A0A5K4F280_SCHMA Loading...

DUF4042 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F280, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,355 aa.

						>A0A5K4F280_SCHMA|A0A5K4F280
MDPGVSQLAIECQHISNVKKELEFLSRLLTHATSFNSMEINTLNSNVSETSGMKTFFRILSRICRDCGGIWTVNEDLDWLVFYLFTRCYGWSDIDLNDVRSQMLAPSTGHRYRNVSKDEELRMKDKVIQTTTEIIYLIRSLPLSLAGLKMLISSMNLARGMHHTRKQIALHAVDWLTFGLQTDGGGVKATASPRFTQKSSTTQPFLPEDSTPESMFMTVKDLIWNCCTDNNRSIRMGTLGPLYSLFGQLSTNTIIRLIKLSVEILEKPEVCASEVTEGVIDILNVLLRRLVPSEQLYDSRTSLSGNTLMSKTNLSACKFSAEYVQNQLFPRLSTMITNLFQSNHFIVRKAAVRVYLTCLSRCSNDTFKEVLLQTVTDLCMNADKQSETYQDNSPSNFESWKSNPYFNESLLTLCRSLIKKVGETSLPSNTGDLQNCLVNFYLGHSSQYVRNSACSLYLTLFISASKNPNRIRYLLNKILEKWQVKQDVVLSPLSKLLFQINETETTTPREMPSPVRSKLSWTWREGRMRMYYLVARSLVRLHLKVLHELDADGCSPITSEDSCISPTFTDDYSQRTLCTSSNNNLLQFGFSPVPKSNPPVLFSNPDRRAPVNKSSASSQPVESSPTFFQQGGKLSSRQKSIYLTVLENIRVLDNERKDKQPVSKTQSWIKRLSIVSGLTSTSKTNVGHLELNSISMKSMLFSILRLAVECTLDENDGLRHSAQKTINDVGRLIRWYDADLLLEMITLHMVDPPTMMSYATLKLLRDGLSELCMYDEILQKEEEEPGFTEKYAIFRTVPILNVALLYGLFSPDISRMWLQCCQQYILDSTTALFISTLSIECALRTLCLVHRLSNLSLVACTWENMRPNPFSNLPYSQRKLDLDANDVVECIKGVVEFAQRIDVKLGPTNEPILNVADFHKMMITQKPYLSCLQPPQSTAKCSLTYFVFKLVTKLESVLYSYLPPSVNSNRPNPDVRITGGLILSPILPYLITWPLALLPPSLDKTLENPSKEARILAVRKLLRLFAAIILALPITNKPEFSKNESTAMKDNALLKELASIAQHSVELETVVSACFAQLENLVSQLNQYYEPTRICTTTSWWWIRALCEHLPRLMQIAPFANPINILRLLIKDVRNKSILPTNTKQNTGHQTVEPTKWTRALEYGLQEAKSKMQVKGSSGTLKYQWPKVGEILKAKETIEKQYILESKGGIKPLSSNIVDTDPSPMDEEQHRFFVTSDNEEEEVCILQEELYNSSSSDNDDEEVQEQESKDNLIPKQERVHSLFYIPIKAEPIVTPPALEDVLELTERVLQYCRPGTVTAVRQILSDFDSPNPSSLEKSIRIQESVLGHTKAPVIQ
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.6	Very low	58.3	Low	209 Å²	209	66.5 Å²	66.5	100%	1.03	36%	0.364	S	S	*	.				0	129	0	-70.3	-174.9	-171.4	0	0	106.2	P3	M1-P3 VanDerWaalsContact O-CD 3.25Å; M1-P3 WeakPolarHBondContact O-CD 3.26Å
2	D	52.7	Low	59.1	Low	89 Å²	89	61.1 Å²	61.1	48%	0.476	34%	0.335	S	S	.	.			trans	-82.6	107.8	169.4	-158.7	-4.9	0	0	0	106.1	G4 V5	D2-G4 PolarHBondContact O-N 2.83Å; D2-V5 HydrophobicContact CB-CG2 4.2Å; D2-V5 PolarHBondContact O-N 3.32Å
3	P	57.7	Low	59.7	Low	93 Å²	93	60.2 Å²	60.2	60%	0.604	33%	0.326	S	S	*	.	H	α-helix	trans	-56.4	-24.7	-171.4	19.2	-30.3	0	0	0	112.9	M1 V5 Q7	M1-P3 VanDerWaalsContact O-CD 3.25Å; M1-P3 WeakPolarHBondContact O-CD 3.26Å; P3-V5 PolarHBondContact O-N 2.87Å; P3-Q7 WeakPolarHBondContact O-CB 3.46Å; P3-Q7 PolarHBondContact O-N 2.8Å
4	G	58.7	Low	60.3	Low	24 Å²	24	64.6 Å²	64.6	25%	0.247	34%	0.344	C	S	.	.	H	α-helix	trans	-64	-33.6	174.6	0	0	0	0	0	114.6	D2 L8	D2-G4 PolarHBondContact O-N 2.83Å; G4-L8 PolarHBondContact O-N 3.11Å; G4-L8 VanDerWaalsContact O-N 3.11Å
5	V	54.3	Low	61.3	Low	20 Å²	20	61.3 Å²	61.3	12%	0.121	33%	0.326	C	S	.	.	H	α-helix	trans	-77.6	-41.1	-175.7	174.8	0	0	0	0	112	D2 P3 Q7 L8 A9 I63	D2-V5 HydrophobicContact CB-CG2 4.2Å; D2-V5 PolarHBondContact O-N 3.32Å; P3-V5 PolarHBondContact O-N 2.87Å; V5-Q7 PolarHBondContact O-N 2.91Å; V5-L8 PolarHBondContact O-N 3.19Å; V5-A9 PolarHBondContact O-N 3.46Å; V5-I63 HydrophobicContact CG1-CB 4.09Å; V5-I63 HydrophobicContact CG1-CD1 3.86Å; V5-I63 HydrophobicContact CG1-CG1 3.57Å; V5-I63 HydrophobicContact CG1-CG2 4.28Å
6	S	57.4	Low	62.1	Low	35 Å²	35	61.9 Å²	61.9	25%	0.245	34%	0.337	C	S	.	.	H	α-helix	trans	-68.3	-25.6	174.1	-59.1	0	0	0	0	112.4	A9 I10	S6-A9 WeakPolarHBondContact O-CB 3.34Å; S6-I10 WeakPolarHBondContact O-CD1 3.26Å; S6-I10 WeakPolarHBondContact O-CG1 3.24Å; S6-I10 PolarHBondContact O-N 3.11Å
7	Q	65.2	Low	63	Low	105 Å²	105	61.1 Å²	61.1	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-77.4	-40.4	175.7	-168.3	149.8	-2	0	0	112.3	P3 V5 A9 I10 E11	P3-Q7 WeakPolarHBondContact O-CB 3.46Å; P3-Q7 PolarHBondContact O-N 2.8Å; V5-Q7 PolarHBondContact O-N 2.91Å; Q7-A9 VanDerWaalsContact C-N 3.29Å; Q7-A9 PolarHBondContact O-N 3.33Å; Q7-I10 PolarHBondContact O-N 2.69Å; Q7-E11 WeakPolarHBondContact O-CB 3.44Å; Q7-E11 WeakPolarHBondContact O-CG 3.42Å; Q7-E11 PolarHBondContact O-N 2.92Å
8	L	64.2	Low	63.9	Low	3 Å²	3	57.7 Å²	57.7	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-56.3	-42	171.4	-99.5	158.3	0	0	0	112.8	G4 V5 E11 C12 F24 R27 H31	G4-L8 PolarHBondContact O-N 3.11Å; G4-L8 VanDerWaalsContact O-N 3.11Å; V5-L8 PolarHBondContact O-N 3.19Å; L8-E11 PolarHBondContact O-N 3.24Å; L8-C12 PolarHBondContact O-N 3.34Å; L8-F24 HydrophobicContact CD2-CD2 3.62Å; L8-F24 HydrophobicContact CD2-CE2 3.75Å; L8-R27 HydrophobicContact CD1-CB 4.34Å; L8-R27 HydrophobicContact CD2-CB 3.86Å; L8-R27 HydrophobicContact CG-CB 4.21Å; L8-H31 WeakPolarHBondContact CD1-CD2 3.34Å
9	A	58.1	Low	64.9	Low	3 Å²	3	61.5 Å²	61.5	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-56.8	-47.4	176	0	0	0	0	0	113.7	V5 S6 Q7 I63 C67	V5-A9 PolarHBondContact O-N 3.46Å; S6-A9 WeakPolarHBondContact O-CB 3.34Å; Q7-A9 VanDerWaalsContact C-N 3.29Å; Q7-A9 PolarHBondContact O-N 3.33Å; A9-I63 HydrophobicContact CB-CG2 4.23Å; A9-C67 HydrophobicContact CB-CB 4.36Å; A9-C67 WeakPolarHBondContact CB-SG 3.21Å
10	I	65.4	Low	65.7	Low	103 Å²	103	63.4 Å²	63.4	53%	0.528	33%	0.332	S	S	.	.	H	α-helix	trans	-72.7	-39.3	179.5	-64.7	166.6	0	0	0	110.4	S6 Q7 C12 Q13 H14	S6-I10 WeakPolarHBondContact O-CD1 3.26Å; S6-I10 WeakPolarHBondContact O-CG1 3.24Å; S6-I10 PolarHBondContact O-N 3.11Å; Q7-I10 PolarHBondContact O-N 2.69Å; I10-C12 VanDerWaalsContact C-N 3.3Å; I10-C12 PolarHBondContact O-N 3.47Å; I10-Q13 PolarHBondContact O-N 2.97Å; I10-H14 PolarHBondContact O-CD2 3.06Å
11	E	67.6	Low	66.5	Low	47 Å²	47	60.3 Å²	60.3	22%	0.22	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-37.3	178.4	-78	173.1	-177.9	0	0	112.4	Q7 L8 Q13 H14 I15 R27	Q7-E11 WeakPolarHBondContact O-CB 3.44Å; Q7-E11 WeakPolarHBondContact O-CG 3.42Å; Q7-E11 PolarHBondContact O-N 2.92Å; L8-E11 PolarHBondContact O-N 3.24Å; E11-Q13 PolarHBondContact O-N 2.88Å; E11-H14 PolarHBondContact O-N 3.37Å; E11-H14 VanDerWaalsContact O-N 3.15Å; E11-I15 VanDerWaalsContact O-CG1 3.23Å; E11-I15 WeakPolarHBondContact O-CG1 3.37Å; E11-R27 IonicContact OE1-CZ 3.74Å; E11-R27 IonicContact OE1-NH1 3.07Å; E11-R27 PolarHBondContact OE1-NH1 3.32Å; E11-R27 IonicContact OE1-NH2 2.8Å; E11-R27 IonicContact OE2-CZ 2.66Å; E11-R27 IonicContact OE2-NE 3.45Å; E11-R27 IonicContact OE2-NH1 3.23Å; E11-R27 PolarHBondContact OE2-NH1 3.1Å
12	C	68.6	Low	68.6	Low	2 Å²	2	51.8 Å²	51.8	1%	0.014	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-28.8	177.2	-169.3	0	0	0	0	113.4	L8 I10 F24 W71 S107	L8-C12 PolarHBondContact O-N 3.34Å; I10-C12 VanDerWaalsContact C-N 3.3Å; I10-C12 PolarHBondContact O-N 3.47Å; C12-F24 HydrophobicContact CB-CD2 4.23Å; C12-F24 HydrophobicContact CB-CE2 3.73Å; C12-F24 HydrophobicContact CB-CZ 4.22Å; C12-W71 HydrophobicContact CB-CZ2 4.49Å; C12-S107 WeakPolarHBondContact O-CB 3.26Å
13	Q	66	Low	70	Confident	49 Å²	49	51.8 Å²	51.8	23%	0.229	27%	0.271	C	S	.	.	H	α-helix	trans	-83.8	-16.1	-179.1	-64.7	175.1	19.9	0	0	113.4	I10 E11	I10-Q13 PolarHBondContact O-N 2.97Å; E11-Q13 PolarHBondContact O-N 2.88Å
14	H	68.9	Low	71.2	Confident	123 Å²	123	47.6 Å²	47.6	57%	0.569	24%	0.244	S	C	*	.			trans	-123.6	31.3	-172.3	-62.5	-54.8	0	0	0	113.1	I10 E11 S16	I10-H14 PolarHBondContact O-CD2 3.06Å; E11-H14 PolarHBondContact O-N 3.37Å; E11-H14 VanDerWaalsContact O-N 3.15Å; H14-S16 PolarHBondContact O-N 3.21Å
15	I	74.7	Confident	72.4	Confident	14 Å²	14	46.5 Å²	46.5	7%	0.072	23%	0.232	C	C	.	.			trans	-74.3	94.7	176.3	-57.9	-177	0	0	0	109.7	E11 K20 E21 F24 P106	E11-I15 VanDerWaalsContact O-CG1 3.23Å; E11-I15 WeakPolarHBondContact O-CG1 3.37Å; I15-K20 HydrophobicContact CG2-CB 4.48Å; I15-E21 HydrophobicContact CG2-CB 3.79Å; I15-F24 HydrophobicContact CD1-CB 4.03Å; I15-F24 HydrophobicContact CD1-CD1 4.03Å; I15-F24 HydrophobicContact CD1-CG 3.97Å; I15-P106 HydrophobicContact CD1-CG 3.39Å
16	S	73.9	Confident	73.8	Confident	72 Å²	72	47.5 Å²	47.5	50%	0.503	24%	0.24	S	C	.	.			trans	-90.5	-17	-179.2	62.6	0	0	0	0	114	H14 K20	H14-S16 PolarHBondContact O-N 3.21Å; S16-K20 PolarHBondContact OG-NZ 2.94Å
17	N	77.5	Confident	74.8	Confident	47 Å²	47	49.5 Å²	49.5	25%	0.251	24%	0.242	S	C	.	.	S	Bend	trans	-154.9	169.9	-177.6	65	27.3	0	0	0	112.7	K19 K20 E21	N17-K19 VanDerWaalsContact C-N 3.28Å; N17-K19 PolarHBondContact O-N 3.46Å; N17-K19 PolarHBondContact OD1-N 2.9Å; N17-K20 PolarHBondContact O-N 3.34Å; N17-K20 WeakPolarHBondContact OD1-CB 3.47Å; N17-K20 WeakPolarHBondContact OD1-CG 3.23Å; N17-K20 PolarHBondContact OD1-N 3.48Å; N17-E21 PolarHBondContact O-N 3.43Å
18	V	80.5	Confident	75.3	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-63.3	-30.5	-178	-170	0	0	0	0	113	E21 L22 E119 E120 M123 V127	V18-E21 WeakPolarHBondContact O-CB 3.44Å; V18-E21 PolarHBondContact O-N 2.98Å; V18-L22 WeakPolarHBondContact O-CB 2.77Å; V18-L22 PolarHBondContact O-N 3.02Å; V18-E119 HydrophobicContact CG2-CG 4.42Å; V18-E120 HydrophobicContact CG2-CG 4.14Å; V18-E120 WeakPolarHBondContact CG2-OE1 3.31Å; V18-E120 WeakPolarHBondContact CG2-OE2 3.23Å; V18-M123 HydrophobicContact CB-CB 4.44Å; V18-M123 HydrophobicContact CG1-CB 3.52Å; V18-M123 HydrophobicContact CG1-CG 4.15Å; V18-V127 HydrophobicContact CG1-CG2 3.87Å
19	K	81.1	Confident	76	Confident	130 Å²	130	46.1 Å²	46.1	57%	0.565	23%	0.227	S	C	*	.	H	α-helix	trans	-67.6	-45.1	179.6	-68.2	-178.6	-175.1	176.3	0	111.4	N17 E21 L22 E23 E119	N17-K19 VanDerWaalsContact C-N 3.28Å; N17-K19 PolarHBondContact O-N 3.46Å; N17-K19 PolarHBondContact OD1-N 2.9Å; K19-E21 VanDerWaalsContact C-N 3.32Å; K19-L22 PolarHBondContact O-N 2.92Å; K19-E23 PolarHBondContact O-N 3.16Å; K19-E119 WeakPolarHBondContact CE-OE1 3.49Å
20	K	80.9	Confident	76.8	Confident	98 Å²	98	50 Å²	50	43%	0.426	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-36.3	173.2	-71.7	-178.4	177.8	179.6	0	111.7	I15 S16 N17 L22 E23 F24	I15-K20 HydrophobicContact CG2-CB 4.48Å; S16-K20 PolarHBondContact OG-NZ 2.94Å; N17-K20 PolarHBondContact O-N 3.34Å; N17-K20 WeakPolarHBondContact OD1-CB 3.47Å; N17-K20 WeakPolarHBondContact OD1-CG 3.23Å; N17-K20 PolarHBondContact OD1-N 3.48Å; K20-L22 VanDerWaalsContact C-N 3.35Å; K20-E23 PolarHBondContact O-N 3.11Å; K20-F24 WeakPolarHBondContact O-CB 3.31Å; K20-F24 PolarHBondContact O-N 3.42Å
21	E	83.7	Confident	76.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.7	-47.9	172.6	-174.1	-173.1	-171.6	0	0	110.9	I15 N17 V18 K19 F24 L25 Y83 R87 R113	I15-E21 HydrophobicContact CG2-CB 3.79Å; N17-E21 PolarHBondContact O-N 3.43Å; V18-E21 WeakPolarHBondContact O-CB 3.44Å; V18-E21 PolarHBondContact O-N 2.98Å; K19-E21 VanDerWaalsContact C-N 3.32Å; E21-F24 WeakPolarHBondContact O-CB 3.19Å; E21-F24 PolarHBondContact O-N 3.42Å; E21-L25 HydrophobicContact CG-CD1 4.2Å; E21-L25 WeakPolarHBondContact O-CG 3.41Å; E21-L25 PolarHBondContact O-N 2.69Å; E21-Y83 WeakPolarHBondContact CG-OH 3.49Å; E21-Y83 PolarHBondContact OE1-OH 3.32Å; E21-R87 IonicContact OE1-CZ 3.92Å; E21-R87 IonicContact OE1-NE 2.66Å; E21-R87 PolarHBondContact OE1-NE 3.25Å; E21-R87 IonicContact OE1-NH2 2.71Å; E21-R87 IonicContact OE2-NH2 3.44Å; E21-R87 PolarHBondContact OE2-NH2 2.7Å; E21-R113 IonicContact OE2-CZ 3Å; E21-R113 IonicContact OE2-NE 3.83Å; E21-R113 IonicContact OE2-NH2 2.93Å; E21-R113 PolarHBondContact OE2-NH2 3.28Å
