A0A5K4ES84_SCHMA Loading...

Putative monocarboxylate transporter

AlphaFold DB , UniProt , Accession A0A5K4ES84, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 843 aa.

						>A0A5K4ES84_SCHMA|A0A5K4ES84
MIDFIDSKLLNKKSNCGIINKKKKTYQSKTDSGWGWIIVISSFIIQLIIDGTFGGFGVLYLSLRNDQAFVNKNYSQTILSMPGTIQPGFFLCTGAFVSPLIQMFGFRISGCFGALLLGLGMSIASYLTNMHAIIIFYGMITGSAFGILMVCAIVSVNYYFDRYRGLASGLAMSGAGVGTLLVPVFYNWIIPIKGWRSSLLLYSLGASLLTALASLTLKPFITNDSSDDPELTKQSTVIEDSKQTTSDQMLVMKTIPEITYIDDDVIYLPGKNHNRTVDITAIHSDCKPDDSVFDFNGEKKERKLSIGFTDALRQYLLNQKVSDSGTGFLYVSTTGNLDEKTEREKEKETLLATQQKYTYTFIYKRPTDLSETDNDAEDAESMIGSRLWKSSLGFKRQPSSYIHNQSQLCQPAQSNQQQKQNYNKFPNQTTQATVAATHGYIHSSYNLSSTRNSRRRKFPSQIYTLFDKPDAFYSASLTNLNPKITQPFNGYKKSTDSLRAYSKYPIKSKSSLISSETVNKNQINELIDSNISSSLNQQHQEQNHKEFHSLDNSIHKSSNNDIYLKSSIIETSIPEENLLTTNNTENSTEFYTLTSKMNTITQNLGLFGYGIIKLFDLGLFTEPSFLYLVGIGITSQLAYFIPFVYLIDYTVSYGMEQDSAVLVVMILSIFHTLGRITSGIMSNVFHLDSVYLSGLATFGGGLAHVFLVFIIPHTFAWYSIYASIYGLCSGIPIPLIPILLVRFSGLEHLTASFSNLNLLKGIFSMIGPTVAITIVEYTSQKDHLFLVAGVCYIVSALLHLGLCRYSCFAKYSKSSTNKQRTNDYDDTSNFEDPYAKCFPCSFQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.1	Very low	36.1	Very low	205 Å²	205	133.3 Å²	133.3	100%	1.01	68%	0.682	S	S	*	*				0	-36.9	0	-172.2	175.2	-85.4	0	0	110.9	D3	M1-D3 VanDerWaalsContact C-N 3.29Å; M1-D3 PolarHBondContact N-OD2 3.39Å; M1-D3 PolarHBondContact O-N 3.28Å
2	I	37.2	Very low	35.7	Very low	143 Å²	143	136.3 Å²	136.3	73%	0.733	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-60	-40.5	172.4	-68.1	170.3	0	0	0	111.3	F4 I5	I2-F4 PolarHBondContact O-N 3.26Å; I2-I5 PolarHBondContact O-N 2.98Å; I2-I5 VanDerWaalsContact O-N 3.12Å
3	D	34.9	Very low	35.4	Very low	135 Å²	135	139.3 Å²	139.3	72%	0.722	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-64.9	-8.4	-174.4	-32.3	-88.3	0	0	0	115	M1	M1-D3 VanDerWaalsContact C-N 3.29Å; M1-D3 PolarHBondContact N-OD2 3.39Å; M1-D3 PolarHBondContact O-N 3.28Å
4	F	37.9	Very low	35	Very low	161 Å²	161	135.1 Å²	135.1	71%	0.706	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-90.9	-8.7	178.6	-160.5	-107.2	0	0	0	113.2	I2	I2-F4 PolarHBondContact O-N 3.26Å
5	I	43	Very low	34.5	Very low	112 Å²	112	136.1 Å²	136.1	57%	0.574	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-44.4	-175.1	-63.3	179.9	0	0	0	111.7	I2 S7 K8 L9	I2-I5 PolarHBondContact O-N 2.98Å; I2-I5 VanDerWaalsContact O-N 3.12Å; I5-S7 VanDerWaalsContact C-N 3.3Å; I5-S7 PolarHBondContact O-N 3.07Å; I5-K8 PolarHBondContact O-N 2.75Å; I5-K8 VanDerWaalsContact O-N 3.14Å; I5-L9 HydrophobicContact CG2-CD1 4.33Å; I5-L9 PolarHBondContact O-N 3.23Å
6	D	37.5	Very low	34.2	Very low	99 Å²	99	134.4 Å²	134.4	53%	0.529	69%	0.694	S	S	.	*	H	α-helix	trans	-61.1	-35.2	-176.6	-86.3	-41.9	0	0	0	113.9	K8 L9 L10	D6-K8 PolarHBondContact O-N 3.35Å; D6-L9 PolarHBondContact O-N 3.29Å; D6-L10 PolarHBondContact O-N 3.07Å
7	S	33.5	Very low	34	Very low	86 Å²	86	129.7 Å²	129.7	60%	0.601	69%	0.686	S	S	*	*	H	α-helix	trans	-55.1	-36.7	177.2	-175.8	0	0	0	0	112.7	I5 N11	I5-S7 VanDerWaalsContact C-N 3.3Å; I5-S7 PolarHBondContact O-N 3.07Å; S7-N11 PolarHBondContact O-N 3.44Å
8	K	36.8	Very low	33.8	Very low	161 Å²	161	130.7 Å²	130.7	70%	0.7	69%	0.69	S	S	*	*	H	α-helix	trans	-84.1	-18.4	178.4	-84.7	-173.8	173.9	179	0	114.4	I5 D6	I5-K8 PolarHBondContact O-N 2.75Å; I5-K8 VanDerWaalsContact O-N 3.14Å; D6-K8 PolarHBondContact O-N 3.35Å
9	L	35.6	Very low	33.7	Very low	109 Å²	109	131.6 Å²	131.6	57%	0.571	69%	0.693	S	S	*	*	H	α-helix	trans	-83.9	-41.5	175.3	-83.3	165.6	0	0	0	111.9	I5 D6 K12	I5-L9 HydrophobicContact CG2-CD1 4.33Å; I5-L9 PolarHBondContact O-N 3.23Å; D6-L9 PolarHBondContact O-N 3.29Å; L9-K12 PolarHBondContact O-N 2.96Å
10	L	33.3	Very low	33.4	Very low	127 Å²	127	131.7 Å²	131.7	67%	0.665	69%	0.694	S	S	*	*	H	α-helix	trans	-63.4	-45.5	176.1	-73.8	168.9	0	0	0	111.6	D6 K12 K13	D6-L10 PolarHBondContact O-N 3.07Å; L10-K12 PolarHBondContact O-N 3.31Å; L10-K12 VanDerWaalsContact O-N 3.08Å; L10-K13 PolarHBondContact O-N 3.49Å; L10-K13 VanDerWaalsContact O-N 3.11Å
11	N	29.8	Very low	33.2	Very low	128 Å²	128	133.9 Å²	133.9	68%	0.684	70%	0.698	S	S	*	*	H	α-helix	trans	-78.5	12.6	-180	-147.7	4.8	0	0	0	114.6	S7 S14	S7-N11 PolarHBondContact O-N 3.44Å; N11-S14 PolarHBondContact O-OG 3.1Å; N11-S14 PolarHBondContact OD1-OG 3.12Å; N11-S14 VanDerWaalsContact OD1-OG 3.1Å
12	K	31.3	Very low	32.7	Very low	169 Å²	169	131.8 Å²	131.8	74%	0.735	68%	0.683	S	S	*	*	H	α-helix	trans	-107	-11.6	166.7	-158.4	172.6	-178	-178.1	0	112.8	L9 L10	L9-K12 PolarHBondContact O-N 2.96Å; L10-K12 PolarHBondContact O-N 3.31Å; L10-K12 VanDerWaalsContact O-N 3.08Å
13	K	31.7	Very low	32.2	Very low	176 Å²	176	131.8 Å²	131.8	77%	0.765	68%	0.678	S	S	*	*	H	α-helix	trans	-82.3	-15.7	171.5	-76.8	-175.8	173.1	178.6	0	113.6	L10 N15	L10-K13 PolarHBondContact O-N 3.49Å; L10-K13 VanDerWaalsContact O-N 3.11Å; K13-N15 VanDerWaalsContact C-N 3.29Å; K13-N15 PolarHBondContact O-N 2.93Å
14	S	30.2	Very low	31.8	Very low	81 Å²	81	133.5 Å²	133.5	57%	0.566	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-13.1	177.9	45.3	0	0	0	0	114.8	N11	N11-S14 PolarHBondContact O-OG 3.1Å; N11-S14 PolarHBondContact OD1-OG 3.12Å; N11-S14 VanDerWaalsContact OD1-OG 3.1Å
15	N	27.3	Very low	31.4	Very low	149 Å²	149	131.1 Å²	131.1	80%	0.797	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.9	19.1	-174.3	-123.9	-9.5	0	0	0	113.9	K13 G17	K13-N15 VanDerWaalsContact C-N 3.29Å; K13-N15 PolarHBondContact O-N 2.93Å; N15-G17 PolarHBondContact O-N 3.05Å
16	C	30.1	Very low	31	Very low	110 Å²	110	135.1 Å²	135.1	74%	0.743	69%	0.687	S	S	*	*			trans	-77.3	70.5	162.4	-166.9	0	0	0	0	108.6	I18	C16-I18 PolarHBondContact O-N 2.99Å
17	G	29.9	Very low	31.1	Very low	54 Å²	54	138.5 Å²	138.5	56%	0.557	70%	0.699	S	S	*	*			trans	-53.5	129.9	178.2	0	0	0	0	0	109.9	N15 I19	N15-G17 PolarHBondContact O-N 3.05Å; G17-I19 PolarHBondContact O-N 3.35Å
18	I	30.7	Very low	32	Very low	147 Å²	147	137 Å²	137	75%	0.754	69%	0.69	S	S	*	*			trans	-67.3	90	177.9	-60.7	167.7	0	0	0	107.4	C16 N20	C16-I18 PolarHBondContact O-N 2.99Å; I18-N20 PolarHBondContact O-N 2.93Å
19	I	31	Very low	32.9	Very low	148 Å²	148	137.7 Å²	137.7	76%	0.759	69%	0.692	S	S	*	*			trans	-68.1	84.1	162.5	-54.6	-179.4	0	0	0	105	G17 K21	G17-I19 PolarHBondContact O-N 3.35Å; I19-K21 HydrophobicContact CG2-CG 4.09Å; I19-K21 PolarHBondContact O-N 3.09Å
20	N	27.6	Very low	34.6	Very low	133 Å²	133	135 Å²	135	71%	0.711	68%	0.681	S	S	*	*			trans	-59.4	78.7	156.3	-90.2	-30.6	0	0	0	106.9	I18 K22	I18-N20 PolarHBondContact O-N 2.93Å; N20-K22 PolarHBondContact O-N 3.49Å
21	K	29.2	Very low	36.5	Very low	179 Å²	179	131.2 Å²	131.2	78%	0.778	66%	0.661	S	S	*	*			trans	-56.2	87.2	149.6	-81.5	-175.8	176.9	176.6	0	104.1	I19 K23	I19-K21 HydrophobicContact CG2-CG 4.09Å; I19-K21 PolarHBondContact O-N 3.09Å; K21-K23 VanDerWaalsContact C-N 3.26Å; K21-K23 PolarHBondContact O-N 3.43Å
22	K	27.5	Very low	38.7	Very low	161 Å²	161	126.9 Å²	126.9	70%	0.7	64%	0.64	S	S	*	*			trans	-51.2	102.8	167.3	-70.9	-166.2	174.8	-162.6	0	104	N20 K24 D285	N20-K22 PolarHBondContact O-N 3.49Å; K22-K24 VanDerWaalsContact C-N 3.27Å; K22-K24 PolarHBondContact O-N 3.4Å; K22-D285 IonicContact NZ-OD2 3.89Å
23	K	27.7	Very low	41.2	Very low	142 Å²	142	121.5 Å²	121.5	62%	0.617	63%	0.633	S	S	*	*			trans	-56.9	105.2	172.4	-84.5	-171.8	174.8	-177.5	0	103.3	K21 T25 D228	K21-K23 VanDerWaalsContact C-N 3.26Å; K21-K23 PolarHBondContact O-N 3.43Å; K23-T25 PolarHBondContact O-N 3.46Å; K23-D228 VanDerWaalsContact CE-OD1 3.3Å; K23-D228 WeakPolarHBondContact CE-OD1 3.28Å; K23-D228 IonicContact NZ-OD1 3.44Å; K23-D228 PolarHBondContact NZ-OD1 3.29Å; K23-D228 IonicContact NZ-OD2 3.88Å; K23-D228 PolarHBondContact NZ-OD2 3.03Å
24	K	25.5	Very low	43.9	Very low	172 Å²	172	118.5 Å²	118.5	75%	0.748	62%	0.617	S	S	*	*			trans	-71.7	77.5	174	-82.1	-172.8	175.2	-179.4	0	105.2	K22 Y26	K22-K24 VanDerWaalsContact C-N 3.27Å; K22-K24 PolarHBondContact O-N 3.4Å; K24-Y26 HydrophobicContact CB-CD2 4.32Å; K24-Y26 HydrophobicContact CD-CE2 4.42Å; K24-Y26 PolarHBondContact O-N 3.11Å
25	T	31	Very low	46.6	Very low	110 Å²	110	114.6 Å²	114.6	68%	0.675	59%	0.59	S	S	*	*			trans	-55.6	92	157.8	-49.7	0	0	0	0	104.4	K23 Q27	K23-T25 PolarHBondContact O-N 3.46Å; T25-Q27 HydrophobicContact CG2-CG 4.32Å; T25-Q27 PolarHBondContact O-N 2.55Å
26	Y	35	Very low	49.6	Very low	197 Å²	197	112.4 Å²	112.4	77%	0.773	57%	0.571	S	S	*	*			trans	-69.9	75.6	170.2	-109.7	-83.5	0	0	0	105.3	K24 S28	K24-Y26 HydrophobicContact CB-CD2 4.32Å; K24-Y26 HydrophobicContact CD-CE2 4.42Å; K24-Y26 PolarHBondContact O-N 3.11Å; Y26-S28 PolarHBondContact O-N 3.41Å
27	Q	39.3	Very low	52.6	Low	169 Å²	169	110.3 Å²	110.3	79%	0.79	55%	0.551	S	S	*	*			trans	-52.1	102.7	152.2	-78.8	-177.3	-36.2	0	0	104.7	T25 K29	T25-Q27 HydrophobicContact CG2-CG 4.32Å; T25-Q27 PolarHBondContact O-N 2.55Å; Q27-K29 PolarHBondContact O-N 3.17Å; Q27-K29 VanDerWaalsContact O-N 3.11Å
28	S	52	Low	55.5	Low	56 Å²	56	107.7 Å²	107.7	39%	0.392	53%	0.525	S	S	.	.			trans	-49.2	121.3	162.2	-175.9	0	0	0	0	105.3	Y26 T30	Y26-S28 PolarHBondContact O-N 3.41Å; S28-T30 VanDerWaalsContact C-N 3.28Å; S28-T30 PolarHBondContact O-N 2.95Å
29	K	56.4	Low	58.4	Low	175 Å²	175	101.1 Å²	101.1	76%	0.761	49%	0.491	S	S	*	.			trans	-60.4	101.1	171.4	-93.7	-165.8	166.1	-168.8	0	106.1	Q27 S32	Q27-K29 PolarHBondContact O-N 3.17Å; Q27-K29 VanDerWaalsContact O-N 3.11Å; K29-S32 WeakPolarHBondContact O-CB 3.46Å; K29-S32 PolarHBondContact O-N 3.05Å; K29-S32 PolarHBondContact O-OG 3.3Å
30	T	69.9	Low	61.5	Low	53 Å²	53	98.9 Å²	98.9	33%	0.325	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	152.5	169.9	45.6	0	0	0	0	108.4	S28 S32 Y159 D161	S28-T30 VanDerWaalsContact C-N 3.28Å; S28-T30 PolarHBondContact O-N 2.95Å; T30-S32 PolarHBondContact O-N 3.45Å; T30-S32 VanDerWaalsContact O-N 3.13Å; T30-Y159 CarbonylContact C-O 3.58Å; T30-Y159 WeakPolarHBondContact CA-O 3.46Å; T30-D161 WeakPolarHBondContact CB-OD2 3.45Å; T30-D161 VanDerWaalsContact CG2-OD2 3.28Å; T30-D161 WeakPolarHBondContact CG2-OD2 3.42Å; T30-D161 PolarHBondContact OG1-OD2 3.08Å
31	D	73.9	Confident	64.6	Low	46 Å²	46	92.9 Å²	92.9	25%	0.246	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	16.4	-167.8	-49.3	-52.2	0	0	0	114.4	Y159 F160 D161 R162 Y163	D31-Y159 PolarHBondContact N-O 3.25Å; D31-F160 HydrophobicContact CB-CD1 4.38Å; D31-F160 VanDerWaalsContact OD1-CA 3.25Å; D31-F160 WeakPolarHBondContact OD1-CA 3.3Å; D31-F160 WeakPolarHBondContact OD1-CB 3.49Å; D31-F160 VanDerWaalsContact OD1-CD1 3.29Å; D31-F160 WeakPolarHBondContact OD1-CD1 3.4Å; D31-D161 PolarHBondContact OD1-N 2.83Å; D31-R162 PolarHBondContact OD1-N 2.66Å; D31-R162 WeakPolarHBondContact OD2-CB 3.17Å; D31-R162 PolarHBondContact OD2-N 3.23Å; D31-Y163 HydrophobicContact CB-CD2 4.05Å; D31-Y163 HydrophobicContact CB-CE2 4.42Å; D31-Y163 PolarHBondContact OD1-N 3.49Å
32	S	75.8	Confident	67.7	Low	37 Å²	37	84.4 Å²	84.4	26%	0.259	41%	0.411	S	S	.	.			trans	-74	159.6	174.5	63.8	0	0	0	0	113.8	K29 T30 W34 G35	K29-S32 WeakPolarHBondContact O-CB 3.46Å; K29-S32 PolarHBondContact O-N 3.05Å; K29-S32 PolarHBondContact O-OG 3.3Å; T30-S32 PolarHBondContact O-N 3.45Å; T30-S32 VanDerWaalsContact O-N 3.13Å; S32-W34 PolarHBondContact O-N 2.85Å; S32-G35 PolarHBondContact O-N 3.34Å
33	G	84.4	Confident	70.9	Confident	57 Å²	57	79.5 Å²	79.5	59%	0.588	39%	0.39	S	S	*	.	H	α-helix	trans	-53	-27.8	-176.9	0	0	0	0	0	116	G35 W36	G33-G35 VanDerWaalsContact C-N 3.28Å; G33-G35 PolarHBondContact O-N 3.15Å; G33-W36 PolarHBondContact O-N 2.96Å
34	W	87.1	Confident	74.1	Confident	112 Å²	112	75.2 Å²	75.2	42%	0.424	37%	0.373	S	S	.	.	H	α-helix	trans	-67.4	-27.7	175	-166.3	-83.8	0	0	0	112.7	S32 W36 I37 I38 Y159 T216	S32-W34 PolarHBondContact O-N 2.85Å; W34-W36 PolarHBondContact O-N 3.36Å; W34-I37 HydrophobicContact CD2-CD1 4.17Å; W34-I37 HydrophobicContact CE3-CD1 3.73Å; W34-I37 HydrophobicContact CH2-CD1 4.39Å; W34-I37 HydrophobicContact CZ3-CD1 3.85Å; W34-I37 WeakPolarHBondContact O-CB 3.5Å; W34-I37 PolarHBondContact O-N 3.26Å; W34-I38 PolarHBondContact O-N 2.99Å; W34-Y159 HydrophobicContact CB-CE1 4.49Å; W34-Y159 AromaticContact CD1-CE1 3.44Å; W34-Y159 VanDerWaalsContact CD1-CE1 3.44Å; W34-Y159 AromaticContact CD1-CZ 3.94Å; W34-Y159 HydrophobicContact CG-CE1 4.29Å; W34-T216 PolarHBondContact NE1-O 3.45Å
35	G	87.4	Confident	77.5	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-56.1	-37.6	175.3	0	0	0	0	0	112.3	S32 G33 I37 I38 V39 F160	S32-G35 PolarHBondContact O-N 3.34Å; G33-G35 VanDerWaalsContact C-N 3.28Å; G33-G35 PolarHBondContact O-N 3.15Å; G35-I37 VanDerWaalsContact C-N 3.29Å; G35-I37 PolarHBondContact O-N 3.31Å; G35-I38 WeakPolarHBondContact O-CA 3.26Å; G35-I38 WeakPolarHBondContact O-CB 3.22Å; G35-I38 PolarHBondContact O-N 3.39Å; G35-V39 PolarHBondContact O-N 3.33Å; G35-F160 WeakPolarHBondContact O-CE2 3.32Å
36	W	90.8	Very high	80.5	Confident	103 Å²	103	61.9 Å²	61.9	39%	0.39	31%	0.306	S	S	.	.	H	α-helix	trans	-65.9	-30.3	177	-64.7	108.5	0	0	0	113	G33 W34 V39 I40 F160 L166 L170	G33-W36 PolarHBondContact O-N 2.96Å; W34-W36 PolarHBondContact O-N 3.36Å; W36-V39 PolarHBondContact O-N 3.41Å; W36-I40 WeakPolarHBondContact O-CG1 3.19Å; W36-I40 PolarHBondContact O-N 3.19Å; W36-F160 HydrophobicContact CD2-CE1 4.29Å; W36-F160 AromaticContact CD2-CZ 3.96Å; W36-F160 HydrophobicContact CD2-CZ 3.96Å; W36-F160 AromaticContact CE2-CE1 3.89Å; W36-F160 HydrophobicContact CE3-CZ 4.28Å; W36-F160 HydrophobicContact CG-CZ 4.24Å; W36-F160 HydrophobicContact CZ2-CE1 4.04Å; W36-F160 HydrophobicContact CZ2-CZ 4.47Å; W36-L166 HydrophobicContact CH2-CD2 4.5Å; W36-L170 HydrophobicContact CH2-CD1 4.44Å; W36-L170 HydrophobicContact CZ3-CD1 3.8Å
37	I	92.6	Very high	83.4	Confident	65 Å²	65	54 Å²	54	33%	0.333	28%	0.277	S	S	.	.	H	α-helix	trans	-69	-36.5	172.2	-60.1	174	0	0	0	110.5	W34 G35 I40 S41 T216	W34-I37 HydrophobicContact CD2-CD1 4.17Å; W34-I37 HydrophobicContact CE3-CD1 3.73Å; W34-I37 HydrophobicContact CH2-CD1 4.39Å; W34-I37 HydrophobicContact CZ3-CD1 3.85Å; W34-I37 WeakPolarHBondContact O-CB 3.5Å; W34-I37 PolarHBondContact O-N 3.26Å; G35-I37 VanDerWaalsContact C-N 3.29Å; G35-I37 PolarHBondContact O-N 3.31Å; I37-I40 PolarHBondContact O-N 3.23Å; I37-S41 WeakPolarHBondContact O-CB 3.27Å; I37-S41 PolarHBondContact O-N 3.1Å; I37-S41 PolarHBondContact O-OG 2.77Å; I37-T216 HydrophobicContact CG2-CG2 4.21Å
38	I	91.2	Very high	86.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.2	-38.5	173.5	-54.7	-62.4	0	0	0	111.1	W34 G35 S41 S42 S155 V156 Y159 L217	W34-I38 PolarHBondContact O-N 2.99Å; G35-I38 WeakPolarHBondContact O-CA 3.26Å; G35-I38 WeakPolarHBondContact O-CB 3.22Å; G35-I38 PolarHBondContact O-N 3.39Å; I38-S41 PolarHBondContact O-N 3.24Å; I38-S42 VanDerWaalsContact O-CB 3.27Å; I38-S42 WeakPolarHBondContact O-CB 3.46Å; I38-S42 PolarHBondContact O-N 3.5Å; I38-S42 PolarHBondContact O-OG 3.33Å; I38-S155 WeakPolarHBondContact CG2-OG 3.23Å; I38-V156 HydrophobicContact CG2-CG2 4.05Å; I38-Y159 HydrophobicContact CD1-CE2 4.12Å; I38-Y159 HydrophobicContact CG1-CD1 4.12Å; I38-Y159 HydrophobicContact CG1-CD2 3.98Å; I38-Y159 HydrophobicContact CG1-CE1 3.97Å; I38-Y159 HydrophobicContact CG1-CE2 3.81Å; I38-Y159 HydrophobicContact CG1-CG 4.09Å; I38-Y159 HydrophobicContact CG2-CD2 4.4Å; I38-L217 HydrophobicContact CD1-CD2 3.87Å; I38-L217 HydrophobicContact CG2-CD2 4.12Å
39	V	92	Very high	88.2	Confident	8 Å²	8	43.5 Å²	43.5	5%	0.048	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-46.8	173.6	170.9	0	0	0	0	111.3	G35 W36 S42 F43 V156 F160 A167 L170 A171	G35-V39 PolarHBondContact O-N 3.33Å; W36-V39 PolarHBondContact O-N 3.41Å; V39-S42 PolarHBondContact O-N 2.7Å; V39-F43 WeakPolarHBondContact O-CB 3.27Å; V39-F43 PolarHBondContact O-N 3Å; V39-V156 HydrophobicContact CG2-CG1 4Å; V39-V156 HydrophobicContact CG2-CG2 4.34Å; V39-F160 HydrophobicContact CG2-CD2 4.45Å; V39-F160 HydrophobicContact CG2-CE2 3.58Å; V39-F160 HydrophobicContact CG2-CZ 4.05Å; V39-A167 HydrophobicContact CG2-CB 3.75Å; V39-L170 HydrophobicContact CG1-CB 3.91Å; V39-A171 HydrophobicContact CG1-CB 4.44Å
40	I	94.5	Very high	89.9	Confident	102 Å²	102	35.8 Å²	35.8	52%	0.523	19%	0.189	S	C	.	.	H	α-helix	trans	-62.9	-42.8	176.4	-67.8	164.1	0	0	0	111.1	W36 I37 S42 F43 I44	W36-I40 WeakPolarHBondContact O-CG1 3.19Å; W36-I40 PolarHBondContact O-N 3.19Å; I37-I40 PolarHBondContact O-N 3.23Å; I40-S42 VanDerWaalsContact C-N 3.31Å; I40-S42 PolarHBondContact O-N 2.92Å; I40-F43 WeakPolarHBondContact O-CB 3.44Å; I40-F43 PolarHBondContact O-N 3.31Å; I40-I44 HydrophobicContact CG2-CD1 4.06Å; I40-I44 WeakPolarHBondContact O-CG1 3.18Å; I40-I44 PolarHBondContact O-N 3.08Å
41	S	94.5	Very high	91.1	Very high	6 Å²	6	33.2 Å²	33.2	4%	0.042	17%	0.174	C	C	.	.	H	α-helix	trans	-62.2	-41.1	177.3	-57.8	0	0	0	0	111.5	I37 I38 I44 I45 T216	I37-S41 WeakPolarHBondContact O-CB 3.27Å; I37-S41 PolarHBondContact O-N 3.1Å; I37-S41 PolarHBondContact O-OG 2.77Å; I38-S41 PolarHBondContact O-N 3.24Å; S41-I44 PolarHBondContact O-N 3.29Å; S41-I45 WeakPolarHBondContact O-CG1 3.36Å; S41-I45 PolarHBondContact O-N 2.71Å; S41-T216 WeakPolarHBondContact CB-OG1 3.44Å; S41-T216 PolarHBondContact OG-OG1 3.43Å
42	S	93.4	Very high	92.1	Very high	1 Å²	1	31 Å²	31	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-71.6	-36.5	178	-58.5	0	0	0	0	112.6	I38 V39 I40 I45 Q46 A152 V156	I38-S42 VanDerWaalsContact O-CB 3.27Å; I38-S42 WeakPolarHBondContact O-CB 3.46Å; I38-S42 PolarHBondContact O-N 3.5Å; I38-S42 PolarHBondContact O-OG 3.33Å; V39-S42 PolarHBondContact O-N 2.7Å; I40-S42 VanDerWaalsContact C-N 3.31Å; I40-S42 PolarHBondContact O-N 2.92Å; S42-I45 PolarHBondContact O-N 3.38Å; S42-Q46 WeakPolarHBondContact O-CB 3.44Å; S42-Q46 PolarHBondContact O-N 3.44Å; S42-A152 PolarHBondContact OG-O 2.81Å; S42-V156 VanDerWaalsContact OG-CG2 3.28Å; S42-V156 WeakPolarHBondContact OG-CG2 3.05Å
43	F	94	Very high	93	Very high	59 Å²	59	29.6 Å²	29.6	26%	0.259	15%	0.151	S	C	.	.	H	α-helix	trans	-58.5	-45.9	170.2	175.8	-80.2	0	0	0	111.4	V39 I40 Q46 L47 L170 A171 G174 V177	V39-F43 WeakPolarHBondContact O-CB 3.27Å; V39-F43 PolarHBondContact O-N 3Å; I40-F43 WeakPolarHBondContact O-CB 3.44Å; I40-F43 PolarHBondContact O-N 3.31Å; F43-Q46 PolarHBondContact O-N 2.83Å; F43-L47 HydrophobicContact CD1-CD1 4.37Å; F43-L47 HydrophobicContact CE1-CD1 3.74Å; F43-L47 HydrophobicContact CZ-CD1 4.46Å; F43-L47 WeakPolarHBondContact O-CB 3.35Å; F43-L47 PolarHBondContact O-N 2.78Å; F43-L170 WeakPolarHBondContact CD2-O 3.39Å; F43-A171 WeakPolarHBondContact CA-O 3.4Å; F43-G174 VanDerWaalsContact CD2-N 3.35Å; F43-V177 HydrophobicContact CE2-CG2 4.42Å; F43-V177 HydrophobicContact CZ-CB 4.22Å; F43-V177 HydrophobicContact CZ-CG1 4.33Å; F43-V177 HydrophobicContact CZ-CG2 4.05Å
44	I	96.4	Very high	93.3	Very high	51 Å²	51	26.9 Å²	26.9	26%	0.262	12%	0.123	S	C	.	.	H	α-helix	trans	-63.1	-43.3	177.2	-69	165.7	0	0	0	110.9	I40 S41 L47 I48 L209 A213	I40-I44 HydrophobicContact CG2-CD1 4.06Å; I40-I44 WeakPolarHBondContact O-CG1 3.18Å; I40-I44 PolarHBondContact O-N 3.08Å; S41-I44 PolarHBondContact O-N 3.29Å; I44-L47 PolarHBondContact O-N 2.96Å; I44-I48 WeakPolarHBondContact O-CG1 3.4Å; I44-I48 PolarHBondContact O-N 3.38Å; I44-I48 VanDerWaalsContact O-N 3.12Å; I44-L209 HydrophobicContact CG2-CB 4.07Å; I44-A213 HydrophobicContact CG2-CB 4.38Å
45	I	96.3	Very high	93.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.7	-47.3	176.3	-71.4	165.6	0	0	0	110.9	S41 S42 L47 I48 I49 L148 A152 T210 A213	S41-I45 WeakPolarHBondContact O-CG1 3.36Å; S41-I45 PolarHBondContact O-N 2.71Å; S42-I45 PolarHBondContact O-N 3.38Å; I45-L47 VanDerWaalsContact C-N 3.35Å; I45-L47 PolarHBondContact O-N 3.32Å; I45-I48 PolarHBondContact O-N 3.17Å; I45-I49 HydrophobicContact CG2-CD1 3.62Å; I45-I49 HydrophobicContact CG2-CG1 4.42Å; I45-I49 VanDerWaalsContact O-CG1 3.3Å; I45-I49 WeakPolarHBondContact O-CG1 3.39Å; I45-I49 PolarHBondContact O-N 2.94Å; I45-L148 HydrophobicContact CG2-CB 3.85Å; I45-A152 HydrophobicContact CB-CB 4.16Å; I45-A152 HydrophobicContact CD1-CB 4.32Å; I45-A152 HydrophobicContact CG2-CB 3.86Å; I45-T210 HydrophobicContact CG1-CG2 4.29Å; I45-A213 HydrophobicContact CD1-CB 3.98Å; I45-A213 HydrophobicContact CG1-CB 3.88Å
46	Q	93.9	Very high	93.9	Very high	3 Å²	3	21.7 Å²	21.7	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-63.1	-39.9	179.1	-161.5	74.6	61.1	0	0	112.5	S42 F43 I48 I49 D50 M149 A175	S42-Q46 WeakPolarHBondContact O-CB 3.44Å; S42-Q46 PolarHBondContact O-N 3.44Å; F43-Q46 PolarHBondContact O-N 2.83Å; Q46-I48 VanDerWaalsContact C-N 3.33Å; Q46-I48 PolarHBondContact O-N 3.45Å; Q46-I49 PolarHBondContact O-N 3.05Å; Q46-D50 PolarHBondContact NE2-OD2 3.28Å; Q46-D50 PolarHBondContact O-N 3.31Å; Q46-M149 PolarHBondContact NE2-SD 3.44Å; Q46-M149 VanDerWaalsContact NE2-SD 3.43Å; Q46-M149 PolarHBondContact OE1-SD 2.96Å; Q46-A175 HydrophobicContact CG-CB 3.66Å
47	L	95.2	Very high	94.1	Very high	30 Å²	30	16.8 Å²	16.8	16%	0.157	9%	0.085	C	C	.	.	H	α-helix	trans	-59.6	-42.1	176.1	-176.6	164.2	0	0	0	111.6	F43 I44 I45 G51 G174 V177 G178 L181	F43-L47 HydrophobicContact CD1-CD1 4.37Å; F43-L47 HydrophobicContact CE1-CD1 3.74Å; F43-L47 HydrophobicContact CZ-CD1 4.46Å; F43-L47 WeakPolarHBondContact O-CB 3.35Å; F43-L47 PolarHBondContact O-N 2.78Å; I44-L47 PolarHBondContact O-N 2.96Å; I45-L47 VanDerWaalsContact C-N 3.35Å; I45-L47 PolarHBondContact O-N 3.32Å; L47-G51 VanDerWaalsContact O-CA 3.28Å; L47-G51 WeakPolarHBondContact O-CA 3.48Å; L47-G51 PolarHBondContact O-N 3.36Å; L47-G174 WeakPolarHBondContact CA-O 3.43Å; L47-G174 WeakPolarHBondContact CB-O 3.46Å; L47-V177 HydrophobicContact CD1-CB 4.41Å; L47-V177 HydrophobicContact CD1-CG1 3.9Å; L47-G178 VanDerWaalsContact O-CA 3.23Å; L47-G178 WeakPolarHBondContact O-CA 3.34Å; L47-L181 HydrophobicContact CD1-CD1 4.39Å
48	I	97.1	Very high	94.3	Very high	6 Å²	6	13.7 Å²	13.7	3%	0.031	7%	0.069	C	C	.	.	H	α-helix	trans	-71.1	-40.8	176.8	-66.8	-60.2	0	0	0	111.9	I44 I45 Q46 T52 L117 F145 Y202 A206 L209 T210	I44-I48 WeakPolarHBondContact O-CG1 3.4Å; I44-I48 PolarHBondContact O-N 3.38Å; I44-I48 VanDerWaalsContact O-N 3.12Å; I45-I48 PolarHBondContact O-N 3.17Å; Q46-I48 VanDerWaalsContact C-N 3.33Å; Q46-I48 PolarHBondContact O-N 3.45Å; I48-T52 WeakPolarHBondContact O-CB 3.35Å; I48-T52 PolarHBondContact O-N 3.2Å; I48-T52 PolarHBondContact O-OG1 2.72Å; I48-L117 HydrophobicContact CG2-CD2 3.92Å; I48-F145 HydrophobicContact CG2-CE1 4.15Å; I48-Y202 PolarHBondContact O-OH 3.35Å; I48-A206 HydrophobicContact CD1-CB 4.02Å; I48-A206 HydrophobicContact CG2-CB 3.76Å; I48-L209 HydrophobicContact CD1-CD1 4.43Å; I48-T210 HydrophobicContact CB-CG2 3.94Å; I48-T210 HydrophobicContact CG1-CG2 4.07Å; I48-T210 HydrophobicContact CG2-CG2 3.85Å
49	I	95.9	Very high	94.5	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.3	-68	179.6	-66.6	163.9	0	0	0	111.2	I45 Q46 G51 T52 F53 F90 F145 L148 M149	I45-I49 HydrophobicContact CG2-CD1 3.62Å; I45-I49 HydrophobicContact CG2-CG1 4.42Å; I45-I49 VanDerWaalsContact O-CG1 3.3Å; I45-I49 WeakPolarHBondContact O-CG1 3.39Å; I45-I49 PolarHBondContact O-N 2.94Å; Q46-I49 PolarHBondContact O-N 3.05Å; I49-G51 VanDerWaalsContact C-N 3.28Å; I49-G51 PolarHBondContact O-N 3.37Å; I49-T52 WeakPolarHBondContact O-CB 3.28Å; I49-T52 PolarHBondContact O-N 3.23Å; I49-F53 HydrophobicContact CG2-CE2 3.65Å; I49-F53 HydrophobicContact CG2-CZ 3.75Å; I49-F53 PolarHBondContact O-N 3.07Å; I49-F90 HydrophobicContact CG2-CD2 4.01Å; I49-F90 HydrophobicContact CG2-CE2 3.64Å; I49-F90 HydrophobicContact CG2-CZ 4.09Å; I49-F145 HydrophobicContact CB-CD1 4.31Å; I49-F145 HydrophobicContact CB-CG 4.43Å; I49-F145 HydrophobicContact CG1-CB 4.04Å; I49-F145 HydrophobicContact CG1-CD1 3.57Å; I49-F145 HydrophobicContact CG1-CE1 4.19Å; I49-F145 HydrophobicContact CG1-CG 3.94Å; I49-F145 HydrophobicContact CG2-CB 4.19Å; I49-F145 HydrophobicContact CG2-CG 4.24Å; I49-L148 HydrophobicContact CD1-CB 4.27Å; I49-M149 HydrophobicContact CD1-CB 4.07Å; I49-M149 HydrophobicContact CD1-SD 4.25Å
50	D	91.9	Very high	94.6	Very high	12 Å²	12	13.4 Å²	13.4	6%	0.064	7%	0.067	C	C	.	.	H	α-helix	trans	-68.1	-33	-175.5	-73.1	-78.6	0	0	0	110.9	Q46 T52 F53 G54 A175 T179 R675	Q46-D50 PolarHBondContact NE2-OD2 3.28Å; Q46-D50 PolarHBondContact O-N 3.31Å; D50-T52 VanDerWaalsContact C-N 3.3Å; D50-T52 PolarHBondContact O-N 2.81Å; D50-F53 WeakPolarHBondContact O-CB 3.25Å; D50-F53 PolarHBondContact O-N 3.15Å; D50-F53 VanDerWaalsContact O-N 3.09Å; D50-G54 PolarHBondContact O-N 3.09Å; D50-A175 HydrophobicContact CB-CB 3.88Å; D50-A175 WeakPolarHBondContact OD2-CB 3.13Å; D50-T179 HydrophobicContact CB-CG2 4Å; D50-T179 WeakPolarHBondContact O-CG2 3.5Å; D50-R675 IonicContact OD1-NH2 2.87Å
51	G	94	Very high	94.6	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-60.2	-37.6	174	0	0	0	0	0	113.5	L47 I49 F53 G54 G55 G178 V182	L47-G51 VanDerWaalsContact O-CA 3.28Å; L47-G51 WeakPolarHBondContact O-CA 3.48Å; L47-G51 PolarHBondContact O-N 3.36Å; I49-G51 VanDerWaalsContact C-N 3.28Å; I49-G51 PolarHBondContact O-N 3.37Å; G51-F53 VanDerWaalsContact C-N 3.34Å; G51-F53 PolarHBondContact O-N 3.16Å; G51-G54 PolarHBondContact O-N 3.23Å; G51-G55 PolarHBondContact O-N 3.4Å; G51-G178 VanDerWaalsContact CA-O 3.23Å; G51-G178 WeakPolarHBondContact CA-O 3.49Å; G51-V182 VanDerWaalsContact O-CB 3.22Å; G51-V182 WeakPolarHBondContact O-CB 3.2Å; G51-V182 WeakPolarHBondContact O-CG1 3.17Å
52	T	96.1	Very high	94.6	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-60.2	-45.2	172	-65.9	0	0	0	0	111.7	I48 I49 D50 G54 G55 F56 M121 F145 Y202	I48-T52 WeakPolarHBondContact O-CB 3.35Å; I48-T52 PolarHBondContact O-N 3.2Å; I48-T52 PolarHBondContact O-OG1 2.72Å; I49-T52 WeakPolarHBondContact O-CB 3.28Å; I49-T52 PolarHBondContact O-N 3.23Å; D50-T52 VanDerWaalsContact C-N 3.3Å; D50-T52 PolarHBondContact O-N 2.81Å; T52-G54 PolarHBondContact O-N 2.97Å; T52-G55 PolarHBondContact O-N 3.28Å; T52-F56 PolarHBondContact O-N 3.05Å; T52-M121 HydrophobicContact CG2-CE 3.36Å; T52-F145 HydrophobicContact CG2-CE2 3.72Å; T52-F145 HydrophobicContact CG2-CZ 3.79Å; T52-F145 WeakPolarHBondContact OG1-CZ 3.22Å; T52-Y202 WeakPolarHBondContact OG1-CE1 3.41Å; T52-Y202 PolarHBondContact OG1-OH 3.42Å; T52-Y202 VanDerWaalsContact OG1-OH 3.13Å
53	F	93.7	Very high	94.6	Very high	6 Å²	6	9.5 Å²	9.5	3%	0.026	5%	0.048	C	C	.	.	H	α-helix	trans	-62.4	-42	179.8	-53.2	-31.1	0	0	0	112.2	I49 D50 G51 Q86 P87 F90 F145 F640	I49-F53 HydrophobicContact CG2-CE2 3.65Å; I49-F53 HydrophobicContact CG2-CZ 3.75Å; I49-F53 PolarHBondContact O-N 3.07Å; D50-F53 WeakPolarHBondContact O-CB 3.25Å; D50-F53 PolarHBondContact O-N 3.15Å; D50-F53 VanDerWaalsContact O-N 3.09Å; G51-F53 VanDerWaalsContact C-N 3.34Å; G51-F53 PolarHBondContact O-N 3.16Å; F53-Q86 HydrophobicContact CE1-CG 4.1Å; F53-P87 HydrophobicContact CD1-CB 4.3Å; F53-P87 HydrophobicContact CD1-CG 3.8Å; F53-P87 HydrophobicContact CE1-CB 4.1Å; F53-P87 HydrophobicContact CE1-CG 3.99Å; F53-P87 HydrophobicContact CE2-CB 4.41Å; F53-P87 HydrophobicContact CG-CG 4.2Å; F53-P87 HydrophobicContact CZ-CB 4.17Å; F53-F90 AromaticContact CE2-CD1 3.8Å; F53-F90 HydrophobicContact CE2-CD1 3.8Å; F53-F90 AromaticContact CE2-CE1 3.84Å; F53-F90 HydrophobicContact CE2-CE1 3.84Å; F53-F90 HydrophobicContact CE2-CG 4.25Å; F53-F90 HydrophobicContact CE2-CZ 4.28Å; F53-F90 HydrophobicContact CZ-CB 3.99Å; F53-F90 AromaticContact CZ-CD1 3.67Å; F53-F90 HydrophobicContact CZ-CD1 3.67Å; F53-F90 HydrophobicContact CZ-CD2 4.28Å; F53-F90 HydrophobicContact CZ-CE1 4.17Å; F53-F90 AromaticContact CZ-CG 3.74Å; F53-F90 HydrophobicContact CZ-CG 3.74Å; F53-F145 AromaticContact CE1-CD2 3.74Å; F53-F145 HydrophobicContact CE1-CD2 3.74Å; F53-F145 AromaticContact CE1-CE2 3.94Å; F53-F145 HydrophobicContact CE1-CE2 3.94Å; F53-F145 AromaticContact CZ-CD2 3.99Å; F53-F145 HydrophobicContact CZ-CD2 3.99Å; F53-F640 HydrophobicContact CB-CE1 4.23Å; F53-F640 AromaticContact CD2-CE1 3.99Å; F53-F640 HydrophobicContact CD2-CE1 3.99Å; F53-F640 HydrophobicContact CD2-CZ 4.45Å; F53-F640 HydrophobicContact CG-CE1 4.23Å
54	G	90.5	Very high	94.6	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-67.9	-40.1	173.6	0	0	0	0	0	113	D50 G51 T52 F56 G57	D50-G54 PolarHBondContact O-N 3.09Å; G51-G54 PolarHBondContact O-N 3.23Å; T52-G54 PolarHBondContact O-N 2.97Å; G54-F56 VanDerWaalsContact C-N 3.26Å; G54-F56 PolarHBondContact O-N 3.23Å; G54-G57 PolarHBondContact O-N 3.26Å
55	G	93.8	Very high	94.4	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-64.1	-26.4	179	0	0	0	0	0	114.2	G51 T52 G57 V58 L59	G51-G55 PolarHBondContact O-N 3.4Å; T52-G55 PolarHBondContact O-N 3.28Å; G55-G57 PolarHBondContact O-N 3.32Å; G55-V58 PolarHBondContact O-N 2.64Å; G55-L59 PolarHBondContact O-N 2.89Å
56	F	95.2	Very high	94.2	Very high	3 Å²	3	12.9 Å²	12.9	1%	0.013	7%	0.065	C	C	.	.	H	α-helix	trans	-61.4	-27.4	-179.9	-173.6	-98.5	0	0	0	113.2	T52 G54 V58 L59 Y60 L63 S80 P82 Y137 V644	T52-F56 PolarHBondContact O-N 3.05Å; G54-F56 VanDerWaalsContact C-N 3.26Å; G54-F56 PolarHBondContact O-N 3.23Å; F56-V58 VanDerWaalsContact C-N 3.27Å; F56-V58 PolarHBondContact O-N 3.06Å; F56-L59 HydrophobicContact CD2-CB 4.26Å; F56-L59 HydrophobicContact CD2-CD1 4.47Å; F56-L59 CarbonylContact O-C 3.56Å; F56-L59 PolarHBondContact O-N 2.89Å; F56-Y60 HydrophobicContact CE1-CD2 4.41Å; F56-Y60 HydrophobicContact CE1-CG 4.38Å; F56-Y60 WeakPolarHBondContact O-CB 3.22Å; F56-Y60 PolarHBondContact O-N 3.14Å; F56-L63 HydrophobicContact CE2-CD1 4.22Å; F56-L63 HydrophobicContact CZ-CD1 4.42Å; F56-S80 WeakPolarHBondContact CE1-O 3.09Å; F56-P82 HydrophobicContact CE2-CB 3.91Å; F56-P82 HydrophobicContact CZ-CB 4.09Å; F56-P82 HydrophobicContact CZ-CG 4.48Å; F56-Y137 AromaticContact CD2-CE1 3.7Å; F56-Y137 HydrophobicContact CD2-CE1 3.7Å; F56-Y137 AromaticContact CD2-CZ 3.79Å; F56-Y137 HydrophobicContact CE2-CE1 4.09Å; F56-V644 HydrophobicContact CD1-CG1 3.94Å; F56-V644 HydrophobicContact CD1-CG2 4.21Å; F56-V644 HydrophobicContact CE1-CG1 3.95Å
57	G	94.1	Very high	94.1	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59.6	-35.2	176.1	0	0	0	0	0	113.9	G54 G55 L61 V644	G54-G57 PolarHBondContact O-N 3.26Å; G55-G57 PolarHBondContact O-N 3.32Å; G57-L61 PolarHBondContact O-N 2.78Å; G57-V644 WeakPolarHBondContact CA-O 3.47Å
58	V	95.8	Very high	93.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-75.7	-39.9	176	-170	0	0	0	0	110.7	G55 F56 S62 P183 I190 I647 V661	G55-V58 PolarHBondContact O-N 2.64Å; F56-V58 VanDerWaalsContact C-N 3.27Å; F56-V58 PolarHBondContact O-N 3.06Å; V58-S62 PolarHBondContact O-N 3.22Å; V58-S62 PolarHBondContact O-OG 3.16Å; V58-P183 HydrophobicContact CG2-CB 3.95Å; V58-I190 HydrophobicContact CG1-CD1 4.11Å; V58-I647 HydrophobicContact CG2-CD1 3.56Å; V58-V661 HydrophobicContact CG2-CG2 3.99Å
59	L	95.6	Very high	93.7	Very high	3 Å²	3	20.1 Å²	20.1	2%	0.016	11%	0.105	C	C	.	.	H	α-helix	trans	-63.3	-42.1	174.1	-73	173.3	0	0	0	111.6	G55 F56 L61 S62 L63 Y137 Y186 I190 W195 L199	G55-L59 PolarHBondContact O-N 2.89Å; F56-L59 HydrophobicContact CD2-CB 4.26Å; F56-L59 HydrophobicContact CD2-CD1 4.47Å; F56-L59 CarbonylContact O-C 3.56Å; F56-L59 PolarHBondContact O-N 2.89Å; L59-L61 PolarHBondContact O-N 3.41Å; L59-S62 CarbonylContact O-C 3.41Å; L59-S62 WeakPolarHBondContact O-CA 3.38Å; L59-S62 WeakPolarHBondContact O-CB 3.35Å; L59-S62 PolarHBondContact O-N 2.75Å; L59-S62 VanDerWaalsContact O-N 3.1Å; L59-L63 WeakPolarHBondContact O-CB 3.26Å; L59-L63 VanDerWaalsContact O-CG 3.24Å; L59-L63 WeakPolarHBondContact O-CG 3.29Å; L59-L63 PolarHBondContact O-N 3.1Å; L59-Y137 HydrophobicContact CD1-CE2 4.2Å; L59-Y186 HydrophobicContact CD1-CD2 4.5Å; L59-Y186 HydrophobicContact CD1-CE1 4.14Å; L59-Y186 HydrophobicContact CD1-CE2 3.88Å; L59-Y186 HydrophobicContact CD2-CD1 3.98Å; L59-Y186 HydrophobicContact CD2-CE1 3.87Å; L59-Y186 HydrophobicContact CD2-CG 4.5Å; L59-Y186 HydrophobicContact CG-CD1 4.27Å; L59-Y186 HydrophobicContact CG-CD2 4.28Å; L59-Y186 HydrophobicContact CG-CE1 4.15Å; L59-Y186 HydrophobicContact CG-CE2 4.15Å; L59-Y186 HydrophobicContact CG-CG 4.36Å; L59-I190 HydrophobicContact CD2-CD1 4.03Å; L59-W195 HydrophobicContact CD2-CB 4.3Å; L59-L199 HydrophobicContact CD1-CD1 4.42Å
60	Y	95.5	Very high	93.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.4	-46.7	-179.4	172.5	-114.4	0	0	0	112.5	F56 S62 L63 R64 L79 Y645 D648	F56-Y60 HydrophobicContact CE1-CD2 4.41Å; F56-Y60 HydrophobicContact CE1-CG 4.38Å; F56-Y60 WeakPolarHBondContact O-CB 3.22Å; F56-Y60 PolarHBondContact O-N 3.14Å; Y60-S62 VanDerWaalsContact C-N 3.28Å; Y60-S62 PolarHBondContact O-N 3.4Å; Y60-L63 PolarHBondContact O-N 3.18Å; Y60-R64 PolarHBondContact O-N 3.42Å; Y60-R64 PolarHBondContact OH-NH2 2.98Å; Y60-L79 HydrophobicContact CD2-CB 4.45Å; Y60-L79 HydrophobicContact CE2-CB 3.97Å; Y60-Y645 HydrophobicContact CD1-CD1 4.18Å; Y60-Y645 AromaticContact CE1-CD1 3.64Å; Y60-Y645 HydrophobicContact CE1-CD1 3.64Å; Y60-Y645 AromaticContact CE1-CE1 3.93Å; Y60-Y645 HydrophobicContact CE1-CE1 3.93Å; Y60-Y645 AromaticContact CZ-CE1 3.92Å; Y60-D648 HydrophobicContact CD1-CB 4.27Å; Y60-D648 HydrophobicContact CE1-CB 4.13Å
61	L	94.1	Very high	93.5	Very high	7 Å²	7	29.5 Å²	29.5	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-59.5	-41	173.3	-178.7	58.5	0	0	0	111.3	G57 L59 N65 I647 V651 Q657	G57-L61 PolarHBondContact O-N 2.78Å; L59-L61 PolarHBondContact O-N 3.41Å; L61-N65 VanDerWaalsContact O-CG 3.28Å; L61-N65 PolarHBondContact O-N 3.07Å; L61-N65 PolarHBondContact O-ND2 3.01Å; L61-I647 HydrophobicContact CD2-CG2 4.13Å; L61-V651 HydrophobicContact CD2-CG1 4.44Å; L61-V651 HydrophobicContact CD2-CG2 4.16Å; L61-Q657 HydrophobicContact CD2-CG 4.11Å
62	S	94	Very high	93.3	Very high	14 Å²	14	34.3 Å²	34.3	10%	0.098	18%	0.178	C	C	.	.	H	α-helix	trans	-66.6	-38	176.3	-54	0	0	0	0	113.2	V58 L59 Y60 N65 D66	V58-S62 PolarHBondContact O-N 3.22Å; V58-S62 PolarHBondContact O-OG 3.16Å; L59-S62 CarbonylContact O-C 3.41Å; L59-S62 WeakPolarHBondContact O-CA 3.38Å; L59-S62 WeakPolarHBondContact O-CB 3.35Å; L59-S62 PolarHBondContact O-N 2.75Å; L59-S62 VanDerWaalsContact O-N 3.1Å; Y60-S62 VanDerWaalsContact C-N 3.28Å; Y60-S62 PolarHBondContact O-N 3.4Å; S62-N65 PolarHBondContact O-N 3.5Å; S62-D66 PolarHBondContact O-N 3.46Å
63	L	94.4	Very high	93.1	Very high	6 Å²	6	41.4 Å²	41.4	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-69.9	-39.9	179	-73	172.6	0	0	0	111.7	F56 L59 Y60 N65 D66 F69 M130 W195	F56-L63 HydrophobicContact CE2-CD1 4.22Å; F56-L63 HydrophobicContact CZ-CD1 4.42Å; L59-L63 WeakPolarHBondContact O-CB 3.26Å; L59-L63 VanDerWaalsContact O-CG 3.24Å; L59-L63 WeakPolarHBondContact O-CG 3.29Å; L59-L63 PolarHBondContact O-N 3.1Å; Y60-L63 PolarHBondContact O-N 3.18Å; L63-N65 PolarHBondContact O-N 3.49Å; L63-D66 PolarHBondContact O-N 3.14Å; L63-F69 HydrophobicContact CD2-CD2 4.28Å; L63-F69 HydrophobicContact CD2-CE2 3.64Å; L63-F69 WeakPolarHBondContact O-CD2 3.25Å; L63-M130 HydrophobicContact CD2-CE 4.07Å; L63-W195 HydrophobicContact CD2-CD2 3.96Å; L63-W195 HydrophobicContact CD2-CE3 3.9Å; L63-W195 HydrophobicContact CD2-CH2 3.53Å; L63-W195 HydrophobicContact CD2-CZ2 3.57Å; L63-W195 HydrophobicContact CD2-CZ3 3.7Å
64	R	92.6	Very high	93.1	Very high	49 Å²	49	43.4 Å²	43.4	19%	0.185	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-33.2	175.1	-163.2	-162.3	-74.1	141.5	-4	111.8	Y60 V70 L79 D648	Y60-R64 PolarHBondContact O-N 3.42Å; Y60-R64 PolarHBondContact OH-NH2 2.98Å; R64-V70 VanDerWaalsContact O-CG2 3.26Å; R64-V70 WeakPolarHBondContact O-CG2 3.36Å; R64-L79 HydrophobicContact CB-CD1 4.26Å; R64-L79 HydrophobicContact CG-CD1 3.97Å; R64-D648 IonicContact CZ-OD1 3.45Å; R64-D648 IonicContact CZ-OD2 3.56Å; R64-D648 VanDerWaalsContact NH1-CG 3.28Å; R64-D648 IonicContact NH1-OD1 3.32Å; R64-D648 PolarHBondContact NH1-OD1 3.29Å; R64-D648 IonicContact NH1-OD2 3.49Å; R64-D648 PolarHBondContact NH1-OD2 2.89Å; R64-D648 IonicContact NH2-OD1 2.72Å; R64-D648 IonicContact NH2-OD2 2.71Å; R64-D648 PolarHBondContact NH2-OD2 3.21Å
65	N	92	Very high	93.2	Very high	108 Å²	108	45.2 Å²	45.2	58%	0.578	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-4.4	-177.8	-63.8	-15.1	0	0	0	113.8	L61 S62 L63 Q67	L61-N65 VanDerWaalsContact O-CG 3.28Å; L61-N65 PolarHBondContact O-N 3.07Å; L61-N65 PolarHBondContact O-ND2 3.01Å; S62-N65 PolarHBondContact O-N 3.5Å; L63-N65 PolarHBondContact O-N 3.49Å; N65-Q67 PolarHBondContact O-N 2.92Å
66	D	93.4	Very high	93.2	Very high	23 Å²	23	47.8 Å²	47.8	12%	0.123	25%	0.249	C	C	.	.			trans	-76.5	121.9	179.4	-174.6	-78.7	0	0	0	111.9	S62 L63 A68 F69 V70 W195 R196	S62-D66 PolarHBondContact O-N 3.46Å; L63-D66 PolarHBondContact O-N 3.14Å; D66-A68 PolarHBondContact O-N 3.38Å; D66-A68 VanDerWaalsContact O-N 3.09Å; D66-A68 WeakPolarHBondContact OD1-CA 3.36Å; D66-A68 VanDerWaalsContact OD1-CB 3.22Å; D66-A68 WeakPolarHBondContact OD1-CB 3.48Å; D66-A68 PolarHBondContact OD1-N 3.33Å; D66-F69 HydrophobicContact CB-CD2 3.81Å; D66-F69 HydrophobicContact CB-CE2 4.25Å; D66-F69 PolarHBondContact O-N 3.18Å; D66-V70 PolarHBondContact O-N 2.67Å; D66-W195 PolarHBondContact OD2-NE1 3.47Å; D66-R196 IonicContact OD1-NH1 2.75Å; D66-R196 IonicContact OD1-NH2 3.29Å; D66-R196 PolarHBondContact OD1-NH2 3.09Å; D66-R196 IonicContact OD2-CZ 3.79Å; D66-R196 IonicContact OD2-NH1 3.48Å; D66-R196 PolarHBondContact OD2-NH1 3.3Å; D66-R196 IonicContact OD2-NH2 3.43Å; D66-R196 PolarHBondContact OD2-NH2 2.91Å
67	Q	91.7	Very high	93.2	Very high	152 Å²	152	48.3 Å²	48.3	71%	0.71	25%	0.252	S	S	*	.	H	α-helix	trans	-56.7	-29.6	-176.4	-66.9	-177.9	-6.7	0	0	113.7	N65 F69 N71	N65-Q67 PolarHBondContact O-N 2.92Å; Q67-F69 PolarHBondContact O-N 2.61Å; Q67-N71 WeakPolarHBondContact O-CB 3.25Å; Q67-N71 PolarHBondContact O-N 3Å; Q67-N71 PolarHBondContact O-ND2 3Å
68	A	90.7	Very high	93.3	Very high	37 Å²	37	50.5 Å²	50.5	31%	0.306	26%	0.263	S	S	.	.	H	α-helix	trans	-73.4	-16.4	-179.8	0	0	0	0	0	113.3	D66 K72	D66-A68 PolarHBondContact O-N 3.38Å; D66-A68 VanDerWaalsContact O-N 3.09Å; D66-A68 WeakPolarHBondContact OD1-CA 3.36Å; D66-A68 VanDerWaalsContact OD1-CB 3.22Å; D66-A68 WeakPolarHBondContact OD1-CB 3.48Å; D66-A68 PolarHBondContact OD1-N 3.33Å; A68-K72 WeakPolarHBondContact O-CD 3.48Å; A68-K72 WeakPolarHBondContact O-CG 3.36Å
69	F	93.1	Very high	93.2	Very high	3 Å²	3	50.9 Å²	50.9	1%	0.013	27%	0.265	C	S	.	.	H	α-helix	trans	-100.2	-36.8	173	-55	-46.7	0	0	0	112.2	L63 D66 Q67 N71 K72 N73 Y74 L79 M130 I133 W195	L63-F69 HydrophobicContact CD2-CD2 4.28Å; L63-F69 HydrophobicContact CD2-CE2 3.64Å; L63-F69 WeakPolarHBondContact O-CD2 3.25Å; D66-F69 HydrophobicContact CB-CD2 3.81Å; D66-F69 HydrophobicContact CB-CE2 4.25Å; D66-F69 PolarHBondContact O-N 3.18Å; Q67-F69 PolarHBondContact O-N 2.61Å; F69-N71 PolarHBondContact O-N 2.76Å; F69-K72 PolarHBondContact O-N 3.34Å; F69-N73 PolarHBondContact O-N 3.07Å; F69-Y74 HydrophobicContact CB-CD2 4.1Å; F69-Y74 HydrophobicContact CD1-CD2 4.08Å; F69-Y74 HydrophobicContact CD1-CE2 4.01Å; F69-Y74 HydrophobicContact CG-CD2 4.48Å; F69-L79 HydrophobicContact CB-CD2 4.11Å; F69-L79 HydrophobicContact CD2-CD2 4.47Å; F69-L79 HydrophobicContact CG-CD2 4.41Å; F69-M130 HydrophobicContact CD1-CE 3.82Å; F69-M130 HydrophobicContact CD1-CG 4.32Å; F69-M130 HydrophobicContact CD2-CE 3.51Å; F69-M130 HydrophobicContact CE1-CE 3.67Å; F69-M130 HydrophobicContact CE2-CE 3.36Å; F69-M130 HydrophobicContact CG-CE 3.77Å; F69-M130 HydrophobicContact CZ-CE 3.46Å; F69-M130 VanDerWaalsContact CZ-CE 3.46Å; F69-I133 HydrophobicContact CE1-CD1 4.22Å; F69-I133 HydrophobicContact CZ-CD1 3.73Å; F69-W195 HydrophobicContact CE2-CH2 4.02Å; F69-W195 AromaticContact CE2-CZ2 3.52Å; F69-W195 HydrophobicContact CE2-CZ2 3.52Å; F69-W195 HydrophobicContact CZ-CH2 4.16Å; F69-W195 AromaticContact CZ-CZ2 3.97Å; F69-W195 HydrophobicContact CZ-CZ2 3.97Å
70	V	91.3	Very high	93.2	Very high	76 Å²	76	50.7 Å²	50.7	46%	0.461	26%	0.264	S	S	.	.	H	α-helix	trans	-57.5	-47.6	170.3	176.6	0	0	0	0	110.6	R64 D66 K72 N73	R64-V70 VanDerWaalsContact O-CG2 3.26Å; R64-V70 WeakPolarHBondContact O-CG2 3.36Å; D66-V70 PolarHBondContact O-N 2.67Å; V70-K72 PolarHBondContact O-N 2.86Å; V70-N73 PolarHBondContact O-N 3.46Å; V70-N73 PolarHBondContact O-OD1 3.41Å
71	N	91.7	Very high	93.2	Very high	132 Å²	132	52.6 Å²	52.6	71%	0.706	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.2	177.7	-68.7	-13.6	0	0	0	114.2	Q67 F69	Q67-N71 WeakPolarHBondContact O-CB 3.25Å; Q67-N71 PolarHBondContact O-N 3Å; Q67-N71 PolarHBondContact O-ND2 3Å; F69-N71 PolarHBondContact O-N 2.76Å
72	K	90.7	Very high	93.3	Very high	101 Å²	101	52.3 Å²	52.3	44%	0.439	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-1.4	175.7	-67.4	-179.5	-178.6	-175.2	0	113.2	A68 F69 V70 Y74 T128	A68-K72 WeakPolarHBondContact O-CD 3.48Å; A68-K72 WeakPolarHBondContact O-CG 3.36Å; F69-K72 PolarHBondContact O-N 3.34Å; V70-K72 PolarHBondContact O-N 2.86Å; K72-Y74 VanDerWaalsContact C-N 3.27Å; K72-Y74 HydrophobicContact CB-CD2 3.86Å; K72-Y74 HydrophobicContact CB-CE2 3.8Å; K72-Y74 HydrophobicContact CD-CD2 4.47Å; K72-Y74 HydrophobicContact CD-CE2 3.66Å; K72-Y74 HydrophobicContact CG-CE2 4.38Å; K72-Y74 PolarHBondContact O-N 3.37Å; K72-T128 PolarHBondContact NZ-O 3.27Å
73	N	91.2	Very high	93.3	Very high	150 Å²	150	51.8 Å²	51.8	80%	0.802	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	43.5	-176.8	-68.6	-27.7	0	0	0	113.5	F69 V70	F69-N73 PolarHBondContact O-N 3.07Å; V70-N73 PolarHBondContact O-N 3.46Å; V70-N73 PolarHBondContact O-OD1 3.41Å
74	Y	93.2	Very high	93.2	Very high	48 Å²	48	51.5 Å²	51.5	19%	0.188	27%	0.267	C	S	.	.			trans	-65.6	139.5	171.6	-75.5	-63	0	0	0	111	F69 K72 I78 N129 M130	F69-Y74 HydrophobicContact CB-CD2 4.1Å; F69-Y74 HydrophobicContact CD1-CD2 4.08Å; F69-Y74 HydrophobicContact CD1-CE2 4.01Å; F69-Y74 HydrophobicContact CG-CD2 4.48Å; K72-Y74 VanDerWaalsContact C-N 3.27Å; K72-Y74 HydrophobicContact CB-CD2 3.86Å; K72-Y74 HydrophobicContact CB-CE2 3.8Å; K72-Y74 HydrophobicContact CD-CD2 4.47Å; K72-Y74 HydrophobicContact CD-CE2 3.66Å; K72-Y74 HydrophobicContact CG-CE2 4.38Å; K72-Y74 PolarHBondContact O-N 3.37Å; Y74-I78 HydrophobicContact CD1-CD1 4.45Å; Y74-I78 HydrophobicContact CD1-CG2 3.77Å; Y74-I78 HydrophobicContact CE1-CG2 4.31Å; Y74-I78 HydrophobicContact CG-CG2 4.33Å; Y74-N129 PolarHBondContact OH-OD1 2.99Å; Y74-M130 HydrophobicContact CD1-CB 4.22Å; Y74-M130 HydrophobicContact CD1-CG 4.32Å; Y74-M130 HydrophobicContact CD2-CB 4.35Å; Y74-M130 HydrophobicContact CD2-CG 3.74Å; Y74-M130 HydrophobicContact CE1-CB 3.95Å; Y74-M130 HydrophobicContact CE1-CG 4.38Å; Y74-M130 HydrophobicContact CE2-CB 4.07Å; Y74-M130 HydrophobicContact CE2-CG 3.79Å; Y74-M130 HydrophobicContact CG-CB 4.41Å; Y74-M130 HydrophobicContact CG-CG 4.01Å; Y74-M130 PolarHBondContact OH-N 2.75Å
75	S	94	Very high	93.4	Very high	38 Å²	38	50 Å²	50	27%	0.266	26%	0.263	S	S	.	.			trans	-64.5	149.6	172.5	57.2	0	0	0	0	111.6	T77 I78 L79 E776	S75-T77 PolarHBondContact O-N 2.87Å; S75-I78 PolarHBondContact O-N 2.97Å; S75-I78 WeakPolarHBondContact OG-CB 3.18Å; S75-I78 WeakPolarHBondContact OG-CD1 3.3Å; S75-I78 VanDerWaalsContact OG-CG1 3.27Å; S75-I78 WeakPolarHBondContact OG-CG1 3.48Å; S75-I78 PolarHBondContact OG-N 3.25Å; S75-L79 WeakPolarHBondContact O-CG 3.33Å; S75-L79 PolarHBondContact O-N 3.27Å; S75-E776 WeakPolarHBondContact CA-OE1 3.37Å; S75-E776 WeakPolarHBondContact CB-OE1 3.21Å
76	Q	92.8	Very high	93.6	Very high	54 Å²	54	44.8 Å²	44.8	25%	0.252	24%	0.235	S	C	.	.	H	α-helix	trans	-55	-36.1	168.9	-54.1	-170.6	43.1	0	0	111	L79 S80 I772 E776	Q76-L79 PolarHBondContact O-N 3.46Å; Q76-S80 PolarHBondContact O-N 3.26Å; Q76-I772 HydrophobicContact CB-CD1 4.16Å; Q76-I772 HydrophobicContact CB-CG1 3.9Å; Q76-E776 WeakPolarHBondContact CA-OE1 3.3Å; Q76-E776 HydrophobicContact CB-CG 4.07Å; Q76-E776 WeakPolarHBondContact CB-OE1 3.34Å; Q76-E776 HydrophobicContact CG-CG 4.36Å; Q76-E776 PolarHBondContact N-OE1 2.78Å
77	T	95.1	Very high	93.6	Very high	14 Å²	14	43.8 Å²	43.8	9%	0.086	23%	0.23	C	C	.	.	H	α-helix	trans	-57.5	-51.3	171.3	-62	0	0	0	0	111.7	S75 L79 S80 M81 T769 I772 T773 E776	S75-T77 PolarHBondContact O-N 2.87Å; T77-L79 VanDerWaalsContact C-N 3.28Å; T77-L79 PolarHBondContact O-N 3.34Å; T77-S80 PolarHBondContact O-N 3.44Å; T77-S80 PolarHBondContact O-OG 3.43Å; T77-M81 HydrophobicContact CG2-CE 4.01Å; T77-M81 WeakPolarHBondContact O-CG 3.47Å; T77-M81 PolarHBondContact O-N 2.71Å; T77-T769 HydrophobicContact CG2-CG2 4.04Å; T77-I772 HydrophobicContact CG2-CG2 4.29Å; T77-T773 PolarHBondContact OG1-OG1 3.12Å; T77-E776 VanDerWaalsContact CB-OE2 3.27Å; T77-E776 WeakPolarHBondContact CB-OE2 3.33Å; T77-E776 PolarHBondContact N-OE1 2.68Å; T77-E776 PolarHBondContact N-OE2 3.28Å; T77-E776 PolarHBondContact OG1-OE2 3.01Å
78	I	95.7	Very high	93.7	Very high	46 Å²	46	36.5 Å²	36.5	24%	0.236	20%	0.196	C	C	.	.	H	α-helix	trans	-66.1	-31.4	178.7	-72.5	169.9	0	0	0	111.8	Y74 S75 M130 I134	Y74-I78 HydrophobicContact CD1-CD1 4.45Å; Y74-I78 HydrophobicContact CD1-CG2 3.77Å; Y74-I78 HydrophobicContact CE1-CG2 4.31Å; Y74-I78 HydrophobicContact CG-CG2 4.33Å; S75-I78 PolarHBondContact O-N 2.97Å; S75-I78 WeakPolarHBondContact OG-CB 3.18Å; S75-I78 WeakPolarHBondContact OG-CD1 3.3Å; S75-I78 VanDerWaalsContact OG-CG1 3.27Å; S75-I78 WeakPolarHBondContact OG-CG1 3.48Å; S75-I78 PolarHBondContact OG-N 3.25Å; I78-M130 HydrophobicContact CG2-CB 3.48Å; I78-M130 VanDerWaalsContact CG2-CB 3.48Å; I78-M130 HydrophobicContact CG2-CG 3.97Å; I78-I134 HydrophobicContact CG2-CD1 4.47Å
79	L	95.4	Very high	94	Very high	7 Å²	7	37.4 Å²	37.4	4%	0.037	19%	0.193	C	C	.	.	H	α-helix	trans	-71.8	-31.9	177.9	-71.2	165	0	0	0	113.6	Y60 R64 F69 S75 Q76 T77 M130	Y60-L79 HydrophobicContact CD2-CB 4.45Å; Y60-L79 HydrophobicContact CE2-CB 3.97Å; R64-L79 HydrophobicContact CB-CD1 4.26Å; R64-L79 HydrophobicContact CG-CD1 3.97Å; F69-L79 HydrophobicContact CB-CD2 4.11Å; F69-L79 HydrophobicContact CD2-CD2 4.47Å; F69-L79 HydrophobicContact CG-CD2 4.41Å; S75-L79 WeakPolarHBondContact O-CG 3.33Å; S75-L79 PolarHBondContact O-N 3.27Å; Q76-L79 PolarHBondContact O-N 3.46Å; T77-L79 VanDerWaalsContact C-N 3.28Å; T77-L79 PolarHBondContact O-N 3.34Å; L79-M130 HydrophobicContact CD2-CE 3.69Å; L79-M130 HydrophobicContact CD2-CG 4.29Å; L79-M130 HydrophobicContact CD2-SD 3.98Å
80	S	95.3	Very high	94.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-85.9	-26.2	179	72.9	0	0	0	0	113.6	F56 Q76 T77 P82 G83 T84 Y645	F56-S80 WeakPolarHBondContact CE1-O 3.09Å; Q76-S80 PolarHBondContact O-N 3.26Å; T77-S80 PolarHBondContact O-N 3.44Å; T77-S80 PolarHBondContact O-OG 3.43Å; S80-P82 VanDerWaalsContact C-N 3.31Å; S80-P82 WeakPolarHBondContact O-CD 3.43Å; S80-G83 PolarHBondContact O-N 3.08Å; S80-T84 PolarHBondContact O-N 2.81Å; S80-Y645 VanDerWaalsContact CB-OH 3.3Å; S80-Y645 WeakPolarHBondContact CB-OH 3.2Å; S80-Y645 PolarHBondContact OG-OH 3.47Å
