD2 3.75Å; F481-Y526 HydrophobicContact CD2-CD2 3.75Å; F481-Y526 HydrophobicContact CG-CD2 4.11Å; L520-Y526 HydrophobicContact CD2-CD2 3.48Å; L520-Y526 VanDerWaalsContact CD2-CD2 3.48Å; L520-Y526 HydrophobicContact CD2-CE2 3.63Å; L520-Y526 HydrophobicContact CD2-CG 4.23Å; L520-Y526 HydrophobicContact CG-CD2 4.05Å; L520-Y526 WeakPolarHBondContact O-CB 3.27Å; H521-Y526 HydrophobicContact CB-CE1 4.45Å; H521-Y526 AromaticContact CE1-CE1 3.88Å; H521-Y526 AromaticContact CE1-CZ 3.56Å; H521-Y526 PolarHBondContact CE1-OH 2.97Å; H521-Y526 AromaticContact CG-CE1 3.96Å; H521-Y526 AromaticContact ND1-CE1 3.55Å; H521-Y526 AromaticContact ND1-CZ 3.73Å; H521-Y526 AromaticContact NE2-CZ 3.89Å; S523-Y526 PolarHBondContact O-N 2.89Å; S523-Y526 VanDerWaalsContact OG-CB 3.28Å; S523-Y526 WeakPolarHBondContact OG-CB 3.27Å; S523-Y526 PolarHBondContact OG-N 3.24Å; S523-Y526 VanDerWaalsContact OG-N 3.09Å; Y526-F528 PolarHBondContact O-N 2.67Å; Y526-S529 PolarHBondContact O-N 3.42Å; Y526-S529 PolarHBondContact O-OG 3.31Å; Y526-S530 PolarHBondContact O-N 3.02Å; Y526-S533 VanDerWaalsContact CE1-OG 3.27Å; Y526-S533 WeakPolarHBondContact CE1-OG 3.41Å; Y526-S533 WeakPolarHBondContact OH-CB 3Å; Y526-S533 PolarHBondContact OH-OG 3.22Å
527	Q	86.3	Confident	86.8	Confident	117 Å²	117	57 Å²	57	55%	0.547	29%	0.289	S	S	.	.	H	α-helix	trans	-61	-34.9	175.9	-66.8	174.8	7.9	0	0	111.9	S523 R524 P531	S523-Q527 PolarHBondContact O-N 2.75Å; R524-Q527 PolarHBondContact O-N 3.19Å; Q527-P531 WeakPolarHBondContact O-CA 3.3Å
528	F	82.8	Confident	86.5	Confident	92 Å²	92	62.4 Å²	62.4	40%	0.404	31%	0.313	S	S	.	.	H	α-helix	trans	-76.1	-40.6	179	-165.8	-97.8	0	0	0	112.7	W464 L474 R524 L525 Y526	W464-F528 HydrophobicContact CH2-CB 4.18Å; W464-F528 HydrophobicContact CH2-CG 4.43Å; W464-F528 HydrophobicContact CZ2-CB 4.25Å; W464-F528 HydrophobicContact CZ2-CD1 4.17Å; W464-F528 HydrophobicContact CZ2-CG 4.23Å; L474-F528 HydrophobicContact CD1-CD1 4Å; L474-F528 HydrophobicContact CD1-CE1 3.67Å; L474-F528 HydrophobicContact CD2-CD1 4.34Å; R524-F528 VanDerWaalsContact O-CB 3.27Å; R524-F528 WeakPolarHBondContact O-CB 3.47Å; R524-F528 PolarHBondContact O-N 3.38Å; L525-F528 PolarHBondContact O-N 3.2Å; Y526-F528 PolarHBondContact O-N 2.67Å
529	S	81.7	Confident	86.3	Confident	15 Å²	15	63.8 Å²	63.8	11%	0.105	32%	0.318	C	S	.	.	H	α-helix	trans	-75.5	-33.2	179.4	64.4	0	0	0	0	112.8	F481 L525 Y526	F481-S529 WeakPolarHBondContact CD2-OG 3.27Å; F481-S529 WeakPolarHBondContact CE2-OG 3.38Å; L525-S529 WeakPolarHBondContact O-CB 3.36Å; L525-S529 PolarHBondContact O-N 2.92Å; L525-S529 PolarHBondContact O-OG 3.18Å; Y526-S529 PolarHBondContact O-N 3.42Å; Y526-S529 PolarHBondContact O-OG 3.31Å
530	S	81.4	Confident	86.2	Confident	19 Å²	19	61.8 Å²	61.8	13%	0.133	31%	0.308	C	S	.	.			trans	-134.8	62	-168.4	-49.6	0	0	0	0	111.7	S478 Y526 F532 S533	S478-S530 PolarHBondContact OG-OG 2.93Å; Y526-S530 PolarHBondContact O-N 3.02Å; S530-F532 PolarHBondContact O-N 3.35Å; S530-F532 VanDerWaalsContact O-N 3.07Å; S530-S533 PolarHBondContact O-N 3.3Å; S530-S533 PolarHBondContact O-OG 3.1Å
531	P	76.4	Confident	86	Confident	87 Å²	87	64.8 Å²	64.8	57%	0.565	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-15	-167.6	26.6	-36.3	0	0	0	115.5	Q527	Q527-P531 WeakPolarHBondContact O-CA 3.3Å
532	F	78.9	Confident	85.9	Confident	201 Å²	201	67.5 Å²	67.5	88%	0.882	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	16.3	-178.7	-54.4	-68.8	0	0	0	113	S530	S530-F532 PolarHBondContact O-N 3.35Å; S530-F532 VanDerWaalsContact O-N 3.07Å
533	S	80.9	Confident	85.9	Confident	50 Å²	50	63.3 Å²	63.3	35%	0.35	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-66.8	154.9	177	65.7	0	0	0	0	111.6	Y526 S530	Y526-S533 VanDerWaalsContact CE1-OG 3.27Å; Y526-S533 WeakPolarHBondContact CE1-OG 3.41Å; Y526-S533 WeakPolarHBondContact OH-CB 3Å; Y526-S533 PolarHBondContact OH-OG 3.22Å; S530-S533 PolarHBondContact O-N 3.3Å; S530-S533 PolarHBondContact O-OG 3.1Å
534	N	83.2	Confident	85.9	Confident	72 Å²	72	62.8 Å²	62.8	39%	0.385	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-74.5	162.1	170.8	-71.1	-65.4	0	0	0	109.1	K538 E539	N534-K538 HydrophobicContact CB-CB 4.39Å; N534-K538 HydrophobicContact CB-CD 4.15Å; N534-K538 HydrophobicContact CB-CG 4.49Å; N534-K538 WeakPolarHBondContact OD1-CE 3.17Å; N534-K538 PolarHBondContact OD1-NZ 2.88Å; N534-E539 HydrophobicContact CB-CG 3.67Å
535	S	87.1	Confident	86.1	Confident	66 Å²	66	60.5 Å²	60.5	46%	0.462	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-61.9	144.1	167.7	63.8	0	0	0	0	110.2	Q537 K538 E539	S535-Q537 PolarHBondContact O-N 3.04Å; S535-Q537 VanDerWaalsContact O-N 3.11Å; S535-K538 WeakPolarHBondContact O-CB 3.29Å; S535-K538 PolarHBondContact O-N 2.88Å; S535-K538 PolarHBondContact OG-N 3.44Å; S535-E539 PolarHBondContact O-N 3.44Å
536	L	89.3	Confident	86.1	Confident	17 Å²	17	67.5 Å²	67.5	9%	0.089	34%	0.343	C	S	.	.	H	α-helix	trans	-50.7	-38.6	176.3	-179.7	54.5	0	0	0	112.4	L517 C518 H521 K538 E539 F540 L602	L517-L536 HydrophobicContact CD1-CD1 4.19Å; L517-L536 HydrophobicContact CD2-CD1 3.77Å; L517-L536 HydrophobicContact CG-CD1 3.76Å; L517-L536 HydrophobicContact CG-CD2 4.16Å; C518-L536 HydrophobicContact CB-CD2 4.41Å; H521-L536 HydrophobicContact CB-CB 4.06Å; H521-L536 HydrophobicContact CB-CD2 4.14Å; L536-K538 PolarHBondContact O-N 3.37Å; L536-E539 PolarHBondContact O-N 3.49Å; L536-F540 VanDerWaalsContact O-CB 3.24Å; L536-F540 WeakPolarHBondContact O-CB 3.38Å; L536-F540 PolarHBondContact O-N 3.31Å; L536-L602 HydrophobicContact CD2-CD2 3.44Å; L536-L602 VanDerWaalsContact CD2-CD2 3.44Å; L536-L602 HydrophobicContact CG-CD2 3.67Å
537	Q	89.6	Confident	86.1	Confident	88 Å²	88	68 Å²	68	41%	0.411	35%	0.345	S	S	.	.	H	α-helix	trans	-58.2	-43.5	175.7	-71.4	171.2	-23	0	0	112.9	S535 L541 L602 L604	S535-Q537 PolarHBondContact O-N 3.04Å; S535-Q537 VanDerWaalsContact O-N 3.11Å; Q537-L541 WeakPolarHBondContact O-CB 3.46Å; Q537-L541 PolarHBondContact O-N 3.32Å; Q537-L602 PolarHBondContact NE2-O 3.48Å; Q537-L604 HydrophobicContact CB-CD1 3.86Å; Q537-L604 HydrophobicContact CG-CD1 3.99Å; Q537-L604 HydrophobicContact CG-CG 4.23Å
538	K	87.1	Confident	86.2	Confident	114 Å²	114	62.4 Å²	62.4	50%	0.496	32%	0.319	S	S	.	.	H	α-helix	trans	-72.6	-38.7	179.9	-176.7	179.1	172.8	-163.9	0	111.5	N534 S535 L536 T542	N534-K538 HydrophobicContact CB-CB 4.39Å; N534-K538 HydrophobicContact CB-CD 4.15Å; N534-K538 HydrophobicContact CB-CG 4.49Å; N534-K538 WeakPolarHBondContact OD1-CE 3.17Å; N534-K538 PolarHBondContact OD1-NZ 2.88Å; S535-K538 WeakPolarHBondContact O-CB 3.29Å; S535-K538 PolarHBondContact O-N 2.88Å; S535-K538 PolarHBondContact OG-N 3.44Å; L536-K538 PolarHBondContact O-N 3.37Å; K538-T542 WeakPolarHBondContact O-CB 3.26Å; K538-T542 PolarHBondContact O-N 3.07Å; K538-T542 PolarHBondContact O-OG1 2.89Å
539	E	88.6	Confident	86.6	Confident	39 Å²	39	61 Å²	61	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-47.7	175.1	-63	-170.8	165.8	0	0	110.9	T485 L489 H521 N534 S535 L536 L541 T542 S543	T485-E539 WeakPolarHBondContact CG2-OE2 3.48Å; L489-E539 HydrophobicContact CD1-CB 3.81Å; H521-E539 IonicContact CE1-OE2 3.68Å; H521-E539 PolarHBondContact CE1-OE2 3.14Å; H521-E539 VanDerWaalsContact CE1-OE2 3.3Å; H521-E539 IonicContact NE2-OE2 3.75Å; N534-E539 HydrophobicContact CB-CG 3.67Å; S535-E539 PolarHBondContact O-N 3.44Å; L536-E539 PolarHBondContact O-N 3.49Å; E539-L541 PolarHBondContact O-N 3.38Å; E539-T542 PolarHBondContact O-N 3.46Å; E539-S543 PolarHBondContact O-N 2.73Å; E539-S543 PolarHBondContact O-OG 3.12Å
540	F	90.8	Very high	86.9	Confident	1 Å²	1	63.2 Å²	63.2	0%	0.004	34%	0.335	C	S	.	.	H	α-helix	trans	-55.5	-52.7	173.7	173.8	-99.2	0	0	0	111.5	L489 I492 L536 T542 S543 F544 I598 L602 L604 P606	L489-F540 HydrophobicContact CD2-CB 3.98Å; L489-F540 HydrophobicContact CD2-CD2 3.96Å; L489-F540 HydrophobicContact CD2-CG 4.49Å; I492-F540 HydrophobicContact CG2-CD2 4.36Å; I492-F540 HydrophobicContact CG2-CE2 3.82Å; L536-F540 VanDerWaalsContact O-CB 3.24Å; L536-F540 WeakPolarHBondContact O-CB 3.38Å; L536-F540 PolarHBondContact O-N 3.31Å; F540-T542 VanDerWaalsContact C-N 3.25Å; F540-T542 PolarHBondContact O-N 2.99Å; F540-S543 PolarHBondContact O-N 3.43Å; F540-F544 HydrophobicContact CE1-CB 4.24Å; F540-F544 HydrophobicContact CE1-CG 4.25Å; F540-F544 HydrophobicContact CE2-CB 4.41Å; F540-F544 HydrophobicContact CE2-CD2 4.26Å; F540-F544 HydrophobicContact CZ-CB 4.15Å; F540-F544 AromaticContact CZ-CD2 3.85Å; F540-F544 HydrophobicContact CZ-CD2 3.85Å; F540-F544 HydrophobicContact CZ-CE2 4.4Å; F540-F544 AromaticContact CZ-CG 3.98Å; F540-F544 HydrophobicContact CZ-CG 3.98Å; F540-F544 WeakPolarHBondContact O-CB 3.32Å; F540-F544 PolarHBondContact O-N 2.82Å; F540-I598 HydrophobicContact CE1-CG2 4.17Å; F540-I598 HydrophobicContact CE2-CD1 4.43Å; F540-I598 HydrophobicContact CZ-CD1 4.11Å; F540-I598 HydrophobicContact CZ-CG2 4Å; F540-L602 HydrophobicContact CB-CD1 4Å; F540-L602 HydrophobicContact CD1-CD1 3.96Å; F540-L602 HydrophobicContact CD2-CD1 3.9Å; F540-L602 HydrophobicContact CE1-CD1 4.46Å; F540-L602 HydrophobicContact CE2-CD1 4.42Å; F540-L602 HydrophobicContact CG-CD1 3.65Å; F540-L604 HydrophobicContact CD1-CD1 3.8Å; F540-L604 HydrophobicContact CE1-CD1 4.42Å; F540-P606 HydrophobicContact CZ-CB 4.4Å
541	L	87.8	Confident	87.2	Confident	64 Å²	64	64.3 Å²	64.3	34%	0.335	34%	0.336	S	S	.	.	H	α-helix	trans	-61.7	-34.7	-177.9	-172.3	64	0	0	0	112.4	Q537 E539 K545 N609	Q537-L541 WeakPolarHBondContact O-CB 3.46Å; Q537-L541 PolarHBondContact O-N 3.32Å; E539-L541 PolarHBondContact O-N 3.38Å; L541-K545 VanDerWaalsContact O-CB 3.24Å; L541-K545 WeakPolarHBondContact O-CB 3.13Å; L541-K545 PolarHBondContact O-N 3.3Å; L541-N609 HydrophobicContact CD1-CB 4.21Å
542	T	89.7	Confident	87.9	Confident	71 Å²	71	60.2 Å²	60.2	44%	0.436	31%	0.31	S	S	.	.	H	α-helix	trans	-68.8	-47.7	177.5	-56.7	0	0	0	0	111.4	K538 E539 F540 K546	K538-T542 WeakPolarHBondContact O-CB 3.26Å; K538-T542 PolarHBondContact O-N 3.07Å; K538-T542 PolarHBondContact O-OG1 2.89Å; E539-T542 PolarHBondContact O-N 3.46Å; F540-T542 VanDerWaalsContact C-N 3.25Å; F540-T542 PolarHBondContact O-N 2.99Å; T542-K546 WeakPolarHBondContact O-CG 3.42Å; T542-K546 PolarHBondContact O-N 3.22Å
543	S	87.5	Confident	88.3	Confident	38 Å²	38	54.8 Å²	54.8	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-66.2	-42.7	177.2	-66	0	0	0	0	111.6	E539 F540 K545 K546 F547	E539-S543 PolarHBondContact O-N 2.73Å; E539-S543 PolarHBondContact O-OG 3.12Å; F540-S543 PolarHBondContact O-N 3.43Å; S543-K545 PolarHBondContact O-N 3.16Å; S543-K546 PolarHBondContact O-N 3.28Å; S543-F547 PolarHBondContact O-N 3.37Å
544	F	90	Very high	88.6	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-63.1	-43.5	178.1	-169.9	-107.8	0	0	0	111.6	C493 Y495 F540 K546 F547 V548 P606 N609 M610	C493-F544 VanDerWaalsContact SG-CA 3.56Å; Y495-F544 HydrophobicContact CE1-CE2 4.5Å; F540-F544 HydrophobicContact CE1-CB 4.24Å; F540-F544 HydrophobicContact CE1-CG 4.25Å; F540-F544 HydrophobicContact CE2-CB 4.41Å; F540-F544 HydrophobicContact CE2-CD2 4.26Å; F540-F544 HydrophobicContact CZ-CB 4.15Å; F540-F544 AromaticContact CZ-CD2 3.85Å; F540-F544 HydrophobicContact CZ-CD2 3.85Å; F540-F544 HydrophobicContact CZ-CE2 4.4Å; F540-F544 AromaticContact CZ-CG 3.98Å; F540-F544 HydrophobicContact CZ-CG 3.98Å; F540-F544 WeakPolarHBondContact O-CB 3.32Å; F540-F544 PolarHBondContact O-N 2.82Å; F544-K546 PolarHBondContact O-N 3.44Å; F544-F547 HydrophobicContact CD2-CD1 4.48Å; F544-F547 PolarHBondContact O-N 2.74Å; F544-V548 HydrophobicContact CD1-CG2 4Å; F544-V548 HydrophobicContact CD2-CG2 4.47Å; F544-V548 HydrophobicContact CE1-CG2 3.73Å; F544-V548 HydrophobicContact CE2-CG2 4.23Å; F544-V548 HydrophobicContact CG-CG2 4.37Å; F544-V548 HydrophobicContact CZ-CG2 3.86Å; F544-V548 VanDerWaalsContact O-CG2 3.28Å; F544-V548 WeakPolarHBondContact O-CG2 3.16Å; F544-V548 PolarHBondContact O-N 3.18Å; F544-P606 HydrophobicContact CE1-CB 4.1Å; F544-P606 WeakPolarHBondContact CE1-O 3.35Å; F544-P606 HydrophobicContact CE2-CB 4.13Å; F544-P606 HydrophobicContact CZ-CB 3.65Å; F544-P606 WeakPolarHBondContact CZ-O 3.49Å; F544-N609 HydrophobicContact CD1-CB 4.28Å; F544-N609 HydrophobicContact CE1-CB 4.07Å; F544-M610 HydrophobicContact CE1-CB 4.06Å; F544-M610 HydrophobicContact CE2-CE 4.32Å; F544-M610 HydrophobicContact CZ-CB 4.06Å; F544-M610 HydrophobicContact CZ-CE 3.91Å
545	K	90.3	Very high	88.7	Confident	105 Å²	105	55.2 Å²	55.2	46%	0.457	28%	0.28	S	S	.	.	H	α-helix	trans	-57.7	-47.4	173.9	-179.8	177.6	179.4	-178.5	0	111.9	L541 S543 F547 V548 L549 F613	L541-K545 VanDerWaalsContact O-CB 3.24Å; L541-K545 WeakPolarHBondContact O-CB 3.13Å; L541-K545 PolarHBondContact O-N 3.3Å; S543-K545 PolarHBondContact O-N 3.16Å; K545-F547 VanDerWaalsContact C-N 3.33Å; K545-F547 PolarHBondContact O-N 2.91Å; K545-V548 PolarHBondContact O-N 3.3Å; K545-L549 HydrophobicContact CG-CD1 3.98Å; K545-L549 WeakPolarHBondContact O-CB 3.22Å; K545-L549 VanDerWaalsContact O-CG 3.29Å; K545-L549 WeakPolarHBondContact O-CG 3.46Å; K545-L549 PolarHBondContact O-N 2.59Å; K545-L549 VanDerWaalsContact O-N 3.09Å; K545-F613 HydrophobicContact CB-CD2 4.46Å; K545-F613 HydrophobicContact CB-CE1 4.28Å; K545-F613 HydrophobicContact CB-CE2 3.74Å; K545-F613 HydrophobicContact CB-CZ 3.64Å; K545-F613 HydrophobicContact CD-CE1 3.76Å; K545-F613 HydrophobicContact CD-CZ 3.87Å; K545-F613 HydrophobicContact CG-CD1 4.19Å; K545-F613 HydrophobicContact CG-CD2 4.45Å; K545-F613 HydrophobicContact CG-CE1 3.71Å; K545-F613 HydrophobicContact CG-CE2 3.99Å; K545-F613 HydrophobicContact CG-CZ 3.61Å
546	K	89.2	Confident	88.5	Confident	149 Å²	149	54.3 Å²	54.3	65%	0.648	27%	0.267	S	S	*	.	H	α-helix	trans	-60.1	-44.9	177.6	-71.8	178.1	-178.5	178.7	0	111.2	T542 S543 F544 A550	T542-K546 WeakPolarHBondContact O-CG 3.42Å; T542-K546 PolarHBondContact O-N 3.22Å; S543-K546 PolarHBondContact O-N 3.28Å; F544-K546 PolarHBondContact O-N 3.44Å; K546-A550 WeakPolarHBondContact O-CB 2.93Å; K546-A550 PolarHBondContact O-N 2.88Å
547	F	89.5	Confident	88.2	Confident	21 Å²	21	57.4 Å²	57.4	9%	0.092	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-51.1	177.3	165.4	-100.7	0	0	0	112.3	C493 N494 S543 F544 K545 L549 A550 R551 M610	C493-F547 HydrophobicContact CB-CB 3.72Å; C493-F547 HydrophobicContact CB-CD1 4.1Å; C493-F547 HydrophobicContact CB-CD2 4.27Å; C493-F547 HydrophobicContact CB-CG 3.75Å; C493-F547 WeakPolarHBondContact O-CD1 3.39Å; C493-F547 WeakPolarHBondContact O-CE1 3.08Å; C493-F547 WeakPolarHBondContact O-CE2 3.41Å; C493-F547 WeakPolarHBondContact O-CZ 3.19Å; N494-F547 HydrophobicContact CB-CE2 4.47Å; N494-F547 WeakPolarHBondContact OD1-CD2 3.44Å; N494-F547 WeakPolarHBondContact OD1-CE2 3.45Å; S543-F547 PolarHBondContact O-N 3.37Å; F544-F547 HydrophobicContact CD2-CD1 4.48Å; F544-F547 PolarHBondContact O-N 2.74Å; K545-F547 VanDerWaalsContact C-N 3.33Å; K545-F547 PolarHBondContact O-N 2.91Å; F547-L549 VanDerWaalsContact C-N 3.32Å; F547-L549 PolarHBondContact O-N 2.81Å; F547-A550 PolarHBondContact O-N 2.88Å; F547-R551 WeakPolarHBondContact O-CB 3.22Å; F547-R551 PolarHBondContact O-N 2.98Å; F547-M610 HydrophobicContact CE1-CE 4.36Å
548	V	89.5	Confident	87.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-43.3	-177.5	174.6	0	0	0	0	110.9	F544 K545 R551 Y552 M610 F613 Y614	F544-V548 HydrophobicContact CD1-CG2 4Å; F544-V548 HydrophobicContact CD2-CG2 4.47Å; F544-V548 HydrophobicContact CE1-CG2 3.73Å; F544-V548 HydrophobicContact CE2-CG2 4.23Å; F544-V548 HydrophobicContact CG-CG2 4.37Å; F544-V548 HydrophobicContact CZ-CG2 3.86Å; F544-V548 VanDerWaalsContact O-CG2 3.28Å; F544-V548 WeakPolarHBondContact O-CG2 3.16Å; F544-V548 PolarHBondContact O-N 3.18Å; K545-V548 PolarHBondContact O-N 3.3Å; V548-R551 PolarHBondContact O-N 2.8Å; V548-Y552 WeakPolarHBondContact O-CB 2.97Å; V548-Y552 PolarHBondContact O-N 2.81Å; V548-M610 HydrophobicContact CG1-CG 4.02Å; V548-M610 HydrophobicContact CG2-CB 4.29Å; V548-M610 HydrophobicContact CG2-CE 4.03Å; V548-M610 HydrophobicContact CG2-CG 4.09Å; V548-F613 HydrophobicContact CB-CB 4.47Å; V548-F613 HydrophobicContact CB-CD2 4.18Å; V548-F613 HydrophobicContact CG1-CB 3.73Å; V548-F613 HydrophobicContact CG1-CD2 4.2Å; V548-F613 HydrophobicContact CG1-CG 4.44Å; V548-F613 HydrophobicContact CG2-CD2 4.43Å; V548-Y614 HydrophobicContact CG1-CD1 3.7Å; V548-Y614 HydrophobicContact CG1-CE1 3.43Å; V548-Y614 VanDerWaalsContact CG1-CE1 3.43Å; V548-Y614 HydrophobicContact CG1-CG 4.45Å
549	L	90.8	Very high	87.2	Confident	62 Å²	62	51.7 Å²	51.7	33%	0.325	27%	0.268	S	S	.	.	H	α-helix	trans	-66.4	-43	177.5	-67.1	175.1	0	0	0	112.2	K545 F547 R551 Y552 E553 S617	K545-L549 HydrophobicContact CG-CD1 3.98Å; K545-L549 WeakPolarHBondContact O-CB 3.22Å; K545-L549 VanDerWaalsContact O-CG 3.29Å; K545-L549 WeakPolarHBondContact O-CG 3.46Å; K545-L549 PolarHBondContact O-N 2.59Å; K545-L549 VanDerWaalsContact O-N 3.09Å; F547-L549 VanDerWaalsContact C-N 3.32Å; F547-L549 PolarHBondContact O-N 2.81Å; L549-R551 VanDerWaalsContact C-N 3.29Å; L549-R551 PolarHBondContact O-N 3.47Å; L549-Y552 PolarHBondContact O-N 3.2Å; L549-E553 PolarHBondContact O-N 2.99Å; L549-S617 WeakPolarHBondContact CD2-OG 3.49Å
550	A	88.2	Confident	86.2	Confident	63 Å²	63	54.4 Å²	54.4	52%	0.521	28%	0.282	S	S	.	.	H	α-helix	trans	-62.5	-38.3	175.3	0	0	0	0	0	111.9	K546 F547 E553 K554	K546-A550 WeakPolarHBondContact O-CB 2.93Å; K546-A550 PolarHBondContact O-N 2.88Å; F547-A550 PolarHBondContact O-N 2.88Å; A550-E553 PolarHBondContact O-N 3.5Å; A550-K554 WeakPolarHBondContact O-CB 3Å; A550-K554 PolarHBondContact O-N 3.24Å
551	R	86.8	Confident	84.7	Confident	42 Å²	42	57.7 Å²	57.7	16%	0.158	32%	0.316	C	S	.	.	H	α-helix	trans	-67.7	-41.2	176.8	-171.8	165.9	-178.3	96.2	1.3	112.1	F547 V548 L549 K554 H555 D586	F547-R551 WeakPolarHBondContact O-CB 3.22Å; F547-R551 PolarHBondContact O-N 2.98Å; V548-R551 PolarHBondContact O-N 2.8Å; L549-R551 VanDerWaalsContact C-N 3.29Å; L549-R551 PolarHBondContact O-N 3.47Å; R551-K554 PolarHBondContact O-N 2.94Å; R551-H555 PolarHBondContact O-CD2 2.88Å; R551-H555 PolarHBondContact O-N 3.13Å; R551-D586 WeakPolarHBondContact CD-OD2 3.38Å; R551-D586 IonicContact CZ-OD1 3.71Å; R551-D586 IonicContact CZ-OD2 3.1Å; R551-D586 VanDerWaalsContact NE-CG 3.27Å; R551-D586 IonicContact NE-OD1 3.61Å; R551-D586 PolarHBondContact NE-OD1 2.79Å; R551-D586 IonicContact NE-OD2 3.37Å; R551-D586 PolarHBondContact NE-OD2 3.15Å; R551-D586 IonicContact NH2-OD1 2.88Å; R551-D586 PolarHBondContact NH2-OD1 2.69Å; R551-D586 IonicContact NH2-OD2 4Å
552	Y	90.6	Very high	83	Confident	1 Å²	1	61.1 Å²	61.1	0%	0.004	33%	0.328	C	S	.	.	H	α-helix	trans	-57.9	-49.3	172.2	176	-90.6	0	0	0	111.4	V548 L549 K554 H555 K556 L579 L583 Y614 S617 L618 D621	V548-Y552 WeakPolarHBondContact O-CB 2.97Å; V548-Y552 PolarHBondContact O-N 2.81Å; L549-Y552 PolarHBondContact O-N 3.2Å; Y552-K554 VanDerWaalsContact C-N 3.34Å; Y552-K554 PolarHBondContact O-N 2.94Å; Y552-H555 PolarHBondContact O-N 3.25Å; Y552-K556 HydrophobicContact CE1-CD 4.07Å; Y552-K556 WeakPolarHBondContact O-CB 3.23Å; Y552-K556 PolarHBondContact O-N 3.03Å; Y552-L579 HydrophobicContact CE2-CD2 4.48Å; Y552-L583 HydrophobicContact CD2-CD1 4.11Å; Y552-L583 HydrophobicContact CD2-CD2 3.86Å; Y552-L583 HydrophobicContact CE2-CD1 3.99Å; Y552-Y614 AromaticContact CD2-CD1 3.97Å; Y552-Y614 HydrophobicContact CD2-CD1 3.97Å; Y552-Y614 HydrophobicContact CD2-CE1 4.42Å; Y552-Y614 HydrophobicContact CG-CD1 4.4Å; Y552-S617 PolarHBondContact OH-O 3.39Å; Y552-L618 HydrophobicContact CE2-CD2 4.15Å; Y552-L618 HydrophobicContact CE2-CG 4.13Å; Y552-D621 WeakPolarHBondContact CE1-OD2 3.5Å; Y552-D621 VanDerWaalsContact CZ-OD2 3.28Å; Y552-D621 PolarHBondContact OH-OD2 3.25Å
553	E	88.6	Confident	80.9	Confident	87 Å²	87	61.3 Å²	61.3	41%	0.407	33%	0.329	S	S	.	.	H	α-helix	trans	-63	-37.8	177.4	-72.5	-58.1	144	0	0	112.5	L549 A550 K556 T557	L549-E553 PolarHBondContact O-N 2.99Å; A550-E553 PolarHBondContact O-N 3.5Å; E553-K556 PolarHBondContact O-N 3Å; E553-T557 WeakPolarHBondContact O-CB 3.44Å; E553-T557 WeakPolarHBondContact O-CG2 3.34Å; E553-T557 PolarHBondContact O-N 3.28Å; E553-T557 PolarHBondContact O-OG1 3.18Å
554	K	85.7	Confident	78.9	Confident	108 Å²	108	67 Å²	67	47%	0.47	36%	0.356	S	S	.	.	H	α-helix	trans	-61.8	-46.2	173.5	-176.2	170.4	-178.7	162.7	0	111.5	A550 R551 Y552 T557 T558	A550-K554 WeakPolarHBondContact O-CB 3Å; A550-K554 PolarHBondContact O-N 3.24Å; R551-K554 PolarHBondContact O-N 2.94Å; Y552-K554 VanDerWaalsContact C-N 3.34Å; Y552-K554 PolarHBondContact O-N 2.94Å; K554-T557 WeakPolarHBondContact CA-OG1 3.37Å; K554-T557 PolarHBondContact O-OG1 2.76Å; K554-T558 VanDerWaalsContact O-CB 3.29Å; K554-T558 WeakPolarHBondContact O-CB 3.47Å; K554-T558 PolarHBondContact O-N 3.32Å; K554-T558 PolarHBondContact O-OG1 3.38Å
555	H	85.1	Confident	76.7	Confident	23 Å²	23	76.1 Å²	76.1	11%	0.106	40%	0.396	C	S	.	.	H	α-helix	trans	-63	-46.1	176.8	-72.4	-34.2	0	0	0	111.6	R551 Y552 T557 T558 V559 L579 L582 D586	R551-H555 PolarHBondContact O-CD2 2.88Å; R551-H555 PolarHBondContact O-N 3.13Å; Y552-H555 PolarHBondContact O-N 3.25Å; H555-T557 PolarHBondContact O-N 2.93Å; H555-T558 PolarHBondContact O-N 2.77Å; H555-V559 WeakPolarHBondContact O-CB 3.36Å; H555-V559 VanDerWaalsContact O-CG2 3.22Å; H555-V559 WeakPolarHBondContact O-CG2 3.41Å; H555-V559 PolarHBondContact O-N 3.15Å; H555-L579 HydrophobicContact CB-CD1 3.81Å; H555-L582 HydrophobicContact CB-CD1 4.17Å; H555-D586 IonicContact CD2-OD2 2.64Å; H555-D586 PolarHBondContact CD2-OD2 3.43Å; H555-D586 IonicContact CE1-OD2 3.25Å; H555-D586 IonicContact NE2-OD2 3.36Å; H555-D586 PolarHBondContact NE2-OD2 3.44Å
556	K	84.3	Confident	74.3	Confident	46 Å²	46	76.6 Å²	76.6	20%	0.2	41%	0.413	C	S	.	.	H	α-helix	trans	-57.2	-50.5	176.9	-176.7	-179	177.1	-176.2	0	111.8	Y552 E553 V559 M560 L579 D621	Y552-K556 HydrophobicContact CE1-CD 4.07Å; Y552-K556 WeakPolarHBondContact O-CB 3.23Å; Y552-K556 PolarHBondContact O-N 3.03Å; E553-K556 PolarHBondContact O-N 3Å; K556-V559 PolarHBondContact O-N 3.24Å; K556-M560 WeakPolarHBondContact O-CB 3.45Å; K556-M560 WeakPolarHBondContact O-CG 3.21Å; K556-M560 PolarHBondContact O-N 2.99Å; K556-L579 HydrophobicContact CB-CD1 4.44Å; K556-D621 WeakPolarHBondContact CE-OD2 3.25Å; K556-D621 IonicContact NZ-OD1 3.69Å; K556-D621 PolarHBondContact NZ-OD1 2.66Å; K556-D621 IonicContact NZ-OD2 3.18Å; K556-D621 PolarHBondContact NZ-OD2 3.17Å
557	T	81.7	Confident	72.3	Confident	83 Å²	83	76.6 Å²	76.6	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-65.4	-39	178.5	50.1	0	0	0	0	112.9	E553 K554 H555 V559 M560 G561	E553-T557 WeakPolarHBondContact O-CB 3.44Å; E553-T557 WeakPolarHBondContact O-CG2 3.34Å; E553-T557 PolarHBondContact O-N 3.28Å; E553-T557 PolarHBondContact O-OG1 3.18Å; K554-T557 WeakPolarHBondContact CA-OG1 3.37Å; K554-T557 PolarHBondContact O-OG1 2.76Å; H555-T557 PolarHBondContact O-N 2.93Å; T557-V559 VanDerWaalsContact C-N 3.27Å; T557-V559 PolarHBondContact O-N 3.46Å; T557-M560 PolarHBondContact O-N 3.32Å; T557-G561 PolarHBondContact O-N 3.08Å
558	T	78.1	Confident	70.6	Confident	75 Å²	75	80.7 Å²	80.7	46%	0.46	44%	0.437	S	S	.	.	H	α-helix	trans	-60.5	-38.2	175.9	-58.6	0	0	0	0	111.9	K554 H555	K554-T558 VanDerWaalsContact O-CB 3.29Å; K554-T558 WeakPolarHBondContact O-CB 3.47Å; K554-T558 PolarHBondContact O-N 3.32Å; K554-T558 PolarHBondContact O-OG1 3.38Å; H555-T558 PolarHBondContact O-N 2.77Å
559	V	77.7	Confident	69	Low	7 Å²	7	84.7 Å²	84.7	4%	0.042	46%	0.458	C	S	.	.	H	α-helix	trans	-74.2	-41.1	177.6	170.4	0	0	0	0	111.4	H555 K556 T557 Q575 L578 L579 L582	H555-V559 WeakPolarHBondContact O-CB 3.36Å; H555-V559 VanDerWaalsContact O-CG2 3.22Å; H555-V559 WeakPolarHBondContact O-CG2 3.41Å; H555-V559 PolarHBondContact O-N 3.15Å; K556-V559 PolarHBondContact O-N 3.24Å; T557-V559 VanDerWaalsContact C-N 3.27Å; T557-V559 PolarHBondContact O-N 3.46Å; V559-Q575 VanDerWaalsContact CG1-CA 3.42Å; V559-Q575 HydrophobicContact CG1-CB 3.42Å; V559-Q575 VanDerWaalsContact CG1-CB 3.42Å; V559-Q575 HydrophobicContact CG1-CG 3.68Å; V559-Q575 WeakPolarHBondContact CG1-O 3.33Å; V559-Q575 PolarHBondContact O-NE2 3.38Å; V559-L578 HydrophobicContact CG2-CB 4.29Å; V559-L578 HydrophobicContact CG2-CD2 3.93Å; V559-L578 HydrophobicContact CG2-CG 3.88Å; V559-L579 HydrophobicContact CG2-CB 4.46Å; V559-L582 HydrophobicContact CG2-CD1 4.02Å
560	M	68.6	Low	67.5	Low	95 Å²	95	83.5 Å²	83.5	47%	0.468	45%	0.451	S	S	.	.	H	α-helix	trans	-75.4	-26.6	-177.1	-68	-67.8	-67	0	0	113.8	K556 T557 K562 Q575	K556-M560 WeakPolarHBondContact O-CB 3.45Å; K556-M560 WeakPolarHBondContact O-CG 3.21Å; K556-M560 PolarHBondContact O-N 2.99Å; T557-M560 PolarHBondContact O-N 3.32Å; M560-K562 VanDerWaalsContact C-N 3.28Å; M560-K562 PolarHBondContact O-N 3.09Å; M560-Q575 PolarHBondContact SD-OE1 3.03Å
561	G	58.7	Low	66.5	Low	70 Å²	70	82.9 Å²	82.9	72%	0.722	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-1.2	-173.7	0	0	0	0	0	116.7	T557	T557-G561 PolarHBondContact O-N 3.08Å
562	K	52.2	Low	65.8	Low	136 Å²	136	84.6 Å²	84.6	59%	0.591	45%	0.448	S	S	*	.			trans	-106.2	86.8	-179.7	-65.9	-177.5	179.8	-179.3	0	110.2	M560	M560-K562 VanDerWaalsContact C-N 3.28Å; M560-K562 PolarHBondContact O-N 3.09Å
563	T	45.3	Very low	65	Low	76 Å²	76	84.6 Å²	84.6	47%	0.466	45%	0.448	S	S	.	.			trans	-163.9	140.1	166.8	27.6	0	0	0	0	121.9	L571	T563-L571 HydrophobicContact CG2-CD1 3.09Å; T563-L571 HydrophobicContact CG2-CD2 3.06Å; T563-L571 HydrophobicContact CG2-CG 3.53Å
564	D	45.8	Very low	64.2	Low	156 Å²	156	83 Å²	83	83%	0.834	45%	0.446	S	S	*	.			trans	-97.2	149.1	154.8	-93.3	-38.8	0	0	0	111.5	S566	D564-S566 PolarHBondContact O-N 3.26Å
565	K	43.9	Very low	64	Low	194 Å²	194	78.5 Å²	78.5	84%	0.843	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	10.4	-150	-73.4	-177.7	174.7	178.1	0	119.1
566	S	40.9	Very low	63.8	Low	115 Å²	115	77.6 Å²	77.6	80%	0.804	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-7.5	-166.9	58.8	0	0	0	0	118.2	D564	D564-S566 PolarHBondContact O-N 3.26Å
567	E	46.1	Very low	63.7	Low	149 Å²	149	76.1 Å²	76.1	70%	0.696	42%	0.417	S	S	*	.			trans	-132.3	59.7	179	-67.8	-172.1	169.4	0	0	112.5	I569 L571	E567-I569 PolarHBondContact O-N 3.01Å; E567-L571 WeakPolarHBondContact O-CB 3.44Å; E567-L571 PolarHBondContact O-N 3.11Å
568	L	53.9	Low	63.7	Low	106 Å²	106	73.9 Å²	73.9	56%	0.555	40%	0.402	S	S	*	.	H	α-helix	trans	-53.8	-41.2	-165.1	-143	79.9	0	0	0	115.3	E572	L568-E572 WeakPolarHBondContact O-CG 3.3Å; L568-E572 PolarHBondContact O-N 3.39Å
569	I	55.3	Low	64.1	Low	85 Å²	85	70.3 Å²	70.3	44%	0.436	38%	0.38	S	S	.	.	H	α-helix	trans	-78.9	-44.9	-171	-61	173.5	0	0	0	112.4	E567 L571 E572 I573 I635	E567-I569 PolarHBondContact O-N 3.01Å; I569-L571 PolarHBondContact O-N 3.17Å; I569-E572 PolarHBondContact O-N 3.31Å; I569-I573 PolarHBondContact O-N 2.95Å; I569-I635 HydrophobicContact CG2-CD1 3.74Å; I569-I635 HydrophobicContact CG2-CG1 4.17Å
570	H	60.1	Low	64.5	Low	37 Å²	37	70 Å²	70	17%	0.171	38%	0.378	C	S	.	.	H	α-helix	trans	-64.8	-35.2	-178.6	-143.1	-58.4	0	0	0	111.4	S574 I657 E658 S661	H570-S574 VanDerWaalsContact O-CB 3.32Å; H570-S574 WeakPolarHBondContact O-CB 3.36Å; H570-S574 PolarHBondContact O-N 3.26Å; H570-S574 PolarHBondContact O-OG 3.12Å; H570-I657 VanDerWaalsContact CE1-CG2 3.48Å; H570-I657 WeakPolarHBondContact CE1-CG2 3.28Å; H570-I657 VanDerWaalsContact NE2-CG2 3.34Å; H570-I657 WeakPolarHBondContact NE2-CG2 3.48Å; H570-E658 WeakPolarHBondContact CD2-CG 3.42Å; H570-E658 IonicContact CD2-OE1 2.76Å; H570-E658 WeakPolarHBondContact NE2-CG 3.18Å; H570-E658 PolarHBondContact NE2-N 3.48Å; H570-S661 PolarHBondContact CE1-OG 3.12Å
571	L	67.2	Low	65.3	Low	50 Å²	50	66.6 Å²	66.6	26%	0.262	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-49.9	174.5	177.9	79.5	0	0	0	112.2	T563 E567 I569 I573 S574 Q575	T563-L571 HydrophobicContact CG2-CD1 3.09Å; T563-L571 HydrophobicContact CG2-CD2 3.06Å; T563-L571 HydrophobicContact CG2-CG 3.53Å; E567-L571 WeakPolarHBondContact O-CB 3.44Å; E567-L571 PolarHBondContact O-N 3.11Å; I569-L571 PolarHBondContact O-N 3.17Å; L571-I573 VanDerWaalsContact C-N 3.29Å; L571-I573 PolarHBondContact O-N 3.45Å; L571-S574 PolarHBondContact O-N 3.43Å; L571-S574 VanDerWaalsContact O-N 3.13Å; L571-Q575 HydrophobicContact CD1-CG 4.39Å; L571-Q575 HydrophobicContact CG-CG 4.25Å; L571-Q575 WeakPolarHBondContact O-CB 3.45Å; L571-Q575 VanDerWaalsContact O-CG 3.25Å; L571-Q575 WeakPolarHBondContact O-CG 3.43Å; L571-Q575 PolarHBondContact O-N 2.9Å
572	E	72.2	Confident	66.5	Low	78 Å²	78	64.7 Å²	64.7	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-39.7	-177.7	-75.1	173	157.5	0	0	111.6	L568 I569 L576 L631	L568-E572 WeakPolarHBondContact O-CG 3.3Å; L568-E572 PolarHBondContact O-N 3.39Å; I569-E572 PolarHBondContact O-N 3.31Å; E572-L576 PolarHBondContact O-N 3.49Å; E572-L631 HydrophobicContact CB-CD1 4.35Å; E572-L631 HydrophobicContact CB-CD2 3.73Å; E572-L631 WeakPolarHBondContact OE2-CD2 3.08Å
573	I	73.5	Confident	68.3	Low	1 Å²	1	58.2 Å²	58.2	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-66.1	-45.9	174.1	-66.3	171.3	0	0	0	110.9	I569 L571 Q575 L576 I577 I635 L662 L665	I569-I573 PolarHBondContact O-N 2.95Å; L571-I573 VanDerWaalsContact C-N 3.29Å; L571-I573 PolarHBondContact O-N 3.45Å; I573-Q575 VanDerWaalsContact C-N 3.29Å; I573-Q575 PolarHBondContact O-N 3.42Å; I573-L576 PolarHBondContact O-N 2.92Å; I573-I577 HydrophobicContact CG2-CD1 3.87Å; I573-I577 HydrophobicContact CG2-CG1 4.42Å; I573-I577 WeakPolarHBondContact O-CB 3.47Å; I573-I577 VanDerWaalsContact O-CG1 3.3Å; I573-I577 WeakPolarHBondContact O-CG1 3.45Å; I573-I577 PolarHBondContact O-N 3.42Å; I573-I635 HydrophobicContact CD1-CD1 3.28Å; I573-L662 HydrophobicContact CD1-CD2 3.73Å; I573-L662 HydrophobicContact CD1-CG 4.27Å; I573-L662 HydrophobicContact CG1-CD2 4.42Å; I573-L662 HydrophobicContact CG2-CD2 4.48Å; I573-L665 HydrophobicContact CG2-CD2 4.41Å
574	S	73	Confident	70.2	Confident	52 Å²	52	54.9 Å²	54.9	36%	0.364	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-37.4	179.4	-62.8	0	0	0	0	112.1	H570 L571 L578	H570-S574 VanDerWaalsContact O-CB 3.32Å; H570-S574 WeakPolarHBondContact O-CB 3.36Å; H570-S574 PolarHBondContact O-N 3.26Å; H570-S574 PolarHBondContact O-OG 3.12Å; L571-S574 PolarHBondContact O-N 3.43Å; L571-S574 VanDerWaalsContact O-N 3.13Å; S574-L578 WeakPolarHBondContact O-CB 3.29Å; S574-L578 PolarHBondContact O-N 3.38Å
575	Q	79.9	Confident	72	Confident	14 Å²	14	50.2 Å²	50.2	7%	0.065	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-49.5	173.1	-78	175.7	-20.3	0	0	110.8	V559 M560 L571 I573 I577 L578 L579	V559-Q575 VanDerWaalsContact CG1-CA 3.42Å; V559-Q575 HydrophobicContact CG1-CB 3.42Å; V559-Q575 VanDerWaalsContact CG1-CB 3.42Å; V559-Q575 HydrophobicContact CG1-CG 3.68Å; V559-Q575 WeakPolarHBondContact CG1-O 3.33Å; V559-Q575 PolarHBondContact O-NE2 3.38Å; M560-Q575 PolarHBondContact SD-OE1 3.03Å; L571-Q575 HydrophobicContact CD1-CG 4.39Å; L571-Q575 HydrophobicContact CG-CG 4.25Å; L571-Q575 WeakPolarHBondContact O-CB 3.45Å; L571-Q575 VanDerWaalsContact O-CG 3.25Å; L571-Q575 WeakPolarHBondContact O-CG 3.43Å; L571-Q575 PolarHBondContact O-N 2.9Å; I573-Q575 VanDerWaalsContact C-N 3.29Å; I573-Q575 PolarHBondContact O-N 3.42Å; Q575-I577 VanDerWaalsContact C-N 3.35Å; Q575-I577 PolarHBondContact O-N 2.87Å; Q575-L578 PolarHBondContact O-N 3.46Å; Q575-L578 VanDerWaalsContact O-N 3.12Å; Q575-L579 PolarHBondContact O-N 2.89Å
576	L	82.5	Confident	74	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-41.6	177.9	-178.7	58.8	0	0	0	112.5	E572 I573 L578 L579 I580 Y622 L628 L665	E572-L576 PolarHBondContact O-N 3.49Å; I573-L576 PolarHBondContact O-N 2.92Å; L576-L578 VanDerWaalsContact C-N 3.3Å; L576-L578 PolarHBondContact O-N 3.39Å; L576-L579 PolarHBondContact O-N 3.3Å; L576-I580 HydrophobicContact CD1-CD1 3.89Å; L576-I580 HydrophobicContact CD1-CG1 4.12Å; L576-I580 HydrophobicContact CG-CD1 3.86Å; L576-I580 WeakPolarHBondContact O-CG1 3.47Å; L576-I580 PolarHBondContact O-N 2.99Å; L576-Y622 HydrophobicContact CD1-CD1 3.79Å; L576-Y622 HydrophobicContact CD1-CD2 3.98Å; L576-Y622 HydrophobicContact CD1-CE1 3.84Å; L576-Y622 HydrophobicContact CD1-CE2 4.04Å; L576-Y622 HydrophobicContact CD1-CG 3.85Å; L576-Y622 HydrophobicContact CD2-CD1 4.25Å; L576-L628 HydrophobicContact CD2-CD1 3.68Å; L576-L665 HydrophobicContact CD2-CD1 3.91Å; L576-L665 HydrophobicContact CD2-CD2 4.04Å; L576-L665 HydrophobicContact CG-CD1 3.9Å
577	I	80.5	Confident	76.2	Confident	16 Å²	16	35.9 Å²	35.9	8%	0.082	18%	0.183	C	C	.	.	H	α-helix	trans	-55.9	-46.5	172.9	-74.5	169.1	0	0	0	110.6	I573 Q575 K581 S661 V664 L665 L668	I573-I577 HydrophobicContact CG2-CD1 3.87Å; I573-I577 HydrophobicContact CG2-CG1 4.42Å; I573-I577 WeakPolarHBondContact O-CB 3.47Å; I573-I577 VanDerWaalsContact O-CG1 3.3Å; I573-I577 WeakPolarHBondContact O-CG1 3.45Å; I573-I577 PolarHBondContact O-N 3.42Å; Q575-I577 VanDerWaalsContact C-N 3.35Å; Q575-I577 PolarHBondContact O-N 2.87Å; I577-K581 HydrophobicContact CG2-CD 4.35Å; I577-K581 WeakPolarHBondContact O-CG 3.44Å; I577-K581 PolarHBondContact O-N 2.86Å; I577-S661 WeakPolarHBondContact CD1-O 3.43Å; I577-V664 HydrophobicContact CD1-CB 4.33Å; I577-V664 HydrophobicContact CD1-CG1 4.21Å; I577-V664 HydrophobicContact CG1-CG1 4.49Å; I577-V664 HydrophobicContact CG2-CG1 4.1Å; I577-L665 HydrophobicContact CD1-CB 4.34Å; I577-L665 HydrophobicContact CG1-CB 3.96Å; I577-L665 HydrophobicContact CG1-CD1 4.15Å; I577-L668 HydrophobicContact CB-CD1 4.3Å; I577-L668 HydrophobicContact CG1-CD1 4.45Å; I577-L668 HydrophobicContact CG2-CD1 3.7Å
578	L	82.7	Confident	77.9	Confident	35 Å²	35	31.9 Å²	31.9	18%	0.183	16%	0.164	C	C	.	.	H	α-helix	trans	-66.6	-41.9	-179.8	-177.7	58.2	0	0	0	111.9	L26 V559 S574 Q575 L576 K581 L582	L26-L578 HydrophobicContact CD1-CD1 3.58Å; L26-L578 HydrophobicContact CD2-CD1 3.97Å; L26-L578 HydrophobicContact CG-CD1 4.44Å; V559-L578 HydrophobicContact CG2-CB 4.29Å; V559-L578 HydrophobicContact CG2-CD2 3.93Å; V559-L578 HydrophobicContact CG2-CG 3.88Å; S574-L578 WeakPolarHBondContact O-CB 3.29Å; S574-L578 PolarHBondContact O-N 3.38Å; Q575-L578 PolarHBondContact O-N 3.46Å; Q575-L578 VanDerWaalsContact O-N 3.12Å; L576-L578 VanDerWaalsContact C-N 3.3Å; L576-L578 PolarHBondContact O-N 3.39Å; L578-K581 PolarHBondContact O-N 3.22Å; L578-L582 HydrophobicContact CG-CD1 4.47Å; L578-L582 WeakPolarHBondContact O-CG 3.34Å; L578-L582 PolarHBondContact O-N 3.13Å
579	L	87.2	Confident	79.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.6	-53	175.7	177.7	60.9	0	0	0	110.9	Y552 H555 K556 V559 Q575 L576 K581 L582 L583 L618 Y622	Y552-L579 HydrophobicContact CE2-CD2 4.48Å; H555-L579 HydrophobicContact CB-CD1 3.81Å; K556-L579 HydrophobicContact CB-CD1 4.44Å; V559-L579 HydrophobicContact CG2-CB 4.46Å; Q575-L579 PolarHBondContact O-N 2.89Å; L576-L579 PolarHBondContact O-N 3.3Å; L579-K581 VanDerWaalsContact C-N 3.27Å; L579-K581 PolarHBondContact O-N 2.68Å; L579-L582 WeakPolarHBondContact O-CB 3.37Å; L579-L582 PolarHBondContact O-N 2.87Å; L579-L582 VanDerWaalsContact O-N 3.09Å; L579-L583 HydrophobicContact CD1-CD1 4.45Å; L579-L583 HydrophobicContact CD1-CG 4.41Å; L579-L583 HydrophobicContact CG-CD1 4.28Å; L579-L583 WeakPolarHBondContact O-CG 3.29Å; L579-L583 PolarHBondContact O-N 2.89Å; L579-L618 HydrophobicContact CD2-CD2 4.25Å; L579-Y622 HydrophobicContact CD2-CE2 3.49Å; L579-Y622 VanDerWaalsContact CD2-CE2 3.49Å
580	I	86	Confident	80.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.8	-39	-178.9	-64.4	162.8	0	0	0	110.9	L576 L582 L583 I584 L618 L665 L668 L669 F672	L576-I580 HydrophobicContact CD1-CD1 3.89Å; L576-I580 HydrophobicContact CD1-CG1 4.12Å; L576-I580 HydrophobicContact CG-CD1 3.86Å; L576-I580 WeakPolarHBondContact O-CG1 3.47Å; L576-I580 PolarHBondContact O-N 2.99Å; I580-L582 PolarHBondContact O-N 3.38Å; I580-L583 PolarHBondContact O-N 2.86Å; I580-I584 HydrophobicContact CG2-CD1 3.9Å; I580-I584 HydrophobicContact CG2-CG1 4.34Å; I580-I584 WeakPolarHBondContact O-CG1 3.34Å; I580-I584 PolarHBondContact O-N 3.28Å; I580-L618 HydrophobicContact CG1-CD2 4.42Å; I580-L665 HydrophobicContact CD1-CD1 3.48Å; I580-L665 VanDerWaalsContact CD1-CD1 3.48Å; I580-L668 HydrophobicContact CG2-CB 3.9Å; I580-L669 HydrophobicContact CD1-CD2 3.57Å; I580-L669 HydrophobicContact CD1-CG 3.94Å; I580-F672 HydrophobicContact CG2-CB 4.45Å
581	K	83.4	Confident	81.7	Confident	25 Å²	25	24.8 Å²	24.8	11%	0.109	13%	0.127	C	C	.	.	H	α-helix	trans	-58.3	-47.3	173.8	-78.5	179.7	175.8	-172.3	0	112.3	I577 L578 L579 L583 I584 I585 L668	I577-K581 HydrophobicContact CG2-CD 4.35Å; I577-K581 WeakPolarHBondContact O-CG 3.44Å; I577-K581 PolarHBondContact O-N 2.86Å; L578-K581 PolarHBondContact O-N 3.22Å; L579-K581 VanDerWaalsContact C-N 3.27Å; L579-K581 PolarHBondContact O-N 2.68Å; K581-L583 VanDerWaalsContact C-N 3.28Å; K581-L583 PolarHBondContact O-N 2.88Å; K581-I584 PolarHBondContact O-N 3.4Å; K581-I585 VanDerWaalsContact O-CG1 3.31Å; K581-I585 WeakPolarHBondContact O-CG1 3.34Å; K581-I585 PolarHBondContact O-N 3.49Å; K581-L668 HydrophobicContact CD-CD1 4.39Å; K581-L668 HydrophobicContact CG-CD1 3.81Å; K581-L668 HydrophobicContact CG-CD2 3.82Å
582	L	85.3	Confident	82.3	Confident	30 Å²	30	29.6 Å²	29.6	16%	0.157	15%	0.148	C	C	.	.	H	α-helix	trans	-60.7	-39.1	178.1	-70.1	170.4	0	0	0	111.7	L26 H555 V559 L578 L579 I580 I585 D586	L26-L582 HydrophobicContact CD2-CD2 4.34Å; H555-L582 HydrophobicContact CB-CD1 4.17Å; V559-L582 HydrophobicContact CG2-CD1 4.02Å; L578-L582 HydrophobicContact CG-CD1 4.47Å; L578-L582 WeakPolarHBondContact O-CG 3.34Å; L578-L582 PolarHBondContact O-N 3.13Å; L579-L582 WeakPolarHBondContact O-CB 3.37Å; L579-L582 PolarHBondContact O-N 2.87Å; L579-L582 VanDerWaalsContact O-N 3.09Å; I580-L582 PolarHBondContact O-N 3.38Å; L582-I585 PolarHBondContact O-N 2.97Å; L582-D586 PolarHBondContact O-N 3.05Å; L582-D586 VanDerWaalsContact O-N 3.07Å
583	L	89.6	Confident	82.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.1	-41.7	176.7	-59.3	176.7	0	0	0	112.4	Y552 L579 I580 K581 D586 L587 Y614 L618 F672	Y552-L583 HydrophobicContact CD2-CD1 4.11Å; Y552-L583 HydrophobicContact CD2-CD2 3.86Å; Y552-L583 HydrophobicContact CE2-CD1 3.99Å; L579-L583 HydrophobicContact CD1-CD1 4.45Å; L579-L583 HydrophobicContact CD1-CG 4.41Å; L579-L583 HydrophobicContact CG-CD1 4.28Å; L579-L583 WeakPolarHBondContact O-CG 3.29Å; L579-L583 PolarHBondContact O-N 2.89Å; I580-L583 PolarHBondContact O-N 2.86Å; K581-L583 VanDerWaalsContact C-N 3.28Å; K581-L583 PolarHBondContact O-N 2.88Å; L583-D586 PolarHBondContact O-N 3.21Å; L583-L587 WeakPolarHBondContact O-CB 3.14Å; L583-L587 VanDerWaalsContact O-CG 3.31Å; L583-L587 WeakPolarHBondContact O-CG 3.13Å; L583-L587 PolarHBondContact O-N 2.82Å; L583-Y614 HydrophobicContact CB-CD2 4.18Å; L583-Y614 HydrophobicContact CB-CE2 4.43Å; L583-Y614 HydrophobicContact CD2-CD1 3.83Å; L583-Y614 HydrophobicContact CD2-CD2 3.91Å; L583-Y614 HydrophobicContact CD2-CE1 3.75Å; L583-Y614 HydrophobicContact CD2-CE2 3.85Å; L583-Y614 HydrophobicContact CD2-CG 3.91Å; L583-L618 HydrophobicContact CD1-CD1 3.69Å; L583-L618 HydrophobicContact CD1-CD2 3.85Å; L583-L618 HydrophobicContact CD1-CG 3.81Å; L583-F672 HydrophobicContact CB-CE2 4.18Å
584	I	85.6	Confident	83	Confident	6 Å²	6	27.2 Å²	27.2	3%	0.031	14%	0.139	C	C	.	.	H	α-helix	trans	-61.3	-44.7	175.6	-70.8	171.1	0	0	0	110.5	I580 K581 D586 L587 E588 L668 K671 F672 M675	I580-I584 HydrophobicContact CG2-CD1 3.9Å; I580-I584 HydrophobicContact CG2-CG1 4.34Å; I580-I584 WeakPolarHBondContact O-CG1 3.34Å; I580-I584 PolarHBondContact O-N 3.28Å; K581-I584 PolarHBondContact O-N 3.4Å; I584-D586 VanDerWaalsContact C-N 3.35Å; I584-D586 PolarHBondContact O-N 2.85Å; I584-L587 PolarHBondContact O-N 3.45Å; I584-E588 HydrophobicContact CG2-CG 4.23Å; I584-E588 WeakPolarHBondContact O-CB 3.11Å; I584-E588 WeakPolarHBondContact O-CG 3.43Å; I584-E588 PolarHBondContact O-N 3.02Å; I584-L668 HydrophobicContact CD1-CD2 4.02Å; I584-K671 HydrophobicContact CD1-CB 4.36Å; I584-K671 HydrophobicContact CD1-CD 4.26Å; I584-K671 HydrophobicContact CD1-CG 4.29Å; I584-K671 HydrophobicContact CG2-CD 4.34Å; I584-F672 HydrophobicContact CD1-CB 4.28Å; I584-F672 HydrophobicContact CG1-CB 4.27Å; I584-F672 HydrophobicContact CG1-CD2 4.01Å; I584-M675 HydrophobicContact CB-SD 4.41Å; I584-M675 HydrophobicContact CG1-SD 4.22Å; I584-M675 HydrophobicContact CG2-SD 4.01Å
585	I	83.8	Confident	83.6	Confident	58 Å²	58	25 Å²	25	30%	0.297	12%	0.123	S	C	.	.	H	α-helix	trans	-60.4	-44.9	178.4	-68.9	165.2	0	0	0	111	K581 L582 L587 E588 K589	K581-I585 VanDerWaalsContact O-CG1 3.31Å; K581-I585 WeakPolarHBondContact O-CG1 3.34Å; K581-I585 PolarHBondContact O-N 3.49Å; L582-I585 PolarHBondContact O-N 2.97Å; I585-L587 VanDerWaalsContact C-N 3.34Å; I585-L587 PolarHBondContact O-N 3Å; I585-E588 PolarHBondContact O-N 3.19Å; I585-K589 WeakPolarHBondContact O-CB 3.18Å; I585-K589 PolarHBondContact O-N 3.12Å
586	D	84.9	Confident	83.8	Confident	7 Å²	7	27.8 Å²	27.8	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-42.9	177.2	-81.2	-18	0	0	0	111.9	R551 H555 L582 L583 I584 C590 M610 Y614	R551-D586 WeakPolarHBondContact CD-OD2 3.38Å; R551-D586 IonicContact CZ-OD1 3.71Å; R551-D586 IonicContact CZ-OD2 3.1Å; R551-D586 VanDerWaalsContact NE-CG 3.27Å; R551-D586 IonicContact NE-OD1 3.61Å; R551-D586 PolarHBondContact NE-OD1 2.79Å; R551-D586 IonicContact NE-OD2 3.37Å; R551-D586 PolarHBondContact NE-OD2 3.15Å; R551-D586 IonicContact NH2-OD1 2.88Å; R551-D586 PolarHBondContact NH2-OD1 2.69Å; R551-D586 IonicContact NH2-OD2 4Å; H555-D586 IonicContact CD2-OD2 2.64Å; H555-D586 PolarHBondContact CD2-OD2 3.43Å; H555-D586 IonicContact CE1-OD2 3.25Å; H555-D586 IonicContact NE2-OD2 3.36Å; H555-D586 PolarHBondContact NE2-OD2 3.44Å; L582-D586 PolarHBondContact O-N 3.05Å; L582-D586 VanDerWaalsContact O-N 3.07Å; L583-D586 PolarHBondContact O-N 3.21Å; I584-D586 VanDerWaalsContact C-N 3.35Å; I584-D586 PolarHBondContact O-N 2.85Å; D586-C590 VanDerWaalsContact O-CB 3.28Å; D586-C590 WeakPolarHBondContact O-CB 3.33Å; D586-C590 PolarHBondContact O-N 3.14Å; D586-M610 HydrophobicContact CB-SD 4.47Å; D586-Y614 HydrophobicContact CB-CE2 4.13Å; D586-Y614 PolarHBondContact OD2-OH 3.45Å
587	L	86.6	Confident	83.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-45	177.5	-75.9	171.2	0	0	0	112.2	L583 I584 I585 K589 C590 C591 F607 M610 Y611 Y614 F672 M675	L583-L587 WeakPolarHBondContact O-CB 3.14Å; L583-L587 VanDerWaalsContact O-CG 3.31Å; L583-L587 WeakPolarHBondContact O-CG 3.13Å; L583-L587 PolarHBondContact O-N 2.82Å; I584-L587 PolarHBondContact O-N 3.45Å; I585-L587 VanDerWaalsContact C-N 3.34Å; I585-L587 PolarHBondContact O-N 3Å; L587-K589 PolarHBondContact O-N 3.35Å; L587-C590 WeakPolarHBondContact O-CB 3.43Å; L587-C590 PolarHBondContact O-N 2.96Å; L587-C591 WeakPolarHBondContact O-CB 3.1Å; L587-C591 PolarHBondContact O-N 2.88Å; L587-F607 HydrophobicContact CB-CD2 4.5Å; L587-F607 HydrophobicContact CB-CE2 4.1Å; L587-F607 HydrophobicContact CD2-CD2 4.11Å; L587-F607 HydrophobicContact CD2-CE2 4.09Å; L587-M610 HydrophobicContact CD2-CB 4.05Å; L587-M610 HydrophobicContact CD2-CG 3.76Å; L587-M610 HydrophobicContact CD2-SD 3.98Å; L587-Y611 HydrophobicContact CD1-CD2 4.01Å; L587-Y614 HydrophobicContact CD1-CD2 4.25Å; L587-Y614 HydrophobicContact CD2-CD2 4.18Å; L587-Y614 HydrophobicContact CG-CD2 4Å; L587-Y614 HydrophobicContact CG-CE2 4.28Å; L587-F672 HydrophobicContact CD1-CD2 3.95Å; L587-F672 HydrophobicContact CD1-CE2 3.45Å; L587-F672 VanDerWaalsContact CD1-CE2 3.45Å; L587-F672 HydrophobicContact CD1-CZ 4.21Å; L587-M675 HydrophobicContact CB-CE 3.58Å; L587-M675 HydrophobicContact CB-SD 4.17Å; L587-M675 HydrophobicContact CD1-SD 4.22Å
588	E	83.9	Confident	84.2	Confident	66 Å²	66	27.8 Å²	27.8	31%	0.308	14%	0.143	S	C	.	.	H	α-helix	trans	-58.5	-47.6	176.7	-75	174.8	167.9	0	0	110.5	I584 I585 C590 C591 E592 K671 M675	I584-E588 HydrophobicContact CG2-CG 4.23Å; I584-E588 WeakPolarHBondContact O-CB 3.11Å; I584-E588 WeakPolarHBondContact O-CG 3.43Å; I584-E588 PolarHBondContact O-N 3.02Å; I585-E588 PolarHBondContact O-N 3.19Å; E588-C590 PolarHBondContact O-N 3.31Å; E588-C591 WeakPolarHBondContact O-CB 3.36Å; E588-C591 PolarHBondContact O-N 3.39Å; E588-E592 WeakPolarHBondContact O-CG 3.5Å; E588-E592 PolarHBondContact O-N 3.21Å; E588-K671 VanDerWaalsContact OE1-CE 3.22Å; E588-K671 WeakPolarHBondContact OE1-CE 3.33Å; E588-K671 IonicContact OE1-NZ 2.89Å; E588-K671 PolarHBondContact OE1-NZ 2.95Å; E588-M675 HydrophobicContact CB-CE 4.48Å; E588-M675 HydrophobicContact CG-CE 3.6Å
589	K	80.9	Confident	84.4	Confident	60 Å²	60	31.1 Å²	31.1	26%	0.261	16%	0.156	S	C	.	.	H	α-helix	trans	-65.6	-40.7	178.5	-170.7	166.1	175.5	-158.6	0	113	N496 I585 L587 C591 V593 Y594	N496-K589 WeakPolarHBondContact OD1-CD 2.99Å; N496-K589 WeakPolarHBondContact OD1-CE 3.17Å; N496-K589 PolarHBondContact OD1-NZ 2.97Å; I585-K589 WeakPolarHBondContact O-CB 3.18Å; I585-K589 PolarHBondContact O-N 3.12Å; L587-K589 PolarHBondContact O-N 3.35Å; K589-C591 VanDerWaalsContact C-N 3.3Å; K589-C591 PolarHBondContact O-N 3.3Å; K589-V593 PolarHBondContact O-N 3.13Å; K589-Y594 HydrophobicContact CG-CE2 4.25Å
590	C	84.1	Confident	84.3	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.187	C	C	.	.	I	π-helix	trans	-59.3	-44.1	172.7	-170.4	0	0	0	0	111.3	Y495 D586 L587 E588 Y594 S595 M610	Y495-C590 WeakPolarHBondContact OH-CA 3.47Å; Y495-C590 WeakPolarHBondContact OH-CB 3.3Å; Y495-C590 PolarHBondContact OH-SG 3.39Å; D586-C590 VanDerWaalsContact O-CB 3.28Å; D586-C590 WeakPolarHBondContact O-CB 3.33Å; D586-C590 PolarHBondContact O-N 3.14Å; L587-C590 WeakPolarHBondContact O-CB 3.43Å; L587-C590 PolarHBondContact O-N 2.96Å; E588-C590 PolarHBondContact O-N 3.31Å; C590-Y594 PolarHBondContact O-N 2.75Å; C590-S595 VanDerWaalsContact O-CB 3.26Å; C590-S595 WeakPolarHBondContact O-CB 3.25Å; C590-S595 PolarHBondContact O-N 2.73Å; C590-M610 HydrophobicContact CB-CE 4.3Å; C590-M610 HydrophobicContact CB-SD 3.87Å
591	C	82.8	Confident	84.3	Confident	19 Å²	19	41.2 Å²	41.2	13%	0.128	20%	0.198	C	C	.	.	I	π-helix	trans	-67.5	-44.9	-175.2	-176.7	0	0	0	0	113	L587 E588 K589 F607 K679	L587-C591 WeakPolarHBondContact O-CB 3.1Å; L587-C591 PolarHBondContact O-N 2.88Å; E588-C591 WeakPolarHBondContact O-CB 3.36Å; E588-C591 PolarHBondContact O-N 3.39Å; K589-C591 VanDerWaalsContact C-N 3.3Å; K589-C591 PolarHBondContact O-N 3.3Å; C591-F607 HydrophobicContact CB-CD2 3.54Å; C591-F607 HydrophobicContact CB-CE2 3.89Å; C591-F607 HydrophobicContact CB-CG 4.17Å; C591-K679 PolarHBondContact O-NZ 3.41Å; C591-K679 VanDerWaalsContact SG-CD 3.58Å; C591-K679 WeakPolarHBondContact SG-CE 3.46Å; C591-K679 PolarHBondContact SG-NZ 3.1Å
592	E	80	Confident	84.4	Confident	150 Å²	150	40.4 Å²	40.4	70%	0.701	20%	0.195	S	C	*	.	I	π-helix	trans	-83.5	-40.7	-172.8	-69.5	-177.5	170	0	0	113	E588	E588-E592 WeakPolarHBondContact O-CG 3.5Å; E588-E592 PolarHBondContact O-N 3.21Å
593	V	79	Confident	84.4	Confident	29 Å²	29	45 Å²	45	18%	0.176	22%	0.22	C	C	.	.	I	π-helix	trans	-101.6	-51.6	-169.3	-177	0	0	0	0	112.2	A502 V507 K589 I597	A502-V593 HydrophobicContact CB-CG1 4.5Å; A502-V593 HydrophobicContact CB-CG2 4.07Å; V507-V593 HydrophobicContact CG2-CG1 4.24Å; K589-V593 PolarHBondContact O-N 3.13Å; V593-I597 WeakPolarHBondContact O-CD1 3.06Å
594	Y	81.9	Confident	84.3	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	23%	0.229	C	C	.	.	I	π-helix	trans	-98.6	-31.7	-164.1	-61.9	-79.1	0	0	0	114.3	Y495 F499 F510 K589 C590 I597 I598	Y495-Y594 HydrophobicContact CD1-CG 4.39Å; Y495-Y594 AromaticContact CD2-CD1 3.98Å; Y495-Y594 HydrophobicContact CD2-CD1 3.98Å; Y495-Y594 AromaticContact CD2-CD2 3.19Å; Y495-Y594 HydrophobicContact CD2-CD2 3.19Å; Y495-Y594 AromaticContact CD2-CE1 3.83Å; Y495-Y594 HydrophobicContact CD2-CE1 3.83Å; Y495-Y594 AromaticContact CD2-CE2 3.03Å; Y495-Y594 HydrophobicContact CD2-CE2 3.03Å; Y495-Y594 AromaticContact CD2-CG 3.67Å; Y495-Y594 HydrophobicContact CD2-CG 3.67Å; Y495-Y594 AromaticContact CD2-CZ 3.35Å; Y495-Y594 AromaticContact CE2-CD2 3.16Å; Y495-Y594 HydrophobicContact CE2-CD2 3.16Å; Y495-Y594 AromaticContact CE2-CE2 3.35Å; Y495-Y594 HydrophobicContact CE2-CE2 3.35Å; Y495-Y594 AromaticContact CE2-CG 3.86Å; Y495-Y594 HydrophobicContact CE2-CG 3.86Å; Y495-Y594 AromaticContact CG-CD1 3.96Å; Y495-Y594 HydrophobicContact CG-CD1 3.96Å; Y495-Y594 AromaticContact CG-CD2 3.95Å; Y495-Y594 HydrophobicContact CG-CD2 3.95Å; Y495-Y594 AromaticContact CG-CE1 3.96Å; Y495-Y594 HydrophobicContact CG-CE1 3.96Å; Y495-Y594 AromaticContact CG-CE2 3.98Å; Y495-Y594 HydrophobicContact CG-CE2 3.98Å; Y495-Y594 AromaticContact CG-CG 3.93Å; Y495-Y594 HydrophobicContact CG-CG 3.93Å; Y495-Y594 AromaticContact CG-CZ 3.95Å; Y495-Y594 AromaticContact CZ-CD2 3.93Å; F499-Y594 PolarHBondContact O-OH 3.01Å; F510-Y594 HydrophobicContact CD1-CD1 4.23Å; F510-Y594 HydrophobicContact CD2-CD1 4.39Å; F510-Y594 HydrophobicContact CD2-CE1 4.27Å; F510-Y594 AromaticContact CE1-CD1 3.91Å; F510-Y594 HydrophobicContact CE1-CD1 3.91Å; F510-Y594 HydrophobicContact CE2-CD1 4.06Å; F510-Y594 HydrophobicContact CE2-CE1 4.31Å; F510-Y594 HydrophobicContact CG-CD1 4.46Å; F510-Y594 HydrophobicContact CG-CE1 4.36Å; F510-Y594 AromaticContact CZ-CD1 3.82Å; F510-Y594 HydrophobicContact CZ-CD1 3.82Å; F510-Y594 HydrophobicContact CZ-CE1 4.48Å; K589-Y594 HydrophobicContact CG-CE2 4.25Å; C590-Y594 PolarHBondContact O-N 2.75Å; Y594-I597 PolarHBondContact O-N 3.02Å; Y594-I598 PolarHBondContact O-N 3.35Å
595	S	85.1	Confident	84.2	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.028	23%	0.234	C	C	.	.	H	α-helix	trans	-56.4	-46.2	177.5	169.1	0	0	0	0	112.9	C590 I597 I598 K599 D605	C590-S595 VanDerWaalsContact O-CB 3.26Å; C590-S595 WeakPolarHBondContact O-CB 3.25Å; C590-S595 PolarHBondContact O-N 2.73Å; S595-I597 VanDerWaalsContact C-N 3.3Å; S595-I597 PolarHBondContact O-N 3.26Å; S595-I598 PolarHBondContact O-N 2.89Å; S595-K599 WeakPolarHBondContact O-CB 3.31Å; S595-K599 PolarHBondContact O-N 3.47Å; S595-D605 PolarHBondContact OG-OD1 3.29Å
596	P	84.5	Confident	84.3	Confident	73 Å²	73	44.9 Å²	44.9	47%	0.474	22%	0.22	S	C	.	.	H	α-helix	trans	-59.9	-38.4	176.9	-23.5	34.2	0	0	0	113.4	K600	P596-K600 WeakPolarHBondContact O-CB 3.37Å; P596-K600 PolarHBondContact O-N 3.3Å; P596-K600 VanDerWaalsContact O-N 3.17Å
597	I	84.4	Confident	84.4	Confident	20 Å²	20	44.6 Å²	44.6	10%	0.103	22%	0.218	C	C	.	.	H	α-helix	trans	-71.6	-52.2	-178.6	-59.9	168.6	0	0	0	110	V507 F510 N511 L514 V593 Y594 S595 K599 K600 Y601	V507-I597 HydrophobicContact CG1-CD1 3.66Å; F510-I597 HydrophobicContact CD1-CD1 4.15Å; F510-I597 HydrophobicContact CD1-CG2 3.86Å; F510-I597 HydrophobicContact CE1-CB 4.16Å; F510-I597 HydrophobicContact CE1-CD1 4.44Å; F510-I597 HydrophobicContact CE1-CG2 3.68Å; N511-I597 WeakPolarHBondContact OD1-CG2 3.37Å; L514-I597 HydrophobicContact CD2-CG2 3.89Å; V593-I597 WeakPolarHBondContact O-CD1 3.06Å; Y594-I597 PolarHBondContact O-N 3.02Å; S595-I597 VanDerWaalsContact C-N 3.3Å; S595-I597 PolarHBondContact O-N 3.26Å; I597-K599 VanDerWaalsContact C-N 3.29Å; I597-K599 PolarHBondContact O-N 3.36Å; I597-K600 WeakPolarHBondContact O-CB 3.31Å; I597-K600 PolarHBondContact O-N 2.95Å; I597-K600 VanDerWaalsContact O-N 3.13Å; I597-Y601 HydrophobicContact CG2-CD2 4.28Å; I597-Y601 HydrophobicContact CG2-CE2 4.35Å; I597-Y601 WeakPolarHBondContact O-CD2 3.45Å; I597-Y601 PolarHBondContact O-N 2.88Å
598	I	87.2	Confident	84.4	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-39.8	-179.3	-69.4	167	0	0	0	110.9	I492 F510 L514 F540 Y594 S595 K600 Y601 L602 P606	I492-I598 HydrophobicContact CG2-CD1 4.48Å; F510-I598 HydrophobicContact CE1-CG1 4.27Å; F510-I598 HydrophobicContact CZ-CD1 4.09Å; F510-I598 HydrophobicContact CZ-CG1 4.06Å; L514-I598 HydrophobicContact CD2-CG1 4.31Å; F540-I598 HydrophobicContact CE1-CG2 4.17Å; F540-I598 HydrophobicContact CE2-CD1 4.43Å; F540-I598 HydrophobicContact CZ-CD1 4.11Å; F540-I598 HydrophobicContact CZ-CG2 4Å; Y594-I598 PolarHBondContact O-N 3.35Å; S595-I598 PolarHBondContact O-N 2.89Å; I598-K600 VanDerWaalsContact C-N 3.33Å; I598-K600 PolarHBondContact O-N 2.72Å; I598-Y601 PolarHBondContact O-N 3.46Å; I598-L602 HydrophobicContact CG2-CB 4.38Å; I598-L602 HydrophobicContact CG2-CD1 4.13Å; I598-L602 WeakPolarHBondContact O-CB 3.19Å; I598-L602 PolarHBondContact O-N 2.83Å; I598-P606 HydrophobicContact CB-CG 3.98Å; I598-P606 HydrophobicContact CD1-CB 4.08Å; I598-P606 HydrophobicContact CD1-CG 3.76Å; I598-P606 HydrophobicContact CG1-CG 4.45Å; I598-P606 HydrophobicContact CG2-CG 4.11Å
599	K	86.1	Confident	84.4	Confident	105 Å²	105	45.1 Å²	45.1	46%	0.457	22%	0.223	S	C	.	.	H	α-helix	trans	-63.3	-37.5	176.8	-170.4	172.8	-176.1	171.4	0	112.5	S595 I597 Y601 D603 L604	S595-K599 WeakPolarHBondContact O-CB 3.31Å; S595-K599 PolarHBondContact O-N 3.47Å; I597-K599 VanDerWaalsContact C-N 3.29Å; I597-K599 PolarHBondContact O-N 3.36Å; K599-Y601 VanDerWaalsContact C-N 3.34Å; K599-Y601 PolarHBondContact O-N 3.25Å; K599-D603 VanDerWaalsContact O-CA 3.3Å; K599-D603 WeakPolarHBondContact O-CA 2.99Å; K599-D603 PolarHBondContact O-N 2.91Å; K599-D603 VanDerWaalsContact O-N 3.1Å; K599-L604 WeakPolarHBondContact CA-O 3.43Å; K599-L604 PolarHBondContact N-O 2.97Å
600	K	86.4	Confident	84.8	Confident	151 Å²	151	42.2 Å²	42.2	66%	0.657	21%	0.21	S	C	*	.	H	α-helix	trans	-60.8	-39.9	176.6	179.3	-170.2	171.6	-159	0	112.5	P596 I597 I598	P596-K600 WeakPolarHBondContact O-CB 3.37Å; P596-K600 PolarHBondContact O-N 3.3Å; P596-K600 VanDerWaalsContact O-N 3.17Å; I597-K600 WeakPolarHBondContact O-CB 3.31Å; I597-K600 PolarHBondContact O-N 2.95Å; I597-K600 VanDerWaalsContact O-N 3.13Å; I598-K600 VanDerWaalsContact C-N 3.33Å; I598-K600 PolarHBondContact O-N 2.72Å
601	Y	85.9	Confident	85	Confident	60 Å²	60	42.7 Å²	42.7	24%	0.235	21%	0.212	C	C	.	.	H	α-helix	trans	-98.2	-36.3	-172.5	-73.7	-86.9	0	0	0	114.1	L514 E515 I597 I598 K599	L514-Y601 HydrophobicContact CD2-CD2 3.61Å; L514-Y601 HydrophobicContact CD2-CG 3.85Å; L514-Y601 HydrophobicContact CG-CD2 4.25Å; L514-Y601 HydrophobicContact CG-CG 4.11Å; E515-Y601 HydrophobicContact CB-CE1 3.84Å; E515-Y601 HydrophobicContact CG-CE1 4.21Å; I597-Y601 HydrophobicContact CG2-CD2 4.28Å; I597-Y601 HydrophobicContact CG2-CE2 4.35Å; I597-Y601 WeakPolarHBondContact O-CD2 3.45Å; I597-Y601 PolarHBondContact O-N 2.88Å; I598-Y601 PolarHBondContact O-N 3.46Å; K599-Y601 VanDerWaalsContact C-N 3.34Å; K599-Y601 PolarHBondContact O-N 3.25Å
602	L	85.5	Confident	85.1	Confident	8 Å²	8	45.4 Å²	45.4	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-106.4	-9.4	-175.7	-61.4	-175.2	0	0	0	114.1	L514 L536 Q537 F540 I598 L604	L514-L602 HydrophobicContact CD1-CD1 4.45Å; L536-L602 HydrophobicContact CD2-CD2 3.44Å; L536-L602 VanDerWaalsContact CD2-CD2 3.44Å; L536-L602 HydrophobicContact CG-CD2 3.67Å; Q537-L602 PolarHBondContact NE2-O 3.48Å; F540-L602 HydrophobicContact CB-CD1 4Å; F540-L602 HydrophobicContact CD1-CD1 3.96Å; F540-L602 HydrophobicContact CD2-CD1 3.9Å; F540-L602 HydrophobicContact CE1-CD1 4.46Å; F540-L602 HydrophobicContact CE2-CD1 4.42Å; F540-L602 HydrophobicContact CG-CD1 3.65Å; I598-L602 HydrophobicContact CG2-CB 4.38Å; I598-L602 HydrophobicContact CG2-CD1 4.13Å; I598-L602 WeakPolarHBondContact O-CB 3.19Å; I598-L602 PolarHBondContact O-N 2.83Å; L602-L604 HydrophobicContact CB-CB 4.35Å; L602-L604 HydrophobicContact CB-CD1 4.43Å; L602-L604 HydrophobicContact CB-CG 4.36Å; L602-L604 PolarHBondContact O-N 2.99Å
603	D	85.4	Confident	85.6	Confident	126 Å²	126	39.8 Å²	39.8	67%	0.674	20%	0.195	S	C	*	.	S	Bend	trans	52.5	34	-170.1	-162.5	31.7	0	0	0	113.1	K599	K599-D603 VanDerWaalsContact O-CA 3.3Å; K599-D603 WeakPolarHBondContact O-CA 2.99Å; K599-D603 PolarHBondContact O-N 2.91Å; K599-D603 VanDerWaalsContact O-N 3.1Å
604	L	85.6	Confident	86.2	Confident	37 Å²	37	38.4 Å²	38.4	19%	0.194	19%	0.187	C	C	.	.			trans	-121.7	142.7	176	-66.8	177.6	0	0	0	109.6	Q537 F540 K599 L602 P606	Q537-L604 HydrophobicContact CB-CD1 3.86Å; Q537-L604 HydrophobicContact CG-CD1 3.99Å; Q537-L604 HydrophobicContact CG-CG 4.23Å; F540-L604 HydrophobicContact CD1-CD1 3.8Å; F540-L604 HydrophobicContact CE1-CD1 4.42Å; K599-L604 WeakPolarHBondContact CA-O 3.43Å; K599-L604 PolarHBondContact N-O 2.97Å; L602-L604 HydrophobicContact CB-CB 4.35Å; L602-L604 HydrophobicContact CB-CD1 4.43Å; L602-L604 HydrophobicContact CB-CG 4.36Å; L602-L604 PolarHBondContact O-N 2.99Å; L604-P606 VanDerWaalsContact O-CD 3.31Å; L604-P606 WeakPolarHBondContact O-CD 3.48Å
605	D	84.5	Confident	86.3	Confident	25 Å²	25	38.7 Å²	38.7	13%	0.134	19%	0.189	C	C	.	.			trans	-99.5	104.1	173.4	-160.6	-26.5	0	0	0	110.6	S595 F607 I608 N609	S595-D605 PolarHBondContact OG-OD1 3.29Å; D605-F607 PolarHBondContact O-N 3.15Å; D605-F607 WeakPolarHBondContact OD1-CB 3.36Å; D605-F607 PolarHBondContact OD1-N 3.49Å; D605-F607 VanDerWaalsContact OD1-N 3.1Å; D605-I608 HydrophobicContact CB-CB 4.26Å; D605-I608 HydrophobicContact CB-CD1 3.7Å; D605-I608 HydrophobicContact CB-CG1 3.76Å; D605-I608 PolarHBondContact O-N 3.24Å; D605-N609 PolarHBondContact O-N 3.38Å; D605-N609 PolarHBondContact O-ND2 2.96Å
606	P	86.2	Confident	86.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.9	-26.3	-179.3	29.9	-37.3	0	0	0	112	F540 F544 I598 L604 N609 M610	F540-P606 HydrophobicContact CZ-CB 4.4Å; F544-P606 HydrophobicContact CE1-CB 4.1Å; F544-P606 WeakPolarHBondContact CE1-O 3.35Å; F544-P606 HydrophobicContact CE2-CB 4.13Å; F544-P606 HydrophobicContact CZ-CB 3.65Å; F544-P606 WeakPolarHBondContact CZ-O 3.49Å; I598-P606 HydrophobicContact CB-CG 3.98Å; I598-P606 HydrophobicContact CD1-CB 4.08Å; I598-P606 HydrophobicContact CD1-CG 3.76Å; I598-P606 HydrophobicContact CG1-CG 4.45Å; I598-P606 HydrophobicContact CG2-CG 4.11Å; L604-P606 VanDerWaalsContact O-CD 3.31Å; L604-P606 WeakPolarHBondContact O-CD 3.48Å; P606-N609 PolarHBondContact O-N 3.41Å; P606-M610 VanDerWaalsContact O-CB 3.24Å; P606-M610 WeakPolarHBondContact O-CB 3.32Å; P606-M610 PolarHBondContact O-N 3.08Å
607	F	87.1	Confident	86.4	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-64.3	-47.1	177.6	167.1	-98.3	0	0	0	110.9	L587 C591 D605 N609 M610 Y611 M675 K679	L587-F607 HydrophobicContact CB-CD2 4.5Å; L587-F607 HydrophobicContact CB-CE2 4.1Å; L587-F607 HydrophobicContact CD2-CD2 4.11Å; L587-F607 HydrophobicContact CD2-CE2 4.09Å; C591-F607 HydrophobicContact CB-CD2 3.54Å; C591-F607 HydrophobicContact CB-CE2 3.89Å; C591-F607 HydrophobicContact CB-CG 4.17Å; D605-F607 PolarHBondContact O-N 3.15Å; D605-F607 WeakPolarHBondContact OD1-CB 3.36Å; D605-F607 PolarHBondContact OD1-N 3.49Å; D605-F607 VanDerWaalsContact OD1-N 3.1Å; F607-N609 VanDerWaalsContact C-N 3.32Å; F607-N609 PolarHBondContact O-N 3Å; F607-M610 PolarHBondContact O-N 2.98Å; F607-Y611 WeakPolarHBondContact O-CB 3.38Å; F607-Y611 PolarHBondContact O-N 3.4Å; F607-M675 HydrophobicContact CE2-CE 4.11Å; F607-M675 HydrophobicContact CZ-CB 4.18Å; F607-M675 WeakPolarHBondContact CZ-O 3.29Å; F607-K679 HydrophobicContact CD1-CD 4.23Å; F607-K679 HydrophobicContact CE1-CB 4.34Å; F607-K679 HydrophobicContact CE1-CD 4.34Å
608	I	85.1	Confident	86.4	Confident	41 Å²	41	40.3 Å²	40.3	21%	0.21	20%	0.195	C	C	.	.	H	α-helix	trans	-60.2	-45.5	179.4	-57.7	-177.2	0	0	0	110.4	D605 K612 I680	D605-I608 HydrophobicContact CB-CB 4.26Å; D605-I608 HydrophobicContact CB-CD1 3.7Å; D605-I608 HydrophobicContact CB-CG1 3.76Å; D605-I608 PolarHBondContact O-N 3.24Å; I608-K612 HydrophobicContact CG2-CD 4.27Å; I608-K612 WeakPolarHBondContact O-CB 3.38Å; I608-K612 WeakPolarHBondContact O-CG 3.11Å; I608-K612 PolarHBondContact O-N 3.44Å; I608-I680 HydrophobicContact CB-CD1 4.27Å; I608-I680 HydrophobicContact CD1-CD1 3.76Å; I608-I680 HydrophobicContact CD1-CG1 3.74Å; I608-I680 HydrophobicContact CG1-CD1 3.68Å; I608-I680 HydrophobicContact CG1-CG1 3.98Å; I608-I680 HydrophobicContact CG2-CD1 3.81Å
609	N	85.6	Confident	86	Confident	35 Å²	35	42.7 Å²	42.7	19%	0.187	21%	0.206	C	C	.	.	H	α-helix	trans	-67.1	-43.9	180	-70	-56.4	0	0	0	111.8	L541 F544 D605 P606 F607 K612 F613	L541-N609 HydrophobicContact CD1-CB 4.21Å; F544-N609 HydrophobicContact CD1-CB 4.28Å; F544-N609 HydrophobicContact CE1-CB 4.07Å; D605-N609 PolarHBondContact O-N 3.38Å; D605-N609 PolarHBondContact O-ND2 2.96Å; P606-N609 PolarHBondContact O-N 3.41Å; F607-N609 VanDerWaalsContact C-N 3.32Å; F607-N609 PolarHBondContact O-N 3Å; N609-K612 PolarHBondContact O-N 3.36Å; N609-F613 HydrophobicContact CB-CE2 4.1Å; N609-F613 WeakPolarHBondContact O-CD2 3.16Å; N609-F613 WeakPolarHBondContact O-CG 3.32Å; N609-F613 PolarHBondContact O-N 2.83Å
610	M	88.7	Confident	85.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-46.1	177.3	-176.5	179.8	-82.5	0	0	111.3	Y495 F544 F547 V548 D586 L587 C590 P606 F607 F613 Y614	Y495-M610 WeakPolarHBondContact OH-CE 3.42Å; F544-M610 HydrophobicContact CE1-CB 4.06Å; F544-M610 HydrophobicContact CE2-CE 4.32Å; F544-M610 HydrophobicContact CZ-CB 4.06Å; F544-M610 HydrophobicContact CZ-CE 3.91Å; F547-M610 HydrophobicContact CE1-CE 4.36Å; V548-M610 HydrophobicContact CG1-CG 4.02Å; V548-M610 HydrophobicContact CG2-CB 4.29Å; V548-M610 HydrophobicContact CG2-CE 4.03Å; V548-M610 HydrophobicContact CG2-CG 4.09Å; D586-M610 HydrophobicContact CB-SD 4.47Å; L587-M610 HydrophobicContact CD2-CB 4.05Å; L587-M610 HydrophobicContact CD2-CG 3.76Å; L587-M610 HydrophobicContact CD2-SD 3.98Å; C590-M610 HydrophobicContact CB-CE 4.3Å; C590-M610 HydrophobicContact CB-SD 3.87Å; P606-M610 VanDerWaalsContact O-CB 3.24Å; P606-M610 WeakPolarHBondContact O-CB 3.32Å; P606-M610 PolarHBondContact O-N 3.08Å; F607-M610 PolarHBondContact O-N 2.98Å; M610-F613 PolarHBondContact O-N 3.46Å; M610-Y614 HydrophobicContact CG-CD2 3.87Å; M610-Y614 HydrophobicContact CG-CE2 3.53Å; M610-Y614 PolarHBondContact O-N 3.2Å; M610-Y614 HydrophobicContact SD-CE2 3.83Å
611	Y	88.2	Confident	85.4	Confident	10 Å²	10	37 Å²	37	4%	0.039	18%	0.184	C	C	.	.	H	α-helix	trans	-58.2	-50.2	175.5	177	-91.8	0	0	0	111.4	L587 F607 F613 Y614 A615 F672 F676 L688	L587-Y611 HydrophobicContact CD1-CD2 4.01Å; F607-Y611 WeakPolarHBondContact O-CB 3.38Å; F607-Y611 PolarHBondContact O-N 3.4Å; Y611-F613 VanDerWaalsContact C-N 3.29Å; Y611-F613 PolarHBondContact O-N 3.36Å; Y611-Y614 PolarHBondContact O-N 2.86Å; Y611-A615 HydrophobicContact CE1-CB 4.29Å; Y611-A615 WeakPolarHBondContact O-CB 3.26Å; Y611-A615 PolarHBondContact O-N 2.92Å; Y611-F672 HydrophobicContact CD2-CE1 4.2Å; Y611-F672 HydrophobicContact CD2-CZ 4.1Å; Y611-F672 AromaticContact CE2-CD1 3.9Å; Y611-F672 HydrophobicContact CE2-CD1 3.9Å; Y611-F672 AromaticContact CE2-CE1 3.6Å; Y611-F672 HydrophobicContact CE2-CE1 3.6Å; Y611-F672 HydrophobicContact CE2-CG 4.5Å; Y611-F672 AromaticContact CE2-CZ 3.97Å; Y611-F672 HydrophobicContact CE2-CZ 3.97Å; Y611-F672 VanDerWaalsContact CE2-O 3.3Å; Y611-F672 WeakPolarHBondContact CE2-O 3.36Å; Y611-F676 HydrophobicContact CD1-CB 4.3Å; Y611-F676 AromaticContact CD1-CD2 3.3Å; Y611-F676 HydrophobicContact CD1-CD2 3.3Å; Y611-F676 AromaticContact CD1-CE2 3.92Å; Y611-F676 HydrophobicContact CD1-CE2 3.92Å; Y611-F676 HydrophobicContact CD1-CG 4.16Å; Y611-F676 HydrophobicContact CE1-CB 3.71Å; Y611-F676 AromaticContact CE1-CD2 3.26Å; Y611-F676 HydrophobicContact CE1-CD2 3.26Å; Y611-F676 HydrophobicContact CE1-CE2 4.01Å; Y611-F676 AromaticContact CE1-CG 3.7Å; Y611-F676 HydrophobicContact CE1-CG 3.7Å; Y611-F676 HydrophobicContact CE2-CB 4.21Å; Y611-F676 HydrophobicContact CG-CD2 4.14Å; Y611-L688 HydrophobicContact CE1-CD1 4.21Å; Y611-L688 HydrophobicContact CE2-CD1 4.43Å; Y611-L688 WeakPolarHBondContact OH-CD1 3.09Å
612	K	85.5	Confident	84.9	Confident	76 Å²	76	35.4 Å²	35.4	33%	0.33	18%	0.178	S	C	.	.	H	α-helix	trans	-57.5	-41.5	178.9	-75.9	-177.7	177.5	-171.1	0	111.6	I608 N609 N616 E684	I608-K612 HydrophobicContact CG2-CD 4.27Å; I608-K612 WeakPolarHBondContact O-CB 3.38Å; I608-K612 WeakPolarHBondContact O-CG 3.11Å; I608-K612 PolarHBondContact O-N 3.44Å; N609-K612 PolarHBondContact O-N 3.36Å; K612-N616 WeakPolarHBondContact O-CB 3.46Å; K612-N616 PolarHBondContact O-N 2.86Å; K612-N616 VanDerWaalsContact O-N 3.07Å; K612-N616 PolarHBondContact O-ND2 2.68Å; K612-N616 VanDerWaalsContact O-ND2 3.16Å; K612-E684 IonicContact NZ-OE2 3.75Å; K612-E684 PolarHBondContact NZ-OE2 3.25Å
613	F	89.6	Confident	84.2	Confident	32 Å²	32	35.5 Å²	35.5	14%	0.14	18%	0.178	C	C	.	.	H	α-helix	trans	-68.6	-46.4	177.2	-62.9	-44.3	0	0	0	112.6	K545 V548 N609 M610 Y611 N616 S617	K545-F613 HydrophobicContact CB-CD2 4.46Å; K545-F613 HydrophobicContact CB-CE1 4.28Å; K545-F613 HydrophobicContact CB-CE2 3.74Å; K545-F613 HydrophobicContact CB-CZ 3.64Å; K545-F613 HydrophobicContact CD-CE1 3.76Å; K545-F613 HydrophobicContact CD-CZ 3.87Å; K545-F613 HydrophobicContact CG-CD1 4.19Å; K545-F613 HydrophobicContact CG-CD2 4.45Å; K545-F613 HydrophobicContact CG-CE1 3.71Å; K545-F613 HydrophobicContact CG-CE2 3.99Å; K545-F613 HydrophobicContact CG-CZ 3.61Å; V548-F613 HydrophobicContact CB-CB 4.47Å; V548-F613 HydrophobicContact CB-CD2 4.18Å; V548-F613 HydrophobicContact CG1-CB 3.73Å; V548-F613 HydrophobicContact CG1-CD2 4.2Å; V548-F613 HydrophobicContact CG1-CG 4.44Å; V548-F613 HydrophobicContact CG2-CD2 4.43Å; N609-F613 HydrophobicContact CB-CE2 4.1Å; N609-F613 WeakPolarHBondContact O-CD2 3.16Å; N609-F613 WeakPolarHBondContact O-CG 3.32Å; N609-F613 PolarHBondContact O-N 2.83Å; M610-F613 PolarHBondContact O-N 3.46Å; Y611-F613 VanDerWaalsContact C-N 3.29Å; Y611-F613 PolarHBondContact O-N 3.36Å; F613-N616 PolarHBondContact O-N 3.02Å; F613-S617 WeakPolarHBondContact O-CB 3.23Å; F613-S617 PolarHBondContact O-N 3.04Å; F613-S617 PolarHBondContact O-OG 2.99Å
614	Y	90.8	Very high	83.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-41.9	176.3	-72.8	-21.4	0	0	0	112.8	V548 Y552 L583 D586 L587 M610 Y611 S617 L618	V548-Y614 HydrophobicContact CG1-CD1 3.7Å; V548-Y614 HydrophobicContact CG1-CE1 3.43Å; V548-Y614 VanDerWaalsContact CG1-CE1 3.43Å; V548-Y614 HydrophobicContact CG1-CG 4.45Å; Y552-Y614 AromaticContact CD2-CD1 3.97Å; Y552-Y614 HydrophobicContact CD2-CD1 3.97Å; Y552-Y614 HydrophobicContact CD2-CE1 4.42Å; Y552-Y614 HydrophobicContact CG-CD1 4.4Å; L583-Y614 HydrophobicContact CB-CD2 4.18Å; L583-Y614 HydrophobicContact CB-CE2 4.43Å; L583-Y614 HydrophobicContact CD2-CD1 3.83Å; L583-Y614 HydrophobicContact CD2-CD2 3.91Å; L583-Y614 HydrophobicContact CD2-CE1 3.75Å; L583-Y614 HydrophobicContact CD2-CE2 3.85Å; L583-Y614 HydrophobicContact CD2-CG 3.91Å; D586-Y614 HydrophobicContact CB-CE2 4.13Å; D586-Y614 PolarHBondContact OD2-OH 3.45Å; L587-Y614 HydrophobicContact CD1-CD2 4.25Å; L587-Y614 HydrophobicContact CD2-CD2 4.18Å; L587-Y614 HydrophobicContact CG-CD2 4Å; L587-Y614 HydrophobicContact CG-CE2 4.28Å; M610-Y614 HydrophobicContact CG-CD2 3.87Å; M610-Y614 HydrophobicContact CG-CE2 3.53Å; M610-Y614 PolarHBondContact O-N 3.2Å; M610-Y614 HydrophobicContact SD-CE2 3.83Å; Y611-Y614 PolarHBondContact O-N 2.86Å; Y614-S617 PolarHBondContact O-N 3.33Å; Y614-L618 WeakPolarHBondContact O-CB 3.37Å; Y614-L618 WeakPolarHBondContact O-CG 3.4Å; Y614-L618 PolarHBondContact O-N 3.29Å