22	L	82.6	Confident	76.9	Confident	29 Å²	29	45.3 Å²	45.3	15%	0.152	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-36.1	-179	-158.3	122.6	0	0	0	112.2	V18 K19 K20 L25 S26 M123 K126 V127	V18-L22 WeakPolarHBondContact O-CB 2.77Å; V18-L22 PolarHBondContact O-N 3.02Å; K19-L22 PolarHBondContact O-N 2.92Å; K20-L22 VanDerWaalsContact C-N 3.35Å; L22-L25 PolarHBondContact O-N 2.86Å; L22-S26 VanDerWaalsContact O-CB 3.24Å; L22-S26 WeakPolarHBondContact O-CB 3.49Å; L22-S26 PolarHBondContact O-N 3.43Å; L22-S26 PolarHBondContact O-OG 3.37Å; L22-M123 HydrophobicContact CD1-CE 4.21Å; L22-K126 HydrophobicContact CD1-CB 3.51Å; L22-V127 HydrophobicContact CD1-CG2 3.81Å
23	E	82.9	Confident	76.8	Confident	89 Å²	89	48.3 Å²	48.3	42%	0.416	25%	0.247	S	C	.	.	H	α-helix	trans	-62.2	-46	172.7	-175.7	172.2	-166.7	0	0	111.3	K19 K20 S26 R27	K19-E23 PolarHBondContact O-N 3.16Å; K20-E23 PolarHBondContact O-N 3.11Å; E23-S26 PolarHBondContact O-N 3.3Å; E23-R27 WeakPolarHBondContact O-CB 3.2Å; E23-R27 VanDerWaalsContact O-CG 3.26Å; E23-R27 WeakPolarHBondContact O-CG 3.41Å; E23-R27 PolarHBondContact O-N 2.84Å; E23-R27 IonicContact OE1-CZ 3.2Å; E23-R27 IonicContact OE1-NE 3.87Å; E23-R27 IonicContact OE1-NH2 3.25Å; E23-R27 PolarHBondContact OE1-NH2 2.82Å
24	F	83.9	Confident	76.6	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-51.4	173.6	167.7	-99.6	0	0	0	111.6	L8 C12 I15 K20 E21 S26 R27 L28 P106	L8-F24 HydrophobicContact CD2-CD2 3.62Å; L8-F24 HydrophobicContact CD2-CE2 3.75Å; C12-F24 HydrophobicContact CB-CD2 4.23Å; C12-F24 HydrophobicContact CB-CE2 3.73Å; C12-F24 HydrophobicContact CB-CZ 4.22Å; I15-F24 HydrophobicContact CD1-CB 4.03Å; I15-F24 HydrophobicContact CD1-CD1 4.03Å; I15-F24 HydrophobicContact CD1-CG 3.97Å; K20-F24 WeakPolarHBondContact O-CB 3.31Å; K20-F24 PolarHBondContact O-N 3.42Å; E21-F24 WeakPolarHBondContact O-CB 3.19Å; E21-F24 PolarHBondContact O-N 3.42Å; F24-S26 VanDerWaalsContact C-N 3.35Å; F24-S26 PolarHBondContact O-N 3.41Å; F24-R27 PolarHBondContact O-N 2.75Å; F24-L28 HydrophobicContact CE1-CD2 4.39Å; F24-L28 HydrophobicContact CZ-CD2 4.4Å; F24-L28 WeakPolarHBondContact O-CB 3.41Å; F24-L28 PolarHBondContact O-N 3.04Å; F24-P106 HydrophobicContact CD1-CG 4.15Å; F24-P106 HydrophobicContact CE1-CB 3.97Å; F24-P106 HydrophobicContact CE1-CG 3.84Å; F24-P106 HydrophobicContact CZ-CB 4.45Å; F24-P106 HydrophobicContact CZ-CG 4.45Å
25	L	83.6	Confident	75.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-40.3	179.6	-71.4	172.9	0	0	0	112.2	E21 L22 L28 L29 Y83 L84 V127 T130 T131 I134	E21-L25 HydrophobicContact CG-CD1 4.2Å; E21-L25 WeakPolarHBondContact O-CG 3.41Å; E21-L25 PolarHBondContact O-N 2.69Å; L22-L25 PolarHBondContact O-N 2.86Å; L25-L28 PolarHBondContact O-N 3.31Å; L25-L29 WeakPolarHBondContact O-CB 3.39Å; L25-L29 PolarHBondContact O-N 3.19Å; L25-Y83 HydrophobicContact CD2-CE1 4.19Å; L25-L84 HydrophobicContact CD2-CD2 3.81Å; L25-V127 HydrophobicContact CD1-CG1 4.3Å; L25-T130 HydrophobicContact CB-CG2 3.77Å; L25-T131 HydrophobicContact CD1-CG2 3.73Å; L25-T131 HydrophobicContact CD2-CG2 4.18Å; L25-I134 HydrophobicContact CB-CD1 4.39Å; L25-I134 HydrophobicContact CD2-CD1 3.9Å
26	S	83.1	Confident	74.7	Confident	41 Å²	41	48.9 Å²	48.9	29%	0.287	26%	0.256	S	S	.	.	H	α-helix	trans	-66.9	-40.6	178.3	-57.1	0	0	0	0	111.4	L22 E23 F24 L29 T30	L22-S26 VanDerWaalsContact O-CB 3.24Å; L22-S26 WeakPolarHBondContact O-CB 3.49Å; L22-S26 PolarHBondContact O-N 3.43Å; L22-S26 PolarHBondContact O-OG 3.37Å; E23-S26 PolarHBondContact O-N 3.3Å; F24-S26 VanDerWaalsContact C-N 3.35Å; F24-S26 PolarHBondContact O-N 3.41Å; S26-L29 PolarHBondContact O-N 3.28Å; S26-T30 WeakPolarHBondContact O-CB 3.44Å; S26-T30 PolarHBondContact O-N 3.36Å; S26-T30 PolarHBondContact O-OG1 3.48Å
27	R	77.7	Confident	73.3	Confident	78 Å²	78	48.4 Å²	48.4	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-66.4	-43.3	174.5	-73.7	176.2	-177.5	-161.5	5.7	111.3	L8 E11 E23 F24 L29 T30 H31	L8-R27 HydrophobicContact CD1-CB 4.34Å; L8-R27 HydrophobicContact CD2-CB 3.86Å; L8-R27 HydrophobicContact CG-CB 4.21Å; E11-R27 IonicContact OE1-CZ 3.74Å; E11-R27 IonicContact OE1-NH1 3.07Å; E11-R27 PolarHBondContact OE1-NH1 3.32Å; E11-R27 IonicContact OE1-NH2 2.8Å; E11-R27 IonicContact OE2-CZ 2.66Å; E11-R27 IonicContact OE2-NE 3.45Å; E11-R27 IonicContact OE2-NH1 3.23Å; E11-R27 PolarHBondContact OE2-NH1 3.1Å; E23-R27 WeakPolarHBondContact O-CB 3.2Å; E23-R27 VanDerWaalsContact O-CG 3.26Å; E23-R27 WeakPolarHBondContact O-CG 3.41Å; E23-R27 PolarHBondContact O-N 2.84Å; E23-R27 IonicContact OE1-CZ 3.2Å; E23-R27 IonicContact OE1-NE 3.87Å; E23-R27 IonicContact OE1-NH2 3.25Å; E23-R27 PolarHBondContact OE1-NH2 2.82Å; F24-R27 PolarHBondContact O-N 2.75Å; R27-L29 VanDerWaalsContact C-N 3.32Å; R27-L29 PolarHBondContact O-N 3.14Å; R27-T30 PolarHBondContact O-N 3.28Å; R27-H31 WeakPolarHBondContact O-CB 3.24Å; R27-H31 PolarHBondContact O-CD2 3.17Å; R27-H31 VanDerWaalsContact O-CD2 3.28Å; R27-H31 PolarHBondContact O-N 2.99Å
28	L	76.6	Confident	71.7	Confident	14 Å²	14	52.3 Å²	52.3	7%	0.073	27%	0.271	C	S	.	.	H	α-helix	trans	-57.7	-46.3	174.9	-176.2	66.1	0	0	0	110.9	F24 L25 H31 A32 I134	F24-L28 HydrophobicContact CE1-CD2 4.39Å; F24-L28 HydrophobicContact CZ-CD2 4.4Å; F24-L28 WeakPolarHBondContact O-CB 3.41Å; F24-L28 PolarHBondContact O-N 3.04Å; L25-L28 PolarHBondContact O-N 3.31Å; L28-H31 PolarHBondContact O-N 3.25Å; L28-A32 WeakPolarHBondContact O-CB 3.26Å; L28-A32 PolarHBondContact O-N 3.1Å; L28-I134 HydrophobicContact CD2-CD1 4.27Å
29	L	78.5	Confident	70	Confident	22 Å²	22	55 Å²	55	12%	0.115	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-41.8	175.8	179.8	65.9	0	0	0	112.6	L25 S26 R27 A32 T33 T130 E133 I134	L25-L29 WeakPolarHBondContact O-CB 3.39Å; L25-L29 PolarHBondContact O-N 3.19Å; S26-L29 PolarHBondContact O-N 3.28Å; R27-L29 VanDerWaalsContact C-N 3.32Å; R27-L29 PolarHBondContact O-N 3.14Å; L29-A32 WeakPolarHBondContact O-CB 3.44Å; L29-A32 PolarHBondContact O-N 2.96Å; L29-T33 HydrophobicContact CD1-CG2 4Å; L29-T33 HydrophobicContact CG-CG2 4.37Å; L29-T33 WeakPolarHBondContact O-CB 3.37Å; L29-T33 WeakPolarHBondContact O-CG2 3.42Å; L29-T33 PolarHBondContact O-N 3.01Å; L29-T33 PolarHBondContact O-OG1 3.44Å; L29-T130 HydrophobicContact CD2-CG2 4.23Å; L29-E133 HydrophobicContact CD1-CB 4.1Å; L29-E133 HydrophobicContact CD2-CB 4.05Å; L29-E133 WeakPolarHBondContact CD2-OE2 3.34Å; L29-I134 HydrophobicContact CB-CD1 4.42Å; L29-I134 HydrophobicContact CB-CG1 4.05Å; L29-I134 HydrophobicContact CD1-CG1 3.97Å
30	T	75	Confident	68.2	Low	84 Å²	84	54.5 Å²	54.5	52%	0.515	29%	0.286	S	S	.	.	H	α-helix	trans	-64.6	-41.6	178.5	-54.8	0	0	0	0	111	S26 R27 T33 S34	S26-T30 WeakPolarHBondContact O-CB 3.44Å; S26-T30 PolarHBondContact O-N 3.36Å; S26-T30 PolarHBondContact O-OG1 3.48Å; R27-T30 PolarHBondContact O-N 3.28Å; T30-T33 WeakPolarHBondContact CA-OG1 3.49Å; T30-T33 PolarHBondContact O-N 3.29Å; T30-T33 PolarHBondContact O-OG1 3.39Å; T30-S34 VanDerWaalsContact O-CB 3.25Å; T30-S34 WeakPolarHBondContact O-CB 3.37Å; T30-S34 PolarHBondContact O-N 2.96Å; T30-S34 PolarHBondContact O-OG 2.79Å
31	H	68.5	Low	66.2	Low	44 Å²	44	56 Å²	56	20%	0.204	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-37.5	173.9	-86.2	-76.9	0	0	0	112.1	L8 R27 L28 S34	L8-H31 WeakPolarHBondContact CD1-CD2 3.34Å; R27-H31 WeakPolarHBondContact O-CB 3.24Å; R27-H31 PolarHBondContact O-CD2 3.17Å; R27-H31 VanDerWaalsContact O-CD2 3.28Å; R27-H31 PolarHBondContact O-N 2.99Å; L28-H31 PolarHBondContact O-N 3.25Å; H31-S34 PolarHBondContact O-OG 3.21Å
32	A	65.8	Low	64.1	Low	9 Å²	9	60 Å²	60	7%	0.074	32%	0.323	C	S	.	.	H	α-helix	trans	-66.1	-41.6	175.8	0	0	0	0	0	112.9	L28 L29 F56 L137	L28-A32 WeakPolarHBondContact O-CB 3.26Å; L28-A32 PolarHBondContact O-N 3.1Å; L29-A32 WeakPolarHBondContact O-CB 3.44Å; L29-A32 PolarHBondContact O-N 2.96Å; A32-F56 HydrophobicContact CB-CD2 4.34Å; A32-F56 HydrophobicContact CB-CE2 3.58Å; A32-F56 HydrophobicContact CB-CZ 4.43Å; A32-L137 HydrophobicContact CB-CD1 3.94Å; A32-L137 HydrophobicContact CB-CD2 3.96Å
33	T	67	Low	62	Low	65 Å²	65	64.7 Å²	64.7	40%	0.399	35%	0.348	S	S	.	.	H	α-helix	trans	-81.8	-37.7	-175.2	49.5	0	0	0	0	113.5	L29 T30 F35 N36 S37 L137	L29-T33 HydrophobicContact CD1-CG2 4Å; L29-T33 HydrophobicContact CG-CG2 4.37Å; L29-T33 WeakPolarHBondContact O-CB 3.37Å; L29-T33 WeakPolarHBondContact O-CG2 3.42Å; L29-T33 PolarHBondContact O-N 3.01Å; L29-T33 PolarHBondContact O-OG1 3.44Å; T30-T33 WeakPolarHBondContact CA-OG1 3.49Å; T30-T33 PolarHBondContact O-N 3.29Å; T30-T33 PolarHBondContact O-OG1 3.39Å; T33-F35 VanDerWaalsContact C-N 3.29Å; T33-F35 PolarHBondContact O-N 3Å; T33-N36 PolarHBondContact O-N 3.02Å; T33-S37 PolarHBondContact O-N 3.12Å; T33-L137 HydrophobicContact CG2-CD1 3.81Å
34	S	61.3	Low	59.8	Low	51 Å²	51	68.1 Å²	68.1	36%	0.357	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-38.5	177.2	52.4	0	0	0	0	112.2	T30 H31 S37 M38	T30-S34 VanDerWaalsContact O-CB 3.25Å; T30-S34 WeakPolarHBondContact O-CB 3.37Å; T30-S34 PolarHBondContact O-N 2.96Å; T30-S34 PolarHBondContact O-OG 2.79Å; H31-S34 PolarHBondContact O-OG 3.21Å; S34-S37 PolarHBondContact O-N 2.86Å; S34-S37 PolarHBondContact O-OG 3.44Å; S34-M38 PolarHBondContact O-N 3.02Å
35	F	53	Low	57.4	Low	75 Å²	75	71.7 Å²	71.7	33%	0.329	40%	0.395	S	S	.	.	H	α-helix	trans	-67.4	-39.7	175.5	-96.8	-90.4	0	0	0	113.4	T33 S37 M38 E39 T55 I59	T33-F35 VanDerWaalsContact C-N 3.29Å; T33-F35 PolarHBondContact O-N 3Å; F35-S37 VanDerWaalsContact C-N 3.27Å; F35-S37 PolarHBondContact O-N 3.35Å; F35-M38 PolarHBondContact O-N 3.33Å; F35-E39 PolarHBondContact O-N 3.06Å; F35-T55 HydrophobicContact CD1-CG2 4.26Å; F35-T55 HydrophobicContact CE1-CG2 4.32Å; F35-I59 HydrophobicContact CD1-CD1 4.03Å; F35-I59 HydrophobicContact CD2-CD1 4.02Å; F35-I59 HydrophobicContact CE1-CD1 4.21Å; F35-I59 HydrophobicContact CE2-CD1 4.19Å; F35-I59 HydrophobicContact CG-CD1 3.93Å; F35-I59 HydrophobicContact CZ-CD1 4.28Å
36	N	50.7	Low	55	Low	71 Å²	71	80 Å²	80	38%	0.38	44%	0.439	S	S	.	.	H	α-helix	trans	-60	-37.5	173.7	-91.5	-6.2	0	0	0	112	T33 I40	T33-N36 PolarHBondContact O-N 3.02Å; N36-I40 WeakPolarHBondContact O-CD1 3.24Å; N36-I40 WeakPolarHBondContact O-CG1 3.32Å; N36-I40 PolarHBondContact O-N 3.46Å
37	S	46.4	Very low	52.5	Low	63 Å²	63	83.9 Å²	83.9	44%	0.441	46%	0.461	S	S	.	.	H	α-helix	trans	-72.2	-29	178	73.5	0	0	0	0	113.6	T33 S34 F35 N41	T33-S37 PolarHBondContact O-N 3.12Å; S34-S37 PolarHBondContact O-N 2.86Å; S34-S37 PolarHBondContact O-OG 3.44Å; F35-S37 VanDerWaalsContact C-N 3.27Å; F35-S37 PolarHBondContact O-N 3.35Å; S37-N41 PolarHBondContact O-N 3Å; S37-N41 PolarHBondContact O-ND2 3.47Å