81	M	95.6	Very high	94.1	Very high	40 Å²	40	35.6 Å²	35.6	20%	0.197	18%	0.18	C	C	.	.	H	α-helix	trans	-40.3	-42.8	-178.8	-83.6	-80.5	177.4	0	0	116.2	T77 G83 T84 I85 I134 T769	T77-M81 HydrophobicContact CG2-CE 4.01Å; T77-M81 WeakPolarHBondContact O-CG 3.47Å; T77-M81 PolarHBondContact O-N 2.71Å; M81-G83 VanDerWaalsContact C-N 3.28Å; M81-G83 PolarHBondContact O-N 3.31Å; M81-T84 WeakPolarHBondContact CA-OG1 3.4Å; M81-T84 PolarHBondContact O-N 3.33Å; M81-T84 VanDerWaalsContact O-N 3.14Å; M81-T84 PolarHBondContact O-OG1 3.48Å; M81-I85 HydrophobicContact CB-CD1 4.2Å; M81-I85 HydrophobicContact CG-CD1 4.49Å; M81-I85 VanDerWaalsContact O-CB 3.27Å; M81-I85 WeakPolarHBondContact O-CB 3.27Å; M81-I85 WeakPolarHBondContact O-CG1 3.18Å; M81-I85 PolarHBondContact O-N 3.01Å; M81-I85 HydrophobicContact SD-CD1 3.56Å; M81-I85 VanDerWaalsContact SD-CD1 3.56Å; M81-I85 HydrophobicContact SD-CG1 4.03Å; M81-I134 HydrophobicContact CB-CD1 3.52Å; M81-I134 HydrophobicContact CB-CG1 3.72Å; M81-I134 HydrophobicContact CG-CD1 4.17Å; M81-T769 HydrophobicContact CE-CG2 3.39Å; M81-T769 WeakPolarHBondContact CE-OG1 3.39Å
82	P	95.7	Very high	94.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-54.8	-41.9	178.9	-26.2	35.2	0	0	0	113.4	F56 S80 Q86 I133 I134 Y137	F56-P82 HydrophobicContact CE2-CB 3.91Å; F56-P82 HydrophobicContact CZ-CB 4.09Å; F56-P82 HydrophobicContact CZ-CG 4.48Å; S80-P82 VanDerWaalsContact C-N 3.31Å; S80-P82 WeakPolarHBondContact O-CD 3.43Å; P82-Q86 VanDerWaalsContact O-CB 3.23Å; P82-Q86 WeakPolarHBondContact O-CB 3.24Å; P82-Q86 PolarHBondContact O-N 2.72Å; P82-Q86 VanDerWaalsContact O-N 3.16Å; P82-I133 HydrophobicContact CB-CG2 4.25Å; P82-I133 HydrophobicContact CG-CG2 3.83Å; P82-I134 HydrophobicContact CG-CG1 3.92Å; P82-Y137 HydrophobicContact CB-CD1 3.68Å; P82-Y137 HydrophobicContact CB-CE1 4.39Å; P82-Y137 HydrophobicContact CB-CG 4.22Å
83	G	93.1	Very high	94.1	Very high	3 Å²	3	26.4 Å²	26.4	3%	0.031	14%	0.138	C	C	.	.	H	α-helix	trans	-87.4	-7	179	0	0	0	0	0	115.5	S80 M81 P87	S80-G83 PolarHBondContact O-N 3.08Å; M81-G83 VanDerWaalsContact C-N 3.28Å; M81-G83 PolarHBondContact O-N 3.31Å; G83-P87 WeakPolarHBondContact O-CD 3.47Å; G83-P87 WeakPolarHBondContact O-CG 3.42Å
84	T	93.9	Very high	93.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-93.1	-32.6	170.3	73.3	0	0	0	0	111.3	S80 M81 M765 P768	S80-T84 PolarHBondContact O-N 2.81Å; M81-T84 WeakPolarHBondContact CA-OG1 3.4Å; M81-T84 PolarHBondContact O-N 3.33Å; M81-T84 VanDerWaalsContact O-N 3.14Å; M81-T84 PolarHBondContact O-OG1 3.48Å; T84-M765 WeakPolarHBondContact O-CA 3.46Å; T84-P768 HydrophobicContact CG2-CB 3.65Å
85	I	95.8	Very high	92.7	Very high	17 Å²	17	18 Å²	18	9%	0.087	10%	0.101	C	C	.	.	H	α-helix	trans	-77.9	-39.7	178.2	-69.6	176.4	0	0	0	111.6	M81 G88 F89 I134 M139 M765	M81-I85 HydrophobicContact CB-CD1 4.2Å; M81-I85 HydrophobicContact CG-CD1 4.49Å; M81-I85 VanDerWaalsContact O-CB 3.27Å; M81-I85 WeakPolarHBondContact O-CB 3.27Å; M81-I85 WeakPolarHBondContact O-CG1 3.18Å; M81-I85 PolarHBondContact O-N 3.01Å; M81-I85 HydrophobicContact SD-CD1 3.56Å; M81-I85 VanDerWaalsContact SD-CD1 3.56Å; M81-I85 HydrophobicContact SD-CG1 4.03Å; I85-G88 PolarHBondContact O-N 3.31Å; I85-G88 VanDerWaalsContact O-N 3.16Å; I85-F89 HydrophobicContact CG2-CD2 3.69Å; I85-F89 HydrophobicContact CG2-CE2 3.91Å; I85-F89 PolarHBondContact O-N 3.41Å; I85-I134 HydrophobicContact CD1-CG2 3.47Å; I85-I134 VanDerWaalsContact CD1-CG2 3.47Å; I85-M139 HydrophobicContact CG2-CG 3.82Å; I85-M765 HydrophobicContact CB-CE 4.46Å; I85-M765 HydrophobicContact CG1-CE 3.97Å; I85-M765 HydrophobicContact CG2-CE 4.26Å
86	Q	95.9	Very high	92.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.2	-47.4	-178.1	-170.1	-169	45.1	0	0	113.9	F53 P82 G88 F90 M121 G138 T141 G142 F145	F53-Q86 HydrophobicContact CE1-CG 4.1Å; P82-Q86 VanDerWaalsContact O-CB 3.23Å; P82-Q86 WeakPolarHBondContact O-CB 3.24Å; P82-Q86 PolarHBondContact O-N 2.72Å; P82-Q86 VanDerWaalsContact O-N 3.16Å; Q86-G88 VanDerWaalsContact C-N 3.29Å; Q86-G88 PolarHBondContact O-N 3.06Å; Q86-F90 WeakPolarHBondContact O-CB 3.32Å; Q86-F90 PolarHBondContact O-N 3.33Å; Q86-F90 VanDerWaalsContact O-N 3.11Å; Q86-M121 VanDerWaalsContact NE2-CE 3.26Å; Q86-G138 WeakPolarHBondContact CA-O 3.48Å; Q86-T141 PolarHBondContact NE2-OG1 2.92Å; Q86-G142 WeakPolarHBondContact O-CA 3.44Å; Q86-F145 HydrophobicContact CG-CD2 4.22Å; Q86-F145 HydrophobicContact CG-CE2 4.14Å
87	P	93.8	Very high	91.7	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-71	-26.9	177	-13.5	29.6	0	0	0	112.7	F53 G83 F90 L91 F640	F53-P87 HydrophobicContact CD1-CB 4.3Å; F53-P87 HydrophobicContact CD1-CG 3.8Å; F53-P87 HydrophobicContact CE1-CB 4.1Å; F53-P87 HydrophobicContact CE1-CG 3.99Å; F53-P87 HydrophobicContact CE2-CB 4.41Å; F53-P87 HydrophobicContact CG-CG 4.2Å; F53-P87 HydrophobicContact CZ-CB 4.17Å; G83-P87 WeakPolarHBondContact O-CD 3.47Å; G83-P87 WeakPolarHBondContact O-CG 3.42Å; P87-F90 WeakPolarHBondContact O-CB 3.22Å; P87-F90 WeakPolarHBondContact O-CD1 3.44Å; P87-F90 PolarHBondContact O-N 3.38Å; P87-L91 WeakPolarHBondContact O-CG 3.43Å; P87-L91 PolarHBondContact O-N 3.26Å; P87-L91 VanDerWaalsContact O-N 3.08Å; P87-F640 HydrophobicContact CB-CD1 4.24Å; P87-F640 HydrophobicContact CB-CD2 3.99Å; P87-F640 HydrophobicContact CB-CE1 3.7Å; P87-F640 HydrophobicContact CB-CE2 3.4Å; P87-F640 VanDerWaalsContact CB-CE2 3.4Å; P87-F640 HydrophobicContact CB-CG 4.38Å; P87-F640 HydrophobicContact CB-CZ 3.26Å; P87-F640 HydrophobicContact CG-CD1 4.04Å; P87-F640 HydrophobicContact CG-CD2 4.32Å; P87-F640 HydrophobicContact CG-CE1 3.89Å; P87-F640 HydrophobicContact CG-CE2 4.17Å; P87-F640 HydrophobicContact CG-CG 4.27Å; P87-F640 HydrophobicContact CG-CZ 3.97Å
88	G	94.6	Very high	90.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.7	-50.6	175.6	0	0	0	0	0	112.3	I85 Q86 F90 L91 C92 G761 S764	I85-G88 PolarHBondContact O-N 3.31Å; I85-G88 VanDerWaalsContact O-N 3.16Å; Q86-G88 VanDerWaalsContact C-N 3.29Å; Q86-G88 PolarHBondContact O-N 3.06Å; G88-F90 VanDerWaalsContact C-N 3.31Å; G88-F90 PolarHBondContact O-N 2.85Å; G88-L91 PolarHBondContact O-N 3.22Å; G88-C92 WeakPolarHBondContact O-CB 3.43Å; G88-C92 PolarHBondContact O-N 2.76Å; G88-C92 PolarHBondContact O-SG 2.81Å; G88-G761 WeakPolarHBondContact CA-O 3.19Å; G88-G761 WeakPolarHBondContact O-CA 3.33Å; G88-S764 WeakPolarHBondContact CA-OG 3.22Å; G88-S764 PolarHBondContact N-OG 2.75Å
89	F	95.5	Very high	89.9	Confident	55 Å²	55	16.5 Å²	16.5	24%	0.241	9%	0.09	C	C	.	.	H	α-helix	trans	-62.7	-36.9	174.5	-87.7	-99.2	0	0	0	112.2	I85 L91 C92 T93 M139 M765	I85-F89 HydrophobicContact CG2-CD2 3.69Å; I85-F89 HydrophobicContact CG2-CE2 3.91Å; I85-F89 PolarHBondContact O-N 3.41Å; F89-L91 PolarHBondContact O-N 3.25Å; F89-C92 PolarHBondContact O-N 3.12Å; F89-T93 WeakPolarHBondContact O-CB 3.48Å; F89-T93 PolarHBondContact O-N 3.36Å; F89-T93 PolarHBondContact O-OG1 3.18Å; F89-M139 HydrophobicContact CD1-CB 4.33Å; F89-M139 HydrophobicContact CD2-CB 4.43Å; F89-M139 HydrophobicContact CD2-CG 4.23Å; F89-M139 HydrophobicContact CE1-CB 4.21Å; F89-M139 HydrophobicContact CE1-CE 4.21Å; F89-M139 HydrophobicContact CE1-CG 4.38Å; F89-M139 HydrophobicContact CE2-CB 4.32Å; F89-M139 HydrophobicContact CE2-CG 3.79Å; F89-M139 HydrophobicContact CG-CB 4.44Å; F89-M139 HydrophobicContact CZ-CB 4.21Å; F89-M139 HydrophobicContact CZ-CE 3.78Å; F89-M139 HydrophobicContact CZ-CG 3.88Å; F89-M765 HydrophobicContact CD2-CE 4.24Å; F89-M765 HydrophobicContact CD2-SD 4.33Å; F89-M765 HydrophobicContact CE2-CE 3.82Å; F89-M765 HydrophobicContact CE2-SD 4.33Å
90	F	95	Very high	89.2	Confident	20 Å²	20	18 Å²	18	9%	0.088	10%	0.098	C	C	.	.	H	α-helix	trans	-55.5	-48	172.1	150.5	-103.6	0	0	0	113	I49 F53 Q86 P87 G88 G94 G142 F145 G146 M149	I49-F90 HydrophobicContact CG2-CD2 4.01Å; I49-F90 HydrophobicContact CG2-CE2 3.64Å; I49-F90 HydrophobicContact CG2-CZ 4.09Å; F53-F90 AromaticContact CE2-CD1 3.8Å; F53-F90 HydrophobicContact CE2-CD1 3.8Å; F53-F90 AromaticContact CE2-CE1 3.84Å; F53-F90 HydrophobicContact CE2-CE1 3.84Å; F53-F90 HydrophobicContact CE2-CG 4.25Å; F53-F90 HydrophobicContact CE2-CZ 4.28Å; F53-F90 HydrophobicContact CZ-CB 3.99Å; F53-F90 AromaticContact CZ-CD1 3.67Å; F53-F90 HydrophobicContact CZ-CD1 3.67Å; F53-F90 HydrophobicContact CZ-CD2 4.28Å; F53-F90 HydrophobicContact CZ-CE1 4.17Å; F53-F90 AromaticContact CZ-CG 3.74Å; F53-F90 HydrophobicContact CZ-CG 3.74Å; Q86-F90 WeakPolarHBondContact O-CB 3.32Å; Q86-F90 PolarHBondContact O-N 3.33Å; Q86-F90 VanDerWaalsContact O-N 3.11Å; P87-F90 WeakPolarHBondContact O-CB 3.22Å; P87-F90 WeakPolarHBondContact O-CD1 3.44Å; P87-F90 PolarHBondContact O-N 3.38Å; G88-F90 VanDerWaalsContact C-N 3.31Å; G88-F90 PolarHBondContact O-N 2.85Å; F90-G94 PolarHBondContact O-N 2.76Å; F90-G142 WeakPolarHBondContact CA-O 3.47Å; F90-G142 PolarHBondContact N-O 2.93Å; F90-F145 HydrophobicContact CB-CB 4.16Å; F90-F145 HydrophobicContact CD2-CB 3.84Å; F90-F145 HydrophobicContact CG-CB 4.39Å; F90-G146 WeakPolarHBondContact O-CA 3.36Å; F90-M149 HydrophobicContact CD2-CB 4.32Å; F90-M149 HydrophobicContact CE2-CB 3.76Å; F90-M149 HydrophobicContact CE2-CE 4.29Å; F90-M149 HydrophobicContact CE2-CG 3.63Å; F90-M149 HydrophobicContact CE2-SD 4.06Å; F90-M149 HydrophobicContact CZ-CE 4.03Å; F90-M149 HydrophobicContact CZ-CG 4.24Å; F90-M149 HydrophobicContact CZ-SD 4.39Å
91	L	92.9	Very high	88.5	Confident	21 Å²	21	18.5 Å²	18.5	11%	0.11	10%	0.101	C	C	.	.	H	α-helix	trans	-70.8	-41.8	178.1	-72.6	173.2	0	0	0	112.6	P87 G88 F89 Q636 K760	P87-L91 WeakPolarHBondContact O-CG 3.43Å; P87-L91 PolarHBondContact O-N 3.26Å; P87-L91 VanDerWaalsContact O-N 3.08Å; G88-L91 PolarHBondContact O-N 3.22Å; F89-L91 PolarHBondContact O-N 3.25Å; L91-Q636 HydrophobicContact CD1-CG 4.34Å; L91-K760 HydrophobicContact CD1-CB 4.16Å
92	C	92.4	Very high	87.6	Confident	18 Å²	18	22.4 Å²	22.4	12%	0.122	12%	0.119	C	C	.	.	H	α-helix	trans	-63.2	-48.7	177.7	-67.6	0	0	0	0	112.1	G88 F89 G94 A95 F96 L758	G88-C92 WeakPolarHBondContact O-CB 3.43Å; G88-C92 PolarHBondContact O-N 2.76Å; G88-C92 PolarHBondContact O-SG 2.81Å; F89-C92 PolarHBondContact O-N 3.12Å; C92-G94 PolarHBondContact O-N 2.93Å; C92-A95 PolarHBondContact O-N 3.28Å; C92-F96 VanDerWaalsContact O-CD2 3.28Å; C92-F96 WeakPolarHBondContact O-CD2 3.42Å; C92-L758 HydrophobicContact CB-CD1 3.86Å
93	T	89	Confident	86.7	Confident	23 Å²	23	25 Å²	25	14%	0.141	13%	0.131	C	C	.	.	H	α-helix	trans	-64.8	-28	-176.3	-65.1	0	0	0	0	112.3	F89 A95 F96 V97 S143 I147	F89-T93 WeakPolarHBondContact O-CB 3.48Å; F89-T93 PolarHBondContact O-N 3.36Å; F89-T93 PolarHBondContact O-OG1 3.18Å; T93-A95 PolarHBondContact O-N 2.89Å; T93-A95 VanDerWaalsContact O-N 3.13Å; T93-F96 PolarHBondContact O-N 3.04Å; T93-V97 HydrophobicContact CG2-CG2 3.61Å; T93-V97 VanDerWaalsContact O-CG2 3.29Å; T93-V97 WeakPolarHBondContact O-CG2 3.5Å; T93-V97 PolarHBondContact O-N 3.19Å; T93-S143 WeakPolarHBondContact CG2-O 3.14Å; T93-I147 HydrophobicContact CG2-CG1 4.25Å
94	G	78.2	Confident	86.2	Confident	21 Å²	21	29.7 Å²	29.7	22%	0.216	15%	0.151	C	C	.	.	H	α-helix	trans	-53.7	-32	175.1	0	0	0	0	0	114.4	F90 C92	F90-G94 PolarHBondContact O-N 2.76Å; C92-G94 PolarHBondContact O-N 2.93Å
95	A	78.1	Confident	85.7	Confident	1 Å²	1	30 Å²	30	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-69.3	-31.5	175.3	0	0	0	0	0	113.3	C92 T93 F615	C92-A95 PolarHBondContact O-N 3.28Å; T93-A95 PolarHBondContact O-N 2.89Å; T93-A95 VanDerWaalsContact O-N 3.13Å; A95-F615 HydrophobicContact CB-CZ 4.12Å
96	F	82.6	Confident	85.3	Confident	83 Å²	83	29.9 Å²	29.9	36%	0.364	15%	0.153	S	C	.	.	H	α-helix	trans	-95.9	-8.3	-173.2	-57.8	-83.6	0	0	0	114	C92 T93 I611 F615 L758	C92-F96 VanDerWaalsContact O-CD2 3.28Å; C92-F96 WeakPolarHBondContact O-CD2 3.42Å; T93-F96 PolarHBondContact O-N 3.04Å; F96-I611 HydrophobicContact CD1-CD1 4.17Å; F96-F615 HydrophobicContact CD1-CE2 4.2Å; F96-F615 AromaticContact CE1-CE2 3.52Å; F96-F615 HydrophobicContact CE1-CE2 3.52Å; F96-F615 AromaticContact CE1-CZ 3.74Å; F96-F615 HydrophobicContact CE1-CZ 3.74Å; F96-F615 HydrophobicContact CE2-CZ 4.31Å; F96-F615 AromaticContact CZ-CE2 3.91Å; F96-F615 HydrophobicContact CZ-CE2 3.91Å; F96-F615 AromaticContact CZ-CZ 3.62Å; F96-F615 HydrophobicContact CZ-CZ 3.62Å; F96-L758 HydrophobicContact CE2-CD1 4.16Å
97	V	83.4	Confident	85	Confident	3 Å²	3	35.3 Å²	35.3	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-84.5	-26.3	-174.5	167.4	0	0	0	0	113.3	T93 L100 I101 I147 V150	T93-V97 HydrophobicContact CG2-CG2 3.61Å; T93-V97 VanDerWaalsContact O-CG2 3.29Å; T93-V97 WeakPolarHBondContact O-CG2 3.5Å; T93-V97 PolarHBondContact O-N 3.19Å; V97-L100 WeakPolarHBondContact O-CB 3.48Å; V97-L100 PolarHBondContact O-N 2.83Å; V97-I101 HydrophobicContact CG1-CD1 3.56Å; V97-I101 HydrophobicContact CG1-CG1 3.86Å; V97-I101 PolarHBondContact O-N 3.32Å; V97-I147 HydrophobicContact CG2-CB 4.27Å; V97-I147 HydrophobicContact CG2-CG1 3.69Å; V97-V150 HydrophobicContact CB-CB 4.34Å; V97-V150 HydrophobicContact CB-CG2 4.13Å; V97-V150 HydrophobicContact CG1-CB 3.74Å; V97-V150 HydrophobicContact CG1-CG1 4.14Å; V97-V150 HydrophobicContact CG1-CG2 4.08Å
98	S	76.8	Confident	84.9	Confident	31 Å²	31	40.5 Å²	40.5	22%	0.217	20%	0.2	C	C	.	.	H	α-helix	trans	-56.8	-43.7	-178.5	-57.3	0	0	0	0	113.6	I101 Q102	S98-I101 PolarHBondContact O-N 3.06Å; S98-Q102 WeakPolarHBondContact O-CG 3.49Å; S98-Q102 PolarHBondContact O-N 3.28Å
99	P	75.4	Confident	84.7	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-71.1	-31.3	174.2	-19.1	35	0	0	0	113.4	I101 Q102 M103 F607 I611 L614	P99-I101 VanDerWaalsContact C-N 3.34Å; P99-I101 PolarHBondContact O-N 2.87Å; P99-Q102 PolarHBondContact O-N 2.78Å; P99-M103 PolarHBondContact O-N 3.31Å; P99-F607 HydrophobicContact CB-CD2 3.53Å; P99-F607 HydrophobicContact CB-CE2 3.93Å; P99-F607 HydrophobicContact CB-CG 4.13Å; P99-I611 HydrophobicContact CG-CG1 4.26Å; P99-L614 HydrophobicContact CG-CD1 3.63Å
100	L	79.9	Confident	84.6	Confident	39 Å²	39	38 Å²	38	20%	0.204	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-42.8	174.8	-172.2	74.8	0	0	0	111.3	V97 Q102 M103 F104 F607	V97-L100 WeakPolarHBondContact O-CB 3.48Å; V97-L100 PolarHBondContact O-N 2.83Å; L100-Q102 VanDerWaalsContact C-N 3.32Å; L100-Q102 PolarHBondContact O-N 2.92Å; L100-M103 PolarHBondContact O-N 3.45Å; L100-F104 HydrophobicContact CD1-CD2 3.67Å; L100-F104 HydrophobicContact CD1-CE2 3.68Å; L100-F104 HydrophobicContact CG-CD2 4.12Å; L100-F104 WeakPolarHBondContact O-CD2 3.19Å; L100-F104 PolarHBondContact O-N 2.84Å; L100-F607 HydrophobicContact CB-CE2 4.38Å
101	I	80.8	Confident	84.6	Confident	11 Å²	11	38.7 Å²	38.7	6%	0.056	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-33.9	175.9	-74.5	175.1	0	0	0	111.7	V97 S98 P99 M103 G105 F106 V150	V97-I101 HydrophobicContact CG1-CD1 3.56Å; V97-I101 HydrophobicContact CG1-CG1 3.86Å; V97-I101 PolarHBondContact O-N 3.32Å; S98-I101 PolarHBondContact O-N 3.06Å; P99-I101 VanDerWaalsContact C-N 3.34Å; P99-I101 PolarHBondContact O-N 2.87Å; I101-M103 VanDerWaalsContact C-N 3.34Å; I101-G105 WeakPolarHBondContact O-CA 3.16Å; I101-G105 PolarHBondContact O-N 2.73Å; I101-F106 HydrophobicContact CD1-CD1 4.1Å; I101-F106 HydrophobicContact CD1-CE1 4.13Å; I101-F106 HydrophobicContact CG2-CD1 3.6Å; I101-F106 HydrophobicContact CG2-CE1 3.38Å; I101-F106 HydrophobicContact CG2-CE2 4.32Å; I101-F106 HydrophobicContact CG2-CG 4.18Å; I101-F106 HydrophobicContact CG2-CZ 3.76Å; I101-V150 HydrophobicContact CD1-CB 4Å; I101-V150 HydrophobicContact CD1-CG1 3.63Å
102	Q	76.4	Confident	84.7	Confident	121 Å²	121	42.9 Å²	42.9	57%	0.565	21%	0.214	S	C	*	.	H	α-helix	trans	-65.8	-37.3	174.9	-70.7	169.5	5	0	0	111.8	S98 P99 L100	S98-Q102 WeakPolarHBondContact O-CG 3.49Å; S98-Q102 PolarHBondContact O-N 3.28Å; P99-Q102 PolarHBondContact O-N 2.78Å; L100-Q102 VanDerWaalsContact C-N 3.32Å; L100-Q102 PolarHBondContact O-N 2.92Å
103	M	78.2	Confident	84.9	Confident	55 Å²	55	42 Å²	42	27%	0.271	21%	0.208	S	C	.	.	H	α-helix	trans	-75.2	-44.6	178	-70.7	177.6	56.3	0	0	114.1	P99 L100 I101 N603 F607	P99-M103 PolarHBondContact O-N 3.31Å; L100-M103 PolarHBondContact O-N 3.45Å; I101-M103 VanDerWaalsContact C-N 3.34Å; M103-N603 HydrophobicContact CE-CB 3.98Å; M103-N603 HydrophobicContact CG-CB 4.2Å; M103-N603 HydrophobicContact SD-CB 4.32Å; M103-F607 HydrophobicContact SD-CB 3.83Å; M103-F607 HydrophobicContact SD-CD2 3.74Å; M103-F607 HydrophobicContact SD-CG 4.13Å
104	F	81.6	Confident	85.3	Confident	102 Å²	102	41 Å²	41	45%	0.447	20%	0.202	S	C	.	.	H	α-helix	trans	-110.2	-6.8	-169.6	-61.6	-71.1	0	0	0	114.3	L100 I108	L100-F104 HydrophobicContact CD1-CD2 3.67Å; L100-F104 HydrophobicContact CD1-CE2 3.68Å; L100-F104 HydrophobicContact CG-CD2 4.12Å; L100-F104 WeakPolarHBondContact O-CD2 3.19Å; L100-F104 PolarHBondContact O-N 2.84Å; F104-I108 HydrophobicContact CB-CB 4.32Å; F104-I108 HydrophobicContact CB-CG2 4.29Å; F104-I108 WeakPolarHBondContact O-CB 3.34Å
105	G	84.1	Confident	86.2	Confident	6 Å²	6	44.6 Å²	44.6	6%	0.062	22%	0.216	C	C	.	.	H	α-helix	trans	70.3	166	-172.8	0	0	0	0	0	113.7	I101 R107 S109	I101-G105 WeakPolarHBondContact O-CA 3.16Å; I101-G105 PolarHBondContact O-N 2.73Å; G105-R107 PolarHBondContact O-N 2.96Å; G105-S109 WeakPolarHBondContact O-CB 3.47Å; G105-S109 PolarHBondContact O-N 3.16Å; G105-S109 PolarHBondContact O-OG 3.08Å
106	F	86.2	Confident	87.1	Confident	14 Å²	14	46.5 Å²	46.5	6%	0.061	23%	0.226	C	C	.	.	H	α-helix	trans	-58.9	-42.4	-178.1	-63.1	-72.4	0	0	0	113.7	I101 G110 C151 V154 Y158 L217 F220	I101-F106 HydrophobicContact CD1-CD1 4.1Å; I101-F106 HydrophobicContact CD1-CE1 4.13Å; I101-F106 HydrophobicContact CG2-CD1 3.6Å; I101-F106 HydrophobicContact CG2-CE1 3.38Å; I101-F106 HydrophobicContact CG2-CE2 4.32Å; I101-F106 HydrophobicContact CG2-CG 4.18Å; I101-F106 HydrophobicContact CG2-CZ 3.76Å; F106-G110 PolarHBondContact O-N 3.16Å; F106-C151 PolarHBondContact O-SG 3.16Å; F106-V154 HydrophobicContact CE1-CB 3.86Å; F106-V154 HydrophobicContact CE1-CG1 3.73Å; F106-V154 HydrophobicContact CZ-CB 4.31Å; F106-V154 HydrophobicContact CZ-CG1 3.68Å; F106-Y158 HydrophobicContact CE2-CD2 4.21Å; F106-Y158 HydrophobicContact CE2-CE2 4.3Å; F106-Y158 HydrophobicContact CZ-CD2 4Å; F106-Y158 AromaticContact CZ-CE2 3.92Å; F106-Y158 HydrophobicContact CZ-CE2 3.92Å; F106-L217 HydrophobicContact CB-CB 4.09Å; F106-L217 HydrophobicContact CB-CD1 4.05Å; F106-F220 HydrophobicContact CD2-CB 4.37Å; F106-F220 HydrophobicContact CE2-CB 4.39Å; F106-F220 AromaticContact CE2-CD2 3.9Å; F106-F220 HydrophobicContact CE2-CD2 3.9Å; F106-F220 HydrophobicContact CE2-CG 4.45Å
107	R	91.3	Very high	87.8	Confident	114 Å²	114	42.6 Å²	42.6	43%	0.43	21%	0.208	S	C	.	.	H	α-helix	trans	-63.6	-51.5	-172.9	-160.2	-177.8	-167	-146.8	-1.2	112.9	G105 C111 S214 L215 L217	G105-R107 PolarHBondContact O-N 2.96Å; R107-C111 PolarHBondContact O-N 2.98Å; R107-C111 VanDerWaalsContact O-N 3.07Å; R107-C111 PolarHBondContact O-SG 3.41Å; R107-S214 WeakPolarHBondContact CG-O 3.5Å; R107-L215 PolarHBondContact NE-O 2.99Å; R107-L215 PolarHBondContact NH2-O 3.43Å; R107-L217 WeakPolarHBondContact CB-O 3.37Å; R107-L217 WeakPolarHBondContact CD-O 3.39Å; R107-L217 VanDerWaalsContact CG-O 3.29Å; R107-L217 WeakPolarHBondContact CG-O 3.29Å
108	I	90.3	Very high	88.5	Confident	110 Å²	110	42.7 Å²	42.7	56%	0.564	21%	0.21	S	C	*	.	H	α-helix	trans	-69.1	-45.4	-178.3	-62.1	174	0	0	0	109.5	F104 G110 C111 F112	F104-I108 HydrophobicContact CB-CB 4.32Å; F104-I108 HydrophobicContact CB-CG2 4.29Å; F104-I108 WeakPolarHBondContact O-CB 3.34Å; I108-G110 PolarHBondContact O-N 3.05Å; I108-C111 PolarHBondContact O-N 3.35Å; I108-F112 WeakPolarHBondContact O-CB 3.45Å; I108-F112 PolarHBondContact O-N 2.87Å
109	S	91.7	Very high	89.4	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-57.4	-46	177.1	-53.9	0	0	0	0	112	G105 F112 G113 I147	G105-S109 WeakPolarHBondContact O-CB 3.47Å; G105-S109 PolarHBondContact O-N 3.16Å; G105-S109 PolarHBondContact O-OG 3.08Å; S109-F112 PolarHBondContact O-N 3.24Å; S109-G113 PolarHBondContact O-N 3.4Å; S109-I147 WeakPolarHBondContact O-CG2 3.44Å
110	G	92.9	Very high	90.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-44.8	176.8	0	0	0	0	0	113	F106 I108 F112 G113 A114 L148 S214	F106-G110 PolarHBondContact O-N 3.16Å; I108-G110 PolarHBondContact O-N 3.05Å; G110-F112 VanDerWaalsContact C-N 3.32Å; G110-F112 PolarHBondContact O-N 2.89Å; G110-G113 PolarHBondContact O-N 3.05Å; G110-A114 PolarHBondContact O-N 3.44Å; G110-L148 WeakPolarHBondContact O-CD2 3.46Å; G110-S214 VanDerWaalsContact C-CB 3.41Å; G110-S214 WeakPolarHBondContact CA-OG 3.48Å; G110-S214 PolarHBondContact O-OG 2.98Å
111	C	94.9	Very high	91.3	Very high	35 Å²	35	43.9 Å²	43.9	24%	0.236	21%	0.214	C	C	.	.	H	α-helix	trans	-63.6	-37.8	177.3	-64.6	0	0	0	0	112.2	R107 I108 A114 L115	R107-C111 PolarHBondContact O-N 2.98Å; R107-C111 VanDerWaalsContact O-N 3.07Å; R107-C111 PolarHBondContact O-SG 3.41Å; I108-C111 PolarHBondContact O-N 3.35Å; C111-A114 PolarHBondContact O-N 3.47Å; C111-L115 WeakPolarHBondContact O-CB 3.32Å; C111-L115 PolarHBondContact O-N 2.8Å
112	F	94.8	Very high	92.1	Very high	109 Å²	109	44.3 Å²	44.3	48%	0.478	22%	0.218	S	C	.	.	H	α-helix	trans	-64	-43.3	173.4	176.9	-115.3	0	0	0	111.9	I108 S109 G110 L115 L116 I147	I108-F112 WeakPolarHBondContact O-CB 3.45Å; I108-F112 PolarHBondContact O-N 2.87Å; S109-F112 PolarHBondContact O-N 3.24Å; G110-F112 VanDerWaalsContact C-N 3.32Å; G110-F112 PolarHBondContact O-N 2.89Å; F112-L115 PolarHBondContact O-N 3.38Å; F112-L116 HydrophobicContact CD1-CD1 3.94Å; F112-L116 HydrophobicContact CD2-CD1 4.47Å; F112-L116 HydrophobicContact CE1-CD1 3.48Å; F112-L116 VanDerWaalsContact CE1-CD1 3.48Å; F112-L116 HydrophobicContact CE2-CD1 4.06Å; F112-L116 HydrophobicContact CE2-CG 4.34Å; F112-L116 HydrophobicContact CG-CD1 4.42Å; F112-L116 HydrophobicContact CZ-CD1 3.55Å; F112-L116 HydrophobicContact CZ-CG 4.27Å; F112-L116 WeakPolarHBondContact O-CB 3.29Å; F112-L116 PolarHBondContact O-N 2.6Å; F112-I147 HydrophobicContact CD1-CD1 4.12Å; F112-I147 HydrophobicContact CE1-CD1 4.16Å
113	G	95.8	Very high	93.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-46.1	171.9	0	0	0	0	0	112.9	S109 G110 L115 L116 L117 A144	S109-G113 PolarHBondContact O-N 3.4Å; G110-G113 PolarHBondContact O-N 3.05Å; G113-L115 VanDerWaalsContact C-N 3.3Å; G113-L115 PolarHBondContact O-N 3.01Å; G113-L116 PolarHBondContact O-N 2.84Å; G113-L117 WeakPolarHBondContact O-CB 3.37Å; G113-L117 PolarHBondContact O-N 2.76Å; G113-A144 WeakPolarHBondContact O-CB 3.34Å
114	A	97.2	Very high	94.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-36.6	177.4	0	0	0	0	0	113.1	G110 C111 G118 L148 S207 T210 A211	G110-A114 PolarHBondContact O-N 3.44Å; C111-A114 PolarHBondContact O-N 3.47Å; A114-G118 PolarHBondContact O-N 3.29Å; A114-G118 VanDerWaalsContact O-N 3.11Å; A114-L148 HydrophobicContact CB-CD2 4.36Å; A114-S207 WeakPolarHBondContact O-CB 3.17Å; A114-S207 PolarHBondContact O-OG 2.87Å; A114-T210 WeakPolarHBondContact CB-OG1 3.43Å; A114-A211 HydrophobicContact CB-CB 3.79Å; A114-A211 VanDerWaalsContact CB-N 3.34Å
115	L	97.3	Very high	94.8	Very high	97 Å²	97	34.4 Å²	34.4	51%	0.508	17%	0.174	S	C	.	.	H	α-helix	trans	-72.2	-42.1	175.7	-179.1	144.3	0	0	0	112	C111 F112 G113 L117 G118 L119	C111-L115 WeakPolarHBondContact O-CB 3.32Å; C111-L115 PolarHBondContact O-N 2.8Å; F112-L115 PolarHBondContact O-N 3.38Å; G113-L115 VanDerWaalsContact C-N 3.3Å; G113-L115 PolarHBondContact O-N 3.01Å; L115-L117 VanDerWaalsContact C-N 3.34Å; L115-L117 PolarHBondContact O-N 3.18Å; L115-G118 PolarHBondContact O-N 3.42Å; L115-L119 HydrophobicContact CD2-CD1 3.61Å; L115-L119 HydrophobicContact CD2-CG 4.34Å; L115-L119 HydrophobicContact CG-CD1 4.28Å; L115-L119 WeakPolarHBondContact O-CG 3.31Å; L115-L119 PolarHBondContact O-N 2.81Å
116	L	97.2	Very high	95.3	Very high	42 Å²	42	42 Å²	42	22%	0.22	20%	0.202	C	C	.	.	H	α-helix	trans	-60.2	-41.7	173.2	-88.6	166.4	0	0	0	112.3	F112 G113 G120 I140 A144 I147	F112-L116 HydrophobicContact CD1-CD1 3.94Å; F112-L116 HydrophobicContact CD2-CD1 4.47Å; F112-L116 HydrophobicContact CE1-CD1 3.48Å; F112-L116 VanDerWaalsContact CE1-CD1 3.48Å; F112-L116 HydrophobicContact CE2-CD1 4.06Å; F112-L116 HydrophobicContact CE2-CG 4.34Å; F112-L116 HydrophobicContact CG-CD1 4.42Å; F112-L116 HydrophobicContact CZ-CD1 3.55Å; F112-L116 HydrophobicContact CZ-CG 4.27Å; F112-L116 WeakPolarHBondContact O-CB 3.29Å; F112-L116 PolarHBondContact O-N 2.6Å; G113-L116 PolarHBondContact O-N 2.84Å; L116-G120 PolarHBondContact O-N 3.29Å; L116-I140 HydrophobicContact CD2-CG2 3.99Å; L116-A144 HydrophobicContact CB-CB 3.71Å; L116-I147 HydrophobicContact CD1-CD1 3.98Å
117	L	97.9	Very high	95.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-51.2	173.8	170	60.2	0	0	0	111.1	I48 G113 L115 M121 T141 A144 F145 L148 A206 T210	I48-L117 HydrophobicContact CG2-CD2 3.92Å; G113-L117 WeakPolarHBondContact O-CB 3.37Å; G113-L117 PolarHBondContact O-N 2.76Å; L115-L117 VanDerWaalsContact C-N 3.34Å; L115-L117 PolarHBondContact O-N 3.18Å; L117-M121 HydrophobicContact CD1-CE 4.47Å; L117-M121 HydrophobicContact CD1-CG 4.26Å; L117-M121 HydrophobicContact CD1-SD 4.44Å; L117-M121 PolarHBondContact O-N 2.91Å; L117-M121 VanDerWaalsContact O-N 3.14Å; L117-T141 HydrophobicContact CD1-CG2 4.29Å; L117-A144 HydrophobicContact CB-CB 4Å; L117-F145 HydrophobicContact CD1-CD1 4.2Å; L117-F145 HydrophobicContact CD1-CE1 3.37Å; L117-F145 HydrophobicContact CD1-CZ 3.57Å; L117-F145 HydrophobicContact CD2-CD1 4.33Å; L117-F145 HydrophobicContact CD2-CE1 3.67Å; L117-F145 HydrophobicContact CG-CE1 4.11Å; L117-L148 HydrophobicContact CD2-CD1 4.12Å; L117-A206 HydrophobicContact CD2-CB 4.35Å; L117-T210 HydrophobicContact CD2-CG2 4.24Å
118	G	97.2	Very high	95.8	Very high	6 Å²	6	41.3 Å²	41.3	6%	0.062	21%	0.21	C	C	.	.	H	α-helix	trans	-59.7	-51.1	179.8	0	0	0	0	0	112.6	A114 L115 S122 S207	A114-G118 PolarHBondContact O-N 3.29Å; A114-G118 VanDerWaalsContact O-N 3.11Å; L115-G118 PolarHBondContact O-N 3.42Å; G118-S122 WeakPolarHBondContact O-CB 3.47Å; G118-S122 PolarHBondContact O-N 2.89Å; G118-S122 PolarHBondContact O-OG 2.92Å; G118-S207 VanDerWaalsContact CA-CB 3.46Å
119	L	97.5	Very high	95.9	Very high	96 Å²	96	39.4 Å²	39.4	50%	0.503	20%	0.201	S	C	.	.	H	α-helix	trans	-64.9	-47.6	179.3	-68.6	179.4	0	0	0	112	L115 M121 S122 I123	L115-L119 HydrophobicContact CD2-CD1 3.61Å; L115-L119 HydrophobicContact CD2-CG 4.34Å; L115-L119 HydrophobicContact CG-CD1 4.28Å; L115-L119 WeakPolarHBondContact O-CG 3.31Å; L115-L119 PolarHBondContact O-N 2.81Å; L119-M121 PolarHBondContact O-N 3.38Å; L119-S122 PolarHBondContact O-N 3.18Å; L119-I123 HydrophobicContact CB-CD1 4.49Å; L119-I123 WeakPolarHBondContact O-CB 3.32Å; L119-I123 WeakPolarHBondContact O-CD1 3.41Å; L119-I123 VanDerWaalsContact O-CG1 3.22Å; L119-I123 WeakPolarHBondContact O-CG1 3.24Å; L119-I123 PolarHBondContact O-N 2.84Å
120	G	97.7	Very high	96.1	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-50.7	-177.8	0	0	0	0	0	112.7	L116 A124 F136	L116-G120 PolarHBondContact O-N 3.29Å; G120-A124 VanDerWaalsContact O-CB 3.32Å; G120-A124 WeakPolarHBondContact O-CB 3.31Å; G120-A124 PolarHBondContact O-N 2.8Å; G120-F136 CarbonylContact C-O 3.48Å; G120-F136 WeakPolarHBondContact CA-O 3.39Å
121	M	97.2	Very high	96.2	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-71.2	-39.8	177.9	-72.4	-150.4	164.6	0	0	113.6	T52 Q86 L117 L119 I123 A124 S125 Y137 T141 L199 Y202	T52-M121 HydrophobicContact CG2-CE 3.36Å; Q86-M121 VanDerWaalsContact NE2-CE 3.26Å; L117-M121 HydrophobicContact CD1-CE 4.47Å; L117-M121 HydrophobicContact CD1-CG 4.26Å; L117-M121 HydrophobicContact CD1-SD 4.44Å; L117-M121 PolarHBondContact O-N 2.91Å; L117-M121 VanDerWaalsContact O-N 3.14Å; L119-M121 PolarHBondContact O-N 3.38Å; M121-I123 PolarHBondContact O-N 2.93Å; M121-A124 WeakPolarHBondContact O-CB 3.38Å; M121-A124 PolarHBondContact O-N 3.48Å; M121-S125 PolarHBondContact O-N 3.47Å; M121-Y137 HydrophobicContact CE-CD2 4.05Å; M121-Y137 HydrophobicContact CE-CE1 4.4Å; M121-Y137 HydrophobicContact CE-CE2 3.46Å; M121-Y137 VanDerWaalsContact CE-CE2 3.46Å; M121-Y137 HydrophobicContact CG-CD2 4.34Å; M121-Y137 HydrophobicContact CG-CE2 4.48Å; M121-Y137 HydrophobicContact SD-CE2 4.13Å; M121-T141 HydrophobicContact CB-CG2 4.47Å; M121-T141 HydrophobicContact CG-CG2 3.69Å; M121-L199 HydrophobicContact CB-CD1 4.25Å; M121-L199 HydrophobicContact CG-CD1 4.38Å; M121-L199 HydrophobicContact SD-CD1 3.7Å; M121-Y202 HydrophobicContact SD-CD1 4.02Å; M121-Y202 HydrophobicContact SD-CE1 4.31Å
122	S	97.6	Very high	96.2	Very high	19 Å²	19	43.3 Å²	43.3	13%	0.133	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-42.5	-178.4	-55.5	0	0	0	0	110.8	G118 L119 S125 Y126 S203	G118-S122 WeakPolarHBondContact O-CB 3.47Å; G118-S122 PolarHBondContact O-N 2.89Å; G118-S122 PolarHBondContact O-OG 2.92Å; L119-S122 PolarHBondContact O-N 3.18Å; S122-S125 WeakPolarHBondContact O-CB 3.34Å; S122-S125 PolarHBondContact O-N 2.96Å; S122-S125 PolarHBondContact O-OG 3.38Å; S122-Y126 VanDerWaalsContact O-CD2 3.25Å; S122-Y126 WeakPolarHBondContact O-CD2 3.33Å; S122-S203 WeakPolarHBondContact OG-CB 3.48Å; S122-S203 PolarHBondContact OG-OG 3.48Å
123	I	97.8	Very high	96.4	Very high	68 Å²	68	38.4 Å²	38.4	35%	0.349	20%	0.198	S	C	.	.	H	α-helix	trans	-62.1	-45.5	172.6	-65.4	166.4	0	0	0	110.2	L119 M121 S125 Y126 L127 F136	L119-I123 HydrophobicContact CB-CD1 4.49Å; L119-I123 WeakPolarHBondContact O-CB 3.32Å; L119-I123 WeakPolarHBondContact O-CD1 3.41Å; L119-I123 VanDerWaalsContact O-CG1 3.22Å; L119-I123 WeakPolarHBondContact O-CG1 3.24Å; L119-I123 PolarHBondContact O-N 2.84Å; M121-I123 PolarHBondContact O-N 2.93Å; I123-S125 PolarHBondContact O-N 3.29Å; I123-Y126 PolarHBondContact O-N 2.93Å; I123-Y126 VanDerWaalsContact O-N 3.1Å; I123-L127 HydrophobicContact CG2-CD1 4.17Å; I123-L127 HydrophobicContact CG2-CG 4.44Å; I123-L127 WeakPolarHBondContact O-CG 3.39Å; I123-F136 HydrophobicContact CB-CD1 3.89Å; I123-F136 HydrophobicContact CB-CE1 4.23Å; I123-F136 HydrophobicContact CB-CG 4.35Å; I123-F136 HydrophobicContact CD1-CD1 4.02Å; I123-F136 HydrophobicContact CD1-CE1 3.68Å; I123-F136 HydrophobicContact CG2-CD1 3.65Å; I123-F136 HydrophobicContact CG2-CD2 4.12Å; I123-F136 HydrophobicContact CG2-CE1 3.77Å; I123-F136 HydrophobicContact CG2-CE2 4.21Å; I123-F136 HydrophobicContact CG2-CG 3.84Å; I123-F136 HydrophobicContact CG2-CZ 4.05Å
124	A	97.2	Very high	96.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-55.9	-34	177.7	0	0	0	0	0	114	G120 M121 Y126 L127 F136 Y137	G120-A124 VanDerWaalsContact O-CB 3.32Å; G120-A124 WeakPolarHBondContact O-CB 3.31Å; G120-A124 PolarHBondContact O-N 2.8Å; M121-A124 WeakPolarHBondContact O-CB 3.38Å; M121-A124 PolarHBondContact O-N 3.48Å; A124-Y126 VanDerWaalsContact C-N 3.26Å; A124-Y126 PolarHBondContact O-N 3.32Å; A124-L127 PolarHBondContact O-N 3.43Å; A124-F136 HydrophobicContact CB-CB 4.14Å; A124-Y137 HydrophobicContact CB-CD2 4.47Å
125	S	96.8	Very high	96.4	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-27.3	178.2	79.1	0	0	0	0	114.6	M121 S122 I123 R196	M121-S125 PolarHBondContact O-N 3.47Å; S122-S125 WeakPolarHBondContact O-CB 3.34Å; S122-S125 PolarHBondContact O-N 2.96Å; S122-S125 PolarHBondContact O-OG 3.38Å; I123-S125 PolarHBondContact O-N 3.29Å; S125-R196 WeakPolarHBondContact CB-O 3.44Å; S125-R196 WeakPolarHBondContact O-CB 3.49Å; S125-R196 WeakPolarHBondContact O-CD 3.11Å; S125-R196 VanDerWaalsContact O-CG 3.22Å; S125-R196 WeakPolarHBondContact O-CG 3.23Å
126	Y	96	Very high	96.5	Very high	165 Å²	165	41.5 Å²	41.5	65%	0.647	21%	0.211	S	C	*	.	H	α-helix	trans	-92.8	-12.2	179.3	-66.7	-75.2	0	0	0	113.6	S122 I123 A124 L200	S122-Y126 VanDerWaalsContact O-CD2 3.25Å; S122-Y126 WeakPolarHBondContact O-CD2 3.33Å; I123-Y126 PolarHBondContact O-N 2.93Å; I123-Y126 VanDerWaalsContact O-N 3.1Å; A124-Y126 VanDerWaalsContact C-N 3.26Å; A124-Y126 PolarHBondContact O-N 3.32Å; Y126-L200 HydrophobicContact CE2-CD1 4.13Å; Y126-L200 HydrophobicContact CE2-CD2 4.21Å; Y126-L200 VanDerWaalsContact OH-CD2 3.26Å; Y126-L200 WeakPolarHBondContact OH-CD2 3.4Å
127	L	95.3	Very high	96.5	Very high	41 Å²	41	39.7 Å²	39.7	22%	0.215	20%	0.201	C	C	.	.			trans	-76.6	146.9	-173.5	-71.4	173.5	0	0	0	112.7	I123 A124 A132 I133 F136	I123-L127 HydrophobicContact CG2-CD1 4.17Å; I123-L127 HydrophobicContact CG2-CG 4.44Å; I123-L127 WeakPolarHBondContact O-CG 3.39Å; A124-L127 PolarHBondContact O-N 3.43Å; L127-A132 HydrophobicContact CD1-CB 3.65Å; L127-A132 HydrophobicContact CD2-CB 4.08Å; L127-A132 HydrophobicContact CG-CB 4.36Å; L127-I133 HydrophobicContact CB-CD1 4.34Å; L127-I133 HydrophobicContact CB-CG1 3.67Å; L127-I133 HydrophobicContact CD1-CG1 4.47Å; L127-F136 HydrophobicContact CD1-CB 4.21Å; L127-F136 HydrophobicContact CD1-CD2 3.68Å; L127-F136 HydrophobicContact CD1-CE2 4.44Å; L127-F136 HydrophobicContact CD1-CG 4.19Å
128	T	91.2	Very high	96.4	Very high	74 Å²	74	39.7 Å²	39.7	45%	0.454	20%	0.201	S	C	.	.			trans	-123.6	10.8	179.3	63.6	0	0	0	0	112.9	K72	K72-T128 PolarHBondContact NZ-O 3.27Å
129	N	93.8	Very high	96.4	Very high	69 Å²	69	42.9 Å²	42.9	37%	0.369	22%	0.215	S	C	.	.			trans	-119.6	122.5	174	-179.9	-13.2	0	0	0	108.7	Y74 H131 A132 I133	Y74-N129 PolarHBondContact OH-OD1 2.99Å; N129-H131 VanDerWaalsContact C-N 3.31Å; N129-H131 PolarHBondContact O-N 3.2Å; N129-H131 PolarHBondContact OD1-CD2 2.92Å; N129-H131 PolarHBondContact OD1-N 3.43Å; N129-H131 VanDerWaalsContact OD1-N 3.07Å; N129-A132 HydrophobicContact CB-CB 4.29Å; N129-A132 PolarHBondContact O-N 2.97Å; N129-A132 VanDerWaalsContact O-N 3.12Å; N129-I133 PolarHBondContact O-N 3.31Å; N129-I133 VanDerWaalsContact O-N 3.1Å
130	M	94.5	Very high	96.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-37.7	-177.4	-84.6	-69.9	144.9	0	0	113.1	L63 F69 Y74 I78 L79 A132 I133 I134	L63-M130 HydrophobicContact CD2-CE 4.07Å; F69-M130 HydrophobicContact CD1-CE 3.82Å; F69-M130 HydrophobicContact CD1-CG 4.32Å; F69-M130 HydrophobicContact CD2-CE 3.51Å; F69-M130 HydrophobicContact CE1-CE 3.67Å; F69-M130 HydrophobicContact CE2-CE 3.36Å; F69-M130 HydrophobicContact CG-CE 3.77Å; F69-M130 HydrophobicContact CZ-CE 3.46Å; F69-M130 VanDerWaalsContact CZ-CE 3.46Å; Y74-M130 HydrophobicContact CD1-CB 4.22Å; Y74-M130 HydrophobicContact CD1-CG 4.32Å; Y74-M130 HydrophobicContact CD2-CB 4.35Å; Y74-M130 HydrophobicContact CD2-CG 3.74Å; Y74-M130 HydrophobicContact CE1-CB 3.95Å; Y74-M130 HydrophobicContact CE1-CG 4.38Å; Y74-M130 HydrophobicContact CE2-CB 4.07Å; Y74-M130 HydrophobicContact CE2-CG 3.79Å; Y74-M130 HydrophobicContact CG-CB 4.41Å; Y74-M130 HydrophobicContact CG-CG 4.01Å; Y74-M130 PolarHBondContact OH-N 2.75Å; I78-M130 HydrophobicContact CG2-CB 3.48Å; I78-M130 VanDerWaalsContact CG2-CB 3.48Å; I78-M130 HydrophobicContact CG2-CG 3.97Å; L79-M130 HydrophobicContact CD2-CE 3.69Å; L79-M130 HydrophobicContact CD2-CG 4.29Å; L79-M130 HydrophobicContact CD2-SD 3.98Å; M130-A132 VanDerWaalsContact C-N 3.26Å; M130-A132 PolarHBondContact O-N 3.16Å; M130-I133 HydrophobicContact CE-CD1 3.8Å; M130-I133 PolarHBondContact O-N 2.82Å; M130-I133 VanDerWaalsContact O-N 3.15Å; M130-I133 HydrophobicContact SD-CD1 4.36Å; M130-I134 VanDerWaalsContact O-CG1 3.28Å; M130-I134 WeakPolarHBondContact O-CG1 3.36Å; M130-I134 PolarHBondContact O-N 3.11Å
131	H	94.9	Very high	96.4	Very high	100 Å²	100	40.5 Å²	40.5	46%	0.463	20%	0.202	S	C	.	.	H	α-helix	trans	-63.8	-33.3	178.2	-55.3	-67.6	0	0	0	112.2	N129 I135	N129-H131 VanDerWaalsContact C-N 3.31Å; N129-H131 PolarHBondContact O-N 3.2Å; N129-H131 PolarHBondContact OD1-CD2 2.92Å; N129-H131 PolarHBondContact OD1-N 3.43Å; N129-H131 VanDerWaalsContact OD1-N 3.07Å; H131-I135 WeakPolarHBondContact O-CG1 3.42Å; H131-I135 PolarHBondContact O-N 2.69Å
132	A	96.5	Very high	96.3	Very high	21 Å²	21	40.5 Å²	40.5	17%	0.174	20%	0.202	C	C	.	.	H	α-helix	trans	-73.8	-39.3	174.8	0	0	0	0	0	111.4	L127 N129 M130 I134 I135 F136	L127-A132 HydrophobicContact CD1-CB 3.65Å; L127-A132 HydrophobicContact CD2-CB 4.08Å; L127-A132 HydrophobicContact CG-CB 4.36Å; N129-A132 HydrophobicContact CB-CB 4.29Å; N129-A132 PolarHBondContact O-N 2.97Å; N129-A132 VanDerWaalsContact O-N 3.12Å; M130-A132 VanDerWaalsContact C-N 3.26Å; M130-A132 PolarHBondContact O-N 3.16Å; A132-I134 VanDerWaalsContact C-N 3.31Å; A132-I134 PolarHBondContact O-N 3.4Å; A132-I135 PolarHBondContact O-N 2.91Å; A132-F136 WeakPolarHBondContact O-CD2 3.43Å; A132-F136 PolarHBondContact O-N 3.29Å
133	I	97.2	Very high	96.2	Very high	6 Å²	6	41 Å²	41	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-61.7	-40.3	173.3	-64.4	166.2	0	0	0	110.6	F69 P82 L127 N129 M130 I135 F136 Y137	F69-I133 HydrophobicContact CE1-CD1 4.22Å; F69-I133 HydrophobicContact CZ-CD1 3.73Å; P82-I133 HydrophobicContact CB-CG2 4.25Å; P82-I133 HydrophobicContact CG-CG2 3.83Å; L127-I133 HydrophobicContact CB-CD1 4.34Å; L127-I133 HydrophobicContact CB-CG1 3.67Å; L127-I133 HydrophobicContact CD1-CG1 4.47Å; N129-I133 PolarHBondContact O-N 3.31Å; N129-I133 VanDerWaalsContact O-N 3.1Å; M130-I133 HydrophobicContact CE-CD1 3.8Å; M130-I133 PolarHBondContact O-N 2.82Å; M130-I133 VanDerWaalsContact O-N 3.15Å; M130-I133 HydrophobicContact SD-CD1 4.36Å; I133-I135 VanDerWaalsContact C-N 3.32Å; I133-I135 PolarHBondContact O-N 3.29Å; I133-F136 PolarHBondContact O-N 2.93Å; I133-Y137 WeakPolarHBondContact O-CA 3.42Å; I133-Y137 WeakPolarHBondContact O-CB 3.35Å; I133-Y137 PolarHBondContact O-N 2.84Å
134	I	97.1	Very high	96.2	Very high	21 Å²	21	37.8 Å²	37.8	11%	0.108	19%	0.189	C	C	.	.	I	π-helix	trans	-58.9	-40.8	175.2	-73.1	165.8	0	0	0	112.1	I78 M81 P82 I85 M130 A132 G138 M139	I78-I134 HydrophobicContact CG2-CD1 4.47Å; M81-I134 HydrophobicContact CB-CD1 3.52Å; M81-I134 HydrophobicContact CB-CG1 3.72Å; M81-I134 HydrophobicContact CG-CD1 4.17Å; P82-I134 HydrophobicContact CG-CG1 3.92Å; I85-I134 HydrophobicContact CD1-CG2 3.47Å; I85-I134 VanDerWaalsContact CD1-CG2 3.47Å; M130-I134 VanDerWaalsContact O-CG1 3.28Å; M130-I134 WeakPolarHBondContact O-CG1 3.36Å; M130-I134 PolarHBondContact O-N 3.11Å; A132-I134 VanDerWaalsContact C-N 3.31Å; A132-I134 PolarHBondContact O-N 3.4Å; I134-G138 CarbonylContact O-C 3.59Å; I134-G138 WeakPolarHBondContact O-CA 3.2Å; I134-G138 PolarHBondContact O-N 3.25Å; I134-M139 PolarHBondContact O-N 2.94Å; I134-M139 VanDerWaalsContact O-N 3.09Å
135	I	97.6	Very high	96.1	Very high	79 Å²	79	37.8 Å²	37.8	41%	0.405	19%	0.189	S	C	.	.	I	π-helix	trans	-70.1	-52	177	-65.8	163.3	0	0	0	110.7	H131 A132 I133 M139 I140	H131-I135 WeakPolarHBondContact O-CG1 3.42Å; H131-I135 PolarHBondContact O-N 2.69Å; A132-I135 PolarHBondContact O-N 2.91Å; I133-I135 VanDerWaalsContact C-N 3.32Å; I133-I135 PolarHBondContact O-N 3.29Å; I135-M139 HydrophobicContact CB-SD 4.47Å; I135-M139 HydrophobicContact CG1-SD 4.03Å; I135-M139 PolarHBondContact O-N 3.43Å; I135-I140 HydrophobicContact CG2-CD1 4.18Å; I135-I140 WeakPolarHBondContact O-CG1 3.49Å; I135-I140 PolarHBondContact O-N 3.37Å
136	F	97.8	Very high	96	Very high	61 Å²	61	37.7 Å²	37.7	27%	0.268	19%	0.189	S	C	.	.	I	π-helix	trans	-77.1	-46.2	-171.9	-81.1	-81	0	0	0	113.8	G120 I123 A124 L127 A132 I133 I140 T141	G120-F136 CarbonylContact C-O 3.48Å; G120-F136 WeakPolarHBondContact CA-O 3.39Å; I123-F136 HydrophobicContact CB-CD1 3.89Å; I123-F136 HydrophobicContact CB-CE1 4.23Å; I123-F136 HydrophobicContact CB-CG 4.35Å; I123-F136 HydrophobicContact CD1-CD1 4.02Å; I123-F136 HydrophobicContact CD1-CE1 3.68Å; I123-F136 HydrophobicContact CG2-CD1 3.65Å; I123-F136 HydrophobicContact CG2-CD2 4.12Å; I123-F136 HydrophobicContact CG2-CE1 3.77Å; I123-F136 HydrophobicContact CG2-CE2 4.21Å; I123-F136 HydrophobicContact CG2-CG 3.84Å; I123-F136 HydrophobicContact CG2-CZ 4.05Å; A124-F136 HydrophobicContact CB-CB 4.14Å; L127-F136 HydrophobicContact CD1-CB 4.21Å; L127-F136 HydrophobicContact CD1-CD2 3.68Å; L127-F136 HydrophobicContact CD1-CE2 4.44Å; L127-F136 HydrophobicContact CD1-CG 4.19Å; A132-F136 WeakPolarHBondContact O-CD2 3.43Å; A132-F136 PolarHBondContact O-N 3.29Å; I133-F136 PolarHBondContact O-N 2.93Å; F136-I140 HydrophobicContact CD1-CD1 3.75Å; F136-I140 HydrophobicContact CE1-CD1 3.9Å; F136-I140 HydrophobicContact CG-CD1 4.31Å; F136-T141 WeakPolarHBondContact O-CG2 3.31Å
137	Y	97.4	Very high	95.9	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.016	16%	0.16	C	C	.	.	I	π-helix	trans	-76.8	-50.7	174.3	-170.3	-79.9	0	0	0	110.7	F56 L59 P82 M121 A124 I133 T141 L199	F56-Y137 AromaticContact CD2-CE1 3.7Å; F56-Y137 HydrophobicContact CD2-CE1 3.7Å; F56-Y137 AromaticContact CD2-CZ 3.79Å; F56-Y137 HydrophobicContact CE2-CE1 4.09Å; L59-Y137 HydrophobicContact CD1-CE2 4.2Å; P82-Y137 HydrophobicContact CB-CD1 3.68Å; P82-Y137 HydrophobicContact CB-CE1 4.39Å; P82-Y137 HydrophobicContact CB-CG 4.22Å; M121-Y137 HydrophobicContact CE-CD2 4.05Å; M121-Y137 HydrophobicContact CE-CE1 4.4Å; M121-Y137 HydrophobicContact CE-CE2 3.46Å; M121-Y137 VanDerWaalsContact CE-CE2 3.46Å; M121-Y137 HydrophobicContact CG-CD2 4.34Å; M121-Y137 HydrophobicContact CG-CE2 4.48Å; M121-Y137 HydrophobicContact SD-CE2 4.13Å; A124-Y137 HydrophobicContact CB-CD2 4.47Å; I133-Y137 WeakPolarHBondContact O-CA 3.42Å; I133-Y137 WeakPolarHBondContact O-CB 3.35Å; I133-Y137 PolarHBondContact O-N 2.84Å; Y137-T141 PolarHBondContact O-OG1 3.06Å; Y137-L199 HydrophobicContact CD2-CD1 4.2Å; Y137-L199 HydrophobicContact CD2-CD2 4.16Å; Y137-L199 HydrophobicContact CE2-CD1 3.73Å; Y137-L199 HydrophobicContact CE2-CD2 4.3Å
138	G	96.6	Very high	95.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	I	π-helix	trans	-69	-79.5	-176.2	0	0	0	0	0	113.1	Q86 I134 G142	Q86-G138 WeakPolarHBondContact CA-O 3.48Å; I134-G138 CarbonylContact O-C 3.59Å; I134-G138 WeakPolarHBondContact O-CA 3.2Å; I134-G138 PolarHBondContact O-N 3.25Å; G138-G142 WeakPolarHBondContact O-CA 3.25Å; G138-G142 PolarHBondContact O-N 3.38Å
139	M	96.6	Very high	95.8	Very high	73 Å²	73	26.4 Å²	26.4	36%	0.36	14%	0.136	S	C	.	.	I	π-helix	trans	-65	-47.9	-168.3	-57.7	169.7	64.8	0	0	112.8	I85 F89 I134 I135 S143	I85-M139 HydrophobicContact CG2-CG 3.82Å; F89-M139 HydrophobicContact CD1-CB 4.33Å; F89-M139 HydrophobicContact CD2-CB 4.43Å; F89-M139 HydrophobicContact CD2-CG 4.23Å; F89-M139 HydrophobicContact CE1-CB 4.21Å; F89-M139 HydrophobicContact CE1-CE 4.21Å; F89-M139 HydrophobicContact CE1-CG 4.38Å; F89-M139 HydrophobicContact CE2-CB 4.32Å; F89-M139 HydrophobicContact CE2-CG 3.79Å; F89-M139 HydrophobicContact CG-CB 4.44Å; F89-M139 HydrophobicContact CZ-CB 4.21Å; F89-M139 HydrophobicContact CZ-CE 3.78Å; F89-M139 HydrophobicContact CZ-CG 3.88Å; I134-M139 PolarHBondContact O-N 2.94Å; I134-M139 VanDerWaalsContact O-N 3.09Å; I135-M139 HydrophobicContact CB-SD 4.47Å; I135-M139 HydrophobicContact CG1-SD 4.03Å; I135-M139 PolarHBondContact O-N 3.43Å; M139-S143 WeakPolarHBondContact O-CB 3.14Å; M139-S143 PolarHBondContact O-N 3.32Å; M139-S143 PolarHBondContact O-OG 3.28Å
140	I	97.1	Very high	95.6	Very high	48 Å²	48	24.1 Å²	24.1	25%	0.246	12%	0.124	C	C	.	.	I	π-helix	trans	-69.2	-49.3	-173.8	-70.3	175.2	0	0	0	111.2	L116 I135 F136 S143 A144	L116-I140 HydrophobicContact CD2-CG2 3.99Å; I135-I140 HydrophobicContact CG2-CD1 4.18Å; I135-I140 WeakPolarHBondContact O-CG1 3.49Å; I135-I140 PolarHBondContact O-N 3.37Å; F136-I140 HydrophobicContact CD1-CD1 3.75Å; F136-I140 HydrophobicContact CE1-CD1 3.9Å; F136-I140 HydrophobicContact CG-CD1 4.31Å; I140-S143 PolarHBondContact O-N 3.14Å; I140-A144 PolarHBondContact O-N 2.94Å
141	T	97.4	Very high	95.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-78.9	-26.1	-179.4	80.7	0	0	0	0	113.2	Q86 L117 M121 F136 Y137 S143 A144 F145	Q86-T141 PolarHBondContact NE2-OG1 2.92Å; L117-T141 HydrophobicContact CD1-CG2 4.29Å; M121-T141 HydrophobicContact CB-CG2 4.47Å; M121-T141 HydrophobicContact CG-CG2 3.69Å; F136-T141 WeakPolarHBondContact O-CG2 3.31Å; Y137-T141 PolarHBondContact O-OG1 3.06Å; T141-S143 VanDerWaalsContact C-N 3.35Å; T141-A144 WeakPolarHBondContact O-CB 3.49Å; T141-A144 PolarHBondContact O-N 3.1Å; T141-F145 WeakPolarHBondContact O-CD2 3.4Å; T141-F145 WeakPolarHBondContact O-CG 3.16Å; T141-F145 PolarHBondContact O-N 2.85Å
142	G	96.5	Very high	95.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.6	-47.8	166.7	0	0	0	0	0	111.3	Q86 F90 G138 A144 F145 G146	Q86-G142 WeakPolarHBondContact O-CA 3.44Å; F90-G142 WeakPolarHBondContact CA-O 3.47Å; F90-G142 PolarHBondContact N-O 2.93Å; G138-G142 WeakPolarHBondContact O-CA 3.25Å; G138-G142 PolarHBondContact O-N 3.38Å; G142-A144 VanDerWaalsContact C-N 3.31Å; G142-A144 PolarHBondContact O-N 2.85Å; G142-F145 PolarHBondContact O-N 2.99Å; G142-G146 PolarHBondContact O-N 3.27Å
143	S	95.6	Very high	94.4	Very high	30 Å²	30	21 Å²	21	21%	0.21	11%	0.108	C	C	.	.	H	α-helix	trans	-60.2	-41.4	173.9	-53.9	0	0	0	0	112	T93 M139 I140 T141 F145 G146 I147	T93-S143 WeakPolarHBondContact CG2-O 3.14Å; M139-S143 WeakPolarHBondContact O-CB 3.14Å; M139-S143 PolarHBondContact O-N 3.32Å; M139-S143 PolarHBondContact O-OG 3.28Å; I140-S143 PolarHBondContact O-N 3.14Å; T141-S143 VanDerWaalsContact C-N 3.35Å; S143-F145 PolarHBondContact O-N 3.1Å; S143-G146 PolarHBondContact O-N 3.29Å; S143-I147 WeakPolarHBondContact O-CG1 3.41Å; S143-I147 PolarHBondContact O-N 3.08Å; S143-I147 VanDerWaalsContact O-N 3.09Å
144	A	96.7	Very high	93.7	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.5	-44.4	176.1	0	0	0	0	0	112.9	G113 L116 L117 I140 T141 G142 I147 L148	G113-A144 WeakPolarHBondContact O-CB 3.34Å; L116-A144 HydrophobicContact CB-CB 3.71Å; L117-A144 HydrophobicContact CB-CB 4Å; I140-A144 PolarHBondContact O-N 2.94Å; T141-A144 WeakPolarHBondContact O-CB 3.49Å; T141-A144 PolarHBondContact O-N 3.1Å; G142-A144 VanDerWaalsContact C-N 3.31Å; G142-A144 PolarHBondContact O-N 2.85Å; A144-I147 PolarHBondContact O-N 3.47Å; A144-L148 WeakPolarHBondContact O-CG 3.12Å; A144-L148 PolarHBondContact O-N 3.02Å
145	F	96	Very high	93.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.3	-37.7	174.3	-68.7	-32.6	0	0	0	112.3	I48 I49 T52 F53 Q86 F90 L117 T141 G142 S143 I147 L148 M149	I48-F145 HydrophobicContact CG2-CE1 4.15Å; I49-F145 HydrophobicContact CB-CD1 4.31Å; I49-F145 HydrophobicContact CB-CG 4.43Å; I49-F145 HydrophobicContact CG1-CB 4.04Å; I49-F145 HydrophobicContact CG1-CD1 3.57Å; I49-F145 HydrophobicContact CG1-CE1 4.19Å; I49-F145 HydrophobicContact CG1-CG 3.94Å; I49-F145 HydrophobicContact CG2-CB 4.19Å; I49-F145 HydrophobicContact CG2-CG 4.24Å; T52-F145 HydrophobicContact CG2-CE2 3.72Å; T52-F145 HydrophobicContact CG2-CZ 3.79Å; T52-F145 WeakPolarHBondContact OG1-CZ 3.22Å; F53-F145 AromaticContact CE1-CD2 3.74Å; F53-F145 HydrophobicContact CE1-CD2 3.74Å; F53-F145 AromaticContact CE1-CE2 3.94Å; F53-F145 HydrophobicContact CE1-CE2 3.94Å; F53-F145 AromaticContact CZ-CD2 3.99Å; F53-F145 HydrophobicContact CZ-CD2 3.99Å; Q86-F145 HydrophobicContact CG-CD2 4.22Å; Q86-F145 HydrophobicContact CG-CE2 4.14Å; F90-F145 HydrophobicContact CB-CB 4.16Å; F90-F145 HydrophobicContact CD2-CB 3.84Å; F90-F145 HydrophobicContact CG-CB 4.39Å; L117-F145 HydrophobicContact CD1-CD1 4.2Å; L117-F145 HydrophobicContact CD1-CE1 3.37Å; L117-F145 HydrophobicContact CD1-CZ 3.57Å; L117-F145 HydrophobicContact CD2-CD1 4.33Å; L117-F145 HydrophobicContact CD2-CE1 3.67Å; L117-F145 HydrophobicContact CG-CE1 4.11Å; T141-F145 WeakPolarHBondContact O-CD2 3.4Å; T141-F145 WeakPolarHBondContact O-CG 3.16Å; T141-F145 PolarHBondContact O-N 2.85Å; G142-F145 PolarHBondContact O-N 2.99Å; S143-F145 PolarHBondContact O-N 3.1Å; F145-I147 VanDerWaalsContact C-N 3.31Å; F145-I147 PolarHBondContact O-N 3.43Å; F145-L148 HydrophobicContact CD1-CD1 4.34Å; F145-L148 PolarHBondContact O-N 3.34Å; F145-M149 WeakPolarHBondContact O-CB 3.38Å; F145-M149 PolarHBondContact O-N 3.01Å