615	A	85	Confident	82.2	Confident	7 Å²	7	38 Å²	38	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-57.6	-48.8	174.8	0	0	0	0	0	111.3	Y611 S617 L618 H619 F672 L688	Y611-A615 HydrophobicContact CE1-CB 4.29Å; Y611-A615 WeakPolarHBondContact O-CB 3.26Å; Y611-A615 PolarHBondContact O-N 2.92Å; A615-S617 PolarHBondContact O-N 3.29Å; A615-L618 PolarHBondContact O-N 3.44Å; A615-H619 VanDerWaalsContact O-CB 3.25Å; A615-H619 WeakPolarHBondContact O-CB 3.3Å; A615-H619 PolarHBondContact O-N 3.32Å; A615-F672 HydrophobicContact CB-CE1 4.33Å; A615-L688 HydrophobicContact CB-CD1 3.45Å; A615-L688 VanDerWaalsContact CB-CD1 3.45Å; A615-L688 HydrophobicContact CB-CG 4.46Å
616	N	84.3	Confident	81.3	Confident	105 Å²	105	40.3 Å²	40.3	56%	0.561	20%	0.199	S	C	*	.	H	α-helix	trans	-63.5	-40.7	178	-72.4	-20.2	0	0	0	112.3	K612 F613 H619 H620	K612-N616 WeakPolarHBondContact O-CB 3.46Å; K612-N616 PolarHBondContact O-N 2.86Å; K612-N616 VanDerWaalsContact O-N 3.07Å; K612-N616 PolarHBondContact O-ND2 2.68Å; K612-N616 VanDerWaalsContact O-ND2 3.16Å; F613-N616 PolarHBondContact O-N 3.02Å; N616-H619 PolarHBondContact O-N 3.36Å; N616-H620 WeakPolarHBondContact O-CB 3.19Å; N616-H620 PolarHBondContact O-N 3.46Å
617	S	87.9	Confident	80.5	Confident	17 Å²	17	43.2 Å²	43.2	12%	0.119	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-47.1	177.4	-68.7	0	0	0	0	112.3	L549 Y552 F613 Y614 A615 H619 H620 D621	L549-S617 WeakPolarHBondContact CD2-OG 3.49Å; Y552-S617 PolarHBondContact OH-O 3.39Å; F613-S617 WeakPolarHBondContact O-CB 3.23Å; F613-S617 PolarHBondContact O-N 3.04Å; F613-S617 PolarHBondContact O-OG 2.99Å; Y614-S617 PolarHBondContact O-N 3.33Å; A615-S617 PolarHBondContact O-N 3.29Å; S617-H619 VanDerWaalsContact C-N 3.27Å; S617-H619 PolarHBondContact O-N 3.35Å; S617-H620 PolarHBondContact O-N 3.45Å; S617-D621 WeakPolarHBondContact O-CB 3.39Å; S617-D621 PolarHBondContact O-N 3.46Å
618	L	84.4	Confident	79.7	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-59.2	-40.9	173.7	-78.5	172.7	0	0	0	111.3	Y552 L579 I580 L583 Y614 A615 Y622 F672	Y552-L618 HydrophobicContact CE2-CD2 4.15Å; Y552-L618 HydrophobicContact CE2-CG 4.13Å; L579-L618 HydrophobicContact CD2-CD2 4.25Å; I580-L618 HydrophobicContact CG1-CD2 4.42Å; L583-L618 HydrophobicContact CD1-CD1 3.69Å; L583-L618 HydrophobicContact CD1-CD2 3.85Å; L583-L618 HydrophobicContact CD1-CG 3.81Å; Y614-L618 WeakPolarHBondContact O-CB 3.37Å; Y614-L618 WeakPolarHBondContact O-CG 3.4Å; Y614-L618 PolarHBondContact O-N 3.29Å; A615-L618 PolarHBondContact O-N 3.44Å; L618-Y622 HydrophobicContact CD2-CD2 4.14Å; L618-Y622 HydrophobicContact CD2-CE2 4.47Å; L618-Y622 PolarHBondContact O-N 2.88Å; L618-F672 HydrophobicContact CD1-CD1 4.43Å; L618-F672 HydrophobicContact CD1-CE1 3.9Å; L618-F672 HydrophobicContact CD1-CE2 4.13Å; L618-F672 HydrophobicContact CD1-CZ 3.74Å
619	H	78.8	Confident	78.9	Confident	51 Å²	51	44 Å²	44	24%	0.236	22%	0.217	C	C	.	.	I	π-helix	trans	-60.7	-50.9	176.6	179.7	77.1	0	0	0	111.1	A615 N616 S617 D621 I623 Q624 T689 F691	A615-H619 VanDerWaalsContact O-CB 3.25Å; A615-H619 WeakPolarHBondContact O-CB 3.3Å; A615-H619 PolarHBondContact O-N 3.32Å; N616-H619 PolarHBondContact O-N 3.36Å; S617-H619 VanDerWaalsContact C-N 3.27Å; S617-H619 PolarHBondContact O-N 3.35Å; H619-D621 PolarHBondContact O-N 3.12Å; H619-I623 VanDerWaalsContact ND1-CG2 3.31Å; H619-I623 WeakPolarHBondContact ND1-CG2 3.42Å; H619-I623 CarbonylContact O-C 3.51Å; H619-I623 WeakPolarHBondContact O-CB 3.27Å; H619-I623 PolarHBondContact O-N 3.07Å; H619-Q624 WeakPolarHBondContact O-CB 3.29Å; H619-Q624 PolarHBondContact O-N 3.24Å; H619-T689 WeakPolarHBondContact ND1-CG2 3.5Å; H619-F691 AromaticContact CE1-CE1 3.83Å; H619-F691 AromaticContact ND1-CE1 4Å
620	H	78.5	Confident	78.1	Confident	110 Å²	110	47.3 Å²	47.3	51%	0.509	24%	0.235	S	C	.	.	I	π-helix	trans	-63.4	-44.6	-178.5	-171.4	50.7	0	0	0	112.3	N616 S617 Q624	N616-H620 WeakPolarHBondContact O-CB 3.19Å; N616-H620 PolarHBondContact O-N 3.46Å; S617-H620 PolarHBondContact O-N 3.45Å; H620-Q624 PolarHBondContact ND1-OE1 3.42Å
621	D	81	Confident	77.1	Confident	27 Å²	27	48 Å²	48	14%	0.144	24%	0.238	C	C	.	.	I	π-helix	trans	-78	-43.3	-172.7	-78.4	-26.3	0	0	0	114.3	Y552 K556 S617 H619 I627	Y552-D621 WeakPolarHBondContact CE1-OD2 3.5Å; Y552-D621 VanDerWaalsContact CZ-OD2 3.28Å; Y552-D621 PolarHBondContact OH-OD2 3.25Å; K556-D621 WeakPolarHBondContact CE-OD2 3.25Å; K556-D621 IonicContact NZ-OD1 3.69Å; K556-D621 PolarHBondContact NZ-OD1 2.66Å; K556-D621 IonicContact NZ-OD2 3.18Å; K556-D621 PolarHBondContact NZ-OD2 3.17Å; S617-D621 WeakPolarHBondContact O-CB 3.39Å; S617-D621 PolarHBondContact O-N 3.46Å; H619-D621 PolarHBondContact O-N 3.12Å; D621-I627 WeakPolarHBondContact O-CD1 3.25Å
622	Y	75.8	Confident	76.3	Confident	26 Å²	26	47.5 Å²	47.5	10%	0.102	24%	0.237	C	C	.	.	I	π-helix	trans	-111.6	-27.7	-168	-69.6	-82.6	0	0	0	113.3	L576 L579 L618 I627 L628	L576-Y622 HydrophobicContact CD1-CD1 3.79Å; L576-Y622 HydrophobicContact CD1-CD2 3.98Å; L576-Y622 HydrophobicContact CD1-CE1 3.84Å; L576-Y622 HydrophobicContact CD1-CE2 4.04Å; L576-Y622 HydrophobicContact CD1-CG 3.85Å; L576-Y622 HydrophobicContact CD2-CD1 4.25Å; L579-Y622 HydrophobicContact CD2-CE2 3.49Å; L579-Y622 VanDerWaalsContact CD2-CE2 3.49Å; L618-Y622 HydrophobicContact CD2-CD2 4.14Å; L618-Y622 HydrophobicContact CD2-CE2 4.47Å; L618-Y622 PolarHBondContact O-N 2.88Å; Y622-I627 HydrophobicContact CD1-CG2 4.22Å; Y622-I627 PolarHBondContact O-N 3.3Å; Y622-L628 PolarHBondContact O-N 3.1Å
623	I	69.2	Low	75.5	Confident	11 Å²	11	47 Å²	47	6%	0.056	24%	0.237	C	C	.	.	I	π-helix	trans	-99.9	-53	-169	-72.6	176.7	0	0	0	111.2	H619 I625 N626 T689 F691	H619-I623 VanDerWaalsContact ND1-CG2 3.31Å; H619-I623 WeakPolarHBondContact ND1-CG2 3.42Å; H619-I623 CarbonylContact O-C 3.51Å; H619-I623 WeakPolarHBondContact O-CB 3.27Å; H619-I623 PolarHBondContact O-N 3.07Å; I623-I625 PolarHBondContact O-N 3.28Å; I623-N626 PolarHBondContact O-N 3.29Å; I623-T689 HydrophobicContact CD1-CG2 4.09Å; I623-T689 HydrophobicContact CG2-CG2 4.41Å; I623-F691 HydrophobicContact CB-CZ 4.23Å; I623-F691 HydrophobicContact CD1-CZ 4.3Å; I623-F691 HydrophobicContact CG1-CZ 4.41Å; I623-F691 HydrophobicContact CG2-CD1 4.41Å; I623-F691 HydrophobicContact CG2-CE1 3.13Å; I623-F691 HydrophobicContact CG2-CE2 4.1Å; I623-F691 HydrophobicContact CG2-CZ 2.98Å
624	Q	66.6	Low	74.5	Confident	118 Å²	118	48.6 Å²	48.6	55%	0.551	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.4	-176.5	-170.5	-178.9	9.5	0	0	111.8	H619 H620 N626	H619-Q624 WeakPolarHBondContact O-CB 3.29Å; H619-Q624 PolarHBondContact O-N 3.24Å; H620-Q624 PolarHBondContact ND1-OE1 3.42Å; Q624-N626 PolarHBondContact O-N 3.22Å
625	I	64.4	Low	73.3	Confident	98 Å²	98	49 Å²	49	50%	0.503	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	4.7	178.6	-53.2	175.2	0	0	0	111.2	I623 I627	I623-I625 PolarHBondContact O-N 3.28Å; I625-I627 HydrophobicContact CB-CD1 3.99Å; I625-I627 HydrophobicContact CB-CG1 4.04Å; I625-I627 HydrophobicContact CD1-CD1 4.49Å; I625-I627 HydrophobicContact CG2-CD1 3.79Å; I625-I627 HydrophobicContact CG2-CG1 3.82Å; I625-I627 PolarHBondContact O-N 3.08Å
626	N	65.5	Low	72.3	Confident	73 Å²	73	48.9 Å²	48.9	39%	0.39	25%	0.251	S	S	.	.	S	Bend	trans	53.2	20.5	-172.5	-71.3	-27.4	0	0	0	113.5	I623 Q624 L628 Q629 N630	I623-N626 PolarHBondContact O-N 3.29Å; Q624-N626 PolarHBondContact O-N 3.22Å; N626-L628 PolarHBondContact O-N 3.34Å; N626-Q629 HydrophobicContact CB-CB 4.28Å; N626-Q629 PolarHBondContact O-N 3.48Å; N626-Q629 PolarHBondContact OD1-OE1 2.96Å; N626-N630 VanDerWaalsContact O-CB 3.27Å; N626-N630 WeakPolarHBondContact O-CB 3.25Å; N626-N630 PolarHBondContact O-N 3.4Å; N626-N630 PolarHBondContact O-ND2 3.08Å; N626-N630 VanDerWaalsContact O-ND2 3.13Å
627	I	69.3	Low	71.5	Confident	60 Å²	60	47.7 Å²	47.7	31%	0.308	25%	0.245	S	C	.	.	H	α-helix	trans	-61.1	-47.7	178.7	-72.6	168.1	0	0	0	109.5	D621 Y622 I625 Q629 N630 L631	D621-I627 WeakPolarHBondContact O-CD1 3.25Å; Y622-I627 HydrophobicContact CD1-CG2 4.22Å; Y622-I627 PolarHBondContact O-N 3.3Å; I625-I627 HydrophobicContact CB-CD1 3.99Å; I625-I627 HydrophobicContact CB-CG1 4.04Å; I625-I627 HydrophobicContact CD1-CD1 4.49Å; I625-I627 HydrophobicContact CG2-CD1 3.79Å; I625-I627 HydrophobicContact CG2-CG1 3.82Å; I625-I627 PolarHBondContact O-N 3.08Å; I627-Q629 VanDerWaalsContact C-N 3.32Å; I627-Q629 PolarHBondContact O-N 3.31Å; I627-N630 CarbonylContact O-C 3.45Å; I627-N630 PolarHBondContact O-N 3.46Å; I627-N630 VanDerWaalsContact O-N 3.17Å; I627-L631 HydrophobicContact CG2-CD1 3.72Å; I627-L631 HydrophobicContact CG2-CG 4.18Å; I627-L631 WeakPolarHBondContact O-CB 3.45Å; I627-L631 WeakPolarHBondContact O-CG 3.34Å; I627-L631 PolarHBondContact O-N 3.39Å
628	L	68.6	Low	70.3	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-44.3	177.4	-175.7	63.1	0	0	0	111.4	L576 Y622 N626 L631 V632 L665 L669 W696	L576-L628 HydrophobicContact CD2-CD1 3.68Å; Y622-L628 PolarHBondContact O-N 3.1Å; N626-L628 PolarHBondContact O-N 3.34Å; L628-L631 PolarHBondContact O-N 2.93Å; L628-V632 HydrophobicContact CD1-CG2 3.89Å; L628-V632 HydrophobicContact CG-CG2 4.23Å; L628-V632 VanDerWaalsContact O-CB 3.27Å; L628-V632 WeakPolarHBondContact O-CB 3.47Å; L628-V632 WeakPolarHBondContact O-CG2 3.44Å; L628-V632 PolarHBondContact O-N 2.87Å; L628-L665 HydrophobicContact CD1-CD2 3.76Å; L628-L669 HydrophobicContact CD2-CD1 4.01Å; L628-W696 HydrophobicContact CB-CE3 4.43Å; L628-W696 HydrophobicContact CB-CZ3 3.89Å; L628-W696 HydrophobicContact CD2-CE3 3.99Å; L628-W696 HydrophobicContact CD2-CZ3 3.77Å; L628-W696 HydrophobicContact CG-CE3 3.99Å; L628-W696 HydrophobicContact CG-CZ3 3.86Å
629	Q	68.2	Low	69.1	Low	55 Å²	55	52 Å²	52	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-62.2	-45	175.8	-170.8	-177.9	13.7	0	0	111.5	N626 I627 L631 V632 L633 W696	N626-Q629 HydrophobicContact CB-CB 4.28Å; N626-Q629 PolarHBondContact O-N 3.48Å; N626-Q629 PolarHBondContact OD1-OE1 2.96Å; I627-Q629 VanDerWaalsContact C-N 3.32Å; I627-Q629 PolarHBondContact O-N 3.31Å; Q629-L631 VanDerWaalsContact C-N 3.29Å; Q629-L631 PolarHBondContact O-N 2.88Å; Q629-V632 PolarHBondContact O-N 3.27Å; Q629-L633 VanDerWaalsContact O-CB 3.25Å; Q629-L633 WeakPolarHBondContact O-CB 3.4Å; Q629-L633 PolarHBondContact O-N 3.28Å; Q629-W696 HydrophobicContact CB-CD2 4.36Å; Q629-W696 HydrophobicContact CB-CE3 4.37Å; Q629-W696 HydrophobicContact CB-CH2 4.14Å; Q629-W696 HydrophobicContact CB-CZ2 4.13Å; Q629-W696 HydrophobicContact CB-CZ3 4.26Å; Q629-W696 HydrophobicContact CG-CZ2 4.48Å
630	N	68.8	Low	68	Low	106 Å²	106	53.5 Å²	53.5	57%	0.567	27%	0.272	S	S	*	.	H	α-helix	trans	-68.7	-25.2	-179.9	-68.8	-26.4	0	0	0	113	N626 I627 P634	N626-N630 VanDerWaalsContact O-CB 3.27Å; N626-N630 WeakPolarHBondContact O-CB 3.25Å; N626-N630 PolarHBondContact O-N 3.4Å; N626-N630 PolarHBondContact O-ND2 3.08Å; N626-N630 VanDerWaalsContact O-ND2 3.13Å; I627-N630 CarbonylContact O-C 3.45Å; I627-N630 PolarHBondContact O-N 3.46Å; I627-N630 VanDerWaalsContact O-N 3.17Å; N630-P634 WeakPolarHBondContact O-CD 3.5Å; N630-P634 WeakPolarHBondContact O-CG 3.43Å
631	L	69.5	Low	67	Low	14 Å²	14	55 Å²	55	7%	0.073	28%	0.279	C	S	.	.	H	α-helix	trans	-76.9	-43.8	171.9	-72.2	171	0	0	0	111.5	E572 I627 L628 Q629 I635	E572-L631 HydrophobicContact CB-CD1 4.35Å; E572-L631 HydrophobicContact CB-CD2 3.73Å; E572-L631 WeakPolarHBondContact OE2-CD2 3.08Å; I627-L631 HydrophobicContact CG2-CD1 3.72Å; I627-L631 HydrophobicContact CG2-CG 4.18Å; I627-L631 WeakPolarHBondContact O-CB 3.45Å; I627-L631 WeakPolarHBondContact O-CG 3.34Å; I627-L631 PolarHBondContact O-N 3.39Å; L628-L631 PolarHBondContact O-N 2.93Å; Q629-L631 VanDerWaalsContact C-N 3.29Å; Q629-L631 PolarHBondContact O-N 2.88Å; L631-I635 WeakPolarHBondContact O-CD1 3.14Å; L631-I635 WeakPolarHBondContact O-CG1 3.33Å
632	V	70.9	Confident	65.6	Low	0 Å²	0	55 Å²	55	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-79.8	-45.5	-170.1	173.8	0	0	0	0	111.7	L628 Q629 I636 L662 W696 F697	L628-V632 HydrophobicContact CD1-CG2 3.89Å; L628-V632 HydrophobicContact CG-CG2 4.23Å; L628-V632 VanDerWaalsContact O-CB 3.27Å; L628-V632 WeakPolarHBondContact O-CB 3.47Å; L628-V632 WeakPolarHBondContact O-CG2 3.44Å; L628-V632 PolarHBondContact O-N 2.87Å; Q629-V632 PolarHBondContact O-N 3.27Å; V632-I636 HydrophobicContact CG1-CD1 3.35Å; V632-I636 HydrophobicContact CG1-CG1 4.27Å; V632-I636 WeakPolarHBondContact O-CB 3.18Å; V632-I636 VanDerWaalsContact O-CG1 3.29Å; V632-I636 WeakPolarHBondContact O-CG1 3.4Å; V632-I636 PolarHBondContact O-N 3.4Å; V632-I636 VanDerWaalsContact O-N 3.17Å; V632-L662 HydrophobicContact CB-CD2 4.45Å; V632-L662 HydrophobicContact CG2-CD2 3.78Å; V632-W696 HydrophobicContact CG1-CB 4.3Å; V632-F697 HydrophobicContact CG2-CE1 4.5Å; V632-F697 HydrophobicContact CG2-CZ 4.35Å
633	L	68.9	Low	64.2	Low	66 Å²	66	56.7 Å²	56.7	35%	0.346	29%	0.288	S	S	.	.	H	α-helix	trans	-66.8	-41.9	-169.6	-141.6	77.2	0	0	0	114.2	Q629 I636 N637	Q629-L633 VanDerWaalsContact O-CB 3.25Å; Q629-L633 WeakPolarHBondContact O-CB 3.4Å; Q629-L633 PolarHBondContact O-N 3.28Å; L633-I636 PolarHBondContact O-N 2.95Å; L633-N637 VanDerWaalsContact O-CB 3.31Å; L633-N637 WeakPolarHBondContact O-CB 3.43Å; L633-N637 PolarHBondContact O-N 3.46Å; L633-N637 PolarHBondContact O-ND2 3.33Å
634	P	68.6	Low	63.1	Low	65 Å²	65	60.8 Å²	60.8	42%	0.422	32%	0.318	S	S	.	.	H	α-helix	trans	-63.9	-43.3	178.8	-23.9	35.8	0	0	0	112.9	N630 I636 N637 Q638	N630-P634 WeakPolarHBondContact O-CD 3.5Å; N630-P634 WeakPolarHBondContact O-CG 3.43Å; P634-I636 VanDerWaalsContact C-N 3.31Å; P634-I636 PolarHBondContact O-N 3.23Å; P634-N637 PolarHBondContact O-N 2.85Å; P634-Q638 VanDerWaalsContact O-CB 3.24Å; P634-Q638 WeakPolarHBondContact O-CB 3.39Å; P634-Q638 PolarHBondContact O-N 2.89Å
635	I	65.9	Low	62	Low	8 Å²	8	60.7 Å²	60.7	4%	0.041	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-48.5	177.4	-62.3	174.8	0	0	0	109.5	I569 I573 L631 E639 E658 L662	I569-I635 HydrophobicContact CG2-CD1 3.74Å; I569-I635 HydrophobicContact CG2-CG1 4.17Å; I573-I635 HydrophobicContact CD1-CD1 3.28Å; L631-I635 WeakPolarHBondContact O-CD1 3.14Å; L631-I635 WeakPolarHBondContact O-CG1 3.33Å; I635-E639 WeakPolarHBondContact O-CB 3.49Å; I635-E639 PolarHBondContact O-N 3.03Å; I635-E658 HydrophobicContact CG2-CB 3.85Å; I635-L662 HydrophobicContact CB-CD1 4.18Å; I635-L662 HydrophobicContact CD1-CD1 4.33Å; I635-L662 HydrophobicContact CG2-CD1 3.84Å
636	I	63.3	Low	60.7	Low	4 Å²	4	59.9 Å²	59.9	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-49	178.7	-78.2	178.3	0	0	0	112.6	V632 L633 P634 E639 L640 L662 W696 P699 V700	V632-I636 HydrophobicContact CG1-CD1 3.35Å; V632-I636 HydrophobicContact CG1-CG1 4.27Å; V632-I636 WeakPolarHBondContact O-CB 3.18Å; V632-I636 VanDerWaalsContact O-CG1 3.29Å; V632-I636 WeakPolarHBondContact O-CG1 3.4Å; V632-I636 PolarHBondContact O-N 3.4Å; V632-I636 VanDerWaalsContact O-N 3.17Å; L633-I636 PolarHBondContact O-N 2.95Å; P634-I636 VanDerWaalsContact C-N 3.31Å; P634-I636 PolarHBondContact O-N 3.23Å; I636-E639 PolarHBondContact O-N 3.38Å; I636-L640 HydrophobicContact CG2-CD1 3.93Å; I636-L640 WeakPolarHBondContact O-CG 3.3Å; I636-L640 PolarHBondContact O-N 2.94Å; I636-L662 HydrophobicContact CG1-CD1 4.32Å; I636-W696 WeakPolarHBondContact CD1-O 3.42Å; I636-P699 HydrophobicContact CB-CB 4.35Å; I636-P699 HydrophobicContact CD1-CB 4.22Å; I636-P699 HydrophobicContact CD1-CG 4.33Å; I636-P699 HydrophobicContact CG1-CB 4.31Å; I636-P699 HydrophobicContact CG2-CB 3.29Å; I636-P699 HydrophobicContact CG2-CG 3.45Å; I636-P699 VanDerWaalsContact CG2-CG 3.45Å; I636-V700 HydrophobicContact CD1-CG2 3.69Å; I636-V700 HydrophobicContact CG1-CG2 3.9Å
637	N	66.4	Low	59.8	Low	80 Å²	80	61.8 Å²	61.8	43%	0.428	34%	0.336	S	S	.	.	H	α-helix	trans	-66.4	-42	-176	-74.4	-19.8	0	0	0	111	L633 P634 E639 L640 E641	L633-N637 VanDerWaalsContact O-CB 3.31Å; L633-N637 WeakPolarHBondContact O-CB 3.43Å; L633-N637 PolarHBondContact O-N 3.46Å; L633-N637 PolarHBondContact O-ND2 3.33Å; P634-N637 PolarHBondContact O-N 2.85Å; N637-E639 PolarHBondContact O-N 2.88Å; N637-L640 PolarHBondContact O-N 3.47Å; N637-E641 PolarHBondContact O-N 3.47Å
638	Q	63.6	Low	58.4	Low	106 Å²	106	64 Å²	64	50%	0.495	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-29.7	178.6	-163	175.6	14.9	0	0	111.9	P634 T642	P634-Q638 VanDerWaalsContact O-CB 3.24Å; P634-Q638 WeakPolarHBondContact O-CB 3.39Å; P634-Q638 PolarHBondContact O-N 2.89Å; Q638-T642 PolarHBondContact O-N 2.8Å
639	E	58.2	Low	57.1	Low	10 Å²	10	67.3 Å²	67.3	5%	0.047	39%	0.387	C	S	.	.	H	α-helix	trans	-81.4	-37.6	177.8	-158.9	160.3	-166.6	0	0	113.3	I635 I636 N637 E641 T642 K643 L659 Y703	I635-E639 WeakPolarHBondContact O-CB 3.49Å; I635-E639 PolarHBondContact O-N 3.03Å; I636-E639 PolarHBondContact O-N 3.38Å; N637-E639 PolarHBondContact O-N 2.88Å; E639-E641 PolarHBondContact O-N 2.96Å; E639-T642 WeakPolarHBondContact CA-OG1 3.42Å; E639-T642 PolarHBondContact O-N 3.16Å; E639-T642 VanDerWaalsContact O-N 3.08Å; E639-T642 PolarHBondContact O-OG1 2.99Å; E639-K643 PolarHBondContact O-N 3.4Å; E639-L659 HydrophobicContact CG-CD1 4.48Å; E639-L659 WeakPolarHBondContact OE1-CD1 3.14Å; E639-L659 WeakPolarHBondContact OE2-CD1 3.32Å; E639-L659 WeakPolarHBondContact OE2-CD2 3.5Å; E639-L659 WeakPolarHBondContact OE2-CG 3.36Å; E639-Y703 HydrophobicContact CG-CD2 4.25Å; E639-Y703 HydrophobicContact CG-CE2 3.92Å; E639-Y703 WeakPolarHBondContact OE1-CE2 3.28Å; E639-Y703 PolarHBondContact OE1-OH 3.3Å
640	L	57	Low	55.7	Low	83 Å²	83	73.5 Å²	73.5	44%	0.435	41%	0.413	S	S	.	.	H	α-helix	trans	-55.6	-38.2	168.2	-78.6	163.3	0	0	0	111.3	I636 N637 K643 P699	I636-L640 HydrophobicContact CG2-CD1 3.93Å; I636-L640 WeakPolarHBondContact O-CG 3.3Å; I636-L640 PolarHBondContact O-N 2.94Å; N637-L640 PolarHBondContact O-N 3.47Å; L640-K643 PolarHBondContact O-N 2.89Å; L640-P699 HydrophobicContact CD1-CB 4.16Å; L640-P699 HydrophobicContact CD1-CG 4.37Å
641	E	56.4	Low	54.4	Low	140 Å²	140	73.7 Å²	73.7	65%	0.654	41%	0.411	S	S	*	.	H	α-helix	trans	-66.3	-42.7	173.1	-73.7	-176	173.1	0	0	112.4	N637 E639 K643 S644	N637-E641 PolarHBondContact O-N 3.47Å; E639-E641 PolarHBondContact O-N 2.96Å; E641-K643 VanDerWaalsContact C-N 3.27Å; E641-K643 PolarHBondContact O-N 3.15Å; E641-S644 WeakPolarHBondContact O-CB 3.35Å; E641-S644 PolarHBondContact O-N 2.86Å; E641-S644 VanDerWaalsContact O-N 3.1Å; E641-S644 PolarHBondContact O-OG 2.69Å
642	T	52.2	Low	53	Low	29 Å²	29	76.2 Å²	76.2	18%	0.178	43%	0.429	C	S	.	.	H	α-helix	trans	-66.4	-24.9	177.6	53.6	0	0	0	0	114.2	Q638 E639 S644 L645 L646 K655	Q638-T642 PolarHBondContact O-N 2.8Å; E639-T642 WeakPolarHBondContact CA-OG1 3.42Å; E639-T642 PolarHBondContact O-N 3.16Å; E639-T642 VanDerWaalsContact O-N 3.08Å; E639-T642 PolarHBondContact O-OG1 2.99Å; T642-S644 PolarHBondContact O-N 2.68Å; T642-L645 PolarHBondContact O-N 3.28Å; T642-L646 WeakPolarHBondContact O-CG 3.33Å; T642-L646 PolarHBondContact O-N 3.16Å; T642-L646 VanDerWaalsContact O-N 3.14Å; T642-K655 VanDerWaalsContact CG2-NZ 3.32Å
643	K	47.2	Very low	51.7	Low	60 Å²	60	81.5 Å²	81.5	26%	0.261	46%	0.457	S	S	.	.	H	α-helix	trans	-57.4	-27.9	171.6	-73.8	-174.2	-174.4	179.5	0	112.4	E639 L640 E641 L645	E639-K643 PolarHBondContact O-N 3.4Å; L640-K643 PolarHBondContact O-N 2.89Å; E641-K643 VanDerWaalsContact C-N 3.27Å; E641-K643 PolarHBondContact O-N 3.15Å; K643-L645 VanDerWaalsContact C-N 3.28Å; K643-L645 PolarHBondContact O-N 3.34Å
644	S	46.6	Very low	50.7	Low	97 Å²	97	83 Å²	83	68%	0.678	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-22.9	174.7	75.5	0	0	0	0	113.7	E641 T642	E641-S644 WeakPolarHBondContact O-CB 3.35Å; E641-S644 PolarHBondContact O-N 2.86Å; E641-S644 VanDerWaalsContact O-N 3.1Å; E641-S644 PolarHBondContact O-OG 2.69Å; T642-S644 PolarHBondContact O-N 2.68Å
645	L	43.5	Very low	50	Low	117 Å²	117	82.5 Å²	82.5	61%	0.613	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-16.9	-175	-72.9	160.9	0	0	0	113.7	T642 K643 S647 T648	T642-L645 PolarHBondContact O-N 3.28Å; K643-L645 VanDerWaalsContact C-N 3.28Å; K643-L645 PolarHBondContact O-N 3.34Å; L645-S647 PolarHBondContact O-N 3.32Å; L645-S647 VanDerWaalsContact O-N 3.1Å; L645-T648 PolarHBondContact O-N 2.88Å; L645-T648 PolarHBondContact O-OG1 3.39Å
646	L	36.6	Very low	49.5	Very low	81 Å²	81	83.5 Å²	83.5	42%	0.424	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-76.1	10.8	-173.1	-79.1	165	0	0	0	115.5	T642 T648	T642-L646 WeakPolarHBondContact O-CG 3.33Å; T642-L646 PolarHBondContact O-N 3.16Å; T642-L646 VanDerWaalsContact O-N 3.14Å; L646-T648 PolarHBondContact O-N 3.42Å
647	S	46.3	Very low	49.3	Very low	113 Å²	113	87.4 Å²	87.4	79%	0.79	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-63.3	-9.5	158.3	60.1	0	0	0	0	112.6	L645	L645-S647 PolarHBondContact O-N 3.32Å; L645-S647 VanDerWaalsContact O-N 3.1Å
648	T	39.1	Very low	49.2	Very low	105 Å²	105	85.7 Å²	85.7	64%	0.644	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-111.6	40.1	-176.4	60	0	0	0	0	114.6	L645 L646 K650	L645-T648 PolarHBondContact O-N 2.88Å; L645-T648 PolarHBondContact O-OG1 3.39Å; L646-T648 PolarHBondContact O-N 3.42Å; T648-K650 PolarHBondContact O-N 3.15Å
649	G	42.3	Very low	49.3	Very low	74 Å²	74	80.9 Å²	80.9	76%	0.763	46%	0.455	S	S	*	.			trans	56	-3	151.3	0	0	0	0	0	121.2
650	K	38.8	Very low	49.6	Very low	185 Å²	185	82 Å²	82	80%	0.804	46%	0.46	S	S	*	.			trans	-97.4	95.7	177.7	-83.5	-178.7	174.4	177.4	0	109.4	T648 C652	T648-K650 PolarHBondContact O-N 3.15Å; K650-C652 PolarHBondContact O-N 3.23Å
651	Q	41.7	Very low	50.2	Low	111 Å²	111	78.9 Å²	78.9	52%	0.519	45%	0.445	S	S	.	.			trans	-66.9	123.2	173.6	-75.5	176.6	-11.6	0	0	110.6	C4 L653	C4-Q651 PolarHBondContact SG-OE1 2.9Å; Q651-L653 PolarHBondContact O-N 3.32Å
652	C	40.1	Very low	51.2	Low	67 Å²	67	72.2 Å²	72.2	45%	0.453	41%	0.413	S	S	.	.			trans	-84.2	106.9	171.1	-171.4	0	0	0	0	108.9	K650 T654 K655	K650-C652 PolarHBondContact O-N 3.23Å; C652-T654 PolarHBondContact O-N 3.42Å; C652-T654 PolarHBondContact SG-OG1 2.77Å; C652-K655 HydrophobicContact CB-CD 4.27Å; C652-K655 HydrophobicContact CB-CG 4.42Å
653	L	43.9	Very low	52.2	Low	111 Å²	111	71.2 Å²	71.2	58%	0.581	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-40.1	-170.9	-147.1	86.3	0	0	0	113.2	Q651 K655 S656	Q651-L653 PolarHBondContact O-N 3.32Å; L653-K655 PolarHBondContact O-N 3.44Å; L653-S656 PolarHBondContact O-N 3.4Å; L653-S656 PolarHBondContact O-OG 3.14Å
654	T	46.3	Very low	53.5	Low	96 Å²	96	69.8 Å²	69.8	59%	0.589	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-39.9	-176.2	38.5	0	0	0	0	113	C652 S656 I657	C652-T654 PolarHBondContact O-N 3.42Å; C652-T654 PolarHBondContact SG-OG1 2.77Å; T654-S656 VanDerWaalsContact C-N 3.33Å; T654-S656 PolarHBondContact O-N 3.48Å; T654-I657 PolarHBondContact O-N 2.88Å
655	K	54.3	Low	55.2	Low	56 Å²	56	65.2 Å²	65.2	24%	0.243	37%	0.371	C	S	.	.	H	α-helix	trans	-66.6	-31.6	-178.8	-63.8	-175.8	178.3	-171.6	0	113.3	T642 C652 L653 I657 E658	T642-K655 VanDerWaalsContact CG2-NZ 3.32Å; C652-K655 HydrophobicContact CB-CD 4.27Å; C652-K655 HydrophobicContact CB-CG 4.42Å; L653-K655 PolarHBondContact O-N 3.44Å; K655-I657 PolarHBondContact O-N 3.18Å; K655-E658 PolarHBondContact O-N 2.75Å
656	S	55.8	Low	57	Low	29 Å²	29	59.7 Å²	59.7	20%	0.203	34%	0.342	C	S	.	.	H	α-helix	trans	-64.8	-23.7	178.2	77.2	0	0	0	0	113.8	L653 T654 K660	L653-S656 PolarHBondContact O-N 3.4Å; L653-S656 PolarHBondContact O-OG 3.14Å; T654-S656 VanDerWaalsContact C-N 3.33Å; T654-S656 PolarHBondContact O-N 3.48Å; S656-K660 WeakPolarHBondContact O-CD 3.49Å; S656-K660 VanDerWaalsContact O-CG 3.28Å; S656-K660 WeakPolarHBondContact O-CG 3.24Å
657	I	58.7	Low	59.1	Low	85 Å²	85	57 Å²	57	44%	0.436	33%	0.328	S	S	.	.	H	α-helix	trans	-78.6	-38.3	-178.7	-53.2	178.7	0	0	0	109.9	H570 T654 K655 K660 S661	H570-I657 VanDerWaalsContact CE1-CG2 3.48Å; H570-I657 WeakPolarHBondContact CE1-CG2 3.28Å; H570-I657 VanDerWaalsContact NE2-CG2 3.34Å; H570-I657 WeakPolarHBondContact NE2-CG2 3.48Å; T654-I657 PolarHBondContact O-N 2.88Å; K655-I657 PolarHBondContact O-N 3.18Å; I657-K660 WeakPolarHBondContact O-CB 3.44Å; I657-K660 PolarHBondContact O-N 3.07Å; I657-S661 PolarHBondContact O-N 2.94Å; I657-S661 VanDerWaalsContact O-N 3.1Å; I657-S661 PolarHBondContact O-OG 3.5Å
658	E	64.4	Low	60.8	Low	45 Å²	45	52.7 Å²	52.7	21%	0.21	30%	0.295	C	S	.	.	H	α-helix	trans	-62.3	-46.7	-178.3	-70.4	172.6	179.3	0	0	112.2	H570 I635 K655 K660 S661 L662	H570-E658 WeakPolarHBondContact CD2-CG 3.42Å; H570-E658 IonicContact CD2-OE1 2.76Å; H570-E658 WeakPolarHBondContact NE2-CG 3.18Å; H570-E658 PolarHBondContact NE2-N 3.48Å; I635-E658 HydrophobicContact CG2-CB 3.85Å; K655-E658 PolarHBondContact O-N 2.75Å; E658-K660 VanDerWaalsContact C-N 3.31Å; E658-K660 PolarHBondContact O-N 3.41Å; E658-S661 WeakPolarHBondContact O-CB 3.48Å; E658-S661 PolarHBondContact O-N 3.28Å; E658-L662 WeakPolarHBondContact O-CG 3.28Å; E658-L662 PolarHBondContact O-N 2.94Å
659	L	65.4	Low	62.9	Low	4 Å²	4	48.3 Å²	48.3	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-34.4	175.2	-77.2	-178	0	0	0	114.1	E639 S661 L662 F663 V700 Y703	E639-L659 HydrophobicContact CG-CD1 4.48Å; E639-L659 WeakPolarHBondContact OE1-CD1 3.14Å; E639-L659 WeakPolarHBondContact OE2-CD1 3.32Å; E639-L659 WeakPolarHBondContact OE2-CD2 3.5Å; E639-L659 WeakPolarHBondContact OE2-CG 3.36Å; L659-S661 VanDerWaalsContact C-N 3.31Å; L659-L662 HydrophobicContact CD2-CD1 4.3Å; L659-L662 PolarHBondContact O-N 3.31Å; L659-F663 WeakPolarHBondContact O-CB 3.33Å; L659-F663 PolarHBondContact O-N 2.89Å; L659-V700 HydrophobicContact CD2-CB 4.41Å; L659-V700 HydrophobicContact CD2-CG1 4.23Å; L659-V700 HydrophobicContact CD2-CG2 3.96Å; L659-Y703 HydrophobicContact CD1-CD1 3.07Å; L659-Y703 HydrophobicContact CD1-CD2 3.68Å; L659-Y703 HydrophobicContact CD1-CE1 3.1Å; L659-Y703 HydrophobicContact CD1-CE2 3.72Å; L659-Y703 HydrophobicContact CD1-CG 3.33Å; L659-Y703 VanDerWaalsContact CD1-CZ 3.4Å
660	K	65.5	Low	64.7	Low	35 Å²	35	45.6 Å²	45.6	15%	0.152	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-44.2	176.1	-73.3	172.8	-176.4	175.3	0	109.9	F7 L10 S656 I657 E658 L662 F663 V664	F7-K660 HydrophobicContact CE2-CD 4.43Å; F7-K660 HydrophobicContact CE2-CG 3.95Å; F7-K660 HydrophobicContact CZ-CG 4.31Å; L10-K660 HydrophobicContact CD1-CG 4.37Å; S656-K660 WeakPolarHBondContact O-CD 3.49Å; S656-K660 VanDerWaalsContact O-CG 3.28Å; S656-K660 WeakPolarHBondContact O-CG 3.24Å; I657-K660 WeakPolarHBondContact O-CB 3.44Å; I657-K660 PolarHBondContact O-N 3.07Å; E658-K660 VanDerWaalsContact C-N 3.31Å; E658-K660 PolarHBondContact O-N 3.41Å; K660-L662 VanDerWaalsContact C-N 3.32Å; K660-L662 PolarHBondContact O-N 3.44Å; K660-F663 PolarHBondContact O-N 3.49Å; K660-V664 WeakPolarHBondContact O-CG2 3.17Å; K660-V664 PolarHBondContact O-N 2.78Å
661	S	70.3	Confident	66.7	Low	17 Å²	17	41.3 Å²	41.3	12%	0.119	22%	0.217	C	C	.	.	H	α-helix	trans	-60.4	-42.7	173.8	-62.9	0	0	0	0	111.4	H570 I577 I657 E658 L659 F663 V664 L665	H570-S661 PolarHBondContact CE1-OG 3.12Å; I577-S661 WeakPolarHBondContact CD1-O 3.43Å; I657-S661 PolarHBondContact O-N 2.94Å; I657-S661 VanDerWaalsContact O-N 3.1Å; I657-S661 PolarHBondContact O-OG 3.5Å; E658-S661 WeakPolarHBondContact O-CB 3.48Å; E658-S661 PolarHBondContact O-N 3.28Å; L659-S661 VanDerWaalsContact C-N 3.31Å; S661-F663 VanDerWaalsContact C-N 3.34Å; S661-F663 PolarHBondContact O-N 3.27Å; S661-V664 PolarHBondContact O-N 2.97Å; S661-L665 WeakPolarHBondContact O-CB 3.45Å; S661-L665 PolarHBondContact O-N 3.48Å
662	L	76.1	Confident	68.7	Low	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-38	175.2	-70.1	-179.1	0	0	0	113.1	I573 V632 I635 I636 E658 L659 K660 L665 Y666 F697 V700	I573-L662 HydrophobicContact CD1-CD2 3.73Å; I573-L662 HydrophobicContact CD1-CG 4.27Å; I573-L662 HydrophobicContact CG1-CD2 4.42Å; I573-L662 HydrophobicContact CG2-CD2 4.48Å; V632-L662 HydrophobicContact CB-CD2 4.45Å; V632-L662 HydrophobicContact CG2-CD2 3.78Å; I635-L662 HydrophobicContact CB-CD1 4.18Å; I635-L662 HydrophobicContact CD1-CD1 4.33Å; I635-L662 HydrophobicContact CG2-CD1 3.84Å; I636-L662 HydrophobicContact CG1-CD1 4.32Å; E658-L662 WeakPolarHBondContact O-CG 3.28Å; E658-L662 PolarHBondContact O-N 2.94Å; L659-L662 HydrophobicContact CD2-CD1 4.3Å; L659-L662 PolarHBondContact O-N 3.31Å; K660-L662 VanDerWaalsContact C-N 3.32Å; K660-L662 PolarHBondContact O-N 3.44Å; L662-L665 HydrophobicContact CD2-CD2 4.39Å; L662-L665 PolarHBondContact O-N 3.29Å; L662-Y666 PolarHBondContact O-N 3.5Å; L662-F697 HydrophobicContact CB-CE1 4.43Å; L662-F697 HydrophobicContact CD2-CE1 4.48Å; L662-F697 VanDerWaalsContact O-CE1 3.23Å; L662-F697 WeakPolarHBondContact O-CE1 3.49Å; L662-V700 HydrophobicContact CB-CG1 4.35Å; L662-V700 HydrophobicContact CB-CG2 4.11Å; L662-V700 HydrophobicContact CD1-CG2 4.11Å
663	F	73.2	Confident	70.6	Confident	8 Å²	8	34.1 Å²	34.1	4%	0.035	18%	0.177	C	C	.	.	H	α-helix	trans	-67.4	-42.2	175.7	-171.1	-100	0	0	0	112	L659 K660 S661 L665 Y666 L667 V700 I701 W704 T766 I770	L659-F663 WeakPolarHBondContact O-CB 3.33Å; L659-F663 PolarHBondContact O-N 2.89Å; K660-F663 PolarHBondContact O-N 3.49Å; S661-F663 VanDerWaalsContact C-N 3.34Å; S661-F663 PolarHBondContact O-N 3.27Å; F663-L665 VanDerWaalsContact C-N 3.32Å; F663-L665 PolarHBondContact O-N 3.01Å; F663-Y666 WeakPolarHBondContact O-CB 3.38Å; F663-Y666 PolarHBondContact O-N 3.47Å; F663-L667 HydrophobicContact CD1-CD1 4.04Å; F663-L667 HydrophobicContact CD1-CG 4.47Å; F663-L667 HydrophobicContact CE1-CD1 3.64Å; F663-L667 HydrophobicContact CE1-CG 4.19Å; F663-L667 HydrophobicContact CZ-CD1 4.34Å; F663-L667 WeakPolarHBondContact O-CG 3.32Å; F663-L667 PolarHBondContact O-N 2.87Å; F663-L667 VanDerWaalsContact O-N 3.08Å; F663-V700 HydrophobicContact CB-CG1 4.21Å; F663-V700 HydrophobicContact CD2-CG1 4.43Å; F663-I701 HydrophobicContact CD2-CD1 4.07Å; F663-I701 HydrophobicContact CE2-CD1 3.8Å; F663-W704 HydrophobicContact CE2-CD2 4.5Å; F663-W704 HydrophobicContact CE2-CG 4.35Å; F663-T766 HydrophobicContact CZ-CG2 4.14Å; F663-I770 HydrophobicContact CE2-CD1 3.72Å; F663-I770 HydrophobicContact CE2-CG1 3.87Å; F663-I770 HydrophobicContact CZ-CD1 3.75Å; F663-I770 HydrophobicContact CZ-CG1 3.71Å
664	V	75.5	Confident	72.2	Confident	30 Å²	30	31.1 Å²	31.1	18%	0.182	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-43.7	173.2	172.1	0	0	0	0	110.8	L15 I577 K660 S661 Y666 L667 L668	L15-V664 HydrophobicContact CD2-CG2 3.88Å; I577-V664 HydrophobicContact CD1-CB 4.33Å; I577-V664 HydrophobicContact CD1-CG1 4.21Å; I577-V664 HydrophobicContact CG1-CG1 4.49Å; I577-V664 HydrophobicContact CG2-CG1 4.1Å; K660-V664 WeakPolarHBondContact O-CG2 3.17Å; K660-V664 PolarHBondContact O-N 2.78Å; S661-V664 PolarHBondContact O-N 2.97Å; V664-Y666 VanDerWaalsContact C-N 3.34Å; V664-Y666 PolarHBondContact O-N 3.2Å; V664-L667 PolarHBondContact O-N 2.96Å; V664-L668 HydrophobicContact CG1-CD1 3.88Å; V664-L668 HydrophobicContact CG1-CG 4.37Å; V664-L668 WeakPolarHBondContact O-CG 3.43Å; V664-L668 PolarHBondContact O-N 3.41Å
665	L	81	Confident	73.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-43.9	177.1	179.2	59.8	0	0	0	111.5	I573 L576 I577 I580 L628 S661 L662 F663 L668 L669 F697	I573-L665 HydrophobicContact CG2-CD2 4.41Å; L576-L665 HydrophobicContact CD2-CD1 3.91Å; L576-L665 HydrophobicContact CD2-CD2 4.04Å; L576-L665 HydrophobicContact CG-CD1 3.9Å; I577-L665 HydrophobicContact CD1-CB 4.34Å; I577-L665 HydrophobicContact CG1-CB 3.96Å; I577-L665 HydrophobicContact CG1-CD1 4.15Å; I580-L665 HydrophobicContact CD1-CD1 3.48Å; I580-L665 VanDerWaalsContact CD1-CD1 3.48Å; L628-L665 HydrophobicContact CD1-CD2 3.76Å; S661-L665 WeakPolarHBondContact O-CB 3.45Å; S661-L665 PolarHBondContact O-N 3.48Å; L662-L665 HydrophobicContact CD2-CD2 4.39Å; L662-L665 PolarHBondContact O-N 3.29Å; F663-L665 VanDerWaalsContact C-N 3.32Å; F663-L665 PolarHBondContact O-N 3.01Å; L665-L668 PolarHBondContact O-N 3.28Å; L665-L669 HydrophobicContact CD1-CD1 4.14Å; L665-L669 HydrophobicContact CD1-CG 4.23Å; L665-L669 HydrophobicContact CG-CD1 4.08Å; L665-L669 WeakPolarHBondContact O-CB 3.47Å; L665-L669 WeakPolarHBondContact O-CG 3.36Å; L665-L669 PolarHBondContact O-N 2.92Å; L665-F697 HydrophobicContact CD2-CZ 4.27Å; L665-F697 HydrophobicContact CG-CZ 4.22Å
666	Y	81.8	Confident	74.5	Confident	1 Å²	1	26.3 Å²	26.3	0%	0.004	13%	0.133	C	C	.	.	H	α-helix	trans	-56.8	-51	174.1	171.5	-98.5	0	0	0	111.8	L662 F663 V664 L668 L669 K670 W693 F697 I770 W772	L662-Y666 PolarHBondContact O-N 3.5Å; F663-Y666 WeakPolarHBondContact O-CB 3.38Å; F663-Y666 PolarHBondContact O-N 3.47Å; V664-Y666 VanDerWaalsContact C-N 3.34Å; V664-Y666 PolarHBondContact O-N 3.2Å; Y666-L668 VanDerWaalsContact C-N 3.3Å; Y666-L668 PolarHBondContact O-N 3.5Å; Y666-L669 PolarHBondContact O-N 3.5Å; Y666-K670 WeakPolarHBondContact O-CB 3.35Å; Y666-K670 PolarHBondContact O-N 3.33Å; Y666-W693 HydrophobicContact CD2-CH2 4.05Å; Y666-W693 AromaticContact CD2-CZ3 3.72Å; Y666-W693 HydrophobicContact CD2-CZ3 3.72Å; Y666-W693 HydrophobicContact CE2-CH2 4.03Å; Y666-W693 HydrophobicContact CE2-CZ3 4.02Å; Y666-F697 HydrophobicContact CD2-CB 3.9Å; Y666-F697 HydrophobicContact CD2-CD1 4.41Å; Y666-F697 AromaticContact CD2-CD2 3.89Å; Y666-F697 HydrophobicContact CD2-CD2 3.89Å; Y666-F697 AromaticContact CD2-CG 3.8Å; Y666-F697 HydrophobicContact CD2-CG 3.8Å; Y666-F697 HydrophobicContact CG-CB 4.46Å; Y666-F697 HydrophobicContact CG-CD1 4.48Å; Y666-F697 HydrophobicContact CG-CG 4.29Å; Y666-I770 HydrophobicContact CE1-CB 4.42Å; Y666-I770 HydrophobicContact CE1-CG2 3.81Å; Y666-I770 WeakPolarHBondContact CE1-O 3.5Å; Y666-I770 PolarHBondContact OH-O 3.23Å; Y666-W772 HydrophobicContact CE2-CE3 4.14Å; Y666-W772 AromaticContact CE2-CZ3 3.76Å; Y666-W772 HydrophobicContact CE2-CZ3 3.76Å; Y666-W772 AromaticContact CZ-CE3 3.83Å; Y666-W772 AromaticContact CZ-CZ3 3.89Å
667	L	80.1	Confident	74.9	Confident	26 Å²	26	29.2 Å²	29.2	14%	0.136	15%	0.146	C	C	.	.	H	α-helix	trans	-62.3	-37.3	-179.6	-68.3	179.2	0	0	0	112.1	L15 F663 V664 K671 L769	L15-L667 HydrophobicContact CD1-CD1 4.07Å; F663-L667 HydrophobicContact CD1-CD1 4.04Å; F663-L667 HydrophobicContact CD1-CG 4.47Å; F663-L667 HydrophobicContact CE1-CD1 3.64Å; F663-L667 HydrophobicContact CE1-CG 4.19Å; F663-L667 HydrophobicContact CZ-CD1 4.34Å; F663-L667 WeakPolarHBondContact O-CG 3.32Å; F663-L667 PolarHBondContact O-N 2.87Å; F663-L667 VanDerWaalsContact O-N 3.08Å; V664-L667 PolarHBondContact O-N 2.96Å; L667-K671 VanDerWaalsContact O-CB 3.27Å; L667-K671 WeakPolarHBondContact O-CB 3.38Å; L667-K671 PolarHBondContact O-N 3.02Å; L667-L769 HydrophobicContact CD1-CD2 4.38Å; L667-L769 HydrophobicContact CD2-CG 4.39Å
668	L	81.8	Confident	75	Confident	21 Å²	21	32 Å²	32	11%	0.11	16%	0.16	C	C	.	.	H	α-helix	trans	-69.6	-42.6	177.1	-72.7	171.4	0	0	0	112.5	I577 I580 K581 I584 V664 L665 Y666 K671 F672	I577-L668 HydrophobicContact CB-CD1 4.3Å; I577-L668 HydrophobicContact CG1-CD1 4.45Å; I577-L668 HydrophobicContact CG2-CD1 3.7Å; I580-L668 HydrophobicContact CG2-CB 3.9Å; K581-L668 HydrophobicContact CD-CD1 4.39Å; K581-L668 HydrophobicContact CG-CD1 3.81Å; K581-L668 HydrophobicContact CG-CD2 3.82Å; I584-L668 HydrophobicContact CD1-CD2 4.02Å; V664-L668 HydrophobicContact CG1-CD1 3.88Å; V664-L668 HydrophobicContact CG1-CG 4.37Å; V664-L668 WeakPolarHBondContact O-CG 3.43Å; V664-L668 PolarHBondContact O-N 3.41Å; L665-L668 PolarHBondContact O-N 3.28Å; Y666-L668 VanDerWaalsContact C-N 3.3Å; Y666-L668 PolarHBondContact O-N 3.5Å; L668-K671 PolarHBondContact O-N 2.67Å; L668-F672 WeakPolarHBondContact O-CB 3.42Å; L668-F672 PolarHBondContact O-N 3.19Å
669	L	83.5	Confident	74.7	Confident	13 Å²	13	34.2 Å²	34.2	7%	0.068	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-43.2	175	-74.7	170.4	0	0	0	111.3	I580 L628 L665 Y666 F672 E673 W693 F697	I580-L669 HydrophobicContact CD1-CD2 3.57Å; I580-L669 HydrophobicContact CD1-CG 3.94Å; L628-L669 HydrophobicContact CD2-CD1 4.01Å; L665-L669 HydrophobicContact CD1-CD1 4.14Å; L665-L669 HydrophobicContact CD1-CG 4.23Å; L665-L669 HydrophobicContact CG-CD1 4.08Å; L665-L669 WeakPolarHBondContact O-CB 3.47Å; L665-L669 WeakPolarHBondContact O-CG 3.36Å; L665-L669 PolarHBondContact O-N 2.92Å; Y666-L669 PolarHBondContact O-N 3.5Å; L669-F672 WeakPolarHBondContact O-CB 3.49Å; L669-F672 PolarHBondContact O-N 3.06Å; L669-E673 WeakPolarHBondContact O-CB 3.26Å; L669-E673 PolarHBondContact O-N 3.42Å; L669-W693 HydrophobicContact CB-CE3 4.39Å; L669-W693 HydrophobicContact CB-CH2 3.59Å; L669-W693 HydrophobicContact CB-CZ2 4.2Å; L669-W693 HydrophobicContact CB-CZ3 3.69Å; L669-W693 HydrophobicContact CD1-CE3 4.14Å; L669-W693 HydrophobicContact CD1-CZ3 3.99Å; L669-F697 HydrophobicContact CD1-CE2 4.2Å; L669-F697 HydrophobicContact CD1-CZ 4.14Å
670	K	80.9	Confident	74.3	Confident	17 Å²	17	35.3 Å²	35.3	7%	0.074	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-43.6	175.9	-176.1	64.3	170.8	176.6	0	111.4	Y666 F672 E673 N674 W693 D771 S773	Y666-K670 WeakPolarHBondContact O-CB 3.35Å; Y666-K670 PolarHBondContact O-N 3.33Å; K670-F672 VanDerWaalsContact C-N 3.35Å; K670-F672 PolarHBondContact O-N 2.66Å; K670-E673 PolarHBondContact O-N 2.78Å; K670-N674 WeakPolarHBondContact O-CB 3.05Å; K670-N674 VanDerWaalsContact O-CG 3.22Å; K670-N674 PolarHBondContact O-N 2.73Å; K670-N674 PolarHBondContact O-OD1 2.68Å; K670-W693 HydrophobicContact CB-CH2 4.16Å; K670-D771 WeakPolarHBondContact CE-O 3.23Å; K670-D771 WeakPolarHBondContact CE-OD2 3.11Å; K670-D771 PolarHBondContact NZ-O 3.5Å; K670-D771 VanDerWaalsContact NZ-O 3.17Å; K670-D771 IonicContact NZ-OD2 3.49Å; K670-D771 PolarHBondContact NZ-OD2 3.49Å; K670-S773 PolarHBondContact NZ-OG 3.42Å
671	K	80.6	Confident	73.8	Confident	96 Å²	96	44.2 Å²	44.2	42%	0.417	21%	0.213	S	C	.	.	H	α-helix	trans	-58.1	-49.1	173.4	-177.8	176.3	175.8	-172.9	0	110.2	I584 E588 L667 L668 E673 N674 M675	I584-K671 HydrophobicContact CD1-CB 4.36Å; I584-K671 HydrophobicContact CD1-CD 4.26Å; I584-K671 HydrophobicContact CD1-CG 4.29Å; I584-K671 HydrophobicContact CG2-CD 4.34Å; E588-K671 VanDerWaalsContact OE1-CE 3.22Å; E588-K671 WeakPolarHBondContact OE1-CE 3.33Å; E588-K671 IonicContact OE1-NZ 2.89Å; E588-K671 PolarHBondContact OE1-NZ 2.95Å; L667-K671 VanDerWaalsContact O-CB 3.27Å; L667-K671 WeakPolarHBondContact O-CB 3.38Å; L667-K671 PolarHBondContact O-N 3.02Å; L668-K671 PolarHBondContact O-N 2.67Å; K671-E673 PolarHBondContact O-N 3.42Å; K671-N674 PolarHBondContact O-N 2.99Å; K671-M675 VanDerWaalsContact O-CG 3.32Å; K671-M675 WeakPolarHBondContact O-CG 3.4Å; K671-M675 PolarHBondContact O-N 2.87Å; K671-M675 VanDerWaalsContact O-N 3.1Å
672	F	83.2	Confident	72.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.3	-50	177.7	-176.1	-90.9	0	0	0	111.3	I580 L583 I584 L587 Y611 A615 L618 L668 L669 K670 N674 M675 L688	I580-F672 HydrophobicContact CG2-CB 4.45Å; L583-F672 HydrophobicContact CB-CE2 4.18Å; I584-F672 HydrophobicContact CD1-CB 4.28Å; I584-F672 HydrophobicContact CG1-CB 4.27Å; I584-F672 HydrophobicContact CG1-CD2 4.01Å; L587-F672 HydrophobicContact CD1-CD2 3.95Å; L587-F672 HydrophobicContact CD1-CE2 3.45Å; L587-F672 VanDerWaalsContact CD1-CE2 3.45Å; L587-F672 HydrophobicContact CD1-CZ 4.21Å; Y611-F672 HydrophobicContact CD2-CE1 4.2Å; Y611-F672 HydrophobicContact CD2-CZ 4.1Å; Y611-F672 AromaticContact CE2-CD1 3.9Å; Y611-F672 HydrophobicContact CE2-CD1 3.9Å; Y611-F672 AromaticContact CE2-CE1 3.6Å; Y611-F672 HydrophobicContact CE2-CE1 3.6Å; Y611-F672 HydrophobicContact CE2-CG 4.5Å; Y611-F672 AromaticContact CE2-CZ 3.97Å; Y611-F672 HydrophobicContact CE2-CZ 3.97Å; Y611-F672 VanDerWaalsContact CE2-O 3.3Å; Y611-F672 WeakPolarHBondContact CE2-O 3.36Å; A615-F672 HydrophobicContact CB-CE1 4.33Å; L618-F672 HydrophobicContact CD1-CD1 4.43Å; L618-F672 HydrophobicContact CD1-CE1 3.9Å; L618-F672 HydrophobicContact CD1-CE2 4.13Å; L618-F672 HydrophobicContact CD1-CZ 3.74Å; L668-F672 WeakPolarHBondContact O-CB 3.42Å; L668-F672 PolarHBondContact O-N 3.19Å; L669-F672 WeakPolarHBondContact O-CB 3.49Å; L669-F672 PolarHBondContact O-N 3.06Å; K670-F672 VanDerWaalsContact C-N 3.35Å; K670-F672 PolarHBondContact O-N 2.66Å; F672-N674 PolarHBondContact O-N 3.4Å; F672-M675 WeakPolarHBondContact O-CB 3.03Å; F672-M675 PolarHBondContact O-N 3.3Å; F672-L688 HydrophobicContact CD1-CD1 4.12Å; F672-L688 HydrophobicContact CD1-CD2 4.43Å; F672-L688 HydrophobicContact CE1-CD1 3.75Å
673	E	79.5	Confident	71.5	Confident	27 Å²	27	54.3 Å²	54.3	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-47.3	177.2	-174.7	170.1	-131.7	0	0	112.2	L669 K670 K671 M675 F676 L688 W693	L669-E673 WeakPolarHBondContact O-CB 3.26Å; L669-E673 PolarHBondContact O-N 3.42Å; K670-E673 PolarHBondContact O-N 2.78Å; K671-E673 PolarHBondContact O-N 3.42Å; E673-M675 PolarHBondContact O-N 2.89Å; E673-F676 WeakPolarHBondContact O-CB 3.31Å; E673-F676 PolarHBondContact O-N 3.24Å; E673-L688 HydrophobicContact CG-CB 4.41Å; E673-W693 PolarHBondContact OE1-NE1 3.48Å; E673-W693 VanDerWaalsContact OE2-CZ2 3.31Å; E673-W693 WeakPolarHBondContact OE2-CZ2 3.37Å; E673-W693 PolarHBondContact OE2-NE1 2.67Å
674	N	78.2	Confident	70.4	Confident	48 Å²	48	59 Å²	59	26%	0.257	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-20.7	180	-72.3	-0.5	0	0	0	113.5	K670 K671 F672 F676 D677 I678	K670-N674 WeakPolarHBondContact O-CB 3.05Å; K670-N674 VanDerWaalsContact O-CG 3.22Å; K670-N674 PolarHBondContact O-N 2.73Å; K670-N674 PolarHBondContact O-OD1 2.68Å; K671-N674 PolarHBondContact O-N 2.99Å; F672-N674 PolarHBondContact O-N 3.4Å; N674-F676 PolarHBondContact O-N 3.17Å; N674-D677 PolarHBondContact O-N 3.34Å; N674-I678 PolarHBondContact O-N 3.39Å
675	M	77.3	Confident	69.1	Low	21 Å²	21	63.5 Å²	63.5	10%	0.103	32%	0.322	C	S	.	.	H	α-helix	trans	-61.3	-27.6	175.8	-69.7	-175.5	79.9	0	0	112.1	I584 L587 E588 F607 K671 F672 E673	I584-M675 HydrophobicContact CB-SD 4.41Å; I584-M675 HydrophobicContact CG1-SD 4.22Å; I584-M675 HydrophobicContact CG2-SD 4.01Å; L587-M675 HydrophobicContact CB-CE 3.58Å; L587-M675 HydrophobicContact CB-SD 4.17Å; L587-M675 HydrophobicContact CD1-SD 4.22Å; E588-M675 HydrophobicContact CB-CE 4.48Å; E588-M675 HydrophobicContact CG-CE 3.6Å; F607-M675 HydrophobicContact CE2-CE 4.11Å; F607-M675 HydrophobicContact CZ-CB 4.18Å; F607-M675 WeakPolarHBondContact CZ-O 3.29Å; K671-M675 VanDerWaalsContact O-CG 3.32Å; K671-M675 WeakPolarHBondContact O-CG 3.4Å; K671-M675 PolarHBondContact O-N 2.87Å; K671-M675 VanDerWaalsContact O-N 3.1Å; F672-M675 WeakPolarHBondContact O-CB 3.03Å; F672-M675 PolarHBondContact O-N 3.3Å; E673-M675 PolarHBondContact O-N 2.89Å
676	F	71.8	Confident	67.7	Low	30 Å²	30	71.5 Å²	71.5	13%	0.132	36%	0.357	C	S	.	.	H	α-helix	trans	-70.7	-43.8	176.1	-169.4	-101.4	0	0	0	112.2	Y611 E673 N674 I678 I680	Y611-F676 HydrophobicContact CD1-CB 4.3Å; Y611-F676 AromaticContact CD1-CD2 3.3Å; Y611-F676 HydrophobicContact CD1-CD2 3.3Å; Y611-F676 AromaticContact CD1-CE2 3.92Å; Y611-F676 HydrophobicContact CD1-CE2 3.92Å; Y611-F676 HydrophobicContact CD1-CG 4.16Å; Y611-F676 HydrophobicContact CE1-CB 3.71Å; Y611-F676 AromaticContact CE1-CD2 3.26Å; Y611-F676 HydrophobicContact CE1-CD2 3.26Å; Y611-F676 HydrophobicContact CE1-CE2 4.01Å; Y611-F676 AromaticContact CE1-CG 3.7Å; Y611-F676 HydrophobicContact CE1-CG 3.7Å; Y611-F676 HydrophobicContact CE2-CB 4.21Å; Y611-F676 HydrophobicContact CG-CD2 4.14Å; E673-F676 WeakPolarHBondContact O-CB 3.31Å; E673-F676 PolarHBondContact O-N 3.24Å; N674-F676 PolarHBondContact O-N 3.17Å; F676-I678 PolarHBondContact O-N 3.36Å; F676-I680 HydrophobicContact CD1-CD1 4.37Å; F676-I680 HydrophobicContact CD2-CD1 3.51Å; F676-I680 HydrophobicContact CE1-CD1 4.07Å; F676-I680 HydrophobicContact CE2-CD1 3.18Å; F676-I680 HydrophobicContact CG-CD1 4.13Å; F676-I680 HydrophobicContact CZ-CD1 3.49Å; F676-I680 VanDerWaalsContact CZ-CD1 3.49Å; F676-I680 PolarHBondContact O-N 3.26Å
677	D	63.6	Low	66.4	Low	89 Å²	89	77.4 Å²	77.4	48%	0.476	38%	0.382	S	S	.	.	H	α-helix	trans	-65.3	-36.1	-174.7	-77.5	-20.9	0	0	0	113.3	N674 K679	N674-D677 PolarHBondContact O-N 3.34Å; D677-K679 VanDerWaalsContact C-N 3.27Å; D677-K679 PolarHBondContact O-N 3.32Å
678	I	61.8	Low	65.1	Low	143 Å²	143	77.5 Å²	77.5	73%	0.733	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.2	-174.7	-66.6	171	0	0	0	112.3	N674 F676	N674-I678 PolarHBondContact O-N 3.39Å; F676-I678 PolarHBondContact O-N 3.36Å
679	K	58	Low	63.8	Low	92 Å²	92	76.9 Å²	76.9	40%	0.4	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-27.8	-173.1	-82.2	-162.2	165.6	-175.3	0	115.4	C591 F607 D677 K681	C591-K679 PolarHBondContact O-NZ 3.41Å; C591-K679 VanDerWaalsContact SG-CD 3.58Å; C591-K679 WeakPolarHBondContact SG-CE 3.46Å; C591-K679 PolarHBondContact SG-NZ 3.1Å; F607-K679 HydrophobicContact CD1-CD 4.23Å; F607-K679 HydrophobicContact CE1-CB 4.34Å; F607-K679 HydrophobicContact CE1-CD 4.34Å; D677-K679 VanDerWaalsContact C-N 3.27Å; D677-K679 PolarHBondContact O-N 3.32Å; K679-K681 PolarHBondContact O-N 3.23Å
680	I	57.1	Low	62.6	Low	28 Å²	28	84.7 Å²	84.7	14%	0.144	42%	0.421	C	S	.	.			trans	-101.5	90.2	-173.7	-57.5	174	0	0	0	109.1	I608 F676 S682	I608-I680 HydrophobicContact CB-CD1 4.27Å; I608-I680 HydrophobicContact CD1-CD1 3.76Å; I608-I680 HydrophobicContact CD1-CG1 3.74Å; I608-I680 HydrophobicContact CG1-CD1 3.68Å; I608-I680 HydrophobicContact CG1-CG1 3.98Å; I608-I680 HydrophobicContact CG2-CD1 3.81Å; F676-I680 HydrophobicContact CD1-CD1 4.37Å; F676-I680 HydrophobicContact CD2-CD1 3.51Å; F676-I680 HydrophobicContact CE1-CD1 4.07Å; F676-I680 HydrophobicContact CE2-CD1 3.18Å; F676-I680 HydrophobicContact CG-CD1 4.13Å; F676-I680 HydrophobicContact CZ-CD1 3.49Å; F676-I680 VanDerWaalsContact CZ-CD1 3.49Å; F676-I680 PolarHBondContact O-N 3.26Å; I680-S682 VanDerWaalsContact CG2-CB 3.47Å; I680-S682 WeakPolarHBondContact CG2-OG 3.34Å; I680-S682 PolarHBondContact O-N 2.89Å
681	K	54.8	Low	61.6	Low	222 Å²	222	86.7 Å²	86.7	97%	0.965	43%	0.43	S	S	*	.			trans	-72.1	42.7	164.6	-67.8	-174.5	177.3	-178.2	0	111.6	K679	K679-K681 PolarHBondContact O-N 3.23Å
682	S	48.4	Very low	61	Low	51 Å²	51	85 Å²	85	36%	0.357	43%	0.426	S	S	.	.			trans	-102.7	150.2	179	87.5	0	0	0	0	111.1	I680 E684	I680-S682 VanDerWaalsContact CG2-CB 3.47Å; I680-S682 WeakPolarHBondContact CG2-OG 3.34Å; I680-S682 PolarHBondContact O-N 2.89Å; S682-E684 PolarHBondContact O-N 3.46Å
683	N	49.6	Very low	60.6	Low	177 Å²	177	85.3 Å²	85.3	95%	0.947	43%	0.427	S	S	*	.			trans	-77.4	15.2	177.9	-75	-14.5	0	0	0	113.3
684	E	49.6	Very low	60.6	Low	108 Å²	108	85.4 Å²	85.4	51%	0.505	43%	0.427	S	S	.	.	S	Bend	trans	-73	145.9	176.5	-73.6	-170.2	168.2	0	0	111	K612 S682 K686	K612-E684 IonicContact NZ-OE2 3.75Å; K612-E684 PolarHBondContact NZ-OE2 3.25Å; S682-E684 PolarHBondContact O-N 3.46Å; E684-K686 PolarHBondContact O-N 3.37Å
685	P	47.6	Very low	60.5	Low	123 Å²	123	86.3 Å²	86.3	80%	0.799	43%	0.434	S	S	*	.			trans	-59.6	128.8	-172.9	21.1	-31.1	0	0	0	112.9	K687	P685-K687 PolarHBondContact O-N 2.77Å; P685-K687 VanDerWaalsContact O-N 3.16Å
686	K	52.5	Low	60.5	Low	169 Å²	169	86.7 Å²	86.7	74%	0.735	43%	0.434	S	S	*	.			trans	-81.2	30	-159.8	-59.8	179.1	174.1	179.8	0	116.9	E684	E684-K686 PolarHBondContact O-N 3.37Å
687	K	54.3	Low	61	Low	124 Å²	124	85.3 Å²	85.3	54%	0.539	43%	0.428	S	S	.	.			trans	-128	130.6	-175.4	-64.7	-168.1	174.6	-170	0	112.3	P685 T689 D692	P685-K687 PolarHBondContact O-N 2.77Å; P685-K687 VanDerWaalsContact O-N 3.16Å; K687-T689 VanDerWaalsContact CB-O 3.28Å; K687-T689 WeakPolarHBondContact CB-O 3.43Å; K687-T689 PolarHBondContact O-N 3.32Å; K687-T689 VanDerWaalsContact O-N 3.17Å; K687-D692 IonicContact NZ-OD1 2.82Å; K687-D692 PolarHBondContact NZ-OD1 3.23Å
688	L	52.6	Low	61.7	Low	28 Å²	28	87.1 Å²	87.1	15%	0.147	43%	0.428	C	S	.	.	S	Bend	trans	-54	-29.8	169.9	-170.7	78.8	0	0	0	111	Y611 A615 F672 E673	Y611-L688 HydrophobicContact CE1-CD1 4.21Å; Y611-L688 HydrophobicContact CE2-CD1 4.43Å; Y611-L688 WeakPolarHBondContact OH-CD1 3.09Å; A615-L688 HydrophobicContact CB-CD1 3.45Å; A615-L688 VanDerWaalsContact CB-CD1 3.45Å; A615-L688 HydrophobicContact CB-CG 4.46Å; F672-L688 HydrophobicContact CD1-CD1 4.12Å; F672-L688 HydrophobicContact CD1-CD2 4.43Å; F672-L688 HydrophobicContact CE1-CD1 3.75Å; E673-L688 HydrophobicContact CG-CB 4.41Å
689	T	54.5	Low	62.3	Low	8 Å²	8	82 Å²	82	5%	0.049	40%	0.404	C	S	.	.	S	Bend	trans	-150.3	151	-175.9	52.9	0	0	0	0	112	H619 I623 K687 F691	H619-T689 WeakPolarHBondContact ND1-CG2 3.5Å; I623-T689 HydrophobicContact CD1-CG2 4.09Å; I623-T689 HydrophobicContact CG2-CG2 4.41Å; K687-T689 VanDerWaalsContact CB-O 3.28Å; K687-T689 WeakPolarHBondContact CB-O 3.43Å; K687-T689 PolarHBondContact O-N 3.32Å; K687-T689 VanDerWaalsContact O-N 3.17Å; T689-F691 HydrophobicContact CG2-CD1 4.39Å; T689-F691 HydrophobicContact CG2-CE1 3.52Å; T689-F691 HydrophobicContact CG2-CZ 3.89Å; T689-F691 PolarHBondContact O-N 3.02Å; T689-F691 WeakPolarHBondContact OG1-CE1 3Å; T689-F691 PolarHBondContact OG1-O 3.08Å
690	D	58	Low	63.2	Low	177 Å²	177	77.8 Å²	77.8	95%	0.947	39%	0.386	S	S	*	.	S	Bend	trans	-67.1	4.2	175.1	-79.1	-22.2	0	0	0	114.6
691	F	60.6	Low	64.4	Low	60 Å²	60	76.4 Å²	76.4	26%	0.263	38%	0.379	S	S	.	.	S	Bend	trans	-134.3	151.9	-178.8	73.2	-83.8	0	0	0	111.9	H619 I623 T689 W693 W696	H619-F691 AromaticContact CE1-CE1 3.83Å; H619-F691 AromaticContact ND1-CE1 4Å; I623-F691 HydrophobicContact CB-CZ 4.23Å; I623-F691 HydrophobicContact CD1-CZ 4.3Å; I623-F691 HydrophobicContact CG1-CZ 4.41Å; I623-F691 HydrophobicContact CG2-CD1 4.41Å; I623-F691 HydrophobicContact CG2-CE1 3.13Å; I623-F691 HydrophobicContact CG2-CE2 4.1Å; I623-F691 HydrophobicContact CG2-CZ 2.98Å; T689-F691 HydrophobicContact CG2-CD1 4.39Å; T689-F691 HydrophobicContact CG2-CE1 3.52Å; T689-F691 HydrophobicContact CG2-CZ 3.89Å; T689-F691 PolarHBondContact O-N 3.02Å; T689-F691 WeakPolarHBondContact OG1-CE1 3Å; T689-F691 PolarHBondContact OG1-O 3.08Å; F691-W693 HydrophobicContact CD2-CB 4.35Å; F691-W693 HydrophobicContact CE2-CB 3.56Å; F691-W693 HydrophobicContact CZ-CB 4.12Å; F691-W693 PolarHBondContact O-N 2.7Å; F691-W693 VanDerWaalsContact O-N 3.08Å; F691-W696 HydrophobicContact CD2-CH2 4.26Å; F691-W696 AromaticContact CD2-CZ2 3.96Å; F691-W696 HydrophobicContact CD2-CZ2 3.96Å; F691-W696 AromaticContact CE2-CH2 3.47Å; F691-W696 HydrophobicContact CE2-CH2 3.47Å; F691-W696 VanDerWaalsContact CE2-CH2 3.47Å; F691-W696 AromaticContact CE2-CZ2 3.62Å; F691-W696 HydrophobicContact CE2-CZ2 3.62Å; F691-W696 HydrophobicContact CE2-CZ3 4.19Å; F691-W696 HydrophobicContact CZ-CH2 4.12Å
692	D	68.4	Low	65.6	Low	60 Å²	60	67.2 Å²	67.2	32%	0.321	34%	0.342	S	S	.	.			trans	-85.2	73	-171.4	-65.7	-28.8	0	0	0	112.3	K687 Y694 T695	K687-D692 IonicContact NZ-OD1 2.82Å; K687-D692 PolarHBondContact NZ-OD1 3.23Å; D692-Y694 HydrophobicContact CB-CD1 4.38Å; D692-Y694 HydrophobicContact CB-CE1 3.7Å; D692-Y694 HydrophobicContact CB-CE2 4.05Å; D692-Y694 PolarHBondContact O-N 3.23Å; D692-Y694 VanDerWaalsContact O-N 3.09Å; D692-Y694 PolarHBondContact OD1-OH 3.02Å; D692-Y694 PolarHBondContact OD2-OH 3.44Å; D692-T695 HydrophobicContact CB-CG2 3.91Å; D692-T695 WeakPolarHBondContact O-CB 3.46Å; D692-T695 WeakPolarHBondContact O-CG2 3.14Å; D692-T695 PolarHBondContact O-N 3.13Å; D692-T695 PolarHBondContact O-OG1 3.45Å
693	W	74.9	Confident	66.8	Low	7 Å²	7	65.8 Å²	65.8	3%	0.027	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-52.2	-31.9	-176.5	66	-94.4	0	0	0	114.5	Y666 L669 K670 E673 F691 T695 W696 F697	Y666-W693 HydrophobicContact CD2-CH2 4.05Å; Y666-W693 AromaticContact CD2-CZ3 3.72Å; Y666-W693 HydrophobicContact CD2-CZ3 3.72Å; Y666-W693 HydrophobicContact CE2-CH2 4.03Å; Y666-W693 HydrophobicContact CE2-CZ3 4.02Å; L669-W693 HydrophobicContact CB-CE3 4.39Å; L669-W693 HydrophobicContact CB-CH2 3.59Å; L669-W693 HydrophobicContact CB-CZ2 4.2Å; L669-W693 HydrophobicContact CB-CZ3 3.69Å; L669-W693 HydrophobicContact CD1-CE3 4.14Å; L669-W693 HydrophobicContact CD1-CZ3 3.99Å; K670-W693 HydrophobicContact CB-CH2 4.16Å; E673-W693 PolarHBondContact OE1-NE1 3.48Å; E673-W693 VanDerWaalsContact OE2-CZ2 3.31Å; E673-W693 WeakPolarHBondContact OE2-CZ2 3.37Å; E673-W693 PolarHBondContact OE2-NE1 2.67Å; F691-W693 HydrophobicContact CD2-CB 4.35Å; F691-W693 HydrophobicContact CE2-CB 3.56Å; F691-W693 HydrophobicContact CZ-CB 4.12Å; F691-W693 PolarHBondContact O-N 2.7Å; F691-W693 VanDerWaalsContact O-N 3.08Å; W693-T695 PolarHBondContact O-N 3.1Å; W693-T695 VanDerWaalsContact O-N 3.16Å; W693-W696 WeakPolarHBondContact O-CB 3.09Å; W693-W696 PolarHBondContact O-N 3.34Å; W693-F697 HydrophobicContact CE3-CD2 4.09Å; W693-F697 AromaticContact CE3-CE2 3.85Å; W693-F697 HydrophobicContact CE3-CE2 3.85Å; W693-F697 HydrophobicContact CZ3-CD2 4.06Å; W693-F697 AromaticContact CZ3-CE2 3.9Å; W693-F697 HydrophobicContact CZ3-CE2 3.9Å
694	Y	78	Confident	68.3	Low	29 Å²	29	57.8 Å²	57.8	11%	0.114	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-61.2	-24.9	179.6	55.6	-99.9	0	0	0	112.5	D692 W696 F697 W772 D774	D692-Y694 HydrophobicContact CB-CD1 4.38Å; D692-Y694 HydrophobicContact CB-CE1 3.7Å; D692-Y694 HydrophobicContact CB-CE2 4.05Å; D692-Y694 PolarHBondContact O-N 3.23Å; D692-Y694 VanDerWaalsContact O-N 3.09Å; D692-Y694 PolarHBondContact OD1-OH 3.02Å; D692-Y694 PolarHBondContact OD2-OH 3.44Å; Y694-W696 PolarHBondContact O-N 3.13Å; Y694-F697 PolarHBondContact O-N 3.29Å; Y694-W772 HydrophobicContact CD2-CZ2 4.39Å; Y694-W772 WeakPolarHBondContact O-CH2 3.47Å; Y694-D774 HydrophobicContact CD2-CB 4.49Å; Y694-D774 HydrophobicContact CE2-CB 3.68Å
695	T	76.9	Confident	69.9	Low	66 Å²	66	52.8 Å²	52.8	41%	0.405	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-60.3	-28.7	178.7	58.9	0	0	0	0	112.9	D692 W693 F697 R698	D692-T695 HydrophobicContact CB-CG2 3.91Å; D692-T695 WeakPolarHBondContact O-CB 3.46Å; D692-T695 WeakPolarHBondContact O-CG2 3.14Å; D692-T695 PolarHBondContact O-N 3.13Å; D692-T695 PolarHBondContact O-OG1 3.45Å; W693-T695 PolarHBondContact O-N 3.1Å; W693-T695 VanDerWaalsContact O-N 3.16Å; T695-F697 PolarHBondContact O-N 3.22Å; T695-R698 VanDerWaalsContact O-CB 3.23Å; T695-R698 WeakPolarHBondContact O-CB 3.45Å; T695-R698 PolarHBondContact O-N 3.3Å
696	W	76.8	Confident	71.4	Confident	30 Å²	30	51.5 Å²	51.5	11%	0.114	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-65.6	-26.8	177.5	-57.1	-16.5	0	0	0	112.5	L628 Q629 V632 I636 F691 W693 Y694 R698	L628-W696 HydrophobicContact CB-CE3 4.43Å; L628-W696 HydrophobicContact CB-CZ3 3.89Å; L628-W696 HydrophobicContact CD2-CE3 3.99Å; L628-W696 HydrophobicContact CD2-CZ3 3.77Å; L628-W696 HydrophobicContact CG-CE3 3.99Å; L628-W696 HydrophobicContact CG-CZ3 3.86Å; Q629-W696 HydrophobicContact CB-CD2 4.36Å; Q629-W696 HydrophobicContact CB-CE3 4.37Å; Q629-W696 HydrophobicContact CB-CH2 4.14Å; Q629-W696 HydrophobicContact CB-CZ2 4.13Å; Q629-W696 HydrophobicContact CB-CZ3 4.26Å; Q629-W696 HydrophobicContact CG-CZ2 4.48Å; V632-W696 HydrophobicContact CG1-CB 4.3Å; I636-W696 WeakPolarHBondContact CD1-O 3.42Å; F691-W696 HydrophobicContact CD2-CH2 4.26Å; F691-W696 AromaticContact CD2-CZ2 3.96Å; F691-W696 HydrophobicContact CD2-CZ2 3.96Å; F691-W696 AromaticContact CE2-CH2 3.47Å; F691-W696 HydrophobicContact CE2-CH2 3.47Å; F691-W696 VanDerWaalsContact CE2-CH2 3.47Å; F691-W696 AromaticContact CE2-CZ2 3.62Å; F691-W696 HydrophobicContact CE2-CZ2 3.62Å; F691-W696 HydrophobicContact CE2-CZ3 4.19Å; F691-W696 HydrophobicContact CZ-CH2 4.12Å; W693-W696 WeakPolarHBondContact O-CB 3.09Å; W693-W696 PolarHBondContact O-N 3.34Å; Y694-W696 PolarHBondContact O-N 3.13Å; W696-R698 VanDerWaalsContact C-N 3.34Å
697	F	82.5	Confident	72.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-88.2	-0.9	179.4	-65.5	-87.1	0	0	0	113.3	V632 L662 L665 Y666 L669 W693 Y694 T695 P699 V700 I701 W772	V632-F697 HydrophobicContact CG2-CE1 4.5Å; V632-F697 HydrophobicContact CG2-CZ 4.35Å; L662-F697 HydrophobicContact CB-CE1 4.43Å; L662-F697 HydrophobicContact CD2-CE1 4.48Å; L662-F697 VanDerWaalsContact O-CE1 3.23Å; L662-F697 WeakPolarHBondContact O-CE1 3.49Å; L665-F697 HydrophobicContact CD2-CZ 4.27Å; L665-F697 HydrophobicContact CG-CZ 4.22Å; Y666-F697 HydrophobicContact CD2-CB 3.9Å; Y666-F697 HydrophobicContact CD2-CD1 4.41Å; Y666-F697 AromaticContact CD2-CD2 3.89Å; Y666-F697 HydrophobicContact CD2-CD2 3.89Å; Y666-F697 AromaticContact CD2-CG 3.8Å; Y666-F697 HydrophobicContact CD2-CG 3.8Å; Y666-F697 HydrophobicContact CG-CB 4.46Å; Y666-F697 HydrophobicContact CG-CD1 4.48Å; Y666-F697 HydrophobicContact CG-CG 4.29Å; L669-F697 HydrophobicContact CD1-CE2 4.2Å; L669-F697 HydrophobicContact CD1-CZ 4.14Å; W693-F697 HydrophobicContact CE3-CD2 4.09Å; W693-F697 AromaticContact CE3-CE2 3.85Å; W693-F697 HydrophobicContact CE3-CE2 3.85Å; W693-F697 HydrophobicContact CZ3-CD2 4.06Å; W693-F697 AromaticContact CZ3-CE2 3.9Å; W693-F697 HydrophobicContact CZ3-CE2 3.9Å; Y694-F697 PolarHBondContact O-N 3.29Å; T695-F697 PolarHBondContact O-N 3.22Å; F697-P699 VanDerWaalsContact C-N 3.34Å; F697-V700 HydrophobicContact CD1-CG2 4.31Å; F697-V700 WeakPolarHBondContact O-CA 3.36Å; F697-V700 WeakPolarHBondContact O-CB 3.16Å; F697-V700 PolarHBondContact O-N 3.43Å; F697-I701 PolarHBondContact O-N 3.1Å; F697-W772 HydrophobicContact CB-CH2 4.44Å; F697-W772 HydrophobicContact CB-CZ3 4.46Å
698	R	78.9	Confident	73.8	Confident	128 Å²	128	39.9 Å²	39.9	48%	0.483	20%	0.196	S	C	.	.	H	α-helix	trans	-51.4	-47.3	-178.7	-173.8	-169.7	177.8	170.6	-1.2	112	T695 W696 V700 I701 S702 W772 Y781	T695-R698 VanDerWaalsContact O-CB 3.23Å; T695-R698 WeakPolarHBondContact O-CB 3.45Å; T695-R698 PolarHBondContact O-N 3.3Å; W696-R698 VanDerWaalsContact C-N 3.34Å; R698-V700 VanDerWaalsContact C-N 3.33Å; R698-V700 PolarHBondContact O-N 3.46Å; R698-I701 PolarHBondContact O-N 3.49Å; R698-S702 PolarHBondContact O-N 2.88Å; R698-S702 PolarHBondContact O-OG 3.34Å; R698-W772 HydrophobicContact CB-CH2 4.35Å; R698-W772 HydrophobicContact CB-CZ2 4.24Å; R698-Y781 WeakPolarHBondContact CG-OH 3.5Å; R698-Y781 PolarHBondContact O-OH 3.26Å; R698-Y781 VanDerWaalsContact O-OH 3.11Å
699	P	74.7	Confident	75.3	Confident	34 Å²	34	40.1 Å²	40.1	22%	0.221	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-28.7	178.1	-27.7	42.9	0	0	0	114.6	I636 L640 F697 Y703	I636-P699 HydrophobicContact CB-CB 4.35Å; I636-P699 HydrophobicContact CD1-CB 4.22Å; I636-P699 HydrophobicContact CD1-CG 4.33Å; I636-P699 HydrophobicContact CG1-CB 4.31Å; I636-P699 HydrophobicContact CG2-CB 3.29Å; I636-P699 HydrophobicContact CG2-CG 3.45Å; I636-P699 VanDerWaalsContact CG2-CG 3.45Å; L640-P699 HydrophobicContact CD1-CB 4.16Å; L640-P699 HydrophobicContact CD1-CG 4.37Å; F697-P699 VanDerWaalsContact C-N 3.34Å; P699-Y703 WeakPolarHBondContact O-CB 3.48Å; P699-Y703 PolarHBondContact O-N 3.49Å
700	V	76.1	Confident	76.5	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-46	175.2	-177	0	0	0	0	109.8	I636 L659 L662 F663 F697 R698 Y703 W704	I636-V700 HydrophobicContact CD1-CG2 3.69Å; I636-V700 HydrophobicContact CG1-CG2 3.9Å; L659-V700 HydrophobicContact CD2-CB 4.41Å; L659-V700 HydrophobicContact CD2-CG1 4.23Å; L659-V700 HydrophobicContact CD2-CG2 3.96Å; L662-V700 HydrophobicContact CB-CG1 4.35Å; L662-V700 HydrophobicContact CB-CG2 4.11Å; L662-V700 HydrophobicContact CD1-CG2 4.11Å; F663-V700 HydrophobicContact CB-CG1 4.21Å; F663-V700 HydrophobicContact CD2-CG1 4.43Å; F697-V700 HydrophobicContact CD1-CG2 4.31Å; F697-V700 WeakPolarHBondContact O-CA 3.36Å; F697-V700 WeakPolarHBondContact O-CB 3.16Å; F697-V700 PolarHBondContact O-N 3.43Å; R698-V700 VanDerWaalsContact C-N 3.33Å; R698-V700 PolarHBondContact O-N 3.46Å; V700-Y703 PolarHBondContact O-N 3.11Å; V700-W704 WeakPolarHBondContact O-CB 3.36Å; V700-W704 PolarHBondContact O-N 3.2Å
701	I	82	Confident	77.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63	-47.1	175.8	-59	-52.3	0	0	0	110.8	F663 F697 R698 Y703 W704 I705 W767 I770 W772 Y781	F663-I701 HydrophobicContact CD2-CD1 4.07Å; F663-I701 HydrophobicContact CE2-CD1 3.8Å; F697-I701 PolarHBondContact O-N 3.1Å; R698-I701 PolarHBondContact O-N 3.49Å; I701-Y703 VanDerWaalsContact C-N 3.29Å; I701-Y703 PolarHBondContact O-N 3.36Å; I701-W704 PolarHBondContact O-N 3.25Å; I701-W704 VanDerWaalsContact O-N 3.17Å; I701-I705 HydrophobicContact CG2-CD1 4.18Å; I701-I705 WeakPolarHBondContact O-CG1 3.45Å; I701-I705 PolarHBondContact O-N 2.84Å; I701-W767 HydrophobicContact CG2-CZ3 4.33Å; I701-I770 HydrophobicContact CD1-CD1 4.24Å; I701-I770 HydrophobicContact CD1-CG2 4.12Å; I701-W772 HydrophobicContact CD1-CZ3 4.24Å; I701-W772 HydrophobicContact CG1-CE3 3.86Å; I701-W772 HydrophobicContact CG1-CH2 4.01Å; I701-W772 HydrophobicContact CG1-CZ3 3.41Å; I701-W772 VanDerWaalsContact CG1-CZ3 3.41Å; I701-Y781 HydrophobicContact CB-CE2 4.49Å; I701-Y781 HydrophobicContact CG2-CD1 4.4Å; I701-Y781 HydrophobicContact CG2-CD2 4.16Å; I701-Y781 HydrophobicContact CG2-CE1 4.24Å; I701-Y781 HydrophobicContact CG2-CE2 3.96Å; I701-Y781 HydrophobicContact CG2-CG 4.35Å
702	S	80.6	Confident	78.9	Confident	28 Å²	28	35.1 Å²	35.1	20%	0.196	17%	0.167	C	C	.	.	H	α-helix	trans	-58.5	-39.8	175.8	-57.2	0	0	0	0	112.5	R698 Q706 Y781	R698-S702 PolarHBondContact O-N 2.88Å; R698-S702 PolarHBondContact O-OG 3.34Å; S702-Q706 WeakPolarHBondContact O-CG 3.48Å; S702-Q706 PolarHBondContact O-N 3.08Å; S702-Y781 PolarHBondContact OG-OH 3.09Å
703	Y	74.4	Confident	79.9	Confident	22 Å²	22	34 Å²	34	9%	0.086	16%	0.161	C	C	.	.	H	α-helix	trans	-66.1	-45.2	174.8	-179.3	-83.5	0	0	0	112.1	F7 E639 L659 P699 V700 I701 I705 Q706 Q707	F7-Y703 HydrophobicContact CE2-CE1 4.32Å; F7-Y703 HydrophobicContact CZ-CD1 4.21Å; F7-Y703 AromaticContact CZ-CE1 3.85Å; F7-Y703 HydrophobicContact CZ-CE1 3.85Å; E639-Y703 HydrophobicContact CG-CD2 4.25Å; E639-Y703 HydrophobicContact CG-CE2 3.92Å; E639-Y703 WeakPolarHBondContact OE1-CE2 3.28Å; E639-Y703 PolarHBondContact OE1-OH 3.3Å; L659-Y703 HydrophobicContact CD1-CD1 3.07Å; L659-Y703 HydrophobicContact CD1-CD2 3.68Å; L659-Y703 HydrophobicContact CD1-CE1 3.1Å; L659-Y703 HydrophobicContact CD1-CE2 3.72Å; L659-Y703 HydrophobicContact CD1-CG 3.33Å; L659-Y703 VanDerWaalsContact CD1-CZ 3.4Å; P699-Y703 WeakPolarHBondContact O-CB 3.48Å; P699-Y703 PolarHBondContact O-N 3.49Å; V700-Y703 PolarHBondContact O-N 3.11Å; I701-Y703 VanDerWaalsContact C-N 3.29Å; I701-Y703 PolarHBondContact O-N 3.36Å; Y703-I705 VanDerWaalsContact C-N 3.32Å; Y703-I705 PolarHBondContact O-N 3.44Å; Y703-Q706 PolarHBondContact O-N 3.31Å; Y703-Q706 VanDerWaalsContact O-N 3.15Å; Y703-Q707 HydrophobicContact CD1-CG 3.56Å; Y703-Q707 HydrophobicContact CE1-CB 4.43Å; Y703-Q707 HydrophobicContact CE1-CG 3.16Å; Y703-Q707 HydrophobicContact CE2-CG 4.38Å; Y703-Q707 HydrophobicContact CG-CG 4.36Å; Y703-Q707 WeakPolarHBondContact O-CG 2.87Å; Y703-Q707 PolarHBondContact O-N 3.02Å
704	W	80.9	Confident	80.4	Confident	9 Å²	9	36.6 Å²	36.6	3%	0.034	18%	0.18	C	C	.	.	H	α-helix	trans	-57	-45.6	178.2	166.9	80.2	0	0	0	111.5	F7 F663 V700 I701 Q706 Q707 C708 L763 T766 W767 I770	F7-W704 AromaticContact CD1-CD1 3.9Å; F7-W704 HydrophobicContact CE1-CB 4.32Å; F7-W704 AromaticContact CE1-CD1 3.77Å; F7-W704 HydrophobicContact CE1-CG 4.44Å; F663-W704 HydrophobicContact CE2-CD2 4.5Å; F663-W704 HydrophobicContact CE2-CG 4.35Å; V700-W704 WeakPolarHBondContact O-CB 3.36Å; V700-W704 PolarHBondContact O-N 3.2Å; I701-W704 PolarHBondContact O-N 3.25Å; I701-W704 VanDerWaalsContact O-N 3.17Å; W704-Q706 VanDerWaalsContact C-N 3.34Å; W704-Q706 PolarHBondContact O-N 3.49Å; W704-Q707 PolarHBondContact O-N 3.35Å; W704-C708 VanDerWaalsContact CE2-SG 3.53Å; W704-C708 PolarHBondContact NE1-SG 3.14Å; W704-C708 VanDerWaalsContact NE1-SG 3.39Å; W704-C708 WeakPolarHBondContact O-CB 3.1Å; W704-C708 PolarHBondContact O-N 3.33Å; W704-C708 PolarHBondContact O-SG 3.11Å; W704-L763 HydrophobicContact CH2-CD1 3.57Å; W704-L763 HydrophobicContact CZ2-CD1 3.68Å; W704-L763 HydrophobicContact CZ3-CD1 4.42Å; W704-T766 HydrophobicContact CH2-CG2 4.22Å; W704-T766 HydrophobicContact CZ2-CG2 3.47Å; W704-T766 VanDerWaalsContact CZ2-CG2 3.47Å; W704-W767 HydrophobicContact CH2-CB 4.28Å; W704-W767 HydrophobicContact CZ3-CE3 4.24Å; W704-I770 HydrophobicContact CD2-CD1 4.28Å; W704-I770 HydrophobicContact CE3-CD1 3.78Å; W704-I770 HydrophobicContact CH2-CD1 3.81Å; W704-I770 HydrophobicContact CZ2-CD1 4.26Å; W704-I770 HydrophobicContact CZ3-CD1 3.55Å
705	I	83.3	Confident	80.8	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-58.5	-45.6	175.9	-68.1	176.1	0	0	0	111	I701 Y703 C708 N709 Y781 E784 I785 I788	I701-I705 HydrophobicContact CG2-CD1 4.18Å; I701-I705 WeakPolarHBondContact O-CG1 3.45Å; I701-I705 PolarHBondContact O-N 2.84Å; Y703-I705 VanDerWaalsContact C-N 3.32Å; Y703-I705 PolarHBondContact O-N 3.44Å; I705-C708 WeakPolarHBondContact O-CB 3.07Å; I705-C708 PolarHBondContact O-N 3.06Å; I705-N709 PolarHBondContact O-N 3.24Å; I705-Y781 HydrophobicContact CD1-CD1 3.39Å; I705-Y781 HydrophobicContact CD1-CE1 4.16Å; I705-Y781 HydrophobicContact CD1-CG 3.87Å; I705-E784 HydrophobicContact CG2-CB 4.09Å; I705-I785 HydrophobicContact CD1-CG1 4.49Å; I705-I788 HydrophobicContact CG2-CD1 3.37Å
706	Q	79.1	Confident	81.6	Confident	96 Å²	96	32.8 Å²	32.8	45%	0.449	16%	0.159	S	C	.	.	H	α-helix	trans	-64.7	-42.3	179	-72.5	177.5	-6.7	0	0	112.9	S702 Y703 W704 C708 N709 F710	S702-Q706 WeakPolarHBondContact O-CG 3.48Å; S702-Q706 PolarHBondContact O-N 3.08Å; Y703-Q706 PolarHBondContact O-N 3.31Å; Y703-Q706 VanDerWaalsContact O-N 3.15Å; W704-Q706 VanDerWaalsContact C-N 3.34Å; W704-Q706 PolarHBondContact O-N 3.49Å; Q706-C708 VanDerWaalsContact C-N 3.34Å; Q706-N709 PolarHBondContact O-N 3.34Å; Q706-F710 PolarHBondContact O-N 3.27Å; Q706-F710 VanDerWaalsContact O-N 3.12Å
707	Q	76.3	Confident	82.3	Confident	48 Å²	48	34 Å²	34	22%	0.224	17%	0.168	C	C	.	.	H	α-helix	trans	-66.1	-38.6	175.3	-68.1	-53.7	-39.1	0	0	111.9	F7 Y703 W704 N709 F710 Q711	F7-Q707 HydrophobicContact CD1-CB 4.02Å; F7-Q707 HydrophobicContact CE1-CB 4.19Å; F7-Q707 HydrophobicContact CE1-CG 4.44Å; F7-Q707 HydrophobicContact CG-CB 4.35Å; F7-Q707 HydrophobicContact CZ-CG 4.49Å; Y703-Q707 HydrophobicContact CD1-CG 3.56Å; Y703-Q707 HydrophobicContact CE1-CB 4.43Å; Y703-Q707 HydrophobicContact CE1-CG 3.16Å; Y703-Q707 HydrophobicContact CE2-CG 4.38Å; Y703-Q707 HydrophobicContact CG-CG 4.36Å; Y703-Q707 WeakPolarHBondContact O-CG 2.87Å; Y703-Q707 PolarHBondContact O-N 3.02Å; W704-Q707 PolarHBondContact O-N 3.35Å; Q707-N709 VanDerWaalsContact C-N 3.31Å; Q707-N709 PolarHBondContact O-N 3.4Å; Q707-F710 PolarHBondContact O-N 3Å; Q707-Q711 VanDerWaalsContact O-CB 3.3Å; Q707-Q711 WeakPolarHBondContact O-CB 3.21Å; Q707-Q711 PolarHBondContact O-N 3.32Å
708	C	80.6	Confident	82.7	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.007	18%	0.184	C	C	.	.	H	α-helix	trans	-59.3	-43.7	173.8	-70.7	0	0	0	0	110.9	M8 W704 I705 Q706 Q711 L712 L763	M8-C708 HydrophobicContact SD-CB 4.48Å; W704-C708 VanDerWaalsContact CE2-SG 3.53Å; W704-C708 PolarHBondContact NE1-SG 3.14Å; W704-C708 VanDerWaalsContact NE1-SG 3.39Å; W704-C708 WeakPolarHBondContact O-CB 3.1Å; W704-C708 PolarHBondContact O-N 3.33Å; W704-C708 PolarHBondContact O-SG 3.11Å; I705-C708 WeakPolarHBondContact O-CB 3.07Å; I705-C708 PolarHBondContact O-N 3.06Å; Q706-C708 VanDerWaalsContact C-N 3.34Å; C708-Q711 PolarHBondContact O-N 3.4Å; C708-L712 WeakPolarHBondContact O-CB 2.83Å; C708-L712 WeakPolarHBondContact O-CD1 3.33Å; C708-L712 WeakPolarHBondContact O-CG 3.48Å; C708-L712 PolarHBondContact O-N 3.17Å; C708-L763 HydrophobicContact CB-CD1 3.85Å