38	M	43.5	Very low	50.4	Low	128 Å²	128	84.3 Å²	84.3	63%	0.631	48%	0.476	S	S	*	.	H	α-helix	trans	-76.4	-35.8	-178.5	-157.6	167.3	165.9	0	0	111.4	S34 F35 N41 T42	S34-M38 PolarHBondContact O-N 3.02Å; F35-M38 PolarHBondContact O-N 3.33Å; M38-N41 PolarHBondContact O-N 2.99Å; M38-T42 PolarHBondContact O-N 2.78Å; M38-T42 PolarHBondContact O-OG1 3.18Å; M38-T42 VanDerWaalsContact O-OG1 3.08Å
39	E	43.7	Very low	48.4	Very low	57 Å²	57	93 Å²	93	27%	0.266	52%	0.516	S	S	.	.	H	α-helix	trans	-67.7	-40.3	174	-79.7	-174.8	173.8	0	0	112.9	F35 N41 T42 L43 G52	F35-E39 PolarHBondContact O-N 3.06Å; E39-N41 VanDerWaalsContact C-N 3.27Å; E39-N41 PolarHBondContact O-N 2.95Å; E39-T42 WeakPolarHBondContact CA-OG1 3.06Å; E39-T42 PolarHBondContact O-N 2.87Å; E39-T42 PolarHBondContact O-OG1 3.48Å; E39-L43 WeakPolarHBondContact O-CD1 3.4Å; E39-L43 PolarHBondContact O-N 3.45Å; E39-G52 WeakPolarHBondContact OE1-CA 3.29Å; E39-G52 WeakPolarHBondContact OE2-CA 3.34Å
40	I	44.6	Very low	46.6	Very low	120 Å²	120	96.3 Å²	96.3	62%	0.615	54%	0.537	S	S	*	.	H	α-helix	trans	-62.3	-34.9	177.1	-64.5	168.1	0	0	0	111.4	N36	N36-I40 WeakPolarHBondContact O-CD1 3.24Å; N36-I40 WeakPolarHBondContact O-CG1 3.32Å; N36-I40 PolarHBondContact O-N 3.46Å
41	N	38	Very low	45	Very low	130 Å²	130	95.8 Å²	95.8	70%	0.695	54%	0.537	S	S	*	.	H	α-helix	trans	-77.6	-24.1	178.2	-75.3	-30.4	0	0	0	113.7	S37 M38 E39	S37-N41 PolarHBondContact O-N 3Å; S37-N41 PolarHBondContact O-ND2 3.47Å; M38-N41 PolarHBondContact O-N 2.99Å; E39-N41 VanDerWaalsContact C-N 3.27Å; E39-N41 PolarHBondContact O-N 2.95Å
42	T	39	Very low	43.9	Very low	85 Å²	85	95.2 Å²	95.2	52%	0.521	54%	0.543	S	S	.	.	H	α-helix	trans	-84.5	-8.3	174.4	44	0	0	0	0	114.4	M38 E39 N44 S45	M38-T42 PolarHBondContact O-N 2.78Å; M38-T42 PolarHBondContact O-OG1 3.18Å; M38-T42 VanDerWaalsContact O-OG1 3.08Å; E39-T42 WeakPolarHBondContact CA-OG1 3.06Å; E39-T42 PolarHBondContact O-N 2.87Å; E39-T42 PolarHBondContact O-OG1 3.48Å; T42-N44 PolarHBondContact O-N 3.45Å; T42-N44 VanDerWaalsContact O-N 3.15Å; T42-S45 PolarHBondContact O-N 3.46Å; T42-S45 PolarHBondContact O-OG 3.37Å
43	L	38.8	Very low	42.8	Very low	126 Å²	126	97.8 Å²	97.8	66%	0.66	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-1.7	178.8	-110	122	0	0	0	114.9	E39	E39-L43 WeakPolarHBondContact O-CD1 3.4Å; E39-L43 PolarHBondContact O-N 3.45Å
44	N	38	Very low	41.7	Very low	162 Å²	162	99 Å²	99	87%	0.866	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	4.8	173.3	-82.4	-21.7	0	0	0	114.5	T42	T42-N44 PolarHBondContact O-N 3.45Å; T42-N44 VanDerWaalsContact O-N 3.15Å
45	S	33.7	Very low	41.2	Very low	81 Å²	81	98.3 Å²	98.3	57%	0.566	55%	0.547	S	S	*	.	S	Bend	trans	-124.9	124.9	171.7	60.9	0	0	0	0	111.2	T42 V47	T42-S45 PolarHBondContact O-N 3.46Å; T42-S45 PolarHBondContact O-OG 3.37Å; S45-V47 VanDerWaalsContact C-N 3.34Å; S45-V47 PolarHBondContact O-N 3.27Å
46	N	31.7	Very low	41.1	Very low	175 Å²	175	96 Å²	96	94%	0.936	54%	0.538	S	S	*	.			trans	-55.5	76	-175.3	-70.2	-25.1	0	0	0	115.2
47	V	31.5	Very low	41.2	Very low	121 Å²	121	94.3 Å²	94.3	73%	0.733	53%	0.527	S	S	*	.			trans	-139	113.2	167.5	-175.1	0	0	0	0	110.1	S45	S45-V47 VanDerWaalsContact C-N 3.34Å; S45-V47 PolarHBondContact O-N 3.27Å
48	S	32.7	Very low	41.4	Very low	88 Å²	88	98.5 Å²	98.5	62%	0.615	53%	0.533	S	S	*	.			trans	15.1	117.8	164.5	59	0	0	0	0	119.6	T50	S48-T50 PolarHBondContact O-N 2.86Å
49	E	35	Very low	41.9	Very low	195 Å²	195	93.9 Å²	93.9	91%	0.911	51%	0.511	S	S	*	.	S	Bend	trans	-63	24.6	177	-66.3	174.8	137.5	0	0	116.8
50	T	40.4	Very low	42.4	Very low	93 Å²	93	91.8 Å²	91.8	57%	0.571	50%	0.501	S	S	*	.			trans	-118	22.1	-163.6	48.1	0	0	0	0	117.2	S48	S48-T50 PolarHBondContact O-N 2.86Å
51	S	42.6	Very low	42.6	Very low	73 Å²	73	88.2 Å²	88.2	51%	0.51	49%	0.487	S	S	.	.			trans	-128.5	-10.4	-178.8	83.5	0	0	0	0	119.6	M53 T55	S51-M53 VanDerWaalsContact C-N 3.3Å; S51-M53 PolarHBondContact O-N 3.39Å; S51-T55 PolarHBondContact O-OG1 3.37Å
52	G	43.6	Very low	43.1	Very low	31 Å²	31	89.4 Å²	89.4	32%	0.32	48%	0.481	S	S	.	.	H	α-helix	trans	-66.3	-30.8	-170.8	0	0	0	0	0	115.6	E39 T55	E39-G52 WeakPolarHBondContact OE1-CA 3.29Å; E39-G52 WeakPolarHBondContact OE2-CA 3.34Å; G52-T55 WeakPolarHBondContact O-CB 3.4Å; G52-T55 PolarHBondContact O-N 3.15Å; G52-T55 PolarHBondContact O-OG1 3.1Å
53	M	42.7	Very low	43.6	Very low	64 Å²	64	85.8 Å²	85.8	32%	0.315	46%	0.459	S	S	.	.	H	α-helix	trans	-80.7	-28.5	-173.1	-156.8	-175	-178.5	0	0	114.3	S51 T55 P142	S51-M53 VanDerWaalsContact C-N 3.3Å; S51-M53 PolarHBondContact O-N 3.39Å; M53-T55 PolarHBondContact O-N 3.22Å; M53-P142 HydrophobicContact CB-CG 4.37Å; M53-P142 VanDerWaalsContact CE-CA 3.5Å; M53-P142 HydrophobicContact CE-CB 3.28Å; M53-P142 HydrophobicContact CE-CG 3.54Å; M53-P142 WeakPolarHBondContact CE-O 3.38Å; M53-P142 HydrophobicContact CG-CB 4.42Å; M53-P142 HydrophobicContact CG-CG 3.72Å; M53-P142 HydrophobicContact SD-CB 3.51Å; M53-P142 VanDerWaalsContact SD-CB 3.51Å; M53-P142 HydrophobicContact SD-CG 3.4Å; M53-P142 WeakPolarHBondContact SD-CG 3.22Å
54	K	45.4	Very low	43.9	Very low	90 Å²	90	80 Å²	80	39%	0.391	43%	0.429	S	S	.	.	H	α-helix	trans	-68.4	-16.7	172.1	-81.1	162.8	-177.5	147.1	0	110.6	R58 E208	K54-R58 WeakPolarHBondContact O-CB 3.18Å; K54-R58 WeakPolarHBondContact O-CD 3.1Å; K54-R58 WeakPolarHBondContact O-CG 3.22Å; K54-R58 PolarHBondContact O-N 3.05Å; K54-R58 VanDerWaalsContact O-N 3.09Å; K54-E208 IonicContact NZ-OE2 2.62Å; K54-E208 PolarHBondContact NZ-OE2 3.02Å
55	T	50.6	Low	44.2	Very low	36 Å²	36	81 Å²	81	22%	0.221	42%	0.421	C	S	.	.	H	α-helix	trans	-83.3	-40.7	-168.6	-33.4	0	0	0	0	113.3	F35 S51 G52 M53 R58 I59	F35-T55 HydrophobicContact CD1-CG2 4.26Å; F35-T55 HydrophobicContact CE1-CG2 4.32Å; S51-T55 PolarHBondContact O-OG1 3.37Å; G52-T55 WeakPolarHBondContact O-CB 3.4Å; G52-T55 PolarHBondContact O-N 3.15Å; G52-T55 PolarHBondContact O-OG1 3.1Å; M53-T55 PolarHBondContact O-N 3.22Å; T55-R58 CarbonylContact O-C 3.58Å; T55-I59 HydrophobicContact CG2-CD1 3.98Å; T55-I59 HydrophobicContact CG2-CG1 4.43Å; T55-I59 WeakPolarHBondContact O-CA 3.16Å; T55-I59 VanDerWaalsContact O-CB 3.25Å; T55-I59 WeakPolarHBondContact O-CB 3.33Å; T55-I59 VanDerWaalsContact O-CD1 3.3Å; T55-I59 WeakPolarHBondContact O-CD1 3.39Å; T55-I59 WeakPolarHBondContact O-CG1 3.37Å; T55-I59 PolarHBondContact O-N 3.28Å
56	F	49.8	Very low	44.8	Very low	28 Å²	28	80.5 Å²	80.5	12%	0.123	41%	0.412	C	S	.	.	H	α-helix	trans	-71.7	-48.6	-178.7	-174.7	-103.2	0	0	0	113.4	A32 I59 L60 L137 L141	A32-F56 HydrophobicContact CB-CD2 4.34Å; A32-F56 HydrophobicContact CB-CE2 3.58Å; A32-F56 HydrophobicContact CB-CZ 4.43Å; F56-I59 WeakPolarHBondContact O-CB 3.3Å; F56-I59 PolarHBondContact O-N 3.34Å; F56-I59 VanDerWaalsContact O-N 3.12Å; F56-L60 HydrophobicContact CD1-CD1 4.01Å; F56-L60 HydrophobicContact CE1-CD1 3.5Å; F56-L60 VanDerWaalsContact CE1-CD1 3.5Å; F56-L60 HydrophobicContact CZ-CD1 3.91Å; F56-L60 PolarHBondContact O-N 3.47Å; F56-L137 HydrophobicContact CD2-CD2 4.34Å; F56-L137 HydrophobicContact CE2-CD2 3.98Å; F56-L137 HydrophobicContact CZ-CD2 4.11Å; F56-L141 HydrophobicContact CB-CD2 4.25Å; F56-L141 HydrophobicContact CD1-CD1 3.66Å; F56-L141 HydrophobicContact CD1-CD2 4.47Å; F56-L141 HydrophobicContact CE1-CD1 4.16Å; F56-L141 HydrophobicContact CG-CD1 4.46Å
57	F	52.5	Low	45.5	Very low	34 Å²	34	72.9 Å²	72.9	15%	0.149	37%	0.371	C	S	.	.	H	α-helix	trans	-67.3	-36	172.4	-78	-70.1	0	0	0	111.5	I59 L60 S61 L77 L141 M150	F57-I59 VanDerWaalsContact C-N 3.3Å; F57-I59 PolarHBondContact O-N 2.91Å; F57-L60 PolarHBondContact O-N 2.88Å; F57-S61 VanDerWaalsContact O-CB 3.27Å; F57-S61 WeakPolarHBondContact O-CB 3.29Å; F57-S61 PolarHBondContact O-N 2.99Å; F57-S61 PolarHBondContact O-OG 3.39Å; F57-L77 HydrophobicContact CD1-CD1 4.46Å; F57-L77 HydrophobicContact CD1-CD2 3.98Å; F57-L77 HydrophobicContact CE1-CD2 3.92Å; F57-L141 HydrophobicContact CE2-CD1 3.89Å; F57-L141 HydrophobicContact CZ-CD1 4.37Å; F57-M150 HydrophobicContact CE1-CE 4.11Å; F57-M150 HydrophobicContact CE1-SD 3.78Å; F57-M150 HydrophobicContact CZ-CE 4.06Å; F57-M150 HydrophobicContact CZ-SD 4.33Å
58	R	52.2	Low	46	Very low	151 Å²	151	70.5 Å²	70.5	57%	0.57	37%	0.371	S	S	*	.	H	α-helix	trans	-65.4	-31.9	168.5	-79.7	174	-173.9	156.8	-2.2	112.4	K54 T55 S61 R62	K54-R58 WeakPolarHBondContact O-CB 3.18Å; K54-R58 WeakPolarHBondContact O-CD 3.1Å; K54-R58 WeakPolarHBondContact O-CG 3.22Å; K54-R58 PolarHBondContact O-N 3.05Å; K54-R58 VanDerWaalsContact O-N 3.09Å; T55-R58 CarbonylContact O-C 3.58Å; R58-S61 CarbonylContact O-C 3.46Å; R58-R62 WeakPolarHBondContact O-CA 3.37Å; R58-R62 WeakPolarHBondContact O-CB 3.38Å; R58-R62 PolarHBondContact O-N 3.48Å
59	I	53.2	Low	46.3	Very low	32 Å²	32	69 Å²	69	16%	0.164	37%	0.37	C	S	.	.	H	α-helix	trans	-65	-54.4	175.3	-76.9	159.1	0	0	0	106.8	F35 T55 F56 F57 S61 R62 I63	F35-I59 HydrophobicContact CD1-CD1 4.03Å; F35-I59 HydrophobicContact CD2-CD1 4.02Å; F35-I59 HydrophobicContact CE1-CD1 4.21Å; F35-I59 HydrophobicContact CE2-CD1 4.19Å; F35-I59 HydrophobicContact CG-CD1 3.93Å; F35-I59 HydrophobicContact CZ-CD1 4.28Å; T55-I59 HydrophobicContact CG2-CD1 3.98Å; T55-I59 HydrophobicContact CG2-CG1 4.43Å; T55-I59 WeakPolarHBondContact O-CA 3.16Å; T55-I59 VanDerWaalsContact O-CB 3.25Å; T55-I59 WeakPolarHBondContact O-CB 3.33Å; T55-I59 VanDerWaalsContact O-CD1 3.3Å; T55-I59 WeakPolarHBondContact O-CD1 3.39Å; T55-I59 WeakPolarHBondContact O-CG1 3.37Å; T55-I59 PolarHBondContact O-N 3.28Å; F56-I59 WeakPolarHBondContact O-CB 3.3Å; F56-I59 PolarHBondContact O-N 3.34Å; F56-I59 VanDerWaalsContact O-N 3.12Å; F57-I59 VanDerWaalsContact C-N 3.3Å; F57-I59 PolarHBondContact O-N 2.91Å; I59-S61 PolarHBondContact O-N 3.45Å; I59-R62 CarbonylContact O-C 3.55Å; I59-R62 WeakPolarHBondContact O-CA 3.19Å; I59-R62 PolarHBondContact O-N 3.24Å; I59-I63 HydrophobicContact CG2-CD1 4.05Å; I59-I63 HydrophobicContact CG2-CG1 4Å; I59-I63 WeakPolarHBondContact O-CG1 3.45Å; I59-I63 PolarHBondContact O-N 3.35Å
60	L	53.9	Low	46.5	Very low	13 Å²	13	63 Å²	63	7%	0.068	34%	0.343	C	S	.	.	H	α-helix	trans	-52.5	-51.8	173.6	-79.6	161.6	0	0	0	111.7	F56 F57 R62 I63 C64 L77 L80	F56-L60 HydrophobicContact CD1-CD1 4.01Å; F56-L60 HydrophobicContact CE1-CD1 3.5Å; F56-L60 VanDerWaalsContact CE1-CD1 3.5Å; F56-L60 HydrophobicContact CZ-CD1 3.91Å; F56-L60 PolarHBondContact O-N 3.47Å; F57-L60 PolarHBondContact O-N 2.88Å; L60-R62 VanDerWaalsContact C-N 3.27Å; L60-R62 PolarHBondContact O-N 2.95Å; L60-I63 WeakPolarHBondContact O-CB 3.47Å; L60-I63 PolarHBondContact O-N 3.46Å; L60-C64 WeakPolarHBondContact O-CB 3.34Å; L60-C64 PolarHBondContact O-N 3.44Å; L60-C64 PolarHBondContact O-SG 3Å; L60-L77 HydrophobicContact CB-CD1 3.76Å; L60-L77 HydrophobicContact CD1-CD1 3.94Å; L60-L77 HydrophobicContact CD2-CD1 4.42Å; L60-L77 HydrophobicContact CG-CD1 4.25Å; L60-L80 HydrophobicContact CD2-CD2 3.64Å