146	G	93.7	Very high	92.5	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-58.3	-42.2	173.4	0	0	0	0	0	112.4	F90 G142 S143 V150	F90-G146 WeakPolarHBondContact O-CA 3.36Å; G142-G146 PolarHBondContact O-N 3.27Å; S143-G146 PolarHBondContact O-N 3.29Å; G146-V150 PolarHBondContact O-N 3.23Å
147	I	93.8	Very high	91.6	Very high	10 Å²	10	17.9 Å²	17.9	5%	0.051	10%	0.097	C	C	.	.	H	α-helix	trans	-63.7	-52.2	174.6	-61.8	160.1	0	0	0	111	T93 V97 S109 F112 L116 S143 A144 F145 M149 C151	T93-I147 HydrophobicContact CG2-CG1 4.25Å; V97-I147 HydrophobicContact CG2-CB 4.27Å; V97-I147 HydrophobicContact CG2-CG1 3.69Å; S109-I147 WeakPolarHBondContact O-CG2 3.44Å; F112-I147 HydrophobicContact CD1-CD1 4.12Å; F112-I147 HydrophobicContact CE1-CD1 4.16Å; L116-I147 HydrophobicContact CD1-CD1 3.98Å; S143-I147 WeakPolarHBondContact O-CG1 3.41Å; S143-I147 PolarHBondContact O-N 3.08Å; S143-I147 VanDerWaalsContact O-N 3.09Å; A144-I147 PolarHBondContact O-N 3.47Å; F145-I147 VanDerWaalsContact C-N 3.31Å; F145-I147 PolarHBondContact O-N 3.43Å; I147-M149 VanDerWaalsContact C-N 3.31Å; I147-M149 PolarHBondContact O-N 3.36Å; I147-C151 PolarHBondContact O-N 3.07Å
148	L	94.7	Very high	90.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.9	-38.9	-179	-75.5	167	0	0	0	112.7	I45 I49 G110 A114 L117 A144 F145 C151 A152 T210	I45-L148 HydrophobicContact CG2-CB 3.85Å; I49-L148 HydrophobicContact CD1-CB 4.27Å; G110-L148 WeakPolarHBondContact O-CD2 3.46Å; A114-L148 HydrophobicContact CB-CD2 4.36Å; L117-L148 HydrophobicContact CD2-CD1 4.12Å; A144-L148 WeakPolarHBondContact O-CG 3.12Å; A144-L148 PolarHBondContact O-N 3.02Å; F145-L148 HydrophobicContact CD1-CD1 4.34Å; F145-L148 PolarHBondContact O-N 3.34Å; L148-C151 PolarHBondContact O-N 3.33Å; L148-A152 WeakPolarHBondContact O-CB 3.12Å; L148-A152 PolarHBondContact O-N 2.92Å; L148-T210 HydrophobicContact CD1-CG2 4.2Å
149	M	91.4	Very high	90.1	Very high	33 Å²	33	24.5 Å²	24.5	16%	0.163	12%	0.123	C	C	.	.	H	α-helix	trans	-63.2	-48.7	-178.5	-176.2	61.7	161.1	0	0	112.9	Q46 I49 F90 F145 I147 C151 A152 I153	Q46-M149 PolarHBondContact NE2-SD 3.44Å; Q46-M149 VanDerWaalsContact NE2-SD 3.43Å; Q46-M149 PolarHBondContact OE1-SD 2.96Å; I49-M149 HydrophobicContact CD1-CB 4.07Å; I49-M149 HydrophobicContact CD1-SD 4.25Å; F90-M149 HydrophobicContact CD2-CB 4.32Å; F90-M149 HydrophobicContact CE2-CB 3.76Å; F90-M149 HydrophobicContact CE2-CE 4.29Å; F90-M149 HydrophobicContact CE2-CG 3.63Å; F90-M149 HydrophobicContact CE2-SD 4.06Å; F90-M149 HydrophobicContact CZ-CE 4.03Å; F90-M149 HydrophobicContact CZ-CG 4.24Å; F90-M149 HydrophobicContact CZ-SD 4.39Å; F145-M149 WeakPolarHBondContact O-CB 3.38Å; F145-M149 PolarHBondContact O-N 3.01Å; I147-M149 VanDerWaalsContact C-N 3.31Å; I147-M149 PolarHBondContact O-N 3.36Å; M149-C151 VanDerWaalsContact C-N 3.32Å; M149-A152 PolarHBondContact O-N 3.36Å; M149-I153 HydrophobicContact CE-CD1 3.43Å; M149-I153 VanDerWaalsContact CE-CD1 3.43Å; M149-I153 HydrophobicContact CE-CG1 4.42Å; M149-I153 HydrophobicContact CG-CD1 4.35Å; M149-I153 PolarHBondContact O-N 3.48Å; M149-I153 HydrophobicContact SD-CD1 3.86Å; M149-I153 HydrophobicContact SD-CG1 4.29Å
150	V	88.4	Confident	89.3	Confident	20 Å²	20	21 Å²	21	12%	0.121	11%	0.106	C	C	.	.	H	α-helix	trans	-67.7	-37.7	178.9	-175	0	0	0	0	109.9	V97 I101 G146 A152 V154	V97-V150 HydrophobicContact CB-CB 4.34Å; V97-V150 HydrophobicContact CB-CG2 4.13Å; V97-V150 HydrophobicContact CG1-CB 3.74Å; V97-V150 HydrophobicContact CG1-CG1 4.14Å; V97-V150 HydrophobicContact CG1-CG2 4.08Å; I101-V150 HydrophobicContact CD1-CB 4Å; I101-V150 HydrophobicContact CD1-CG1 3.63Å; G146-V150 PolarHBondContact O-N 3.23Å; V150-A152 PolarHBondContact O-N 3.1Å; V150-V154 HydrophobicContact CG1-CG2 3.72Å; V150-V154 VanDerWaalsContact O-CB 3.24Å; V150-V154 WeakPolarHBondContact O-CB 3.4Å; V150-V154 VanDerWaalsContact O-CG2 3.3Å; V150-V154 WeakPolarHBondContact O-CG2 3.43Å; V150-V154 PolarHBondContact O-N 3.5Å
151	C	89.4	Confident	88.3	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.3	-43.1	171.8	-76.2	0	0	0	0	113	F106 I147 L148 M149 S155 L217	F106-C151 PolarHBondContact O-SG 3.16Å; I147-C151 PolarHBondContact O-N 3.07Å; L148-C151 PolarHBondContact O-N 3.33Å; M149-C151 VanDerWaalsContact C-N 3.32Å; C151-S155 WeakPolarHBondContact O-CB 3.44Å; C151-S155 PolarHBondContact O-N 3.02Å; C151-S155 PolarHBondContact O-OG 3.2Å; C151-L217 HydrophobicContact CB-CD1 4.05Å
152	A	89.3	Confident	87.3	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-66.5	-60.3	178.4	0	0	0	0	0	112.2	S42 I45 L148 M149 V150 V154 S155 V156	S42-A152 PolarHBondContact OG-O 2.81Å; I45-A152 HydrophobicContact CB-CB 4.16Å; I45-A152 HydrophobicContact CD1-CB 4.32Å; I45-A152 HydrophobicContact CG2-CB 3.86Å; L148-A152 WeakPolarHBondContact O-CB 3.12Å; L148-A152 PolarHBondContact O-N 2.92Å; M149-A152 PolarHBondContact O-N 3.36Å; V150-A152 PolarHBondContact O-N 3.1Å; A152-V154 PolarHBondContact O-N 3.03Å; A152-S155 PolarHBondContact O-OG 3.18Å; A152-S155 VanDerWaalsContact O-OG 3.09Å; A152-V156 PolarHBondContact O-N 2.9Å
153	I	82.4	Confident	86.4	Confident	55 Å²	55	36.9 Å²	36.9	28%	0.282	17%	0.17	S	C	.	.	H	α-helix	trans	-62.3	-48.3	-174.4	-70	179.3	0	0	0	111.8	M149 S155 N157	M149-I153 HydrophobicContact CE-CD1 3.43Å; M149-I153 VanDerWaalsContact CE-CD1 3.43Å; M149-I153 HydrophobicContact CE-CG1 4.42Å; M149-I153 HydrophobicContact CG-CD1 4.35Å; M149-I153 PolarHBondContact O-N 3.48Å; M149-I153 HydrophobicContact SD-CD1 3.86Å; M149-I153 HydrophobicContact SD-CG1 4.29Å; I153-S155 PolarHBondContact O-N 3.27Å; I153-N157 PolarHBondContact O-N 3.36Å; I153-N157 PolarHBondContact O-ND2 3.24Å
154	V	81.9	Confident	85.4	Confident	49 Å²	49	40.1 Å²	40.1	30%	0.297	18%	0.177	S	C	.	.	H	α-helix	trans	-69.9	-38.1	-172.9	-179.4	0	0	0	0	110.5	F106 V150 A152 V156 N157 Y158	F106-V154 HydrophobicContact CE1-CB 3.86Å; F106-V154 HydrophobicContact CE1-CG1 3.73Å; F106-V154 HydrophobicContact CZ-CB 4.31Å; F106-V154 HydrophobicContact CZ-CG1 3.68Å; V150-V154 HydrophobicContact CG1-CG2 3.72Å; V150-V154 VanDerWaalsContact O-CB 3.24Å; V150-V154 WeakPolarHBondContact O-CB 3.4Å; V150-V154 VanDerWaalsContact O-CG2 3.3Å; V150-V154 WeakPolarHBondContact O-CG2 3.43Å; V150-V154 PolarHBondContact O-N 3.5Å; A152-V154 PolarHBondContact O-N 3.03Å; V154-V156 PolarHBondContact O-N 3.46Å; V154-N157 PolarHBondContact O-N 3Å; V154-Y158 HydrophobicContact CG1-CD2 3.95Å; V154-Y158 HydrophobicContact CG1-CE2 3.71Å; V154-Y158 WeakPolarHBondContact O-CD2 3.33Å; V154-Y158 PolarHBondContact O-N 3.28Å
155	S	84.9	Confident	84.2	Confident	3 Å²	3	43 Å²	43	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-42.5	178.7	67	0	0	0	0	112.7	I38 C151 A152 I153 N157 Y158 Y159	I38-S155 WeakPolarHBondContact CG2-OG 3.23Å; C151-S155 WeakPolarHBondContact O-CB 3.44Å; C151-S155 PolarHBondContact O-N 3.02Å; C151-S155 PolarHBondContact O-OG 3.2Å; A152-S155 PolarHBondContact O-OG 3.18Å; A152-S155 VanDerWaalsContact O-OG 3.09Å; I153-S155 PolarHBondContact O-N 3.27Å; S155-N157 VanDerWaalsContact C-N 3.25Å; S155-N157 PolarHBondContact O-N 3.25Å; S155-Y158 PolarHBondContact O-N 3.29Å; S155-Y158 VanDerWaalsContact O-N 3.12Å; S155-Y159 VanDerWaalsContact O-CD2 3.31Å; S155-Y159 WeakPolarHBondContact O-CD2 3.12Å
156	V	85.4	Confident	83.3	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-55.9	-41.6	176.1	173.7	0	0	0	0	111.6	I38 V39 S42 A152 V154 Y158 Y159 F160 A167 A171	I38-V156 HydrophobicContact CG2-CG2 4.05Å; V39-V156 HydrophobicContact CG2-CG1 4Å; V39-V156 HydrophobicContact CG2-CG2 4.34Å; S42-V156 VanDerWaalsContact OG-CG2 3.28Å; S42-V156 WeakPolarHBondContact OG-CG2 3.05Å; A152-V156 PolarHBondContact O-N 2.9Å; V154-V156 PolarHBondContact O-N 3.46Å; V156-Y158 VanDerWaalsContact C-N 3.31Å; V156-Y158 PolarHBondContact O-N 3.41Å; V156-Y159 PolarHBondContact O-N 3.11Å; V156-F160 HydrophobicContact CG1-CD2 4.39Å; V156-A167 HydrophobicContact CG1-CB 3.78Å; V156-A171 HydrophobicContact CG2-CB 4.06Å
157	N	78.4	Confident	82.7	Confident	48 Å²	48	47.8 Å²	47.8	26%	0.257	23%	0.233	S	C	.	.	H	α-helix	trans	-67.1	-28.6	-178.4	-76.8	-86.9	0	0	0	113.2	I153 V154 S155 R164	I153-N157 PolarHBondContact O-N 3.36Å; I153-N157 PolarHBondContact O-ND2 3.24Å; V154-N157 PolarHBondContact O-N 3Å; S155-N157 VanDerWaalsContact C-N 3.25Å; S155-N157 PolarHBondContact O-N 3.25Å; N157-R164 PolarHBondContact O-NE 2.95Å; N157-R164 PolarHBondContact O-NH2 3.4Å; N157-R164 WeakPolarHBondContact OD1-CD 3.38Å; N157-R164 WeakPolarHBondContact OD1-CG 3.24Å
158	Y	80.7	Confident	82.1	Confident	127 Å²	127	48.4 Å²	48.4	50%	0.498	24%	0.238	S	C	.	.	H	α-helix	trans	-74.2	-17.9	174.8	-88.6	-76.3	0	0	0	114.8	F106 V154 S155 V156 F220	F106-Y158 HydrophobicContact CE2-CD2 4.21Å; F106-Y158 HydrophobicContact CE2-CE2 4.3Å; F106-Y158 HydrophobicContact CZ-CD2 4Å; F106-Y158 AromaticContact CZ-CE2 3.92Å; F106-Y158 HydrophobicContact CZ-CE2 3.92Å; V154-Y158 HydrophobicContact CG1-CD2 3.95Å; V154-Y158 HydrophobicContact CG1-CE2 3.71Å; V154-Y158 WeakPolarHBondContact O-CD2 3.33Å; V154-Y158 PolarHBondContact O-N 3.28Å; S155-Y158 PolarHBondContact O-N 3.29Å; S155-Y158 VanDerWaalsContact O-N 3.12Å; V156-Y158 VanDerWaalsContact C-N 3.31Å; V156-Y158 PolarHBondContact O-N 3.41Å; Y158-F220 AromaticContact CE1-CE2 3.96Å; Y158-F220 HydrophobicContact CE1-CE2 3.96Å; Y158-F220 HydrophobicContact CE2-CE2 4.44Å; Y158-F220 AromaticContact CZ-CE2 3.81Å
159	Y	82.2	Confident	81.2	Confident	17 Å²	17	50.5 Å²	50.5	7%	0.067	26%	0.259	C	S	.	.	H	α-helix	trans	-99.6	-18.3	-176.3	-82.5	-102.3	0	0	0	114.5	T30 D31 W34 I38 S155 V156 K218	T30-Y159 CarbonylContact C-O 3.58Å; T30-Y159 WeakPolarHBondContact CA-O 3.46Å; D31-Y159 PolarHBondContact N-O 3.25Å; W34-Y159 HydrophobicContact CB-CE1 4.49Å; W34-Y159 AromaticContact CD1-CE1 3.44Å; W34-Y159 VanDerWaalsContact CD1-CE1 3.44Å; W34-Y159 AromaticContact CD1-CZ 3.94Å; W34-Y159 HydrophobicContact CG-CE1 4.29Å; I38-Y159 HydrophobicContact CD1-CE2 4.12Å; I38-Y159 HydrophobicContact CG1-CD1 4.12Å; I38-Y159 HydrophobicContact CG1-CD2 3.98Å; I38-Y159 HydrophobicContact CG1-CE1 3.97Å; I38-Y159 HydrophobicContact CG1-CE2 3.81Å; I38-Y159 HydrophobicContact CG1-CG 4.09Å; I38-Y159 HydrophobicContact CG2-CD2 4.4Å; S155-Y159 VanDerWaalsContact O-CD2 3.31Å; S155-Y159 WeakPolarHBondContact O-CD2 3.12Å; V156-Y159 PolarHBondContact O-N 3.11Å; Y159-K218 WeakPolarHBondContact OH-CB 3.39Å; Y159-K218 WeakPolarHBondContact OH-CD 3.32Å; Y159-K218 WeakPolarHBondContact OH-CG 3.3Å
160	F	79.3	Confident	80.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.27	C	S	.	.			trans	-123.4	136.7	-179	-66.8	-90.9	0	0	0	111	D31 G35 W36 V39 V156 R164 A167	D31-F160 HydrophobicContact CB-CD1 4.38Å; D31-F160 VanDerWaalsContact OD1-CA 3.25Å; D31-F160 WeakPolarHBondContact OD1-CA 3.3Å; D31-F160 WeakPolarHBondContact OD1-CB 3.49Å; D31-F160 VanDerWaalsContact OD1-CD1 3.29Å; D31-F160 WeakPolarHBondContact OD1-CD1 3.4Å; G35-F160 WeakPolarHBondContact O-CE2 3.32Å; W36-F160 HydrophobicContact CD2-CE1 4.29Å; W36-F160 AromaticContact CD2-CZ 3.96Å; W36-F160 HydrophobicContact CD2-CZ 3.96Å; W36-F160 AromaticContact CE2-CE1 3.89Å; W36-F160 HydrophobicContact CE3-CZ 4.28Å; W36-F160 HydrophobicContact CG-CZ 4.24Å; W36-F160 HydrophobicContact CZ2-CE1 4.04Å; W36-F160 HydrophobicContact CZ2-CZ 4.47Å; V39-F160 HydrophobicContact CG2-CD2 4.45Å; V39-F160 HydrophobicContact CG2-CE2 3.58Å; V39-F160 HydrophobicContact CG2-CZ 4.05Å; V156-F160 HydrophobicContact CG1-CD2 4.39Å; F160-R164 HydrophobicContact CB-CB 4.34Å; F160-R164 VanDerWaalsContact O-CZ 3.24Å; F160-R164 PolarHBondContact O-NE 3.13Å; F160-R164 PolarHBondContact O-NH2 2.96Å; F160-A167 HydrophobicContact CB-CB 4.27Å; F160-A167 HydrophobicContact CD1-CB 4.13Å; F160-A167 HydrophobicContact CD2-CB 3.48Å; F160-A167 VanDerWaalsContact CD2-CB 3.48Å; F160-A167 HydrophobicContact CE1-CB 4.31Å; F160-A167 HydrophobicContact CE2-CB 3.7Å; F160-A167 HydrophobicContact CG-CB 3.7Å; F160-A167 HydrophobicContact CZ-CB 4.1Å
161	D	75.9	Confident	80.8	Confident	84 Å²	84	51.8 Å²	51.8	45%	0.449	27%	0.266	S	S	.	.	S	Bend	trans	-111.5	-60.8	169.1	-72.9	-48	0	0	0	109.1	T30 D31 Y163 R164	T30-D161 WeakPolarHBondContact CB-OD2 3.45Å; T30-D161 VanDerWaalsContact CG2-OD2 3.28Å; T30-D161 WeakPolarHBondContact CG2-OD2 3.42Å; T30-D161 PolarHBondContact OG1-OD2 3.08Å; D31-D161 PolarHBondContact OD1-N 2.83Å; D161-Y163 VanDerWaalsContact C-N 3.34Å; D161-Y163 PolarHBondContact O-N 2.94Å; D161-R164 IonicContact OD1-CZ 3.95Å; D161-R164 IonicContact OD1-NH1 3.95Å; D161-R164 IonicContact OD1-NH2 2.73Å; D161-R164 PolarHBondContact OD1-NH2 3.14Å
162	R	77	Confident	80.5	Confident	200 Å²	200	54.2 Å²	54.2	76%	0.755	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-34.1	-176.6	-170.1	177.1	-177.3	-179.1	1.1	112.6	D31	D31-R162 PolarHBondContact OD1-N 2.66Å; D31-R162 WeakPolarHBondContact OD2-CB 3.17Å; D31-R162 PolarHBondContact OD2-N 3.23Å
163	Y	77.7	Confident	80.2	Confident	97 Å²	97	55.5 Å²	55.5	38%	0.38	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	14.9	-176.1	-54.9	-77.3	0	0	0	114	D31 D161 G165 L166 A167	D31-Y163 HydrophobicContact CB-CD2 4.05Å; D31-Y163 HydrophobicContact CB-CE2 4.42Å; D31-Y163 PolarHBondContact OD1-N 3.49Å; D161-Y163 VanDerWaalsContact C-N 3.34Å; D161-Y163 PolarHBondContact O-N 2.94Å; Y163-G165 VanDerWaalsContact C-N 3.28Å; Y163-G165 PolarHBondContact O-N 3.39Å; Y163-G165 VanDerWaalsContact O-N 3.12Å; Y163-L166 PolarHBondContact O-N 2.94Å; Y163-A167 WeakPolarHBondContact O-CB 3.32Å; Y163-A167 PolarHBondContact O-N 3.33Å
164	R	75.2	Confident	80.5	Confident	97 Å²	97	52.9 Å²	52.9	37%	0.366	27%	0.274	S	S	.	.	H	α-helix	trans	-49.2	-42.2	-173.7	-175.2	172.7	-76.4	153.7	5.3	114.2	N157 F160 D161 S168	N157-R164 PolarHBondContact O-NE 2.95Å; N157-R164 PolarHBondContact O-NH2 3.4Å; N157-R164 WeakPolarHBondContact OD1-CD 3.38Å; N157-R164 WeakPolarHBondContact OD1-CG 3.24Å; F160-R164 HydrophobicContact CB-CB 4.34Å; F160-R164 VanDerWaalsContact O-CZ 3.24Å; F160-R164 PolarHBondContact O-NE 3.13Å; F160-R164 PolarHBondContact O-NH2 2.96Å; D161-R164 IonicContact OD1-CZ 3.95Å; D161-R164 IonicContact OD1-NH1 3.95Å; D161-R164 IonicContact OD1-NH2 2.73Å; D161-R164 PolarHBondContact OD1-NH2 3.14Å; R164-S168 VanDerWaalsContact O-CB 3.28Å; R164-S168 WeakPolarHBondContact O-CB 3.49Å; R164-S168 PolarHBondContact O-N 3.45Å; R164-S168 PolarHBondContact O-OG 2.92Å
165	G	70	Confident	80.8	Confident	62 Å²	62	50.5 Å²	50.5	64%	0.639	26%	0.26	S	S	*	.	H	α-helix	trans	-67.3	-44.4	177.6	0	0	0	0	0	113.8	Y163 G169	Y163-G165 VanDerWaalsContact C-N 3.28Å; Y163-G165 PolarHBondContact O-N 3.39Å; Y163-G165 VanDerWaalsContact O-N 3.12Å; G165-G169 PolarHBondContact O-N 2.83Å
166	L	76.7	Confident	80.8	Confident	100 Å²	100	50.5 Å²	50.5	52%	0.524	26%	0.26	S	S	.	.	H	α-helix	trans	-67.2	-44.9	177.6	178.2	63.4	0	0	0	111.2	W36 Y163 S168 G169 L170	W36-L166 HydrophobicContact CH2-CD2 4.5Å; Y163-L166 PolarHBondContact O-N 2.94Å; L166-S168 PolarHBondContact O-N 3.01Å; L166-G169 PolarHBondContact O-N 3.45Å; L166-L170 HydrophobicContact CD1-CD1 4.06Å; L166-L170 HydrophobicContact CD1-CG 4.27Å; L166-L170 HydrophobicContact CG-CD1 4Å; L166-L170 WeakPolarHBondContact O-CB 3.21Å; L166-L170 WeakPolarHBondContact O-CG 3.39Å; L166-L170 PolarHBondContact O-N 3.08Å
167	A	82.6	Confident	81	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-44.1	177.1	0	0	0	0	0	111.8	V39 V156 F160 Y163 A171	V39-A167 HydrophobicContact CG2-CB 3.75Å; V156-A167 HydrophobicContact CG1-CB 3.78Å; F160-A167 HydrophobicContact CB-CB 4.27Å; F160-A167 HydrophobicContact CD1-CB 4.13Å; F160-A167 HydrophobicContact CD2-CB 3.48Å; F160-A167 VanDerWaalsContact CD2-CB 3.48Å; F160-A167 HydrophobicContact CE1-CB 4.31Å; F160-A167 HydrophobicContact CE2-CB 3.7Å; F160-A167 HydrophobicContact CG-CB 3.7Å; F160-A167 HydrophobicContact CZ-CB 4.1Å; Y163-A167 WeakPolarHBondContact O-CB 3.32Å; Y163-A167 PolarHBondContact O-N 3.33Å; A167-A171 WeakPolarHBondContact O-CB 3.22Å; A167-A171 PolarHBondContact O-N 3.47Å
168	S	79.8	Confident	81.7	Confident	23 Å²	23	50.6 Å²	50.6	16%	0.161	26%	0.262	C	S	.	.	H	α-helix	trans	-67.1	-43.7	176.3	-58.4	0	0	0	0	112.1	R164 L166 L170 A171 M172	R164-S168 VanDerWaalsContact O-CB 3.28Å; R164-S168 WeakPolarHBondContact O-CB 3.49Å; R164-S168 PolarHBondContact O-N 3.45Å; R164-S168 PolarHBondContact O-OG 2.92Å; L166-S168 PolarHBondContact O-N 3.01Å; S168-L170 PolarHBondContact O-N 3.13Å; S168-A171 PolarHBondContact O-N 3.24Å; S168-M172 WeakPolarHBondContact O-CB 3.47Å; S168-M172 VanDerWaalsContact O-CG 3.32Å; S168-M172 WeakPolarHBondContact O-CG 3.28Å; S168-M172 PolarHBondContact O-N 3.44Å
169	G	76.2	Confident	82.1	Confident	44 Å²	44	44.6 Å²	44.6	45%	0.454	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-41.8	176.8	0	0	0	0	0	112.8	G165 L166 M172 S173	G165-G169 PolarHBondContact O-N 2.83Å; L166-G169 PolarHBondContact O-N 3.45Å; G169-M172 PolarHBondContact O-N 3.4Å; G169-S173 PolarHBondContact O-N 3.01Å
170	L	84.8	Confident	82.6	Confident	73 Å²	73	45.8 Å²	45.8	38%	0.382	25%	0.246	S	C	.	.	H	α-helix	trans	-63.7	-48.2	173.8	-75	168.3	0	0	0	111.4	W36 V39 F43 L166 S168 M172 S173	W36-L170 HydrophobicContact CH2-CD1 4.44Å; W36-L170 HydrophobicContact CZ3-CD1 3.8Å; V39-L170 HydrophobicContact CG1-CB 3.91Å; F43-L170 WeakPolarHBondContact CD2-O 3.39Å; L166-L170 HydrophobicContact CD1-CD1 4.06Å; L166-L170 HydrophobicContact CD1-CG 4.27Å; L166-L170 HydrophobicContact CG-CD1 4Å; L166-L170 WeakPolarHBondContact O-CB 3.21Å; L166-L170 WeakPolarHBondContact O-CG 3.39Å; L166-L170 PolarHBondContact O-N 3.08Å; S168-L170 PolarHBondContact O-N 3.13Å; L170-M172 VanDerWaalsContact C-N 3.35Å; L170-M172 PolarHBondContact O-N 2.98Å; L170-S173 WeakPolarHBondContact O-CB 3.11Å; L170-S173 PolarHBondContact O-N 3.46Å; L170-S173 VanDerWaalsContact O-N 3.15Å; L170-S173 PolarHBondContact O-OG 3.3Å
171	A	86.9	Confident	83.3	Confident	6 Å²	6	49.9 Å²	49.9	5%	0.05	27%	0.268	C	S	.	.	H	α-helix	trans	-57.6	-45.7	175.7	0	0	0	0	0	112.2	V39 F43 V156 A167 S168 S173 G174	V39-A171 HydrophobicContact CG1-CB 4.44Å; F43-A171 WeakPolarHBondContact CA-O 3.4Å; V156-A171 HydrophobicContact CG2-CB 4.06Å; A167-A171 WeakPolarHBondContact O-CB 3.22Å; A167-A171 PolarHBondContact O-N 3.47Å; S168-A171 PolarHBondContact O-N 3.24Å; A171-S173 VanDerWaalsContact C-N 3.27Å; A171-S173 PolarHBondContact O-N 3.14Å; A171-G174 PolarHBondContact O-N 3.11Å
172	M	82.5	Confident	84.2	Confident	51 Å²	51	46.2 Å²	46.2	25%	0.251	25%	0.248	S	C	.	.	H	α-helix	trans	-70.8	-17.8	179.1	-68.7	-176.5	78.2	0	0	114	S168 G169 L170 G174 A175	S168-M172 WeakPolarHBondContact O-CB 3.47Å; S168-M172 VanDerWaalsContact O-CG 3.32Å; S168-M172 WeakPolarHBondContact O-CG 3.28Å; S168-M172 PolarHBondContact O-N 3.44Å; G169-M172 PolarHBondContact O-N 3.4Å; L170-M172 VanDerWaalsContact C-N 3.35Å; L170-M172 PolarHBondContact O-N 2.98Å; M172-G174 PolarHBondContact O-N 3.34Å; M172-A175 VanDerWaalsContact O-CB 3.24Å; M172-A175 WeakPolarHBondContact O-CB 3.16Å; M172-A175 PolarHBondContact O-N 3.18Å
173	S	83	Confident	85	Confident	28 Å²	28	36.7 Å²	36.7	20%	0.196	21%	0.212	C	C	.	.	H	α-helix	trans	-68	-24.1	176.4	76	0	0	0	0	113.1	G169 L170 A171 A175 G176	G169-S173 PolarHBondContact O-N 3.01Å; L170-S173 WeakPolarHBondContact O-CB 3.11Å; L170-S173 PolarHBondContact O-N 3.46Å; L170-S173 VanDerWaalsContact O-N 3.15Å; L170-S173 PolarHBondContact O-OG 3.3Å; A171-S173 VanDerWaalsContact C-N 3.27Å; A171-S173 PolarHBondContact O-N 3.14Å; S173-A175 PolarHBondContact O-N 3.34Å; S173-A175 VanDerWaalsContact O-N 3.11Å; S173-G176 PolarHBondContact O-N 3.47Å
174	G	88.9	Confident	85.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-54.7	-30.9	174.4	0	0	0	0	0	112.9	F43 L47 A171 M172 G176 V177 G178	F43-G174 VanDerWaalsContact CD2-N 3.35Å; L47-G174 WeakPolarHBondContact CA-O 3.43Å; L47-G174 WeakPolarHBondContact CB-O 3.46Å; A171-G174 PolarHBondContact O-N 3.11Å; M172-G174 PolarHBondContact O-N 3.34Å; G174-G176 PolarHBondContact O-N 2.89Å; G174-V177 PolarHBondContact O-N 2.87Å; G174-G178 PolarHBondContact O-N 3.26Å
175	A	88.7	Confident	86.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-48.1	-54.3	176.3	0	0	0	0	0	113.9	Q46 D50 M172 S173 G178 T179	Q46-A175 HydrophobicContact CG-CB 3.66Å; D50-A175 HydrophobicContact CB-CB 3.88Å; D50-A175 WeakPolarHBondContact OD2-CB 3.13Å; M172-A175 VanDerWaalsContact O-CB 3.24Å; M172-A175 WeakPolarHBondContact O-CB 3.16Å; M172-A175 PolarHBondContact O-N 3.18Å; S173-A175 PolarHBondContact O-N 3.34Å; S173-A175 VanDerWaalsContact O-N 3.11Å; A175-G178 WeakPolarHBondContact O-CA 3.4Å; A175-G178 PolarHBondContact O-N 2.9Å; A175-T179 PolarHBondContact O-N 3.44Å
176	G	84.3	Confident	88	Confident	2 Å²	2	30.1 Å²	30.1	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-80.2	-25.5	-173.4	0	0	0	0	0	113.5	S173 G174 G178 T179 L180 T672	S173-G176 PolarHBondContact O-N 3.47Å; G174-G176 PolarHBondContact O-N 2.89Å; G176-G178 VanDerWaalsContact C-N 3.28Å; G176-T179 PolarHBondContact O-OG1 3.43Å; G176-L180 WeakPolarHBondContact O-CB 3.44Å; G176-L180 PolarHBondContact O-N 3.09Å; G176-T672 VanDerWaalsContact CA-OG1 3.32Å; G176-T672 WeakPolarHBondContact CA-OG1 3.34Å
177	V	89.7	Confident	88.8	Confident	51 Å²	51	26.2 Å²	26.2	31%	0.309	16%	0.155	S	C	.	.	H	α-helix	trans	-65	-37.8	164.6	179.8	0	0	0	0	109.9	F43 L47 G174 L180 L181	F43-V177 HydrophobicContact CE2-CG2 4.42Å; F43-V177 HydrophobicContact CZ-CB 4.22Å; F43-V177 HydrophobicContact CZ-CG1 4.33Å; F43-V177 HydrophobicContact CZ-CG2 4.05Å; L47-V177 HydrophobicContact CD1-CB 4.41Å; L47-V177 HydrophobicContact CD1-CG1 3.9Å; G174-V177 PolarHBondContact O-N 2.87Å; V177-L180 PolarHBondContact O-N 3.2Å; V177-L181 HydrophobicContact CG1-CD1 3.7Å; V177-L181 HydrophobicContact CG1-CG 4.22Å; V177-L181 WeakPolarHBondContact O-CB 3.38Å; V177-L181 VanDerWaalsContact O-CG 3.31Å; V177-L181 WeakPolarHBondContact O-CG 3.42Å; V177-L181 PolarHBondContact O-N 3.48Å
178	G	93.2	Very high	89.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.9	-56	172.5	0	0	0	0	0	112.7	L47 G51 G174 A175 G176 L180 L181 V182	L47-G178 VanDerWaalsContact O-CA 3.23Å; L47-G178 WeakPolarHBondContact O-CA 3.34Å; G51-G178 VanDerWaalsContact CA-O 3.23Å; G51-G178 WeakPolarHBondContact CA-O 3.49Å; G174-G178 PolarHBondContact O-N 3.26Å; A175-G178 WeakPolarHBondContact O-CA 3.4Å; A175-G178 PolarHBondContact O-N 2.9Å; G176-G178 VanDerWaalsContact C-N 3.28Å; G178-L180 PolarHBondContact O-N 2.98Å; G178-L180 VanDerWaalsContact O-N 3.14Å; G178-L181 PolarHBondContact O-N 3.26Å; G178-V182 WeakPolarHBondContact O-CG2 3.48Å; G178-V182 PolarHBondContact O-N 2.88Å; G178-V182 VanDerWaalsContact O-N 3.08Å
179	T	90.4	Very high	90.2	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-64.1	-18.4	-178.7	59.5	0	0	0	0	112.9	D50 A175 G176 P183 F643 S668	D50-T179 HydrophobicContact CB-CG2 4Å; D50-T179 WeakPolarHBondContact O-CG2 3.5Å; A175-T179 PolarHBondContact O-N 3.44Å; G176-T179 PolarHBondContact O-OG1 3.43Å; T179-P183 WeakPolarHBondContact O-CD 3.45Å; T179-P183 WeakPolarHBondContact O-CG 3.47Å; T179-F643 HydrophobicContact CG2-CE1 4.18Å; T179-S668 WeakPolarHBondContact CB-OG 3.27Å; T179-S668 PolarHBondContact O-OG 3.41Å; T179-S668 VanDerWaalsContact O-OG 3.12Å; T179-S668 WeakPolarHBondContact OG1-CB 3.29Å; T179-S668 PolarHBondContact OG1-OG 3.32Å
180	L	91.2	Very high	91.1	Very high	41 Å²	41	33.2 Å²	33.2	22%	0.215	17%	0.167	C	C	.	.	H	α-helix	trans	-80.3	-53.1	169.7	-173.5	164.8	0	0	0	112	G176 V177 G178 V184 M665 I669	G176-L180 WeakPolarHBondContact O-CB 3.44Å; G176-L180 PolarHBondContact O-N 3.09Å; V177-L180 PolarHBondContact O-N 3.2Å; G178-L180 PolarHBondContact O-N 2.98Å; G178-L180 VanDerWaalsContact O-N 3.14Å; L180-V184 WeakPolarHBondContact O-CG2 3.16Å; L180-M665 HydrophobicContact CD2-CE 3.82Å; L180-M665 HydrophobicContact CG-CB 4.31Å; L180-M665 HydrophobicContact CG-CE 4.11Å; L180-M665 HydrophobicContact CG-CG 4.25Å; L180-I669 HydrophobicContact CD1-CD1 4.17Å; L180-I669 HydrophobicContact CD1-CG1 3.77Å
181	L	94.2	Very high	91.5	Very high	87 Å²	87	34.5 Å²	34.5	46%	0.455	18%	0.179	S	C	.	.	H	α-helix	trans	-73.1	-37.8	-169.6	-71.1	176.3	0	0	0	114.1	L47 V177 G178 V184 F185	L47-L181 HydrophobicContact CD1-CD1 4.39Å; V177-L181 HydrophobicContact CG1-CD1 3.7Å; V177-L181 HydrophobicContact CG1-CG 4.22Å; V177-L181 WeakPolarHBondContact O-CB 3.38Å; V177-L181 VanDerWaalsContact O-CG 3.31Å; V177-L181 WeakPolarHBondContact O-CG 3.42Å; V177-L181 PolarHBondContact O-N 3.48Å; G178-L181 PolarHBondContact O-N 3.26Å; L181-V184 PolarHBondContact O-N 3.41Å; L181-F185 PolarHBondContact O-N 3.05Å
182	V	95.2	Very high	91.9	Very high	6 Å²	6	39.6 Å²	39.6	4%	0.036	21%	0.205	C	C	.	.	H	α-helix	trans	-74	-38.8	-170.9	-177.8	0	0	0	0	113.1	G51 G178 V184 F185 Y186 Y202	G51-V182 VanDerWaalsContact O-CB 3.22Å; G51-V182 WeakPolarHBondContact O-CB 3.2Å; G51-V182 WeakPolarHBondContact O-CG1 3.17Å; G178-V182 WeakPolarHBondContact O-CG2 3.48Å; G178-V182 PolarHBondContact O-N 2.88Å; G178-V182 VanDerWaalsContact O-N 3.08Å; V182-V184 VanDerWaalsContact C-N 3.3Å; V182-V184 PolarHBondContact O-N 3.01Å; V182-F185 PolarHBondContact O-N 3.4Å; V182-Y186 HydrophobicContact CG1-CD2 3.8Å; V182-Y186 HydrophobicContact CG1-CE2 3.53Å; V182-Y186 WeakPolarHBondContact O-CD2 3.24Å; V182-Y186 PolarHBondContact O-N 3.23Å; V182-Y202 HydrophobicContact CB-CE2 4.38Å; V182-Y202 HydrophobicContact CG1-CD2 4.26Å; V182-Y202 HydrophobicContact CG1-CE2 3.63Å; V182-Y202 HydrophobicContact CG2-CE2 3.82Å
183	P	93.7	Very high	92.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.2	-41.2	167.9	-27.6	36.6	0	0	0	113.2	V58 T179 Y186 N187 V661 V664	V58-P183 HydrophobicContact CG2-CB 3.95Å; T179-P183 WeakPolarHBondContact O-CD 3.45Å; T179-P183 WeakPolarHBondContact O-CG 3.47Å; P183-Y186 PolarHBondContact O-N 3.09Å; P183-N187 WeakPolarHBondContact O-CB 3.48Å; P183-N187 PolarHBondContact O-N 3.23Å; P183-V661 HydrophobicContact CB-CG1 4.06Å; P183-V664 HydrophobicContact CG-CG1 4.33Å
184	V	94.4	Very high	93	Very high	59 Å²	59	43.4 Å²	43.4	36%	0.358	23%	0.225	S	C	.	.	H	α-helix	trans	-65.1	-44.4	178	176.9	0	0	0	0	111.2	L180 L181 V182 Y186 N187 W188 V661 M665	L180-V184 WeakPolarHBondContact O-CG2 3.16Å; L181-V184 PolarHBondContact O-N 3.41Å; V182-V184 VanDerWaalsContact C-N 3.3Å; V182-V184 PolarHBondContact O-N 3.01Å; V184-Y186 VanDerWaalsContact C-N 3.34Å; V184-Y186 PolarHBondContact O-N 3.23Å; V184-N187 PolarHBondContact O-N 3.44Å; V184-W188 WeakPolarHBondContact O-CB 3.42Å; V184-W188 PolarHBondContact O-N 3.47Å; V184-V661 HydrophobicContact CG2-CG1 4.23Å; V184-M665 HydrophobicContact CG2-CE 3.81Å; V184-M665 HydrophobicContact CG2-CG 4.02Å; V184-M665 HydrophobicContact CG2-SD 3.31Å; V184-M665 WeakPolarHBondContact CG2-SD 3.01Å
185	F	95.7	Very high	93.3	Very high	60 Å²	60	44.2 Å²	44.2	26%	0.263	23%	0.229	S	C	.	.	H	α-helix	trans	-55.7	-47.6	174.1	173	-83.4	0	0	0	111.7	L181 V182 I189 L201 Y202	L181-F185 PolarHBondContact O-N 3.05Å; V182-F185 PolarHBondContact O-N 3.4Å; F185-I189 HydrophobicContact CD1-CD1 4.47Å; F185-I189 HydrophobicContact CD2-CD1 3.87Å; F185-I189 HydrophobicContact CE1-CD1 4.09Å; F185-I189 HydrophobicContact CE2-CD1 3.48Å; F185-I189 VanDerWaalsContact CE2-CD1 3.48Å; F185-I189 HydrophobicContact CG-CD1 4.36Å; F185-I189 HydrophobicContact CZ-CD1 3.61Å; F185-I189 WeakPolarHBondContact O-CG1 3.47Å; F185-I189 PolarHBondContact O-N 2.83Å; F185-I189 VanDerWaalsContact O-N 3.14Å; F185-L201 HydrophobicContact CZ-CB 4.5Å; F185-L201 HydrophobicContact CZ-CD2 4.25Å; F185-L201 HydrophobicContact CZ-CG 4.17Å; F185-Y202 HydrophobicContact CD1-CD2 4.11Å; F185-Y202 AromaticContact CE1-CD2 4Å; F185-Y202 HydrophobicContact CE1-CD2 4Å; F185-Y202 HydrophobicContact CE1-CG 4.36Å; F185-Y202 HydrophobicContact CZ-CD2 4.47Å
186	Y	96.1	Very high	93.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.4	-45	177.4	-78.4	-53.8	0	0	0	112	L59 V182 P183 V184 W188 I189 I190 Y202	L59-Y186 HydrophobicContact CD1-CD2 4.5Å; L59-Y186 HydrophobicContact CD1-CE1 4.14Å; L59-Y186 HydrophobicContact CD1-CE2 3.88Å; L59-Y186 HydrophobicContact CD2-CD1 3.98Å; L59-Y186 HydrophobicContact CD2-CE1 3.87Å; L59-Y186 HydrophobicContact CD2-CG 4.5Å; L59-Y186 HydrophobicContact CG-CD1 4.27Å; L59-Y186 HydrophobicContact CG-CD2 4.28Å; L59-Y186 HydrophobicContact CG-CE1 4.15Å; L59-Y186 HydrophobicContact CG-CE2 4.15Å; L59-Y186 HydrophobicContact CG-CG 4.36Å; V182-Y186 HydrophobicContact CG1-CD2 3.8Å; V182-Y186 HydrophobicContact CG1-CE2 3.53Å; V182-Y186 WeakPolarHBondContact O-CD2 3.24Å; V182-Y186 PolarHBondContact O-N 3.23Å; P183-Y186 PolarHBondContact O-N 3.09Å; V184-Y186 VanDerWaalsContact C-N 3.34Å; V184-Y186 PolarHBondContact O-N 3.23Å; Y186-W188 PolarHBondContact O-N 3.46Å; Y186-I189 PolarHBondContact O-N 3.41Å; Y186-I190 HydrophobicContact CD1-CD1 3.98Å; Y186-I190 HydrophobicContact CD1-CG1 4.31Å; Y186-I190 HydrophobicContact CG-CD1 4.23Å; Y186-I190 VanDerWaalsContact O-CB 3.23Å; Y186-I190 WeakPolarHBondContact O-CB 3.34Å; Y186-I190 WeakPolarHBondContact O-CG1 3.44Å; Y186-I190 PolarHBondContact O-N 3.32Å; Y186-Y202 AromaticContact CZ-CG 3.92Å; Y186-Y202 WeakPolarHBondContact OH-CB 3.12Å; Y186-Y202 WeakPolarHBondContact OH-CD1 3.33Å; Y186-Y202 VanDerWaalsContact OH-CG 3.27Å
187	N	94.1	Very high	94.2	Very high	18 Å²	18	50.1 Å²	50.1	10%	0.096	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-35.6	-179.9	-162.1	66.6	0	0	0	112.5	P183 V184 P191 Q657 D658 V661	P183-N187 WeakPolarHBondContact O-CB 3.48Å; P183-N187 PolarHBondContact O-N 3.23Å; V184-N187 PolarHBondContact O-N 3.44Å; N187-P191 WeakPolarHBondContact O-CD 3.34Å; N187-P191 WeakPolarHBondContact O-CG 3.4Å; N187-Q657 PolarHBondContact OD1-NE2 3.05Å; N187-D658 PolarHBondContact ND2-OD1 3.32Å; N187-V661 HydrophobicContact CB-CG1 4.43Å; N187-V661 HydrophobicContact CB-CG2 4.03Å
188	W	94.6	Very high	94.5	Very high	181 Å²	181	47.7 Å²	47.7	69%	0.686	24%	0.244	S	C	*	.	H	α-helix	trans	-75.5	-40.7	178.1	-176.9	54.8	0	0	0	113.7	V184 Y186 I192	V184-W188 WeakPolarHBondContact O-CB 3.42Å; V184-W188 PolarHBondContact O-N 3.47Å; Y186-W188 PolarHBondContact O-N 3.46Å; W188-I192 VanDerWaalsContact O-CD1 3.3Å; W188-I192 WeakPolarHBondContact O-CD1 3.37Å; W188-I192 WeakPolarHBondContact O-CG1 3.44Å
189	I	96.1	Very high	94.7	Very high	12 Å²	12	48 Å²	48	6%	0.062	25%	0.246	C	C	.	.	H	α-helix	trans	-92.9	-29.1	-170.7	-57	-177.7	0	0	0	113	F185 Y186 I192 K193 L201	F185-I189 HydrophobicContact CD1-CD1 4.47Å; F185-I189 HydrophobicContact CD2-CD1 3.87Å; F185-I189 HydrophobicContact CE1-CD1 4.09Å; F185-I189 HydrophobicContact CE2-CD1 3.48Å; F185-I189 VanDerWaalsContact CE2-CD1 3.48Å; F185-I189 HydrophobicContact CG-CD1 4.36Å; F185-I189 HydrophobicContact CZ-CD1 3.61Å; F185-I189 WeakPolarHBondContact O-CG1 3.47Å; F185-I189 PolarHBondContact O-N 2.83Å; F185-I189 VanDerWaalsContact O-N 3.14Å; Y186-I189 PolarHBondContact O-N 3.41Å; I189-I192 PolarHBondContact O-N 3.02Å; I189-K193 HydrophobicContact CG2-CB 4.29Å; I189-K193 HydrophobicContact CG2-CD 4.28Å; I189-K193 HydrophobicContact CG2-CG 4.34Å; I189-K193 PolarHBondContact O-N 2.89Å; I189-L201 HydrophobicContact CD1-CD2 3.96Å
190	I	95.8	Very high	95	Very high	21 Å²	21	49.7 Å²	49.7	11%	0.108	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-44.2	-179.5	-69	177.5	0	0	0	112.6	V58 L59 Y186 I192 G194 W195 S198	V58-I190 HydrophobicContact CG1-CD1 4.11Å; L59-I190 HydrophobicContact CD2-CD1 4.03Å; Y186-I190 HydrophobicContact CD1-CD1 3.98Å; Y186-I190 HydrophobicContact CD1-CG1 4.31Å; Y186-I190 HydrophobicContact CG-CD1 4.23Å; Y186-I190 VanDerWaalsContact O-CB 3.23Å; Y186-I190 WeakPolarHBondContact O-CB 3.34Å; Y186-I190 WeakPolarHBondContact O-CG1 3.44Å; Y186-I190 PolarHBondContact O-N 3.32Å; I190-I192 PolarHBondContact O-N 3.5Å; I190-G194 WeakPolarHBondContact O-CA 3.46Å; I190-G194 PolarHBondContact O-N 3.13Å; I190-W195 HydrophobicContact CD1-CB 4.17Å; I190-W195 HydrophobicContact CG1-CB 4.27Å; I190-W195 HydrophobicContact CG2-CB 4.26Å; I190-S198 WeakPolarHBondContact CA-OG 3.41Å; I190-S198 WeakPolarHBondContact CG1-OG 3.15Å; I190-S198 PolarHBondContact N-OG 3.36Å
191	P	93.8	Very high	95.3	Very high	100 Å²	100	51.5 Å²	51.5	65%	0.649	26%	0.264	S	S	*	.	H	α-helix	trans	-62.3	-26.9	175.2	-24.4	35.5	0	0	0	114	N187	N187-P191 WeakPolarHBondContact O-CD 3.34Å; N187-P191 WeakPolarHBondContact O-CG 3.4Å
192	I	94.6	Very high	95.4	Very high	113 Å²	113	48 Å²	48	58%	0.579	25%	0.245	S	C	*	.	H	α-helix	trans	-89.8	-41.8	-174	-53.9	174.6	0	0	0	111.8	W188 I189 I190	W188-I192 VanDerWaalsContact O-CD1 3.3Å; W188-I192 WeakPolarHBondContact O-CD1 3.37Å; W188-I192 WeakPolarHBondContact O-CG1 3.44Å; I189-I192 PolarHBondContact O-N 3.02Å; I190-I192 PolarHBondContact O-N 3.5Å
193	K	93.6	Very high	95.5	Very high	125 Å²	125	47.8 Å²	47.8	54%	0.543	24%	0.243	S	C	.	.	H	α-helix	trans	-123	-2.5	-171.8	-61.1	-169	176.6	-177.2	0	114.8	I189 S197	I189-K193 HydrophobicContact CG2-CB 4.29Å; I189-K193 HydrophobicContact CG2-CD 4.28Å; I189-K193 HydrophobicContact CG2-CG 4.34Å; I189-K193 PolarHBondContact O-N 2.89Å; K193-S197 WeakPolarHBondContact O-CB 3.39Å; K193-S197 PolarHBondContact O-OG 3.18Å
194	G	94.4	Very high	95.7	Very high	33 Å²	33	52.7 Å²	52.7	34%	0.34	27%	0.269	S	S	.	.	H	α-helix	trans	75.3	159.9	-171.5	0	0	0	0	0	113.3	I190 R196 S197 S198	I190-G194 WeakPolarHBondContact O-CA 3.46Å; I190-G194 PolarHBondContact O-N 3.13Å; G194-R196 PolarHBondContact O-N 3.13Å; G194-S197 PolarHBondContact O-N 3.38Å; G194-S198 WeakPolarHBondContact O-CB 3.43Å; G194-S198 PolarHBondContact O-N 2.92Å; G194-S198 PolarHBondContact O-OG 2.92Å
195	W	94.9	Very high	95.8	Very high	18 Å²	18	51.4 Å²	51.4	7%	0.068	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-34.1	-172.9	71.6	-96.3	0	0	0	114	L59 L63 D66 F69 I190 S198 L199	L59-W195 HydrophobicContact CD2-CB 4.3Å; L63-W195 HydrophobicContact CD2-CD2 3.96Å; L63-W195 HydrophobicContact CD2-CE3 3.9Å; L63-W195 HydrophobicContact CD2-CH2 3.53Å; L63-W195 HydrophobicContact CD2-CZ2 3.57Å; L63-W195 HydrophobicContact CD2-CZ3 3.7Å; D66-W195 PolarHBondContact OD2-NE1 3.47Å; F69-W195 HydrophobicContact CE2-CH2 4.02Å; F69-W195 AromaticContact CE2-CZ2 3.52Å; F69-W195 HydrophobicContact CE2-CZ2 3.52Å; F69-W195 HydrophobicContact CZ-CH2 4.16Å; F69-W195 AromaticContact CZ-CZ2 3.97Å; F69-W195 HydrophobicContact CZ-CZ2 3.97Å; I190-W195 HydrophobicContact CD1-CB 4.17Å; I190-W195 HydrophobicContact CG1-CB 4.27Å; I190-W195 HydrophobicContact CG2-CB 4.26Å; W195-S198 PolarHBondContact O-N 2.89Å; W195-L199 HydrophobicContact CZ3-CD2 4.34Å; W195-L199 WeakPolarHBondContact O-CB 3.46Å; W195-L199 PolarHBondContact O-N 3.39Å
196	R	96.1	Very high	95.8	Very high	69 Å²	69	48.6 Å²	48.6	26%	0.26	26%	0.256	S	S	.	.	H	α-helix	trans	-59.8	-53	176.8	-66.8	-172.8	177.1	79.4	2.7	111.1	D66 S125 G194 S198 L199 L200	D66-R196 IonicContact OD1-NH1 2.75Å; D66-R196 IonicContact OD1-NH2 3.29Å; D66-R196 PolarHBondContact OD1-NH2 3.09Å; D66-R196 IonicContact OD2-CZ 3.79Å; D66-R196 IonicContact OD2-NH1 3.48Å; D66-R196 PolarHBondContact OD2-NH1 3.3Å; D66-R196 IonicContact OD2-NH2 3.43Å; D66-R196 PolarHBondContact OD2-NH2 2.91Å; S125-R196 WeakPolarHBondContact CB-O 3.44Å; S125-R196 WeakPolarHBondContact O-CB 3.49Å; S125-R196 WeakPolarHBondContact O-CD 3.11Å; S125-R196 VanDerWaalsContact O-CG 3.22Å; S125-R196 WeakPolarHBondContact O-CG 3.23Å; G194-R196 PolarHBondContact O-N 3.13Å; R196-S198 VanDerWaalsContact C-N 3.29Å; R196-S198 PolarHBondContact O-N 2.97Å; R196-L199 PolarHBondContact O-N 3.36Å; R196-L200 PolarHBondContact O-N 3.13Å
197	S	95.9	Very high	95.9	Very high	57 Å²	57	49.8 Å²	49.8	40%	0.399	26%	0.264	S	S	.	.	H	α-helix	trans	-61.9	-35.6	176.4	-44.1	0	0	0	0	112.9	K193 G194 L201	K193-S197 WeakPolarHBondContact O-CB 3.39Å; K193-S197 PolarHBondContact O-OG 3.18Å; G194-S197 PolarHBondContact O-N 3.38Å; S197-L201 WeakPolarHBondContact O-CB 3.44Å; S197-L201 PolarHBondContact O-N 3.17Å
198	S	96.4	Very high	96	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.5	-42.7	179	-54.3	0	0	0	0	111.7	I190 G194 W195 R196 L201 Y202	I190-S198 WeakPolarHBondContact CA-OG 3.41Å; I190-S198 WeakPolarHBondContact CG1-OG 3.15Å; I190-S198 PolarHBondContact N-OG 3.36Å; G194-S198 WeakPolarHBondContact O-CB 3.43Å; G194-S198 PolarHBondContact O-N 2.92Å; G194-S198 PolarHBondContact O-OG 2.92Å; W195-S198 PolarHBondContact O-N 2.89Å; R196-S198 VanDerWaalsContact C-N 3.29Å; R196-S198 PolarHBondContact O-N 2.97Å; S198-L201 PolarHBondContact O-N 3.21Å; S198-Y202 WeakPolarHBondContact O-CB 3.34Å; S198-Y202 PolarHBondContact O-N 2.74Å
199	L	96.9	Very high	96.1	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-41.6	174.7	176.4	57.2	0	0	0	111.7	L59 M121 Y137 W195 R196 Y202 S203	L59-L199 HydrophobicContact CD1-CD1 4.42Å; M121-L199 HydrophobicContact CB-CD1 4.25Å; M121-L199 HydrophobicContact CG-CD1 4.38Å; M121-L199 HydrophobicContact SD-CD1 3.7Å; Y137-L199 HydrophobicContact CD2-CD1 4.2Å; Y137-L199 HydrophobicContact CD2-CD2 4.16Å; Y137-L199 HydrophobicContact CE2-CD1 3.73Å; Y137-L199 HydrophobicContact CE2-CD2 4.3Å; W195-L199 HydrophobicContact CZ3-CD2 4.34Å; W195-L199 WeakPolarHBondContact O-CB 3.46Å; W195-L199 PolarHBondContact O-N 3.39Å; R196-L199 PolarHBondContact O-N 3.36Å; L199-Y202 PolarHBondContact O-N 3.05Å; L199-S203 WeakPolarHBondContact O-CB 3.34Å; L199-S203 PolarHBondContact O-N 2.85Å; L199-S203 PolarHBondContact O-OG 3.34Å
200	L	97.4	Very high	96.1	Very high	38 Å²	38	49 Å²	49	20%	0.199	27%	0.272	C	S	.	.	H	α-helix	trans	-65.4	-39.9	175.7	-177.1	64.1	0	0	0	112.7	Y126 R196 S203 L204	Y126-L200 HydrophobicContact CE2-CD1 4.13Å; Y126-L200 HydrophobicContact CE2-CD2 4.21Å; Y126-L200 VanDerWaalsContact OH-CD2 3.26Å; Y126-L200 WeakPolarHBondContact OH-CD2 3.4Å; R196-L200 PolarHBondContact O-N 3.13Å; L200-S203 WeakPolarHBondContact CA-OG 3.43Å; L200-S203 PolarHBondContact O-OG 3.36Å; L200-L204 HydrophobicContact CD1-CD1 4.25Å; L200-L204 HydrophobicContact CD1-CG 4.44Å; L200-L204 HydrophobicContact CG-CD1 4.26Å; L200-L204 VanDerWaalsContact O-CG 3.32Å; L200-L204 WeakPolarHBondContact O-CG 3.33Å; L200-L204 PolarHBondContact O-N 2.75Å
201	L	96.9	Very high	96.2	Very high	80 Å²	80	49.3 Å²	49.3	42%	0.419	28%	0.278	S	S	.	.	H	α-helix	trans	-67.4	-39.7	176.1	-176.3	61	0	0	0	111.1	F185 I189 S197 S198 G205	F185-L201 HydrophobicContact CZ-CB 4.5Å; F185-L201 HydrophobicContact CZ-CD2 4.25Å; F185-L201 HydrophobicContact CZ-CG 4.17Å; I189-L201 HydrophobicContact CD1-CD2 3.96Å; S197-L201 WeakPolarHBondContact O-CB 3.44Å; S197-L201 PolarHBondContact O-N 3.17Å; S198-L201 PolarHBondContact O-N 3.21Å; L201-G205 PolarHBondContact O-N 3.39Å
202	Y	97.2	Very high	96.2	Very high	14 Å²	14	49.2 Å²	49.2	6%	0.055	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-48.1	173.8	-174.2	-102.4	0	0	0	111.9	I48 T52 M121 V182 F185 Y186 S198 L199 L204 G205 A206	I48-Y202 PolarHBondContact O-OH 3.35Å; T52-Y202 WeakPolarHBondContact OG1-CE1 3.41Å; T52-Y202 PolarHBondContact OG1-OH 3.42Å; T52-Y202 VanDerWaalsContact OG1-OH 3.13Å; M121-Y202 HydrophobicContact SD-CD1 4.02Å; M121-Y202 HydrophobicContact SD-CE1 4.31Å; V182-Y202 HydrophobicContact CB-CE2 4.38Å; V182-Y202 HydrophobicContact CG1-CD2 4.26Å; V182-Y202 HydrophobicContact CG1-CE2 3.63Å; V182-Y202 HydrophobicContact CG2-CE2 3.82Å; F185-Y202 HydrophobicContact CD1-CD2 4.11Å; F185-Y202 AromaticContact CE1-CD2 4Å; F185-Y202 HydrophobicContact CE1-CD2 4Å; F185-Y202 HydrophobicContact CE1-CG 4.36Å; F185-Y202 HydrophobicContact CZ-CD2 4.47Å; Y186-Y202 AromaticContact CZ-CG 3.92Å; Y186-Y202 WeakPolarHBondContact OH-CB 3.12Å; Y186-Y202 WeakPolarHBondContact OH-CD1 3.33Å; Y186-Y202 VanDerWaalsContact OH-CG 3.27Å; S198-Y202 WeakPolarHBondContact O-CB 3.34Å; S198-Y202 PolarHBondContact O-N 2.74Å; L199-Y202 PolarHBondContact O-N 3.05Å; Y202-L204 PolarHBondContact O-N 3.26Å; Y202-G205 PolarHBondContact O-N 3.03Å; Y202-A206 HydrophobicContact CD1-CB 4.31Å; Y202-A206 HydrophobicContact CE1-CB 3.99Å; Y202-A206 WeakPolarHBondContact O-CB 3.33Å; Y202-A206 PolarHBondContact O-N 3.42Å
203	S	96.9	Very high	96.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-42.4	-175.1	62.6	0	0	0	0	113	S122 L199 L200 S207	S122-S203 WeakPolarHBondContact OG-CB 3.48Å; S122-S203 PolarHBondContact OG-OG 3.48Å; L199-S203 WeakPolarHBondContact O-CB 3.34Å; L199-S203 PolarHBondContact O-N 2.85Å; L199-S203 PolarHBondContact O-OG 3.34Å; L200-S203 WeakPolarHBondContact CA-OG 3.43Å; L200-S203 PolarHBondContact O-OG 3.36Å; S203-S207 WeakPolarHBondContact O-CB 3.36Å; S203-S207 PolarHBondContact O-N 3.3Å
204	L	97	Very high	96.2	Very high	104 Å²	104	38.1 Å²	38.1	55%	0.545	22%	0.22	S	C	.	.	H	α-helix	trans	-66.9	-43.7	177.4	-66	172	0	0	0	111.3	L200 Y202 L208	L200-L204 HydrophobicContact CD1-CD1 4.25Å; L200-L204 HydrophobicContact CD1-CG 4.44Å; L200-L204 HydrophobicContact CG-CD1 4.26Å; L200-L204 VanDerWaalsContact O-CG 3.32Å; L200-L204 WeakPolarHBondContact O-CG 3.33Å; L200-L204 PolarHBondContact O-N 2.75Å; Y202-L204 PolarHBondContact O-N 3.26Å; L204-L208 WeakPolarHBondContact O-CB 3.15Å; L204-L208 PolarHBondContact O-N 3.22Å
205	G	96.8	Very high	96.1	Very high	31 Å²	31	40.2 Å²	40.2	32%	0.32	22%	0.223	S	C	.	.	H	α-helix	trans	-65.2	-47	175.9	0	0	0	0	0	113	L201 Y202 L208 L209	L201-G205 PolarHBondContact O-N 3.39Å; Y202-G205 PolarHBondContact O-N 3.03Å; G205-L208 PolarHBondContact O-N 2.71Å; G205-L209 WeakPolarHBondContact O-CB 3.37Å; G205-L209 VanDerWaalsContact O-CG 3.28Å; G205-L209 WeakPolarHBondContact O-CG 3.22Å; G205-L209 PolarHBondContact O-N 2.91Å
206	A	97	Very high	95.9	Very high	2 Å²	2	41.1 Å²	41.1	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-43.7	178.2	0	0	0	0	0	112.3	I48 L117 Y202 T210	I48-A206 HydrophobicContact CD1-CB 4.02Å; I48-A206 HydrophobicContact CG2-CB 3.76Å; L117-A206 HydrophobicContact CD2-CB 4.35Å; Y202-A206 HydrophobicContact CD1-CB 4.31Å; Y202-A206 HydrophobicContact CE1-CB 3.99Å; Y202-A206 WeakPolarHBondContact O-CB 3.33Å; Y202-A206 PolarHBondContact O-N 3.42Å; A206-T210 WeakPolarHBondContact O-CB 3.47Å; A206-T210 WeakPolarHBondContact O-CG2 3.34Å; A206-T210 PolarHBondContact O-N 3.02Å; A206-T210 PolarHBondContact O-OG1 2.85Å
207	S	97.1	Very high	95.4	Very high	25 Å²	25	37.9 Å²	37.9	18%	0.175	22%	0.218	C	C	.	.	H	α-helix	trans	-63.9	-45.3	175.3	-175.5	0	0	0	0	111.8	A114 G118 S203 T210 A211	A114-S207 WeakPolarHBondContact O-CB 3.17Å; A114-S207 PolarHBondContact O-OG 2.87Å; G118-S207 VanDerWaalsContact CA-CB 3.46Å; S203-S207 WeakPolarHBondContact O-CB 3.36Å; S203-S207 PolarHBondContact O-N 3.3Å; S207-T210 PolarHBondContact O-N 3.41Å; S207-T210 PolarHBondContact O-OG1 3.48Å; S207-A211 WeakPolarHBondContact O-CB 3.39Å; S207-A211 PolarHBondContact O-N 3.26Å
208	L	97.1	Very high	94.2	Very high	108 Å²	108	40.7 Å²	40.7	57%	0.565	22%	0.223	S	C	*	.	H	α-helix	trans	-62.6	-46.6	177.2	-179.9	60.4	0	0	0	112	L204 G205 A211 L212	L204-L208 WeakPolarHBondContact O-CB 3.15Å; L204-L208 PolarHBondContact O-N 3.22Å; G205-L208 PolarHBondContact O-N 2.71Å; L208-A211 PolarHBondContact O-N 2.95Å; L208-L212 HydrophobicContact CD1-CD1 3.99Å; L208-L212 HydrophobicContact CD1-CG 4.17Å; L208-L212 HydrophobicContact CG-CD1 4.02Å; L208-L212 WeakPolarHBondContact O-CB 3.42Å; L208-L212 VanDerWaalsContact O-CG 3.26Å; L208-L212 WeakPolarHBondContact O-CG 3.32Å; L208-L212 PolarHBondContact O-N 2.78Å
209	L	96.7	Very high	92.3	Very high	86 Å²	86	44.8 Å²	44.8	45%	0.45	25%	0.25	S	C	.	.	H	α-helix	trans	-63.4	-44.6	178.7	-72.7	170.1	0	0	0	112.2	I44 I48 G205 A213	I44-L209 HydrophobicContact CG2-CB 4.07Å; I48-L209 HydrophobicContact CD1-CD1 4.43Å; G205-L209 WeakPolarHBondContact O-CB 3.37Å; G205-L209 VanDerWaalsContact O-CG 3.28Å; G205-L209 WeakPolarHBondContact O-CG 3.22Å; G205-L209 PolarHBondContact O-N 2.91Å; L209-A213 VanDerWaalsContact O-CB 3.29Å; L209-A213 WeakPolarHBondContact O-CB 3.28Å; L209-A213 PolarHBondContact O-N 3.26Å
210	T	96.3	Very high	90.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71.5	-30.4	178.1	52.5	0	0	0	0	112.9	I45 I48 A114 L117 L148 A206 S207 S214	I45-T210 HydrophobicContact CG1-CG2 4.29Å; I48-T210 HydrophobicContact CB-CG2 3.94Å; I48-T210 HydrophobicContact CG1-CG2 4.07Å; I48-T210 HydrophobicContact CG2-CG2 3.85Å; A114-T210 WeakPolarHBondContact CB-OG1 3.43Å; L117-T210 HydrophobicContact CD2-CG2 4.24Å; L148-T210 HydrophobicContact CD1-CG2 4.2Å; A206-T210 WeakPolarHBondContact O-CB 3.47Å; A206-T210 WeakPolarHBondContact O-CG2 3.34Å; A206-T210 PolarHBondContact O-N 3.02Å; A206-T210 PolarHBondContact O-OG1 2.85Å; S207-T210 PolarHBondContact O-N 3.41Å; S207-T210 PolarHBondContact O-OG1 3.48Å; T210-S214 VanDerWaalsContact O-CB 3.25Å; T210-S214 WeakPolarHBondContact O-CB 3.39Å; T210-S214 PolarHBondContact O-N 3.02Å; T210-S214 PolarHBondContact O-OG 3.11Å
211	A	96.2	Very high	87.8	Confident	27 Å²	27	52.4 Å²	52.4	22%	0.223	29%	0.286	C	S	.	.	H	α-helix	trans	-68.9	-47.4	172.7	0	0	0	0	0	111.3	A114 S207 L208 A213 S214 L215	A114-A211 HydrophobicContact CB-CB 3.79Å; A114-A211 VanDerWaalsContact CB-N 3.34Å; S207-A211 WeakPolarHBondContact O-CB 3.39Å; S207-A211 PolarHBondContact O-N 3.26Å; L208-A211 PolarHBondContact O-N 2.95Å; A211-A213 PolarHBondContact O-N 3.44Å; A211-S214 PolarHBondContact O-N 2.91Å; A211-L215 WeakPolarHBondContact O-CB 3.36Å; A211-L215 VanDerWaalsContact O-CG 3.29Å; A211-L215 WeakPolarHBondContact O-CG 3.38Å; A211-L215 PolarHBondContact O-N 2.93Å
212	L	95.6	Very high	85.1	Confident	99 Å²	99	52.8 Å²	52.8	52%	0.518	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-44.1	175.4	-71.3	170.8	0	0	0	111.5	L208 L215	L208-L212 HydrophobicContact CD1-CD1 3.99Å; L208-L212 HydrophobicContact CD1-CG 4.17Å; L208-L212 HydrophobicContact CG-CD1 4.02Å; L208-L212 WeakPolarHBondContact O-CB 3.42Å; L208-L212 VanDerWaalsContact O-CG 3.26Å; L208-L212 WeakPolarHBondContact O-CG 3.32Å; L208-L212 PolarHBondContact O-N 2.78Å; L212-L215 PolarHBondContact O-N 3.3Å
213	A	94.4	Very high	81.7	Confident	5 Å²	5	59 Å²	59	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-40.6	173.5	0	0	0	0	0	112.5	I44 I45 L209 A211 L215 T216	I44-A213 HydrophobicContact CG2-CB 4.38Å; I45-A213 HydrophobicContact CD1-CB 3.98Å; I45-A213 HydrophobicContact CG1-CB 3.88Å; L209-A213 VanDerWaalsContact O-CB 3.29Å; L209-A213 WeakPolarHBondContact O-CB 3.28Å; L209-A213 PolarHBondContact O-N 3.26Å; A211-A213 PolarHBondContact O-N 3.44Å; A213-L215 VanDerWaalsContact C-N 3.31Å; A213-L215 PolarHBondContact O-N 2.96Å; A213-T216 PolarHBondContact O-N 2.96Å; A213-T216 PolarHBondContact O-OG1 3.37Å
214	S	93.1	Very high	78.6	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-68.1	-29.2	176.9	-63.3	0	0	0	0	113.1	R107 G110 T210 A211 T216 L217	R107-S214 WeakPolarHBondContact CG-O 3.5Å; G110-S214 VanDerWaalsContact C-CB 3.41Å; G110-S214 WeakPolarHBondContact CA-OG 3.48Å; G110-S214 PolarHBondContact O-OG 2.98Å; T210-S214 VanDerWaalsContact O-CB 3.25Å; T210-S214 WeakPolarHBondContact O-CB 3.39Å; T210-S214 PolarHBondContact O-N 3.02Å; T210-S214 PolarHBondContact O-OG 3.11Å; A211-S214 PolarHBondContact O-N 2.91Å; S214-T216 VanDerWaalsContact C-N 3.28Å; S214-T216 PolarHBondContact O-N 3.32Å; S214-L217 WeakPolarHBondContact O-CB 3.31Å; S214-L217 WeakPolarHBondContact O-CG 3.33Å; S214-L217 PolarHBondContact O-N 2.94Å