709	N	84.9	Confident	83.2	Confident	34 Å²	34	32.8 Å²	32.8	18%	0.182	17%	0.165	C	C	.	.	H	α-helix	trans	-58.6	-53.2	176	-167.2	11.9	0	0	0	111.7	I705 Q706 Q707 Q711 L712 L713 I788 E791	I705-N709 PolarHBondContact O-N 3.24Å; Q706-N709 PolarHBondContact O-N 3.34Å; Q707-N709 VanDerWaalsContact C-N 3.31Å; Q707-N709 PolarHBondContact O-N 3.4Å; N709-Q711 VanDerWaalsContact C-N 3.33Å; N709-Q711 PolarHBondContact O-N 3.34Å; N709-L712 PolarHBondContact O-N 3.3Å; N709-L713 PolarHBondContact O-N 2.88Å; N709-I788 HydrophobicContact CB-CD1 3.81Å; N709-I788 HydrophobicContact CB-CG1 3.81Å; N709-I788 HydrophobicContact CB-CG2 4.05Å; N709-E791 PolarHBondContact ND2-OE2 3.27Å
710	F	78.7	Confident	84.1	Confident	122 Å²	122	31.4 Å²	31.4	54%	0.535	16%	0.155	S	C	.	.	H	α-helix	trans	-58.3	-44.9	-179.8	179	-96.5	0	0	0	112.1	Q706 Q707 S714	Q706-F710 PolarHBondContact O-N 3.27Å; Q706-F710 VanDerWaalsContact O-N 3.12Å; Q707-F710 PolarHBondContact O-N 3Å; F710-S714 WeakPolarHBondContact O-CB 3.42Å; F710-S714 PolarHBondContact O-N 3.09Å
711	Q	80.2	Confident	84.7	Confident	15 Å²	15	37.7 Å²	37.7	7%	0.07	19%	0.185	C	C	.	.	H	α-helix	trans	-69	-39.1	-180	-170.6	178.7	-5	0	0	111.9	C4 K5 M8 Q707 C708 N709 S714 N715	C4-Q711 PolarHBondContact O-NE2 2.77Å; C4-Q711 PolarHBondContact O-OE1 3.32Å; K5-Q711 PolarHBondContact O-NE2 2.84Å; M8-Q711 HydrophobicContact CG-CB 4.42Å; M8-Q711 VanDerWaalsContact CG-CD 3.47Å; M8-Q711 HydrophobicContact CG-CG 4.09Å; Q707-Q711 VanDerWaalsContact O-CB 3.3Å; Q707-Q711 WeakPolarHBondContact O-CB 3.21Å; Q707-Q711 PolarHBondContact O-N 3.32Å; C708-Q711 PolarHBondContact O-N 3.4Å; N709-Q711 VanDerWaalsContact C-N 3.33Å; N709-Q711 PolarHBondContact O-N 3.34Å; Q711-S714 PolarHBondContact O-N 3.46Å; Q711-N715 VanDerWaalsContact O-CB 3.23Å; Q711-N715 WeakPolarHBondContact O-CB 3Å; Q711-N715 PolarHBondContact O-N 3.31Å; Q711-N715 PolarHBondContact O-ND2 3.22Å
712	L	88.5	Confident	85.1	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-47.1	176.7	-80.5	168.8	0	0	0	111.5	M8 C708 N709 M716 N759 L760 L763 I788 V792	M8-L712 HydrophobicContact CE-CD2 3.54Å; M8-L712 HydrophobicContact CE-CG 4.06Å; M8-L712 HydrophobicContact SD-CD2 4.49Å; M8-L712 HydrophobicContact SD-CG 4.39Å; C708-L712 WeakPolarHBondContact O-CB 2.83Å; C708-L712 WeakPolarHBondContact O-CD1 3.33Å; C708-L712 WeakPolarHBondContact O-CG 3.48Å; C708-L712 PolarHBondContact O-N 3.17Å; N709-L712 PolarHBondContact O-N 3.3Å; L712-M716 WeakPolarHBondContact O-CB 3.34Å; L712-M716 PolarHBondContact O-N 2.84Å; L712-N759 HydrophobicContact CD2-CB 3.51Å; L712-L760 HydrophobicContact CD1-CD2 3.99Å; L712-L760 HydrophobicContact CD2-CD2 4.33Å; L712-L763 HydrophobicContact CD1-CD2 3.87Å; L712-I788 HydrophobicContact CD1-CG2 3.82Å; L712-V792 HydrophobicContact CB-CG1 4.39Å; L712-V792 HydrophobicContact CB-CG2 3.77Å
713	L	89.8	Confident	85.6	Confident	37 Å²	37	42.4 Å²	42.4	19%	0.194	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-47.9	176.3	-72.3	171	0	0	0	111.4	N709 N715 M716 D717 V792	N709-L713 PolarHBondContact O-N 2.88Å; L713-N715 PolarHBondContact O-N 2.93Å; L713-M716 HydrophobicContact CD2-CE 4.04Å; L713-M716 PolarHBondContact O-N 3.47Å; L713-D717 VanDerWaalsContact O-CG 3.32Å; L713-D717 PolarHBondContact O-N 2.98Å; L713-V792 HydrophobicContact CD2-CB 4.4Å; L713-V792 HydrophobicContact CD2-CG2 3.81Å; L713-V792 HydrophobicContact CG-CG2 3.98Å
714	S	84.9	Confident	86.2	Confident	60 Å²	60	48.5 Å²	48.5	42%	0.42	24%	0.237	S	C	.	.	H	α-helix	trans	-64.3	-39.4	179.2	179.2	0	0	0	0	113.2	F710 Q711 R718	F710-S714 WeakPolarHBondContact O-CB 3.42Å; F710-S714 PolarHBondContact O-N 3.09Å; Q711-S714 PolarHBondContact O-N 3.46Å; S714-R718 PolarHBondContact O-N 2.86Å
715	N	87.6	Confident	86.5	Confident	13 Å²	13	48.2 Å²	48.2	7%	0.07	24%	0.236	C	C	.	.	H	α-helix	trans	-65.2	-48.5	174.1	-77.6	-22.7	0	0	0	110.4	Q711 L713 D717 R718 D719	Q711-N715 VanDerWaalsContact O-CB 3.23Å; Q711-N715 WeakPolarHBondContact O-CB 3Å; Q711-N715 PolarHBondContact O-N 3.31Å; Q711-N715 PolarHBondContact O-ND2 3.22Å; L713-N715 PolarHBondContact O-N 2.93Å; N715-D717 VanDerWaalsContact C-N 3.33Å; N715-D717 PolarHBondContact O-N 3.43Å; N715-R718 PolarHBondContact O-N 2.98Å; N715-R718 VanDerWaalsContact O-N 3.16Å; N715-R718 PolarHBondContact OD1-NH2 3.33Å; N715-D719 VanDerWaalsContact O-CB 3.29Å; N715-D719 WeakPolarHBondContact O-CB 3.42Å; N715-D719 PolarHBondContact O-N 3.24Å
716	M	92.9	Very high	86.7	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-55.4	-46.2	178	177.7	-81.5	-64.5	0	0	112	L712 L713 R718 D719 I720 I756 V792 S795 Y796	L712-M716 WeakPolarHBondContact O-CB 3.34Å; L712-M716 PolarHBondContact O-N 2.84Å; L713-M716 HydrophobicContact CD2-CE 4.04Å; L713-M716 PolarHBondContact O-N 3.47Å; M716-R718 PolarHBondContact O-N 3.08Å; M716-D719 PolarHBondContact O-N 3.29Å; M716-I720 WeakPolarHBondContact O-CG2 3.29Å; M716-I720 PolarHBondContact O-N 2.98Å; M716-I720 HydrophobicContact SD-CG2 4.44Å; M716-I756 HydrophobicContact CB-CD1 4.41Å; M716-I756 HydrophobicContact CB-CG1 4.33Å; M716-I756 HydrophobicContact CG-CD1 3.68Å; M716-I756 HydrophobicContact CG-CG1 4.11Å; M716-V792 HydrophobicContact CB-CG1 4.21Å; M716-V792 HydrophobicContact CG-CG1 4.29Å; M716-S795 WeakPolarHBondContact CE-OG 3.48Å; M716-Y796 HydrophobicContact CG-CD2 4.09Å; M716-Y796 HydrophobicContact CG-CG 4.33Å; M716-Y796 VanDerWaalsContact SD-CA 3.59Å; M716-Y796 HydrophobicContact SD-CD2 4.24Å
717	D	91.7	Very high	86.8	Confident	56 Å²	56	51 Å²	51	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-43.6	177.6	-73.1	-22.6	0	0	0	112	L713 N715 I720 Q721 Q799	L713-D717 VanDerWaalsContact O-CG 3.32Å; L713-D717 PolarHBondContact O-N 2.98Å; N715-D717 VanDerWaalsContact C-N 3.33Å; N715-D717 PolarHBondContact O-N 3.43Å; D717-I720 WeakPolarHBondContact O-CG2 3.12Å; D717-Q721 WeakPolarHBondContact O-CB 3.43Å; D717-Q721 WeakPolarHBondContact O-CG 3.24Å; D717-Q721 PolarHBondContact O-N 3.35Å; D717-Q721 VanDerWaalsContact O-N 3.14Å; D717-Q799 PolarHBondContact OD1-NE2 3.25Å
718	R	89.6	Confident	86.7	Confident	87 Å²	87	49.9 Å²	49.9	33%	0.328	25%	0.253	S	S	.	.	H	α-helix	trans	-67.6	-44.5	176.8	-179	-169.7	62.9	-140.4	-14.5	111.6	S714 N715 M716 I720 Q721 N722	S714-R718 PolarHBondContact O-N 2.86Å; N715-R718 PolarHBondContact O-N 2.98Å; N715-R718 VanDerWaalsContact O-N 3.16Å; N715-R718 PolarHBondContact OD1-NH2 3.33Å; M716-R718 PolarHBondContact O-N 3.08Å; R718-I720 VanDerWaalsContact C-N 3.35Å; R718-Q721 PolarHBondContact O-N 3.18Å; R718-N722 PolarHBondContact O-N 2.95Å; R718-N722 VanDerWaalsContact O-N 3.12Å; R718-N722 PolarHBondContact O-ND2 3.15Å; R718-N722 VanDerWaalsContact O-ND2 3.11Å
719	D	91.2	Very high	86	Confident	16 Å²	16	55.4 Å²	55.4	9%	0.086	28%	0.283	C	S	.	.	H	α-helix	trans	-68.6	-37.8	-173.3	-61.9	-10.6	0	0	0	109.9	N715 M716 D723 Q755	N715-D719 VanDerWaalsContact O-CB 3.29Å; N715-D719 WeakPolarHBondContact O-CB 3.42Å; N715-D719 PolarHBondContact O-N 3.24Å; M716-D719 PolarHBondContact O-N 3.29Å; D719-D723 PolarHBondContact O-N 3.22Å; D719-Q755 PolarHBondContact OD2-OE1 3.17Å
720	I	92.6	Very high	84.9	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-73.6	-36.2	174.5	-159.6	179.2	0	0	0	113.2	M716 D717 R718 N722 D723 Y796 Q799 L800 K803	M716-I720 WeakPolarHBondContact O-CG2 3.29Å; M716-I720 PolarHBondContact O-N 2.98Å; M716-I720 HydrophobicContact SD-CG2 4.44Å; D717-I720 WeakPolarHBondContact O-CG2 3.12Å; R718-I720 VanDerWaalsContact C-N 3.35Å; I720-N722 VanDerWaalsContact C-N 3.3Å; I720-N722 PolarHBondContact O-N 3.07Å; I720-D723 WeakPolarHBondContact O-CB 3.42Å; I720-D723 PolarHBondContact O-N 3.3Å; I720-Y796 HydrophobicContact CB-CD2 4.04Å; I720-Y796 HydrophobicContact CB-CE2 4.02Å; I720-Y796 HydrophobicContact CD1-CD2 3.64Å; I720-Y796 HydrophobicContact CD1-CE2 3.75Å; I720-Y796 HydrophobicContact CG1-CD2 4.02Å; I720-Y796 HydrophobicContact CG1-CE2 3.77Å; I720-Q799 HydrophobicContact CD1-CB 3.5Å; I720-Q799 VanDerWaalsContact CD1-CB 3.5Å; I720-Q799 HydrophobicContact CG2-CB 4.43Å; I720-L800 HydrophobicContact CD1-CB 3.89Å; I720-L800 VanDerWaalsContact CD1-N 3.26Å; I720-K803 PolarHBondContact O-NZ 3.36Å
721	Q	89.9	Confident	84	Confident	137 Å²	137	60 Å²	60	64%	0.64	31%	0.305	S	S	*	.	H	α-helix	trans	-59.7	-44.1	175.4	-78.6	171.7	9.5	0	0	110.9	D717 R718 D723 K803	D717-Q721 WeakPolarHBondContact O-CB 3.43Å; D717-Q721 WeakPolarHBondContact O-CG 3.24Å; D717-Q721 PolarHBondContact O-N 3.35Å; D717-Q721 VanDerWaalsContact O-N 3.14Å; R718-Q721 PolarHBondContact O-N 3.18Å; Q721-D723 VanDerWaalsContact C-N 3.32Å; Q721-D723 PolarHBondContact O-N 3.3Å; Q721-K803 PolarHBondContact O-NZ 2.95Å; Q721-K803 VanDerWaalsContact O-NZ 3.12Å
722	N	89.2	Confident	83	Confident	116 Å²	116	61 Å²	61	62%	0.62	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-8.4	-179	-65.3	-33	0	0	0	114.4	R718 I720 Q724	R718-N722 PolarHBondContact O-N 2.95Å; R718-N722 VanDerWaalsContact O-N 3.12Å; R718-N722 PolarHBondContact O-ND2 3.15Å; R718-N722 VanDerWaalsContact O-ND2 3.11Å; I720-N722 VanDerWaalsContact C-N 3.3Å; I720-N722 PolarHBondContact O-N 3.07Å; N722-Q724 PolarHBondContact O-N 3.03Å
723	D	90.4	Very high	81.6	Confident	11 Å²	11	61.6 Å²	61.6	6%	0.059	31%	0.314	C	S	.	.			trans	-70.4	119.1	-175.8	-167.8	-1.9	0	0	0	112.6	D719 I720 Q721 L725 S750 S752 K803	D719-D723 PolarHBondContact O-N 3.22Å; I720-D723 WeakPolarHBondContact O-CB 3.42Å; I720-D723 PolarHBondContact O-N 3.3Å; Q721-D723 VanDerWaalsContact C-N 3.32Å; Q721-D723 PolarHBondContact O-N 3.3Å; D723-L725 VanDerWaalsContact C-N 3.29Å; D723-L725 PolarHBondContact OD1-N 3.17Å; D723-S750 VanDerWaalsContact OD1-CB 3.27Å; D723-S750 WeakPolarHBondContact OD1-CB 3.49Å; D723-S750 PolarHBondContact OD1-OG 3.35Å; D723-S750 WeakPolarHBondContact OD2-CB 3.47Å; D723-S750 PolarHBondContact OD2-OG 3.35Å; D723-S752 VanDerWaalsContact OD2-CB 3.31Å; D723-S752 WeakPolarHBondContact OD2-CB 3.49Å; D723-S752 PolarHBondContact OD2-OG 3.41Å; D723-K803 WeakPolarHBondContact O-CE 3.47Å; D723-K803 PolarHBondContact O-NZ 2.97Å
724	Q	87.8	Confident	80.4	Confident	150 Å²	150	65.7 Å²	65.7	70%	0.701	34%	0.336	S	S	*	.			trans	-86.2	1.7	175.7	-64.9	-176.2	-17.5	0	0	113.4	N722 I726	N722-Q724 PolarHBondContact O-N 3.03Å; Q724-I726 VanDerWaalsContact C-N 3.27Å; Q724-I726 HydrophobicContact CB-CD1 3.83Å; Q724-I726 HydrophobicContact CB-CG1 4.02Å; Q724-I726 PolarHBondContact O-N 3.22Å
725	L	88.4	Confident	79.6	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.016	34%	0.338	C	S	.	.			trans	56.7	39.5	-176.5	-60.1	174.1	0	0	0	113	D723 L800 L804 I824	D723-L725 VanDerWaalsContact C-N 3.29Å; D723-L725 PolarHBondContact OD1-N 3.17Å; L725-L800 HydrophobicContact CD2-CD1 3.71Å; L725-L804 HydrophobicContact CD1-CD2 3.58Å; L725-L804 HydrophobicContact CD1-CG 4.48Å; L725-I824 WeakPolarHBondContact O-CD1 3.3Å
726	I	85.4	Confident	78.7	Confident	100 Å²	100	67.3 Å²	67.3	51%	0.513	34%	0.335	S	S	.	.			trans	-101.3	133.8	175.8	-59.1	171	0	0	0	108.7	Q724 T728	Q724-I726 VanDerWaalsContact C-N 3.27Å; Q724-I726 HydrophobicContact CB-CD1 3.83Å; Q724-I726 HydrophobicContact CB-CG1 4.02Å; Q724-I726 PolarHBondContact O-N 3.22Å; I726-T728 PolarHBondContact O-OG1 3.06Å
727	S	82	Confident	77.5	Confident	55 Å²	55	68.3 Å²	68.3	39%	0.385	34%	0.342	S	S	.	.			trans	-62.9	134	177.5	54.5	0	0	0	0	110.7	G747 Y749	S727-G747 WeakPolarHBondContact CB-O 3.34Å; S727-Y749 WeakPolarHBondContact CA-O 3.5Å
728	T	75.2	Confident	76.5	Confident	25 Å²	25	71.6 Å²	71.6	15%	0.153	36%	0.359	C	S	.	.			trans	-119.6	139.5	-178.5	-48.3	0	0	0	0	111.3	I726 E730 Y749 I751	I726-T728 PolarHBondContact O-OG1 3.06Å; T728-E730 VanDerWaalsContact C-N 3.27Å; T728-E730 HydrophobicContact CG2-CB 3.54Å; T728-E730 HydrophobicContact CG2-CG 3.35Å; T728-Y749 PolarHBondContact N-O 3.47Å; T728-I751 HydrophobicContact CG2-CD1 4.16Å; T728-I751 HydrophobicContact CG2-CG1 3.97Å; T728-I751 WeakPolarHBondContact OG1-CG1 3.45Å
729	N	66	Low	75.5	Confident	118 Å²	118	72.2 Å²	72.2	63%	0.631	36%	0.364	S	S	*	.			trans	-93.4	23.6	174.7	-70	-26.6	0	0	0	112.4	G747	N729-G747 PolarHBondContact OD1-N 3.41Å
730	E	60.6	Low	74.3	Confident	79 Å²	79	71.7 Å²	71.7	37%	0.369	36%	0.362	S	S	.	.			trans	-69.4	154.5	-166	-101.5	176.8	-166	0	0	114	T728 L732 I733	T728-E730 VanDerWaalsContact C-N 3.27Å; T728-E730 HydrophobicContact CG2-CB 3.54Å; T728-E730 HydrophobicContact CG2-CG 3.35Å; E730-L732 PolarHBondContact O-N 3.25Å; E730-L732 WeakPolarHBondContact OE2-CD1 3.44Å; E730-I733 WeakPolarHBondContact O-CG1 3.46Å; E730-I733 PolarHBondContact O-N 3.06Å
731	Q	60	Low	72.8	Confident	172 Å²	172	74.6 Å²	74.6	80%	0.804	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-57.3	-18.2	175	-64.4	177.1	-2.6	0	0	113.3	I733 N734	Q731-I733 PolarHBondContact O-N 3.35Å; Q731-I733 VanDerWaalsContact O-N 3.09Å; Q731-N734 WeakPolarHBondContact O-CB 2.99Å; Q731-N734 PolarHBondContact O-N 3.39Å; Q731-N734 VanDerWaalsContact O-N 3.08Å
732	L	59	Low	71	Confident	37 Å²	37	74.6 Å²	74.6	19%	0.194	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-59.8	-20.6	179.4	-71.5	177	0	0	0	113.6	E730 N734 F735 L754 Q755	E730-L732 PolarHBondContact O-N 3.25Å; E730-L732 WeakPolarHBondContact OE2-CD1 3.44Å; L732-N734 PolarHBondContact O-N 2.68Å; L732-N734 VanDerWaalsContact O-N 3.11Å; L732-F735 HydrophobicContact CD2-CD2 3.8Å; L732-F735 HydrophobicContact CD2-CE2 3.85Å; L732-F735 WeakPolarHBondContact O-CB 3.5Å; L732-F735 PolarHBondContact O-N 2.84Å; L732-L754 HydrophobicContact CB-CB 4.37Å; L732-L754 HydrophobicContact CB-CD1 4.42Å; L732-Q755 HydrophobicContact CD1-CG 4.39Å
733	I	59.3	Low	69.3	Low	15 Å²	15	75 Å²	75	8%	0.077	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-56.5	-27.8	174.6	-64.5	169.9	0	0	0	111.6	E730 Q731 F735 I736 K741 F746 L754	E730-I733 WeakPolarHBondContact O-CG1 3.46Å; E730-I733 PolarHBondContact O-N 3.06Å; Q731-I733 PolarHBondContact O-N 3.35Å; Q731-I733 VanDerWaalsContact O-N 3.09Å; I733-F735 PolarHBondContact O-N 3.4Å; I733-I736 HydrophobicContact CG2-CD1 4.45Å; I733-I736 PolarHBondContact O-N 2.83Å; I733-I736 VanDerWaalsContact O-N 3.17Å; I733-K741 WeakPolarHBondContact O-CE 3.31Å; I733-F746 HydrophobicContact CD1-CD1 3.93Å; I733-F746 HydrophobicContact CD1-CE1 4.13Å; I733-F746 HydrophobicContact CD1-CG 4.46Å; I733-L754 HydrophobicContact CG1-CD1 4.45Å
734	N	65.8	Low	67.8	Low	124 Å²	124	83.5 Å²	83.5	66%	0.663	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-62.1	-29.2	177.7	-72.3	-19.6	0	0	0	112.9	Q731 L732 I736 K741	Q731-N734 WeakPolarHBondContact O-CB 2.99Å; Q731-N734 PolarHBondContact O-N 3.39Å; Q731-N734 VanDerWaalsContact O-N 3.08Å; L732-N734 PolarHBondContact O-N 2.68Å; L732-N734 VanDerWaalsContact O-N 3.11Å; N734-I736 VanDerWaalsContact C-N 3.31Å; N734-I736 PolarHBondContact O-N 2.93Å; N734-K741 PolarHBondContact O-NZ 3.29Å
735	F	66.8	Low	66.5	Low	104 Å²	104	77 Å²	77	46%	0.456	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-76.2	-13.6	179.2	-66.1	-76.6	0	0	0	114	L732 I733 P737 N758	L732-F735 HydrophobicContact CD2-CD2 3.8Å; L732-F735 HydrophobicContact CD2-CE2 3.85Å; L732-F735 WeakPolarHBondContact O-CB 3.5Å; L732-F735 PolarHBondContact O-N 2.84Å; I733-F735 PolarHBondContact O-N 3.4Å; F735-P737 VanDerWaalsContact O-CD 3.3Å; F735-P737 WeakPolarHBondContact O-CD 3.48Å; F735-N758 HydrophobicContact CB-CB 4.46Å
736	I	68.2	Low	65.3	Low	3 Å²	3	83.7 Å²	83.7	2%	0.015	41%	0.408	C	S	.	.	S	Bend	trans	-64.4	123.7	174.9	-59.9	176.9	0	0	0	108.1	I733 N734 N738 I740 K741 Y749 L754 L831	I733-I736 HydrophobicContact CG2-CD1 4.45Å; I733-I736 PolarHBondContact O-N 2.83Å; I733-I736 VanDerWaalsContact O-N 3.17Å; N734-I736 VanDerWaalsContact C-N 3.31Å; N734-I736 PolarHBondContact O-N 2.93Å; I736-N738 PolarHBondContact O-N 2.52Å; I736-I740 HydrophobicContact CG2-CB 3.84Å; I736-I740 HydrophobicContact CG2-CG2 3.9Å; I736-K741 HydrophobicContact CB-CG 4.26Å; I736-K741 HydrophobicContact CG2-CG 4.05Å; I736-K741 WeakPolarHBondContact O-CE 3.37Å; I736-K741 PolarHBondContact O-NZ 3.3Å; I736-K741 VanDerWaalsContact O-NZ 3.14Å; I736-Y749 HydrophobicContact CD1-CE2 4.44Å; I736-L754 HydrophobicContact CD1-CD2 3.81Å; I736-L754 HydrophobicContact CG1-CD2 4.3Å; I736-L831 HydrophobicContact CD1-CD1 4.32Å
737	P	68	Low	64.6	Low	22 Å²	22	79.7 Å²	79.7	14%	0.143	39%	0.392	C	S	.	.			trans	-54.7	136.1	177.7	-27.4	34.3	0	0	0	111.9	F735 K739 I740 K741 F835 F842	F735-P737 VanDerWaalsContact O-CD 3.3Å; F735-P737 WeakPolarHBondContact O-CD 3.48Å; P737-K739 PolarHBondContact O-N 3.32Å; P737-I740 HydrophobicContact CG-CD1 4.45Å; P737-I740 PolarHBondContact O-N 2.81Å; P737-K741 PolarHBondContact O-N 2.96Å; P737-F835 HydrophobicContact CG-CE2 4.28Å; P737-F842 HydrophobicContact CB-CD1 3.91Å; P737-F842 HydrophobicContact CB-CE1 3.31Å; P737-F842 HydrophobicContact CB-CE2 4.17Å; P737-F842 HydrophobicContact CB-CZ 3.47Å; P737-F842 VanDerWaalsContact CB-CZ 3.47Å; P737-F842 HydrophobicContact CG-CD1 4.3Å; P737-F842 HydrophobicContact CG-CD2 4.31Å; P737-F842 HydrophobicContact CG-CE1 3.95Å; P737-F842 HydrophobicContact CG-CE2 3.95Å; P737-F842 HydrophobicContact CG-CG 4.5Å; P737-F842 HydrophobicContact CG-CZ 3.78Å
738	N	70.9	Confident	64.6	Low	126 Å²	126	78 Å²	78	67%	0.674	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-25.9	-173.9	-69.5	-13	0	0	0	113.9	I736 I740 K741	I736-N738 PolarHBondContact O-N 2.52Å; N738-I740 PolarHBondContact O-N 3.22Å; N738-K741 PolarHBondContact O-N 3.37Å; N738-K741 VanDerWaalsContact O-N 3.12Å; N738-K741 PolarHBondContact OD1-NZ 3.48Å
739	K	68	Low	65.2	Low	100 Å²	100	76.9 Å²	76.9	44%	0.435	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-22.2	177.8	-52.8	-172.9	179	164.3	0	113.3	P737 L841 F842	P737-K739 PolarHBondContact O-N 3.32Å; K739-L841 HydrophobicContact CD-CD2 3.23Å; K739-L841 HydrophobicContact CD-CG 3.72Å; K739-F842 HydrophobicContact CB-CE1 4.03Å; K739-F842 HydrophobicContact CD-CE1 4.18Å; K739-F842 HydrophobicContact CG-CE1 4.28Å
740	I	67	Low	66.4	Low	5 Å²	5	71.3 Å²	71.3	3%	0.026	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-27.6	172	-61.6	164.4	0	0	0	110.2	I736 P737 N738 M742 Y745 L831 K834 F835 F842	I736-I740 HydrophobicContact CG2-CB 3.84Å; I736-I740 HydrophobicContact CG2-CG2 3.9Å; P737-I740 HydrophobicContact CG-CD1 4.45Å; P737-I740 PolarHBondContact O-N 2.81Å; N738-I740 PolarHBondContact O-N 3.22Å; I740-M742 VanDerWaalsContact C-N 3.28Å; I740-M742 PolarHBondContact O-N 2.95Å; I740-Y745 PolarHBondContact O-OH 3.05Å; I740-L831 HydrophobicContact CG2-CD1 4.08Å; I740-K834 HydrophobicContact CG2-CB 4.24Å; I740-K834 HydrophobicContact CG2-CD 4.43Å; I740-F835 HydrophobicContact CD1-CB 4.1Å; I740-F835 HydrophobicContact CD1-CD2 3.95Å; I740-F835 HydrophobicContact CD1-CG 4.47Å; I740-F842 HydrophobicContact CD1-CE2 3.87Å; I740-F842 HydrophobicContact CD1-CZ 3.69Å; I740-F842 HydrophobicContact CG1-CZ 3.91Å
741	K	62	Low	67.7	Low	65 Å²	65	70.1 Å²	70.1	28%	0.283	34%	0.337	S	S	.	.			trans	-67.9	76.4	-177.9	-70.2	-176.7	179.1	147.1	0	112.6	I733 N734 I736 P737 N738 Y745	I733-K741 WeakPolarHBondContact O-CE 3.31Å; N734-K741 PolarHBondContact O-NZ 3.29Å; I736-K741 HydrophobicContact CB-CG 4.26Å; I736-K741 HydrophobicContact CG2-CG 4.05Å; I736-K741 WeakPolarHBondContact O-CE 3.37Å; I736-K741 PolarHBondContact O-NZ 3.3Å; I736-K741 VanDerWaalsContact O-NZ 3.14Å; P737-K741 PolarHBondContact O-N 2.96Å; N738-K741 PolarHBondContact O-N 3.37Å; N738-K741 VanDerWaalsContact O-N 3.12Å; N738-K741 PolarHBondContact OD1-NZ 3.48Å; K741-Y745 VanDerWaalsContact CA-CE2 3.49Å; K741-Y745 HydrophobicContact CB-CE2 4.35Å
742	M	50.4	Low	69.2	Low	137 Å²	137	62 Å²	62	68%	0.675	30%	0.299	S	S	*	.			trans	-113.9	118.4	163.4	-63.9	-69.8	-89.9	0	0	109.9	I740 Y745	I740-M742 VanDerWaalsContact C-N 3.28Å; I740-M742 PolarHBondContact O-N 2.95Å; M742-Y745 VanDerWaalsContact C-CE2 3.48Å; M742-Y745 VanDerWaalsContact N-CE2 3.31Å; M742-Y745 PolarHBondContact N-OH 3.12Å; M742-Y745 WeakPolarHBondContact O-CE2 3.41Å; M742-Y745 PolarHBondContact O-OH 2.93Å
743	E	54.2	Low	70.7	Confident	124 Å²	124	60.2 Å²	60.2	58%	0.579	29%	0.29	S	S	*	.	S	Bend	trans	86.2	165.6	178	-52	171.4	-177.9	0	0	117.1	Y745 S988	E743-Y745 WeakPolarHBondContact O-CD2 3.27Å; E743-Y745 WeakPolarHBondContact O-CE2 3.34Å; E743-Y745 PolarHBondContact O-N 3.19Å; E743-S988 PolarHBondContact OE1-OG 3.22Å; E743-S988 VanDerWaalsContact OE2-CB 3.23Å; E743-S988 WeakPolarHBondContact OE2-CB 3.36Å; E743-S988 PolarHBondContact OE2-OG 3.31Å
744	K	57.8	Low	72.2	Confident	189 Å²	189	59.7 Å²	59.7	82%	0.822	29%	0.288	S	S	*	.			trans	-63.5	95.7	-176.6	-81.5	178.6	174.2	176.3	0	111	F746	K744-F746 VanDerWaalsContact C-N 3.33Å; K744-F746 PolarHBondContact O-N 3.32Å
745	Y	61.7	Low	73.2	Confident	13 Å²	13	56.7 Å²	56.7	5%	0.051	27%	0.269	C	S	.	.			trans	-80.6	-6.2	177.4	-69.2	-66.6	0	0	0	115.7	I740 K741 M742 E743 G747 L748 Y749	I740-Y745 PolarHBondContact O-OH 3.05Å; K741-Y745 VanDerWaalsContact CA-CE2 3.49Å; K741-Y745 HydrophobicContact CB-CE2 4.35Å; M742-Y745 VanDerWaalsContact C-CE2 3.48Å; M742-Y745 VanDerWaalsContact N-CE2 3.31Å; M742-Y745 PolarHBondContact N-OH 3.12Å; M742-Y745 WeakPolarHBondContact O-CE2 3.41Å; M742-Y745 PolarHBondContact O-OH 2.93Å; E743-Y745 WeakPolarHBondContact O-CD2 3.27Å; E743-Y745 WeakPolarHBondContact O-CE2 3.34Å; E743-Y745 PolarHBondContact O-N 3.19Å; Y745-G747 PolarHBondContact O-N 3.02Å; Y745-G747 VanDerWaalsContact O-N 3.16Å; Y745-L748 HydrophobicContact CD1-CD1 4.26Å; Y745-L748 PolarHBondContact O-N 3.2Å; Y745-Y749 AromaticContact CD1-CE2 3.31Å; Y745-Y749 HydrophobicContact CD1-CE2 3.31Å; Y745-Y749 AromaticContact CD1-CZ 3.52Å; Y745-Y749 WeakPolarHBondContact CD1-OH 3.47Å; Y745-Y749 HydrophobicContact CE1-CE2 4.1Å; Y745-Y749 AromaticContact CE1-CZ 3.91Å; Y745-Y749 WeakPolarHBondContact CE1-OH 3.33Å; Y745-Y749 AromaticContact CG-CE2 3.92Å; Y745-Y749 HydrophobicContact CG-CE2 3.92Å
746	F	62.3	Low	74.4	Confident	144 Å²	144	51.9 Å²	51.9	63%	0.632	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	120.6	-177.8	-77.6	-80.2	0	0	0	110.6	I733 K744	I733-F746 HydrophobicContact CD1-CD1 3.93Å; I733-F746 HydrophobicContact CD1-CE1 4.13Å; I733-F746 HydrophobicContact CD1-CG 4.46Å; K744-F746 VanDerWaalsContact C-N 3.33Å; K744-F746 PolarHBondContact O-N 3.32Å
747	G	71.6	Confident	75.5	Confident	16 Å²	16	51.8 Å²	51.8	17%	0.165	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	15.4	176.5	0	0	0	0	0	115.8	S727 N729 Y745	S727-G747 WeakPolarHBondContact CB-O 3.34Å; N729-G747 PolarHBondContact OD1-N 3.41Å; Y745-G747 PolarHBondContact O-N 3.02Å; Y745-G747 VanDerWaalsContact O-N 3.16Å
748	L	82.8	Confident	76.4	Confident	20 Å²	20	51.7 Å²	51.7	11%	0.105	25%	0.246	C	C	.	.	S	Bend	trans	-94.2	-22.4	179.4	-65.5	-175.2	0	0	0	114.6	Y745 N827	Y745-L748 HydrophobicContact CD1-CD1 4.26Å; Y745-L748 PolarHBondContact O-N 3.2Å; L748-N827 VanDerWaalsContact O-CB 3.3Å; L748-N827 WeakPolarHBondContact O-CB 3.33Å; L748-N827 PolarHBondContact O-ND2 3.17Å
749	Y	87.2	Confident	77.2	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.008	22%	0.218	C	C	.	.	S	Bend	trans	-120.3	152.4	-168.4	-53.8	-61.7	0	0	0	112.3	S727 T728 I736 Y745 L754 N827 L831	S727-Y749 WeakPolarHBondContact CA-O 3.5Å; T728-Y749 PolarHBondContact N-O 3.47Å; I736-Y749 HydrophobicContact CD1-CE2 4.44Å; Y745-Y749 AromaticContact CD1-CE2 3.31Å; Y745-Y749 HydrophobicContact CD1-CE2 3.31Å; Y745-Y749 AromaticContact CD1-CZ 3.52Å; Y745-Y749 WeakPolarHBondContact CD1-OH 3.47Å; Y745-Y749 HydrophobicContact CE1-CE2 4.1Å; Y745-Y749 AromaticContact CE1-CZ 3.91Å; Y745-Y749 WeakPolarHBondContact CE1-OH 3.33Å; Y745-Y749 AromaticContact CG-CE2 3.92Å; Y745-Y749 HydrophobicContact CG-CE2 3.92Å; Y749-L754 HydrophobicContact CD2-CD2 4.14Å; Y749-L754 HydrophobicContact CG-CD2 4.44Å; Y749-N827 HydrophobicContact CD1-CB 3.78Å; Y749-N827 HydrophobicContact CE1-CB 3.7Å; Y749-N827 WeakPolarHBondContact CE1-O 3.42Å; Y749-L831 HydrophobicContact CD1-CB 4.22Å; Y749-L831 HydrophobicContact CD1-CD2 3.94Å; Y749-L831 HydrophobicContact CD2-CD2 4.21Å; Y749-L831 HydrophobicContact CE1-CB 3.72Å; Y749-L831 HydrophobicContact CE1-CD2 4.03Å; Y749-L831 HydrophobicContact CE1-CG 4.31Å; Y749-L831 HydrophobicContact CE2-CD1 4.48Å; Y749-L831 HydrophobicContact CE2-CD2 4.25Å; Y749-L831 HydrophobicContact CG-CD2 4.04Å
750	S	90.2	Very high	78.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.198	C	C	.	.			trans	-84.5	166.8	165.5	75.9	0	0	0	0	111.3	D723 S752 S753 N828	D723-S750 VanDerWaalsContact OD1-CB 3.27Å; D723-S750 WeakPolarHBondContact OD1-CB 3.49Å; D723-S750 PolarHBondContact OD1-OG 3.35Å; D723-S750 WeakPolarHBondContact OD2-CB 3.47Å; D723-S750 PolarHBondContact OD2-OG 3.35Å; S750-S752 VanDerWaalsContact C-N 3.3Å; S750-S752 PolarHBondContact O-N 3.41Å; S750-S752 PolarHBondContact OG-OG 3.03Å; S750-S753 PolarHBondContact O-OG 3.46Å; S750-S753 VanDerWaalsContact O-OG 3.13Å; S750-N828 PolarHBondContact N-OD1 3.07Å; S750-N828 PolarHBondContact OG-ND2 3.07Å
751	I	88	Confident	79.3	Confident	54 Å²	54	42.1 Å²	42.1	28%	0.277	20%	0.201	S	C	.	.	H	α-helix	trans	-64	-35.2	-177.1	-61	176.2	0	0	0	111.7	T728 S753 L754 Q755	T728-I751 HydrophobicContact CG2-CD1 4.16Å; T728-I751 HydrophobicContact CG2-CG1 3.97Å; T728-I751 WeakPolarHBondContact OG1-CG1 3.45Å; I751-S753 PolarHBondContact O-N 3.41Å; I751-L754 PolarHBondContact O-N 3.13Å; I751-Q755 HydrophobicContact CG2-CG 3.93Å; I751-Q755 WeakPolarHBondContact O-CB 3.25Å; I751-Q755 WeakPolarHBondContact O-CG 3.48Å; I751-Q755 PolarHBondContact O-N 3.24Å
752	S	91.9	Very high	80.3	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-41.9	-173.8	72.3	0	0	0	0	112.8	D723 S750 Q755 I756 Y796	D723-S752 VanDerWaalsContact OD2-CB 3.31Å; D723-S752 WeakPolarHBondContact OD2-CB 3.49Å; D723-S752 PolarHBondContact OD2-OG 3.41Å; S750-S752 VanDerWaalsContact C-N 3.3Å; S750-S752 PolarHBondContact O-N 3.41Å; S750-S752 PolarHBondContact OG-OG 3.03Å; S752-Q755 PolarHBondContact O-N 2.86Å; S752-I756 WeakPolarHBondContact O-CD1 3.18Å; S752-I756 VanDerWaalsContact O-CG1 3.29Å; S752-I756 WeakPolarHBondContact O-CG1 3.47Å; S752-I756 PolarHBondContact O-N 2.9Å; S752-I756 VanDerWaalsContact O-N 3.07Å; S752-Y796 WeakPolarHBondContact OG-CE2 3.48Å; S752-Y796 PolarHBondContact OG-OH 3.07Å
753	S	91.1	Very high	82	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.4	-41.8	178.2	66	0	0	0	0	110.9	S750 I751 Q755 I756 I757 Y796 N828	S750-S753 PolarHBondContact O-OG 3.46Å; S750-S753 VanDerWaalsContact O-OG 3.13Å; I751-S753 PolarHBondContact O-N 3.41Å; S753-Q755 PolarHBondContact O-N 3.37Å; S753-I756 PolarHBondContact O-N 2.78Å; S753-I757 VanDerWaalsContact O-CG1 3.3Å; S753-I757 WeakPolarHBondContact O-CG1 3.42Å; S753-I757 PolarHBondContact O-N 2.81Å; S753-Y796 WeakPolarHBondContact CB-OH 3.49Å; S753-Y796 PolarHBondContact N-OH 2.82Å; S753-N828 WeakPolarHBondContact CB-OD1 3.49Å; S753-N828 PolarHBondContact OG-OD1 3.48Å
754	L	89.5	Confident	83.6	Confident	5 Å²	5	29.2 Å²	29.2	3%	0.026	14%	0.138	C	C	.	.	H	α-helix	trans	-63.5	-40.5	176.2	-63.7	178.2	0	0	0	112.1	L732 I733 I736 Y749 I751 I757 N758 L831	L732-L754 HydrophobicContact CB-CB 4.37Å; L732-L754 HydrophobicContact CB-CD1 4.42Å; I733-L754 HydrophobicContact CG1-CD1 4.45Å; I736-L754 HydrophobicContact CD1-CD2 3.81Å; I736-L754 HydrophobicContact CG1-CD2 4.3Å; Y749-L754 HydrophobicContact CD2-CD2 4.14Å; Y749-L754 HydrophobicContact CG-CD2 4.44Å; I751-L754 PolarHBondContact O-N 3.13Å; L754-I757 PolarHBondContact O-N 2.99Å; L754-N758 VanDerWaalsContact O-CB 3.32Å; L754-N758 WeakPolarHBondContact O-CB 3.22Å; L754-N758 PolarHBondContact O-N 3.34Å; L754-L831 HydrophobicContact CD2-CD2 4.07Å
755	Q	88.7	Confident	84.9	Confident	60 Å²	60	24.4 Å²	24.4	28%	0.28	12%	0.121	S	C	.	.	H	α-helix	trans	-63.3	-41.4	176.1	-77.3	175.2	-17.3	0	0	111.9	D719 L732 I751 S752 S753 N758 N759	D719-Q755 PolarHBondContact OD2-OE1 3.17Å; L732-Q755 HydrophobicContact CD1-CG 4.39Å; I751-Q755 HydrophobicContact CG2-CG 3.93Å; I751-Q755 WeakPolarHBondContact O-CB 3.25Å; I751-Q755 WeakPolarHBondContact O-CG 3.48Å; I751-Q755 PolarHBondContact O-N 3.24Å; S752-Q755 PolarHBondContact O-N 2.86Å; S753-Q755 PolarHBondContact O-N 3.37Å; Q755-N758 PolarHBondContact O-N 3.27Å; Q755-N759 VanDerWaalsContact O-CB 3.32Å; Q755-N759 WeakPolarHBondContact O-CB 3.24Å; Q755-N759 PolarHBondContact O-N 3.41Å; Q755-N759 PolarHBondContact O-ND2 3.4Å; Q755-N759 VanDerWaalsContact O-ND2 3.13Å
756	I	91.1	Very high	85.8	Confident	3 Å²	3	24.8 Å²	24.8	2%	0.015	13%	0.125	C	C	.	.	H	α-helix	trans	-63.2	-47	176.1	-67.4	163.1	0	0	0	110.8	M716 S752 S753 N758 N759 L760 V792 T793 Y796	M716-I756 HydrophobicContact CB-CD1 4.41Å; M716-I756 HydrophobicContact CB-CG1 4.33Å; M716-I756 HydrophobicContact CG-CD1 3.68Å; M716-I756 HydrophobicContact CG-CG1 4.11Å; S752-I756 WeakPolarHBondContact O-CD1 3.18Å; S752-I756 VanDerWaalsContact O-CG1 3.29Å; S752-I756 WeakPolarHBondContact O-CG1 3.47Å; S752-I756 PolarHBondContact O-N 2.9Å; S752-I756 VanDerWaalsContact O-N 3.07Å; S753-I756 PolarHBondContact O-N 2.78Å; I756-N758 VanDerWaalsContact C-N 3.34Å; I756-N758 PolarHBondContact O-N 3.36Å; I756-N759 PolarHBondContact O-N 3.45Å; I756-L760 HydrophobicContact CG2-CD1 3.95Å; I756-L760 HydrophobicContact CG2-CG 4.47Å; I756-L760 WeakPolarHBondContact O-CG 3.16Å; I756-L760 PolarHBondContact O-N 3.32Å; I756-V792 HydrophobicContact CG2-CG1 4.38Å; I756-T793 HydrophobicContact CG2-CG2 4.49Å; I756-Y796 HydrophobicContact CD1-CD1 3.8Å; I756-Y796 HydrophobicContact CD1-CD2 3.06Å; I756-Y796 HydrophobicContact CD1-CE1 4.12Å; I756-Y796 HydrophobicContact CD1-CE2 3.41Å; I756-Y796 VanDerWaalsContact CD1-CE2 3.41Å; I756-Y796 HydrophobicContact CD1-CG 3.26Å
757	I	90.3	Very high	87	Confident	2 Å²	2	18.4 Å²	18.4	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-60.9	-44.1	176.8	-64.4	-65.6	0	0	0	111.1	S753 L754 L760 T761 L831 I832 F835	S753-I757 VanDerWaalsContact O-CG1 3.3Å; S753-I757 WeakPolarHBondContact O-CG1 3.42Å; S753-I757 PolarHBondContact O-N 2.81Å; L754-I757 PolarHBondContact O-N 2.99Å; I757-L760 PolarHBondContact O-N 2.89Å; I757-T761 VanDerWaalsContact O-CB 3.27Å; I757-T761 WeakPolarHBondContact O-CB 2.97Å; I757-T761 PolarHBondContact O-N 3.09Å; I757-T761 PolarHBondContact O-OG1 3.18Å; I757-L831 HydrophobicContact CD1-CG 4.39Å; I757-L831 HydrophobicContact CG1-CD2 4.09Å; I757-L831 HydrophobicContact CG1-CG 4.1Å; I757-I832 HydrophobicContact CD1-CG2 4.5Å; I757-F835 HydrophobicContact CD1-CB 3.37Å; I757-F835 HydrophobicContact CD1-CD1 4.24Å; I757-F835 HydrophobicContact CD1-CD2 3.53Å; I757-F835 HydrophobicContact CD1-CE2 4.35Å; I757-F835 HydrophobicContact CD1-CG 3.45Å; I757-F835 VanDerWaalsContact CD1-CG 3.45Å; I757-F835 HydrophobicContact CG2-CD2 4.04Å; I757-F835 HydrophobicContact CG2-CE2 4.21Å
758	N	87.5	Confident	87.5	Confident	19 Å²	19	20.9 Å²	20.9	10%	0.102	11%	0.105	C	C	.	.	H	α-helix	trans	-60.4	-48.2	176.8	-178.1	26.1	0	0	0	111.1	F735 L754 Q755 I756 L760 T761 R762	F735-N758 HydrophobicContact CB-CB 4.46Å; L754-N758 VanDerWaalsContact O-CB 3.32Å; L754-N758 WeakPolarHBondContact O-CB 3.22Å; L754-N758 PolarHBondContact O-N 3.34Å; Q755-N758 PolarHBondContact O-N 3.27Å; I756-N758 VanDerWaalsContact C-N 3.34Å; I756-N758 PolarHBondContact O-N 3.36Å; N758-L760 PolarHBondContact O-N 3.4Å; N758-T761 PolarHBondContact O-N 3.36Å; N758-R762 VanDerWaalsContact O-CG 3.25Å; N758-R762 WeakPolarHBondContact O-CG 3.27Å; N758-R762 PolarHBondContact O-N 3.31Å
759	N	88	Confident	87.2	Confident	15 Å²	15	24 Å²	24	8%	0.08	12%	0.121	C	C	.	.	H	α-helix	trans	-60.8	-46	178.4	-72.1	-28.8	0	0	0	111.6	M8 L712 Q755 I756 T761 R762 L763	M8-N759 HydrophobicContact CE-CB 3.62Å; M8-N759 WeakPolarHBondContact CE-O 3.34Å; L712-N759 HydrophobicContact CD2-CB 3.51Å; Q755-N759 VanDerWaalsContact O-CB 3.32Å; Q755-N759 WeakPolarHBondContact O-CB 3.24Å; Q755-N759 PolarHBondContact O-N 3.41Å; Q755-N759 PolarHBondContact O-ND2 3.4Å; Q755-N759 VanDerWaalsContact O-ND2 3.13Å; I756-N759 PolarHBondContact O-N 3.45Å; N759-T761 PolarHBondContact O-N 3.43Å; N759-R762 WeakPolarHBondContact O-CB 3.44Å; N759-R762 PolarHBondContact O-N 3.24Å; N759-L763 PolarHBondContact O-N 3.21Å
760	L	91.4	Very high	87	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-65.7	-37.3	176.3	-68.9	172.9	0	0	0	112.7	L712 I756 I757 N758 R762 L763 I764 A789 T793 F835	L712-L760 HydrophobicContact CD1-CD2 3.99Å; L712-L760 HydrophobicContact CD2-CD2 4.33Å; I756-L760 HydrophobicContact CG2-CD1 3.95Å; I756-L760 HydrophobicContact CG2-CG 4.47Å; I756-L760 WeakPolarHBondContact O-CG 3.16Å; I756-L760 PolarHBondContact O-N 3.32Å; I757-L760 PolarHBondContact O-N 2.89Å; N758-L760 PolarHBondContact O-N 3.4Å; L760-R762 VanDerWaalsContact C-N 3.32Å; L760-R762 PolarHBondContact O-N 2.88Å; L760-L763 WeakPolarHBondContact O-CB 3.15Å; L760-L763 PolarHBondContact O-N 3.14Å; L760-I764 WeakPolarHBondContact O-CG1 3.24Å; L760-I764 PolarHBondContact O-N 2.86Å; L760-A789 HydrophobicContact CD2-CB 3.97Å; L760-T793 HydrophobicContact CD1-CG2 3.67Å; L760-F835 HydrophobicContact CB-CE1 3.65Å; L760-F835 HydrophobicContact CB-CE2 4.5Å; L760-F835 HydrophobicContact CB-CZ 3.55Å; L760-F835 HydrophobicContact CD1-CD1 4.06Å; L760-F835 HydrophobicContact CD1-CE1 3.73Å; L760-F835 HydrophobicContact CD1-CZ 4.42Å; L760-F835 HydrophobicContact CG-CE1 4.3Å
761	T	87.8	Confident	86.5	Confident	15 Å²	15	27 Å²	27	9%	0.092	14%	0.138	C	C	.	.	H	α-helix	trans	-64.2	-39.8	175.6	-58.5	0	0	0	0	110.8	I757 N758 N759 I764 N765	I757-T761 VanDerWaalsContact O-CB 3.27Å; I757-T761 WeakPolarHBondContact O-CB 2.97Å; I757-T761 PolarHBondContact O-N 3.09Å; I757-T761 PolarHBondContact O-OG1 3.18Å; N758-T761 PolarHBondContact O-N 3.36Å; N759-T761 PolarHBondContact O-N 3.43Å; T761-I764 PolarHBondContact O-N 3.43Å; T761-N765 WeakPolarHBondContact O-CB 3.35Å; T761-N765 PolarHBondContact O-N 3.46Å; T761-N765 PolarHBondContact O-ND2 3.4Å
762	R	83	Confident	86.3	Confident	47 Å²	47	24.7 Å²	24.7	18%	0.177	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-45.5	173.4	-70.3	166.9	67.1	170.4	10.7	111.7	M8 N9 N758 N759 L760 I764 N765 T766	M8-R762 VanDerWaalsContact C-NH2 3.34Å; M8-R762 PolarHBondContact O-NH2 3.19Å; N9-R762 VanDerWaalsContact CA-NH2 3.27Å; N9-R762 PolarHBondContact OD1-NH1 2.94Å; N9-R762 PolarHBondContact OD1-NH2 3.48Å; N758-R762 VanDerWaalsContact O-CG 3.25Å; N758-R762 WeakPolarHBondContact O-CG 3.27Å; N758-R762 PolarHBondContact O-N 3.31Å; N759-R762 WeakPolarHBondContact O-CB 3.44Å; N759-R762 PolarHBondContact O-N 3.24Å; L760-R762 VanDerWaalsContact C-N 3.32Å; L760-R762 PolarHBondContact O-N 2.88Å; R762-I764 VanDerWaalsContact C-N 3.32Å; R762-I764 PolarHBondContact O-N 3.19Å; R762-N765 PolarHBondContact O-N 2.91Å; R762-T766 WeakPolarHBondContact O-CB 3.31Å; R762-T766 PolarHBondContact O-N 3.36Å; R762-T766 PolarHBondContact O-OG1 2.77Å
763	L	86.6	Confident	85.6	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-54.8	-48.3	174	174.1	66.8	0	0	0	111.4	W704 C708 L712 N759 L760 T766 W767 I785 I788	W704-L763 HydrophobicContact CH2-CD1 3.57Å; W704-L763 HydrophobicContact CZ2-CD1 3.68Å; W704-L763 HydrophobicContact CZ3-CD1 4.42Å; C708-L763 HydrophobicContact CB-CD1 3.85Å; L712-L763 HydrophobicContact CD1-CD2 3.87Å; N759-L763 PolarHBondContact O-N 3.21Å; L760-L763 WeakPolarHBondContact O-CB 3.15Å; L760-L763 PolarHBondContact O-N 3.14Å; L763-T766 PolarHBondContact O-N 3.22Å; L763-W767 WeakPolarHBondContact O-CB 3.14Å; L763-W767 PolarHBondContact O-N 3.1Å; L763-I785 HydrophobicContact CD2-CG2 4.02Å; L763-I785 HydrophobicContact CG-CG2 4.33Å; L763-I788 HydrophobicContact CD2-CG2 4.44Å
764	I	88	Confident	85.1	Confident	5 Å²	5	28.8 Å²	28.8	3%	0.026	15%	0.151	C	C	.	.	H	α-helix	trans	-63.4	-45.3	179.2	-68.3	171.6	0	0	0	111.1	L760 T761 R762 T766 W767 I768 F835 I839 F842 L843	L760-I764 WeakPolarHBondContact O-CG1 3.24Å; L760-I764 PolarHBondContact O-N 2.86Å; T761-I764 PolarHBondContact O-N 3.43Å; R762-I764 VanDerWaalsContact C-N 3.32Å; R762-I764 PolarHBondContact O-N 3.19Å; I764-T766 PolarHBondContact O-N 3.23Å; I764-W767 WeakPolarHBondContact O-CB 3.23Å; I764-W767 PolarHBondContact O-N 3.25Å; I764-I768 HydrophobicContact CG2-CD1 3.92Å; I764-I768 WeakPolarHBondContact O-CG1 3.3Å; I764-I768 PolarHBondContact O-N 3.05Å; I764-F835 HydrophobicContact CD1-CE1 4.27Å; I764-F835 HydrophobicContact CD1-CZ 3.7Å; I764-I839 HydrophobicContact CD1-CG1 4.13Å; I764-F842 HydrophobicContact CD1-CB 4Å; I764-F842 HydrophobicContact CD1-CD2 4.48Å; I764-F842 HydrophobicContact CG2-CB 4.14Å; I764-F842 WeakPolarHBondContact CG2-O 3.34Å; I764-L843 HydrophobicContact CB-CD2 4.41Å; I764-L843 HydrophobicContact CG1-CD2 4.06Å; I764-L843 HydrophobicContact CG1-CG 4.31Å; I764-L843 HydrophobicContact CG2-CD2 4Å; I764-L843 HydrophobicContact CG2-CG 4.3Å
765	N	84	Confident	84.4	Confident	89 Å²	89	33.3 Å²	33.3	48%	0.476	17%	0.172	S	C	.	.	H	α-helix	trans	-65.1	-40.7	179.8	-70.8	-14	0	0	0	112	T761 R762 W767 I768 L769	T761-N765 WeakPolarHBondContact O-CB 3.35Å; T761-N765 PolarHBondContact O-N 3.46Å; T761-N765 PolarHBondContact O-ND2 3.4Å; R762-N765 PolarHBondContact O-N 2.91Å; N765-W767 VanDerWaalsContact C-N 3.33Å; N765-I768 PolarHBondContact O-N 3.48Å; N765-L769 PolarHBondContact O-N 3.32Å
766	T	80.4	Confident	83.8	Confident	21 Å²	21	37 Å²	37	13%	0.129	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-40.1	173.5	-57.9	0	0	0	0	111	F663 W704 R762 L763 I764 I768 L769 I770	F663-T766 HydrophobicContact CZ-CG2 4.14Å; W704-T766 HydrophobicContact CH2-CG2 4.22Å; W704-T766 HydrophobicContact CZ2-CG2 3.47Å; W704-T766 VanDerWaalsContact CZ2-CG2 3.47Å; R762-T766 WeakPolarHBondContact O-CB 3.31Å; R762-T766 PolarHBondContact O-N 3.36Å; R762-T766 PolarHBondContact O-OG1 2.77Å; L763-T766 PolarHBondContact O-N 3.22Å; I764-T766 PolarHBondContact O-N 3.23Å; T766-I768 PolarHBondContact O-N 3.49Å; T766-L769 WeakPolarHBondContact O-CB 3.38Å; T766-L769 PolarHBondContact O-N 2.84Å; T766-I770 HydrophobicContact CG2-CD1 4.4Å; T766-I770 VanDerWaalsContact O-CG1 3.31Å; T766-I770 WeakPolarHBondContact O-CG1 3.48Å; T766-I770 PolarHBondContact O-N 2.76Å
767	W	87.2	Confident	83.5	Confident	9 Å²	9	37.4 Å²	37.4	3%	0.034	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-42	173.5	172	-103.8	0	0	0	113.1	I701 W704 L763 I764 N765 L769 I770 D771 W772 K778 Y781 I782 I785 L843	I701-W767 HydrophobicContact CG2-CZ3 4.33Å; W704-W767 HydrophobicContact CH2-CB 4.28Å; W704-W767 HydrophobicContact CZ3-CE3 4.24Å; L763-W767 WeakPolarHBondContact O-CB 3.14Å; L763-W767 PolarHBondContact O-N 3.1Å; I764-W767 WeakPolarHBondContact O-CB 3.23Å; I764-W767 PolarHBondContact O-N 3.25Å; N765-W767 VanDerWaalsContact C-N 3.33Å; W767-L769 VanDerWaalsContact C-N 3.29Å; W767-L769 PolarHBondContact O-N 3.49Å; W767-I770 HydrophobicContact CE3-CD1 4.28Å; W767-I770 HydrophobicContact CZ3-CG2 4.38Å; W767-I770 WeakPolarHBondContact O-CB 3.33Å; W767-I770 PolarHBondContact O-N 2.87Å; W767-D771 PolarHBondContact O-N 3.45Å; W767-W772 HydrophobicContact CH2-CB 3.86Å; W767-W772 HydrophobicContact CH2-CG 4.47Å; W767-W772 HydrophobicContact CZ3-CB 4.41Å; W767-K778 HydrophobicContact CH2-CG 4.43Å; W767-K778 HydrophobicContact CZ2-CG 3.86Å; W767-Y781 AromaticContact CH2-CD2 3.84Å; W767-Y781 HydrophobicContact CH2-CD2 3.84Å; W767-Y781 HydrophobicContact CH2-CG 4Å; W767-Y781 HydrophobicContact CZ3-CD2 4.09Å; W767-Y781 HydrophobicContact CZ3-CG 4.1Å; W767-I782 HydrophobicContact CZ2-CD1 4.23Å; W767-I782 HydrophobicContact CZ2-CG1 3.6Å; W767-I785 HydrophobicContact CB-CD1 3.74Å; W767-I785 HydrophobicContact CD2-CD1 3.39Å; W767-I785 HydrophobicContact CE3-CD1 3.6Å; W767-I785 HydrophobicContact CG-CD1 3.44Å; W767-I785 VanDerWaalsContact CG-CD1 3.44Å; W767-I785 HydrophobicContact CZ3-CD1 4.43Å; W767-L843 HydrophobicContact CG-CD2 4.32Å
768	I	83.3	Confident	83.4	Confident	68 Å²	68	40 Å²	40	35%	0.349	20%	0.203	S	C	.	.	H	α-helix	trans	-62.4	-39.9	175.3	-66.6	165.1	0	0	0	110.5	I764 N765 T766 D771	I764-I768 HydrophobicContact CG2-CD1 3.92Å; I764-I768 WeakPolarHBondContact O-CG1 3.3Å; I764-I768 PolarHBondContact O-N 3.05Å; N765-I768 PolarHBondContact O-N 3.48Å; T766-I768 PolarHBondContact O-N 3.49Å; I768-D771 PolarHBondContact O-N 3.45Å
769	L	76.5	Confident	83.5	Confident	85 Å²	85	40.1 Å²	40.1	45%	0.445	20%	0.202	S	C	.	.	H	α-helix	trans	-66.1	-34.7	176.8	-174.2	70.6	0	0	0	112.9	L667 N765 T766 W767 D771	L667-L769 HydrophobicContact CD1-CD2 4.38Å; L667-L769 HydrophobicContact CD2-CG 4.39Å; N765-L769 PolarHBondContact O-N 3.32Å; T766-L769 WeakPolarHBondContact O-CB 3.38Å; T766-L769 PolarHBondContact O-N 2.84Å; W767-L769 VanDerWaalsContact C-N 3.29Å; W767-L769 PolarHBondContact O-N 3.49Å; L769-D771 PolarHBondContact O-N 2.85Å
770	I	81.9	Confident	83.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-36.1	176.3	-73.5	164.8	0	0	0	110.5	F663 Y666 I701 W704 T766 W767 W772	F663-I770 HydrophobicContact CE2-CD1 3.72Å; F663-I770 HydrophobicContact CE2-CG1 3.87Å; F663-I770 HydrophobicContact CZ-CD1 3.75Å; F663-I770 HydrophobicContact CZ-CG1 3.71Å; Y666-I770 HydrophobicContact CE1-CB 4.42Å; Y666-I770 HydrophobicContact CE1-CG2 3.81Å; Y666-I770 WeakPolarHBondContact CE1-O 3.5Å; Y666-I770 PolarHBondContact OH-O 3.23Å; I701-I770 HydrophobicContact CD1-CD1 4.24Å; I701-I770 HydrophobicContact CD1-CG2 4.12Å; W704-I770 HydrophobicContact CD2-CD1 4.28Å; W704-I770 HydrophobicContact CE3-CD1 3.78Å; W704-I770 HydrophobicContact CH2-CD1 3.81Å; W704-I770 HydrophobicContact CZ2-CD1 4.26Å; W704-I770 HydrophobicContact CZ3-CD1 3.55Å; T766-I770 HydrophobicContact CG2-CD1 4.4Å; T766-I770 VanDerWaalsContact O-CG1 3.31Å; T766-I770 WeakPolarHBondContact O-CG1 3.48Å; T766-I770 PolarHBondContact O-N 2.76Å; W767-I770 HydrophobicContact CE3-CD1 4.28Å; W767-I770 HydrophobicContact CZ3-CG2 4.38Å; W767-I770 WeakPolarHBondContact O-CB 3.33Å; W767-I770 PolarHBondContact O-N 2.87Å; I770-W772 HydrophobicContact CG2-CB 4.29Å; I770-W772 HydrophobicContact CG2-CE3 4.15Å; I770-W772 PolarHBondContact O-N 3.37Å
771	D	79.7	Confident	83.6	Confident	66 Å²	66	42.4 Å²	42.4	35%	0.353	21%	0.214	S	C	.	.			trans	43	58.8	178.7	-174.8	44.3	0	0	0	113.3	K670 W767 I768 L769 S773	K670-D771 WeakPolarHBondContact CE-O 3.23Å; K670-D771 WeakPolarHBondContact CE-OD2 3.11Å; K670-D771 PolarHBondContact NZ-O 3.5Å; K670-D771 VanDerWaalsContact NZ-O 3.17Å; K670-D771 IonicContact NZ-OD2 3.49Å; K670-D771 PolarHBondContact NZ-OD2 3.49Å; W767-D771 PolarHBondContact O-N 3.45Å; I768-D771 PolarHBondContact O-N 3.45Å; L769-D771 PolarHBondContact O-N 2.85Å; D771-S773 PolarHBondContact O-N 3.31Å
772	W	84.6	Confident	83.8	Confident	5 Å²	5	41.9 Å²	41.9	2%	0.019	21%	0.211	C	C	.	.			trans	-61	122.5	-173.2	-168	-103.6	0	0	0	112.1	Y666 Y694 F697 R698 I701 W767 I770 T777 K778 Y781	Y666-W772 HydrophobicContact CE2-CE3 4.14Å; Y666-W772 AromaticContact CE2-CZ3 3.76Å; Y666-W772 HydrophobicContact CE2-CZ3 3.76Å; Y666-W772 AromaticContact CZ-CE3 3.83Å; Y666-W772 AromaticContact CZ-CZ3 3.89Å; Y694-W772 HydrophobicContact CD2-CZ2 4.39Å; Y694-W772 WeakPolarHBondContact O-CH2 3.47Å; F697-W772 HydrophobicContact CB-CH2 4.44Å; F697-W772 HydrophobicContact CB-CZ3 4.46Å; R698-W772 HydrophobicContact CB-CH2 4.35Å; R698-W772 HydrophobicContact CB-CZ2 4.24Å; I701-W772 HydrophobicContact CD1-CZ3 4.24Å; I701-W772 HydrophobicContact CG1-CE3 3.86Å; I701-W772 HydrophobicContact CG1-CH2 4.01Å; I701-W772 HydrophobicContact CG1-CZ3 3.41Å; I701-W772 VanDerWaalsContact CG1-CZ3 3.41Å; W767-W772 HydrophobicContact CH2-CB 3.86Å; W767-W772 HydrophobicContact CH2-CG 4.47Å; W767-W772 HydrophobicContact CZ3-CB 4.41Å; I770-W772 HydrophobicContact CG2-CB 4.29Å; I770-W772 HydrophobicContact CG2-CE3 4.15Å; I770-W772 PolarHBondContact O-N 3.37Å; W772-T777 PolarHBondContact NE1-OG1 2.88Å; W772-K778 HydrophobicContact CB-CB 4.48Å; W772-K778 HydrophobicContact CB-CG 4.46Å; W772-Y781 HydrophobicContact CD2-CE2 4.37Å; W772-Y781 AromaticContact CE2-CE2 3.96Å; W772-Y781 HydrophobicContact CG-CD2 4.49Å; W772-Y781 HydrophobicContact CZ2-CE2 4.3Å; W772-Y781 AromaticContact NE1-CE2 3.93Å
773	S	77.1	Confident	84.4	Confident	43 Å²	43	40.6 Å²	40.6	30%	0.301	21%	0.207	S	C	.	.	S	Bend	trans	-73.6	-31.5	-169.2	-55	0	0	0	0	114.9	K670 D771 E775	K670-S773 PolarHBondContact NZ-OG 3.42Å; D771-S773 PolarHBondContact O-N 3.31Å; S773-E775 PolarHBondContact O-N 3.38Å
774	D	81.3	Confident	84.7	Confident	45 Å²	45	43.5 Å²	43.5	24%	0.241	22%	0.221	C	C	.	.			trans	-82.5	109.3	179.7	167.1	30.5	0	0	0	111.2	Y694 Q776 T777 K778	Y694-D774 HydrophobicContact CD2-CB 4.49Å; Y694-D774 HydrophobicContact CE2-CB 3.68Å; D774-Q776 VanDerWaalsContact C-N 3.26Å; D774-Q776 PolarHBondContact O-N 3.44Å; D774-Q776 PolarHBondContact OD1-N 3.07Å; D774-T777 VanDerWaalsContact CG-OG1 3.27Å; D774-T777 PolarHBondContact O-N 2.89Å; D774-T777 VanDerWaalsContact OD2-CB 3.24Å; D774-T777 WeakPolarHBondContact OD2-CB 3.32Å; D774-T777 WeakPolarHBondContact OD2-CG2 3.29Å; D774-T777 PolarHBondContact OD2-N 3.45Å; D774-T777 PolarHBondContact OD2-OG1 3.01Å; D774-K778 WeakPolarHBondContact O-CB 3.4Å; D774-K778 PolarHBondContact O-N 3.27Å
775	E	74.2	Confident	85	Confident	99 Å²	99	43.3 Å²	43.3	46%	0.463	22%	0.22	S	C	.	.	H	α-helix	trans	-55.6	-38.6	-179.1	-65.7	-165.3	159	0	0	113	S773 Y779	S773-E775 PolarHBondContact O-N 3.38Å; E775-Y779 WeakPolarHBondContact O-CD2 3.25Å; E775-Y779 WeakPolarHBondContact O-CE2 3.44Å; E775-Y779 PolarHBondContact O-N 2.93Å
776	Q	76.2	Confident	85.5	Confident	138 Å²	138	39.1 Å²	39.1	65%	0.645	20%	0.197	S	C	*	.	H	α-helix	trans	-69.7	-46.2	-175.3	-170.1	178.9	1.5	0	0	111.4	D774 N780	D774-Q776 VanDerWaalsContact C-N 3.26Å; D774-Q776 PolarHBondContact O-N 3.44Å; D774-Q776 PolarHBondContact OD1-N 3.07Å; Q776-N780 PolarHBondContact O-ND2 3.37Å
777	T	84.9	Confident	86.3	Confident	12 Å²	12	42.2 Å²	42.2	7%	0.074	21%	0.21	C	C	.	.	H	α-helix	trans	-79.5	-25.6	177.7	56.7	0	0	0	0	113.3	W772 D774 Y779 N780 Y781	W772-T777 PolarHBondContact NE1-OG1 2.88Å; D774-T777 VanDerWaalsContact CG-OG1 3.27Å; D774-T777 PolarHBondContact O-N 2.89Å; D774-T777 VanDerWaalsContact OD2-CB 3.24Å; D774-T777 WeakPolarHBondContact OD2-CB 3.32Å; D774-T777 WeakPolarHBondContact OD2-CG2 3.29Å; D774-T777 PolarHBondContact OD2-N 3.45Å; D774-T777 PolarHBondContact OD2-OG1 3.01Å; T777-Y779 VanDerWaalsContact C-N 3.33Å; T777-Y779 PolarHBondContact O-N 3.4Å; T777-N780 WeakPolarHBondContact O-CB 3.27Å; T777-N780 PolarHBondContact O-N 3.26Å; T777-N780 VanDerWaalsContact O-N 3.1Å; T777-Y781 VanDerWaalsContact O-CD2 3.29Å; T777-Y781 WeakPolarHBondContact O-CD2 3.32Å; T777-Y781 PolarHBondContact O-N 3.49Å; T777-Y781 VanDerWaalsContact O-N 3.11Å
778	K	87.6	Confident	86.6	Confident	56 Å²	56	42.2 Å²	42.2	24%	0.243	21%	0.211	C	C	.	.	H	α-helix	trans	-51.7	-50.6	173.7	-178.2	180	-171.5	160.7	0	111.3	W767 W772 D774 N780 Y781 I782	W767-K778 HydrophobicContact CH2-CG 4.43Å; W767-K778 HydrophobicContact CZ2-CG 3.86Å; W772-K778 HydrophobicContact CB-CB 4.48Å; W772-K778 HydrophobicContact CB-CG 4.46Å; D774-K778 WeakPolarHBondContact O-CB 3.4Å; D774-K778 PolarHBondContact O-N 3.27Å; K778-N780 VanDerWaalsContact C-N 3.33Å; K778-N780 PolarHBondContact O-N 3.05Å; K778-Y781 PolarHBondContact O-N 3.27Å; K778-I782 HydrophobicContact CG-CD1 4.16Å; K778-I782 WeakPolarHBondContact O-CG1 3.37Å; K778-I782 PolarHBondContact O-N 3.21Å
779	Y	89.5	Confident	87.2	Confident	21 Å²	21	39.1 Å²	39.1	8%	0.082	20%	0.195	C	C	.	.	H	α-helix	trans	-70.4	-27.2	-179.3	-63.8	-64.8	0	0	0	113.5	E775 T777 Y781 I782 I783 I910 P911 H914	E775-Y779 WeakPolarHBondContact O-CD2 3.25Å; E775-Y779 WeakPolarHBondContact O-CE2 3.44Å; E775-Y779 PolarHBondContact O-N 2.93Å; T777-Y779 VanDerWaalsContact C-N 3.33Å; T777-Y779 PolarHBondContact O-N 3.4Å; Y779-Y781 VanDerWaalsContact C-N 3.35Å; Y779-I782 HydrophobicContact CD1-CD1 3.87Å; Y779-I782 HydrophobicContact CE1-CD1 4.21Å; Y779-I782 PolarHBondContact O-N 3.16Å; Y779-I783 VanDerWaalsContact O-CG1 3.26Å; Y779-I783 WeakPolarHBondContact O-CG1 3.32Å; Y779-I783 PolarHBondContact O-N 3.09Å; Y779-I910 HydrophobicContact CD1-CG2 4.03Å; Y779-I910 HydrophobicContact CE1-CB 4.38Å; Y779-I910 HydrophobicContact CE1-CD1 4.21Å; Y779-I910 HydrophobicContact CE1-CG1 4.11Å; Y779-I910 HydrophobicContact CE1-CG2 3.68Å; Y779-I910 HydrophobicContact CE2-CG2 4.21Å; Y779-I910 HydrophobicContact CG-CG2 4.46Å; Y779-P911 HydrophobicContact CD2-CG 4.44Å; Y779-H914 VanDerWaalsContact CB-CD2 3.42Å; Y779-H914 WeakPolarHBondContact CB-CD2 3.31Å; Y779-H914 HydrophobicContact CG-CB 4.3Å
780	N	90.4	Very high	88.1	Confident	60 Å²	60	35.9 Å²	35.9	32%	0.321	18%	0.179	S	C	.	.	H	α-helix	trans	-64.5	-41.4	172.3	-64.3	-24.9	0	0	0	111	Q776 T777 K778 I783 E784 H914	Q776-N780 PolarHBondContact O-ND2 3.37Å; T777-N780 WeakPolarHBondContact O-CB 3.27Å; T777-N780 PolarHBondContact O-N 3.26Å; T777-N780 VanDerWaalsContact O-N 3.1Å; K778-N780 VanDerWaalsContact C-N 3.33Å; K778-N780 PolarHBondContact O-N 3.05Å; N780-I783 WeakPolarHBondContact O-CB 3.44Å; N780-I783 PolarHBondContact O-N 3.05Å; N780-E784 PolarHBondContact O-N 3.37Å; N780-H914 PolarHBondContact OD1-CD2 3.42Å; N780-H914 PolarHBondContact OD1-NE2 2.9Å
781	Y	91.9	Very high	88.8	Confident	5 Å²	5	40.5 Å²	40.5	2%	0.02	20%	0.201	C	C	.	.	H	α-helix	trans	-69	-37.5	175.1	-66.7	-46.2	0	0	0	113.3	R698 I701 S702 I705 W767 W772 T777 K778 Y779 I783 E784 I785	R698-Y781 WeakPolarHBondContact CG-OH 3.5Å; R698-Y781 PolarHBondContact O-OH 3.26Å; R698-Y781 VanDerWaalsContact O-OH 3.11Å; I701-Y781 HydrophobicContact CB-CE2 4.49Å; I701-Y781 HydrophobicContact CG2-CD1 4.4Å; I701-Y781 HydrophobicContact CG2-CD2 4.16Å; I701-Y781 HydrophobicContact CG2-CE1 4.24Å; I701-Y781 HydrophobicContact CG2-CE2 3.96Å; I701-Y781 HydrophobicContact CG2-CG 4.35Å; S702-Y781 PolarHBondContact OG-OH 3.09Å; I705-Y781 HydrophobicContact CD1-CD1 3.39Å; I705-Y781 HydrophobicContact CD1-CE1 4.16Å; I705-Y781 HydrophobicContact CD1-CG 3.87Å; W767-Y781 AromaticContact CH2-CD2 3.84Å; W767-Y781 HydrophobicContact CH2-CD2 3.84Å; W767-Y781 HydrophobicContact CH2-CG 4Å; W767-Y781 HydrophobicContact CZ3-CD2 4.09Å; W767-Y781 HydrophobicContact CZ3-CG 4.1Å; W772-Y781 HydrophobicContact CD2-CE2 4.37Å; W772-Y781 AromaticContact CE2-CE2 3.96Å; W772-Y781 HydrophobicContact CG-CD2 4.49Å; W772-Y781 HydrophobicContact CZ2-CE2 4.3Å; W772-Y781 AromaticContact NE1-CE2 3.93Å; T777-Y781 VanDerWaalsContact O-CD2 3.29Å; T777-Y781 WeakPolarHBondContact O-CD2 3.32Å; T777-Y781 PolarHBondContact O-N 3.49Å; T777-Y781 VanDerWaalsContact O-N 3.11Å; K778-Y781 PolarHBondContact O-N 3.27Å; Y779-Y781 VanDerWaalsContact C-N 3.35Å; Y781-I783 VanDerWaalsContact C-N 3.26Å; Y781-I783 PolarHBondContact O-N 3.31Å; Y781-E784 PolarHBondContact O-N 2.96Å; Y781-I785 WeakPolarHBondContact O-CG1 3.33Å; Y781-I785 PolarHBondContact O-N 2.87Å
782	I	92.4	Very high	89.5	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.015	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-41.4	172.2	-65.6	172	0	0	0	110	W767 K778 Y779 E784 I785 V786 L843 V845 L918	W767-I782 HydrophobicContact CZ2-CD1 4.23Å; W767-I782 HydrophobicContact CZ2-CG1 3.6Å; K778-I782 HydrophobicContact CG-CD1 4.16Å; K778-I782 WeakPolarHBondContact O-CG1 3.37Å; K778-I782 PolarHBondContact O-N 3.21Å; Y779-I782 HydrophobicContact CD1-CD1 3.87Å; Y779-I782 HydrophobicContact CE1-CD1 4.21Å; Y779-I782 PolarHBondContact O-N 3.16Å; I782-E784 PolarHBondContact O-N 2.69Å; I782-I785 PolarHBondContact O-N 3.02Å; I782-V786 HydrophobicContact CG2-CG2 4.45Å; I782-V786 WeakPolarHBondContact O-CG2 3.39Å; I782-V786 PolarHBondContact O-N 3.31Å; I782-L843 HydrophobicContact CG2-CD1 4.1Å; I782-V845 HydrophobicContact CD1-CG2 4.28Å; I782-V845 HydrophobicContact CG2-CG2 4.05Å; I782-L918 HydrophobicContact CB-CD2 4.48Å; I782-L918 HydrophobicContact CG2-CD1 3.94Å; I782-L918 HydrophobicContact CG2-CD2 3.69Å; I782-L918 HydrophobicContact CG2-CG 4.5Å
783	I	94	Very high	90.1	Very high	21 Å²	21	37.2 Å²	37.2	11%	0.108	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-47.4	174.8	-74.6	166.1	0	0	0	110.8	Y779 N780 Y781 V786 Q787 T917 L918 L921	Y779-I783 VanDerWaalsContact O-CG1 3.26Å; Y779-I783 WeakPolarHBondContact O-CG1 3.32Å; Y779-I783 PolarHBondContact O-N 3.09Å; N780-I783 WeakPolarHBondContact O-CB 3.44Å; N780-I783 PolarHBondContact O-N 3.05Å; Y781-I783 VanDerWaalsContact C-N 3.26Å; Y781-I783 PolarHBondContact O-N 3.31Å; I783-V786 PolarHBondContact O-N 3.08Å; I783-Q787 VanDerWaalsContact O-CG 3.28Å; I783-Q787 WeakPolarHBondContact O-CG 3.45Å; I783-Q787 PolarHBondContact O-N 3.31Å; I783-T917 HydrophobicContact CD1-CG2 3.89Å; I783-T917 HydrophobicContact CG1-CG2 4.28Å; I783-T917 HydrophobicContact CG2-CG2 4.5Å; I783-L918 HydrophobicContact CB-CD2 4.32Å; I783-L918 HydrophobicContact CG1-CD2 3.6Å; I783-L918 HydrophobicContact CG1-CG 3.81Å; I783-L921 HydrophobicContact CG2-CD1 3.76Å
784	E	93.3	Very high	91.1	Very high	63 Å²	63	36.8 Å²	36.8	29%	0.294	18%	0.178	S	C	.	.	H	α-helix	trans	-61.4	-43.6	176.9	-70.9	178.8	-148.7	0	0	112.2	I705 N780 Y781 I782 V786 Q787 I788	I705-E784 HydrophobicContact CG2-CB 4.09Å; N780-E784 PolarHBondContact O-N 3.37Å; Y781-E784 PolarHBondContact O-N 2.96Å; I782-E784 PolarHBondContact O-N 2.69Å; E784-V786 PolarHBondContact O-N 3.02Å; E784-Q787 WeakPolarHBondContact O-CB 3.34Å; E784-Q787 PolarHBondContact O-N 2.99Å; E784-I788 VanDerWaalsContact O-CG1 3.28Å; E784-I788 WeakPolarHBondContact O-CG1 3.48Å; E784-I788 PolarHBondContact O-N 2.97Å
785	I	94	Very high	91.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-62.3	-43.5	178	-70.6	166	0	0	0	111.3	I705 L763 W767 Y781 I782 Q787 I788 A789 L843	I705-I785 HydrophobicContact CD1-CG1 4.49Å; L763-I785 HydrophobicContact CD2-CG2 4.02Å; L763-I785 HydrophobicContact CG-CG2 4.33Å; W767-I785 HydrophobicContact CB-CD1 3.74Å; W767-I785 HydrophobicContact CD2-CD1 3.39Å; W767-I785 HydrophobicContact CE3-CD1 3.6Å; W767-I785 HydrophobicContact CG-CD1 3.44Å; W767-I785 VanDerWaalsContact CG-CD1 3.44Å; W767-I785 HydrophobicContact CZ3-CD1 4.43Å; Y781-I785 WeakPolarHBondContact O-CG1 3.33Å; Y781-I785 PolarHBondContact O-N 2.87Å; I782-I785 PolarHBondContact O-N 3.02Å; I785-Q787 VanDerWaalsContact C-N 3.33Å; I785-I788 PolarHBondContact O-N 3.3Å; I785-A789 WeakPolarHBondContact O-CB 2.89Å; I785-A789 PolarHBondContact O-N 3.17Å; I785-L843 HydrophobicContact CG2-CD1 4.34Å; I785-L843 HydrophobicContact CG2-CD2 4.18Å
786	V	95.7	Very high	92.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.6	-38.6	176.8	172.7	0	0	0	0	111	I782 I783 E784 A789 C790 I839 L840 L843 L918 L921	I782-V786 HydrophobicContact CG2-CG2 4.45Å; I782-V786 WeakPolarHBondContact O-CG2 3.39Å; I782-V786 PolarHBondContact O-N 3.31Å; I783-V786 PolarHBondContact O-N 3.08Å; E784-V786 PolarHBondContact O-N 3.02Å; V786-A789 PolarHBondContact O-N 3.37Å; V786-C790 WeakPolarHBondContact O-CB 3.01Å; V786-C790 PolarHBondContact O-N 3.26Å; V786-C790 PolarHBondContact O-SG 3.4Å; V786-I839 HydrophobicContact CG1-CG2 4.4Å; V786-I839 HydrophobicContact CG2-CD1 4.35Å; V786-I839 HydrophobicContact CG2-CG2 4.47Å; V786-L840 HydrophobicContact CG2-CD2 3.9Å; V786-L843 HydrophobicContact CG2-CD1 3.54Å; V786-L918 HydrophobicContact CB-CD2 4.35Å; V786-L918 HydrophobicContact CG2-CD2 3.96Å; V786-L921 HydrophobicContact CG1-CB 4.09Å
787	Q	95.6	Very high	93.9	Very high	86 Å²	86	25.1 Å²	25.1	40%	0.402	13%	0.126	S	C	.	.	H	α-helix	trans	-60.3	-48.6	174	-75.5	171.6	-6.3	0	0	111.5	I783 E784 I785 A789 C790 E791 L921	I783-Q787 VanDerWaalsContact O-CG 3.28Å; I783-Q787 WeakPolarHBondContact O-CG 3.45Å; I783-Q787 PolarHBondContact O-N 3.31Å; E784-Q787 WeakPolarHBondContact O-CB 3.34Å; E784-Q787 PolarHBondContact O-N 2.99Å; I785-Q787 VanDerWaalsContact C-N 3.33Å; Q787-A789 PolarHBondContact O-N 2.79Å; Q787-C790 PolarHBondContact O-N 3.35Å; Q787-E791 WeakPolarHBondContact O-CB 3.49Å; Q787-E791 PolarHBondContact O-N 2.93Å; Q787-L921 HydrophobicContact CG-CD1 3.89Å; Q787-L921 HydrophobicContact CG-CD2 3.86Å
788	I	94.1	Very high	94.4	Very high	10 Å²	10	29.6 Å²	29.6	5%	0.051	15%	0.145	C	C	.	.	H	α-helix	trans	-58.5	-47.9	177.4	-69.2	165.3	0	0	0	110.8	I705 N709 L712 L763 E784 I785 C790 E791 V792	I705-I788 HydrophobicContact CG2-CD1 3.37Å; N709-I788 HydrophobicContact CB-CD1 3.81Å; N709-I788 HydrophobicContact CB-CG1 3.81Å; N709-I788 HydrophobicContact CB-CG2 4.05Å; L712-I788 HydrophobicContact CD1-CG2 3.82Å; L763-I788 HydrophobicContact CD2-CG2 4.44Å; E784-I788 VanDerWaalsContact O-CG1 3.28Å; E784-I788 WeakPolarHBondContact O-CG1 3.48Å; E784-I788 PolarHBondContact O-N 2.97Å; I785-I788 PolarHBondContact O-N 3.3Å; I788-C790 VanDerWaalsContact C-N 3.33Å; I788-C790 PolarHBondContact O-N 2.82Å; I788-E791 PolarHBondContact O-N 3.37Å; I788-V792 HydrophobicContact CG2-CG2 4.15Å; I788-V792 WeakPolarHBondContact O-CB 3.37Å; I788-V792 VanDerWaalsContact O-CG2 3.26Å; I788-V792 WeakPolarHBondContact O-CG2 3.49Å; I788-V792 PolarHBondContact O-N 3.49Å
789	A	95.9	Very high	94.8	Very high	2 Å²	2	29.7 Å²	29.7	2%	0.017	15%	0.146	C	C	.	.	H	α-helix	trans	-61.1	-42.3	179.2	0	0	0	0	0	112	L760 I785 V786 Q787 T793 I836 I839	L760-A789 HydrophobicContact CD2-CB 3.97Å; I785-A789 WeakPolarHBondContact O-CB 2.89Å; I785-A789 PolarHBondContact O-N 3.17Å; V786-A789 PolarHBondContact O-N 3.37Å; Q787-A789 PolarHBondContact O-N 2.79Å; A789-T793 WeakPolarHBondContact O-CB 3.32Å; A789-T793 VanDerWaalsContact O-CG2 3.29Å; A789-T793 WeakPolarHBondContact O-CG2 3.3Å; A789-T793 PolarHBondContact O-N 3.38Å; A789-T793 VanDerWaalsContact O-N 3.08Å; A789-T793 PolarHBondContact O-OG1 3.31Å; A789-I836 HydrophobicContact CB-CD1 4.02Å; A789-I839 HydrophobicContact CB-CD1 3.25Å
790	C	96.3	Very high	95	Very high	17 Å²	17	28.7 Å²	28.7	12%	0.115	14%	0.142	C	C	.	.	H	α-helix	trans	-64.5	-41	175.3	-67.3	0	0	0	0	112	V786 Q787 I788 T793 L794	V786-C790 WeakPolarHBondContact O-CB 3.01Å; V786-C790 PolarHBondContact O-N 3.26Å; V786-C790 PolarHBondContact O-SG 3.4Å; Q787-C790 PolarHBondContact O-N 3.35Å; I788-C790 VanDerWaalsContact C-N 3.33Å; I788-C790 PolarHBondContact O-N 2.82Å; C790-T793 PolarHBondContact O-OG1 2.81Å; C790-L794 WeakPolarHBondContact O-CB 3.33Å; C790-L794 PolarHBondContact O-N 3.28Å
791	E	95.5	Very high	95.2	Very high	98 Å²	98	26.1 Å²	26.1	46%	0.458	13%	0.128	S	C	.	.	H	α-helix	trans	-64.8	-51.3	179.2	-176.5	179.1	-172.7	0	0	111.7	N709 Q787 I788 L794 S795	N709-E791 PolarHBondContact ND2-OE2 3.27Å; Q787-E791 WeakPolarHBondContact O-CB 3.49Å; Q787-E791 PolarHBondContact O-N 2.93Å; I788-E791 PolarHBondContact O-N 3.37Å; E791-L794 PolarHBondContact O-N 3.16Å; E791-S795 WeakPolarHBondContact O-CB 3.49Å; E791-S795 PolarHBondContact O-N 2.82Å
792	V	95.6	Very high	95.2	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-61.9	-47.4	-179	173.5	0	0	0	0	110.9	L712 L713 M716 I756 I788 S795 Y796	L712-V792 HydrophobicContact CB-CG1 4.39Å; L712-V792 HydrophobicContact CB-CG2 3.77Å; L713-V792 HydrophobicContact CD2-CB 4.4Å; L713-V792 HydrophobicContact CD2-CG2 3.81Å; L713-V792 HydrophobicContact CG-CG2 3.98Å; M716-V792 HydrophobicContact CB-CG1 4.21Å; M716-V792 HydrophobicContact CG-CG1 4.29Å; I756-V792 HydrophobicContact CG2-CG1 4.38Å; I788-V792 HydrophobicContact CG2-CG2 4.15Å; I788-V792 WeakPolarHBondContact O-CB 3.37Å; I788-V792 VanDerWaalsContact O-CG2 3.26Å; I788-V792 WeakPolarHBondContact O-CG2 3.49Å; I788-V792 PolarHBondContact O-N 3.49Å; V792-S795 PolarHBondContact O-N 2.95Å; V792-Y796 WeakPolarHBondContact O-CB 3.36Å; V792-Y796 PolarHBondContact O-N 3.17Å
793	T	96.9	Very high	95.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.7	-39.6	179.5	52.3	0	0	0	0	112.3	I756 L760 A789 C790 Y796 A797 I832 I836	I756-T793 HydrophobicContact CG2-CG2 4.49Å; L760-T793 HydrophobicContact CD1-CG2 3.67Å; A789-T793 WeakPolarHBondContact O-CB 3.32Å; A789-T793 VanDerWaalsContact O-CG2 3.29Å; A789-T793 WeakPolarHBondContact O-CG2 3.3Å; A789-T793 PolarHBondContact O-N 3.38Å; A789-T793 VanDerWaalsContact O-N 3.08Å; A789-T793 PolarHBondContact O-OG1 3.31Å; C790-T793 PolarHBondContact O-OG1 2.81Å; T793-Y796 PolarHBondContact O-N 3.26Å; T793-A797 WeakPolarHBondContact O-CB 3.38Å; T793-A797 PolarHBondContact O-N 3.1Å; T793-I832 HydrophobicContact CG2-CB 4.22Å; T793-I836 HydrophobicContact CG2-CD1 4.06Å; T793-I836 HydrophobicContact CG2-CG1 4.17Å
794	L	96.8	Very high	95	Very high	34 Å²	34	30.2 Å²	30.2	18%	0.178	15%	0.146	C	C	.	.	H	α-helix	trans	-67.9	-39.5	177.2	-178.6	59.5	0	0	0	112.1	C790 E791 A797 K798 E928 L929 V932	C790-L794 WeakPolarHBondContact O-CB 3.33Å; C790-L794 PolarHBondContact O-N 3.28Å; E791-L794 PolarHBondContact O-N 3.16Å; L794-A797 PolarHBondContact O-N 2.88Å; L794-K798 HydrophobicContact CD1-CG 4.47Å; L794-K798 HydrophobicContact CG-CD 4.4Å; L794-K798 WeakPolarHBondContact O-CG 3.48Å; L794-K798 PolarHBondContact O-N 3.25Å; L794-E928 HydrophobicContact CD1-CB 3.83Å; L794-E928 HydrophobicContact CD2-CB 4.18Å; L794-E928 HydrophobicContact CD2-CG 4.48Å; L794-L929 HydrophobicContact CB-CD2 4.44Å; L794-L929 HydrophobicContact CD1-CD2 4.35Å; L794-V932 HydrophobicContact CD1-CG2 4.3Å
795	S	95.8	Very high	94.7	Very high	37 Å²	37	32.3 Å²	32.3	26%	0.259	15%	0.152	S	C	.	.	H	α-helix	trans	-63.1	-46.2	175.4	-171.3	0	0	0	0	110.8	M716 E791 V792 A797 K798 Q799	M716-S795 WeakPolarHBondContact CE-OG 3.48Å; E791-S795 WeakPolarHBondContact O-CB 3.49Å; E791-S795 PolarHBondContact O-N 2.82Å; V792-S795 PolarHBondContact O-N 2.95Å; S795-A797 PolarHBondContact O-N 2.98Å; S795-K798 PolarHBondContact O-N 2.91Å; S795-Q799 WeakPolarHBondContact O-CG 3.31Å; S795-Q799 PolarHBondContact O-N 3.33Å
796	Y	97.4	Very high	94.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.1	-48.1	172.8	174.8	-105.3	0	0	0	112.2	M716 I720 S752 S753 I756 V792 T793 K798 Q799 L800 N828 I832	M716-Y796 HydrophobicContact CG-CD2 4.09Å; M716-Y796 HydrophobicContact CG-CG 4.33Å; M716-Y796 VanDerWaalsContact SD-CA 3.59Å; M716-Y796 HydrophobicContact SD-CD2 4.24Å; I720-Y796 HydrophobicContact CB-CD2 4.04Å; I720-Y796 HydrophobicContact CB-CE2 4.02Å; I720-Y796 HydrophobicContact CD1-CD2 3.64Å; I720-Y796 HydrophobicContact CD1-CE2 3.75Å; I720-Y796 HydrophobicContact CG1-CD2 4.02Å; I720-Y796 HydrophobicContact CG1-CE2 3.77Å; S752-Y796 WeakPolarHBondContact OG-CE2 3.48Å; S752-Y796 PolarHBondContact OG-OH 3.07Å; S753-Y796 WeakPolarHBondContact CB-OH 3.49Å; S753-Y796 PolarHBondContact N-OH 2.82Å; I756-Y796 HydrophobicContact CD1-CD1 3.8Å; I756-Y796 HydrophobicContact CD1-CD2 3.06Å; I756-Y796 HydrophobicContact CD1-CE1 4.12Å; I756-Y796 HydrophobicContact CD1-CE2 3.41Å; I756-Y796 VanDerWaalsContact CD1-CE2 3.41Å; I756-Y796 HydrophobicContact CD1-CG 3.26Å; V792-Y796 WeakPolarHBondContact O-CB 3.36Å; V792-Y796 PolarHBondContact O-N 3.17Å; T793-Y796 PolarHBondContact O-N 3.26Å; Y796-K798 VanDerWaalsContact C-N 3.31Å; Y796-K798 PolarHBondContact O-N 3.48Å; Y796-Q799 PolarHBondContact O-N 2.99Å; Y796-L800 HydrophobicContact CE1-CD2 3.86Å; Y796-L800 VanDerWaalsContact O-CB 3.3Å; Y796-L800 WeakPolarHBondContact O-CB 3.36Å; Y796-L800 PolarHBondContact O-N 3.05Å; Y796-N828 HydrophobicContact CE1-CB 4.48Å; Y796-N828 PolarHBondContact OH-ND2 3.35Å; Y796-I832 HydrophobicContact CD1-CD1 3.6Å; Y796-I832 HydrophobicContact CD1-CG2 4.12Å; Y796-I832 HydrophobicContact CE1-CD1 4.04Å; Y796-I832 HydrophobicContact CE1-CG2 4.16Å
797	A	97.4	Very high	93.6	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.3	-43.6	-179.7	0	0	0	0	0	112.2	T793 L794 S795 L800 H801 L829 I832 L929 V932	T793-A797 WeakPolarHBondContact O-CB 3.38Å; T793-A797 PolarHBondContact O-N 3.1Å; L794-A797 PolarHBondContact O-N 2.88Å; S795-A797 PolarHBondContact O-N 2.98Å; A797-L800 PolarHBondContact O-N 3.32Å; A797-H801 WeakPolarHBondContact O-CB 3.4Å; A797-H801 PolarHBondContact O-N 3.48Å; A797-L829 HydrophobicContact CB-CD2 3.66Å; A797-I832 HydrophobicContact CB-CD1 3.8Å; A797-L929 HydrophobicContact CB-CD2 3.55Å; A797-V932 HydrophobicContact CB-CB 4.37Å; A797-V932 HydrophobicContact CB-CG1 4.06Å; A797-V932 WeakPolarHBondContact O-CG1 3.39Å
798	K	96	Very high	92.4	Very high	106 Å²	106	38.8 Å²	38.8	46%	0.461	19%	0.19	S	C	.	.	H	α-helix	trans	-64.7	-45.1	177.5	-73.7	173.6	179.7	175.4	0	111.8	L794 S795 Y796 H801 E802 V932	L794-K798 HydrophobicContact CD1-CG 4.47Å; L794-K798 HydrophobicContact CG-CD 4.4Å; L794-K798 WeakPolarHBondContact O-CG 3.48Å; L794-K798 PolarHBondContact O-N 3.25Å; S795-K798 PolarHBondContact O-N 2.91Å; Y796-K798 VanDerWaalsContact C-N 3.31Å; Y796-K798 PolarHBondContact O-N 3.48Å; K798-H801 PolarHBondContact O-N 2.85Å; K798-E802 WeakPolarHBondContact O-CG 3.21Å; K798-E802 PolarHBondContact O-N 3.41Å; K798-V932 HydrophobicContact CG-CG2 4.42Å
799	Q	95.6	Very high	91.2	Very high	58 Å²	58	38.9 Å²	38.9	27%	0.271	19%	0.19	S	C	.	.	H	α-helix	trans	-68.4	-35.7	178.4	-67.8	-173.6	48.9	0	0	112.1	D717 I720 S795 Y796 E802 K803	D717-Q799 PolarHBondContact OD1-NE2 3.25Å; I720-Q799 HydrophobicContact CD1-CB 3.5Å; I720-Q799 VanDerWaalsContact CD1-CB 3.5Å; I720-Q799 HydrophobicContact CG2-CB 4.43Å; S795-Q799 WeakPolarHBondContact O-CG 3.31Å; S795-Q799 PolarHBondContact O-N 3.33Å; Y796-Q799 PolarHBondContact O-N 2.99Å; Q799-E802 PolarHBondContact O-N 2.92Å; Q799-K803 WeakPolarHBondContact O-CB 3.22Å; Q799-K803 PolarHBondContact O-N 2.94Å
800	L	95.3	Very high	89.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.8	-44.1	175.5	-179.6	56.9	0	0	0	110.7	I720 L725 Y796 A797 E802 K803 L804 N828 L829	I720-L800 HydrophobicContact CD1-CB 3.89Å; I720-L800 VanDerWaalsContact CD1-N 3.26Å; L725-L800 HydrophobicContact CD2-CD1 3.71Å; Y796-L800 HydrophobicContact CE1-CD2 3.86Å; Y796-L800 VanDerWaalsContact O-CB 3.3Å; Y796-L800 WeakPolarHBondContact O-CB 3.36Å; Y796-L800 PolarHBondContact O-N 3.05Å; A797-L800 PolarHBondContact O-N 3.32Å; L800-E802 PolarHBondContact O-N 2.84Å; L800-K803 PolarHBondContact O-N 3.39Å; L800-L804 HydrophobicContact CD1-CD1 4.39Å; L800-L804 HydrophobicContact CD1-CG 4.3Å; L800-L804 HydrophobicContact CG-CD1 4.24Å; L800-L804 VanDerWaalsContact O-CG 3.3Å; L800-L804 WeakPolarHBondContact O-CG 3.02Å; L800-L804 PolarHBondContact O-N 3.23Å; L800-N828 HydrophobicContact CD2-CB 3.69Å; L800-L829 HydrophobicContact CB-CD2 4.43Å; L800-L829 HydrophobicContact CD2-CD2 3.9Å; L800-L829 HydrophobicContact CD2-CG 3.89Å; L800-L829 HydrophobicContact CG-CD2 4.45Å
801	H	93.5	Very high	87.4	Confident	7 Å²	7	44.1 Å²	44.1	3%	0.032	22%	0.219	C	C	.	.	H	α-helix	trans	-57.2	-47.9	172.8	178.8	70.8	0	0	0	111.8	A797 K798 K803 L804 R805 V932 R935 T936	A797-H801 WeakPolarHBondContact O-CB 3.4Å; A797-H801 PolarHBondContact O-N 3.48Å; K798-H801 PolarHBondContact O-N 2.85Å; H801-K803 VanDerWaalsContact C-N 3.34Å; H801-K803 PolarHBondContact O-N 3.18Å; H801-L804 PolarHBondContact O-N 3.42Å; H801-R805 WeakPolarHBondContact O-CB 3.49Å; H801-R805 PolarHBondContact O-N 2.77Å; H801-V932 HydrophobicContact CB-CG1 3.89Å; H801-R935 PolarHBondContact NE2-NE 2.74Å; H801-T936 PolarHBondContact ND1-OG1 3.45Å
802	E	91.9	Very high	85.6	Confident	72 Å²	72	47.6 Å²	47.6	34%	0.336	24%	0.235	S	C	.	.	H	α-helix	trans	-64.8	-37.1	177.3	-73.5	-59.1	133.4	0	0	112.5	K798 Q799 L800 R805 L806	K798-E802 WeakPolarHBondContact O-CG 3.21Å; K798-E802 PolarHBondContact O-N 3.41Å; Q799-E802 PolarHBondContact O-N 2.92Å; L800-E802 PolarHBondContact O-N 2.84Å; E802-R805 WeakPolarHBondContact O-CB 3.42Å; E802-R805 PolarHBondContact O-N 3.41Å; E802-R805 IonicContact OE1-NE 3.58Å; E802-R805 IonicContact OE2-CZ 2.81Å; E802-R805 IonicContact OE2-NE 3.48Å; E802-R805 PolarHBondContact OE2-NE 2.73Å; E802-R805 IonicContact OE2-NH2 3.84Å; E802-R805 PolarHBondContact OE2-NH2 3.07Å; E802-L806 WeakPolarHBondContact O-CB 3.21Å; E802-L806 VanDerWaalsContact O-CG 3.3Å; E802-L806 WeakPolarHBondContact O-CG 3.35Å; E802-L806 PolarHBondContact O-N 3.12Å