61	S	49.3	Very low	46.3	Very low	45 Å²	45	59.4 Å²	59.4	32%	0.315	32%	0.319	S	S	.	.	H	α-helix	trans	-64.2	-23	176.1	-52	0	0	0	0	114.3	F57 R58 I59 C64 R65	F57-S61 VanDerWaalsContact O-CB 3.27Å; F57-S61 WeakPolarHBondContact O-CB 3.29Å; F57-S61 PolarHBondContact O-N 2.99Å; F57-S61 PolarHBondContact O-OG 3.39Å; R58-S61 CarbonylContact O-C 3.46Å; I59-S61 PolarHBondContact O-N 3.45Å; S61-C64 WeakPolarHBondContact O-CB 2.87Å; S61-R65 VanDerWaalsContact O-CB 3.29Å; S61-R65 WeakPolarHBondContact O-CB 3.31Å; S61-R65 PolarHBondContact O-N 3.48Å
62	R	48.4	Very low	46.2	Very low	154 Å²	154	59.8 Å²	59.8	58%	0.581	32%	0.319	S	S	*	.	H	α-helix	trans	-90.2	-33.5	177.7	-171.4	172.4	-170.6	171.5	3.1	111	R58 I59 L60 C64 R65 D66	R58-R62 WeakPolarHBondContact O-CA 3.37Å; R58-R62 WeakPolarHBondContact O-CB 3.38Å; R58-R62 PolarHBondContact O-N 3.48Å; I59-R62 CarbonylContact O-C 3.55Å; I59-R62 WeakPolarHBondContact O-CA 3.19Å; I59-R62 PolarHBondContact O-N 3.24Å; L60-R62 VanDerWaalsContact C-N 3.27Å; L60-R62 PolarHBondContact O-N 2.95Å; R62-C64 VanDerWaalsContact C-N 3.3Å; R62-R65 PolarHBondContact O-N 3.37Å; R62-D66 VanDerWaalsContact O-CB 3.26Å; R62-D66 WeakPolarHBondContact O-CB 3.24Å; R62-D66 VanDerWaalsContact O-CG 3.23Å; R62-D66 PolarHBondContact O-N 2.97Å
63	I	48.8	Very low	46.4	Very low	9 Å²	9	63.2 Å²	63.2	5%	0.046	33%	0.333	C	S	.	.	H	α-helix	trans	-56.3	-52	162.2	-46.7	-146.3	0	0	0	106.8	V5 A9 I59 L60 R65 D66 C67	V5-I63 HydrophobicContact CG1-CB 4.09Å; V5-I63 HydrophobicContact CG1-CD1 3.86Å; V5-I63 HydrophobicContact CG1-CG1 3.57Å; V5-I63 HydrophobicContact CG1-CG2 4.28Å; A9-I63 HydrophobicContact CB-CG2 4.23Å; I59-I63 HydrophobicContact CG2-CD1 4.05Å; I59-I63 HydrophobicContact CG2-CG1 4Å; I59-I63 WeakPolarHBondContact O-CG1 3.45Å; I59-I63 PolarHBondContact O-N 3.35Å; L60-I63 WeakPolarHBondContact O-CB 3.47Å; L60-I63 PolarHBondContact O-N 3.46Å; I63-R65 PolarHBondContact O-N 2.91Å; I63-D66 PolarHBondContact O-N 2.66Å; I63-C67 PolarHBondContact O-N 2.92Å; I63-C67 PolarHBondContact O-SG 3.2Å
64	C	46.3	Very low	47.1	Very low	5 Å²	5	65.8 Å²	65.8	3%	0.034	35%	0.348	C	S	.	.	H	α-helix	trans	-52.8	-48.3	176.1	-67.5	0	0	0	0	113.5	L60 S61 R62 C67 W71	L60-C64 WeakPolarHBondContact O-CB 3.34Å; L60-C64 PolarHBondContact O-N 3.44Å; L60-C64 PolarHBondContact O-SG 3Å; S61-C64 WeakPolarHBondContact O-CB 2.87Å; R62-C64 VanDerWaalsContact C-N 3.3Å; C64-C67 WeakPolarHBondContact O-CB 3.4Å; C64-C67 PolarHBondContact O-N 2.89Å; C64-W71 HydrophobicContact CB-CB 3.33Å; C64-W71 HydrophobicContact CB-CD2 4.39Å; C64-W71 HydrophobicContact CB-CE3 4.46Å; C64-W71 HydrophobicContact CB-CG 4.02Å; C64-W71 WeakPolarHBondContact SG-CB 3.44Å; C64-W71 VanDerWaalsContact SG-CD2 3.54Å
65	R	44.3	Very low	47.8	Very low	184 Å²	184	67.9 Å²	67.9	69%	0.694	36%	0.359	S	S	*	.	H	α-helix	trans	-72.4	-36.6	-175.5	-159.4	-177	73.8	170.1	7.6	112.6	S61 R62 I63 C67	S61-R65 VanDerWaalsContact O-CB 3.29Å; S61-R65 WeakPolarHBondContact O-CB 3.31Å; S61-R65 PolarHBondContact O-N 3.48Å; R62-R65 PolarHBondContact O-N 3.37Å; I63-R65 PolarHBondContact O-N 2.91Å; R65-C67 VanDerWaalsContact C-N 3.3Å
66	D	45.7	Very low	48.4	Very low	70 Å²	70	66.6 Å²	66.6	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-81.5	-9.5	179.8	-63.1	-13.3	0	0	0	112	R62 I63 G68	R62-D66 VanDerWaalsContact O-CB 3.26Å; R62-D66 WeakPolarHBondContact O-CB 3.24Å; R62-D66 VanDerWaalsContact O-CG 3.23Å; R62-D66 PolarHBondContact O-N 2.97Å; I63-D66 PolarHBondContact O-N 2.66Å; D66-G68 PolarHBondContact O-N 3Å
67	C	46.1	Very low	49.3	Very low	14 Å²	14	66.2 Å²	66.2	10%	0.095	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	9.5	167.8	-68.5	0	0	0	0	114.6	A9 I63 C64 R65 I70	A9-C67 HydrophobicContact CB-CB 4.36Å; A9-C67 WeakPolarHBondContact CB-SG 3.21Å; I63-C67 PolarHBondContact O-N 2.92Å; I63-C67 PolarHBondContact O-SG 3.2Å; C64-C67 WeakPolarHBondContact O-CB 3.4Å; C64-C67 PolarHBondContact O-N 2.89Å; R65-C67 VanDerWaalsContact C-N 3.3Å; C67-I70 HydrophobicContact CB-CB 4.41Å; C67-I70 WeakPolarHBondContact O-CD1 3.39Å
68	G	41.9	Very low	50.4	Low	71 Å²	71	65.5 Å²	65.5	73%	0.732	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	32	179.6	0	0	0	0	0	115.1	D66	D66-G68 PolarHBondContact O-N 3Å
69	G	39.7	Very low	51.8	Low	56 Å²	56	58.9 Å²	58.9	58%	0.577	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	15.6	175.8	0	0	0	0	0	115.1	W71	G69-W71 VanDerWaalsContact C-N 3.26Å
70	I	39.6	Very low	53.1	Low	70 Å²	70	57.6 Å²	57.6	36%	0.359	32%	0.317	S	S	.	.	S	Bend	trans	-78.5	-13.5	176	-64.2	169	0	0	0	111.7	C67	C67-I70 HydrophobicContact CB-CB 4.41Å; C67-I70 WeakPolarHBondContact O-CD1 3.39Å
71	W	36.8	Very low	54.4	Low	17 Å²	17	57.3 Å²	57.3	6%	0.064	32%	0.315	C	S	.	.	S	Bend	trans	-122.1	103.5	174.2	-61.3	47	0	0	0	108.8	C12 C64 G69 D76 L80	C12-W71 HydrophobicContact CB-CZ2 4.49Å; C64-W71 HydrophobicContact CB-CB 3.33Å; C64-W71 HydrophobicContact CB-CD2 4.39Å; C64-W71 HydrophobicContact CB-CE3 4.46Å; C64-W71 HydrophobicContact CB-CG 4.02Å; C64-W71 WeakPolarHBondContact SG-CB 3.44Å; C64-W71 VanDerWaalsContact SG-CD2 3.54Å; G69-W71 VanDerWaalsContact C-N 3.26Å; W71-D76 VanDerWaalsContact C-OD2 3.3Å; W71-D76 WeakPolarHBondContact CA-OD2 3.37Å; W71-D76 HydrophobicContact CB-CB 3.84Å; W71-D76 HydrophobicContact CD2-CB 4.05Å; W71-D76 HydrophobicContact CE3-CB 3.93Å; W71-D76 HydrophobicContact CG-CB 3.99Å; W71-L80 HydrophobicContact CH2-CD2 4.16Å; W71-L80 HydrophobicContact CZ3-CD2 4.03Å
72	T	39.9	Very low	56.2	Low	81 Å²	81	55.6 Å²	55.6	50%	0.497	30%	0.302	S	S	.	.			trans	-76.9	144.3	168.2	62.9	0	0	0	0	109.5	N74 D76	T72-N74 PolarHBondContact O-N 2.81Å; T72-D76 PolarHBondContact N-OD2 3.04Å; T72-D76 PolarHBondContact OG1-OD2 3.41Å
73	V	47.4	Very low	58	Low	104 Å²	104	48.3 Å²	48.3	63%	0.63	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-7.3	-154.6	179.9	0	0	0	0	115.6
74	N	57	Low	59.9	Low	117 Å²	117	48 Å²	48	63%	0.626	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.6	-49	178.9	-66.6	-26.7	0	0	0	114.4	T72 D76 D78	T72-N74 PolarHBondContact O-N 2.81Å; N74-D76 PolarHBondContact O-N 2.88Å; N74-D78 PolarHBondContact O-N 3.49Å
75	E	60.8	Low	62	Low	134 Å²	134	48 Å²	48	63%	0.626	27%	0.272	S	S	*	.	H	α-helix	trans	-65.7	-36.7	-171.7	-68	-170.2	173.6	0	0	113.9	W79	E75-W79 WeakPolarHBondContact O-CB 3.32Å; E75-W79 PolarHBondContact O-N 3.16Å
76	D	61.9	Low	64	Low	10 Å²	10	39.2 Å²	39.2	5%	0.053	24%	0.24	C	C	.	.	H	α-helix	trans	-81.2	-29.1	-172.9	-57.4	-71	0	0	0	112.6	W71 T72 N74 L80 T108	W71-D76 VanDerWaalsContact C-OD2 3.3Å; W71-D76 WeakPolarHBondContact CA-OD2 3.37Å; W71-D76 HydrophobicContact CB-CB 3.84Å; W71-D76 HydrophobicContact CD2-CB 4.05Å; W71-D76 HydrophobicContact CE3-CB 3.93Å; W71-D76 HydrophobicContact CG-CB 3.99Å; T72-D76 PolarHBondContact N-OD2 3.04Å; T72-D76 PolarHBondContact OG1-OD2 3.41Å; N74-D76 PolarHBondContact O-N 2.88Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 PolarHBondContact O-N 3.07Å; D76-T108 HydrophobicContact CB-CG2 4.33Å; D76-T108 WeakPolarHBondContact OD1-CB 3.27Å; D76-T108 WeakPolarHBondContact OD1-CG2 2.91Å; D76-T108 PolarHBondContact OD1-OG1 2.89Å
77	L	69.1	Low	66	Low	20 Å²	20	36 Å²	36	11%	0.105	22%	0.222	C	C	.	.	H	α-helix	trans	-70.7	-42.7	172.3	-165.4	85.8	0	0	0	110.5	F57 L60 W79 L80 V81 M150	F57-L77 HydrophobicContact CD1-CD1 4.46Å; F57-L77 HydrophobicContact CD1-CD2 3.98Å; F57-L77 HydrophobicContact CE1-CD2 3.92Å; L60-L77 HydrophobicContact CB-CD1 3.76Å; L60-L77 HydrophobicContact CD1-CD1 3.94Å; L60-L77 HydrophobicContact CD2-CD1 4.42Å; L60-L77 HydrophobicContact CG-CD1 4.25Å; L77-W79 VanDerWaalsContact C-N 3.3Å; L77-W79 PolarHBondContact O-N 3.31Å; L77-L80 PolarHBondContact O-N 2.84Å; L77-V81 PolarHBondContact O-N 3.36Å; L77-M150 HydrophobicContact CD2-CG 3.99Å; L77-M150 HydrophobicContact CD2-SD 3.37Å; L77-M150 WeakPolarHBondContact CD2-SD 3.49Å; L77-M150 HydrophobicContact CG-CG 4.31Å; L77-M150 HydrophobicContact CG-SD 3.66Å
78	D	76.6	Confident	68	Low	18 Å²	18	35.7 Å²	35.7	10%	0.096	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-42.3	173.5	-62.2	-18.8	0	0	0	110.5	N74 V81 F82 M150 S153 S154 L157	N74-D78 PolarHBondContact O-N 3.49Å; D78-V81 PolarHBondContact O-N 3.13Å; D78-F82 VanDerWaalsContact O-CB 3.25Å; D78-F82 WeakPolarHBondContact O-CB 3.36Å; D78-F82 PolarHBondContact O-N 2.96Å; D78-M150 VanDerWaalsContact OD1-CA 3.24Å; D78-M150 WeakPolarHBondContact OD1-CA 3.28Å; D78-M150 VanDerWaalsContact OD1-CG 3.31Å; D78-M150 WeakPolarHBondContact OD1-CG 3.19Å; D78-S153 VanDerWaalsContact CG-OG 3.23Å; D78-S153 WeakPolarHBondContact OD2-CB 3.49Å; D78-S153 PolarHBondContact OD2-OG 3.38Å; D78-S154 PolarHBondContact O-OG 2.97Å; D78-L157 HydrophobicContact CB-CD1 3.93Å
79	W	80.9	Confident	70.2	Confident	13 Å²	13	35 Å²	35	5%	0.049	20%	0.196	C	C	.	.	H	α-helix	trans	-63.6	-44	175.1	-175.1	-99.9	0	0	0	112.7	E75 L77 V81 F82 Y83 L104 A105 T108 R111 L157	E75-W79 WeakPolarHBondContact O-CB 3.32Å; E75-W79 PolarHBondContact O-N 3.16Å; L77-W79 VanDerWaalsContact C-N 3.3Å; L77-W79 PolarHBondContact O-N 3.31Å; W79-V81 VanDerWaalsContact C-N 3.35Å; W79-V81 PolarHBondContact O-N 3.39Å; W79-F82 HydrophobicContact CD2-CD1 4.24Å; W79-F82 AromaticContact CE3-CD1 3.8Å; W79-F82 HydrophobicContact CE3-CD1 3.8Å; W79-F82 HydrophobicContact CE3-CE1 4.2Å; W79-F82 HydrophobicContact CH2-CD1 4.23Å; W79-F82 AromaticContact CH2-CE1 3.84Å; W79-F82 HydrophobicContact CH2-CE1 3.84Å; W79-F82 HydrophobicContact CZ2-CE1 4.45Å; W79-F82 AromaticContact CZ3-CD1 3.79Å; W79-F82 HydrophobicContact CZ3-CD1 3.79Å; W79-F82 AromaticContact CZ3-CE1 3.7Å; W79-F82 HydrophobicContact CZ3-CE1 3.7Å; W79-F82 PolarHBondContact O-N 3.37Å; W79-Y83 VanDerWaalsContact O-CB 3.23Å; W79-Y83 WeakPolarHBondContact O-CB 3.37Å; W79-Y83 PolarHBondContact O-N 3.23Å; W79-L104 HydrophobicContact CH2-CD2 3.55Å; W79-L104 HydrophobicContact CZ2-CD2 3.54Å; W79-A105 PolarHBondContact NE1-O 2.88Å; W79-T108 HydrophobicContact CB-CG2 3.57Å; W79-T108 HydrophobicContact CD2-CG2 4.21Å; W79-T108 HydrophobicContact CG-CG2 3.53Å; W79-R111 HydrophobicContact CH2-CB 4Å; W79-R111 HydrophobicContact CH2-CG 3.93Å; W79-R111 HydrophobicContact CZ2-CB 3.56Å; W79-R111 HydrophobicContact CZ2-CG 3.56Å; W79-L157 HydrophobicContact CE3-CD1 4.41Å
80	L	80.2	Confident	72.2	Confident	5 Å²	5	32.3 Å²	32.3	3%	0.026	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-43.5	178.8	-179.2	66.5	0	0	0	111.4	L60 W71 D76 L77 Y83 L84 P106	L60-L80 HydrophobicContact CD2-CD2 3.64Å; W71-L80 HydrophobicContact CH2-CD2 4.16Å; W71-L80 HydrophobicContact CZ3-CD2 4.03Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 PolarHBondContact O-N 3.07Å; L77-L80 PolarHBondContact O-N 2.84Å; L80-Y83 HydrophobicContact CD1-CD1 4.19Å; L80-Y83 WeakPolarHBondContact O-CB 3.49Å; L80-Y83 PolarHBondContact O-N 3.34Å; L80-L84 WeakPolarHBondContact O-CG 3.46Å; L80-L84 PolarHBondContact O-N 3.35Å; L80-P106 HydrophobicContact CD1-CB 3.92Å