215	L	92.9	Very high	75.2	Confident	77 Å²	77	65.1 Å²	65.1	40%	0.403	37%	0.367	S	S	.	.	H	α-helix	trans	-71.7	-16.6	179	-77.5	168.4	0	0	0	113.9	R107 A211 L212 A213	R107-L215 PolarHBondContact NE-O 2.99Å; R107-L215 PolarHBondContact NH2-O 3.43Å; A211-L215 WeakPolarHBondContact O-CB 3.36Å; A211-L215 VanDerWaalsContact O-CG 3.29Å; A211-L215 WeakPolarHBondContact O-CG 3.38Å; A211-L215 PolarHBondContact O-N 2.93Å; L212-L215 PolarHBondContact O-N 3.3Å; A213-L215 VanDerWaalsContact C-N 3.31Å; A213-L215 PolarHBondContact O-N 2.96Å
216	T	90.8	Very high	72.2	Confident	36 Å²	36	69 Å²	69	22%	0.221	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-20.5	175.7	74.4	0	0	0	0	113.2	W34 I37 S41 A213 S214 K218	W34-T216 PolarHBondContact NE1-O 3.45Å; I37-T216 HydrophobicContact CG2-CG2 4.21Å; S41-T216 WeakPolarHBondContact CB-OG1 3.44Å; S41-T216 PolarHBondContact OG-OG1 3.43Å; A213-T216 PolarHBondContact O-N 2.96Å; A213-T216 PolarHBondContact O-OG1 3.37Å; S214-T216 VanDerWaalsContact C-N 3.28Å; S214-T216 PolarHBondContact O-N 3.32Å; T216-K218 PolarHBondContact O-N 2.86Å
217	L	84.1	Confident	69	Low	2 Å²	2	76.6 Å²	76.6	1%	0.01	43%	0.43	C	S	.	.	S	Bend	trans	-65.8	130.6	178.2	-50.2	-176.3	0	0	0	109	I38 F106 R107 C151 S214	I38-L217 HydrophobicContact CD1-CD2 3.87Å; I38-L217 HydrophobicContact CG2-CD2 4.12Å; F106-L217 HydrophobicContact CB-CB 4.09Å; F106-L217 HydrophobicContact CB-CD1 4.05Å; R107-L217 WeakPolarHBondContact CB-O 3.37Å; R107-L217 WeakPolarHBondContact CD-O 3.39Å; R107-L217 VanDerWaalsContact CG-O 3.29Å; R107-L217 WeakPolarHBondContact CG-O 3.29Å; C151-L217 HydrophobicContact CB-CD1 4.05Å; S214-L217 WeakPolarHBondContact O-CB 3.31Å; S214-L217 WeakPolarHBondContact O-CG 3.33Å; S214-L217 PolarHBondContact O-N 2.94Å
218	K	71.3	Confident	65.7	Low	116 Å²	116	78.2 Å²	78.2	50%	0.504	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-70.4	148.6	173.9	-78.2	-177.9	-177.2	179.7	0	110.7	Y159 T216	Y159-K218 WeakPolarHBondContact OH-CB 3.39Å; Y159-K218 WeakPolarHBondContact OH-CD 3.32Å; Y159-K218 WeakPolarHBondContact OH-CG 3.3Å; T216-K218 PolarHBondContact O-N 2.86Å
219	P	57.1	Low	62.5	Low	85 Å²	85	77.6 Å²	77.6	55%	0.552	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-60.2	144	165.1	28.7	-34.5	0	0	0	109.5
220	F	55	Low	59.4	Low	77 Å²	77	81 Å²	81	34%	0.338	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-74	133.9	172.5	-167.7	-113.7	0	0	0	108.5	F106 Y158 T222	F106-F220 HydrophobicContact CD2-CB 4.37Å; F106-F220 HydrophobicContact CE2-CB 4.39Å; F106-F220 AromaticContact CE2-CD2 3.9Å; F106-F220 HydrophobicContact CE2-CD2 3.9Å; F106-F220 HydrophobicContact CE2-CG 4.45Å; Y158-F220 AromaticContact CE1-CE2 3.96Å; Y158-F220 HydrophobicContact CE1-CE2 3.96Å; Y158-F220 HydrophobicContact CE2-CE2 4.44Å; Y158-F220 AromaticContact CZ-CE2 3.81Å; F220-T222 HydrophobicContact CD1-CG2 3.83Å; F220-T222 HydrophobicContact CE1-CG2 3.61Å
221	I	43.4	Very low	56.2	Low	126 Å²	126	86.8 Å²	86.8	65%	0.646	48%	0.483	S	S	*	.			trans	-111.7	99.7	175.1	-55.8	176.6	0	0	0	106.9	N223	I221-N223 WeakPolarHBondContact CG2-OD1 3.38Å; I221-N223 PolarHBondContact O-N 3.28Å
222	T	40.6	Very low	53.1	Low	89 Å²	89	90 Å²	90	55%	0.546	50%	0.5	S	S	.	.			trans	-67.6	93.6	164.8	41.6	0	0	0	0	108.9	F220 D224	F220-T222 HydrophobicContact CD1-CG2 3.83Å; F220-T222 HydrophobicContact CE1-CG2 3.61Å; T222-D224 PolarHBondContact O-N 3.06Å
223	N	27.2	Very low	50	Low	144 Å²	144	92.6 Å²	92.6	77%	0.77	51%	0.507	S	S	*	.			trans	-79.3	60.9	166.1	-79	-16.6	0	0	0	109.9	I221	I221-N223 WeakPolarHBondContact CG2-OD1 3.38Å; I221-N223 PolarHBondContact O-N 3.28Å
224	D	30.3	Very low	46.9	Very low	133 Å²	133	99.4 Å²	99.4	71%	0.711	54%	0.538	S	S	*	.			trans	-124.1	154.1	174.3	-83.8	-56.6	0	0	0	110	T222	T222-D224 PolarHBondContact O-N 3.06Å
225	S	27.2	Very low	43.8	Very low	100 Å²	100	102.7 Å²	102.7	70%	0.699	56%	0.561	S	S	*	*	S	Bend	trans	61.8	89.1	-178.7	51.9	0	0	0	0	117.9	D227	S225-D227 PolarHBondContact O-N 2.98Å
226	S	31.8	Very low	40.8	Very low	113 Å²	113	104 Å²	104	79%	0.79	57%	0.572	S	S	*	*				62.5	39.7	117.7	67.6	0	0	0	0	121.9
227	D	30	Very low	37.9	Very low	161 Å²	161	107.7 Å²	107.7	86%	0.861	59%	0.594	S	S	*	*			trans	-100.6	41.2	160.5	-92.8	-31.2	0	0	0	112.9	S225 P229	S225-D227 PolarHBondContact O-N 2.98Å; D227-P229 WeakPolarHBondContact O-CD 3.44Å
228	D	28.4	Very low	35.3	Very low	59 Å²	59	113.7 Å²	113.7	32%	0.316	63%	0.625	S	S	.	*			trans	-96.8	96.3	166.5	-80.4	-41.4	0	0	0	110	K23 E230 L231	K23-D228 VanDerWaalsContact CE-OD1 3.3Å; K23-D228 WeakPolarHBondContact CE-OD1 3.28Å; K23-D228 IonicContact NZ-OD1 3.44Å; K23-D228 PolarHBondContact NZ-OD1 3.29Å; K23-D228 IonicContact NZ-OD2 3.88Å; K23-D228 PolarHBondContact NZ-OD2 3.03Å; D228-E230 PolarHBondContact O-N 3.07Å; D228-L231 HydrophobicContact CB-CD1 3.94Å; D228-L231 PolarHBondContact O-N 3.3Å; D228-L231 VanDerWaalsContact O-N 3.13Å
229	P	31.1	Very low	33.2	Very low	95 Å²	95	116.7 Å²	116.7	62%	0.617	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	14.3	178.5	30.1	-37.4	0	0	0	114.7	D227	D227-P229 WeakPolarHBondContact O-CD 3.44Å
230	E	30.8	Very low	31.8	Very low	158 Å²	158	120.7 Å²	120.7	74%	0.738	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-28.9	171.1	-67.5	-175.8	110.7	0	0	112.1	D228 K233	D228-E230 PolarHBondContact O-N 3.07Å; E230-K233 PolarHBondContact O-N 3.3Å
231	L	29.6	Very low	30.3	Very low	121 Å²	121	121.3 Å²	121.3	63%	0.634	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-69	-37.4	174.7	-93.1	119.2	0	0	0	112	D228 K233 Q234	D228-L231 HydrophobicContact CB-CD1 3.94Å; D228-L231 PolarHBondContact O-N 3.3Å; D228-L231 VanDerWaalsContact O-N 3.13Å; L231-K233 PolarHBondContact O-N 3Å; L231-K233 VanDerWaalsContact O-N 3.07Å; L231-Q234 PolarHBondContact O-N 3.42Å
232	T	29.4	Very low	29.6	Very low	95 Å²	95	125 Å²	125	58%	0.583	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-67.7	-4.4	175.5	-24.9	0	0	0	0	113.7	S235	T232-S235 PolarHBondContact O-OG 3.45Å
233	K	30.9	Very low	28.8	Very low	152 Å²	152	129.7 Å²	129.7	66%	0.661	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-105.3	-6.2	175.8	-73.8	-177	176.7	175.9	0	114.3	E230 L231 V237	E230-K233 PolarHBondContact O-N 3.3Å; L231-K233 PolarHBondContact O-N 3Å; L231-K233 VanDerWaalsContact O-N 3.07Å; K233-V237 WeakPolarHBondContact O-CG2 3.31Å
234	Q	30.2	Very low	28.7	Very low	149 Å²	149	128.6 Å²	128.6	70%	0.696	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-17.9	170.2	-82.6	-174.4	-33.9	0	0	113.1	L231	L231-Q234 PolarHBondContact O-N 3.42Å
235	S	28.4	Very low	28.6	Very low	69 Å²	69	128.4 Å²	128.4	48%	0.483	70%	0.701	S	S	.	*	S	Bend	trans	-74.1	-40.2	169.8	42.3	0	0	0	0	112.7	T232 V237	T232-S235 PolarHBondContact O-OG 3.45Å; S235-V237 PolarHBondContact O-N 2.91Å
236	T	28.5	Very low	28.4	Very low	103 Å²	103	128.7 Å²	128.7	63%	0.632	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	28.5	-176.3	64.1	0	0	0	0	114.7
237	V	30.6	Very low	28.1	Very low	114 Å²	114	130.2 Å²	130.2	69%	0.691	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.5	2.7	-178	-171.7	0	0	0	0	111.7	K233 S235	K233-V237 WeakPolarHBondContact O-CG2 3.31Å; S235-V237 PolarHBondContact O-N 2.91Å
238	I	30	Very low	27.9	Very low	129 Å²	129	132.1 Å²	132.1	66%	0.662	71%	0.706	S	S	*	*	S	Bend	trans	-122.8	-8.1	-172.2	-57.4	-177.4	0	0	0	113
239	E	27.4	Very low	27.6	Very low	178 Å²	178	138.3 Å²	138.3	83%	0.832	74%	0.736	S	S	*	*	S	Bend	trans	-78.9	-22.3	178.9	-67.1	-172.7	129.3	0	0	113.9	S241	E239-S241 PolarHBondContact O-N 2.82Å
240	D	26.1	Very low	27.2	Very low	169 Å²	169	141.5 Å²	141.5	90%	0.904	75%	0.746	S	S	*	*	S	Bend	trans	-78.9	45.6	172.4	-81.3	-38.5	0	0	0	113.4
241	S	24.8	Very low	26.8	Very low	91 Å²	91	140.4 Å²	140.4	64%	0.636	75%	0.75	S	S	*	*	S	Bend	trans	-175.6	85	154.5	40.2	0	0	0	0	114.8	E239	E239-S241 PolarHBondContact O-N 2.82Å
242	K	27.8	Very low	26.5	Very low	204 Å²	204	142.1 Å²	142.1	89%	0.887	76%	0.757	S	S	*	*				177.6	103.6	124.9	-95.1	154.4	-171.6	177.9	0	112.6
243	Q	23.5	Very low	26.1	Very low	186 Å²	186	146.9 Å²	146.9	87%	0.869	77%	0.77	S	S	*	*			trans	-66.5	138.6	138.3	-67.3	173.1	-39.7	0	0	108.2
244	T	25.7	Very low	25.7	Very low	121 Å²	121	144.9 Å²	144.9	74%	0.742	77%	0.77	S	S	*	*			trans	165.7	131.2	130.2	-68.5	0	0	0	0	110.5
245	T	29.1	Very low	25.3	Very low	130 Å²	130	144.7 Å²	144.7	80%	0.798	77%	0.772	S	S	*	*			trans	55.7	122.9	168.1	50	0	0	0	0	120.5
246	S	23.2	Very low	25.2	Very low	105 Å²	105	146.1 Å²	146.1	73%	0.734	78%	0.78	S	S	*	*			trans	-64.7	-176	155.4	-52.4	0	0	0	0	112.9
247	D	23.7	Very low	24.9	Very low	146 Å²	146	150.2 Å²	150.2	78%	0.781	79%	0.792	S	S	*	*			trans	91.3	67.1	161.8	-57.8	-4.5	0	0	0	118.1
248	Q	27.4	Very low	24.5	Very low	200 Å²	200	152 Å²	152	94%	0.935	80%	0.797	S	S	*	*				-164.8	109	126.3	-108.1	156.8	68.9	0	0	112.2
249	M	21	Very low	24.1	Very low	190 Å²	190	151.1 Å²	151.1	94%	0.936	80%	0.797	S	S	*	*			trans	-144.5	63.1	171.9	-156.3	-177.5	-154.2	0	0	111.8
250	L	22.5	Very low	23.8	Very low	161 Å²	161	153.2 Å²	153.2	84%	0.843	80%	0.799	S	S	*	*			trans	-154.6	150.4	168.5	-144	76.8	0	0	0	110
251	V	23.7	Very low	23.6	Very low	135 Å²	135	152.2 Å²	152.2	82%	0.818	79%	0.792	S	S	*	*			trans	67.5	120.6	-172.4	-166	0	0	0	0	111.2
252	M	22.4	Very low	23.6	Very low	157 Å²	157	154.9 Å²	154.9	77%	0.773	80%	0.799	S	S	*	*			cis	-145.6	146.5	33.4	-155.4	163.6	-178.8	0	0	112.7
253	K	21.7	Very low	23.5	Very low	195 Å²	195	152.6 Å²	152.6	85%	0.848	80%	0.797	S	S	*	*			trans	-135.7	142.6	168.2	-174.9	176.2	-177.9	177.2	0	107
254	T	21.3	Very low	23.5	Very low	111 Å²	111	151.9 Å²	151.9	68%	0.681	80%	0.799	S	S	*	*			trans	71	152.6	-159	74.1	0	0	0	0	111.9
255	I	23.3	Very low	23.5	Very low	144 Å²	144	150.7 Å²	150.7	74%	0.738	79%	0.791	S	S	*	*			cis	-130.4	-149.7	24.8	-26	178.5	0	0	0	112.1
256	P	26.2	Very low	23.3	Very low	100 Å²	100	150.4 Å²	150.4	65%	0.649	78%	0.783	S	S	*	*			trans	-126.5	-176.9	-130.9	46.1	-27.6	0	0	0	117.9
257	E	21.8	Very low	23.3	Very low	188 Å²	188	152.9 Å²	152.9	88%	0.879	78%	0.778	S	S	*	*			trans	2.8	115.8	147.2	-175.7	179.1	-133.6	0	0	118.4
258	I	22.8	Very low	23.5	Very low	153 Å²	153	150 Å²	150	79%	0.785	76%	0.762	S	S	*	*			trans	-138.7	120	160.3	-56.6	-177.1	0	0	0	111.6
259	T	20.2	Very low	23.4	Very low	109 Å²	109	144.4 Å²	144.4	67%	0.669	74%	0.743	S	S	*	*			trans	-10	137.7	148.7	-14.9	0	0	0	0	119
260	Y	21.7	Very low	23.8	Very low	223 Å²	223	138 Å²	138	88%	0.875	73%	0.725	S	S	*	*			trans	-73.2	139.2	162.8	-74.7	-96.7	0	0	0	112.5
261	I	22.4	Very low	24.1	Very low	147 Å²	147	138.9 Å²	138.9	75%	0.754	72%	0.723	S	S	*	*			trans	-135.3	150.8	157.2	-62.2	177.5	0	0	0	105.3
262	D	24.1	Very low	24.2	Very low	148 Å²	148	137.9 Å²	137.9	79%	0.791	71%	0.712	S	S	*	*			trans	-70.4	-177	-172.8	-60.6	-81.9	0	0	0	115.1
263	D	26.2	Very low	24.4	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	72%	0.716	S	S	*	*			trans	85.4	113.3	179.1	-61.6	-29.3	0	0	0	118.6	V265	D263-V265 PolarHBondContact O-N 3.27Å
264	D	23.3	Very low	24.5	Very low	171 Å²	171	138.1 Å²	138.1	91%	0.914	72%	0.72	S	S	*	*			trans	-75	103.3	178.2	-83.2	-52.1	0	0	0	112.6
265	V	25.8	Very low	24.5	Very low	95 Å²	95	143.1 Å²	143.1	58%	0.576	73%	0.726	S	S	*	*			trans	-134.1	117.5	168.1	-174.6	0	0	0	0	111.4	D263 Y267	D263-V265 PolarHBondContact O-N 3.27Å; V265-Y267 HydrophobicContact CG1-CE2 4.33Å
266	I	24.1	Very low	24.5	Very low	124 Å²	124	143.6 Å²	143.6	64%	0.636	74%	0.736	S	S	*	*			trans	-107.7	120.9	176.3	-59.9	178.2	0	0	0	109.9
267	Y	24.3	Very low	24.4	Very low	157 Å²	157	144 Å²	144	62%	0.616	74%	0.737	S	S	*	*			trans	-85.5	138.7	-177.8	-66.4	-98.4	0	0	0	112.7	V265	V265-Y267 HydrophobicContact CG1-CE2 4.33Å
268	L	26.5	Very low	24.4	Very low	86 Å²	86	140.6 Å²	140.6	45%	0.45	72%	0.724	S	S	.	*			trans	-143.9	133.4	168.9	-70.7	171	0	0	0	111.4	L316	L268-L316 HydrophobicContact CD1-CB 3.68Å; L268-L316 HydrophobicContact CD1-CD1 3.57Å; L268-L316 HydrophobicContact CD1-CD2 4.07Å; L268-L316 HydrophobicContact CD1-CG 3.95Å; L268-L316 HydrophobicContact CD2-CB 4.48Å
269	P	26.7	Very low	24.5	Very low	82 Å²	82	139.6 Å²	139.6	53%	0.532	72%	0.719	S	S	.	*			trans	-89.7	165.4	174.8	37	-35.1	0	0	0	112.3	G325	P269-G325 WeakPolarHBondContact CB-O 3.46Å
270	G	28.4	Very low	24.7	Very low	55 Å²	55	139 Å²	139	57%	0.567	72%	0.715	S	S	*	*			trans	178.5	163.4	170.8	0	0	0	0	0	114.2
271	K	28.5	Very low	24.8	Very low	181 Å²	181	132.2 Å²	132.2	79%	0.787	71%	0.705	S	S	*	*			trans	-151.2	132.5	173.7	-115.8	175.7	-174.3	169.7	0	113.8
272	N	25.4	Very low	25	Very low	113 Å²	113	131.9 Å²	131.9	60%	0.604	70%	0.704	S	S	*	*			trans	41.9	94.9	146.4	-58.1	2.8	0	0	0	119.6
273	H	26.8	Very low	25.1	Very low	185 Å²	185	133.1 Å²	133.1	86%	0.856	70%	0.704	S	S	*	*				-146.2	136.3	128.6	-97.7	-57.5	0	0	0	110.4	R275	H273-R275 PolarHBondContact O-N 3.35Å
274	N	24.1	Very low	25	Very low	173 Å²	173	130 Å²	130	93%	0.925	70%	0.695	S	S	*	*			trans	-69.3	101.2	172.2	-77.7	-0.1	0	0	0	109.7
275	R	22.5	Very low	25	Very low	216 Å²	216	128.8 Å²	128.8	82%	0.815	69%	0.689	S	S	*	*			trans	-134.1	110.4	161	-76.3	-171.5	174	-179.8	-1	109.4	H273 V277	H273-R275 PolarHBondContact O-N 3.35Å; R275-V277 VanDerWaalsContact C-N 3.33Å; R275-V277 HydrophobicContact CB-CG2 4.29Å; R275-V277 PolarHBondContact O-N 3.42Å
276	T	22.5	Very low	25	Very low	154 Å²	154	129.9 Å²	129.9	95%	0.945	70%	0.699	S	S	*	*			trans	-64.5	95.1	157.2	32	0	0	0	0	108.2
277	V	24.2	Very low	25.1	Very low	109 Å²	109	133 Å²	133	66%	0.661	71%	0.708	S	S	*	*			trans	-82.5	115	170.1	179.3	0	0	0	0	107.6	R275 I279	R275-V277 VanDerWaalsContact C-N 3.33Å; R275-V277 HydrophobicContact CB-CG2 4.29Å; R275-V277 PolarHBondContact O-N 3.42Å; V277-I279 WeakPolarHBondContact O-CG1 3.26Å; V277-I279 PolarHBondContact O-N 3.19Å
278	D	21.6	Very low	25.1	Very low	116 Å²	116	131.2 Å²	131.2	62%	0.62	72%	0.716	S	S	*	*			trans	-74.9	109.1	177.2	-166.3	-28.3	0	0	0	110	T280	D278-T280 VanDerWaalsContact CG-OG1 3.23Å; D278-T280 PolarHBondContact O-N 3.13Å; D278-T280 VanDerWaalsContact OD1-CB 3.31Å; D278-T280 WeakPolarHBondContact OD1-CB 3.29Å; D278-T280 WeakPolarHBondContact OD1-CG2 3.28Å; D278-T280 PolarHBondContact OD1-N 3.37Å; D278-T280 PolarHBondContact OD1-OG1 3.26Å
279	I	25.2	Very low	25	Very low	131 Å²	131	133.7 Å²	133.7	67%	0.672	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-84.5	16.2	-175.5	-36.4	-175.6	0	0	0	111.7	V277 A281 I282	V277-I279 WeakPolarHBondContact O-CG1 3.26Å; V277-I279 PolarHBondContact O-N 3.19Å; I279-A281 PolarHBondContact O-N 3.3Å; I279-I282 HydrophobicContact CG2-CD1 4.05Å
280	T	24.6	Very low	24.9	Very low	96 Å²	96	137.4 Å²	137.4	59%	0.589	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-66.7	-19.7	170.6	48.4	0	0	0	0	113.7	D278 I282	D278-T280 VanDerWaalsContact CG-OG1 3.23Å; D278-T280 PolarHBondContact O-N 3.13Å; D278-T280 VanDerWaalsContact OD1-CB 3.31Å; D278-T280 WeakPolarHBondContact OD1-CB 3.29Å; D278-T280 WeakPolarHBondContact OD1-CG2 3.28Å; D278-T280 PolarHBondContact OD1-N 3.37Å; D278-T280 PolarHBondContact OD1-OG1 3.26Å; T280-I282 PolarHBondContact O-N 2.95Å
281	A	24.2	Very low	24.7	Very low	81 Å²	81	140 Å²	140	67%	0.669	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-80.2	1.8	-173.2	0	0	0	0	0	116.7	I279	I279-A281 PolarHBondContact O-N 3.3Å
282	I	26.6	Very low	24.5	Very low	141 Å²	141	137.9 Å²	137.9	72%	0.723	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-101.5	-11.3	-177.2	-66.6	177.1	0	0	0	112.8	I279 T280	I279-I282 HydrophobicContact CG2-CD1 4.05Å; T280-I282 PolarHBondContact O-N 2.95Å
283	H	25.1	Very low	24.4	Very low	173 Å²	173	140.6 Å²	140.6	80%	0.801	76%	0.763	S	S	*	*	S	Bend	trans	-109.9	50.7	-175.4	-112.7	-62.2	0	0	0	114.2
284	S	24.9	Very low	24.3	Very low	92 Å²	92	139.3 Å²	139.3	64%	0.643	76%	0.762	S	S	*	*			trans	-140.7	53.5	-179.6	70.3	0	0	0	0	115.2
285	D	24.2	Very low	24.3	Very low	145 Å²	145	139 Å²	139	78%	0.775	75%	0.753	S	S	*	*			trans	-161.2	44.2	157.7	-122.7	-4.6	0	0	0	113.3	K22	K22-D285 IonicContact NZ-OD2 3.89Å
286	C	25.5	Very low	24.5	Very low	117 Å²	117	136.7 Å²	136.7	79%	0.791	76%	0.757	S	S	*	*			trans	-107.8	113.3	169.1	-72.8	0	0	0	0	110.6
287	K	25.7	Very low	24.7	Very low	189 Å²	189	133.4 Å²	133.4	82%	0.822	75%	0.753	S	S	*	*			trans	-72.9	138.5	165.9	-74	-170.7	170.5	-165.1	0	110.4
288	P	24.3	Very low	24.8	Very low	120 Å²	120	135.8 Å²	135.8	78%	0.779	76%	0.757	S	S	*	*			trans	-84	119.6	166.9	32.8	-29.4	0	0	0	110
289	D	24.1	Very low	24.9	Very low	139 Å²	139	140.6 Å²	140.6	74%	0.743	77%	0.773	S	S	*	*			trans	-148.4	154.7	163.7	-82.3	-54.7	0	0	0	108.1
290	D	25.8	Very low	24.9	Very low	159 Å²	159	142.4 Å²	142.4	85%	0.85	78%	0.776	S	S	*	*			trans	58.1	70.7	176.2	-61.9	-21.3	0	0	0	117.7
291	S	22.1	Very low	24.9	Very low	110 Å²	110	146.9 Å²	146.9	77%	0.769	79%	0.79	S	S	*	*			trans	-72.8	119.3	158.4	57.6	0	0	0	0	111.7
292	V	25.6	Very low	25	Very low	136 Å²	136	154.7 Å²	154.7	82%	0.824	80%	0.802	S	S	*	*			trans	-121.4	111	163.2	180	0	0	0	0	108.5
293	F	23.2	Very low	25	Very low	171 Å²	171	157.7 Å²	157.7	75%	0.75	81%	0.81	S	S	*	*			trans	-76.3	143.6	164.2	-83.5	-97.6	0	0	0	109.5	F295	F293-F295 HydrophobicContact CD1-CD2 4.23Å; F293-F295 AromaticContact CD1-CE2 3.92Å; F293-F295 HydrophobicContact CD1-CE2 3.92Å; F293-F295 HydrophobicContact CE1-CE2 4.3Å
294	D	25.1	Very low	25.3	Very low	157 Å²	157	155.2 Å²	155.2	84%	0.84	80%	0.802	S	S	*	*			trans	-134.2	141.7	146.8	-162.1	-2.7	0	0	0	108.2
295	F	24.3	Very low	25.7	Very low	166 Å²	166	154.9 Å²	154.9	73%	0.728	80%	0.799	S	S	*	*			trans	-109	101.4	-173	-106.7	-94.3	0	0	0	109.2	F293	F293-F295 HydrophobicContact CD1-CD2 4.23Å; F293-F295 AromaticContact CD1-CE2 3.92Å; F293-F295 HydrophobicContact CD1-CE2 3.92Å; F293-F295 HydrophobicContact CE1-CE2 4.3Å
296	N	26.6	Very low	26.4	Very low	169 Å²	169	154 Å²	154	90%	0.904	79%	0.794	S	S	*	*			trans	-165	145.4	145.5	-97.6	-46	0	0	0	111.3	E298	N296-E298 PolarHBondContact O-N 3.44Å
297	G	26.5	Very low	26.8	Very low	84 Å²	84	150.7 Å²	150.7	87%	0.866	78%	0.779	S	S	*	*			trans	-90.2	99.4	-170.5	0	0	0	0	0	114
298	E	25.5	Very low	27.6	Very low	159 Å²	159	147.7 Å²	147.7	74%	0.743	77%	0.766	S	S	*	*			trans	-122.8	137.5	160.2	-73.7	-163.1	143.7	0	0	111.1	N296 K300	N296-E298 PolarHBondContact O-N 3.44Å; E298-K300 PolarHBondContact O-N 3.35Å; E298-K300 IonicContact OE2-NZ 3Å
299	K	23.5	Very low	28.3	Very low	217 Å²	217	145.5 Å²	145.5	94%	0.943	75%	0.751	S	S	*	*			trans	-71.9	118.8	171.4	-72	-177.9	176.9	-179.3	0	109.6
300	K	25.5	Very low	29	Very low	169 Å²	169	142.3 Å²	142.3	74%	0.735	73%	0.734	S	S	*	*			trans	-124.6	117.8	163.1	-81.3	176.5	179.2	154.5	0	110.5	E298 R302	E298-K300 PolarHBondContact O-N 3.35Å; E298-K300 IonicContact OE2-NZ 3Å; K300-R302 PolarHBondContact O-N 3.4Å
301	E	25.2	Very low	29.7	Very low	191 Å²	191	137.5 Å²	137.5	89%	0.893	72%	0.716	S	S	*	*			trans	-59.6	119	168.1	-63.6	175.7	152.1	0	0	108.8	K303	E301-K303 PolarHBondContact O-N 3.16Å; E301-K303 VanDerWaalsContact O-N 3.1Å
302	R	25.1	Very low	30.8	Very low	245 Å²	245	136.4 Å²	136.4	93%	0.925	70%	0.701	S	S	*	*			trans	-76.9	98.6	172.7	-71	-173	179.8	-171.5	1.3	108.2	K300 L304	K300-R302 PolarHBondContact O-N 3.4Å; R302-L304 PolarHBondContact O-N 3.24Å
303	K	26.9	Very low	31.6	Very low	204 Å²	204	136.3 Å²	136.3	89%	0.887	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-49.6	125.9	163.2	-74.1	-166.5	172.4	-167.9	0	108.6	E301	E301-K303 PolarHBondContact O-N 3.16Å; E301-K303 VanDerWaalsContact O-N 3.1Å
304	L	31.5	Very low	32.6	Very low	120 Å²	120	134.3 Å²	134.3	63%	0.628	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-60	139.8	176.4	-144.9	74.3	0	0	0	108.7	R302 I306 F308 T309	R302-L304 PolarHBondContact O-N 3.24Å; L304-I306 PolarHBondContact O-N 2.82Å; L304-F308 HydrophobicContact CD2-CD1 3.84Å; L304-F308 HydrophobicContact CG-CD1 4.49Å; L304-T309 HydrophobicContact CD2-CG2 4.37Å
305	S	34.4	Very low	33.4	Very low	85 Å²	85	134.1 Å²	134.1	59%	0.594	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-64.5	126.9	175.5	179.6	0	0	0	0	109.2	G307 F308	S305-G307 PolarHBondContact O-N 3.5Å; S305-G307 VanDerWaalsContact O-N 3.12Å; S305-F308 WeakPolarHBondContact O-CB 3Å; S305-F308 PolarHBondContact O-N 2.99Å
306	I	37.9	Very low	34.3	Very low	128 Å²	128	129.5 Å²	129.5	66%	0.656	65%	0.65	S	S	*	*	H	α-helix	trans	-54.9	-32	178.3	-63.5	168	0	0	0	110.9	L304 F308 T309 D310	L304-I306 PolarHBondContact O-N 2.82Å; I306-F308 VanDerWaalsContact C-N 3.25Å; I306-F308 PolarHBondContact O-N 2.93Å; I306-T309 PolarHBondContact O-N 3.47Å; I306-T309 PolarHBondContact O-OG1 2.98Å; I306-D310 PolarHBondContact O-N 3.41Å
307	G	34.2	Very low	35	Very low	47 Å²	47	127.2 Å²	127.2	49%	0.485	64%	0.637	S	S	.	*	H	α-helix	trans	-65.8	-20.1	174.9	0	0	0	0	0	115	S305 A311	S305-G307 PolarHBondContact O-N 3.5Å; S305-G307 VanDerWaalsContact O-N 3.12Å; G307-A311 WeakPolarHBondContact O-CB 3.35Å; G307-A311 PolarHBondContact O-N 3.22Å; G307-A311 VanDerWaalsContact O-N 3.08Å
308	F	42.2	Very low	35.6	Very low	126 Å²	126	129.6 Å²	129.6	55%	0.553	63%	0.63	S	S	*	*	H	α-helix	trans	-78.3	-43.4	174.1	-175.7	-95.7	0	0	0	111.4	L304 S305 I306 A311 L312	L304-F308 HydrophobicContact CD2-CD1 3.84Å; L304-F308 HydrophobicContact CG-CD1 4.49Å; S305-F308 WeakPolarHBondContact O-CB 3Å; S305-F308 PolarHBondContact O-N 2.99Å; I306-F308 VanDerWaalsContact C-N 3.25Å; I306-F308 PolarHBondContact O-N 2.93Å; F308-A311 PolarHBondContact O-N 3.04Å; F308-L312 VanDerWaalsContact O-CB 3.29Å; F308-L312 WeakPolarHBondContact O-CB 3.38Å; F308-L312 PolarHBondContact O-N 3.07Å
309	T	39	Very low	36	Very low	74 Å²	74	128 Å²	128	45%	0.454	62%	0.623	S	S	.	*	H	α-helix	trans	-64.2	-42.3	174.2	28.9	0	0	0	0	111.5	L304 I306 L312 R313	L304-T309 HydrophobicContact CD2-CG2 4.37Å; I306-T309 PolarHBondContact O-N 3.47Å; I306-T309 PolarHBondContact O-OG1 2.98Å; T309-L312 PolarHBondContact O-N 3.28Å; T309-R313 WeakPolarHBondContact O-CB 3.14Å; T309-R313 PolarHBondContact O-N 3.19Å
310	D	39	Very low	36.2	Very low	71 Å²	71	127.8 Å²	127.8	38%	0.38	62%	0.622	S	S	.	*	H	α-helix	trans	-68.4	-38.5	175.8	-82.3	-37.8	0	0	0	113.2	I306 R313 Q314	I306-D310 PolarHBondContact O-N 3.41Å; D310-R313 PolarHBondContact O-N 3.27Å; D310-R313 IonicContact OD1-NH1 3.65Å; D310-Q314 WeakPolarHBondContact O-CG 3.49Å; D310-Q314 PolarHBondContact O-N 3.29Å
311	A	41.3	Very low	36.5	Very low	58 Å²	58	124.8 Å²	124.8	48%	0.479	62%	0.617	S	S	.	*	H	α-helix	trans	-64.1	-42.8	174.6	0	0	0	0	0	112	G307 F308 Q314 Y315	G307-A311 WeakPolarHBondContact O-CB 3.35Å; G307-A311 PolarHBondContact O-N 3.22Å; G307-A311 VanDerWaalsContact O-N 3.08Å; F308-A311 PolarHBondContact O-N 3.04Å; A311-Q314 PolarHBondContact O-N 2.99Å; A311-Y315 WeakPolarHBondContact O-CB 3.33Å; A311-Y315 PolarHBondContact O-N 3.16Å
312	L	43.9	Very low	36.6	Very low	87 Å²	87	120.2 Å²	120.2	46%	0.455	61%	0.606	S	S	.	*	H	α-helix	trans	-64	-43.2	175.6	-171.6	67.2	0	0	0	111	F308 T309 Y315 L316	F308-L312 VanDerWaalsContact O-CB 3.29Å; F308-L312 WeakPolarHBondContact O-CB 3.38Å; F308-L312 PolarHBondContact O-N 3.07Å; T309-L312 PolarHBondContact O-N 3.28Å; L312-Y315 PolarHBondContact O-N 3.02Å; L312-L316 HydrophobicContact CD1-CD1 4.2Å; L312-L316 HydrophobicContact CG-CD1 3.89Å; L312-L316 WeakPolarHBondContact O-CB 3.17Å; L312-L316 WeakPolarHBondContact O-CD1 3.41Å; L312-L316 VanDerWaalsContact O-CG 3.25Å; L312-L316 WeakPolarHBondContact O-CG 3.21Å; L312-L316 PolarHBondContact O-N 3.23Å
313	R	43.6	Very low	36.7	Very low	135 Å²	135	115.1 Å²	115.1	51%	0.509	60%	0.598	S	S	.	*	H	α-helix	trans	-61.7	-45.8	176.5	-173.6	-178.3	-176.4	-163.8	5	112.1	T309 D310 L316 L317	T309-R313 WeakPolarHBondContact O-CB 3.14Å; T309-R313 PolarHBondContact O-N 3.19Å; D310-R313 PolarHBondContact O-N 3.27Å; D310-R313 IonicContact OD1-NH1 3.65Å; R313-L316 PolarHBondContact O-N 2.97Å; R313-L317 HydrophobicContact CG-CD1 3.99Å; R313-L317 WeakPolarHBondContact O-CB 3.47Å; R313-L317 VanDerWaalsContact O-CG 3.26Å; R313-L317 WeakPolarHBondContact O-CG 3.48Å; R313-L317 PolarHBondContact O-N 3.48Å
314	Q	43.4	Very low	36.6	Very low	129 Å²	129	111.1 Å²	111.1	60%	0.603	60%	0.595	S	S	*	*	H	α-helix	trans	-66.4	-38.8	176	-74.1	-168.8	6.3	0	0	112.7	D310 A311 L316 L317 N318	D310-Q314 WeakPolarHBondContact O-CG 3.49Å; D310-Q314 PolarHBondContact O-N 3.29Å; A311-Q314 PolarHBondContact O-N 2.99Å; Q314-L316 VanDerWaalsContact C-N 3.3Å; Q314-L316 PolarHBondContact O-N 2.82Å; Q314-L317 PolarHBondContact O-N 2.91Å; Q314-N318 WeakPolarHBondContact O-CB 3.39Å; Q314-N318 PolarHBondContact O-N 2.99Å; Q314-N318 VanDerWaalsContact O-N 3.12Å; Q314-N318 PolarHBondContact O-ND2 2.96Å
315	Y	42.7	Very low	36.4	Very low	153 Å²	153	107.9 Å²	107.9	60%	0.6	59%	0.591	S	S	*	*	H	α-helix	trans	-60.4	-42	175.9	-178	-97.8	0	0	0	111.8	A311 L312	A311-Y315 WeakPolarHBondContact O-CB 3.33Å; A311-Y315 PolarHBondContact O-N 3.16Å; L312-Y315 PolarHBondContact O-N 3.02Å
316	L	42.2	Very low	36.2	Very low	69 Å²	69	110.1 Å²	110.1	36%	0.361	60%	0.601	S	S	.	*	H	α-helix	trans	-75.7	-36.8	-179.4	-65.6	163.7	0	0	0	112.4	L268 L312 R313 Q314 N318 Q319	L268-L316 HydrophobicContact CD1-CB 3.68Å; L268-L316 HydrophobicContact CD1-CD1 3.57Å; L268-L316 HydrophobicContact CD1-CD2 4.07Å; L268-L316 HydrophobicContact CD1-CG 3.95Å; L268-L316 HydrophobicContact CD2-CB 4.48Å; L312-L316 HydrophobicContact CD1-CD1 4.2Å; L312-L316 HydrophobicContact CG-CD1 3.89Å; L312-L316 WeakPolarHBondContact O-CB 3.17Å; L312-L316 WeakPolarHBondContact O-CD1 3.41Å; L312-L316 VanDerWaalsContact O-CG 3.25Å; L312-L316 WeakPolarHBondContact O-CG 3.21Å; L312-L316 PolarHBondContact O-N 3.23Å; R313-L316 PolarHBondContact O-N 2.97Å; Q314-L316 VanDerWaalsContact C-N 3.3Å; Q314-L316 PolarHBondContact O-N 2.82Å; L316-N318 VanDerWaalsContact C-N 3.28Å; L316-N318 PolarHBondContact O-N 3.34Å; L316-Q319 PolarHBondContact O-N 3.3Å
317	L	40.8	Very low	35.6	Very low	120 Å²	120	105.9 Å²	105.9	63%	0.628	59%	0.589	S	S	*	*	H	α-helix	trans	-66.1	-26.3	174.1	-74.9	170	0	0	0	113.6	R313 Q314 Q319	R313-L317 HydrophobicContact CG-CD1 3.99Å; R313-L317 WeakPolarHBondContact O-CB 3.47Å; R313-L317 VanDerWaalsContact O-CG 3.26Å; R313-L317 WeakPolarHBondContact O-CG 3.48Å; R313-L317 PolarHBondContact O-N 3.48Å; Q314-L317 PolarHBondContact O-N 2.91Å; L317-Q319 VanDerWaalsContact C-N 3.29Å; L317-Q319 PolarHBondContact O-N 3.14Å
318	N	39.4	Very low	35.2	Very low	135 Å²	135	111 Å²	111	72%	0.722	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-7.2	179.6	-81.7	-33.3	0	0	0	114.3	Q314 L316 K320	Q314-N318 WeakPolarHBondContact O-CB 3.39Å; Q314-N318 PolarHBondContact O-N 2.99Å; Q314-N318 VanDerWaalsContact O-N 3.12Å; Q314-N318 PolarHBondContact O-ND2 2.96Å; L316-N318 VanDerWaalsContact C-N 3.28Å; L316-N318 PolarHBondContact O-N 3.34Å; N318-K320 PolarHBondContact O-N 2.88Å
319	Q	33.5	Very low	34.4	Very low	126 Å²	126	111 Å²	111	59%	0.589	60%	0.603	S	S	*	*	S	Bend	trans	-88.3	96.7	170.3	-66.8	-158	11	0	0	111.2	L316 L317 V321	L316-Q319 PolarHBondContact O-N 3.3Å; L317-Q319 VanDerWaalsContact C-N 3.29Å; L317-Q319 PolarHBondContact O-N 3.14Å; Q319-V321 PolarHBondContact O-N 3.08Å
320	K	28.5	Very low	33.7	Very low	211 Å²	211	116.1 Å²	116.1	92%	0.917	62%	0.615	S	S	*	*			trans	-61.4	106.2	168	-76.2	-176.5	174.3	-179.2	0	110.6	N318	N318-K320 PolarHBondContact O-N 2.88Å
321	V	32	Very low	33.1	Very low	106 Å²	106	118.2 Å²	118.2	64%	0.642	63%	0.631	S	S	*	*			trans	-134.7	133.9	167.7	-175.3	0	0	0	0	108.6	Q319	Q319-V321 PolarHBondContact O-N 3.08Å
322	S	26.9	Very low	32.3	Very low	95 Å²	95	119.6 Å²	119.6	66%	0.664	64%	0.637	S	S	*	*			trans	-93.1	146	-176.8	53	0	0	0	0	113.3
323	D	26.7	Very low	31.4	Very low	139 Å²	139	121.8 Å²	121.8	74%	0.743	65%	0.654	S	S	*	*	S	Bend	trans	66.1	120.3	154.2	-53.5	-27.7	0	0	0	121.8
324	S	25.8	Very low	30.5	Very low	119 Å²	119	120.3 Å²	120.3	83%	0.832	66%	0.66	S	S	*	*			trans	65.5	101.3	145.7	67.3	0	0	0	0	119.5
325	G	27.8	Very low	29.6	Very low	52 Å²	52	117.4 Å²	117.4	54%	0.536	66%	0.664	S	S	.	*			trans	153.2	113	159.1	0	0	0	0	0	114.1	P269	P269-G325 WeakPolarHBondContact CB-O 3.46Å
326	T	28.5	Very low	28.8	Very low	132 Å²	132	116.3 Å²	116.3	81%	0.81	67%	0.669	S	S	*	*			trans	-87.3	138.4	175.1	47.1	0	0	0	0	112.1
327	G	26.4	Very low	27.9	Very low	39 Å²	39	121 Å²	121	40%	0.402	69%	0.694	S	S	.	*			trans	-150.1	158.3	170.3	0	0	0	0	0	111
328	F	26	Very low	27.3	Very low	156 Å²	156	121.7 Å²	121.7	68%	0.684	70%	0.698	S	S	*	*			trans	-99.4	148.2	-176.2	-60.1	-83	0	0	0	111.8	Y330	F328-Y330 HydrophobicContact CB-CE2 4.33Å
329	L	25.7	Very low	26.5	Very low	126 Å²	126	123.2 Å²	123.2	66%	0.66	70%	0.701	S	S	*	*			trans	-115.6	121.4	173.2	-168.7	79	0	0	0	109.3	F361	L329-F361 HydrophobicContact CD1-CD1 4.15Å
330	Y	24.6	Very low	26.1	Very low	180 Å²	180	125.8 Å²	125.8	71%	0.706	71%	0.71	S	S	*	*			trans	-99.4	129.5	172.6	-72.9	-87.9	0	0	0	110.4	F328	F328-Y330 HydrophobicContact CB-CE2 4.33Å
331	V	25.5	Very low	26.1	Very low	116 Å²	116	121.6 Å²	121.6	70%	0.703	70%	0.702	S	S	*	*			trans	-98.1	107.2	166.3	-179.9	0	0	0	0	107.6
332	S	24.5	Very low	25.8	Very low	86 Å²	86	123 Å²	123	60%	0.601	70%	0.702	S	S	*	*			trans	-110.3	126	176.8	-176.1	0	0	0	0	110.2	T334	S332-T334 PolarHBondContact O-N 3.05Å
333	T	24.4	Very low	25.7	Very low	133 Å²	133	127.6 Å²	127.6	82%	0.816	70%	0.704	S	S	*	*			trans	-91.4	84.9	170.7	52.2	0	0	0	0	109.6	G335	T333-G335 PolarHBondContact O-N 3.42Å
334	T	25.8	Very low	25.6	Very low	105 Å²	105	128.9 Å²	128.9	64%	0.644	71%	0.706	S	S	*	*			trans	-72	95.4	173.8	52.8	0	0	0	0	110.4	S332	S332-T334 PolarHBondContact O-N 3.05Å
335	G	25	Very low	25.7	Very low	67 Å²	67	132.5 Å²	132.5	69%	0.691	71%	0.707	S	S	*	*			trans	-83	121.9	164.2	0	0	0	0	0	110	T333 L337	T333-G335 PolarHBondContact O-N 3.42Å; G335-L337 PolarHBondContact O-N 2.76Å; G335-L337 VanDerWaalsContact O-N 3.16Å
336	N	25.4	Very low	25.6	Very low	130 Å²	130	136.8 Å²	136.8	70%	0.695	71%	0.713	S	S	*	*			trans	-69	109.8	170.6	-100.4	49	0	0	0	109.7	D338	N336-D338 WeakPolarHBondContact CB-OD2 3.3Å; N336-D338 PolarHBondContact ND2-OD2 3.29Å; N336-D338 PolarHBondContact O-N 3.45Å
337	L	23.7	Very low	25.4	Very low	169 Å²	169	138.5 Å²	138.5	89%	0.885	71%	0.709	S	S	*	*			trans	-92.9	75	161.5	-81	166.4	0	0	0	108.4	G335 E339	G335-L337 PolarHBondContact O-N 2.76Å; G335-L337 VanDerWaalsContact O-N 3.16Å; L337-E339 PolarHBondContact O-N 2.85Å
338	D	26.4	Very low	25.3	Very low	134 Å²	134	145.1 Å²	145.1	72%	0.717	73%	0.729	S	S	*	*			trans	-78.3	97.5	168.8	-68.3	-56.9	0	0	0	108.7	N336	N336-D338 WeakPolarHBondContact CB-OD2 3.3Å; N336-D338 PolarHBondContact ND2-OD2 3.29Å; N336-D338 PolarHBondContact O-N 3.45Å
339	E	24.4	Very low	25.4	Very low	167 Å²	167	144.9 Å²	144.9	78%	0.78	74%	0.741	S	S	*	*			trans	-101.8	136.6	179.2	-163.8	-178.4	-120.2	0	0	111.1	L337	L337-E339 PolarHBondContact O-N 2.85Å
340	K	25	Very low	25.2	Very low	180 Å²	180	146.6 Å²	146.6	78%	0.783	75%	0.75	S	S	*	*			trans	79.2	138.7	-170.5	-47.3	158.8	-174.1	167.9	0	112.4
341	T	28.5	Very low	25.1	Very low	122 Å²	122	145.6 Å²	145.6	75%	0.748	76%	0.756	S	S	*	*			cis	-150.4	138.2	17.2	-32.6	0	0	0	0	112.7
342	E	25.1	Very low	25	Very low	137 Å²	137	144.6 Å²	144.6	64%	0.64	76%	0.76	S	S	*	*			trans	39.2	130.6	152.7	-68.4	-163.7	102.7	0	0	126
343	R	24	Very low	25.1	Very low	190 Å²	190	147.4 Å²	147.4	72%	0.717	77%	0.774	S	S	*	*			trans	73.5	112.1	137.5	-70.7	-172.3	-122	173.4	6.6	123.2
344	E	25.2	Very low	25.1	Very low	167 Å²	167	149.7 Å²	149.7	78%	0.78	78%	0.775	S	S	*	*				48.8	108.9	128.5	-55.3	-173.6	149.9	0	0	121.3
345	K	27.1	Very low	25.1	Very low	195 Å²	195	152.1 Å²	152.1	85%	0.848	78%	0.779	S	S	*	*				-172.5	168.4	97.9	-103.8	176	-176.8	178.8	0	115.9
346	E	26.4	Very low	25.1	Very low	141 Å²	141	157 Å²	157	66%	0.659	78%	0.781	S	S	*	*			trans	-63.1	143.9	-161.2	-63.3	-179.7	85.1	0	0	119.7
347	K	24.1	Very low	25.1	Very low	169 Å²	169	158.7 Å²	158.7	74%	0.735	78%	0.779	S	S	*	*			trans	62.7	145.4	131.8	-69.3	173.3	-175	146.1	0	122.9
348	E	24.8	Very low	25.1	Very low	177 Å²	177	155.7 Å²	155.7	83%	0.827	77%	0.768	S	S	*	*			trans	63.5	73.7	153.8	-70.4	-178.4	-164.9	0	0	119.1
349	T	26.8	Very low	25.2	Very low	152 Å²	152	157.4 Å²	157.4	93%	0.933	77%	0.766	S	S	*	*				-140.3	132.8	120.7	-31.1	0	0	0	0	110.4
350	L	22.6	Very low	25.2	Very low	161 Å²	161	153.8 Å²	153.8	84%	0.843	76%	0.755	S	S	*	*			trans	-110.1	108.2	-176.8	-179.4	145.2	0	0	0	109.3
351	L	23.1	Very low	25.3	Very low	160 Å²	160	152.1 Å²	152.1	84%	0.838	75%	0.748	S	S	*	*			trans	-175.2	134.1	158	-106.3	157.4	0	0	0	113.1
352	A	23.7	Very low	25.2	Very low	95 Å²	95	151.9 Å²	151.9	79%	0.785	74%	0.741	S	S	*	*			trans	43.7	88.3	153.7	0	0	0	0	0	120.3
353	T	25.9	Very low	25.2	Very low	145 Å²	145	153 Å²	153	89%	0.89	74%	0.74	S	S	*	*			trans	-118.9	99.7	154.9	-0.1	0	0	0	0	110.7
354	Q	24.7	Very low	25.2	Very low	181 Å²	181	153 Å²	153	85%	0.846	75%	0.746	S	S	*	*			trans	-73.4	123.8	165.9	-76.1	-175.6	-22.3	0	0	109.4	K356	Q354-K356 PolarHBondContact O-N 2.85Å
355	Q	25.6	Very low	25.1	Very low	155 Å²	155	151.7 Å²	151.7	72%	0.724	73%	0.734	S	S	*	*			trans	-70.5	98.7	166	-76.3	-176.5	-30.6	0	0	109.7	Y357	Q355-Y357 HydrophobicContact CB-CE2 4.04Å; Q355-Y357 PolarHBondContact O-N 3.45Å; Q355-Y357 PolarHBondContact OE1-OH 3.44Å
356	K	24.3	Very low	25.1	Very low	170 Å²	170	148.5 Å²	148.5	74%	0.739	73%	0.733	S	S	*	*			trans	-69.7	105.4	166.2	-90.9	-175.2	170.4	-178.7	0	109.4	Q354 T358	Q354-K356 PolarHBondContact O-N 2.85Å; K356-T358 PolarHBondContact O-N 2.97Å
357	Y	26.2	Very low	25	Very low	166 Å²	166	145.9 Å²	145.9	65%	0.651	73%	0.727	S	S	*	*			trans	-77.9	100.2	162.7	-71.2	-86.5	0	0	0	109	Q355 Y359	Q355-Y357 HydrophobicContact CB-CE2 4.04Å; Q355-Y357 PolarHBondContact O-N 3.45Å; Q355-Y357 PolarHBondContact OE1-OH 3.44Å; Y357-Y359 PolarHBondContact O-N 3Å
358	T	23.3	Very low	25.1	Very low	105 Å²	105	145.7 Å²	145.7	64%	0.644	73%	0.734	S	S	*	*			trans	-84.2	108	177.3	-55.7	0	0	0	0	109.8	K356 T360	K356-T358 PolarHBondContact O-N 2.97Å; T358-T360 PolarHBondContact O-N 3.17Å
359	Y	28.1	Very low	25.1	Very low	171 Å²	171	145.8 Å²	145.8	67%	0.671	74%	0.739	S	S	*	*			trans	-82.3	100.6	174.4	-65.4	-85.3	0	0	0	110.3	Y357 F361	Y357-Y359 PolarHBondContact O-N 3Å; Y359-F361 PolarHBondContact O-N 3.27Å
360	T	24.1	Very low	25.2	Very low	90 Å²	90	143.2 Å²	143.2	55%	0.552	73%	0.727	S	S	*	*			trans	-88.4	103.1	-179.4	-54.7	0	0	0	0	110.9	T358 I362	T358-T360 PolarHBondContact O-N 3.17Å; T360-I362 HydrophobicContact CG2-CG1 4.09Å; T360-I362 PolarHBondContact O-N 3.18Å
361	F	27.6	Very low	25.5	Very low	145 Å²	145	144.2 Å²	144.2	64%	0.636	73%	0.727	S	S	*	*			trans	-80.9	106.2	174.9	-62.5	-79.7	0	0	0	111	L329 Y359	L329-F361 HydrophobicContact CD1-CD1 4.15Å; Y359-F361 PolarHBondContact O-N 3.27Å
362	I	25.7	Very low	25.8	Very low	118 Å²	118	142.3 Å²	142.3	61%	0.605	72%	0.722	S	S	*	*			trans	-92.2	106.6	178.7	-57.1	178.1	0	0	0	109.8	T360	T360-I362 HydrophobicContact CG2-CG1 4.09Å; T360-I362 PolarHBondContact O-N 3.18Å
363	Y	25.6	Very low	26.1	Very low	159 Å²	159	143.5 Å²	143.5	62%	0.624	72%	0.716	S	S	*	*			trans	-88.8	112.3	168.8	-177.4	-86.7	0	0	0	109.6	R365	Y363-R365 HydrophobicContact CE1-CB 4.39Å
364	K	24.6	Very low	26.2	Very low	191 Å²	191	142.5 Å²	142.5	83%	0.83	71%	0.705	S	S	*	*			trans	-113.5	123.4	176.5	-156.4	176.7	-173.8	-176.5	0	110.1
365	R	23.5	Very low	26.3	Very low	140 Å²	140	141.3 Å²	141.3	53%	0.528	70%	0.704	S	S	.	*			trans	-88.8	136.5	179.9	-172.5	-172.6	-66.4	159.1	4.1	110.2	Y363 T367	Y363-R365 HydrophobicContact CE1-CB 4.39Å; R365-T367 VanDerWaalsContact C-N 3.26Å; R365-T367 WeakPolarHBondContact CD-OG1 3.22Å; R365-T367 HydrophobicContact CG-CG2 4.46Å; R365-T367 PolarHBondContact O-N 3.48Å
366	P	25.6	Very low	26.5	Very low	128 Å²	128	138.3 Å²	138.3	83%	0.831	71%	0.706	S	S	*	*	S	Bend	trans	-82.3	68.4	174.3	34.5	-35.5	0	0	0	111.3
367	T	25.4	Very low	26.7	Very low	86 Å²	86	139 Å²	139	53%	0.528	71%	0.712	S	S	.	*			trans	-146.8	93.3	168.5	52.6	0	0	0	0	108	R365	R365-T367 VanDerWaalsContact C-N 3.26Å; R365-T367 WeakPolarHBondContact CD-OG1 3.22Å; R365-T367 HydrophobicContact CG-CG2 4.46Å; R365-T367 PolarHBondContact O-N 3.48Å
368	D	26.4	Very low	26.7	Very low	165 Å²	165	138.6 Å²	138.6	88%	0.882	72%	0.721	S	S	*	*			trans	173.4	84.3	159	-84.8	-22.6	0	0	0	106.5
369	L	25	Very low	26.9	Very low	179 Å²	179	138 Å²	138	94%	0.937	73%	0.727	S	S	*	*			trans	-149.7	77.3	179.7	-103.5	176.1	0	0	0	109.9
370	S	28.1	Very low	26.9	Very low	98 Å²	98	138.5 Å²	138.5	69%	0.685	74%	0.735	S	S	*	*			trans	-165.5	117.3	170.7	52.3	0	0	0	0	109.1
371	E	29.1	Very low	26.9	Very low	182 Å²	182	138.8 Å²	138.8	85%	0.85	74%	0.741	S	S	*	*			trans	54.8	133	149.3	-63.6	150.9	-159.5	0	0	118.2
372	T	29.5	Very low	26.8	Very low	119 Å²	119	139.4 Å²	139.4	73%	0.73	75%	0.748	S	S	*	*			cis	-161.4	174.9	0	18.8	0	0	0	0	106.6
373	D	29.1	Very low	26.7	Very low	121 Å²	121	140.7 Å²	140.7	65%	0.647	76%	0.755	S	S	*	*			cis	-155.4	156	10.4	-131.9	-2.3	0	0	0	111.4
374	N	28.2	Very low	26.6	Very low	123 Å²	123	135.9 Å²	135.9	66%	0.658	75%	0.753	S	S	*	*			trans	38	146.6	149.8	-54.2	-37.8	0	0	0	125.2
375	D	27.9	Very low	26.6	Very low	157 Å²	157	132 Å²	132	84%	0.84	75%	0.75	S	S	*	*			trans	64.8	125.2	160.3	-51	-23.5	0	0	0	118.5
376	A	29.6	Very low	26.6	Very low	92 Å²	92	135.8 Å²	135.8	76%	0.76	76%	0.764	S	S	*	*			cis	-144	178.6	12	0	0	0	0	0	113.7
377	E	28	Very low	26.4	Very low	183 Å²	183	136.6 Å²	136.6	86%	0.855	76%	0.761	S	S	*	*			trans	-43.5	152.2	176.7	-62.8	148.7	147.3	0	0	113.6
378	D	27.2	Very low	26.4	Very low	159 Å²	159	143.9 Å²	143.9	85%	0.85	78%	0.779	S	S	*	*			cis	-159	173.4	43.9	-144	-24.6	0	0	0	113.6
379	A	26.8	Very low	26.2	Very low	93 Å²	93	144.4 Å²	144.4	77%	0.769	77%	0.773	S	S	*	*			trans	73.9	112.7	177.4	0	0	0	0	0	118.5
380	E	27.1	Very low	26.1	Very low	180 Å²	180	141.2 Å²	141.2	84%	0.841	77%	0.766	S	S	*	*			trans	-67.3	149.8	-178.4	-56.2	178.1	119.4	0	0	113.1
381	S	24.9	Very low	26	Very low	96 Å²	96	142 Å²	142	67%	0.671	77%	0.771	S	S	*	*			cis	69.3	142.2	43.3	121.4	0	0	0	0	113.8
382	M	24.9	Very low	25.7	Very low	158 Å²	158	141.9 Å²	141.9	78%	0.778	78%	0.776	S	S	*	*			cis	-161.5	164.2	-9.4	-126.7	-179.4	-177.1	0	0	111.5
383	I	23.9	Very low	25.4	Very low	146 Å²	146	139.2 Å²	139.2	75%	0.749	77%	0.772	S	S	*	*			trans	7.2	140.5	144.5	-58.1	162.3	0	0	0	117.9
384	G	23.4	Very low	25.2	Very low	58 Å²	58	142.7 Å²	142.7	60%	0.598	78%	0.781	S	S	*	*			cis	136.6	130.7	0.6	0	0	0	0	0	114.6
385	S	25	Very low	24.9	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	79%	0.792	S	S	*	*			trans	54.7	116.8	161.3	75.4	0	0	0	0	121.1
386	R	23.3	Very low	24.7	Very low	220 Å²	220	150 Å²	150	83%	0.83	79%	0.793	S	S	*	*				165.8	140	104.4	-90.4	179.9	178.7	-168.1	-0.9	113.7
387	L	22.4	Very low	24.5	Very low	144 Å²	144	154.5 Å²	154.5	75%	0.754	80%	0.799	S	S	*	*			trans	46.6	113.3	144.4	-61.7	167.4	0	0	0	119.3
388	W	24.7	Very low	24.7	Very low	239 Å²	239	150.9 Å²	150.9	91%	0.905	79%	0.791	S	S	*	*				173.3	-174.1	85.5	-138.7	59.1	0	0	0	111.3
389	K	22.7	Very low	24.6	Very low	176 Å²	176	148.6 Å²	148.6	77%	0.765	79%	0.788	S	S	*	*			trans	-92.4	144	-171.1	-66.6	-178	177.3	178.8	0	114.9
390	S	22	Very low	24.5	Very low	112 Å²	112	148.4 Å²	148.4	78%	0.783	78%	0.781	S	S	*	*			trans	54.8	97.8	141.4	64.5	0	0	0	0	120.9
391	S	25.7	Very low	24.4	Very low	115 Å²	115	151.5 Å²	151.5	80%	0.804	79%	0.787	S	S	*	*				-154.9	113.2	116.6	59.3	0	0	0	0	108.4
392	L	23.7	Very low	24.5	Very low	179 Å²	179	153 Å²	153	94%	0.937	79%	0.786	S	S	*	*				58.4	83.4	75.2	-139.8	-177.7	0	0	0	112.5
393	G	23.1	Very low	24.6	Very low	63 Å²	63	154.3 Å²	154.3	65%	0.649	79%	0.79	S	S	*	*			trans	139.3	87.7	158.8	0	0	0	0	0	117.3
394	F	25.1	Very low	24.7	Very low	194 Å²	194	153.6 Å²	153.6	85%	0.851	79%	0.787	S	S	*	*			trans	-153.4	112	131.5	-114.4	-70.5	0	0	0	111.9
395	K	22.5	Very low	24.9	Very low	200 Å²	200	160.2 Å²	160.2	87%	0.87	80%	0.803	S	S	*	*			trans	-76.4	122.9	161	-80.7	-178.3	173.1	-179.8	0	108.3
396	R	24.1	Very low	24.8	Very low	233 Å²	233	160.2 Å²	160.2	88%	0.879	80%	0.803	S	S	*	*			trans	-163.3	110.9	149.4	-109.8	162.8	-165.4	-160	3	112.1
397	Q	24.3	Very low	25.2	Very low	187 Å²	187	158.5 Å²	158.5	87%	0.874	80%	0.804	S	S	*	*			trans	-158.5	160	167.3	-99	-154.6	1.3	0	0	106.9
398	P	31.3	Very low	25.4	Very low	107 Å²	107	159.6 Å²	159.6	70%	0.695	81%	0.81	S	S	*	*			cis	-137	-176	-39.5	37.5	-21	0	0	0	111.4
399	S	25	Very low	25.5	Very low	111 Å²	111	153.8 Å²	153.8	78%	0.776	81%	0.805	S	S	*	*			trans	-146.7	91	156.6	56.8	0	0	0	0	108.6
400	S	26.2	Very low	25.7	Very low	90 Å²	90	154.6 Å²	154.6	63%	0.629	81%	0.811	S	S	*	*				78.4	97	76.4	71.3	0	0	0	0	113.1
401	Y	24.2	Very low	26	Very low	244 Å²	244	155.6 Å²	155.6	96%	0.957	82%	0.815	S	S	*	*			trans	-65.8	140	154.6	-102.4	-96.2	0	0	0	109.1
402	I	26.7	Very low	26.1	Very low	128 Å²	128	154.3 Å²	154.3	66%	0.656	81%	0.811	S	S	*	*			trans	-106.1	139.5	-179.2	-65.6	172.1	0	0	0	109
403	H	28.1	Very low	26.4	Very low	186 Å²	186	154.5 Å²	154.5	86%	0.861	81%	0.807	S	S	*	*			trans	-128.8	138.6	149.1	-143.2	-77.2	0	0	0	109.7
404	N	25	Very low	26.6	Very low	130 Å²	130	156 Å²	156	70%	0.695	81%	0.808	S	S	*	*			trans	-79.1	140.3	-166.6	-62.9	-43.9	0	0	0	113
405	Q	27.9	Very low	26.6	Very low	197 Å²	197	153.3 Å²	153.3	92%	0.921	80%	0.802	S	S	*	*				-161.5	145.9	113.5	-107.3	176.8	11.6	0	0	111.3
406	S	23.1	Very low	26.8	Very low	110 Å²	110	150.4 Å²	150.4	77%	0.769	79%	0.792	S	S	*	*			trans	-147.2	114.5	-173.9	58.3	0	0	0	0	111.6
407	Q	30.6	Very low	26.8	Very low	184 Å²	184	146.3 Å²	146.3	86%	0.86	78%	0.783	S	S	*	*			trans	-167.6	105.9	160.3	-116.1	176.7	22.9	0	0	111.5
408	L	28.2	Very low	26.8	Very low	167 Å²	167	144.2 Å²	144.2	87%	0.874	77%	0.773	S	S	*	*				166.6	154.4	111.8	-93	159.2	0	0	0	111.5
409	C	25.4	Very low	26.4	Very low	117 Å²	117	146.9 Å²	146.9	79%	0.791	77%	0.774	S	S	*	*			trans	-113.6	145.8	-174.4	-56.4	0	0	0	0	111
410	Q	27.7	Very low	26.4	Very low	193 Å²	193	149.2 Å²	149.2	90%	0.902	77%	0.772	S	S	*	*				161.4	133	123.5	-89.4	-179.8	8.7	0	0	112.2
411	P	27.4	Very low	26.3	Very low	133 Å²	133	151.3 Å²	151.3	86%	0.864	78%	0.776	S	S	*	*			trans	-116.2	141.5	168	37.1	-27.1	0	0	0	114
412	A	29	Very low	26.3	Very low	88 Å²	88	148.7 Å²	148.7	73%	0.727	77%	0.766	S	S	*	*			trans	-149.8	115.1	164.7	0	0	0	0	0	109.1
413	Q	30.2	Very low	26.2	Very low	182 Å²	182	148 Å²	148	85%	0.85	76%	0.764	S	S	*	*				66.4	115.5	103.4	-68.8	-176.9	-12.4	0	0	114.4
414	S	26.4	Very low	26.1	Very low	95 Å²	95	148.6 Å²	148.6	66%	0.664	76%	0.764	S	S	*	*				71.8	135.3	58.1	76.4	0	0	0	0	113.8
415	N	25.6	Very low	26	Very low	137 Å²	137	151.2 Å²	151.2	73%	0.733	77%	0.769	S	S	*	*			cis	-163.8	-175.8	6.2	-111.4	12.4	0	0	0	108.2
416	Q	25.8	Very low	26.1	Very low	139 Å²	139	146.5 Å²	146.5	65%	0.65	76%	0.756	S	S	*	*			cis	-160.4	170.8	6.9	-138.4	159.7	-84.5	0	0	112.9
417	Q	24.3	Very low	26.2	Very low	148 Å²	148	147.5 Å²	147.5	69%	0.692	75%	0.753	S	S	*	*			trans	19.8	137.4	147.5	-79.3	170.5	-27.4	0	0	124.7
418	Q	24	Very low	26.1	Very low	143 Å²	143	147.2 Å²	147.2	67%	0.668	75%	0.751	S	S	*	*			trans	79.7	129.2	140.9	-74.5	-166	39.1	0	0	124.1
419	K	23.6	Very low	26	Very low	162 Å²	162	144.5 Å²	144.5	70%	0.704	74%	0.742	S	S	*	*			trans	69.9	124.5	138.9	-74.2	-179.5	178.1	171.7	0	123.5
420	Q	25	Very low	26.2	Very low	161 Å²	161	146 Å²	146	75%	0.752	75%	0.747	S	S	*	*			trans	69.9	112.9	136.3	-67.2	178.4	-62.4	0	0	121.6
421	N	23.8	Very low	26.3	Very low	133 Å²	133	144.3 Å²	144.3	71%	0.711	74%	0.74	S	S	*	*			trans	44.4	129.2	130.9	-62.5	9.3	0	0	0	119.6
422	Y	25	Very low	26.4	Very low	190 Å²	190	143 Å²	143	75%	0.745	74%	0.74	S	S	*	*			cis	176.5	152.7	46.5	-123.1	-47	0	0	0	111.5
423	N	23.1	Very low	26.3	Very low	113 Å²	113	144.5 Å²	144.5	60%	0.604	74%	0.74	S	S	*	*			trans	64.4	98.8	147.7	-68	-25.9	0	0	0	123.6
424	K	26.4	Very low	26.2	Very low	199 Å²	199	142.3 Å²	142.3	87%	0.865	74%	0.739	S	S	*	*				176.5	125.5	112.9	-93.5	164.7	-176.2	178.9	0	107.9
425	F	23.8	Very low	26.3	Very low	185 Å²	185	141.7 Å²	141.7	81%	0.811	74%	0.74	S	S	*	*				57.7	141.5	53.4	-81.5	-81	0	0	0	114.1
426	P	29.4	Very low	26.3	Very low	98 Å²	98	139.4 Å²	139.4	64%	0.636	74%	0.74	S	S	*	*			cis	-141.5	-173.3	13.1	43.9	-25	0	0	0	117.3
427	N	24.6	Very low	26.2	Very low	131 Å²	131	139.4 Å²	139.4	70%	0.701	75%	0.75	S	S	*	*			trans	63.8	134.7	143.5	-71.7	-5.5	0	0	0	124
428	Q	29.7	Very low	26.2	Very low	177 Å²	177	141.7 Å²	141.7	83%	0.827	76%	0.76	S	S	*	*			trans	63.9	150.4	147.5	-67.5	172.5	-1.9	0	0	118.9
429	T	26.7	Very low	26.2	Very low	110 Å²	110	137.8 Å²	137.8	68%	0.675	76%	0.757	S	S	*	*			cis	168.3	120.4	-27	-87.8	0	0	0	0	103.4	Q431	T429-Q431 HydrophobicContact CG2-CG 4.06Å
430	T	29.3	Very low	26.2	Very low	149 Å²	149	141.2 Å²	141.2	91%	0.914	77%	0.768	S	S	*	*			trans	-133.1	130.4	157.5	-36.2	0	0	0	0	107.3
431	Q	29.2	Very low	26.1	Very low	158 Å²	158	140.3 Å²	140.3	74%	0.738	77%	0.766	S	S	*	*			trans	-99.8	144.2	-171.2	-69.5	177.3	-39.1	0	0	112.6	T429	T429-Q431 HydrophobicContact CG2-CG 4.06Å
432	A	28.7	Very low	26.2	Very low	106 Å²	106	142.2 Å²	142.2	88%	0.876	77%	0.771	S	S	*	*			trans	-129.8	94.5	149	0	0	0	0	0	108.1
433	T	27.4	Very low	26	Very low	118 Å²	118	137.2 Å²	137.2	72%	0.724	76%	0.764	S	S	*	*			trans	-53.5	157.3	172.7	-2.8	0	0	0	0	111.8
434	V	28.4	Very low	26	Very low	136 Å²	136	136.4 Å²	136.4	82%	0.824	77%	0.767	S	S	*	*			cis	-153.9	151.8	22.1	-176.2	0	0	0	0	106.4
435	A	27.6	Very low	25.9	Very low	83 Å²	83	136.9 Å²	136.9	69%	0.686	77%	0.765	S	S	*	*			cis	-151	170.1	-6.9	0	0	0	0	0	106.5
436	A	25.3	Very low	25.9	Very low	88 Å²	88	134.3 Å²	134.3	73%	0.727	76%	0.759	S	S	*	*			cis	80.2	125.2	34.5	0	0	0	0	0	114.6
437	T	25.5	Very low	25.6	Very low	140 Å²	140	136.6 Å²	136.6	86%	0.859	77%	0.766	S	S	*	*			cis	-163.6	156.4	1.9	-7	0	0	0	0	113.5
438	H	23.2	Very low	25.6	Very low	196 Å²	196	135.5 Å²	135.5	91%	0.907	77%	0.768	S	S	*	*			trans	-69.3	161.3	153.2	-80.5	-86.5	0	0	0	110.3
439	G	23.6	Very low	25.3	Very low	60 Å²	60	131.4 Å²	131.4	62%	0.619	76%	0.759	S	S	*	*			cis	166	-135.5	5.7	0	0	0	0	0	110.8
440	Y	24.4	Very low	25.4	Very low	235 Å²	235	131.9 Å²	131.9	92%	0.922	76%	0.762	S	S	*	*			trans	86.8	163.2	176.3	-79.4	-79.6	0	0	0	119.8
441	I	23.2	Very low	25.2	Very low	141 Å²	141	135 Å²	135	72%	0.723	76%	0.757	S	S	*	*			trans	-140.1	125.9	-150	-51	163.2	0	0	0	109.3
442	H	24.9	Very low	25.1	Very low	173 Å²	173	133.9 Å²	133.9	80%	0.801	76%	0.756	S	S	*	*				-176.8	157.4	120.3	-120.7	-89.9	0	0	0	115.8
443	S	22.2	Very low	25.1	Very low	85 Å²	85	133.6 Å²	133.6	59%	0.594	75%	0.748	S	S	*	*			trans	-33	137.3	174.3	53.4	0	0	0	0	120.7
444	S	22.8	Very low	25	Very low	96 Å²	96	140.3 Å²	140.3	67%	0.671	76%	0.76	S	S	*	*				59.4	120.7	129.4	-50.9	0	0	0	0	121.1
445	Y	24.8	Very low	24.8	Very low	209 Å²	209	145.2 Å²	145.2	82%	0.82	76%	0.763	S	S	*	*				-176.7	147.3	93.4	-101.9	-69.9	0	0	0	114.4
446	N	22.7	Very low	24.8	Very low	131 Å²	131	152.8 Å²	152.8	70%	0.701	77%	0.774	S	S	*	*			trans	50.2	116.6	147.9	-76.2	-7.1	0	0	0	123.9
447	L	23.5	Very low	24.8	Very low	147 Å²	147	158.8 Å²	158.8	77%	0.77	78%	0.784	S	S	*	*				61.1	119.4	113.7	-122.1	82.8	0	0	0	121.1
448	S	23.4	Very low	24.6	Very low	107 Å²	107	161.9 Å²	161.9	75%	0.748	79%	0.786	S	S	*	*			trans	66	153.6	141.6	76.8	0	0	0	0	119.2
449	S	24.1	Very low	25.2	Very low	91 Å²	91	157.4 Å²	157.4	64%	0.636	77%	0.774	S	S	*	*			cis	-172.6	-174.6	-27.1	59.2	0	0	0	0	107.4
450	T	29.1	Very low	25.1	Very low	120 Å²	120	159.4 Å²	159.4	74%	0.736	78%	0.779	S	S	*	*			trans	74.7	142	172.2	84.9	0	0	0	0	115.7
451	R	26.1	Very low	25.3	Very low	214 Å²	214	156.3 Å²	156.3	81%	0.808	77%	0.772	S	S	*	*			cis	-159.4	171.2	-15.4	-131.4	178.8	178.8	151	-0	112.3