803	K	91.9	Very high	83.9	Confident	39 Å²	39	56.2 Å²	56.2	17%	0.17	28%	0.275	C	S	.	.	H	α-helix	trans	-63	-48.6	175.5	-170.3	171.3	-164.5	167.9	0	111.6	I720 Q721 D723 Q799 L800 H801 R805 L806 Q807	I720-K803 PolarHBondContact O-NZ 3.36Å; Q721-K803 PolarHBondContact O-NZ 2.95Å; Q721-K803 VanDerWaalsContact O-NZ 3.12Å; D723-K803 WeakPolarHBondContact O-CE 3.47Å; D723-K803 PolarHBondContact O-NZ 2.97Å; Q799-K803 WeakPolarHBondContact O-CB 3.22Å; Q799-K803 PolarHBondContact O-N 2.94Å; L800-K803 PolarHBondContact O-N 3.39Å; H801-K803 VanDerWaalsContact C-N 3.34Å; H801-K803 PolarHBondContact O-N 3.18Å; K803-R805 VanDerWaalsContact C-N 3.28Å; K803-R805 PolarHBondContact O-N 2.95Å; K803-L806 PolarHBondContact O-N 3.32Å; K803-Q807 WeakPolarHBondContact O-CB 3.25Å; K803-Q807 WeakPolarHBondContact O-CG 3.12Å; K803-Q807 PolarHBondContact O-N 3.03Å
804	L	90.9	Very high	82.5	Confident	3 Å²	3	60 Å²	60	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-60.2	-39.4	175.2	-68.9	170.6	0	0	0	111.5	L725 L800 H801 Q807 Y809 L822 T936	L725-L804 HydrophobicContact CD1-CD2 3.58Å; L725-L804 HydrophobicContact CD1-CG 4.48Å; L800-L804 HydrophobicContact CD1-CD1 4.39Å; L800-L804 HydrophobicContact CD1-CG 4.3Å; L800-L804 HydrophobicContact CG-CD1 4.24Å; L800-L804 VanDerWaalsContact O-CG 3.3Å; L800-L804 WeakPolarHBondContact O-CG 3.02Å; L800-L804 PolarHBondContact O-N 3.23Å; H801-L804 PolarHBondContact O-N 3.42Å; L804-Q807 CarbonylContact O-C 3.57Å; L804-Y809 HydrophobicContact CB-CD1 4.12Å; L804-Y809 HydrophobicContact CB-CE1 3.93Å; L804-Y809 PolarHBondContact O-N 2.92Å; L804-L822 HydrophobicContact CD1-CD1 4.32Å; L804-L822 HydrophobicContact CD2-CD1 4.42Å; L804-T936 HydrophobicContact CD1-CG2 3.99Å
805	R	87.1	Confident	81.6	Confident	108 Å²	108	62 Å²	62	41%	0.408	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-43.8	176.6	-172.3	-170.3	68	71.9	0.2	112.7	H801 E802 K803 G808 Y809	H801-R805 WeakPolarHBondContact O-CB 3.49Å; H801-R805 PolarHBondContact O-N 2.77Å; E802-R805 WeakPolarHBondContact O-CB 3.42Å; E802-R805 PolarHBondContact O-N 3.41Å; E802-R805 IonicContact OE1-NE 3.58Å; E802-R805 IonicContact OE2-CZ 2.81Å; E802-R805 IonicContact OE2-NE 3.48Å; E802-R805 PolarHBondContact OE2-NE 2.73Å; E802-R805 IonicContact OE2-NH2 3.84Å; E802-R805 PolarHBondContact OE2-NH2 3.07Å; K803-R805 VanDerWaalsContact C-N 3.28Å; K803-R805 PolarHBondContact O-N 2.95Å; R805-G808 WeakPolarHBondContact O-CA 3.36Å; R805-G808 PolarHBondContact O-N 3.26Å; R805-G808 VanDerWaalsContact O-N 3.12Å; R805-Y809 HydrophobicContact CB-CE2 4.28Å; R805-Y809 HydrophobicContact CG-CE2 4.19Å
806	L	85.3	Confident	81.1	Confident	124 Å²	124	61 Å²	61	65%	0.649	31%	0.314	S	S	*	.	H	α-helix	trans	-70	-33.8	-179.9	-74.6	174.1	0	0	0	112.1	E802 K803 G808	E802-L806 WeakPolarHBondContact O-CB 3.21Å; E802-L806 VanDerWaalsContact O-CG 3.3Å; E802-L806 WeakPolarHBondContact O-CG 3.35Å; E802-L806 PolarHBondContact O-N 3.12Å; K803-L806 PolarHBondContact O-N 3.32Å; L806-G808 PolarHBondContact O-N 3.21Å
807	Q	81.9	Confident	80.6	Confident	79 Å²	79	63.3 Å²	63.3	37%	0.369	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	26.6	167.5	-66.3	179.2	-22.7	0	0	112	K803 L804 Y809 C810	K803-Q807 WeakPolarHBondContact O-CB 3.25Å; K803-Q807 WeakPolarHBondContact O-CG 3.12Å; K803-Q807 PolarHBondContact O-N 3.03Å; L804-Q807 CarbonylContact O-C 3.57Å; Q807-Y809 PolarHBondContact O-N 2.86Å; Q807-C810 VanDerWaalsContact O-CB 3.31Å; Q807-C810 WeakPolarHBondContact O-CB 3.01Å; Q807-C810 PolarHBondContact O-N 2.73Å; Q807-C810 PolarHBondContact O-SG 3.21Å
808	G	69	Low	80.2	Confident	19 Å²	19	63.6 Å²	63.6	20%	0.196	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	13.7	177.2	0	0	0	0	0	117.6	R805 L806 C810	R805-G808 WeakPolarHBondContact O-CA 3.36Å; R805-G808 PolarHBondContact O-N 3.26Å; R805-G808 VanDerWaalsContact O-N 3.12Å; L806-G808 PolarHBondContact O-N 3.21Å; G808-C810 WeakPolarHBondContact CA-SG 3.13Å; G808-C810 PolarHBondContact O-N 2.74Å
809	Y	68.7	Low	79.8	Confident	13 Å²	13	59.5 Å²	59.5	5%	0.051	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	18	-161.3	-51.1	-77.8	0	0	0	113.7	L804 R805 Q807 F816 L822 T936 R939 K943	L804-Y809 HydrophobicContact CB-CD1 4.12Å; L804-Y809 HydrophobicContact CB-CE1 3.93Å; L804-Y809 PolarHBondContact O-N 2.92Å; R805-Y809 HydrophobicContact CB-CE2 4.28Å; R805-Y809 HydrophobicContact CG-CE2 4.19Å; Q807-Y809 PolarHBondContact O-N 2.86Å; Y809-F816 VanDerWaalsContact O-CE2 3.28Å; Y809-F816 WeakPolarHBondContact O-CE2 3.39Å; Y809-L822 HydrophobicContact CD1-CD1 4.04Å; Y809-T936 HydrophobicContact CE1-CG2 4.32Å; Y809-R939 HydrophobicContact CE1-CB 4.35Å; Y809-R939 HydrophobicContact CE2-CB 3.89Å; Y809-R939 WeakPolarHBondContact OH-CB 3.19Å; Y809-K943 HydrophobicContact CD2-CG 4.31Å
810	C	58.2	Low	79.5	Confident	32 Å²	32	61.1 Å²	61.1	22%	0.216	32%	0.323	C	S	.	.	S	Bend	trans	-55	139.3	-146.2	-69.5	0	0	0	0	118.5	Q807 G808 E812	Q807-C810 VanDerWaalsContact O-CB 3.31Å; Q807-C810 WeakPolarHBondContact O-CB 3.01Å; Q807-C810 PolarHBondContact O-N 2.73Å; Q807-C810 PolarHBondContact O-SG 3.21Å; G808-C810 WeakPolarHBondContact CA-SG 3.13Å; G808-C810 PolarHBondContact O-N 2.74Å; C810-E812 HydrophobicContact CB-CG 4.06Å; C810-E812 WeakPolarHBondContact SG-CG 3.5Å
811	D	55.3	Low	79.2	Confident	96 Å²	96	63 Å²	63	51%	0.513	34%	0.336	S	S	.	.				-98.3	136	84	-71	-45.3	0	0	0	110.6
812	E	57.5	Low	79.1	Confident	172 Å²	172	62.8 Å²	62.8	80%	0.804	34%	0.335	S	S	*	.			trans	-84.3	-22.8	179.9	-68.3	-161.8	170.4	0	0	113.6	C810	C810-E812 HydrophobicContact CB-CG 4.06Å; C810-E812 WeakPolarHBondContact SG-CG 3.5Å
813	E	58.9	Low	79.1	Confident	181 Å²	181	59.3 Å²	59.3	85%	0.846	32%	0.319	S	S	*	.	S	Bend	trans	-110	122.3	-177.7	-64.9	-172.7	168.9	0	0	110.1
814	G	68.9	Low	79	Confident	80 Å²	80	57.8 Å²	57.8	83%	0.825	31%	0.313	S	S	*	.	S	Bend	trans	89.7	-147.7	174.2	0	0	0	0	0	114.8
815	Q	76.7	Confident	79.2	Confident	75 Å²	75	57.7 Å²	57.7	35%	0.35	31%	0.312	S	S	.	.	S	Bend	trans	-74.5	132.2	-178.2	161.1	159	30.7	0	0	109.8	D817 E947 Y974	Q815-D817 PolarHBondContact O-N 2.71Å; Q815-E947 HydrophobicContact CB-CG 4.4Å; Q815-E947 HydrophobicContact CG-CG 3.94Å; Q815-Y974 HydrophobicContact CG-CD2 4.05Å; Q815-Y974 HydrophobicContact CG-CE2 3.68Å
816	F	86.5	Confident	79.5	Confident	18 Å²	18	52.5 Å²	52.5	8%	0.079	29%	0.292	C	S	.	.			trans	-68	118.5	177.6	171.8	-96.2	0	0	0	110.5	Y809 I818 L822 M940 K943 M944 Y974	Y809-F816 VanDerWaalsContact O-CE2 3.28Å; Y809-F816 WeakPolarHBondContact O-CE2 3.39Å; F816-I818 HydrophobicContact CE1-CG1 4.31Å; F816-L822 HydrophobicContact CZ-CD2 4.3Å; F816-M940 HydrophobicContact CE1-CG 4.29Å; F816-M940 HydrophobicContact CZ-CG 4.35Å; F816-K943 HydrophobicContact CB-CB 4.5Å; F816-K943 HydrophobicContact CD1-CB 3.69Å; F816-K943 HydrophobicContact CD2-CB 3.75Å; F816-K943 HydrophobicContact CD2-CD 4.49Å; F816-K943 HydrophobicContact CD2-CG 4.3Å; F816-K943 HydrophobicContact CE1-CB 3.75Å; F816-K943 HydrophobicContact CE2-CB 3.78Å; F816-K943 HydrophobicContact CE2-CG 4.18Å; F816-K943 HydrophobicContact CG-CB 3.7Å; F816-K943 HydrophobicContact CZ-CB 3.79Å; F816-K943 HydrophobicContact CZ-CG 4.49Å; F816-M944 HydrophobicContact CD1-CG 3.71Å; F816-M944 HydrophobicContact CE1-CG 3.67Å; F816-Y974 WeakPolarHBondContact O-CE2 3.39Å; F816-Y974 PolarHBondContact O-OH 3.25Å
817	D	85.4	Confident	79.9	Confident	48 Å²	48	46.7 Å²	46.7	26%	0.257	26%	0.262	S	S	.	.			trans	-114.2	144.6	169	-73	-44.9	0	0	0	110.9	Q815 S819 Y974 N978	Q815-D817 PolarHBondContact O-N 2.71Å; D817-S819 PolarHBondContact O-N 2.97Å; D817-S819 VanDerWaalsContact O-N 3.14Å; D817-Y974 WeakPolarHBondContact OD1-CE2 3.37Å; D817-N978 WeakPolarHBondContact CA-OD1 3.5Å; D817-N978 PolarHBondContact OD1-ND2 3.44Å
818	I	89.9	Confident	80.4	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.026	24%	0.244	C	C	.	.			trans	-65.1	114.6	176.4	-66.2	172.6	0	0	0	107.6	F816 L822 M940 M944 N978 T981 L982 I998	F816-I818 HydrophobicContact CE1-CG1 4.31Å; I818-L822 HydrophobicContact CG2-CD2 4.33Å; I818-M940 HydrophobicContact CD1-CE 4.2Å; I818-M940 HydrophobicContact CD1-CG 4.26Å; I818-M940 HydrophobicContact CD1-SD 3.62Å; I818-M940 HydrophobicContact CG1-CG 4.07Å; I818-M940 HydrophobicContact CG1-SD 3.91Å; I818-M944 HydrophobicContact CD1-SD 4.07Å; I818-M944 HydrophobicContact CG1-SD 4.41Å; I818-N978 WeakPolarHBondContact CB-OD1 3.43Å; I818-N978 HydrophobicContact CD1-CB 3.95Å; I818-N978 HydrophobicContact CG1-CB 4.32Å; I818-N978 VanDerWaalsContact CG1-OD1 3.3Å; I818-N978 WeakPolarHBondContact CG1-OD1 3.34Å; I818-N978 PolarHBondContact N-OD1 2.81Å; I818-T981 VanDerWaalsContact O-CG2 3.26Å; I818-T981 WeakPolarHBondContact O-CG2 3.3Å; I818-L982 HydrophobicContact CD1-CD1 3.66Å; I818-L982 HydrophobicContact CD1-CD2 4.15Å; I818-L982 HydrophobicContact CD1-CG 3.82Å; I818-L982 HydrophobicContact CG2-CD2 3.9Å; I818-L982 HydrophobicContact CG2-CG 4.24Å; I818-I998 HydrophobicContact CD1-CD1 4.37Å
819	S	88.4	Confident	81.7	Confident	21 Å²	21	42 Å²	42	15%	0.147	24%	0.235	C	C	.	.			trans	-80.1	159.1	178.7	59.9	0	0	0	0	113	D817 S821 L822 S823	D817-S819 PolarHBondContact O-N 2.97Å; D817-S819 VanDerWaalsContact O-N 3.14Å; S819-S821 VanDerWaalsContact C-N 3.26Å; S819-S821 PolarHBondContact O-N 3.2Å; S819-S821 PolarHBondContact OG-OG 3.47Å; S819-S821 VanDerWaalsContact OG-OG 3.07Å; S819-L822 PolarHBondContact O-N 2.81Å; S819-L822 WeakPolarHBondContact OG-CB 3.43Å; S819-L822 PolarHBondContact OG-N 2.66Å; S819-S823 PolarHBondContact O-N 3.08Å; S819-S823 VanDerWaalsContact O-N 3.15Å; S819-S823 PolarHBondContact O-OG 3Å
820	N	87.4	Confident	82.8	Confident	92 Å²	92	42 Å²	42	49%	0.492	24%	0.235	S	C	.	.	H	α-helix	trans	-61.2	-37.5	172.8	-69	-6.1	0	0	0	111.3	S823 I824 N985	N820-S823 WeakPolarHBondContact O-CB 3.16Å; N820-S823 PolarHBondContact O-N 3.32Å; N820-I824 WeakPolarHBondContact O-CD1 3.02Å; N820-I824 VanDerWaalsContact O-CG1 3.29Å; N820-I824 WeakPolarHBondContact O-CG1 3.4Å; N820-I824 PolarHBondContact O-N 2.88Å; N820-N985 PolarHBondContact OD1-ND2 3.46Å
821	S	89.1	Confident	84.4	Confident	40 Å²	40	40.4 Å²	40.4	28%	0.28	23%	0.225	S	C	.	.	H	α-helix	trans	-64.9	-39.3	178.7	54.1	0	0	0	0	112.2	S819 I824 G825	S819-S821 VanDerWaalsContact C-N 3.26Å; S819-S821 PolarHBondContact O-N 3.2Å; S819-S821 PolarHBondContact OG-OG 3.47Å; S819-S821 VanDerWaalsContact OG-OG 3.07Å; S821-I824 PolarHBondContact O-N 2.96Å; S821-G825 PolarHBondContact O-N 3.25Å
822	L	91.8	Very high	86.2	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-62.2	-44.7	172.2	178	56.6	0	0	0	111.3	L804 Y809 F816 I818 S819 I824 G825 L826 T936 M940	L804-L822 HydrophobicContact CD1-CD1 4.32Å; L804-L822 HydrophobicContact CD2-CD1 4.42Å; Y809-L822 HydrophobicContact CD1-CD1 4.04Å; F816-L822 HydrophobicContact CZ-CD2 4.3Å; I818-L822 HydrophobicContact CG2-CD2 4.33Å; S819-L822 PolarHBondContact O-N 2.81Å; S819-L822 WeakPolarHBondContact OG-CB 3.43Å; S819-L822 PolarHBondContact OG-N 2.66Å; L822-I824 PolarHBondContact O-N 3.43Å; L822-G825 PolarHBondContact O-N 3.48Å; L822-L826 HydrophobicContact CD1-CD1 4.47Å; L822-L826 HydrophobicContact CD1-CG 4.24Å; L822-L826 HydrophobicContact CG-CD1 4.36Å; L822-L826 WeakPolarHBondContact O-CG 3.34Å; L822-L826 PolarHBondContact O-N 3.05Å; L822-T936 HydrophobicContact CD1-CG2 4.39Å; L822-M940 HydrophobicContact CD2-CB 4.1Å; L822-M940 HydrophobicContact CD2-CG 3.77Å; L822-M940 HydrophobicContact CD2-SD 4Å
823	S	91.8	Very high	88	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.1	-45.6	177.8	-60.7	0	0	0	0	112	S819 N820 L826 N827 N985	S819-S823 PolarHBondContact O-N 3.08Å; S819-S823 VanDerWaalsContact O-N 3.15Å; S819-S823 PolarHBondContact O-OG 3Å; N820-S823 WeakPolarHBondContact O-CB 3.16Å; N820-S823 PolarHBondContact O-N 3.32Å; S823-L826 PolarHBondContact O-N 2.93Å; S823-N827 PolarHBondContact O-N 3.48Å; S823-N827 PolarHBondContact O-ND2 2.91Å; S823-N985 VanDerWaalsContact CB-CB 3.49Å
824	I	91.4	Very high	89.5	Confident	7 Å²	7	20.2 Å²	20.2	4%	0.036	13%	0.127	C	C	.	.	H	α-helix	trans	-63.5	-42.6	175.6	-67.4	159.7	0	0	0	110.9	L725 N820 S821 L822 L826 N827 N828	L725-I824 WeakPolarHBondContact O-CD1 3.3Å; N820-I824 WeakPolarHBondContact O-CD1 3.02Å; N820-I824 VanDerWaalsContact O-CG1 3.29Å; N820-I824 WeakPolarHBondContact O-CG1 3.4Å; N820-I824 PolarHBondContact O-N 2.88Å; S821-I824 PolarHBondContact O-N 2.96Å; L822-I824 PolarHBondContact O-N 3.43Å; I824-L826 PolarHBondContact O-N 3.13Å; I824-N827 WeakPolarHBondContact O-CB 3.45Å; I824-N827 PolarHBondContact O-N 3.44Å; I824-N828 PolarHBondContact O-N 3.44Å; I824-N828 PolarHBondContact O-OD1 2.9Å
825	G	93.3	Very high	90.6	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-59.9	-42.9	175.4	0	0	0	0	0	113	S821 L822 N828 L829	S821-G825 PolarHBondContact O-N 3.25Å; L822-G825 PolarHBondContact O-N 3.48Å; G825-N828 WeakPolarHBondContact O-CB 3.41Å; G825-N828 PolarHBondContact O-N 2.96Å; G825-L829 WeakPolarHBondContact O-CG 3.44Å; G825-L829 PolarHBondContact O-N 3.34Å; G825-L829 VanDerWaalsContact O-N 3.13Å
826	L	94.4	Very high	91.5	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.9	-42.7	175.3	-67	173.8	0	0	0	111.5	L822 S823 I824 N828 L829 E830 L933 T936 I937 M940 L990	L822-L826 HydrophobicContact CD1-CD1 4.47Å; L822-L826 HydrophobicContact CD1-CG 4.24Å; L822-L826 HydrophobicContact CG-CD1 4.36Å; L822-L826 WeakPolarHBondContact O-CG 3.34Å; L822-L826 PolarHBondContact O-N 3.05Å; S823-L826 PolarHBondContact O-N 2.93Å; I824-L826 PolarHBondContact O-N 3.13Å; L826-N828 VanDerWaalsContact C-N 3.32Å; L826-N828 PolarHBondContact O-N 3.16Å; L826-L829 PolarHBondContact O-N 2.92Å; L826-E830 PolarHBondContact O-N 3.39Å; L826-L933 HydrophobicContact CD2-CD1 3.92Å; L826-T936 HydrophobicContact CD2-CG2 3.72Å; L826-I937 HydrophobicContact CD2-CG1 3.85Å; L826-M940 HydrophobicContact CD1-SD 4.33Å; L826-L990 VanDerWaalsContact C-CD2 3.4Å; L826-L990 HydrophobicContact CB-CD2 3.6Å; L826-L990 WeakPolarHBondContact O-CD2 3.49Å
827	N	92.5	Very high	91.9	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-59.5	-42.3	174.8	-75.8	-28.1	0	0	0	112.3	L748 Y749 S823 I824 L829 E830 L831 N985 V986 S987	L748-N827 VanDerWaalsContact O-CB 3.3Å; L748-N827 WeakPolarHBondContact O-CB 3.33Å; L748-N827 PolarHBondContact O-ND2 3.17Å; Y749-N827 HydrophobicContact CD1-CB 3.78Å; Y749-N827 HydrophobicContact CE1-CB 3.7Å; Y749-N827 WeakPolarHBondContact CE1-O 3.42Å; S823-N827 PolarHBondContact O-N 3.48Å; S823-N827 PolarHBondContact O-ND2 2.91Å; I824-N827 WeakPolarHBondContact O-CB 3.45Å; I824-N827 PolarHBondContact O-N 3.44Å; N827-L829 VanDerWaalsContact C-N 3.33Å; N827-L829 PolarHBondContact O-N 3.36Å; N827-E830 PolarHBondContact O-N 3.43Å; N827-L831 WeakPolarHBondContact O-CB 3.46Å; N827-L831 PolarHBondContact O-N 3.13Å; N827-N985 PolarHBondContact ND2-O 3.37Å; N827-V986 WeakPolarHBondContact OD1-CA 3.46Å; N827-S987 PolarHBondContact OD1-N 3.15Å; N827-S987 VanDerWaalsContact OD1-N 3.08Å
828	N	93.7	Very high	92.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.9	-42.9	176.3	-71.9	-15	0	0	0	111.7	S750 S753 Y796 L800 I824 G825 L826 L831 I832	S750-N828 PolarHBondContact N-OD1 3.07Å; S750-N828 PolarHBondContact OG-ND2 3.07Å; S753-N828 WeakPolarHBondContact CB-OD1 3.49Å; S753-N828 PolarHBondContact OG-OD1 3.48Å; Y796-N828 HydrophobicContact CE1-CB 4.48Å; Y796-N828 PolarHBondContact OH-ND2 3.35Å; L800-N828 HydrophobicContact CD2-CB 3.69Å; I824-N828 PolarHBondContact O-N 3.44Å; I824-N828 PolarHBondContact O-OD1 2.9Å; G825-N828 WeakPolarHBondContact O-CB 3.41Å; G825-N828 PolarHBondContact O-N 2.96Å; L826-N828 VanDerWaalsContact C-N 3.32Å; L826-N828 PolarHBondContact O-N 3.16Å; N828-L831 PolarHBondContact O-N 3.21Å; N828-I832 WeakPolarHBondContact O-CG1 3.14Å; N828-I832 PolarHBondContact O-N 2.72Å
829	L	95.3	Very high	92.2	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-64.5	-38.6	175.5	-69.3	177.7	0	0	0	112.3	A797 L800 G825 L826 N827 I832 S833 V932 L933 T936	A797-L829 HydrophobicContact CB-CD2 3.66Å; L800-L829 HydrophobicContact CB-CD2 4.43Å; L800-L829 HydrophobicContact CD2-CD2 3.9Å; L800-L829 HydrophobicContact CD2-CG 3.89Å; L800-L829 HydrophobicContact CG-CD2 4.45Å; G825-L829 WeakPolarHBondContact O-CG 3.44Å; G825-L829 PolarHBondContact O-N 3.34Å; G825-L829 VanDerWaalsContact O-N 3.13Å; L826-L829 PolarHBondContact O-N 2.92Å; N827-L829 VanDerWaalsContact C-N 3.33Å; N827-L829 PolarHBondContact O-N 3.36Å; L829-I832 HydrophobicContact CD2-CD1 4.04Å; L829-I832 WeakPolarHBondContact O-CG1 3.28Å; L829-S833 WeakPolarHBondContact O-CB 3.31Å; L829-S833 PolarHBondContact O-N 3.45Å; L829-S833 PolarHBondContact O-OG 3.48Å; L829-V932 HydrophobicContact CD2-CG1 4.36Å; L829-L933 HydrophobicContact CB-CB 4.38Å; L829-L933 HydrophobicContact CB-CD1 3.83Å; L829-L933 HydrophobicContact CD1-CD1 4.23Å; L829-T936 HydrophobicContact CD1-CG2 4.43Å
830	E	92.6	Very high	92.4	Very high	11 Å²	11	16.4 Å²	16.4	5%	0.051	8%	0.08	C	C	.	.	H	α-helix	trans	-66.6	-42.2	174.9	-177.8	68	-170.5	0	0	111.4	L826 N827 S833 K834 L933 L990	L826-E830 PolarHBondContact O-N 3.39Å; N827-E830 PolarHBondContact O-N 3.43Å; E830-S833 WeakPolarHBondContact O-CB 3.14Å; E830-S833 PolarHBondContact O-N 2.91Å; E830-K834 HydrophobicContact CG-CD 4.4Å; E830-K834 WeakPolarHBondContact O-CG 3.3Å; E830-K834 PolarHBondContact O-N 3.32Å; E830-K834 VanDerWaalsContact OE1-CE 3.23Å; E830-K834 WeakPolarHBondContact OE1-CE 3.41Å; E830-L933 VanDerWaalsContact OE2-CD2 3.22Å; E830-L933 WeakPolarHBondContact OE2-CD2 3.42Å; E830-L990 HydrophobicContact CB-CD2 4.12Å; E830-L990 HydrophobicContact CG-CB 4.45Å
831	L	91.3	Very high	92.5	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-60.6	-50.5	-179.1	177.4	62.7	0	0	0	112.1	I736 I740 Y749 L754 I757 N827 N828 S833 K834 F835	I736-L831 HydrophobicContact CD1-CD1 4.32Å; I740-L831 HydrophobicContact CG2-CD1 4.08Å; Y749-L831 HydrophobicContact CD1-CB 4.22Å; Y749-L831 HydrophobicContact CD1-CD2 3.94Å; Y749-L831 HydrophobicContact CD2-CD2 4.21Å; Y749-L831 HydrophobicContact CE1-CB 3.72Å; Y749-L831 HydrophobicContact CE1-CD2 4.03Å; Y749-L831 HydrophobicContact CE1-CG 4.31Å; Y749-L831 HydrophobicContact CE2-CD1 4.48Å; Y749-L831 HydrophobicContact CE2-CD2 4.25Å; Y749-L831 HydrophobicContact CG-CD2 4.04Å; L754-L831 HydrophobicContact CD2-CD2 4.07Å; I757-L831 HydrophobicContact CD1-CG 4.39Å; I757-L831 HydrophobicContact CG1-CD2 4.09Å; I757-L831 HydrophobicContact CG1-CG 4.1Å; N827-L831 WeakPolarHBondContact O-CB 3.46Å; N827-L831 PolarHBondContact O-N 3.13Å; N828-L831 PolarHBondContact O-N 3.21Å; L831-S833 VanDerWaalsContact C-N 3.28Å; L831-S833 PolarHBondContact O-N 3.21Å; L831-K834 PolarHBondContact O-N 2.61Å; L831-F835 PolarHBondContact O-N 2.97Å
832	I	93.7	Very high	92.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-65.1	-34.2	177.9	64.7	-174.9	0	0	0	111.5	I757 T793 Y796 A797 N828 L829 F835 I836 L929	I757-I832 HydrophobicContact CD1-CG2 4.5Å; T793-I832 HydrophobicContact CG2-CB 4.22Å; Y796-I832 HydrophobicContact CD1-CD1 3.6Å; Y796-I832 HydrophobicContact CD1-CG2 4.12Å; Y796-I832 HydrophobicContact CE1-CD1 4.04Å; Y796-I832 HydrophobicContact CE1-CG2 4.16Å; A797-I832 HydrophobicContact CB-CD1 3.8Å; N828-I832 WeakPolarHBondContact O-CG1 3.14Å; N828-I832 PolarHBondContact O-N 2.72Å; L829-I832 HydrophobicContact CD2-CD1 4.04Å; L829-I832 WeakPolarHBondContact O-CG1 3.28Å; I832-F835 PolarHBondContact O-N 3.35Å; I832-I836 PolarHBondContact O-N 3.1Å; I832-I836 VanDerWaalsContact O-N 3.12Å; I832-L929 HydrophobicContact CD1-CD2 4.03Å; I832-L929 HydrophobicContact CG1-CD2 4.31Å
833	S	94.6	Very high	92.3	Very high	1 Å²	1	14 Å²	14	1%	0.007	6%	0.063	C	C	.	.	H	α-helix	trans	-63.5	-48.4	175.4	-59.4	0	0	0	0	110.6	L829 E830 L831 F835 I836 Q837 Y926 L929	L829-S833 WeakPolarHBondContact O-CB 3.31Å; L829-S833 PolarHBondContact O-N 3.45Å; L829-S833 PolarHBondContact O-OG 3.48Å; E830-S833 WeakPolarHBondContact O-CB 3.14Å; E830-S833 PolarHBondContact O-N 2.91Å; L831-S833 VanDerWaalsContact C-N 3.28Å; L831-S833 PolarHBondContact O-N 3.21Å; S833-F835 VanDerWaalsContact C-N 3.3Å; S833-F835 PolarHBondContact O-N 2.89Å; S833-I836 PolarHBondContact O-N 3.34Å; S833-Q837 PolarHBondContact O-N 3.41Å; S833-Y926 VanDerWaalsContact O-CD2 3.31Å; S833-Y926 WeakPolarHBondContact O-CD2 3.32Å; S833-L929 WeakPolarHBondContact OG-CB 3.34Å
834	K	90.8	Very high	92	Very high	24 Å²	24	19.3 Å²	19.3	10%	0.104	9%	0.091	C	C	.	.	H	α-helix	trans	-60.2	-39	174.6	-75.4	-179.5	174.2	176.1	0	111.9	I740 E830 L831 I836 Q837 W838	I740-K834 HydrophobicContact CG2-CB 4.24Å; I740-K834 HydrophobicContact CG2-CD 4.43Å; E830-K834 HydrophobicContact CG-CD 4.4Å; E830-K834 WeakPolarHBondContact O-CG 3.3Å; E830-K834 PolarHBondContact O-N 3.32Å; E830-K834 VanDerWaalsContact OE1-CE 3.23Å; E830-K834 WeakPolarHBondContact OE1-CE 3.41Å; L831-K834 PolarHBondContact O-N 2.61Å; K834-I836 PolarHBondContact O-N 3.5Å; K834-Q837 WeakPolarHBondContact O-CB 3.35Å; K834-Q837 PolarHBondContact O-N 2.75Å; K834-W838 VanDerWaalsContact O-CD1 3.22Å; K834-W838 PolarHBondContact O-N 3.11Å; K834-W838 VanDerWaalsContact O-N 3.15Å
835	F	92.9	Very high	91.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-59.7	-46.9	176.4	-174.2	-90.1	0	0	0	112.4	P737 I740 I757 L760 I764 L831 I832 S833 W838 I839 F842	P737-F835 HydrophobicContact CG-CE2 4.28Å; I740-F835 HydrophobicContact CD1-CB 4.1Å; I740-F835 HydrophobicContact CD1-CD2 3.95Å; I740-F835 HydrophobicContact CD1-CG 4.47Å; I757-F835 HydrophobicContact CD1-CB 3.37Å; I757-F835 HydrophobicContact CD1-CD1 4.24Å; I757-F835 HydrophobicContact CD1-CD2 3.53Å; I757-F835 HydrophobicContact CD1-CE2 4.35Å; I757-F835 HydrophobicContact CD1-CG 3.45Å; I757-F835 VanDerWaalsContact CD1-CG 3.45Å; I757-F835 HydrophobicContact CG2-CD2 4.04Å; I757-F835 HydrophobicContact CG2-CE2 4.21Å; L760-F835 HydrophobicContact CB-CE1 3.65Å; L760-F835 HydrophobicContact CB-CE2 4.5Å; L760-F835 HydrophobicContact CB-CZ 3.55Å; L760-F835 HydrophobicContact CD1-CD1 4.06Å; L760-F835 HydrophobicContact CD1-CE1 3.73Å; L760-F835 HydrophobicContact CD1-CZ 4.42Å; L760-F835 HydrophobicContact CG-CE1 4.3Å; I764-F835 HydrophobicContact CD1-CE1 4.27Å; I764-F835 HydrophobicContact CD1-CZ 3.7Å; L831-F835 PolarHBondContact O-N 2.97Å; I832-F835 PolarHBondContact O-N 3.35Å; S833-F835 VanDerWaalsContact C-N 3.3Å; S833-F835 PolarHBondContact O-N 2.89Å; F835-W838 CarbonylContact O-C 3.44Å; F835-W838 PolarHBondContact O-N 3.49Å; F835-I839 HydrophobicContact CE1-CD1 4.35Å; F835-I839 HydrophobicContact CE1-CG1 4.46Å; F835-I839 PolarHBondContact O-N 3.41Å; F835-F842 HydrophobicContact CD2-CD2 4.37Å; F835-F842 AromaticContact CD2-CE2 3.92Å; F835-F842 HydrophobicContact CD2-CE2 3.92Å; F835-F842 HydrophobicContact CE2-CD2 4.07Å; F835-F842 HydrophobicContact CE2-CE2 4.05Å; F835-F842 HydrophobicContact CG-CE2 4.49Å; F835-F842 HydrophobicContact CZ-CD2 4.37Å
836	I	95.3	Very high	90.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66	-37.9	175.8	-62.8	-56.2	0	0	0	111.6	A789 T793 I832 S833 K834 W838 I839 Q922 L929	A789-I836 HydrophobicContact CB-CD1 4.02Å; T793-I836 HydrophobicContact CG2-CD1 4.06Å; T793-I836 HydrophobicContact CG2-CG1 4.17Å; I832-I836 PolarHBondContact O-N 3.1Å; I832-I836 VanDerWaalsContact O-N 3.12Å; S833-I836 PolarHBondContact O-N 3.34Å; K834-I836 PolarHBondContact O-N 3.5Å; I836-W838 PolarHBondContact O-N 3.41Å; I836-W838 VanDerWaalsContact O-N 3.13Å; I836-I839 HydrophobicContact CD1-CD1 4.17Å; I836-I839 VanDerWaalsContact O-CG2 3.25Å; I836-I839 WeakPolarHBondContact O-CG2 3.49Å; I836-I839 PolarHBondContact O-N 2.89Å; I836-Q922 VanDerWaalsContact O-CG 3.29Å; I836-Q922 WeakPolarHBondContact O-CG 3.06Å; I836-Q922 PolarHBondContact O-NE2 2.78Å; I836-L929 HydrophobicContact CB-CD1 4.03Å; I836-L929 HydrophobicContact CG1-CD1 3.62Å
837	Q	93.4	Very high	88.4	Confident	61 Å²	61	28.9 Å²	28.9	29%	0.285	14%	0.139	S	C	.	.	H	α-helix	trans	-55.9	-31.1	174.7	-169.2	-173.8	24.2	0	0	112.9	S833 K834 Q922 Y926	S833-Q837 PolarHBondContact O-N 3.41Å; K834-Q837 WeakPolarHBondContact O-CB 3.35Å; K834-Q837 PolarHBondContact O-N 2.75Å; Q837-Q922 VanDerWaalsContact C-NE2 3.26Å; Q837-Q922 PolarHBondContact O-NE2 3.48Å; Q837-Y926 HydrophobicContact CB-CD2 3.84Å; Q837-Y926 HydrophobicContact CB-CE2 3.91Å; Q837-Y926 HydrophobicContact CG-CD2 4.42Å; Q837-Y926 HydrophobicContact CG-CE2 4.24Å
838	W	90.6	Very high	86	Confident	100 Å²	100	33.8 Å²	33.8	38%	0.379	17%	0.171	S	C	.	.	H	α-helix	trans	-109.5	4.3	-176.8	-67.7	100.4	0	0	0	114.5	K834 F835 I836 L840 L841 F842	K834-W838 VanDerWaalsContact O-CD1 3.22Å; K834-W838 PolarHBondContact O-N 3.11Å; K834-W838 VanDerWaalsContact O-N 3.15Å; F835-W838 CarbonylContact O-C 3.44Å; F835-W838 PolarHBondContact O-N 3.49Å; I836-W838 PolarHBondContact O-N 3.41Å; I836-W838 VanDerWaalsContact O-N 3.13Å; W838-L840 PolarHBondContact O-N 3.41Å; W838-L841 HydrophobicContact CE3-CB 4.39Å; W838-L841 HydrophobicContact CE3-CD2 3.43Å; W838-L841 VanDerWaalsContact CE3-CD2 3.43Å; W838-L841 HydrophobicContact CZ3-CD2 3.53Å; W838-L841 WeakPolarHBondContact O-CB 3.45Å; W838-L841 PolarHBondContact O-N 3.16Å; W838-F842 HydrophobicContact CB-CE1 4.17Å; W838-F842 HydrophobicContact CB-CE2 3.73Å; W838-F842 HydrophobicContact CB-CZ 3.48Å; W838-F842 VanDerWaalsContact CB-CZ 3.48Å; W838-F842 PolarHBondContact O-N 3Å
839	I	92.9	Very high	83.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.5	-41.8	-171.8	-164.3	171.8	0	0	0	114.5	I764 V786 A789 F835 I836 L841 F842 L843 Q922	I764-I839 HydrophobicContact CD1-CG1 4.13Å; V786-I839 HydrophobicContact CG1-CG2 4.4Å; V786-I839 HydrophobicContact CG2-CD1 4.35Å; V786-I839 HydrophobicContact CG2-CG2 4.47Å; A789-I839 HydrophobicContact CB-CD1 3.25Å; F835-I839 HydrophobicContact CE1-CD1 4.35Å; F835-I839 HydrophobicContact CE1-CG1 4.46Å; F835-I839 PolarHBondContact O-N 3.41Å; I836-I839 HydrophobicContact CD1-CD1 4.17Å; I836-I839 VanDerWaalsContact O-CG2 3.25Å; I836-I839 WeakPolarHBondContact O-CG2 3.49Å; I836-I839 PolarHBondContact O-N 2.89Å; I839-L841 PolarHBondContact O-N 3.24Å; I839-F842 PolarHBondContact O-N 3.1Å; I839-F842 VanDerWaalsContact O-N 3.08Å; I839-L843 HydrophobicContact CG1-CD1 4.1Å; I839-L843 PolarHBondContact O-N 3.32Å; I839-L843 VanDerWaalsContact O-N 3.08Å; I839-Q922 HydrophobicContact CG2-CG 4.08Å
840	L	91.9	Very high	80.4	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-34.7	179.7	-64.4	-173.6	0	0	0	111.6	V786 W838 F842 L843 N844 V845 L918 K919 Q922	V786-L840 HydrophobicContact CG2-CD2 3.9Å; W838-L840 PolarHBondContact O-N 3.41Å; L840-F842 VanDerWaalsContact C-N 3.34Å; L840-L843 PolarHBondContact O-N 3.46Å; L840-N844 PolarHBondContact O-N 3.27Å; L840-V845 HydrophobicContact CB-CB 4.27Å; L840-V845 WeakPolarHBondContact O-CB 3.29Å; L840-V845 PolarHBondContact O-N 3.45Å; L840-L918 HydrophobicContact CD1-CB 4.23Å; L840-L918 HydrophobicContact CD2-CB 3.91Å; L840-L918 HydrophobicContact CD2-CD2 4.05Å; L840-L918 HydrophobicContact CD2-CG 4.41Å; L840-K919 HydrophobicContact CD1-CG 4.27Å; L840-Q922 HydrophobicContact CD1-CB 4.26Å; L840-Q922 VanDerWaalsContact CD1-OE1 3.24Å; L840-Q922 HydrophobicContact CG-CB 4.34Å; L840-Q922 HydrophobicContact CG-CG 4.47Å
841	L	89.1	Confident	77.7	Confident	53 Å²	53	52.2 Å²	52.2	28%	0.277	27%	0.271	S	S	.	.	H	α-helix	trans	-74.7	-25.8	178.6	-178.3	59.4	0	0	0	112.4	K739 W838 I839	K739-L841 HydrophobicContact CD-CD2 3.23Å; K739-L841 HydrophobicContact CD-CG 3.72Å; W838-L841 HydrophobicContact CE3-CB 4.39Å; W838-L841 HydrophobicContact CE3-CD2 3.43Å; W838-L841 VanDerWaalsContact CE3-CD2 3.43Å; W838-L841 HydrophobicContact CZ3-CD2 3.53Å; W838-L841 WeakPolarHBondContact O-CB 3.45Å; W838-L841 PolarHBondContact O-N 3.16Å; I839-L841 PolarHBondContact O-N 3.24Å
842	F	88.8	Confident	74.8	Confident	22 Å²	22	59.3 Å²	59.3	10%	0.096	31%	0.309	C	S	.	.	H	α-helix	trans	-75	-30.2	170.7	-56.3	-36.1	0	0	0	112.3	P737 K739 I740 I764 F835 W838 I839 L840 N844	P737-F842 HydrophobicContact CB-CD1 3.91Å; P737-F842 HydrophobicContact CB-CE1 3.31Å; P737-F842 HydrophobicContact CB-CE2 4.17Å; P737-F842 HydrophobicContact CB-CZ 3.47Å; P737-F842 VanDerWaalsContact CB-CZ 3.47Å; P737-F842 HydrophobicContact CG-CD1 4.3Å; P737-F842 HydrophobicContact CG-CD2 4.31Å; P737-F842 HydrophobicContact CG-CE1 3.95Å; P737-F842 HydrophobicContact CG-CE2 3.95Å; P737-F842 HydrophobicContact CG-CG 4.5Å; P737-F842 HydrophobicContact CG-CZ 3.78Å; K739-F842 HydrophobicContact CB-CE1 4.03Å; K739-F842 HydrophobicContact CD-CE1 4.18Å; K739-F842 HydrophobicContact CG-CE1 4.28Å; I740-F842 HydrophobicContact CD1-CE2 3.87Å; I740-F842 HydrophobicContact CD1-CZ 3.69Å; I740-F842 HydrophobicContact CG1-CZ 3.91Å; I764-F842 HydrophobicContact CD1-CB 4Å; I764-F842 HydrophobicContact CD1-CD2 4.48Å; I764-F842 HydrophobicContact CG2-CB 4.14Å; I764-F842 WeakPolarHBondContact CG2-O 3.34Å; F835-F842 HydrophobicContact CD2-CD2 4.37Å; F835-F842 AromaticContact CD2-CE2 3.92Å; F835-F842 HydrophobicContact CD2-CE2 3.92Å; F835-F842 HydrophobicContact CE2-CD2 4.07Å; F835-F842 HydrophobicContact CE2-CE2 4.05Å; F835-F842 HydrophobicContact CG-CE2 4.49Å; F835-F842 HydrophobicContact CZ-CD2 4.37Å; W838-F842 HydrophobicContact CB-CE1 4.17Å; W838-F842 HydrophobicContact CB-CE2 3.73Å; W838-F842 HydrophobicContact CB-CZ 3.48Å; W838-F842 VanDerWaalsContact CB-CZ 3.48Å; W838-F842 PolarHBondContact O-N 3Å; I839-F842 PolarHBondContact O-N 3.1Å; I839-F842 VanDerWaalsContact O-N 3.08Å; L840-F842 VanDerWaalsContact C-N 3.34Å; F842-N844 PolarHBondContact O-N 3.14Å
843	L	88.8	Confident	71.8	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.042	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	12.5	174.5	-71.6	160.9	0	0	0	113.3	I764 W767 I782 I785 V786 I839 L840 V845	I764-L843 HydrophobicContact CB-CD2 4.41Å; I764-L843 HydrophobicContact CG1-CD2 4.06Å; I764-L843 HydrophobicContact CG1-CG 4.31Å; I764-L843 HydrophobicContact CG2-CD2 4Å; I764-L843 HydrophobicContact CG2-CG 4.3Å; W767-L843 HydrophobicContact CG-CD2 4.32Å; I782-L843 HydrophobicContact CG2-CD1 4.1Å; I785-L843 HydrophobicContact CG2-CD1 4.34Å; I785-L843 HydrophobicContact CG2-CD2 4.18Å; V786-L843 HydrophobicContact CG2-CD1 3.54Å; I839-L843 HydrophobicContact CG1-CD1 4.1Å; I839-L843 PolarHBondContact O-N 3.32Å; I839-L843 VanDerWaalsContact O-N 3.08Å; L840-L843 PolarHBondContact O-N 3.46Å; L843-V845 HydrophobicContact CB-CG2 4.09Å; L843-V845 PolarHBondContact O-N 3.3Å; L843-V845 VanDerWaalsContact O-N 3.12Å
844	N	84.4	Confident	68.9	Low	111 Å²	111	74 Å²	74	59%	0.594	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	26	-175.1	-68.1	-25.6	0	0	0	114.4	L840 F842 Q846	L840-N844 PolarHBondContact O-N 3.27Å; F842-N844 PolarHBondContact O-N 3.14Å; N844-Q846 PolarHBondContact O-N 3.29Å
845	V	82.6	Confident	66.2	Low	7 Å²	7	80.4 Å²	80.4	4%	0.042	41%	0.407	C	S	.	.			trans	-81.8	88	172.9	-178.2	0	0	0	0	107.5	I782 L840 L843 T847 I910 L915 L918	I782-V845 HydrophobicContact CD1-CG2 4.28Å; I782-V845 HydrophobicContact CG2-CG2 4.05Å; L840-V845 HydrophobicContact CB-CB 4.27Å; L840-V845 WeakPolarHBondContact O-CB 3.29Å; L840-V845 PolarHBondContact O-N 3.45Å; L843-V845 HydrophobicContact CB-CG2 4.09Å; L843-V845 PolarHBondContact O-N 3.3Å; L843-V845 VanDerWaalsContact O-N 3.12Å; V845-T847 PolarHBondContact O-N 2.92Å; V845-I910 HydrophobicContact CG1-CD1 3.79Å; V845-L915 HydrophobicContact CG1-CD1 3.95Å; V845-L918 HydrophobicContact CG1-CD1 4.27Å
846	Q	66.6	Low	63.3	Low	154 Å²	154	83.3 Å²	83.3	72%	0.72	43%	0.425	S	S	*	.			trans	-71	123.9	175	-66.4	-166	-0.5	0	0	109.8	N844	N844-Q846 PolarHBondContact O-N 3.29Å
847	T	54.6	Low	60.1	Low	46 Å²	46	89.7 Å²	89.7	28%	0.282	46%	0.459	S	S	.	.			trans	-82.3	127.1	166.8	55.8	0	0	0	0	107.8	V845 W849 S850 L915 K919	V845-T847 PolarHBondContact O-N 2.92Å; T847-W849 PolarHBondContact O-N 3.32Å; T847-S850 PolarHBondContact O-N 3Å; T847-L915 HydrophobicContact CG2-CD1 4.3Å; T847-K919 VanDerWaalsContact CG2-CE 3.45Å
848	P	43	Very low	57.2	Low	104 Å²	104	91.2 Å²	91.2	68%	0.675	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	2.2	-179.7	-24.6	32.7	0	0	0	116.1
849	W	36.6	Very low	54.2	Low	203 Å²	203	90.1 Å²	90.1	77%	0.769	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.6	37.7	-174.5	-51.3	-34.5	0	0	0	113.6	T847	T847-W849 PolarHBondContact O-N 3.32Å
850	S	33.3	Very low	51.1	Low	93 Å²	93	95.6 Å²	95.6	65%	0.65	51%	0.512	S	S	*	.			trans	-82.8	106.6	160.7	55.6	0	0	0	0	108.4	T847	T847-S850 PolarHBondContact O-N 3Å
851	S	35.7	Very low	48.1	Very low	104 Å²	104	99.8 Å²	99.8	73%	0.727	54%	0.541	S	S	*	.	S	Bend		-169.6	10	88.4	-64.7	0	0	0	0	114.7
852	N	31	Very low	45.1	Very low	149 Å²	149	104.1 Å²	104.1	80%	0.797	57%	0.565	S	S	*	*	S	Bend	trans	-96.2	1.2	-173.5	-85.7	1.9	0	0	0	116.6	K854	N852-K854 PolarHBondContact O-N 3.16Å
853	N	30.3	Very low	42	Very low	114 Å²	114	108.4 Å²	108.4	61%	0.61	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-93.8	34.1	-178.1	-81.4	-6.1	0	0	0	115.3	H855 V856	N853-H855 PolarHBondContact O-N 3.07Å; N853-V856 HydrophobicContact CB-CB 4.32Å; N853-V856 HydrophobicContact CB-CG2 4.25Å; N853-V856 PolarHBondContact O-N 3.34Å
854	K	35.4	Very low	39	Very low	194 Å²	194	115.4 Å²	115.4	84%	0.843	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-61.7	-15.9	163	-84.6	-172.9	176.6	-179.7	0	112.8	N852	N852-K854 PolarHBondContact O-N 3.16Å
855	H	33	Very low	36.1	Very low	159 Å²	159	117.7 Å²	117.7	74%	0.736	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-94.1	-14.9	178.2	-76	-75.1	0	0	0	115.7	N853 S858	N853-H855 PolarHBondContact O-N 3.07Å; H855-S858 PolarHBondContact O-OG 2.98Å
856	V	31.6	Very low	33.3	Very low	62 Å²	62	124.6 Å²	124.6	38%	0.376	69%	0.685	S	S	.	*	G	3₁₀ helix	trans	-90	-11.3	-175.6	-175.4	0	0	0	0	113.4	N853 S858 S859	N853-V856 HydrophobicContact CB-CB 4.32Å; N853-V856 HydrophobicContact CB-CG2 4.25Å; N853-V856 PolarHBondContact O-N 3.34Å; V856-S858 PolarHBondContact O-N 3.26Å; V856-S859 PolarHBondContact O-N 3.17Å; V856-S859 PolarHBondContact O-OG 2.79Å
857	L	27.7	Very low	31.1	Very low	133 Å²	133	122 Å²	122	70%	0.696	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-68.2	-9.2	169.5	-91.6	152.2	0	0	0	113.5
858	S	33.8	Very low	29.6	Very low	94 Å²	94	124.7 Å²	124.7	66%	0.657	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-87.3	-10.5	174.4	66.5	0	0	0	0	114.7	H855 V856	H855-S858 PolarHBondContact O-OG 2.98Å; V856-S858 PolarHBondContact O-N 3.26Å
859	S	28	Very low	28.9	Very low	76 Å²	76	127.8 Å²	127.8	53%	0.531	72%	0.716	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.4	-1	-176.8	53.5	0	0	0	0	115.4	V856	V856-S859 PolarHBondContact O-N 3.17Å; V856-S859 PolarHBondContact O-OG 2.79Å
860	I	27.7	Very low	28.1	Very low	115 Å²	115	126.2 Å²	126.2	59%	0.59	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	0.6	177.9	-60.3	175.7	0	0	0	112.4	N862	I860-N862 VanDerWaalsContact C-N 3.34Å
861	S	27.6	Very low	27.4	Very low	94 Å²	94	128 Å²	128	66%	0.657	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-6.3	172.5	54.5	0	0	0	0	115
862	N	26.7	Very low	26.9	Very low	144 Å²	144	126.1 Å²	126.1	77%	0.77	73%	0.729	S	S	*	*			trans	-121.7	45.5	-175.1	-75	11.3	0	0	0	114.3	I860	I860-N862 VanDerWaalsContact C-N 3.34Å
863	T	23.8	Very low	26.5	Very low	112 Å²	112	125.3 Å²	125.3	69%	0.687	73%	0.73	S	S	*	*			trans	-117.7	73.8	165.2	62.7	0	0	0	0	110.5
864	N	25.1	Very low	26.3	Very low	156 Å²	156	125.7 Å²	125.7	83%	0.834	74%	0.737	S	S	*	*			trans	-125.9	65.9	157.6	-88.8	-13.9	0	0	0	107.1
865	D	24.3	Very low	25.7	Very low	158 Å²	158	123.4 Å²	123.4	85%	0.845	74%	0.739	S	S	*	*			trans	-153.1	94.3	164.2	-87.1	-37.2	0	0	0	108.6
866	T	22.6	Very low	25.4	Very low	153 Å²	153	119.4 Å²	119.4	94%	0.939	74%	0.741	S	S	*	*			trans	-114.2	90.3	166.2	46.3	0	0	0	0	107.9
867	S	21.8	Very low	25	Very low	99 Å²	99	126.6 Å²	126.6	69%	0.692	77%	0.767	S	S	*	*			trans	-138.2	115.8	157.6	54.6	0	0	0	0	109.1
868	S	23.4	Very low	24.8	Very low	102 Å²	102	124.9 Å²	124.9	71%	0.713	77%	0.766	S	S	*	*			trans	48	109.4	155.4	57.5	0	0	0	0	118.8
869	N	26.6	Very low	24.4	Very low	170 Å²	170	127 Å²	127	91%	0.909	77%	0.77	S	S	*	*				-159.6	102.3	122.8	-91.7	-18.5	0	0	0	109.6
870	L	20.4	Very low	24.2	Very low	170 Å²	170	130.5 Å²	130.5	89%	0.89	78%	0.783	S	S	*	*			trans	-80.9	151.1	164.2	-97.2	110.3	0	0	0	109.1
871	C	19.9	Very low	24.3	Very low	131 Å²	131	132.1 Å²	132.1	89%	0.885	80%	0.799	S	S	*	*			trans	107.2	118.2	144.2	-128.1	0	0	0	0	119.1
872	G	23.3	Very low	24.1	Very low	64 Å²	64	137.6 Å²	137.6	66%	0.66	81%	0.811	S	S	*	*			trans	78.4	142.7	148.1	0	0	0	0	0	116.9
873	T	24.4	Very low	24.3	Very low	132 Å²	132	136.4 Å²	136.4	81%	0.81	81%	0.813	S	S	*	*			cis	-173.5	149.2	8.8	13.4	0	0	0	0	108.6
874	T	24.8	Very low	24.2	Very low	122 Å²	122	137.6 Å²	137.6	75%	0.748	82%	0.816	S	S	*	*			trans	59.6	104.6	145.1	56.1	0	0	0	0	121.9
875	T	22.7	Very low	24.5	Very low	146 Å²	146	138 Å²	138	90%	0.896	82%	0.818	S	S	*	*			trans	-8.1	119.7	133.5	53.3	0	0	0	0	117.7
876	G	27.7	Very low	24.5	Very low	75 Å²	75	136.5 Å²	136.5	77%	0.773	81%	0.81	S	S	*	*			trans	-147.7	105.4	165.7	0	0	0	0	0	111.4
877	K	23	Very low	24.9	Very low	212 Å²	212	137 Å²	137	92%	0.922	81%	0.807	S	S	*	*			trans	-65.9	140.5	165.6	-67.5	170.4	175	175	0	109.1
878	S	23.8	Very low	25.1	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	81%	0.809	S	S	*	*				167.3	132.5	108	99.7	0	0	0	0	113.2
879	N	24.9	Very low	25.4	Very low	138 Å²	138	141.8 Å²	141.8	74%	0.738	82%	0.816	S	S	*	*			trans	65	110.7	130	-61	-13.8	0	0	0	122.4
880	N	23.9	Very low	25.4	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	81%	0.812	S	S	*	*				43.6	118	120	-76.7	-16.6	0	0	0	118.5
881	T	29.6	Very low	25.8	Very low	150 Å²	150	135 Å²	135	92%	0.92	81%	0.809	S	S	*	*				-150.1	131.2	126.9	25.4	0	0	0	0	111.2
882	K	23.8	Very low	26.1	Very low	209 Å²	209	133.3 Å²	133.3	91%	0.909	81%	0.805	S	S	*	*			trans	-68.9	143.7	175.4	-69.2	167.7	171.1	175.3	0	110.4
883	S	29.6	Very low	26.3	Very low	118 Å²	118	136.3 Å²	136.3	83%	0.825	81%	0.81	S	S	*	*			trans	-136.2	109.4	155	177.7	0	0	0	0	108.7
884	N	23.6	Very low	26.5	Very low	138 Å²	138	137.5 Å²	137.5	74%	0.738	81%	0.812	S	S	*	*			trans	-71.8	133.9	173	-115.5	-3	0	0	0	108.8
885	N	30.8	Very low	26.6	Very low	164 Å²	164	139.1 Å²	139.1	88%	0.877	82%	0.816	S	S	*	*			trans	-143.5	105.4	150	-106.3	-16.3	0	0	0	110.6
886	N	24.8	Very low	26.9	Very low	127 Å²	127	138.2 Å²	138.2	68%	0.679	81%	0.81	S	S	*	*			trans	-61.8	138.2	163.6	-75.6	-28.8	0	0	0	109.5
887	N	30.3	Very low	26.9	Very low	163 Å²	163	142.2 Å²	142.2	87%	0.872	81%	0.814	S	S	*	*			trans	-157.2	126.8	130.9	-103.2	-20.4	0	0	0	112.1
888	N	26.1	Very low	27.2	Very low	139 Å²	139	136.4 Å²	136.4	74%	0.743	81%	0.805	S	S	*	*			trans	-62.9	141.5	176.7	-60.4	-42.4	0	0	0	111
889	N	30.4	Very low	27.3	Very low	162 Å²	162	137.9 Å²	137.9	87%	0.866	81%	0.811	S	S	*	*				-164	129.1	119.1	-100.8	-17.8	0	0	0	112.7
890	S	25.6	Very low	27.3	Very low	118 Å²	118	137.9 Å²	137.9	83%	0.825	82%	0.816	S	S	*	*			trans	-68.2	131.6	-178.1	48.9	0	0	0	0	113.4
891	G	29.2	Very low	27.4	Very low	79 Å²	79	139.6 Å²	139.6	81%	0.814	82%	0.816	S	S	*	*			trans	-138.6	98.1	159	0	0	0	0	0	107.7
892	A	25.8	Very low	27.3	Very low	97 Å²	97	137 Å²	137	80%	0.802	80%	0.804	S	S	*	*			trans	-79.3	127.2	-175.2	0	0	0	0	0	111.4
893	T	27.8	Very low	27.5	Very low	126 Å²	126	133.4 Å²	133.4	77%	0.773	79%	0.793	S	S	*	*			trans	-152.7	102.9	151.8	46	0	0	0	0	109
894	D	28.1	Very low	27.6	Very low	158 Å²	158	134.2 Å²	134.2	85%	0.845	79%	0.788	S	S	*	*			trans	40	80.2	147.6	-59.5	-19.8	0	0	0	119	T896	D894-T896 PolarHBondContact O-N 3.15Å
895	N	27.3	Very low	28.1	Very low	155 Å²	155	133.4 Å²	133.4	83%	0.829	78%	0.784	S	S	*	*			trans	-80.3	98.3	158.7	-86	-17.6	0	0	0	109.9	N897	N895-N897 PolarHBondContact O-N 3.2Å
896	T	29.2	Very low	28.2	Very low	128 Å²	128	134.4 Å²	134.4	79%	0.785	78%	0.783	S	S	*	*			trans	-62.7	114.9	155.8	47.5	0	0	0	0	108.6	D894 A898	D894-T896 PolarHBondContact O-N 3.15Å; T896-A898 VanDerWaalsContact C-N 3.31Å; T896-A898 PolarHBondContact O-N 3.2Å
897	N	27.3	Very low	29.1	Very low	158 Å²	158	135.9 Å²	135.9	85%	0.845	79%	0.786	S	S	*	*			trans	-58.8	86.3	174.4	-72.7	-29.8	0	0	0	111	N895 T899	N895-N897 PolarHBondContact O-N 3.2Å; N897-T899 PolarHBondContact O-N 3.25Å
898	A	29.3	Very low	30	Very low	90 Å²	90	132.8 Å²	132.8	74%	0.744	77%	0.774	S	S	*	*			trans	-88.4	97.4	163.1	0	0	0	0	0	107.6	T896 T900	T896-A898 VanDerWaalsContact C-N 3.31Å; T896-A898 PolarHBondContact O-N 3.2Å; A898-T900 PolarHBondContact O-N 3.26Å; A898-T900 VanDerWaalsContact O-N 3.16Å
899	T	26.5	Very low	31.7	Very low	130 Å²	130	134.9 Å²	134.9	80%	0.798	78%	0.776	S	S	*	*			trans	-42.4	115.8	171.3	-17.9	0	0	0	0	110.1	N897 K901	N897-T899 PolarHBondContact O-N 3.25Å; T899-K901 VanDerWaalsContact C-N 3.3Å; T899-K901 PolarHBondContact O-N 2.9Å
900	T	24.7	Very low	33.7	Very low	138 Å²	138	128.7 Å²	128.7	85%	0.847	74%	0.743	S	S	*	*			trans	-54.7	92.1	166.8	41.8	0	0	0	0	109.2	A898 S902	A898-T900 PolarHBondContact O-N 3.26Å; A898-T900 VanDerWaalsContact O-N 3.16Å; T900-S902 PolarHBondContact O-N 3.11Å
901	K	26.1	Very low	36.2	Very low	185 Å²	185	125.6 Å²	125.6	80%	0.804	72%	0.72	S	S	*	*			trans	-75.8	105.6	153.3	-78	-174.8	175.8	-178	0	105.4	T899 I903	T899-K901 VanDerWaalsContact C-N 3.3Å; T899-K901 PolarHBondContact O-N 2.9Å; K901-I903 PolarHBondContact O-N 2.91Å
902	S	26.8	Very low	38.7	Very low	94 Å²	94	129.3 Å²	129.3	66%	0.657	71%	0.71	S	S	*	*			trans	-50.1	104.5	160.9	46.1	0	0	0	0	107.3	T900 D904	T900-S902 PolarHBondContact O-N 3.11Å; S902-D904 PolarHBondContact O-N 3.36Å; S902-D904 VanDerWaalsContact O-N 3.17Å
903	I	28.1	Very low	41.5	Very low	135 Å²	135	131.8 Å²	131.8	69%	0.692	71%	0.705	S	S	*	*			trans	-72.9	104.6	163.9	-64.2	173.7	0	0	0	103.4	K901 D905	K901-I903 PolarHBondContact O-N 2.91Å; I903-D905 WeakPolarHBondContact CG2-OD1 3.16Å; I903-D905 PolarHBondContact O-N 3.31Å
904	D	31.4	Very low	44.4	Very low	135 Å²	135	127.2 Å²	127.2	72%	0.722	68%	0.675	S	S	*	*			trans	-63.7	86.5	169.3	-68.1	-45.1	0	0	0	107.5	S902 E906	S902-D904 PolarHBondContact O-N 3.36Å; S902-D904 VanDerWaalsContact O-N 3.17Å; D904-E906 PolarHBondContact O-N 2.95Å
905	D	33.6	Very low	47.2	Very low	120 Å²	120	120.6 Å²	120.6	64%	0.642	64%	0.64	S	S	*	*			trans	-70.8	72.1	168.8	-71.2	-31.9	0	0	0	108.6	I903 E907	I903-D905 WeakPolarHBondContact CG2-OD1 3.16Å; I903-D905 PolarHBondContact O-N 3.31Å; D905-E907 PolarHBondContact O-N 3.48Å; D905-E907 VanDerWaalsContact O-N 3.14Å
906	E	34.7	Very low	50.1	Low	185 Å²	185	118 Å²	118	86%	0.864	62%	0.623	S	S	*	*			trans	-77.1	39.4	164.3	-74.4	-154.6	151.2	0	0	111.6	D904 T908	D904-E906 PolarHBondContact O-N 2.95Å; E906-T908 PolarHBondContact O-N 3.36Å; E906-T908 VanDerWaalsContact O-N 3.09Å
907	E	42.3	Very low	53.2	Low	158 Å²	158	114.1 Å²	114.1	74%	0.738	60%	0.599	S	S	*	*			trans	-76.3	98.5	170.9	-79.8	-170.4	158	0	0	110.1	D905 K909	D905-E907 PolarHBondContact O-N 3.48Å; D905-E907 VanDerWaalsContact O-N 3.14Å; E907-K909 PolarHBondContact O-N 2.84Å
908	T	49.5	Very low	56.3	Low	99 Å²	99	106.6 Å²	106.6	61%	0.607	56%	0.558	S	S	*	*			trans	31.2	74.7	154.2	51.6	0	0	0	0	115.6	E906 I910	E906-T908 PolarHBondContact O-N 3.36Å; E906-T908 VanDerWaalsContact O-N 3.09Å; T908-I910 PolarHBondContact O-N 3.2Å; T908-I910 VanDerWaalsContact O-N 3.15Å
909	K	62.4	Low	59.3	Low	182 Å²	182	105 Å²	105	79%	0.791	54%	0.535	S	S	*	.			trans	-75.6	103.2	175.7	-77.6	176.8	-178.5	165	0	110.4	E907	E907-K909 PolarHBondContact O-N 2.84Å
910	I	72	Confident	62.5	Low	33 Å²	33	107.4 Å²	107.4	17%	0.169	53%	0.529	C	S	.	.			trans	-46.6	125.5	166.6	-50.3	-173.9	0	0	0	109	Y779 V845 T908 Y912 L915	Y779-I910 HydrophobicContact CD1-CG2 4.03Å; Y779-I910 HydrophobicContact CE1-CB 4.38Å; Y779-I910 HydrophobicContact CE1-CD1 4.21Å; Y779-I910 HydrophobicContact CE1-CG1 4.11Å; Y779-I910 HydrophobicContact CE1-CG2 3.68Å; Y779-I910 HydrophobicContact CE2-CG2 4.21Å; Y779-I910 HydrophobicContact CG-CG2 4.46Å; V845-I910 HydrophobicContact CG1-CD1 3.79Å; T908-I910 PolarHBondContact O-N 3.2Å; T908-I910 VanDerWaalsContact O-N 3.15Å; I910-Y912 PolarHBondContact O-N 2.85Å; I910-L915 HydrophobicContact CG2-CB 4.01Å
911	P	78.9	Confident	65.8	Low	53 Å²	53	102.2 Å²	102.2	34%	0.344	50%	0.496	S	S	.	.			trans	-54.7	127.4	177.4	-25.9	33.8	0	0	0	111	Y779 Q913 H914 L915	Y779-P911 HydrophobicContact CD2-CG 4.44Å; P911-Q913 PolarHBondContact O-N 3.48Å; P911-Q913 VanDerWaalsContact O-N 3.13Å; P911-H914 PolarHBondContact O-N 3.33Å; P911-L915 PolarHBondContact O-N 3.43Å; P911-L915 VanDerWaalsContact O-N 3.13Å
912	Y	80.2	Confident	69	Low	157 Å²	157	94.6 Å²	94.6	62%	0.616	46%	0.463	S	S	*	.	H	α-helix	trans	-53	-40.8	-171.8	177.6	-93	0	0	0	112.9	I910 H914 L915 E916	I910-Y912 PolarHBondContact O-N 2.85Å; Y912-H914 PolarHBondContact O-N 2.95Å; Y912-L915 PolarHBondContact O-N 3Å; Y912-E916 HydrophobicContact CE1-CB 4.43Å; Y912-E916 WeakPolarHBondContact CE1-OE2 3.38Å; Y912-E916 WeakPolarHBondContact O-CB 3.27Å; Y912-E916 PolarHBondContact O-N 2.9Å
913	Q	85.1	Confident	72.2	Confident	149 Å²	149	95.7 Å²	95.7	70%	0.696	46%	0.458	S	S	*	.	H	α-helix	trans	-61.9	-40.5	179.6	-67.3	-179.7	-13.5	0	0	113	P911 T917	P911-Q913 PolarHBondContact O-N 3.48Å; P911-Q913 VanDerWaalsContact O-N 3.13Å; Q913-T917 WeakPolarHBondContact O-CB 3.42Å; Q913-T917 PolarHBondContact O-N 3.23Å; Q913-T917 PolarHBondContact O-OG1 3.32Å
914	H	88.1	Confident	75.4	Confident	30 Å²	30	96.3 Å²	96.3	14%	0.139	46%	0.455	C	S	.	.	H	α-helix	trans	-69	-43.8	176.4	-71.1	85.2	0	0	0	111.2	Y779 N780 P911 Y912 E916 T917 L918	Y779-H914 VanDerWaalsContact CB-CD2 3.42Å; Y779-H914 WeakPolarHBondContact CB-CD2 3.31Å; Y779-H914 HydrophobicContact CG-CB 4.3Å; N780-H914 PolarHBondContact OD1-CD2 3.42Å; N780-H914 PolarHBondContact OD1-NE2 2.9Å; P911-H914 PolarHBondContact O-N 3.33Å; Y912-H914 PolarHBondContact O-N 2.95Å; H914-E916 VanDerWaalsContact C-N 3.35Å; H914-E916 PolarHBondContact O-N 3.42Å; H914-T917 PolarHBondContact O-N 3.46Å; H914-L918 WeakPolarHBondContact O-CB 3.48Å; H914-L918 VanDerWaalsContact O-CG 3.32Å; H914-L918 WeakPolarHBondContact O-CG 3.13Å; H914-L918 PolarHBondContact O-N 2.93Å
915	L	87.5	Confident	78.4	Confident	19 Å²	19	90.3 Å²	90.3	10%	0.099	43%	0.425	C	S	.	.	H	α-helix	trans	-61.9	-43.1	177.5	-175.5	62.6	0	0	0	111.8	V845 T847 I910 P911 Y912 L918 K919	V845-L915 HydrophobicContact CG1-CD1 3.95Å; T847-L915 HydrophobicContact CG2-CD1 4.3Å; I910-L915 HydrophobicContact CG2-CB 4.01Å; P911-L915 PolarHBondContact O-N 3.43Å; P911-L915 VanDerWaalsContact O-N 3.13Å; Y912-L915 PolarHBondContact O-N 3Å; L915-L918 PolarHBondContact O-N 3.26Å; L915-K919 WeakPolarHBondContact O-CB 3.37Å; L915-K919 WeakPolarHBondContact O-CG 3.14Å; L915-K919 PolarHBondContact O-N 2.63Å
916	E	89	Confident	81.4	Confident	101 Å²	101	87.5 Å²	87.5	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-62.9	-43.7	175.9	-174.7	173.5	-163.8	0	0	111.3	Y912 H914 L918 K919 R920	Y912-E916 HydrophobicContact CE1-CB 4.43Å; Y912-E916 WeakPolarHBondContact CE1-OE2 3.38Å; Y912-E916 WeakPolarHBondContact O-CB 3.27Å; Y912-E916 PolarHBondContact O-N 2.9Å; H914-E916 VanDerWaalsContact C-N 3.35Å; H914-E916 PolarHBondContact O-N 3.42Å; E916-L918 PolarHBondContact O-N 3.39Å; E916-K919 PolarHBondContact O-N 2.92Å; E916-R920 WeakPolarHBondContact O-CB 3.34Å; E916-R920 PolarHBondContact O-N 3.5Å
917	T	92.8	Very high	84.3	Confident	46 Å²	46	80.5 Å²	80.5	28%	0.282	38%	0.383	S	S	.	.	H	α-helix	trans	-61.9	-45.1	176.8	-60.3	0	0	0	0	111.8	I783 Q913 H914 R920 L921	I783-T917 HydrophobicContact CD1-CG2 3.89Å; I783-T917 HydrophobicContact CG1-CG2 4.28Å; I783-T917 HydrophobicContact CG2-CG2 4.5Å; Q913-T917 WeakPolarHBondContact O-CB 3.42Å; Q913-T917 PolarHBondContact O-N 3.23Å; Q913-T917 PolarHBondContact O-OG1 3.32Å; H914-T917 PolarHBondContact O-N 3.46Å; T917-R920 PolarHBondContact O-N 2.79Å; T917-L921 HydrophobicContact CG2-CD1 4.02Å; T917-L921 WeakPolarHBondContact O-CB 3.48Å; T917-L921 WeakPolarHBondContact O-CG 3.33Å; T917-L921 PolarHBondContact O-N 3.02Å
918	L	93.3	Very high	86.9	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-61.8	-47	177.3	-77.1	170.6	0	0	0	112	I782 I783 V786 L840 V845 H914 L915 E916 R920 L921 Q922	I782-L918 HydrophobicContact CB-CD2 4.48Å; I782-L918 HydrophobicContact CG2-CD1 3.94Å; I782-L918 HydrophobicContact CG2-CD2 3.69Å; I782-L918 HydrophobicContact CG2-CG 4.5Å; I783-L918 HydrophobicContact CB-CD2 4.32Å; I783-L918 HydrophobicContact CG1-CD2 3.6Å; I783-L918 HydrophobicContact CG1-CG 3.81Å; V786-L918 HydrophobicContact CB-CD2 4.35Å; V786-L918 HydrophobicContact CG2-CD2 3.96Å; L840-L918 HydrophobicContact CD1-CB 4.23Å; L840-L918 HydrophobicContact CD2-CB 3.91Å; L840-L918 HydrophobicContact CD2-CD2 4.05Å; L840-L918 HydrophobicContact CD2-CG 4.41Å; V845-L918 HydrophobicContact CG1-CD1 4.27Å; H914-L918 WeakPolarHBondContact O-CB 3.48Å; H914-L918 VanDerWaalsContact O-CG 3.32Å; H914-L918 WeakPolarHBondContact O-CG 3.13Å; H914-L918 PolarHBondContact O-N 2.93Å; L915-L918 PolarHBondContact O-N 3.26Å; E916-L918 PolarHBondContact O-N 3.39Å; L918-R920 VanDerWaalsContact C-N 3.35Å; L918-R920 PolarHBondContact O-N 3.43Å; L918-L921 PolarHBondContact O-N 2.98Å; L918-Q922 WeakPolarHBondContact O-CB 3.26Å; L918-Q922 PolarHBondContact O-N 2.89Å
919	K	91.7	Very high	89.2	Confident	56 Å²	56	70.9 Å²	70.9	24%	0.243	33%	0.331	C	S	.	.	H	α-helix	trans	-59.5	-47	174.7	-76	179.9	178.4	-178.9	0	110.7	L840 T847 L915 E916 L921 Q922 H923	L840-K919 HydrophobicContact CD1-CG 4.27Å; T847-K919 VanDerWaalsContact CG2-CE 3.45Å; L915-K919 WeakPolarHBondContact O-CB 3.37Å; L915-K919 WeakPolarHBondContact O-CG 3.14Å; L915-K919 PolarHBondContact O-N 2.63Å; E916-K919 PolarHBondContact O-N 2.92Å; K919-L921 VanDerWaalsContact C-N 3.32Å; K919-L921 PolarHBondContact O-N 3.29Å; K919-Q922 PolarHBondContact O-N 2.98Å; K919-H923 WeakPolarHBondContact O-CB 3.36Å; K919-H923 PolarHBondContact O-N 2.73Å; K919-H923 PolarHBondContact O-ND1 2.92Å
920	R	93.4	Very high	90.8	Very high	180 Å²	180	63.4 Å²	63.4	68%	0.679	30%	0.3	S	S	*	.	H	α-helix	trans	-59.7	-43.1	179.6	-169.5	-179.2	72.5	173	1.2	111.8	E916 T917 L918 K924	E916-R920 WeakPolarHBondContact O-CB 3.34Å; E916-R920 PolarHBondContact O-N 3.5Å; T917-R920 PolarHBondContact O-N 2.79Å; L918-R920 VanDerWaalsContact C-N 3.35Å; L918-R920 PolarHBondContact O-N 3.43Å; R920-K924 VanDerWaalsContact O-CB 3.25Å; R920-K924 WeakPolarHBondContact O-CB 3.34Å; R920-K924 PolarHBondContact O-N 3.32Å
921	L	93.9	Very high	91.9	Very high	30 Å²	30	68.7 Å²	68.7	16%	0.157	32%	0.318	C	S	.	.	H	α-helix	trans	-63.7	-47.5	177	-76.1	166.2	0	0	0	112	I783 V786 Q787 T917 L918 K919 K924 G925	I783-L921 HydrophobicContact CG2-CD1 3.76Å; V786-L921 HydrophobicContact CG1-CB 4.09Å; Q787-L921 HydrophobicContact CG-CD1 3.89Å; Q787-L921 HydrophobicContact CG-CD2 3.86Å; T917-L921 HydrophobicContact CG2-CD1 4.02Å; T917-L921 WeakPolarHBondContact O-CB 3.48Å; T917-L921 WeakPolarHBondContact O-CG 3.33Å; T917-L921 PolarHBondContact O-N 3.02Å; L918-L921 PolarHBondContact O-N 2.98Å; K919-L921 VanDerWaalsContact C-N 3.32Å; K919-L921 PolarHBondContact O-N 3.29Å; L921-K924 PolarHBondContact O-N 2.95Å; L921-G925 PolarHBondContact O-N 3.44Å
922	Q	94.4	Very high	92.8	Very high	24 Å²	24	66.7 Å²	66.7	11%	0.112	30%	0.304	C	S	.	.	H	α-helix	trans	-58.5	-49.8	177.1	-176.2	-175.3	39.1	0	0	111.9	I836 Q837 I839 L840 L918 K919 K924 G925 Y926	I836-Q922 VanDerWaalsContact O-CG 3.29Å; I836-Q922 WeakPolarHBondContact O-CG 3.06Å; I836-Q922 PolarHBondContact O-NE2 2.78Å; Q837-Q922 VanDerWaalsContact C-NE2 3.26Å; Q837-Q922 PolarHBondContact O-NE2 3.48Å; I839-Q922 HydrophobicContact CG2-CG 4.08Å; L840-Q922 HydrophobicContact CD1-CB 4.26Å; L840-Q922 VanDerWaalsContact CD1-OE1 3.24Å; L840-Q922 HydrophobicContact CG-CB 4.34Å; L840-Q922 HydrophobicContact CG-CG 4.47Å; L918-Q922 WeakPolarHBondContact O-CB 3.26Å; L918-Q922 PolarHBondContact O-N 2.89Å; K919-Q922 PolarHBondContact O-N 2.98Å; Q922-K924 VanDerWaalsContact C-N 3.35Å; Q922-K924 PolarHBondContact O-N 2.93Å; Q922-G925 PolarHBondContact O-N 3.3Å; Q922-Y926 WeakPolarHBondContact O-CB 3.49Å; Q922-Y926 PolarHBondContact O-N 3.34Å
923	H	94.4	Very high	93.5	Very high	118 Å²	118	59.2 Å²	59.2	55%	0.546	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-40.9	-179.8	-73.9	82	0	0	0	111.4	K919 G927	K919-H923 WeakPolarHBondContact O-CB 3.36Å; K919-H923 PolarHBondContact O-N 2.73Å; K919-H923 PolarHBondContact O-ND1 2.92Å; H923-G927 PolarHBondContact O-N 3.1Å
924	K	94.7	Very high	94	Very high	148 Å²	148	55.3 Å²	55.3	64%	0.643	26%	0.259	S	S	*	.	H	α-helix	trans	-62.5	-47.8	175.7	-175.8	-179.4	179.2	-177.6	0	111.6	R920 L921 Q922 G927 E928	R920-K924 VanDerWaalsContact O-CB 3.25Å; R920-K924 WeakPolarHBondContact O-CB 3.34Å; R920-K924 PolarHBondContact O-N 3.32Å; L921-K924 PolarHBondContact O-N 2.95Å; Q922-K924 VanDerWaalsContact C-N 3.35Å; Q922-K924 PolarHBondContact O-N 2.93Å; K924-G927 PolarHBondContact O-N 2.95Å; K924-E928 WeakPolarHBondContact O-CG 3.37Å; K924-E928 PolarHBondContact O-N 3.42Å
925	G	94.6	Very high	94.2	Very high	8 Å²	8	59.9 Å²	59.9	8%	0.082	28%	0.275	C	S	.	.	H	α-helix	trans	-60.9	-49.2	178.4	0	0	0	0	0	112.1	L921 Q922 G927 E928 L929	L921-G925 PolarHBondContact O-N 3.44Å; Q922-G925 PolarHBondContact O-N 3.3Å; G925-G927 PolarHBondContact O-N 3.36Å; G925-E928 PolarHBondContact O-N 2.85Å; G925-L929 WeakPolarHBondContact O-CG 3.48Å; G925-L929 PolarHBondContact O-N 2.84Å; G925-L929 VanDerWaalsContact O-N 3.1Å
926	Y	96.2	Very high	94.5	Very high	62 Å²	62	59 Å²	59	24%	0.243	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-46.5	176.1	177.9	-108	0	0	0	112.1	S833 Q837 Q922 E928 L929 I930	S833-Y926 VanDerWaalsContact O-CD2 3.31Å; S833-Y926 WeakPolarHBondContact O-CD2 3.32Å; Q837-Y926 HydrophobicContact CB-CD2 3.84Å; Q837-Y926 HydrophobicContact CB-CE2 3.91Å; Q837-Y926 HydrophobicContact CG-CD2 4.42Å; Q837-Y926 HydrophobicContact CG-CE2 4.24Å; Q922-Y926 WeakPolarHBondContact O-CB 3.49Å; Q922-Y926 PolarHBondContact O-N 3.34Å; Y926-E928 PolarHBondContact O-N 2.88Å; Y926-L929 PolarHBondContact O-N 3.24Å; Y926-I930 HydrophobicContact CD1-CG1 4.2Å; Y926-I930 HydrophobicContact CD2-CG1 4.17Å; Y926-I930 HydrophobicContact CE1-CD1 4.47Å; Y926-I930 HydrophobicContact CE1-CG1 3.79Å; Y926-I930 HydrophobicContact CE2-CD1 3.84Å; Y926-I930 HydrophobicContact CE2-CG1 3.76Å; Y926-I930 HydrophobicContact CG-CG1 4.38Å; Y926-I930 WeakPolarHBondContact O-CG1 3.24Å; Y926-I930 PolarHBondContact O-N 3.04Å
927	G	96.1	Very high	94.7	Very high	37 Å²	37	54.3 Å²	54.3	38%	0.381	25%	0.248	S	C	.	.	H	α-helix	trans	-59.3	-43.4	178.6	0	0	0	0	0	113.1	H923 K924 G925 I930 R931	H923-G927 PolarHBondContact O-N 3.1Å; K924-G927 PolarHBondContact O-N 2.95Å; G925-G927 PolarHBondContact O-N 3.36Å; G927-I930 PolarHBondContact O-N 3.03Å; G927-R931 WeakPolarHBondContact O-CB 3.35Å; G927-R931 PolarHBondContact O-N 3.42Å
928	E	97.1	Very high	94.7	Very high	56 Å²	56	57.9 Å²	57.9	26%	0.262	26%	0.257	S	S	.	.	H	α-helix	trans	-64.9	-39.3	176	-74.7	-61.7	140.8	0	0	112.6	L794 K924 G925 Y926 R931 V932	L794-E928 HydrophobicContact CD1-CB 3.83Å; L794-E928 HydrophobicContact CD2-CB 4.18Å; L794-E928 HydrophobicContact CD2-CG 4.48Å; K924-E928 WeakPolarHBondContact O-CG 3.37Å; K924-E928 PolarHBondContact O-N 3.42Å; G925-E928 PolarHBondContact O-N 2.85Å; Y926-E928 PolarHBondContact O-N 2.88Å; E928-R931 WeakPolarHBondContact O-CB 3.48Å; E928-R931 PolarHBondContact O-N 3.12Å; E928-R931 IonicContact OE1-NE 3.58Å; E928-R931 IonicContact OE1-NH2 2.77Å; E928-R931 IonicContact OE2-CZ 2.69Å; E928-R931 VanDerWaalsContact OE2-CZ 3.32Å; E928-R931 IonicContact OE2-NE 3.03Å; E928-R931 PolarHBondContact OE2-NE 3.49Å; E928-R931 VanDerWaalsContact OE2-NE 3.12Å; E928-R931 IonicContact OE2-NH2 3.94Å; E928-R931 PolarHBondContact OE2-NH2 3.3Å; E928-V932 WeakPolarHBondContact O-CG2 3.29Å; E928-V932 PolarHBondContact O-N 3.39Å; E928-V932 VanDerWaalsContact O-N 3.09Å
929	L	97.2	Very high	94.6	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-44.8	175.9	-69.1	173.2	0	0	0	111.8	L794 A797 I832 S833 I836 G925 Y926 R931 V932 L933	L794-L929 HydrophobicContact CB-CD2 4.44Å; L794-L929 HydrophobicContact CD1-CD2 4.35Å; A797-L929 HydrophobicContact CB-CD2 3.55Å; I832-L929 HydrophobicContact CD1-CD2 4.03Å; I832-L929 HydrophobicContact CG1-CD2 4.31Å; S833-L929 WeakPolarHBondContact OG-CB 3.34Å; I836-L929 HydrophobicContact CB-CD1 4.03Å; I836-L929 HydrophobicContact CG1-CD1 3.62Å; G925-L929 WeakPolarHBondContact O-CG 3.48Å; G925-L929 PolarHBondContact O-N 2.84Å; G925-L929 VanDerWaalsContact O-N 3.1Å; Y926-L929 PolarHBondContact O-N 3.24Å; L929-R931 VanDerWaalsContact C-N 3.25Å; L929-R931 PolarHBondContact O-N 2.74Å; L929-V932 PolarHBondContact O-N 3.37Å; L929-V932 VanDerWaalsContact O-N 3.13Å; L929-L933 PolarHBondContact O-N 3.34Å
930	I	96	Very high	94.6	Very high	24 Å²	24	60.4 Å²	60.4	12%	0.123	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-36.3	174.8	-68.6	-59.6	0	0	0	111.4	Y926 G927 L933 N934	Y926-I930 HydrophobicContact CD1-CG1 4.2Å; Y926-I930 HydrophobicContact CD2-CG1 4.17Å; Y926-I930 HydrophobicContact CE1-CD1 4.47Å; Y926-I930 HydrophobicContact CE1-CG1 3.79Å; Y926-I930 HydrophobicContact CE2-CD1 3.84Å; Y926-I930 HydrophobicContact CE2-CG1 3.76Å; Y926-I930 HydrophobicContact CG-CG1 4.38Å; Y926-I930 WeakPolarHBondContact O-CG1 3.24Å; Y926-I930 PolarHBondContact O-N 3.04Å; G927-I930 PolarHBondContact O-N 3.03Å; I930-L933 HydrophobicContact CD1-CD2 4.26Å; I930-L933 PolarHBondContact O-N 3.33Å; I930-N934 WeakPolarHBondContact O-CB 2.94Å; I930-N934 VanDerWaalsContact O-CG 3.26Å; I930-N934 PolarHBondContact O-N 3.12Å
931	R	95.9	Very high	94.5	Very high	145 Å²	145	52.1 Å²	52.1	55%	0.547	23%	0.234	S	C	.	.	H	α-helix	trans	-63	-42.4	174.5	-169.4	176.1	72	125.3	-4.3	112	G927 E928 L929 R935	G927-R931 WeakPolarHBondContact O-CB 3.35Å; G927-R931 PolarHBondContact O-N 3.42Å; E928-R931 WeakPolarHBondContact O-CB 3.48Å; E928-R931 PolarHBondContact O-N 3.12Å; E928-R931 IonicContact OE1-NE 3.58Å; E928-R931 IonicContact OE1-NH2 2.77Å; E928-R931 IonicContact OE2-CZ 2.69Å; E928-R931 VanDerWaalsContact OE2-CZ 3.32Å; E928-R931 IonicContact OE2-NE 3.03Å; E928-R931 PolarHBondContact OE2-NE 3.49Å; E928-R931 VanDerWaalsContact OE2-NE 3.12Å; E928-R931 IonicContact OE2-NH2 3.94Å; E928-R931 PolarHBondContact OE2-NH2 3.3Å; L929-R931 VanDerWaalsContact C-N 3.25Å; L929-R931 PolarHBondContact O-N 2.74Å; R931-R935 WeakPolarHBondContact O-CB 3.21Å; R931-R935 PolarHBondContact O-N 3.24Å
932	V	96.3	Very high	94.4	Very high	11 Å²	11	52.3 Å²	52.3	7%	0.067	24%	0.24	C	C	.	.	H	α-helix	trans	-66.6	-42.5	176	177	0	0	0	0	111.2	L794 A797 K798 H801 L829 E928 L929 R935 T936	L794-V932 HydrophobicContact CD1-CG2 4.3Å; A797-V932 HydrophobicContact CB-CB 4.37Å; A797-V932 HydrophobicContact CB-CG1 4.06Å; A797-V932 WeakPolarHBondContact O-CG1 3.39Å; K798-V932 HydrophobicContact CG-CG2 4.42Å; H801-V932 HydrophobicContact CB-CG1 3.89Å; L829-V932 HydrophobicContact CD2-CG1 4.36Å; E928-V932 WeakPolarHBondContact O-CG2 3.29Å; E928-V932 PolarHBondContact O-N 3.39Å; E928-V932 VanDerWaalsContact O-N 3.09Å; L929-V932 PolarHBondContact O-N 3.37Å; L929-V932 VanDerWaalsContact O-N 3.13Å; V932-R935 PolarHBondContact O-N 3.02Å; V932-T936 PolarHBondContact O-N 3.13Å; V932-T936 PolarHBondContact O-OG1 2.79Å
933	L	95.6	Very high	94.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.1	-54.5	174.4	175.3	62.8	0	0	0	111.4	L826 L829 E830 L929 I930 R935 T936 I937 L990	L826-L933 HydrophobicContact CD2-CD1 3.92Å; L829-L933 HydrophobicContact CB-CB 4.38Å; L829-L933 HydrophobicContact CB-CD1 3.83Å; L829-L933 HydrophobicContact CD1-CD1 4.23Å; E830-L933 VanDerWaalsContact OE2-CD2 3.22Å; E830-L933 WeakPolarHBondContact OE2-CD2 3.42Å; L929-L933 PolarHBondContact O-N 3.34Å; I930-L933 HydrophobicContact CD1-CD2 4.26Å; I930-L933 PolarHBondContact O-N 3.33Å; L933-R935 VanDerWaalsContact C-N 3.29Å; L933-R935 PolarHBondContact O-N 2.92Å; L933-T936 WeakPolarHBondContact O-CA 3.43Å; L933-T936 WeakPolarHBondContact O-CB 3.45Å; L933-T936 PolarHBondContact O-N 3.34Å; L933-I937 HydrophobicContact CD1-CD1 4.21Å; L933-I937 HydrophobicContact CD1-CG1 4.48Å; L933-I937 HydrophobicContact CG-CD1 4.17Å; L933-I937 WeakPolarHBondContact O-CG1 3.44Å; L933-I937 PolarHBondContact O-N 3.07Å; L933-L990 HydrophobicContact CD1-CD1 3.98Å; L933-L990 HydrophobicContact CD2-CD1 4.24Å
934	N	94.8	Very high	94	Very high	66 Å²	66	50.3 Å²	50.3	35%	0.353	23%	0.23	S	C	.	.	H	α-helix	trans	-62	-37.1	-180	-71.3	-9.2	0	0	0	111.9	I930 T936 I937 Y938 R993	I930-N934 WeakPolarHBondContact O-CB 2.94Å; I930-N934 VanDerWaalsContact O-CG 3.26Å; I930-N934 PolarHBondContact O-N 3.12Å; N934-T936 VanDerWaalsContact C-N 3.27Å; N934-T936 PolarHBondContact O-N 2.89Å; N934-I937 PolarHBondContact O-N 3.25Å; N934-Y938 WeakPolarHBondContact O-CB 3.37Å; N934-Y938 PolarHBondContact O-N 3.41Å; N934-R993 WeakPolarHBondContact OD1-CD 3.34Å; N934-R993 PolarHBondContact OD1-NH1 3.36Å
935	R	93.5	Very high	94	Very high	127 Å²	127	45.1 Å²	45.1	48%	0.479	21%	0.206	S	C	.	.	H	α-helix	trans	-62	-35.9	172.9	-179.7	175.7	170.5	145.3	-1.2	111.9	H801 R931 V932 L933 R939	H801-R935 PolarHBondContact NE2-NE 2.74Å; R931-R935 WeakPolarHBondContact O-CB 3.21Å; R931-R935 PolarHBondContact O-N 3.24Å; V932-R935 PolarHBondContact O-N 3.02Å; L933-R935 VanDerWaalsContact C-N 3.29Å; L933-R935 PolarHBondContact O-N 2.92Å; R935-R939 WeakPolarHBondContact O-CG 3.28Å; R935-R939 PolarHBondContact O-N 3.1Å; R935-R939 VanDerWaalsContact O-N 3.11Å
936	T	93.7	Very high	93.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.7	-44.6	177.6	-50.7	0	0	0	0	110.8	H801 L804 Y809 L822 L826 L829 V932 L933 N934 Y938 R939 M940	H801-T936 PolarHBondContact ND1-OG1 3.45Å; L804-T936 HydrophobicContact CD1-CG2 3.99Å; Y809-T936 HydrophobicContact CE1-CG2 4.32Å; L822-T936 HydrophobicContact CD1-CG2 4.39Å; L826-T936 HydrophobicContact CD2-CG2 3.72Å; L829-T936 HydrophobicContact CD1-CG2 4.43Å; V932-T936 PolarHBondContact O-N 3.13Å; V932-T936 PolarHBondContact O-OG1 2.79Å; L933-T936 WeakPolarHBondContact O-CA 3.43Å; L933-T936 WeakPolarHBondContact O-CB 3.45Å; L933-T936 PolarHBondContact O-N 3.34Å; N934-T936 VanDerWaalsContact C-N 3.27Å; N934-T936 PolarHBondContact O-N 2.89Å; T936-Y938 PolarHBondContact O-N 3.38Å; T936-R939 PolarHBondContact O-N 3Å; T936-M940 PolarHBondContact O-N 3.17Å
937	I	94.1	Very high	93.7	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-61.1	-43.8	174.3	-62.5	172.2	0	0	0	110.9	L826 L933 N934 R939 M940 N941 L990 R993 S997	L826-I937 HydrophobicContact CD2-CG1 3.85Å; L933-I937 HydrophobicContact CD1-CD1 4.21Å; L933-I937 HydrophobicContact CD1-CG1 4.48Å; L933-I937 HydrophobicContact CG-CD1 4.17Å; L933-I937 WeakPolarHBondContact O-CG1 3.44Å; L933-I937 PolarHBondContact O-N 3.07Å; N934-I937 PolarHBondContact O-N 3.25Å; I937-R939 VanDerWaalsContact C-N 3.28Å; I937-R939 PolarHBondContact O-N 3.36Å; I937-M940 HydrophobicContact CG2-CE 4.13Å; I937-M940 VanDerWaalsContact O-CB 3.32Å; I937-M940 WeakPolarHBondContact O-CB 3.26Å; I937-M940 PolarHBondContact O-N 3.16Å; I937-M940 VanDerWaalsContact O-N 3.16Å; I937-N941 PolarHBondContact O-N 3.45Å; I937-N941 PolarHBondContact O-OD1 3.2Å; I937-L990 HydrophobicContact CD1-CD1 3.98Å; I937-R993 HydrophobicContact CD1-CG 3.88Å; I937-S997 WeakPolarHBondContact CG2-OG 3.13Å
938	Y	91.9	Very high	93.6	Very high	121 Å²	121	45 Å²	45	48%	0.475	20%	0.202	S	C	.	.	H	α-helix	trans	-59.3	-39.8	175.6	176.2	-98.2	0	0	0	112.1	N934 T936 N941 A942	N934-Y938 WeakPolarHBondContact O-CB 3.37Å; N934-Y938 PolarHBondContact O-N 3.41Å; T936-Y938 PolarHBondContact O-N 3.38Å; Y938-N941 PolarHBondContact O-N 2.76Å; Y938-A942 WeakPolarHBondContact O-CB 3Å; Y938-A942 PolarHBondContact O-N 2.89Å
939	R	90.7	Very high	93.4	Very high	110 Å²	110	46.7 Å²	46.7	42%	0.415	21%	0.206	S	C	.	.	H	α-helix	trans	-68	-35.8	176.5	-69.9	-69.7	-176	-177.2	-0.5	112.7	Y809 R935 T936 I937 A942 K943	Y809-R939 HydrophobicContact CE1-CB 4.35Å; Y809-R939 HydrophobicContact CE2-CB 3.89Å; Y809-R939 WeakPolarHBondContact OH-CB 3.19Å; R935-R939 WeakPolarHBondContact O-CG 3.28Å; R935-R939 PolarHBondContact O-N 3.1Å; R935-R939 VanDerWaalsContact O-N 3.11Å; T936-R939 PolarHBondContact O-N 3Å; I937-R939 VanDerWaalsContact C-N 3.28Å; I937-R939 PolarHBondContact O-N 3.36Å; R939-A942 PolarHBondContact O-N 3.38Å; R939-K943 PolarHBondContact O-N 3.45Å
940	M	92	Very high	93.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.1	-50.6	170.2	175.5	-170.2	81.1	0	0	110.4	F816 I818 L822 L826 T936 I937 A942 K943 M944 I998	F816-M940 HydrophobicContact CE1-CG 4.29Å; F816-M940 HydrophobicContact CZ-CG 4.35Å; I818-M940 HydrophobicContact CD1-CE 4.2Å; I818-M940 HydrophobicContact CD1-CG 4.26Å; I818-M940 HydrophobicContact CD1-SD 3.62Å; I818-M940 HydrophobicContact CG1-CG 4.07Å; I818-M940 HydrophobicContact CG1-SD 3.91Å; L822-M940 HydrophobicContact CD2-CB 4.1Å; L822-M940 HydrophobicContact CD2-CG 3.77Å; L822-M940 HydrophobicContact CD2-SD 4Å; L826-M940 HydrophobicContact CD1-SD 4.33Å; T936-M940 PolarHBondContact O-N 3.17Å; I937-M940 HydrophobicContact CG2-CE 4.13Å; I937-M940 VanDerWaalsContact O-CB 3.32Å; I937-M940 WeakPolarHBondContact O-CB 3.26Å; I937-M940 PolarHBondContact O-N 3.16Å; I937-M940 VanDerWaalsContact O-N 3.16Å; M940-A942 VanDerWaalsContact C-N 3.33Å; M940-A942 PolarHBondContact O-N 3.09Å; M940-K943 WeakPolarHBondContact O-CA 3.15Å; M940-K943 WeakPolarHBondContact O-CB 3.26Å; M940-K943 PolarHBondContact O-N 2.97Å; M940-M944 PolarHBondContact O-N 2.86Å; M940-M944 VanDerWaalsContact O-N 3.09Å; M940-I998 HydrophobicContact CE-CD1 4.27Å; M940-I998 HydrophobicContact CE-CG1 4.22Å
941	N	92.3	Very high	93	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.027	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-39.3	178.5	-62.8	-1.3	0	0	0	112.5	I937 Y938 K943 M944 R945 S997 E1001	I937-N941 PolarHBondContact O-N 3.45Å; I937-N941 PolarHBondContact O-OD1 3.2Å; Y938-N941 PolarHBondContact O-N 2.76Å; N941-K943 PolarHBondContact O-N 3.35Å; N941-M944 CarbonylContact O-C 3.56Å; N941-M944 PolarHBondContact O-N 3.25Å; N941-R945 PolarHBondContact O-N 3.48Å; N941-S997 WeakPolarHBondContact ND2-CB 3.25Å; N941-S997 PolarHBondContact ND2-O 3.46Å; N941-S997 PolarHBondContact ND2-OG 3Å; N941-E1001 HydrophobicContact CB-CB 4.15Å; N941-E1001 HydrophobicContact CB-CG 4.1Å
942	A	90.3	Very high	92.8	Very high	34 Å²	34	43.8 Å²	43.8	28%	0.281	20%	0.197	S	C	.	.	H	α-helix	trans	-60	-26.7	175.3	0	0	0	0	0	112.7	Y938 R939 M940	Y938-A942 WeakPolarHBondContact O-CB 3Å; Y938-A942 PolarHBondContact O-N 2.89Å; R939-A942 PolarHBondContact O-N 3.38Å; M940-A942 VanDerWaalsContact C-N 3.33Å; M940-A942 PolarHBondContact O-N 3.09Å
943	K	89.8	Confident	92.4	Very high	99 Å²	99	45.7 Å²	45.7	43%	0.43	21%	0.205	S	C	.	.	H	α-helix	trans	-81.5	-30.6	172.7	-74.7	-73.9	-168.3	161.7	0	113.2	Y809 F816 R939 M940 N941 P946	Y809-K943 HydrophobicContact CD2-CG 4.31Å; F816-K943 HydrophobicContact CB-CB 4.5Å; F816-K943 HydrophobicContact CD1-CB 3.69Å; F816-K943 HydrophobicContact CD2-CB 3.75Å; F816-K943 HydrophobicContact CD2-CD 4.49Å; F816-K943 HydrophobicContact CD2-CG 4.3Å; F816-K943 HydrophobicContact CE1-CB 3.75Å; F816-K943 HydrophobicContact CE2-CB 3.78Å; F816-K943 HydrophobicContact CE2-CG 4.18Å; F816-K943 HydrophobicContact CG-CB 3.7Å; F816-K943 HydrophobicContact CZ-CB 3.79Å; F816-K943 HydrophobicContact CZ-CG 4.49Å; R939-K943 PolarHBondContact O-N 3.45Å; M940-K943 WeakPolarHBondContact O-CA 3.15Å; M940-K943 WeakPolarHBondContact O-CB 3.26Å; M940-K943 PolarHBondContact O-N 2.97Å; N941-K943 PolarHBondContact O-N 3.35Å; K943-P946 VanDerWaalsContact O-CD 3.28Å; K943-P946 WeakPolarHBondContact O-CD 3Å