81	V	82.7	Confident	74.2	Confident	6 Å²	6	30.3 Å²	30.3	4%	0.036	16%	0.156	C	C	.	.	H	α-helix	trans	-69.2	-43.8	178.2	173.4	0	0	0	0	111.2	L77 D78 W79 Y83 L84 F85 I138 M150 L151	L77-V81 PolarHBondContact O-N 3.36Å; D78-V81 PolarHBondContact O-N 3.13Å; W79-V81 VanDerWaalsContact C-N 3.35Å; W79-V81 PolarHBondContact O-N 3.39Å; V81-Y83 VanDerWaalsContact C-N 3.27Å; V81-Y83 PolarHBondContact O-N 3.24Å; V81-L84 PolarHBondContact O-N 2.93Å; V81-F85 HydrophobicContact CG1-CD2 3.96Å; V81-F85 HydrophobicContact CG1-CE2 4.02Å; V81-F85 WeakPolarHBondContact O-CD2 3.21Å; V81-F85 PolarHBondContact O-N 3.11Å; V81-F85 VanDerWaalsContact O-N 3.07Å; V81-I138 HydrophobicContact CG2-CD1 4.49Å; V81-M150 HydrophobicContact CB-CE 4.5Å; V81-M150 HydrophobicContact CB-CG 4.48Å; V81-M150 HydrophobicContact CB-SD 4.38Å; V81-M150 HydrophobicContact CG1-CE 4.38Å; V81-M150 HydrophobicContact CG2-CE 3.73Å; V81-M150 HydrophobicContact CG2-CG 4.21Å; V81-M150 HydrophobicContact CG2-SD 3.51Å; V81-M150 VanDerWaalsContact CG2-SD 3.51Å; V81-L151 HydrophobicContact CG1-CD2 3.91Å
82	F	86.2	Confident	76	Confident	10 Å²	10	32.4 Å²	32.4	4%	0.044	17%	0.174	C	C	.	.	H	α-helix	trans	-53.6	-44.8	169.8	164.7	-111.1	0	0	0	112	D78 W79 F85 T86 L104 L157 A158 M161	D78-F82 VanDerWaalsContact O-CB 3.25Å; D78-F82 WeakPolarHBondContact O-CB 3.36Å; D78-F82 PolarHBondContact O-N 2.96Å; W79-F82 HydrophobicContact CD2-CD1 4.24Å; W79-F82 AromaticContact CE3-CD1 3.8Å; W79-F82 HydrophobicContact CE3-CD1 3.8Å; W79-F82 HydrophobicContact CE3-CE1 4.2Å; W79-F82 HydrophobicContact CH2-CD1 4.23Å; W79-F82 AromaticContact CH2-CE1 3.84Å; W79-F82 HydrophobicContact CH2-CE1 3.84Å; W79-F82 HydrophobicContact CZ2-CE1 4.45Å; W79-F82 AromaticContact CZ3-CD1 3.79Å; W79-F82 HydrophobicContact CZ3-CD1 3.79Å; W79-F82 AromaticContact CZ3-CE1 3.7Å; W79-F82 HydrophobicContact CZ3-CE1 3.7Å; W79-F82 PolarHBondContact O-N 3.37Å; F82-F85 PolarHBondContact O-N 3.18Å; F82-T86 WeakPolarHBondContact CE2-OG1 3.24Å; F82-T86 WeakPolarHBondContact CZ-OG1 3.47Å; F82-T86 WeakPolarHBondContact O-CB 3.33Å; F82-T86 PolarHBondContact O-N 2.86Å; F82-T86 PolarHBondContact O-OG1 3.42Å; F82-L104 HydrophobicContact CE1-CD1 4.11Å; F82-L104 HydrophobicContact CE1-CD2 4.29Å; F82-L104 HydrophobicContact CZ-CD1 4.12Å; F82-L157 HydrophobicContact CB-CB 4.29Å; F82-L157 HydrophobicContact CB-CD1 4.18Å; F82-L157 HydrophobicContact CD1-CB 4.36Å; F82-L157 HydrophobicContact CD2-CB 4.19Å; F82-L157 HydrophobicContact CG-CB 4Å; F82-A158 HydrophobicContact CD2-CB 3.88Å; F82-A158 HydrophobicContact CE2-CB 3.67Å; F82-M161 HydrophobicContact CE2-SD 4.23Å; F82-M161 HydrophobicContact CZ-SD 4.04Å
83	Y	87	Confident	77.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.6	-47.1	177.7	160.3	-95.1	0	0	0	111.8	E21 L25 W79 L80 V81 F85 T86 R87 L104 P106	E21-Y83 WeakPolarHBondContact CG-OH 3.49Å; E21-Y83 PolarHBondContact OE1-OH 3.32Å; L25-Y83 HydrophobicContact CD2-CE1 4.19Å; W79-Y83 VanDerWaalsContact O-CB 3.23Å; W79-Y83 WeakPolarHBondContact O-CB 3.37Å; W79-Y83 PolarHBondContact O-N 3.23Å; L80-Y83 HydrophobicContact CD1-CD1 4.19Å; L80-Y83 WeakPolarHBondContact O-CB 3.49Å; L80-Y83 PolarHBondContact O-N 3.34Å; V81-Y83 VanDerWaalsContact C-N 3.27Å; V81-Y83 PolarHBondContact O-N 3.24Å; Y83-F85 VanDerWaalsContact C-N 3.35Å; Y83-F85 PolarHBondContact O-N 2.95Å; Y83-T86 PolarHBondContact O-N 2.88Å; Y83-R87 HydrophobicContact CD2-CG 3.79Å; Y83-R87 HydrophobicContact CE1-CG 4.38Å; Y83-R87 HydrophobicContact CE2-CG 3.36Å; Y83-R87 HydrophobicContact CG-CG 4.44Å; Y83-R87 WeakPolarHBondContact O-CG 3.34Å; Y83-R87 PolarHBondContact O-N 2.9Å; Y83-L104 HydrophobicContact CD2-CB 4.25Å; Y83-L104 WeakPolarHBondContact CE2-O 3.07Å; Y83-P106 HydrophobicContact CD1-CB 3.78Å; Y83-P106 HydrophobicContact CE1-CB 3.72Å; Y83-P106 HydrophobicContact CE1-CG 4.22Å; Y83-P106 HydrophobicContact CE2-CB 4.49Å; Y83-P106 HydrophobicContact CG-CB 4.2Å
84	L	87.9	Confident	78.7	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-58.7	-45.9	178.7	-72.2	171.1	0	0	0	111.7	L25 L80 V81 R87 C88 T131 I134 I135 I138	L25-L84 HydrophobicContact CD2-CD2 3.81Å; L80-L84 WeakPolarHBondContact O-CG 3.46Å; L80-L84 PolarHBondContact O-N 3.35Å; V81-L84 PolarHBondContact O-N 2.93Å; L84-R87 PolarHBondContact O-N 2.92Å; L84-C88 WeakPolarHBondContact O-CB 3.32Å; L84-C88 PolarHBondContact O-N 2.75Å; L84-T131 HydrophobicContact CD2-CG2 3.94Å; L84-I134 HydrophobicContact CD1-CG2 3.68Å; L84-I134 HydrophobicContact CD2-CD1 4.14Å; L84-I134 HydrophobicContact CD2-CG2 4.26Å; L84-I135 HydrophobicContact CB-CG1 4.4Å; L84-I138 HydrophobicContact CD1-CD1 4.05Å
85	F	89.4	Confident	79.2	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.018	14%	0.136	C	C	.	.	H	α-helix	trans	-66.9	-39.9	177.6	-86.9	-96.6	0	0	0	112.3	V81 F82 Y83 C88 Y89 I135 L151 T164 Q167 I168 H171	V81-F85 HydrophobicContact CG1-CD2 3.96Å; V81-F85 HydrophobicContact CG1-CE2 4.02Å; V81-F85 WeakPolarHBondContact O-CD2 3.21Å; V81-F85 PolarHBondContact O-N 3.11Å; V81-F85 VanDerWaalsContact O-N 3.07Å; F82-F85 PolarHBondContact O-N 3.18Å; Y83-F85 VanDerWaalsContact C-N 3.35Å; Y83-F85 PolarHBondContact O-N 2.95Å; F85-C88 PolarHBondContact O-N 3.08Å; F85-Y89 AromaticContact CD1-CD2 3.79Å; F85-Y89 HydrophobicContact CD1-CD2 3.79Å; F85-Y89 AromaticContact CD1-CE2 3.81Å; F85-Y89 HydrophobicContact CD1-CE2 3.81Å; F85-Y89 HydrophobicContact CE1-CD2 4.45Å; F85-Y89 HydrophobicContact CE1-CE2 4.04Å; F85-Y89 WeakPolarHBondContact O-CB 3.22Å; F85-Y89 PolarHBondContact O-N 3.03Å; F85-I135 HydrophobicContact CD1-CD1 4.42Å; F85-I135 HydrophobicContact CD2-CD1 4.19Å; F85-I135 HydrophobicContact CD2-CG1 4.34Å; F85-I135 HydrophobicContact CE1-CG2 4.38Å; F85-I135 HydrophobicContact CE2-CD1 4.31Å; F85-I135 HydrophobicContact CE2-CG1 4.13Å; F85-I135 HydrophobicContact CE2-CG2 4.22Å; F85-I135 HydrophobicContact CG-CD1 4.26Å; F85-I135 HydrophobicContact CZ-CD1 4.47Å; F85-I135 HydrophobicContact CZ-CG1 4.46Å; F85-I135 HydrophobicContact CZ-CG2 3.82Å; F85-L151 HydrophobicContact CE2-CD2 4.23Å; F85-T164 HydrophobicContact CB-CG2 4.05Å; F85-Q167 HydrophobicContact CD1-CB 4.34Å; F85-I168 HydrophobicContact CB-CD1 3.98Å; F85-I168 HydrophobicContact CB-CG1 3.63Å; F85-I168 HydrophobicContact CD1-CB 4.27Å; F85-I168 HydrophobicContact CD1-CG1 3.44Å; F85-I168 VanDerWaalsContact CD1-CG1 3.44Å; F85-I168 HydrophobicContact CD2-CG1 4.09Å; F85-I168 HydrophobicContact CE1-CB 4.46Å; F85-I168 HydrophobicContact CE1-CG1 4.07Å; F85-I168 HydrophobicContact CG-CD1 4.28Å; F85-I168 HydrophobicContact CG-CG1 3.45Å; F85-I168 VanDerWaalsContact CG-CG1 3.45Å; F85-H171 HydrophobicContact CE1-CB 3.93Å; F85-H171 AromaticContact CE1-CD2 3.51Å; F85-H171 AromaticContact CE1-CG 3.81Å; F85-H171 HydrophobicContact CZ-CB 3.89Å
86	T	88	Confident	79.3	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-62.4	-42.8	175.7	-59.3	0	0	0	0	111.7	F82 Y83 C88 G90 L104 M161	F82-T86 WeakPolarHBondContact CE2-OG1 3.24Å; F82-T86 WeakPolarHBondContact CZ-OG1 3.47Å; F82-T86 WeakPolarHBondContact O-CB 3.33Å; F82-T86 PolarHBondContact O-N 2.86Å; F82-T86 PolarHBondContact O-OG1 3.42Å; Y83-T86 PolarHBondContact O-N 2.88Å; T86-C88 VanDerWaalsContact C-N 3.33Å; T86-C88 PolarHBondContact O-N 3.42Å; T86-G90 WeakPolarHBondContact O-CA 3.47Å; T86-G90 PolarHBondContact O-N 3.02Å; T86-L104 HydrophobicContact CG2-CD1 3.43Å; T86-L104 VanDerWaalsContact CG2-CD1 3.43Å; T86-M161 HydrophobicContact CG2-CE 3.39Å; T86-M161 HydrophobicContact CG2-SD 3.64Å
87	R	87.4	Confident	79.3	Confident	1 Å²	1	27.1 Å²	27.1	0%	0.004	14%	0.143	C	C	.	.	H	α-helix	trans	-73	-25.3	178.3	-64.6	-57.2	-70.8	150.1	-8.3	113.3	E21 Y83 L84 W91 M103 E120 V127 T131	E21-R87 IonicContact OE1-CZ 3.92Å; E21-R87 IonicContact OE1-NE 2.66Å; E21-R87 PolarHBondContact OE1-NE 3.25Å; E21-R87 IonicContact OE1-NH2 2.71Å; E21-R87 IonicContact OE2-NH2 3.44Å; E21-R87 PolarHBondContact OE2-NH2 2.7Å; Y83-R87 HydrophobicContact CD2-CG 3.79Å; Y83-R87 HydrophobicContact CE1-CG 4.38Å; Y83-R87 HydrophobicContact CE2-CG 3.36Å; Y83-R87 HydrophobicContact CG-CG 4.44Å; Y83-R87 WeakPolarHBondContact O-CG 3.34Å; Y83-R87 PolarHBondContact O-N 2.9Å; L84-R87 PolarHBondContact O-N 2.92Å; R87-W91 VanDerWaalsContact NH1-CZ2 3.35Å; R87-W91 PolarHBondContact O-NE1 2.9Å; R87-M103 PolarHBondContact NH1-SD 3.44Å; R87-E120 IonicContact CZ-OE2 3.82Å; R87-E120 IonicContact NH2-OE2 2.7Å; R87-E120 PolarHBondContact NH2-OE2 2.98Å; R87-V127 HydrophobicContact CB-CG1 4.22Å; R87-T131 HydrophobicContact CB-CG2 4.18Å
88	C	88.2	Confident	78.9	Confident	9 Å²	9	30.7 Å²	30.7	6%	0.061	16%	0.162	C	C	.	.	H	α-helix	trans	-80.4	-45.5	174.6	-173.1	0	0	0	0	112.1	L84 F85 T86 T132 I135	L84-C88 WeakPolarHBondContact O-CB 3.32Å; L84-C88 PolarHBondContact O-N 2.75Å; F85-C88 PolarHBondContact O-N 3.08Å; T86-C88 VanDerWaalsContact C-N 3.33Å; T86-C88 PolarHBondContact O-N 3.42Å; C88-T132 PolarHBondContact SG-OG1 2.85Å; C88-T132 VanDerWaalsContact SG-OG1 3.37Å; C88-I135 HydrophobicContact CB-CD1 3.76Å
89	Y	86.9	Confident	77.6	Confident	55 Å²	55	37 Å²	37	22%	0.216	20%	0.2	C	C	.	.	H	α-helix	trans	-121.6	-16.9	-166	-59	-66	0	0	0	115.4	F85 W91 I135 H163 Q167 H171	F85-Y89 AromaticContact CD1-CD2 3.79Å; F85-Y89 HydrophobicContact CD1-CD2 3.79Å; F85-Y89 AromaticContact CD1-CE2 3.81Å; F85-Y89 HydrophobicContact CD1-CE2 3.81Å; F85-Y89 HydrophobicContact CE1-CD2 4.45Å; F85-Y89 HydrophobicContact CE1-CE2 4.04Å; F85-Y89 WeakPolarHBondContact O-CB 3.22Å; F85-Y89 PolarHBondContact O-N 3.03Å; Y89-W91 VanDerWaalsContact C-N 3.3Å; Y89-W91 PolarHBondContact O-N 3.37Å; Y89-I135 HydrophobicContact CE2-CD1 4.17Å; Y89-H163 PolarHBondContact O-ND1 3.27Å; Y89-Q167 HydrophobicContact CD1-CB 4.47Å; Y89-Q167 HydrophobicContact CD1-CG 3.87Å; Y89-Q167 HydrophobicContact CD2-CB 3.6Å; Y89-Q167 HydrophobicContact CD2-CG 3.89Å; Y89-Q167 HydrophobicContact CE1-CG 4.38Å; Y89-Q167 HydrophobicContact CE2-CB 3.99Å; Y89-Q167 HydrophobicContact CE2-CG 4.39Å; Y89-Q167 HydrophobicContact CG-CB 3.86Å; Y89-Q167 HydrophobicContact CG-CG 3.59Å; Y89-H171 AromaticContact CE2-NE2 3.87Å; Y89-H171 AromaticContact CZ-NE2 3.72Å; Y89-H171 PolarHBondContact OH-NE2 3.44Å
90	G	82.5	Confident	76.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-83.5	6.8	-172.9	0	0	0	0	0	115.3	T86 S92 D93 I94 T164	T86-G90 WeakPolarHBondContact O-CA 3.47Å; T86-G90 PolarHBondContact O-N 3.02Å; G90-S92 PolarHBondContact O-N 3.23Å; G90-D93 PolarHBondContact O-N 3.33Å; G90-I94 WeakPolarHBondContact O-CG1 3.41Å; G90-I94 PolarHBondContact O-N 3.01Å; G90-T164 WeakPolarHBondContact CA-OG1 3.19Å