452	N	26.7	Very low	25.3	Very low	136 Å²	136	157 Å²	157	73%	0.727	78%	0.776	S	S	*	*			trans	81	143.1	157.9	-58.1	-20.3	0	0	0	118.4
453	S	28	Very low	25.4	Very low	100 Å²	100	159.5 Å²	159.5	70%	0.699	78%	0.78	S	S	*	*			cis	-171.8	127	-30	48.1	0	0	0	0	111.3
454	R	25.8	Very low	25.7	Very low	259 Å²	259	160.7 Å²	160.7	98%	0.977	78%	0.784	S	S	*	*			trans	-138.6	144	147	-75	-164.9	172.7	179.2	-1.3	109.8
455	R	24.7	Very low	25.7	Very low	238 Å²	238	162.8 Å²	162.8	90%	0.898	79%	0.787	S	S	*	*			trans	-111.5	142.2	-173.6	-71.5	174	167.9	172.9	-5.1	111.4
456	R	26.4	Very low	25.8	Very low	242 Å²	242	161.2 Å²	161.2	91%	0.913	79%	0.785	S	S	*	*			trans	172.2	100.1	138.1	-93	157.8	-168.5	-155.6	3.6	106.1
457	K	25.6	Very low	26	Very low	215 Å²	215	162.6 Å²	162.6	94%	0.935	79%	0.792	S	S	*	*				79	141.8	85.4	-90.1	-160.2	169.6	-167.3	0	113.5
458	F	20.9	Very low	26.1	Very low	204 Å²	204	164.3 Å²	164.3	90%	0.895	79%	0.793	S	S	*	*			trans	-123.4	-171.6	-163.2	-128.1	-33.5	0	0	0	110
459	P	36.5	Very low	26.6	Very low	103 Å²	103	164 Å²	164	67%	0.669	79%	0.789	S	S	*	*				-118.7	-175.5	-126.7	44.2	-30.4	0	0	0	115.5
460	S	22.3	Very low	26.7	Very low	101 Å²	101	167.1 Å²	167.1	71%	0.706	80%	0.798	S	S	*	*				164.4	166.5	123.2	53.8	0	0	0	0	114.2
461	Q	27.5	Very low	26.6	Very low	170 Å²	170	165 Å²	165	79%	0.794	79%	0.793	S	S	*	*			trans	70.1	121.3	169.7	-58.9	178.5	-1	0	0	115.7
462	I	22.9	Very low	26.6	Very low	155 Å²	155	162.8 Å²	162.8	80%	0.795	79%	0.789	S	S	*	*				77.4	104.3	57.3	-63.9	169.4	0	0	0	112.6
463	Y	27.2	Very low	26.5	Very low	226 Å²	226	165 Å²	165	89%	0.886	79%	0.789	S	S	*	*			trans	-153.1	152.1	143.9	-101.6	-74.3	0	0	0	111.4
464	T	28.3	Very low	26.2	Very low	111 Å²	111	165.8 Å²	165.8	68%	0.681	79%	0.794	S	S	*	*			trans	-46.5	144.8	175.8	45.9	0	0	0	0	116.4
465	L	23.6	Very low	26.1	Very low	140 Å²	140	157.8 Å²	157.8	73%	0.733	78%	0.784	S	S	*	*				84.9	149.3	65	-127.5	175.8	0	0	0	113
466	F	27.5	Very low	26.1	Very low	175 Å²	175	152 Å²	152	77%	0.768	78%	0.78	S	S	*	*			trans	72.8	139.9	-159.6	-56.6	-83.1	0	0	0	112.6
467	D	26.1	Very low	26	Very low	160 Å²	160	148.2 Å²	148.2	86%	0.856	78%	0.777	S	S	*	*			cis	-94.2	173.6	18.7	-72.7	-47.5	0	0	0	118.5
468	K	24.9	Very low	26.1	Very low	184 Å²	184	143.6 Å²	143.6	80%	0.8	77%	0.766	S	S	*	*			trans	-172.6	177.9	-178.5	-120.7	-175.2	177.6	-175.8	0	107.2
469	P	33.7	Very low	26.4	Very low	101 Å²	101	140 Å²	140	66%	0.656	76%	0.756	S	S	*	*			cis	-134.6	178.9	-12.9	41.3	-25	0	0	0	114.6
470	D	26.5	Very low	25.9	Very low	156 Å²	156	142 Å²	142	83%	0.834	76%	0.761	S	S	*	*				-153.8	123.3	124.3	-98.1	-30.6	0	0	0	106
471	A	27.2	Very low	26.1	Very low	75 Å²	75	144.3 Å²	144.3	62%	0.62	77%	0.765	S	S	*	*				83	131.2	74.6	0	0	0	0	0	112.6
472	F	25.4	Very low	26.2	Very low	168 Å²	168	141.1 Å²	141.1	74%	0.737	76%	0.759	S	S	*	*			cis	-155.5	134.9	-0.8	-140.3	-125	0	0	0	111.3
473	Y	26.1	Very low	26.4	Very low	183 Å²	183	143.3 Å²	143.3	72%	0.718	76%	0.763	S	S	*	*			trans	67.6	134.7	147.7	-81.7	-127.7	0	0	0	123.3
474	S	21.3	Very low	26.5	Very low	115 Å²	115	139.5 Å²	139.5	80%	0.804	76%	0.756	S	S	*	*			trans	-134.4	159.5	140.1	65.7	0	0	0	0	108.8
475	A	23.8	Very low	26.5	Very low	92 Å²	92	139.7 Å²	139.7	76%	0.76	76%	0.758	S	S	*	*			trans	67.3	103	179.8	0	0	0	0	0	118.1
476	S	23.5	Very low	26.7	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	77%	0.765	S	S	*	*			trans	-118.2	137.3	142.3	-80.9	0	0	0	0	107.5
477	L	24.5	Very low	27.1	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	76%	0.76	S	S	*	*			trans	-145	112.9	-176.2	-147.9	177	0	0	0	110.7
478	T	28.8	Very low	27.2	Very low	117 Å²	117	140.9 Å²	140.9	72%	0.718	76%	0.763	S	S	*	*			trans	-147.3	148.7	174.6	42	0	0	0	0	107.8
479	N	27.5	Very low	27.1	Very low	128 Å²	128	139.6 Å²	139.6	68%	0.684	77%	0.765	S	S	*	*			cis	-155	151	6	-121.6	-16.6	0	0	0	111
480	L	26.2	Very low	26.8	Very low	146 Å²	146	137.4 Å²	137.4	76%	0.764	76%	0.76	S	S	*	*			trans	52.3	135.2	150.3	-59.7	161.6	0	0	0	118.8
481	N	25.4	Very low	26.8	Very low	150 Å²	150	139.2 Å²	139.2	80%	0.802	76%	0.757	S	S	*	*			cis	-166.2	152.6	48.5	-145.6	0.9	0	0	0	111.7
482	P	29.5	Very low	26.8	Very low	102 Å²	102	143 Å²	143	66%	0.662	76%	0.759	S	S	*	*			trans	-116.9	150.8	-174.3	39.6	-30.1	0	0	0	116.8
483	K	27.1	Very low	26.8	Very low	201 Å²	201	144.3 Å²	144.3	87%	0.874	77%	0.765	S	S	*	*			trans	164.6	154.8	159.6	-93.7	160.6	-175.7	-179.8	0	107.9
484	I	29.8	Very low	26.7	Very low	146 Å²	146	141 Å²	141	75%	0.749	77%	0.768	S	S	*	*			cis	-153.9	153.6	9.7	-131.8	155.5	0	0	0	112.3
485	T	29	Very low	26.7	Very low	115 Å²	115	140.9 Å²	140.9	71%	0.706	76%	0.763	S	S	*	*			trans	8.4	119.3	167.8	59	0	0	0	0	125.9
486	Q	28	Very low	26.7	Very low	192 Å²	192	143.3 Å²	143.3	90%	0.897	76%	0.763	S	S	*	*				60.5	161.3	111.2	-76.6	-153.7	-4.6	0	0	125.3
487	P	34.9	Very low	26.7	Very low	101 Å²	101	142.3 Å²	142.3	66%	0.656	76%	0.756	S	S	*	*			trans	-127.4	177.7	-153	45.6	-32.3	0	0	0	117.5
488	F	27.2	Very low	26.6	Very low	208 Å²	208	141.1 Å²	141.1	91%	0.912	75%	0.75	S	S	*	*			trans	-157.5	177.8	160.2	-107.7	-81.4	0	0	0	111.8
489	N	24.7	Very low	26.2	Very low	157 Å²	157	145.9 Å²	145.9	84%	0.84	76%	0.755	S	S	*	*				-152.5	157	-96.4	-166.6	-0.1	0	0	0	111.8
490	G	26.2	Very low	25.9	Very low	55 Å²	55	144 Å²	144	57%	0.567	76%	0.756	S	S	*	*			trans	110.5	156.8	168.7	0	0	0	0	0	117
491	Y	26.9	Very low	25.8	Very low	193 Å²	193	148.3 Å²	148.3	76%	0.757	76%	0.764	S	S	*	*			cis	-160.6	131.4	4.5	-141.9	-107.1	0	0	0	113.6
492	K	26.7	Very low	25.6	Very low	155 Å²	155	146 Å²	146	67%	0.674	76%	0.76	S	S	*	*			trans	49.4	131.2	155.6	-67.8	-176.4	-170.4	167.9	0	121
493	K	24.9	Very low	25.4	Very low	196 Å²	196	150.8 Å²	150.8	85%	0.852	77%	0.77	S	S	*	*				72.9	142.4	64.9	-83.9	-168.9	175.5	-169.9	0	114.1
494	S	24.1	Very low	25.1	Very low	112 Å²	112	151.9 Å²	151.9	78%	0.783	77%	0.77	S	S	*	*			cis	-156.7	-161	7.9	42.1	0	0	0	0	113.9
495	T	22.3	Very low	24.9	Very low	114 Å²	114	150 Å²	150	70%	0.699	77%	0.767	S	S	*	*			trans	-102.8	-175.4	-159.2	42.5	0	0	0	0	116.7
496	D	24.3	Very low	24.6	Very low	143 Å²	143	151.3 Å²	151.3	77%	0.765	77%	0.769	S	S	*	*			trans	89.8	144.4	154.5	-56.4	-57.1	0	0	0	119.3
497	S	22.6	Very low	24.3	Very low	95 Å²	95	151 Å²	151	66%	0.664	76%	0.764	S	S	*	*			cis	-168.3	168.5	-17.3	60.3	0	0	0	0	114.2
498	L	22.3	Very low	23.7	Very low	138 Å²	138	151.5 Å²	151.5	72%	0.723	77%	0.77	S	S	*	*			trans	64.6	115.2	147	-74.1	163.1	0	0	0	125.3
499	R	20.8	Very low	23.6	Very low	217 Å²	217	150.5 Å²	150.5	82%	0.819	77%	0.765	S	S	*	*				69.4	95.7	119	-166	-177.8	-73.9	175.1	-3.1	123
500	A	21.2	Very low	23.4	Very low	87 Å²	87	148.8 Å²	148.8	72%	0.719	77%	0.766	S	S	*	*				36.2	134.7	127.7	0	0	0	0	0	124.5
501	Y	24.4	Very low	23.2	Very low	238 Å²	238	151.1 Å²	151.1	93%	0.933	77%	0.773	S	S	*	*			trans	-155.2	-176	137.4	-111.5	-71.5	0	0	0	111.3
502	S	21	Very low	22.9	Very low	100 Å²	100	149.3 Å²	149.3	70%	0.699	78%	0.776	S	S	*	*			trans	-136.5	156.8	-151.1	58.4	0	0	0	0	117.8
503	K	24.5	Very low	22.8	Very low	204 Å²	204	150.2 Å²	150.2	89%	0.887	79%	0.787	S	S	*	*			trans	-174.5	146	141.1	-104.6	164.4	-174.9	178.3	0	114.1
504	Y	20.5	Very low	22.6	Very low	223 Å²	223	145.7 Å²	145.7	88%	0.875	78%	0.779	S	S	*	*			trans	-94.6	171.9	165.4	-86	-81.3	0	0	0	109
505	P	26.9	Very low	22.7	Very low	106 Å²	106	144.8 Å²	144.8	69%	0.688	77%	0.773	S	S	*	*			cis	-155.3	159.9	37	44	-21.6	0	0	0	121.9
506	I	22.1	Very low	22.9	Very low	143 Å²	143	147.7 Å²	147.7	73%	0.733	78%	0.779	S	S	*	*			trans	58.4	126.2	132	-60.2	171	0	0	0	122.4
507	K	21.3	Very low	23	Very low	186 Å²	186	146.8 Å²	146.8	81%	0.809	78%	0.779	S	S	*	*			trans	82.4	111.1	152	-85.8	171.7	-178.4	179.4	0	122.9
508	S	22.3	Very low	23.2	Very low	111 Å²	111	148 Å²	148	78%	0.776	78%	0.782	S	S	*	*				99.6	150.6	121.5	80.4	0	0	0	0	120.8
509	K	25.1	Very low	23.4	Very low	187 Å²	187	148.6 Å²	148.6	81%	0.813	79%	0.786	S	S	*	*			trans	56.4	80.5	172.6	-69.3	-169.5	175.2	-175.9	0	118.2	S511	K509-S511 PolarHBondContact O-N 3.23Å
510	S	20.8	Very low	23.5	Very low	122 Å²	122	147 Å²	147	85%	0.853	79%	0.785	S	S	*	*				8	101.4	126.2	57.5	0	0	0	0	118.9
511	S	22	Very low	23.6	Very low	103 Å²	103	150.3 Å²	150.3	72%	0.72	79%	0.79	S	S	*	*			trans	-165.2	133	140.3	52.9	0	0	0	0	111.8	K509	K509-S511 PolarHBondContact O-N 3.23Å
512	L	22.2	Very low	23.7	Very low	156 Å²	156	148 Å²	148	82%	0.817	79%	0.788	S	S	*	*			trans	41.9	115	150.4	-73.1	150.9	0	0	0	119.8
513	I	23.4	Very low	23.9	Very low	174 Å²	174	151.5 Å²	151.5	89%	0.892	80%	0.797	S	S	*	*			trans	-112.7	130	134.8	-67.5	177.9	0	0	0	107.1
514	S	21.6	Very low	23.8	Very low	100 Å²	100	148.7 Å²	148.7	70%	0.699	79%	0.792	S	S	*	*			trans	-128.4	123.5	168.9	55.7	0	0	0	0	108.8
515	S	25.5	Very low	24.2	Very low	94 Å²	94	146.6 Å²	146.6	66%	0.657	79%	0.79	S	S	*	*			trans	-102	112.1	157.5	53	0	0	0	0	106.3
516	E	26.3	Very low	24.2	Very low	174 Å²	174	148.5 Å²	148.5	81%	0.813	79%	0.794	S	S	*	*				75.4	133.2	98.5	-73.7	175.9	150.5	0	0	112.2
517	T	27.3	Very low	24.5	Very low	124 Å²	124	149.5 Å²	149.5	76%	0.761	80%	0.799	S	S	*	*			cis	-161.4	152.3	8.5	18.9	0	0	0	0	108
518	V	27.1	Very low	24.6	Very low	120 Å²	120	146.6 Å²	146.6	73%	0.727	79%	0.792	S	S	*	*			cis	-165.2	169.9	-13.7	88.2	0	0	0	0	110.1
519	N	26.1	Very low	24.9	Very low	151 Å²	151	145.9 Å²	145.9	81%	0.807	79%	0.787	S	S	*	*			trans	67.8	143.8	164.7	-90.1	-10.6	0	0	0	122.2
520	K	22.5	Very low	25	Very low	184 Å²	184	143.9 Å²	143.9	80%	0.8	79%	0.785	S	S	*	*	S	Bend	trans	-90.2	169.8	152.5	-72.2	175.3	172.9	178.3	0	109.2
521	N	23.6	Very low	25.4	Very low	156 Å²	156	144.5 Å²	144.5	83%	0.834	78%	0.778	S	S	*	*			trans	81.9	144.2	-178.6	-48.2	-15.2	0	0	0	112.9
522	Q	25.4	Very low	25.3	Very low	190 Å²	190	145.2 Å²	145.2	89%	0.888	78%	0.783	S	S	*	*			trans	60.8	85.4	-167.3	-63.4	-177.1	-34	0	0	114.8
523	I	26	Very low	25.6	Very low	174 Å²	174	142.6 Å²	142.6	89%	0.892	78%	0.777	S	S	*	*				-149.7	101.6	103.3	-87.5	150.2	0	0	0	106.6
524	N	23	Very low	25.7	Very low	145 Å²	145	139.5 Å²	139.5	78%	0.775	77%	0.771	S	S	*	*	S	Bend	trans	-157.1	136.8	156.1	-106.9	3.3	0	0	0	104.8
525	E	27.2	Very low	25.9	Very low	179 Å²	179	142.6 Å²	142.6	84%	0.836	78%	0.779	S	S	*	*			trans	60.3	106.6	167.6	-62.4	168.8	-177.4	0	0	117.9
526	L	27.7	Very low	25.8	Very low	145 Å²	145	143.9 Å²	143.9	76%	0.759	78%	0.779	S	S	*	*				177.2	58.5	117.7	-94	167.8	0	0	0	114.4	D528	L526-D528 HydrophobicContact CD2-CB 4.36Å
527	I	28.2	Very low	25.7	Very low	165 Å²	165	143 Å²	143	85%	0.846	78%	0.775	S	S	*	*			trans	-151.5	96	142	-57.4	-173.6	0	0	0	103
528	D	24	Very low	25.6	Very low	125 Å²	125	144.9 Å²	144.9	67%	0.668	78%	0.775	S	S	*	*			cis	72.8	128.1	23.2	-149.1	3.9	0	0	0	114.8	L526	L526-D528 HydrophobicContact CD2-CB 4.36Å
529	S	27.9	Very low	25.6	Very low	96 Å²	96	145.6 Å²	145.6	67%	0.671	77%	0.77	S	S	*	*			trans	51.9	108.9	-157.4	66.4	0	0	0	0	114.2
530	N	27.9	Very low	25.5	Very low	144 Å²	144	145.8 Å²	145.8	77%	0.77	77%	0.766	S	S	*	*	S	Bend		-152.7	143.9	50.3	-99	-32.8	0	0	0	113.8
531	I	28.1	Very low	25.6	Very low	135 Å²	135	143.7 Å²	143.7	69%	0.692	76%	0.759	S	S	*	*			trans	63.3	102.6	156.9	-54.1	165.3	0	0	0	114.8
532	S	21.3	Very low	25.8	Very low	118 Å²	118	143 Å²	143	83%	0.825	75%	0.751	S	S	*	*			cis	77.9	49.8	9.6	96.8	0	0	0	0	118.7
533	S	26.7	Very low	25.8	Very low	101 Å²	101	140.5 Å²	140.5	71%	0.706	74%	0.743	S	S	*	*			trans	-173.5	142.8	154.4	53.5	0	0	0	0	109.1
534	S	26.8	Very low	25.7	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	74%	0.736	S	S	*	*			cis	-162.3	170.1	-7.5	50.7	0	0	0	0	106.3
535	L	26.2	Very low	25.8	Very low	165 Å²	165	141.7 Å²	141.7	86%	0.864	74%	0.737	S	S	*	*			cis	-150.5	169	6.7	-140	162	0	0	0	107.7
536	N	22.3	Very low	25.8	Very low	121 Å²	121	142.6 Å²	142.6	65%	0.647	74%	0.741	S	S	*	*			trans	-137.2	141	-168.7	-157.1	21.8	0	0	0	113.1
537	Q	25.5	Very low	25.6	Very low	156 Å²	156	144 Å²	144	73%	0.729	74%	0.742	S	S	*	*			trans	69.2	162.3	152.6	-77.6	169.6	0.2	0	0	123.6
538	Q	24.6	Very low	25.4	Very low	163 Å²	163	143.4 Å²	143.4	76%	0.762	74%	0.735	S	S	*	*			trans	82.1	131.5	165.3	-51.8	-161.9	-30.9	0	0	117
539	H	27.6	Very low	25.5	Very low	135 Å²	135	142.6 Å²	142.6	63%	0.625	74%	0.739	S	S	*	*			cis	-136.4	148.7	2.4	-100.2	-21.7	0	0	0	109.9
540	Q	23.2	Very low	25.4	Very low	155 Å²	155	146 Å²	146	72%	0.724	75%	0.749	S	S	*	*				51.5	138.7	94.4	-77.2	175.7	-62.8	0	0	115.4
541	E	25.5	Very low	25.1	Very low	139 Å²	139	145.4 Å²	145.4	65%	0.65	75%	0.746	S	S	*	*			cis	-162.4	165.4	23.1	-139.9	-167	127.8	0	0	114
542	Q	27	Very low	25	Very low	143 Å²	143	145.6 Å²	145.6	67%	0.668	75%	0.748	S	S	*	*			trans	68.3	153.3	158.9	-66.3	179.2	31.5	0	0	119.2
543	N	25	Very low	25.2	Very low	136 Å²	136	145.8 Å²	145.8	73%	0.727	75%	0.749	S	S	*	*			cis	-148.3	-165.9	-1.3	-131.6	-42.2	0	0	0	114
544	H	24	Very low	25.1	Very low	162 Å²	162	147.5 Å²	147.5	75%	0.75	75%	0.749	S	S	*	*			trans	-119.6	156.5	-151.3	-121.3	-60	0	0	0	118.2
545	K	24.9	Very low	25	Very low	183 Å²	183	150.4 Å²	150.4	80%	0.796	75%	0.751	S	S	*	*			trans	74.8	123.1	153.4	-63	164.1	-179.4	175.2	0	120
546	E	27.4	Very low	24.9	Very low	197 Å²	197	152.2 Å²	152.2	92%	0.921	75%	0.751	S	S	*	*				-157.6	-168.1	99.4	-121.2	-179.1	-155.7	0	0	113.4
547	F	23.4	Very low	25	Very low	174 Å²	174	152 Å²	152	76%	0.763	76%	0.76	S	S	*	*			trans	-160.9	133.4	-133.9	-169.1	-108.5	0	0	0	116.7
548	H	23.5	Very low	24.9	Very low	154 Å²	154	149 Å²	149	71%	0.713	76%	0.755	S	S	*	*			trans	78.1	154.3	156	-101	-109.8	0	0	0	123.7
549	S	26.7	Very low	24.8	Very low	107 Å²	107	147.8 Å²	147.8	75%	0.748	75%	0.754	S	S	*	*			trans	74.4	145.3	177	83.4	0	0	0	0	115.8
550	L	25.3	Very low	24.6	Very low	168 Å²	168	148.5 Å²	148.5	88%	0.88	76%	0.763	S	S	*	*			cis	-113.7	161.2	7.5	-127.8	89.5	0	0	0	113
551	D	21.4	Very low	24.8	Very low	132 Å²	132	147.6 Å²	147.6	71%	0.706	76%	0.763	S	S	*	*			trans	-144.1	165.7	168.3	-167.1	7.2	0	0	0	109.8
552	N	26	Very low	24.8	Very low	138 Å²	138	149.5 Å²	149.5	74%	0.738	78%	0.776	S	S	*	*			trans	84.2	96.6	-176.3	-54.9	-82.9	0	0	0	117.5
553	S	26.4	Very low	24.9	Very low	122 Å²	122	152.3 Å²	152.3	85%	0.853	78%	0.782	S	S	*	*				-154	121.2	119	54.9	0	0	0	0	110.5
554	I	23.6	Very low	24.9	Very low	137 Å²	137	154.1 Å²	154.1	70%	0.703	79%	0.791	S	S	*	*			trans	-133.5	147.9	-174.8	-53	-178.2	0	0	0	109.9
555	H	25	Very low	24.9	Very low	172 Å²	172	156 Å²	156	80%	0.796	80%	0.796	S	S	*	*			trans	74.7	104.4	171.6	-62.4	-53	0	0	0	118.9
556	K	24.9	Very low	24.9	Very low	202 Å²	202	152 Å²	152	88%	0.878	79%	0.792	S	S	*	*				-168.9	163.4	87.7	-103.1	174	-177.7	173.7	0	112.9
557	S	24.9	Very low	24.8	Very low	118 Å²	118	147.4 Å²	147.4	83%	0.825	78%	0.781	S	S	*	*			trans	68.8	132.5	-177.8	-151.9	0	0	0	0	115.2
558	S	23.2	Very low	25	Very low	91 Å²	91	146.2 Å²	146.2	64%	0.636	78%	0.781	S	S	*	*			cis	141.8	94.7	-18.5	173.6	0	0	0	0	109.2
559	N	22.4	Very low	25.2	Very low	139 Å²	139	145.2 Å²	145.2	74%	0.743	78%	0.78	S	S	*	*			trans	66.9	142.7	159.5	-57.8	-12.3	0	0	0	119.2
560	N	23.6	Very low	25	Very low	150 Å²	150	148.8 Å²	148.8	80%	0.802	79%	0.785	S	S	*	*			trans	66.7	122.8	178.3	-47.5	-12.3	0	0	0	112.3
561	D	27.1	Very low	25.2	Very low	136 Å²	136	146 Å²	146	73%	0.727	77%	0.774	S	S	*	*			cis	-130.8	148.2	28.1	-68.4	-47.8	0	0	0	114.4	Y563	D561-Y563 HydrophobicContact CB-CD2 4.07Å; D561-Y563 PolarHBondContact O-N 3.25Å
562	I	25.1	Very low	25.3	Very low	179 Å²	179	145.3 Å²	145.3	92%	0.918	78%	0.78	S	S	*	*			trans	-92.7	88.5	165.2	-60.4	171.4	0	0	0	108.2
563	Y	28.5	Very low	25.4	Very low	201 Å²	201	145.7 Å²	145.7	79%	0.788	78%	0.781	S	S	*	*			trans	-109.6	140.2	162.6	-91.4	-80.8	0	0	0	110.6	D561 K565	D561-Y563 HydrophobicContact CB-CD2 4.07Å; D561-Y563 PolarHBondContact O-N 3.25Å; Y563-K565 VanDerWaalsContact C-N 3.3Å; Y563-K565 PolarHBondContact O-N 3.02Å
564	L	25.3	Very low	25.5	Very low	175 Å²	175	145.5 Å²	145.5	92%	0.916	78%	0.776	S	S	*	*			trans	-66.2	82.3	-179.4	-97.8	152	0	0	0	111.4	S566	L564-S566 PolarHBondContact O-N 3.06Å
565	K	23.7	Very low	25.7	Very low	201 Å²	201	148.5 Å²	148.5	87%	0.874	79%	0.788	S	S	*	*			trans	-81.7	87.7	164.2	-161.9	170.1	-171.8	177.5	0	107.9	Y563 S567	Y563-K565 VanDerWaalsContact C-N 3.3Å; Y563-K565 PolarHBondContact O-N 3.02Å; K565-S567 PolarHBondContact O-N 3.5Å
566	S	26.7	Very low	25.9	Very low	100 Å²	100	148.2 Å²	148.2	70%	0.699	79%	0.786	S	S	*	*			trans	-62.8	95.2	173.8	53.8	0	0	0	0	109.5	L564 I568	L564-S566 PolarHBondContact O-N 3.06Å; S566-I568 PolarHBondContact O-N 3.49Å
567	S	24.7	Very low	26	Very low	99 Å²	99	145.1 Å²	145.1	69%	0.692	78%	0.779	S	S	*	*			trans	-62.8	105.9	170.8	51.9	0	0	0	0	108.7	K565 I569	K565-S567 PolarHBondContact O-N 3.5Å; S567-I569 PolarHBondContact O-N 2.95Å; S567-I569 VanDerWaalsContact O-N 3.16Å
568	I	27.5	Very low	26.2	Very low	150 Å²	150	146.9 Å²	146.9	77%	0.769	78%	0.779	S	S	*	*			trans	-59.1	118.3	159.6	-65.2	173.9	0	0	0	105.5	S566 E570	S566-I568 PolarHBondContact O-N 3.49Å; I568-E570 HydrophobicContact CG2-CG 4.48Å; I568-E570 PolarHBondContact O-N 3.43Å; I568-E570 VanDerWaalsContact O-N 3.15Å
569	I	27	Very low	26.4	Very low	133 Å²	133	150.1 Å²	150.1	68%	0.682	79%	0.788	S	S	*	*			trans	-77.4	101.1	173.1	-61.3	174.6	0	0	0	105.8	S567 T571	S567-I569 PolarHBondContact O-N 2.95Å; S567-I569 VanDerWaalsContact O-N 3.16Å; I569-T571 HydrophobicContact CG2-CG2 3.96Å; I569-T571 PolarHBondContact O-N 3.36Å
570	E	23.9	Very low	26.7	Very low	182 Å²	182	148.5 Å²	148.5	85%	0.85	78%	0.783	S	S	*	*			trans	-71.1	76.8	167.4	-68.7	-175.1	142.1	0	0	109.3	I568 S572	I568-E570 HydrophobicContact CG2-CG 4.48Å; I568-E570 PolarHBondContact O-N 3.43Å; I568-E570 VanDerWaalsContact O-N 3.15Å; E570-S572 VanDerWaalsContact C-N 3.35Å; E570-S572 PolarHBondContact O-N 3.21Å
571	T	27.8	Very low	27	Very low	108 Å²	108	146.3 Å²	146.3	66%	0.663	78%	0.776	S	S	*	*			trans	-69.6	97.3	159.1	42.3	0	0	0	0	108.1	I569 I573	I569-T571 HydrophobicContact CG2-CG2 3.96Å; I569-T571 PolarHBondContact O-N 3.36Å; T571-I573 PolarHBondContact O-N 2.84Å; T571-I573 VanDerWaalsContact O-N 3.16Å
572	S	24.1	Very low	27.1	Very low	118 Å²	118	147.2 Å²	147.2	83%	0.825	78%	0.78	S	S	*	*			trans	-59.3	112.3	167	51.5	0	0	0	0	110	E570	E570-S572 VanDerWaalsContact C-N 3.35Å; E570-S572 PolarHBondContact O-N 3.21Å
573	I	28.7	Very low	27.5	Very low	147 Å²	147	143.5 Å²	143.5	75%	0.754	76%	0.762	S	S	*	*			trans	-96.9	128.9	167.7	-59.7	176.8	0	0	0	106.8	T571	T571-I573 PolarHBondContact O-N 2.84Å; T571-I573 VanDerWaalsContact O-N 3.16Å
574	P	27	Very low	28.1	Very low	117 Å²	117	139 Å²	139	76%	0.76	76%	0.756	S	S	*	*			trans	-67	141.7	-179.3	-18.8	31.7	0	0	0	112.5	E576	P574-E576 PolarHBondContact O-N 3.33Å
575	E	29.6	Very low	28.9	Very low	201 Å²	201	138.2 Å²	138.2	94%	0.939	75%	0.748	S	S	*	*			trans	-75.1	95.9	164.4	-72.7	-171.2	114.6	0	0	110.2
576	E	28.4	Very low	29.5	Very low	165 Å²	165	133.6 Å²	133.6	77%	0.771	73%	0.733	S	S	*	*			trans	-156.7	147.9	150.1	-128.4	178.3	-159.5	0	0	113	P574	P574-E576 PolarHBondContact O-N 3.33Å
577	N	26.1	Very low	30.3	Very low	137 Å²	137	131.3 Å²	131.3	73%	0.733	72%	0.717	S	S	*	*			trans	58.3	85	164.9	-59.5	-55.2	0	0	0	118.4
578	L	29.5	Very low	31.5	Very low	155 Å²	155	130.5 Å²	130.5	81%	0.812	71%	0.708	S	S	*	*			trans	-143.4	92.9	140.9	-142.5	120.3	0	0	0	113.4
579	L	27.8	Very low	32.7	Very low	160 Å²	160	129.9 Å²	129.9	84%	0.838	70%	0.701	S	S	*	*			trans	-77.6	120.8	167.8	-95.2	164.6	0	0	0	110.3
580	T	29.1	Very low	34	Very low	104 Å²	104	129.9 Å²	129.9	64%	0.638	70%	0.697	S	S	*	*	S	Bend	trans	73.1	150.5	160.2	71.2	0	0	0	0	119.7
581	T	28.9	Very low	35.6	Very low	105 Å²	105	129.5 Å²	129.5	64%	0.644	69%	0.689	S	S	*	*			trans	82.6	108	167.7	71	0	0	0	0	120	N583	T581-N583 PolarHBondContact O-N 3.37Å
582	N	30.8	Very low	37.6	Very low	154 Å²	154	127.4 Å²	127.4	82%	0.824	68%	0.676	S	S	*	*			trans	60.6	31.5	130.7	-56.5	9.6	0	0	0	121.6
583	N	33.3	Very low	39.6	Very low	101 Å²	101	126.2 Å²	126.2	54%	0.54	66%	0.66	S	S	.	*			trans	-108.3	11.8	174.1	-89.1	-49.4	0	0	0	116.4	T581 E585 N586 S587	T581-N583 PolarHBondContact O-N 3.37Å; N583-E585 PolarHBondContact O-N 3.06Å; N583-N586 PolarHBondContact OD1-ND2 3.02Å; N583-S587 PolarHBondContact O-N 3.19Å; N583-S587 PolarHBondContact O-OG 3.38Å
584	T	39.6	Very low	41.6	Very low	107 Å²	107	121.7 Å²	121.7	66%	0.656	64%	0.639	S	S	*	*	H	α-helix	trans	-70.3	-25.5	-177.7	42.9	0	0	0	0	115.1	S587 T588	T584-S587 PolarHBondContact O-OG 3.27Å; T584-S587 VanDerWaalsContact O-OG 3.1Å; T584-T588 WeakPolarHBondContact O-CG2 3.34Å; T584-T588 PolarHBondContact O-N 2.93Å; T584-T588 PolarHBondContact O-OG1 3.04Å
585	E	42.4	Very low	43.8	Very low	159 Å²	159	119 Å²	119	74%	0.743	62%	0.623	S	S	*	*	H	α-helix	trans	-75.8	-49.6	178.8	-64.6	-173.8	142.4	0	0	111	N583 S587 T588 E589	N583-E585 PolarHBondContact O-N 3.06Å; E585-S587 VanDerWaalsContact C-N 3.3Å; E585-S587 PolarHBondContact O-N 3.12Å; E585-T588 PolarHBondContact O-N 2.83Å; E585-T588 VanDerWaalsContact O-N 3.1Å; E585-T588 PolarHBondContact O-OG1 3.45Å; E585-E589 PolarHBondContact O-N 3.46Å
586	N	36.1	Very low	46	Very low	103 Å²	103	115.3 Å²	115.3	55%	0.551	60%	0.604	S	S	*	*	H	α-helix	trans	-57.6	-39.4	177.8	-69.8	-26.7	0	0	0	113	N583 F590	N583-N586 PolarHBondContact OD1-ND2 3.02Å; N586-F590 WeakPolarHBondContact O-CB 3.33Å; N586-F590 PolarHBondContact O-N 3.43Å
587	S	43.7	Very low	47.8	Very low	52 Å²	52	113.1 Å²	113.1	36%	0.364	60%	0.595	S	S	.	*	H	α-helix	trans	-67.8	-40.5	176.4	55.6	0	0	0	0	112.5	N583 T584 E585 F590 Y591	N583-S587 PolarHBondContact O-N 3.19Å; N583-S587 PolarHBondContact O-OG 3.38Å; T584-S587 PolarHBondContact O-OG 3.27Å; T584-S587 VanDerWaalsContact O-OG 3.1Å; E585-S587 VanDerWaalsContact C-N 3.3Å; E585-S587 PolarHBondContact O-N 3.12Å; S587-F590 PolarHBondContact O-N 3.15Å; S587-Y591 WeakPolarHBondContact O-CD2 3.49Å; S587-Y591 PolarHBondContact O-N 3.33Å
588	T	50.7	Low	50	Low	83 Å²	83	111.2 Å²	111.2	51%	0.509	59%	0.585	S	S	.	*	H	α-helix	trans	-73.6	-32.8	179.1	48.6	0	0	0	0	112.1	T584 E585 T592	T584-T588 WeakPolarHBondContact O-CG2 3.34Å; T584-T588 PolarHBondContact O-N 2.93Å; T584-T588 PolarHBondContact O-OG1 3.04Å; E585-T588 PolarHBondContact O-N 2.83Å; E585-T588 VanDerWaalsContact O-N 3.1Å; E585-T588 PolarHBondContact O-OG1 3.45Å; T588-T592 WeakPolarHBondContact O-CB 3.48Å; T588-T592 VanDerWaalsContact O-CG2 3.3Å; T588-T592 WeakPolarHBondContact O-CG2 3.26Å; T588-T592 PolarHBondContact O-N 2.76Å; T588-T592 PolarHBondContact O-OG1 2.95Å
589	E	51.9	Low	52.1	Low	136 Å²	136	107.2 Å²	107.2	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-65.6	-43.3	170	-170.4	162	-135.1	0	0	111.6	E585 T592 L593	E585-E589 PolarHBondContact O-N 3.46Å; E589-T592 PolarHBondContact O-N 3.29Å; E589-T592 PolarHBondContact O-OG1 3.36Å; E589-L593 WeakPolarHBondContact O-CB 3.5Å; E589-L593 PolarHBondContact O-N 3.32Å
590	F	54.8	Low	54.3	Low	134 Å²	134	104.1 Å²	104.1	59%	0.588	55%	0.55	S	S	*	*	H	α-helix	trans	-63.1	-45	175.7	-172	-97.5	0	0	0	112.9	N586 S587 T592 L593 T594	N586-F590 WeakPolarHBondContact O-CB 3.33Å; N586-F590 PolarHBondContact O-N 3.43Å; S587-F590 PolarHBondContact O-N 3.15Å; F590-T592 PolarHBondContact O-N 3.43Å; F590-L593 PolarHBondContact O-N 3Å; F590-T594 WeakPolarHBondContact O-CB 3.47Å; F590-T594 PolarHBondContact O-N 3.41Å; F590-T594 PolarHBondContact O-OG1 3.32Å
591	Y	57.3	Low	56.3	Low	173 Å²	173	103.6 Å²	103.6	68%	0.678	55%	0.547	S	S	*	.	H	α-helix	trans	-63.7	-38.8	175.6	-81.2	-62.6	0	0	0	112.4	S587 T594 S595	S587-Y591 WeakPolarHBondContact O-CD2 3.49Å; S587-Y591 PolarHBondContact O-N 3.33Å; Y591-T594 PolarHBondContact O-N 2.92Å; Y591-S595 PolarHBondContact O-N 3.44Å; Y591-S595 PolarHBondContact O-OG 2.84Å
592	T	70	Confident	58.4	Low	64 Å²	64	105 Å²	105	39%	0.393	55%	0.547	S	S	.	.	H	α-helix	trans	-75.7	-24.4	176.2	61.6	0	0	0	0	113.8	T588 E589 F590 S595 K596	T588-T592 WeakPolarHBondContact O-CB 3.48Å; T588-T592 VanDerWaalsContact O-CG2 3.3Å; T588-T592 WeakPolarHBondContact O-CG2 3.26Å; T588-T592 PolarHBondContact O-N 2.76Å; T588-T592 PolarHBondContact O-OG1 2.95Å; E589-T592 PolarHBondContact O-N 3.29Å; E589-T592 PolarHBondContact O-OG1 3.36Å; F590-T592 PolarHBondContact O-N 3.43Å; T592-S595 PolarHBondContact O-OG 2.87Å; T592-K596 WeakPolarHBondContact O-CB 3.48Å; T592-K596 WeakPolarHBondContact O-CD 3.49Å; T592-K596 WeakPolarHBondContact O-CG 3.15Å; T592-K596 PolarHBondContact O-N 3.27Å
593	L	66.8	Low	60.4	Low	93 Å²	93	100.2 Å²	100.2	49%	0.487	52%	0.521	S	S	.	.	H	α-helix	trans	-71.6	-43.3	169.2	-171.7	69.3	0	0	0	110.9	E589 F590 K596 M597	E589-L593 WeakPolarHBondContact O-CB 3.5Å; E589-L593 PolarHBondContact O-N 3.32Å; F590-L593 PolarHBondContact O-N 3Å; L593-K596 PolarHBondContact O-N 3.39Å; L593-M597 PolarHBondContact O-N 3.47Å
594	T	69.4	Low	62.3	Low	52 Å²	52	100.2 Å²	100.2	32%	0.319	52%	0.52	S	S	.	.	H	α-helix	trans	-64.8	-42.1	177.4	-54.5	0	0	0	0	111.4	F590 Y591 M597 N598	F590-T594 WeakPolarHBondContact O-CB 3.47Å; F590-T594 PolarHBondContact O-N 3.41Å; F590-T594 PolarHBondContact O-OG1 3.32Å; Y591-T594 PolarHBondContact O-N 2.92Å; T594-M597 PolarHBondContact O-N 3.12Å; T594-N598 PolarHBondContact O-N 3.03Å
595	S	73.5	Confident	63.8	Low	61 Å²	61	97.2 Å²	97.2	43%	0.427	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-44.4	175.1	70.5	0	0	0	0	111.8	Y591 T592 M597 N598 T599	Y591-S595 PolarHBondContact O-N 3.44Å; Y591-S595 PolarHBondContact O-OG 2.84Å; T592-S595 PolarHBondContact O-OG 2.87Å; S595-M597 VanDerWaalsContact C-N 3.32Å; S595-M597 PolarHBondContact O-N 3.08Å; S595-N598 PolarHBondContact O-N 3.14Å; S595-T599 PolarHBondContact O-N 3.1Å; S595-T599 PolarHBondContact O-OG1 2.89Å; S595-T599 VanDerWaalsContact O-OG1 3.09Å
596	K	74.9	Confident	65.1	Low	124 Å²	124	94.7 Å²	94.7	54%	0.539	50%	0.502	S	S	.	.	H	α-helix	trans	-55.9	-43.9	172.1	-74.4	163.8	-169.4	160.2	0	112	T592 L593 T599 I600	T592-K596 WeakPolarHBondContact O-CB 3.48Å; T592-K596 WeakPolarHBondContact O-CD 3.49Å; T592-K596 WeakPolarHBondContact O-CG 3.15Å; T592-K596 PolarHBondContact O-N 3.27Å; L593-K596 PolarHBondContact O-N 3.39Å; K596-T599 PolarHBondContact O-N 3.07Å; K596-I600 WeakPolarHBondContact O-CB 3.18Å; K596-I600 WeakPolarHBondContact O-CD1 3.16Å; K596-I600 VanDerWaalsContact O-CG1 3.25Å; K596-I600 WeakPolarHBondContact O-CG1 3.3Å; K596-I600 PolarHBondContact O-N 3.17Å
597	M	67.8	Low	66.8	Low	118 Å²	118	92.4 Å²	92.4	58%	0.581	49%	0.487	S	S	*	.	H	α-helix	trans	-66.5	-37.4	177.2	-79.1	-154.8	159.4	0	0	113	L593 T594 S595 I600 T601	L593-M597 PolarHBondContact O-N 3.47Å; T594-M597 PolarHBondContact O-N 3.12Å; S595-M597 VanDerWaalsContact C-N 3.32Å; S595-M597 PolarHBondContact O-N 3.08Å; M597-I600 PolarHBondContact O-N 3.18Å; M597-T601 WeakPolarHBondContact O-CB 3.42Å; M597-T601 PolarHBondContact O-N 2.95Å; M597-T601 PolarHBondContact O-OG1 2.91Å
598	N	71.5	Confident	68.1	Low	98 Å²	98	91.3 Å²	91.3	52%	0.524	48%	0.484	S	S	.	.	H	α-helix	trans	-65.3	-42.1	173.6	-72.8	-14.5	0	0	0	111.6	T594 S595 T601 Q602	T594-N598 PolarHBondContact O-N 3.03Å; S595-N598 PolarHBondContact O-N 3.14Å; N598-T601 PolarHBondContact O-N 3.42Å; N598-Q602 PolarHBondContact O-N 3.18Å
599	T	73.7	Confident	69.1	Low	71 Å²	71	94.4 Å²	94.4	44%	0.436	49%	0.487	S	S	.	.	H	α-helix	trans	-62.4	-42.5	173	-53.6	0	0	0	0	112	S595 K596 T601 Q602 N603	S595-T599 PolarHBondContact O-N 3.1Å; S595-T599 PolarHBondContact O-OG1 2.89Å; S595-T599 VanDerWaalsContact O-OG1 3.09Å; K596-T599 PolarHBondContact O-N 3.07Å; T599-T601 VanDerWaalsContact C-N 3.33Å; T599-T601 PolarHBondContact O-N 3.03Å; T599-Q602 PolarHBondContact O-N 3.46Å; T599-N603 WeakPolarHBondContact O-CB 3.44Å; T599-N603 PolarHBondContact O-N 2.88Å; T599-N603 PolarHBondContact O-ND2 2.72Å
600	I	73.2	Confident	69.9	Low	94 Å²	94	88.6 Å²	88.6	48%	0.482	46%	0.464	S	S	.	.	H	α-helix	trans	-61.5	-42.6	174.9	-71.3	163.1	0	0	0	110.6	K596 M597 N603 L604	K596-I600 WeakPolarHBondContact O-CB 3.18Å; K596-I600 WeakPolarHBondContact O-CD1 3.16Å; K596-I600 VanDerWaalsContact O-CG1 3.25Å; K596-I600 WeakPolarHBondContact O-CG1 3.3Å; K596-I600 PolarHBondContact O-N 3.17Å; M597-I600 PolarHBondContact O-N 3.18Å; I600-N603 PolarHBondContact O-N 2.98Å; I600-L604 HydrophobicContact CG2-CD1 3.92Å; I600-L604 WeakPolarHBondContact O-CB 3.18Å; I600-L604 VanDerWaalsContact O-CG 3.31Å; I600-L604 WeakPolarHBondContact O-CG 3.2Å; I600-L604 PolarHBondContact O-N 3.4Å
601	T	71.2	Confident	70.7	Confident	93 Å²	93	84.2 Å²	84.2	57%	0.571	45%	0.446	S	S	*	.	H	α-helix	trans	-68	-41.1	179.7	-55.7	0	0	0	0	111.9	M597 N598 T599 L604 G605	M597-T601 WeakPolarHBondContact O-CB 3.42Å; M597-T601 PolarHBondContact O-N 2.95Å; M597-T601 PolarHBondContact O-OG1 2.91Å; N598-T601 PolarHBondContact O-N 3.42Å; T599-T601 VanDerWaalsContact C-N 3.33Å; T599-T601 PolarHBondContact O-N 3.03Å; T601-L604 PolarHBondContact O-N 3.29Å; T601-G605 PolarHBondContact O-N 3.08Å
602	Q	73.6	Confident	71.4	Confident	136 Å²	136	81.9 Å²	81.9	64%	0.636	44%	0.444	S	S	*	.	H	α-helix	trans	-62	-44.1	171.4	-79.6	-176	-42.3	0	0	111.9	N598 T599 L604 G605 L606	N598-Q602 PolarHBondContact O-N 3.18Å; T599-Q602 PolarHBondContact O-N 3.46Å; Q602-L604 VanDerWaalsContact C-N 3.34Å; Q602-L604 PolarHBondContact O-N 2.94Å; Q602-G605 PolarHBondContact O-N 3.26Å; Q602-G605 VanDerWaalsContact O-N 3.14Å; Q602-L606 PolarHBondContact O-N 2.93Å
603	N	73.3	Confident	71.4	Confident	52 Å²	52	85.9 Å²	85.9	28%	0.278	46%	0.456	S	S	.	.	H	α-helix	trans	-64.1	-37.4	177.6	-73.7	-15.6	0	0	0	112.1	M103 T599 I600 L606 F607	M103-N603 HydrophobicContact CE-CB 3.98Å; M103-N603 HydrophobicContact CG-CB 4.2Å; M103-N603 HydrophobicContact SD-CB 4.32Å; T599-N603 WeakPolarHBondContact O-CB 3.44Å; T599-N603 PolarHBondContact O-N 2.88Å; T599-N603 PolarHBondContact O-ND2 2.72Å; I600-N603 PolarHBondContact O-N 2.98Å; N603-L606 PolarHBondContact O-N 3.49Å; N603-F607 VanDerWaalsContact O-CB 3.27Å; N603-F607 WeakPolarHBondContact O-CB 3.2Å; N603-F607 PolarHBondContact O-N 3Å
604	L	73.6	Confident	71.6	Confident	101 Å²	101	82.2 Å²	82.2	53%	0.529	44%	0.437	S	S	.	.	H	α-helix	trans	-66	-37.2	171.9	-74.1	166.2	0	0	0	112.2	I600 T601 Q602 F607 G608	I600-L604 HydrophobicContact CG2-CD1 3.92Å; I600-L604 WeakPolarHBondContact O-CB 3.18Å; I600-L604 VanDerWaalsContact O-CG 3.31Å; I600-L604 WeakPolarHBondContact O-CG 3.2Å; I600-L604 PolarHBondContact O-N 3.4Å; T601-L604 PolarHBondContact O-N 3.29Å; Q602-L604 VanDerWaalsContact C-N 3.34Å; Q602-L604 PolarHBondContact O-N 2.94Å; L604-F607 PolarHBondContact O-N 3.39Å; L604-G608 PolarHBondContact O-N 3.36Å
605	G	70.4	Confident	71.9	Confident	45 Å²	45	82.1 Å²	82.1	46%	0.464	43%	0.432	S	S	.	.	H	α-helix	trans	-64.1	-45.9	172.4	0	0	0	0	0	112.8	T601 Q602 G608 Y609	T601-G605 PolarHBondContact O-N 3.08Å; Q602-G605 PolarHBondContact O-N 3.26Å; Q602-G605 VanDerWaalsContact O-N 3.14Å; G605-G608 PolarHBondContact O-N 3.48Å; G605-Y609 WeakPolarHBondContact O-CB 3.41Å; G605-Y609 PolarHBondContact O-N 2.99Å
606	L	70	Confident	72	Confident	105 Å²	105	81.5 Å²	81.5	55%	0.55	42%	0.424	S	S	.	.	H	α-helix	trans	-60.7	-42.2	173.2	-83.2	160	0	0	0	111.9	Q602 N603 Y609 G610	Q602-L606 PolarHBondContact O-N 2.93Å; N603-L606 PolarHBondContact O-N 3.49Å; L606-Y609 PolarHBondContact O-N 3.25Å; L606-G610 PolarHBondContact O-N 2.98Å
607	F	70.7	Confident	72.4	Confident	56 Å²	56	81.5 Å²	81.5	25%	0.246	43%	0.429	C	S	.	.	H	α-helix	trans	-61	-46.7	175	-177.8	-86.6	0	0	0	111.7	P99 L100 M103 N603 L604 G610 I611	P99-F607 HydrophobicContact CB-CD2 3.53Å; P99-F607 HydrophobicContact CB-CE2 3.93Å; P99-F607 HydrophobicContact CB-CG 4.13Å; L100-F607 HydrophobicContact CB-CE2 4.38Å; M103-F607 HydrophobicContact SD-CB 3.83Å; M103-F607 HydrophobicContact SD-CD2 3.74Å; M103-F607 HydrophobicContact SD-CG 4.13Å; N603-F607 VanDerWaalsContact O-CB 3.27Å; N603-F607 WeakPolarHBondContact O-CB 3.2Å; N603-F607 PolarHBondContact O-N 3Å; L604-F607 PolarHBondContact O-N 3.39Å; F607-G610 PolarHBondContact O-N 3.25Å; F607-I611 HydrophobicContact CD1-CD1 3.98Å; F607-I611 HydrophobicContact CE1-CD1 3.35Å; F607-I611 HydrophobicContact CE1-CG1 4.32Å; F607-I611 HydrophobicContact CZ-CD1 3.81Å; F607-I611 PolarHBondContact O-N 3.44Å
608	G	71.3	Confident	73.2	Confident	29 Å²	29	77.8 Å²	77.8	30%	0.299	42%	0.422	S	S	.	.	H	α-helix	trans	-62.4	-47	176.5	0	0	0	0	0	112.9	L604 G605 G610 I611 I612	L604-G608 PolarHBondContact O-N 3.36Å; G605-G608 PolarHBondContact O-N 3.48Å; G608-G610 VanDerWaalsContact C-N 3.32Å; G608-G610 PolarHBondContact O-N 2.9Å; G608-I611 PolarHBondContact O-N 3.38Å; G608-I612 WeakPolarHBondContact O-CG1 3.5Å; G608-I612 PolarHBondContact O-N 3Å
609	Y	71.4	Confident	73.8	Confident	147 Å²	147	73.7 Å²	73.7	58%	0.576	40%	0.4	S	S	*	.	H	α-helix	trans	-62.6	-39.1	175	-179.5	-110.8	0	0	0	112.2	G605 L606 I612 K613	G605-Y609 WeakPolarHBondContact O-CB 3.41Å; G605-Y609 PolarHBondContact O-N 2.99Å; L606-Y609 PolarHBondContact O-N 3.25Å; Y609-I612 PolarHBondContact O-N 3.41Å; Y609-K613 PolarHBondContact O-N 3.45Å
610	G	69.3	Low	74.5	Confident	14 Å²	14	73.1 Å²	73.1	14%	0.144	39%	0.391	C	S	.	.	H	α-helix	trans	-58.1	-47.9	172.9	0	0	0	0	0	112.2	L606 F607 G608 K613 L614	L606-G610 PolarHBondContact O-N 2.98Å; F607-G610 PolarHBondContact O-N 3.25Å; G608-G610 VanDerWaalsContact C-N 3.32Å; G608-G610 PolarHBondContact O-N 2.9Å; G610-K613 PolarHBondContact O-N 2.99Å; G610-L614 VanDerWaalsContact O-CD1 3.3Å; G610-L614 WeakPolarHBondContact O-CD1 3.39Å; G610-L614 VanDerWaalsContact O-CG 3.22Å; G610-L614 WeakPolarHBondContact O-CG 3.45Å; G610-L614 PolarHBondContact O-N 3.46Å
611	I	71.8	Confident	75.3	Confident	42 Å²	42	74 Å²	74	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-60.7	-45.4	175.1	-74.8	-177.8	0	0	0	111.6	F96 P99 F607 G608 K613 L614 F615	F96-I611 HydrophobicContact CD1-CD1 4.17Å; P99-I611 HydrophobicContact CG-CG1 4.26Å; F607-I611 HydrophobicContact CD1-CD1 3.98Å; F607-I611 HydrophobicContact CE1-CD1 3.35Å; F607-I611 HydrophobicContact CE1-CG1 4.32Å; F607-I611 HydrophobicContact CZ-CD1 3.81Å; F607-I611 PolarHBondContact O-N 3.44Å; G608-I611 PolarHBondContact O-N 3.38Å; I611-K613 VanDerWaalsContact C-N 3.3Å; I611-K613 PolarHBondContact O-N 2.81Å; I611-L614 PolarHBondContact O-N 3.1Å; I611-L614 VanDerWaalsContact O-N 3.14Å; I611-F615 HydrophobicContact CG2-CD2 3.95Å; I611-F615 HydrophobicContact CG2-CE2 4.12Å; I611-F615 WeakPolarHBondContact O-CD2 3.49Å; I611-F615 PolarHBondContact O-N 2.88Å; I611-F615 VanDerWaalsContact O-N 3.16Å
612	I	72.7	Confident	76	Confident	124 Å²	124	74.1 Å²	74.1	64%	0.636	40%	0.395	S	S	*	.	H	α-helix	trans	-59.1	-43.1	177.8	-67	164.5	0	0	0	110.8	G608 Y609 L614 F615	G608-I612 WeakPolarHBondContact O-CG1 3.5Å; G608-I612 PolarHBondContact O-N 3Å; Y609-I612 PolarHBondContact O-N 3.41Å; I612-L614 VanDerWaalsContact C-N 3.31Å; I612-L614 PolarHBondContact O-N 2.97Å; I612-F615 CarbonylContact O-C 3.5Å; I612-F615 PolarHBondContact O-N 2.96Å
613	K	69.2	Low	76.8	Confident	149 Å²	149	70 Å²	70	65%	0.648	38%	0.381	S	S	*	.	H	α-helix	trans	-73.1	-19.9	179	-162.5	175.1	-178.5	-176.3	0	113.8	Y609 G610 I611	Y609-K613 PolarHBondContact O-N 3.45Å; G610-K613 PolarHBondContact O-N 2.99Å; I611-K613 VanDerWaalsContact C-N 3.3Å; I611-K613 PolarHBondContact O-N 2.81Å
614	L	71.5	Confident	77.7	Confident	15 Å²	15	68.3 Å²	68.3	8%	0.079	37%	0.372	C	S	.	.	H	α-helix	trans	-78.2	-30.7	173.5	-74.4	158.1	0	0	0	112	P99 G610 I611 I612 D616 T750	P99-L614 HydrophobicContact CG-CD1 3.63Å; G610-L614 VanDerWaalsContact O-CD1 3.3Å; G610-L614 WeakPolarHBondContact O-CD1 3.39Å; G610-L614 VanDerWaalsContact O-CG 3.22Å; G610-L614 WeakPolarHBondContact O-CG 3.45Å; G610-L614 PolarHBondContact O-N 3.46Å; I611-L614 PolarHBondContact O-N 3.1Å; I611-L614 VanDerWaalsContact O-N 3.14Å; I612-L614 VanDerWaalsContact C-N 3.31Å; I612-L614 PolarHBondContact O-N 2.97Å; L614-D616 PolarHBondContact O-N 2.88Å; L614-T750 HydrophobicContact CD2-CG2 3.79Å
615	F	74.9	Confident	78.5	Confident	51 Å²	51	63.5 Å²	63.5	22%	0.224	35%	0.347	C	S	.	.			trans	-96.9	56.5	175.6	-67	-65.6	0	0	0	112.5	A95 F96 I611 I612 L617 N755 L758	A95-F615 HydrophobicContact CB-CZ 4.12Å; F96-F615 HydrophobicContact CD1-CE2 4.2Å; F96-F615 AromaticContact CE1-CE2 3.52Å; F96-F615 HydrophobicContact CE1-CE2 3.52Å; F96-F615 AromaticContact CE1-CZ 3.74Å; F96-F615 HydrophobicContact CE1-CZ 3.74Å; F96-F615 HydrophobicContact CE2-CZ 4.31Å; F96-F615 AromaticContact CZ-CE2 3.91Å; F96-F615 HydrophobicContact CZ-CE2 3.91Å; F96-F615 AromaticContact CZ-CZ 3.62Å; F96-F615 HydrophobicContact CZ-CZ 3.62Å; I611-F615 HydrophobicContact CG2-CD2 3.95Å; I611-F615 HydrophobicContact CG2-CE2 4.12Å; I611-F615 WeakPolarHBondContact O-CD2 3.49Å; I611-F615 PolarHBondContact O-N 2.88Å; I611-F615 VanDerWaalsContact O-N 3.16Å; I612-F615 CarbonylContact O-C 3.5Å; I612-F615 PolarHBondContact O-N 2.96Å; F615-L617 PolarHBondContact O-N 3.26Å; F615-N755 VanDerWaalsContact CD1-OD1 3.26Å; F615-N755 WeakPolarHBondContact CD1-OD1 3.12Å; F615-L758 HydrophobicContact CD1-CD2 4.44Å; F615-L758 HydrophobicContact CE1-CD2 3.47Å; F615-L758 VanDerWaalsContact CE1-CD2 3.47Å; F615-L758 HydrophobicContact CZ-CD2 3.95Å
616	D	77.2	Confident	79.7	Confident	48 Å²	48	65.3 Å²	65.3	26%	0.257	35%	0.346	S	S	.	.			trans	-65.8	96.5	168	-176.7	-4.5	0	0	0	109.6	L614 G618 L619 H748 A751 N755	L614-D616 PolarHBondContact O-N 2.88Å; D616-G618 PolarHBondContact O-N 2.92Å; D616-G618 WeakPolarHBondContact OD1-CA 3.32Å; D616-G618 PolarHBondContact OD1-N 3.27Å; D616-L619 HydrophobicContact CB-CD1 4.03Å; D616-L619 HydrophobicContact CB-CG 4.35Å; D616-H748 IonicContact OD2-CE1 2.7Å; D616-H748 PolarHBondContact OD2-CE1 2.82Å; D616-H748 IonicContact OD2-ND1 3.54Å; D616-H748 PolarHBondContact OD2-ND1 3.13Å; D616-A751 HydrophobicContact CB-CB 3.98Å; D616-N755 PolarHBondContact O-ND2 2.68Å
617	L	81.9	Confident	80.9	Confident	123 Å²	123	63.9 Å²	63.9	64%	0.644	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-73.9	-14.3	178.4	-65.2	180	0	0	0	112.7	F615 L619 F620	F615-L617 PolarHBondContact O-N 3.26Å; L617-L619 PolarHBondContact O-N 3.27Å; L617-F620 HydrophobicContact CD2-CD2 4.19Å; L617-F620 HydrophobicContact CD2-CE2 4.2Å; L617-F620 PolarHBondContact O-N 2.75Å; L617-F620 VanDerWaalsContact O-N 3.11Å
618	G	84	Confident	82	Confident	41 Å²	41	61.6 Å²	61.6	42%	0.423	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-61.9	-30.3	174.7	0	0	0	0	0	112	D616 F620 T621	D616-G618 PolarHBondContact O-N 2.92Å; D616-G618 WeakPolarHBondContact OD1-CA 3.32Å; D616-G618 PolarHBondContact OD1-N 3.27Å; G618-F620 PolarHBondContact O-N 3.48Å; G618-F620 VanDerWaalsContact O-N 3.08Å; G618-T621 PolarHBondContact O-N 3Å; G618-T621 PolarHBondContact O-OG1 3.48Å
619	L	84.8	Confident	83.1	Confident	11 Å²	11	60.8 Å²	60.8	6%	0.058	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-55.9	-27.8	173.9	-69.5	167.5	0	0	0	113.5	D616 L617 T621 E622 F625 H748 A751 S752	D616-L619 HydrophobicContact CB-CD1 4.03Å; D616-L619 HydrophobicContact CB-CG 4.35Å; L617-L619 PolarHBondContact O-N 3.27Å; L619-T621 VanDerWaalsContact C-N 3.28Å; L619-T621 PolarHBondContact O-N 2.92Å; L619-E622 PolarHBondContact O-N 3.38Å; L619-F625 HydrophobicContact CB-CD1 3.85Å; L619-F625 HydrophobicContact CB-CE1 3.96Å; L619-F625 HydrophobicContact CB-CG 4.29Å; L619-F625 WeakPolarHBondContact O-CB 3.38Å; L619-F625 WeakPolarHBondContact O-CD1 3.39Å; L619-H748 HydrophobicContact CD1-CB 4.45Å; L619-H748 HydrophobicContact CD2-CB 3.9Å; L619-A751 HydrophobicContact CD1-CB 3.87Å; L619-S752 VanDerWaalsContact CD1-OG 3.29Å; L619-S752 WeakPolarHBondContact CD1-OG 3.46Å; L619-S752 WeakPolarHBondContact CD2-OG 3.28Å
620	F	89.1	Confident	84.3	Confident	60 Å²	60	54.7 Å²	54.7	26%	0.263	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-77.6	-6	178.4	-68.4	-86.2	0	0	0	114.3	L617 G618 F625 L626 V629 N755 L759	L617-F620 HydrophobicContact CD2-CD2 4.19Å; L617-F620 HydrophobicContact CD2-CE2 4.2Å; L617-F620 PolarHBondContact O-N 2.75Å; L617-F620 VanDerWaalsContact O-N 3.11Å; G618-F620 PolarHBondContact O-N 3.48Å; G618-F620 VanDerWaalsContact O-N 3.08Å; F620-F625 HydrophobicContact CD1-CD1 4.34Å; F620-F625 HydrophobicContact CD1-CE1 4.07Å; F620-F625 HydrophobicContact CD2-CE1 4.34Å; F620-F625 HydrophobicContact CE1-CD1 4.48Å; F620-F625 AromaticContact CE1-CE1 3.81Å; F620-F625 HydrophobicContact CE1-CE1 3.81Å; F620-F625 HydrophobicContact CE2-CE1 4.11Å; F620-F625 HydrophobicContact CG-CE1 4.33Å; F620-F625 AromaticContact CZ-CE1 3.84Å; F620-F625 HydrophobicContact CZ-CE1 3.84Å; F620-L626 HydrophobicContact CB-CD2 4.49Å; F620-L626 HydrophobicContact CD1-CD2 4.18Å; F620-L626 WeakPolarHBondContact O-CD2 3.23Å; F620-V629 HydrophobicContact CE1-CG1 4.4Å; F620-V629 HydrophobicContact CE1-CG2 3.99Å; F620-N755 HydrophobicContact CE2-CB 4.12Å; F620-N755 HydrophobicContact CZ-CB 4.08Å; F620-L759 HydrophobicContact CE1-CD1 3.59Å; F620-L759 HydrophobicContact CZ-CD1 3.71Å
621	T	88.6	Confident	85.5	Confident	113 Å²	113	54.7 Å²	54.7	69%	0.693	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-84	-16.8	167.4	61.4	0	0	0	0	112.8	G618 L619 P623	G618-T621 PolarHBondContact O-N 3Å; G618-T621 PolarHBondContact O-OG1 3.48Å; L619-T621 VanDerWaalsContact C-N 3.28Å; L619-T621 PolarHBondContact O-N 2.92Å; T621-P623 WeakPolarHBondContact O-CD 3.23Å
622	E	87.5	Confident	86.6	Confident	95 Å²	95	52.9 Å²	52.9	44%	0.444	28%	0.283	S	S	.	.			trans	-79.3	117.8	-179.9	-84.5	-58.9	140.7	0	0	112.4	L619 S624 F625 L626	L619-E622 PolarHBondContact O-N 3.38Å; E622-S624 PolarHBondContact O-N 3.5Å; E622-F625 HydrophobicContact CB-CB 4.16Å; E622-F625 PolarHBondContact O-N 2.86Å; E622-L626 PolarHBondContact O-N 3.4Å
623	P	90.5	Very high	87.7	Confident	50 Å²	50	48.3 Å²	48.3	33%	0.325	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-32.9	-178.3	-24.3	34.8	0	0	0	113.2	T621 F625 L626 Y627 Y805	T621-P623 WeakPolarHBondContact O-CD 3.23Å; P623-F625 VanDerWaalsContact C-N 3.33Å; P623-F625 PolarHBondContact O-N 3Å; P623-L626 PolarHBondContact O-N 2.86Å; P623-Y627 WeakPolarHBondContact O-CD2 3.45Å; P623-Y627 PolarHBondContact O-N 3.19Å; P623-Y805 HydrophobicContact CB-CE1 4.26Å; P623-Y805 HydrophobicContact CB-CE2 3.97Å; P623-Y805 HydrophobicContact CG-CE2 4.4Å
624	S	90.7	Very high	89	Confident	15 Å²	15	42.3 Å²	42.3	11%	0.105	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-42.9	175.3	-43.5	0	0	0	0	111.7	E622 Y627 L628 Y805	E622-S624 PolarHBondContact O-N 3.5Å; S624-Y627 PolarHBondContact O-N 3.09Å; S624-L628 PolarHBondContact O-N 3.42Å; S624-Y805 WeakPolarHBondContact OG-CE1 3.43Å
625	F	92	Very high	90.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-74.1	-38.1	178.8	-174.5	-107.5	0	0	0	111.5	L619 F620 E622 P623 Y627 L628 V629 L740 S752 N755	L619-F625 HydrophobicContact CB-CD1 3.85Å; L619-F625 HydrophobicContact CB-CE1 3.96Å; L619-F625 HydrophobicContact CB-CG 4.29Å; L619-F625 WeakPolarHBondContact O-CB 3.38Å; L619-F625 WeakPolarHBondContact O-CD1 3.39Å; F620-F625 HydrophobicContact CD1-CD1 4.34Å; F620-F625 HydrophobicContact CD1-CE1 4.07Å; F620-F625 HydrophobicContact CD2-CE1 4.34Å; F620-F625 HydrophobicContact CE1-CD1 4.48Å; F620-F625 AromaticContact CE1-CE1 3.81Å; F620-F625 HydrophobicContact CE1-CE1 3.81Å; F620-F625 HydrophobicContact CE2-CE1 4.11Å; F620-F625 HydrophobicContact CG-CE1 4.33Å; F620-F625 AromaticContact CZ-CE1 3.84Å; F620-F625 HydrophobicContact CZ-CE1 3.84Å; E622-F625 HydrophobicContact CB-CB 4.16Å; E622-F625 PolarHBondContact O-N 2.86Å; P623-F625 VanDerWaalsContact C-N 3.33Å; P623-F625 PolarHBondContact O-N 3Å; F625-Y627 VanDerWaalsContact C-N 3.29Å; F625-Y627 PolarHBondContact O-N 3.31Å; F625-L628 PolarHBondContact O-N 3.46Å; F625-L628 VanDerWaalsContact O-N 3.1Å; F625-V629 HydrophobicContact CD1-CG2 3.87Å; F625-V629 HydrophobicContact CE1-CG2 3.49Å; F625-V629 VanDerWaalsContact CE1-CG2 3.49Å; F625-V629 HydrophobicContact CE2-CG2 4.22Å; F625-V629 HydrophobicContact CG-CG2 4.41Å; F625-V629 HydrophobicContact CZ-CG2 3.67Å; F625-V629 WeakPolarHBondContact O-CB 3.48Å; F625-V629 WeakPolarHBondContact O-CG2 3.36Å; F625-V629 PolarHBondContact O-N 2.91Å; F625-L740 HydrophobicContact CD2-CD2 4.21Å; F625-L740 HydrophobicContact CE2-CD2 3.95Å; F625-S752 WeakPolarHBondContact CE2-O 3.43Å; F625-N755 HydrophobicContact CE1-CB 4.39Å; F625-N755 HydrophobicContact CZ-CB 3.88Å
626	L	94.1	Very high	91.1	Very high	83 Å²	83	40.8 Å²	40.8	44%	0.435	23%	0.231	S	C	.	.	H	α-helix	trans	-58.2	-39.1	172.1	-70.1	176.7	0	0	0	112.5	F620 E622 P623 V629 G630	F620-L626 HydrophobicContact CB-CD2 4.49Å; F620-L626 HydrophobicContact CD1-CD2 4.18Å; F620-L626 WeakPolarHBondContact O-CD2 3.23Å; E622-L626 PolarHBondContact O-N 3.4Å; P623-L626 PolarHBondContact O-N 2.86Å; L626-V629 PolarHBondContact O-N 2.85Å; L626-G630 PolarHBondContact O-N 3.2Å
627	Y	94.8	Very high	91.9	Very high	75 Å²	75	40.1 Å²	40.1	29%	0.294	23%	0.228	S	C	.	.	H	α-helix	trans	-62.8	-46.2	171.2	-92.6	-68.2	0	0	0	112.5	P623 S624 F625 V629 G630 I631 L798 L802 Y805	P623-Y627 WeakPolarHBondContact O-CD2 3.45Å; P623-Y627 PolarHBondContact O-N 3.19Å; S624-Y627 PolarHBondContact O-N 3.09Å; F625-Y627 VanDerWaalsContact C-N 3.29Å; F625-Y627 PolarHBondContact O-N 3.31Å; Y627-V629 VanDerWaalsContact C-N 3.33Å; Y627-V629 PolarHBondContact O-N 2.73Å; Y627-G630 PolarHBondContact O-N 2.93Å; Y627-I631 WeakPolarHBondContact O-CB 3.25Å; Y627-I631 WeakPolarHBondContact O-CD1 3.31Å; Y627-I631 VanDerWaalsContact O-CG1 3.26Å; Y627-I631 WeakPolarHBondContact O-CG1 3.42Å; Y627-I631 PolarHBondContact O-N 3.02Å; Y627-L798 HydrophobicContact CD1-CB 4.5Å; Y627-L798 HydrophobicContact CD1-CD2 4.23Å; Y627-L798 WeakPolarHBondContact CD1-O 3.42Å; Y627-L798 HydrophobicContact CE1-CD2 4.15Å; Y627-L802 HydrophobicContact CD1-CB 4.19Å; Y627-L802 HydrophobicContact CG-CB 4.02Å; Y627-L802 HydrophobicContact CG-CD1 4.38Å; Y627-Y805 HydrophobicContact CE2-CG 4.45Å
628	L	94.3	Very high	92.6	Very high	9 Å²	9	34.3 Å²	34.3	5%	0.047	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-38.4	176.8	-69.5	177.2	0	0	0	112.5	S624 F625 G632 L739 L740 F743 L756 L802	S624-L628 PolarHBondContact O-N 3.42Å; F625-L628 PolarHBondContact O-N 3.46Å; F625-L628 VanDerWaalsContact O-N 3.1Å; L628-G632 PolarHBondContact O-N 3.46Å; L628-L739 HydrophobicContact CD2-CB 3.99Å; L628-L739 HydrophobicContact CD2-CD1 4.45Å; L628-L740 HydrophobicContact CD1-CD2 3.84Å; L628-L740 HydrophobicContact CD1-CG 4.34Å; L628-F743 HydrophobicContact CD1-CB 3.95Å; L628-F743 HydrophobicContact CD1-CD2 4.17Å; L628-F743 HydrophobicContact CD1-CG 4.48Å; L628-F743 HydrophobicContact CD2-CD2 4.44Å; L628-L756 WeakPolarHBondContact O-CD1 3.29Å; L628-L802 HydrophobicContact CD2-CD2 3.64Å; L628-L802 HydrophobicContact CG-CD2 4.22Å
629	V	95.1	Very high	93.1	Very high	12 Å²	12	33.5 Å²	33.5	7%	0.073	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-46.6	173.1	167.2	0	0	0	0	110.9	F620 F625 L626 Y627 G632 I633 L756 L759	F620-V629 HydrophobicContact CE1-CG1 4.4Å; F620-V629 HydrophobicContact CE1-CG2 3.99Å; F625-V629 HydrophobicContact CD1-CG2 3.87Å; F625-V629 HydrophobicContact CE1-CG2 3.49Å; F625-V629 VanDerWaalsContact CE1-CG2 3.49Å; F625-V629 HydrophobicContact CE2-CG2 4.22Å; F625-V629 HydrophobicContact CG-CG2 4.41Å; F625-V629 HydrophobicContact CZ-CG2 3.67Å; F625-V629 WeakPolarHBondContact O-CB 3.48Å; F625-V629 WeakPolarHBondContact O-CG2 3.36Å; F625-V629 PolarHBondContact O-N 2.91Å; L626-V629 PolarHBondContact O-N 2.85Å; Y627-V629 VanDerWaalsContact C-N 3.33Å; Y627-V629 PolarHBondContact O-N 2.73Å; V629-G632 PolarHBondContact O-N 3Å; V629-I633 HydrophobicContact CG1-CD1 3.63Å; V629-I633 HydrophobicContact CG1-CG1 4.38Å; V629-I633 WeakPolarHBondContact O-CB 3.5Å; V629-I633 VanDerWaalsContact O-CG1 3.31Å; V629-I633 WeakPolarHBondContact O-CG1 3.26Å; V629-I633 PolarHBondContact O-N 2.81Å; V629-L756 HydrophobicContact CG2-CD1 4.15Å; V629-L759 HydrophobicContact CG1-CD1 3.63Å; V629-L759 HydrophobicContact CG2-CD1 4.36Å