944	M	92	Very high	92	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-74.2	-28.9	172.2	-60.6	-178.9	74.8	0	0	112.7	F816 I818 M940 N941 P946 E947 I948 Y974 L975 N978 I998	F816-M944 HydrophobicContact CD1-CG 3.71Å; F816-M944 HydrophobicContact CE1-CG 3.67Å; I818-M944 HydrophobicContact CD1-SD 4.07Å; I818-M944 HydrophobicContact CG1-SD 4.41Å; M940-M944 PolarHBondContact O-N 2.86Å; M940-M944 VanDerWaalsContact O-N 3.09Å; N941-M944 CarbonylContact O-C 3.56Å; N941-M944 PolarHBondContact O-N 3.25Å; M944-P946 VanDerWaalsContact C-CD 3.45Å; M944-E947 PolarHBondContact O-N 2.85Å; M944-E947 VanDerWaalsContact O-N 3.11Å; M944-I948 HydrophobicContact CB-CD1 3.88Å; M944-I948 HydrophobicContact CB-CG1 4.44Å; M944-I948 WeakPolarHBondContact O-CG1 3.39Å; M944-I948 PolarHBondContact O-N 2.97Å; M944-Y974 HydrophobicContact CB-CE1 4.42Å; M944-Y974 HydrophobicContact CE-CE1 3.95Å; M944-L975 HydrophobicContact CE-CD2 4.23Å; M944-N978 HydrophobicContact CE-CB 3.9Å; M944-I998 HydrophobicContact CE-CD1 4.41Å; M944-I998 HydrophobicContact CE-CG2 4.31Å; M944-I998 HydrophobicContact SD-CD1 4.19Å; M944-I998 HydrophobicContact SD-CG1 4.09Å
945	R	93.5	Very high	91.8	Very high	39 Å²	39	47.1 Å²	47.1	15%	0.147	21%	0.209	C	C	.	.	H	α-helix	trans	-46.2	-48.1	-175.8	179.3	179.7	-59.1	-142.3	-6.8	114.5	N941 E947 I948 R949 E1001 E1004	N941-R945 PolarHBondContact O-N 3.48Å; R945-E947 VanDerWaalsContact C-N 3.34Å; R945-E947 PolarHBondContact O-N 3.44Å; R945-I948 PolarHBondContact O-N 2.94Å; R945-R949 WeakPolarHBondContact O-CB 3Å; R945-R949 PolarHBondContact O-N 2.96Å; R945-E1001 WeakPolarHBondContact CB-OE1 3.49Å; R945-E1001 WeakPolarHBondContact CD-OE1 3.35Å; R945-E1001 WeakPolarHBondContact CG-OE1 3.48Å; R945-E1001 IonicContact CZ-OE1 2.73Å; R945-E1001 VanDerWaalsContact CZ-OE1 3.22Å; R945-E1001 IonicContact CZ-OE2 3.22Å; R945-E1001 IonicContact NE-OE1 2.93Å; R945-E1001 PolarHBondContact NE-OE1 2.97Å; R945-E1001 IonicContact NE-OE2 3.28Å; R945-E1001 PolarHBondContact NE-OE2 3.26Å; R945-E1001 IonicContact NH2-OE1 2.92Å; R945-E1001 PolarHBondContact NH2-OE1 3.49Å; R945-E1001 IonicContact NH2-OE2 2.75Å; R945-E1001 PolarHBondContact NH2-OE2 2.94Å; R945-E1004 IonicContact CZ-OE1 3.34Å; R945-E1004 IonicContact CZ-OE2 3.72Å; R945-E1004 IonicContact NH1-OE1 3.64Å; R945-E1004 PolarHBondContact NH1-OE1 3.49Å; R945-E1004 IonicContact NH1-OE2 3.39Å; R945-E1004 IonicContact NH2-OE1 2.71Å; R945-E1004 PolarHBondContact NH2-OE1 3.08Å; R945-E1004 IonicContact NH2-OE2 3.19Å; R945-E1004 PolarHBondContact NH2-OE2 3.49Å
946	P	91.6	Very high	91.5	Very high	72 Å²	72	41.3 Å²	41.3	47%	0.468	19%	0.188	S	C	.	.	H	α-helix	trans	-59.8	-41.7	-178.9	-23.6	35.9	0	0	0	113.1	K943 M944 K950	K943-P946 VanDerWaalsContact O-CD 3.28Å; K943-P946 WeakPolarHBondContact O-CD 3Å; M944-P946 VanDerWaalsContact C-CD 3.45Å; P946-K950 WeakPolarHBondContact O-CB 3.28Å; P946-K950 PolarHBondContact O-N 2.96Å
947	E	92.4	Very high	90.9	Very high	33 Å²	33	47.8 Å²	47.8	15%	0.154	21%	0.212	C	C	.	.	H	α-helix	trans	-74.5	-40	179.2	-74.2	-59.6	138.4	0	0	111.9	Q815 M944 R945 R949 K950 N951 Y974	Q815-E947 HydrophobicContact CB-CG 4.4Å; Q815-E947 HydrophobicContact CG-CG 3.94Å; M944-E947 PolarHBondContact O-N 2.85Å; M944-E947 VanDerWaalsContact O-N 3.11Å; R945-E947 VanDerWaalsContact C-N 3.34Å; R945-E947 PolarHBondContact O-N 3.44Å; E947-R949 VanDerWaalsContact C-N 3.33Å; E947-R949 PolarHBondContact O-N 3.39Å; E947-K950 PolarHBondContact O-N 3.08Å; E947-K950 IonicContact OE1-NZ 3.26Å; E947-K950 PolarHBondContact OE1-NZ 2.94Å; E947-K950 IonicContact OE2-NZ 2.9Å; E947-K950 PolarHBondContact OE2-NZ 3.43Å; E947-N951 WeakPolarHBondContact O-CB 3.4Å; E947-N951 PolarHBondContact O-N 3.34Å; E947-N951 PolarHBondContact O-ND2 3.06Å; E947-Y974 HydrophobicContact CB-CD1 4.36Å; E947-Y974 HydrophobicContact CB-CE1 3.89Å
948	I	95.1	Very high	90.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58	-50.1	172.9	-63.5	170.7	0	0	0	109.5	M944 R945 K950 N951 V952 L971 Y974 L975 E1001 Q1005	M944-I948 HydrophobicContact CB-CD1 3.88Å; M944-I948 HydrophobicContact CB-CG1 4.44Å; M944-I948 WeakPolarHBondContact O-CG1 3.39Å; M944-I948 PolarHBondContact O-N 2.97Å; R945-I948 PolarHBondContact O-N 2.94Å; I948-K950 PolarHBondContact O-N 3.04Å; I948-N951 PolarHBondContact O-N 3.18Å; I948-V952 HydrophobicContact CG2-CG2 4.39Å; I948-V952 VanDerWaalsContact O-CG2 3.31Å; I948-V952 WeakPolarHBondContact O-CG2 3.36Å; I948-V952 PolarHBondContact O-N 3.4Å; I948-L971 HydrophobicContact CG1-CD1 4.48Å; I948-L971 HydrophobicContact CG2-CD1 4.38Å; I948-Y974 HydrophobicContact CG1-CE1 4.19Å; I948-L975 HydrophobicContact CD1-CD2 4.48Å; I948-E1001 HydrophobicContact CD1-CG 3.93Å; I948-Q1005 HydrophobicContact CB-CG 4.32Å; I948-Q1005 HydrophobicContact CG2-CB 4.09Å; I948-Q1005 HydrophobicContact CG2-CG 3.73Å
949	R	93.2	Very high	90.1	Very high	91 Å²	91	49.4 Å²	49.4	34%	0.343	23%	0.231	S	C	.	.	H	α-helix	trans	-59.6	-47.6	178.9	-175.9	-176	-67	159	-13.6	112.3	R945 E947 N951 V952 F953 Q1005 E1008	R945-R949 WeakPolarHBondContact O-CB 3Å; R945-R949 PolarHBondContact O-N 2.96Å; E947-R949 VanDerWaalsContact C-N 3.33Å; E947-R949 PolarHBondContact O-N 3.39Å; R949-N951 VanDerWaalsContact C-N 3.29Å; R949-N951 PolarHBondContact O-N 3.24Å; R949-V952 PolarHBondContact O-N 2.9Å; R949-F953 VanDerWaalsContact O-CB 3.3Å; R949-F953 WeakPolarHBondContact O-CB 3.35Å; R949-F953 PolarHBondContact O-N 2.83Å; R949-Q1005 HydrophobicContact CB-CG 4.36Å; R949-E1008 IonicContact CZ-OE2 3.24Å; R949-E1008 IonicContact NE-OE2 3.25Å; R949-E1008 IonicContact NH2-OE2 3.89Å; R949-E1008 PolarHBondContact NH2-OE2 3.04Å
950	K	91.5	Very high	89.5	Confident	96 Å²	96	50.4 Å²	50.4	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-57.7	-42.8	177.6	172	-178.1	155.7	-148.9	0	111.4	P946 E947 I948 F953 H954	P946-K950 WeakPolarHBondContact O-CB 3.28Å; P946-K950 PolarHBondContact O-N 2.96Å; E947-K950 PolarHBondContact O-N 3.08Å; E947-K950 IonicContact OE1-NZ 3.26Å; E947-K950 PolarHBondContact OE1-NZ 2.94Å; E947-K950 IonicContact OE2-NZ 2.9Å; E947-K950 PolarHBondContact OE2-NZ 3.43Å; I948-K950 PolarHBondContact O-N 3.04Å; K950-F953 WeakPolarHBondContact O-CB 3.49Å; K950-F953 PolarHBondContact O-N 3.48Å; K950-H954 PolarHBondContact O-CD2 3.35Å; K950-H954 PolarHBondContact O-N 2.91Å
951	N	93.2	Very high	89.2	Confident	11 Å²	11	55.3 Å²	55.3	6%	0.059	27%	0.269	C	S	.	.	H	α-helix	trans	-69.7	-41.8	177.9	-82.2	-75.6	0	0	0	113	E947 I948 R949 F953 H954 L955 D970 L971	E947-N951 WeakPolarHBondContact O-CB 3.4Å; E947-N951 PolarHBondContact O-N 3.34Å; E947-N951 PolarHBondContact O-ND2 3.06Å; I948-N951 PolarHBondContact O-N 3.18Å; R949-N951 VanDerWaalsContact C-N 3.29Å; R949-N951 PolarHBondContact O-N 3.24Å; N951-F953 VanDerWaalsContact C-N 3.25Å; N951-F953 PolarHBondContact O-N 3.46Å; N951-H954 PolarHBondContact O-N 3.03Å; N951-L955 PolarHBondContact O-N 3.12Å; N951-D970 WeakPolarHBondContact OD1-CB 3.39Å; N951-L971 HydrophobicContact CB-CB 3.84Å; N951-L971 HydrophobicContact CB-CD1 3.97Å; N951-L971 HydrophobicContact CB-CG 4.35Å; N951-L971 PolarHBondContact OD1-N 2.67Å
952	V	92.3	Very high	89	Confident	2 Å²	2	57 Å²	57	1%	0.012	28%	0.279	C	S	.	.	H	α-helix	trans	-60.9	-38.9	173.3	172.9	0	0	0	0	110.7	I948 R949 L955 C956 L971 Q1005 Y1006 Q1009 L1077	I948-V952 HydrophobicContact CG2-CG2 4.39Å; I948-V952 VanDerWaalsContact O-CG2 3.31Å; I948-V952 WeakPolarHBondContact O-CG2 3.36Å; I948-V952 PolarHBondContact O-N 3.4Å; R949-V952 PolarHBondContact O-N 2.9Å; V952-L955 WeakPolarHBondContact O-CB 3.31Å; V952-L955 PolarHBondContact O-N 2.95Å; V952-C956 PolarHBondContact O-N 3.11Å; V952-C956 PolarHBondContact O-SG 3.39Å; V952-L971 HydrophobicContact CG2-CD2 4.44Å; V952-Q1005 HydrophobicContact CG2-CB 4.36Å; V952-Y1006 HydrophobicContact CG1-CD2 4.41Å; V952-Y1006 HydrophobicContact CG2-CD2 3.86Å; V952-Y1006 HydrophobicContact CG2-CE2 3.63Å; V952-Q1009 HydrophobicContact CG1-CB 3.86Å; V952-Q1009 HydrophobicContact CG1-CG 4.05Å; V952-L1077 HydrophobicContact CG1-CD2 4.18Å
953	F	87.7	Confident	89.1	Confident	51 Å²	51	58.1 Å²	58.1	22%	0.224	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-48.2	172.9	176.6	-92.2	0	0	0	112.1	R949 K950 N951 L955 C956 W957 P1024 G1025	R949-F953 VanDerWaalsContact O-CB 3.3Å; R949-F953 WeakPolarHBondContact O-CB 3.35Å; R949-F953 PolarHBondContact O-N 2.83Å; K950-F953 WeakPolarHBondContact O-CB 3.49Å; K950-F953 PolarHBondContact O-N 3.48Å; N951-F953 VanDerWaalsContact C-N 3.25Å; N951-F953 PolarHBondContact O-N 3.46Å; F953-L955 VanDerWaalsContact C-N 3.3Å; F953-L955 PolarHBondContact O-N 2.92Å; F953-C956 WeakPolarHBondContact O-CA 3.49Å; F953-C956 WeakPolarHBondContact O-CB 3.25Å; F953-C956 PolarHBondContact O-N 3.45Å; F953-W957 HydrophobicContact CD1-CG 4.43Å; F953-W957 HydrophobicContact CE1-CB 4.34Å; F953-W957 AromaticContact CE1-CD2 3.95Å; F953-W957 HydrophobicContact CE1-CD2 3.95Å; F953-W957 HydrophobicContact CE1-CE3 4.47Å; F953-W957 AromaticContact CE1-CG 3.81Å; F953-W957 HydrophobicContact CE1-CG 3.81Å; F953-W957 AromaticContact CE2-CD1 3.74Å; F953-W957 HydrophobicContact CE2-CG 4.32Å; F953-W957 AromaticContact CE2-NE1 3.66Å; F953-W957 AromaticContact CZ-CD1 3.6Å; F953-W957 AromaticContact CZ-CD2 3.67Å; F953-W957 HydrophobicContact CZ-CD2 3.67Å; F953-W957 AromaticContact CZ-CE2 3.64Å; F953-W957 HydrophobicContact CZ-CE3 4.38Å; F953-W957 AromaticContact CZ-CG 3.74Å; F953-W957 HydrophobicContact CZ-CG 3.74Å; F953-W957 HydrophobicContact CZ-CZ2 4.41Å; F953-W957 AromaticContact CZ-NE1 3.55Å; F953-W957 WeakPolarHBondContact O-CB 3.24Å; F953-W957 PolarHBondContact O-N 3.48Å; F953-P1024 HydrophobicContact CE2-CB 4.44Å; F953-P1024 HydrophobicContact CZ-CB 4.18Å; F953-G1025 VanDerWaalsContact CE2-CA 3.48Å
954	H	87.2	Confident	89.3	Confident	93 Å²	93	53.8 Å²	53.8	43%	0.431	27%	0.266	S	S	.	.	H	α-helix	trans	-62.3	-35	177.3	-76.4	-54.7	0	0	0	113.1	K950 N951 C956 W957 S958	K950-H954 PolarHBondContact O-CD2 3.35Å; K950-H954 PolarHBondContact O-N 2.91Å; N951-H954 PolarHBondContact O-N 3.03Å; H954-C956 VanDerWaalsContact C-N 3.28Å; H954-C956 PolarHBondContact O-N 3.42Å; H954-W957 CarbonylContact O-C 3.6Å; H954-W957 PolarHBondContact O-N 3.36Å; H954-S958 WeakPolarHBondContact O-CB 3.4Å; H954-S958 PolarHBondContact O-N 2.88Å
955	L	90	Very high	89.2	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-56.8	-44.7	171	164.5	67.6	0	0	0	111.2	N951 V952 F953 W957 S958 V964 A967 M968 R1076 L1077 S1080	N951-L955 PolarHBondContact O-N 3.12Å; V952-L955 WeakPolarHBondContact O-CB 3.31Å; V952-L955 PolarHBondContact O-N 2.95Å; F953-L955 VanDerWaalsContact C-N 3.3Å; F953-L955 PolarHBondContact O-N 2.92Å; L955-W957 VanDerWaalsContact C-N 3.35Å; L955-S958 PolarHBondContact O-OG 3.33Å; L955-V964 HydrophobicContact CD1-CG1 4.05Å; L955-A967 HydrophobicContact CD1-CB 3.78Å; L955-M968 HydrophobicContact CD1-CG 4.14Å; L955-M968 HydrophobicContact CD2-CG 4.39Å; L955-R1076 PolarHBondContact O-NE 3.33Å; L955-L1077 HydrophobicContact CD2-CD2 4.12Å; L955-S1080 WeakPolarHBondContact CD2-OG 3.44Å
956	C	86.5	Confident	89.1	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.034	31%	0.312	C	S	.	.	H	α-helix	trans	-70.5	-32.6	179	-62.5	0	0	0	0	112.4	V952 F953 H954 Q1009 T1073	V952-C956 PolarHBondContact O-N 3.11Å; V952-C956 PolarHBondContact O-SG 3.39Å; F953-C956 WeakPolarHBondContact O-CA 3.49Å; F953-C956 WeakPolarHBondContact O-CB 3.25Å; F953-C956 PolarHBondContact O-N 3.45Å; H954-C956 VanDerWaalsContact C-N 3.28Å; H954-C956 PolarHBondContact O-N 3.42Å; C956-Q1009 VanDerWaalsContact SG-CG 3.58Å; C956-T1073 HydrophobicContact CB-CG2 3.52Å; C956-T1073 VanDerWaalsContact SG-CG2 3.56Å
957	W	82.2	Confident	89.1	Confident	137 Å²	137	60.5 Å²	60.5	52%	0.519	30%	0.296	S	S	.	.	H	α-helix	trans	-88.9	-8	-179	-91.2	54.6	0	0	0	115.1	F953 H954 L955 P1024	F953-W957 HydrophobicContact CD1-CG 4.43Å; F953-W957 HydrophobicContact CE1-CB 4.34Å; F953-W957 AromaticContact CE1-CD2 3.95Å; F953-W957 HydrophobicContact CE1-CD2 3.95Å; F953-W957 HydrophobicContact CE1-CE3 4.47Å; F953-W957 AromaticContact CE1-CG 3.81Å; F953-W957 HydrophobicContact CE1-CG 3.81Å; F953-W957 AromaticContact CE2-CD1 3.74Å; F953-W957 HydrophobicContact CE2-CG 4.32Å; F953-W957 AromaticContact CE2-NE1 3.66Å; F953-W957 AromaticContact CZ-CD1 3.6Å; F953-W957 AromaticContact CZ-CD2 3.67Å; F953-W957 HydrophobicContact CZ-CD2 3.67Å; F953-W957 AromaticContact CZ-CE2 3.64Å; F953-W957 HydrophobicContact CZ-CE3 4.38Å; F953-W957 AromaticContact CZ-CG 3.74Å; F953-W957 HydrophobicContact CZ-CG 3.74Å; F953-W957 HydrophobicContact CZ-CZ2 4.41Å; F953-W957 AromaticContact CZ-NE1 3.55Å; F953-W957 WeakPolarHBondContact O-CB 3.24Å; F953-W957 PolarHBondContact O-N 3.48Å; H954-W957 CarbonylContact O-C 3.6Å; H954-W957 PolarHBondContact O-N 3.36Å; L955-W957 VanDerWaalsContact C-N 3.35Å; W957-P1024 WeakPolarHBondContact CZ2-O 3.08Å
958	S	85.3	Confident	89.2	Confident	29 Å²	29	59.1 Å²	59.1	20%	0.203	29%	0.29	C	S	.	.	S	Bend	trans	-64.2	149	176.6	63	0	0	0	0	111.8	H954 L955 R960 R1076	H954-S958 WeakPolarHBondContact O-CB 3.4Å; H954-S958 PolarHBondContact O-N 2.88Å; L955-S958 PolarHBondContact O-OG 3.33Å; S958-R960 PolarHBondContact O-N 3.09Å; S958-R1076 PolarHBondContact OG-NH2 3.49Å
959	L	82.7	Confident	89.1	Confident	127 Å²	127	64.3 Å²	64.3	67%	0.665	31%	0.314	S	S	*	.			trans	-54.2	138.9	176.1	-66.3	168	0	0	0	109.9	S961 T962	L959-S961 PolarHBondContact O-N 3.42Å; L959-S961 VanDerWaalsContact O-N 3.07Å; L959-T962 WeakPolarHBondContact O-CA 3.41Å; L959-T962 WeakPolarHBondContact O-CB 3.43Å; L959-T962 PolarHBondContact O-N 3.34Å; L959-T962 PolarHBondContact O-OG1 3.36Å
960	R	79	Confident	89.1	Confident	131 Å²	131	65 Å²	65	49%	0.494	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.2	179.7	-69.4	-174	-177.3	171.9	0.6	113.1	S958 T962 F1068	S958-R960 PolarHBondContact O-N 3.09Å; R960-T962 VanDerWaalsContact C-N 3.26Å; R960-T962 PolarHBondContact O-N 3.03Å; R960-F1068 PolarHBondContact NH2-O 2.99Å; R960-F1068 VanDerWaalsContact NH2-O 3.15Å
961	S	85.4	Confident	89.3	Confident	103 Å²	103	60.6 Å²	60.6	72%	0.72	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-17.9	175.7	54.3	0	0	0	0	113.7	L959 P963	L959-S961 PolarHBondContact O-N 3.42Å; L959-S961 VanDerWaalsContact O-N 3.07Å; S961-P963 WeakPolarHBondContact O-CD 3.45Å
962	T	89.1	Confident	89.4	Confident	41 Å²	41	62 Å²	62	25%	0.252	31%	0.312	S	S	.	.	S	Bend	trans	-73.3	120.2	177.8	-55.8	0	0	0	0	109.4	L959 R960 K966 A967 R1076	L959-T962 WeakPolarHBondContact O-CA 3.41Å; L959-T962 WeakPolarHBondContact O-CB 3.43Å; L959-T962 PolarHBondContact O-N 3.34Å; L959-T962 PolarHBondContact O-OG1 3.36Å; R960-T962 VanDerWaalsContact C-N 3.26Å; R960-T962 PolarHBondContact O-N 3.03Å; T962-K966 HydrophobicContact CG2-CB 4.21Å; T962-A967 HydrophobicContact CG2-CB 4.17Å; T962-R1076 PolarHBondContact O-NH1 2.92Å; T962-R1076 PolarHBondContact O-NH2 3.03Å
963	P	91.6	Very high	89.4	Confident	58 Å²	58	65.5 Å²	65.5	38%	0.377	33%	0.334	S	S	.	.			trans	-54.1	144.3	173	-25.1	35	0	0	0	111.9	S961 D965 K966 A967	S961-P963 WeakPolarHBondContact O-CD 3.45Å; P963-D965 VanDerWaalsContact C-N 3.33Å; P963-D965 WeakPolarHBondContact CB-OD1 3.42Å; P963-D965 PolarHBondContact O-N 3.43Å; P963-K966 HydrophobicContact CB-CB 4.46Å; P963-K966 HydrophobicContact CB-CG 4.3Å; P963-K966 HydrophobicContact CG-CD 4.18Å; P963-K966 HydrophobicContact CG-CG 4.47Å; P963-K966 PolarHBondContact O-N 2.82Å; P963-A967 PolarHBondContact O-N 2.95Å
964	V	93.1	Very high	89.8	Confident	8 Å²	8	63.5 Å²	63.5	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-40.3	-175	175.2	0	0	0	0	111.6	L955 K966 A967 M968 R1076 K1079 I1083	L955-V964 HydrophobicContact CD1-CG1 4.05Å; V964-K966 VanDerWaalsContact C-N 3.32Å; V964-K966 PolarHBondContact O-N 3.37Å; V964-A967 PolarHBondContact O-N 3.39Å; V964-A967 VanDerWaalsContact O-N 3.16Å; V964-M968 HydrophobicContact CG1-CG 4.36Å; V964-M968 HydrophobicContact CG1-SD 4.1Å; V964-M968 VanDerWaalsContact O-CG 3.32Å; V964-M968 WeakPolarHBondContact O-CG 3.43Å; V964-M968 PolarHBondContact O-N 2.99Å; V964-R1076 HydrophobicContact CG2-CB 4.25Å; V964-R1076 HydrophobicContact CG2-CG 4.07Å; V964-K1079 HydrophobicContact CB-CD 4.1Å; V964-K1079 HydrophobicContact CB-CG 4.24Å; V964-K1079 HydrophobicContact CG1-CB 4.31Å; V964-K1079 HydrophobicContact CG1-CG 4.23Å; V964-K1079 HydrophobicContact CG2-CB 4.3Å; V964-K1079 HydrophobicContact CG2-CD 3.89Å; V964-K1079 HydrophobicContact CG2-CG 4.28Å; V964-I1083 HydrophobicContact CB-CD1 4.47Å; V964-I1083 HydrophobicContact CG1-CD1 3.99Å
965	D	91.2	Very high	90.2	Very high	91 Å²	91	59 Å²	59	49%	0.487	30%	0.304	S	S	.	.	H	α-helix	trans	-56.8	-42.9	174.2	55.1	-60.9	0	0	0	112.3	P963 M968 H969 I1083	P963-D965 VanDerWaalsContact C-N 3.33Å; P963-D965 WeakPolarHBondContact CB-OD1 3.42Å; P963-D965 PolarHBondContact O-N 3.43Å; D965-M968 PolarHBondContact O-N 2.95Å; D965-H969 PolarHBondContact O-N 3.01Å; D965-I1083 HydrophobicContact CB-CD1 4.34Å
966	K	91.6	Very high	90.4	Very high	144 Å²	144	61 Å²	61	63%	0.626	32%	0.315	S	S	*	.	H	α-helix	trans	-69.3	-38.4	175.5	-67.4	-170.1	179.7	-178.6	0	112.3	T962 P963 V964 M968 H969	T962-K966 HydrophobicContact CG2-CB 4.21Å; P963-K966 HydrophobicContact CB-CB 4.46Å; P963-K966 HydrophobicContact CB-CG 4.3Å; P963-K966 HydrophobicContact CG-CD 4.18Å; P963-K966 HydrophobicContact CG-CG 4.47Å; P963-K966 PolarHBondContact O-N 2.82Å; V964-K966 VanDerWaalsContact C-N 3.32Å; V964-K966 PolarHBondContact O-N 3.37Å; K966-M968 PolarHBondContact O-N 2.91Å; K966-H969 WeakPolarHBondContact O-CB 3.45Å; K966-H969 PolarHBondContact O-N 3.01Å
967	A	91.7	Very high	90.7	Very high	18 Å²	18	63.2 Å²	63.2	15%	0.149	33%	0.33	C	S	.	.	H	α-helix	trans	-69.2	-23.2	178.2	0	0	0	0	0	113.1	L955 T962 P963 V964	L955-A967 HydrophobicContact CD1-CB 3.78Å; T962-A967 HydrophobicContact CG2-CB 4.17Å; P963-A967 PolarHBondContact O-N 2.95Å; V964-A967 PolarHBondContact O-N 3.39Å; V964-A967 VanDerWaalsContact O-N 3.16Å
968	M	93	Very high	91.2	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.015	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.2	175.4	-69.6	-179.3	77.7	0	0	114	L955 V964 D965 K966 D970 L971 I972 S1080 I1083 L1084	L955-M968 HydrophobicContact CD1-CG 4.14Å; L955-M968 HydrophobicContact CD2-CG 4.39Å; V964-M968 HydrophobicContact CG1-CG 4.36Å; V964-M968 HydrophobicContact CG1-SD 4.1Å; V964-M968 VanDerWaalsContact O-CG 3.32Å; V964-M968 WeakPolarHBondContact O-CG 3.43Å; V964-M968 PolarHBondContact O-N 2.99Å; D965-M968 PolarHBondContact O-N 2.95Å; K966-M968 PolarHBondContact O-N 2.91Å; M968-D970 VanDerWaalsContact C-N 3.3Å; M968-D970 PolarHBondContact O-N 2.79Å; M968-L971 HydrophobicContact CE-CD2 4.4Å; M968-L971 WeakPolarHBondContact O-CB 3.34Å; M968-L971 PolarHBondContact O-N 2.82Å; M968-I972 HydrophobicContact CB-CG1 4.29Å; M968-I972 HydrophobicContact CE-CD1 4.28Å; M968-I972 WeakPolarHBondContact O-CG1 3.31Å; M968-I972 PolarHBondContact O-N 3.31Å; M968-S1080 WeakPolarHBondContact CE-O 3.3Å; M968-S1080 WeakPolarHBondContact SD-CA 3.37Å; M968-S1080 WeakPolarHBondContact SD-CB 3.41Å; M968-I1083 HydrophobicContact CE-CB 4.28Å; M968-I1083 HydrophobicContact CE-CG2 4.18Å; M968-I1083 HydrophobicContact SD-CB 3.89Å; M968-I1083 HydrophobicContact SD-CD1 3.95Å; M968-I1083 HydrophobicContact SD-CG2 3.93Å; M968-L1084 HydrophobicContact CE-CB 4.2Å; M968-L1084 HydrophobicContact CE-CD1 4.36Å
969	H	93.5	Very high	91.6	Very high	110 Å²	110	55.4 Å²	55.4	51%	0.509	30%	0.296	S	S	.	.	H	α-helix	trans	-52.2	-49	-170	-179	64.1	0	0	0	112.2	D965 K966 L971 I972 V973	D965-H969 PolarHBondContact O-N 3.01Å; K966-H969 WeakPolarHBondContact O-CB 3.45Å; K966-H969 PolarHBondContact O-N 3.01Å; H969-L971 PolarHBondContact O-N 3.5Å; H969-I972 PolarHBondContact O-N 3.45Å; H969-V973 WeakPolarHBondContact O-CB 3.37Å; H969-V973 VanDerWaalsContact O-CG2 3.29Å; H969-V973 WeakPolarHBondContact O-CG2 3.47Å; H969-V973 PolarHBondContact O-N 2.73Å
970	D	93.1	Very high	91.9	Very high	104 Å²	104	56.6 Å²	56.6	56%	0.556	29%	0.292	S	S	*	.	H	α-helix	trans	-64.6	-38	-178.4	-61.6	-16.5	0	0	0	112.3	N951 M968 Y974	N951-D970 WeakPolarHBondContact OD1-CB 3.39Å; M968-D970 VanDerWaalsContact C-N 3.3Å; M968-D970 PolarHBondContact O-N 2.79Å; D970-Y974 VanDerWaalsContact O-CB 3.28Å; D970-Y974 WeakPolarHBondContact O-CB 3.3Å; D970-Y974 PolarHBondContact O-N 3.29Å
971	L	95.1	Very high	92.5	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-47.4	173.8	-176.8	55.9	0	0	0	111.3	I948 N951 V952 M968 H969 Y974 L975 L1084	I948-L971 HydrophobicContact CG1-CD1 4.48Å; I948-L971 HydrophobicContact CG2-CD1 4.38Å; N951-L971 HydrophobicContact CB-CB 3.84Å; N951-L971 HydrophobicContact CB-CD1 3.97Å; N951-L971 HydrophobicContact CB-CG 4.35Å; N951-L971 PolarHBondContact OD1-N 2.67Å; V952-L971 HydrophobicContact CG2-CD2 4.44Å; M968-L971 HydrophobicContact CE-CD2 4.4Å; M968-L971 WeakPolarHBondContact O-CB 3.34Å; M968-L971 PolarHBondContact O-N 2.82Å; H969-L971 PolarHBondContact O-N 3.5Å; L971-Y974 PolarHBondContact O-N 3.48Å; L971-L975 HydrophobicContact CD1-CD1 3.95Å; L971-L975 HydrophobicContact CD1-CG 4.07Å; L971-L975 HydrophobicContact CG-CD1 3.96Å; L971-L975 HydrophobicContact CG-CG 4.43Å; L971-L975 WeakPolarHBondContact O-CB 3.47Å; L971-L975 VanDerWaalsContact O-CG 3.3Å; L971-L975 WeakPolarHBondContact O-CG 3.49Å; L971-L975 PolarHBondContact O-N 3.48Å; L971-L1084 HydrophobicContact CD2-CD1 4.5Å
972	I	95.4	Very high	92.8	Very high	40 Å²	40	47 Å²	47	21%	0.205	24%	0.243	C	C	.	.	H	α-helix	trans	-66.8	-42.8	-177.4	-66.2	-65	0	0	0	110.2	M968 H969 Y974 L975 D976 L1084 F1087	M968-I972 HydrophobicContact CB-CG1 4.29Å; M968-I972 HydrophobicContact CE-CD1 4.28Å; M968-I972 WeakPolarHBondContact O-CG1 3.31Å; M968-I972 PolarHBondContact O-N 3.31Å; H969-I972 PolarHBondContact O-N 3.45Å; I972-Y974 VanDerWaalsContact C-N 3.33Å; I972-Y974 PolarHBondContact O-N 2.93Å; I972-L975 PolarHBondContact O-N 3.42Å; I972-D976 WeakPolarHBondContact O-CB 3.33Å; I972-D976 PolarHBondContact O-N 3.39Å; I972-L1084 HydrophobicContact CD1-CD1 4.24Å; I972-F1087 HydrophobicContact CD1-CB 3.98Å; I972-F1087 HydrophobicContact CD1-CD1 4.31Å; I972-F1087 HydrophobicContact CD1-CD2 3.89Å; I972-F1087 HydrophobicContact CD1-CE2 4.48Å; I972-F1087 HydrophobicContact CD1-CG 3.79Å; I972-F1087 HydrophobicContact CG2-CD2 3.91Å; I972-F1087 HydrophobicContact CG2-CE2 3.93Å
973	V	94.2	Very high	92.7	Very high	76 Å²	76	47.7 Å²	47.7	46%	0.461	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-44.1	175.8	170.3	0	0	0	0	110.8	H969 D976 S977	H969-V973 WeakPolarHBondContact O-CB 3.37Å; H969-V973 VanDerWaalsContact O-CG2 3.29Å; H969-V973 WeakPolarHBondContact O-CG2 3.47Å; H969-V973 PolarHBondContact O-N 2.73Å; V973-D976 PolarHBondContact O-N 2.76Å; V973-S977 WeakPolarHBondContact O-CB 3.2Å; V973-S977 PolarHBondContact O-N 3.33Å
974	Y	94.9	Very high	92.5	Very high	9 Å²	9	49.6 Å²	49.6	4%	0.035	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-50.8	177.4	175.4	-121.8	0	0	0	112.5	Q815 F816 D817 M944 E947 I948 D970 L971 I972 D976 S977 N978	Q815-Y974 HydrophobicContact CG-CD2 4.05Å; Q815-Y974 HydrophobicContact CG-CE2 3.68Å; F816-Y974 WeakPolarHBondContact O-CE2 3.39Å; F816-Y974 PolarHBondContact O-OH 3.25Å; D817-Y974 WeakPolarHBondContact OD1-CE2 3.37Å; M944-Y974 HydrophobicContact CB-CE1 4.42Å; M944-Y974 HydrophobicContact CE-CE1 3.95Å; E947-Y974 HydrophobicContact CB-CD1 4.36Å; E947-Y974 HydrophobicContact CB-CE1 3.89Å; I948-Y974 HydrophobicContact CG1-CE1 4.19Å; D970-Y974 VanDerWaalsContact O-CB 3.28Å; D970-Y974 WeakPolarHBondContact O-CB 3.3Å; D970-Y974 PolarHBondContact O-N 3.29Å; L971-Y974 PolarHBondContact O-N 3.48Å; I972-Y974 VanDerWaalsContact C-N 3.33Å; I972-Y974 PolarHBondContact O-N 2.93Å; Y974-D976 VanDerWaalsContact C-N 3.35Å; Y974-D976 PolarHBondContact O-N 3.26Å; Y974-S977 PolarHBondContact O-N 2.97Å; Y974-N978 WeakPolarHBondContact CD2-ND2 3.37Å; Y974-N978 WeakPolarHBondContact CE2-ND2 3.38Å; Y974-N978 PolarHBondContact O-N 3.26Å; Y974-N978 VanDerWaalsContact O-N 3.17Å; Y974-N978 PolarHBondContact O-ND2 3.48Å
975	L	95.6	Very high	92.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-40.5	178.8	-68.4	175.9	0	0	0	111.5	M944 I948 L971 I972 N978 I979 I998 L1084 F1087 F1088	M944-L975 HydrophobicContact CE-CD2 4.23Å; I948-L975 HydrophobicContact CD1-CD2 4.48Å; L971-L975 HydrophobicContact CD1-CD1 3.95Å; L971-L975 HydrophobicContact CD1-CG 4.07Å; L971-L975 HydrophobicContact CG-CD1 3.96Å; L971-L975 HydrophobicContact CG-CG 4.43Å; L971-L975 WeakPolarHBondContact O-CB 3.47Å; L971-L975 VanDerWaalsContact O-CG 3.3Å; L971-L975 WeakPolarHBondContact O-CG 3.49Å; L971-L975 PolarHBondContact O-N 3.48Å; I972-L975 PolarHBondContact O-N 3.42Å; L975-N978 PolarHBondContact O-N 2.71Å; L975-I979 VanDerWaalsContact O-CB 3.3Å; L975-I979 WeakPolarHBondContact O-CB 3.17Å; L975-I979 VanDerWaalsContact O-CG1 3.23Å; L975-I979 WeakPolarHBondContact O-CG1 3.33Å; L975-I979 PolarHBondContact O-N 2.99Å; L975-I998 HydrophobicContact CD2-CG2 3.78Å; L975-L1084 HydrophobicContact CD1-CD1 3.74Å; L975-F1087 HydrophobicContact CB-CE1 3.69Å; L975-F1087 HydrophobicContact CB-CZ 3.69Å; L975-F1087 HydrophobicContact CD1-CE1 4.15Å; L975-F1088 HydrophobicContact CD1-CE2 4.25Å; L975-F1088 HydrophobicContact CD1-CZ 4.31Å
976	D	94.2	Very high	92.1	Very high	43 Å²	43	46.8 Å²	46.8	23%	0.23	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-44.1	179.2	-168.4	68.8	0	0	0	111.5	I972 V973 Y974 N978 I979 R980 F1087	I972-D976 WeakPolarHBondContact O-CB 3.33Å; I972-D976 PolarHBondContact O-N 3.39Å; V973-D976 PolarHBondContact O-N 2.76Å; Y974-D976 VanDerWaalsContact C-N 3.35Å; Y974-D976 PolarHBondContact O-N 3.26Å; D976-N978 PolarHBondContact O-N 2.75Å; D976-I979 PolarHBondContact O-N 3.25Å; D976-R980 WeakPolarHBondContact O-CB 3.25Å; D976-R980 PolarHBondContact O-N 3.06Å; D976-R980 IonicContact OD2-CZ 2.74Å; D976-R980 IonicContact OD2-NE 2.71Å; D976-R980 IonicContact OD2-NH2 3.56Å; D976-R980 PolarHBondContact OD2-NH2 3.39Å; D976-F1087 HydrophobicContact CB-CE2 4.03Å; D976-F1087 HydrophobicContact CB-CZ 4.22Å
977	S	92.4	Very high	91.8	Very high	52 Å²	52	40.2 Å²	40.2	36%	0.364	21%	0.211	S	C	.	.	H	α-helix	trans	-55.7	-52.3	175.1	-174.8	0	0	0	0	111.1	V973 Y974 R980 T981	V973-S977 WeakPolarHBondContact O-CB 3.2Å; V973-S977 PolarHBondContact O-N 3.33Å; Y974-S977 PolarHBondContact O-N 2.97Å; S977-R980 PolarHBondContact O-N 2.94Å; S977-T981 PolarHBondContact O-N 3.01Å; S977-T981 PolarHBondContact O-OG1 3.37Å
978	N	93.5	Very high	91.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-66.5	-43.2	-177.6	-79.8	-79.8	0	0	0	113	D817 I818 M944 Y974 L975 D976 R980 T981 L982	D817-N978 WeakPolarHBondContact CA-OD1 3.5Å; D817-N978 PolarHBondContact OD1-ND2 3.44Å; I818-N978 WeakPolarHBondContact CB-OD1 3.43Å; I818-N978 HydrophobicContact CD1-CB 3.95Å; I818-N978 HydrophobicContact CG1-CB 4.32Å; I818-N978 VanDerWaalsContact CG1-OD1 3.3Å; I818-N978 WeakPolarHBondContact CG1-OD1 3.34Å; I818-N978 PolarHBondContact N-OD1 2.81Å; M944-N978 HydrophobicContact CE-CB 3.9Å; Y974-N978 WeakPolarHBondContact CD2-ND2 3.37Å; Y974-N978 WeakPolarHBondContact CE2-ND2 3.38Å; Y974-N978 PolarHBondContact O-N 3.26Å; Y974-N978 VanDerWaalsContact O-N 3.17Å; Y974-N978 PolarHBondContact O-ND2 3.48Å; L975-N978 PolarHBondContact O-N 2.71Å; D976-N978 PolarHBondContact O-N 2.75Å; N978-R980 VanDerWaalsContact C-N 3.33Å; N978-T981 PolarHBondContact O-N 3.13Å; N978-L982 WeakPolarHBondContact O-CG 3.41Å; N978-L982 PolarHBondContact O-N 3.48Å
979	I	93.2	Very high	90.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.2	-37.5	176.4	-70.2	171	0	0	0	110.7	L975 D976 T981 L982 K983 I995 F1087 F1088 N1091	L975-I979 VanDerWaalsContact O-CB 3.3Å; L975-I979 WeakPolarHBondContact O-CB 3.17Å; L975-I979 VanDerWaalsContact O-CG1 3.23Å; L975-I979 WeakPolarHBondContact O-CG1 3.33Å; L975-I979 PolarHBondContact O-N 2.99Å; D976-I979 PolarHBondContact O-N 3.25Å; I979-T981 VanDerWaalsContact C-N 3.33Å; I979-T981 PolarHBondContact O-N 2.92Å; I979-L982 WeakPolarHBondContact O-CB 3Å; I979-L982 PolarHBondContact O-N 3.4Å; I979-K983 HydrophobicContact CG2-CD 4.3Å; I979-K983 HydrophobicContact CG2-CG 4.21Å; I979-K983 WeakPolarHBondContact O-CB 3.19Å; I979-K983 WeakPolarHBondContact O-CG 3.38Å; I979-K983 PolarHBondContact O-N 3.47Å; I979-I995 HydrophobicContact CG2-CD1 4.45Å; I979-F1087 HydrophobicContact CD1-CE1 3.67Å; I979-F1087 HydrophobicContact CD1-CZ 3.93Å; I979-F1088 HydrophobicContact CD1-CD1 4.36Å; I979-F1088 HydrophobicContact CD1-CE1 3.86Å; I979-F1088 HydrophobicContact CD1-CZ 4.45Å; I979-N1091 HydrophobicContact CG2-CB 4.12Å
980	R	90.5	Very high	90.6	Very high	152 Å²	152	39.1 Å²	39.1	57%	0.574	21%	0.208	S	C	*	.	H	α-helix	trans	-63.8	-39.8	176.3	-170	-178.3	-59.7	-168.8	2.4	111.8	D976 S977 N978 K983 T984	D976-R980 WeakPolarHBondContact O-CB 3.25Å; D976-R980 PolarHBondContact O-N 3.06Å; D976-R980 IonicContact OD2-CZ 2.74Å; D976-R980 IonicContact OD2-NE 2.71Å; D976-R980 IonicContact OD2-NH2 3.56Å; D976-R980 PolarHBondContact OD2-NH2 3.39Å; S977-R980 PolarHBondContact O-N 2.94Å; N978-R980 VanDerWaalsContact C-N 3.33Å; R980-K983 PolarHBondContact O-N 2.94Å; R980-T984 WeakPolarHBondContact O-CB 3.4Å; R980-T984 PolarHBondContact O-N 3.39Å; R980-T984 PolarHBondContact O-OG1 3.46Å
981	T	90.6	Very high	90.4	Very high	32 Å²	32	35.1 Å²	35.1	20%	0.196	19%	0.186	C	C	.	.	H	α-helix	trans	-62.3	-44.1	173.2	-55.6	0	0	0	0	111.3	I818 S977 N978 I979 T984 N985	I818-T981 VanDerWaalsContact O-CG2 3.26Å; I818-T981 WeakPolarHBondContact O-CG2 3.3Å; S977-T981 PolarHBondContact O-N 3.01Å; S977-T981 PolarHBondContact O-OG1 3.37Å; N978-T981 PolarHBondContact O-N 3.13Å; I979-T981 VanDerWaalsContact C-N 3.33Å; I979-T981 PolarHBondContact O-N 2.92Å; T981-T984 PolarHBondContact O-N 3.07Å; T981-N985 WeakPolarHBondContact CG2-ND2 3.15Å; T981-N985 WeakPolarHBondContact O-CB 3.1Å; T981-N985 PolarHBondContact O-N 2.96Å; T981-N985 VanDerWaalsContact O-N 3.09Å; T981-N985 PolarHBondContact O-ND2 3.16Å
982	L	91.2	Very high	90.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-48.8	174.5	-70.2	171.3	0	0	0	111.9	I818 N978 I979 T984 N985 V986 L991 C994 I998	I818-L982 HydrophobicContact CD1-CD1 3.66Å; I818-L982 HydrophobicContact CD1-CD2 4.15Å; I818-L982 HydrophobicContact CD1-CG 3.82Å; I818-L982 HydrophobicContact CG2-CD2 3.9Å; I818-L982 HydrophobicContact CG2-CG 4.24Å; N978-L982 WeakPolarHBondContact O-CG 3.41Å; N978-L982 PolarHBondContact O-N 3.48Å; I979-L982 WeakPolarHBondContact O-CB 3Å; I979-L982 PolarHBondContact O-N 3.4Å; L982-T984 PolarHBondContact O-N 3.25Å; L982-N985 PolarHBondContact O-N 2.87Å; L982-V986 HydrophobicContact CB-CG2 4.48Å; L982-V986 HydrophobicContact CD2-CG2 3.75Å; L982-V986 WeakPolarHBondContact O-CA 3.32Å; L982-V986 WeakPolarHBondContact O-CB 3.39Å; L982-V986 PolarHBondContact O-N 3.12Å; L982-L991 HydrophobicContact CB-CD1 3.79Å; L982-C994 HydrophobicContact CD1-CB 3.81Å; L982-C994 HydrophobicContact CD2-CB 4.41Å; L982-I998 HydrophobicContact CD1-CD1 3.77Å
983	K	87.6	Confident	89.9	Confident	56 Å²	56	39 Å²	39	24%	0.243	20%	0.2	C	C	.	.	H	α-helix	trans	-55.4	-37.1	178.7	-78.4	-172.9	175.1	-155.2	0	112.8	I979 R980 L991 N1091 D1093	I979-K983 HydrophobicContact CG2-CD 4.3Å; I979-K983 HydrophobicContact CG2-CG 4.21Å; I979-K983 WeakPolarHBondContact O-CB 3.19Å; I979-K983 WeakPolarHBondContact O-CG 3.38Å; I979-K983 PolarHBondContact O-N 3.47Å; R980-K983 PolarHBondContact O-N 2.94Å; K983-L991 HydrophobicContact CG-CD1 3.88Å; K983-L991 HydrophobicContact CG-CD2 3.87Å; K983-N1091 WeakPolarHBondContact CE-O 3.45Å; K983-N1091 PolarHBondContact NZ-O 3.03Å; K983-N1091 PolarHBondContact NZ-OD1 3.18Å; K983-D1093 IonicContact NZ-OD1 3.3Å; K983-D1093 PolarHBondContact NZ-OD1 2.99Å; K983-D1093 IonicContact NZ-OD2 3.62Å; K983-D1093 PolarHBondContact NZ-OD2 3.39Å
984	T	86.7	Confident	89.8	Confident	99 Å²	99	35.4 Å²	35.4	61%	0.607	18%	0.178	S	C	*	.	H	α-helix	trans	-76.8	-37.5	-178	-53.7	0	0	0	0	111.7	R980 T981 L982	R980-T984 WeakPolarHBondContact O-CB 3.4Å; R980-T984 PolarHBondContact O-N 3.39Å; R980-T984 PolarHBondContact O-OG1 3.46Å; T981-T984 PolarHBondContact O-N 3.07Å; L982-T984 PolarHBondContact O-N 3.25Å
985	N	88	Confident	89.7	Confident	30 Å²	30	35.1 Å²	35.1	16%	0.16	18%	0.177	C	C	.	.	H	α-helix	trans	-113.8	-2.9	-164.8	-61.8	-61.2	0	0	0	114.6	N820 S823 N827 T981 L982	N820-N985 PolarHBondContact OD1-ND2 3.46Å; S823-N985 VanDerWaalsContact CB-CB 3.49Å; N827-N985 PolarHBondContact ND2-O 3.37Å; T981-N985 WeakPolarHBondContact CG2-ND2 3.15Å; T981-N985 WeakPolarHBondContact O-CB 3.1Å; T981-N985 PolarHBondContact O-N 2.96Å; T981-N985 VanDerWaalsContact O-N 3.09Å; T981-N985 PolarHBondContact O-ND2 3.16Å; L982-N985 PolarHBondContact O-N 2.87Å
986	V	88.8	Confident	89.5	Confident	10 Å²	10	36.7 Å²	36.7	6%	0.061	19%	0.186	C	C	.	.	S	Bend	trans	-122.6	146.6	-173.6	179.4	0	0	0	0	111.4	N827 L982 L990	N827-V986 WeakPolarHBondContact OD1-CA 3.46Å; L982-V986 HydrophobicContact CB-CG2 4.48Å; L982-V986 HydrophobicContact CD2-CG2 3.75Å; L982-V986 WeakPolarHBondContact O-CA 3.32Å; L982-V986 WeakPolarHBondContact O-CB 3.39Å; L982-V986 PolarHBondContact O-N 3.12Å; V986-L990 HydrophobicContact CG1-CB 3.48Å; V986-L990 VanDerWaalsContact CG1-CB 3.48Å; V986-L990 HydrophobicContact CG1-CD2 3.42Å; V986-L990 VanDerWaalsContact CG1-CD2 3.42Å; V986-L990 HydrophobicContact CG1-CG 3.32Å
987	S	85.7	Confident	89.5	Confident	6 Å²	6	36.2 Å²	36.2	4%	0.042	19%	0.185	C	C	.	.			trans	-64.1	154.1	175.4	70.3	0	0	0	0	113.2	N827 N989 L990 L991	N827-S987 PolarHBondContact OD1-N 3.15Å; N827-S987 VanDerWaalsContact OD1-N 3.08Å; S987-N989 PolarHBondContact O-N 2.95Å; S987-L990 PolarHBondContact O-N 3.02Å; S987-L990 VanDerWaalsContact O-N 3.08Å; S987-L990 WeakPolarHBondContact OG-CB 3.44Å; S987-L991 WeakPolarHBondContact O-CB 3.34Å; S987-L991 PolarHBondContact O-N 3.25Å
988	S	81.7	Confident	89.6	Confident	15 Å²	15	33.8 Å²	33.8	11%	0.105	17%	0.168	C	C	.	.	H	α-helix	trans	-53.5	-49.7	-175.3	61.7	0	0	0	0	114.3	E743 L990 L991 H992	E743-S988 PolarHBondContact OE1-OG 3.22Å; E743-S988 VanDerWaalsContact OE2-CB 3.23Å; E743-S988 WeakPolarHBondContact OE2-CB 3.36Å; E743-S988 PolarHBondContact OE2-OG 3.31Å; S988-L990 VanDerWaalsContact C-N 3.29Å; S988-L990 PolarHBondContact O-N 3.09Å; S988-L991 WeakPolarHBondContact O-CB 3.5Å; S988-L991 PolarHBondContact O-N 3.33Å; S988-H992 PolarHBondContact O-N 3.01Å
989	N	80.9	Confident	89.7	Confident	93 Å²	93	33.7 Å²	33.7	50%	0.497	17%	0.168	S	C	.	.	H	α-helix	trans	-61.3	-38.9	179.1	-70	-12.3	0	0	0	112.3	S987 R993	S987-N989 PolarHBondContact O-N 2.95Å; N989-R993 PolarHBondContact O-N 2.99Å
990	L	89.2	Confident	89.8	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-76.7	-35	-179.8	-179.5	59.8	0	0	0	110.9	L826 E830 L933 I937 V986 S987 S988 H992 R993 C994	L826-L990 VanDerWaalsContact C-CD2 3.4Å; L826-L990 HydrophobicContact CB-CD2 3.6Å; L826-L990 WeakPolarHBondContact O-CD2 3.49Å; E830-L990 HydrophobicContact CB-CD2 4.12Å; E830-L990 HydrophobicContact CG-CB 4.45Å; L933-L990 HydrophobicContact CD1-CD1 3.98Å; L933-L990 HydrophobicContact CD2-CD1 4.24Å; I937-L990 HydrophobicContact CD1-CD1 3.98Å; V986-L990 HydrophobicContact CG1-CB 3.48Å; V986-L990 VanDerWaalsContact CG1-CB 3.48Å; V986-L990 HydrophobicContact CG1-CD2 3.42Å; V986-L990 VanDerWaalsContact CG1-CD2 3.42Å; V986-L990 HydrophobicContact CG1-CG 3.32Å; S987-L990 PolarHBondContact O-N 3.02Å; S987-L990 VanDerWaalsContact O-N 3.08Å; S987-L990 WeakPolarHBondContact OG-CB 3.44Å; S988-L990 VanDerWaalsContact C-N 3.29Å; S988-L990 PolarHBondContact O-N 3.09Å; L990-H992 VanDerWaalsContact C-N 3.35Å; L990-H992 PolarHBondContact O-N 2.88Å; L990-R993 WeakPolarHBondContact O-CB 3.29Å; L990-R993 PolarHBondContact O-N 3.38Å; L990-C994 WeakPolarHBondContact O-CB 3.34Å; L990-C994 PolarHBondContact O-N 2.71Å; L990-C994 PolarHBondContact O-SG 2.96Å; L990-C994 VanDerWaalsContact O-SG 3.32Å
991	L	89.9	Confident	90	Very high	20 Å²	20	29.9 Å²	29.9	11%	0.105	16%	0.157	C	C	.	.	H	α-helix	trans	-57	-48.9	171.6	175.7	67.7	0	0	0	110.6	L982 K983 S987 S988 R993 C994 I995	L982-L991 HydrophobicContact CB-CD1 3.79Å; K983-L991 HydrophobicContact CG-CD1 3.88Å; K983-L991 HydrophobicContact CG-CD2 3.87Å; S987-L991 WeakPolarHBondContact O-CB 3.34Å; S987-L991 PolarHBondContact O-N 3.25Å; S988-L991 WeakPolarHBondContact O-CB 3.5Å; S988-L991 PolarHBondContact O-N 3.33Å; L991-R993 VanDerWaalsContact C-N 3.3Å; L991-R993 PolarHBondContact O-N 3.41Å; L991-C994 PolarHBondContact O-N 3.15Å; L991-I995 HydrophobicContact CD1-CD1 3.78Å; L991-I995 HydrophobicContact CD1-CG1 4.09Å; L991-I995 HydrophobicContact CD2-CD1 4.42Å; L991-I995 HydrophobicContact CG-CD1 3.77Å; L991-I995 HydrophobicContact CG-CG1 4.39Å; L991-I995 WeakPolarHBondContact O-CB 3.23Å; L991-I995 VanDerWaalsContact O-CG1 3.3Å; L991-I995 WeakPolarHBondContact O-CG1 3.38Å; L991-I995 PolarHBondContact O-N 3.23Å
992	H	87.7	Confident	90.3	Very high	55 Å²	55	28.4 Å²	28.4	26%	0.255	15%	0.147	S	C	.	.	H	α-helix	trans	-55.7	-46.4	176.3	-174.9	81.5	0	0	0	111.7	S988 L990 I995 L996 I1096	S988-H992 PolarHBondContact O-N 3.01Å; L990-H992 VanDerWaalsContact C-N 3.35Å; L990-H992 PolarHBondContact O-N 2.88Å; H992-I995 PolarHBondContact O-N 3.36Å; H992-L996 VanDerWaalsContact NE2-CD1 3.35Å; H992-L996 WeakPolarHBondContact NE2-CD1 3.24Å; H992-L996 WeakPolarHBondContact O-CG 3.25Å; H992-L996 PolarHBondContact O-N 3.4Å; H992-I1096 WeakPolarHBondContact ND1-CG1 3.18Å
993	R	91.2	Very high	90.6	Very high	71 Å²	71	28.5 Å²	28.5	27%	0.268	15%	0.148	S	C	.	.	H	α-helix	trans	-63	-44.1	178	-172.4	177.8	-66.1	-151.9	6.6	112.5	N934 I937 N989 L990 L991 S997	N934-R993 WeakPolarHBondContact OD1-CD 3.34Å; N934-R993 PolarHBondContact OD1-NH1 3.36Å; I937-R993 HydrophobicContact CD1-CG 3.88Å; N989-R993 PolarHBondContact O-N 2.99Å; L990-R993 WeakPolarHBondContact O-CB 3.29Å; L990-R993 PolarHBondContact O-N 3.38Å; L991-R993 VanDerWaalsContact C-N 3.3Å; L991-R993 PolarHBondContact O-N 3.41Å; R993-S997 VanDerWaalsContact O-CB 3.3Å; R993-S997 WeakPolarHBondContact O-CB 3.39Å; R993-S997 PolarHBondContact O-N 3.35Å; R993-S997 VanDerWaalsContact O-N 3.08Å
994	C	93.1	Very high	90.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.5	-45.6	177.2	-71	0	0	0	0	111.2	L982 L990 L991 S997 I998	L982-C994 HydrophobicContact CD1-CB 3.81Å; L982-C994 HydrophobicContact CD2-CB 4.41Å; L990-C994 WeakPolarHBondContact O-CB 3.34Å; L990-C994 PolarHBondContact O-N 2.71Å; L990-C994 PolarHBondContact O-SG 2.96Å; L990-C994 VanDerWaalsContact O-SG 3.32Å; L991-C994 PolarHBondContact O-N 3.15Å; C994-S997 WeakPolarHBondContact O-CB 3.34Å; C994-S997 PolarHBondContact O-N 2.97Å; C994-I998 VanDerWaalsContact O-CG1 3.29Å; C994-I998 WeakPolarHBondContact O-CG1 3.24Å; C994-I998 PolarHBondContact O-N 3.45Å
995	I	92.3	Very high	91.2	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-48.8	-179.3	-69.3	172.6	0	0	0	111.3	I979 L991 H992 S997 I998 W999 F1088 I1096	I979-I995 HydrophobicContact CG2-CD1 4.45Å; L991-I995 HydrophobicContact CD1-CD1 3.78Å; L991-I995 HydrophobicContact CD1-CG1 4.09Å; L991-I995 HydrophobicContact CD2-CD1 4.42Å; L991-I995 HydrophobicContact CG-CD1 3.77Å; L991-I995 HydrophobicContact CG-CG1 4.39Å; L991-I995 WeakPolarHBondContact O-CB 3.23Å; L991-I995 VanDerWaalsContact O-CG1 3.3Å; L991-I995 WeakPolarHBondContact O-CG1 3.38Å; L991-I995 PolarHBondContact O-N 3.23Å; H992-I995 PolarHBondContact O-N 3.36Å; I995-S997 PolarHBondContact O-N 3.26Å; I995-I998 PolarHBondContact O-N 3.15Å; I995-W999 WeakPolarHBondContact O-CB 3.34Å; I995-W999 PolarHBondContact O-N 3.16Å; I995-F1088 HydrophobicContact CG2-CD1 3.53Å; I995-F1088 HydrophobicContact CG2-CE1 3.92Å; I995-I1096 HydrophobicContact CB-CD1 3.88Å; I995-I1096 HydrophobicContact CD1-CD1 3.96Å; I995-I1096 HydrophobicContact CG2-CD1 3.37Å
996	L	91.6	Very high	91.5	Very high	34 Å²	34	23.9 Å²	23.9	18%	0.178	12%	0.119	C	C	.	.	H	α-helix	trans	-60.3	-38.3	176.8	-71.1	-177.8	0	0	0	111.5	H992 W999 H1000 I1096 L1101	H992-L996 VanDerWaalsContact NE2-CD1 3.35Å; H992-L996 WeakPolarHBondContact NE2-CD1 3.24Å; H992-L996 WeakPolarHBondContact O-CG 3.25Å; H992-L996 PolarHBondContact O-N 3.4Å; L996-W999 WeakPolarHBondContact O-CB 3.33Å; L996-W999 PolarHBondContact O-N 2.94Å; L996-H1000 PolarHBondContact O-CD2 2.96Å; L996-H1000 PolarHBondContact O-N 3.26Å; L996-I1096 HydrophobicContact CD2-CG2 4.44Å; L996-L1101 HydrophobicContact CD2-CD2 3.86Å
997	S	93.8	Very high	91.7	Very high	32 Å²	32	24.7 Å²	24.7	22%	0.224	12%	0.123	C	C	.	.	H	α-helix	trans	-65.6	-42.6	177.9	-156.4	0	0	0	0	112.4	I937 N941 R993 C994 I995 W999 H1000 E1001	I937-S997 WeakPolarHBondContact CG2-OG 3.13Å; N941-S997 WeakPolarHBondContact ND2-CB 3.25Å; N941-S997 PolarHBondContact ND2-O 3.46Å; N941-S997 PolarHBondContact ND2-OG 3Å; R993-S997 VanDerWaalsContact O-CB 3.3Å; R993-S997 WeakPolarHBondContact O-CB 3.39Å; R993-S997 PolarHBondContact O-N 3.35Å; R993-S997 VanDerWaalsContact O-N 3.08Å; C994-S997 WeakPolarHBondContact O-CB 3.34Å; C994-S997 PolarHBondContact O-N 2.97Å; I995-S997 PolarHBondContact O-N 3.26Å; S997-W999 VanDerWaalsContact C-N 3.34Å; S997-H1000 PolarHBondContact O-N 3.41Å; S997-E1001 PolarHBondContact O-N 3.42Å
998	I	94.9	Very high	91.9	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-65.6	-39.1	175.2	-63.8	166.9	0	0	0	110.6	I818 M940 M944 L975 L982 C994 I995 E1001 C1002 F1088	I818-I998 HydrophobicContact CD1-CD1 4.37Å; M940-I998 HydrophobicContact CE-CD1 4.27Å; M940-I998 HydrophobicContact CE-CG1 4.22Å; M944-I998 HydrophobicContact CE-CD1 4.41Å; M944-I998 HydrophobicContact CE-CG2 4.31Å; M944-I998 HydrophobicContact SD-CD1 4.19Å; M944-I998 HydrophobicContact SD-CG1 4.09Å; L975-I998 HydrophobicContact CD2-CG2 3.78Å; L982-I998 HydrophobicContact CD1-CD1 3.77Å; C994-I998 VanDerWaalsContact O-CG1 3.29Å; C994-I998 WeakPolarHBondContact O-CG1 3.24Å; C994-I998 PolarHBondContact O-N 3.45Å; I995-I998 PolarHBondContact O-N 3.15Å; I998-E1001 PolarHBondContact O-N 3.37Å; I998-C1002 PolarHBondContact O-N 2.85Å; I998-C1002 PolarHBondContact O-SG 3.46Å; I998-F1088 HydrophobicContact CG2-CE1 4.32Å; I998-F1088 HydrophobicContact CG2-CZ 4.01Å
999	W	95.4	Very high	92.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.2	-48.9	174	167.9	-114.8	0	0	0	111.6	I995 L996 S997 E1001 C1002 L1003 L1081 L1084 L1085 F1088 L1101 Y1106	I995-W999 WeakPolarHBondContact O-CB 3.34Å; I995-W999 PolarHBondContact O-N 3.16Å; L996-W999 WeakPolarHBondContact O-CB 3.33Å; L996-W999 PolarHBondContact O-N 2.94Å; S997-W999 VanDerWaalsContact C-N 3.34Å; W999-E1001 VanDerWaalsContact C-N 3.32Å; W999-E1001 PolarHBondContact O-N 3.32Å; W999-C1002 WeakPolarHBondContact O-CB 3.47Å; W999-C1002 PolarHBondContact O-N 2.73Å; W999-C1002 VanDerWaalsContact O-N 3.11Å; W999-L1003 HydrophobicContact CD2-CD1 4.22Å; W999-L1003 HydrophobicContact CD2-CG 4.17Å; W999-L1003 HydrophobicContact CG-CD1 4.47Å; W999-L1003 HydrophobicContact CH2-CD2 3.9Å; W999-L1003 HydrophobicContact CZ2-CD1 3.97Å; W999-L1003 HydrophobicContact CZ2-CD2 3.77Å; W999-L1003 HydrophobicContact CZ2-CG 4.1Å; W999-L1003 HydrophobicContact CZ3-CD2 4.34Å; W999-L1003 WeakPolarHBondContact O-CG 3.46Å; W999-L1003 PolarHBondContact O-N 3.03Å; W999-L1081 HydrophobicContact CH2-CD1 4.24Å; W999-L1084 HydrophobicContact CE3-CD2 4.26Å; W999-L1084 HydrophobicContact CE3-CG 4.36Å; W999-L1084 HydrophobicContact CZ3-CB 4.21Å; W999-L1084 HydrophobicContact CZ3-CD2 3.8Å; W999-L1084 HydrophobicContact CZ3-CG 3.81Å; W999-L1085 HydrophobicContact CH2-CB 4.16Å; W999-L1085 HydrophobicContact CH2-CD1 4.24Å; W999-L1085 HydrophobicContact CZ2-CD1 4.23Å; W999-F1088 HydrophobicContact CB-CD1 4.29Å; W999-F1088 HydrophobicContact CB-CE1 4.14Å; W999-F1088 HydrophobicContact CB-CZ 4.28Å; W999-F1088 HydrophobicContact CD2-CD2 4.33Å; W999-F1088 AromaticContact CE3-CD2 3.38Å; W999-F1088 HydrophobicContact CE3-CD2 3.38Å; W999-F1088 AromaticContact CE3-CE2 3.66Å; W999-F1088 HydrophobicContact CE3-CE2 3.66Å; W999-F1088 HydrophobicContact CE3-CG 4.05Å; W999-F1088 HydrophobicContact CE3-CZ 4.49Å; W999-F1088 AromaticContact CZ3-CD2 3.88Å; W999-F1088 HydrophobicContact CZ3-CD2 3.88Å; W999-F1088 HydrophobicContact CZ3-CE2 4.34Å; W999-L1101 HydrophobicContact CB-CD2 4.23Å; W999-L1101 HydrophobicContact CD2-CD2 4.09Å; W999-L1101 HydrophobicContact CG-CD2 3.76Å; W999-L1101 HydrophobicContact CZ2-CB 4.42Å; W999-L1101 WeakPolarHBondContact CZ2-O 3.17Å; W999-L1101 PolarHBondContact NE1-O 2.65Å; W999-Y1106 AromaticContact CH2-CD2 3.66Å; W999-Y1106 HydrophobicContact CH2-CD2 3.66Å; W999-Y1106 HydrophobicContact CH2-CE2 4.08Å; W999-Y1106 AromaticContact CZ2-CD2 3.43Å; W999-Y1106 HydrophobicContact CZ2-CD2 3.43Å; W999-Y1106 VanDerWaalsContact CZ2-CD2 3.43Å; W999-Y1106 HydrophobicContact CZ2-CE2 4.19Å; W999-Y1106 HydrophobicContact CZ2-CG 4.02Å
1000	H	94.7	Very high	92.6	Very high	66 Å²	66	22.3 Å²	22.3	31%	0.306	11%	0.106	S	C	.	.	H	α-helix	trans	-60	-39.9	175.5	-75.7	-64.8	0	0	0	112.7	L996 S997 C1002 L1003 E1004 E1105	L996-H1000 PolarHBondContact O-CD2 2.96Å; L996-H1000 PolarHBondContact O-N 3.26Å; S997-H1000 PolarHBondContact O-N 3.41Å; H1000-C1002 VanDerWaalsContact C-N 3.31Å; H1000-C1002 PolarHBondContact O-N 3.33Å; H1000-L1003 PolarHBondContact O-N 3.33Å; H1000-E1004 PolarHBondContact O-N 3.38Å; H1000-E1105 IonicContact CE1-OE2 2.87Å; H1000-E1105 PolarHBondContact CE1-OE2 3.07Å; H1000-E1105 IonicContact ND1-OE2 2.86Å
1001	E	95.8	Very high	92.5	Very high	6 Å²	6	24 Å²	24	3%	0.028	12%	0.115	C	C	.	.	H	α-helix	trans	-62.5	-39.3	175.1	-176.5	64.1	-132.4	0	0	111.4	N941 R945 I948 S997 I998 W999 E1004 Q1005	N941-E1001 HydrophobicContact CB-CB 4.15Å; N941-E1001 HydrophobicContact CB-CG 4.1Å; R945-E1001 WeakPolarHBondContact CB-OE1 3.49Å; R945-E1001 WeakPolarHBondContact CD-OE1 3.35Å; R945-E1001 WeakPolarHBondContact CG-OE1 3.48Å; R945-E1001 IonicContact CZ-OE1 2.73Å; R945-E1001 VanDerWaalsContact CZ-OE1 3.22Å; R945-E1001 IonicContact CZ-OE2 3.22Å; R945-E1001 IonicContact NE-OE1 2.93Å; R945-E1001 PolarHBondContact NE-OE1 2.97Å; R945-E1001 IonicContact NE-OE2 3.28Å; R945-E1001 PolarHBondContact NE-OE2 3.26Å; R945-E1001 IonicContact NH2-OE1 2.92Å; R945-E1001 PolarHBondContact NH2-OE1 3.49Å; R945-E1001 IonicContact NH2-OE2 2.75Å; R945-E1001 PolarHBondContact NH2-OE2 2.94Å; I948-E1001 HydrophobicContact CD1-CG 3.93Å; S997-E1001 PolarHBondContact O-N 3.42Å; I998-E1001 PolarHBondContact O-N 3.37Å; W999-E1001 VanDerWaalsContact C-N 3.32Å; W999-E1001 PolarHBondContact O-N 3.32Å; E1001-E1004 PolarHBondContact O-N 3.32Å; E1001-Q1005 WeakPolarHBondContact O-CG 3.25Å; E1001-Q1005 PolarHBondContact O-N 3.42Å; E1001-Q1005 VanDerWaalsContact O-N 3.17Å; E1001-Q1005 PolarHBondContact OE1-NE2 3.34Å
1002	C	96.5	Very high	92.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.8	-45.1	173.1	-63.3	0	0	0	0	111.6	I998 W999 H1000 E1004 Q1005 Y1006 L1084	I998-C1002 PolarHBondContact O-N 2.85Å; I998-C1002 PolarHBondContact O-SG 3.46Å; W999-C1002 WeakPolarHBondContact O-CB 3.47Å; W999-C1002 PolarHBondContact O-N 2.73Å; W999-C1002 VanDerWaalsContact O-N 3.11Å; H1000-C1002 VanDerWaalsContact C-N 3.31Å; H1000-C1002 PolarHBondContact O-N 3.33Å; C1002-E1004 VanDerWaalsContact C-N 3.31Å; C1002-E1004 PolarHBondContact O-N 2.91Å; C1002-Q1005 PolarHBondContact O-N 3.48Å; C1002-Y1006 VanDerWaalsContact O-CD2 3.24Å; C1002-Y1006 WeakPolarHBondContact O-CD2 3.29Å; C1002-Y1006 PolarHBondContact O-N 3.3Å; C1002-L1084 HydrophobicContact CB-CD2 3.72Å
1003	L	96.3	Very high	92	Very high	2 Å²	2	23 Å²	23	1%	0.01	11%	0.109	C	C	.	.	H	α-helix	trans	-61.4	-39	177.5	-67.2	178.7	0	0	0	112.3	W999 H1000 Q1005 Y1006 M1007 L1081 E1105 Y1106	W999-L1003 HydrophobicContact CD2-CD1 4.22Å; W999-L1003 HydrophobicContact CD2-CG 4.17Å; W999-L1003 HydrophobicContact CG-CD1 4.47Å; W999-L1003 HydrophobicContact CH2-CD2 3.9Å; W999-L1003 HydrophobicContact CZ2-CD1 3.97Å; W999-L1003 HydrophobicContact CZ2-CD2 3.77Å; W999-L1003 HydrophobicContact CZ2-CG 4.1Å; W999-L1003 HydrophobicContact CZ3-CD2 4.34Å; W999-L1003 WeakPolarHBondContact O-CG 3.46Å; W999-L1003 PolarHBondContact O-N 3.03Å; H1000-L1003 PolarHBondContact O-N 3.33Å; L1003-Q1005 VanDerWaalsContact C-N 3.34Å; L1003-Q1005 PolarHBondContact O-N 2.93Å; L1003-Y1006 PolarHBondContact O-N 2.74Å; L1003-M1007 WeakPolarHBondContact O-CB 3.47Å; L1003-M1007 PolarHBondContact O-N 3.44Å; L1003-L1081 HydrophobicContact CD2-CD1 3.68Å; L1003-E1105 HydrophobicContact CB-CB 4.44Å; L1003-E1105 HydrophobicContact CD1-CB 3.98Å; L1003-Y1106 HydrophobicContact CD2-CD2 4.14Å
1004	E	94.2	Very high	91.6	Very high	86 Å²	86	19.7 Å²	19.7	40%	0.402	10%	0.097	S	C	.	.	H	α-helix	trans	-59.2	-45.5	174.5	-167.3	-175.8	157.8	0	0	110.7	R945 H1000 E1001 C1002 Y1006 M1007 E1008	R945-E1004 IonicContact CZ-OE1 3.34Å; R945-E1004 IonicContact CZ-OE2 3.72Å; R945-E1004 IonicContact NH1-OE1 3.64Å; R945-E1004 PolarHBondContact NH1-OE1 3.49Å; R945-E1004 IonicContact NH1-OE2 3.39Å; R945-E1004 IonicContact NH2-OE1 2.71Å; R945-E1004 PolarHBondContact NH2-OE1 3.08Å; R945-E1004 IonicContact NH2-OE2 3.19Å; R945-E1004 PolarHBondContact NH2-OE2 3.49Å; H1000-E1004 PolarHBondContact O-N 3.38Å; E1001-E1004 PolarHBondContact O-N 3.32Å; C1002-E1004 VanDerWaalsContact C-N 3.31Å; C1002-E1004 PolarHBondContact O-N 2.91Å; E1004-Y1006 PolarHBondContact O-N 3.07Å; E1004-M1007 PolarHBondContact O-N 3.17Å; E1004-E1008 WeakPolarHBondContact O-CB 3.37Å; E1004-E1008 PolarHBondContact O-N 2.98Å
1005	Q	94.2	Very high	91	Very high	3 Å²	3	20.5 Å²	20.5	1%	0.014	10%	0.101	C	C	.	.	H	α-helix	trans	-67.7	-35.4	177.5	-59.7	-40.2	-65.4	0	0	112.6	I948 R949 V952 E1001 C1002 L1003 E1008 Q1009	I948-Q1005 HydrophobicContact CB-CG 4.32Å; I948-Q1005 HydrophobicContact CG2-CB 4.09Å; I948-Q1005 HydrophobicContact CG2-CG 3.73Å; R949-Q1005 HydrophobicContact CB-CG 4.36Å; V952-Q1005 HydrophobicContact CG2-CB 4.36Å; E1001-Q1005 WeakPolarHBondContact O-CG 3.25Å; E1001-Q1005 PolarHBondContact O-N 3.42Å; E1001-Q1005 VanDerWaalsContact O-N 3.17Å; E1001-Q1005 PolarHBondContact OE1-NE2 3.34Å; C1002-Q1005 PolarHBondContact O-N 3.48Å; L1003-Q1005 VanDerWaalsContact C-N 3.34Å; L1003-Q1005 PolarHBondContact O-N 2.93Å; Q1005-E1008 PolarHBondContact OE1-OE2 3.08Å; Q1005-Q1009 WeakPolarHBondContact O-CB 3.38Å; Q1005-Q1009 PolarHBondContact O-N 3Å
1006	Y	94.7	Very high	90	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-67.4	-40.6	174.3	-92.3	-113.4	0	0	0	112.2	V952 C1002 L1003 E1004 Q1009 T1010 L1077 S1080 L1081 L1084	V952-Y1006 HydrophobicContact CG1-CD2 4.41Å; V952-Y1006 HydrophobicContact CG2-CD2 3.86Å; V952-Y1006 HydrophobicContact CG2-CE2 3.63Å; C1002-Y1006 VanDerWaalsContact O-CD2 3.24Å; C1002-Y1006 WeakPolarHBondContact O-CD2 3.29Å; C1002-Y1006 PolarHBondContact O-N 3.3Å; L1003-Y1006 PolarHBondContact O-N 2.74Å; E1004-Y1006 PolarHBondContact O-N 3.07Å; Y1006-Q1009 PolarHBondContact O-N 3.11Å; Y1006-T1010 VanDerWaalsContact O-CB 3.26Å; Y1006-T1010 WeakPolarHBondContact O-CB 3.32Å; Y1006-T1010 PolarHBondContact O-N 2.9Å; Y1006-T1010 PolarHBondContact O-OG1 3.24Å; Y1006-L1077 HydrophobicContact CD1-CD2 4.09Å; Y1006-L1077 HydrophobicContact CE1-CD2 4.08Å; Y1006-S1080 WeakPolarHBondContact CE1-OG 3Å; Y1006-S1080 VanDerWaalsContact OH-CB 3.25Å; Y1006-S1080 WeakPolarHBondContact OH-CB 3.37Å; Y1006-S1080 PolarHBondContact OH-OG 2.85Å; Y1006-L1081 HydrophobicContact CD1-CB 4.13Å; Y1006-L1081 HydrophobicContact CD1-CD1 4.03Å; Y1006-L1081 HydrophobicContact CE1-CB 3.85Å; Y1006-L1081 HydrophobicContact CE1-CD1 4.27Å; Y1006-L1084 HydrophobicContact CE2-CD2 3.95Å
1007	M	91.8	Very high	88.6	Confident	26 Å²	26	21.4 Å²	21.4	13%	0.128	11%	0.105	C	C	.	.	H	α-helix	trans	-64	-49.1	176.1	-169.2	65.7	177.2	0	0	110.6	L1003 E1004 Q1009 T1010 I1011 V1109 L1112 Y1304	L1003-M1007 WeakPolarHBondContact O-CB 3.47Å; L1003-M1007 PolarHBondContact O-N 3.44Å; E1004-M1007 PolarHBondContact O-N 3.17Å; M1007-Q1009 VanDerWaalsContact C-N 3.29Å; M1007-Q1009 PolarHBondContact O-N 3.47Å; M1007-T1010 PolarHBondContact O-N 2.91Å; M1007-I1011 HydrophobicContact CE-CD1 4.2Å; M1007-I1011 HydrophobicContact CG-CD1 4.18Å; M1007-I1011 WeakPolarHBondContact O-CG1 3.44Å; M1007-I1011 PolarHBondContact O-N 3.33Å; M1007-V1109 HydrophobicContact CB-CG2 3.82Å; M1007-V1109 HydrophobicContact CG-CG2 4.42Å; M1007-V1109 HydrophobicContact SD-CG2 3.86Å; M1007-L1112 HydrophobicContact CE-CD2 3.39Å; M1007-L1112 HydrophobicContact SD-CD2 3.84Å; M1007-Y1304 HydrophobicContact CE-CD1 3.87Å; M1007-Y1304 HydrophobicContact CE-CD2 3.38Å; M1007-Y1304 HydrophobicContact CE-CE1 3.93Å; M1007-Y1304 HydrophobicContact CE-CE2 3.42Å; M1007-Y1304 VanDerWaalsContact CE-CE2 3.42Å; M1007-Y1304 HydrophobicContact CE-CG 3.6Å
1008	E	89.2	Confident	86.6	Confident	57 Å²	57	21.9 Å²	21.9	27%	0.266	11%	0.109	S	C	.	.	H	α-helix	trans	-56.9	-44.1	177.5	-167.9	-171.8	149.9	0	0	111.1	R949 E1004 Q1005 K1012	R949-E1008 IonicContact CZ-OE2 3.24Å; R949-E1008 IonicContact NE-OE2 3.25Å; R949-E1008 IonicContact NH2-OE2 3.89Å; R949-E1008 PolarHBondContact NH2-OE2 3.04Å; E1004-E1008 WeakPolarHBondContact O-CB 3.37Å; E1004-E1008 PolarHBondContact O-N 2.98Å; Q1005-E1008 PolarHBondContact OE1-OE2 3.08Å; E1008-K1012 HydrophobicContact CG-CD 4.45Å; E1008-K1012 WeakPolarHBondContact O-CG 3.24Å; E1008-K1012 PolarHBondContact O-N 2.92Å; E1008-K1012 VanDerWaalsContact O-N 3.15Å; E1008-K1012 WeakPolarHBondContact OE1-CE 3.24Å; E1008-K1012 IonicContact OE1-NZ 2.62Å; E1008-K1012 PolarHBondContact OE1-NZ 3.37Å
1009	Q	89	Confident	84.3	Confident	7 Å²	7	24.7 Å²	24.7	3%	0.033	13%	0.126	C	C	.	.	H	α-helix	trans	-69.9	-41.2	177.9	-164.7	64.7	29.2	0	0	112	V952 C956 Q1005 Y1006 M1007 I1011 K1012 E1013 L1077	V952-Q1009 HydrophobicContact CG1-CB 3.86Å; V952-Q1009 HydrophobicContact CG1-CG 4.05Å; C956-Q1009 VanDerWaalsContact SG-CG 3.58Å; Q1005-Q1009 WeakPolarHBondContact O-CB 3.38Å; Q1005-Q1009 PolarHBondContact O-N 3Å; Y1006-Q1009 PolarHBondContact O-N 3.11Å; M1007-Q1009 VanDerWaalsContact C-N 3.29Å; M1007-Q1009 PolarHBondContact O-N 3.47Å; Q1009-I1011 VanDerWaalsContact C-N 3.33Å; Q1009-I1011 PolarHBondContact O-N 2.92Å; Q1009-K1012 PolarHBondContact O-N 3.38Å; Q1009-E1013 HydrophobicContact CG-CG 4.36Å; Q1009-E1013 PolarHBondContact NE2-OE1 3.48Å; Q1009-E1013 VanDerWaalsContact O-CG 3.32Å; Q1009-E1013 WeakPolarHBondContact O-CG 3.35Å; Q1009-E1013 PolarHBondContact O-N 3.1Å; Q1009-L1077 HydrophobicContact CB-CD1 4.46Å; Q1009-L1077 HydrophobicContact CG-CD1 4.15Å; Q1009-L1077 HydrophobicContact CG-CD2 4.49Å
1010	T	89.9	Confident	82	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-56.6	-47.7	177.7	-64.4	0	0	0	0	111.1	Y1006 M1007 E1013 G1014 L1074 L1112 I1113 Y1116	Y1006-T1010 VanDerWaalsContact O-CB 3.26Å; Y1006-T1010 WeakPolarHBondContact O-CB 3.32Å; Y1006-T1010 PolarHBondContact O-N 2.9Å; Y1006-T1010 PolarHBondContact O-OG1 3.24Å; M1007-T1010 PolarHBondContact O-N 2.91Å; T1010-E1013 PolarHBondContact O-N 3.23Å; T1010-G1014 PolarHBondContact O-N 3.48Å; T1010-L1074 HydrophobicContact CG2-CD2 4Å; T1010-L1112 HydrophobicContact CG2-CB 4.28Å; T1010-L1112 HydrophobicContact CG2-CD2 3.94Å; T1010-L1112 HydrophobicContact CG2-CG 3.92Å; T1010-I1113 HydrophobicContact CG2-CG1 3.54Å; T1010-Y1116 HydrophobicContact CG2-CD2 3.92Å; T1010-Y1116 HydrophobicContact CG2-CE2 3.8Å; T1010-Y1116 VanDerWaalsContact O-CE2 3.29Å; T1010-Y1116 WeakPolarHBondContact O-CE2 3.27Å
1011	I	86.7	Confident	79.9	Confident	35 Å²	35	33.1 Å²	33.1	18%	0.179	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-49.2	176.5	-67.8	169.1	0	0	0	110.7	M1007 Q1009 E1013 G1014 E1015 L1112 Y1304	M1007-I1011 HydrophobicContact CE-CD1 4.2Å; M1007-I1011 HydrophobicContact CG-CD1 4.18Å; M1007-I1011 WeakPolarHBondContact O-CG1 3.44Å; M1007-I1011 PolarHBondContact O-N 3.33Å; Q1009-I1011 VanDerWaalsContact C-N 3.33Å; Q1009-I1011 PolarHBondContact O-N 2.92Å; I1011-E1013 PolarHBondContact O-N 2.89Å; I1011-G1014 PolarHBondContact O-N 3.44Å; I1011-G1014 VanDerWaalsContact O-N 3.17Å; I1011-E1015 HydrophobicContact CG2-CG 4.5Å; I1011-E1015 WeakPolarHBondContact CG2-OE2 3.22Å; I1011-E1015 WeakPolarHBondContact O-CB 3.16Å; I1011-E1015 PolarHBondContact O-N 2.87Å; I1011-L1112 HydrophobicContact CG1-CD2 3.79Å; I1011-Y1304 HydrophobicContact CD1-CE1 3.93Å
1012	K	83.9	Confident	77.7	Confident	56 Å²	56	34.9 Å²	34.9	24%	0.243	20%	0.195	C	C	.	.	H	α-helix	trans	-58.3	-31	179.7	-78.6	170.5	172.3	171.5	0	114.1	E1008 Q1009 A1026	E1008-K1012 HydrophobicContact CG-CD 4.45Å; E1008-K1012 WeakPolarHBondContact O-CG 3.24Å; E1008-K1012 PolarHBondContact O-N 2.92Å; E1008-K1012 VanDerWaalsContact O-N 3.15Å; E1008-K1012 WeakPolarHBondContact OE1-CE 3.24Å; E1008-K1012 IonicContact OE1-NZ 2.62Å; E1008-K1012 PolarHBondContact OE1-NZ 3.37Å; Q1009-K1012 PolarHBondContact O-N 3.38Å; K1012-A1026 WeakPolarHBondContact O-CB 3.35Å
1013	E	83.9	Confident	75.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-91.5	-21	179.4	-53.9	-56.9	-170	0	0	114	Q1009 T1010 I1011 F1027 T1073 L1074	Q1009-E1013 HydrophobicContact CG-CG 4.36Å; Q1009-E1013 PolarHBondContact NE2-OE1 3.48Å; Q1009-E1013 VanDerWaalsContact O-CG 3.32Å; Q1009-E1013 WeakPolarHBondContact O-CG 3.35Å; Q1009-E1013 PolarHBondContact O-N 3.1Å; T1010-E1013 PolarHBondContact O-N 3.23Å; I1011-E1013 PolarHBondContact O-N 2.89Å; E1013-F1027 HydrophobicContact CB-CD2 4.44Å; E1013-F1027 VanDerWaalsContact CD-CE2 3.44Å; E1013-F1027 HydrophobicContact CG-CD2 4.17Å; E1013-F1027 HydrophobicContact CG-CE2 4.4Å; E1013-F1027 VanDerWaalsContact OE1-CE2 3.28Å; E1013-F1027 WeakPolarHBondContact OE1-CE2 3.39Å; E1013-F1027 WeakPolarHBondContact OE2-CD2 3.29Å; E1013-F1027 WeakPolarHBondContact OE2-CE2 3.49Å; E1013-F1027 PolarHBondContact OE2-N 3.44Å; E1013-T1073 HydrophobicContact CG-CG2 3.98Å; E1013-L1074 HydrophobicContact CB-CD2 4.17Å; E1013-L1074 HydrophobicContact CB-CG 4.43Å
1014	G	82.6	Confident	73.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-91.1	-24.2	179.6	0	0	0	0	0	114.8	T1010 I1011	T1010-G1014 PolarHBondContact O-N 3.48Å; I1011-G1014 PolarHBondContact O-N 3.44Å; I1011-G1014 VanDerWaalsContact O-N 3.17Å
1015	E	80.1	Confident	71.5	Confident	18 Å²	18	37.7 Å²	37.7	8%	0.084	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	145.6	-172.5	-68.8	173.9	-163.5	0	0	113.5	I1011 P1041 I1043 Y1116 Q1312	I1011-E1015 HydrophobicContact CG2-CG 4.5Å; I1011-E1015 WeakPolarHBondContact CG2-OE2 3.22Å; I1011-E1015 WeakPolarHBondContact O-CB 3.16Å; I1011-E1015 PolarHBondContact O-N 2.87Å; E1015-P1041 HydrophobicContact CB-CB 4.45Å; E1015-P1041 HydrophobicContact CG-CB 4.48Å; E1015-I1043 HydrophobicContact CG-CD1 4.43Å; E1015-I1043 HydrophobicContact CG-CG1 3.83Å; E1015-Y1116 HydrophobicContact CG-CE1 4.27Å; E1015-Y1116 PolarHBondContact OE1-OH 2.97Å; E1015-Q1312 PolarHBondContact OE1-OE1 2.95Å
1016	I	70.1	Confident	70	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	115.1	169.7	-62	156.6	0	0	0	108.5	L1028 I1030 T1042 I1044 I1062	I1016-L1028 HydrophobicContact CD1-CB 4.3Å; I1016-L1028 HydrophobicContact CG1-CB 3.41Å; I1016-L1028 VanDerWaalsContact CG1-CB 3.41Å; I1016-L1028 HydrophobicContact CG1-CD1 4.16Å; I1016-L1028 HydrophobicContact CG1-CG 4.38Å; I1016-I1030 HydrophobicContact CG2-CD1 3.62Å; I1016-I1030 HydrophobicContact CG2-CG1 3.42Å; I1016-I1030 VanDerWaalsContact CG2-CG1 3.42Å; I1016-T1042 WeakPolarHBondContact CA-O 3.28Å; I1016-T1042 VanDerWaalsContact CB-O 3.26Å; I1016-T1042 WeakPolarHBondContact CB-O 3.49Å; I1016-T1042 PolarHBondContact N-O 2.91Å; I1016-T1042 PolarHBondContact O-N 3.42Å; I1016-I1044 HydrophobicContact CD1-CD1 3.26Å; I1016-I1044 HydrophobicContact CD1-CG1 3.53Å; I1016-I1062 HydrophobicContact CD1-CD1 3.63Å
1017	N	63.4	Low	68.6	Low	50 Å²	50	39.7 Å²	39.7	27%	0.267	24%	0.24	S	C	.	.			trans	-104.3	118.3	171.9	-73.4	-32.1	0	0	0	109.8	T1019 V1021 P1041	N1017-T1019 VanDerWaalsContact C-N 3.3Å; N1017-V1021 HydrophobicContact CB-CB 4.44Å; N1017-P1041 WeakPolarHBondContact OD1-CB 3.32Å
1018	S	51.1	Low	67.4	Low	42 Å²	42	38.5 Å²	38.5	29%	0.294	23%	0.234	S	C	.	.	S	Bend	trans	-70.4	-26	178.8	58.4	0	0	0	0	113	A1036	S1018-A1036 WeakPolarHBondContact OG-CB 3.31Å
1019	T	47.5	Very low	66.1	Low	61 Å²	61	39.7 Å²	39.7	37%	0.374	24%	0.239	S	C	.	.	S	Bend	trans	-133.5	114.3	-176.2	55.5	0	0	0	0	110.6	N1017 V1021 N1039	N1017-T1019 VanDerWaalsContact C-N 3.3Å; T1019-V1021 PolarHBondContact O-N 3Å; T1019-N1039 PolarHBondContact OG1-OD1 2.99Å
1020	N	46.8	Very low	64.8	Low	168 Å²	168	41.3 Å²	41.3	90%	0.898	25%	0.248	S	C	*	.	S	Bend	trans	75.4	7.9	155.9	-60.3	-18.4	0	0	0	122.4
1021	V	49.9	Very low	63.2	Low	75 Å²	75	48.1 Å²	48.1	46%	0.455	28%	0.278	S	S	.	.			trans	-122.8	8.7	170.8	-158	0	0	0	0	114.3	N1017 T1019 G1023	N1017-V1021 HydrophobicContact CB-CB 4.44Å; T1019-V1021 PolarHBondContact O-N 3Å; V1021-G1023 PolarHBondContact O-N 2.92Å
1022	G	49.2	Very low	61.6	Low	42 Å²	42	52.1 Å²	52.1	43%	0.433	31%	0.309	S	S	.	.			trans	-69.9	64.3	168.1	0	0	0	0	0	112.2	Q1029	G1022-Q1029 PolarHBondContact O-NE2 2.96Å
1023	G	52.1	Low	60	Low	33 Å²	33	55.9 Å²	55.9	34%	0.34	33%	0.332	S	S	.	.			trans	-61.9	168.5	167.5	0	0	0	0	0	110.2	V1021 G1025 A1026 Q1029	V1021-G1023 PolarHBondContact O-N 2.92Å; G1023-G1025 PolarHBondContact O-N 2.75Å; G1023-A1026 PolarHBondContact O-N 3.25Å; G1023-A1026 VanDerWaalsContact O-N 3.09Å; G1023-Q1029 PolarHBondContact O-NE2 3.44Å
1024	P	53.1	Low	58.2	Low	106 Å²	106	60.5 Å²	60.5	69%	0.688	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-21.8	-178.7	-27.3	33.4	0	0	0	114.1	F953 W957	F953-P1024 HydrophobicContact CE2-CB 4.44Å; F953-P1024 HydrophobicContact CZ-CB 4.18Å; W957-P1024 WeakPolarHBondContact CZ2-O 3.08Å
1025	G	53.4	Low	56.6	Low	8 Å²	8	68 Å²	68	8%	0.082	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-39.2	-179.5	0	0	0	0	0	116.3	F953 G1023 F1027	F953-G1025 VanDerWaalsContact CE2-CA 3.48Å; G1023-G1025 PolarHBondContact O-N 2.75Å; G1025-F1027 PolarHBondContact O-N 2.87Å; G1025-F1027 VanDerWaalsContact O-N 3.14Å
1026	A	61.4	Low	55.2	Low	13 Å²	13	68.5 Å²	68.5	11%	0.107	40%	0.399	C	S	.	.			trans	-65.7	114.1	-163	0	0	0	0	0	111.6	K1012 G1023 L1028 Q1029	K1012-A1026 WeakPolarHBondContact O-CB 3.35Å; G1023-A1026 PolarHBondContact O-N 3.25Å; G1023-A1026 VanDerWaalsContact O-N 3.09Å; A1026-L1028 VanDerWaalsContact C-N 3.34Å; A1026-L1028 PolarHBondContact O-N 3.42Å; A1026-Q1029 HydrophobicContact CB-CG 4.45Å; A1026-Q1029 PolarHBondContact O-NE2 2.91Å
1027	F	66.2	Low	54.2	Low	32 Å²	32	75.8 Å²	75.8	14%	0.14	44%	0.438	C	S	.	.	S	Bend	trans	-71.6	-25.9	-177.7	-72.6	-64.8	0	0	0	114.1	E1013 G1025 Q1066 R1069 A1070 T1073	E1013-F1027 HydrophobicContact CB-CD2 4.44Å; E1013-F1027 VanDerWaalsContact CD-CE2 3.44Å; E1013-F1027 HydrophobicContact CG-CD2 4.17Å; E1013-F1027 HydrophobicContact CG-CE2 4.4Å; E1013-F1027 VanDerWaalsContact OE1-CE2 3.28Å; E1013-F1027 WeakPolarHBondContact OE1-CE2 3.39Å; E1013-F1027 WeakPolarHBondContact OE2-CD2 3.29Å; E1013-F1027 WeakPolarHBondContact OE2-CE2 3.49Å; E1013-F1027 PolarHBondContact OE2-N 3.44Å; G1025-F1027 PolarHBondContact O-N 2.87Å; G1025-F1027 VanDerWaalsContact O-N 3.14Å; F1027-Q1066 WeakPolarHBondContact O-CB 3.21Å; F1027-Q1066 WeakPolarHBondContact O-CG 3.32Å; F1027-Q1066 PolarHBondContact O-OE1 2.91Å; F1027-R1069 HydrophobicContact CB-CB 4.5Å; F1027-R1069 HydrophobicContact CD1-CB 3.7Å; F1027-R1069 HydrophobicContact CD1-CG 4.42Å; F1027-R1069 HydrophobicContact CE1-CB 4.15Å; F1027-R1069 HydrophobicContact CG-CB 4.04Å; F1027-A1070 HydrophobicContact CB-CB 4.02Å; F1027-T1073 HydrophobicContact CD2-CG2 4.29Å; F1027-T1073 HydrophobicContact CE2-CG2 3.68Å; F1027-T1073 WeakPolarHBondContact CE2-OG1 3.36Å
1028	L	65.4	Low	53.8	Low	2 Å²	2	79.3 Å²	79.3	1%	0.01	46%	0.457	C	S	.	.			trans	-103.1	91.7	-177.3	-55	173.2	0	0	0	110	I1016 A1026 L1046 I1067 A1070	I1016-L1028 HydrophobicContact CD1-CB 4.3Å; I1016-L1028 HydrophobicContact CG1-CB 3.41Å; I1016-L1028 VanDerWaalsContact CG1-CB 3.41Å; I1016-L1028 HydrophobicContact CG1-CD1 4.16Å; I1016-L1028 HydrophobicContact CG1-CG 4.38Å; A1026-L1028 VanDerWaalsContact C-N 3.34Å; A1026-L1028 PolarHBondContact O-N 3.42Å; L1028-L1046 HydrophobicContact CD1-CD2 4.26Å; L1028-I1067 HydrophobicContact CD2-CG1 4.11Å; L1028-A1070 HydrophobicContact CD1-CB 4.44Å; L1028-A1070 HydrophobicContact CD2-CB 4.08Å; L1028-A1070 HydrophobicContact CG-CB 4.1Å
1029	Q	62.9	Low	54.2	Low	81 Å²	81	83.3 Å²	83.3	38%	0.379	48%	0.475	S	S	.	.			trans	-120.7	137	178.3	-67.1	-175.8	2.9	0	0	111	G1022 G1023 A1026	G1022-Q1029 PolarHBondContact O-NE2 2.96Å; G1023-Q1029 PolarHBondContact O-NE2 3.44Å; A1026-Q1029 HydrophobicContact CB-CG 4.45Å; A1026-Q1029 PolarHBondContact O-NE2 2.91Å
1030	I	61.1	Low	54.8	Low	42 Å²	42	83.5 Å²	83.5	22%	0.215	48%	0.479	C	S	.	.			trans	-83.1	146	172.6	-45.7	179.9	0	0	0	109.1	I1016 F1034 E1061	I1016-I1030 HydrophobicContact CG2-CD1 3.62Å; I1016-I1030 HydrophobicContact CG2-CG1 3.42Å; I1016-I1030 VanDerWaalsContact CG2-CG1 3.42Å; I1030-F1034 HydrophobicContact CD1-CD1 4.37Å; I1030-F1034 HydrophobicContact CD1-CG 4.47Å; I1030-F1034 HydrophobicContact CG2-CB 3.59Å; I1030-F1034 HydrophobicContact CG2-CD2 3.73Å; I1030-F1034 HydrophobicContact CG2-CG 3.71Å; I1030-E1061 WeakPolarHBondContact CG2-OE2 3.36Å
1031	K	55.6	Low	55.9	Low	143 Å²	143	77.4 Å²	77.4	62%	0.622	45%	0.449	S	S	*	.			trans	-68.9	152.6	170.9	-71	179.9	179.1	174.2	0	109.7	N1033 F1034 E1061	K1031-N1033 PolarHBondContact O-N 2.96Å; K1031-F1034 PolarHBondContact O-N 3.14Å; K1031-E1061 HydrophobicContact CB-CB 4.46Å
1032	S	54.1	Low	56.8	Low	118 Å²	118	75.7 Å²	75.7	83%	0.825	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-3.8	-169.1	55.6	0	0	0	0	116.9
1033	N	50	Low	58	Low	136 Å²	136	73.7 Å²	73.7	73%	0.727	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	10.3	-175.2	-72.2	0.9	0	0	0	113.8	K1031	K1031-N1033 PolarHBondContact O-N 2.96Å
1034	F	46.3	Very low	59	Low	97 Å²	97	72.3 Å²	72.3	43%	0.425	40%	0.402	S	S	.	.			trans	-88.5	112.1	178.8	-133.5	-96.2	0	0	0	111.6	I1030 K1031 A1036 P1059	I1030-F1034 HydrophobicContact CD1-CD1 4.37Å; I1030-F1034 HydrophobicContact CD1-CG 4.47Å; I1030-F1034 HydrophobicContact CG2-CB 3.59Å; I1030-F1034 HydrophobicContact CG2-CD2 3.73Å; I1030-F1034 HydrophobicContact CG2-CG 3.71Å; K1031-F1034 PolarHBondContact O-N 3.14Å; F1034-A1036 VanDerWaalsContact C-N 3.28Å; F1034-A1036 PolarHBondContact O-N 3.41Å; F1034-P1059 HydrophobicContact CD2-CB 4.42Å; F1034-P1059 HydrophobicContact CE2-CB 3.31Å; F1034-P1059 HydrophobicContact CE2-CG 4.23Å; F1034-P1059 HydrophobicContact CZ-CB 3.48Å; F1034-P1059 VanDerWaalsContact CZ-CB 3.48Å; F1034-P1059 HydrophobicContact CZ-CG 4.09Å
1035	N	49.2	Very low	60	Low	156 Å²	156	67.4 Å²	67.4	83%	0.834	37%	0.37	S	S	*	.			trans	-72.2	84.1	168.1	-83.6	-8.8	0	0	0	109.2	D1037	N1035-D1037 PolarHBondContact O-N 3.45Å
1036	A	49.8	Very low	61.2	Low	29 Å²	29	67.1 Å²	67.1	24%	0.24	37%	0.367	C	S	.	.			trans	-87.6	83.8	174.2	0	0	0	0	0	109.9	S1018 F1034 N1038	S1018-A1036 WeakPolarHBondContact OG-CB 3.31Å; F1034-A1036 VanDerWaalsContact C-N 3.28Å; F1034-A1036 PolarHBondContact O-N 3.41Å; A1036-N1038 PolarHBondContact O-N 2.96Å; A1036-N1038 VanDerWaalsContact O-N 3.15Å
1037	D	50.9	Low	61.7	Low	158 Å²	158	66.7 Å²	66.7	85%	0.845	36%	0.363	S	S	*	.			trans	-66.8	-4.7	169.7	-82.2	-28.7	0	0	0	112.8	N1035	N1035-D1037 PolarHBondContact O-N 3.45Å