91	W	81.2	Confident	75.1	Confident	28 Å²	28	47.8 Å²	47.8	11%	0.106	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-62.2	-22.9	177.2	-68.2	92.2	0	0	0	113.9	R87 Y89 M103 E120 K124	R87-W91 VanDerWaalsContact NH1-CZ2 3.35Å; R87-W91 PolarHBondContact O-NE1 2.9Å; Y89-W91 VanDerWaalsContact C-N 3.3Å; Y89-W91 PolarHBondContact O-N 3.37Å; W91-M103 HydrophobicContact CZ3-CE 4.46Å; W91-E120 HydrophobicContact CH2-CB 4.36Å; W91-E120 HydrophobicContact CZ3-CB 4.42Å; W91-K124 HydrophobicContact CD2-CD 3.84Å; W91-K124 HydrophobicContact CD2-CG 4.08Å; W91-K124 HydrophobicContact CE3-CD 3.9Å; W91-K124 HydrophobicContact CE3-CG 4.37Å; W91-K124 HydrophobicContact CG-CD 4.36Å; W91-K124 HydrophobicContact CH2-CB 3.96Å; W91-K124 HydrophobicContact CH2-CD 4.32Å; W91-K124 HydrophobicContact CH2-CG 4Å; W91-K124 HydrophobicContact CZ2-CB 4.01Å; W91-K124 HydrophobicContact CZ2-CD 4.29Å; W91-K124 HydrophobicContact CZ2-CG 3.69Å; W91-K124 HydrophobicContact CZ3-CB 4.47Å; W91-K124 HydrophobicContact CZ3-CD 4.14Å; W91-K124 HydrophobicContact CZ3-CG 4.32Å
92	S	74.4	Confident	74.4	Confident	62 Å²	62	52.1 Å²	52.1	43%	0.434	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-81	-21.6	173.7	53.1	0	0	0	0	113.2	G90 I94 H163	G90-S92 PolarHBondContact O-N 3.23Å; S92-I94 VanDerWaalsContact C-N 3.35Å; S92-H163 WeakPolarHBondContact OG-CB 3.33Å
93	D	72.4	Confident	73.9	Confident	38 Å²	38	51.6 Å²	51.6	20%	0.203	26%	0.264	C	S	.	.	S	Bend	trans	-90.3	-2.4	-177.9	-57.6	-33.8	0	0	0	111.2	G90 M161 H163 T164	G90-D93 PolarHBondContact O-N 3.33Å; D93-M161 HydrophobicContact CB-CB 4.17Å; D93-M161 HydrophobicContact CB-CE 3.58Å; D93-M161 HydrophobicContact CB-CG 4.3Å; D93-H163 WeakPolarHBondContact OD1-CB 3.44Å; D93-H163 PolarHBondContact OD1-N 3.17Å; D93-H163 VanDerWaalsContact OD1-N 3.09Å; D93-H163 WeakPolarHBondContact OD2-CB 3.44Å; D93-H163 PolarHBondContact OD2-N 2.95Å; D93-T164 PolarHBondContact OD2-N 3.24Å; D93-T164 PolarHBondContact OD2-OG1 2.6Å
94	I	72.7	Confident	73.4	Confident	38 Å²	38	52.4 Å²	52.4	20%	0.195	27%	0.268	C	S	.	.	S	Bend	trans	-112.6	114.6	-176.2	-60.1	164.4	0	0	0	109.6	G90 S92 L96 M103 M161	G90-I94 WeakPolarHBondContact O-CG1 3.41Å; G90-I94 PolarHBondContact O-N 3.01Å; S92-I94 VanDerWaalsContact C-N 3.35Å; I94-L96 HydrophobicContact CG2-CD2 4.47Å; I94-L96 PolarHBondContact O-N 2.89Å; I94-M103 HydrophobicContact CD1-CE 4.41Å; I94-M103 HydrophobicContact CD1-SD 4.1Å; I94-M103 HydrophobicContact CG2-CE 3.93Å; I94-M161 HydrophobicContact CD1-CE 4.38Å; I94-M161 HydrophobicContact CG1-CE 4.02Å
95	D	66.2	Low	72.9	Confident	105 Å²	105	52.5 Å²	52.5	56%	0.561	27%	0.269	S	S	*	.			trans	-78.3	101.4	171.6	-166.3	-6.7	0	0	0	111	N97 D98	D95-N97 PolarHBondContact O-N 3Å; D95-N97 VanDerWaalsContact O-N 3.16Å; D95-N97 VanDerWaalsContact OD1-CB 3.29Å; D95-N97 WeakPolarHBondContact OD1-CB 3.3Å; D95-N97 PolarHBondContact OD1-N 2.68Å; D95-D98 PolarHBondContact O-N 2.83Å
96	L	64.1	Low	72.1	Confident	34 Å²	34	52.4 Å²	52.4	18%	0.178	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-0.4	176.9	-70	168.5	0	0	0	113.4	I94 M103 K117 L121	I94-L96 HydrophobicContact CG2-CD2 4.47Å; I94-L96 PolarHBondContact O-N 2.89Å; L96-M103 HydrophobicContact CD2-CE 3.46Å; L96-M103 VanDerWaalsContact CD2-CE 3.46Å; L96-K117 WeakPolarHBondContact O-CE 3.26Å; L96-K117 PolarHBondContact O-NZ 3.19Å; L96-L121 HydrophobicContact CD1-CD2 4.16Å
97	N	60.2	Low	71.3	Confident	120 Å²	120	52.6 Å²	52.6	64%	0.642	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-12.8	176.7	-60.7	-33.4	0	0	0	113.2	D95 V99 K117	D95-N97 PolarHBondContact O-N 3Å; D95-N97 VanDerWaalsContact O-N 3.16Å; D95-N97 VanDerWaalsContact OD1-CB 3.29Å; D95-N97 WeakPolarHBondContact OD1-CB 3.3Å; D95-N97 PolarHBondContact OD1-N 2.68Å; N97-V99 PolarHBondContact O-N 3.2Å; N97-K117 PolarHBondContact OD1-NZ 3.29Å
98	D	62.3	Low	70.2	Confident	94 Å²	94	54 Å²	54	50%	0.503	28%	0.279	S	S	.	.	S	Bend	trans	-70.7	127.5	172.5	-169.5	-13.9	0	0	0	110.2	D95 R100 S101	D95-D98 PolarHBondContact O-N 2.83Å; D98-R100 PolarHBondContact O-N 3.32Å; D98-R100 VanDerWaalsContact O-N 3.09Å; D98-R100 PolarHBondContact OD1-N 2.94Å; D98-R100 VanDerWaalsContact OD1-N 3.1Å; D98-S101 WeakPolarHBondContact O-CB 3.36Å; D98-S101 PolarHBondContact O-N 3.22Å; D98-S101 PolarHBondContact O-OG 3.14Å
99	V	49.3	Very low	69.1	Low	150 Å²	150	56.1 Å²	56.1	91%	0.909	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.9	-179.3	-177.4	0	0	0	0	111.7	N97	N97-V99 PolarHBondContact O-N 3.2Å
100	R	51.2	Low	68.3	Low	211 Å²	211	59.8 Å²	59.8	80%	0.796	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	10.5	175.2	-69.4	-175.3	178.1	178.1	1.8	114.8	D98 Q102	D98-R100 PolarHBondContact O-N 3.32Å; D98-R100 VanDerWaalsContact O-N 3.09Å; D98-R100 PolarHBondContact OD1-N 2.94Å; D98-R100 VanDerWaalsContact OD1-N 3.1Å; R100-Q102 PolarHBondContact O-N 2.99Å
101	S	57.3	Low	67.8	Low	34 Å²	34	65 Å²	65	24%	0.238	34%	0.341	C	S	.	.			trans	-59.8	98.4	-175.6	39	0	0	0	0	111.8	D98 V115	D98-S101 WeakPolarHBondContact O-CB 3.36Å; D98-S101 PolarHBondContact O-N 3.22Å; D98-S101 PolarHBondContact O-OG 3.14Å; S101-V115 WeakPolarHBondContact O-CB 3.45Å; S101-V115 WeakPolarHBondContact O-CG2 3.46Å
102	Q	68.5	Low	67.5	Low	97 Å²	97	69.9 Å²	69.9	45%	0.453	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-92.6	136	172.2	-69.8	176.6	-1.3	0	0	108.4	R100 Y112	R100-Q102 PolarHBondContact O-N 2.99Å; Q102-Y112 HydrophobicContact CB-CD1 3.99Å; Q102-Y112 HydrophobicContact CB-CG 4.26Å
103	M	74.4	Confident	67.6	Low	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	143.2	174.6	-76.7	-69	155.7	0	0	109.5	R87 W91 I94 L96 Y112 R113 V115 E120	R87-M103 PolarHBondContact NH1-SD 3.44Å; W91-M103 HydrophobicContact CZ3-CE 4.46Å; I94-M103 HydrophobicContact CD1-CE 4.41Å; I94-M103 HydrophobicContact CD1-SD 4.1Å; I94-M103 HydrophobicContact CG2-CE 3.93Å; L96-M103 HydrophobicContact CD2-CE 3.46Å; L96-M103 VanDerWaalsContact CD2-CE 3.46Å; M103-Y112 CarbonylContact O-C 3.55Å; M103-Y112 WeakPolarHBondContact O-CA 3.47Å; M103-R113 HydrophobicContact CB-CG 4.17Å; M103-R113 PolarHBondContact N-O 2.93Å; M103-R113 PolarHBondContact O-N 3.25Å; M103-V115 HydrophobicContact CB-CG2 3.7Å; M103-V115 HydrophobicContact CE-CG1 4.5Å; M103-V115 HydrophobicContact CG-CB 4.4Å; M103-V115 HydrophobicContact CG-CG1 4.05Å; M103-V115 HydrophobicContact CG-CG2 3.38Å; M103-E120 HydrophobicContact CG-CG 4.31Å
104	L	77	Confident	67.4	Low	17 Å²	17	72 Å²	72	9%	0.089	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	143.3	174.9	-73.8	154.8	0	0	0	110.8	W79 F82 Y83 T86 R111 Y112 M161	W79-L104 HydrophobicContact CH2-CD2 3.55Å; W79-L104 HydrophobicContact CZ2-CD2 3.54Å; F82-L104 HydrophobicContact CE1-CD1 4.11Å; F82-L104 HydrophobicContact CE1-CD2 4.29Å; F82-L104 HydrophobicContact CZ-CD1 4.12Å; Y83-L104 HydrophobicContact CD2-CB 4.25Å; Y83-L104 WeakPolarHBondContact CE2-O 3.07Å; T86-L104 HydrophobicContact CG2-CD1 3.43Å; T86-L104 VanDerWaalsContact CG2-CD1 3.43Å; L104-R111 CarbonylContact C-O 3.49Å; L104-R111 VanDerWaalsContact CA-O 3.3Å; L104-R111 WeakPolarHBondContact CA-O 3.27Å; L104-Y112 HydrophobicContact CD2-CD1 4.19Å; L104-Y112 HydrophobicContact CD2-CE1 3.67Å; L104-Y112 HydrophobicContact CG-CE1 4.23Å; L104-M161 HydrophobicContact CD1-SD 4.31Å
105	A	77.6	Confident	67.2	Low	4 Å²	4	72.2 Å²	72.2	3%	0.033	37%	0.369	C	S	.	.			trans	-117.9	151.6	175.2	0	0	0	0	0	110.6	W79 S107 H110 R111	W79-A105 PolarHBondContact NE1-O 2.88Å; A105-S107 PolarHBondContact O-N 3.35Å; A105-H110 VanDerWaalsContact CB-O 3.28Å; A105-H110 WeakPolarHBondContact CB-O 3.19Å; A105-R111 PolarHBondContact N-O 3.41Å
106	P	73.4	Confident	67.4	Low	3 Å²	3	70 Å²	70	2%	0.019	36%	0.361	C	S	.	.	S	Bend	trans	-70.5	-10.9	-172.8	25.3	-33	0	0	0	114.5	I15 F24 L80 Y83	I15-P106 HydrophobicContact CD1-CG 3.39Å; F24-P106 HydrophobicContact CD1-CG 4.15Å; F24-P106 HydrophobicContact CE1-CB 3.97Å; F24-P106 HydrophobicContact CE1-CG 3.84Å; F24-P106 HydrophobicContact CZ-CB 4.45Å; F24-P106 HydrophobicContact CZ-CG 4.45Å; L80-P106 HydrophobicContact CD1-CB 3.92Å; Y83-P106 HydrophobicContact CD1-CB 3.78Å; Y83-P106 HydrophobicContact CE1-CB 3.72Å; Y83-P106 HydrophobicContact CE1-CG 4.22Å; Y83-P106 HydrophobicContact CE2-CB 4.49Å; Y83-P106 HydrophobicContact CG-CB 4.2Å
107	S	71.2	Confident	67.7	Low	4 Å²	4	72.4 Å²	72.4	3%	0.028	37%	0.37	C	S	.	.			trans	-94.5	135	178.1	170.9	0	0	0	0	111.3	C12 A105 G109 H110 R111	C12-S107 WeakPolarHBondContact O-CB 3.26Å; A105-S107 PolarHBondContact O-N 3.35Å; S107-G109 VanDerWaalsContact C-N 3.3Å; S107-G109 PolarHBondContact O-N 3.31Å; S107-G109 PolarHBondContact OG-N 2.66Å; S107-H110 CarbonylContact O-C 3.13Å; S107-H110 VanDerWaalsContact O-C 3.24Å; S107-H110 PolarHBondContact O-N 2.8Å; S107-R111 WeakPolarHBondContact O-CA 3.37Å; S107-R111 PolarHBondContact O-N 3.25Å
108	T	63.9	Low	68.4	Low	31 Å²	31	71.6 Å²	71.6	19%	0.19	37%	0.366	C	S	.	.	S	Bend	trans	-71	-23.8	173.9	51.5	0	0	0	0	113.5	D76 W79 R111	D76-T108 HydrophobicContact CB-CG2 4.33Å; D76-T108 WeakPolarHBondContact OD1-CB 3.27Å; D76-T108 WeakPolarHBondContact OD1-CG2 2.91Å; D76-T108 PolarHBondContact OD1-OG1 2.89Å; W79-T108 HydrophobicContact CB-CG2 3.57Å; W79-T108 HydrophobicContact CD2-CG2 4.21Å; W79-T108 HydrophobicContact CG-CG2 3.53Å; T108-R111 WeakPolarHBondContact O-CG 3.41Å
109	G	65.2	Low	69.1	Low	54 Å²	54	69.2 Å²	69.2	56%	0.557	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-24.1	176.7	0	0	0	0	0	113.8	S107	S107-G109 VanDerWaalsContact C-N 3.3Å; S107-G109 PolarHBondContact O-N 3.31Å; S107-G109 PolarHBondContact OG-N 2.66Å
110	H	69.3	Low	70.6	Confident	132 Å²	132	62.1 Å²	62.1	61%	0.611	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.7	77.7	173.2	-73.2	80.6	0	0	0	108.2	A105 S107 Y112	A105-H110 VanDerWaalsContact CB-O 3.28Å; A105-H110 WeakPolarHBondContact CB-O 3.19Å; S107-H110 CarbonylContact O-C 3.13Å; S107-H110 VanDerWaalsContact O-C 3.24Å; S107-H110 PolarHBondContact O-N 2.8Å; H110-Y112 PolarHBondContact O-N 2.95Å; H110-Y112 VanDerWaalsContact O-N 3.11Å
111	R	72.4	Confident	72	Confident	109 Å²	109	56 Å²	56	41%	0.411	29%	0.292	S	S	.	.			trans	-63.5	-18.7	-173.6	-66.4	-174.7	-175.9	-169.1	-2.1	113.9	W79 L104 A105 S107 T108	W79-R111 HydrophobicContact CH2-CB 4Å; W79-R111 HydrophobicContact CH2-CG 3.93Å; W79-R111 HydrophobicContact CZ2-CB 3.56Å; W79-R111 HydrophobicContact CZ2-CG 3.56Å; L104-R111 CarbonylContact C-O 3.49Å; L104-R111 VanDerWaalsContact CA-O 3.3Å; L104-R111 WeakPolarHBondContact CA-O 3.27Å; A105-R111 PolarHBondContact N-O 3.41Å; S107-R111 WeakPolarHBondContact O-CA 3.37Å; S107-R111 PolarHBondContact O-N 3.25Å; T108-R111 WeakPolarHBondContact O-CG 3.41Å
112	Y	74.8	Confident	73.2	Confident	131 Å²	131	63.2 Å²	63.2	51%	0.514	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.9	-172.4	-63.6	-71.8	0	0	0	111.2	Q102 M103 L104 H110	Q102-Y112 HydrophobicContact CB-CD1 3.99Å; Q102-Y112 HydrophobicContact CB-CG 4.26Å; M103-Y112 CarbonylContact O-C 3.55Å; M103-Y112 WeakPolarHBondContact O-CA 3.47Å; L104-Y112 HydrophobicContact CD2-CD1 4.19Å; L104-Y112 HydrophobicContact CD2-CE1 3.67Å; L104-Y112 HydrophobicContact CG-CE1 4.23Å; H110-Y112 PolarHBondContact O-N 2.95Å; H110-Y112 VanDerWaalsContact O-N 3.11Å