630	G	95.8	Very high	93.5	Very high	19 Å²	19	33.4 Å²	33.4	20%	0.196	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-45.3	175.6	0	0	0	0	0	112.8	L626 Y627 T634	L626-G630 PolarHBondContact O-N 3.2Å; Y627-G630 PolarHBondContact O-N 2.93Å; G630-T634 WeakPolarHBondContact O-CB 3.41Å; G630-T634 WeakPolarHBondContact O-CG2 3.47Å; G630-T634 PolarHBondContact O-N 3.47Å; G630-T634 PolarHBondContact O-OG1 2.97Å
631	I	95.9	Very high	93.8	Very high	13 Å²	13	30.6 Å²	30.6	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-57.9	-48.5	174	-73.9	163.9	0	0	0	110.9	Y627 T634 S635 S795 L798 H799 L802	Y627-I631 WeakPolarHBondContact O-CB 3.25Å; Y627-I631 WeakPolarHBondContact O-CD1 3.31Å; Y627-I631 VanDerWaalsContact O-CG1 3.26Å; Y627-I631 WeakPolarHBondContact O-CG1 3.42Å; Y627-I631 PolarHBondContact O-N 3.02Å; I631-T634 PolarHBondContact O-OG1 2.89Å; I631-S635 WeakPolarHBondContact O-CB 3.39Å; I631-S635 PolarHBondContact O-N 3.3Å; I631-S635 PolarHBondContact O-OG 2.75Å; I631-S795 PolarHBondContact O-OG 3.49Å; I631-S795 VanDerWaalsContact O-OG 3.13Å; I631-L798 HydrophobicContact CD1-CB 4.48Å; I631-L798 HydrophobicContact CG1-CB 3.64Å; I631-H799 HydrophobicContact CD1-CB 4.41Å; I631-H799 WeakPolarHBondContact CG2-CE1 3.29Å; I631-L802 HydrophobicContact CD1-CB 4.39Å; I631-L802 HydrophobicContact CD1-CD2 3.86Å
632	G	94.1	Very high	94	Very high	4 Å²	4	25.2 Å²	25.2	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-50.2	179.9	0	0	0	0	0	112.1	L628 V629 S635 Q636	L628-G632 PolarHBondContact O-N 3.46Å; V629-G632 PolarHBondContact O-N 3Å; G632-S635 PolarHBondContact O-OG 2.87Å; G632-Q636 WeakPolarHBondContact O-CB 3.4Å; G632-Q636 PolarHBondContact O-N 3.42Å
633	I	95.7	Very high	94.1	Very high	29 Å²	29	20.9 Å²	20.9	15%	0.149	12%	0.115	C	C	.	.	H	α-helix	trans	-59.7	-50.4	178.3	-73.1	171.4	0	0	0	111.4	V629 Q636 L637 L759 F763	V629-I633 HydrophobicContact CG1-CD1 3.63Å; V629-I633 HydrophobicContact CG1-CG1 4.38Å; V629-I633 WeakPolarHBondContact O-CB 3.5Å; V629-I633 VanDerWaalsContact O-CG1 3.31Å; V629-I633 WeakPolarHBondContact O-CG1 3.26Å; V629-I633 PolarHBondContact O-N 2.81Å; I633-Q636 PolarHBondContact O-N 2.85Å; I633-L637 WeakPolarHBondContact O-CG 3.18Å; I633-L637 PolarHBondContact O-N 3.44Å; I633-L759 HydrophobicContact CD1-CB 4.3Å; I633-L759 HydrophobicContact CD1-CD1 4.49Å; I633-L759 HydrophobicContact CG1-CB 4.3Å; I633-F763 HydrophobicContact CB-CD2 4.24Å; I633-F763 HydrophobicContact CB-CG 4.36Å; I633-F763 HydrophobicContact CD1-CD2 3.92Å; I633-F763 HydrophobicContact CD1-CE2 3.7Å; I633-F763 HydrophobicContact CD1-CZ 4.43Å; I633-F763 HydrophobicContact CG1-CD2 3.64Å; I633-F763 HydrophobicContact CG1-CE2 3.98Å; I633-F763 HydrophobicContact CG1-CG 4.22Å; I633-F763 HydrophobicContact CG2-CB 4.21Å; I633-F763 HydrophobicContact CG2-CD1 3.69Å; I633-F763 HydrophobicContact CG2-CD2 3.76Å; I633-F763 HydrophobicContact CG2-CE1 3.9Å; I633-F763 HydrophobicContact CG2-CE2 3.98Å; I633-F763 HydrophobicContact CG2-CG 3.61Å; I633-F763 HydrophobicContact CG2-CZ 4.05Å
634	T	96.3	Very high	94.3	Very high	22 Å²	22	18.6 Å²	18.6	14%	0.135	10%	0.1	C	C	.	.	H	α-helix	trans	-69.3	-39.8	-173.5	51.1	0	0	0	0	113.1	G630 I631 C791 V794 S795 L798	G630-T634 WeakPolarHBondContact O-CB 3.41Å; G630-T634 WeakPolarHBondContact O-CG2 3.47Å; G630-T634 PolarHBondContact O-N 3.47Å; G630-T634 PolarHBondContact O-OG1 2.97Å; I631-T634 PolarHBondContact O-OG1 2.89Å; T634-C791 WeakPolarHBondContact O-CB 3.38Å; T634-V794 HydrophobicContact CG2-CG1 3.94Å; T634-S795 VanDerWaalsContact OG1-CA 3.31Å; T634-S795 WeakPolarHBondContact OG1-CA 3.45Å; T634-S795 VanDerWaalsContact OG1-CB 3.3Å; T634-S795 WeakPolarHBondContact OG1-CB 3.49Å; T634-L798 HydrophobicContact CG2-CD1 4.03Å
635	S	95.3	Very high	94.5	Very high	21 Å²	21	17.9 Å²	17.9	15%	0.147	10%	0.095	C	C	.	.	H	α-helix	trans	-67.5	-41.3	171.5	55.1	0	0	0	0	111.9	I631 G632 L637 A638 Y639 Y792	I631-S635 WeakPolarHBondContact O-CB 3.39Å; I631-S635 PolarHBondContact O-N 3.3Å; I631-S635 PolarHBondContact O-OG 2.75Å; G632-S635 PolarHBondContact O-OG 2.87Å; S635-L637 PolarHBondContact O-N 3.32Å; S635-A638 PolarHBondContact O-N 3.38Å; S635-A638 VanDerWaalsContact O-N 3.07Å; S635-Y639 PolarHBondContact O-N 2.98Å; S635-Y792 WeakPolarHBondContact O-CE2 3.43Å
636	Q	94.9	Very high	94.7	Very high	14 Å²	14	17.9 Å²	17.9	7%	0.065	10%	0.095	C	C	.	.	H	α-helix	trans	-72.1	-27	-172.7	-167.6	67.7	78.2	0	0	114.2	L91 G632 I633 A638 K760	L91-Q636 HydrophobicContact CD1-CG 4.34Å; G632-Q636 WeakPolarHBondContact O-CB 3.4Å; G632-Q636 PolarHBondContact O-N 3.42Å; I633-Q636 PolarHBondContact O-N 2.85Å; Q636-A638 PolarHBondContact O-N 3.14Å; Q636-K760 HydrophobicContact CB-CB 4.25Å; Q636-K760 HydrophobicContact CB-CG 4.08Å; Q636-K760 HydrophobicContact CG-CB 3.85Å; Q636-K760 HydrophobicContact CG-CG 4.21Å; Q636-K760 WeakPolarHBondContact CG-O 3.47Å
637	L	95.4	Very high	94.7	Very high	34 Å²	34	14 Å²	14	18%	0.178	7%	0.074	C	C	.	.	H	α-helix	trans	-51.4	-34.3	167	-82.1	168.3	0	0	0	112.4	I633 S635 F763 I766 G767 P768	I633-L637 WeakPolarHBondContact O-CG 3.18Å; I633-L637 PolarHBondContact O-N 3.44Å; S635-L637 PolarHBondContact O-N 3.32Å; L637-F763 HydrophobicContact CD2-CB 4.43Å; L637-F763 HydrophobicContact CD2-CD1 3.91Å; L637-F763 HydrophobicContact CG-CB 4.4Å; L637-F763 HydrophobicContact CG-CD1 4.2Å; L637-I766 HydrophobicContact CD2-CB 4.38Å; L637-I766 HydrophobicContact CD2-CG2 4.18Å; L637-G767 CarbonylContact O-C 3.57Å; L637-G767 VanDerWaalsContact O-CA 3.22Å; L637-G767 WeakPolarHBondContact O-CA 3.4Å; L637-P768 WeakPolarHBondContact O-CD 3.37Å
638	A	94.6	Very high	94.7	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-105.9	-29.3	-171	0	0	0	0	0	114	S635 Q636 F640 I641 A788 C791 Y792	S635-A638 PolarHBondContact O-N 3.38Å; S635-A638 VanDerWaalsContact O-N 3.07Å; Q636-A638 PolarHBondContact O-N 3.14Å; A638-F640 VanDerWaalsContact C-N 3.28Å; A638-F640 PolarHBondContact O-N 3.11Å; A638-I641 WeakPolarHBondContact O-CB 3.47Å; A638-I641 PolarHBondContact O-N 2.85Å; A638-A788 HydrophobicContact CB-CB 3.94Å; A638-C791 HydrophobicContact CB-CB 3.75Å; A638-Y792 HydrophobicContact CB-CD2 3.53Å; A638-Y792 HydrophobicContact CB-CE2 3.58Å
639	Y	94.6	Very high	94.8	Very high	25 Å²	25	10.1 Å²	10.1	10%	0.098	6%	0.059	C	C	.	.	H	α-helix	trans	-48.3	-40.6	-170.5	175.5	-93.8	0	0	0	115.3	S635 P642 F643 H671 Y725 I733	S635-Y639 PolarHBondContact O-N 2.98Å; Y639-P642 WeakPolarHBondContact O-CD 3.38Å; Y639-F643 HydrophobicContact CE1-CE2 4.09Å; Y639-F643 HydrophobicContact CE2-CE2 4.33Å; Y639-F643 AromaticContact CZ-CE2 3.99Å; Y639-F643 WeakPolarHBondContact O-CD2 3.39Å; Y639-H671 PolarHBondContact OH-NE2 3.14Å; Y639-Y725 PolarHBondContact O-OH 2.95Å; Y639-Y725 VanDerWaalsContact O-OH 3.08Å; Y639-I733 HydrophobicContact CE2-CD1 3.93Å
640	F	93.2	Very high	94.8	Very high	9 Å²	9	9.6 Å²	9.6	4%	0.039	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-11.3	-178.3	-70.9	-69.8	0	0	0	115	F53 P87 A638 F643 V644 P768	F53-F640 HydrophobicContact CB-CE1 4.23Å; F53-F640 AromaticContact CD2-CE1 3.99Å; F53-F640 HydrophobicContact CD2-CE1 3.99Å; F53-F640 HydrophobicContact CD2-CZ 4.45Å; F53-F640 HydrophobicContact CG-CE1 4.23Å; P87-F640 HydrophobicContact CB-CD1 4.24Å; P87-F640 HydrophobicContact CB-CD2 3.99Å; P87-F640 HydrophobicContact CB-CE1 3.7Å; P87-F640 HydrophobicContact CB-CE2 3.4Å; P87-F640 VanDerWaalsContact CB-CE2 3.4Å; P87-F640 HydrophobicContact CB-CG 4.38Å; P87-F640 HydrophobicContact CB-CZ 3.26Å; P87-F640 HydrophobicContact CG-CD1 4.04Å; P87-F640 HydrophobicContact CG-CD2 4.32Å; P87-F640 HydrophobicContact CG-CE1 3.89Å; P87-F640 HydrophobicContact CG-CE2 4.17Å; P87-F640 HydrophobicContact CG-CG 4.27Å; P87-F640 HydrophobicContact CG-CZ 3.97Å; A638-F640 VanDerWaalsContact C-N 3.28Å; A638-F640 PolarHBondContact O-N 3.11Å; F640-F643 HydrophobicContact CD1-CD2 4.47Å; F640-F643 PolarHBondContact O-N 3.34Å; F640-V644 PolarHBondContact O-N 3.17Å; F640-V644 VanDerWaalsContact O-N 3.08Å; F640-P768 HydrophobicContact CB-CG 4.08Å
641	I	95.7	Very high	94.8	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-55.9	-45.4	-178.4	-66.2	178.1	0	0	0	111.8	A638 Y645 P768 A771 L784 F785 A788	A638-I641 WeakPolarHBondContact O-CB 3.47Å; A638-I641 PolarHBondContact O-N 2.85Å; I641-Y645 HydrophobicContact CB-CD2 4.4Å; I641-Y645 HydrophobicContact CG2-CD2 3.95Å; I641-Y645 WeakPolarHBondContact O-CB 3.36Å; I641-Y645 VanDerWaalsContact O-CD2 3.32Å; I641-Y645 WeakPolarHBondContact O-CD2 3.47Å; I641-Y645 PolarHBondContact O-N 3.49Å; I641-P768 HydrophobicContact CG1-CB 4.12Å; I641-P768 HydrophobicContact CG1-CG 4.1Å; I641-A771 HydrophobicContact CD1-CB 3.64Å; I641-A771 HydrophobicContact CG1-CB 4.37Å; I641-L784 HydrophobicContact CG2-CB 3.97Å; I641-F785 HydrophobicContact CG2-CE1 4.38Å; I641-A788 HydrophobicContact CB-CB 4.46Å; I641-A788 HydrophobicContact CD1-CB 4.03Å; I641-A788 HydrophobicContact CG2-CB 4.4Å
642	P	94	Very high	94.6	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-68.4	-40.4	178.3	-20.7	35.2	0	0	0	113.2	Y639 V644 L646 L667 Y725 F785	Y639-P642 WeakPolarHBondContact O-CD 3.38Å; P642-V644 VanDerWaalsContact C-N 3.32Å; P642-V644 PolarHBondContact O-N 3.47Å; P642-L646 WeakPolarHBondContact O-CB 3.29Å; P642-L646 PolarHBondContact O-N 3.01Å; P642-L667 HydrophobicContact CB-CD1 3.99Å; P642-Y725 HydrophobicContact CB-CD1 4.39Å; P642-Y725 HydrophobicContact CB-CE1 4.07Å; P642-Y725 HydrophobicContact CG-CD1 4.14Å; P642-Y725 HydrophobicContact CG-CE1 3.63Å; P642-Y725 HydrophobicContact CG-CE2 4.46Å; P642-F785 HydrophobicContact CB-CE1 4.23Å; P642-F785 HydrophobicContact CG-CE1 4.11Å
643	F	90	Very high	94.6	Very high	4 Å²	4	17 Å²	17	2%	0.018	9%	0.091	C	C	.	.	H	α-helix	trans	-64.6	-35.6	-178.9	-64.7	-82.9	0	0	0	112.4	T179 Y639 F640 L667	T179-F643 HydrophobicContact CG2-CE1 4.18Å; Y639-F643 HydrophobicContact CE1-CE2 4.09Å; Y639-F643 HydrophobicContact CE2-CE2 4.33Å; Y639-F643 AromaticContact CZ-CE2 3.99Å; Y639-F643 WeakPolarHBondContact O-CD2 3.39Å; F640-F643 HydrophobicContact CD1-CD2 4.47Å; F640-F643 PolarHBondContact O-N 3.34Å; F643-L667 HydrophobicContact CD1-CD2 4.28Å; F643-L667 HydrophobicContact CE1-CD2 3.54Å; F643-L667 HydrophobicContact CE2-CD2 4.42Å; F643-L667 HydrophobicContact CZ-CD2 3.63Å
644	V	93.6	Very high	94.4	Very high	2 Å²	2	19 Å²	19	1%	0.012	12%	0.118	C	C	.	.	H	α-helix	trans	-83.1	-42.8	178	179.3	0	0	0	0	112.3	F56 G57 F640 P642	F56-V644 HydrophobicContact CD1-CG1 3.94Å; F56-V644 HydrophobicContact CD1-CG2 4.21Å; F56-V644 HydrophobicContact CE1-CG1 3.95Å; G57-V644 WeakPolarHBondContact CA-O 3.47Å; F640-V644 PolarHBondContact O-N 3.17Å; F640-V644 VanDerWaalsContact O-N 3.08Å; P642-V644 VanDerWaalsContact C-N 3.32Å; P642-V644 PolarHBondContact O-N 3.47Å
645	Y	95.7	Very high	94.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-113	-11.1	-164.7	-54	-65.2	0	0	0	116.2	Y60 S80 I641 I647 D648 Y649 P768 I772 L784	Y60-Y645 HydrophobicContact CD1-CD1 4.18Å; Y60-Y645 AromaticContact CE1-CD1 3.64Å; Y60-Y645 HydrophobicContact CE1-CD1 3.64Å; Y60-Y645 AromaticContact CE1-CE1 3.93Å; Y60-Y645 HydrophobicContact CE1-CE1 3.93Å; Y60-Y645 AromaticContact CZ-CE1 3.92Å; S80-Y645 VanDerWaalsContact CB-OH 3.3Å; S80-Y645 WeakPolarHBondContact CB-OH 3.2Å; S80-Y645 PolarHBondContact OG-OH 3.47Å; I641-Y645 HydrophobicContact CB-CD2 4.4Å; I641-Y645 HydrophobicContact CG2-CD2 3.95Å; I641-Y645 WeakPolarHBondContact O-CB 3.36Å; I641-Y645 VanDerWaalsContact O-CD2 3.32Å; I641-Y645 WeakPolarHBondContact O-CD2 3.47Å; I641-Y645 PolarHBondContact O-N 3.49Å; Y645-I647 VanDerWaalsContact C-N 3.34Å; Y645-I647 PolarHBondContact O-N 3.03Å; Y645-D648 PolarHBondContact O-N 2.88Å; Y645-Y649 WeakPolarHBondContact O-CB 3.46Å; Y645-Y649 PolarHBondContact O-N 3.07Å; Y645-P768 HydrophobicContact CE2-CB 4.1Å; Y645-P768 PolarHBondContact OH-O 3.38Å; Y645-I772 HydrophobicContact CD1-CD1 4.39Å; Y645-I772 HydrophobicContact CE1-CB 4.17Å; Y645-I772 HydrophobicContact CE1-CD1 3.97Å; Y645-I772 HydrophobicContact CE1-CG1 4.14Å; Y645-I772 WeakPolarHBondContact OH-CB 3.34Å; Y645-I772 VanDerWaalsContact OH-CG2 3.25Å; Y645-I772 WeakPolarHBondContact OH-CG2 3.41Å; Y645-L784 HydrophobicContact CD2-CD1 4.46Å; Y645-L784 HydrophobicContact CD2-CD2 3.74Å; Y645-L784 HydrophobicContact CE2-CD2 3.94Å; Y645-L784 HydrophobicContact CG-CD1 4.11Å; Y645-L784 HydrophobicContact CG-CD2 4.12Å
646	L	95.4	Very high	94.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-37.9	-173.4	-175.9	59.8	0	0	0	113	P642 Y649 T650 V663 V664 L667 L707 Y721 F785	P642-L646 WeakPolarHBondContact O-CB 3.29Å; P642-L646 PolarHBondContact O-N 3.01Å; L646-Y649 PolarHBondContact O-N 3.46Å; L646-T650 HydrophobicContact CD1-CG2 4.32Å; L646-T650 WeakPolarHBondContact O-CG2 3.27Å; L646-T650 PolarHBondContact O-N 2.94Å; L646-T650 PolarHBondContact O-OG1 2.71Å; L646-V663 HydrophobicContact CD2-CG1 3.75Å; L646-V663 HydrophobicContact CG-CG1 4.25Å; L646-V664 HydrophobicContact CB-CG2 4.39Å; L646-V664 HydrophobicContact CD2-CG2 4.24Å; L646-L667 HydrophobicContact CD2-CD1 3.83Å; L646-L707 HydrophobicContact CD1-CD2 4.5Å; L646-Y721 HydrophobicContact CD1-CD1 4.29Å; L646-Y721 HydrophobicContact CD1-CE1 3.83Å; L646-Y721 HydrophobicContact CD2-CD1 4.42Å; L646-Y721 HydrophobicContact CD2-CE1 3.88Å; L646-F785 HydrophobicContact CB-CZ 4.34Å; L646-F785 HydrophobicContact CD1-CE1 4.44Å; L646-F785 HydrophobicContact CD1-CZ 3.91Å
647	I	95.1	Very high	94.3	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-46.8	176.9	-54.3	-176.2	0	0	0	110.4	V58 L61 Y645 Y649 T650 V651 A660 V661 V664	V58-I647 HydrophobicContact CG2-CD1 3.56Å; L61-I647 HydrophobicContact CD2-CG2 4.13Å; Y645-I647 VanDerWaalsContact C-N 3.34Å; Y645-I647 PolarHBondContact O-N 3.03Å; I647-Y649 VanDerWaalsContact C-N 3.3Å; I647-Y649 PolarHBondContact O-N 2.97Å; I647-T650 PolarHBondContact O-OG1 2.74Å; I647-T650 VanDerWaalsContact O-OG1 3.08Å; I647-V651 HydrophobicContact CG2-CG2 4.45Å; I647-V651 WeakPolarHBondContact O-CB 3.26Å; I647-V651 WeakPolarHBondContact O-CG2 3.44Å; I647-V651 PolarHBondContact O-N 3.29Å; I647-A660 HydrophobicContact CB-CB 4.47Å; I647-A660 HydrophobicContact CG2-CB 3.8Å; I647-V661 HydrophobicContact CD1-CG2 4.09Å; I647-V664 HydrophobicContact CD1-CB 4.5Å; I647-V664 HydrophobicContact CD1-CG2 3.99Å; I647-V664 HydrophobicContact CG1-CB 4.5Å; I647-V664 HydrophobicContact CG1-CG2 3.53Å
648	D	94.8	Very high	94.3	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-34.5	177.5	174.9	50.9	0	0	0	112.6	Y60 R64 Y645 S652 K781	Y60-D648 HydrophobicContact CD1-CB 4.27Å; Y60-D648 HydrophobicContact CE1-CB 4.13Å; R64-D648 IonicContact CZ-OD1 3.45Å; R64-D648 IonicContact CZ-OD2 3.56Å; R64-D648 VanDerWaalsContact NH1-CG 3.28Å; R64-D648 IonicContact NH1-OD1 3.32Å; R64-D648 PolarHBondContact NH1-OD1 3.29Å; R64-D648 IonicContact NH1-OD2 3.49Å; R64-D648 PolarHBondContact NH1-OD2 2.89Å; R64-D648 IonicContact NH2-OD1 2.72Å; R64-D648 IonicContact NH2-OD2 2.71Å; R64-D648 PolarHBondContact NH2-OD2 3.21Å; Y645-D648 PolarHBondContact O-N 2.88Å; D648-S652 PolarHBondContact O-N 3.39Å; D648-S652 VanDerWaalsContact O-N 3.16Å; D648-S652 PolarHBondContact O-OG 3.35Å; D648-K781 PolarHBondContact O-NZ 2.69Å; D648-K781 IonicContact OD1-NZ 2.76Å; D648-K781 PolarHBondContact OD1-NZ 2.75Å; D648-K781 IonicContact OD2-NZ 2.64Å; D648-K781 PolarHBondContact OD2-NZ 2.74Å
649	Y	95.4	Very high	94.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.8	-53.6	176.6	-174.6	-95.7	0	0	0	111.6	Y645 L646 I647 V651 S652 Y653 L707 Y718 K781 D782 F785	Y645-Y649 WeakPolarHBondContact O-CB 3.46Å; Y645-Y649 PolarHBondContact O-N 3.07Å; L646-Y649 PolarHBondContact O-N 3.46Å; I647-Y649 VanDerWaalsContact C-N 3.3Å; I647-Y649 PolarHBondContact O-N 2.97Å; Y649-V651 PolarHBondContact O-N 3.3Å; Y649-S652 PolarHBondContact O-N 3.43Å; Y649-S652 PolarHBondContact O-OG 3.17Å; Y649-Y653 HydrophobicContact CD1-CD2 4.24Å; Y649-Y653 HydrophobicContact CD1-CE2 4.46Å; Y649-Y653 HydrophobicContact CD2-CE2 4.35Å; Y649-Y653 HydrophobicContact CE1-CD2 4.07Å; Y649-Y653 HydrophobicContact CE1-CE2 4.02Å; Y649-Y653 AromaticContact CE2-CE2 3.9Å; Y649-Y653 HydrophobicContact CE2-CE2 3.9Å; Y649-Y653 AromaticContact CZ-CE2 3.74Å; Y649-Y653 WeakPolarHBondContact O-CD2 3.49Å; Y649-Y653 PolarHBondContact O-N 2.98Å; Y649-L707 HydrophobicContact CE1-CD2 4.39Å; Y649-L707 HydrophobicContact CE1-CG 4.38Å; Y649-Y718 AromaticContact CD1-CE1 3.78Å; Y649-Y718 HydrophobicContact CD1-CE1 3.78Å; Y649-Y718 AromaticContact CE1-CE1 3.73Å; Y649-Y718 HydrophobicContact CE1-CE1 3.73Å; Y649-Y718 WeakPolarHBondContact CE1-OH 3.4Å; Y649-K781 HydrophobicContact CD2-CB 3.78Å; Y649-K781 HydrophobicContact CD2-CD 4.49Å; Y649-K781 HydrophobicContact CE2-CB 4Å; Y649-D782 PolarHBondContact OH-OD1 3.46Å; Y649-F785 HydrophobicContact CD1-CD2 4.44Å; Y649-F785 AromaticContact CD1-CE2 3.97Å; Y649-F785 HydrophobicContact CD1-CE2 3.97Å; Y649-F785 AromaticContact CD2-CD2 3.87Å; Y649-F785 HydrophobicContact CD2-CD2 3.87Å; Y649-F785 AromaticContact CD2-CE2 3.58Å; Y649-F785 HydrophobicContact CD2-CE2 3.58Å; Y649-F785 HydrophobicContact CE1-CD2 4.35Å; Y649-F785 HydrophobicContact CE1-CE2 4.34Å; Y649-F785 AromaticContact CE2-CD2 3.78Å; Y649-F785 HydrophobicContact CE2-CD2 3.78Å; Y649-F785 AromaticContact CE2-CE2 3.98Å; Y649-F785 HydrophobicContact CE2-CE2 3.98Å; Y649-F785 HydrophobicContact CG-CD2 4.19Å; Y649-F785 AromaticContact CG-CE2 3.56Å; Y649-F785 HydrophobicContact CG-CE2 3.56Å
650	T	95	Very high	94.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-42.1	180	53.7	0	0	0	0	111.9	L646 I647 S652 Y653 G654 M655 A660 Y718	L646-T650 HydrophobicContact CD1-CG2 4.32Å; L646-T650 WeakPolarHBondContact O-CG2 3.27Å; L646-T650 PolarHBondContact O-N 2.94Å; L646-T650 PolarHBondContact O-OG1 2.71Å; I647-T650 PolarHBondContact O-OG1 2.74Å; I647-T650 VanDerWaalsContact O-OG1 3.08Å; T650-S652 VanDerWaalsContact C-N 3.35Å; T650-S652 PolarHBondContact O-N 3.27Å; T650-Y653 CarbonylContact O-C 3.59Å; T650-Y653 PolarHBondContact O-N 2.76Å; T650-G654 PolarHBondContact O-N 3.27Å; T650-M655 HydrophobicContact CG2-CE 3.98Å; T650-M655 HydrophobicContact CG2-SD 4.14Å; T650-M655 VanDerWaalsContact O-CB 3.24Å; T650-M655 WeakPolarHBondContact O-CB 3.31Å; T650-M655 PolarHBondContact O-N 3.26Å; T650-M655 VanDerWaalsContact O-N 3.14Å; T650-A660 WeakPolarHBondContact OG1-CB 3.3Å; T650-Y718 HydrophobicContact CG2-CD1 3.51Å; T650-Y718 HydrophobicContact CG2-CD2 3.84Å; T650-Y718 HydrophobicContact CG2-CE1 3.61Å; T650-Y718 HydrophobicContact CG2-CE2 3.9Å; T650-Y718 HydrophobicContact CG2-CG 3.64Å
651	V	95.2	Very high	94.5	Very high	43 Å²	43	29.4 Å²	29.4	26%	0.261	17%	0.17	S	C	.	.	H	α-helix	trans	-62.7	-39.4	178.4	171.6	0	0	0	0	111.7	L61 I647 Y649 Y653 G654 M655 A660	L61-V651 HydrophobicContact CD2-CG1 4.44Å; L61-V651 HydrophobicContact CD2-CG2 4.16Å; I647-V651 HydrophobicContact CG2-CG2 4.45Å; I647-V651 WeakPolarHBondContact O-CB 3.26Å; I647-V651 WeakPolarHBondContact O-CG2 3.44Å; I647-V651 PolarHBondContact O-N 3.29Å; Y649-V651 PolarHBondContact O-N 3.3Å; V651-Y653 PolarHBondContact O-N 2.93Å; V651-G654 PolarHBondContact O-N 2.76Å; V651-M655 WeakPolarHBondContact CA-O 3.39Å; V651-A660 HydrophobicContact CG2-CB 3.75Å
652	S	92.9	Very high	94.5	Very high	62 Å²	62	33.3 Å²	33.3	43%	0.434	19%	0.191	S	C	.	.	H	α-helix	trans	-67.7	-18.9	174.2	47.4	0	0	0	0	115.1	D648 Y649 T650 G654 K781	D648-S652 PolarHBondContact O-N 3.39Å; D648-S652 VanDerWaalsContact O-N 3.16Å; D648-S652 PolarHBondContact O-OG 3.35Å; Y649-S652 PolarHBondContact O-N 3.43Å; Y649-S652 PolarHBondContact O-OG 3.17Å; T650-S652 VanDerWaalsContact C-N 3.35Å; T650-S652 PolarHBondContact O-N 3.27Å; S652-G654 VanDerWaalsContact C-N 3.26Å; S652-K781 VanDerWaalsContact CB-NZ 3.25Å; S652-K781 VanDerWaalsContact OG-CD 3.31Å; S652-K781 WeakPolarHBondContact OG-CD 3.48Å; S652-K781 WeakPolarHBondContact OG-CE 3.45Å; S652-K781 PolarHBondContact OG-NZ 2.78Å
653	Y	93.1	Very high	94.6	Very high	87 Å²	87	33.3 Å²	33.3	34%	0.341	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	13.4	169.9	-79	-70.2	0	0	0	113.1	Y649 T650 V651 H713 D782	Y649-Y653 HydrophobicContact CD1-CD2 4.24Å; Y649-Y653 HydrophobicContact CD1-CE2 4.46Å; Y649-Y653 HydrophobicContact CD2-CE2 4.35Å; Y649-Y653 HydrophobicContact CE1-CD2 4.07Å; Y649-Y653 HydrophobicContact CE1-CE2 4.02Å; Y649-Y653 AromaticContact CE2-CE2 3.9Å; Y649-Y653 HydrophobicContact CE2-CE2 3.9Å; Y649-Y653 AromaticContact CZ-CE2 3.74Å; Y649-Y653 WeakPolarHBondContact O-CD2 3.49Å; Y649-Y653 PolarHBondContact O-N 2.98Å; T650-Y653 CarbonylContact O-C 3.59Å; T650-Y653 PolarHBondContact O-N 2.76Å; V651-Y653 PolarHBondContact O-N 2.93Å; Y653-H713 HydrophobicContact CD1-CB 4.4Å; Y653-H713 AromaticContact CD1-CD2 3.54Å; Y653-H713 AromaticContact CD1-CE1 3.95Å; Y653-H713 AromaticContact CD1-CG 3.74Å; Y653-H713 AromaticContact CD1-ND1 3.99Å; Y653-H713 AromaticContact CD1-NE2 3.71Å; Y653-H713 AromaticContact CE1-CD2 3.82Å; Y653-H713 AromaticContact CE1-CE1 3.73Å; Y653-H713 AromaticContact CE1-NE2 3.47Å; Y653-H713 WeakPolarHBondContact CE1-NE2 3.45Å; Y653-H713 HydrophobicContact CG-CB 4.22Å; Y653-H713 AromaticContact CG-CG 3.84Å; Y653-H713 AromaticContact CG-ND1 3.91Å; Y653-H713 AromaticContact CZ-CE1 3.82Å; Y653-D782 PolarHBondContact OH-OD1 3.43Å
654	G	92.8	Very high	94.7	Very high	71 Å²	71	33.1 Å²	33.1	73%	0.732	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.9	11.4	174.2	0	0	0	0	0	115.1	T650 V651 S652	T650-G654 PolarHBondContact O-N 3.27Å; V651-G654 PolarHBondContact O-N 2.76Å; S652-G654 VanDerWaalsContact C-N 3.26Å
655	M	95	Very high	94.8	Very high	24 Å²	24	34.9 Å²	34.9	12%	0.118	20%	0.199	C	C	.	.			trans	-74.5	141.4	172.9	-167.8	179	-67.5	0	0	111.3	T650 V651 S659 A660 V663 F715 Y718	T650-M655 HydrophobicContact CG2-CE 3.98Å; T650-M655 HydrophobicContact CG2-SD 4.14Å; T650-M655 VanDerWaalsContact O-CB 3.24Å; T650-M655 WeakPolarHBondContact O-CB 3.31Å; T650-M655 PolarHBondContact O-N 3.26Å; T650-M655 VanDerWaalsContact O-N 3.14Å; V651-M655 WeakPolarHBondContact CA-O 3.39Å; M655-S659 VanDerWaalsContact SD-C 3.56Å; M655-A660 HydrophobicContact SD-CB 4.05Å; M655-A660 PolarHBondContact SD-N 2.78Å; M655-V663 HydrophobicContact CE-CG2 4.37Å; M655-V663 HydrophobicContact SD-CG2 4.16Å; M655-F715 HydrophobicContact CE-CB 4.07Å; M655-F715 HydrophobicContact CE-CD2 4.32Å; M655-F715 HydrophobicContact SD-CD2 4.24Å; M655-Y718 HydrophobicContact CE-CD2 3.25Å; M655-Y718 HydrophobicContact CE-CE2 3.88Å; M655-Y718 HydrophobicContact CE-CG 3.98Å
656	E	95.4	Very high	94.8	Very high	137 Å²	137	36.7 Å²	36.7	64%	0.64	21%	0.208	S	C	*	.			trans	-65.7	145.3	169.5	-176.3	169	-136.4	0	0	111.7	D658 S659 A660	E656-D658 VanDerWaalsContact C-N 3.31Å; E656-D658 PolarHBondContact O-N 3.23Å; E656-S659 WeakPolarHBondContact O-CB 3.44Å; E656-S659 PolarHBondContact O-N 2.92Å; E656-S659 VanDerWaalsContact O-N 3.13Å; E656-A660 PolarHBondContact O-N 2.95Å
657	Q	94.1	Very high	94.7	Very high	54 Å²	54	36.7 Å²	36.7	25%	0.252	21%	0.208	S	C	.	.	H	α-helix	trans	-60	-38.6	-174.8	-166.6	179	-73.9	0	0	112.8	L61 N187 S659 A660 V661	L61-Q657 HydrophobicContact CD2-CG 4.11Å; N187-Q657 PolarHBondContact OD1-NE2 3.05Å; Q657-S659 PolarHBondContact O-N 3.31Å; Q657-A660 WeakPolarHBondContact O-CB 3.38Å; Q657-A660 PolarHBondContact O-N 3.15Å; Q657-A660 VanDerWaalsContact O-N 3.13Å; Q657-V661 WeakPolarHBondContact O-CG2 3.16Å; Q657-V661 PolarHBondContact O-N 3.33Å
658	D	94.4	Very high	94.6	Very high	89 Å²	89	36.6 Å²	36.6	48%	0.476	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-43.3	177.1	-73.7	23.4	0	0	0	111.4	N187 E656 A660 V661 L662	N187-D658 PolarHBondContact ND2-OD1 3.32Å; E656-D658 VanDerWaalsContact C-N 3.31Å; E656-D658 PolarHBondContact O-N 3.23Å; D658-A660 VanDerWaalsContact C-N 3.32Å; D658-A660 PolarHBondContact O-N 2.73Å; D658-V661 PolarHBondContact O-N 3.36Å; D658-L662 WeakPolarHBondContact O-CG 3.39Å; D658-L662 PolarHBondContact O-N 2.88Å
659	S	96.1	Very high	94.6	Very high	34 Å²	34	40 Å²	40	24%	0.238	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-37.7	172.4	-70.6	0	0	0	0	111.9	M655 E656 Q657 L662 V663 F715	M655-S659 VanDerWaalsContact SD-C 3.56Å; E656-S659 WeakPolarHBondContact O-CB 3.44Å; E656-S659 PolarHBondContact O-N 2.92Å; E656-S659 VanDerWaalsContact O-N 3.13Å; Q657-S659 PolarHBondContact O-N 3.31Å; S659-L662 WeakPolarHBondContact O-CB 3.49Å; S659-L662 PolarHBondContact O-N 2.89Å; S659-V663 WeakPolarHBondContact O-CG2 3.38Å; S659-V663 PolarHBondContact O-N 3.33Å; S659-V663 VanDerWaalsContact O-N 3.15Å; S659-F715 WeakPolarHBondContact O-CE2 3.35Å
660	A	95.4	Very high	94.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-35.6	176.9	0	0	0	0	0	112.9	I647 T650 V651 M655 E656 Q657 D658 V663 V664	I647-A660 HydrophobicContact CB-CB 4.47Å; I647-A660 HydrophobicContact CG2-CB 3.8Å; T650-A660 WeakPolarHBondContact OG1-CB 3.3Å; V651-A660 HydrophobicContact CG2-CB 3.75Å; M655-A660 HydrophobicContact SD-CB 4.05Å; M655-A660 PolarHBondContact SD-N 2.78Å; E656-A660 PolarHBondContact O-N 2.95Å; Q657-A660 WeakPolarHBondContact O-CB 3.38Å; Q657-A660 PolarHBondContact O-N 3.15Å; Q657-A660 VanDerWaalsContact O-N 3.13Å; D658-A660 VanDerWaalsContact C-N 3.32Å; D658-A660 PolarHBondContact O-N 2.73Å; A660-V663 PolarHBondContact O-N 3.11Å; A660-V664 PolarHBondContact O-N 3.43Å
661	V	94.9	Very high	94.4	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-40.6	172.7	170.7	0	0	0	0	111	V58 P183 V184 N187 I647 Q657 D658 V663 V664 M665	V58-V661 HydrophobicContact CG2-CG2 3.99Å; P183-V661 HydrophobicContact CB-CG1 4.06Å; V184-V661 HydrophobicContact CG2-CG1 4.23Å; N187-V661 HydrophobicContact CB-CG1 4.43Å; N187-V661 HydrophobicContact CB-CG2 4.03Å; I647-V661 HydrophobicContact CD1-CG2 4.09Å; Q657-V661 WeakPolarHBondContact O-CG2 3.16Å; Q657-V661 PolarHBondContact O-N 3.33Å; D658-V661 PolarHBondContact O-N 3.36Å; V661-V663 VanDerWaalsContact C-N 3.27Å; V661-V663 PolarHBondContact O-N 2.84Å; V661-V664 PolarHBondContact O-N 3.48Å; V661-M665 HydrophobicContact CG1-CG 4.5Å; V661-M665 HydrophobicContact CG1-SD 4.33Å; V661-M665 WeakPolarHBondContact O-CG 3.17Å; V661-M665 PolarHBondContact O-N 3.41Å
662	L	95.7	Very high	94.1	Very high	82 Å²	82	42.4 Å²	42.4	43%	0.429	23%	0.234	S	C	.	.	H	α-helix	trans	-58	-37.1	173.8	-73.7	169.9	0	0	0	112.5	D658 S659 V664 M665 I666 F715	D658-L662 WeakPolarHBondContact O-CG 3.39Å; D658-L662 PolarHBondContact O-N 2.88Å; S659-L662 WeakPolarHBondContact O-CB 3.49Å; S659-L662 PolarHBondContact O-N 2.89Å; L662-V664 VanDerWaalsContact C-N 3.35Å; L662-V664 PolarHBondContact O-N 3.39Å; L662-M665 HydrophobicContact CD2-CE 4.48Å; L662-M665 HydrophobicContact CD2-SD 3.86Å; L662-M665 WeakPolarHBondContact O-CB 3.34Å; L662-M665 PolarHBondContact O-N 3.44Å; L662-I666 WeakPolarHBondContact O-CG1 3.37Å; L662-I666 PolarHBondContact O-N 2.88Å; L662-F715 HydrophobicContact CB-CE2 3.86Å; L662-F715 HydrophobicContact CB-CZ 4.13Å
663	V	96	Very high	94	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-41.2	173.3	174.3	0	0	0	0	111.7	L646 M655 S659 A660 V661 I666 L667 F715 A722	L646-V663 HydrophobicContact CD2-CG1 3.75Å; L646-V663 HydrophobicContact CG-CG1 4.25Å; M655-V663 HydrophobicContact CE-CG2 4.37Å; M655-V663 HydrophobicContact SD-CG2 4.16Å; S659-V663 WeakPolarHBondContact O-CG2 3.38Å; S659-V663 PolarHBondContact O-N 3.33Å; S659-V663 VanDerWaalsContact O-N 3.15Å; A660-V663 PolarHBondContact O-N 3.11Å; V661-V663 VanDerWaalsContact C-N 3.27Å; V661-V663 PolarHBondContact O-N 2.84Å; V663-I666 PolarHBondContact O-N 3.32Å; V663-L667 PolarHBondContact O-N 3.3Å; V663-F715 HydrophobicContact CG2-CD2 3.73Å; V663-F715 HydrophobicContact CG2-CE2 3.71Å; V663-A722 HydrophobicContact CG1-CB 3.87Å; V663-A722 WeakPolarHBondContact O-CB 3.33Å
664	V	93.6	Very high	93.8	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-72.8	-29.9	177	174.6	0	0	0	0	112.4	P183 L646 I647 A660 V661 L662 L667 S668	P183-V664 HydrophobicContact CG-CG1 4.33Å; L646-V664 HydrophobicContact CB-CG2 4.39Å; L646-V664 HydrophobicContact CD2-CG2 4.24Å; I647-V664 HydrophobicContact CD1-CB 4.5Å; I647-V664 HydrophobicContact CD1-CG2 3.99Å; I647-V664 HydrophobicContact CG1-CB 4.5Å; I647-V664 HydrophobicContact CG1-CG2 3.53Å; A660-V664 PolarHBondContact O-N 3.43Å; V661-V664 PolarHBondContact O-N 3.48Å; L662-V664 VanDerWaalsContact C-N 3.35Å; L662-V664 PolarHBondContact O-N 3.39Å; V664-L667 PolarHBondContact O-N 2.71Å; V664-S668 WeakPolarHBondContact O-CB 3.15Å; V664-S668 PolarHBondContact O-N 3.4Å; V664-S668 PolarHBondContact O-OG 2.97Å
665	M	94	Very high	93.5	Very high	39 Å²	39	37.1 Å²	37.1	19%	0.192	19%	0.187	C	C	.	.	H	α-helix	trans	-64.8	-43.8	169.4	-66.1	170.5	68.2	0	0	111.3	L180 V184 V661 L662 L667 S668 I669	L180-M665 HydrophobicContact CD2-CE 3.82Å; L180-M665 HydrophobicContact CG-CB 4.31Å; L180-M665 HydrophobicContact CG-CE 4.11Å; L180-M665 HydrophobicContact CG-CG 4.25Å; V184-M665 HydrophobicContact CG2-CE 3.81Å; V184-M665 HydrophobicContact CG2-CG 4.02Å; V184-M665 HydrophobicContact CG2-SD 3.31Å; V184-M665 WeakPolarHBondContact CG2-SD 3.01Å; V661-M665 HydrophobicContact CG1-CG 4.5Å; V661-M665 HydrophobicContact CG1-SD 4.33Å; V661-M665 WeakPolarHBondContact O-CG 3.17Å; V661-M665 PolarHBondContact O-N 3.41Å; L662-M665 HydrophobicContact CD2-CE 4.48Å; L662-M665 HydrophobicContact CD2-SD 3.86Å; L662-M665 WeakPolarHBondContact O-CB 3.34Å; L662-M665 PolarHBondContact O-N 3.44Å; M665-L667 PolarHBondContact O-N 2.78Å; M665-S668 WeakPolarHBondContact O-CB 3.21Å; M665-S668 PolarHBondContact O-N 3.39Å; M665-S668 VanDerWaalsContact O-N 3.15Å; M665-I669 WeakPolarHBondContact O-CG1 3.21Å; M665-I669 PolarHBondContact O-N 3.19Å
666	I	95.8	Very high	92.9	Very high	37 Å²	37	40 Å²	40	19%	0.19	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-46.3	175	-68.7	166.3	0	0	0	110.3	L662 V663 S668 I669 F670 F715 S719 A722 S723	L662-I666 WeakPolarHBondContact O-CG1 3.37Å; L662-I666 PolarHBondContact O-N 2.88Å; V663-I666 PolarHBondContact O-N 3.32Å; I666-S668 VanDerWaalsContact C-N 3.26Å; I666-S668 PolarHBondContact O-N 3Å; I666-I669 PolarHBondContact O-N 3.47Å; I666-F670 HydrophobicContact CG2-CD2 4.01Å; I666-F670 HydrophobicContact CG2-CE2 4.22Å; I666-F670 WeakPolarHBondContact O-CD2 3.28Å; I666-F670 PolarHBondContact O-N 3.44Å; I666-F715 HydrophobicContact CD1-CZ 4.16Å; I666-S719 WeakPolarHBondContact CD1-OG 3.22Å; I666-A722 HydrophobicContact CB-CB 4.31Å; I666-A722 HydrophobicContact CG2-CB 3.99Å; I666-S723 WeakPolarHBondContact CG2-OG 3.49Å
667	L	95	Very high	92.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-54.3	-44.8	174.1	-169.3	158.7	0	0	0	111.1	P642 F643 L646 V663 V664 M665 H671 A722 Y725	P642-L667 HydrophobicContact CB-CD1 3.99Å; F643-L667 HydrophobicContact CD1-CD2 4.28Å; F643-L667 HydrophobicContact CE1-CD2 3.54Å; F643-L667 HydrophobicContact CE2-CD2 4.42Å; F643-L667 HydrophobicContact CZ-CD2 3.63Å; L646-L667 HydrophobicContact CD2-CD1 3.83Å; V663-L667 PolarHBondContact O-N 3.3Å; V664-L667 PolarHBondContact O-N 2.71Å; M665-L667 PolarHBondContact O-N 2.78Å; L667-H671 WeakPolarHBondContact O-CB 3.42Å; L667-H671 PolarHBondContact O-N 3.04Å; L667-A722 WeakPolarHBondContact CA-O 3.37Å; L667-A722 HydrophobicContact CB-CB 3.94Å; L667-Y725 HydrophobicContact CD1-CD1 3.86Å; L667-Y725 HydrophobicContact CD1-CE1 4.34Å; L667-Y725 HydrophobicContact CD2-CD1 4.43Å; L667-Y725 HydrophobicContact CG-CD1 4.13Å
668	S	92.9	Very high	91.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.1	-41.8	179.1	-63.2	0	0	0	0	113.8	T179 V664 M665 I666 H671 T672	T179-S668 WeakPolarHBondContact CB-OG 3.27Å; T179-S668 PolarHBondContact O-OG 3.41Å; T179-S668 VanDerWaalsContact O-OG 3.12Å; T179-S668 WeakPolarHBondContact OG1-CB 3.29Å; T179-S668 PolarHBondContact OG1-OG 3.32Å; V664-S668 WeakPolarHBondContact O-CB 3.15Å; V664-S668 PolarHBondContact O-N 3.4Å; V664-S668 PolarHBondContact O-OG 2.97Å; M665-S668 WeakPolarHBondContact O-CB 3.21Å; M665-S668 PolarHBondContact O-N 3.39Å; M665-S668 VanDerWaalsContact O-N 3.15Å; I666-S668 VanDerWaalsContact C-N 3.26Å; I666-S668 PolarHBondContact O-N 3Å; S668-H671 PolarHBondContact O-N 2.9Å; S668-T672 PolarHBondContact O-N 2.87Å; S668-T672 PolarHBondContact O-OG1 3.02Å
669	I	93.8	Very high	90.7	Very high	74 Å²	74	30 Å²	30	38%	0.379	16%	0.163	S	C	.	.	H	α-helix	trans	-61.6	-52.4	176.2	-67.6	164.5	0	0	0	109.5	L180 M665 I666 H671 T672 L673	L180-I669 HydrophobicContact CD1-CD1 4.17Å; L180-I669 HydrophobicContact CD1-CG1 3.77Å; M665-I669 WeakPolarHBondContact O-CG1 3.21Å; M665-I669 PolarHBondContact O-N 3.19Å; I666-I669 PolarHBondContact O-N 3.47Å; I669-H671 VanDerWaalsContact C-N 3.33Å; I669-H671 PolarHBondContact O-N 3.32Å; I669-T672 VanDerWaalsContact O-CB 3.32Å; I669-T672 WeakPolarHBondContact O-CB 3.48Å; I669-T672 PolarHBondContact O-N 3.34Å; I669-T672 VanDerWaalsContact O-N 3.13Å; I669-L673 HydrophobicContact CG2-CD1 4.19Å; I669-L673 WeakPolarHBondContact O-CG 3.46Å; I669-L673 PolarHBondContact O-N 3.11Å
670	F	94.9	Very high	89.9	Confident	70 Å²	70	32.2 Å²	32.2	31%	0.307	17%	0.17	S	C	.	.	H	α-helix	trans	-68.5	-30.8	-179.3	-80.3	-88.8	0	0	0	113.1	I666 L673 G674 S723 G726 L727	I666-F670 HydrophobicContact CG2-CD2 4.01Å; I666-F670 HydrophobicContact CG2-CE2 4.22Å; I666-F670 WeakPolarHBondContact O-CD2 3.28Å; I666-F670 PolarHBondContact O-N 3.44Å; F670-L673 HydrophobicContact CD1-CD1 4.27Å; F670-L673 HydrophobicContact CE1-CD1 4.44Å; F670-L673 PolarHBondContact O-N 3.18Å; F670-G674 PolarHBondContact O-N 3.38Å; F670-S723 VanDerWaalsContact CB-O 3.29Å; F670-S723 WeakPolarHBondContact CB-O 3.33Å; F670-S723 WeakPolarHBondContact CE2-OG 3.46Å; F670-G726 CarbonylContact O-C 3.56Å; F670-L727 HydrophobicContact CB-CB 4.33Å; F670-L727 HydrophobicContact CD1-CB 4.36Å; F670-L727 HydrophobicContact CD1-CD1 4.29Å; F670-L727 WeakPolarHBondContact O-CA 3.33Å; F670-L727 PolarHBondContact O-N 3.39Å
671	H	91.4	Very high	89.3	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.6	-39	169.6	172.8	-128.1	0	0	0	112.6	Y639 L667 S668 I669 R675 G726 I733	Y639-H671 PolarHBondContact OH-NE2 3.14Å; L667-H671 WeakPolarHBondContact O-CB 3.42Å; L667-H671 PolarHBondContact O-N 3.04Å; S668-H671 PolarHBondContact O-N 2.9Å; I669-H671 VanDerWaalsContact C-N 3.33Å; I669-H671 PolarHBondContact O-N 3.32Å; H671-R675 PolarHBondContact CE1-NH2 3.37Å; H671-R675 PolarHBondContact NE2-NE 2.98Å; H671-R675 VanDerWaalsContact NE2-NE 3.17Å; H671-R675 PolarHBondContact NE2-NH2 2.78Å; H671-R675 VanDerWaalsContact NE2-NH2 3.14Å; H671-R675 PolarHBondContact O-N 3.07Å; H671-G726 WeakPolarHBondContact CA-O 3.15Å; H671-I733 WeakPolarHBondContact NE2-CD1 3.39Å
672	T	88.1	Confident	88.4	Confident	25 Å²	25	35.3 Å²	35.3	15%	0.153	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-48.3	171.1	-46.6	0	0	0	0	110.7	G176 S668 I669 G674 R675 I676	G176-T672 VanDerWaalsContact CA-OG1 3.32Å; G176-T672 WeakPolarHBondContact CA-OG1 3.34Å; S668-T672 PolarHBondContact O-N 2.87Å; S668-T672 PolarHBondContact O-OG1 3.02Å; I669-T672 VanDerWaalsContact O-CB 3.32Å; I669-T672 WeakPolarHBondContact O-CB 3.48Å; I669-T672 PolarHBondContact O-N 3.34Å; I669-T672 VanDerWaalsContact O-N 3.13Å; T672-G674 PolarHBondContact O-N 3.16Å; T672-R675 PolarHBondContact O-N 3.38Å; T672-I676 HydrophobicContact CG2-CD1 4.29Å; T672-I676 WeakPolarHBondContact O-CG1 3.13Å; T672-I676 PolarHBondContact O-N 3.41Å
673	L	91.4	Very high	87.4	Confident	75 Å²	75	36.3 Å²	36.3	39%	0.393	19%	0.193	S	C	.	.	H	α-helix	trans	-61.5	-42.1	179.1	-66.8	172.6	0	0	0	111.8	I669 F670 R675 I676 T677	I669-L673 HydrophobicContact CG2-CD1 4.19Å; I669-L673 WeakPolarHBondContact O-CG 3.46Å; I669-L673 PolarHBondContact O-N 3.11Å; F670-L673 HydrophobicContact CD1-CD1 4.27Å; F670-L673 HydrophobicContact CE1-CD1 4.44Å; F670-L673 PolarHBondContact O-N 3.18Å; L673-R675 VanDerWaalsContact C-N 3.31Å; L673-R675 PolarHBondContact O-N 3.28Å; L673-I676 PolarHBondContact O-N 3.5Å; L673-T677 WeakPolarHBondContact O-CG2 3.45Å; L673-T677 PolarHBondContact O-N 3.38Å; L673-T677 PolarHBondContact O-OG1 2.93Å; L673-T677 VanDerWaalsContact O-OG1 3.14Å
674	G	90.2	Very high	86.5	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-35.7	176.9	0	0	0	0	0	113.9	F670 T672 I676 T677 S678 I731	F670-G674 PolarHBondContact O-N 3.38Å; T672-G674 PolarHBondContact O-N 3.16Å; G674-I676 VanDerWaalsContact C-N 3.35Å; G674-T677 PolarHBondContact O-OG1 3.46Å; G674-S678 WeakPolarHBondContact O-CB 3.48Å; G674-S678 PolarHBondContact O-N 3.4Å; G674-S678 PolarHBondContact O-OG 3.46Å; G674-I731 WeakPolarHBondContact O-CG1 3.32Å
675	R	85.9	Confident	85.9	Confident	33 Å²	33	47.6 Å²	47.6	13%	0.125	25%	0.25	C	C	.	.	H	α-helix	trans	-69.6	-30.4	173.3	-68.6	179.5	-177.2	-156.9	0.9	112.5	D50 H671 T672 L673 S678 G730	D50-R675 IonicContact OD1-NH2 2.87Å; H671-R675 PolarHBondContact CE1-NH2 3.37Å; H671-R675 PolarHBondContact NE2-NE 2.98Å; H671-R675 VanDerWaalsContact NE2-NE 3.17Å; H671-R675 PolarHBondContact NE2-NH2 2.78Å; H671-R675 VanDerWaalsContact NE2-NH2 3.14Å; H671-R675 PolarHBondContact O-N 3.07Å; T672-R675 PolarHBondContact O-N 3.38Å; L673-R675 VanDerWaalsContact C-N 3.31Å; L673-R675 PolarHBondContact O-N 3.28Å; R675-S678 PolarHBondContact O-OG 3.2Å; R675-G730 WeakPolarHBondContact CG-O 3.38Å
676	I	82.4	Confident	85.3	Confident	86 Å²	86	53 Å²	53	44%	0.441	28%	0.275	S	S	.	.	H	α-helix	trans	-80.1	-47.9	178	-63.6	167.1	0	0	0	110.7	T672 L673 G674 S678 G679 I680	T672-I676 HydrophobicContact CG2-CD1 4.29Å; T672-I676 WeakPolarHBondContact O-CG1 3.13Å; T672-I676 PolarHBondContact O-N 3.41Å; L673-I676 PolarHBondContact O-N 3.5Å; G674-I676 VanDerWaalsContact C-N 3.35Å; I676-S678 PolarHBondContact O-N 3.07Å; I676-G679 PolarHBondContact O-N 3.36Å; I676-I680 HydrophobicContact CG2-CD1 4.09Å; I676-I680 PolarHBondContact O-N 2.98Å
677	T	84	Confident	84.7	Confident	46 Å²	46	55.2 Å²	55.2	28%	0.282	29%	0.286	S	S	.	.	H	α-helix	trans	-65.7	-40	-177.4	55.1	0	0	0	0	112.1	L673 G674 G679 I680 M681	L673-T677 WeakPolarHBondContact O-CG2 3.45Å; L673-T677 PolarHBondContact O-N 3.38Å; L673-T677 PolarHBondContact O-OG1 2.93Å; L673-T677 VanDerWaalsContact O-OG1 3.14Å; G674-T677 PolarHBondContact O-OG1 3.46Å; T677-G679 VanDerWaalsContact C-N 3.34Å; T677-G679 PolarHBondContact O-N 3.08Å; T677-I680 PolarHBondContact O-N 3.08Å; T677-I680 VanDerWaalsContact O-N 3.13Å; T677-M681 VanDerWaalsContact O-CB 3.31Å; T677-M681 WeakPolarHBondContact O-CB 3.4Å; T677-M681 WeakPolarHBondContact O-CG 3.37Å; T677-M681 PolarHBondContact O-N 2.97Å
678	S	82.9	Confident	84.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.6	-42.5	175.7	46	0	0	0	0	113.5	G674 R675 I676 I680 M681 S682 I731 P734	G674-S678 WeakPolarHBondContact O-CB 3.48Å; G674-S678 PolarHBondContact O-N 3.4Å; G674-S678 PolarHBondContact O-OG 3.46Å; R675-S678 PolarHBondContact O-OG 3.2Å; I676-S678 PolarHBondContact O-N 3.07Å; S678-I680 VanDerWaalsContact C-N 3.34Å; S678-I680 PolarHBondContact O-N 2.82Å; S678-M681 PolarHBondContact O-N 3.36Å; S678-S682 WeakPolarHBondContact O-CB 3.49Å; S678-S682 PolarHBondContact O-N 3.43Å; S678-I731 WeakPolarHBondContact CB-O 3.21Å; S678-P734 WeakPolarHBondContact OG-CG 3.32Å
679	G	70.9	Confident	84.2	Confident	24 Å²	24	58.2 Å²	58.2	25%	0.247	30%	0.303	C	S	.	.	H	α-helix	trans	-62.2	-38.8	174.9	0	0	0	0	0	113	I676 T677 N683	I676-G679 PolarHBondContact O-N 3.36Å; T677-G679 VanDerWaalsContact C-N 3.34Å; T677-G679 PolarHBondContact O-N 3.08Å; G679-N683 VanDerWaalsContact O-CB 3.25Å; G679-N683 WeakPolarHBondContact O-CB 3.22Å; G679-N683 VanDerWaalsContact O-CG 3.32Å; G679-N683 PolarHBondContact O-N 2.93Å; G679-N683 PolarHBondContact O-ND2 3.11Å; G679-N683 VanDerWaalsContact O-ND2 3.08Å
680	I	78.5	Confident	84.1	Confident	79 Å²	79	54.7 Å²	54.7	41%	0.405	29%	0.285	S	S	.	.	H	α-helix	trans	-71.5	-45.2	175.6	-61.5	168.2	0	0	0	110.6	I676 T677 S678 S682 N683 V684 F685	I676-I680 HydrophobicContact CG2-CD1 4.09Å; I676-I680 PolarHBondContact O-N 2.98Å; T677-I680 PolarHBondContact O-N 3.08Å; T677-I680 VanDerWaalsContact O-N 3.13Å; S678-I680 VanDerWaalsContact C-N 3.34Å; S678-I680 PolarHBondContact O-N 2.82Å; I680-S682 PolarHBondContact O-N 2.93Å; I680-N683 PolarHBondContact O-N 3.32Å; I680-V684 HydrophobicContact CG2-CB 4.2Å; I680-V684 HydrophobicContact CG2-CG2 4.1Å; I680-V684 WeakPolarHBondContact O-CA 3.29Å; I680-V684 VanDerWaalsContact O-CB 3.29Å; I680-V684 WeakPolarHBondContact O-CB 3.38Å; I680-V684 PolarHBondContact O-N 3.12Å; I680-F685 HydrophobicContact CG2-CD2 4.15Å; I680-F685 HydrophobicContact CG2-CE2 3.88Å; I680-F685 PolarHBondContact O-N 3.39Å
681	M	83.2	Confident	83.9	Confident	56 Å²	56	57.8 Å²	57.8	28%	0.276	30%	0.296	S	S	.	.	H	α-helix	trans	-63.1	-41.5	-178.2	-73.9	172.2	81.9	0	0	112.7	T677 S678 F685 H686 L687 L692	T677-M681 VanDerWaalsContact O-CB 3.31Å; T677-M681 WeakPolarHBondContact O-CB 3.4Å; T677-M681 WeakPolarHBondContact O-CG 3.37Å; T677-M681 PolarHBondContact O-N 2.97Å; S678-M681 PolarHBondContact O-N 3.36Å; M681-F685 CarbonylContact O-C 3.6Å; M681-H686 PolarHBondContact O-N 3.06Å; M681-L687 HydrophobicContact CB-CD1 4.17Å; M681-L687 HydrophobicContact CE-CD1 3.82Å; M681-L687 HydrophobicContact CG-CD1 4.44Å; M681-L687 WeakPolarHBondContact O-CB 3.3Å; M681-L687 PolarHBondContact O-N 3.37Å; M681-L687 VanDerWaalsContact O-N 3.11Å; M681-L692 HydrophobicContact CB-CD2 3.69Å; M681-L692 HydrophobicContact CE-CD1 3.54Å; M681-L692 HydrophobicContact SD-CD1 4.11Å
682	S	75.8	Confident	84	Confident	15 Å²	15	58.5 Å²	58.5	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-76.3	-33.4	178.6	-161	0	0	0	0	113	S678 I680 S689	S678-S682 WeakPolarHBondContact O-CB 3.49Å; S678-S682 PolarHBondContact O-N 3.43Å; I680-S682 PolarHBondContact O-N 2.93Å; S682-S689 PolarHBondContact OG-OG 2.92Å
683	N	74.6	Confident	84.2	Confident	103 Å²	103	57.5 Å²	57.5	55%	0.551	29%	0.293	S	S	*	.	H	α-helix	trans	-98.4	-35.1	-172	-64.6	-29.4	0	0	0	114.6	G679 I680 H686	G679-N683 VanDerWaalsContact O-CB 3.25Å; G679-N683 WeakPolarHBondContact O-CB 3.22Å; G679-N683 VanDerWaalsContact O-CG 3.32Å; G679-N683 PolarHBondContact O-N 2.93Å; G679-N683 PolarHBondContact O-ND2 3.11Å; G679-N683 VanDerWaalsContact O-ND2 3.08Å; I680-N683 PolarHBondContact O-N 3.32Å; N683-H686 PolarHBondContact O-CE1 2.89Å; N683-H686 PolarHBondContact O-ND1 3.31Å
684	V	77.1	Confident	84.4	Confident	98 Å²	98	54.3 Å²	54.3	59%	0.594	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-42.2	-175.7	-175.4	0	0	0	0	111.4	I680	I680-V684 HydrophobicContact CG2-CB 4.2Å; I680-V684 HydrophobicContact CG2-CG2 4.1Å; I680-V684 WeakPolarHBondContact O-CA 3.29Å; I680-V684 VanDerWaalsContact O-CB 3.29Å; I680-V684 WeakPolarHBondContact O-CB 3.38Å; I680-V684 PolarHBondContact O-N 3.12Å
685	F	81.4	Confident	84.6	Confident	139 Å²	139	60.3 Å²	60.3	61%	0.61	31%	0.31	S	S	*	.	S	Bend	trans	-92.3	1.4	178.1	-63.8	-78.6	0	0	0	113.3	I680 M681 L687	I680-F685 HydrophobicContact CG2-CD2 4.15Å; I680-F685 HydrophobicContact CG2-CE2 3.88Å; I680-F685 PolarHBondContact O-N 3.39Å; M681-F685 CarbonylContact O-C 3.6Å; F685-L687 HydrophobicContact CB-CD1 4.4Å; F685-L687 HydrophobicContact CB-CG 4.07Å; F685-L687 PolarHBondContact O-N 3.44Å
686	H	80.9	Confident	85.1	Confident	154 Å²	154	59 Å²	59	71%	0.713	31%	0.306	S	S	*	.			trans	48.8	29.6	180	-57.3	-47.5	0	0	0	114.7	M681 N683 D688	M681-H686 PolarHBondContact O-N 3.06Å; N683-H686 PolarHBondContact O-CE1 2.89Å; N683-H686 PolarHBondContact O-ND1 3.31Å; H686-D688 PolarHBondContact O-N 2.99Å
687	L	84.2	Confident	85.8	Confident	82 Å²	82	55 Å²	55	43%	0.429	29%	0.286	S	S	.	.			trans	-70.2	130.5	177.6	-63.4	178.5	0	0	0	109.7	M681 F685 S689	M681-L687 HydrophobicContact CB-CD1 4.17Å; M681-L687 HydrophobicContact CE-CD1 3.82Å; M681-L687 HydrophobicContact CG-CD1 4.44Å; M681-L687 WeakPolarHBondContact O-CB 3.3Å; M681-L687 PolarHBondContact O-N 3.37Å; M681-L687 VanDerWaalsContact O-N 3.11Å; F685-L687 HydrophobicContact CB-CD1 4.4Å; F685-L687 HydrophobicContact CB-CG 4.07Å; F685-L687 PolarHBondContact O-N 3.44Å; L687-S689 PolarHBondContact O-N 3.25Å; L687-S689 VanDerWaalsContact O-N 3.17Å
688	D	88.5	Confident	86.4	Confident	55 Å²	55	57 Å²	57	29%	0.294	29%	0.291	S	S	.	.			trans	-60.2	120.1	-177.6	-172.8	-47	0	0	0	110.9	H686 V690 Y691 L692 R742	H686-D688 PolarHBondContact O-N 2.99Å; D688-V690 PolarHBondContact O-N 3.35Å; D688-V690 VanDerWaalsContact O-N 3.1Å; D688-V690 WeakPolarHBondContact OD1-CB 3.24Å; D688-V690 WeakPolarHBondContact OD1-CG2 3.4Å; D688-V690 PolarHBondContact OD1-N 3.39Å; D688-Y691 HydrophobicContact CB-CD2 4.04Å; D688-Y691 PolarHBondContact O-N 3.01Å; D688-Y691 VanDerWaalsContact O-N 3.09Å; D688-L692 PolarHBondContact O-N 3.24Å; D688-R742 IonicContact OD1-CZ 3.93Å; D688-R742 IonicContact OD1-NH1 3.62Å; D688-R742 PolarHBondContact OD1-NH1 3.49Å; D688-R742 IonicContact OD1-NH2 2.78Å; D688-R742 IonicContact OD2-CZ 2.97Å; D688-R742 IonicContact OD2-NH1 3.32Å; D688-R742 PolarHBondContact OD2-NH1 3.41Å; D688-R742 IonicContact OD2-NH2 2.65Å; D688-R742 PolarHBondContact OD2-NH2 3.14Å
689	S	88	Confident	87.1	Confident	8 Å²	8	57.9 Å²	57.9	6%	0.056	30%	0.3	C	S	.	.	H	α-helix	trans	-57.6	-26.3	-175.6	-36.4	0	0	0	0	113.7	S682 L687 S693	S682-S689 PolarHBondContact OG-OG 2.92Å; L687-S689 PolarHBondContact O-N 3.25Å; L687-S689 VanDerWaalsContact O-N 3.17Å; S689-S693 WeakPolarHBondContact O-CB 3.1Å; S689-S693 PolarHBondContact O-N 3.28Å
690	V	91.4	Very high	88.4	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-69.8	-49.5	176.7	-176.4	0	0	0	0	110.2	D688 G694 L739 F743 L802 C803	D688-V690 PolarHBondContact O-N 3.35Å; D688-V690 VanDerWaalsContact O-N 3.1Å; D688-V690 WeakPolarHBondContact OD1-CB 3.24Å; D688-V690 WeakPolarHBondContact OD1-CG2 3.4Å; D688-V690 PolarHBondContact OD1-N 3.39Å; V690-G694 PolarHBondContact O-N 3.26Å; V690-L739 HydrophobicContact CB-CD2 4.36Å; V690-L739 HydrophobicContact CG2-CD2 3.52Å; V690-F743 HydrophobicContact CG2-CE2 3.8Å; V690-F743 HydrophobicContact CG2-CZ 4Å; V690-L802 HydrophobicContact CG1-CD2 4.44Å; V690-L802 HydrophobicContact CG1-CG 4.48Å; V690-C803 HydrophobicContact CG1-CB 3.97Å
691	Y	91.8	Very high	89.3	Confident	135 Å²	135	53 Å²	53	53%	0.529	27%	0.269	S	S	.	.	H	α-helix	trans	-67.2	-39.6	177.5	-78.2	-68.9	0	0	0	111.6	D688 G694 L695 C803	D688-Y691 HydrophobicContact CB-CD2 4.04Å; D688-Y691 PolarHBondContact O-N 3.01Å; D688-Y691 VanDerWaalsContact O-N 3.09Å; Y691-G694 PolarHBondContact O-N 3.17Å; Y691-L695 VanDerWaalsContact O-CB 3.29Å; Y691-L695 WeakPolarHBondContact O-CB 3.32Å; Y691-L695 PolarHBondContact O-N 3.42Å; Y691-C803 WeakPolarHBondContact CE2-SG 3.49Å; Y691-C803 PolarHBondContact OH-SG 2.78Å; Y691-C803 VanDerWaalsContact OH-SG 3.38Å