1038	N	54.6	Low	61.3	Low	123 Å²	123	68.1 Å²	68.1	66%	0.658	38%	0.375	S	S	*	.			trans	-113.7	109.3	173.3	-68.8	-19.9	0	0	0	110.3	A1036 S1040	A1036-N1038 PolarHBondContact O-N 2.96Å; A1036-N1038 VanDerWaalsContact O-N 3.15Å; N1038-S1040 PolarHBondContact O-N 2.95Å
1039	N	58.5	Low	61	Low	126 Å²	126	75.3 Å²	75.3	67%	0.674	41%	0.408	S	S	*	.			trans	-70.1	24.7	172.4	-79.9	-24.8	0	0	0	113.6	T1019	T1019-N1039 PolarHBondContact OG1-OD1 2.99Å
1040	S	61.1	Low	60.6	Low	65 Å²	65	72.9 Å²	72.9	46%	0.455	40%	0.397	S	S	.	.			trans	-90.4	132.8	-178.2	53.4	0	0	0	0	111.3	N1038 T1042	N1038-S1040 PolarHBondContact O-N 2.95Å; S1040-T1042 PolarHBondContact O-N 2.81Å
1041	P	69	Low	60.3	Low	41 Å²	41	71.2 Å²	71.2	27%	0.266	39%	0.388	S	S	.	.			trans	-58.2	137.4	173.9	24.9	-33	0	0	0	110.3	E1015 N1017	E1015-P1041 HydrophobicContact CB-CB 4.45Å; E1015-P1041 HydrophobicContact CG-CB 4.48Å; N1017-P1041 WeakPolarHBondContact OD1-CB 3.32Å
1042	T	70	Confident	60.2	Low	38 Å²	38	71.8 Å²	71.8	23%	0.233	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.7	178.7	-60.7	0	0	0	0	110.4	I1016 S1040 Q1312 T1314	I1016-T1042 WeakPolarHBondContact CA-O 3.28Å; I1016-T1042 VanDerWaalsContact CB-O 3.26Å; I1016-T1042 WeakPolarHBondContact CB-O 3.49Å; I1016-T1042 PolarHBondContact N-O 2.91Å; I1016-T1042 PolarHBondContact O-N 3.42Å; S1040-T1042 PolarHBondContact O-N 2.81Å; T1042-Q1312 CarbonylContact C-O 3.54Å; T1042-Q1312 WeakPolarHBondContact CA-O 3.42Å; T1042-T1314 HydrophobicContact CG2-CG2 3.53Å
1043	I	74.1	Confident	60.1	Low	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	138.1	175.6	-61.8	170.2	0	0	0	109.6	E1015 Y1116 I1309 Q1312 R1313	E1015-I1043 HydrophobicContact CG-CD1 4.43Å; E1015-I1043 HydrophobicContact CG-CG1 3.83Å; I1043-Y1116 HydrophobicContact CD1-CD1 4.01Å; I1043-Y1116 HydrophobicContact CD1-CE1 3.44Å; I1043-Y1116 VanDerWaalsContact CD1-CE1 3.44Å; I1043-Y1116 HydrophobicContact CG1-CD1 4.44Å; I1043-Y1116 HydrophobicContact CG1-CE1 3.95Å; I1043-Y1116 HydrophobicContact CG2-CD1 4.06Å; I1043-Y1116 HydrophobicContact CG2-CE1 4.41Å; I1043-I1309 HydrophobicContact CD1-CB 4.33Å; I1043-I1309 HydrophobicContact CD1-CD1 3.51Å; I1043-I1309 HydrophobicContact CD1-CG1 4.47Å; I1043-I1309 HydrophobicContact CD1-CG2 3.92Å; I1043-Q1312 HydrophobicContact CB-CB 4.3Å; I1043-Q1312 HydrophobicContact CD1-CB 3.63Å; I1043-Q1312 HydrophobicContact CD1-CG 4.35Å; I1043-Q1312 HydrophobicContact CG1-CB 3.79Å; I1043-Q1312 PolarHBondContact N-O 3.08Å; I1043-R1313 HydrophobicContact CB-CG 4.07Å; I1043-R1313 HydrophobicContact CG2-CG 4.12Å; I1043-R1313 WeakPolarHBondContact O-CA 3.49Å
1044	I	73.4	Confident	60.2	Low	4 Å²	4	68.3 Å²	68.3	2%	0.021	36%	0.359	C	S	.	.			trans	-108.1	137.9	168.8	-60.2	173.3	0	0	0	109.3	I1016 L1046 L1058 I1062 I1067	I1016-I1044 HydrophobicContact CD1-CD1 3.26Å; I1016-I1044 HydrophobicContact CD1-CG1 3.53Å; I1044-L1046 PolarHBondContact O-N 3.01Å; I1044-L1058 HydrophobicContact CD1-CD2 3.51Å; I1044-L1058 HydrophobicContact CG1-CD2 4.21Å; I1044-L1058 HydrophobicContact CG2-CD2 4.37Å; I1044-I1062 HydrophobicContact CD1-CD1 3.4Å; I1044-I1062 VanDerWaalsContact CD1-CD1 3.4Å; I1044-I1062 HydrophobicContact CD1-CG2 4.45Å; I1044-I1067 HydrophobicContact CG2-CD1 4.38Å
1045	P	73.9	Confident	60.4	Low	3 Å²	3	66 Å²	66	2%	0.019	35%	0.351	C	S	.	.			trans	-57	120.1	169.6	-18.4	28.4	0	0	0	111.2	S1047 E1050 L1054	P1045-S1047 VanDerWaalsContact C-N 3.32Å; P1045-E1050 VanDerWaalsContact CB-OE2 3.25Å; P1045-E1050 WeakPolarHBondContact CB-OE2 3.37Å; P1045-E1050 VanDerWaalsContact CG-OE2 3.25Å; P1045-E1050 WeakPolarHBondContact CG-OE2 3.38Å; P1045-L1054 HydrophobicContact CG-CD1 3.96Å
1046	L	77.2	Confident	60.6	Low	2 Å²	2	62.8 Å²	62.8	1%	0.01	34%	0.341	C	S	.	.			trans	-85	-5.4	-178.3	-56.9	178.6	0	0	0	113.1	L1028 I1044 I1067 A1070 K1071 L1074 Y1116	L1028-L1046 HydrophobicContact CD1-CD2 4.26Å; I1044-L1046 PolarHBondContact O-N 3.01Å; L1046-I1067 HydrophobicContact CB-CG2 4.5Å; L1046-I1067 HydrophobicContact CD2-CG2 3.69Å; L1046-A1070 HydrophobicContact CD1-CB 4.18Å; L1046-A1070 HydrophobicContact CD2-CB 4.01Å; L1046-K1071 HydrophobicContact CB-CB 4.13Å; L1046-K1071 HydrophobicContact CB-CG 4.42Å; L1046-K1071 WeakPolarHBondContact O-CD 3.49Å; L1046-L1074 HydrophobicContact CD1-CD1 3.4Å; L1046-Y1116 WeakPolarHBondContact CB-O 3.43Å; L1046-Y1116 WeakPolarHBondContact CG-O 3.12Å
1047	S	71.7	Confident	60.7	Low	4 Å²	4	68 Å²	68	3%	0.028	37%	0.365	C	S	.	.	S	Bend	trans	-82.2	155.9	-179.3	72	0	0	0	0	113	P1045 M1051 S1119	P1045-S1047 VanDerWaalsContact C-N 3.32Å; S1047-M1051 WeakPolarHBondContact O-CG 3.49Å; S1047-S1119 WeakPolarHBondContact OG-CA 3.46Å; S1047-S1119 WeakPolarHBondContact OG-CB 3.31Å; S1047-S1119 PolarHBondContact OG-N 3.49Å; S1047-S1119 VanDerWaalsContact OG-N 3.12Å
1048	T	59.1	Low	60.8	Low	62 Å²	62	61.2 Å²	61.2	38%	0.38	33%	0.329	S	S	.	.	H	α-helix	trans	-77.1	-22.1	-169.9	43.4	0	0	0	0	114.7	H1052 F1068	T1048-H1052 PolarHBondContact O-ND1 3.45Å; T1048-F1068 HydrophobicContact CG2-CE1 4.31Å
1049	H	58.5	Low	60.6	Low	153 Å²	153	57.6 Å²	57.6	71%	0.708	31%	0.312	S	S	*	.	H	α-helix	trans	-67.1	-38.8	-173.1	-69.8	-70	0	0	0	112
1050	E	55	Low	60.3	Low	30 Å²	30	60.5 Å²	60.5	14%	0.14	32%	0.324	C	S	.	.	H	α-helix	trans	-95	-24.8	179.5	-62	-172.9	129.6	0	0	113.6	P1045 H1052 E1053 L1054 T1120 P1121	P1045-E1050 VanDerWaalsContact CB-OE2 3.25Å; P1045-E1050 WeakPolarHBondContact CB-OE2 3.37Å; P1045-E1050 VanDerWaalsContact CG-OE2 3.25Å; P1045-E1050 WeakPolarHBondContact CG-OE2 3.38Å; E1050-H1052 PolarHBondContact O-N 3.22Å; E1050-H1052 VanDerWaalsContact O-N 3.09Å; E1050-E1053 PolarHBondContact O-N 3.29Å; E1050-L1054 HydrophobicContact CB-CD1 4.08Å; E1050-L1054 PolarHBondContact O-N 3.03Å; E1050-T1120 VanDerWaalsContact OE1-CB 3.24Å; E1050-T1120 WeakPolarHBondContact OE1-CB 3.46Å; E1050-T1120 WeakPolarHBondContact OE2-CB 3.5Å; E1050-T1120 PolarHBondContact OE2-N 2.87Å; E1050-T1120 PolarHBondContact OE2-OG1 3.21Å; E1050-P1121 WeakPolarHBondContact OE1-CD 3.48Å
1051	M	53.9	Low	60.4	Low	7 Å²	7	59.9 Å²	59.9	3%	0.034	31%	0.313	C	S	.	.	H	α-helix	trans	-50	-39	179.8	-88.7	-104.5	-96.7	0	0	112.7	S1047 E1053 I1055 I1067 F1068	S1047-M1051 WeakPolarHBondContact O-CG 3.49Å; M1051-E1053 VanDerWaalsContact C-N 3.34Å; M1051-E1053 PolarHBondContact O-N 3.48Å; M1051-I1055 HydrophobicContact CB-CD1 4.19Å; M1051-I1055 WeakPolarHBondContact O-CB 3.46Å; M1051-I1055 WeakPolarHBondContact O-CD1 3.26Å; M1051-I1055 WeakPolarHBondContact O-CG1 3.44Å; M1051-I1055 PolarHBondContact O-N 3.35Å; M1051-I1055 HydrophobicContact SD-CD1 4.12Å; M1051-I1067 HydrophobicContact CE-CB 3.75Å; M1051-I1067 HydrophobicContact CE-CD1 4.3Å; M1051-I1067 HydrophobicContact CE-CG2 3.34Å; M1051-I1067 HydrophobicContact SD-CB 4.03Å; M1051-I1067 HydrophobicContact SD-CD1 3.46Å; M1051-I1067 WeakPolarHBondContact SD-CD1 3.4Å; M1051-I1067 HydrophobicContact SD-CG1 4.33Å; M1051-I1067 HydrophobicContact SD-CG2 3.56Å; M1051-I1067 VanDerWaalsContact SD-CG2 3.56Å; M1051-F1068 HydrophobicContact CE-CD1 4.42Å; M1051-F1068 HydrophobicContact CE-CD2 4.42Å; M1051-F1068 HydrophobicContact CE-CE1 4.06Å; M1051-F1068 HydrophobicContact CE-CE2 4.05Å; M1051-F1068 HydrophobicContact CE-CZ 3.86Å
1052	H	54.2	Low	60.1	Low	156 Å²	156	59 Å²	59	72%	0.722	31%	0.306	S	S	*	.	H	α-helix	trans	-64.1	-35.5	-178.5	-73.1	84.3	0	0	0	113.5	T1048 E1050	T1048-H1052 PolarHBondContact O-ND1 3.45Å; E1050-H1052 PolarHBondContact O-N 3.22Å; E1050-H1052 VanDerWaalsContact O-N 3.09Å
1053	E	52.4	Low	60.1	Low	155 Å²	155	60.7 Å²	60.7	72%	0.724	31%	0.314	S	S	*	.	H	α-helix	trans	-86.1	-38.9	175.8	-84.9	-173.6	149.5	0	0	112.6	E1050 M1051 I1055 S1056	E1050-E1053 PolarHBondContact O-N 3.29Å; M1051-E1053 VanDerWaalsContact C-N 3.34Å; M1051-E1053 PolarHBondContact O-N 3.48Å; E1053-I1055 VanDerWaalsContact C-N 3.33Å; E1053-I1055 PolarHBondContact O-N 2.95Å; E1053-S1056 PolarHBondContact O-N 3.06Å; E1053-S1056 PolarHBondContact O-OG 3.41Å
1054	L	51.4	Low	59.9	Low	25 Å²	25	65.6 Å²	65.6	13%	0.131	34%	0.335	C	S	.	.	H	α-helix	trans	-66.3	-34.5	177.3	-105.1	143.6	0	0	0	111.6	P1045 E1050 S1056 N1057 L1058 D1315	P1045-L1054 HydrophobicContact CG-CD1 3.96Å; E1050-L1054 HydrophobicContact CB-CD1 4.08Å; E1050-L1054 PolarHBondContact O-N 3.03Å; L1054-S1056 PolarHBondContact O-N 3.47Å; L1054-S1056 VanDerWaalsContact O-N 3.14Å; L1054-N1057 CarbonylContact O-C 3.45Å; L1054-N1057 PolarHBondContact O-N 2.99Å; L1054-L1058 HydrophobicContact CB-CD1 4.32Å; L1054-L1058 HydrophobicContact CB-CG 4.38Å; L1054-L1058 HydrophobicContact CD2-CD2 4.33Å; L1054-L1058 HydrophobicContact CD2-CG 4.16Å; L1054-L1058 WeakPolarHBondContact O-CB 2.99Å; L1054-L1058 VanDerWaalsContact O-CG 3.24Å; L1054-L1058 WeakPolarHBondContact O-CG 3.4Å; L1054-L1058 PolarHBondContact O-N 2.88Å; L1054-D1315 HydrophobicContact CD1-CB 4.29Å
1055	I	50.5	Low	59.9	Low	49 Å²	49	69.8 Å²	69.8	25%	0.251	36%	0.357	S	S	.	.	H	α-helix	trans	-57.7	-28.4	177.8	-77.8	161.4	0	0	0	113.1	M1051 E1053 N1057 L1058 K1064	M1051-I1055 HydrophobicContact CB-CD1 4.19Å; M1051-I1055 WeakPolarHBondContact O-CB 3.46Å; M1051-I1055 WeakPolarHBondContact O-CD1 3.26Å; M1051-I1055 WeakPolarHBondContact O-CG1 3.44Å; M1051-I1055 PolarHBondContact O-N 3.35Å; M1051-I1055 HydrophobicContact SD-CD1 4.12Å; E1053-I1055 VanDerWaalsContact C-N 3.33Å; E1053-I1055 PolarHBondContact O-N 2.95Å; I1055-N1057 VanDerWaalsContact C-N 3.35Å; I1055-L1058 HydrophobicContact CG1-CD1 4.08Å; I1055-K1064 HydrophobicContact CD1-CD 3.62Å; I1055-K1064 VanDerWaalsContact CD1-CE 3.41Å; I1055-K1064 HydrophobicContact CD1-CG 3.86Å; I1055-K1064 HydrophobicContact CG1-CD 4.45Å; I1055-K1064 HydrophobicContact CG1-CG 4.34Å; I1055-K1064 VanDerWaalsContact CG2-CE 3.42Å
1056	S	52.8	Low	60.1	Low	89 Å²	89	72 Å²	72	62%	0.622	37%	0.367	S	S	*	.	H	α-helix	trans	-77.6	-20.9	175.2	52.5	0	0	0	0	113.7	E1053 L1054	E1053-S1056 PolarHBondContact O-N 3.06Å; E1053-S1056 PolarHBondContact O-OG 3.41Å; L1054-S1056 PolarHBondContact O-N 3.47Å; L1054-S1056 VanDerWaalsContact O-N 3.14Å
1057	N	52	Low	60.1	Low	137 Å²	137	71.9 Å²	71.9	73%	0.733	37%	0.367	S	S	*	.	H	α-helix	trans	-118.3	-7.7	-174.1	-67.2	-19.3	0	0	0	114.2	L1054 I1055	L1054-N1057 CarbonylContact O-C 3.45Å; L1054-N1057 PolarHBondContact O-N 2.99Å; I1055-N1057 VanDerWaalsContact C-N 3.35Å
1058	L	53.1	Low	60.5	Low	17 Å²	17	76 Å²	76	9%	0.089	39%	0.385	C	S	.	.	S	Bend	trans	-56.3	138.7	171.7	-88.3	160.5	0	0	0	107.1	I1044 L1054 I1055 M1060 I1067	I1044-L1058 HydrophobicContact CD1-CD2 3.51Å; I1044-L1058 HydrophobicContact CG1-CD2 4.21Å; I1044-L1058 HydrophobicContact CG2-CD2 4.37Å; L1054-L1058 HydrophobicContact CB-CD1 4.32Å; L1054-L1058 HydrophobicContact CB-CG 4.38Å; L1054-L1058 HydrophobicContact CD2-CD2 4.33Å; L1054-L1058 HydrophobicContact CD2-CG 4.16Å; L1054-L1058 WeakPolarHBondContact O-CB 2.99Å; L1054-L1058 VanDerWaalsContact O-CG 3.24Å; L1054-L1058 WeakPolarHBondContact O-CG 3.4Å; L1054-L1058 PolarHBondContact O-N 2.88Å; I1055-L1058 HydrophobicContact CG1-CD1 4.08Å; L1058-M1060 PolarHBondContact O-N 2.89Å; L1058-I1067 HydrophobicContact CD1-CD1 4.33Å
1059	P	51.5	Low	61.6	Low	47 Å²	47	79.2 Å²	79.2	31%	0.305	39%	0.39	S	S	.	.			trans	-49	123.1	165.5	19.8	-28.8	0	0	0	106.6	F1034 E1061	F1034-P1059 HydrophobicContact CD2-CB 4.42Å; F1034-P1059 HydrophobicContact CE2-CB 3.31Å; F1034-P1059 HydrophobicContact CE2-CG 4.23Å; F1034-P1059 HydrophobicContact CZ-CB 3.48Å; F1034-P1059 VanDerWaalsContact CZ-CB 3.48Å; F1034-P1059 HydrophobicContact CZ-CG 4.09Å; P1059-E1061 PolarHBondContact O-N 3.15Å
1060	M	52	Low	62.8	Low	187 Å²	187	71.9 Å²	71.9	92%	0.921	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	16.7	-165.1	-89.1	-84.3	-64.4	0	0	116.2	L1058	L1058-M1060 PolarHBondContact O-N 2.89Å
1061	E	62.7	Low	64.3	Low	52 Å²	52	73.3 Å²	73.3	24%	0.243	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-13.6	-168.1	-60.8	-167.7	154.4	0	0	115.3	I1030 K1031 P1059	I1030-E1061 WeakPolarHBondContact CG2-OE2 3.36Å; K1031-E1061 HydrophobicContact CB-CB 4.46Å; P1059-E1061 PolarHBondContact O-N 3.15Å
1062	I	63.4	Low	65.8	Low	21 Å²	21	74.8 Å²	74.8	11%	0.108	37%	0.372	C	S	.	.			trans	-91.1	114.3	-179.3	-58.1	174.3	0	0	0	110.7	I1016 I1044 I1067	I1016-I1062 HydrophobicContact CD1-CD1 3.63Å; I1044-I1062 HydrophobicContact CD1-CD1 3.4Å; I1044-I1062 VanDerWaalsContact CD1-CD1 3.4Å; I1044-I1062 HydrophobicContact CD1-CG2 4.45Å; I1062-I1067 HydrophobicContact CG2-CD1 4.26Å; I1062-I1067 HydrophobicContact CG2-CG1 4.13Å
1063	D	68.5	Low	67.5	Low	74 Å²	74	67.6 Å²	67.6	40%	0.396	34%	0.34	S	S	.	.			trans	-67.8	128.9	-179.6	177.9	1.4	0	0	0	111	N1065 Q1066	D1063-N1065 PolarHBondContact O-N 3.09Å; D1063-N1065 WeakPolarHBondContact OD1-CB 3.26Å; D1063-N1065 PolarHBondContact OD1-N 3.28Å; D1063-N1065 PolarHBondContact OD1-ND2 3.34Å; D1063-N1065 VanDerWaalsContact OD1-ND2 3.11Å; D1063-N1065 PolarHBondContact OD2-ND2 3.21Å; D1063-Q1066 HydrophobicContact CB-CG 4.14Å; D1063-Q1066 WeakPolarHBondContact O-CA 3.37Å; D1063-Q1066 VanDerWaalsContact O-CB 3.25Å; D1063-Q1066 WeakPolarHBondContact O-CB 3.32Å; D1063-Q1066 PolarHBondContact O-N 3.42Å
1064	K	70.5	Confident	69.3	Low	103 Å²	103	60.2 Å²	60.2	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-50.6	-35.4	174.8	-60.5	-171.8	-170.9	-167.3	0	112.2	I1055 Q1066 I1067 F1068	I1055-K1064 HydrophobicContact CD1-CD 3.62Å; I1055-K1064 VanDerWaalsContact CD1-CE 3.41Å; I1055-K1064 HydrophobicContact CD1-CG 3.86Å; I1055-K1064 HydrophobicContact CG1-CD 4.45Å; I1055-K1064 HydrophobicContact CG1-CG 4.34Å; I1055-K1064 VanDerWaalsContact CG2-CE 3.42Å; K1064-Q1066 VanDerWaalsContact C-N 3.25Å; K1064-Q1066 PolarHBondContact O-N 2.89Å; K1064-I1067 PolarHBondContact O-N 3.34Å; K1064-F1068 HydrophobicContact CB-CD2 4.48Å; K1064-F1068 HydrophobicContact CB-CE2 4.33Å; K1064-F1068 WeakPolarHBondContact O-CD2 3.47Å; K1064-F1068 PolarHBondContact O-N 3.36Å; K1064-F1068 VanDerWaalsContact O-N 3.1Å
1065	N	74.5	Confident	71.1	Confident	92 Å²	92	62.9 Å²	62.9	49%	0.492	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-34.8	177.6	-64.1	-49.7	0	0	0	112.1	D1063 R1069	D1063-N1065 PolarHBondContact O-N 3.09Å; D1063-N1065 WeakPolarHBondContact OD1-CB 3.26Å; D1063-N1065 PolarHBondContact OD1-N 3.28Å; D1063-N1065 PolarHBondContact OD1-ND2 3.34Å; D1063-N1065 VanDerWaalsContact OD1-ND2 3.11Å; D1063-N1065 PolarHBondContact OD2-ND2 3.21Å; N1065-R1069 WeakPolarHBondContact O-CG 3.36Å; N1065-R1069 PolarHBondContact O-N 3.46Å
1066	Q	77.3	Confident	73.1	Confident	49 Å²	49	61.4 Å²	61.4	23%	0.229	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-44.7	175.9	-72.4	178.7	2.6	0	0	111.5	F1027 D1063 K1064 F1068 R1069 A1070	F1027-Q1066 WeakPolarHBondContact O-CB 3.21Å; F1027-Q1066 WeakPolarHBondContact O-CG 3.32Å; F1027-Q1066 PolarHBondContact O-OE1 2.91Å; D1063-Q1066 HydrophobicContact CB-CG 4.14Å; D1063-Q1066 WeakPolarHBondContact O-CA 3.37Å; D1063-Q1066 VanDerWaalsContact O-CB 3.25Å; D1063-Q1066 WeakPolarHBondContact O-CB 3.32Å; D1063-Q1066 PolarHBondContact O-N 3.42Å; K1064-Q1066 VanDerWaalsContact C-N 3.25Å; K1064-Q1066 PolarHBondContact O-N 2.89Å; Q1066-F1068 PolarHBondContact O-N 2.91Å; Q1066-R1069 CarbonylContact O-C 3.55Å; Q1066-R1069 WeakPolarHBondContact O-CA 3.48Å; Q1066-R1069 WeakPolarHBondContact O-CB 3.34Å; Q1066-R1069 PolarHBondContact O-N 3.04Å; Q1066-A1070 PolarHBondContact O-N 3.26Å
1067	I	77.9	Confident	75.1	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-62.7	-46.3	178.2	-59.2	173.2	0	0	0	110.7	L1028 I1044 L1046 M1051 L1058 I1062 K1064 R1069 A1070 K1071	L1028-I1067 HydrophobicContact CD2-CG1 4.11Å; I1044-I1067 HydrophobicContact CG2-CD1 4.38Å; L1046-I1067 HydrophobicContact CB-CG2 4.5Å; L1046-I1067 HydrophobicContact CD2-CG2 3.69Å; M1051-I1067 HydrophobicContact CE-CB 3.75Å; M1051-I1067 HydrophobicContact CE-CD1 4.3Å; M1051-I1067 HydrophobicContact CE-CG2 3.34Å; M1051-I1067 HydrophobicContact SD-CB 4.03Å; M1051-I1067 HydrophobicContact SD-CD1 3.46Å; M1051-I1067 WeakPolarHBondContact SD-CD1 3.4Å; M1051-I1067 HydrophobicContact SD-CG1 4.33Å; M1051-I1067 HydrophobicContact SD-CG2 3.56Å; M1051-I1067 VanDerWaalsContact SD-CG2 3.56Å; L1058-I1067 HydrophobicContact CD1-CD1 4.33Å; I1062-I1067 HydrophobicContact CG2-CD1 4.26Å; I1062-I1067 HydrophobicContact CG2-CG1 4.13Å; K1064-I1067 PolarHBondContact O-N 3.34Å; I1067-R1069 PolarHBondContact O-N 3.49Å; I1067-A1070 PolarHBondContact O-N 3.45Å; I1067-K1071 PolarHBondContact O-N 3.11Å
1068	F	80.3	Confident	77.1	Confident	90 Å²	90	54.8 Å²	54.8	40%	0.395	26%	0.262	S	S	.	.	H	α-helix	trans	-62.8	-29.5	173.8	-71	-63.3	0	0	0	112.5	R960 T1048 M1051 K1064 Q1066 S1072	R960-F1068 PolarHBondContact NH2-O 2.99Å; R960-F1068 VanDerWaalsContact NH2-O 3.15Å; T1048-F1068 HydrophobicContact CG2-CE1 4.31Å; M1051-F1068 HydrophobicContact CE-CD1 4.42Å; M1051-F1068 HydrophobicContact CE-CD2 4.42Å; M1051-F1068 HydrophobicContact CE-CE1 4.06Å; M1051-F1068 HydrophobicContact CE-CE2 4.05Å; M1051-F1068 HydrophobicContact CE-CZ 3.86Å; K1064-F1068 HydrophobicContact CB-CD2 4.48Å; K1064-F1068 HydrophobicContact CB-CE2 4.33Å; K1064-F1068 WeakPolarHBondContact O-CD2 3.47Å; K1064-F1068 PolarHBondContact O-N 3.36Å; K1064-F1068 VanDerWaalsContact O-N 3.1Å; Q1066-F1068 PolarHBondContact O-N 2.91Å; F1068-S1072 VanDerWaalsContact O-CB 3.26Å; F1068-S1072 WeakPolarHBondContact O-CB 3.43Å; F1068-S1072 PolarHBondContact O-N 3.36Å
1069	R	80.5	Confident	79	Confident	129 Å²	129	60 Å²	60	49%	0.487	28%	0.283	S	S	.	.	H	α-helix	trans	-68.7	-53.6	173.2	-60.3	-121.1	169.4	95.6	-5.6	109.9	F1027 N1065 Q1066 I1067 K1071 S1072 T1073	F1027-R1069 HydrophobicContact CB-CB 4.5Å; F1027-R1069 HydrophobicContact CD1-CB 3.7Å; F1027-R1069 HydrophobicContact CD1-CG 4.42Å; F1027-R1069 HydrophobicContact CE1-CB 4.15Å; F1027-R1069 HydrophobicContact CG-CB 4.04Å; N1065-R1069 WeakPolarHBondContact O-CG 3.36Å; N1065-R1069 PolarHBondContact O-N 3.46Å; Q1066-R1069 CarbonylContact O-C 3.55Å; Q1066-R1069 WeakPolarHBondContact O-CA 3.48Å; Q1066-R1069 WeakPolarHBondContact O-CB 3.34Å; Q1066-R1069 PolarHBondContact O-N 3.04Å; I1067-R1069 PolarHBondContact O-N 3.49Å; R1069-K1071 PolarHBondContact O-N 2.88Å; R1069-S1072 CarbonylContact O-C 3.28Å; R1069-S1072 WeakPolarHBondContact O-CB 3.47Å; R1069-S1072 PolarHBondContact O-N 2.98Å; R1069-S1072 VanDerWaalsContact O-N 3.08Å; R1069-T1073 PolarHBondContact O-N 3.43Å; R1069-T1073 PolarHBondContact O-OG1 2.92Å
1070	A	84.6	Confident	81.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-52	-52	179	0	0	0	0	0	111.7	F1027 L1028 L1046 Q1066 I1067 S1072 T1073 L1074	F1027-A1070 HydrophobicContact CB-CB 4.02Å; L1028-A1070 HydrophobicContact CD1-CB 4.44Å; L1028-A1070 HydrophobicContact CD2-CB 4.08Å; L1028-A1070 HydrophobicContact CG-CB 4.1Å; L1046-A1070 HydrophobicContact CD1-CB 4.18Å; L1046-A1070 HydrophobicContact CD2-CB 4.01Å; Q1066-A1070 PolarHBondContact O-N 3.26Å; I1067-A1070 PolarHBondContact O-N 3.45Å; A1070-S1072 PolarHBondContact O-N 3.37Å; A1070-T1073 WeakPolarHBondContact O-CB 3.35Å; A1070-T1073 PolarHBondContact O-N 2.99Å; A1070-T1073 VanDerWaalsContact O-N 3.1Å; A1070-L1074 WeakPolarHBondContact O-CG 3.27Å; A1070-L1074 PolarHBondContact O-N 3.31Å
1071	K	86.1	Confident	83.2	Confident	60 Å²	60	49 Å²	49	26%	0.261	23%	0.226	S	C	.	.	H	α-helix	trans	-55.8	-49.5	176	-170.2	-177.8	-170.4	162	0	112.3	L1046 I1067 R1069 T1073 L1074 E1075	L1046-K1071 HydrophobicContact CB-CB 4.13Å; L1046-K1071 HydrophobicContact CB-CG 4.42Å; L1046-K1071 WeakPolarHBondContact O-CD 3.49Å; I1067-K1071 PolarHBondContact O-N 3.11Å; R1069-K1071 PolarHBondContact O-N 2.88Å; K1071-T1073 VanDerWaalsContact C-N 3.25Å; K1071-T1073 PolarHBondContact O-N 3.37Å; K1071-L1074 PolarHBondContact O-N 3.12Å; K1071-E1075 PolarHBondContact O-N 3.15Å
1072	S	86.3	Confident	84.6	Confident	37 Å²	37	47.8 Å²	47.8	26%	0.259	23%	0.228	S	C	.	.	H	α-helix	trans	-61.7	-36.1	180	-177.9	0	0	0	0	111.7	F1068 R1069 A1070 R1076	F1068-S1072 VanDerWaalsContact O-CB 3.26Å; F1068-S1072 WeakPolarHBondContact O-CB 3.43Å; F1068-S1072 PolarHBondContact O-N 3.36Å; R1069-S1072 CarbonylContact O-C 3.28Å; R1069-S1072 WeakPolarHBondContact O-CB 3.47Å; R1069-S1072 PolarHBondContact O-N 2.98Å; R1069-S1072 VanDerWaalsContact O-N 3.08Å; A1070-S1072 PolarHBondContact O-N 3.37Å; S1072-R1076 VanDerWaalsContact O-CG 3.28Å; S1072-R1076 WeakPolarHBondContact O-CG 3.4Å; S1072-R1076 PolarHBondContact O-N 3.28Å; S1072-R1076 VanDerWaalsContact O-N 3.14Å
1073	T	88.4	Confident	86.1	Confident	6 Å²	6	49 Å²	49	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-70.1	-45.5	178.1	-59	0	0	0	0	111.4	C956 E1013 F1027 R1069 A1070 K1071 E1075 R1076 L1077	C956-T1073 HydrophobicContact CB-CG2 3.52Å; C956-T1073 VanDerWaalsContact SG-CG2 3.56Å; E1013-T1073 HydrophobicContact CG-CG2 3.98Å; F1027-T1073 HydrophobicContact CD2-CG2 4.29Å; F1027-T1073 HydrophobicContact CE2-CG2 3.68Å; F1027-T1073 WeakPolarHBondContact CE2-OG1 3.36Å; R1069-T1073 PolarHBondContact O-N 3.43Å; R1069-T1073 PolarHBondContact O-OG1 2.92Å; A1070-T1073 WeakPolarHBondContact O-CB 3.35Å; A1070-T1073 PolarHBondContact O-N 2.99Å; A1070-T1073 VanDerWaalsContact O-N 3.1Å; K1071-T1073 VanDerWaalsContact C-N 3.25Å; K1071-T1073 PolarHBondContact O-N 3.37Å; T1073-E1075 VanDerWaalsContact C-N 3.3Å; T1073-E1075 PolarHBondContact O-N 3.47Å; T1073-R1076 CarbonylContact O-C 3.55Å; T1073-R1076 WeakPolarHBondContact O-CA 3.41Å; T1073-R1076 WeakPolarHBondContact O-CB 3.26Å; T1073-R1076 PolarHBondContact O-N 3.42Å; T1073-L1077 HydrophobicContact CG2-CD1 4.49Å; T1073-L1077 PolarHBondContact O-N 2.69Å
1074	L	90.7	Very high	87.3	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-38.8	176.8	-71.3	175.4	0	0	0	112.1	T1010 E1013 L1046 A1070 K1071 R1076 L1077 K1078 I1113 Y1116 N1117	T1010-L1074 HydrophobicContact CG2-CD2 4Å; E1013-L1074 HydrophobicContact CB-CD2 4.17Å; E1013-L1074 HydrophobicContact CB-CG 4.43Å; L1046-L1074 HydrophobicContact CD1-CD1 3.4Å; A1070-L1074 WeakPolarHBondContact O-CG 3.27Å; A1070-L1074 PolarHBondContact O-N 3.31Å; K1071-L1074 PolarHBondContact O-N 3.12Å; L1074-R1076 VanDerWaalsContact C-N 3.33Å; L1074-R1076 PolarHBondContact O-N 3.26Å; L1074-L1077 HydrophobicContact CD2-CD1 4.26Å; L1074-L1077 WeakPolarHBondContact O-CB 3.33Å; L1074-L1077 PolarHBondContact O-N 3.46Å; L1074-K1078 PolarHBondContact O-N 2.74Å; L1074-I1113 HydrophobicContact CB-CG2 4.22Å; L1074-I1113 HydrophobicContact CD2-CG1 4.39Å; L1074-Y1116 HydrophobicContact CD1-CD2 4.16Å; L1074-Y1116 HydrophobicContact CD1-CG 4.34Å; L1074-Y1116 HydrophobicContact CD2-CD2 4.34Å; L1074-N1117 WeakPolarHBondContact CD1-OD1 3.39Å
1075	E	90.1	Very high	88.4	Confident	80 Å²	80	41.2 Å²	41.2	37%	0.374	20%	0.197	S	C	.	.	H	α-helix	trans	-66.2	-33.7	172.3	-73.3	-59.5	151.3	0	0	112.8	K1071 T1073 K1078 K1079 N1117	K1071-E1075 PolarHBondContact O-N 3.15Å; T1073-E1075 VanDerWaalsContact C-N 3.3Å; T1073-E1075 PolarHBondContact O-N 3.47Å; E1075-K1078 PolarHBondContact O-N 3.25Å; E1075-K1079 PolarHBondContact O-N 3.49Å; E1075-N1117 PolarHBondContact OE1-ND2 2.92Å
1076	R	92.4	Very high	89.2	Confident	19 Å²	19	42.1 Å²	42.1	7%	0.072	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-44.1	171.7	-70.4	174.3	77.4	76.5	4.7	111.2	L955 S958 T962 V964 S1072 T1073 L1074 K1078 K1079 S1080	L955-R1076 PolarHBondContact O-NE 3.33Å; S958-R1076 PolarHBondContact OG-NH2 3.49Å; T962-R1076 PolarHBondContact O-NH1 2.92Å; T962-R1076 PolarHBondContact O-NH2 3.03Å; V964-R1076 HydrophobicContact CG2-CB 4.25Å; V964-R1076 HydrophobicContact CG2-CG 4.07Å; S1072-R1076 VanDerWaalsContact O-CG 3.28Å; S1072-R1076 WeakPolarHBondContact O-CG 3.4Å; S1072-R1076 PolarHBondContact O-N 3.28Å; S1072-R1076 VanDerWaalsContact O-N 3.14Å; T1073-R1076 CarbonylContact O-C 3.55Å; T1073-R1076 WeakPolarHBondContact O-CA 3.41Å; T1073-R1076 WeakPolarHBondContact O-CB 3.26Å; T1073-R1076 PolarHBondContact O-N 3.42Å; L1074-R1076 VanDerWaalsContact C-N 3.33Å; L1074-R1076 PolarHBondContact O-N 3.26Å; R1076-K1078 VanDerWaalsContact C-N 3.33Å; R1076-K1078 PolarHBondContact O-N 3.12Å; R1076-K1079 PolarHBondContact O-N 3.34Å; R1076-S1080 WeakPolarHBondContact O-CB 3.2Å; R1076-S1080 PolarHBondContact O-N 3.41Å; R1076-S1080 PolarHBondContact O-OG 2.9Å
1077	L	93.6	Very high	90	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.5	-41.1	175	-76	170.3	0	0	0	111.8	V952 L955 Y1006 Q1009 T1073 L1074 K1079 S1080 L1081 I1113	V952-L1077 HydrophobicContact CG1-CD2 4.18Å; L955-L1077 HydrophobicContact CD2-CD2 4.12Å; Y1006-L1077 HydrophobicContact CD1-CD2 4.09Å; Y1006-L1077 HydrophobicContact CE1-CD2 4.08Å; Q1009-L1077 HydrophobicContact CB-CD1 4.46Å; Q1009-L1077 HydrophobicContact CG-CD1 4.15Å; Q1009-L1077 HydrophobicContact CG-CD2 4.49Å; T1073-L1077 HydrophobicContact CG2-CD1 4.49Å; T1073-L1077 PolarHBondContact O-N 2.69Å; L1074-L1077 HydrophobicContact CD2-CD1 4.26Å; L1074-L1077 WeakPolarHBondContact O-CB 3.33Å; L1074-L1077 PolarHBondContact O-N 3.46Å; L1077-K1079 PolarHBondContact O-N 3.27Å; L1077-S1080 VanDerWaalsContact CA-OG 3.31Å; L1077-S1080 WeakPolarHBondContact CA-OG 3.19Å; L1077-S1080 PolarHBondContact O-N 3.36Å; L1077-S1080 PolarHBondContact O-OG 3.5Å; L1077-L1081 VanDerWaalsContact O-CB 3.24Å; L1077-L1081 WeakPolarHBondContact O-CB 3.39Å; L1077-L1081 PolarHBondContact O-N 3.09Å; L1077-I1113 HydrophobicContact CB-CD1 4.04Å
1078	K	94.1	Very high	90.7	Very high	86 Å²	86	40.8 Å²	40.8	37%	0.374	19%	0.192	S	C	.	.	H	α-helix	trans	-60.1	-47.5	174.7	-168.4	177.1	177.8	176.5	0	111.9	L1074 E1075 R1076 L1081 G1082 I1113	L1074-K1078 PolarHBondContact O-N 2.74Å; E1075-K1078 PolarHBondContact O-N 3.25Å; R1076-K1078 VanDerWaalsContact C-N 3.33Å; R1076-K1078 PolarHBondContact O-N 3.12Å; K1078-L1081 PolarHBondContact O-N 3.03Å; K1078-G1082 PolarHBondContact O-N 2.83Å; K1078-I1113 HydrophobicContact CB-CG2 4.03Å; K1078-I1113 HydrophobicContact CD-CG2 4.37Å; K1078-I1113 HydrophobicContact CG-CG2 4.47Å
1079	K	93.9	Very high	91.1	Very high	126 Å²	126	39 Å²	39	55%	0.548	19%	0.186	S	C	.	.	H	α-helix	trans	-67.2	-40.5	179.9	-174.5	169.8	178.7	179.4	0	111.4	V964 E1075 R1076 L1077 G1082 I1083	V964-K1079 HydrophobicContact CB-CD 4.1Å; V964-K1079 HydrophobicContact CB-CG 4.24Å; V964-K1079 HydrophobicContact CG1-CB 4.31Å; V964-K1079 HydrophobicContact CG1-CG 4.23Å; V964-K1079 HydrophobicContact CG2-CB 4.3Å; V964-K1079 HydrophobicContact CG2-CD 3.89Å; V964-K1079 HydrophobicContact CG2-CG 4.28Å; E1075-K1079 PolarHBondContact O-N 3.49Å; R1076-K1079 PolarHBondContact O-N 3.34Å; L1077-K1079 PolarHBondContact O-N 3.27Å; K1079-G1082 PolarHBondContact O-N 3.04Å; K1079-I1083 PolarHBondContact O-N 2.89Å
1080	S	95.4	Very high	91.5	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-68.1	-36.4	178.5	67	0	0	0	0	112.3	L955 M968 Y1006 R1076 L1077 G1082 I1083 L1084	L955-S1080 WeakPolarHBondContact CD2-OG 3.44Å; M968-S1080 WeakPolarHBondContact CE-O 3.3Å; M968-S1080 WeakPolarHBondContact SD-CA 3.37Å; M968-S1080 WeakPolarHBondContact SD-CB 3.41Å; Y1006-S1080 WeakPolarHBondContact CE1-OG 3Å; Y1006-S1080 VanDerWaalsContact OH-CB 3.25Å; Y1006-S1080 WeakPolarHBondContact OH-CB 3.37Å; Y1006-S1080 PolarHBondContact OH-OG 2.85Å; R1076-S1080 WeakPolarHBondContact O-CB 3.2Å; R1076-S1080 PolarHBondContact O-N 3.41Å; R1076-S1080 PolarHBondContact O-OG 2.9Å; L1077-S1080 VanDerWaalsContact CA-OG 3.31Å; L1077-S1080 WeakPolarHBondContact CA-OG 3.19Å; L1077-S1080 PolarHBondContact O-N 3.36Å; L1077-S1080 PolarHBondContact O-OG 3.5Å; S1080-G1082 VanDerWaalsContact C-N 3.27Å; S1080-G1082 PolarHBondContact O-N 2.94Å; S1080-I1083 PolarHBondContact O-N 3.42Å; S1080-L1084 WeakPolarHBondContact O-CB 3.36Å; S1080-L1084 PolarHBondContact O-N 2.88Å
1081	L	95.2	Very high	91.4	Very high	3 Å²	3	41 Å²	41	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-38.5	174.2	-176.5	64.5	0	0	0	111.6	W999 L1003 Y1006 L1077 K1078 L1084 L1085 Y1106 V1109 K1110	W999-L1081 HydrophobicContact CH2-CD1 4.24Å; L1003-L1081 HydrophobicContact CD2-CD1 3.68Å; Y1006-L1081 HydrophobicContact CD1-CB 4.13Å; Y1006-L1081 HydrophobicContact CD1-CD1 4.03Å; Y1006-L1081 HydrophobicContact CE1-CB 3.85Å; Y1006-L1081 HydrophobicContact CE1-CD1 4.27Å; L1077-L1081 VanDerWaalsContact O-CB 3.24Å; L1077-L1081 WeakPolarHBondContact O-CB 3.39Å; L1077-L1081 PolarHBondContact O-N 3.09Å; K1078-L1081 PolarHBondContact O-N 3.03Å; L1081-L1084 PolarHBondContact O-N 2.93Å; L1081-L1085 PolarHBondContact O-N 2.91Å; L1081-Y1106 HydrophobicContact CD1-CD2 3.93Å; L1081-Y1106 HydrophobicContact CD1-CE2 3.99Å; L1081-Y1106 HydrophobicContact CD2-CD2 4.13Å; L1081-Y1106 HydrophobicContact CD2-CE2 3.88Å; L1081-Y1106 HydrophobicContact CG-CD2 4.05Å; L1081-Y1106 HydrophobicContact CG-CE2 3.66Å; L1081-V1109 HydrophobicContact CD2-CB 4.29Å; L1081-V1109 HydrophobicContact CD2-CG1 3.83Å; L1081-K1110 HydrophobicContact CD2-CB 4.23Å
1082	G	93.5	Very high	90.8	Very high	28 Å²	28	38.4 Å²	38.4	29%	0.289	19%	0.19	S	C	.	.	H	α-helix	trans	-64.8	-44.7	173.3	0	0	0	0	0	113.3	K1078 K1079 S1080 L1084 L1085 E1086	K1078-G1082 PolarHBondContact O-N 2.83Å; K1079-G1082 PolarHBondContact O-N 3.04Å; S1080-G1082 VanDerWaalsContact C-N 3.27Å; S1080-G1082 PolarHBondContact O-N 2.94Å; G1082-L1084 VanDerWaalsContact C-N 3.3Å; G1082-L1084 PolarHBondContact O-N 3.41Å; G1082-L1085 PolarHBondContact O-N 3.44Å; G1082-E1086 PolarHBondContact O-N 3.22Å; G1082-E1086 VanDerWaalsContact O-N 3.1Å
1083	I	93.8	Very high	90	Very high	46 Å²	46	41.1 Å²	41.1	24%	0.236	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-41	175.9	-65.4	167.4	0	0	0	110.6	V964 D965 M968 K1079 S1080 E1086 F1087	V964-I1083 HydrophobicContact CB-CD1 4.47Å; V964-I1083 HydrophobicContact CG1-CD1 3.99Å; D965-I1083 HydrophobicContact CB-CD1 4.34Å; M968-I1083 HydrophobicContact CE-CB 4.28Å; M968-I1083 HydrophobicContact CE-CG2 4.18Å; M968-I1083 HydrophobicContact SD-CB 3.89Å; M968-I1083 HydrophobicContact SD-CD1 3.95Å; M968-I1083 HydrophobicContact SD-CG2 3.93Å; K1079-I1083 PolarHBondContact O-N 2.89Å; S1080-I1083 PolarHBondContact O-N 3.42Å; I1083-E1086 PolarHBondContact O-N 2.97Å; I1083-F1087 WeakPolarHBondContact O-CB 3.3Å; I1083-F1087 PolarHBondContact O-N 3.04Å
1084	L	94.6	Very high	88.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.8	-43.2	179	-163.9	67.2	0	0	0	111.3	M968 L971 I972 L975 W999 C1002 Y1006 S1080 L1081 G1082 E1086 F1087 F1088	M968-L1084 HydrophobicContact CE-CB 4.2Å; M968-L1084 HydrophobicContact CE-CD1 4.36Å; L971-L1084 HydrophobicContact CD2-CD1 4.5Å; I972-L1084 HydrophobicContact CD1-CD1 4.24Å; L975-L1084 HydrophobicContact CD1-CD1 3.74Å; W999-L1084 HydrophobicContact CE3-CD2 4.26Å; W999-L1084 HydrophobicContact CE3-CG 4.36Å; W999-L1084 HydrophobicContact CZ3-CB 4.21Å; W999-L1084 HydrophobicContact CZ3-CD2 3.8Å; W999-L1084 HydrophobicContact CZ3-CG 3.81Å; C1002-L1084 HydrophobicContact CB-CD2 3.72Å; Y1006-L1084 HydrophobicContact CE2-CD2 3.95Å; S1080-L1084 WeakPolarHBondContact O-CB 3.36Å; S1080-L1084 PolarHBondContact O-N 2.88Å; L1081-L1084 PolarHBondContact O-N 2.93Å; G1082-L1084 VanDerWaalsContact C-N 3.3Å; G1082-L1084 PolarHBondContact O-N 3.41Å; L1084-E1086 VanDerWaalsContact C-N 3.35Å; L1084-E1086 PolarHBondContact O-N 3.25Å; L1084-F1087 HydrophobicContact CD1-CD1 4.4Å; L1084-F1087 WeakPolarHBondContact O-CB 3.45Å; L1084-F1087 PolarHBondContact O-N 3.34Å; L1084-F1088 HydrophobicContact CD1-CD2 4.21Å; L1084-F1088 HydrophobicContact CD1-CE2 3.81Å; L1084-F1088 HydrophobicContact CD2-CE2 4.33Å; L1084-F1088 HydrophobicContact CG-CD2 3.94Å; L1084-F1088 HydrophobicContact CG-CE2 3.81Å; L1084-F1088 VanDerWaalsContact O-CD2 3.3Å; L1084-F1088 WeakPolarHBondContact O-CD2 3.41Å; L1084-F1088 PolarHBondContact O-N 3.19Å
1085	L	93.6	Very high	87.9	Confident	13 Å²	13	54 Å²	54	7%	0.068	27%	0.267	C	S	.	.	H	α-helix	trans	-57.5	-46.7	173.8	178	64.7	0	0	0	111.6	W999 L1081 G1082 F1087 F1088 L1089 L1101 Y1106	W999-L1085 HydrophobicContact CH2-CB 4.16Å; W999-L1085 HydrophobicContact CH2-CD1 4.24Å; W999-L1085 HydrophobicContact CZ2-CD1 4.23Å; L1081-L1085 PolarHBondContact O-N 2.91Å; G1082-L1085 PolarHBondContact O-N 3.44Å; L1085-F1087 VanDerWaalsContact C-N 3.32Å; L1085-F1087 PolarHBondContact O-N 3.31Å; L1085-F1088 PolarHBondContact O-N 3.06Å; L1085-L1089 HydrophobicContact CD1-CD1 4.46Å; L1085-L1089 HydrophobicContact CG-CD1 4.18Å; L1085-L1089 WeakPolarHBondContact O-CB 3.32Å; L1085-L1089 WeakPolarHBondContact O-CG 3.47Å; L1085-L1089 PolarHBondContact O-N 3.38Å; L1085-L1101 HydrophobicContact CD1-CB 3.54Å; L1085-L1101 HydrophobicContact CD1-CD1 3.98Å; L1085-L1101 HydrophobicContact CD1-CG 4.41Å; L1085-Y1106 HydrophobicContact CB-CE2 4.39Å; L1085-Y1106 HydrophobicContact CD2-CE2 4.19Å
1086	E	91.5	Very high	87.3	Confident	112 Å²	112	50.6 Å²	50.6	52%	0.523	25%	0.251	S	S	.	.	H	α-helix	trans	-62.6	-37.9	176.1	-71.9	-175.5	-174.2	0	0	112.8	G1082 I1083 L1084 L1089 K1090	G1082-E1086 PolarHBondContact O-N 3.22Å; G1082-E1086 VanDerWaalsContact O-N 3.1Å; I1083-E1086 PolarHBondContact O-N 2.97Å; L1084-E1086 VanDerWaalsContact C-N 3.35Å; L1084-E1086 PolarHBondContact O-N 3.25Å; E1086-L1089 PolarHBondContact O-N 2.99Å; E1086-K1090 WeakPolarHBondContact O-CG 3.48Å; E1086-K1090 PolarHBondContact O-N 3.44Å
1087	F	93.5	Very high	86.9	Confident	21 Å²	21	52.8 Å²	52.8	9%	0.092	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-48	176.1	167.1	-94.6	0	0	0	111.5	I972 L975 D976 I979 I1083 L1084 L1085 K1090 N1091	I972-F1087 HydrophobicContact CD1-CB 3.98Å; I972-F1087 HydrophobicContact CD1-CD1 4.31Å; I972-F1087 HydrophobicContact CD1-CD2 3.89Å; I972-F1087 HydrophobicContact CD1-CE2 4.48Å; I972-F1087 HydrophobicContact CD1-CG 3.79Å; I972-F1087 HydrophobicContact CG2-CD2 3.91Å; I972-F1087 HydrophobicContact CG2-CE2 3.93Å; L975-F1087 HydrophobicContact CB-CE1 3.69Å; L975-F1087 HydrophobicContact CB-CZ 3.69Å; L975-F1087 HydrophobicContact CD1-CE1 4.15Å; D976-F1087 HydrophobicContact CB-CE2 4.03Å; D976-F1087 HydrophobicContact CB-CZ 4.22Å; I979-F1087 HydrophobicContact CD1-CE1 3.67Å; I979-F1087 HydrophobicContact CD1-CZ 3.93Å; I1083-F1087 WeakPolarHBondContact O-CB 3.3Å; I1083-F1087 PolarHBondContact O-N 3.04Å; L1084-F1087 HydrophobicContact CD1-CD1 4.4Å; L1084-F1087 WeakPolarHBondContact O-CB 3.45Å; L1084-F1087 PolarHBondContact O-N 3.34Å; L1085-F1087 VanDerWaalsContact C-N 3.32Å; L1085-F1087 PolarHBondContact O-N 3.31Å; F1087-K1090 PolarHBondContact O-N 3.31Å; F1087-N1091 WeakPolarHBondContact CE2-ND2 3.3Å; F1087-N1091 WeakPolarHBondContact CZ-ND2 3.37Å; F1087-N1091 WeakPolarHBondContact O-CB 3.44Å; F1087-N1091 PolarHBondContact O-N 3.42Å
1088	F	93.1	Very high	86.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68.1	-35.6	178.7	-83.5	-78.4	0	0	0	112.7	L975 I979 I995 I998 W999 L1084 L1085 N1091 G1092 L1101	L975-F1088 HydrophobicContact CD1-CE2 4.25Å; L975-F1088 HydrophobicContact CD1-CZ 4.31Å; I979-F1088 HydrophobicContact CD1-CD1 4.36Å; I979-F1088 HydrophobicContact CD1-CE1 3.86Å; I979-F1088 HydrophobicContact CD1-CZ 4.45Å; I995-F1088 HydrophobicContact CG2-CD1 3.53Å; I995-F1088 HydrophobicContact CG2-CE1 3.92Å; I998-F1088 HydrophobicContact CG2-CE1 4.32Å; I998-F1088 HydrophobicContact CG2-CZ 4.01Å; W999-F1088 HydrophobicContact CB-CD1 4.29Å; W999-F1088 HydrophobicContact CB-CE1 4.14Å; W999-F1088 HydrophobicContact CB-CZ 4.28Å; W999-F1088 HydrophobicContact CD2-CD2 4.33Å; W999-F1088 AromaticContact CE3-CD2 3.38Å; W999-F1088 HydrophobicContact CE3-CD2 3.38Å; W999-F1088 AromaticContact CE3-CE2 3.66Å; W999-F1088 HydrophobicContact CE3-CE2 3.66Å; W999-F1088 HydrophobicContact CE3-CG 4.05Å; W999-F1088 HydrophobicContact CE3-CZ 4.49Å; W999-F1088 AromaticContact CZ3-CD2 3.88Å; W999-F1088 HydrophobicContact CZ3-CD2 3.88Å; W999-F1088 HydrophobicContact CZ3-CE2 4.34Å; L1084-F1088 HydrophobicContact CD1-CD2 4.21Å; L1084-F1088 HydrophobicContact CD1-CE2 3.81Å; L1084-F1088 HydrophobicContact CD2-CE2 4.33Å; L1084-F1088 HydrophobicContact CG-CD2 3.94Å; L1084-F1088 HydrophobicContact CG-CE2 3.81Å; L1084-F1088 VanDerWaalsContact O-CD2 3.3Å; L1084-F1088 WeakPolarHBondContact O-CD2 3.41Å; L1084-F1088 PolarHBondContact O-N 3.19Å; L1085-F1088 PolarHBondContact O-N 3.06Å; F1088-N1091 PolarHBondContact O-N 3.25Å; F1088-G1092 PolarHBondContact O-N 3.25Å; F1088-L1101 HydrophobicContact CB-CD1 3.79Å; F1088-L1101 HydrophobicContact CB-CD2 4.18Å
1089	L	89	Confident	85.9	Confident	52 Å²	52	57 Å²	57	27%	0.272	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-47.5	172.6	-77.7	170.6	0	0	0	112	L1085 E1086 N1091 G1092 K1098 L1101	L1085-L1089 HydrophobicContact CD1-CD1 4.46Å; L1085-L1089 HydrophobicContact CG-CD1 4.18Å; L1085-L1089 WeakPolarHBondContact O-CB 3.32Å; L1085-L1089 WeakPolarHBondContact O-CG 3.47Å; L1085-L1089 PolarHBondContact O-N 3.38Å; E1086-L1089 PolarHBondContact O-N 2.99Å; L1089-N1091 VanDerWaalsContact C-N 3.32Å; L1089-N1091 PolarHBondContact O-N 3.5Å; L1089-G1092 PolarHBondContact O-N 3.03Å; L1089-K1098 HydrophobicContact CD2-CB 4.15Å; L1089-L1101 HydrophobicContact CD2-CD1 3.81Å; L1089-L1101 HydrophobicContact CG-CD1 3.8Å
1090	K	87.3	Confident	85.5	Confident	151 Å²	151	53 Å²	53	66%	0.657	29%	0.292	S	S	*	.	H	α-helix	trans	-64	-38.8	177.8	-73	171.2	-175.1	168.2	0	111.9	E1086 F1087 G1092	E1086-K1090 WeakPolarHBondContact O-CG 3.48Å; E1086-K1090 PolarHBondContact O-N 3.44Å; F1087-K1090 PolarHBondContact O-N 3.31Å; K1090-G1092 VanDerWaalsContact C-N 3.29Å; K1090-G1092 PolarHBondContact O-N 3.02Å
1091	N	83.7	Confident	85.1	Confident	21 Å²	21	53 Å²	53	11%	0.112	29%	0.292	C	S	.	.	H	α-helix	trans	-78.8	-9.5	179.5	-89.7	-54.6	0	0	0	114.1	I979 K983 F1087 F1088 L1089 D1093	I979-N1091 HydrophobicContact CG2-CB 4.12Å; K983-N1091 WeakPolarHBondContact CE-O 3.45Å; K983-N1091 PolarHBondContact NZ-O 3.03Å; K983-N1091 PolarHBondContact NZ-OD1 3.18Å; F1087-N1091 WeakPolarHBondContact CE2-ND2 3.3Å; F1087-N1091 WeakPolarHBondContact CZ-ND2 3.37Å; F1087-N1091 WeakPolarHBondContact O-CB 3.44Å; F1087-N1091 PolarHBondContact O-N 3.42Å; F1088-N1091 PolarHBondContact O-N 3.25Å; L1089-N1091 VanDerWaalsContact C-N 3.32Å; L1089-N1091 PolarHBondContact O-N 3.5Å; N1091-D1093 VanDerWaalsContact C-N 3.29Å; N1091-D1093 PolarHBondContact O-N 2.92Å
1092	G	73.4	Confident	84.8	Confident	6 Å²	6	56 Å²	56	6%	0.062	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-5.2	174.7	0	0	0	0	0	115.6	F1088 L1089 K1090 D1094 Q1095	F1088-G1092 PolarHBondContact O-N 3.25Å; L1089-G1092 PolarHBondContact O-N 3.03Å; K1090-G1092 VanDerWaalsContact C-N 3.29Å; K1090-G1092 PolarHBondContact O-N 3.02Å; G1092-D1094 VanDerWaalsContact C-N 3.31Å; G1092-D1094 PolarHBondContact O-N 3.25Å; G1092-Q1095 WeakPolarHBondContact O-CB 3.39Å; G1092-Q1095 PolarHBondContact O-N 3.31Å
1093	D	68.6	Low	84.6	Confident	93 Å²	93	55.9 Å²	55.9	50%	0.497	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.6	51.4	-177.5	-61.6	-24	0	0	0	112.9	K983 N1091 Q1095	K983-D1093 IonicContact NZ-OD1 3.3Å; K983-D1093 PolarHBondContact NZ-OD1 2.99Å; K983-D1093 IonicContact NZ-OD2 3.62Å; K983-D1093 PolarHBondContact NZ-OD2 3.39Å; N1091-D1093 VanDerWaalsContact C-N 3.29Å; N1091-D1093 PolarHBondContact O-N 2.92Å; D1093-Q1095 PolarHBondContact O-N 3.37Å
1094	D	66.9	Low	84.3	Confident	168 Å²	168	60.5 Å²	60.5	90%	0.898	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	-2.9	-176.2	-58.7	-34.7	0	0	0	116.4	G1092	G1092-D1094 VanDerWaalsContact C-N 3.31Å; G1092-D1094 PolarHBondContact O-N 3.25Å
1095	Q	69.3	Low	84	Confident	109 Å²	109	64.7 Å²	64.7	51%	0.509	34%	0.339	S	S	.	.			trans	-82.1	-23.5	177.5	-58.2	-173.6	15.2	0	0	113	G1092 D1093	G1092-Q1095 WeakPolarHBondContact O-CB 3.39Å; G1092-Q1095 PolarHBondContact O-N 3.31Å; D1093-Q1095 PolarHBondContact O-N 3.37Å
1096	I	78.1	Confident	84	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.041	34%	0.339	C	S	.	.	S	Bend	trans	-96.9	106.4	177.9	-54.8	-177.2	0	0	0	108.6	H992 I995 L996 L1101	H992-I1096 WeakPolarHBondContact ND1-CG1 3.18Å; I995-I1096 HydrophobicContact CB-CD1 3.88Å; I995-I1096 HydrophobicContact CD1-CD1 3.96Å; I995-I1096 HydrophobicContact CG2-CD1 3.37Å; L996-I1096 HydrophobicContact CD2-CG2 4.44Å; I1096-L1101 HydrophobicContact CG2-CD1 3.81Å; I1096-L1101 HydrophobicContact CG2-CD2 3.97Å; I1096-L1101 HydrophobicContact CG2-CG 3.6Å
1097	S	83	Confident	84	Confident	65 Å²	65	62.9 Å²	62.9	46%	0.455	33%	0.332	S	S	.	.			trans	-68.1	152.1	174.5	82.7	0	0	0	0	110.8	G1099 S1100	S1097-G1099 PolarHBondContact O-N 3.46Å; S1097-G1099 PolarHBondContact OG-N 3.1Å; S1097-S1100 WeakPolarHBondContact O-CB 3.07Å; S1097-S1100 PolarHBondContact O-N 3.02Å; S1097-S1100 PolarHBondContact OG-N 2.85Å; S1097-S1100 PolarHBondContact OG-OG 3.34Å
1098	K	83.5	Confident	83.9	Confident	118 Å²	118	64.3 Å²	64.3	51%	0.513	34%	0.341	S	S	.	.	H	α-helix	trans	-55.4	-37.9	172.5	-175.4	174.9	169.8	179.7	0	112.6	L1089 S1100 L1101 E1102	L1089-K1098 HydrophobicContact CD2-CB 4.15Å; K1098-S1100 PolarHBondContact O-N 2.86Å; K1098-L1101 PolarHBondContact O-N 2.76Å; K1098-E1102 WeakPolarHBondContact CE-OE1 3.31Å; K1098-E1102 HydrophobicContact CG-CG 4.22Å; K1098-E1102 IonicContact NZ-OE1 2.83Å; K1098-E1102 PolarHBondContact O-N 3.08Å
1099	G	83.6	Confident	83.9	Confident	57 Å²	57	64.3 Å²	64.3	59%	0.588	34%	0.341	S	S	*	.	H	α-helix	trans	-64.9	-23.9	175.6	0	0	0	0	0	114.3	S1097 L1101	S1097-G1099 PolarHBondContact O-N 3.46Å; S1097-G1099 PolarHBondContact OG-N 3.1Å; G1099-L1101 VanDerWaalsContact C-N 3.35Å
1100	S	84.2	Confident	84.1	Confident	42 Å²	42	66.2 Å²	66.2	29%	0.294	35%	0.347	S	S	.	.	H	α-helix	trans	-76.2	-21.9	176.2	-54.4	0	0	0	0	113.1	S1097 K1098 T1103	S1097-S1100 WeakPolarHBondContact O-CB 3.07Å; S1097-S1100 PolarHBondContact O-N 3.02Å; S1097-S1100 PolarHBondContact OG-N 2.85Å; S1097-S1100 PolarHBondContact OG-OG 3.34Å; K1098-S1100 PolarHBondContact O-N 2.86Å; S1100-T1103 WeakPolarHBondContact O-CG2 3.26Å
1101	L	88.4	Confident	84.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-100	-28.1	178.9	-66.2	171.6	0	0	0	112.7	L996 W999 L1085 F1088 L1089 I1096 K1098 G1099 T1103	L996-L1101 HydrophobicContact CD2-CD2 3.86Å; W999-L1101 HydrophobicContact CB-CD2 4.23Å; W999-L1101 HydrophobicContact CD2-CD2 4.09Å; W999-L1101 HydrophobicContact CG-CD2 3.76Å; W999-L1101 HydrophobicContact CZ2-CB 4.42Å; W999-L1101 WeakPolarHBondContact CZ2-O 3.17Å; W999-L1101 PolarHBondContact NE1-O 2.65Å; L1085-L1101 HydrophobicContact CD1-CB 3.54Å; L1085-L1101 HydrophobicContact CD1-CD1 3.98Å; L1085-L1101 HydrophobicContact CD1-CG 4.41Å; F1088-L1101 HydrophobicContact CB-CD1 3.79Å; F1088-L1101 HydrophobicContact CB-CD2 4.18Å; L1089-L1101 HydrophobicContact CD2-CD1 3.81Å; L1089-L1101 HydrophobicContact CG-CD1 3.8Å; I1096-L1101 HydrophobicContact CG2-CD1 3.81Å; I1096-L1101 HydrophobicContact CG2-CD2 3.97Å; I1096-L1101 HydrophobicContact CG2-CG 3.6Å; K1098-L1101 PolarHBondContact O-N 2.76Å; G1099-L1101 VanDerWaalsContact C-N 3.35Å; L1101-T1103 PolarHBondContact O-N 3.46Å
1102	E	87.9	Confident	84.7	Confident	67 Å²	67	59.8 Å²	59.8	31%	0.313	32%	0.317	S	S	.	.	S	Bend	trans	-76.2	53.6	173.4	-67.3	-175.9	150.2	0	0	111.5	K1098 Y1106 N1107	K1098-E1102 WeakPolarHBondContact CE-OE1 3.31Å; K1098-E1102 HydrophobicContact CG-CG 4.22Å; K1098-E1102 IonicContact NZ-OE1 2.83Å; K1098-E1102 PolarHBondContact O-N 3.08Å; E1102-Y1106 HydrophobicContact CB-CD1 4.18Å; E1102-Y1106 HydrophobicContact CG-CD1 4.12Å; E1102-Y1106 HydrophobicContact CG-CE1 3.98Å; E1102-N1107 PolarHBondContact O-ND2 3.14Å
1103	T	89.5	Confident	85.6	Confident	25 Å²	25	59.5 Å²	59.5	15%	0.153	31%	0.314	C	S	.	.			trans	-68.1	169.9	179.2	72.3	0	0	0	0	111.5	S1100 L1101 E1105 Y1106 N1107	S1100-T1103 WeakPolarHBondContact O-CG2 3.26Å; L1101-T1103 PolarHBondContact O-N 3.46Å; T1103-E1105 WeakPolarHBondContact CB-OE2 3.45Å; T1103-E1105 PolarHBondContact O-N 2.77Å; T1103-E1105 PolarHBondContact OG1-OE2 3.2Å; T1103-Y1106 WeakPolarHBondContact O-CB 3.39Å; T1103-Y1106 PolarHBondContact O-N 3.5Å; T1103-Y1106 PolarHBondContact OG1-N 2.69Å; T1103-N1107 PolarHBondContact O-N 3.07Å; T1103-N1107 VanDerWaalsContact O-N 3.09Å; T1103-N1107 PolarHBondContact O-ND2 2.86Å
1104	E	87	Confident	86.7	Confident	142 Å²	142	58.7 Å²	58.7	66%	0.664	31%	0.308	S	S	*	.	H	α-helix	trans	-57.2	-40.6	175.7	-169.6	178.3	165	0	0	111.4	Y1106 N1107 N1108	E1104-Y1106 PolarHBondContact O-N 3.11Å; E1104-N1107 PolarHBondContact O-N 3.31Å; E1104-N1108 WeakPolarHBondContact O-CB 3.41Å; E1104-N1108 PolarHBondContact O-N 2.94Å; E1104-N1108 PolarHBondContact O-ND2 3.35Å; E1104-N1108 PolarHBondContact O-OD1 3.03Å
1105	E	89.7	Confident	87.8	Confident	89 Å²	89	50.8 Å²	50.8	42%	0.416	27%	0.265	S	S	.	.	H	α-helix	trans	-63.5	-40.3	177.9	-55.6	80.3	-176.5	0	0	112.3	H1000 L1003 T1103 N1107 N1108 V1109	H1000-E1105 IonicContact CE1-OE2 2.87Å; H1000-E1105 PolarHBondContact CE1-OE2 3.07Å; H1000-E1105 IonicContact ND1-OE2 2.86Å; L1003-E1105 HydrophobicContact CB-CB 4.44Å; L1003-E1105 HydrophobicContact CD1-CB 3.98Å; T1103-E1105 WeakPolarHBondContact CB-OE2 3.45Å; T1103-E1105 PolarHBondContact O-N 2.77Å; T1103-E1105 PolarHBondContact OG1-OE2 3.2Å; E1105-N1107 VanDerWaalsContact C-N 3.35Å; E1105-N1108 PolarHBondContact O-N 2.81Å; E1105-V1109 WeakPolarHBondContact O-CG2 3.28Å; E1105-V1109 PolarHBondContact O-N 3.05Å
1106	Y	94	Very high	88.8	Confident	15 Å²	15	45.6 Å²	45.6	6%	0.059	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-46.7	175.4	168.5	-96.6	0	0	0	111.1	W999 L1003 L1081 L1085 E1102 T1103 E1104 N1108 V1109 K1110	W999-Y1106 AromaticContact CH2-CD2 3.66Å; W999-Y1106 HydrophobicContact CH2-CD2 3.66Å; W999-Y1106 HydrophobicContact CH2-CE2 4.08Å; W999-Y1106 AromaticContact CZ2-CD2 3.43Å; W999-Y1106 HydrophobicContact CZ2-CD2 3.43Å; W999-Y1106 VanDerWaalsContact CZ2-CD2 3.43Å; W999-Y1106 HydrophobicContact CZ2-CE2 4.19Å; W999-Y1106 HydrophobicContact CZ2-CG 4.02Å; L1003-Y1106 HydrophobicContact CD2-CD2 4.14Å; L1081-Y1106 HydrophobicContact CD1-CD2 3.93Å; L1081-Y1106 HydrophobicContact CD1-CE2 3.99Å; L1081-Y1106 HydrophobicContact CD2-CD2 4.13Å; L1081-Y1106 HydrophobicContact CD2-CE2 3.88Å; L1081-Y1106 HydrophobicContact CG-CD2 4.05Å; L1081-Y1106 HydrophobicContact CG-CE2 3.66Å; L1085-Y1106 HydrophobicContact CB-CE2 4.39Å; L1085-Y1106 HydrophobicContact CD2-CE2 4.19Å; E1102-Y1106 HydrophobicContact CB-CD1 4.18Å; E1102-Y1106 HydrophobicContact CG-CD1 4.12Å; E1102-Y1106 HydrophobicContact CG-CE1 3.98Å; T1103-Y1106 WeakPolarHBondContact O-CB 3.39Å; T1103-Y1106 PolarHBondContact O-N 3.5Å; T1103-Y1106 PolarHBondContact OG1-N 2.69Å; E1104-Y1106 PolarHBondContact O-N 3.11Å; Y1106-N1108 VanDerWaalsContact C-N 3.32Å; Y1106-V1109 PolarHBondContact O-N 2.95Å; Y1106-K1110 HydrophobicContact CE1-CD 4.35Å; Y1106-K1110 WeakPolarHBondContact O-CB 3.49Å; Y1106-K1110 PolarHBondContact O-N 3.34Å; Y1106-K1110 VanDerWaalsContact O-N 3.08Å
1107	N	91.2	Very high	89.3	Confident	72 Å²	72	45.8 Å²	45.8	39%	0.385	24%	0.242	S	C	.	.	H	α-helix	trans	-65.7	-37.9	178.6	-69.4	-48.7	0	0	0	111.2	E1102 T1103 E1104 E1105 K1110 Y1111	E1102-N1107 PolarHBondContact O-ND2 3.14Å; T1103-N1107 PolarHBondContact O-N 3.07Å; T1103-N1107 VanDerWaalsContact O-N 3.09Å; T1103-N1107 PolarHBondContact O-ND2 2.86Å; E1104-N1107 PolarHBondContact O-N 3.31Å; E1105-N1107 VanDerWaalsContact C-N 3.35Å; N1107-K1110 PolarHBondContact O-N 3.29Å; N1107-Y1111 WeakPolarHBondContact O-CB 3.45Å; N1107-Y1111 PolarHBondContact O-N 3.27Å
1108	N	90.7	Very high	89.6	Confident	50 Å²	50	43.4 Å²	43.4	27%	0.267	23%	0.226	S	C	.	.	H	α-helix	trans	-63.5	-45.4	176.9	-71.4	-15.2	0	0	0	111.9	E1104 E1105 Y1106 K1110 Y1111 L1112	E1104-N1108 WeakPolarHBondContact O-CB 3.41Å; E1104-N1108 PolarHBondContact O-N 2.94Å; E1104-N1108 PolarHBondContact O-ND2 3.35Å; E1104-N1108 PolarHBondContact O-OD1 3.03Å; E1105-N1108 PolarHBondContact O-N 2.81Å; Y1106-N1108 VanDerWaalsContact C-N 3.32Å; N1108-K1110 PolarHBondContact O-N 3.03Å; N1108-Y1111 PolarHBondContact O-N 3.32Å; N1108-L1112 VanDerWaalsContact O-CB 3.23Å; N1108-L1112 WeakPolarHBondContact O-CB 3.43Å; N1108-L1112 PolarHBondContact O-N 2.89Å
1109	V	92.5	Very high	89.8	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-59.5	-50.2	174.8	174.1	0	0	0	0	110.3	M1007 L1081 E1105 Y1106 Y1111 L1112 I1113	M1007-V1109 HydrophobicContact CB-CG2 3.82Å; M1007-V1109 HydrophobicContact CG-CG2 4.42Å; M1007-V1109 HydrophobicContact SD-CG2 3.86Å; L1081-V1109 HydrophobicContact CD2-CB 4.29Å; L1081-V1109 HydrophobicContact CD2-CG1 3.83Å; E1105-V1109 WeakPolarHBondContact O-CG2 3.28Å; E1105-V1109 PolarHBondContact O-N 3.05Å; Y1106-V1109 PolarHBondContact O-N 2.95Å; V1109-Y1111 VanDerWaalsContact C-N 3.31Å; V1109-Y1111 PolarHBondContact O-N 2.92Å; V1109-L1112 PolarHBondContact O-N 3.31Å; V1109-I1113 HydrophobicContact CG1-CD1 3.9Å; V1109-I1113 VanDerWaalsContact O-CG1 3.26Å; V1109-I1113 WeakPolarHBondContact O-CG1 3.29Å; V1109-I1113 PolarHBondContact O-N 3.26Å
1110	K	92.8	Very high	90	Very high	91 Å²	91	35.4 Å²	35.4	40%	0.396	18%	0.175	S	C	.	.	H	α-helix	trans	-60.9	-41.9	-179	-178	-179	175.9	-175.7	0	112	L1081 Y1106 N1107 N1108 Q1114	L1081-K1110 HydrophobicContact CD2-CB 4.23Å; Y1106-K1110 HydrophobicContact CE1-CD 4.35Å; Y1106-K1110 WeakPolarHBondContact O-CB 3.49Å; Y1106-K1110 PolarHBondContact O-N 3.34Å; Y1106-K1110 VanDerWaalsContact O-N 3.08Å; N1107-K1110 PolarHBondContact O-N 3.29Å; N1108-K1110 PolarHBondContact O-N 3.03Å; K1110-Q1114 PolarHBondContact O-N 2.87Å
1111	Y	92.3	Very high	90.3	Very high	38 Å²	38	34.9 Å²	34.9	15%	0.149	17%	0.171	C	C	.	.	H	α-helix	trans	-69.8	-44.5	-179.3	-176.9	-125.8	0	0	0	111.6	N1107 N1108 V1109 I1113 Q1114 L1115 Q1126 E1130	N1107-Y1111 WeakPolarHBondContact O-CB 3.45Å; N1107-Y1111 PolarHBondContact O-N 3.27Å; N1108-Y1111 PolarHBondContact O-N 3.32Å; V1109-Y1111 VanDerWaalsContact C-N 3.31Å; V1109-Y1111 PolarHBondContact O-N 2.92Å; Y1111-I1113 PolarHBondContact O-N 3.35Å; Y1111-Q1114 WeakPolarHBondContact O-CA 3.42Å; Y1111-Q1114 VanDerWaalsContact O-CB 3.31Å; Y1111-Q1114 WeakPolarHBondContact O-CB 3.4Å; Y1111-Q1114 PolarHBondContact O-N 3.15Å; Y1111-L1115 HydrophobicContact CD1-CD1 4.1Å; Y1111-L1115 HydrophobicContact CD2-CG 4.43Å; Y1111-L1115 HydrophobicContact CE1-CD1 3.59Å; Y1111-L1115 HydrophobicContact CE1-CG 4.2Å; Y1111-L1115 HydrophobicContact CE2-CD1 4.29Å; Y1111-L1115 HydrophobicContact CE2-CD2 3.92Å; Y1111-L1115 HydrophobicContact CE2-CG 4.01Å; Y1111-L1115 WeakPolarHBondContact O-CG 3.38Å; Y1111-L1115 PolarHBondContact O-N 3.06Å; Y1111-Q1126 HydrophobicContact CE2-CG 3.78Å; Y1111-Q1126 WeakPolarHBondContact OH-CG 3.42Å; Y1111-E1130 WeakPolarHBondContact CE1-OE1 3.29Å; Y1111-E1130 PolarHBondContact OH-OE1 3.18Å
1112	L	91.9	Very high	90.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-42.1	177.7	-175.1	59.2	0	0	0	112.1	M1007 T1010 I1011 N1108 V1109 Q1114 L1115 Y1116 Y1304 I1309	M1007-L1112 HydrophobicContact CE-CD2 3.39Å; M1007-L1112 HydrophobicContact SD-CD2 3.84Å; T1010-L1112 HydrophobicContact CG2-CB 4.28Å; T1010-L1112 HydrophobicContact CG2-CD2 3.94Å; T1010-L1112 HydrophobicContact CG2-CG 3.92Å; I1011-L1112 HydrophobicContact CG1-CD2 3.79Å; N1108-L1112 VanDerWaalsContact O-CB 3.23Å; N1108-L1112 WeakPolarHBondContact O-CB 3.43Å; N1108-L1112 PolarHBondContact O-N 2.89Å; V1109-L1112 PolarHBondContact O-N 3.31Å; L1112-Q1114 VanDerWaalsContact C-N 3.26Å; L1112-Q1114 PolarHBondContact O-N 3.2Å; L1112-L1115 PolarHBondContact O-N 2.69Å; L1112-Y1116 HydrophobicContact CD1-CD1 4.39Å; L1112-Y1116 HydrophobicContact CD1-CD2 4.34Å; L1112-Y1116 HydrophobicContact CD1-CE1 3.91Å; L1112-Y1116 HydrophobicContact CD1-CE2 3.87Å; L1112-Y1116 HydrophobicContact CD2-CE2 3.88Å; L1112-Y1116 HydrophobicContact CG-CD2 4.06Å; L1112-Y1116 HydrophobicContact CG-CE2 3.59Å; L1112-Y1116 PolarHBondContact O-N 3.4Å; L1112-Y1304 HydrophobicContact CD2-CD1 4.39Å; L1112-I1309 HydrophobicContact CD1-CD1 3.61Å; L1112-I1309 HydrophobicContact CD1-CG1 4.34Å
1113	I	92.1	Very high	90.7	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.6	-42.7	172.6	-70.2	169.6	0	0	0	111	T1010 L1074 L1077 K1078 V1109 Y1111 N1117	T1010-I1113 HydrophobicContact CG2-CG1 3.54Å; L1074-I1113 HydrophobicContact CB-CG2 4.22Å; L1074-I1113 HydrophobicContact CD2-CG1 4.39Å; L1077-I1113 HydrophobicContact CB-CD1 4.04Å; K1078-I1113 HydrophobicContact CB-CG2 4.03Å; K1078-I1113 HydrophobicContact CD-CG2 4.37Å; K1078-I1113 HydrophobicContact CG-CG2 4.47Å; V1109-I1113 HydrophobicContact CG1-CD1 3.9Å; V1109-I1113 VanDerWaalsContact O-CG1 3.26Å; V1109-I1113 WeakPolarHBondContact O-CG1 3.29Å; V1109-I1113 PolarHBondContact O-N 3.26Å; Y1111-I1113 PolarHBondContact O-N 3.35Å; I1113-N1117 WeakPolarHBondContact O-CB 3.2Å; I1113-N1117 PolarHBondContact O-N 2.95Å
1114	Q	91.8	Very high	90.9	Very high	76 Å²	76	33.9 Å²	33.9	36%	0.355	16%	0.164	S	C	.	.	H	α-helix	trans	-61.9	-48	176.3	173.9	-176.3	-21.3	0	0	111.1	K1110 Y1111 L1112 Y1116 N1117 S1118	K1110-Q1114 PolarHBondContact O-N 2.87Å; Y1111-Q1114 WeakPolarHBondContact O-CA 3.42Å; Y1111-Q1114 VanDerWaalsContact O-CB 3.31Å; Y1111-Q1114 WeakPolarHBondContact O-CB 3.4Å; Y1111-Q1114 PolarHBondContact O-N 3.15Å; L1112-Q1114 VanDerWaalsContact C-N 3.26Å; L1112-Q1114 PolarHBondContact O-N 3.2Å; Q1114-Y1116 PolarHBondContact O-N 3.23Å; Q1114-N1117 PolarHBondContact O-N 3.02Å; Q1114-S1118 PolarHBondContact O-N 2.95Å; Q1114-S1118 VanDerWaalsContact O-N 3.13Å; Q1114-S1118 PolarHBondContact O-OG 2.98Å
1115	L	90.9	Very high	91.2	Very high	1 Å²	1	29 Å²	29	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-42.4	-178.4	-67	-176.8	0	0	0	113.2	Y1111 L1112 N1117 S1118 V1123 Q1126 A1306 I1309 R1313	Y1111-L1115 HydrophobicContact CD1-CD1 4.1Å; Y1111-L1115 HydrophobicContact CD2-CG 4.43Å; Y1111-L1115 HydrophobicContact CE1-CD1 3.59Å; Y1111-L1115 HydrophobicContact CE1-CG 4.2Å; Y1111-L1115 HydrophobicContact CE2-CD1 4.29Å; Y1111-L1115 HydrophobicContact CE2-CD2 3.92Å; Y1111-L1115 HydrophobicContact CE2-CG 4.01Å; Y1111-L1115 WeakPolarHBondContact O-CG 3.38Å; Y1111-L1115 PolarHBondContact O-N 3.06Å; L1112-L1115 PolarHBondContact O-N 2.69Å; L1115-N1117 VanDerWaalsContact C-N 3.3Å; L1115-N1117 PolarHBondContact O-N 3.44Å; L1115-S1118 PolarHBondContact O-N 2.86Å; L1115-V1123 HydrophobicContact CD2-CG1 4.29Å; L1115-V1123 HydrophobicContact CD2-CG2 4.3Å; L1115-Q1126 HydrophobicContact CD2-CB 4.41Å; L1115-Q1126 HydrophobicContact CD2-CG 4Å; L1115-A1306 HydrophobicContact CD2-CB 4.29Å; L1115-I1309 HydrophobicContact CB-CG1 4.07Å; L1115-I1309 HydrophobicContact CB-CG2 4.42Å; L1115-I1309 HydrophobicContact CD1-CB 4.47Å; L1115-I1309 HydrophobicContact CD1-CG1 3.66Å; L1115-R1313 PolarHBondContact O-NH2 3.19Å
1116	Y	89.4	Confident	91.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.3	-35.6	176	-70.9	-31.6	0	0	0	112.4	T1010 E1015 I1043 L1046 L1074 L1112 Q1114 S1118 I1309	T1010-Y1116 HydrophobicContact CG2-CD2 3.92Å; T1010-Y1116 HydrophobicContact CG2-CE2 3.8Å; T1010-Y1116 VanDerWaalsContact O-CE2 3.29Å; T1010-Y1116 WeakPolarHBondContact O-CE2 3.27Å; E1015-Y1116 HydrophobicContact CG-CE1 4.27Å; E1015-Y1116 PolarHBondContact OE1-OH 2.97Å; I1043-Y1116 HydrophobicContact CD1-CD1 4.01Å; I1043-Y1116 HydrophobicContact CD1-CE1 3.44Å; I1043-Y1116 VanDerWaalsContact CD1-CE1 3.44Å; I1043-Y1116 HydrophobicContact CG1-CD1 4.44Å; I1043-Y1116 HydrophobicContact CG1-CE1 3.95Å; I1043-Y1116 HydrophobicContact CG2-CD1 4.06Å; I1043-Y1116 HydrophobicContact CG2-CE1 4.41Å; L1046-Y1116 WeakPolarHBondContact CB-O 3.43Å; L1046-Y1116 WeakPolarHBondContact CG-O 3.12Å; L1074-Y1116 HydrophobicContact CD1-CD2 4.16Å; L1074-Y1116 HydrophobicContact CD1-CG 4.34Å; L1074-Y1116 HydrophobicContact CD2-CD2 4.34Å; L1112-Y1116 HydrophobicContact CD1-CD1 4.39Å; L1112-Y1116 HydrophobicContact CD1-CD2 4.34Å; L1112-Y1116 HydrophobicContact CD1-CE1 3.91Å; L1112-Y1116 HydrophobicContact CD1-CE2 3.87Å; L1112-Y1116 HydrophobicContact CD2-CE2 3.88Å; L1112-Y1116 HydrophobicContact CG-CD2 4.06Å; L1112-Y1116 HydrophobicContact CG-CE2 3.59Å; L1112-Y1116 PolarHBondContact O-N 3.4Å; Q1114-Y1116 PolarHBondContact O-N 3.23Å; Y1116-S1118 VanDerWaalsContact C-N 3.29Å; Y1116-S1118 PolarHBondContact O-N 3.47Å; Y1116-I1309 HydrophobicContact CD1-CD1 4.25Å; Y1116-I1309 HydrophobicContact CE1-CD1 3.72Å
1117	N	89.1	Confident	91.3	Very high	13 Å²	13	26.1 Å²	26.1	7%	0.07	13%	0.129	C	C	.	.	H	α-helix	trans	-78.5	-10.8	178.9	-80.3	-13.9	0	0	0	114.1	L1074 E1075 I1113 Q1114 L1115	L1074-N1117 WeakPolarHBondContact CD1-OD1 3.39Å; E1075-N1117 PolarHBondContact OE1-ND2 2.92Å; I1113-N1117 WeakPolarHBondContact O-CB 3.2Å; I1113-N1117 PolarHBondContact O-N 2.95Å; Q1114-N1117 PolarHBondContact O-N 3.02Å; L1115-N1117 VanDerWaalsContact C-N 3.3Å; L1115-N1117 PolarHBondContact O-N 3.44Å
1118	S	88.8	Confident	91.4	Very high	15 Å²	15	22.7 Å²	22.7	11%	0.105	11%	0.11	C	C	.	.	S	Bend	trans	-87.8	150	-175.5	-87.9	0	0	0	0	113.9	Q1114 L1115 Y1116 E1122 R1313	Q1114-S1118 PolarHBondContact O-N 2.95Å; Q1114-S1118 VanDerWaalsContact O-N 3.13Å; Q1114-S1118 PolarHBondContact O-OG 2.98Å; L1115-S1118 PolarHBondContact O-N 2.86Å; Y1116-S1118 VanDerWaalsContact C-N 3.29Å; Y1116-S1118 PolarHBondContact O-N 3.47Å; S1118-E1122 WeakPolarHBondContact CA-OE2 3.39Å; S1118-E1122 WeakPolarHBondContact CB-OE2 3.46Å; S1118-E1122 PolarHBondContact OG-OE2 2.93Å; S1118-R1313 PolarHBondContact O-NH1 2.88Å; S1118-R1313 PolarHBondContact O-NH2 3.47Å
1119	S	87.4	Confident	91.5	Very high	6 Å²	6	22 Å²	22	4%	0.042	11%	0.107	C	C	.	.			trans	-65.6	161.9	167.3	63.3	0	0	0	0	111.8	S1047 E1122 V1123 R1313	S1047-S1119 WeakPolarHBondContact OG-CA 3.46Å; S1047-S1119 WeakPolarHBondContact OG-CB 3.31Å; S1047-S1119 PolarHBondContact OG-N 3.49Å; S1047-S1119 VanDerWaalsContact OG-N 3.12Å; S1119-E1122 WeakPolarHBondContact CB-OE1 3.5Å; S1119-E1122 PolarHBondContact N-OE2 3.47Å; S1119-E1122 WeakPolarHBondContact O-CB 3.31Å; S1119-E1122 PolarHBondContact O-N 3.47Å; S1119-E1122 WeakPolarHBondContact OG-CB 3.26Å; S1119-E1122 WeakPolarHBondContact OG-CG 3.32Å; S1119-E1122 PolarHBondContact OG-N 3.26Å; S1119-E1122 PolarHBondContact OG-OE1 3.05Å; S1119-V1123 WeakPolarHBondContact O-CG2 3.24Å; S1119-V1123 PolarHBondContact O-N 3.41Å; S1119-R1313 PolarHBondContact O-NH1 3.08Å
1120	T	88.5	Confident	91.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59.9	-44.4	175.6	-68.7	0	0	0	0	111.8	E1050 E1122 V1123 I1124 L1310 R1313 D1315 Y1317 A1318	E1050-T1120 VanDerWaalsContact OE1-CB 3.24Å; E1050-T1120 WeakPolarHBondContact OE1-CB 3.46Å; E1050-T1120 WeakPolarHBondContact OE2-CB 3.5Å; E1050-T1120 PolarHBondContact OE2-N 2.87Å; E1050-T1120 PolarHBondContact OE2-OG1 3.21Å; T1120-E1122 VanDerWaalsContact C-N 3.32Å; T1120-E1122 PolarHBondContact O-N 2.92Å; T1120-V1123 PolarHBondContact O-N 3.41Å; T1120-V1123 VanDerWaalsContact O-N 3.17Å; T1120-I1124 HydrophobicContact CG2-CD1 3.58Å; T1120-I1124 HydrophobicContact CG2-CG1 4.17Å; T1120-I1124 VanDerWaalsContact O-CG1 3.24Å; T1120-I1124 WeakPolarHBondContact O-CG1 3.48Å; T1120-I1124 PolarHBondContact O-N 3.4Å; T1120-L1310 HydrophobicContact CG2-CD2 3.97Å; T1120-R1313 WeakPolarHBondContact OG1-CD 3.46Å; T1120-R1313 PolarHBondContact OG1-NH1 2.91Å; T1120-D1315 WeakPolarHBondContact CG2-OD1 3.4Å; T1120-D1315 PolarHBondContact OG1-OD2 3.35Å; T1120-Y1317 HydrophobicContact CG2-CD1 4.19Å; T1120-A1318 HydrophobicContact CG2-CB 3.72Å
1121	P	91.2	Very high	91.3	Very high	32 Å²	32	19 Å²	19	21%	0.208	9%	0.094	C	C	.	.	H	α-helix	trans	-50	-48.9	169.5	-31.6	34.5	0	0	0	113.3	E1050 V1123 I1124 E1125 H1188	E1050-P1121 WeakPolarHBondContact OE1-CD 3.48Å; P1121-V1123 PolarHBondContact O-N 3.2Å; P1121-I1124 PolarHBondContact O-N 3.07Å; P1121-E1125 WeakPolarHBondContact O-CB 3.33Å; P1121-E1125 WeakPolarHBondContact O-CG 3.45Å; P1121-E1125 PolarHBondContact O-N 2.75Å; P1121-H1188 PolarHBondContact O-CE1 3.06Å
1122	E	92.1	Very high	91.3	Very high	70 Å²	70	17.3 Å²	17.3	33%	0.327	9%	0.087	S	C	.	.	H	α-helix	trans	-63.3	-39	178.9	-73.9	159.3	-133.2	0	0	113	S1118 S1119 T1120 E1125 Q1126	S1118-E1122 WeakPolarHBondContact CA-OE2 3.39Å; S1118-E1122 WeakPolarHBondContact CB-OE2 3.46Å; S1118-E1122 PolarHBondContact OG-OE2 2.93Å; S1119-E1122 WeakPolarHBondContact CB-OE1 3.5Å; S1119-E1122 PolarHBondContact N-OE2 3.47Å; S1119-E1122 WeakPolarHBondContact O-CB 3.31Å; S1119-E1122 PolarHBondContact O-N 3.47Å; S1119-E1122 WeakPolarHBondContact OG-CB 3.26Å; S1119-E1122 WeakPolarHBondContact OG-CG 3.32Å; S1119-E1122 PolarHBondContact OG-N 3.26Å; S1119-E1122 PolarHBondContact OG-OE1 3.05Å; T1120-E1122 VanDerWaalsContact C-N 3.32Å; T1120-E1122 PolarHBondContact O-N 2.92Å; E1122-E1125 WeakPolarHBondContact O-CB 3.47Å; E1122-E1125 PolarHBondContact O-N 3.1Å; E1122-Q1126 WeakPolarHBondContact O-CB 3.42Å; E1122-Q1126 PolarHBondContact O-N 3.19Å
1123	V	92	Very high	91.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-68.3	-38.5	176.7	177.5	0	0	0	0	110.8	L1115 S1119 T1120 P1121 Q1126 Y1127 A1306 I1309 L1310	L1115-V1123 HydrophobicContact CD2-CG1 4.29Å; L1115-V1123 HydrophobicContact CD2-CG2 4.3Å; S1119-V1123 WeakPolarHBondContact O-CG2 3.24Å; S1119-V1123 PolarHBondContact O-N 3.41Å; T1120-V1123 PolarHBondContact O-N 3.41Å; T1120-V1123 VanDerWaalsContact O-N 3.17Å; P1121-V1123 PolarHBondContact O-N 3.2Å; V1123-Q1126 WeakPolarHBondContact O-CB 2.85Å; V1123-Q1126 PolarHBondContact O-N 3.49Å; V1123-Y1127 PolarHBondContact O-N 3.15Å; V1123-A1306 HydrophobicContact CG1-CB 3.98Å; V1123-A1306 WeakPolarHBondContact CG1-O 3.15Å; V1123-I1309 HydrophobicContact CG1-CB 4.43Å; V1123-I1309 HydrophobicContact CG1-CG2 4.28Å; V1123-L1310 HydrophobicContact CB-CD2 4.05Å; V1123-L1310 HydrophobicContact CG1-CD1 4.28Å; V1123-L1310 HydrophobicContact CG1-CD2 3.74Å; V1123-L1310 HydrophobicContact CG1-CG 3.69Å
1124	I	92.8	Very high	91.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.5	-45.5	175.3	-67	165.6	0	0	0	110.4	T1120 P1121 Q1126 Y1127 F1128 P1186 L1310 Y1317 I1321	T1120-I1124 HydrophobicContact CG2-CD1 3.58Å; T1120-I1124 HydrophobicContact CG2-CG1 4.17Å; T1120-I1124 VanDerWaalsContact O-CG1 3.24Å; T1120-I1124 WeakPolarHBondContact O-CG1 3.48Å; T1120-I1124 PolarHBondContact O-N 3.4Å; P1121-I1124 PolarHBondContact O-N 3.07Å; I1124-Q1126 VanDerWaalsContact C-N 3.29Å; I1124-Q1126 PolarHBondContact O-N 2.82Å; I1124-Y1127 WeakPolarHBondContact O-CB 3.46Å; I1124-Y1127 PolarHBondContact O-N 3.36Å; I1124-F1128 HydrophobicContact CG2-CD2 3.84Å; I1124-F1128 HydrophobicContact CG2-CE2 3.54Å; I1124-F1128 WeakPolarHBondContact O-CD2 3.31Å; I1124-F1128 PolarHBondContact O-N 3.07Å; I1124-F1128 VanDerWaalsContact O-N 3.12Å; I1124-P1186 HydrophobicContact CG2-CB 3.88Å; I1124-P1186 HydrophobicContact CG2-CG 4.24Å; I1124-L1310 HydrophobicContact CD1-CD2 4.44Å; I1124-L1310 HydrophobicContact CG1-CD1 3.88Å; I1124-L1310 HydrophobicContact CG1-CD2 3.69Å; I1124-L1310 HydrophobicContact CG1-CG 4.47Å; I1124-Y1317 HydrophobicContact CD1-CD1 3.41Å; I1124-Y1317 VanDerWaalsContact CD1-CD1 3.41Å; I1124-Y1317 HydrophobicContact CD1-CD2 4.07Å; I1124-Y1317 HydrophobicContact CD1-CE1 3.23Å; I1124-Y1317 HydrophobicContact CD1-CE2 3.9Å; I1124-Y1317 HydrophobicContact CD1-CG 3.83Å; I1124-Y1317 VanDerWaalsContact CD1-CZ 3.48Å; I1124-I1321 HydrophobicContact CD1-CG1 3.76Å; I1124-I1321 HydrophobicContact CG1-CB 4.46Å; I1124-I1321 HydrophobicContact CG1-CG1 4.06Å; I1124-I1321 HydrophobicContact CG1-CG2 4.39Å; I1124-I1321 HydrophobicContact CG2-CD1 4.5Å; I1124-I1321 HydrophobicContact CG2-CG1 4.29Å
1125	E	94.6	Very high	91	Very high	40 Å²	40	18.9 Å²	18.9	19%	0.187	10%	0.097	C	C	.	.	H	α-helix	trans	-55.6	-46.7	173	-78.9	-172	-136.9	0	0	111.7	P1121 E1122 Y1127 F1128 I1129 P1186 H1188 H1225 S1227	P1121-E1125 WeakPolarHBondContact O-CB 3.33Å; P1121-E1125 WeakPolarHBondContact O-CG 3.45Å; P1121-E1125 PolarHBondContact O-N 2.75Å; E1122-E1125 WeakPolarHBondContact O-CB 3.47Å; E1122-E1125 PolarHBondContact O-N 3.1Å; E1125-Y1127 VanDerWaalsContact C-N 3.34Å; E1125-Y1127 PolarHBondContact O-N 3.08Å; E1125-F1128 PolarHBondContact O-N 2.72Å; E1125-I1129 WeakPolarHBondContact O-CG1 3.28Å; E1125-I1129 PolarHBondContact O-N 2.93Å; E1125-P1186 HydrophobicContact CG-CG 3.86Å; E1125-H1188 IonicContact OE1-NE2 3.44Å; E1125-H1188 PolarHBondContact OE1-NE2 3.03Å; E1125-H1225 IonicContact OE1-CE1 3.26Å; E1125-H1225 IonicContact OE2-CE1 3.72Å; E1125-H1225 PolarHBondContact OE2-CE1 2.53Å; E1125-H1225 VanDerWaalsContact OE2-CE1 3.26Å; E1125-S1227 WeakPolarHBondContact CB-OG 3.22Å; E1125-S1227 WeakPolarHBondContact OE2-CB 3.38Å; E1125-S1227 PolarHBondContact OE2-OG 3.04Å
1126	Q	92.8	Very high	90.8	Very high	41 Å²	41	23.7 Å²	23.7	19%	0.192	12%	0.119	C	C	.	.	H	α-helix	trans	-60.5	-42.4	178.3	-175.1	62.6	34.5	0	0	111.7	Y1111 L1115 E1122 V1123 I1124 F1128 I1129 E1130	Y1111-Q1126 HydrophobicContact CE2-CG 3.78Å; Y1111-Q1126 WeakPolarHBondContact OH-CG 3.42Å; L1115-Q1126 HydrophobicContact CD2-CB 4.41Å; L1115-Q1126 HydrophobicContact CD2-CG 4Å; E1122-Q1126 WeakPolarHBondContact O-CB 3.42Å; E1122-Q1126 PolarHBondContact O-N 3.19Å; V1123-Q1126 WeakPolarHBondContact O-CB 2.85Å; V1123-Q1126 PolarHBondContact O-N 3.49Å; I1124-Q1126 VanDerWaalsContact C-N 3.29Å; I1124-Q1126 PolarHBondContact O-N 2.82Å; Q1126-F1128 PolarHBondContact O-N 3.36Å; Q1126-I1129 PolarHBondContact O-N 3.49Å; Q1126-E1130 WeakPolarHBondContact O-CG 3.4Å; Q1126-E1130 PolarHBondContact O-N 3.11Å
1127	Y	92.8	Very high	90.5	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-56	-49.2	174	173.9	-105.6	0	0	0	111.8	V1123 I1124 E1125 I1129 E1130 K1131 L1307 W1325 E1329	V1123-Y1127 PolarHBondContact O-N 3.15Å; I1124-Y1127 WeakPolarHBondContact O-CB 3.46Å; I1124-Y1127 PolarHBondContact O-N 3.36Å; E1125-Y1127 VanDerWaalsContact C-N 3.34Å; E1125-Y1127 PolarHBondContact O-N 3.08Å; Y1127-I1129 PolarHBondContact O-N 3.37Å; Y1127-E1130 WeakPolarHBondContact O-CB 3.06Å; Y1127-E1130 PolarHBondContact O-N 3.03Å; Y1127-E1130 VanDerWaalsContact O-N 3.17Å; Y1127-K1131 HydrophobicContact CE1-CG 4.11Å; Y1127-K1131 HydrophobicContact CE2-CD 4.3Å; Y1127-K1131 HydrophobicContact CE2-CG 4.19Å; Y1127-K1131 WeakPolarHBondContact O-CG 3.22Å; Y1127-K1131 PolarHBondContact O-N 3.25Å; Y1127-L1307 HydrophobicContact CD2-CB 3.85Å; Y1127-L1307 HydrophobicContact CD2-CD1 4.47Å; Y1127-L1307 HydrophobicContact CE2-CB 3.74Å; Y1127-L1307 HydrophobicContact CE2-CD1 4.13Å; Y1127-L1307 HydrophobicContact CE2-CD2 4.11Å; Y1127-L1307 HydrophobicContact CE2-CG 4.21Å; Y1127-W1325 HydrophobicContact CE1-CB 4.24Å; Y1127-W1325 AromaticContact CE1-CD2 3.94Å; Y1127-W1325 HydrophobicContact CE1-CD2 3.94Å; Y1127-W1325 HydrophobicContact CE1-CE3 4.39Å; Y1127-W1325 AromaticContact CE1-CG 3.83Å; Y1127-W1325 HydrophobicContact CE1-CG 3.83Å; Y1127-E1329 PolarHBondContact OH-OE1 2.51Å