113	R	76.8	Confident	73.8	Confident	14 Å²	14	60.2 Å²	60.2	5%	0.053	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.9	171.5	65.4	177.2	-176.3	74.9	4.2	110.9	E21 M103 V115 E120	E21-R113 IonicContact OE2-CZ 3Å; E21-R113 IonicContact OE2-NE 3.83Å; E21-R113 IonicContact OE2-NH2 2.93Å; E21-R113 PolarHBondContact OE2-NH2 3.28Å; M103-R113 HydrophobicContact CB-CG 4.17Å; M103-R113 PolarHBondContact N-O 2.93Å; M103-R113 PolarHBondContact O-N 3.25Å; R113-V115 WeakPolarHBondContact O-CG2 3.01Å; R113-E120 IonicContact CZ-OE1 2.69Å; R113-E120 IonicContact NH1-OE1 3.36Å; R113-E120 PolarHBondContact NH1-OE1 3.48Å; R113-E120 IonicContact NH2-OE1 3.52Å; R113-E120 PolarHBondContact NH2-OE1 2.7Å; R113-E120 IonicContact NH2-OE2 2.79Å; R113-E120 PolarHBondContact NH2-OE2 3.27Å
114	N	68.5	Low	74.3	Confident	131 Å²	131	63.3 Å²	63.3	70%	0.701	31%	0.313	S	S	*	.			trans	-70.1	149.1	176.6	-68.9	-23.9	0	0	0	111.4
115	V	67.6	Low	74.7	Confident	42 Å²	42	68.3 Å²	68.3	26%	0.255	34%	0.34	S	S	.	.			trans	-122.7	132.6	-161.3	-173.4	0	0	0	0	111.8	S101 M103 R113 E120	S101-V115 WeakPolarHBondContact O-CB 3.45Å; S101-V115 WeakPolarHBondContact O-CG2 3.46Å; M103-V115 HydrophobicContact CB-CG2 3.7Å; M103-V115 HydrophobicContact CE-CG1 4.5Å; M103-V115 HydrophobicContact CG-CB 4.4Å; M103-V115 HydrophobicContact CG-CG1 4.05Å; M103-V115 HydrophobicContact CG-CG2 3.38Å; R113-V115 WeakPolarHBondContact O-CG2 3.01Å; V115-E120 HydrophobicContact CG1-CG 3.3Å
116	S	71.3	Confident	75.1	Confident	58 Å²	58	73.7 Å²	73.7	41%	0.406	36%	0.363	S	S	.	.			trans	-99.4	108.6	160.6	168.3	0	0	0	0	108.3	D118 E119 E120	S116-D118 PolarHBondContact O-N 3.09Å; S116-E119 PolarHBondContact O-N 2.89Å; S116-E120 PolarHBondContact O-N 3.1Å
117	K	70.7	Confident	75.7	Confident	84 Å²	84	73.6 Å²	73.6	37%	0.365	36%	0.362	S	S	.	.	H	α-helix	trans	-52.4	-40.8	-175.7	-173.7	170.5	-177.8	161.8	0	112.4	L96 N97 L121	L96-K117 WeakPolarHBondContact O-CE 3.26Å; L96-K117 PolarHBondContact O-NZ 3.19Å; N97-K117 PolarHBondContact OD1-NZ 3.29Å; K117-L121 HydrophobicContact CG-CD1 4.1Å; K117-L121 WeakPolarHBondContact O-CG 3.47Å; K117-L121 PolarHBondContact O-N 2.88Å; K117-L121 VanDerWaalsContact O-N 3.16Å
118	D	73.8	Confident	76.5	Confident	104 Å²	104	75.4 Å²	75.4	56%	0.556	37%	0.371	S	S	*	.	H	α-helix	trans	-72	-29.8	179.3	-66.6	-25	0	0	0	112.9	S116 R122	S116-D118 PolarHBondContact O-N 3.09Å; D118-R122 WeakPolarHBondContact O-CB 3.25Å; D118-R122 VanDerWaalsContact O-CG 3.3Å; D118-R122 WeakPolarHBondContact O-CG 3.41Å; D118-R122 PolarHBondContact O-N 3.44Å; D118-R122 PolarHBondContact O-NE 2.72Å
119	E	77.7	Confident	77.7	Confident	44 Å²	44	79.4 Å²	79.4	21%	0.206	39%	0.387	C	S	.	.	H	α-helix	trans	-77	-40.5	176.9	-165.7	168.8	-164.9	0	0	111.8	V18 K19 S116 M123	V18-E119 HydrophobicContact CG2-CG 4.42Å; K19-E119 WeakPolarHBondContact CE-OE1 3.49Å; S116-E119 PolarHBondContact O-N 2.89Å; E119-M123 PolarHBondContact O-N 3.39Å
120	E	80.6	Confident	78.6	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-60.8	-49.8	174.4	-66.1	-64	154.1	0	0	112.1	V18 R87 W91 M103 R113 V115 S116 R122 M123 K124	V18-E120 HydrophobicContact CG2-CG 4.14Å; V18-E120 WeakPolarHBondContact CG2-OE1 3.31Å; V18-E120 WeakPolarHBondContact CG2-OE2 3.23Å; R87-E120 IonicContact CZ-OE2 3.82Å; R87-E120 IonicContact NH2-OE2 2.7Å; R87-E120 PolarHBondContact NH2-OE2 2.98Å; W91-E120 HydrophobicContact CH2-CB 4.36Å; W91-E120 HydrophobicContact CZ3-CB 4.42Å; M103-E120 HydrophobicContact CG-CG 4.31Å; R113-E120 IonicContact CZ-OE1 2.69Å; R113-E120 IonicContact NH1-OE1 3.36Å; R113-E120 PolarHBondContact NH1-OE1 3.48Å; R113-E120 IonicContact NH2-OE1 3.52Å; R113-E120 PolarHBondContact NH2-OE1 2.7Å; R113-E120 IonicContact NH2-OE2 2.79Å; R113-E120 PolarHBondContact NH2-OE2 3.27Å; V115-E120 HydrophobicContact CG1-CG 3.3Å; S116-E120 PolarHBondContact O-N 3.1Å; E120-R122 VanDerWaalsContact C-N 3.3Å; E120-R122 PolarHBondContact O-N 3.48Å; E120-M123 PolarHBondContact O-N 2.91Å; E120-K124 WeakPolarHBondContact O-CB 3.45Å; E120-K124 PolarHBondContact O-N 3.45Å
121	L	79.4	Confident	79.5	Confident	83 Å²	83	71.2 Å²	71.2	44%	0.435	34%	0.336	S	S	.	.	H	α-helix	trans	-65.6	-33.8	-175.8	-73.9	170.5	0	0	0	112.3	L96 K117 M123	L96-L121 HydrophobicContact CD1-CD2 4.16Å; K117-L121 HydrophobicContact CG-CD1 4.1Å; K117-L121 WeakPolarHBondContact O-CG 3.47Å; K117-L121 PolarHBondContact O-N 2.88Å; K117-L121 VanDerWaalsContact O-N 3.16Å; L121-M123 VanDerWaalsContact C-N 3.35Å
122	R	82.6	Confident	80.3	Confident	185 Å²	185	68.7 Å²	68.7	70%	0.698	33%	0.333	S	S	*	.	H	α-helix	trans	-69.9	-30.8	176.5	-79.5	-177.5	-70.3	-155.7	-0.8	113.4	D118 E120	D118-R122 WeakPolarHBondContact O-CB 3.25Å; D118-R122 VanDerWaalsContact O-CG 3.3Å; D118-R122 WeakPolarHBondContact O-CG 3.41Å; D118-R122 PolarHBondContact O-N 3.44Å; D118-R122 PolarHBondContact O-NE 2.72Å; E120-R122 VanDerWaalsContact C-N 3.3Å; E120-R122 PolarHBondContact O-N 3.48Å
123	M	81.5	Confident	80.7	Confident	34 Å²	34	66.5 Å²	66.5	17%	0.167	33%	0.327	C	S	.	.	H	α-helix	trans	-103.2	-7.2	-174.8	-65	-65.1	-75.5	0	0	112.9	V18 L22 E119 E120 L121 D125 K126 V127	V18-M123 HydrophobicContact CB-CB 4.44Å; V18-M123 HydrophobicContact CG1-CB 3.52Å; V18-M123 HydrophobicContact CG1-CG 4.15Å; L22-M123 HydrophobicContact CD1-CE 4.21Å; E119-M123 PolarHBondContact O-N 3.39Å; E120-M123 PolarHBondContact O-N 2.91Å; L121-M123 VanDerWaalsContact C-N 3.35Å; M123-D125 PolarHBondContact O-N 3.45Å; M123-K126 HydrophobicContact CE-CD 4.16Å; M123-K126 PolarHBondContact O-N 3.28Å; M123-K126 VanDerWaalsContact O-N 3.08Å; M123-K126 HydrophobicContact SD-CD 4.27Å; M123-V127 PolarHBondContact O-N 3.4Å
124	K	84.4	Confident	81	Confident	64 Å²	64	66.2 Å²	66.2	28%	0.278	33%	0.327	S	S	.	.	H	α-helix	trans	-45.5	-53.7	-179.4	173.3	172.6	177.6	-180	0	113.1	W91 E120 K126 V127 I128	W91-K124 HydrophobicContact CD2-CD 3.84Å; W91-K124 HydrophobicContact CD2-CG 4.08Å; W91-K124 HydrophobicContact CE3-CD 3.9Å; W91-K124 HydrophobicContact CE3-CG 4.37Å; W91-K124 HydrophobicContact CG-CD 4.36Å; W91-K124 HydrophobicContact CH2-CB 3.96Å; W91-K124 HydrophobicContact CH2-CD 4.32Å; W91-K124 HydrophobicContact CH2-CG 4Å; W91-K124 HydrophobicContact CZ2-CB 4.01Å; W91-K124 HydrophobicContact CZ2-CD 4.29Å; W91-K124 HydrophobicContact CZ2-CG 3.69Å; W91-K124 HydrophobicContact CZ3-CB 4.47Å; W91-K124 HydrophobicContact CZ3-CD 4.14Å; W91-K124 HydrophobicContact CZ3-CG 4.32Å; E120-K124 WeakPolarHBondContact O-CB 3.45Å; E120-K124 PolarHBondContact O-N 3.45Å; K124-K126 VanDerWaalsContact C-N 3.28Å; K124-K126 PolarHBondContact O-N 3.16Å; K124-V127 PolarHBondContact O-N 2.89Å; K124-I128 HydrophobicContact CD-CD1 4.34Å; K124-I128 HydrophobicContact CG-CD1 3.66Å; K124-I128 HydrophobicContact CG-CG1 4.37Å; K124-I128 WeakPolarHBondContact O-CG1 3.42Å; K124-I128 PolarHBondContact O-N 3.07Å
125	D	85.2	Confident	81.8	Confident	123 Å²	123	60.3 Å²	60.3	66%	0.658	30%	0.295	S	S	*	.	H	α-helix	trans	-62.3	-36.9	-175.6	-65	-22.4	0	0	0	112	M123 Q129	M123-D125 PolarHBondContact O-N 3.45Å; D125-Q129 WeakPolarHBondContact O-CB 3.4Å; D125-Q129 PolarHBondContact O-N 3.22Å
126	K	86.4	Confident	82.5	Confident	117 Å²	117	66.4 Å²	66.4	51%	0.509	32%	0.315	S	S	.	.	H	α-helix	trans	-71.2	-39.1	177.2	-61.7	-176.1	177.3	-179.3	0	112.1	L22 M123 K124 Q129 T130	L22-K126 HydrophobicContact CD1-CB 3.51Å; M123-K126 HydrophobicContact CE-CD 4.16Å; M123-K126 PolarHBondContact O-N 3.28Å; M123-K126 VanDerWaalsContact O-N 3.08Å; M123-K126 HydrophobicContact SD-CD 4.27Å; K124-K126 VanDerWaalsContact C-N 3.28Å; K124-K126 PolarHBondContact O-N 3.16Å; K126-Q129 PolarHBondContact O-N 2.91Å; K126-T130 PolarHBondContact O-N 2.9Å; K126-T130 PolarHBondContact O-OG1 2.86Å
127	V	86.5	Confident	82.7	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.9	-45.7	174.7	174.6	0	0	0	0	110	V18 L22 L25 R87 M123 K124 Q129 T130 T131	V18-V127 HydrophobicContact CG1-CG2 3.87Å; L22-V127 HydrophobicContact CD1-CG2 3.81Å; L25-V127 HydrophobicContact CD1-CG1 4.3Å; R87-V127 HydrophobicContact CB-CG1 4.22Å; M123-V127 PolarHBondContact O-N 3.4Å; K124-V127 PolarHBondContact O-N 2.89Å; V127-Q129 PolarHBondContact O-N 3.06Å; V127-T130 PolarHBondContact O-N 3.25Å; V127-T131 HydrophobicContact CG1-CG2 4.33Å; V127-T131 WeakPolarHBondContact O-CB 3.29Å; V127-T131 WeakPolarHBondContact O-CG2 3.46Å; V127-T131 PolarHBondContact O-N 3.14Å; V127-T131 PolarHBondContact O-OG1 2.84Å
128	I	87.8	Confident	82.9	Confident	43 Å²	43	61.2 Å²	61.2	22%	0.221	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-45.8	177.2	-68.4	171.1	0	0	0	110.3	K124 T130 T131 T132	K124-I128 HydrophobicContact CD-CD1 4.34Å; K124-I128 HydrophobicContact CG-CD1 3.66Å; K124-I128 HydrophobicContact CG-CG1 4.37Å; K124-I128 WeakPolarHBondContact O-CG1 3.42Å; K124-I128 PolarHBondContact O-N 3.07Å; I128-T130 PolarHBondContact O-N 3.37Å; I128-T131 WeakPolarHBondContact CA-OG1 3.24Å; I128-T131 PolarHBondContact O-N 3.11Å; I128-T131 PolarHBondContact O-OG1 3.48Å; I128-T131 VanDerWaalsContact O-OG1 3.11Å; I128-T132 VanDerWaalsContact O-CB 3.24Å; I128-T132 WeakPolarHBondContact O-CB 3.33Å; I128-T132 PolarHBondContact O-N 3.12Å; I128-T132 PolarHBondContact O-OG1 3.37Å
129	Q	89.1	Confident	82.8	Confident	114 Å²	114	60.2 Å²	60.2	53%	0.533	28%	0.275	S	S	.	.	H	α-helix	trans	-58.5	-51.3	178.2	-176.4	179.6	-4.2	0	0	111.5	D125 K126 V127 T131 T132 E133	D125-Q129 WeakPolarHBondContact O-CB 3.4Å; D125-Q129 PolarHBondContact O-N 3.22Å; K126-Q129 PolarHBondContact O-N 2.91Å; V127-Q129 PolarHBondContact O-N 3.06Å; Q129-T131 PolarHBondContact O-N 2.92Å; Q129-T132 PolarHBondContact O-N 2.92Å; Q129-E133 PolarHBondContact NE2-OE1 2.75Å; Q129-E133 WeakPolarHBondContact O-CG 3.15Å; Q129-E133 PolarHBondContact O-N 2.93Å
130	T	85.2	Confident	82.5	Confident	15 Å²	15	61.4 Å²	61.4	9%	0.092	29%	0.288	C	S	.	.	H	α-helix	trans	-65	-42.5	-177.1	-45.4	0	0	0	0	111.5	L25 L29 K126 V127 I128 E133 I134	L25-T130 HydrophobicContact CB-CG2 3.77Å; L29-T130 HydrophobicContact CD2-CG2 4.23Å; K126-T130 PolarHBondContact O-N 2.9Å; K126-T130 PolarHBondContact O-OG1 2.86Å; V127-T130 PolarHBondContact O-N 3.25Å; I128-T130 PolarHBondContact O-N 3.37Å; T130-E133 PolarHBondContact O-N 3.37Å; T130-I134 HydrophobicContact CG2-CD1 4.44Å; T130-I134 WeakPolarHBondContact O-CG1 3.29Å; T130-I134 PolarHBondContact O-N 3.47Å; T130-I134 VanDerWaalsContact O-N 3.14Å