692	L	92.5	Very high	89.9	Confident	15 Å²	15	53.1 Å²	53.1	8%	0.079	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-45.4	178.5	-178.3	56	0	0	0	112	M681 D688 A696 I731 L735	M681-L692 HydrophobicContact CB-CD2 3.69Å; M681-L692 HydrophobicContact CE-CD1 3.54Å; M681-L692 HydrophobicContact SD-CD1 4.11Å; D688-L692 PolarHBondContact O-N 3.24Å; L692-A696 WeakPolarHBondContact O-CB 3.36Å; L692-A696 PolarHBondContact O-N 3.45Å; L692-A696 VanDerWaalsContact O-N 3.14Å; L692-I731 HydrophobicContact CD1-CG2 4.06Å; L692-I731 HydrophobicContact CG-CG2 3.82Å; L692-L735 HydrophobicContact CB-CD1 4.17Å; L692-L735 HydrophobicContact CD2-CD1 3.89Å; L692-L735 HydrophobicContact CG-CD1 3.86Å
693	S	93.2	Very high	90.9	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-69.3	-37.8	175.3	-174.2	0	0	0	0	112.5	S689 T697 P732 H799	S689-S693 WeakPolarHBondContact O-CB 3.1Å; S689-S693 PolarHBondContact O-N 3.28Å; S693-T697 PolarHBondContact O-N 3.35Å; S693-T697 PolarHBondContact O-OG1 3.34Å; S693-P732 WeakPolarHBondContact OG-CB 3.32Å; S693-H799 VanDerWaalsContact CB-NE2 3.33Å; S693-H799 WeakPolarHBondContact CB-NE2 3.29Å; S693-H799 PolarHBondContact OG-NE2 2.93Å
694	G	95.2	Very high	92	Very high	9 Å²	9	47.9 Å²	47.9	9%	0.093	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-43.4	176.8	0	0	0	0	0	113.5	V690 Y691 T697 F698 H799	V690-G694 PolarHBondContact O-N 3.26Å; Y691-G694 PolarHBondContact O-N 3.17Å; G694-T697 WeakPolarHBondContact CA-OG1 3.24Å; G694-T697 PolarHBondContact O-OG1 3.25Å; G694-T697 VanDerWaalsContact O-OG1 3.07Å; G694-F698 WeakPolarHBondContact O-CB 3.12Å; G694-F698 PolarHBondContact O-N 3.48Å; G694-H799 VanDerWaalsContact CA-CG 3.49Å; G694-H799 PolarHBondContact N-CD2 3.33Å
695	L	95.3	Very high	92.8	Very high	125 Å²	125	44.8 Å²	44.8	65%	0.654	22%	0.224	S	C	*	.	H	α-helix	trans	-68.2	-38.8	176.9	-176.4	62.1	0	0	0	111.6	Y691 F698 G699	Y691-L695 VanDerWaalsContact O-CB 3.29Å; Y691-L695 WeakPolarHBondContact O-CB 3.32Å; Y691-L695 PolarHBondContact O-N 3.42Å; L695-F698 PolarHBondContact O-N 3.45Å; L695-G699 PolarHBondContact O-N 3.42Å
696	A	95.9	Very high	93.5	Very high	6 Å²	6	43 Å²	43	5%	0.05	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-44.5	175.5	0	0	0	0	0	112.2	L692 F698 G699 G700 C728 I731 P732	L692-A696 WeakPolarHBondContact O-CB 3.36Å; L692-A696 PolarHBondContact O-N 3.45Å; L692-A696 VanDerWaalsContact O-N 3.14Å; A696-F698 VanDerWaalsContact C-N 3.33Å; A696-F698 PolarHBondContact O-N 3.49Å; A696-G699 PolarHBondContact O-N 2.83Å; A696-G700 PolarHBondContact O-N 3.32Å; A696-C728 VanDerWaalsContact O-CB 3.28Å; A696-C728 WeakPolarHBondContact O-CB 3.34Å; A696-I731 HydrophobicContact CB-CB 3.7Å; A696-I731 HydrophobicContact CB-CD1 4.1Å; A696-I731 HydrophobicContact CB-CG2 3.55Å; A696-P732 HydrophobicContact CB-CG 4.36Å
697	T	96.3	Very high	94.2	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-36.6	173.9	46	0	0	0	0	112.2	S693 G694 G700 G701 P732 Y792 H799	S693-T697 PolarHBondContact O-N 3.35Å; S693-T697 PolarHBondContact O-OG1 3.34Å; G694-T697 WeakPolarHBondContact CA-OG1 3.24Å; G694-T697 PolarHBondContact O-OG1 3.25Å; G694-T697 VanDerWaalsContact O-OG1 3.07Å; T697-G700 PolarHBondContact O-N 3.46Å; T697-G701 PolarHBondContact O-N 2.83Å; T697-P732 HydrophobicContact CG2-CG 3.94Å; T697-Y792 WeakPolarHBondContact O-CD1 3.35Å; T697-H799 PolarHBondContact OG1-CE1 3.12Å; T697-H799 PolarHBondContact OG1-ND1 3.27Å
698	F	97.6	Very high	94.6	Very high	88 Å²	88	32.4 Å²	32.4	39%	0.386	17%	0.166	S	C	.	.	H	α-helix	trans	-63	-47.1	172.6	-172.3	-118.2	0	0	0	112.4	G694 L695 A696 G700 G701 L702 A796	G694-F698 WeakPolarHBondContact O-CB 3.12Å; G694-F698 PolarHBondContact O-N 3.48Å; L695-F698 PolarHBondContact O-N 3.45Å; A696-F698 VanDerWaalsContact C-N 3.33Å; A696-F698 PolarHBondContact O-N 3.49Å; F698-G700 PolarHBondContact O-N 3.49Å; F698-G701 PolarHBondContact O-N 3.46Å; F698-L702 HydrophobicContact CD1-CD1 3.99Å; F698-L702 HydrophobicContact CE1-CD1 3.52Å; F698-L702 HydrophobicContact CE1-CG 4.22Å; F698-L702 HydrophobicContact CE2-CG 4.4Å; F698-L702 HydrophobicContact CZ-CD1 3.83Å; F698-L702 HydrophobicContact CZ-CD2 4.34Å; F698-L702 HydrophobicContact CZ-CG 4.14Å; F698-L702 PolarHBondContact O-N 3.15Å; F698-A796 HydrophobicContact CB-CB 3.71Å; F698-A796 HydrophobicContact CD2-CB 4.15Å; F698-A796 HydrophobicContact CG-CB 4.41Å
699	G	97.2	Very high	94.6	Very high	19 Å²	19	36.6 Å²	36.6	20%	0.196	18%	0.182	C	C	.	.	H	α-helix	trans	-61.2	-40.7	177.2	0	0	0	0	0	113.2	L695 A696 L702 A703	L695-G699 PolarHBondContact O-N 3.42Å; A696-G699 PolarHBondContact O-N 2.83Å; G699-L702 PolarHBondContact O-N 3.4Å; G699-A703 WeakPolarHBondContact O-CB 3.15Å; G699-A703 PolarHBondContact O-N 2.96Å
700	G	97	Very high	94.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-40.8	173.4	0	0	0	0	0	112.7	A696 T697 F698 A703 H704	A696-G700 PolarHBondContact O-N 3.32Å; T697-G700 PolarHBondContact O-N 3.46Å; F698-G700 PolarHBondContact O-N 3.49Å; G700-A703 PolarHBondContact O-N 2.87Å; G700-H704 PolarHBondContact O-CD2 3.13Å; G700-H704 VanDerWaalsContact O-CD2 3.29Å; G700-H704 PolarHBondContact O-N 3.4Å; G700-H704 VanDerWaalsContact O-N 3.09Å
701	G	97.3	Very high	93.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.8	-45.3	175.6	0	0	0	0	0	112.9	T697 F698 A703 H704 V705 Y792	T697-G701 PolarHBondContact O-N 2.83Å; F698-G701 PolarHBondContact O-N 3.46Å; G701-A703 PolarHBondContact O-N 2.98Å; G701-H704 PolarHBondContact O-N 3.34Å; G701-V705 WeakPolarHBondContact O-CG2 3.43Å; G701-V705 PolarHBondContact O-N 3.32Å; G701-V705 VanDerWaalsContact O-N 3.13Å; G701-Y792 VanDerWaalsContact CA-CB 3.42Å
702	L	97.1	Very high	92.9	Very high	58 Å²	58	42.9 Å²	42.9	30%	0.304	23%	0.226	S	C	.	.	H	α-helix	trans	-61.3	-41.7	172.6	-73.4	-179.7	0	0	0	112.1	F698 G699 H704 V705 F706	F698-L702 HydrophobicContact CD1-CD1 3.99Å; F698-L702 HydrophobicContact CE1-CD1 3.52Å; F698-L702 HydrophobicContact CE1-CG 4.22Å; F698-L702 HydrophobicContact CE2-CG 4.4Å; F698-L702 HydrophobicContact CZ-CD1 3.83Å; F698-L702 HydrophobicContact CZ-CD2 4.34Å; F698-L702 HydrophobicContact CZ-CG 4.14Å; F698-L702 PolarHBondContact O-N 3.15Å; G699-L702 PolarHBondContact O-N 3.4Å; L702-H704 VanDerWaalsContact C-N 3.34Å; L702-H704 PolarHBondContact O-N 3.35Å; L702-V705 PolarHBondContact O-N 3.03Å; L702-F706 HydrophobicContact CB-CD2 4.16Å; L702-F706 HydrophobicContact CB-CE2 4.09Å; L702-F706 HydrophobicContact CD2-CE2 4.22Å; L702-F706 WeakPolarHBondContact O-CB 3.48Å; L702-F706 WeakPolarHBondContact O-CD2 3.29Å; L702-F706 PolarHBondContact O-N 3.12Å
703	A	96.7	Very high	92.6	Very high	8 Å²	8	44.6 Å²	44.6	7%	0.066	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-43.4	177.9	0	0	0	0	0	111.9	G699 G700 G701 L707 Y721 I724	G699-A703 WeakPolarHBondContact O-CB 3.15Å; G699-A703 PolarHBondContact O-N 2.96Å; G700-A703 PolarHBondContact O-N 2.87Å; G701-A703 PolarHBondContact O-N 2.98Å; A703-L707 WeakPolarHBondContact O-CB 3.33Å; A703-L707 PolarHBondContact O-N 3.26Å; A703-Y721 HydrophobicContact CB-CD2 4.02Å; A703-Y721 HydrophobicContact CB-CE2 4.19Å; A703-Y721 WeakPolarHBondContact O-CD2 3.4Å; A703-I724 HydrophobicContact CB-CB 4.35Å; A703-I724 HydrophobicContact CB-CG2 3.86Å
704	H	96.7	Very high	92.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.3	-40.3	174.6	-65.2	-43.4	0	0	0	113.3	G700 G701 L702 Y721 Y725 F785 A788	G700-H704 PolarHBondContact O-CD2 3.13Å; G700-H704 VanDerWaalsContact O-CD2 3.29Å; G700-H704 PolarHBondContact O-N 3.4Å; G700-H704 VanDerWaalsContact O-N 3.09Å; G701-H704 PolarHBondContact O-N 3.34Å; L702-H704 VanDerWaalsContact C-N 3.34Å; L702-H704 PolarHBondContact O-N 3.35Å; H704-Y721 PolarHBondContact CE1-OH 2.86Å; H704-Y721 VanDerWaalsContact CE1-OH 3.27Å; H704-Y721 AromaticContact ND1-CE2 3.61Å; H704-Y721 AromaticContact ND1-CZ 3.74Å; H704-Y721 PolarHBondContact ND1-OH 3.13Å; H704-Y725 AromaticContact CE1-CD2 3.21Å; H704-Y725 WeakPolarHBondContact CE1-CD2 3.21Å; H704-Y725 AromaticContact CE1-CE2 3.17Å; H704-Y725 WeakPolarHBondContact CE1-CE2 3.41Å; H704-Y725 AromaticContact CE1-CG 3.9Å; H704-Y725 AromaticContact CE1-CZ 3.82Å; H704-Y725 AromaticContact ND1-CD2 3.97Å; H704-Y725 AromaticContact NE2-CD2 3.49Å; H704-Y725 WeakPolarHBondContact NE2-CD2 3.21Å; H704-Y725 AromaticContact NE2-CE2 3.14Å; H704-Y725 WeakPolarHBondContact NE2-CE2 3.31Å; H704-Y725 AromaticContact NE2-CZ 3.99Å; H704-F785 HydrophobicContact CB-CB 4.47Å; H704-F785 WeakPolarHBondContact CB-O 3.46Å; H704-F785 AromaticContact ND1-CD1 3.89Å; H704-A788 HydrophobicContact CB-CB 4.38Å
705	V	95.8	Very high	92.5	Very high	34 Å²	34	51 Å²	51	21%	0.206	26%	0.264	C	S	.	.	H	α-helix	trans	-67.5	-48.6	178.1	171.5	0	0	0	0	110.7	G701 L702 L707 V708 F709 I793	G701-V705 WeakPolarHBondContact O-CG2 3.43Å; G701-V705 PolarHBondContact O-N 3.32Å; G701-V705 VanDerWaalsContact O-N 3.13Å; L702-V705 PolarHBondContact O-N 3.03Å; V705-L707 VanDerWaalsContact C-N 3.29Å; V705-L707 PolarHBondContact O-N 3.04Å; V705-V708 PolarHBondContact O-N 3.34Å; V705-F709 HydrophobicContact CG1-CD2 3.85Å; V705-F709 HydrophobicContact CG1-CE2 3.94Å; V705-F709 VanDerWaalsContact O-CD2 3.31Å; V705-F709 WeakPolarHBondContact O-CD2 3.44Å; V705-F709 PolarHBondContact O-N 3.09Å; V705-I793 HydrophobicContact CG2-CD1 4.1Å
706	F	94.8	Very high	92.4	Very high	101 Å²	101	47.9 Å²	47.9	44%	0.443	26%	0.256	S	S	.	.	H	α-helix	trans	-64.4	-31.7	179.6	-74.9	-56.7	0	0	0	112.9	L702 V708 F709 I710 W717	L702-F706 HydrophobicContact CB-CD2 4.16Å; L702-F706 HydrophobicContact CB-CE2 4.09Å; L702-F706 HydrophobicContact CD2-CE2 4.22Å; L702-F706 WeakPolarHBondContact O-CB 3.48Å; L702-F706 WeakPolarHBondContact O-CD2 3.29Å; L702-F706 PolarHBondContact O-N 3.12Å; F706-V708 PolarHBondContact O-N 3.23Å; F706-V708 VanDerWaalsContact O-N 3.16Å; F706-F709 PolarHBondContact O-N 2.77Å; F706-I710 HydrophobicContact CB-CD1 4.05Å; F706-I710 HydrophobicContact CD1-CD1 4.06Å; F706-I710 HydrophobicContact CG-CD1 4.34Å; F706-I710 WeakPolarHBondContact O-CB 3.37Å; F706-I710 WeakPolarHBondContact O-CG1 3.47Å; F706-I710 PolarHBondContact O-N 3.38Å; F706-W717 HydrophobicContact CB-CH2 4.22Å; F706-W717 HydrophobicContact CB-CZ2 4.16Å; F706-W717 WeakPolarHBondContact O-CZ2 3.47Å
707	L	94.9	Very high	92.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-52.7	-36	176.4	-179.9	62.3	0	0	0	113	L646 Y649 A703 V705 Y718 Y721 F785	L646-L707 HydrophobicContact CD1-CD2 4.5Å; Y649-L707 HydrophobicContact CE1-CD2 4.39Å; Y649-L707 HydrophobicContact CE1-CG 4.38Å; A703-L707 WeakPolarHBondContact O-CB 3.33Å; A703-L707 PolarHBondContact O-N 3.26Å; V705-L707 VanDerWaalsContact C-N 3.29Å; V705-L707 PolarHBondContact O-N 3.04Å; L707-Y718 HydrophobicContact CD1-CD1 3.63Å; L707-Y718 HydrophobicContact CD1-CE1 3.62Å; L707-Y721 HydrophobicContact CB-CD2 3.9Å; L707-Y721 HydrophobicContact CB-CE2 4.24Å; L707-Y721 HydrophobicContact CB-CG 4.28Å; L707-Y721 HydrophobicContact CD1-CD1 3.97Å; L707-Y721 HydrophobicContact CD1-CD2 4.23Å; L707-Y721 HydrophobicContact CD1-CG 3.73Å; L707-Y721 HydrophobicContact CD2-CD1 3.89Å; L707-Y721 HydrophobicContact CD2-CD2 4.01Å; L707-Y721 HydrophobicContact CD2-CE1 3.73Å; L707-Y721 HydrophobicContact CD2-CE2 3.86Å; L707-Y721 HydrophobicContact CD2-CG 4.02Å; L707-Y721 HydrophobicContact CG-CD1 4.48Å; L707-Y721 HydrophobicContact CG-CD2 4.27Å; L707-Y721 HydrophobicContact CG-CG 4.24Å; L707-F785 HydrophobicContact CD2-CB 4.21Å; L707-F785 HydrophobicContact CD2-CD1 3.75Å; L707-F785 HydrophobicContact CD2-CD2 3.88Å; L707-F785 HydrophobicContact CD2-CE1 4.07Å; L707-F785 HydrophobicContact CD2-CE2 4.2Å; L707-F785 HydrophobicContact CD2-CG 3.65Å; L707-F785 HydrophobicContact CD2-CZ 4.29Å
708	V	92.5	Very high	92.3	Very high	14 Å²	14	49.3 Å²	49.3	9%	0.085	26%	0.26	C	S	.	.	H	α-helix	trans	-82.3	-44.7	-179.2	171.3	0	0	0	0	111.6	V705 F706 D782 F785 L786	V705-V708 PolarHBondContact O-N 3.34Å; F706-V708 PolarHBondContact O-N 3.23Å; F706-V708 VanDerWaalsContact O-N 3.16Å; V708-D782 HydrophobicContact CG1-CB 3.75Å; V708-D782 HydrophobicContact CG2-CB 4Å; V708-F785 HydrophobicContact CG2-CB 4Å; V708-L786 HydrophobicContact CB-CD2 4.08Å; V708-L786 HydrophobicContact CB-CG 4.5Å; V708-L786 HydrophobicContact CG1-CD1 4.43Å; V708-L786 HydrophobicContact CG1-CD2 4.04Å; V708-L786 HydrophobicContact CG1-CG 4.25Å; V708-L786 HydrophobicContact CG2-CD2 4.15Å; V708-L786 HydrophobicContact CG2-CG 4.16Å
709	F	89	Confident	92.2	Very high	143 Å²	143	45.9 Å²	45.9	63%	0.627	25%	0.247	S	C	*	.	H	α-helix	trans	-81.7	-14.6	-173.9	-69.1	-67.5	0	0	0	114.8	V705 F706 L786	V705-F709 HydrophobicContact CG1-CD2 3.85Å; V705-F709 HydrophobicContact CG1-CE2 3.94Å; V705-F709 VanDerWaalsContact O-CD2 3.31Å; V705-F709 WeakPolarHBondContact O-CD2 3.44Å; V705-F709 PolarHBondContact O-N 3.09Å; F706-F709 PolarHBondContact O-N 2.77Å; F709-L786 HydrophobicContact CE2-CD2 3.92Å; F709-L786 HydrophobicContact CZ-CD2 4.33Å
710	I	80.8	Confident	92.2	Very high	66 Å²	66	49.1 Å²	49.1	34%	0.338	26%	0.259	S	S	.	.	S	Bend	trans	-98.5	102.9	-179.9	-63.7	-178.8	0	0	0	110.7	F706 W717	F706-I710 HydrophobicContact CB-CD1 4.05Å; F706-I710 HydrophobicContact CD1-CD1 4.06Å; F706-I710 HydrophobicContact CG-CD1 4.34Å; F706-I710 WeakPolarHBondContact O-CB 3.37Å; F706-I710 WeakPolarHBondContact O-CG1 3.47Å; F706-I710 PolarHBondContact O-N 3.38Å; I710-W717 HydrophobicContact CB-CD2 4.41Å; I710-W717 HydrophobicContact CB-CH2 4.44Å; I710-W717 HydrophobicContact CB-CZ2 3.74Å; I710-W717 HydrophobicContact CD1-CH2 3.72Å; I710-W717 HydrophobicContact CD1-CZ2 3.82Å; I710-W717 HydrophobicContact CD1-CZ3 4.32Å; I710-W717 HydrophobicContact CG1-CZ2 4.21Å; I710-W717 HydrophobicContact CG2-CD2 3.92Å; I710-W717 HydrophobicContact CG2-CE3 4.34Å; I710-W717 HydrophobicContact CG2-CG 4.34Å; I710-W717 HydrophobicContact CG2-CZ2 4.09Å; I710-W717 PolarHBondContact O-NE1 3Å
711	I	76.7	Confident	92.2	Very high	130 Å²	130	49.2 Å²	49.2	67%	0.667	26%	0.259	S	S	*	.			trans	-95.5	133.5	168.3	-61.2	174.7	0	0	0	106.5
712	P	79.5	Confident	92.1	Very high	80 Å²	80	49.2 Å²	49.2	52%	0.519	26%	0.259	S	S	.	.			cis	-97.5	148.4	22.1	36.5	-36.2	0	0	0	116.3	T714	P712-T714 HydrophobicContact CB-CG2 3.99Å; P712-T714 HydrophobicContact CG-CG2 3.76Å; P712-T714 PolarHBondContact O-N 2.65Å; P712-T714 PolarHBondContact O-OG1 3.41Å
713	H	84.5	Confident	92.1	Very high	50 Å²	50	47.7 Å²	47.7	23%	0.231	25%	0.254	C	S	.	.			trans	-67.1	61.5	174.4	-58.4	-77.1	0	0	0	113.1	Y653 Y718	Y653-H713 HydrophobicContact CD1-CB 4.4Å; Y653-H713 AromaticContact CD1-CD2 3.54Å; Y653-H713 AromaticContact CD1-CE1 3.95Å; Y653-H713 AromaticContact CD1-CG 3.74Å; Y653-H713 AromaticContact CD1-ND1 3.99Å; Y653-H713 AromaticContact CD1-NE2 3.71Å; Y653-H713 AromaticContact CE1-CD2 3.82Å; Y653-H713 AromaticContact CE1-CE1 3.73Å; Y653-H713 AromaticContact CE1-NE2 3.47Å; Y653-H713 WeakPolarHBondContact CE1-NE2 3.45Å; Y653-H713 HydrophobicContact CG-CB 4.22Å; Y653-H713 AromaticContact CG-CG 3.84Å; Y653-H713 AromaticContact CG-ND1 3.91Å; Y653-H713 AromaticContact CZ-CE1 3.82Å; H713-Y718 HydrophobicContact CB-CE2 3.81Å; H713-Y718 PolarHBondContact ND1-OH 3.2Å; H713-Y718 VanDerWaalsContact ND1-OH 3.13Å
714	T	92.3	Very high	92.1	Very high	62 Å²	62	51 Å²	51	38%	0.38	27%	0.269	S	S	.	.			trans	-96.6	151.1	-176.8	55.8	0	0	0	0	112.1	P712 A716 W717 Y718	P712-T714 HydrophobicContact CB-CG2 3.99Å; P712-T714 HydrophobicContact CG-CG2 3.76Å; P712-T714 PolarHBondContact O-N 2.65Å; P712-T714 PolarHBondContact O-OG1 3.41Å; T714-A716 PolarHBondContact O-N 3.34Å; T714-A716 VanDerWaalsContact O-N 3.17Å; T714-W717 PolarHBondContact O-N 2.83Å; T714-W717 WeakPolarHBondContact OG1-CB 3.35Å; T714-W717 PolarHBondContact OG1-N 2.9Å; T714-Y718 WeakPolarHBondContact O-CD2 3.5Å; T714-Y718 PolarHBondContact O-N 3.07Å
715	F	94.4	Very high	92.1	Very high	85 Å²	85	51 Å²	51	37%	0.373	27%	0.269	S	S	.	.	H	α-helix	trans	-51.8	-37.5	173	174.6	-98.6	0	0	0	112.8	M655 S659 L662 V663 I666 S719	M655-F715 HydrophobicContact CE-CB 4.07Å; M655-F715 HydrophobicContact CE-CD2 4.32Å; M655-F715 HydrophobicContact SD-CD2 4.24Å; S659-F715 WeakPolarHBondContact O-CE2 3.35Å; L662-F715 HydrophobicContact CB-CE2 3.86Å; L662-F715 HydrophobicContact CB-CZ 4.13Å; V663-F715 HydrophobicContact CG2-CD2 3.73Å; V663-F715 HydrophobicContact CG2-CE2 3.71Å; I666-F715 HydrophobicContact CD1-CZ 4.16Å; F715-S719 VanDerWaalsContact O-CB 3.29Å; F715-S719 WeakPolarHBondContact O-CB 3.44Å; F715-S719 PolarHBondContact O-N 3.47Å; F715-S719 PolarHBondContact O-OG 2.87Å
716	A	94.4	Very high	92.1	Very high	60 Å²	60	49.4 Å²	49.4	50%	0.496	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-47	174.5	0	0	0	0	0	112.4	T714 S719 I720	T714-A716 PolarHBondContact O-N 3.34Å; T714-A716 VanDerWaalsContact O-N 3.17Å; A716-S719 WeakPolarHBondContact O-CB 3.44Å; A716-S719 PolarHBondContact O-N 2.98Å; A716-I720 WeakPolarHBondContact O-CG1 3.49Å; A716-I720 PolarHBondContact O-N 3.21Å
717	W	93.5	Very high	92.1	Very high	37 Å²	37	47.4 Å²	47.4	14%	0.14	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-46.3	176.9	176.6	-131.3	0	0	0	112.2	F706 I710 T714 S719 I720 Y721	F706-W717 HydrophobicContact CB-CH2 4.22Å; F706-W717 HydrophobicContact CB-CZ2 4.16Å; F706-W717 WeakPolarHBondContact O-CZ2 3.47Å; I710-W717 HydrophobicContact CB-CD2 4.41Å; I710-W717 HydrophobicContact CB-CH2 4.44Å; I710-W717 HydrophobicContact CB-CZ2 3.74Å; I710-W717 HydrophobicContact CD1-CH2 3.72Å; I710-W717 HydrophobicContact CD1-CZ2 3.82Å; I710-W717 HydrophobicContact CD1-CZ3 4.32Å; I710-W717 HydrophobicContact CG1-CZ2 4.21Å; I710-W717 HydrophobicContact CG2-CD2 3.92Å; I710-W717 HydrophobicContact CG2-CE3 4.34Å; I710-W717 HydrophobicContact CG2-CG 4.34Å; I710-W717 HydrophobicContact CG2-CZ2 4.09Å; I710-W717 PolarHBondContact O-NE1 3Å; T714-W717 PolarHBondContact O-N 2.83Å; T714-W717 WeakPolarHBondContact OG1-CB 3.35Å; T714-W717 PolarHBondContact OG1-N 2.9Å; W717-S719 VanDerWaalsContact C-N 3.27Å; W717-S719 PolarHBondContact O-N 3.37Å; W717-I720 HydrophobicContact CE3-CB 4.11Å; W717-I720 HydrophobicContact CE3-CD1 4.36Å; W717-I720 HydrophobicContact CE3-CG2 4.19Å; W717-I720 HydrophobicContact CZ3-CB 4.21Å; W717-I720 HydrophobicContact CZ3-CG2 3.78Å; W717-I720 PolarHBondContact O-N 2.92Å; W717-I720 VanDerWaalsContact O-N 3.14Å; W717-Y721 PolarHBondContact O-N 3.16Å
718	Y	95.9	Very high	92.1	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-34.6	175.7	-73.6	-65.4	0	0	0	113	Y649 T650 M655 L707 H713 T714 A722	Y649-Y718 AromaticContact CD1-CE1 3.78Å; Y649-Y718 HydrophobicContact CD1-CE1 3.78Å; Y649-Y718 AromaticContact CE1-CE1 3.73Å; Y649-Y718 HydrophobicContact CE1-CE1 3.73Å; Y649-Y718 WeakPolarHBondContact CE1-OH 3.4Å; T650-Y718 HydrophobicContact CG2-CD1 3.51Å; T650-Y718 HydrophobicContact CG2-CD2 3.84Å; T650-Y718 HydrophobicContact CG2-CE1 3.61Å; T650-Y718 HydrophobicContact CG2-CE2 3.9Å; T650-Y718 HydrophobicContact CG2-CG 3.64Å; M655-Y718 HydrophobicContact CE-CD2 3.25Å; M655-Y718 HydrophobicContact CE-CE2 3.88Å; M655-Y718 HydrophobicContact CE-CG 3.98Å; L707-Y718 HydrophobicContact CD1-CD1 3.63Å; L707-Y718 HydrophobicContact CD1-CE1 3.62Å; H713-Y718 HydrophobicContact CB-CE2 3.81Å; H713-Y718 PolarHBondContact ND1-OH 3.2Å; H713-Y718 VanDerWaalsContact ND1-OH 3.13Å; T714-Y718 WeakPolarHBondContact O-CD2 3.5Å; T714-Y718 PolarHBondContact O-N 3.07Å; Y718-A722 VanDerWaalsContact O-CB 3.22Å; Y718-A722 WeakPolarHBondContact O-CB 3.46Å; Y718-A722 PolarHBondContact O-N 3.44Å
719	S	96.1	Very high	92.1	Very high	17 Å²	17	47.4 Å²	47.4	12%	0.119	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-38.1	174.5	-62.6	0	0	0	0	112.8	I666 F715 A716 W717 A722 S723	I666-S719 WeakPolarHBondContact CD1-OG 3.22Å; F715-S719 VanDerWaalsContact O-CB 3.29Å; F715-S719 WeakPolarHBondContact O-CB 3.44Å; F715-S719 PolarHBondContact O-N 3.47Å; F715-S719 PolarHBondContact O-OG 2.87Å; A716-S719 WeakPolarHBondContact O-CB 3.44Å; A716-S719 PolarHBondContact O-N 2.98Å; W717-S719 VanDerWaalsContact C-N 3.27Å; W717-S719 PolarHBondContact O-N 3.37Å; S719-A722 PolarHBondContact O-N 3.49Å; S719-S723 WeakPolarHBondContact O-CB 3.4Å; S719-S723 PolarHBondContact O-N 3.45Å; S719-S723 PolarHBondContact O-OG 3.39Å
720	I	96	Very high	92.2	Very high	87 Å²	87	40.6 Å²	40.6	45%	0.446	22%	0.224	S	C	.	.	H	α-helix	trans	-64.6	-49.4	174.2	-68.3	163.1	0	0	0	109.9	A716 W717 A722 S723 I724	A716-I720 WeakPolarHBondContact O-CG1 3.49Å; A716-I720 PolarHBondContact O-N 3.21Å; W717-I720 HydrophobicContact CE3-CB 4.11Å; W717-I720 HydrophobicContact CE3-CD1 4.36Å; W717-I720 HydrophobicContact CE3-CG2 4.19Å; W717-I720 HydrophobicContact CZ3-CB 4.21Å; W717-I720 HydrophobicContact CZ3-CG2 3.78Å; W717-I720 PolarHBondContact O-N 2.92Å; W717-I720 VanDerWaalsContact O-N 3.14Å; I720-A722 PolarHBondContact O-N 3.02Å; I720-S723 PolarHBondContact O-N 3.39Å; I720-I724 HydrophobicContact CG2-CD1 3.81Å; I720-I724 WeakPolarHBondContact O-CG1 3.28Å; I720-I724 PolarHBondContact O-N 3.25Å
721	Y	96.6	Very high	92.7	Very high	1 Å²	1	38 Å²	38	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-54.7	-49.9	173.8	160.9	-100.8	0	0	0	111.9	L646 A703 H704 L707 W717 S723 I724 Y725 F785	L646-Y721 HydrophobicContact CD1-CD1 4.29Å; L646-Y721 HydrophobicContact CD1-CE1 3.83Å; L646-Y721 HydrophobicContact CD2-CD1 4.42Å; L646-Y721 HydrophobicContact CD2-CE1 3.88Å; A703-Y721 HydrophobicContact CB-CD2 4.02Å; A703-Y721 HydrophobicContact CB-CE2 4.19Å; A703-Y721 WeakPolarHBondContact O-CD2 3.4Å; H704-Y721 PolarHBondContact CE1-OH 2.86Å; H704-Y721 VanDerWaalsContact CE1-OH 3.27Å; H704-Y721 AromaticContact ND1-CE2 3.61Å; H704-Y721 AromaticContact ND1-CZ 3.74Å; H704-Y721 PolarHBondContact ND1-OH 3.13Å; L707-Y721 HydrophobicContact CB-CD2 3.9Å; L707-Y721 HydrophobicContact CB-CE2 4.24Å; L707-Y721 HydrophobicContact CB-CG 4.28Å; L707-Y721 HydrophobicContact CD1-CD1 3.97Å; L707-Y721 HydrophobicContact CD1-CD2 4.23Å; L707-Y721 HydrophobicContact CD1-CG 3.73Å; L707-Y721 HydrophobicContact CD2-CD1 3.89Å; L707-Y721 HydrophobicContact CD2-CD2 4.01Å; L707-Y721 HydrophobicContact CD2-CE1 3.73Å; L707-Y721 HydrophobicContact CD2-CE2 3.86Å; L707-Y721 HydrophobicContact CD2-CG 4.02Å; L707-Y721 HydrophobicContact CG-CD1 4.48Å; L707-Y721 HydrophobicContact CG-CD2 4.27Å; L707-Y721 HydrophobicContact CG-CG 4.24Å; W717-Y721 PolarHBondContact O-N 3.16Å; Y721-S723 VanDerWaalsContact C-N 3.31Å; Y721-S723 PolarHBondContact O-N 2.94Å; Y721-I724 PolarHBondContact O-N 2.88Å; Y721-Y725 HydrophobicContact CE2-CG 4.46Å; Y721-Y725 WeakPolarHBondContact O-CB 3.33Å; Y721-Y725 PolarHBondContact O-N 3.39Å; Y721-F785 WeakPolarHBondContact OH-CE1 3.25Å
722	A	96.4	Very high	93.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.3	-40.9	179.5	0	0	0	0	0	112.2	V663 I666 L667 Y718 S719 I720 G726	V663-A722 HydrophobicContact CG1-CB 3.87Å; V663-A722 WeakPolarHBondContact O-CB 3.33Å; I666-A722 HydrophobicContact CB-CB 4.31Å; I666-A722 HydrophobicContact CG2-CB 3.99Å; L667-A722 WeakPolarHBondContact CA-O 3.37Å; L667-A722 HydrophobicContact CB-CB 3.94Å; Y718-A722 VanDerWaalsContact O-CB 3.22Å; Y718-A722 WeakPolarHBondContact O-CB 3.46Å; Y718-A722 PolarHBondContact O-N 3.44Å; S719-A722 PolarHBondContact O-N 3.49Å; I720-A722 PolarHBondContact O-N 3.02Å; A722-G726 WeakPolarHBondContact O-CA 3.36Å; A722-G726 PolarHBondContact O-N 3.21Å
723	S	96.9	Very high	93.7	Very high	27 Å²	27	30.9 Å²	30.9	19%	0.189	17%	0.17	C	C	.	.	H	α-helix	trans	-64.7	-47.1	177.7	-55.4	0	0	0	0	111.9	I666 F670 S719 I720 Y721 L727	I666-S723 WeakPolarHBondContact CG2-OG 3.49Å; F670-S723 VanDerWaalsContact CB-O 3.29Å; F670-S723 WeakPolarHBondContact CB-O 3.33Å; F670-S723 WeakPolarHBondContact CE2-OG 3.46Å; S719-S723 WeakPolarHBondContact O-CB 3.4Å; S719-S723 PolarHBondContact O-N 3.45Å; S719-S723 PolarHBondContact O-OG 3.39Å; I720-S723 PolarHBondContact O-N 3.39Å; Y721-S723 VanDerWaalsContact C-N 3.31Å; Y721-S723 PolarHBondContact O-N 2.94Å; S723-L727 PolarHBondContact O-N 3.26Å
724	I	96.9	Very high	93.6	Very high	77 Å²	77	30.2 Å²	30.2	40%	0.395	17%	0.171	S	C	.	.	H	α-helix	trans	-67.3	-52.7	-179.8	-62.8	167.5	0	0	0	110.4	A703 I720 Y721 G726 L727 C728	A703-I724 HydrophobicContact CB-CB 4.35Å; A703-I724 HydrophobicContact CB-CG2 3.86Å; I720-I724 HydrophobicContact CG2-CD1 3.81Å; I720-I724 WeakPolarHBondContact O-CG1 3.28Å; I720-I724 PolarHBondContact O-N 3.25Å; Y721-I724 PolarHBondContact O-N 2.88Å; I724-G726 PolarHBondContact O-N 2.8Å; I724-L727 PolarHBondContact O-N 2.95Å; I724-C728 VanDerWaalsContact O-CB 3.24Å; I724-C728 WeakPolarHBondContact O-CB 3.38Å; I724-C728 PolarHBondContact O-N 3.11Å; I724-C728 PolarHBondContact O-SG 3.1Å
725	Y	96.6	Very high	93.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64.8	-38.2	-179.1	175.6	-96	0	0	0	112.3	Y639 P642 L667 H704 Y721 C728 S729 Y792	Y639-Y725 PolarHBondContact O-OH 2.95Å; Y639-Y725 VanDerWaalsContact O-OH 3.08Å; P642-Y725 HydrophobicContact CB-CD1 4.39Å; P642-Y725 HydrophobicContact CB-CE1 4.07Å; P642-Y725 HydrophobicContact CG-CD1 4.14Å; P642-Y725 HydrophobicContact CG-CE1 3.63Å; P642-Y725 HydrophobicContact CG-CE2 4.46Å; L667-Y725 HydrophobicContact CD1-CD1 3.86Å; L667-Y725 HydrophobicContact CD1-CE1 4.34Å; L667-Y725 HydrophobicContact CD2-CD1 4.43Å; L667-Y725 HydrophobicContact CG-CD1 4.13Å; H704-Y725 AromaticContact CE1-CD2 3.21Å; H704-Y725 WeakPolarHBondContact CE1-CD2 3.21Å; H704-Y725 AromaticContact CE1-CE2 3.17Å; H704-Y725 WeakPolarHBondContact CE1-CE2 3.41Å; H704-Y725 AromaticContact CE1-CG 3.9Å; H704-Y725 AromaticContact CE1-CZ 3.82Å; H704-Y725 AromaticContact ND1-CD2 3.97Å; H704-Y725 AromaticContact NE2-CD2 3.49Å; H704-Y725 WeakPolarHBondContact NE2-CD2 3.21Å; H704-Y725 AromaticContact NE2-CE2 3.14Å; H704-Y725 WeakPolarHBondContact NE2-CE2 3.31Å; H704-Y725 AromaticContact NE2-CZ 3.99Å; Y721-Y725 HydrophobicContact CE2-CG 4.46Å; Y721-Y725 WeakPolarHBondContact O-CB 3.33Å; Y721-Y725 PolarHBondContact O-N 3.39Å; Y725-C728 PolarHBondContact O-N 2.7Å; Y725-S729 VanDerWaalsContact O-CB 3.28Å; Y725-S729 WeakPolarHBondContact O-CB 3.24Å; Y725-S729 PolarHBondContact O-N 3.42Å; Y725-S729 PolarHBondContact O-OG 3.39Å; Y725-Y792 AromaticContact CE2-CE1 3.88Å; Y725-Y792 HydrophobicContact CE2-CE1 3.88Å; Y725-Y792 AromaticContact CE2-CZ 3.91Å; Y725-Y792 PolarHBondContact OH-OH 2.83Å
726	G	95.3	Very high	93	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-55.5	-57.6	174	0	0	0	0	0	110.9	F670 H671 A722 I724 C728 S729 G730	F670-G726 CarbonylContact O-C 3.56Å; H671-G726 WeakPolarHBondContact CA-O 3.15Å; A722-G726 WeakPolarHBondContact O-CA 3.36Å; A722-G726 PolarHBondContact O-N 3.21Å; I724-G726 PolarHBondContact O-N 2.8Å; G726-C728 VanDerWaalsContact C-N 3.33Å; G726-C728 PolarHBondContact O-N 2.86Å; G726-S729 PolarHBondContact O-N 2.89Å; G726-S729 PolarHBondContact O-OG 3.09Å; G726-G730 PolarHBondContact O-N 2.85Å
727	L	94.9	Very high	92.5	Very high	59 Å²	59	24.4 Å²	24.4	31%	0.309	14%	0.135	S	C	.	.	H	α-helix	trans	-61.3	-41.1	-179.4	-171.5	142.3	0	0	0	112.2	F670 S723 I724 G730 I731	F670-L727 HydrophobicContact CB-CB 4.33Å; F670-L727 HydrophobicContact CD1-CB 4.36Å; F670-L727 HydrophobicContact CD1-CD1 4.29Å; F670-L727 WeakPolarHBondContact O-CA 3.33Å; F670-L727 PolarHBondContact O-N 3.39Å; S723-L727 PolarHBondContact O-N 3.26Å; I724-L727 PolarHBondContact O-N 2.95Å; L727-G730 PolarHBondContact O-N 2.97Å; L727-I731 HydrophobicContact CD2-CD1 3.68Å; L727-I731 HydrophobicContact CG-CD1 4.44Å; L727-I731 WeakPolarHBondContact O-CG1 3.36Å; L727-I731 PolarHBondContact O-N 3.35Å
728	C	95.6	Very high	92.1	Very high	13 Å²	13	25.7 Å²	25.7	9%	0.088	14%	0.144	C	C	.	.	H	α-helix	trans	-66	-36.8	177.4	-71.1	0	0	0	0	113.9	A696 I724 Y725 G726 P732	A696-C728 VanDerWaalsContact O-CB 3.28Å; A696-C728 WeakPolarHBondContact O-CB 3.34Å; I724-C728 VanDerWaalsContact O-CB 3.24Å; I724-C728 WeakPolarHBondContact O-CB 3.38Å; I724-C728 PolarHBondContact O-N 3.11Å; I724-C728 PolarHBondContact O-SG 3.1Å; Y725-C728 PolarHBondContact O-N 2.7Å; G726-C728 VanDerWaalsContact C-N 3.33Å; G726-C728 PolarHBondContact O-N 2.86Å; C728-P732 WeakPolarHBondContact O-CD 3.43Å
729	S	92.6	Very high	91.7	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	15%	0.145	C	C	.	.	H	α-helix	trans	-79.3	-25.7	177.9	57.5	0	0	0	0	112.9	Y725 G726 I733	Y725-S729 VanDerWaalsContact O-CB 3.28Å; Y725-S729 WeakPolarHBondContact O-CB 3.24Å; Y725-S729 PolarHBondContact O-N 3.42Å; Y725-S729 PolarHBondContact O-OG 3.39Å; G726-S729 PolarHBondContact O-N 2.89Å; G726-S729 PolarHBondContact O-OG 3.09Å; S729-I733 WeakPolarHBondContact O-CD1 3.33Å
730	G	89.8	Confident	91.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-72.7	-32.9	176.6	0	0	0	0	0	114.1	R675 G726 L727 P734	R675-G730 WeakPolarHBondContact CG-O 3.38Å; G726-G730 PolarHBondContact O-N 2.85Å; L727-G730 PolarHBondContact O-N 2.97Å; G730-P734 WeakPolarHBondContact O-CD 3.38Å
731	I	91.5	Very high	90.8	Very high	11 Å²	11	23.7 Å²	23.7	6%	0.056	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-47.4	-173.3	-75.7	165.1	0	0	0	114.2	G674 S678 L692 A696 L727 I733 P734 L735	G674-I731 WeakPolarHBondContact O-CG1 3.32Å; S678-I731 WeakPolarHBondContact CB-O 3.21Å; L692-I731 HydrophobicContact CD1-CG2 4.06Å; L692-I731 HydrophobicContact CG-CG2 3.82Å; A696-I731 HydrophobicContact CB-CB 3.7Å; A696-I731 HydrophobicContact CB-CD1 4.1Å; A696-I731 HydrophobicContact CB-CG2 3.55Å; L727-I731 HydrophobicContact CD2-CD1 3.68Å; L727-I731 HydrophobicContact CG-CD1 4.44Å; L727-I731 WeakPolarHBondContact O-CG1 3.36Å; L727-I731 PolarHBondContact O-N 3.35Å; I731-I733 VanDerWaalsContact C-N 3.3Å; I731-I733 PolarHBondContact O-N 3.05Å; I731-P734 WeakPolarHBondContact O-CD 3.29Å; I731-L735 HydrophobicContact CG2-CD1 3.95Å; I731-L735 WeakPolarHBondContact O-CD1 3.32Å; I731-L735 WeakPolarHBondContact O-CG 3.48Å
732	P	91.2	Very high	90.4	Very high	18 Å²	18	29 Å²	29	12%	0.117	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-29.4	-177.9	-27.9	37.4	0	0	0	114.8	S693 A696 T697 C728 L735 I736	S693-P732 WeakPolarHBondContact OG-CB 3.32Å; A696-P732 HydrophobicContact CB-CG 4.36Å; T697-P732 HydrophobicContact CG2-CG 3.94Å; C728-P732 WeakPolarHBondContact O-CD 3.43Å; P732-L735 PolarHBondContact O-N 3.32Å; P732-I736 WeakPolarHBondContact O-CG1 3.43Å; P732-I736 PolarHBondContact O-N 3.07Å; P732-I736 VanDerWaalsContact O-N 3.12Å
733	I	86.3	Confident	89.9	Confident	42 Å²	42	30.7 Å²	30.7	22%	0.215	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-54.4	-167.2	-62.8	175.3	0	0	0	113.2	Y639 H671 S729 I731 L735	Y639-I733 HydrophobicContact CE2-CD1 3.93Å; H671-I733 WeakPolarHBondContact NE2-CD1 3.39Å; S729-I733 WeakPolarHBondContact O-CD1 3.33Å; I731-I733 VanDerWaalsContact C-N 3.3Å; I731-I733 PolarHBondContact O-N 3.05Å; I733-L735 PolarHBondContact O-N 3.32Å
734	P	81.7	Confident	89.3	Confident	37 Å²	37	30.2 Å²	30.2	24%	0.24	16%	0.159	C	C	.	.	H	α-helix	trans	-73.7	-12.5	175.8	30.7	-36.6	0	0	0	113.8	S678 G730 I731	S678-P734 WeakPolarHBondContact OG-CG 3.32Å; G730-P734 WeakPolarHBondContact O-CD 3.38Å; I731-P734 WeakPolarHBondContact O-CD 3.29Å
735	L	86.7	Confident	88.5	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-83.6	-23.7	178.8	-58.1	177.8	0	0	0	112.7	L692 I731 P732 I733 I738 L739	L692-L735 HydrophobicContact CB-CD1 4.17Å; L692-L735 HydrophobicContact CD2-CD1 3.89Å; L692-L735 HydrophobicContact CG-CD1 3.86Å; I731-L735 HydrophobicContact CG2-CD1 3.95Å; I731-L735 WeakPolarHBondContact O-CD1 3.32Å; I731-L735 WeakPolarHBondContact O-CG 3.48Å; P732-L735 PolarHBondContact O-N 3.32Å; I733-L735 PolarHBondContact O-N 3.32Å; L735-I738 HydrophobicContact CD2-CD1 4.2Å; L735-I738 WeakPolarHBondContact O-CB 3.41Å; L735-I738 PolarHBondContact O-N 2.9Å; L735-I738 VanDerWaalsContact O-N 3.07Å; L735-L739 WeakPolarHBondContact O-CG 3.43Å; L735-L739 PolarHBondContact O-N 2.96Å
736	I	88.3	Confident	87.5	Confident	35 Å²	35	33.8 Å²	33.8	18%	0.179	18%	0.183	C	C	.	.	H	α-helix	trans	-53.3	-48.3	-179.8	-74.3	163	0	0	0	113.1	P732 I738 L739 L740 F753 L756	P732-I736 WeakPolarHBondContact O-CG1 3.43Å; P732-I736 PolarHBondContact O-N 3.07Å; P732-I736 VanDerWaalsContact O-N 3.12Å; I736-I738 VanDerWaalsContact C-N 3.33Å; I736-I738 PolarHBondContact O-N 3.02Å; I736-L739 PolarHBondContact O-N 2.95Å; I736-L740 HydrophobicContact CG2-CD1 3.78Å; I736-L740 WeakPolarHBondContact O-CG 3.31Å; I736-L740 PolarHBondContact O-N 3.14Å; I736-F753 HydrophobicContact CG2-CD2 4.42Å; I736-F753 HydrophobicContact CG2-CE2 4.35Å; I736-L756 HydrophobicContact CG2-CD2 3.79Å
737	P	83.2	Confident	86.6	Confident	49 Å²	49	40.9 Å²	40.9	32%	0.318	22%	0.216	S	C	.	.	H	α-helix	trans	-62.8	-37.1	176.2	-23.4	35.1	0	0	0	113.3	L740 V741 F753	P737-L740 PolarHBondContact O-N 3.18Å; P737-V741 WeakPolarHBondContact O-CG2 3.28Å; P737-V741 PolarHBondContact O-N 3.26Å; P737-F753 HydrophobicContact CG-CE2 4.2Å
738	I	85.1	Confident	85.9	Confident	64 Å²	64	41.7 Å²	41.7	33%	0.328	22%	0.219	S	C	.	.	H	α-helix	trans	-65.6	-43.3	178.6	-58.7	173.7	0	0	0	110.2	L735 I736 R742	L735-I738 HydrophobicContact CD2-CD1 4.2Å; L735-I738 WeakPolarHBondContact O-CB 3.41Å; L735-I738 PolarHBondContact O-N 2.9Å; L735-I738 VanDerWaalsContact O-N 3.07Å; I736-I738 VanDerWaalsContact C-N 3.33Å; I736-I738 PolarHBondContact O-N 3.02Å; I738-R742 VanDerWaalsContact O-CB 3.31Å; I738-R742 WeakPolarHBondContact O-CB 3.27Å; I738-R742 PolarHBondContact O-N 3.03Å
739	L	89.1	Confident	85.2	Confident	4 Å²	4	43 Å²	43	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-41.6	174.6	-68.6	172.5	0	0	0	111.7	L628 V690 L735 I736 R742 F743	L628-L739 HydrophobicContact CD2-CB 3.99Å; L628-L739 HydrophobicContact CD2-CD1 4.45Å; V690-L739 HydrophobicContact CB-CD2 4.36Å; V690-L739 HydrophobicContact CG2-CD2 3.52Å; L735-L739 WeakPolarHBondContact O-CG 3.43Å; L735-L739 PolarHBondContact O-N 2.96Å; I736-L739 PolarHBondContact O-N 2.95Å; L739-R742 PolarHBondContact O-N 3.17Å; L739-F743 HydrophobicContact CD2-CE2 4.21Å; L739-F743 WeakPolarHBondContact O-CD2 3.44Å; L739-F743 PolarHBondContact O-N 2.82Å; L739-F743 VanDerWaalsContact O-N 3.11Å
740	L	88	Confident	84.5	Confident	1 Å²	1	47 Å²	47	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-65.3	-45.9	177.6	-72.5	162	0	0	0	112.3	F625 L628 I736 P737 R742 F743 S744 L749 F753 L756	F625-L740 HydrophobicContact CD2-CD2 4.21Å; F625-L740 HydrophobicContact CE2-CD2 3.95Å; L628-L740 HydrophobicContact CD1-CD2 3.84Å; L628-L740 HydrophobicContact CD1-CG 4.34Å; I736-L740 HydrophobicContact CG2-CD1 3.78Å; I736-L740 WeakPolarHBondContact O-CG 3.31Å; I736-L740 PolarHBondContact O-N 3.14Å; P737-L740 PolarHBondContact O-N 3.18Å; L740-R742 VanDerWaalsContact C-N 3.27Å; L740-R742 PolarHBondContact O-N 2.68Å; L740-F743 PolarHBondContact O-N 3.45Å; L740-S744 WeakPolarHBondContact O-CA 3.45Å; L740-S744 WeakPolarHBondContact O-CB 3.43Å; L740-S744 PolarHBondContact O-N 3.03Å; L740-L749 HydrophobicContact CB-CD1 3.74Å; L740-F753 HydrophobicContact CD1-CB 4Å; L740-F753 HydrophobicContact CD1-CD2 3.7Å; L740-F753 HydrophobicContact CD1-CG 4.35Å; L740-L756 HydrophobicContact CD1-CD2 4Å; L740-L756 HydrophobicContact CD2-CD2 4.25Å; L740-L756 HydrophobicContact CG-CD2 4.45Å
741	V	84.5	Confident	84.2	Confident	56 Å²	56	47.4 Å²	47.4	34%	0.339	25%	0.252	S	S	.	.	H	α-helix	trans	-59.1	-40.5	174.2	175	0	0	0	0	111.3	P737 F743 G745 L746 L749	P737-V741 WeakPolarHBondContact O-CG2 3.28Å; P737-V741 PolarHBondContact O-N 3.26Å; V741-F743 VanDerWaalsContact C-N 3.32Å; V741-F743 PolarHBondContact O-N 2.97Å; V741-G745 WeakPolarHBondContact O-CA 3.18Å; V741-G745 PolarHBondContact O-N 2.93Å; V741-L746 HydrophobicContact CG1-CD1 4.33Å; V741-L746 HydrophobicContact CG2-CD1 4Å; V741-L749 HydrophobicContact CG2-CB 4.49Å; V741-L749 HydrophobicContact CG2-CD1 3.71Å; V741-L749 HydrophobicContact CG2-CD2 3.68Å; V741-L749 HydrophobicContact CG2-CG 4.15Å
742	R	87.2	Confident	84	Confident	114 Å²	114	46.9 Å²	46.9	43%	0.43	25%	0.249	S	C	.	.	H	α-helix	trans	-66.8	-27.4	-179.2	178.9	174.3	175.5	178.3	-2.7	114.3	D688 I738 L739 L740	D688-R742 IonicContact OD1-CZ 3.93Å; D688-R742 IonicContact OD1-NH1 3.62Å; D688-R742 PolarHBondContact OD1-NH1 3.49Å; D688-R742 IonicContact OD1-NH2 2.78Å; D688-R742 IonicContact OD2-CZ 2.97Å; D688-R742 IonicContact OD2-NH1 3.32Å; D688-R742 PolarHBondContact OD2-NH1 3.41Å; D688-R742 IonicContact OD2-NH2 2.65Å; D688-R742 PolarHBondContact OD2-NH2 3.14Å; I738-R742 VanDerWaalsContact O-CB 3.31Å; I738-R742 WeakPolarHBondContact O-CB 3.27Å; I738-R742 PolarHBondContact O-N 3.03Å; L739-R742 PolarHBondContact O-N 3.17Å; L740-R742 VanDerWaalsContact C-N 3.27Å; L740-R742 PolarHBondContact O-N 2.68Å
743	F	87.3	Confident	83.8	Confident	35 Å²	35	50 Å²	50	15%	0.154	26%	0.261	C	S	.	.	H	α-helix	trans	-118.9	-17.1	-171.8	-71.8	-59.8	0	0	0	115.5	L628 V690 L739 L740 V741 L802 S806	L628-F743 HydrophobicContact CD1-CB 3.95Å; L628-F743 HydrophobicContact CD1-CD2 4.17Å; L628-F743 HydrophobicContact CD1-CG 4.48Å; L628-F743 HydrophobicContact CD2-CD2 4.44Å; V690-F743 HydrophobicContact CG2-CE2 3.8Å; V690-F743 HydrophobicContact CG2-CZ 4Å; L739-F743 HydrophobicContact CD2-CE2 4.21Å; L739-F743 WeakPolarHBondContact O-CD2 3.44Å; L739-F743 PolarHBondContact O-N 2.82Å; L739-F743 VanDerWaalsContact O-N 3.11Å; L740-F743 PolarHBondContact O-N 3.45Å; V741-F743 VanDerWaalsContact C-N 3.32Å; V741-F743 PolarHBondContact O-N 2.97Å; F743-L802 HydrophobicContact CD1-CD1 4.32Å; F743-L802 HydrophobicContact CD2-CD1 4.32Å; F743-L802 HydrophobicContact CD2-CD2 4.24Å; F743-L802 HydrophobicContact CE1-CD1 4.05Å; F743-L802 HydrophobicContact CE2-CD1 4.05Å; F743-L802 HydrophobicContact CE2-CD2 3.81Å; F743-L802 HydrophobicContact CE2-CG 4.05Å; F743-L802 HydrophobicContact CG-CD1 4.47Å; F743-L802 HydrophobicContact CZ-CD1 3.91Å; F743-L802 HydrophobicContact CZ-CD2 4.32Å; F743-L802 HydrophobicContact CZ-CG 4.04Å; F743-S806 WeakPolarHBondContact CE1-OG 3.39Å; F743-S806 VanDerWaalsContact CZ-OG 3.3Å; F743-S806 WeakPolarHBondContact CZ-OG 3.25Å
744	S	83.9	Confident	83.8	Confident	17 Å²	17	48.2 Å²	48.2	12%	0.119	25%	0.253	C	S	.	.	H	α-helix	trans	-120.9	3.3	177.4	-57.5	0	0	0	0	113.4	L740 S752	L740-S744 WeakPolarHBondContact O-CA 3.45Å; L740-S744 WeakPolarHBondContact O-CB 3.43Å; L740-S744 PolarHBondContact O-N 3.03Å; S744-S752 WeakPolarHBondContact CB-OG 3.48Å; S744-S752 PolarHBondContact OG-OG 2.89Å
745	G	79.7	Confident	84.2	Confident	23 Å²	23	46.7 Å²	46.7	24%	0.237	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	173.9	-174.9	0	0	0	0	0	113.2	V741	V741-G745 WeakPolarHBondContact O-CA 3.18Å; V741-G745 PolarHBondContact O-N 2.93Å
746	L	76.6	Confident	84.4	Confident	128 Å²	128	46.9 Å²	46.9	67%	0.67	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-31.2	178.3	-172.8	63	0	0	0	111.1	V741 L749	V741-L746 HydrophobicContact CG1-CD1 4.33Å; V741-L746 HydrophobicContact CG2-CD1 4Å; L746-L749 HydrophobicContact CD1-CD2 4.14Å; L746-L749 WeakPolarHBondContact O-CB 3.33Å; L746-L749 PolarHBondContact O-N 2.91Å
747	E	76.5	Confident	84.6	Confident	149 Å²	149	46 Å²	46	70%	0.696	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-35.8	-176.8	58.3	-91	92.6	0	0	113.2
748	H	79.8	Confident	85	Confident	77 Å²	77	45.6 Å²	45.6	36%	0.356	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-1.2	176.4	-58.7	-94.4	0	0	0	113.4	D616 L619 T750 A751 S752	D616-H748 IonicContact OD2-CE1 2.7Å; D616-H748 PolarHBondContact OD2-CE1 2.82Å; D616-H748 IonicContact OD2-ND1 3.54Å; D616-H748 PolarHBondContact OD2-ND1 3.13Å; L619-H748 HydrophobicContact CD1-CB 4.45Å; L619-H748 HydrophobicContact CD2-CB 3.9Å; H748-T750 VanDerWaalsContact C-N 3.27Å; H748-T750 PolarHBondContact O-N 2.76Å; H748-T750 VanDerWaalsContact O-N 3.08Å; H748-A751 PolarHBondContact O-N 3Å; H748-S752 PolarHBondContact O-N 3.48Å; H748-S752 PolarHBondContact O-OG 3.48Å; H748-S752 VanDerWaalsContact O-OG 3.08Å
749	L	80.1	Confident	85.4	Confident	41 Å²	41	44.4 Å²	44.4	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-48.1	-46.4	-173.2	176.2	61.6	0	0	0	113.1	L740 V741 L746 F753	L740-L749 HydrophobicContact CB-CD1 3.74Å; V741-L749 HydrophobicContact CG2-CB 4.49Å; V741-L749 HydrophobicContact CG2-CD1 3.71Å; V741-L749 HydrophobicContact CG2-CD2 3.68Å; V741-L749 HydrophobicContact CG2-CG 4.15Å; L746-L749 HydrophobicContact CD1-CD2 4.14Å; L746-L749 WeakPolarHBondContact O-CB 3.33Å; L746-L749 PolarHBondContact O-N 2.91Å; L749-F753 WeakPolarHBondContact O-CB 3.36Å; L749-F753 PolarHBondContact O-N 3.32Å
750	T	79.1	Confident	85.6	Confident	85 Å²	85	45.2 Å²	45.2	52%	0.521	23%	0.231	S	C	.	.	H	α-helix	trans	-65.2	-42.1	-178.6	-51.1	0	0	0	0	112.3	L614 H748 S754	L614-T750 HydrophobicContact CD2-CG2 3.79Å; H748-T750 VanDerWaalsContact C-N 3.27Å; H748-T750 PolarHBondContact O-N 2.76Å; H748-T750 VanDerWaalsContact O-N 3.08Å; T750-S754 VanDerWaalsContact O-CB 3.26Å; T750-S754 WeakPolarHBondContact O-CB 3.39Å; T750-S754 PolarHBondContact O-N 3.26Å; T750-S754 PolarHBondContact O-OG 2.78Å
751	A	82.7	Confident	85.9	Confident	8 Å²	8	45.1 Å²	45.1	7%	0.066	23%	0.231	C	C	.	.	H	α-helix	trans	-69.7	-46.7	177.3	0	0	0	0	0	110.7	D616 L619 H748 F753 S754 N755	D616-A751 HydrophobicContact CB-CB 3.98Å; L619-A751 HydrophobicContact CD1-CB 3.87Å; H748-A751 PolarHBondContact O-N 3Å; A751-F753 PolarHBondContact O-N 3.19Å; A751-S754 PolarHBondContact O-N 3.36Å; A751-N755 VanDerWaalsContact O-CB 3.29Å; A751-N755 WeakPolarHBondContact O-CB 3.48Å; A751-N755 PolarHBondContact O-N 3.21Å
752	S	87.6	Confident	86.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-42.6	177.1	-52.5	0	0	0	0	112.5	L619 F625 S744 H748 L756	L619-S752 VanDerWaalsContact CD1-OG 3.29Å; L619-S752 WeakPolarHBondContact CD1-OG 3.46Å; L619-S752 WeakPolarHBondContact CD2-OG 3.28Å; F625-S752 WeakPolarHBondContact CE2-O 3.43Å; S744-S752 WeakPolarHBondContact CB-OG 3.48Å; S744-S752 PolarHBondContact OG-OG 2.89Å; H748-S752 PolarHBondContact O-N 3.48Å; H748-S752 PolarHBondContact O-OG 3.48Å; H748-S752 VanDerWaalsContact O-OG 3.08Å; S752-L756 WeakPolarHBondContact O-CB 3.37Å; S752-L756 PolarHBondContact O-N 2.9Å
753	F	86.7	Confident	86.8	Confident	83 Å²	83	43.3 Å²	43.3	36%	0.364	22%	0.224	S	C	.	.	H	α-helix	trans	-69	-37.9	176.2	-172.8	-105.1	0	0	0	112.3	I736 P737 L740 L749 A751 N757	I736-F753 HydrophobicContact CG2-CD2 4.42Å; I736-F753 HydrophobicContact CG2-CE2 4.35Å; P737-F753 HydrophobicContact CG-CE2 4.2Å; L740-F753 HydrophobicContact CD1-CB 4Å; L740-F753 HydrophobicContact CD1-CD2 3.7Å; L740-F753 HydrophobicContact CD1-CG 4.35Å; L749-F753 WeakPolarHBondContact O-CB 3.36Å; L749-F753 PolarHBondContact O-N 3.32Å; A751-F753 PolarHBondContact O-N 3.19Å; F753-N757 WeakPolarHBondContact CD1-ND2 3.2Å; F753-N757 WeakPolarHBondContact CE1-ND2 3.43Å; F753-N757 WeakPolarHBondContact CE2-ND2 3.41Å; F753-N757 WeakPolarHBondContact CZ-ND2 3.44Å; F753-N757 WeakPolarHBondContact O-CB 3.4Å; F753-N757 PolarHBondContact O-N 2.84Å; F753-N757 PolarHBondContact O-ND2 3.07Å
754	S	86.6	Confident	87.1	Confident	6 Å²	6	41.6 Å²	41.6	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-69.7	-47.8	177.5	-61	0	0	0	0	111.9	T750 A751 L756 N757 L758	T750-S754 VanDerWaalsContact O-CB 3.26Å; T750-S754 WeakPolarHBondContact O-CB 3.39Å; T750-S754 PolarHBondContact O-N 3.26Å; T750-S754 PolarHBondContact O-OG 2.78Å; A751-S754 PolarHBondContact O-N 3.36Å; S754-L756 PolarHBondContact O-N 2.75Å; S754-N757 PolarHBondContact O-N 2.84Å; S754-L758 PolarHBondContact O-N 2.65Å
755	N	88.8	Confident	87.6	Confident	5 Å²	5	43 Å²	43	3%	0.027	22%	0.222	C	C	.	.	H	α-helix	trans	-58.2	-45.9	174.7	-77.9	-19.5	0	0	0	111.7	F615 D616 F620 F625 A751 L759	F615-N755 VanDerWaalsContact CD1-OD1 3.26Å; F615-N755 WeakPolarHBondContact CD1-OD1 3.12Å; D616-N755 PolarHBondContact O-ND2 2.68Å; F620-N755 HydrophobicContact CE2-CB 4.12Å; F620-N755 HydrophobicContact CZ-CB 4.08Å; F625-N755 HydrophobicContact CE1-CB 4.39Å; F625-N755 HydrophobicContact CZ-CB 3.88Å; A751-N755 VanDerWaalsContact O-CB 3.29Å; A751-N755 WeakPolarHBondContact O-CB 3.48Å; A751-N755 PolarHBondContact O-N 3.21Å; N755-L759 PolarHBondContact O-N 3.37Å
756	L	92	Very high	88.3	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-44.4	177.2	-178.3	66.1	0	0	0	111.8	L628 V629 I736 L740 S752 S754 L759 K760	L628-L756 WeakPolarHBondContact O-CD1 3.29Å; V629-L756 HydrophobicContact CG2-CD1 4.15Å; I736-L756 HydrophobicContact CG2-CD2 3.79Å; L740-L756 HydrophobicContact CD1-CD2 4Å; L740-L756 HydrophobicContact CD2-CD2 4.25Å; L740-L756 HydrophobicContact CG-CD2 4.45Å; S752-L756 WeakPolarHBondContact O-CB 3.37Å; S752-L756 PolarHBondContact O-N 2.9Å; S754-L756 PolarHBondContact O-N 2.75Å; L756-L759 PolarHBondContact O-N 3.26Å; L756-K760 HydrophobicContact CD1-CD 4.32Å; L756-K760 HydrophobicContact CD2-CD 4.45Å; L756-K760 HydrophobicContact CG-CD 3.91Å; L756-K760 WeakPolarHBondContact O-CB 3.47Å; L756-K760 VanDerWaalsContact O-CG 3.28Å; L756-K760 WeakPolarHBondContact O-CG 3.36Å; L756-K760 PolarHBondContact O-N 3.21Å
757	N	91.4	Very high	89.1	Confident	17 Å²	17	39.3 Å²	39.3	9%	0.091	20%	0.198	C	C	.	.	H	α-helix	trans	-73.7	-31.4	-178.5	-74	-47.3	0	0	0	113.3	F753 S754 K760 G761	F753-N757 WeakPolarHBondContact CD1-ND2 3.2Å; F753-N757 WeakPolarHBondContact CE1-ND2 3.43Å; F753-N757 WeakPolarHBondContact CE2-ND2 3.41Å; F753-N757 WeakPolarHBondContact CZ-ND2 3.44Å; F753-N757 WeakPolarHBondContact O-CB 3.4Å; F753-N757 PolarHBondContact O-N 2.84Å; F753-N757 PolarHBondContact O-ND2 3.07Å; S754-N757 PolarHBondContact O-N 2.84Å; N757-K760 PolarHBondContact O-N 3.38Å; N757-K760 PolarHBondContact OD1-NZ 3.41Å; N757-G761 PolarHBondContact O-N 2.87Å
758	L	91.9	Very high	89.9	Confident	39 Å²	39	32.2 Å²	32.2	20%	0.204	17%	0.165	C	C	.	.	H	α-helix	trans	-59.4	-50.6	170.4	177.9	64	0	0	0	111	C92 F96 F615 S754 G761 I762	C92-L758 HydrophobicContact CB-CD1 3.86Å; F96-L758 HydrophobicContact CE2-CD1 4.16Å; F615-L758 HydrophobicContact CD1-CD2 4.44Å; F615-L758 HydrophobicContact CE1-CD2 3.47Å; F615-L758 VanDerWaalsContact CE1-CD2 3.47Å; F615-L758 HydrophobicContact CZ-CD2 3.95Å; S754-L758 PolarHBondContact O-N 2.65Å; L758-G761 PolarHBondContact O-N 3.34Å; L758-I762 HydrophobicContact CG-CD1 4.4Å; L758-I762 WeakPolarHBondContact O-CG1 3.44Å; L758-I762 PolarHBondContact O-N 3.45Å; L758-I762 VanDerWaalsContact O-N 3.1Å
759	L	93.5	Very high	90.7	Very high	40 Å²	40	29.7 Å²	29.7	21%	0.209	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-45.1	178.7	-70.3	174.3	0	0	0	111.5	F620 V629 I633 N755 L756 G761 I762 F763	F620-L759 HydrophobicContact CE1-CD1 3.59Å; F620-L759 HydrophobicContact CZ-CD1 3.71Å; V629-L759 HydrophobicContact CG1-CD1 3.63Å; V629-L759 HydrophobicContact CG2-CD1 4.36Å; I633-L759 HydrophobicContact CD1-CB 4.3Å; I633-L759 HydrophobicContact CD1-CD1 4.49Å; I633-L759 HydrophobicContact CG1-CB 4.3Å; N755-L759 PolarHBondContact O-N 3.37Å; L756-L759 PolarHBondContact O-N 3.26Å; L759-G761 VanDerWaalsContact C-N 3.28Å; L759-G761 PolarHBondContact O-N 3.36Å; L759-I762 PolarHBondContact O-N 3.25Å; L759-F763 WeakPolarHBondContact O-CD2 3.49Å; L759-F763 PolarHBondContact O-N 3.02Å