1128	F	93.9	Very high	90.3	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.8	-32.7	-179.6	-72	-63.9	0	0	0	113	I1124 E1125 Q1126 E1130 K1131 L1132 L1185 P1186 C1229 W1325	I1124-F1128 HydrophobicContact CG2-CD2 3.84Å; I1124-F1128 HydrophobicContact CG2-CE2 3.54Å; I1124-F1128 WeakPolarHBondContact O-CD2 3.31Å; I1124-F1128 PolarHBondContact O-N 3.07Å; I1124-F1128 VanDerWaalsContact O-N 3.12Å; E1125-F1128 PolarHBondContact O-N 2.72Å; Q1126-F1128 PolarHBondContact O-N 3.36Å; F1128-E1130 VanDerWaalsContact C-N 3.3Å; F1128-E1130 PolarHBondContact O-N 2.88Å; F1128-K1131 PolarHBondContact O-N 3.22Å; F1128-L1132 WeakPolarHBondContact O-CB 3.18Å; F1128-L1132 VanDerWaalsContact O-CG 3.25Å; F1128-L1132 WeakPolarHBondContact O-CG 3.43Å; F1128-L1132 PolarHBondContact O-N 2.88Å; F1128-L1185 HydrophobicContact CD1-CB 4.32Å; F1128-L1185 HydrophobicContact CD1-CD1 4.49Å; F1128-L1185 HydrophobicContact CD2-CB 4.34Å; F1128-L1185 HydrophobicContact CE1-CB 4Å; F1128-L1185 HydrophobicContact CE1-CD1 3.56Å; F1128-L1185 HydrophobicContact CE1-CG 4.34Å; F1128-L1185 HydrophobicContact CE2-CB 3.98Å; F1128-L1185 HydrophobicContact CZ-CB 3.82Å; F1128-L1185 HydrophobicContact CZ-CD1 3.6Å; F1128-L1185 HydrophobicContact CZ-CD2 4.26Å; F1128-L1185 HydrophobicContact CZ-CG 4.09Å; F1128-P1186 HydrophobicContact CD2-CB 4.28Å; F1128-P1186 HydrophobicContact CD2-CG 3.82Å; F1128-P1186 HydrophobicContact CE2-CB 4.38Å; F1128-P1186 HydrophobicContact CE2-CG 4.4Å; F1128-C1229 HydrophobicContact CB-CB 3.93Å; F1128-C1229 HydrophobicContact CD1-CB 4.14Å; F1128-C1229 HydrophobicContact CG-CB 4.21Å; F1128-W1325 AromaticContact CE1-CE2 3.86Å; F1128-W1325 AromaticContact CE1-CZ2 3.79Å; F1128-W1325 HydrophobicContact CE1-CZ2 3.79Å; F1128-W1325 AromaticContact CE1-NE1 3.98Å; F1128-W1325 AromaticContact CZ-CE2 3.98Å; F1128-W1325 HydrophobicContact CZ-CZ2 4.22Å; F1128-W1325 AromaticContact CZ-NE1 3.62Å
1129	I	92.6	Very high	89.7	Confident	37 Å²	37	34.8 Å²	34.8	19%	0.19	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-43.7	170.3	-70.8	168.2	0	0	0	110.5	E1125 Q1126 Y1127 K1131 L1132 N1133 S1227	E1125-I1129 WeakPolarHBondContact O-CG1 3.28Å; E1125-I1129 PolarHBondContact O-N 2.93Å; Q1126-I1129 PolarHBondContact O-N 3.49Å; Y1127-I1129 PolarHBondContact O-N 3.37Å; I1129-K1131 VanDerWaalsContact C-N 3.35Å; I1129-K1131 PolarHBondContact O-N 3.05Å; I1129-L1132 PolarHBondContact O-N 2.84Å; I1129-N1133 PolarHBondContact O-N 2.83Å; I1129-N1133 PolarHBondContact O-ND2 3.18Å; I1129-N1133 PolarHBondContact O-OD1 3.23Å; I1129-S1227 WeakPolarHBondContact CD1-OG 3.09Å
1130	E	90.5	Very high	89.2	Confident	24 Å²	24	39 Å²	39	11%	0.112	22%	0.216	C	C	.	.	H	α-helix	trans	-59.7	-45.2	176.1	-69	178.1	151	0	0	111.6	Y1111 Q1126 Y1127 F1128 L1132 N1133 E1134	Y1111-E1130 WeakPolarHBondContact CE1-OE1 3.29Å; Y1111-E1130 PolarHBondContact OH-OE1 3.18Å; Q1126-E1130 WeakPolarHBondContact O-CG 3.4Å; Q1126-E1130 PolarHBondContact O-N 3.11Å; Y1127-E1130 WeakPolarHBondContact O-CB 3.06Å; Y1127-E1130 PolarHBondContact O-N 3.03Å; Y1127-E1130 VanDerWaalsContact O-N 3.17Å; F1128-E1130 VanDerWaalsContact C-N 3.3Å; F1128-E1130 PolarHBondContact O-N 2.88Å; E1130-L1132 PolarHBondContact O-N 2.74Å; E1130-N1133 PolarHBondContact O-N 2.84Å; E1130-N1133 VanDerWaalsContact O-N 3.17Å; E1130-E1134 WeakPolarHBondContact O-CG 3.33Å; E1130-E1134 PolarHBondContact O-N 3.28Å
1131	K	89.8	Confident	88.8	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-37.6	179.2	-61.9	-41.4	178.2	-171.3	0	113.4	Y1127 F1128 I1129 N1133 E1134 Q1135 F1250 P1299 I1300 E1329	Y1127-K1131 HydrophobicContact CE1-CG 4.11Å; Y1127-K1131 HydrophobicContact CE2-CD 4.3Å; Y1127-K1131 HydrophobicContact CE2-CG 4.19Å; Y1127-K1131 WeakPolarHBondContact O-CG 3.22Å; Y1127-K1131 PolarHBondContact O-N 3.25Å; F1128-K1131 PolarHBondContact O-N 3.22Å; I1129-K1131 VanDerWaalsContact C-N 3.35Å; I1129-K1131 PolarHBondContact O-N 3.05Å; K1131-N1133 VanDerWaalsContact C-N 3.33Å; K1131-N1133 PolarHBondContact O-N 2.82Å; K1131-E1134 WeakPolarHBondContact CD-OE2 3.46Å; K1131-E1134 IonicContact NZ-OE1 3.4Å; K1131-E1134 PolarHBondContact NZ-OE1 3.41Å; K1131-E1134 VanDerWaalsContact NZ-OE1 3.1Å; K1131-E1134 IonicContact NZ-OE2 3.61Å; K1131-E1134 PolarHBondContact NZ-OE2 2.85Å; K1131-E1134 PolarHBondContact O-N 3.06Å; K1131-Q1135 PolarHBondContact O-N 3.39Å; K1131-F1250 HydrophobicContact CB-CD1 4.34Å; K1131-F1250 HydrophobicContact CB-CD2 3.74Å; K1131-F1250 HydrophobicContact CB-CE1 4.29Å; K1131-F1250 HydrophobicContact CB-CE2 3.72Å; K1131-F1250 HydrophobicContact CB-CG 4.03Å; K1131-F1250 HydrophobicContact CB-CZ 3.98Å; K1131-F1250 HydrophobicContact CG-CE2 4.12Å; K1131-F1250 HydrophobicContact CG-CZ 4.11Å; K1131-P1299 HydrophobicContact CD-CB 4Å; K1131-I1300 PolarHBondContact NZ-O 2.81Å; K1131-E1329 IonicContact NZ-OE1 2.81Å
1132	L	92	Very high	88.4	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-42.2	171.1	-71.5	171.6	0	0	0	111.8	F1128 I1129 E1130 Q1135 E1136 C1229 F1250 I1251 R1252	F1128-L1132 WeakPolarHBondContact O-CB 3.18Å; F1128-L1132 VanDerWaalsContact O-CG 3.25Å; F1128-L1132 WeakPolarHBondContact O-CG 3.43Å; F1128-L1132 PolarHBondContact O-N 2.88Å; I1129-L1132 PolarHBondContact O-N 2.84Å; E1130-L1132 PolarHBondContact O-N 2.74Å; L1132-Q1135 WeakPolarHBondContact O-CB 3.24Å; L1132-Q1135 PolarHBondContact O-N 3.16Å; L1132-E1136 WeakPolarHBondContact O-CG 3.32Å; L1132-E1136 PolarHBondContact O-N 2.81Å; L1132-E1136 VanDerWaalsContact O-N 3.08Å; L1132-C1229 HydrophobicContact CD1-CB 4.09Å; L1132-C1229 HydrophobicContact CD2-CB 4.21Å; L1132-C1229 HydrophobicContact CG-CB 4.17Å; L1132-F1250 HydrophobicContact CD2-CB 3.95Å; L1132-I1251 VanDerWaalsContact CD2-C 3.44Å; L1132-R1252 HydrophobicContact CD1-CB 4.29Å; L1132-R1252 HydrophobicContact CD1-CG 4.44Å; L1132-R1252 HydrophobicContact CD2-CB 3.97Å
1133	N	90.4	Very high	88.2	Confident	62 Å²	62	42.9 Å²	42.9	33%	0.332	24%	0.242	S	C	.	.	H	α-helix	trans	-70.8	-38.2	179.2	-62.8	-18.1	0	0	0	111.8	I1129 E1130 K1131 Q1135 E1136 L1137 R1252	I1129-N1133 PolarHBondContact O-N 2.83Å; I1129-N1133 PolarHBondContact O-ND2 3.18Å; I1129-N1133 PolarHBondContact O-OD1 3.23Å; E1130-N1133 PolarHBondContact O-N 2.84Å; E1130-N1133 VanDerWaalsContact O-N 3.17Å; K1131-N1133 VanDerWaalsContact C-N 3.33Å; K1131-N1133 PolarHBondContact O-N 2.82Å; N1133-Q1135 VanDerWaalsContact C-N 3.3Å; N1133-Q1135 PolarHBondContact O-N 3.38Å; N1133-E1136 PolarHBondContact O-N 3.47Å; N1133-L1137 WeakPolarHBondContact O-CG 3.13Å; N1133-L1137 PolarHBondContact O-N 2.64Å; N1133-L1137 VanDerWaalsContact O-N 3.09Å; N1133-R1252 PolarHBondContact OD1-NH2 3.38Å
1134	E	88.6	Confident	88.1	Confident	42 Å²	42	42.9 Å²	42.9	20%	0.196	24%	0.242	C	C	.	.	H	α-helix	trans	-57.7	-43.3	171.2	-75.3	171.1	-160.9	0	0	110.8	E1130 K1131 L1137 A1138 I1297	E1130-E1134 WeakPolarHBondContact O-CG 3.33Å; E1130-E1134 PolarHBondContact O-N 3.28Å; K1131-E1134 WeakPolarHBondContact CD-OE2 3.46Å; K1131-E1134 IonicContact NZ-OE1 3.4Å; K1131-E1134 PolarHBondContact NZ-OE1 3.41Å; K1131-E1134 VanDerWaalsContact NZ-OE1 3.1Å; K1131-E1134 IonicContact NZ-OE2 3.61Å; K1131-E1134 PolarHBondContact NZ-OE2 2.85Å; K1131-E1134 PolarHBondContact O-N 3.06Å; E1134-L1137 PolarHBondContact O-N 2.96Å; E1134-A1138 PolarHBondContact O-N 3.27Å; E1134-I1297 HydrophobicContact CB-CD1 4.13Å
1135	Q	90.9	Very high	88.2	Confident	6 Å²	6	47.6 Å²	47.6	3%	0.028	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-42.1	175.9	-174.1	71.8	65	0	0	112.8	K1131 L1132 N1133 L1137 A1138 F1250 L1294 P1295 I1297	K1131-Q1135 PolarHBondContact O-N 3.39Å; L1132-Q1135 WeakPolarHBondContact O-CB 3.24Å; L1132-Q1135 PolarHBondContact O-N 3.16Å; N1133-Q1135 VanDerWaalsContact C-N 3.3Å; N1133-Q1135 PolarHBondContact O-N 3.38Å; Q1135-L1137 VanDerWaalsContact C-N 3.29Å; Q1135-L1137 PolarHBondContact O-N 2.81Å; Q1135-A1138 PolarHBondContact O-N 2.98Å; Q1135-F1250 HydrophobicContact CB-CB 4.44Å; Q1135-F1250 VanDerWaalsContact CG-O 3.27Å; Q1135-F1250 WeakPolarHBondContact CG-O 3.07Å; Q1135-L1294 HydrophobicContact CG-CD1 4.44Å; Q1135-P1295 PolarHBondContact NE2-O 3.23Å; Q1135-I1297 HydrophobicContact CB-CD1 4.42Å
1136	E	85.6	Confident	88.2	Confident	102 Å²	102	45.8 Å²	45.8	48%	0.477	25%	0.254	S	S	.	.	H	α-helix	trans	-64.3	-35.4	179.4	-74.8	178.5	173.1	0	0	111.6	L1132 N1133 R1252	L1132-E1136 WeakPolarHBondContact O-CG 3.32Å; L1132-E1136 PolarHBondContact O-N 2.81Å; L1132-E1136 VanDerWaalsContact O-N 3.08Å; N1133-E1136 PolarHBondContact O-N 3.47Å; E1136-R1252 VanDerWaalsContact CD-NH1 3.33Å; E1136-R1252 IonicContact OE1-CZ 3.46Å; E1136-R1252 IonicContact OE1-NH1 2.7Å; E1136-R1252 PolarHBondContact OE1-NH1 2.87Å; E1136-R1252 IonicContact OE2-NH1 2.86Å; E1136-R1252 PolarHBondContact OE2-NH1 3.11Å
1137	L	84.5	Confident	88.3	Confident	147 Å²	147	44.4 Å²	44.4	77%	0.77	25%	0.249	S	C	*	.	H	α-helix	trans	-78.5	-24.4	178	-69	168.2	0	0	0	113.6	N1133 E1134 Q1135 S1139	N1133-L1137 WeakPolarHBondContact O-CG 3.13Å; N1133-L1137 PolarHBondContact O-N 2.64Å; N1133-L1137 VanDerWaalsContact O-N 3.09Å; E1134-L1137 PolarHBondContact O-N 2.96Å; Q1135-L1137 VanDerWaalsContact C-N 3.29Å; Q1135-L1137 PolarHBondContact O-N 2.81Å; L1137-S1139 PolarHBondContact O-N 2.85Å
1138	A	84	Confident	88.4	Confident	20 Å²	20	44.5 Å²	44.5	17%	0.165	25%	0.25	C	C	.	.			trans	-68.2	103.4	-177.1	0	0	0	0	0	111.9	E1134 Q1135 K1271 P1295 I1297	E1134-A1138 PolarHBondContact O-N 3.27Å; Q1135-A1138 PolarHBondContact O-N 2.98Å; A1138-K1271 PolarHBondContact O-NZ 2.82Å; A1138-P1295 HydrophobicContact CB-CG 3.95Å; A1138-P1295 VanDerWaalsContact O-CG 3.3Å; A1138-P1295 WeakPolarHBondContact O-CG 3.12Å; A1138-I1297 HydrophobicContact CB-CG2 3.73Å
1139	S	77.6	Confident	88.4	Confident	93 Å²	93	46.8 Å²	46.8	65%	0.65	26%	0.26	S	S	*	.			trans	-80	-39.8	179.2	54.8	0	0	0	0	113.3	L1137	L1137-S1139 PolarHBondContact O-N 2.85Å
1140	S	76.6	Confident	88.4	Confident	95 Å²	95	45 Å²	45	66%	0.664	25%	0.251	S	S	*	.			trans	-144.9	151.2	-179.1	54.2	0	0	0	0	110
1141	S	79.3	Confident	88.5	Confident	31 Å²	31	44 Å²	44	22%	0.217	25%	0.246	C	C	.	.			trans	-138.1	144.8	175.4	172.6	0	0	0	0	110.7	Y1143 L1296	S1141-Y1143 VanDerWaalsContact C-N 3.26Å; S1141-Y1143 WeakPolarHBondContact OG-CB 3.44Å; S1141-Y1143 VanDerWaalsContact OG-CD2 3.22Å; S1141-Y1143 WeakPolarHBondContact OG-CD2 3.26Å; S1141-Y1143 PolarHBondContact OG-N 2.64Å; S1141-L1296 WeakPolarHBondContact CB-O 3.42Å; S1141-L1296 PolarHBondContact OG-O 3.01Å
1142	S	82.6	Confident	88.5	Confident	88 Å²	88	44.9 Å²	44.9	62%	0.615	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-13.7	169.2	50.4	0	0	0	0	113.2	G1144	S1142-G1144 VanDerWaalsContact C-N 3.3Å; S1142-G1144 PolarHBondContact O-N 3.15Å
1143	Y	87.6	Confident	88.3	Confident	64 Å²	64	47.3 Å²	47.3	25%	0.251	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	6.4	-177.6	-49.2	-66.8	0	0	0	113.6	S1141 V1168 R1298 I1333	S1141-Y1143 VanDerWaalsContact C-N 3.26Å; S1141-Y1143 WeakPolarHBondContact OG-CB 3.44Å; S1141-Y1143 VanDerWaalsContact OG-CD2 3.22Å; S1141-Y1143 WeakPolarHBondContact OG-CD2 3.26Å; S1141-Y1143 PolarHBondContact OG-N 2.64Å; Y1143-V1168 HydrophobicContact CD1-CG2 3.78Å; Y1143-R1298 HydrophobicContact CD1-CG 4.35Å; Y1143-R1298 HydrophobicContact CD2-CB 4.5Å; Y1143-R1298 HydrophobicContact CD2-CG 4.06Å; Y1143-R1298 HydrophobicContact CE1-CG 4.13Å; Y1143-R1298 HydrophobicContact CE2-CB 3.95Å; Y1143-R1298 HydrophobicContact CE2-CG 3.82Å; Y1143-R1298 HydrophobicContact CG-CG 4.34Å; Y1143-I1333 HydrophobicContact CD1-CD1 4.11Å; Y1143-I1333 HydrophobicContact CE1-CD1 3.7Å
1144	G	91.1	Very high	88	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.01	28%	0.276	C	S	.	.			trans	92.8	-167.2	-179.7	0	0	0	0	0	114.3	S1142 T1165 N1166 P1295 L1296	S1142-G1144 VanDerWaalsContact C-N 3.3Å; S1142-G1144 PolarHBondContact O-N 3.15Å; G1144-T1165 CarbonylContact C-O 3.58Å; G1144-T1165 WeakPolarHBondContact CA-O 3.45Å; G1144-N1166 WeakPolarHBondContact CA-O 3.22Å; G1144-N1166 PolarHBondContact N-O 2.86Å; G1144-P1295 WeakPolarHBondContact O-CA 3.44Å; G1144-L1296 PolarHBondContact O-N 3.2Å
1145	K	93.5	Very high	88	Confident	98 Å²	98	54.4 Å²	54.4	43%	0.426	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	144.4	-178.2	-59.6	178.7	-176.5	174.7	0	111	A1164 T1165 L1294 L1296	K1145-A1164 CarbonylContact O-C 3.28Å; K1145-A1164 WeakPolarHBondContact O-CA 3.43Å; K1145-T1165 PolarHBondContact N-O 2.88Å; K1145-T1165 PolarHBondContact O-N 3.25Å; K1145-L1294 CarbonylContact C-O 3.51Å; K1145-L1294 VanDerWaalsContact CA-O 3.27Å; K1145-L1294 WeakPolarHBondContact CA-O 3.39Å; K1145-L1296 VanDerWaalsContact C-CD1 3.4Å
1146	L	95.6	Very high	88	Confident	2 Å²	2	55 Å²	55	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	131.7	173.9	-178.6	64.1	0	0	0	110	V1148 I1161 A1164 I1180 F1232 V1249 C1293 L1294 L1296	L1146-V1148 HydrophobicContact CD1-CG1 4.34Å; L1146-V1148 HydrophobicContact CD2-CG1 3.85Å; L1146-V1148 HydrophobicContact CG-CG1 3.82Å; L1146-I1161 HydrophobicContact CD1-CG2 4.38Å; L1146-A1164 HydrophobicContact CD1-CB 4.06Å; L1146-I1180 HydrophobicContact CD1-CD1 3.33Å; L1146-I1180 HydrophobicContact CD2-CD1 4.21Å; L1146-I1180 HydrophobicContact CG-CD1 4.42Å; L1146-F1232 HydrophobicContact CD2-CB 3.54Å; L1146-F1232 HydrophobicContact CD2-CD1 4.11Å; L1146-F1232 HydrophobicContact CD2-CD2 4.36Å; L1146-F1232 HydrophobicContact CD2-CG 3.75Å; L1146-V1249 HydrophobicContact CB-CG2 3.99Å; L1146-V1249 HydrophobicContact CD2-CB 4.29Å; L1146-V1249 HydrophobicContact CD2-CG2 4.29Å; L1146-C1293 WeakPolarHBondContact O-CA 3.39Å; L1146-L1294 PolarHBondContact N-O 3.14Å; L1146-L1294 PolarHBondContact O-N 3.21Å; L1146-L1296 HydrophobicContact CB-CD1 4.17Å
1147	T	95.4	Very high	88.3	Confident	13 Å²	13	50.1 Å²	50.1	8%	0.08	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	116.2	174.5	-52.7	0	0	0	0	110.1	Q1162 R1163 L1292	T1147-Q1162 HydrophobicContact CG2-CB 4.44Å; T1147-Q1162 HydrophobicContact CG2-CG 4.49Å; T1147-Q1162 WeakPolarHBondContact O-CB 3.25Å; T1147-Q1162 PolarHBondContact O-N 3.44Å; T1147-R1163 PolarHBondContact N-O 3.32Å; T1147-R1163 PolarHBondContact O-N 2.74Å; T1147-L1292 CarbonylContact C-O 3.53Å; T1147-L1292 VanDerWaalsContact CA-O 3.3Å; T1147-L1292 WeakPolarHBondContact CA-O 3.24Å
1148	V	94.6	Very high	88.7	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	155	177.1	-58.7	0	0	0	0	110.8	L1146 I1150 D1160 I1161 F1232 I1251 L1292	L1146-V1148 HydrophobicContact CD1-CG1 4.34Å; L1146-V1148 HydrophobicContact CD2-CG1 3.85Å; L1146-V1148 HydrophobicContact CG-CG1 3.82Å; V1148-I1150 HydrophobicContact CG2-CG2 4.32Å; V1148-D1160 CarbonylContact C-O 3.51Å; V1148-D1160 VanDerWaalsContact CA-O 3.31Å; V1148-D1160 WeakPolarHBondContact CA-O 3.5Å; V1148-I1161 HydrophobicContact CG1-CG1 4.36Å; V1148-I1161 HydrophobicContact CG1-CG2 4.41Å; V1148-F1232 HydrophobicContact CB-CZ 4.37Å; V1148-F1232 HydrophobicContact CG1-CD1 4.33Å; V1148-F1232 HydrophobicContact CG1-CE1 3.95Å; V1148-F1232 HydrophobicContact CG1-CZ 4.04Å; V1148-F1232 HydrophobicContact CG2-CE2 4.34Å; V1148-F1232 HydrophobicContact CG2-CZ 4.24Å; V1148-I1251 HydrophobicContact CG2-CD1 3.51Å; V1148-L1292 HydrophobicContact CG2-CB 4.14Å; V1148-L1292 PolarHBondContact N-O 2.96Å; V1148-L1292 PolarHBondContact O-N 2.94Å
1149	K	92.9	Very high	89.2	Confident	49 Å²	49	45.4 Å²	45.4	21%	0.213	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	133.6	162.9	-62.2	179.2	-172	146.6	0	108.9	L1159 D1160 L1290 Q1291	K1149-L1159 CarbonylContact O-C 3.59Å; K1149-L1159 WeakPolarHBondContact O-CA 3.43Å; K1149-D1160 HydrophobicContact CB-CB 4.11Å; K1149-D1160 WeakPolarHBondContact CD-OD2 3.48Å; K1149-D1160 PolarHBondContact N-O 2.71Å; K1149-D1160 IonicContact NZ-OD2 3.28Å; K1149-D1160 PolarHBondContact O-N 3.44Å; K1149-L1290 CarbonylContact C-O 3.54Å; K1149-L1290 VanDerWaalsContact CA-O 3.31Å; K1149-L1290 WeakPolarHBondContact CA-O 3.46Å; K1149-Q1291 HydrophobicContact CD-CG 4.47Å; K1149-Q1291 VanDerWaalsContact CE-CD 3.41Å; K1149-Q1291 HydrophobicContact CG-CB 3.84Å; K1149-Q1291 HydrophobicContact CG-CG 3.69Å
1150	I	93.6	Very high	90	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	140.6	174.7	62.9	168.7	0	0	0	108.7	V1148 Y1158 L1159 L1230 I1251 L1256 Q1289 L1290 L1292	V1148-I1150 HydrophobicContact CG2-CG2 4.32Å; I1150-Y1158 CarbonylContact C-O 3.58Å; I1150-Y1158 WeakPolarHBondContact CA-O 3.47Å; I1150-L1159 HydrophobicContact CB-CD2 4.14Å; I1150-L1159 HydrophobicContact CG2-CD2 3.58Å; I1150-L1230 HydrophobicContact CG2-CD2 4.1Å; I1150-I1251 HydrophobicContact CD1-CG2 3.9Å; I1150-L1256 HydrophobicContact CB-CD1 4.44Å; I1150-L1256 HydrophobicContact CD1-CD1 3.95Å; I1150-L1256 HydrophobicContact CD1-CD2 4.44Å; I1150-L1256 HydrophobicContact CD1-CG 4Å; I1150-L1256 HydrophobicContact CG1-CD1 4.11Å; I1150-L1256 HydrophobicContact CG1-CD2 4.16Å; I1150-L1256 HydrophobicContact CG1-CG 4.22Å; I1150-Q1289 CarbonylContact O-C 3.58Å; I1150-Q1289 VanDerWaalsContact O-CA 3.3Å; I1150-Q1289 WeakPolarHBondContact O-CA 3.43Å; I1150-Q1289 WeakPolarHBondContact O-CG 3.27Å; I1150-L1290 HydrophobicContact CG1-CB 3.94Å; I1150-L1290 PolarHBondContact N-O 2.81Å; I1150-L1290 PolarHBondContact O-N 3.35Å; I1150-L1292 HydrophobicContact CD1-CD1 3.94Å; I1150-L1292 HydrophobicContact CG1-CD1 4.21Å
1151	G	91.8	Very high	91	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	152.2	178.7	0	0	0	0	0	111.3	L1157 Y1158 K1288	G1151-L1157 CarbonylContact O-C 3.58Å; G1151-L1157 WeakPolarHBondContact O-CA 3.47Å; G1151-Y1158 PolarHBondContact N-O 3.41Å; G1151-Y1158 PolarHBondContact O-N 3.36Å; G1151-K1288 CarbonylContact C-O 3.49Å; G1151-K1288 WeakPolarHBondContact CA-O 3.42Å
1152	Y	90.9	Very high	91.7	Very high	24 Å²	24	37 Å²	37	9%	0.094	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126	178.7	-173.8	-104.6	0	0	0	110.9	T1155 S1156 L1157 V1218 P1220 L1223 K1288	Y1152-T1155 WeakPolarHBondContact OH-CA 3.48Å; Y1152-S1156 WeakPolarHBondContact CA-O 3.36Å; Y1152-S1156 VanDerWaalsContact CD2-O 3.22Å; Y1152-S1156 WeakPolarHBondContact CD2-O 3.4Å; Y1152-L1157 HydrophobicContact CD2-CB 4.4Å; Y1152-V1218 HydrophobicContact CE2-CB 4.32Å; Y1152-V1218 WeakPolarHBondContact CE2-O 3.21Å; Y1152-V1218 PolarHBondContact OH-O 2.52Å; Y1152-P1220 WeakPolarHBondContact OH-CA 3.34Å; Y1152-P1220 WeakPolarHBondContact OH-CD 3.34Å; Y1152-P1220 WeakPolarHBondContact OH-CG 3.34Å; Y1152-L1223 HydrophobicContact CD1-CD2 3.61Å; Y1152-L1223 HydrophobicContact CD2-CD1 3.86Å; Y1152-L1223 HydrophobicContact CD2-CD2 3.89Å; Y1152-L1223 HydrophobicContact CD2-CG 4.42Å; Y1152-L1223 HydrophobicContact CE1-CD2 3.79Å; Y1152-L1223 HydrophobicContact CE2-CB 4.49Å; Y1152-L1223 HydrophobicContact CE2-CD1 4.14Å; Y1152-L1223 HydrophobicContact CE2-CD2 4.05Å; Y1152-L1223 HydrophobicContact CE2-CG 4.46Å; Y1152-L1223 HydrophobicContact CG-CD1 4.32Å; Y1152-L1223 HydrophobicContact CG-CD2 3.66Å; Y1152-K1288 PolarHBondContact N-O 2.98Å
1153	Q	87.1	Confident	92.3	Very high	53 Å²	53	39 Å²	39	25%	0.248	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	138.7	178.5	172.2	176.4	53.6	0	0	110.7	T1155 S1156 Y1158 Y1287	Q1153-T1155 VanDerWaalsContact C-N 3.32Å; Q1153-T1155 PolarHBondContact O-N 2.9Å; Q1153-S1156 PolarHBondContact N-O 3.01Å; Q1153-S1156 PolarHBondContact O-N 3.2Å; Q1153-Y1158 HydrophobicContact CB-CD2 4.49Å; Q1153-Y1158 HydrophobicContact CB-CE2 3.93Å; Q1153-Y1287 HydrophobicContact CB-CD2 3.71Å; Q1153-Y1287 HydrophobicContact CB-CE2 4.25Å; Q1153-Y1287 HydrophobicContact CG-CD2 4.25Å
1154	R	84.2	Confident	92.6	Very high	175 Å²	175	36 Å²	36	66%	0.66	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.3	53	171	-64.2	172.6	-175.7	171.3	1.8	113	S1156	R1154-S1156 PolarHBondContact O-N 3.15Å
1155	T	87.7	Confident	92.7	Very high	78 Å²	78	37.8 Å²	37.8	48%	0.479	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	20.9	179.5	65.7	0	0	0	0	115.8	Y1152 Q1153 V1218	Y1152-T1155 WeakPolarHBondContact OH-CA 3.48Å; Q1153-T1155 VanDerWaalsContact C-N 3.32Å; Q1153-T1155 PolarHBondContact O-N 2.9Å; T1155-V1218 CarbonylContact C-O 3.59Å; T1155-V1218 VanDerWaalsContact C-O 3.22Å; T1155-V1218 WeakPolarHBondContact CA-O 3.42Å; T1155-V1218 CarbonylContact O-C 3.59Å; T1155-V1218 PolarHBondContact O-N 2.63Å
1156	S	90.9	Very high	92.6	Very high	18 Å²	18	38.1 Å²	38.1	13%	0.126	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.1	174.2	-70.7	0	0	0	0	111.1	Y1152 Q1153 R1154 Y1158 E1215 F1216	Y1152-S1156 WeakPolarHBondContact CA-O 3.36Å; Y1152-S1156 VanDerWaalsContact CD2-O 3.22Å; Y1152-S1156 WeakPolarHBondContact CD2-O 3.4Å; Q1153-S1156 PolarHBondContact N-O 3.01Å; Q1153-S1156 PolarHBondContact O-N 3.2Å; R1154-S1156 PolarHBondContact O-N 3.15Å; S1156-Y1158 WeakPolarHBondContact CB-OH 3.42Å; S1156-E1215 WeakPolarHBondContact CB-OE1 3.25Å; S1156-E1215 PolarHBondContact OG-OE1 3.48Å; S1156-F1216 CarbonylContact C-O 3.59Å; S1156-F1216 WeakPolarHBondContact CA-O 3.39Å
1157	L	93.2	Very high	92.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	118.7	168.5	-179.4	71.1	0	0	0	109	G1151 Y1152 L1159 E1215 F1216 V1218 L1223 F1228 L1230 L1256	G1151-L1157 CarbonylContact O-C 3.58Å; G1151-L1157 WeakPolarHBondContact O-CA 3.47Å; Y1152-L1157 HydrophobicContact CD2-CB 4.4Å; L1157-L1159 HydrophobicContact CD1-CD2 4.37Å; L1157-L1159 HydrophobicContact CD2-CD2 4.06Å; L1157-L1159 HydrophobicContact CG-CD2 3.91Å; L1157-E1215 WeakPolarHBondContact O-CA 3.48Å; L1157-F1216 PolarHBondContact N-O 2.98Å; L1157-F1216 PolarHBondContact O-N 2.93Å; L1157-V1218 HydrophobicContact CB-CB 4.4Å; L1157-V1218 HydrophobicContact CB-CG2 3.99Å; L1157-L1223 HydrophobicContact CD1-CD1 4.3Å; L1157-F1228 HydrophobicContact CD2-CZ 4.06Å; L1157-L1230 HydrophobicContact CD2-CD2 4.46Å; L1157-L1256 HydrophobicContact CD1-CD1 3.92Å
1158	Y	93.4	Very high	92.1	Very high	64 Å²	64	38.8 Å²	38.8	25%	0.251	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	130.8	178.1	-61.4	-83.9	0	0	0	109.9	I1150 G1151 Q1153 S1156 E1215	I1150-Y1158 CarbonylContact C-O 3.58Å; I1150-Y1158 WeakPolarHBondContact CA-O 3.47Å; G1151-Y1158 PolarHBondContact N-O 3.41Å; G1151-Y1158 PolarHBondContact O-N 3.36Å; Q1153-Y1158 HydrophobicContact CB-CD2 4.49Å; Q1153-Y1158 HydrophobicContact CB-CE2 3.93Å; S1156-Y1158 WeakPolarHBondContact CB-OH 3.42Å; Y1158-E1215 HydrophobicContact CD1-CB 4.25Å; Y1158-E1215 HydrophobicContact CD1-CG 4.04Å; Y1158-E1215 HydrophobicContact CE1-CB 4.27Å; Y1158-E1215 HydrophobicContact CE1-CG 3.69Å; Y1158-E1215 WeakPolarHBondContact CE1-OE1 3.34Å; Y1158-E1215 PolarHBondContact OH-OE1 3.44Å
1159	L	94.7	Very high	91.7	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.016	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.1	177	-48.5	-179.2	0	0	0	109.1	K1149 I1150 L1157 V1182 H1213 F1214 F1216 L1230 F1232	K1149-L1159 CarbonylContact O-C 3.59Å; K1149-L1159 WeakPolarHBondContact O-CA 3.43Å; I1150-L1159 HydrophobicContact CB-CD2 4.14Å; I1150-L1159 HydrophobicContact CG2-CD2 3.58Å; L1157-L1159 HydrophobicContact CD1-CD2 4.37Å; L1157-L1159 HydrophobicContact CD2-CD2 4.06Å; L1157-L1159 HydrophobicContact CG-CD2 3.91Å; L1159-V1182 HydrophobicContact CD1-CG1 3.55Å; L1159-H1213 CarbonylContact O-C 3.58Å; L1159-H1213 VanDerWaalsContact O-CA 3.23Å; L1159-H1213 WeakPolarHBondContact O-CA 3.29Å; L1159-F1214 HydrophobicContact CB-CB 4.29Å; L1159-F1214 PolarHBondContact N-O 2.73Å; L1159-F1214 PolarHBondContact O-N 3.39Å; L1159-F1216 HydrophobicContact CD1-CD2 3.95Å; L1159-F1216 HydrophobicContact CD1-CE2 3.57Å; L1159-F1216 HydrophobicContact CG-CD2 4.36Å; L1159-F1216 HydrophobicContact CG-CE2 4.33Å; L1159-L1230 HydrophobicContact CD1-CD1 3.81Å; L1159-L1230 HydrophobicContact CD1-CD2 4.01Å; L1159-L1230 HydrophobicContact CD1-CG 4.48Å; L1159-L1230 HydrophobicContact CD2-CD2 3.44Å; L1159-L1230 VanDerWaalsContact CD2-CD2 3.44Å; L1159-L1230 HydrophobicContact CG-CD2 4.41Å; L1159-F1232 HydrophobicContact CD1-CE1 4.39Å; L1159-F1232 HydrophobicContact CD1-CZ 4.29Å
1160	D	94.3	Very high	91.4	Very high	19 Å²	19	41.3 Å²	41.3	10%	0.102	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	105.9	170.3	161.6	24.7	0	0	0	107.3	V1148 K1149 Q1162 H1213	V1148-D1160 CarbonylContact C-O 3.51Å; V1148-D1160 VanDerWaalsContact CA-O 3.31Å; V1148-D1160 WeakPolarHBondContact CA-O 3.5Å; K1149-D1160 HydrophobicContact CB-CB 4.11Å; K1149-D1160 WeakPolarHBondContact CD-OD2 3.48Å; K1149-D1160 PolarHBondContact N-O 2.71Å; K1149-D1160 IonicContact NZ-OD2 3.28Å; K1149-D1160 PolarHBondContact O-N 3.44Å; D1160-Q1162 PolarHBondContact OD2-NE2 3.05Å; D1160-H1213 IonicContact OD1-CE1 2.71Å; D1160-H1213 IonicContact OD1-NE2 3.16Å
1161	I	96	Very high	90.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	105.7	179.5	-55.9	-175.6	0	0	0	107.2	L1146 V1148 I1180 V1182 T1199 F1210 D1211 E1212 F1214 F1232	L1146-I1161 HydrophobicContact CD1-CG2 4.38Å; V1148-I1161 HydrophobicContact CG1-CG1 4.36Å; V1148-I1161 HydrophobicContact CG1-CG2 4.41Å; I1161-I1180 HydrophobicContact CD1-CG2 4.37Å; I1161-I1180 HydrophobicContact CG2-CD1 3.81Å; I1161-V1182 HydrophobicContact CD1-CG2 3.47Å; I1161-V1182 VanDerWaalsContact CD1-CG2 3.47Å; I1161-T1199 HydrophobicContact CD1-CG2 3.9Å; I1161-T1199 HydrophobicContact CG2-CG2 4.38Å; I1161-F1210 HydrophobicContact CG2-CB 4.21Å; I1161-F1210 HydrophobicContact CG2-CD2 4Å; I1161-F1210 HydrophobicContact CG2-CG 4.3Å; I1161-D1211 VanDerWaalsContact O-CA 3.27Å; I1161-D1211 WeakPolarHBondContact O-CA 3.25Å; I1161-D1211 PolarHBondContact O-N 3.04Å; I1161-E1212 PolarHBondContact N-O 2.87Å; I1161-E1212 PolarHBondContact O-N 3.19Å; I1161-F1214 HydrophobicContact CD1-CD2 3.89Å; I1161-F1214 HydrophobicContact CD1-CE2 3.61Å; I1161-F1214 HydrophobicContact CG1-CD2 4.22Å; I1161-F1214 HydrophobicContact CG1-CE2 4.18Å; I1161-F1232 HydrophobicContact CD1-CD1 3.96Å; I1161-F1232 HydrophobicContact CD1-CE1 3.8Å; I1161-F1232 HydrophobicContact CG1-CD1 4.44Å; I1161-F1232 HydrophobicContact CG1-CE1 3.94Å
1162	Q	94.2	Very high	90.4	Very high	25 Å²	25	49.3 Å²	49.3	12%	0.117	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-63.5	-169.4	-46.8	-154	-66.7	0	0	110.8	T1147 D1160 F1210 D1211	T1147-Q1162 HydrophobicContact CG2-CB 4.44Å; T1147-Q1162 HydrophobicContact CG2-CG 4.49Å; T1147-Q1162 WeakPolarHBondContact O-CB 3.25Å; T1147-Q1162 PolarHBondContact O-N 3.44Å; D1160-Q1162 PolarHBondContact OD2-NE2 3.05Å; Q1162-F1210 PolarHBondContact O-N 3.05Å; Q1162-D1211 PolarHBondContact O-N 3.13Å; Q1162-D1211 VanDerWaalsContact O-N 3.1Å
1163	R	95.1	Very high	90	Very high	129 Å²	129	51.9 Å²	51.9	49%	0.487	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	155.7	-174.3	56.8	178.1	156.6	172.3	-5.8	112	T1147 P1208 V1209	T1147-R1163 PolarHBondContact N-O 3.32Å; T1147-R1163 PolarHBondContact O-N 2.74Å; R1163-P1208 CarbonylContact C-O 3.54Å; R1163-P1208 WeakPolarHBondContact CA-O 3.24Å; R1163-P1208 WeakPolarHBondContact CB-O 3.35Å; R1163-V1209 HydrophobicContact CB-CG2 4.21Å
1164	A	94.9	Very high	89.9	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	156.8	159.9	0	0	0	0	0	109.9	K1145 L1146 L1167 D1207 P1208 F1210	K1145-A1164 CarbonylContact O-C 3.28Å; K1145-A1164 WeakPolarHBondContact O-CA 3.43Å; L1146-A1164 HydrophobicContact CD1-CB 4.06Å; A1164-L1167 HydrophobicContact CB-CD1 3.83Å; A1164-L1167 HydrophobicContact CB-CD2 3.93Å; A1164-L1167 HydrophobicContact CB-CG 4Å; A1164-D1207 CarbonylContact O-C 3.52Å; A1164-D1207 WeakPolarHBondContact O-CA 3.35Å; A1164-P1208 HydrophobicContact CB-CG 3.87Å; A1164-P1208 PolarHBondContact N-O 2.74Å; A1164-P1208 WeakPolarHBondContact O-CD 3.19Å; A1164-F1210 HydrophobicContact CB-CE2 4.28Å
1165	T	92.8	Very high	90.1	Very high	39 Å²	39	46 Å²	46	24%	0.239	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.9	-178.5	57.8	0	0	0	0	111.3	G1144 K1145 L1167 D1207	G1144-T1165 CarbonylContact C-O 3.58Å; G1144-T1165 WeakPolarHBondContact CA-O 3.45Å; K1145-T1165 PolarHBondContact N-O 2.88Å; K1145-T1165 PolarHBondContact O-N 3.25Å; T1165-L1167 VanDerWaalsContact C-N 3.32Å; T1165-L1167 PolarHBondContact O-N 3.48Å; T1165-D1207 WeakPolarHBondContact CA-OD1 3.32Å; T1165-D1207 WeakPolarHBondContact CB-OD1 3.29Å
1166	N	91.6	Very high	90.3	Very high	106 Å²	106	42.3 Å²	42.3	57%	0.567	24%	0.24	S	C	*	.	S	Bend	trans	54.7	45.3	177.7	-167.5	81.7	0	0	0	112.7	G1144 V1206 D1207	G1144-N1166 WeakPolarHBondContact CA-O 3.22Å; G1144-N1166 PolarHBondContact N-O 2.86Å; N1166-V1206 PolarHBondContact N-O 2.79Å; N1166-V1206 VanDerWaalsContact N-O 3.13Å; N1166-D1207 PolarHBondContact N-OD1 3.06Å
1167	L	92.4	Very high	90.4	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.026	24%	0.237	C	C	.	.			trans	-64.7	159.3	171.7	-63.9	171.7	0	0	0	110.8	A1164 T1165 P1178 V1206 P1208 V1234 E1246 L1296	A1164-L1167 HydrophobicContact CB-CD1 3.83Å; A1164-L1167 HydrophobicContact CB-CD2 3.93Å; A1164-L1167 HydrophobicContact CB-CG 4Å; T1165-L1167 VanDerWaalsContact C-N 3.32Å; T1165-L1167 PolarHBondContact O-N 3.48Å; L1167-P1178 HydrophobicContact CD1-CB 3.7Å; L1167-P1178 HydrophobicContact CD1-CG 3.89Å; L1167-V1206 HydrophobicContact CB-CB 4.22Å; L1167-V1206 WeakPolarHBondContact CB-O 3.43Å; L1167-V1206 PolarHBondContact N-O 3.43Å; L1167-V1206 WeakPolarHBondContact O-CG1 3.15Å; L1167-P1208 VanDerWaalsContact CD1-CD 3.48Å; L1167-P1208 HydrophobicContact CD1-CG 3.6Å; L1167-V1234 HydrophobicContact CD1-CG1 4.35Å; L1167-V1234 HydrophobicContact CD2-CG1 4.14Å; L1167-E1246 VanDerWaalsContact CD1-OE2 3.29Å; L1167-E1246 WeakPolarHBondContact CD1-OE2 3.42Å; L1167-L1296 HydrophobicContact CD2-CD1 4.04Å; L1167-L1296 HydrophobicContact CD2-CD2 3.69Å
1168	V	88.4	Confident	90.4	Very high	24 Å²	24	42.1 Å²	42.1	15%	0.145	24%	0.237	C	C	.	.			trans	-75.7	127.5	175.7	-174.3	0	0	0	0	108.2	Y1143 L1170 S1176 I1333	Y1143-V1168 HydrophobicContact CD1-CG2 3.78Å; V1168-L1170 HydrophobicContact CB-CD2 4.25Å; V1168-L1170 HydrophobicContact CG1-CD2 3.83Å; V1168-L1170 PolarHBondContact O-N 3.19Å; V1168-S1176 PolarHBondContact O-OG 2.91Å; V1168-I1333 HydrophobicContact CG1-CD1 4.17Å; V1168-I1333 HydrophobicContact CG2-CD1 4.26Å
1169	P	86.2	Confident	90.6	Very high	64 Å²	64	39.4 Å²	39.4	42%	0.416	23%	0.227	S	C	.	.			trans	-72.5	112.2	171.9	28.9	-31.7	0	0	0	109.7	G1174 L1175 V1206	P1169-G1174 WeakPolarHBondContact CB-O 3.49Å; P1169-L1175 CarbonylContact C-O 3.59Å; P1169-L1175 VanDerWaalsContact CA-O 3.25Å; P1169-L1175 WeakPolarHBondContact CA-O 3.39Å; P1169-L1175 WeakPolarHBondContact CB-O 3.19Å; P1169-V1206 HydrophobicContact CB-CG1 4.03Å
1170	L	85.4	Confident	90.7	Very high	41 Å²	41	39.3 Å²	39.3	22%	0.215	23%	0.226	C	C	.	.			trans	-98.2	-23.7	178.6	-55.9	179.5	0	0	0	112.1	V1168 L1175 S1176 D1236 D1244 E1246 I1333	V1168-L1170 HydrophobicContact CB-CD2 4.25Å; V1168-L1170 HydrophobicContact CG1-CD2 3.83Å; V1168-L1170 PolarHBondContact O-N 3.19Å; L1170-L1175 PolarHBondContact N-O 3.33Å; L1170-S1176 PolarHBondContact N-OG 3.03Å; L1170-D1236 HydrophobicContact CB-CB 4.45Å; L1170-D1236 WeakPolarHBondContact CB-OD2 3.35Å; L1170-D1236 HydrophobicContact CD1-CB 4.05Å; L1170-D1244 HydrophobicContact CD1-CB 3.67Å; L1170-E1246 HydrophobicContact CD1-CB 4.48Å; L1170-E1246 HydrophobicContact CD1-CG 3.52Å; L1170-E1246 HydrophobicContact CG-CG 4.24Å; L1170-I1333 HydrophobicContact CD2-CG2 4.43Å
1171	D	84.4	Confident	90.8	Very high	33 Å²	33	39.7 Å²	39.7	18%	0.176	23%	0.228	C	C	.	.	S	Bend	trans	-72.8	150.4	175.6	-81.3	-38.5	0	0	0	113	N1173 G1174 L1175	D1171-N1173 WeakPolarHBondContact CB-OD1 3.13Å; D1171-N1173 PolarHBondContact O-N 3.24Å; D1171-G1174 PolarHBondContact O-N 2.89Å; D1171-L1175 VanDerWaalsContact CB-O 3.31Å; D1171-L1175 WeakPolarHBondContact CB-O 3.5Å; D1171-L1175 PolarHBondContact N-O 3.42Å
1172	S	81.3	Confident	90.8	Very high	136 Å²	136	39.7 Å²	39.7	95%	0.951	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-15	174.1	61.8	0	0	0	0	115.3	G1174	S1172-G1174 VanDerWaalsContact C-N 3.28Å
1173	N	82.3	Confident	90.8	Very high	78 Å²	78	39.9 Å²	39.9	42%	0.417	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-4.6	175.9	63.2	9.9	0	0	0	113	D1171 L1175 N1204	D1171-N1173 WeakPolarHBondContact CB-OD1 3.13Å; D1171-N1173 PolarHBondContact O-N 3.24Å; N1173-L1175 WeakPolarHBondContact OD1-CA 3.4Å; N1173-L1175 WeakPolarHBondContact OD1-CB 3.25Å; N1173-L1175 PolarHBondContact OD1-N 2.91Å; N1173-N1204 PolarHBondContact ND2-OD1 2.59Å
1174	G	84.1	Confident	90.8	Very high	46 Å²	46	34.1 Å²	34.1	47%	0.474	21%	0.207	S	C	.	.	S	Bend	trans	77.8	19.7	-174.3	0	0	0	0	0	114.2	P1169 D1171 S1172	P1169-G1174 WeakPolarHBondContact CB-O 3.49Å; D1171-G1174 PolarHBondContact O-N 2.89Å; S1172-G1174 VanDerWaalsContact C-N 3.28Å
1175	L	88.9	Confident	90.8	Very high	59 Å²	59	34.2 Å²	34.2	31%	0.309	21%	0.208	S	C	.	.	S	Bend	trans	-131.6	-164	175.2	-61.3	169.6	0	0	0	108.9	P1169 L1170 D1171 N1173 N1204 V1206	P1169-L1175 CarbonylContact C-O 3.59Å; P1169-L1175 VanDerWaalsContact CA-O 3.25Å; P1169-L1175 WeakPolarHBondContact CA-O 3.39Å; P1169-L1175 WeakPolarHBondContact CB-O 3.19Å; L1170-L1175 PolarHBondContact N-O 3.33Å; D1171-L1175 VanDerWaalsContact CB-O 3.31Å; D1171-L1175 WeakPolarHBondContact CB-O 3.5Å; D1171-L1175 PolarHBondContact N-O 3.42Å; N1173-L1175 WeakPolarHBondContact OD1-CA 3.4Å; N1173-L1175 WeakPolarHBondContact OD1-CB 3.25Å; N1173-L1175 PolarHBondContact OD1-N 2.91Å; L1175-N1204 HydrophobicContact CD1-CB 3.98Å; L1175-V1206 HydrophobicContact CD2-CG1 4.42Å
1176	S	91.1	Very high	90.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.197	C	C	.	.			trans	-148.2	165.5	172.3	-79.2	0	0	0	0	110	V1168 L1170 P1178 N1204 T1205 D1236 E1246	V1168-S1176 PolarHBondContact O-OG 2.91Å; L1170-S1176 PolarHBondContact N-OG 3.03Å; S1176-P1178 WeakPolarHBondContact O-CD 3.41Å; S1176-N1204 CarbonylContact O-C 3.5Å; S1176-N1204 WeakPolarHBondContact O-CA 3.19Å; S1176-N1204 PolarHBondContact O-N 2.91Å; S1176-N1204 VanDerWaalsContact O-N 3.15Å; S1176-T1205 PolarHBondContact O-N 3.48Å; S1176-D1236 WeakPolarHBondContact CA-OD2 3.13Å; S1176-D1236 WeakPolarHBondContact CB-OD2 3.35Å; S1176-D1236 PolarHBondContact OG-OD2 3.39Å; S1176-E1246 VanDerWaalsContact CB-OE1 3.22Å; S1176-E1246 WeakPolarHBondContact CB-OE1 3.19Å; S1176-E1246 PolarHBondContact OG-OE1 2.71Å
1177	D	92.8	Very high	90.8	Very high	14 Å²	14	30.4 Å²	30.4	8%	0.075	18%	0.183	C	C	.	.			trans	-108	62.9	170.7	-78.7	-3.5	0	0	0	111.1	I1201 V1202 K1203 N1204 D1236 H1237	D1177-I1201 HydrophobicContact CB-CG2 4.05Å; D1177-V1202 CarbonylContact C-O 3.58Å; D1177-V1202 WeakPolarHBondContact CA-O 2.93Å; D1177-K1203 WeakPolarHBondContact OD1-CA 3.35Å; D1177-K1203 WeakPolarHBondContact OD1-CB 3.39Å; D1177-N1204 PolarHBondContact OD1-N 2.78Å; D1177-D1236 WeakPolarHBondContact CA-OD1 3.15Å; D1177-D1236 PolarHBondContact N-OD1 2.85Å; D1177-H1237 HydrophobicContact CB-CB 4.16Å; D1177-H1237 PolarHBondContact O-N 2.88Å; D1177-H1237 VanDerWaalsContact O-N 3.14Å
1178	P	95.1	Very high	90.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	144	-168	26.8	-39.2	0	0	0	115	L1167 S1176 V1202 T1205 P1208 F1210 M1235	L1167-P1178 HydrophobicContact CD1-CB 3.7Å; L1167-P1178 HydrophobicContact CD1-CG 3.89Å; S1176-P1178 WeakPolarHBondContact O-CD 3.41Å; P1178-V1202 WeakPolarHBondContact CD-O 3.37Å; P1178-V1202 PolarHBondContact O-N 2.93Å; P1178-T1205 VanDerWaalsContact CD-O 3.26Å; P1178-T1205 WeakPolarHBondContact CD-O 3.5Å; P1178-T1205 HydrophobicContact CG-CG2 4.21Å; P1178-T1205 WeakPolarHBondContact CG-O 3.36Å; P1178-P1208 HydrophobicContact CB-CG 4.04Å; P1178-P1208 HydrophobicContact CG-CB 3.62Å; P1178-P1208 HydrophobicContact CG-CG 3.46Å; P1178-P1208 VanDerWaalsContact CG-CG 3.46Å; P1178-F1210 HydrophobicContact CB-CZ 4.43Å; P1178-M1235 CarbonylContact C-O 3.53Å; P1178-M1235 VanDerWaalsContact CA-O 3.27Å; P1178-M1235 WeakPolarHBondContact CA-O 3.37Å
1179	F	95.9	Very high	90.9	Very high	7 Å²	7	33.3 Å²	33.3	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	161.5	165.5	71	-81.1	0	0	0	111.3	I1181 I1201 M1235 H1237 D1243	F1179-I1181 HydrophobicContact CD2-CG1 4.23Å; F1179-I1181 HydrophobicContact CE2-CD1 4.02Å; F1179-I1181 HydrophobicContact CE2-CG1 3.78Å; F1179-I1201 HydrophobicContact CB-CG1 3.92Å; F1179-I1201 HydrophobicContact CD1-CG1 4.06Å; F1179-I1201 HydrophobicContact CG-CG1 4.13Å; F1179-M1235 HydrophobicContact CD1-CB 3.92Å; F1179-M1235 WeakPolarHBondContact CD1-O 3.41Å; F1179-M1235 HydrophobicContact CD2-CB 4.35Å; F1179-M1235 HydrophobicContact CE1-CB 3.39Å; F1179-M1235 HydrophobicContact CE1-CG 4.4Å; F1179-M1235 HydrophobicContact CE2-CB 3.88Å; F1179-M1235 HydrophobicContact CE2-CG 4.09Å; F1179-M1235 HydrophobicContact CG-CB 4.38Å; F1179-M1235 HydrophobicContact CZ-CB 3.37Å; F1179-M1235 HydrophobicContact CZ-CG 3.89Å; F1179-M1235 PolarHBondContact N-O 2.8Å; F1179-M1235 PolarHBondContact O-N 2.79Å; F1179-H1237 HydrophobicContact CD1-CB 3.95Å; F1179-H1237 HydrophobicContact CE1-CB 3.95Å; F1179-D1243 HydrophobicContact CE1-CB 4.18Å; F1179-D1243 HydrophobicContact CZ-CB 4.2Å; F1179-D1243 WeakPolarHBondContact CZ-OD2 3.25Å
1180	I	97	Very high	91.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.4	-174.7	-57.1	-178.4	0	0	0	110.3	L1146 I1161 V1182 R1198 T1199 F1210 F1232 I1233 V1234	L1146-I1180 HydrophobicContact CD1-CD1 3.33Å; L1146-I1180 HydrophobicContact CD2-CD1 4.21Å; L1146-I1180 HydrophobicContact CG-CD1 4.42Å; I1161-I1180 HydrophobicContact CD1-CG2 4.37Å; I1161-I1180 HydrophobicContact CG2-CD1 3.81Å; I1180-V1182 HydrophobicContact CG2-CG2 4.45Å; I1180-R1198 CarbonylContact O-C 3.58Å; I1180-R1198 WeakPolarHBondContact O-CA 3.2Å; I1180-T1199 HydrophobicContact CB-CG2 4Å; I1180-T1199 PolarHBondContact N-OG1 3.06Å; I1180-T1199 PolarHBondContact O-N 2.81Å; I1180-F1210 HydrophobicContact CD1-CD2 3.92Å; I1180-F1210 HydrophobicContact CD1-CE2 3.41Å; I1180-F1210 VanDerWaalsContact CD1-CE2 3.41Å; I1180-F1210 HydrophobicContact CD1-CZ 3.82Å; I1180-F1210 HydrophobicContact CG1-CE1 4.38Å; I1180-F1210 HydrophobicContact CG1-CE2 3.95Å; I1180-F1210 HydrophobicContact CG1-CZ 3.8Å; I1180-F1232 HydrophobicContact CG2-CB 3.94Å; I1180-F1232 HydrophobicContact CG2-CD1 4.04Å; I1180-I1233 CarbonylContact C-O 3.49Å; I1180-I1233 WeakPolarHBondContact CA-O 3.4Å; I1180-V1234 HydrophobicContact CD1-CG2 4.25Å; I1180-V1234 HydrophobicContact CG1-CG1 4.34Å; I1180-V1234 HydrophobicContact CG1-CG2 4.08Å
1181	I	95.9	Very high	91.2	Very high	28 Å²	28	34.1 Å²	34.1	14%	0.144	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.4	169.5	-53.8	171.5	0	0	0	108.6	F1179 E1183 S1196 S1197 R1198 F1232 I1233 M1235	F1179-I1181 HydrophobicContact CD2-CG1 4.23Å; F1179-I1181 HydrophobicContact CE2-CD1 4.02Å; F1179-I1181 HydrophobicContact CE2-CG1 3.78Å; I1181-E1183 HydrophobicContact CG2-CG 4.1Å; I1181-S1196 WeakPolarHBondContact CG2-OG 3.38Å; I1181-S1197 CarbonylContact C-O 3.46Å; I1181-S1197 WeakPolarHBondContact CA-O 3.42Å; I1181-R1198 HydrophobicContact CG1-CB 4.41Å; I1181-F1232 CarbonylContact O-C 3.22Å; I1181-F1232 WeakPolarHBondContact O-CA 3.39Å; I1181-I1233 HydrophobicContact CB-CB 4.23Å; I1181-I1233 PolarHBondContact N-O 3.33Å; I1181-I1233 PolarHBondContact O-N 3.13Å; I1181-M1235 HydrophobicContact CD1-CG 4.01Å; I1181-M1235 HydrophobicContact CG1-CG 4.44Å
1182	V	96.3	Very high	91.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	122.8	-177.7	-172.4	0	0	0	0	109.5	L1159 I1161 I1180 S1197 F1216 L1230 A1231 F1232	L1159-V1182 HydrophobicContact CD1-CG1 3.55Å; I1161-V1182 HydrophobicContact CD1-CG2 3.47Å; I1161-V1182 VanDerWaalsContact CD1-CG2 3.47Å; I1180-V1182 HydrophobicContact CG2-CG2 4.45Å; V1182-S1197 PolarHBondContact N-O 2.93Å; V1182-S1197 PolarHBondContact O-N 3Å; V1182-S1197 VanDerWaalsContact O-N 3.1Å; V1182-F1216 HydrophobicContact CG1-CE2 4.07Å; V1182-F1216 HydrophobicContact CG1-CZ 4.12Å; V1182-L1230 HydrophobicContact CG1-CD1 3.94Å; V1182-A1231 WeakPolarHBondContact CA-O 3.19Å; V1182-F1232 HydrophobicContact CG1-CE1 4.24Å; V1182-F1232 HydrophobicContact CG2-CD1 4.08Å; V1182-F1232 HydrophobicContact CG2-CE1 4.22Å
1183	E	94.5	Very high	91.5	Very high	29 Å²	29	38.4 Å²	38.4	14%	0.136	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.1	-178.3	-65	-174.8	170.7	0	0	112	I1181 L1185 S1196 A1231	I1181-E1183 HydrophobicContact CG2-CG 4.1Å; E1183-L1185 HydrophobicContact CB-CD1 4.06Å; E1183-L1185 HydrophobicContact CB-CG 4.09Å; E1183-S1196 WeakPolarHBondContact CG-OG 3.24Å; E1183-S1196 PolarHBondContact OE1-OG 3.48Å; E1183-A1231 PolarHBondContact N-O 3.25Å; E1183-A1231 PolarHBondContact O-N 3.02Å
1184	L	96	Very high	91.7	Very high	7 Å²	7	36 Å²	36	4%	0.037	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.2	171.6	-81.5	65.7	0	0	0	108.2	F1190 P1194 F1216 V1218 F1228 L1230	L1184-F1190 HydrophobicContact CB-CE1 4.42Å; L1184-F1190 HydrophobicContact CB-CE2 3.91Å; L1184-F1190 HydrophobicContact CB-CZ 3.76Å; L1184-F1190 HydrophobicContact CD2-CE1 4.11Å; L1184-F1190 HydrophobicContact CD2-CZ 4.24Å; L1184-F1190 HydrophobicContact CG-CZ 4.38Å; L1184-P1194 HydrophobicContact CB-CB 3.87Å; L1184-P1194 HydrophobicContact CB-CG 3.8Å; L1184-P1194 HydrophobicContact CD2-CB 4.4Å; L1184-P1194 WeakPolarHBondContact O-CG 3.41Å; L1184-F1216 HydrophobicContact CD1-CB 4.37Å; L1184-F1216 HydrophobicContact CD1-CD1 3.73Å; L1184-F1216 HydrophobicContact CD1-CD2 3.81Å; L1184-F1216 HydrophobicContact CD1-CE1 3.88Å; L1184-F1216 HydrophobicContact CD1-CE2 3.97Å; L1184-F1216 HydrophobicContact CD1-CG 3.69Å; L1184-F1216 HydrophobicContact CD1-CZ 3.99Å; L1184-F1216 HydrophobicContact CD2-CB 3.74Å; L1184-F1216 HydrophobicContact CD2-CD1 4.18Å; L1184-F1216 HydrophobicContact CD2-CG 3.96Å; L1184-V1218 HydrophobicContact CD2-CG2 3.71Å; L1184-F1228 HydrophobicContact CB-CE2 4.09Å; L1184-F1228 HydrophobicContact CD2-CE2 4.34Å; L1184-F1228 HydrophobicContact CD2-CZ 4.03Å; L1184-F1228 HydrophobicContact CG-CE2 3.86Å; L1184-F1228 HydrophobicContact CG-CZ 3.97Å; L1184-L1230 HydrophobicContact CD1-CD1 3.71Å; L1184-L1230 HydrophobicContact CG-CD1 4.31Å
1185	L	94.7	Very high	91.8	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	155.5	-170.5	-64.2	168	0	0	0	111.4	F1128 E1183 K1187 C1229 A1231 W1325	F1128-L1185 HydrophobicContact CD1-CB 4.32Å; F1128-L1185 HydrophobicContact CD1-CD1 4.49Å; F1128-L1185 HydrophobicContact CD2-CB 4.34Å; F1128-L1185 HydrophobicContact CE1-CB 4Å; F1128-L1185 HydrophobicContact CE1-CD1 3.56Å; F1128-L1185 HydrophobicContact CE1-CG 4.34Å; F1128-L1185 HydrophobicContact CE2-CB 3.98Å; F1128-L1185 HydrophobicContact CZ-CB 3.82Å; F1128-L1185 HydrophobicContact CZ-CD1 3.6Å; F1128-L1185 HydrophobicContact CZ-CD2 4.26Å; F1128-L1185 HydrophobicContact CZ-CG 4.09Å; E1183-L1185 HydrophobicContact CB-CD1 4.06Å; E1183-L1185 HydrophobicContact CB-CG 4.09Å; L1185-K1187 HydrophobicContact CD2-CG 4.16Å; L1185-C1229 PolarHBondContact N-O 3.39Å; L1185-C1229 PolarHBondContact O-N 3.37Å; L1185-C1229 VanDerWaalsContact O-O 3.13Å; L1185-A1231 HydrophobicContact CD1-CB 3.99Å; L1185-W1325 HydrophobicContact CD1-CH2 4.48Å; L1185-W1325 HydrophobicContact CD1-CZ2 3.57Å
1186	P	93.9	Very high	91.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.226	C	C	.	.	S	Bend	cis	-64.3	149.2	-14.4	-12.2	19.6	0	0	0	112.9	I1124 E1125 F1128 H1188 I1189 F1190 S1227	I1124-P1186 HydrophobicContact CG2-CB 3.88Å; I1124-P1186 HydrophobicContact CG2-CG 4.24Å; E1125-P1186 HydrophobicContact CG-CG 3.86Å; F1128-P1186 HydrophobicContact CD2-CB 4.28Å; F1128-P1186 HydrophobicContact CD2-CG 3.82Å; F1128-P1186 HydrophobicContact CE2-CB 4.38Å; F1128-P1186 HydrophobicContact CE2-CG 4.4Å; P1186-H1188 WeakPolarHBondContact CB-CE1 3.44Å; P1186-H1188 WeakPolarHBondContact CB-ND1 3.5Å; P1186-H1188 PolarHBondContact O-N 2.75Å; P1186-H1188 VanDerWaalsContact O-N 3.16Å; P1186-I1189 HydrophobicContact CB-CG2 4.37Å; P1186-I1189 HydrophobicContact CG-CG2 4.15Å; P1186-I1189 WeakPolarHBondContact O-CG1 3.45Å; P1186-I1189 PolarHBondContact O-N 3.31Å; P1186-F1190 VanDerWaalsContact O-CD2 3.3Å; P1186-F1190 WeakPolarHBondContact O-CD2 3.16Å; P1186-F1190 WeakPolarHBondContact O-CE2 3.42Å; P1186-S1227 WeakPolarHBondContact CD-O 3.44Å
1187	K	90.9	Very high	92	Very high	65 Å²	65	44.4 Å²	44.4	28%	0.283	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-60	-29.6	-178.3	-64.7	177.8	-175.4	169.1	0	114.5	L1185 I1189 T1193 E1320	L1185-K1187 HydrophobicContact CD2-CG 4.16Å; K1187-I1189 PolarHBondContact O-N 3.49Å; K1187-T1193 HydrophobicContact CB-CG2 4.04Å; K1187-T1193 HydrophobicContact CD-CG2 4.19Å; K1187-T1193 HydrophobicContact CG-CG2 4.42Å; K1187-E1320 IonicContact NZ-OE1 3.86Å; K1187-E1320 PolarHBondContact NZ-OE1 2.87Å
1188	H	90.3	Very high	92.1	Very high	65 Å²	65	52 Å²	52	30%	0.301	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-78.4	-13.7	-173.1	66.8	-97.6	0	0	0	114.7	P1121 E1125 P1186 F1190 Y1317	P1121-H1188 PolarHBondContact O-CE1 3.06Å; E1125-H1188 IonicContact OE1-NE2 3.44Å; E1125-H1188 PolarHBondContact OE1-NE2 3.03Å; P1186-H1188 WeakPolarHBondContact CB-CE1 3.44Å; P1186-H1188 WeakPolarHBondContact CB-ND1 3.5Å; P1186-H1188 PolarHBondContact O-N 2.75Å; P1186-H1188 VanDerWaalsContact O-N 3.16Å; H1188-F1190 PolarHBondContact O-N 2.84Å; H1188-Y1317 HydrophobicContact CB-CE1 4.31Å; H1188-Y1317 AromaticContact ND1-CE1 3.55Å; H1188-Y1317 AromaticContact ND1-CZ 3.71Å; H1188-Y1317 PolarHBondContact ND1-OH 3.12Å
1189	I	92.1	Very high	92.1	Very high	24 Å²	24	52.2 Å²	52.2	12%	0.123	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-76.1	-15.7	177.2	76.1	177.8	0	0	0	111.6	P1186 K1187 H1225 F1228	P1186-I1189 HydrophobicContact CB-CG2 4.37Å; P1186-I1189 HydrophobicContact CG-CG2 4.15Å; P1186-I1189 WeakPolarHBondContact O-CG1 3.45Å; P1186-I1189 PolarHBondContact O-N 3.31Å; K1187-I1189 PolarHBondContact O-N 3.49Å; I1189-H1225 HydrophobicContact CD1-CB 4.12Å; I1189-F1228 HydrophobicContact CD1-CB 3.61Å; I1189-F1228 HydrophobicContact CD1-CD2 4.23Å; I1189-F1228 HydrophobicContact CD1-CG 4.03Å
1190	F	92	Very high	92.1	Very high	18 Å²	18	60.1 Å²	60.1	8%	0.079	30%	0.297	C	S	.	.	S	Bend	trans	-96.9	137.9	-177.3	-56.2	-81.4	0	0	0	110.9	L1184 P1186 H1188 E1192 P1194 V1218 E1222 F1228	L1184-F1190 HydrophobicContact CB-CE1 4.42Å; L1184-F1190 HydrophobicContact CB-CE2 3.91Å; L1184-F1190 HydrophobicContact CB-CZ 3.76Å; L1184-F1190 HydrophobicContact CD2-CE1 4.11Å; L1184-F1190 HydrophobicContact CD2-CZ 4.24Å; L1184-F1190 HydrophobicContact CG-CZ 4.38Å; P1186-F1190 VanDerWaalsContact O-CD2 3.3Å; P1186-F1190 WeakPolarHBondContact O-CD2 3.16Å; P1186-F1190 WeakPolarHBondContact O-CE2 3.42Å; H1188-F1190 PolarHBondContact O-N 2.84Å; F1190-E1192 VanDerWaalsContact C-N 3.32Å; F1190-E1192 VanDerWaalsContact CB-O 3.31Å; F1190-E1192 WeakPolarHBondContact CB-O 3.41Å; F1190-E1192 PolarHBondContact O-N 3.42Å; F1190-P1194 HydrophobicContact CD2-CG 3.75Å; F1190-P1194 HydrophobicContact CE2-CG 4.16Å; F1190-P1194 HydrophobicContact CG-CG 4.19Å; F1190-V1218 HydrophobicContact CE1-CG1 4.45Å; F1190-V1218 HydrophobicContact CE1-CG2 4.47Å; F1190-E1222 WeakPolarHBondContact CA-OE1 3.46Å; F1190-E1222 HydrophobicContact CD1-CB 4.25Å; F1190-E1222 HydrophobicContact CD1-CG 4.24Å; F1190-E1222 HydrophobicContact CE1-CB 4.34Å; F1190-F1228 HydrophobicContact CE1-CD2 4.35Å; F1190-F1228 HydrophobicContact CE1-CE1 4.31Å; F1190-F1228 HydrophobicContact CE1-CE2 4.08Å; F1190-F1228 HydrophobicContact CE1-CZ 4.02Å; F1190-F1228 HydrophobicContact CE2-CD2 4.46Å; F1190-F1228 HydrophobicContact CE2-CE2 4.49Å; F1190-F1228 AromaticContact CZ-CD2 3.56Å; F1190-F1228 HydrophobicContact CZ-CD2 3.56Å; F1190-F1228 HydrophobicContact CZ-CE1 4.4Å; F1190-F1228 AromaticContact CZ-CE2 3.45Å; F1190-F1228 HydrophobicContact CZ-CE2 3.45Å; F1190-F1228 VanDerWaalsContact CZ-CE2 3.45Å; F1190-F1228 HydrophobicContact CZ-CG 4.17Å; F1190-F1228 AromaticContact CZ-CZ 3.87Å; F1190-F1228 HydrophobicContact CZ-CZ 3.87Å
1191	S	86	Confident	91.9	Very high	104 Å²	104	63.2 Å²	63.2	73%	0.727	31%	0.312	S	S	*	.	S	Bend	trans	-60.6	-39.6	175.5	47.7	0	0	0	0	113.1	E1222	S1191-E1222 PolarHBondContact N-OE1 2.93Å; S1191-E1222 PolarHBondContact OG-OE1 2.83Å
1192	E	85.4	Confident	91.8	Very high	151 Å²	151	63.7 Å²	63.7	71%	0.706	32%	0.316	S	S	*	.	S	Bend	trans	-112.2	135.8	170.1	-66.3	-173.1	175.1	0	0	109.9	F1190 P1194	F1190-E1192 VanDerWaalsContact C-N 3.32Å; F1190-E1192 VanDerWaalsContact CB-O 3.31Å; F1190-E1192 WeakPolarHBondContact CB-O 3.41Å; F1190-E1192 PolarHBondContact O-N 3.42Å; E1192-P1194 WeakPolarHBondContact O-CD 3.32Å; E1192-P1194 VanDerWaalsContact O-N 3.13Å
1193	T	85.5	Confident	91.6	Very high	109 Å²	109	70 Å²	70	67%	0.669	34%	0.344	S	S	*	.			trans	-66.5	114.4	-176.8	-24.4	0	0	0	0	109.8	K1187 K1195	K1187-T1193 HydrophobicContact CB-CG2 4.04Å; K1187-T1193 HydrophobicContact CD-CG2 4.19Å; K1187-T1193 HydrophobicContact CG-CG2 4.42Å; T1193-K1195 PolarHBondContact O-N 3Å
1194	P	86.7	Confident	91.3	Very high	28 Å²	28	72.9 Å²	72.9	18%	0.182	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-69	135.6	-173.6	26.3	-33.2	0	0	0	110.6	L1184 F1190 E1192	L1184-P1194 HydrophobicContact CB-CB 3.87Å; L1184-P1194 HydrophobicContact CB-CG 3.8Å; L1184-P1194 HydrophobicContact CD2-CB 4.4Å; L1184-P1194 WeakPolarHBondContact O-CG 3.41Å; F1190-P1194 HydrophobicContact CD2-CG 3.75Å; F1190-P1194 HydrophobicContact CE2-CG 4.16Å; F1190-P1194 HydrophobicContact CG-CG 4.19Å; E1192-P1194 WeakPolarHBondContact O-CD 3.32Å; E1192-P1194 VanDerWaalsContact O-N 3.13Å
1195	K	86.8	Confident	91.2	Very high	179 Å²	179	74 Å²	74	78%	0.778	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-80.2	134.4	176	-68.9	-178.2	-178.7	175.1	0	110.3	T1193	T1193-K1195 PolarHBondContact O-N 3Å
1196	S	89.7	Confident	91.1	Very high	65 Å²	65	75.2 Å²	75.2	46%	0.455	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-63.5	136.8	169.1	-174.7	0	0	0	0	109.9	I1181 E1183	I1181-S1196 WeakPolarHBondContact CG2-OG 3.38Å; E1183-S1196 WeakPolarHBondContact CG-OG 3.24Å; E1183-S1196 PolarHBondContact OE1-OG 3.48Å
1197	S	94.2	Very high	91.1	Very high	36 Å²	36	79.2 Å²	79.2	25%	0.252	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	155.6	176.8	-63.9	0	0	0	0	109.4	I1181 V1182	I1181-S1197 CarbonylContact C-O 3.46Å; I1181-S1197 WeakPolarHBondContact CA-O 3.42Å; V1182-S1197 PolarHBondContact N-O 2.93Å; V1182-S1197 PolarHBondContact O-N 3Å; V1182-S1197 VanDerWaalsContact O-N 3.1Å
1198	R	94.8	Very high	91.3	Very high	173 Å²	173	76.1 Å²	76.1	65%	0.653	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.4	150.2	176.8	67.2	178.8	179.7	178.3	0.6	112	I1180 I1181	I1180-R1198 CarbonylContact O-C 3.58Å; I1180-R1198 WeakPolarHBondContact O-CA 3.2Å; I1181-R1198 HydrophobicContact CG1-CB 4.41Å
1199	T	96.4	Very high	91.6	Very high	6 Å²	6	77 Å²	77	4%	0.037	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-73	170.9	171.6	65.7	0	0	0	0	111.4	I1161 I1180 F1210 E1212 F1214	I1161-T1199 HydrophobicContact CD1-CG2 3.9Å; I1161-T1199 HydrophobicContact CG2-CG2 4.38Å; I1180-T1199 HydrophobicContact CB-CG2 4Å; I1180-T1199 PolarHBondContact N-OG1 3.06Å; I1180-T1199 PolarHBondContact O-N 2.81Å; T1199-F1210 HydrophobicContact CG2-CD1 4.19Å; T1199-F1210 HydrophobicContact CG2-CG 4.42Å; T1199-E1212 VanDerWaalsContact CA-OE2 3.25Å; T1199-E1212 WeakPolarHBondContact CA-OE2 3.25Å; T1199-E1212 HydrophobicContact CG2-CB 4.44Å; T1199-F1214 HydrophobicContact CG2-CE2 4.02Å; T1199-F1214 HydrophobicContact CG2-CZ 4.03Å
1200	R	94.5	Very high	91.7	Very high	173 Å²	173	76.4 Å²	76.4	65%	0.653	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-67.3	155.1	161.1	-65.1	172.2	-76.8	-170.5	-2	110.4	E1212	R1200-E1212 WeakPolarHBondContact CB-OE1 3.38Å; R1200-E1212 VanDerWaalsContact CG-OE1 3.3Å; R1200-E1212 WeakPolarHBondContact CG-OE1 3.28Å; R1200-E1212 IonicContact CZ-OE1 3.57Å; R1200-E1212 PolarHBondContact N-OE1 2.86Å; R1200-E1212 PolarHBondContact N-OE2 2.83Å; R1200-E1212 IonicContact NE-OE1 3.5Å; R1200-E1212 PolarHBondContact NE-OE1 2.93Å; R1200-E1212 IonicContact NH2-OE1 3.41Å
1201	I	94.1	Very high	91.7	Very high	65 Å²	65	79.9 Å²	79.9	33%	0.333	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-77.9	129.2	173.7	-64.7	154.5	0	0	0	108.7	D1177 F1179 K1203 H1237	D1177-I1201 HydrophobicContact CB-CG2 4.05Å; F1179-I1201 HydrophobicContact CB-CG1 3.92Å; F1179-I1201 HydrophobicContact CD1-CG1 4.06Å; F1179-I1201 HydrophobicContact CG-CG1 4.13Å; I1201-K1203 HydrophobicContact CG2-CG 4.38Å; I1201-H1237 HydrophobicContact CD1-CB 3.99Å; I1201-H1237 HydrophobicContact CG1-CB 4.08Å; I1201-H1237 HydrophobicContact CG2-CB 3.96Å
1202	V	93	Very high	92.2	Very high	37 Å²	37	76 Å²	76	22%	0.224	38%	0.379	C	S	.	.			trans	-107.6	114.5	176.1	-173.7	0	0	0	0	108.1	D1177 P1178 T1205 P1208 F1210	D1177-V1202 CarbonylContact C-O 3.58Å; D1177-V1202 WeakPolarHBondContact CA-O 2.93Å; P1178-V1202 WeakPolarHBondContact CD-O 3.37Å; P1178-V1202 PolarHBondContact O-N 2.93Å; V1202-T1205 HydrophobicContact CB-CG2 4.26Å; V1202-T1205 HydrophobicContact CG1-CG2 3.61Å; V1202-P1208 HydrophobicContact CB-CB 3.85Å; V1202-P1208 HydrophobicContact CG1-CB 4Å; V1202-P1208 HydrophobicContact CG2-CB 4.12Å; V1202-F1210 HydrophobicContact CG2-CD1 3.7Å; V1202-F1210 HydrophobicContact CG2-CE1 3.69Å
1203	K	91.2	Very high	92.6	Very high	132 Å²	132	75.4 Å²	75.4	57%	0.574	38%	0.376	S	S	*	.			trans	-82.3	146.8	-169.2	-60.3	-168.2	171.3	-160.4	0	114.3	D1177 I1201	D1177-K1203 WeakPolarHBondContact OD1-CA 3.35Å; D1177-K1203 WeakPolarHBondContact OD1-CB 3.39Å; I1201-K1203 HydrophobicContact CG2-CG 4.38Å
1204	N	89.8	Confident	93.1	Very high	90 Å²	90	71.7 Å²	71.7	48%	0.481	35%	0.351	S	S	.	.	S	Bend	trans	50	56.9	170.2	-57.8	-86	0	0	0	112.7	N1173 L1175 S1176 D1177	N1173-N1204 PolarHBondContact ND2-OD1 2.59Å; L1175-N1204 HydrophobicContact CD1-CB 3.98Å; S1176-N1204 CarbonylContact O-C 3.5Å; S1176-N1204 WeakPolarHBondContact O-CA 3.19Å; S1176-N1204 PolarHBondContact O-N 2.91Å; S1176-N1204 VanDerWaalsContact O-N 3.15Å; D1177-N1204 PolarHBondContact OD1-N 2.78Å
1205	T	93.9	Very high	93.4	Very high	31 Å²	31	75.6 Å²	75.6	19%	0.19	37%	0.366	C	S	.	.			trans	-155.1	142.4	178.1	-174	0	0	0	0	112.6	S1176 P1178 V1202 D1207 P1208	S1176-T1205 PolarHBondContact O-N 3.48Å; P1178-T1205 VanDerWaalsContact CD-O 3.26Å; P1178-T1205 WeakPolarHBondContact CD-O 3.5Å; P1178-T1205 HydrophobicContact CG-CG2 4.21Å; P1178-T1205 WeakPolarHBondContact CG-O 3.36Å; V1202-T1205 HydrophobicContact CB-CG2 4.26Å; V1202-T1205 HydrophobicContact CG1-CG2 3.61Å; T1205-D1207 PolarHBondContact OG1-N 2.93Å; T1205-D1207 PolarHBondContact OG1-O 2.81Å; T1205-P1208 HydrophobicContact CG2-CB 3.79Å
1206	V	91.9	Very high	93.7	Very high	28 Å²	28	67.7 Å²	67.7	17%	0.17	33%	0.332	C	S	.	.	S	Bend	trans	-98.3	-0.4	167.1	-65	0	0	0	0	112.5	N1166 L1167 P1169 L1175 P1208	N1166-V1206 PolarHBondContact N-O 2.79Å; N1166-V1206 VanDerWaalsContact N-O 3.13Å; L1167-V1206 HydrophobicContact CB-CB 4.22Å; L1167-V1206 WeakPolarHBondContact CB-O 3.43Å; L1167-V1206 PolarHBondContact N-O 3.43Å; L1167-V1206 WeakPolarHBondContact O-CG1 3.15Å; P1169-V1206 HydrophobicContact CB-CG1 4.03Å; L1175-V1206 HydrophobicContact CD2-CG1 4.42Å; V1206-P1208 VanDerWaalsContact C-CD 3.41Å
1207	D	94.3	Very high	93.8	Very high	84 Å²	84	69.4 Å²	69.4	45%	0.449	34%	0.341	S	S	.	.	S	Bend	trans	-127.3	60.1	177.4	-65.1	-63.4	0	0	0	110.7	A1164 T1165 N1166 T1205	A1164-D1207 CarbonylContact O-C 3.52Å; A1164-D1207 WeakPolarHBondContact O-CA 3.35Å; T1165-D1207 WeakPolarHBondContact CA-OD1 3.32Å; T1165-D1207 WeakPolarHBondContact CB-OD1 3.29Å; N1166-D1207 PolarHBondContact N-OD1 3.06Å; T1205-D1207 PolarHBondContact OG1-N 2.93Å; T1205-D1207 PolarHBondContact OG1-O 2.81Å
1208	P	95.5	Very high	93.7	Very high	1 Å²	1	67.8 Å²	67.8	1%	0.006	33%	0.33	C	S	.	.			trans	-68.2	138.8	-176.6	30.6	-38.5	0	0	0	112	R1163 A1164 L1167 P1178 V1202 T1205 V1206 F1210	R1163-P1208 CarbonylContact C-O 3.54Å; R1163-P1208 WeakPolarHBondContact CA-O 3.24Å; R1163-P1208 WeakPolarHBondContact CB-O 3.35Å; A1164-P1208 HydrophobicContact CB-CG 3.87Å; A1164-P1208 PolarHBondContact N-O 2.74Å; A1164-P1208 WeakPolarHBondContact O-CD 3.19Å; L1167-P1208 VanDerWaalsContact CD1-CD 3.48Å; L1167-P1208 HydrophobicContact CD1-CG 3.6Å; P1178-P1208 HydrophobicContact CB-CG 4.04Å; P1178-P1208 HydrophobicContact CG-CB 3.62Å; P1178-P1208 HydrophobicContact CG-CG 3.46Å; P1178-P1208 VanDerWaalsContact CG-CG 3.46Å; V1202-P1208 HydrophobicContact CB-CB 3.85Å; V1202-P1208 HydrophobicContact CG1-CB 4Å; V1202-P1208 HydrophobicContact CG2-CB 4.12Å; T1205-P1208 HydrophobicContact CG2-CB 3.79Å; V1206-P1208 VanDerWaalsContact C-CD 3.41Å; P1208-F1210 HydrophobicContact CB-CE1 4.15Å; P1208-F1210 HydrophobicContact CB-CE2 3.82Å; P1208-F1210 HydrophobicContact CB-CZ 3.62Å; P1208-F1210 HydrophobicContact CG-CE2 3.56Å; P1208-F1210 HydrophobicContact CG-CZ 3.55Å
1209	V	94.9	Very high	93.6	Very high	83 Å²	83	61.8 Å²	61.8	50%	0.503	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118	167.6	-178.2	0	0	0	0	107.7	R1163 D1211	R1163-V1209 HydrophobicContact CB-CG2 4.21Å; V1209-D1211 WeakPolarHBondContact CG1-OD2 3.11Å
1210	F	94.5	Very high	93.2	Very high	11 Å²	11	64.2 Å²	64.2	5%	0.048	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-51.1	-178.5	-58.6	-78.1	0	0	0	110.8	I1161 Q1162 A1164 P1178 I1180 T1199 V1202 P1208 E1212	I1161-F1210 HydrophobicContact CG2-CB 4.21Å; I1161-F1210 HydrophobicContact CG2-CD2 4Å; I1161-F1210 HydrophobicContact CG2-CG 4.3Å; Q1162-F1210 PolarHBondContact O-N 3.05Å; A1164-F1210 HydrophobicContact CB-CE2 4.28Å; P1178-F1210 HydrophobicContact CB-CZ 4.43Å; I1180-F1210 HydrophobicContact CD1-CD2 3.92Å; I1180-F1210 HydrophobicContact CD1-CE2 3.41Å; I1180-F1210 VanDerWaalsContact CD1-CE2 3.41Å; I1180-F1210 HydrophobicContact CD1-CZ 3.82Å; I1180-F1210 HydrophobicContact CG1-CE1 4.38Å; I1180-F1210 HydrophobicContact CG1-CE2 3.95Å; I1180-F1210 HydrophobicContact CG1-CZ 3.8Å; T1199-F1210 HydrophobicContact CG2-CD1 4.19Å; T1199-F1210 HydrophobicContact CG2-CG 4.42Å; V1202-F1210 HydrophobicContact CG2-CD1 3.7Å; V1202-F1210 HydrophobicContact CG2-CE1 3.69Å; P1208-F1210 HydrophobicContact CB-CE1 4.15Å; P1208-F1210 HydrophobicContact CB-CE2 3.82Å; P1208-F1210 HydrophobicContact CB-CZ 3.62Å; P1208-F1210 HydrophobicContact CG-CE2 3.56Å; P1208-F1210 HydrophobicContact CG-CZ 3.55Å; F1210-E1212 HydrophobicContact CB-CG 4.35Å; F1210-E1212 WeakPolarHBondContact O-CG 3.49Å; F1210-E1212 PolarHBondContact O-N 2.93Å
1211	D	93.2	Very high	92.9	Very high	91 Å²	91	63.7 Å²	63.7	49%	0.487	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	45.2	45.1	-172.4	-69	-32.5	0	0	0	113	I1161 Q1162 V1209	I1161-D1211 VanDerWaalsContact O-CA 3.27Å; I1161-D1211 WeakPolarHBondContact O-CA 3.25Å; I1161-D1211 PolarHBondContact O-N 3.04Å; Q1162-D1211 PolarHBondContact O-N 3.13Å; Q1162-D1211 VanDerWaalsContact O-N 3.1Å; V1209-D1211 WeakPolarHBondContact CG1-OD2 3.11Å
1212	E	96.4	Very high	92.8	Very high	24 Å²	24	61.6 Å²	61.6	11%	0.112	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.3	-177.3	-63.8	-163.1	-166.9	0	0	112.6	I1161 T1199 R1200 F1210 F1214	I1161-E1212 PolarHBondContact N-O 2.87Å; I1161-E1212 PolarHBondContact O-N 3.19Å; T1199-E1212 VanDerWaalsContact CA-OE2 3.25Å; T1199-E1212 WeakPolarHBondContact CA-OE2 3.25Å; T1199-E1212 HydrophobicContact CG2-CB 4.44Å; R1200-E1212 WeakPolarHBondContact CB-OE1 3.38Å; R1200-E1212 VanDerWaalsContact CG-OE1 3.3Å; R1200-E1212 WeakPolarHBondContact CG-OE1 3.28Å; R1200-E1212 IonicContact CZ-OE1 3.57Å; R1200-E1212 PolarHBondContact N-OE1 2.86Å; R1200-E1212 PolarHBondContact N-OE2 2.83Å; R1200-E1212 IonicContact NE-OE1 3.5Å; R1200-E1212 PolarHBondContact NE-OE1 2.93Å; R1200-E1212 IonicContact NH2-OE1 3.41Å; F1210-E1212 HydrophobicContact CB-CG 4.35Å; F1210-E1212 WeakPolarHBondContact O-CG 3.49Å; F1210-E1212 PolarHBondContact O-N 2.93Å; E1212-F1214 HydrophobicContact CB-CE2 3.86Å; E1212-F1214 HydrophobicContact CB-CZ 4.25Å
1213	H	93.7	Very high	92.7	Very high	138 Å²	138	59.8 Å²	59.8	64%	0.639	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.9	-173	-59.4	69.2	0	0	0	110.8	L1159 D1160	L1159-H1213 CarbonylContact O-C 3.58Å; L1159-H1213 VanDerWaalsContact O-CA 3.23Å; L1159-H1213 WeakPolarHBondContact O-CA 3.29Å; D1160-H1213 IonicContact OD1-CE1 2.71Å; D1160-H1213 IonicContact OD1-NE2 3.16Å
1214	F	95.1	Very high	92.7	Very high	31 Å²	31	58.7 Å²	58.7	14%	0.136	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.1	177.6	-57.4	-91.2	0	0	0	110.4	L1159 I1161 T1199 E1212 F1216	L1159-F1214 HydrophobicContact CB-CB 4.29Å; L1159-F1214 PolarHBondContact N-O 2.73Å; L1159-F1214 PolarHBondContact O-N 3.39Å; I1161-F1214 HydrophobicContact CD1-CD2 3.89Å; I1161-F1214 HydrophobicContact CD1-CE2 3.61Å; I1161-F1214 HydrophobicContact CG1-CD2 4.22Å; I1161-F1214 HydrophobicContact CG1-CE2 4.18Å; T1199-F1214 HydrophobicContact CG2-CE2 4.02Å; T1199-F1214 HydrophobicContact CG2-CZ 4.03Å; E1212-F1214 HydrophobicContact CB-CE2 3.86Å; E1212-F1214 HydrophobicContact CB-CZ 4.25Å; F1214-F1216 HydrophobicContact CB-CD2 4.49Å; F1214-F1216 HydrophobicContact CB-CE2 3.71Å; F1214-F1216 HydrophobicContact CB-CZ 4.3Å
1215	E	93.3	Very high	92.8	Very high	109 Å²	109	57 Å²	57	51%	0.509	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	130.4	177.1	-178.4	174.9	-174.2	0	0	109.7	S1156 L1157 Y1158	S1156-E1215 WeakPolarHBondContact CB-OE1 3.25Å; S1156-E1215 PolarHBondContact OG-OE1 3.48Å; L1157-E1215 WeakPolarHBondContact O-CA 3.48Å; Y1158-E1215 HydrophobicContact CD1-CB 4.25Å; Y1158-E1215 HydrophobicContact CD1-CG 4.04Å; Y1158-E1215 HydrophobicContact CE1-CB 4.27Å; Y1158-E1215 HydrophobicContact CE1-CG 3.69Å; Y1158-E1215 WeakPolarHBondContact CE1-OE1 3.34Å; Y1158-E1215 PolarHBondContact OH-OE1 3.44Å
1216	F	93.5	Very high	92.7	Very high	14 Å²	14	59.4 Å²	59.4	6%	0.061	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.4	177.9	-62.7	-86.3	0	0	0	110.3	S1156 L1157 L1159 V1182 L1184 F1214 V1218	S1156-F1216 CarbonylContact C-O 3.59Å; S1156-F1216 WeakPolarHBondContact CA-O 3.39Å; L1157-F1216 PolarHBondContact N-O 2.98Å; L1157-F1216 PolarHBondContact O-N 2.93Å; L1159-F1216 HydrophobicContact CD1-CD2 3.95Å; L1159-F1216 HydrophobicContact CD1-CE2 3.57Å; L1159-F1216 HydrophobicContact CG-CD2 4.36Å; L1159-F1216 HydrophobicContact CG-CE2 4.33Å; V1182-F1216 HydrophobicContact CG1-CE2 4.07Å; V1182-F1216 HydrophobicContact CG1-CZ 4.12Å; L1184-F1216 HydrophobicContact CD1-CB 4.37Å; L1184-F1216 HydrophobicContact CD1-CD1 3.73Å; L1184-F1216 HydrophobicContact CD1-CD2 3.81Å; L1184-F1216 HydrophobicContact CD1-CE1 3.88Å; L1184-F1216 HydrophobicContact CD1-CE2 3.97Å; L1184-F1216 HydrophobicContact CD1-CG 3.69Å; L1184-F1216 HydrophobicContact CD1-CZ 3.99Å; L1184-F1216 HydrophobicContact CD2-CB 3.74Å; L1184-F1216 HydrophobicContact CD2-CD1 4.18Å; L1184-F1216 HydrophobicContact CD2-CG 3.96Å; F1214-F1216 HydrophobicContact CB-CD2 4.49Å; F1214-F1216 HydrophobicContact CB-CE2 3.71Å; F1214-F1216 HydrophobicContact CB-CZ 4.3Å; F1216-V1218 HydrophobicContact CB-CG2 4.24Å; F1216-V1218 PolarHBondContact O-N 2.75Å
1217	P	91.4	Very high	92.7	Very high	100 Å²	100	58.1 Å²	58.1	65%	0.649	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.3	122	170.7	28.5	-32	0	0	0	109.1
1218	V	92.7	Very high	92.8	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.012	28%	0.284	C	S	.	.			trans	-144.6	121.4	-179.8	-178.9	0	0	0	0	109	Y1152 T1155 L1157 L1184 F1190 F1216 E1222 L1223 F1228	Y1152-V1218 HydrophobicContact CE2-CB 4.32Å; Y1152-V1218 WeakPolarHBondContact CE2-O 3.21Å; Y1152-V1218 PolarHBondContact OH-O 2.52Å; T1155-V1218 CarbonylContact C-O 3.59Å; T1155-V1218 VanDerWaalsContact C-O 3.22Å; T1155-V1218 WeakPolarHBondContact CA-O 3.42Å; T1155-V1218 CarbonylContact O-C 3.59Å; T1155-V1218 PolarHBondContact O-N 2.63Å; L1157-V1218 HydrophobicContact CB-CB 4.4Å; L1157-V1218 HydrophobicContact CB-CG2 3.99Å; L1184-V1218 HydrophobicContact CD2-CG2 3.71Å; F1190-V1218 HydrophobicContact CE1-CG1 4.45Å; F1190-V1218 HydrophobicContact CE1-CG2 4.47Å; F1216-V1218 HydrophobicContact CB-CG2 4.24Å; F1216-V1218 PolarHBondContact O-N 2.75Å; V1218-E1222 HydrophobicContact CG1-CB 3.83Å; V1218-L1223 HydrophobicContact CG1-CB 4.11Å; V1218-L1223 HydrophobicContact CG1-CD1 4.4Å; V1218-F1228 HydrophobicContact CG1-CE1 3.98Å
1219	T	91.5	Very high	92.8	Very high	48 Å²	48	54 Å²	54	29%	0.294	28%	0.284	S	S	.	.			trans	-69.9	158	176.3	64.5	0	0	0	0	111.6	E1221 E1222 L1223	T1219-E1221 PolarHBondContact O-N 3.03Å; T1219-E1222 WeakPolarHBondContact CB-OE2 3.39Å; T1219-E1222 WeakPolarHBondContact CG2-OE2 3.12Å; T1219-E1222 PolarHBondContact N-OE2 3.45Å; T1219-E1222 PolarHBondContact O-N 3.04Å; T1219-E1222 WeakPolarHBondContact OG1-CB 3.27Å; T1219-E1222 WeakPolarHBondContact OG1-CG 3.12Å; T1219-E1222 PolarHBondContact OG1-N 2.72Å; T1219-E1222 PolarHBondContact OG1-OE2 3Å; T1219-L1223 WeakPolarHBondContact O-CB 3.22Å; T1219-L1223 PolarHBondContact O-N 2.97Å
1220	P	88.1	Confident	92.8	Very high	56 Å²	56	50.1 Å²	50.1	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-63.5	-25	179.3	-23.1	34.4	0	0	0	113.4	Y1152 Q1224	Y1152-P1220 WeakPolarHBondContact OH-CA 3.34Å; Y1152-P1220 WeakPolarHBondContact OH-CD 3.34Å; Y1152-P1220 WeakPolarHBondContact OH-CG 3.34Å; P1220-Q1224 WeakPolarHBondContact O-CG 3.36Å; P1220-Q1224 PolarHBondContact O-N 3.05Å; P1220-Q1224 PolarHBondContact O-NE2 2.67Å
1221	E	88.3	Confident	92.8	Very high	163 Å²	163	49.6 Å²	49.6	76%	0.762	26%	0.258	S	S	*	.	H	α-helix	trans	-73.9	-49.7	176.9	-69.4	156.3	-166.3	0	0	110.2	T1219 L1223 Q1224 H1225	T1219-E1221 PolarHBondContact O-N 3.03Å; E1221-L1223 VanDerWaalsContact C-N 3.32Å; E1221-L1223 PolarHBondContact O-N 3.16Å; E1221-Q1224 PolarHBondContact O-N 2.76Å; E1221-H1225 PolarHBondContact O-N 2.76Å
1222	E	93.3	Very high	93	Very high	20 Å²	20	45.2 Å²	45.2	9%	0.093	23%	0.234	C	C	.	.	H	α-helix	trans	-58.8	-41.8	173	-71	160.8	164.2	0	0	111.5	F1190 S1191 V1218 T1219 Q1224 H1225 F1228	F1190-E1222 WeakPolarHBondContact CA-OE1 3.46Å; F1190-E1222 HydrophobicContact CD1-CB 4.25Å; F1190-E1222 HydrophobicContact CD1-CG 4.24Å; F1190-E1222 HydrophobicContact CE1-CB 4.34Å; S1191-E1222 PolarHBondContact N-OE1 2.93Å; S1191-E1222 PolarHBondContact OG-OE1 2.83Å; V1218-E1222 HydrophobicContact CG1-CB 3.83Å; T1219-E1222 WeakPolarHBondContact CB-OE2 3.39Å; T1219-E1222 WeakPolarHBondContact CG2-OE2 3.12Å; T1219-E1222 PolarHBondContact N-OE2 3.45Å; T1219-E1222 PolarHBondContact O-N 3.04Å; T1219-E1222 WeakPolarHBondContact OG1-CB 3.27Å; T1219-E1222 WeakPolarHBondContact OG1-CG 3.12Å; T1219-E1222 PolarHBondContact OG1-N 2.72Å; T1219-E1222 PolarHBondContact OG1-OE2 3Å; E1222-Q1224 PolarHBondContact O-N 2.66Å; E1222-H1225 VanDerWaalsContact O-CB 3.3Å; E1222-H1225 WeakPolarHBondContact O-CB 3.48Å; E1222-H1225 PolarHBondContact O-N 3.48Å; E1222-F1228 WeakPolarHBondContact O-CD1 3.37Å
1223	L	90.9	Very high	92.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.6	-34.5	178.1	-170.3	79.3	0	0	0	112.8	Y1152 L1157 V1218 T1219 E1221 F1228 P1253 M1257	Y1152-L1223 HydrophobicContact CD1-CD2 3.61Å; Y1152-L1223 HydrophobicContact CD2-CD1 3.86Å; Y1152-L1223 HydrophobicContact CD2-CD2 3.89Å; Y1152-L1223 HydrophobicContact CD2-CG 4.42Å; Y1152-L1223 HydrophobicContact CE1-CD2 3.79Å; Y1152-L1223 HydrophobicContact CE2-CB 4.49Å; Y1152-L1223 HydrophobicContact CE2-CD1 4.14Å; Y1152-L1223 HydrophobicContact CE2-CD2 4.05Å; Y1152-L1223 HydrophobicContact CE2-CG 4.46Å; Y1152-L1223 HydrophobicContact CG-CD1 4.32Å; Y1152-L1223 HydrophobicContact CG-CD2 3.66Å; L1157-L1223 HydrophobicContact CD1-CD1 4.3Å; V1218-L1223 HydrophobicContact CG1-CB 4.11Å; V1218-L1223 HydrophobicContact CG1-CD1 4.4Å; T1219-L1223 WeakPolarHBondContact O-CB 3.22Å; T1219-L1223 PolarHBondContact O-N 2.97Å; E1221-L1223 VanDerWaalsContact C-N 3.32Å; E1221-L1223 PolarHBondContact O-N 3.16Å; L1223-F1228 HydrophobicContact CD1-CE1 4.15Å; L1223-P1253 HydrophobicContact CD1-CB 3.8Å; L1223-M1257 HydrophobicContact CD2-CG 3.91Å; L1223-M1257 HydrophobicContact CD2-SD 4.18Å
1224	Q	90.2	Very high	93	Very high	109 Å²	109	37.5 Å²	37.5	51%	0.509	20%	0.199	S	C	.	.	H	α-helix	trans	-89.4	-4.4	-177.1	-75.8	174.6	73.6	0	0	113.3	P1220 E1221 E1222 M1257	P1220-Q1224 WeakPolarHBondContact O-CG 3.36Å; P1220-Q1224 PolarHBondContact O-N 3.05Å; P1220-Q1224 PolarHBondContact O-NE2 2.67Å; E1221-Q1224 PolarHBondContact O-N 2.76Å; E1222-Q1224 PolarHBondContact O-N 2.66Å; Q1224-M1257 HydrophobicContact CG-CG 4.31Å
1225	H	93.2	Very high	92.8	Very high	55 Å²	55	36.8 Å²	36.8	26%	0.255	20%	0.196	S	C	.	.			trans	-59.7	129.6	179.4	-161.3	-88.3	0	0	0	110.6	E1125 I1189 E1221 E1222 S1227 F1228	E1125-H1225 IonicContact OE1-CE1 3.26Å; E1125-H1225 IonicContact OE2-CE1 3.72Å; E1125-H1225 PolarHBondContact OE2-CE1 2.53Å; E1125-H1225 VanDerWaalsContact OE2-CE1 3.26Å; I1189-H1225 HydrophobicContact CD1-CB 4.12Å; E1221-H1225 PolarHBondContact O-N 2.76Å; E1222-H1225 VanDerWaalsContact O-CB 3.3Å; E1222-H1225 WeakPolarHBondContact O-CB 3.48Å; E1222-H1225 PolarHBondContact O-N 3.48Å; H1225-S1227 PolarHBondContact ND1-N 2.94Å; H1225-S1227 PolarHBondContact O-N 3.25Å; H1225-F1228 HydrophobicContact CB-CB 4.26Å; H1225-F1228 WeakPolarHBondContact O-CB 3.48Å; H1225-F1228 PolarHBondContact O-N 3.04Å; H1225-F1228 VanDerWaalsContact O-N 3.1Å
1226	P	91.6	Very high	92.7	Very high	80 Å²	80	31.6 Å²	31.6	52%	0.519	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-32	-172.3	23.2	-33.9	0	0	0	113.1
1227	S	92.2	Very high	92.5	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.007	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.3	-177.6	-38.3	0	0	0	0	113.1	E1125 I1129 P1186 H1225 C1229	E1125-S1227 WeakPolarHBondContact CB-OG 3.22Å; E1125-S1227 WeakPolarHBondContact OE2-CB 3.38Å; E1125-S1227 PolarHBondContact OE2-OG 3.04Å; I1129-S1227 WeakPolarHBondContact CD1-OG 3.09Å; P1186-S1227 WeakPolarHBondContact CD-O 3.44Å; H1225-S1227 PolarHBondContact ND1-N 2.94Å; H1225-S1227 PolarHBondContact O-N 3.25Å; S1227-C1229 PolarHBondContact O-N 2.83Å
1228	F	95.9	Very high	92.1	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.			trans	-63.7	115.4	178.5	-178.9	-167.2	0	0	0	110	L1157 L1184 I1189 F1190 V1218 E1222 L1223 H1225 P1253	L1157-F1228 HydrophobicContact CD2-CZ 4.06Å; L1184-F1228 HydrophobicContact CB-CE2 4.09Å; L1184-F1228 HydrophobicContact CD2-CE2 4.34Å; L1184-F1228 HydrophobicContact CD2-CZ 4.03Å; L1184-F1228 HydrophobicContact CG-CE2 3.86Å; L1184-F1228 HydrophobicContact CG-CZ 3.97Å; I1189-F1228 HydrophobicContact CD1-CB 3.61Å; I1189-F1228 HydrophobicContact CD1-CD2 4.23Å; I1189-F1228 HydrophobicContact CD1-CG 4.03Å; F1190-F1228 HydrophobicContact CE1-CD2 4.35Å; F1190-F1228 HydrophobicContact CE1-CE1 4.31Å; F1190-F1228 HydrophobicContact CE1-CE2 4.08Å; F1190-F1228 HydrophobicContact CE1-CZ 4.02Å; F1190-F1228 HydrophobicContact CE2-CD2 4.46Å; F1190-F1228 HydrophobicContact CE2-CE2 4.49Å; F1190-F1228 AromaticContact CZ-CD2 3.56Å; F1190-F1228 HydrophobicContact CZ-CD2 3.56Å; F1190-F1228 HydrophobicContact CZ-CE1 4.4Å; F1190-F1228 AromaticContact CZ-CE2 3.45Å; F1190-F1228 HydrophobicContact CZ-CE2 3.45Å; F1190-F1228 VanDerWaalsContact CZ-CE2 3.45Å; F1190-F1228 HydrophobicContact CZ-CG 4.17Å; F1190-F1228 AromaticContact CZ-CZ 3.87Å; F1190-F1228 HydrophobicContact CZ-CZ 3.87Å; V1218-F1228 HydrophobicContact CG1-CE1 3.98Å; E1222-F1228 WeakPolarHBondContact O-CD1 3.37Å; L1223-F1228 HydrophobicContact CD1-CE1 4.15Å; H1225-F1228 HydrophobicContact CB-CB 4.26Å; H1225-F1228 WeakPolarHBondContact O-CB 3.48Å; H1225-F1228 PolarHBondContact O-N 3.04Å; H1225-F1228 VanDerWaalsContact O-N 3.1Å; F1228-P1253 HydrophobicContact CD1-CB 3.85Å; F1228-P1253 HydrophobicContact CD1-CG 3.65Å; F1228-P1253 HydrophobicContact CD2-CG 4.04Å; F1228-P1253 HydrophobicContact CE1-CB 3.65Å; F1228-P1253 HydrophobicContact CE1-CG 3.52Å; F1228-P1253 HydrophobicContact CE2-CG 3.86Å; F1228-P1253 HydrophobicContact CG-CG 3.93Å; F1228-P1253 HydrophobicContact CZ-CB 4.18Å; F1228-P1253 HydrophobicContact CZ-CG 3.63Å; F1228-P1253 WeakPolarHBondContact O-CD 3.4Å
1229	C	94.3	Very high	91.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	119.6	178.6	-179.6	0	0	0	0	110	F1128 L1132 L1185 S1227 F1250	F1128-C1229 HydrophobicContact CB-CB 3.93Å; F1128-C1229 HydrophobicContact CD1-CB 4.14Å; F1128-C1229 HydrophobicContact CG-CB 4.21Å; L1132-C1229 HydrophobicContact CD1-CB 4.09Å; L1132-C1229 HydrophobicContact CD2-CB 4.21Å; L1132-C1229 HydrophobicContact CG-CB 4.17Å; L1185-C1229 PolarHBondContact N-O 3.39Å; L1185-C1229 PolarHBondContact O-N 3.37Å; L1185-C1229 VanDerWaalsContact O-O 3.13Å; S1227-C1229 PolarHBondContact O-N 2.83Å; C1229-F1250 WeakPolarHBondContact SG-CD1 3.34Å
1230	L	95.4	Very high	90.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	109.6	166	177.2	66.7	0	0	0	108.4	I1150 L1157 L1159 V1182 L1184 F1232 I1251 P1253	I1150-L1230 HydrophobicContact CG2-CD2 4.1Å; L1157-L1230 HydrophobicContact CD2-CD2 4.46Å; L1159-L1230 HydrophobicContact CD1-CD1 3.81Å; L1159-L1230 HydrophobicContact CD1-CD2 4.01Å; L1159-L1230 HydrophobicContact CD1-CG 4.48Å; L1159-L1230 HydrophobicContact CD2-CD2 3.44Å; L1159-L1230 VanDerWaalsContact CD2-CD2 3.44Å; L1159-L1230 HydrophobicContact CG-CD2 4.41Å; V1182-L1230 HydrophobicContact CG1-CD1 3.94Å; L1184-L1230 HydrophobicContact CD1-CD1 3.71Å; L1184-L1230 HydrophobicContact CG-CD1 4.31Å; L1230-F1232 HydrophobicContact CD2-CE2 3.56Å; L1230-F1232 HydrophobicContact CD2-CZ 3.55Å; L1230-F1232 HydrophobicContact CG-CD2 4.42Å; L1230-F1232 HydrophobicContact CG-CE2 3.62Å; L1230-F1232 HydrophobicContact CG-CZ 3.89Å; L1230-I1251 HydrophobicContact CB-CB 4.36Å; L1230-I1251 PolarHBondContact N-O 3.43Å; L1230-I1251 PolarHBondContact O-N 2.83Å; L1230-P1253 HydrophobicContact CB-CG 3.9Å
1231	A	95.3	Very high	90	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131.4	-178.2	0	0	0	0	0	111	V1182 E1183 L1185 V1249 F1250 W1325	V1182-A1231 WeakPolarHBondContact CA-O 3.19Å; E1183-A1231 PolarHBondContact N-O 3.25Å; E1183-A1231 PolarHBondContact O-N 3.02Å; L1185-A1231 HydrophobicContact CD1-CB 3.99Å; A1231-V1249 WeakPolarHBondContact CA-O 3.44Å; A1231-F1250 HydrophobicContact CB-CD1 3.85Å; A1231-F1250 HydrophobicContact CB-CE1 3.98Å; A1231-W1325 HydrophobicContact CB-CH2 4.33Å
1232	F	96.4	Very high	89.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	113.8	168.3	-60.4	-91.5	0	0	0	107.7	L1146 V1148 L1159 I1161 I1180 I1181 V1182 L1230 C1248 V1249 I1251	L1146-F1232 HydrophobicContact CD2-CB 3.54Å; L1146-F1232 HydrophobicContact CD2-CD1 4.11Å; L1146-F1232 HydrophobicContact CD2-CD2 4.36Å; L1146-F1232 HydrophobicContact CD2-CG 3.75Å; V1148-F1232 HydrophobicContact CB-CZ 4.37Å; V1148-F1232 HydrophobicContact CG1-CD1 4.33Å; V1148-F1232 HydrophobicContact CG1-CE1 3.95Å; V1148-F1232 HydrophobicContact CG1-CZ 4.04Å; V1148-F1232 HydrophobicContact CG2-CE2 4.34Å; V1148-F1232 HydrophobicContact CG2-CZ 4.24Å; L1159-F1232 HydrophobicContact CD1-CE1 4.39Å; L1159-F1232 HydrophobicContact CD1-CZ 4.29Å; I1161-F1232 HydrophobicContact CD1-CD1 3.96Å; I1161-F1232 HydrophobicContact CD1-CE1 3.8Å; I1161-F1232 HydrophobicContact CG1-CD1 4.44Å; I1161-F1232 HydrophobicContact CG1-CE1 3.94Å; I1180-F1232 HydrophobicContact CG2-CB 3.94Å; I1180-F1232 HydrophobicContact CG2-CD1 4.04Å; I1181-F1232 CarbonylContact O-C 3.22Å; I1181-F1232 WeakPolarHBondContact O-CA 3.39Å; V1182-F1232 HydrophobicContact CG1-CE1 4.24Å; V1182-F1232 HydrophobicContact CG2-CD1 4.08Å; V1182-F1232 HydrophobicContact CG2-CE1 4.22Å; L1230-F1232 HydrophobicContact CD2-CE2 3.56Å; L1230-F1232 HydrophobicContact CD2-CZ 3.55Å; L1230-F1232 HydrophobicContact CG-CD2 4.42Å; L1230-F1232 HydrophobicContact CG-CE2 3.62Å; L1230-F1232 HydrophobicContact CG-CZ 3.89Å; F1232-C1248 CarbonylContact O-C 3.5Å; F1232-C1248 WeakPolarHBondContact O-CA 3.49Å; F1232-C1248 WeakPolarHBondContact O-CB 3.41Å; F1232-V1249 HydrophobicContact CB-CB 4.31Å; F1232-V1249 HydrophobicContact CD2-CG1 4.46Å; F1232-V1249 PolarHBondContact N-O 2.68Å; F1232-V1249 PolarHBondContact O-N 2.92Å; F1232-I1251 HydrophobicContact CD2-CD1 4.07Å; F1232-I1251 HydrophobicContact CD2-CG1 4.25Å; F1232-I1251 HydrophobicContact CE2-CD1 3.49Å; F1232-I1251 VanDerWaalsContact CE2-CD1 3.49Å; F1232-I1251 HydrophobicContact CE2-CG1 3.93Å; F1232-I1251 HydrophobicContact CZ-CD1 4.4Å
1233	I	94.8	Very high	89.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	111.1	-177.7	-52.9	170.8	0	0	0	106.4	I1180 I1181 M1235 F1245 W1325 L1328	I1180-I1233 CarbonylContact C-O 3.49Å; I1180-I1233 WeakPolarHBondContact CA-O 3.4Å; I1181-I1233 HydrophobicContact CB-CB 4.23Å; I1181-I1233 PolarHBondContact N-O 3.33Å; I1181-I1233 PolarHBondContact O-N 3.13Å; I1233-M1235 HydrophobicContact CG2-CG 4.2Å; I1233-M1235 HydrophobicContact CG2-SD 3.7Å; I1233-F1245 HydrophobicContact CG2-CD2 3.96Å; I1233-F1245 HydrophobicContact CG2-CE2 3.76Å; I1233-W1325 HydrophobicContact CD1-CH2 3.98Å; I1233-W1325 HydrophobicContact CD1-CZ2 4.41Å; I1233-W1325 HydrophobicContact CG1-CH2 4.28Å; I1233-L1328 HydrophobicContact CD1-CD1 4.32Å; I1233-L1328 HydrophobicContact CG2-CD1 4.34Å; I1233-L1328 HydrophobicContact CG2-CD2 4.4Å
1234	V	94.6	Very high	89	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.7	179.7	-168.1	0	0	0	0	108.3	L1167 I1180 E1246 G1247 L1296	L1167-V1234 HydrophobicContact CD1-CG1 4.35Å; L1167-V1234 HydrophobicContact CD2-CG1 4.14Å; I1180-V1234 HydrophobicContact CD1-CG2 4.25Å; I1180-V1234 HydrophobicContact CG1-CG1 4.34Å; I1180-V1234 HydrophobicContact CG1-CG2 4.08Å; V1234-E1246 HydrophobicContact CB-CB 4.32Å; V1234-E1246 HydrophobicContact CG1-CB 4.15Å; V1234-E1246 WeakPolarHBondContact CG1-OE2 3.07Å; V1234-E1246 PolarHBondContact O-N 3.02Å; V1234-G1247 WeakPolarHBondContact CA-O 3.37Å; V1234-G1247 WeakPolarHBondContact CB-O 3.49Å; V1234-G1247 PolarHBondContact N-O 3.19Å; V1234-G1247 PolarHBondContact O-N 3.16Å; V1234-L1296 HydrophobicContact CB-CD2 3.73Å; V1234-L1296 HydrophobicContact CG1-CD2 4.24Å; V1234-L1296 HydrophobicContact CG2-CD2 3.54Å; V1234-L1296 HydrophobicContact CG2-CG 4.24Å
1235	M	92.4	Very high	89	Confident	16 Å²	16	43.3 Å²	43.3	8%	0.079	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	145.8	-173.5	-58.6	-65.9	-56.7	0	0	108.8	P1178 F1179 I1181 I1233 D1243 D1244 F1245 L1328	P1178-M1235 CarbonylContact C-O 3.53Å; P1178-M1235 VanDerWaalsContact CA-O 3.27Å; P1178-M1235 WeakPolarHBondContact CA-O 3.37Å; F1179-M1235 HydrophobicContact CD1-CB 3.92Å; F1179-M1235 WeakPolarHBondContact CD1-O 3.41Å; F1179-M1235 HydrophobicContact CD2-CB 4.35Å; F1179-M1235 HydrophobicContact CE1-CB 3.39Å; F1179-M1235 HydrophobicContact CE1-CG 4.4Å; F1179-M1235 HydrophobicContact CE2-CB 3.88Å; F1179-M1235 HydrophobicContact CE2-CG 4.09Å; F1179-M1235 HydrophobicContact CG-CB 4.38Å; F1179-M1235 HydrophobicContact CZ-CB 3.37Å; F1179-M1235 HydrophobicContact CZ-CG 3.89Å; F1179-M1235 PolarHBondContact N-O 2.8Å; F1179-M1235 PolarHBondContact O-N 2.79Å; I1181-M1235 HydrophobicContact CD1-CG 4.01Å; I1181-M1235 HydrophobicContact CG1-CG 4.44Å; I1233-M1235 HydrophobicContact CG2-CG 4.2Å; I1233-M1235 HydrophobicContact CG2-SD 3.7Å; M1235-D1243 HydrophobicContact CE-CB 4.04Å; M1235-D1243 VanDerWaalsContact CE-O 3.32Å; M1235-D1243 WeakPolarHBondContact CE-O 3.27Å; M1235-D1244 CarbonylContact C-O 3.57Å; M1235-D1244 VanDerWaalsContact CA-O 3.31Å; M1235-D1244 WeakPolarHBondContact CA-O 3.45Å; M1235-F1245 HydrophobicContact CE-CB 4.38Å; M1235-F1245 HydrophobicContact SD-CB 4.23Å; M1235-F1245 HydrophobicContact SD-CD2 3.84Å; M1235-L1328 HydrophobicContact SD-CD2 4.42Å
1236	D	90.6	Very high	88.7	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.5	167.4	-163.2	-5.4	0	0	0	109.5	L1170 S1176 D1177 D1243 D1244 E1246	L1170-D1236 HydrophobicContact CB-CB 4.45Å; L1170-D1236 WeakPolarHBondContact CB-OD2 3.35Å; L1170-D1236 HydrophobicContact CD1-CB 4.05Å; S1176-D1236 WeakPolarHBondContact CA-OD2 3.13Å; S1176-D1236 WeakPolarHBondContact CB-OD2 3.35Å; S1176-D1236 PolarHBondContact OG-OD2 3.39Å; D1177-D1236 WeakPolarHBondContact CA-OD1 3.15Å; D1177-D1236 PolarHBondContact N-OD1 2.85Å; D1236-D1243 CarbonylContact O-C 3.6Å; D1236-D1243 WeakPolarHBondContact O-CA 3.46Å; D1236-D1243 WeakPolarHBondContact O-CB 3.45Å; D1236-D1244 HydrophobicContact CB-CB 4.29Å; D1236-D1244 PolarHBondContact N-O 2.94Å; D1236-D1244 PolarHBondContact O-N 2.89Å; D1236-D1244 VanDerWaalsContact O-N 3.08Å; D1236-E1246 HydrophobicContact CB-CG 4.13Å; D1236-E1246 WeakPolarHBondContact CB-OE1 3.4Å
1237	H	88.9	Confident	88.7	Confident	49 Å²	49	36.9 Å²	36.9	23%	0.227	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-96.3	116.2	-178.1	179.9	52.1	0	0	0	112.5	D1177 F1179 I1201 D1243	D1177-H1237 HydrophobicContact CB-CB 4.16Å; D1177-H1237 PolarHBondContact O-N 2.88Å; D1177-H1237 VanDerWaalsContact O-N 3.14Å; F1179-H1237 HydrophobicContact CD1-CB 3.95Å; F1179-H1237 HydrophobicContact CE1-CB 3.95Å; I1201-H1237 HydrophobicContact CD1-CB 3.99Å; I1201-H1237 HydrophobicContact CG1-CB 4.08Å; I1201-H1237 HydrophobicContact CG2-CB 3.96Å; H1237-D1243 WeakPolarHBondContact CA-OD1 3.47Å; H1237-D1243 IonicContact CE1-OD1 3.67Å; H1237-D1243 IonicContact CG-OD1 3.52Å; H1237-D1243 IonicContact ND1-OD1 3.52Å; H1237-D1243 PolarHBondContact ND1-OD1 3.12Å; H1237-D1243 IonicContact ND1-OD2 3.75Å
1238	D	84.7	Confident	88.8	Confident	30 Å²	30	36.9 Å²	36.9	16%	0.16	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-101.1	136.8	179.1	-82.7	-67	0	0	0	113.1	M1241 D1243	D1238-M1241 HydrophobicContact CB-CB 4.17Å; D1238-D1243 PolarHBondContact N-OD1 3.33Å
1239	L	77.3	Confident	88.7	Confident	148 Å²	148	36.9 Å²	36.9	78%	0.775	20%	0.197	S	C	*	.	S	Bend	trans	-75.7	-28.2	179.5	-75.3	169.9	0	0	0	113.8
1240	I	73	Confident	88.7	Confident	163 Å²	163	37.1 Å²	37.1	84%	0.836	20%	0.198	S	C	*	.	S	Bend	trans	-121.5	-34	-170.4	-57.5	176	0	0	0	111.7
1241	M	76.9	Confident	88.6	Confident	141 Å²	141	37.3 Å²	37.3	70%	0.695	20%	0.199	S	C	*	.	S	Bend	trans	-99.7	178.6	179.5	-64	-99.4	58.7	0	0	110.4	D1238	D1238-M1241 HydrophobicContact CB-CB 4.17Å
1242	S	80	Confident	88.5	Confident	90 Å²	90	39.2 Å²	39.2	63%	0.629	21%	0.206	S	C	*	.	P	Polyproline II helix	trans	-70.5	140.2	168.2	48.4	0	0	0	0	110.2	D1244	S1242-D1244 PolarHBondContact O-N 2.83Å
1243	D	84.7	Confident	88.3	Confident	59 Å²	59	39.2 Å²	39.2	32%	0.316	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-48.1	126.1	172.7	-61.1	-24.2	0	0	0	111.7	F1179 M1235 D1236 H1237 D1238	F1179-D1243 HydrophobicContact CE1-CB 4.18Å; F1179-D1243 HydrophobicContact CZ-CB 4.2Å; F1179-D1243 WeakPolarHBondContact CZ-OD2 3.25Å; M1235-D1243 HydrophobicContact CE-CB 4.04Å; M1235-D1243 VanDerWaalsContact CE-O 3.32Å; M1235-D1243 WeakPolarHBondContact CE-O 3.27Å; D1236-D1243 CarbonylContact O-C 3.6Å; D1236-D1243 WeakPolarHBondContact O-CA 3.46Å; D1236-D1243 WeakPolarHBondContact O-CB 3.45Å; H1237-D1243 WeakPolarHBondContact CA-OD1 3.47Å; H1237-D1243 IonicContact CE1-OD1 3.67Å; H1237-D1243 IonicContact CG-OD1 3.52Å; H1237-D1243 IonicContact ND1-OD1 3.52Å; H1237-D1243 PolarHBondContact ND1-OD1 3.12Å; H1237-D1243 IonicContact ND1-OD2 3.75Å; D1238-D1243 PolarHBondContact N-OD1 3.33Å
1244	D	87.4	Confident	87.9	Confident	69 Å²	69	40.3 Å²	40.3	37%	0.369	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	144.1	-177.2	-78.7	-28.2	0	0	0	112.4	L1170 M1235 D1236 S1242	L1170-D1244 HydrophobicContact CD1-CB 3.67Å; M1235-D1244 CarbonylContact C-O 3.57Å; M1235-D1244 VanDerWaalsContact CA-O 3.31Å; M1235-D1244 WeakPolarHBondContact CA-O 3.45Å; D1236-D1244 HydrophobicContact CB-CB 4.29Å; D1236-D1244 PolarHBondContact N-O 2.94Å; D1236-D1244 PolarHBondContact O-N 2.89Å; D1236-D1244 VanDerWaalsContact O-N 3.08Å; S1242-D1244 PolarHBondContact O-N 2.83Å
1245	F	88.9	Confident	87.5	Confident	8 Å²	8	41.6 Å²	41.6	4%	0.035	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	121.2	179.7	174.9	-122.1	0	0	0	111.4	I1233 M1235 G1247 C1248 R1298 L1328 S1331	I1233-F1245 HydrophobicContact CG2-CD2 3.96Å; I1233-F1245 HydrophobicContact CG2-CE2 3.76Å; M1235-F1245 HydrophobicContact CE-CB 4.38Å; M1235-F1245 HydrophobicContact SD-CB 4.23Å; M1235-F1245 HydrophobicContact SD-CD2 3.84Å; F1245-G1247 WeakPolarHBondContact CE2-O 3.42Å; F1245-G1247 VanDerWaalsContact CZ-CA 3.42Å; F1245-C1248 HydrophobicContact CE2-CB 4.06Å; F1245-C1248 HydrophobicContact CZ-CB 3.96Å; F1245-R1298 HydrophobicContact CE1-CG 3.98Å; F1245-R1298 PolarHBondContact O-NH2 2.77Å; F1245-L1328 HydrophobicContact CB-CD2 4.08Å; F1245-L1328 HydrophobicContact CD1-CB 4.41Å; F1245-L1328 HydrophobicContact CD1-CD2 4.41Å; F1245-L1328 VanDerWaalsContact CD1-O 3.29Å; F1245-L1328 WeakPolarHBondContact CD1-O 3.39Å; F1245-L1328 HydrophobicContact CD2-CD2 3.67Å; F1245-L1328 HydrophobicContact CE1-CB 4.33Å; F1245-L1328 WeakPolarHBondContact CE1-O 3.25Å; F1245-L1328 HydrophobicContact CE2-CD2 4.14Å; F1245-L1328 HydrophobicContact CG-CD2 3.81Å; F1245-L1328 HydrophobicContact CZ-CB 4.47Å; F1245-S1331 WeakPolarHBondContact CD1-OG 3.49Å
1246	E	87.9	Confident	87.2	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-37.9	178.1	-73.3	-177.4	-164.6	0	0	112.5	L1167 L1170 S1176 V1234 D1236	L1167-E1246 VanDerWaalsContact CD1-OE2 3.29Å; L1167-E1246 WeakPolarHBondContact CD1-OE2 3.42Å; L1170-E1246 HydrophobicContact CD1-CB 4.48Å; L1170-E1246 HydrophobicContact CD1-CG 3.52Å; L1170-E1246 HydrophobicContact CG-CG 4.24Å; S1176-E1246 VanDerWaalsContact CB-OE1 3.22Å; S1176-E1246 WeakPolarHBondContact CB-OE1 3.19Å; S1176-E1246 PolarHBondContact OG-OE1 2.71Å; V1234-E1246 HydrophobicContact CB-CB 4.32Å; V1234-E1246 HydrophobicContact CG1-CB 4.15Å; V1234-E1246 WeakPolarHBondContact CG1-OE2 3.07Å; V1234-E1246 PolarHBondContact O-N 3.02Å; D1236-E1246 HydrophobicContact CB-CG 4.13Å; D1236-E1246 WeakPolarHBondContact CB-OE1 3.4Å
1247	G	91.7	Very high	86.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.7	176.9	179.5	0	0	0	0	0	112.4	V1234 F1245	V1234-G1247 WeakPolarHBondContact CA-O 3.37Å; V1234-G1247 WeakPolarHBondContact CB-O 3.49Å; V1234-G1247 PolarHBondContact N-O 3.19Å; V1234-G1247 PolarHBondContact O-N 3.16Å; F1245-G1247 WeakPolarHBondContact CE2-O 3.42Å; F1245-G1247 VanDerWaalsContact CZ-CA 3.42Å
1248	C	93.1	Very high	85.5	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	159	-178.9	61.2	0	0	0	0	112.8	F1232 F1245 F1250 L1296 I1297	F1232-C1248 CarbonylContact O-C 3.5Å; F1232-C1248 WeakPolarHBondContact O-CA 3.49Å; F1232-C1248 WeakPolarHBondContact O-CB 3.41Å; F1245-C1248 HydrophobicContact CE2-CB 4.06Å; F1245-C1248 HydrophobicContact CZ-CB 3.96Å; C1248-F1250 HydrophobicContact CB-CE2 4.36Å; C1248-F1250 HydrophobicContact CB-CZ 4.35Å; C1248-F1250 WeakPolarHBondContact SG-CE2 3.28Å; C1248-F1250 VanDerWaalsContact SG-CZ 3.56Å; C1248-L1296 CarbonylContact O-C 3.57Å; C1248-L1296 WeakPolarHBondContact O-CA 3.47Å; C1248-I1297 PolarHBondContact N-O 3.04Å; C1248-I1297 PolarHBondContact O-N 3.1Å; C1248-I1297 PolarHBondContact SG-O 3.07Å
1249	V	94.6	Very high	84	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.3	172.4	171.8	0	0	0	0	109.2	L1146 A1231 F1232 I1251 L1294 L1296	L1146-V1249 HydrophobicContact CB-CG2 3.99Å; L1146-V1249 HydrophobicContact CD2-CB 4.29Å; L1146-V1249 HydrophobicContact CD2-CG2 4.29Å; A1231-V1249 WeakPolarHBondContact CA-O 3.44Å; F1232-V1249 HydrophobicContact CB-CB 4.31Å; F1232-V1249 HydrophobicContact CD2-CG1 4.46Å; F1232-V1249 PolarHBondContact N-O 2.68Å; F1232-V1249 PolarHBondContact O-N 2.92Å; V1249-I1251 HydrophobicContact CG1-CD1 4.19Å; V1249-I1251 HydrophobicContact CG1-CG1 3.87Å; V1249-L1294 HydrophobicContact CG1-CB 3.79Å; V1249-L1294 HydrophobicContact CG1-CD1 3.59Å; V1249-L1294 HydrophobicContact CG1-CG 4.34Å; V1249-L1294 HydrophobicContact CG2-CB 4.39Å; V1249-L1296 HydrophobicContact CG2-CG 4.27Å
1250	F	94.7	Very high	82.5	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.9	178.6	-58.2	-76.7	0	0	0	111	K1131 L1132 Q1135 C1229 A1231 C1248 I1297 W1325	K1131-F1250 HydrophobicContact CB-CD1 4.34Å; K1131-F1250 HydrophobicContact CB-CD2 3.74Å; K1131-F1250 HydrophobicContact CB-CE1 4.29Å; K1131-F1250 HydrophobicContact CB-CE2 3.72Å; K1131-F1250 HydrophobicContact CB-CG 4.03Å; K1131-F1250 HydrophobicContact CB-CZ 3.98Å; K1131-F1250 HydrophobicContact CG-CE2 4.12Å; K1131-F1250 HydrophobicContact CG-CZ 4.11Å; L1132-F1250 HydrophobicContact CD2-CB 3.95Å; Q1135-F1250 HydrophobicContact CB-CB 4.44Å; Q1135-F1250 VanDerWaalsContact CG-O 3.27Å; Q1135-F1250 WeakPolarHBondContact CG-O 3.07Å; C1229-F1250 WeakPolarHBondContact SG-CD1 3.34Å; A1231-F1250 HydrophobicContact CB-CD1 3.85Å; A1231-F1250 HydrophobicContact CB-CE1 3.98Å; C1248-F1250 HydrophobicContact CB-CE2 4.36Å; C1248-F1250 HydrophobicContact CB-CZ 4.35Å; C1248-F1250 WeakPolarHBondContact SG-CE2 3.28Å; C1248-F1250 VanDerWaalsContact SG-CZ 3.56Å; F1250-I1297 HydrophobicContact CD2-CD1 3.75Å; F1250-I1297 HydrophobicContact CD2-CG1 4.19Å; F1250-I1297 HydrophobicContact CE2-CD1 3.93Å; F1250-I1297 HydrophobicContact CE2-CG1 4.17Å; F1250-W1325 AromaticContact CE1-CH2 3.49Å; F1250-W1325 HydrophobicContact CE1-CH2 3.49Å; F1250-W1325 VanDerWaalsContact CE1-CH2 3.49Å; F1250-W1325 HydrophobicContact CE1-CZ2 4.35Å; F1250-W1325 AromaticContact CE1-CZ3 3.72Å; F1250-W1325 HydrophobicContact CE1-CZ3 3.72Å; F1250-W1325 HydrophobicContact CZ-CE3 4.38Å; F1250-W1325 AromaticContact CZ-CH2 3.82Å; F1250-W1325 HydrophobicContact CZ-CH2 3.82Å; F1250-W1325 AromaticContact CZ-CZ3 3.51Å; F1250-W1325 HydrophobicContact CZ-CZ3 3.51Å
1251	I	93.8	Very high	80.9	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.9	-177.1	-51.2	-170.6	0	0	0	109.6	L1132 V1148 I1150 L1230 F1232 V1249 P1253 L1292 L1294	L1132-I1251 VanDerWaalsContact CD2-C 3.44Å; V1148-I1251 HydrophobicContact CG2-CD1 3.51Å; I1150-I1251 HydrophobicContact CD1-CG2 3.9Å; L1230-I1251 HydrophobicContact CB-CB 4.36Å; L1230-I1251 PolarHBondContact N-O 3.43Å; L1230-I1251 PolarHBondContact O-N 2.83Å; F1232-I1251 HydrophobicContact CD2-CD1 4.07Å; F1232-I1251 HydrophobicContact CD2-CG1 4.25Å; F1232-I1251 HydrophobicContact CE2-CD1 3.49Å; F1232-I1251 VanDerWaalsContact CE2-CD1 3.49Å; F1232-I1251 HydrophobicContact CE2-CG1 3.93Å; F1232-I1251 HydrophobicContact CZ-CD1 4.4Å; V1249-I1251 HydrophobicContact CG1-CD1 4.19Å; V1249-I1251 HydrophobicContact CG1-CG1 3.87Å; I1251-P1253 WeakPolarHBondContact O-CD 3.18Å; I1251-L1292 HydrophobicContact CD1-CD1 3.7Å; I1251-L1292 HydrophobicContact CG1-CD1 4.45Å; I1251-L1292 HydrophobicContact CG2-CD1 3.56Å; I1251-L1294 HydrophobicContact CD1-CD1 3.79Å; I1251-L1294 HydrophobicContact CG1-CD1 3.71Å
1252	R	93.1	Very high	78.9	Confident	40 Å²	40	49.8 Å²	49.8	15%	0.151	27%	0.268	C	S	.	.			trans	-83.9	104.7	173.3	-175.2	174.9	-77.4	143.2	-5.2	109.2	L1132 N1133 E1136 S1254 L1255	L1132-R1252 HydrophobicContact CD1-CB 4.29Å; L1132-R1252 HydrophobicContact CD1-CG 4.44Å; L1132-R1252 HydrophobicContact CD2-CB 3.97Å; N1133-R1252 PolarHBondContact OD1-NH2 3.38Å; E1136-R1252 VanDerWaalsContact CD-NH1 3.33Å; E1136-R1252 IonicContact OE1-CZ 3.46Å; E1136-R1252 IonicContact OE1-NH1 2.7Å; E1136-R1252 PolarHBondContact OE1-NH1 2.87Å; E1136-R1252 IonicContact OE2-NH1 2.86Å; E1136-R1252 PolarHBondContact OE2-NH1 3.11Å; R1252-S1254 VanDerWaalsContact CG-OG 3.3Å; R1252-S1254 WeakPolarHBondContact CG-OG 3.42Å; R1252-S1254 PolarHBondContact O-N 3.28Å; R1252-L1255 HydrophobicContact CB-CD1 4.4Å; R1252-L1255 HydrophobicContact CB-CG 4.3Å; R1252-L1255 WeakPolarHBondContact O-CB 3.26Å; R1252-L1255 WeakPolarHBondContact O-CD1 3.44Å; R1252-L1255 WeakPolarHBondContact O-CG 3.4Å; R1252-L1255 PolarHBondContact O-N 3.49Å; R1252-L1255 VanDerWaalsContact O-N 3.12Å
1253	P	91.1	Very high	76.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-68.7	-22.1	-170.7	-25.8	42	0	0	0	113.3	L1223 F1228 L1230 I1251 L1255 L1256	L1223-P1253 HydrophobicContact CD1-CB 3.8Å; F1228-P1253 HydrophobicContact CD1-CB 3.85Å; F1228-P1253 HydrophobicContact CD1-CG 3.65Å; F1228-P1253 HydrophobicContact CD2-CG 4.04Å; F1228-P1253 HydrophobicContact CE1-CB 3.65Å; F1228-P1253 HydrophobicContact CE1-CG 3.52Å; F1228-P1253 HydrophobicContact CE2-CG 3.86Å; F1228-P1253 HydrophobicContact CG-CG 3.93Å; F1228-P1253 HydrophobicContact CZ-CB 4.18Å; F1228-P1253 HydrophobicContact CZ-CG 3.63Å; F1228-P1253 WeakPolarHBondContact O-CD 3.4Å; L1230-P1253 HydrophobicContact CB-CG 3.9Å; I1251-P1253 WeakPolarHBondContact O-CD 3.18Å; P1253-L1255 PolarHBondContact O-N 3.44Å; P1253-L1256 WeakPolarHBondContact O-CB 3.06Å; P1253-L1256 PolarHBondContact O-N 3.3Å
1254	S	87.7	Confident	74.1	Confident	24 Å²	24	61 Å²	61	17%	0.168	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-60.5	-12.9	173.5	67.4	0	0	0	0	114	R1252 L1256 M1257	R1252-S1254 VanDerWaalsContact CG-OG 3.3Å; R1252-S1254 WeakPolarHBondContact CG-OG 3.42Å; R1252-S1254 PolarHBondContact O-N 3.28Å; S1254-L1256 PolarHBondContact O-N 2.96Å; S1254-M1257 WeakPolarHBondContact O-CB 3.42Å; S1254-M1257 PolarHBondContact O-N 3.17Å
1255	L	86	Confident	71.5	Confident	26 Å²	26	63.6 Å²	63.6	14%	0.136	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-56.5	-28.2	167.6	-68.1	174.1	0	0	0	112.8	R1252 P1253 M1257 K1258 L1290	R1252-L1255 HydrophobicContact CB-CD1 4.4Å; R1252-L1255 HydrophobicContact CB-CG 4.3Å; R1252-L1255 WeakPolarHBondContact O-CB 3.26Å; R1252-L1255 WeakPolarHBondContact O-CD1 3.44Å; R1252-L1255 WeakPolarHBondContact O-CG 3.4Å; R1252-L1255 PolarHBondContact O-N 3.49Å; R1252-L1255 VanDerWaalsContact O-N 3.12Å; P1253-L1255 PolarHBondContact O-N 3.44Å; L1255-M1257 PolarHBondContact O-N 3.12Å; L1255-K1258 HydrophobicContact CD2-CD 3.96Å; L1255-K1258 PolarHBondContact O-N 3.28Å; L1255-L1290 HydrophobicContact CB-CD1 4.4Å
1256	L	84.9	Confident	68.8	Low	5 Å²	5	68.7 Å²	68.7	3%	0.026	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-64.8	-19.1	174	-72.9	165.9	0	0	0	113.1	I1150 L1157 P1253 S1254 K1288 L1290	I1150-L1256 HydrophobicContact CB-CD1 4.44Å; I1150-L1256 HydrophobicContact CD1-CD1 3.95Å; I1150-L1256 HydrophobicContact CD1-CD2 4.44Å; I1150-L1256 HydrophobicContact CD1-CG 4Å; I1150-L1256 HydrophobicContact CG1-CD1 4.11Å; I1150-L1256 HydrophobicContact CG1-CD2 4.16Å; I1150-L1256 HydrophobicContact CG1-CG 4.22Å; L1157-L1256 HydrophobicContact CD1-CD1 3.92Å; P1253-L1256 WeakPolarHBondContact O-CB 3.06Å; P1253-L1256 PolarHBondContact O-N 3.3Å; S1254-L1256 PolarHBondContact O-N 2.96Å; L1256-K1288 WeakPolarHBondContact O-CD 3.04Å; L1256-L1290 HydrophobicContact CD2-CB 3.85Å; L1256-L1290 HydrophobicContact CD2-CD1 4.25Å
1257	M	76.2	Confident	66.6	Low	72 Å²	72	73.8 Å²	73.8	36%	0.355	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-96.7	-14.9	-177.6	-64.6	-61.8	-78.1	0	0	113.8	L1223 Q1224 S1254 L1255 S1259	L1223-M1257 HydrophobicContact CD2-CG 3.91Å; L1223-M1257 HydrophobicContact CD2-SD 4.18Å; Q1224-M1257 HydrophobicContact CG-CG 4.31Å; S1254-M1257 WeakPolarHBondContact O-CB 3.42Å; S1254-M1257 PolarHBondContact O-N 3.17Å; L1255-M1257 PolarHBondContact O-N 3.12Å; M1257-S1259 PolarHBondContact O-N 2.74Å
1258	K	68.5	Low	64	Low	123 Å²	123	82.2 Å²	82.2	54%	0.535	42%	0.421	S	S	.	.	S	Bend	trans	-67	121.8	-179.1	-68.4	-175.3	-179.5	176	0	110.5	L1255	L1255-K1258 HydrophobicContact CD2-CD 3.96Å; L1255-K1258 PolarHBondContact O-N 3.28Å
1259	S	52.2	Low	61.3	Low	91 Å²	91	89 Å²	89	64%	0.636	46%	0.457	S	S	*	.			trans	-63.6	135.7	178.3	54.4	0	0	0	0	111.6	M1257 N1261	M1257-S1259 PolarHBondContact O-N 2.74Å; S1259-N1261 VanDerWaalsContact C-N 3.28Å; S1259-N1261 PolarHBondContact O-N 3.18Å
1260	S	47	Very low	58.5	Low	76 Å²	76	91.4 Å²	91.4	53%	0.531	47%	0.474	S	S	.	.			trans	-63.8	75.4	179.3	-35.5	0	0	0	0	112.4	K1262	S1260-K1262 PolarHBondContact O-N 3.08Å
1261	N	39.7	Very low	56.5	Low	150 Å²	150	95 Å²	95	80%	0.802	49%	0.49	S	S	*	.			trans	-74.5	111.3	170.5	-87.2	-10.7	0	0	0	109.2	S1259 Q1263	S1259-N1261 VanDerWaalsContact C-N 3.28Å; S1259-N1261 PolarHBondContact O-N 3.18Å; N1261-Q1263 PolarHBondContact O-N 3.24Å; N1261-Q1263 VanDerWaalsContact O-N 3.12Å
1262	K	33.8	Very low	54.2	Low	203 Å²	203	98.5 Å²	98.5	88%	0.883	51%	0.508	S	S	*	.			trans	-53.7	104.1	178.7	-64.7	172.8	175.8	178.8	0	111.7	S1260	S1260-K1262 PolarHBondContact O-N 3.08Å
1263	Q	34	Very low	51.9	Low	173 Å²	173	100.5 Å²	100.5	81%	0.808	52%	0.524	S	S	*	.			trans	-136	114.3	146.1	-76.1	-173.2	-15.1	0	0	107	N1261 I1265	N1261-Q1263 PolarHBondContact O-N 3.24Å; N1261-Q1263 VanDerWaalsContact O-N 3.12Å; Q1263-I1265 PolarHBondContact O-N 2.79Å
1264	E	30.9	Very low	49.7	Very low	210 Å²	210	104.9 Å²	104.9	98%	0.981	54%	0.544	S	S	*	.			trans	-62.2	97.6	175.1	-73.4	173.3	156.4	0	0	108.7
1265	I	32.8	Very low	47.6	Very low	125 Å²	125	106.2 Å²	106.2	64%	0.641	55%	0.553	S	S	*	*			trans	-98.3	127.3	170.6	-61.5	171.7	0	0	0	106.9	Q1263	Q1263-I1265 PolarHBondContact O-N 2.79Å
1266	N	32	Very low	45.5	Very low	114 Å²	114	109.6 Å²	109.6	61%	0.61	57%	0.571	S	S	*	*			trans	-37.6	124	-176.7	-156.3	4.5	0	0	0	113.2	E1268 N1269	N1266-E1268 PolarHBondContact O-N 2.61Å; N1266-N1269 PolarHBondContact O-N 2.65Å
1267	P	41.2	Very low	43.2	Very low	109 Å²	109	112.8 Å²	112.8	71%	0.708	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-16.6	-169	21.1	-33.5	0	0	0	115.6	N1269	P1267-N1269 VanDerWaalsContact C-N 3.3Å; P1267-N1269 PolarHBondContact O-N 2.93Å
1268	E	37.6	Very low	41.1	Very low	176 Å²	176	120.8 Å²	120.8	82%	0.822	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-13.6	179.1	-70.3	-168.1	157.3	0	0	114	N1266	N1266-E1268 PolarHBondContact O-N 2.61Å
1269	N	36.1	Very low	39.5	Very low	143 Å²	143	122.3 Å²	122.3	77%	0.765	63%	0.633	S	S	*	*	S	Bend	trans	-120.3	2.7	-179.3	-78.5	-18	0	0	0	115.2	N1266 P1267 K1271	N1266-N1269 PolarHBondContact O-N 2.65Å; P1267-N1269 VanDerWaalsContact C-N 3.3Å; P1267-N1269 PolarHBondContact O-N 2.93Å; N1269-K1271 PolarHBondContact O-N 2.99Å
1270	S	35.3	Very low	38.6	Very low	52 Å²	52	126.6 Å²	126.6	36%	0.364	64%	0.644	S	S	.	*			trans	-84.9	102.9	-176.9	59.7	0	0	0	0	112.1	L1272	S1270-L1272 PolarHBondContact O-N 3.28Å
1271	K	51.8	Low	38.1	Very low	80 Å²	80	130.5 Å²	130.5	35%	0.348	66%	0.658	S	S	.	*	S	Bend	trans	-62.8	-11.7	172.7	-78.2	179.4	174.2	177.1	0	115.1	A1138 N1269	A1138-K1271 PolarHBondContact O-NZ 2.82Å; N1269-K1271 PolarHBondContact O-N 2.99Å
1272	L	46.5	Very low	37.8	Very low	76 Å²	76	135.2 Å²	135.2	40%	0.398	67%	0.665	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.3	109.1	-171.3	-56.3	176.1	0	0	0	109.7	S1270 F1274 L1290 L1292	S1270-L1272 PolarHBondContact O-N 3.28Å; L1272-F1274 HydrophobicContact CB-CE2 4.12Å; L1272-L1290 HydrophobicContact CD2-CD2 4.05Å; L1272-L1292 HydrophobicContact CD2-CD2 3.11Å; L1272-L1292 HydrophobicContact CG-CD2 4.49Å
1273	V	45.7	Very low	38.1	Very low	82 Å²	82	130.4 Å²	130.4	50%	0.497	66%	0.657	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.2	111.3	172.7	-177.8	0	0	0	0	108.7	Q1291	V1273-Q1291 PolarHBondContact N-O 3.26Å; V1273-Q1291 PolarHBondContact O-N 2.91Å; V1273-Q1291 VanDerWaalsContact O-N 3.09Å
1274	F	43.4	Very low	38.6	Very low	93 Å²	93	127 Å²	127	41%	0.408	66%	0.658	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.4	112	173.5	-69.6	-92.5	0	0	0	109.6	L1272 L1290	L1272-F1274 HydrophobicContact CB-CE2 4.12Å; F1274-L1290 HydrophobicContact CD1-CD1 3.69Å; F1274-L1290 HydrophobicContact CD1-CG 3.94Å; F1274-L1290 HydrophobicContact CE1-CD1 3.16Å; F1274-L1290 HydrophobicContact CE1-CG 3.86Å; F1274-L1290 HydrophobicContact CZ-CD1 3.69Å; F1274-L1290 HydrophobicContact CZ-CG 4.32Å
1275	S	43.1	Very low	39.4	Very low	51 Å²	51	122.3 Å²	122.3	36%	0.357	64%	0.64	S	S	.	*			trans	-95.1	93.1	170.3	54.9	0	0	0	0	109.9	S1277	S1275-S1277 PolarHBondContact O-N 3.32Å
1276	N	42.6	Very low	40.6	Very low	98 Å²	98	123.8 Å²	123.8	52%	0.524	64%	0.644	S	S	.	*			trans	-77.3	98	164.5	-78.7	-21.1	0	0	0	108.2	R1278	N1276-R1278 VanDerWaalsContact C-N 3.3Å; N1276-R1278 PolarHBondContact O-N 2.67Å
1277	S	36.7	Very low	42.2	Very low	72 Å²	72	121.8 Å²	121.8	50%	0.503	63%	0.629	S	S	.	*			trans	-67.1	92.3	168.1	51.9	0	0	0	0	108.8	S1275 L1279	S1275-S1277 PolarHBondContact O-N 3.32Å; S1277-L1279 PolarHBondContact O-N 3.07Å
1278	R	32.1	Very low	43.9	Very low	239 Å²	239	119.3 Å²	119.3	90%	0.902	61%	0.607	S	S	*	*			trans	-69.5	76.4	168.6	-74.5	-175	-175.3	172	3.8	109.1	N1276 Q1280	N1276-R1278 VanDerWaalsContact C-N 3.3Å; N1276-R1278 PolarHBondContact O-N 2.67Å; R1278-Q1280 PolarHBondContact O-N 2.76Å
1279	L	34.3	Very low	46.1	Very low	155 Å²	155	113 Å²	113	81%	0.812	58%	0.577	S	S	*	*			trans	-70	113.6	158.4	-78.7	161.5	0	0	0	106.8	S1277 N1281	S1277-L1279 PolarHBondContact O-N 3.07Å; L1279-N1281 VanDerWaalsContact C-N 3.35Å; L1279-N1281 PolarHBondContact O-N 2.97Å
1280	Q	34	Very low	48.5	Very low	182 Å²	182	106.3 Å²	106.3	85%	0.85	54%	0.541	S	S	*	.	S	Bend	trans	-56.2	97.1	170.5	-68.2	174.7	-4.9	0	0	108.5	R1278	R1278-Q1280 PolarHBondContact O-N 2.76Å
1281	N	36.7	Very low	51.1	Low	157 Å²	157	107 Å²	107	84%	0.84	54%	0.538	S	S	*	.			trans	-177.2	126.8	143.1	-89.8	-28.8	0	0	0	110.1	L1279 S1283	L1279-N1281 VanDerWaalsContact C-N 3.35Å; L1279-N1281 PolarHBondContact O-N 2.97Å; N1281-S1283 PolarHBondContact O-N 2.63Å
1282	R	33.5	Very low	52.9	Low	250 Å²	250	103.2 Å²	103.2	94%	0.943	52%	0.522	S	S	*	.			trans	-64	106.6	178.3	-72	173.8	169.7	173.9	-3.8	110.5
1283	S	39.2	Very low	55.1	Low	102 Å²	102	102.1 Å²	102.1	71%	0.713	52%	0.52	S	S	*	.	S	Bend	trans	175.8	101	145.1	50.5	0	0	0	0	111.2	N1281 N1285	N1281-S1283 PolarHBondContact O-N 2.63Å; S1283-N1285 PolarHBondContact O-N 3.47Å
1284	A	45.3	Very low	57.3	Low	102 Å²	102	99 Å²	99	84%	0.843	50%	0.501	S	S	*	.	S	Bend	trans	32.2	53.6	148	0	0	0	0	0	120.2
1285	N	46.8	Very low	59.7	Low	110 Å²	110	94.8 Å²	94.8	59%	0.588	48%	0.483	S	S	*	.			trans	-142.6	60.6	163.7	-90.9	-33.3	0	0	0	109.3	S1283 Y1287	S1283-N1285 PolarHBondContact O-N 3.47Å; N1285-Y1287 PolarHBondContact O-N 2.83Å
1286	E	57.8	Low	62	Low	156 Å²	156	92.3 Å²	92.3	73%	0.729	47%	0.466	S	S	*	.			trans	-61.5	97.4	178.6	-74.6	-173.2	167.5	0	0	110.3	K1288	E1286-K1288 PolarHBondContact O-N 2.58Å; E1286-K1288 WeakPolarHBondContact OE2-CE 3.02Å; E1286-K1288 IonicContact OE2-NZ 2.65Å
1287	Y	66.2	Low	64.2	Low	73 Å²	73	88.6 Å²	88.6	29%	0.286	45%	0.445	S	S	.	.			trans	-68.4	114.2	164.1	178.9	-95.4	0	0	0	107.9	Q1153 N1285 Q1289	Q1153-Y1287 HydrophobicContact CB-CD2 3.71Å; Q1153-Y1287 HydrophobicContact CB-CE2 4.25Å; Q1153-Y1287 HydrophobicContact CG-CD2 4.25Å; N1285-Y1287 PolarHBondContact O-N 2.83Å; Y1287-Q1289 HydrophobicContact CD1-CB 4.3Å; Y1287-Q1289 HydrophobicContact CE1-CB 3.66Å; Y1287-Q1289 HydrophobicContact CE1-CG 4.33Å
1288	K	76.3	Confident	66.4	Low	57 Å²	57	87.1 Å²	87.1	25%	0.248	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.2	178.6	-63.5	-172	-174.7	176.3	0	108.9	G1151 Y1152 L1256 E1286	G1151-K1288 CarbonylContact C-O 3.49Å; G1151-K1288 WeakPolarHBondContact CA-O 3.42Å; Y1152-K1288 PolarHBondContact N-O 2.98Å; L1256-K1288 WeakPolarHBondContact O-CD 3.04Å; E1286-K1288 PolarHBondContact O-N 2.58Å; E1286-K1288 WeakPolarHBondContact OE2-CE 3.02Å; E1286-K1288 IonicContact OE2-NZ 2.65Å
1289	Q	84.5	Confident	68.3	Low	44 Å²	44	75.9 Å²	75.9	21%	0.206	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	145.6	-179.9	-172.2	177.8	10	0	0	110.8	I1150 Y1287	I1150-Q1289 CarbonylContact O-C 3.58Å; I1150-Q1289 VanDerWaalsContact O-CA 3.3Å; I1150-Q1289 WeakPolarHBondContact O-CA 3.43Å; I1150-Q1289 WeakPolarHBondContact O-CG 3.27Å; Y1287-Q1289 HydrophobicContact CD1-CB 4.3Å; Y1287-Q1289 HydrophobicContact CE1-CB 3.66Å; Y1287-Q1289 HydrophobicContact CE1-CG 4.33Å
1290	L	86.1	Confident	70.1	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.005	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	126	-175.9	-135.1	143.4	0	0	0	108.9	K1149 I1150 L1255 L1256 L1272 F1274 L1292	K1149-L1290 CarbonylContact C-O 3.54Å; K1149-L1290 VanDerWaalsContact CA-O 3.31Å; K1149-L1290 WeakPolarHBondContact CA-O 3.46Å; I1150-L1290 HydrophobicContact CG1-CB 3.94Å; I1150-L1290 PolarHBondContact N-O 2.81Å; I1150-L1290 PolarHBondContact O-N 3.35Å; L1255-L1290 HydrophobicContact CB-CD1 4.4Å; L1256-L1290 HydrophobicContact CD2-CB 3.85Å; L1256-L1290 HydrophobicContact CD2-CD1 4.25Å; L1272-L1290 HydrophobicContact CD2-CD2 4.05Å; F1274-L1290 HydrophobicContact CD1-CD1 3.69Å; F1274-L1290 HydrophobicContact CD1-CG 3.94Å; F1274-L1290 HydrophobicContact CE1-CD1 3.16Å; F1274-L1290 HydrophobicContact CE1-CG 3.86Å; F1274-L1290 HydrophobicContact CZ-CD1 3.69Å; F1274-L1290 HydrophobicContact CZ-CG 4.32Å; L1290-L1292 HydrophobicContact CD2-CD1 4.21Å; L1290-L1292 HydrophobicContact CD2-CD2 3.28Å; L1290-L1292 HydrophobicContact CD2-CG 3.67Å
1291	Q	90.3	Very high	71.6	Confident	66 Å²	66	68.4 Å²	68.4	31%	0.308	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	128.8	171.3	-173.4	165.9	-8.8	0	0	109.4	K1149 V1273	K1149-Q1291 HydrophobicContact CD-CG 4.47Å; K1149-Q1291 VanDerWaalsContact CE-CD 3.41Å; K1149-Q1291 HydrophobicContact CG-CB 3.84Å; K1149-Q1291 HydrophobicContact CG-CG 3.69Å; V1273-Q1291 PolarHBondContact N-O 3.26Å; V1273-Q1291 PolarHBondContact O-N 2.91Å; V1273-Q1291 VanDerWaalsContact O-N 3.09Å
1292	L	90.6	Very high	73.1	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.5	-171.9	-67	174.5	0	0	0	109.3	T1147 V1148 I1150 I1251 L1272 L1290 L1294	T1147-L1292 CarbonylContact C-O 3.53Å; T1147-L1292 VanDerWaalsContact CA-O 3.3Å; T1147-L1292 WeakPolarHBondContact CA-O 3.24Å; V1148-L1292 HydrophobicContact CG2-CB 4.14Å; V1148-L1292 PolarHBondContact N-O 2.96Å; V1148-L1292 PolarHBondContact O-N 2.94Å; I1150-L1292 HydrophobicContact CD1-CD1 3.94Å; I1150-L1292 HydrophobicContact CG1-CD1 4.21Å; I1251-L1292 HydrophobicContact CD1-CD1 3.7Å; I1251-L1292 HydrophobicContact CG1-CD1 4.45Å; I1251-L1292 HydrophobicContact CG2-CD1 3.56Å; L1272-L1292 HydrophobicContact CD2-CD2 3.11Å; L1272-L1292 HydrophobicContact CG-CD2 4.49Å; L1290-L1292 HydrophobicContact CD2-CD1 4.21Å; L1290-L1292 HydrophobicContact CD2-CD2 3.28Å; L1290-L1292 HydrophobicContact CD2-CG 3.67Å; L1292-L1294 HydrophobicContact CB-CD1 4.33Å; L1292-L1294 HydrophobicContact CB-CG 4.3Å; L1292-L1294 HydrophobicContact CD1-CD1 4.47Å
1293	C	91.9	Very high	74.9	Confident	52 Å²	52	62 Å²	62	35%	0.351	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	105.2	166.4	-173.5	0	0	0	0	107.4	L1146	L1146-C1293 WeakPolarHBondContact O-CA 3.39Å
1294	L	92.2	Very high	76.5	Confident	18 Å²	18	60.3 Å²	60.3	9%	0.094	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	140.4	-170.8	-66.7	173.4	0	0	0	110.7	Q1135 K1145 L1146 V1249 I1251 L1292	Q1135-L1294 HydrophobicContact CG-CD1 4.44Å; K1145-L1294 CarbonylContact C-O 3.51Å; K1145-L1294 VanDerWaalsContact CA-O 3.27Å; K1145-L1294 WeakPolarHBondContact CA-O 3.39Å; L1146-L1294 PolarHBondContact N-O 3.14Å; L1146-L1294 PolarHBondContact O-N 3.21Å; V1249-L1294 HydrophobicContact CG1-CB 3.79Å; V1249-L1294 HydrophobicContact CG1-CD1 3.59Å; V1249-L1294 HydrophobicContact CG1-CG 4.34Å; V1249-L1294 HydrophobicContact CG2-CB 4.39Å; I1251-L1294 HydrophobicContact CD1-CD1 3.79Å; I1251-L1294 HydrophobicContact CG1-CD1 3.71Å; L1292-L1294 HydrophobicContact CB-CD1 4.33Å; L1292-L1294 HydrophobicContact CB-CG 4.3Å; L1292-L1294 HydrophobicContact CD1-CD1 4.47Å
1295	P	93.4	Very high	78.4	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.019	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	138.5	172.6	27	-30.6	0	0	0	110.6	Q1135 A1138 G1144	Q1135-P1295 PolarHBondContact NE2-O 3.23Å; A1138-P1295 HydrophobicContact CB-CG 3.95Å; A1138-P1295 VanDerWaalsContact O-CG 3.3Å; A1138-P1295 WeakPolarHBondContact O-CG 3.12Å; G1144-P1295 WeakPolarHBondContact O-CA 3.44Å
1296	L	92.2	Very high	80.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.24	C	C	.	.			trans	-66.6	134	169.9	-78.7	82.3	0	0	0	108.8	S1141 G1144 K1145 L1146 L1167 V1234 C1248 V1249	S1141-L1296 WeakPolarHBondContact CB-O 3.42Å; S1141-L1296 PolarHBondContact OG-O 3.01Å; G1144-L1296 PolarHBondContact O-N 3.2Å; K1145-L1296 VanDerWaalsContact C-CD1 3.4Å; L1146-L1296 HydrophobicContact CB-CD1 4.17Å; L1167-L1296 HydrophobicContact CD2-CD1 4.04Å; L1167-L1296 HydrophobicContact CD2-CD2 3.69Å; V1234-L1296 HydrophobicContact CB-CD2 3.73Å; V1234-L1296 HydrophobicContact CG1-CD2 4.24Å; V1234-L1296 HydrophobicContact CG2-CD2 3.54Å; V1234-L1296 HydrophobicContact CG2-CG 4.24Å; C1248-L1296 CarbonylContact O-C 3.57Å; C1248-L1296 WeakPolarHBondContact O-CA 3.47Å; V1249-L1296 HydrophobicContact CG2-CG 4.27Å
1297	I	89	Confident	82	Confident	19 Å²	19	43.2 Å²	43.2	10%	0.097	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-111.3	149.8	173.4	66.7	174	0	0	0	109.9	E1134 Q1135 A1138 C1248 F1250	E1134-I1297 HydrophobicContact CB-CD1 4.13Å; Q1135-I1297 HydrophobicContact CB-CD1 4.42Å; A1138-I1297 HydrophobicContact CB-CG2 3.73Å; C1248-I1297 PolarHBondContact N-O 3.04Å; C1248-I1297 PolarHBondContact O-N 3.1Å; C1248-I1297 PolarHBondContact SG-O 3.07Å; F1250-I1297 HydrophobicContact CD2-CD1 3.75Å; F1250-I1297 HydrophobicContact CD2-CG1 4.19Å; F1250-I1297 HydrophobicContact CE2-CD1 3.93Å; F1250-I1297 HydrophobicContact CE2-CG1 4.17Å
1298	R	82.9	Confident	83	Confident	42 Å²	42	41.5 Å²	41.5	16%	0.158	20%	0.202	C	C	.	.			trans	-101.9	121.3	160.9	-76	-167.5	166.2	-153	-3.9	107.9	Y1143 F1245 I1300 S1331 I1333	Y1143-R1298 HydrophobicContact CD1-CG 4.35Å; Y1143-R1298 HydrophobicContact CD2-CB 4.5Å; Y1143-R1298 HydrophobicContact CD2-CG 4.06Å; Y1143-R1298 HydrophobicContact CE1-CG 4.13Å; Y1143-R1298 HydrophobicContact CE2-CB 3.95Å; Y1143-R1298 HydrophobicContact CE2-CG 3.82Å; Y1143-R1298 HydrophobicContact CG-CG 4.34Å; F1245-R1298 HydrophobicContact CE1-CG 3.98Å; F1245-R1298 PolarHBondContact O-NH2 2.77Å; R1298-I1300 PolarHBondContact O-N 2.93Å; R1298-S1331 PolarHBondContact NH1-O 3.29Å; R1298-I1333 VanDerWaalsContact NH1-CG1 3.26Å
1299	P	72.1	Confident	83.5	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.019	19%	0.19	C	C	.	.			trans	-68	133.8	-178.1	15.6	-10.6	0	0	0	109.3	K1131 E1329	K1131-P1299 HydrophobicContact CD-CB 4Å; P1299-E1329 HydrophobicContact CB-CG 3.82Å; P1299-E1329 WeakPolarHBondContact CB-OE1 3.49Å; P1299-E1329 HydrophobicContact CG-CG 3.76Å; P1299-E1329 WeakPolarHBondContact O-CG 3.39Å
1300	I	70.6	Confident	83.7	Confident	131 Å²	131	36.7 Å²	36.7	67%	0.672	18%	0.18	S	C	*	.			trans	-105.9	131.1	176.4	-57.4	172.3	0	0	0	107.6	K1131 R1298 K1302	K1131-I1300 PolarHBondContact NZ-O 2.81Å; R1298-I1300 PolarHBondContact O-N 2.93Å; I1300-K1302 PolarHBondContact O-N 2.87Å
1301	S	66	Low	83.6	Confident	49 Å²	49	37.5 Å²	37.5	34%	0.343	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-67.7	121	174.9	62.8	0	0	0	0	109.8	E1329	S1301-E1329 WeakPolarHBondContact CA-OE2 3.49Å; S1301-E1329 VanDerWaalsContact CB-OE2 3.27Å; S1301-E1329 WeakPolarHBondContact CB-OE2 3.48Å; S1301-E1329 PolarHBondContact N-OE2 2.99Å
1302	K	69.1	Low	83.2	Confident	118 Å²	118	36.8 Å²	36.8	51%	0.513	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-81.3	133.1	166.2	-67.1	-179.9	-174.7	171.6	0	108.5	I1300 Y1304 G1305 D1308	I1300-K1302 PolarHBondContact O-N 2.87Å; K1302-Y1304 PolarHBondContact O-N 3.3Å; K1302-G1305 WeakPolarHBondContact O-CA 3.44Å; K1302-G1305 PolarHBondContact O-N 2.94Å; K1302-D1308 VanDerWaalsContact O-OD2 3.07Å
1303	K	70.1	Confident	82.9	Confident	153 Å²	153	36.7 Å²	36.7	67%	0.665	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	125.5	172.4	-169.2	-177.5	-178.2	178.1	0	109.3	G1305 D1308	K1303-G1305 VanDerWaalsContact C-N 3.25Å; K1303-G1305 PolarHBondContact O-N 3.28Å; K1303-D1308 WeakPolarHBondContact CA-OD2 3.33Å
1304	Y	74.1	Confident	81.9	Confident	67 Å²	67	38.2 Å²	38.2	26%	0.263	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	21.3	-172.6	-42.1	-70.7	0	0	0	114.1	M1007 I1011 L1112 K1302 D1308	M1007-Y1304 HydrophobicContact CE-CD1 3.87Å; M1007-Y1304 HydrophobicContact CE-CD2 3.38Å; M1007-Y1304 HydrophobicContact CE-CE1 3.93Å; M1007-Y1304 HydrophobicContact CE-CE2 3.42Å; M1007-Y1304 VanDerWaalsContact CE-CE2 3.42Å; M1007-Y1304 HydrophobicContact CE-CG 3.6Å; I1011-Y1304 HydrophobicContact CD1-CE1 3.93Å; L1112-Y1304 HydrophobicContact CD2-CD1 4.39Å; K1302-Y1304 PolarHBondContact O-N 3.3Å; Y1304-D1308 PolarHBondContact N-OD2 3.19Å
1305	G	84.5	Confident	81.1	Confident	4 Å²	4	38.3 Å²	38.3	4%	0.041	19%	0.193	C	C	.	.			trans	-74.9	170.9	175.2	0	0	0	0	0	112.8	K1302 K1303 L1307 D1308 I1309	K1302-G1305 WeakPolarHBondContact O-CA 3.44Å; K1302-G1305 PolarHBondContact O-N 2.94Å; K1303-G1305 VanDerWaalsContact C-N 3.25Å; K1303-G1305 PolarHBondContact O-N 3.28Å; G1305-L1307 VanDerWaalsContact C-N 3.25Å; G1305-L1307 PolarHBondContact O-N 2.86Å; G1305-D1308 PolarHBondContact O-N 3.32Å; G1305-D1308 VanDerWaalsContact O-N 3.16Å; G1305-I1309 WeakPolarHBondContact O-CG1 3.3Å; G1305-I1309 PolarHBondContact O-N 2.7Å
1306	A	90.5	Very high	80.5	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-56.7	-38.6	-179.8	0	0	0	0	0	112.7	L1115 V1123 I1309 L1310	L1115-A1306 HydrophobicContact CD2-CB 4.29Å; V1123-A1306 HydrophobicContact CG1-CB 3.98Å; V1123-A1306 WeakPolarHBondContact CG1-O 3.15Å; A1306-I1309 PolarHBondContact O-N 2.91Å; A1306-L1310 VanDerWaalsContact O-CG 3.3Å; A1306-L1310 WeakPolarHBondContact O-CG 3.43Å; A1306-L1310 PolarHBondContact O-N 3.22Å
1307	L	89.9	Confident	80.2	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-65.6	-41.5	178.3	-168.1	65.8	0	0	0	112.8	Y1127 G1305 I1309 L1310 G1311 F1322 W1325 K1326 E1329	Y1127-L1307 HydrophobicContact CD2-CB 3.85Å; Y1127-L1307 HydrophobicContact CD2-CD1 4.47Å; Y1127-L1307 HydrophobicContact CE2-CB 3.74Å; Y1127-L1307 HydrophobicContact CE2-CD1 4.13Å; Y1127-L1307 HydrophobicContact CE2-CD2 4.11Å; Y1127-L1307 HydrophobicContact CE2-CG 4.21Å; G1305-L1307 VanDerWaalsContact C-N 3.25Å; G1305-L1307 PolarHBondContact O-N 2.86Å; L1307-I1309 VanDerWaalsContact C-N 3.29Å; L1307-I1309 PolarHBondContact O-N 2.82Å; L1307-L1310 PolarHBondContact O-N 3.48Å; L1307-G1311 PolarHBondContact O-N 3.22Å; L1307-F1322 HydrophobicContact CD1-CD2 4.08Å; L1307-F1322 HydrophobicContact CG-CD2 4Å; L1307-F1322 HydrophobicContact CG-CE2 4.44Å; L1307-F1322 VanDerWaalsContact O-CD2 3.3Å; L1307-F1322 WeakPolarHBondContact O-CD2 3.1Å; L1307-W1325 HydrophobicContact CD1-CB 3.96Å; L1307-W1325 HydrophobicContact CD2-CB 4.37Å; L1307-K1326 HydrophobicContact CD2-CD 4.5Å; L1307-E1329 HydrophobicContact CD2-CG 4.31Å; L1307-E1329 WeakPolarHBondContact CD2-OE1 3.31Å; L1307-E1329 VanDerWaalsContact CD2-OE2 3.25Å; L1307-E1329 WeakPolarHBondContact CD2-OE2 3.19Å
1308	D	85.7	Confident	80.1	Confident	37 Å²	37	44.3 Å²	44.3	20%	0.198	23%	0.231	C	C	.	.	H	α-helix	trans	-59.7	-43.2	175.9	-72.6	-7.8	0	0	0	110.6	K1302 K1303 Y1304 G1305 G1311 Q1312	K1302-D1308 VanDerWaalsContact O-OD2 3.07Å; K1303-D1308 WeakPolarHBondContact CA-OD2 3.33Å; Y1304-D1308 PolarHBondContact N-OD2 3.19Å; G1305-D1308 PolarHBondContact O-N 3.32Å; G1305-D1308 VanDerWaalsContact O-N 3.16Å; D1308-G1311 PolarHBondContact O-N 3.45Å; D1308-Q1312 WeakPolarHBondContact O-CG 3.21Å; D1308-Q1312 PolarHBondContact O-N 3.14Å
1309	I	87.5	Confident	80.3	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-63.9	-40.5	177.1	-61.4	-56.7	0	0	0	111.4	I1043 L1112 L1115 Y1116 V1123 G1305 A1306 L1307 G1311 Q1312 R1313	I1043-I1309 HydrophobicContact CD1-CB 4.33Å; I1043-I1309 HydrophobicContact CD1-CD1 3.51Å; I1043-I1309 HydrophobicContact CD1-CG1 4.47Å; I1043-I1309 HydrophobicContact CD1-CG2 3.92Å; L1112-I1309 HydrophobicContact CD1-CD1 3.61Å; L1112-I1309 HydrophobicContact CD1-CG1 4.34Å; L1115-I1309 HydrophobicContact CB-CG1 4.07Å; L1115-I1309 HydrophobicContact CB-CG2 4.42Å; L1115-I1309 HydrophobicContact CD1-CB 4.47Å; L1115-I1309 HydrophobicContact CD1-CG1 3.66Å; Y1116-I1309 HydrophobicContact CD1-CD1 4.25Å; Y1116-I1309 HydrophobicContact CE1-CD1 3.72Å; V1123-I1309 HydrophobicContact CG1-CB 4.43Å; V1123-I1309 HydrophobicContact CG1-CG2 4.28Å; G1305-I1309 WeakPolarHBondContact O-CG1 3.3Å; G1305-I1309 PolarHBondContact O-N 2.7Å; A1306-I1309 PolarHBondContact O-N 2.91Å; L1307-I1309 VanDerWaalsContact C-N 3.29Å; L1307-I1309 PolarHBondContact O-N 2.82Å; I1309-G1311 VanDerWaalsContact C-N 3.32Å; I1309-G1311 PolarHBondContact O-N 3.06Å; I1309-Q1312 PolarHBondContact O-N 3.18Å; I1309-R1313 WeakPolarHBondContact O-CG 3.17Å; I1309-R1313 PolarHBondContact O-N 3.12Å
1310	L	88.8	Confident	81.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-39	174.6	-67.6	168.4	0	0	0	111.9	T1120 V1123 I1124 A1306 L1307 Q1312 R1313 A1318 I1321 F1322	T1120-L1310 HydrophobicContact CG2-CD2 3.97Å; V1123-L1310 HydrophobicContact CB-CD2 4.05Å; V1123-L1310 HydrophobicContact CG1-CD1 4.28Å; V1123-L1310 HydrophobicContact CG1-CD2 3.74Å; V1123-L1310 HydrophobicContact CG1-CG 3.69Å; I1124-L1310 HydrophobicContact CD1-CD2 4.44Å; I1124-L1310 HydrophobicContact CG1-CD1 3.88Å; I1124-L1310 HydrophobicContact CG1-CD2 3.69Å; I1124-L1310 HydrophobicContact CG1-CG 4.47Å; A1306-L1310 VanDerWaalsContact O-CG 3.3Å; A1306-L1310 WeakPolarHBondContact O-CG 3.43Å; A1306-L1310 PolarHBondContact O-N 3.22Å; L1307-L1310 PolarHBondContact O-N 3.48Å; L1310-Q1312 VanDerWaalsContact C-N 3.25Å; L1310-Q1312 PolarHBondContact O-N 3.34Å; L1310-R1313 PolarHBondContact O-N 2.72Å; L1310-R1313 VanDerWaalsContact O-N 3.16Å; L1310-A1318 HydrophobicContact CB-CB 4.29Å; L1310-A1318 HydrophobicContact CD2-CB 3.77Å; L1310-I1321 HydrophobicContact CD1-CB 4.45Å; L1310-I1321 HydrophobicContact CD1-CG2 3.79Å; L1310-F1322 HydrophobicContact CB-CB 4.32Å
1311	G	84.5	Confident	82.1	Confident	18 Å²	18	42.6 Å²	42.6	19%	0.186	22%	0.221	C	C	.	.	H	α-helix	trans	-65.4	-27.7	178.2	0	0	0	0	0	114.4	L1307 D1308 I1309 Q1319	L1307-G1311 PolarHBondContact O-N 3.22Å; D1308-G1311 PolarHBondContact O-N 3.45Å; I1309-G1311 VanDerWaalsContact C-N 3.32Å; I1309-G1311 PolarHBondContact O-N 3.06Å; G1311-Q1319 PolarHBondContact O-NE2 3.01Å
1312	Q	82	Confident	83.2	Confident	50 Å²	50	42.4 Å²	42.4	23%	0.234	21%	0.214	C	C	.	.	H	α-helix	trans	-87.7	-10.5	176.4	-65.4	177.5	23.2	0	0	113.2	E1015 T1042 I1043 D1308 I1309 L1310	E1015-Q1312 PolarHBondContact OE1-OE1 2.95Å; T1042-Q1312 CarbonylContact C-O 3.54Å; T1042-Q1312 WeakPolarHBondContact CA-O 3.42Å; I1043-Q1312 HydrophobicContact CB-CB 4.3Å; I1043-Q1312 HydrophobicContact CD1-CB 3.63Å; I1043-Q1312 HydrophobicContact CD1-CG 4.35Å; I1043-Q1312 HydrophobicContact CG1-CB 3.79Å; I1043-Q1312 PolarHBondContact N-O 3.08Å; D1308-Q1312 WeakPolarHBondContact O-CG 3.21Å; D1308-Q1312 PolarHBondContact O-N 3.14Å; I1309-Q1312 PolarHBondContact O-N 3.18Å; L1310-Q1312 VanDerWaalsContact C-N 3.25Å; L1310-Q1312 PolarHBondContact O-N 3.34Å
1313	R	83.4	Confident	84.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-83.9	138.5	175.8	-75	178.4	-175.6	-147.2	-2.1	111.6	I1043 L1115 S1118 S1119 T1120 I1309 L1310 D1315 A1318 Q1319	I1043-R1313 HydrophobicContact CB-CG 4.07Å; I1043-R1313 HydrophobicContact CG2-CG 4.12Å; I1043-R1313 WeakPolarHBondContact O-CA 3.49Å; L1115-R1313 PolarHBondContact O-NH2 3.19Å; S1118-R1313 PolarHBondContact O-NH1 2.88Å; S1118-R1313 PolarHBondContact O-NH2 3.47Å; S1119-R1313 PolarHBondContact O-NH1 3.08Å; T1120-R1313 WeakPolarHBondContact OG1-CD 3.46Å; T1120-R1313 PolarHBondContact OG1-NH1 2.91Å; I1309-R1313 WeakPolarHBondContact O-CG 3.17Å; I1309-R1313 PolarHBondContact O-N 3.12Å; L1310-R1313 PolarHBondContact O-N 2.72Å; L1310-R1313 VanDerWaalsContact O-N 3.16Å; R1313-D1315 WeakPolarHBondContact CB-OD2 3.45Å; R1313-A1318 HydrophobicContact CB-CB 3.68Å; R1313-Q1319 WeakPolarHBondContact O-CG 3.36Å; R1313-Q1319 PolarHBondContact O-NE2 3.07Å
1314	T	72.5	Confident	85	Confident	84 Å²	84	39.8 Å²	39.8	52%	0.515	20%	0.201	S	C	.	.			trans	-87.1	-8.3	-178.4	51	0	0	0	0	114.5	T1042	T1042-T1314 HydrophobicContact CG2-CG2 3.53Å
1315	D	75.4	Confident	85.7	Confident	20 Å²	20	36.7 Å²	36.7	11%	0.107	19%	0.189	C	C	.	.	S	Bend	trans	-68.5	146.5	-179.4	71.2	82.3	0	0	0	111.4	L1054 T1120 R1313 Y1317 A1318 Q1319	L1054-D1315 HydrophobicContact CD1-CB 4.29Å; T1120-D1315 WeakPolarHBondContact CG2-OD1 3.4Å; T1120-D1315 PolarHBondContact OG1-OD2 3.35Å; R1313-D1315 WeakPolarHBondContact CB-OD2 3.45Å; D1315-Y1317 PolarHBondContact O-N 3.23Å; D1315-Y1317 PolarHBondContact OD1-N 3.17Å; D1315-A1318 PolarHBondContact O-N 3.43Å; D1315-A1318 VanDerWaalsContact OD1-CB 3.28Å; D1315-A1318 WeakPolarHBondContact OD1-CB 3.2Å; D1315-A1318 PolarHBondContact OD1-N 3.29Å; D1315-A1318 WeakPolarHBondContact OD2-CB 3.33Å; D1315-Q1319 WeakPolarHBondContact O-CG 3.15Å; D1315-Q1319 PolarHBondContact O-N 3.18Å
1316	S	80.5	Confident	85.8	Confident	103 Å²	103	38.5 Å²	38.5	72%	0.72	20%	0.196	S	C	*	.	H	α-helix	trans	-62.5	-31	-171.4	-173.3	0	0	0	0	112.5	E1320	S1316-E1320 WeakPolarHBondContact O-CB 3.3Å; S1316-E1320 PolarHBondContact O-N 3.1Å
1317	Y	85.9	Confident	85.4	Confident	46 Å²	46	43.4 Å²	43.4	18%	0.18	23%	0.225	C	C	.	.	H	α-helix	trans	-76.3	-43.1	-176.4	-172.7	-152.8	0	0	0	111	T1120 I1124 H1188 D1315 Q1319 E1320 I1321	T1120-Y1317 HydrophobicContact CG2-CD1 4.19Å; I1124-Y1317 HydrophobicContact CD1-CD1 3.41Å; I1124-Y1317 VanDerWaalsContact CD1-CD1 3.41Å; I1124-Y1317 HydrophobicContact CD1-CD2 4.07Å; I1124-Y1317 HydrophobicContact CD1-CE1 3.23Å; I1124-Y1317 HydrophobicContact CD1-CE2 3.9Å; I1124-Y1317 HydrophobicContact CD1-CG 3.83Å; I1124-Y1317 VanDerWaalsContact CD1-CZ 3.48Å; H1188-Y1317 HydrophobicContact CB-CE1 4.31Å; H1188-Y1317 AromaticContact ND1-CE1 3.55Å; H1188-Y1317 AromaticContact ND1-CZ 3.71Å; H1188-Y1317 PolarHBondContact ND1-OH 3.12Å; D1315-Y1317 PolarHBondContact O-N 3.23Å; D1315-Y1317 PolarHBondContact OD1-N 3.17Å; Y1317-Q1319 VanDerWaalsContact C-N 3.33Å; Y1317-Q1319 PolarHBondContact O-N 3.02Å; Y1317-E1320 PolarHBondContact O-N 2.69Å; Y1317-I1321 HydrophobicContact CD2-CG1 4.12Å; Y1317-I1321 HydrophobicContact CE2-CD1 4.01Å; Y1317-I1321 HydrophobicContact CE2-CG1 3.87Å; Y1317-I1321 WeakPolarHBondContact O-CG1 3.42Å; Y1317-I1321 PolarHBondContact O-N 2.88Å
1318	A	86.8	Confident	85	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.6	-46.1	171.7	0	0	0	0	0	111.4	T1120 L1310 R1313 D1315 E1320 I1321 F1322	T1120-A1318 HydrophobicContact CG2-CB 3.72Å; L1310-A1318 HydrophobicContact CB-CB 4.29Å; L1310-A1318 HydrophobicContact CD2-CB 3.77Å; R1313-A1318 HydrophobicContact CB-CB 3.68Å; D1315-A1318 PolarHBondContact O-N 3.43Å; D1315-A1318 VanDerWaalsContact OD1-CB 3.28Å; D1315-A1318 WeakPolarHBondContact OD1-CB 3.2Å; D1315-A1318 PolarHBondContact OD1-N 3.29Å; D1315-A1318 WeakPolarHBondContact OD2-CB 3.33Å; A1318-E1320 PolarHBondContact O-N 2.6Å; A1318-I1321 PolarHBondContact O-N 3.23Å; A1318-F1322 VanDerWaalsContact O-CB 3.23Å; A1318-F1322 WeakPolarHBondContact O-CB 3.41Å; A1318-F1322 PolarHBondContact O-N 3.45Å
1319	Q	87.4	Confident	84.7	Confident	46 Å²	46	43.1 Å²	43.1	22%	0.215	22%	0.223	C	C	.	.	H	α-helix	trans	-66.9	-33.6	178.9	-71.7	-64.5	-48.7	0	0	113.2	G1311 R1313 D1315 Y1317 K1323	G1311-Q1319 PolarHBondContact O-NE2 3.01Å; R1313-Q1319 WeakPolarHBondContact O-CG 3.36Å; R1313-Q1319 PolarHBondContact O-NE2 3.07Å; D1315-Q1319 WeakPolarHBondContact O-CG 3.15Å; D1315-Q1319 PolarHBondContact O-N 3.18Å; Y1317-Q1319 VanDerWaalsContact C-N 3.33Å; Y1317-Q1319 PolarHBondContact O-N 3.02Å; Q1319-K1323 WeakPolarHBondContact O-CB 3.5Å; Q1319-K1323 VanDerWaalsContact O-CG 3.23Å; Q1319-K1323 WeakPolarHBondContact O-CG 3.18Å; Q1319-K1323 PolarHBondContact O-N 3.08Å
1320	E	88.9	Confident	84.1	Confident	87 Å²	87	47.3 Å²	47.3	41%	0.407	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-53	172.2	-178.6	-169.4	155.4	0	0	110.6	K1187 S1316 Y1317 A1318 R1324	K1187-E1320 IonicContact NZ-OE1 3.86Å; K1187-E1320 PolarHBondContact NZ-OE1 2.87Å; S1316-E1320 WeakPolarHBondContact O-CB 3.3Å; S1316-E1320 PolarHBondContact O-N 3.1Å; Y1317-E1320 PolarHBondContact O-N 2.69Å; A1318-E1320 PolarHBondContact O-N 2.6Å; E1320-R1324 VanDerWaalsContact O-CB 3.3Å; E1320-R1324 WeakPolarHBondContact O-CB 3.4Å; E1320-R1324 PolarHBondContact O-N 3.25Å
1321	I	90.5	Very high	83.1	Confident	6 Å²	6	49 Å²	49	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-46.7	-179.7	-64.3	-61	0	0	0	110.5	I1124 L1310 Y1317 A1318 R1324 W1325	I1124-I1321 HydrophobicContact CD1-CG1 3.76Å; I1124-I1321 HydrophobicContact CG1-CB 4.46Å; I1124-I1321 HydrophobicContact CG1-CG1 4.06Å; I1124-I1321 HydrophobicContact CG1-CG2 4.39Å; I1124-I1321 HydrophobicContact CG2-CD1 4.5Å; I1124-I1321 HydrophobicContact CG2-CG1 4.29Å; L1310-I1321 HydrophobicContact CD1-CB 4.45Å; L1310-I1321 HydrophobicContact CD1-CG2 3.79Å; Y1317-I1321 HydrophobicContact CD2-CG1 4.12Å; Y1317-I1321 HydrophobicContact CE2-CD1 4.01Å; Y1317-I1321 HydrophobicContact CE2-CG1 3.87Å; Y1317-I1321 WeakPolarHBondContact O-CG1 3.42Å; Y1317-I1321 PolarHBondContact O-N 2.88Å; A1318-I1321 PolarHBondContact O-N 3.23Å; I1321-R1324 PolarHBondContact O-N 3.18Å; I1321-W1325 VanDerWaalsContact O-CD1 3.3Å; I1321-W1325 PolarHBondContact O-N 3.29Å
1322	F	89.7	Confident	81.8	Confident	45 Å²	45	55.9 Å²	55.9	20%	0.197	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-55	179.6	176.7	-108.3	0	0	0	111.6	L1307 L1310 A1318 R1324 W1325 K1326	L1307-F1322 HydrophobicContact CD1-CD2 4.08Å; L1307-F1322 HydrophobicContact CG-CD2 4Å; L1307-F1322 HydrophobicContact CG-CE2 4.44Å; L1307-F1322 VanDerWaalsContact O-CD2 3.3Å; L1307-F1322 WeakPolarHBondContact O-CD2 3.1Å; L1310-F1322 HydrophobicContact CB-CB 4.32Å; A1318-F1322 VanDerWaalsContact O-CB 3.23Å; A1318-F1322 WeakPolarHBondContact O-CB 3.41Å; A1318-F1322 PolarHBondContact O-N 3.45Å; F1322-R1324 VanDerWaalsContact C-N 3.29Å; F1322-R1324 PolarHBondContact O-N 3.22Å; F1322-W1325 PolarHBondContact O-N 3.47Å; F1322-K1326 HydrophobicContact CD2-CB 4.16Å; F1322-K1326 HydrophobicContact CE1-CB 4.43Å; F1322-K1326 HydrophobicContact CE1-CG 4.36Å; F1322-K1326 HydrophobicContact CE2-CB 3.94Å; F1322-K1326 HydrophobicContact CE2-CD 4.18Å; F1322-K1326 HydrophobicContact CE2-CG 3.89Å; F1322-K1326 HydrophobicContact CZ-CB 4.09Å; F1322-K1326 HydrophobicContact CZ-CD 4.36Å; F1322-K1326 HydrophobicContact CZ-CG 3.76Å; F1322-K1326 WeakPolarHBondContact O-CA 3.48Å; F1322-K1326 WeakPolarHBondContact O-CB 3.25Å; F1322-K1326 PolarHBondContact O-N 3.12Å
1323	K	87.6	Confident	80.4	Confident	134 Å²	134	55.7 Å²	55.7	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-57.9	-44.3	-180	-72.7	172.8	-175.4	177	0	111.4	Q1319 T1327	Q1319-K1323 WeakPolarHBondContact O-CB 3.5Å; Q1319-K1323 VanDerWaalsContact O-CG 3.23Å; Q1319-K1323 WeakPolarHBondContact O-CG 3.18Å; Q1319-K1323 PolarHBondContact O-N 3.08Å; K1323-T1327 WeakPolarHBondContact O-CB 2.96Å; K1323-T1327 PolarHBondContact O-N 3.43Å; K1323-T1327 PolarHBondContact O-OG1 3.46Å
1324	R	88.4	Confident	78.4	Confident	83 Å²	83	62.9 Å²	62.9	31%	0.313	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-49.9	-178.4	177.2	60.5	176.5	125	-3.9	112.2	E1320 I1321 F1322	E1320-R1324 VanDerWaalsContact O-CB 3.3Å; E1320-R1324 WeakPolarHBondContact O-CB 3.4Å; E1320-R1324 PolarHBondContact O-N 3.25Å; I1321-R1324 PolarHBondContact O-N 3.18Å; F1322-R1324 VanDerWaalsContact C-N 3.29Å; F1322-R1324 PolarHBondContact O-N 3.22Å
1325	W	89.1	Confident	76.6	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.008	35%	0.352	C	S	.	.	H	α-helix	trans	-85.6	-32.4	-172.8	-73	96.4	0	0	0	112.8	Y1127 F1128 L1185 A1231 I1233 F1250 L1307 I1321 F1322 T1327 L1328 E1329	Y1127-W1325 HydrophobicContact CE1-CB 4.24Å; Y1127-W1325 AromaticContact CE1-CD2 3.94Å; Y1127-W1325 HydrophobicContact CE1-CD2 3.94Å; Y1127-W1325 HydrophobicContact CE1-CE3 4.39Å; Y1127-W1325 AromaticContact CE1-CG 3.83Å; Y1127-W1325 HydrophobicContact CE1-CG 3.83Å; F1128-W1325 AromaticContact CE1-CE2 3.86Å; F1128-W1325 AromaticContact CE1-CZ2 3.79Å; F1128-W1325 HydrophobicContact CE1-CZ2 3.79Å; F1128-W1325 AromaticContact CE1-NE1 3.98Å; F1128-W1325 AromaticContact CZ-CE2 3.98Å; F1128-W1325 HydrophobicContact CZ-CZ2 4.22Å; F1128-W1325 AromaticContact CZ-NE1 3.62Å; L1185-W1325 HydrophobicContact CD1-CH2 4.48Å; L1185-W1325 HydrophobicContact CD1-CZ2 3.57Å; A1231-W1325 HydrophobicContact CB-CH2 4.33Å; I1233-W1325 HydrophobicContact CD1-CH2 3.98Å; I1233-W1325 HydrophobicContact CD1-CZ2 4.41Å; I1233-W1325 HydrophobicContact CG1-CH2 4.28Å; F1250-W1325 AromaticContact CE1-CH2 3.49Å; F1250-W1325 HydrophobicContact CE1-CH2 3.49Å; F1250-W1325 VanDerWaalsContact CE1-CH2 3.49Å; F1250-W1325 HydrophobicContact CE1-CZ2 4.35Å; F1250-W1325 AromaticContact CE1-CZ3 3.72Å; F1250-W1325 HydrophobicContact CE1-CZ3 3.72Å; F1250-W1325 HydrophobicContact CZ-CE3 4.38Å; F1250-W1325 AromaticContact CZ-CH2 3.82Å; F1250-W1325 HydrophobicContact CZ-CH2 3.82Å; F1250-W1325 AromaticContact CZ-CZ3 3.51Å; F1250-W1325 HydrophobicContact CZ-CZ3 3.51Å; L1307-W1325 HydrophobicContact CD1-CB 3.96Å; L1307-W1325 HydrophobicContact CD2-CB 4.37Å; I1321-W1325 VanDerWaalsContact O-CD1 3.3Å; I1321-W1325 PolarHBondContact O-N 3.29Å; F1322-W1325 PolarHBondContact O-N 3.47Å; W1325-T1327 VanDerWaalsContact C-N 3.33Å; W1325-T1327 PolarHBondContact O-N 2.97Å; W1325-L1328 HydrophobicContact CD2-CD1 4.36Å; W1325-L1328 HydrophobicContact CE3-CD1 3.77Å; W1325-L1328 HydrophobicContact CH2-CD1 4.4Å; W1325-L1328 HydrophobicContact CZ3-CD1 3.79Å; W1325-L1328 WeakPolarHBondContact O-CB 3.43Å; W1325-L1328 PolarHBondContact O-N 3.17Å; W1325-L1328 VanDerWaalsContact O-N 3.1Å; W1325-E1329 WeakPolarHBondContact O-CG 3.13Å; W1325-E1329 PolarHBondContact O-N 3.3Å
1326	K	86	Confident	76.7	Confident	42 Å²	42	72.8 Å²	72.8	18%	0.183	36%	0.364	C	S	.	.	H	α-helix	trans	-62.8	-40.1	174.9	-171.7	55	169.3	157.2	0	111.7	L1307 F1322 L1328 E1329 D1330	L1307-K1326 HydrophobicContact CD2-CD 4.5Å; F1322-K1326 HydrophobicContact CD2-CB 4.16Å; F1322-K1326 HydrophobicContact CE1-CB 4.43Å; F1322-K1326 HydrophobicContact CE1-CG 4.36Å; F1322-K1326 HydrophobicContact CE2-CB 3.94Å; F1322-K1326 HydrophobicContact CE2-CD 4.18Å; F1322-K1326 HydrophobicContact CE2-CG 3.89Å; F1322-K1326 HydrophobicContact CZ-CB 4.09Å; F1322-K1326 HydrophobicContact CZ-CD 4.36Å; F1322-K1326 HydrophobicContact CZ-CG 3.76Å; F1322-K1326 WeakPolarHBondContact O-CA 3.48Å; F1322-K1326 WeakPolarHBondContact O-CB 3.25Å; F1322-K1326 PolarHBondContact O-N 3.12Å; K1326-L1328 VanDerWaalsContact C-N 3.26Å; K1326-L1328 PolarHBondContact O-N 3.1Å; K1326-E1329 PolarHBondContact O-N 2.82Å; K1326-D1330 WeakPolarHBondContact CD-OD2 3.32Å; K1326-D1330 VanDerWaalsContact CE-OD1 3.25Å; K1326-D1330 WeakPolarHBondContact CE-OD1 3.39Å; K1326-D1330 WeakPolarHBondContact CE-OD2 3.46Å; K1326-D1330 WeakPolarHBondContact CG-OD2 3.5Å; K1326-D1330 IonicContact NZ-OD1 3.56Å; K1326-D1330 PolarHBondContact NZ-OD1 3.48Å; K1326-D1330 IonicContact NZ-OD2 2.84Å; K1326-D1330 WeakPolarHBondContact O-CB 3.47Å; K1326-D1330 PolarHBondContact O-N 3.32Å
1327	T	82.6	Confident	76.5	Confident	102 Å²	102	71.2 Å²	71.2	63%	0.626	35%	0.345	S	S	*	.	H	α-helix	trans	-61.5	-32.7	173.7	-58.9	0	0	0	0	112.9	K1323 W1325 S1331	K1323-T1327 WeakPolarHBondContact O-CB 2.96Å; K1323-T1327 PolarHBondContact O-N 3.43Å; K1323-T1327 PolarHBondContact O-OG1 3.46Å; W1325-T1327 VanDerWaalsContact C-N 3.33Å; W1325-T1327 PolarHBondContact O-N 2.97Å; T1327-S1331 PolarHBondContact O-N 3.21Å
1328	L	82.8	Confident	75.9	Confident	8 Å²	8	72.6 Å²	72.6	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-77.3	-33.1	175.3	-64.2	174.6	0	0	0	112.6	I1233 M1235 F1245 W1325 K1326 S1331	I1233-L1328 HydrophobicContact CD1-CD1 4.32Å; I1233-L1328 HydrophobicContact CG2-CD1 4.34Å; I1233-L1328 HydrophobicContact CG2-CD2 4.4Å; M1235-L1328 HydrophobicContact SD-CD2 4.42Å; F1245-L1328 HydrophobicContact CB-CD2 4.08Å; F1245-L1328 HydrophobicContact CD1-CB 4.41Å; F1245-L1328 HydrophobicContact CD1-CD2 4.41Å; F1245-L1328 VanDerWaalsContact CD1-O 3.29Å; F1245-L1328 WeakPolarHBondContact CD1-O 3.39Å; F1245-L1328 HydrophobicContact CD2-CD2 3.67Å; F1245-L1328 HydrophobicContact CE1-CB 4.33Å; F1245-L1328 WeakPolarHBondContact CE1-O 3.25Å; F1245-L1328 HydrophobicContact CE2-CD2 4.14Å; F1245-L1328 HydrophobicContact CG-CD2 3.81Å; F1245-L1328 HydrophobicContact CZ-CB 4.47Å; W1325-L1328 HydrophobicContact CD2-CD1 4.36Å; W1325-L1328 HydrophobicContact CE3-CD1 3.77Å; W1325-L1328 HydrophobicContact CH2-CD1 4.4Å; W1325-L1328 HydrophobicContact CZ3-CD1 3.79Å; W1325-L1328 WeakPolarHBondContact O-CB 3.43Å; W1325-L1328 PolarHBondContact O-N 3.17Å; W1325-L1328 VanDerWaalsContact O-N 3.1Å; K1326-L1328 VanDerWaalsContact C-N 3.26Å; K1326-L1328 PolarHBondContact O-N 3.1Å; L1328-S1331 PolarHBondContact O-OG 2.81Å; L1328-S1331 VanDerWaalsContact O-OG 3.05Å
1329	E	78.2	Confident	75.3	Confident	28 Å²	28	76.8 Å²	76.8	13%	0.131	38%	0.375	C	S	.	.	H	α-helix	trans	-73.9	-35.5	176.3	-67.5	-170.1	-176.7	0	0	112	Y1127 K1131 P1299 S1301 L1307 W1325 K1326	Y1127-E1329 PolarHBondContact OH-OE1 2.51Å; K1131-E1329 IonicContact NZ-OE1 2.81Å; P1299-E1329 HydrophobicContact CB-CG 3.82Å; P1299-E1329 WeakPolarHBondContact CB-OE1 3.49Å; P1299-E1329 HydrophobicContact CG-CG 3.76Å; P1299-E1329 WeakPolarHBondContact O-CG 3.39Å; S1301-E1329 WeakPolarHBondContact CA-OE2 3.49Å; S1301-E1329 VanDerWaalsContact CB-OE2 3.27Å; S1301-E1329 WeakPolarHBondContact CB-OE2 3.48Å; S1301-E1329 PolarHBondContact N-OE2 2.99Å; L1307-E1329 HydrophobicContact CD2-CG 4.31Å; L1307-E1329 WeakPolarHBondContact CD2-OE1 3.31Å; L1307-E1329 VanDerWaalsContact CD2-OE2 3.25Å; L1307-E1329 WeakPolarHBondContact CD2-OE2 3.19Å; W1325-E1329 WeakPolarHBondContact O-CG 3.13Å; W1325-E1329 PolarHBondContact O-N 3.3Å; K1326-E1329 PolarHBondContact O-N 2.82Å
1330	D	75.1	Confident	74.5	Confident	89 Å²	89	78.8 Å²	78.8	48%	0.476	39%	0.385	S	S	.	.	H	α-helix	trans	-87.9	-8.7	-175.8	-70.3	-13.3	0	0	0	114.4	K1326 E1332	K1326-D1330 WeakPolarHBondContact CD-OD2 3.32Å; K1326-D1330 VanDerWaalsContact CE-OD1 3.25Å; K1326-D1330 WeakPolarHBondContact CE-OD1 3.39Å; K1326-D1330 WeakPolarHBondContact CE-OD2 3.46Å; K1326-D1330 WeakPolarHBondContact CG-OD2 3.5Å; K1326-D1330 IonicContact NZ-OD1 3.56Å; K1326-D1330 PolarHBondContact NZ-OD1 3.48Å; K1326-D1330 IonicContact NZ-OD2 2.84Å; K1326-D1330 WeakPolarHBondContact O-CB 3.47Å; K1326-D1330 PolarHBondContact O-N 3.32Å; D1330-E1332 VanDerWaalsContact C-N 3.26Å; D1330-E1332 PolarHBondContact O-N 3.05Å
1331	S	68.6	Low	73.6	Confident	36 Å²	36	78.2 Å²	78.2	25%	0.252	38%	0.384	S	S	.	.			trans	-67.1	84.9	176	57.4	0	0	0	0	109.4	F1245 R1298 T1327 L1328 I1333	F1245-S1331 WeakPolarHBondContact CD1-OG 3.49Å; R1298-S1331 PolarHBondContact NH1-O 3.29Å; T1327-S1331 PolarHBondContact O-N 3.21Å; L1328-S1331 PolarHBondContact O-OG 2.81Å; L1328-S1331 VanDerWaalsContact O-OG 3.05Å; S1331-I1333 PolarHBondContact O-N 3.12Å
1332	E	57.2	Low	72.4	Confident	163 Å²	163	83.4 Å²	83.4	76%	0.762	41%	0.409	S	S	*	.			trans	-61.5	132	176	-72.3	-176.9	159.6	0	0	109.8	D1330 N1334	D1330-E1332 VanDerWaalsContact C-N 3.26Å; D1330-E1332 PolarHBondContact O-N 3.05Å; E1332-N1334 PolarHBondContact O-N 3.49Å; E1332-N1334 VanDerWaalsContact O-N 3.11Å
1333	I	51.7	Low	71.1	Confident	46 Å²	46	86.3 Å²	86.3	24%	0.236	43%	0.425	C	S	.	.			trans	-70.4	108.8	158.8	-51.7	-173.6	0	0	0	103.8	Y1143 V1168 L1170 R1298 S1331 Q1335	Y1143-I1333 HydrophobicContact CD1-CD1 4.11Å; Y1143-I1333 HydrophobicContact CE1-CD1 3.7Å; V1168-I1333 HydrophobicContact CG1-CD1 4.17Å; V1168-I1333 HydrophobicContact CG2-CD1 4.26Å; L1170-I1333 HydrophobicContact CD2-CG2 4.43Å; R1298-I1333 VanDerWaalsContact NH1-CG1 3.26Å; S1331-I1333 PolarHBondContact O-N 3.12Å; I1333-Q1335 HydrophobicContact CG2-CG 3.98Å; I1333-Q1335 PolarHBondContact O-N 2.95Å
1334	N	41.7	Very low	69.7	Low	150 Å²	150	82.3 Å²	82.3	80%	0.802	41%	0.412	S	S	*	.			trans	-62.1	83	160.3	-76.1	-43.4	0	0	0	107.2	E1332	E1332-N1334 PolarHBondContact O-N 3.49Å; E1332-N1334 VanDerWaalsContact O-N 3.11Å
1335	Q	34.8	Very low	68	Low	239 Å²	239	82.3 Å²	82.3	100%	1.117	42%	0.421	S	S	*	.			trans	-76.4	0	151.1	-72.7	-170.8	-7	0	0	107.6	I1333	I1333-Q1335 HydrophobicContact CG2-CG 3.98Å; I1333-Q1335 PolarHBondContact O-N 2.95Å

Retrieved 1,335 of 1,335 residues in 513.8 ms (Link to these results)

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