760	K	94.3	Very high	91.4	Very high	20 Å²	20	31.1 Å²	31.1	9%	0.087	17%	0.165	C	C	.	.	H	α-helix	trans	-54.8	-43.4	172.5	-79.3	172.1	63.7	-155.5	0	112	L91 Q636 L756 N757 I762 F763 S764	L91-K760 HydrophobicContact CD1-CB 4.16Å; Q636-K760 HydrophobicContact CB-CB 4.25Å; Q636-K760 HydrophobicContact CB-CG 4.08Å; Q636-K760 HydrophobicContact CG-CB 3.85Å; Q636-K760 HydrophobicContact CG-CG 4.21Å; Q636-K760 WeakPolarHBondContact CG-O 3.47Å; L756-K760 HydrophobicContact CD1-CD 4.32Å; L756-K760 HydrophobicContact CD2-CD 4.45Å; L756-K760 HydrophobicContact CG-CD 3.91Å; L756-K760 WeakPolarHBondContact O-CB 3.47Å; L756-K760 VanDerWaalsContact O-CG 3.28Å; L756-K760 WeakPolarHBondContact O-CG 3.36Å; L756-K760 PolarHBondContact O-N 3.21Å; N757-K760 PolarHBondContact O-N 3.38Å; N757-K760 PolarHBondContact OD1-NZ 3.41Å; K760-I762 PolarHBondContact O-N 3.45Å; K760-F763 PolarHBondContact O-N 3.05Å; K760-S764 WeakPolarHBondContact O-CB 3.3Å; K760-S764 PolarHBondContact O-N 2.73Å
761	G	94.4	Very high	92.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.7	-43	178.2	0	0	0	0	0	113.3	G88 N757 L758 L759 S764 M765	G88-G761 WeakPolarHBondContact CA-O 3.19Å; G88-G761 WeakPolarHBondContact O-CA 3.33Å; N757-G761 PolarHBondContact O-N 2.87Å; L758-G761 PolarHBondContact O-N 3.34Å; L759-G761 VanDerWaalsContact C-N 3.28Å; L759-G761 PolarHBondContact O-N 3.36Å; G761-S764 PolarHBondContact O-N 3Å; G761-S764 PolarHBondContact O-OG 2.91Å; G761-S764 VanDerWaalsContact O-OG 3.11Å; G761-M765 WeakPolarHBondContact O-CG 3.33Å
762	I	94.1	Very high	92.8	Very high	70 Å²	70	26.8 Å²	26.8	36%	0.359	14%	0.137	S	C	.	.	H	α-helix	trans	-60.7	-48.2	174	-64.4	166.1	0	0	0	110.5	L758 L759 K760 S764 M765 I766	L758-I762 HydrophobicContact CG-CD1 4.4Å; L758-I762 WeakPolarHBondContact O-CG1 3.44Å; L758-I762 PolarHBondContact O-N 3.45Å; L758-I762 VanDerWaalsContact O-N 3.1Å; L759-I762 PolarHBondContact O-N 3.25Å; K760-I762 PolarHBondContact O-N 3.45Å; I762-S764 PolarHBondContact O-N 3.37Å; I762-M765 WeakPolarHBondContact O-CB 3.33Å; I762-M765 PolarHBondContact O-N 3.32Å; I762-I766 HydrophobicContact CG2-CD1 3.93Å; I762-I766 WeakPolarHBondContact O-CG1 3.29Å; I762-I766 PolarHBondContact O-N 2.99Å
763	F	95.1	Very high	93.3	Very high	61 Å²	61	29.9 Å²	29.9	27%	0.268	16%	0.156	S	C	.	.	H	α-helix	trans	-75.1	-22.8	-176.4	-79.1	-82.5	0	0	0	114.2	I633 L637 L759 K760 M765 I766 G767	I633-F763 HydrophobicContact CB-CD2 4.24Å; I633-F763 HydrophobicContact CB-CG 4.36Å; I633-F763 HydrophobicContact CD1-CD2 3.92Å; I633-F763 HydrophobicContact CD1-CE2 3.7Å; I633-F763 HydrophobicContact CD1-CZ 4.43Å; I633-F763 HydrophobicContact CG1-CD2 3.64Å; I633-F763 HydrophobicContact CG1-CE2 3.98Å; I633-F763 HydrophobicContact CG1-CG 4.22Å; I633-F763 HydrophobicContact CG2-CB 4.21Å; I633-F763 HydrophobicContact CG2-CD1 3.69Å; I633-F763 HydrophobicContact CG2-CD2 3.76Å; I633-F763 HydrophobicContact CG2-CE1 3.9Å; I633-F763 HydrophobicContact CG2-CE2 3.98Å; I633-F763 HydrophobicContact CG2-CG 3.61Å; I633-F763 HydrophobicContact CG2-CZ 4.05Å; L637-F763 HydrophobicContact CD2-CB 4.43Å; L637-F763 HydrophobicContact CD2-CD1 3.91Å; L637-F763 HydrophobicContact CG-CB 4.4Å; L637-F763 HydrophobicContact CG-CD1 4.2Å; L759-F763 WeakPolarHBondContact O-CD2 3.49Å; L759-F763 PolarHBondContact O-N 3.02Å; K760-F763 PolarHBondContact O-N 3.05Å; F763-M765 PolarHBondContact O-N 3.38Å; F763-I766 HydrophobicContact CD1-CD1 4.08Å; F763-I766 HydrophobicContact CE1-CD1 4.23Å; F763-I766 PolarHBondContact O-N 3.17Å; F763-G767 PolarHBondContact O-N 3.48Å
764	S	94	Very high	93.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68	-22.2	172.5	85.8	0	0	0	0	113.1	G88 K760 G761 I762 P768	G88-S764 WeakPolarHBondContact CA-OG 3.22Å; G88-S764 PolarHBondContact N-OG 2.75Å; K760-S764 WeakPolarHBondContact O-CB 3.3Å; K760-S764 PolarHBondContact O-N 2.73Å; G761-S764 PolarHBondContact O-N 3Å; G761-S764 PolarHBondContact O-OG 2.91Å; G761-S764 VanDerWaalsContact O-OG 3.11Å; I762-S764 PolarHBondContact O-N 3.37Å; S764-P768 WeakPolarHBondContact O-CD 3.45Å; S764-P768 WeakPolarHBondContact O-CG 3.31Å
765	M	94.3	Very high	94.2	Very high	46 Å²	46	28.6 Å²	28.6	23%	0.227	15%	0.152	C	C	.	.	H	α-helix	trans	-81.3	-43	173.9	-54.5	165.1	60.3	0	0	110.6	T84 I85 F89 G761 I762 F763 T769	T84-M765 WeakPolarHBondContact O-CA 3.46Å; I85-M765 HydrophobicContact CB-CE 4.46Å; I85-M765 HydrophobicContact CG1-CE 3.97Å; I85-M765 HydrophobicContact CG2-CE 4.26Å; F89-M765 HydrophobicContact CD2-CE 4.24Å; F89-M765 HydrophobicContact CD2-SD 4.33Å; F89-M765 HydrophobicContact CE2-CE 3.82Å; F89-M765 HydrophobicContact CE2-SD 4.33Å; G761-M765 WeakPolarHBondContact O-CG 3.33Å; I762-M765 WeakPolarHBondContact O-CB 3.33Å; I762-M765 PolarHBondContact O-N 3.32Å; F763-M765 PolarHBondContact O-N 3.38Å; M765-T769 VanDerWaalsContact O-CB 3.29Å; M765-T769 WeakPolarHBondContact O-CB 3.2Å; M765-T769 PolarHBondContact O-OG1 3.08Å
766	I	95.2	Very high	94.5	Very high	71 Å²	71	31.3 Å²	31.3	36%	0.364	17%	0.165	S	C	.	.	H	α-helix	trans	-67.6	-49.3	-175.4	-65.5	168.4	0	0	0	111.3	L637 I762 F763 T769 V770	L637-I766 HydrophobicContact CD2-CB 4.38Å; L637-I766 HydrophobicContact CD2-CG2 4.18Å; I762-I766 HydrophobicContact CG2-CD1 3.93Å; I762-I766 WeakPolarHBondContact O-CG1 3.29Å; I762-I766 PolarHBondContact O-N 2.99Å; F763-I766 HydrophobicContact CD1-CD1 4.08Å; F763-I766 HydrophobicContact CE1-CD1 4.23Å; F763-I766 PolarHBondContact O-N 3.17Å; I766-T769 WeakPolarHBondContact O-CB 3.45Å; I766-T769 PolarHBondContact O-N 3.47Å; I766-V770 HydrophobicContact CG2-CG2 3.95Å; I766-V770 WeakPolarHBondContact O-CG2 3.37Å; I766-V770 PolarHBondContact O-N 2.94Å
767	G	93	Very high	94.6	Very high	3 Å²	3	41.2 Å²	41.2	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-65.2	-51.9	-168.3	0	0	0	0	0	114.8	L637 F763 T769 V770 A771	L637-G767 CarbonylContact O-C 3.57Å; L637-G767 VanDerWaalsContact O-CA 3.22Å; L637-G767 WeakPolarHBondContact O-CA 3.4Å; F763-G767 PolarHBondContact O-N 3.48Å; G767-T769 PolarHBondContact O-N 2.78Å; G767-V770 PolarHBondContact O-N 3.3Å; G767-A771 WeakPolarHBondContact O-CB 3.49Å; G767-A771 PolarHBondContact O-N 3.39Å
768	P	94.2	Very high	94.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.5	-22.9	174.9	-22.6	35.2	0	0	0	113.8	T84 L637 F640 I641 Y645 S764 I772	T84-P768 HydrophobicContact CG2-CB 3.65Å; L637-P768 WeakPolarHBondContact O-CD 3.37Å; F640-P768 HydrophobicContact CB-CG 4.08Å; I641-P768 HydrophobicContact CG1-CB 4.12Å; I641-P768 HydrophobicContact CG1-CG 4.1Å; Y645-P768 HydrophobicContact CE2-CB 4.1Å; Y645-P768 PolarHBondContact OH-O 3.38Å; S764-P768 WeakPolarHBondContact O-CD 3.45Å; S764-P768 WeakPolarHBondContact O-CG 3.31Å; P768-I772 WeakPolarHBondContact O-CG2 3.15Å; P768-I772 PolarHBondContact O-N 2.7Å
769	T	95.3	Very high	94.9	Very high	24 Å²	24	45.9 Å²	45.9	15%	0.147	24%	0.239	C	C	.	.	H	α-helix	trans	-73	-50.5	172.4	-67	0	0	0	0	111.3	T77 M81 M765 I766 G767 A771 I772 T773	T77-T769 HydrophobicContact CG2-CG2 4.04Å; M81-T769 HydrophobicContact CE-CG2 3.39Å; M81-T769 WeakPolarHBondContact CE-OG1 3.39Å; M765-T769 VanDerWaalsContact O-CB 3.29Å; M765-T769 WeakPolarHBondContact O-CB 3.2Å; M765-T769 PolarHBondContact O-OG1 3.08Å; I766-T769 WeakPolarHBondContact O-CB 3.45Å; I766-T769 PolarHBondContact O-N 3.47Å; G767-T769 PolarHBondContact O-N 2.78Å; T769-A771 VanDerWaalsContact C-N 3.32Å; T769-A771 PolarHBondContact O-N 3.47Å; T769-I772 VanDerWaalsContact O-CG2 3.25Å; T769-I772 WeakPolarHBondContact O-CG2 3.46Å; T769-I772 PolarHBondContact O-N 3.2Å; T769-T773 WeakPolarHBondContact O-CB 3.21Å; T769-T773 PolarHBondContact O-N 2.93Å; T769-T773 PolarHBondContact O-OG1 3.01Å
770	V	95.2	Very high	95	Very high	71 Å²	71	49.3 Å²	49.3	43%	0.43	25%	0.254	S	S	.	.	H	α-helix	trans	-62.3	-42.3	178.6	169.1	0	0	0	0	110.3	I766 G767 I772 T773 I774	I766-V770 HydrophobicContact CG2-CG2 3.95Å; I766-V770 WeakPolarHBondContact O-CG2 3.37Å; I766-V770 PolarHBondContact O-N 2.94Å; G767-V770 PolarHBondContact O-N 3.3Å; V770-I772 PolarHBondContact O-N 3.13Å; V770-T773 PolarHBondContact O-N 3.36Å; V770-I774 HydrophobicContact CG1-CD1 3.83Å; V770-I774 WeakPolarHBondContact O-CD1 3.44Å; V770-I774 VanDerWaalsContact O-CG1 3.29Å; V770-I774 WeakPolarHBondContact O-CG1 3.34Å; V770-I774 PolarHBondContact O-N 2.69Å
771	A	96.1	Very high	94.9	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-57.9	-48.2	177.3	0	0	0	0	0	112.7	I641 G767 T769 I774 V775 L784 V787	I641-A771 HydrophobicContact CD1-CB 3.64Å; I641-A771 HydrophobicContact CG1-CB 4.37Å; G767-A771 WeakPolarHBondContact O-CB 3.49Å; G767-A771 PolarHBondContact O-N 3.39Å; T769-A771 VanDerWaalsContact C-N 3.32Å; T769-A771 PolarHBondContact O-N 3.47Å; A771-I774 PolarHBondContact O-N 3.02Å; A771-V775 PolarHBondContact O-N 2.75Å; A771-L784 HydrophobicContact CB-CD2 3.97Å; A771-V787 HydrophobicContact CB-CB 4.43Å; A771-V787 HydrophobicContact CB-CG1 4.21Å
772	I	95.7	Very high	94.9	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-71.9	-34.2	178.1	-167.6	68.3	0	0	0	112.3	Q76 T77 Y645 P768 T769 V770 I774 V775 E776 L784	Q76-I772 HydrophobicContact CB-CD1 4.16Å; Q76-I772 HydrophobicContact CB-CG1 3.9Å; T77-I772 HydrophobicContact CG2-CG2 4.29Å; Y645-I772 HydrophobicContact CD1-CD1 4.39Å; Y645-I772 HydrophobicContact CE1-CB 4.17Å; Y645-I772 HydrophobicContact CE1-CD1 3.97Å; Y645-I772 HydrophobicContact CE1-CG1 4.14Å; Y645-I772 WeakPolarHBondContact OH-CB 3.34Å; Y645-I772 VanDerWaalsContact OH-CG2 3.25Å; Y645-I772 WeakPolarHBondContact OH-CG2 3.41Å; P768-I772 WeakPolarHBondContact O-CG2 3.15Å; P768-I772 PolarHBondContact O-N 2.7Å; T769-I772 VanDerWaalsContact O-CG2 3.25Å; T769-I772 WeakPolarHBondContact O-CG2 3.46Å; T769-I772 PolarHBondContact O-N 3.2Å; V770-I772 PolarHBondContact O-N 3.13Å; I772-I774 VanDerWaalsContact C-N 3.26Å; I772-I774 PolarHBondContact O-N 2.82Å; I772-V775 HydrophobicContact CD1-CB 4.21Å; I772-V775 HydrophobicContact CD1-CG1 4.48Å; I772-V775 HydrophobicContact CD1-CG2 4.45Å; I772-V775 WeakPolarHBondContact O-CA 3.49Å; I772-V775 WeakPolarHBondContact O-CB 3.35Å; I772-V775 PolarHBondContact O-N 2.75Å; I772-E776 WeakPolarHBondContact O-CG 3.4Å; I772-E776 PolarHBondContact O-N 3.11Å; I772-L784 HydrophobicContact CB-CD2 4.37Å; I772-L784 HydrophobicContact CD1-CD2 4.25Å
773	T	96.6	Very high	95	Very high	66 Å²	66	50.3 Å²	50.3	41%	0.405	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-37.9	173.6	-54.9	0	0	0	0	111.5	T77 T769 V770 E776 Y777	T77-T773 PolarHBondContact OG1-OG1 3.12Å; T769-T773 WeakPolarHBondContact O-CB 3.21Å; T769-T773 PolarHBondContact O-N 2.93Å; T769-T773 PolarHBondContact O-OG1 3.01Å; V770-T773 PolarHBondContact O-N 3.36Å; T773-E776 PolarHBondContact O-N 3.4Å; T773-Y777 PolarHBondContact O-N 3.13Å; T773-Y777 VanDerWaalsContact O-N 3.11Å
774	I	96.9	Very high	95	Very high	56 Å²	56	47.4 Å²	47.4	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-66.3	-39.1	174.4	-66.6	162.4	0	0	0	110.9	V770 A771 I772 E776 Y777 T778 H783 V787	V770-I774 HydrophobicContact CG1-CD1 3.83Å; V770-I774 WeakPolarHBondContact O-CD1 3.44Å; V770-I774 VanDerWaalsContact O-CG1 3.29Å; V770-I774 WeakPolarHBondContact O-CG1 3.34Å; V770-I774 PolarHBondContact O-N 2.69Å; A771-I774 PolarHBondContact O-N 3.02Å; I772-I774 VanDerWaalsContact C-N 3.26Å; I772-I774 PolarHBondContact O-N 2.82Å; I774-E776 VanDerWaalsContact C-N 3.34Å; I774-E776 PolarHBondContact O-N 3.28Å; I774-Y777 PolarHBondContact O-N 3.46Å; I774-T778 HydrophobicContact CG2-CG2 4.1Å; I774-T778 WeakPolarHBondContact O-CB 3.13Å; I774-T778 VanDerWaalsContact O-CG2 3.29Å; I774-T778 WeakPolarHBondContact O-CG2 3.28Å; I774-T778 PolarHBondContact O-N 3.35Å; I774-T778 PolarHBondContact O-OG1 2.91Å; I774-H783 HydrophobicContact CG2-CB 3.69Å; I774-V787 HydrophobicContact CD1-CG2 3.88Å
775	V	96.5	Very high	95.2	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.03	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-42.3	172.7	176.9	0	0	0	0	111.5	A771 I772 Y777 T778 S779 K781 H783 L784	A771-V775 PolarHBondContact O-N 2.75Å; I772-V775 HydrophobicContact CD1-CB 4.21Å; I772-V775 HydrophobicContact CD1-CG1 4.48Å; I772-V775 HydrophobicContact CD1-CG2 4.45Å; I772-V775 WeakPolarHBondContact O-CA 3.49Å; I772-V775 WeakPolarHBondContact O-CB 3.35Å; I772-V775 PolarHBondContact O-N 2.75Å; V775-Y777 VanDerWaalsContact C-N 3.34Å; V775-Y777 PolarHBondContact O-N 3.4Å; V775-T778 PolarHBondContact O-N 3.12Å; V775-S779 WeakPolarHBondContact O-CA 3.43Å; V775-S779 PolarHBondContact O-N 3.5Å; V775-K781 HydrophobicContact CG1-CB 4.47Å; V775-K781 HydrophobicContact CG1-CG 4.04Å; V775-H783 HydrophobicContact CG2-CB 4.37Å; V775-L784 HydrophobicContact CG2-CD1 4.25Å; V775-L784 HydrophobicContact CG2-CD2 3.84Å; V775-L784 HydrophobicContact CG2-CG 3.6Å
776	E	94.7	Very high	95.3	Very high	63 Å²	63	47.6 Å²	47.6	29%	0.294	25%	0.247	S	C	.	.	H	α-helix	trans	-63.8	-39.3	179.6	-66.4	-168.2	118.6	0	0	112.3	S75 Q76 T77 I772 T773 I774	S75-E776 WeakPolarHBondContact CA-OE1 3.37Å; S75-E776 WeakPolarHBondContact CB-OE1 3.21Å; Q76-E776 WeakPolarHBondContact CA-OE1 3.3Å; Q76-E776 HydrophobicContact CB-CG 4.07Å; Q76-E776 WeakPolarHBondContact CB-OE1 3.34Å; Q76-E776 HydrophobicContact CG-CG 4.36Å; Q76-E776 PolarHBondContact N-OE1 2.78Å; T77-E776 VanDerWaalsContact CB-OE2 3.27Å; T77-E776 WeakPolarHBondContact CB-OE2 3.33Å; T77-E776 PolarHBondContact N-OE1 2.68Å; T77-E776 PolarHBondContact N-OE2 3.28Å; T77-E776 PolarHBondContact OG1-OE2 3.01Å; I772-E776 WeakPolarHBondContact O-CG 3.4Å; I772-E776 PolarHBondContact O-N 3.11Å; T773-E776 PolarHBondContact O-N 3.4Å; I774-E776 VanDerWaalsContact C-N 3.34Å; I774-E776 PolarHBondContact O-N 3.28Å
777	Y	95.3	Very high	95.3	Very high	212 Å²	212	45.9 Å²	45.9	83%	0.831	24%	0.239	S	C	*	.	H	α-helix	trans	-72.9	-40.6	176.7	-176.5	-97.4	0	0	0	113	T773 I774 V775	T773-Y777 PolarHBondContact O-N 3.13Å; T773-Y777 VanDerWaalsContact O-N 3.11Å; I774-Y777 PolarHBondContact O-N 3.46Å; V775-Y777 VanDerWaalsContact C-N 3.34Å; V775-Y777 PolarHBondContact O-N 3.4Å
778	T	96.3	Very high	95.5	Very high	44 Å²	44	45.7 Å²	45.7	27%	0.27	24%	0.238	S	C	.	.	H	α-helix	trans	-88.3	-16.5	-175.4	59.1	0	0	0	0	114.2	I774 V775 Q780 H783	I774-T778 HydrophobicContact CG2-CG2 4.1Å; I774-T778 WeakPolarHBondContact O-CB 3.13Å; I774-T778 VanDerWaalsContact O-CG2 3.29Å; I774-T778 WeakPolarHBondContact O-CG2 3.28Å; I774-T778 PolarHBondContact O-N 3.35Å; I774-T778 PolarHBondContact O-OG1 2.91Å; V775-T778 PolarHBondContact O-N 3.12Å; T778-Q780 PolarHBondContact O-N 2.97Å; T778-Q780 PolarHBondContact OG1-N 3.27Å; T778-H783 PolarHBondContact OG1-ND1 3.14Å; T778-H783 VanDerWaalsContact OG1-ND1 3.08Å
779	S	93.3	Very high	95.6	Very high	110 Å²	110	45.7 Å²	45.7	77%	0.769	24%	0.238	S	C	*	.	S	Bend	trans	55.3	17	-166.6	-59.4	0	0	0	0	115.3	V775	V775-S779 WeakPolarHBondContact O-CA 3.43Å; V775-S779 PolarHBondContact O-N 3.5Å
780	Q	93.7	Very high	95.7	Very high	113 Å²	113	48.9 Å²	48.9	53%	0.528	26%	0.257	S	S	.	.			trans	-119.5	113.2	-178.3	-71.4	177.2	2.6	0	0	110.4	T778 D782 H783	T778-Q780 PolarHBondContact O-N 2.97Å; T778-Q780 PolarHBondContact OG1-N 3.27Å; Q780-D782 PolarHBondContact O-N 2.72Å; Q780-H783 PolarHBondContact O-ND1 3.04Å; Q780-H783 PolarHBondContact OE1-CE1 3.19Å
781	K	93.7	Very high	95.8	Very high	34 Å²	34	46.6 Å²	46.6	15%	0.148	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-24	-176	-64.8	-158.2	-173.3	-175.8	0	114	D648 Y649 S652 V775 H783 L784	D648-K781 PolarHBondContact O-NZ 2.69Å; D648-K781 IonicContact OD1-NZ 2.76Å; D648-K781 PolarHBondContact OD1-NZ 2.75Å; D648-K781 IonicContact OD2-NZ 2.64Å; D648-K781 PolarHBondContact OD2-NZ 2.74Å; Y649-K781 HydrophobicContact CD2-CB 3.78Å; Y649-K781 HydrophobicContact CD2-CD 4.49Å; Y649-K781 HydrophobicContact CE2-CB 4Å; S652-K781 VanDerWaalsContact CB-NZ 3.25Å; S652-K781 VanDerWaalsContact OG-CD 3.31Å; S652-K781 WeakPolarHBondContact OG-CD 3.48Å; S652-K781 WeakPolarHBondContact OG-CE 3.45Å; S652-K781 PolarHBondContact OG-NZ 2.78Å; V775-K781 HydrophobicContact CG1-CB 4.47Å; V775-K781 HydrophobicContact CG1-CG 4.04Å; K781-H783 PolarHBondContact O-N 2.98Å; K781-H783 VanDerWaalsContact O-N 3.08Å; K781-L784 HydrophobicContact CB-CD1 4.44Å; K781-L784 VanDerWaalsContact O-CB 3.31Å; K781-L784 WeakPolarHBondContact O-CB 3.45Å; K781-L784 WeakPolarHBondContact O-CD1 3.42Å; K781-L784 VanDerWaalsContact O-CG 3.24Å; K781-L784 WeakPolarHBondContact O-CG 3.31Å; K781-L784 PolarHBondContact O-N 3.23Å
782	D	94.6	Very high	95.9	Very high	34 Å²	34	46.9 Å²	46.9	18%	0.182	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.3	-177.7	-59.3	8.2	0	0	0	112.6	Y649 Y653 V708 Q780 L784 F785 L786	Y649-D782 PolarHBondContact OH-OD1 3.46Å; Y653-D782 PolarHBondContact OH-OD1 3.43Å; V708-D782 HydrophobicContact CG1-CB 3.75Å; V708-D782 HydrophobicContact CG2-CB 4Å; Q780-D782 PolarHBondContact O-N 2.72Å; D782-L784 PolarHBondContact O-N 3.08Å; D782-L784 VanDerWaalsContact O-N 3.12Å; D782-F785 PolarHBondContact O-N 3.19Å; D782-L786 PolarHBondContact O-N 2.88Å
783	H	95.5	Very high	96	Very high	43 Å²	43	49.1 Å²	49.1	20%	0.199	26%	0.256	C	S	.	.	H	α-helix	trans	-55.2	-27.3	173.8	-68.3	98.7	0	0	0	113.9	I774 V775 T778 Q780 K781 F785 V787	I774-H783 HydrophobicContact CG2-CB 3.69Å; V775-H783 HydrophobicContact CG2-CB 4.37Å; T778-H783 PolarHBondContact OG1-ND1 3.14Å; T778-H783 VanDerWaalsContact OG1-ND1 3.08Å; Q780-H783 PolarHBondContact O-ND1 3.04Å; Q780-H783 PolarHBondContact OE1-CE1 3.19Å; K781-H783 PolarHBondContact O-N 2.98Å; K781-H783 VanDerWaalsContact O-N 3.08Å; H783-F785 VanDerWaalsContact C-N 3.32Å; H783-F785 PolarHBondContact O-N 3.49Å; H783-V787 VanDerWaalsContact O-CB 3.24Å; H783-V787 WeakPolarHBondContact O-CB 3.28Å; H783-V787 WeakPolarHBondContact O-CG2 3.42Å; H783-V787 PolarHBondContact O-N 3.24Å
784	L	96	Very high	96	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.1	-50.5	173.2	-66.5	166.1	0	0	0	110.9	I641 Y645 A771 I772 V775 K781 D782 A788	I641-L784 HydrophobicContact CG2-CB 3.97Å; Y645-L784 HydrophobicContact CD2-CD1 4.46Å; Y645-L784 HydrophobicContact CD2-CD2 3.74Å; Y645-L784 HydrophobicContact CE2-CD2 3.94Å; Y645-L784 HydrophobicContact CG-CD1 4.11Å; Y645-L784 HydrophobicContact CG-CD2 4.12Å; A771-L784 HydrophobicContact CB-CD2 3.97Å; I772-L784 HydrophobicContact CB-CD2 4.37Å; I772-L784 HydrophobicContact CD1-CD2 4.25Å; V775-L784 HydrophobicContact CG2-CD1 4.25Å; V775-L784 HydrophobicContact CG2-CD2 3.84Å; V775-L784 HydrophobicContact CG2-CG 3.6Å; K781-L784 HydrophobicContact CB-CD1 4.44Å; K781-L784 VanDerWaalsContact O-CB 3.31Å; K781-L784 WeakPolarHBondContact O-CB 3.45Å; K781-L784 WeakPolarHBondContact O-CD1 3.42Å; K781-L784 VanDerWaalsContact O-CG 3.24Å; K781-L784 WeakPolarHBondContact O-CG 3.31Å; K781-L784 PolarHBondContact O-N 3.23Å; D782-L784 PolarHBondContact O-N 3.08Å; D782-L784 VanDerWaalsContact O-N 3.12Å; L784-A788 WeakPolarHBondContact O-CB 3.19Å; L784-A788 PolarHBondContact O-N 3.11Å
785	F	96.6	Very high	96	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-86.8	-29.2	-174.6	-62.7	-75.4	0	0	0	112	I641 P642 L646 Y649 H704 L707 V708 Y721 D782 H783 A788 G789	I641-F785 HydrophobicContact CG2-CE1 4.38Å; P642-F785 HydrophobicContact CB-CE1 4.23Å; P642-F785 HydrophobicContact CG-CE1 4.11Å; L646-F785 HydrophobicContact CB-CZ 4.34Å; L646-F785 HydrophobicContact CD1-CE1 4.44Å; L646-F785 HydrophobicContact CD1-CZ 3.91Å; Y649-F785 HydrophobicContact CD1-CD2 4.44Å; Y649-F785 AromaticContact CD1-CE2 3.97Å; Y649-F785 HydrophobicContact CD1-CE2 3.97Å; Y649-F785 AromaticContact CD2-CD2 3.87Å; Y649-F785 HydrophobicContact CD2-CD2 3.87Å; Y649-F785 AromaticContact CD2-CE2 3.58Å; Y649-F785 HydrophobicContact CD2-CE2 3.58Å; Y649-F785 HydrophobicContact CE1-CD2 4.35Å; Y649-F785 HydrophobicContact CE1-CE2 4.34Å; Y649-F785 AromaticContact CE2-CD2 3.78Å; Y649-F785 HydrophobicContact CE2-CD2 3.78Å; Y649-F785 AromaticContact CE2-CE2 3.98Å; Y649-F785 HydrophobicContact CE2-CE2 3.98Å; Y649-F785 HydrophobicContact CG-CD2 4.19Å; Y649-F785 AromaticContact CG-CE2 3.56Å; Y649-F785 HydrophobicContact CG-CE2 3.56Å; H704-F785 HydrophobicContact CB-CB 4.47Å; H704-F785 WeakPolarHBondContact CB-O 3.46Å; H704-F785 AromaticContact ND1-CD1 3.89Å; L707-F785 HydrophobicContact CD2-CB 4.21Å; L707-F785 HydrophobicContact CD2-CD1 3.75Å; L707-F785 HydrophobicContact CD2-CD2 3.88Å; L707-F785 HydrophobicContact CD2-CE1 4.07Å; L707-F785 HydrophobicContact CD2-CE2 4.2Å; L707-F785 HydrophobicContact CD2-CG 3.65Å; L707-F785 HydrophobicContact CD2-CZ 4.29Å; V708-F785 HydrophobicContact CG2-CB 4Å; Y721-F785 WeakPolarHBondContact OH-CE1 3.25Å; D782-F785 PolarHBondContact O-N 3.19Å; H783-F785 VanDerWaalsContact C-N 3.32Å; H783-F785 PolarHBondContact O-N 3.49Å; F785-A788 PolarHBondContact O-N 3.06Å; F785-G789 PolarHBondContact O-N 3.39Å
786	L	96.2	Very high	96	Very high	49 Å²	49	46 Å²	46	26%	0.257	24%	0.241	S	C	.	.	H	α-helix	trans	-61.8	-45.4	168	-64.3	178.8	0	0	0	111.8	V708 F709 D782 G789 V790	V708-L786 HydrophobicContact CB-CD2 4.08Å; V708-L786 HydrophobicContact CB-CG 4.5Å; V708-L786 HydrophobicContact CG1-CD1 4.43Å; V708-L786 HydrophobicContact CG1-CD2 4.04Å; V708-L786 HydrophobicContact CG1-CG 4.25Å; V708-L786 HydrophobicContact CG2-CD2 4.15Å; V708-L786 HydrophobicContact CG2-CG 4.16Å; F709-L786 HydrophobicContact CE2-CD2 3.92Å; F709-L786 HydrophobicContact CZ-CD2 4.33Å; D782-L786 PolarHBondContact O-N 2.88Å; L786-G789 PolarHBondContact O-N 3.43Å; L786-V790 WeakPolarHBondContact O-CG2 3.35Å; L786-V790 PolarHBondContact O-N 2.97Å
787	V	96.2	Very high	96.1	Very high	35 Å²	35	48.1 Å²	48.1	21%	0.212	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-44.3	174.7	169.9	0	0	0	0	110.7	A771 I774 H783 G789 V790 C791	A771-V787 HydrophobicContact CB-CB 4.43Å; A771-V787 HydrophobicContact CB-CG1 4.21Å; I774-V787 HydrophobicContact CD1-CG2 3.88Å; H783-V787 VanDerWaalsContact O-CB 3.24Å; H783-V787 WeakPolarHBondContact O-CB 3.28Å; H783-V787 WeakPolarHBondContact O-CG2 3.42Å; H783-V787 PolarHBondContact O-N 3.24Å; V787-G789 VanDerWaalsContact C-N 3.34Å; V787-G789 PolarHBondContact O-N 2.98Å; V787-V790 PolarHBondContact O-N 3.07Å; V787-C791 WeakPolarHBondContact O-CB 3.13Å; V787-C791 PolarHBondContact O-N 3.02Å; V787-C791 VanDerWaalsContact O-N 3.08Å; V787-C791 PolarHBondContact O-SG 3.13Å
788	A	96.9	Very high	96.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.2	-44.3	176.6	0	0	0	0	0	112.5	A638 I641 H704 L784 F785 C791 Y792	A638-A788 HydrophobicContact CB-CB 3.94Å; I641-A788 HydrophobicContact CB-CB 4.46Å; I641-A788 HydrophobicContact CD1-CB 4.03Å; I641-A788 HydrophobicContact CG2-CB 4.4Å; H704-A788 HydrophobicContact CB-CB 4.38Å; L784-A788 WeakPolarHBondContact O-CB 3.19Å; L784-A788 PolarHBondContact O-N 3.11Å; F785-A788 PolarHBondContact O-N 3.06Å; A788-C791 PolarHBondContact O-N 3.47Å; A788-Y792 PolarHBondContact O-N 3.44Å
789	G	97.1	Very high	96.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.5	-48.2	178.8	0	0	0	0	0	113.1	F785 L786 V787 C791 Y792 I793	F785-G789 PolarHBondContact O-N 3.39Å; L786-G789 PolarHBondContact O-N 3.43Å; V787-G789 VanDerWaalsContact C-N 3.34Å; V787-G789 PolarHBondContact O-N 2.98Å; G789-C791 VanDerWaalsContact C-N 3.35Å; G789-C791 PolarHBondContact O-N 3.41Å; G789-Y792 PolarHBondContact O-N 3.44Å; G789-I793 WeakPolarHBondContact O-CB 3.29Å; G789-I793 VanDerWaalsContact O-CG1 3.28Å; G789-I793 WeakPolarHBondContact O-CG1 3.25Å; G789-I793 PolarHBondContact O-N 3.43Å
790	V	96.8	Very high	96.1	Very high	91 Å²	91	38 Å²	38	55%	0.552	20%	0.202	S	C	*	.	H	α-helix	trans	-58.8	-46.5	176	171.1	0	0	0	0	110.9	L786 V787 Y792 I793 V794	L786-V790 WeakPolarHBondContact O-CG2 3.35Å; L786-V790 PolarHBondContact O-N 2.97Å; V787-V790 PolarHBondContact O-N 3.07Å; V790-Y792 PolarHBondContact O-N 3.39Å; V790-I793 PolarHBondContact O-N 3.39Å; V790-V794 HydrophobicContact CG1-CG2 4.5Å; V790-V794 WeakPolarHBondContact O-CG2 3.05Å; V790-V794 PolarHBondContact O-N 2.94Å
791	C	97.3	Very high	96.1	Very high	23 Å²	23	33.4 Å²	33.4	16%	0.155	19%	0.185	C	C	.	.	H	α-helix	trans	-59.2	-43.8	177.8	-75	0	0	0	0	113	T634 A638 V787 A788 G789 S795	T634-C791 WeakPolarHBondContact O-CB 3.38Å; A638-C791 HydrophobicContact CB-CB 3.75Å; V787-C791 WeakPolarHBondContact O-CB 3.13Å; V787-C791 PolarHBondContact O-N 3.02Å; V787-C791 VanDerWaalsContact O-N 3.08Å; V787-C791 PolarHBondContact O-SG 3.13Å; A788-C791 PolarHBondContact O-N 3.47Å; G789-C791 VanDerWaalsContact C-N 3.35Å; G789-C791 PolarHBondContact O-N 3.41Å; C791-S795 PolarHBondContact O-N 3.3Å
792	Y	97.5	Very high	96	Very high	6 Å²	6	31.8 Å²	31.8	2%	0.024	18%	0.178	C	C	.	.	H	α-helix	trans	-69.5	-37.4	176.5	-94.9	-124.9	0	0	0	113	S635 A638 T697 G701 Y725 A788 G789 V790 S795 A796	S635-Y792 WeakPolarHBondContact O-CE2 3.43Å; A638-Y792 HydrophobicContact CB-CD2 3.53Å; A638-Y792 HydrophobicContact CB-CE2 3.58Å; T697-Y792 WeakPolarHBondContact O-CD1 3.35Å; G701-Y792 VanDerWaalsContact CA-CB 3.42Å; Y725-Y792 AromaticContact CE2-CE1 3.88Å; Y725-Y792 HydrophobicContact CE2-CE1 3.88Å; Y725-Y792 AromaticContact CE2-CZ 3.91Å; Y725-Y792 PolarHBondContact OH-OH 2.83Å; A788-Y792 PolarHBondContact O-N 3.44Å; G789-Y792 PolarHBondContact O-N 3.44Å; V790-Y792 PolarHBondContact O-N 3.39Å; Y792-S795 WeakPolarHBondContact O-CB 3.26Å; Y792-S795 PolarHBondContact O-N 3.36Å; Y792-A796 PolarHBondContact O-N 2.87Å
793	I	97.3	Very high	95.8	Very high	47 Å²	47	30.6 Å²	30.6	24%	0.241	17%	0.173	C	C	.	.	H	α-helix	trans	-65.8	-41.4	175.7	-69.5	165.6	0	0	0	110.7	V705 G789 V790 S795 A796 L797	V705-I793 HydrophobicContact CG2-CD1 4.1Å; G789-I793 WeakPolarHBondContact O-CB 3.29Å; G789-I793 VanDerWaalsContact O-CG1 3.28Å; G789-I793 WeakPolarHBondContact O-CG1 3.25Å; G789-I793 PolarHBondContact O-N 3.43Å; V790-I793 PolarHBondContact O-N 3.39Å; I793-S795 VanDerWaalsContact C-N 3.34Å; I793-A796 PolarHBondContact O-N 3.42Å; I793-L797 HydrophobicContact CG2-CD1 4.45Å; I793-L797 WeakPolarHBondContact O-CG 3.18Å; I793-L797 PolarHBondContact O-N 3.28Å
794	V	97.4	Very high	95.5	Very high	58 Å²	58	38 Å²	38	35%	0.352	20%	0.199	S	C	.	.	H	α-helix	trans	-63.4	-40.7	173	175.6	0	0	0	0	111	T634 V790 A796 L797 L798	T634-V794 HydrophobicContact CG2-CG1 3.94Å; V790-V794 HydrophobicContact CG1-CG2 4.5Å; V790-V794 WeakPolarHBondContact O-CG2 3.05Å; V790-V794 PolarHBondContact O-N 2.94Å; V794-A796 VanDerWaalsContact C-N 3.32Å; V794-A796 PolarHBondContact O-N 3.12Å; V794-L797 PolarHBondContact O-N 3.43Å; V794-L798 HydrophobicContact CG1-CD1 4.29Å; V794-L798 WeakPolarHBondContact O-CG 3.47Å; V794-L798 PolarHBondContact O-N 3.05Å
795	S	96.8	Very high	95.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59	-41.7	173.6	-167	0	0	0	0	112.3	I631 T634 C791 Y792 I793 L798 H799	I631-S795 PolarHBondContact O-OG 3.49Å; I631-S795 VanDerWaalsContact O-OG 3.13Å; T634-S795 VanDerWaalsContact OG1-CA 3.31Å; T634-S795 WeakPolarHBondContact OG1-CA 3.45Å; T634-S795 VanDerWaalsContact OG1-CB 3.3Å; T634-S795 WeakPolarHBondContact OG1-CB 3.49Å; C791-S795 PolarHBondContact O-N 3.3Å; Y792-S795 WeakPolarHBondContact O-CB 3.26Å; Y792-S795 PolarHBondContact O-N 3.36Å; I793-S795 VanDerWaalsContact C-N 3.34Å; S795-L798 PolarHBondContact O-N 3.38Å; S795-H799 PolarHBondContact O-N 3.46Å; S795-H799 VanDerWaalsContact O-N 3.07Å; S795-H799 PolarHBondContact O-ND1 2.98Å
796	A	96.6	Very high	94.4	Very high	5 Å²	5	42.6 Å²	42.6	4%	0.041	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-41.4	175.5	0	0	0	0	0	112.8	F698 Y792 I793 V794 L798 H799 L800	F698-A796 HydrophobicContact CB-CB 3.71Å; F698-A796 HydrophobicContact CD2-CB 4.15Å; F698-A796 HydrophobicContact CG-CB 4.41Å; Y792-A796 PolarHBondContact O-N 2.87Å; I793-A796 PolarHBondContact O-N 3.42Å; V794-A796 VanDerWaalsContact C-N 3.32Å; V794-A796 PolarHBondContact O-N 3.12Å; A796-L798 VanDerWaalsContact C-N 3.27Å; A796-L798 PolarHBondContact O-N 3.08Å; A796-H799 WeakPolarHBondContact O-CB 3.39Å; A796-H799 PolarHBondContact O-N 3.01Å; A796-H799 VanDerWaalsContact O-N 3.16Å; A796-L800 PolarHBondContact O-N 3.2Å; A796-L800 VanDerWaalsContact O-N 3.11Å
797	L	96.5	Very high	93.6	Very high	107 Å²	107	43 Å²	43	56%	0.56	23%	0.226	S	C	*	.	H	α-helix	trans	-61.4	-35.8	174	-68.6	172.1	0	0	0	111.9	I793 V794 L800 G801	I793-L797 HydrophobicContact CG2-CD1 4.45Å; I793-L797 WeakPolarHBondContact O-CG 3.18Å; I793-L797 PolarHBondContact O-N 3.28Å; V794-L797 PolarHBondContact O-N 3.43Å; L797-L800 HydrophobicContact CD2-CD1 4.47Å; L797-L800 PolarHBondContact O-N 3.03Å; L797-G801 PolarHBondContact O-N 3.05Å
798	L	96.7	Very high	92.7	Very high	47 Å²	47	47.9 Å²	47.9	25%	0.246	25%	0.245	C	C	.	.	H	α-helix	trans	-69.9	-33	174.5	-67.8	170.6	0	0	0	112.8	Y627 I631 T634 V794 S795 A796 G801 L802	Y627-L798 HydrophobicContact CD1-CB 4.5Å; Y627-L798 HydrophobicContact CD1-CD2 4.23Å; Y627-L798 WeakPolarHBondContact CD1-O 3.42Å; Y627-L798 HydrophobicContact CE1-CD2 4.15Å; I631-L798 HydrophobicContact CD1-CB 4.48Å; I631-L798 HydrophobicContact CG1-CB 3.64Å; T634-L798 HydrophobicContact CG2-CD1 4.03Å; V794-L798 HydrophobicContact CG1-CD1 4.29Å; V794-L798 WeakPolarHBondContact O-CG 3.47Å; V794-L798 PolarHBondContact O-N 3.05Å; S795-L798 PolarHBondContact O-N 3.38Å; A796-L798 VanDerWaalsContact C-N 3.27Å; A796-L798 PolarHBondContact O-N 3.08Å; L798-G801 PolarHBondContact O-N 3.08Å; L798-L802 WeakPolarHBondContact O-CB 3.47Å; L798-L802 PolarHBondContact O-N 3.29Å
799	H	95	Very high	91.7	Very high	3 Å²	3	49.7 Å²	49.7	1%	0.014	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-41.6	169.6	-73.4	87.6	0	0	0	112	I631 S693 G694 T697 S795 A796 G801 L802 C803	I631-H799 HydrophobicContact CD1-CB 4.41Å; I631-H799 WeakPolarHBondContact CG2-CE1 3.29Å; S693-H799 VanDerWaalsContact CB-NE2 3.33Å; S693-H799 WeakPolarHBondContact CB-NE2 3.29Å; S693-H799 PolarHBondContact OG-NE2 2.93Å; G694-H799 VanDerWaalsContact CA-CG 3.49Å; G694-H799 PolarHBondContact N-CD2 3.33Å; T697-H799 PolarHBondContact OG1-CE1 3.12Å; T697-H799 PolarHBondContact OG1-ND1 3.27Å; S795-H799 PolarHBondContact O-N 3.46Å; S795-H799 VanDerWaalsContact O-N 3.07Å; S795-H799 PolarHBondContact O-ND1 2.98Å; A796-H799 WeakPolarHBondContact O-CB 3.39Å; A796-H799 PolarHBondContact O-N 3.01Å; A796-H799 VanDerWaalsContact O-N 3.16Å; H799-G801 VanDerWaalsContact C-N 3.32Å; H799-L802 PolarHBondContact O-N 3.41Å; H799-C803 WeakPolarHBondContact O-CB 3.15Å; H799-C803 PolarHBondContact O-N 3.29Å
800	L	93.7	Very high	90.4	Very high	102 Å²	102	56.7 Å²	56.7	53%	0.534	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-39.1	175	-64.5	175.4	0	0	0	111.4	A796 L797 C803 R804	A796-L800 PolarHBondContact O-N 3.2Å; A796-L800 VanDerWaalsContact O-N 3.11Å; L797-L800 HydrophobicContact CD2-CD1 4.47Å; L797-L800 PolarHBondContact O-N 3.03Å; L800-C803 PolarHBondContact O-N 2.76Å; L800-R804 WeakPolarHBondContact O-CB 3.36Å; L800-R804 PolarHBondContact O-N 3.47Å
801	G	93.4	Very high	89	Confident	17 Å²	17	60.4 Å²	60.4	18%	0.175	30%	0.295	C	S	.	.	H	α-helix	trans	-60	-50	172.3	0	0	0	0	0	112.9	L797 L798 H799 C803 R804 Y805	L797-G801 PolarHBondContact O-N 3.05Å; L798-G801 PolarHBondContact O-N 3.08Å; H799-G801 VanDerWaalsContact C-N 3.32Å; G801-C803 VanDerWaalsContact C-N 3.32Å; G801-C803 PolarHBondContact O-N 3.11Å; G801-R804 PolarHBondContact O-N 3.21Å; G801-Y805 WeakPolarHBondContact O-CB 3.44Å; G801-Y805 PolarHBondContact O-N 2.89Å
802	L	92.6	Very high	87.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-42.9	175.7	177.4	57.2	0	0	0	111.9	Y627 L628 I631 V690 F743 L798 H799 Y805 S806	Y627-L802 HydrophobicContact CD1-CB 4.19Å; Y627-L802 HydrophobicContact CG-CB 4.02Å; Y627-L802 HydrophobicContact CG-CD1 4.38Å; L628-L802 HydrophobicContact CD2-CD2 3.64Å; L628-L802 HydrophobicContact CG-CD2 4.22Å; I631-L802 HydrophobicContact CD1-CB 4.39Å; I631-L802 HydrophobicContact CD1-CD2 3.86Å; V690-L802 HydrophobicContact CG1-CD2 4.44Å; V690-L802 HydrophobicContact CG1-CG 4.48Å; F743-L802 HydrophobicContact CD1-CD1 4.32Å; F743-L802 HydrophobicContact CD2-CD1 4.32Å; F743-L802 HydrophobicContact CD2-CD2 4.24Å; F743-L802 HydrophobicContact CE1-CD1 4.05Å; F743-L802 HydrophobicContact CE2-CD1 4.05Å; F743-L802 HydrophobicContact CE2-CD2 3.81Å; F743-L802 HydrophobicContact CE2-CG 4.05Å; F743-L802 HydrophobicContact CG-CD1 4.47Å; F743-L802 HydrophobicContact CZ-CD1 3.91Å; F743-L802 HydrophobicContact CZ-CD2 4.32Å; F743-L802 HydrophobicContact CZ-CG 4.04Å; L798-L802 WeakPolarHBondContact O-CB 3.47Å; L798-L802 PolarHBondContact O-N 3.29Å; H799-L802 PolarHBondContact O-N 3.41Å; L802-Y805 PolarHBondContact O-N 3Å; L802-S806 WeakPolarHBondContact O-CB 3.4Å; L802-S806 PolarHBondContact O-N 3.19Å; L802-S806 PolarHBondContact O-OG 3.43Å
803	C	89.4	Confident	86	Confident	10 Å²	10	69 Å²	69	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-64.9	-46	177.3	-166.7	0	0	0	0	111.8	V690 Y691 H799 L800 G801 Y805 S806 C807	V690-C803 HydrophobicContact CG1-CB 3.97Å; Y691-C803 WeakPolarHBondContact CE2-SG 3.49Å; Y691-C803 PolarHBondContact OH-SG 2.78Å; Y691-C803 VanDerWaalsContact OH-SG 3.38Å; H799-C803 WeakPolarHBondContact O-CB 3.15Å; H799-C803 PolarHBondContact O-N 3.29Å; L800-C803 PolarHBondContact O-N 2.76Å; G801-C803 VanDerWaalsContact C-N 3.32Å; G801-C803 PolarHBondContact O-N 3.11Å; C803-Y805 VanDerWaalsContact C-N 3.35Å; C803-Y805 PolarHBondContact O-N 3.09Å; C803-S806 WeakPolarHBondContact O-CB 3.13Å; C803-S806 PolarHBondContact O-N 3.11Å; C803-S806 VanDerWaalsContact O-N 3.16Å; C803-C807 PolarHBondContact O-N 2.91Å
804	R	88.7	Confident	84.3	Confident	198 Å²	198	69.6 Å²	69.6	75%	0.747	35%	0.345	S	S	*	.	H	α-helix	trans	-63	-40	177.4	-169.7	175.4	179.4	93.9	0.6	112.1	L800 G801 C807 F808	L800-R804 WeakPolarHBondContact O-CB 3.36Å; L800-R804 PolarHBondContact O-N 3.47Å; G801-R804 PolarHBondContact O-N 3.21Å; R804-C807 PolarHBondContact O-N 2.96Å; R804-F808 WeakPolarHBondContact O-CB 3.5Å; R804-F808 PolarHBondContact O-N 3.23Å
805	Y	87.8	Confident	82.4	Confident	76 Å²	76	69 Å²	69	30%	0.298	34%	0.343	S	S	.	.	H	α-helix	trans	-60.4	-45.2	172.3	179.4	-98.1	0	0	0	111.6	P623 S624 Y627 G801 L802 C803 C807 F808 A809	P623-Y805 HydrophobicContact CB-CE1 4.26Å; P623-Y805 HydrophobicContact CB-CE2 3.97Å; P623-Y805 HydrophobicContact CG-CE2 4.4Å; S624-Y805 WeakPolarHBondContact OG-CE1 3.43Å; Y627-Y805 HydrophobicContact CE2-CG 4.45Å; G801-Y805 WeakPolarHBondContact O-CB 3.44Å; G801-Y805 PolarHBondContact O-N 2.89Å; L802-Y805 PolarHBondContact O-N 3Å; C803-Y805 VanDerWaalsContact C-N 3.35Å; C803-Y805 PolarHBondContact O-N 3.09Å; Y805-C807 VanDerWaalsContact C-N 3.35Å; Y805-C807 PolarHBondContact O-N 3.35Å; Y805-F808 PolarHBondContact O-N 3.37Å; Y805-A809 WeakPolarHBondContact O-CB 3.39Å; Y805-A809 PolarHBondContact O-N 3.01Å
806	S	82.3	Confident	80.6	Confident	20 Å²	20	72 Å²	72	14%	0.14	36%	0.362	C	S	.	.	H	α-helix	trans	-58.1	-43.8	178.1	-56.6	0	0	0	0	112.7	F743 L802 C803 K810	F743-S806 WeakPolarHBondContact CE1-OG 3.39Å; F743-S806 VanDerWaalsContact CZ-OG 3.3Å; F743-S806 WeakPolarHBondContact CZ-OG 3.25Å; L802-S806 WeakPolarHBondContact O-CB 3.4Å; L802-S806 PolarHBondContact O-N 3.19Å; L802-S806 PolarHBondContact O-OG 3.43Å; C803-S806 WeakPolarHBondContact O-CB 3.13Å; C803-S806 PolarHBondContact O-N 3.11Å; C803-S806 VanDerWaalsContact O-N 3.16Å; S806-K810 PolarHBondContact O-N 3.21Å
807	C	78.5	Confident	78.7	Confident	58 Å²	58	76.4 Å²	76.4	39%	0.392	39%	0.385	S	S	.	.	H	α-helix	trans	-67.8	-43.2	176.1	-65.9	0	0	0	0	111.9	C803 R804 Y805 K810 Y811	C803-C807 PolarHBondContact O-N 2.91Å; R804-C807 PolarHBondContact O-N 2.96Å; Y805-C807 VanDerWaalsContact C-N 3.35Å; Y805-C807 PolarHBondContact O-N 3.35Å; C807-K810 PolarHBondContact O-N 3.32Å; C807-Y811 PolarHBondContact O-N 3.41Å
808	F	79	Confident	76.7	Confident	138 Å²	138	77.9 Å²	77.9	61%	0.605	39%	0.386	S	S	*	.	H	α-helix	trans	-65.2	-41.1	179.9	-173.2	-97.7	0	0	0	112.6	R804 Y805 K810 Y811 S812	R804-F808 WeakPolarHBondContact O-CB 3.5Å; R804-F808 PolarHBondContact O-N 3.23Å; Y805-F808 PolarHBondContact O-N 3.37Å; F808-K810 VanDerWaalsContact C-N 3.35Å; F808-K810 PolarHBondContact O-N 2.92Å; F808-Y811 PolarHBondContact O-N 3.45Å; F808-S812 WeakPolarHBondContact O-CB 3.29Å; F808-S812 PolarHBondContact O-N 3.18Å
809	A	74.2	Confident	74.5	Confident	37 Å²	37	82.1 Å²	82.1	31%	0.306	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-40	176.6	0	0	0	0	0	112.3	Y805 K813	Y805-A809 WeakPolarHBondContact O-CB 3.39Å; Y805-A809 PolarHBondContact O-N 3.01Å; A809-K813 PolarHBondContact O-N 3.32Å
810	K	70.7	Confident	72.2	Confident	148 Å²	148	89.7 Å²	89.7	64%	0.643	43%	0.434	S	S	*	.	H	α-helix	trans	-63.4	-47.7	171.8	-77.4	-168.7	172.5	-164.8	0	112.1	S806 C807 F808 S812 K813 S814	S806-K810 PolarHBondContact O-N 3.21Å; C807-K810 PolarHBondContact O-N 3.32Å; F808-K810 VanDerWaalsContact C-N 3.35Å; F808-K810 PolarHBondContact O-N 2.92Å; K810-S812 VanDerWaalsContact C-N 3.35Å; K810-S812 PolarHBondContact O-N 3.1Å; K810-K813 PolarHBondContact O-N 2.95Å; K810-S814 PolarHBondContact O-N 3.47Å
811	Y	68.1	Low	70	Confident	168 Å²	168	88.7 Å²	88.7	66%	0.659	43%	0.432	S	S	*	.	H	α-helix	trans	-60.5	-43.7	179.3	-175.7	-93.7	0	0	0	111.9	C807 F808 S814 S815	C807-Y811 PolarHBondContact O-N 3.41Å; F808-Y811 PolarHBondContact O-N 3.45Å; Y811-S814 PolarHBondContact O-N 2.88Å; Y811-S815 PolarHBondContact O-N 2.85Å; Y811-S815 PolarHBondContact O-OG 3.23Å
812	S	65.9	Low	67.6	Low	52 Å²	52	94.1 Å²	94.1	36%	0.364	46%	0.457	S	S	.	.	H	α-helix	trans	-58.7	-49.8	177.3	-177.5	0	0	0	0	111.9	F808 K810 S814 S815 T816	F808-S812 WeakPolarHBondContact O-CB 3.29Å; F808-S812 PolarHBondContact O-N 3.18Å; K810-S812 VanDerWaalsContact C-N 3.35Å; K810-S812 PolarHBondContact O-N 3.1Å; S812-S814 PolarHBondContact O-N 2.96Å; S812-S815 PolarHBondContact O-N 3.3Å; S812-S815 PolarHBondContact O-OG 3.22Å; S812-T816 PolarHBondContact O-N 3.2Å; S812-T816 VanDerWaalsContact O-N 3.08Å; S812-T816 PolarHBondContact O-OG1 3.1Å
813	K	66.3	Low	65.2	Low	158 Å²	158	100.7 Å²	100.7	69%	0.687	49%	0.492	S	S	*	.	H	α-helix	trans	-61.2	-39.5	175.2	-73.4	-171.4	175.2	-172.1	0	113.1	A809 K810 S815 T816 N817	A809-K813 PolarHBondContact O-N 3.32Å; K810-K813 PolarHBondContact O-N 2.95Å; K813-S815 VanDerWaalsContact C-N 3.35Å; K813-T816 PolarHBondContact O-OG1 3.25Å; K813-N817 WeakPolarHBondContact O-CB 3.38Å; K813-N817 PolarHBondContact O-N 3.32Å
814	S	60.2	Low	62.7	Low	60 Å²	60	109.1 Å²	109.1	42%	0.42	52%	0.523	S	S	.	.	H	α-helix	trans	-63.5	-40.4	175.3	-174.3	0	0	0	0	111.9	K810 Y811 S812 N817 K818	K810-S814 PolarHBondContact O-N 3.47Å; Y811-S814 PolarHBondContact O-N 2.88Å; S812-S814 PolarHBondContact O-N 2.96Å; S814-N817 PolarHBondContact O-N 3.26Å; S814-K818 PolarHBondContact O-N 3.03Å
815	S	58.1	Low	60.1	Low	44 Å²	44	105.9 Å²	105.9	31%	0.308	52%	0.521	S	S	.	.	H	α-helix	trans	-67.9	-40.1	179.2	70.4	0	0	0	0	113.4	Y811 S812 K813 K818 Q819	Y811-S815 PolarHBondContact O-N 2.85Å; Y811-S815 PolarHBondContact O-OG 3.23Å; S812-S815 PolarHBondContact O-N 3.3Å; S812-S815 PolarHBondContact O-OG 3.22Å; K813-S815 VanDerWaalsContact C-N 3.35Å; S815-K818 PolarHBondContact O-N 3.1Å; S815-Q819 WeakPolarHBondContact O-CG 3.4Å; S815-Q819 PolarHBondContact O-N 3.1Å
816	T	59.8	Low	57.5	Low	63 Å²	63	109.8 Å²	109.8	39%	0.387	55%	0.547	S	S	.	.	H	α-helix	trans	-72.5	-34.2	175.9	46.6	0	0	0	0	112.6	S812 K813 Q819 R820	S812-T816 PolarHBondContact O-N 3.2Å; S812-T816 VanDerWaalsContact O-N 3.08Å; S812-T816 PolarHBondContact O-OG1 3.1Å; K813-T816 PolarHBondContact O-OG1 3.25Å; T816-Q819 PolarHBondContact O-N 3.26Å; T816-R820 PolarHBondContact O-N 3.06Å; T816-R820 VanDerWaalsContact O-N 3.09Å
817	N	56.8	Low	55	Low	98 Å²	98	115.2 Å²	115.2	52%	0.524	58%	0.58	S	S	.	*	H	α-helix	trans	-66	-43.2	170.6	-83.9	9.9	0	0	0	111.6	K813 S814 Q819 R820 T821	K813-N817 WeakPolarHBondContact O-CB 3.38Å; K813-N817 PolarHBondContact O-N 3.32Å; S814-N817 PolarHBondContact O-N 3.26Å; N817-Q819 VanDerWaalsContact C-N 3.28Å; N817-Q819 PolarHBondContact O-N 3.35Å; N817-R820 WeakPolarHBondContact O-CA 3.21Å; N817-R820 PolarHBondContact O-N 3.02Å; N817-T821 PolarHBondContact O-N 3.46Å; N817-T821 PolarHBondContact O-OG1 2.81Å
818	K	52.6	Low	52.8	Low	138 Å²	138	117 Å²	117	60%	0.6	59%	0.593	S	S	*	*	H	α-helix	trans	-61.5	-33.7	173.3	-83.2	-166.4	170.8	-171.4	0	113.4	S814 S815 R820 T821 N822	S814-K818 PolarHBondContact O-N 3.03Å; S815-K818 PolarHBondContact O-N 3.1Å; K818-R820 VanDerWaalsContact C-N 3.32Å; K818-T821 WeakPolarHBondContact CA-OG1 3.28Å; K818-T821 PolarHBondContact O-OG1 3.36Å; K818-N822 WeakPolarHBondContact O-CB 3.45Å; K818-N822 PolarHBondContact O-N 3.01Å; K818-N822 PolarHBondContact O-OD1 3.26Å; K818-N822 VanDerWaalsContact O-OD1 3.11Å
819	Q	52	Low	50.5	Low	136 Å²	136	118.7 Å²	118.7	64%	0.636	61%	0.608	S	S	*	*	H	α-helix	trans	-68.6	-29.4	172.3	-75.9	-179.2	-42.8	0	0	112.9	S815 T816 N817	S815-Q819 WeakPolarHBondContact O-CG 3.4Å; S815-Q819 PolarHBondContact O-N 3.1Å; T816-Q819 PolarHBondContact O-N 3.26Å; N817-Q819 VanDerWaalsContact C-N 3.28Å; N817-Q819 PolarHBondContact O-N 3.35Å
820	R	46.7	Very low	48.5	Very low	163 Å²	163	125.8 Å²	125.8	62%	0.615	63%	0.632	S	S	*	*	H	α-helix	trans	-78.1	-38.5	174	-72.9	177.4	174	-179.1	-2.6	113.3	T816 N817 K818 N822 D823	T816-R820 PolarHBondContact O-N 3.06Å; T816-R820 VanDerWaalsContact O-N 3.09Å; N817-R820 WeakPolarHBondContact O-CA 3.21Å; N817-R820 PolarHBondContact O-N 3.02Å; K818-R820 VanDerWaalsContact C-N 3.32Å; R820-N822 VanDerWaalsContact C-N 3.29Å; R820-D823 PolarHBondContact O-N 3.36Å
821	T	47.6	Very low	46.6	Very low	80 Å²	80	125.5 Å²	125.5	49%	0.491	63%	0.633	S	S	.	*	H	α-helix	trans	-70.7	-26.2	174	58.7	0	0	0	0	111.8	N817 K818 D823 Y824	N817-T821 PolarHBondContact O-N 3.46Å; N817-T821 PolarHBondContact O-OG1 2.81Å; K818-T821 WeakPolarHBondContact CA-OG1 3.28Å; K818-T821 PolarHBondContact O-OG1 3.36Å; T821-D823 PolarHBondContact O-N 3.41Å; T821-Y824 CarbonylContact O-C 3.28Å; T821-Y824 VanDerWaalsContact O-C 3.28Å; T821-Y824 PolarHBondContact O-N 3.31Å; T821-Y824 VanDerWaalsContact O-N 3.1Å
822	N	42	Very low	44.8	Very low	132 Å²	132	121.7 Å²	121.7	71%	0.706	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-10.5	172.9	-72.7	8.7	0	0	0	113.7	K818 R820	K818-N822 WeakPolarHBondContact O-CB 3.45Å; K818-N822 PolarHBondContact O-N 3.01Å; K818-N822 PolarHBondContact O-OD1 3.26Å; K818-N822 VanDerWaalsContact O-OD1 3.11Å; R820-N822 VanDerWaalsContact C-N 3.29Å
823	D	43	Very low	43.1	Very low	137 Å²	137	123.5 Å²	123.5	73%	0.733	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-8.2	170.2	-79	-27.1	0	0	0	112.8	R820 T821	R820-D823 PolarHBondContact O-N 3.36Å; T821-D823 PolarHBondContact O-N 3.41Å
824	Y	35.9	Very low	41.5	Very low	187 Å²	187	124.6 Å²	124.6	73%	0.733	64%	0.636	S	S	*	*	S	Bend	trans	-146.3	118.6	-180	-92.4	-89.8	0	0	0	112.1	T821	T821-Y824 CarbonylContact O-C 3.28Å; T821-Y824 VanDerWaalsContact O-C 3.28Å; T821-Y824 PolarHBondContact O-N 3.31Å; T821-Y824 VanDerWaalsContact O-N 3.1Å
825	D	35	Very low	40.3	Very low	131 Å²	131	125.5 Å²	125.5	70%	0.701	65%	0.647	S	S	*	*			trans	89.9	95.9	174.2	-54.2	-16.7	0	0	0	117
826	D	32.2	Very low	38.9	Very low	157 Å²	157	130.9 Å²	130.9	84%	0.84	67%	0.665	S	S	*	*	S	Bend		-53.8	139.6	128.5	-95.9	-49.3	0	0	0	108.4
827	T	31	Very low	37.3	Very low	135 Å²	135	132.6 Å²	132.6	83%	0.828	68%	0.678	S	S	*	*	S	Bend	trans	74.7	64.5	174.5	70.1	0	0	0	0	119.3
828	S	31.9	Very low	35.9	Very low	95 Å²	95	136.9 Å²	136.9	66%	0.664	69%	0.693	S	S	*	*				-164	131.1	118.7	52.8	0	0	0	0	114.8	F830	S828-F830 PolarHBondContact O-N 3.46Å
829	N	31.2	Very low	34.8	Very low	174 Å²	174	135.1 Å²	135.1	93%	0.93	70%	0.695	S	S	*	*			trans	-87	80.1	169.6	-81.1	-41.4	0	0	0	110.2
830	F	31.5	Very low	33.6	Very low	185 Å²	185	134 Å²	134	81%	0.811	70%	0.702	S	S	*	*			trans	-94.6	99.4	168.3	-142.4	-93.4	0	0	0	109.9	S828 D832	S828-F830 PolarHBondContact O-N 3.46Å; F830-D832 PolarHBondContact O-N 3.42Å
831	E	30.4	Very low	32.6	Very low	142 Å²	142	130.5 Å²	130.5	66%	0.664	70%	0.702	S	S	*	*			trans	-67	114.1	173.6	-74.1	-157	152	0	0	110.2	P833 K836	E831-P833 VanDerWaalsContact O-CD 3.28Å; E831-P833 WeakPolarHBondContact O-CD 3.31Å; E831-P833 VanDerWaalsContact O-N 3.13Å; E831-K836 IonicContact OE2-NZ 2.81Å; E831-K836 PolarHBondContact OE2-NZ 3.27Å
832	D	31.8	Very low	31.7	Very low	89 Å²	89	136.9 Å²	136.9	48%	0.476	72%	0.723	S	S	.	*			trans	-57.6	113.2	171.4	175.7	-0.3	0	0	0	110.5	F830 Y834 A835	F830-D832 PolarHBondContact O-N 3.42Å; D832-Y834 PolarHBondContact O-N 3.43Å; D832-Y834 WeakPolarHBondContact OD1-CB 3.2Å; D832-Y834 PolarHBondContact OD1-N 3.2Å; D832-A835 WeakPolarHBondContact O-CB 3.49Å; D832-A835 PolarHBondContact O-N 3.04Å
833	P	29.8	Very low	30.9	Very low	89 Å²	89	142.5 Å²	142.5	58%	0.578	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-67.1	-18.2	-175.3	27.9	-34.9	0	0	0	113.1	E831 A835	E831-P833 VanDerWaalsContact O-CD 3.28Å; E831-P833 WeakPolarHBondContact O-CD 3.31Å; E831-P833 VanDerWaalsContact O-N 3.13Å; P833-A835 VanDerWaalsContact C-N 3.28Å; P833-A835 PolarHBondContact O-N 3.04Å
834	Y	32.9	Very low	30.3	Very low	182 Å²	182	142.8 Å²	142.8	71%	0.714	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-80	-7.8	179.2	-63.7	-73.7	0	0	0	113.7	D832 K836	D832-Y834 PolarHBondContact O-N 3.43Å; D832-Y834 WeakPolarHBondContact OD1-CB 3.2Å; D832-Y834 PolarHBondContact OD1-N 3.2Å; Y834-K836 PolarHBondContact O-N 2.64Å
835	A	34.2	Very low	30	Very low	79 Å²	79	140.4 Å²	140.4	65%	0.653	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-69.8	-14.8	176.3	0	0	0	0	0	114.2	D832 P833 C837	D832-A835 WeakPolarHBondContact O-CB 3.49Å; D832-A835 PolarHBondContact O-N 3.04Å; P833-A835 VanDerWaalsContact C-N 3.28Å; P833-A835 PolarHBondContact O-N 3.04Å; A835-C837 VanDerWaalsContact C-N 3.34Å; A835-C837 PolarHBondContact O-N 3.16Å
836	K	27.9	Very low	29.8	Very low	156 Å²	156	140.9 Å²	140.9	68%	0.678	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-85.1	5.4	-174	-77.2	165.5	-179.4	150.2	0	114.9	E831 Y834 F838	E831-K836 IonicContact OE2-NZ 2.81Å; E831-K836 PolarHBondContact OE2-NZ 3.27Å; Y834-K836 PolarHBondContact O-N 2.64Å; K836-F838 PolarHBondContact O-N 2.76Å; K836-F838 VanDerWaalsContact O-N 3.1Å
837	C	26	Very low	29.6	Very low	99 Å²	99	140 Å²	140	67%	0.669	74%	0.743	S	S	*	*	S	Bend	trans	-79.4	88.1	175.1	-70.3	0	0	0	0	113.3	A835	A835-C837 VanDerWaalsContact C-N 3.34Å; A835-C837 PolarHBondContact O-N 3.16Å
838	F	29.3	Very low	29.5	Very low	189 Å²	189	140.3 Å²	140.3	83%	0.829	74%	0.738	S	S	*	*			trans	68.8	131.6	173.8	-89.5	-95.5	0	0	0	117.5	K836	K836-F838 PolarHBondContact O-N 2.76Å; K836-F838 VanDerWaalsContact O-N 3.1Å
839	P	29.4	Very low	29.4	Very low	101 Å²	101	143.3 Å²	143.3	66%	0.656	74%	0.743	S	S	*	*			trans	-76.5	127.6	171.3	32.5	-33.2	0	0	0	110.5	S841	P839-S841 PolarHBondContact O-N 3.49Å
840	C	26.6	Very low	29.2	Very low	113 Å²	113	141.1 Å²	141.1	76%	0.764	73%	0.73	S	S	*	*			trans	-77.8	42	165.1	-69.8	0	0	0	0	111.6	F842	C840-F842 VanDerWaalsContact C-N 3.31Å; C840-F842 PolarHBondContact O-N 3.23Å
841	S	25.1	Very low	29.1	Very low	88 Å²	88	137.8 Å²	137.8	62%	0.615	72%	0.723	S	S	*	*			trans	-84.8	69.6	-178.7	59.8	0	0	0	0	111.2	P839	P839-S841 PolarHBondContact O-N 3.49Å
842	F	27.8	Very low	29	Very low	214 Å²	214	137.4 Å²	137.4	94%	0.939	73%	0.728	S	S	*	*			trans	-141.1	56.6	166.2	-113.4	-69.8	0	0	0	110	C840	C840-F842 VanDerWaalsContact C-N 3.31Å; C840-F842 PolarHBondContact O-N 3.23Å
843	Q	26.7	Very low	28.7	Very low	250 Å²	250	141.8 Å²	141.8	100%	1.168	75%	0.751	S	S	*	*			trans	-154.2	0	167.7	-165.8	163.6	2.9	0	0	109.3

Retrieved 843 of 843 residues in 222.5 ms (Link to these results)

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