131	T	88	Confident	82	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.4	-35.7	177.1	51.5	0	0	0	0	112.2	L25 L84 R87 V127 I128 Q129 I134 I135	L25-T131 HydrophobicContact CD1-CG2 3.73Å; L25-T131 HydrophobicContact CD2-CG2 4.18Å; L84-T131 HydrophobicContact CD2-CG2 3.94Å; R87-T131 HydrophobicContact CB-CG2 4.18Å; V127-T131 HydrophobicContact CG1-CG2 4.33Å; V127-T131 WeakPolarHBondContact O-CB 3.29Å; V127-T131 WeakPolarHBondContact O-CG2 3.46Å; V127-T131 PolarHBondContact O-N 3.14Å; V127-T131 PolarHBondContact O-OG1 2.84Å; I128-T131 WeakPolarHBondContact CA-OG1 3.24Å; I128-T131 PolarHBondContact O-N 3.11Å; I128-T131 PolarHBondContact O-OG1 3.48Å; I128-T131 VanDerWaalsContact O-OG1 3.11Å; Q129-T131 PolarHBondContact O-N 2.92Å; T131-I134 PolarHBondContact O-N 3.03Å; T131-I135 VanDerWaalsContact O-CG1 3.28Å; T131-I135 WeakPolarHBondContact O-CG1 3.49Å; T131-I135 PolarHBondContact O-N 3.16Å
132	T	87.8	Confident	81.4	Confident	56 Å²	56	61.3 Å²	61.3	34%	0.344	29%	0.291	S	S	.	.	H	α-helix	trans	-62	-43	174	-58.9	0	0	0	0	111.4	C88 I128 Q129 I134 I135 Y136	C88-T132 PolarHBondContact SG-OG1 2.85Å; C88-T132 VanDerWaalsContact SG-OG1 3.37Å; I128-T132 VanDerWaalsContact O-CB 3.24Å; I128-T132 WeakPolarHBondContact O-CB 3.33Å; I128-T132 PolarHBondContact O-N 3.12Å; I128-T132 PolarHBondContact O-OG1 3.37Å; Q129-T132 PolarHBondContact O-N 2.92Å; T132-I134 VanDerWaalsContact C-N 3.34Å; T132-I134 PolarHBondContact O-N 3.37Å; T132-I135 PolarHBondContact O-N 3.33Å; T132-Y136 WeakPolarHBondContact O-CB 3.44Å; T132-Y136 PolarHBondContact O-N 2.89Å
133	E	84.3	Confident	81	Confident	85 Å²	85	53 Å²	53	40%	0.397	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-40	176.9	-72.4	175.9	-161.5	0	0	111.6	L29 Q129 T130 Y136 L137	L29-E133 HydrophobicContact CD1-CB 4.1Å; L29-E133 HydrophobicContact CD2-CB 4.05Å; L29-E133 WeakPolarHBondContact CD2-OE2 3.34Å; Q129-E133 PolarHBondContact NE2-OE1 2.75Å; Q129-E133 WeakPolarHBondContact O-CG 3.15Å; Q129-E133 PolarHBondContact O-N 2.93Å; T130-E133 PolarHBondContact O-N 3.37Å; E133-Y136 PolarHBondContact O-N 2.98Å; E133-L137 WeakPolarHBondContact O-CB 3.42Å; E133-L137 PolarHBondContact O-N 3.29Å
134	I	82.8	Confident	80.8	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.036	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-45.8	174.4	-62.9	164.3	0	0	0	111	L25 L28 L29 L84 T130 T131 T132 Y136 L137 I138	L25-I134 HydrophobicContact CB-CD1 4.39Å; L25-I134 HydrophobicContact CD2-CD1 3.9Å; L28-I134 HydrophobicContact CD2-CD1 4.27Å; L29-I134 HydrophobicContact CB-CD1 4.42Å; L29-I134 HydrophobicContact CB-CG1 4.05Å; L29-I134 HydrophobicContact CD1-CG1 3.97Å; L84-I134 HydrophobicContact CD1-CG2 3.68Å; L84-I134 HydrophobicContact CD2-CD1 4.14Å; L84-I134 HydrophobicContact CD2-CG2 4.26Å; T130-I134 HydrophobicContact CG2-CD1 4.44Å; T130-I134 WeakPolarHBondContact O-CG1 3.29Å; T130-I134 PolarHBondContact O-N 3.47Å; T130-I134 VanDerWaalsContact O-N 3.14Å; T131-I134 PolarHBondContact O-N 3.03Å; T132-I134 VanDerWaalsContact C-N 3.34Å; T132-I134 PolarHBondContact O-N 3.37Å; I134-Y136 VanDerWaalsContact C-N 3.3Å; I134-Y136 PolarHBondContact O-N 3.46Å; I134-L137 WeakPolarHBondContact O-CB 3.33Å; I134-L137 PolarHBondContact O-N 3.21Å; I134-L137 VanDerWaalsContact O-N 3.13Å; I134-I138 HydrophobicContact CG2-CD1 4.27Å; I134-I138 WeakPolarHBondContact O-CG1 3.38Å; I134-I138 PolarHBondContact O-N 2.83Å
135	I	85.3	Confident	80.4	Confident	8 Å²	8	49.4 Å²	49.4	4%	0.041	25%	0.246	C	C	.	.	H	α-helix	trans	-61.5	-40.4	177.5	-69.2	166.9	0	0	0	110.7	L84 F85 C88 Y89 T131 T132 L137 I138 R139	L84-I135 HydrophobicContact CB-CG1 4.4Å; F85-I135 HydrophobicContact CD1-CD1 4.42Å; F85-I135 HydrophobicContact CD2-CD1 4.19Å; F85-I135 HydrophobicContact CD2-CG1 4.34Å; F85-I135 HydrophobicContact CE1-CG2 4.38Å; F85-I135 HydrophobicContact CE2-CD1 4.31Å; F85-I135 HydrophobicContact CE2-CG1 4.13Å; F85-I135 HydrophobicContact CE2-CG2 4.22Å; F85-I135 HydrophobicContact CG-CD1 4.26Å; F85-I135 HydrophobicContact CZ-CD1 4.47Å; F85-I135 HydrophobicContact CZ-CG1 4.46Å; F85-I135 HydrophobicContact CZ-CG2 3.82Å; C88-I135 HydrophobicContact CB-CD1 3.76Å; Y89-I135 HydrophobicContact CE2-CD1 4.17Å; T131-I135 VanDerWaalsContact O-CG1 3.28Å; T131-I135 WeakPolarHBondContact O-CG1 3.49Å; T131-I135 PolarHBondContact O-N 3.16Å; T132-I135 PolarHBondContact O-N 3.33Å; I135-L137 VanDerWaalsContact C-N 3.32Å; I135-L137 PolarHBondContact O-N 3.46Å; I135-I138 PolarHBondContact O-N 3.49Å; I135-R139 PolarHBondContact O-N 2.89Å
136	Y	81.7	Confident	79.8	Confident	169 Å²	169	46.4 Å²	46.4	66%	0.663	24%	0.238	S	C	*	.	H	α-helix	trans	-62	-41	174.7	-177.4	-96.3	0	0	0	111.6	T132 E133 I134 R139 S140	T132-Y136 WeakPolarHBondContact O-CB 3.44Å; T132-Y136 PolarHBondContact O-N 2.89Å; E133-Y136 PolarHBondContact O-N 2.98Å; I134-Y136 VanDerWaalsContact C-N 3.3Å; I134-Y136 PolarHBondContact O-N 3.46Å; Y136-R139 WeakPolarHBondContact O-CB 3.47Å; Y136-R139 PolarHBondContact O-N 3.33Å; Y136-S140 PolarHBondContact O-N 3.44Å
137	L	76.8	Confident	79.4	Confident	14 Å²	14	40.8 Å²	40.8	7%	0.073	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-41.4	175.8	-164.3	142.2	0	0	0	111.5	A32 T33 F56 E133 I134 I135 R139 S140 L141	A32-L137 HydrophobicContact CB-CD1 3.94Å; A32-L137 HydrophobicContact CB-CD2 3.96Å; T33-L137 HydrophobicContact CG2-CD1 3.81Å; F56-L137 HydrophobicContact CD2-CD2 4.34Å; F56-L137 HydrophobicContact CE2-CD2 3.98Å; F56-L137 HydrophobicContact CZ-CD2 4.11Å; E133-L137 WeakPolarHBondContact O-CB 3.42Å; E133-L137 PolarHBondContact O-N 3.29Å; I134-L137 WeakPolarHBondContact O-CB 3.33Å; I134-L137 PolarHBondContact O-N 3.21Å; I134-L137 VanDerWaalsContact O-N 3.13Å; I135-L137 VanDerWaalsContact C-N 3.32Å; I135-L137 PolarHBondContact O-N 3.46Å; L137-R139 VanDerWaalsContact C-N 3.3Å; L137-R139 PolarHBondContact O-N 3.33Å; L137-S140 PolarHBondContact O-N 2.95Å; L137-S140 VanDerWaalsContact O-N 3.11Å; L137-S140 PolarHBondContact O-OG 3.26Å; L137-L141 PolarHBondContact O-N 2.94Å
138	I	74	Confident	79.1	Confident	19 Å²	19	40.9 Å²	40.9	10%	0.097	21%	0.214	C	C	.	.	H	α-helix	trans	-58.1	-43.5	171.9	-65.7	167.9	0	0	0	110.6	V81 L84 I134 I135 S140 L141	V81-I138 HydrophobicContact CG2-CD1 4.49Å; L84-I138 HydrophobicContact CD1-CD1 4.05Å; I134-I138 HydrophobicContact CG2-CD1 4.27Å; I134-I138 WeakPolarHBondContact O-CG1 3.38Å; I134-I138 PolarHBondContact O-N 2.83Å; I135-I138 PolarHBondContact O-N 3.49Å; I138-S140 VanDerWaalsContact C-N 3.26Å; I138-S140 PolarHBondContact O-N 3.37Å; I138-L141 WeakPolarHBondContact O-CB 3.32Å; I138-L141 PolarHBondContact O-N 3.19Å
139	R	72.5	Confident	78.9	Confident	83 Å²	83	44.2 Å²	44.2	31%	0.313	23%	0.227	S	C	.	.	H	α-helix	trans	-67.6	-23.9	178.2	-174.5	174.9	166.6	139.2	0.8	113.4	I135 Y136 L137 L141 D174 W175	I135-R139 PolarHBondContact O-N 2.89Å; Y136-R139 WeakPolarHBondContact O-CB 3.47Å; Y136-R139 PolarHBondContact O-N 3.33Å; L137-R139 VanDerWaalsContact C-N 3.3Å; L137-R139 PolarHBondContact O-N 3.33Å; R139-L141 VanDerWaalsContact C-N 3.29Å; R139-D174 IonicContact CZ-OD2 3.47Å; R139-D174 IonicContact NH1-OD2 3.45Å; R139-D174 PolarHBondContact NH1-OD2 3.45Å; R139-D174 IonicContact NH2-OD2 2.69Å; R139-W175 PolarHBondContact O-NE1 2.92Å
140	S	71.2	Confident	78.5	Confident	69 Å²	69	39 Å²	39	48%	0.483	20%	0.203	S	C	.	.	H	α-helix	trans	-79.2	-11	176.2	74.4	0	0	0	0	113.8	Y136 L137 I138	Y136-S140 PolarHBondContact O-N 3.44Å; L137-S140 PolarHBondContact O-N 2.95Å; L137-S140 VanDerWaalsContact O-N 3.11Å; L137-S140 PolarHBondContact O-OG 3.26Å; I138-S140 VanDerWaalsContact C-N 3.26Å; I138-S140 PolarHBondContact O-N 3.37Å
141	L	69.3	Low	78.6	Confident	18 Å²	18	38.7 Å²	38.7	9%	0.094	20%	0.2	C	C	.	.	S	Bend	trans	-69.3	146.2	174.4	-61.5	171.3	0	0	0	110.1	F56 F57 L137 I138 R139 W175	F56-L141 HydrophobicContact CB-CD2 4.25Å; F56-L141 HydrophobicContact CD1-CD1 3.66Å; F56-L141 HydrophobicContact CD1-CD2 4.47Å; F56-L141 HydrophobicContact CE1-CD1 4.16Å; F56-L141 HydrophobicContact CG-CD1 4.46Å; F57-L141 HydrophobicContact CE2-CD1 3.89Å; F57-L141 HydrophobicContact CZ-CD1 4.37Å; L137-L141 PolarHBondContact O-N 2.94Å; I138-L141 WeakPolarHBondContact O-CB 3.32Å; I138-L141 PolarHBondContact O-N 3.19Å; R139-L141 VanDerWaalsContact C-N 3.29Å; L141-W175 PolarHBondContact O-NE1 3.38Å
142	P	67.4	Low	78.5	Confident	64 Å²	64	39.5 Å²	39.5	42%	0.416	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-59.6	165.1	172.6	-6	13.6	0	0	0	111.4	M53 W175	M53-P142 HydrophobicContact CB-CG 4.37Å; M53-P142 VanDerWaalsContact CE-CA 3.5Å; M53-P142 HydrophobicContact CE-CB 3.28Å; M53-P142 HydrophobicContact CE-CG 3.54Å; M53-P142 WeakPolarHBondContact CE-O 3.38Å; M53-P142 HydrophobicContact CG-CB 4.42Å; M53-P142 HydrophobicContact CG-CG 3.72Å; M53-P142 HydrophobicContact SD-CB 3.51Å; M53-P142 VanDerWaalsContact SD-CB 3.51Å; M53-P142 HydrophobicContact SD-CG 3.4Å; M53-P142 WeakPolarHBondContact SD-CG 3.22Å; P142-W175 WeakPolarHBondContact O-CZ2 3.45Å
143	L	74.7	Confident	78.4	Confident	10 Å²	10	38.5 Å²	38.5	5%	0.052	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-70.6	133.3	-178.1	-170.8	64.4	0	0	0	111.4	L148 W175 L176 L180 P207 M215	L143-L148 HydrophobicContact CD1-CD1 3.97Å; L143-L148 HydrophobicContact CD1-CD2 4.48Å; L143-L148 HydrophobicContact CD1-CG 4.21Å; L143-W175 HydrophobicContact CD1-CD2 4.33Å; L143-W175 HydrophobicContact CD1-CE3 4.24Å; L143-W175 HydrophobicContact CD1-CZ3 4.37Å; L143-L176 HydrophobicContact CD1-CD1 4.22Å; L143-L176 HydrophobicContact CD2-CD1 3.97Å; L143-L180 HydrophobicContact CD2-CD2 4.48Å; L143-L180 HydrophobicContact CD2-CG 4.48Å; L143-P207 HydrophobicContact CB-CG 4.48Å; L143-P207 HydrophobicContact CG-CG 4.3Å; L143-P207 WeakPolarHBondContact O-CG 3.15Å; L143-M215 HydrophobicContact CD2-CE 3.76Å; L143-M215 HydrophobicContact CG-CE 4.31Å
144	S	76.7	Confident	78.4	Confident	11 Å²	11	34.4 Å²	34.4	8%	0.077	18%	0.181	C	C	.	.			trans	-138.6	150.2	173.9	60.3	0	0	0	0	112.2	G147 L148	S144-G147 PolarHBondContact O-N 2.86Å; S144-G147 PolarHBondContact OG-N 3.46Å; S144-L148 PolarHBondContact O-N 3.31Å
145	L	75.5	Confident	78.6	Confident	12 Å²	12	34.2 Å²	34.2	6%	0.063	18%	0.18	C	C	.	.	H	α-helix	trans	-66.7	-42.5	177.8	-175.3	68.6	0	0	0	111.1	G147 L148 K149 D209 M215 T218	L145-G147 VanDerWaalsContact C-N 3.34Å; L145-G147 PolarHBondContact O-N 3.26Å; L145-L148 PolarHBondContact O-N 2.78Å; L145-K149 WeakPolarHBondContact O-CG 3.42Å; L145-K149 PolarHBondContact O-N 3.36Å; L145-D209 WeakPolarHBondContact CB-OD2 3.4Å; L145-D209 PolarHBondContact N-OD1 3.37Å; L145-D209 PolarHBondContact N-OD2 3.46Å; L145-M215 HydrophobicContact CD1-SD 4.12Å; L145-T218 HydrophobicContact CD1-CG2 4.14Å; L145-T218 VanDerWaalsContact CD1-OG1 3.25Å; L145-T218 WeakPolarHBondContact CD1-OG1 3.47Å
146	A	74	Confident	78.7	Confident	60 Å²	60	37.1 Å²	37.1	50%	0.496	20%	0.195	S	C	.	.	H	α-helix	trans	-59.3	-43.7	176.5	0	0	0	0	0	112	L148 K149 M150 D209	A146-L148 PolarHBondContact O-N 3.31Å; A146-K149 PolarHBondContact O-N 3.33Å; A146-M150 WeakPolarHBondContact O-CB 3.38Å; A146-M150 PolarHBondContact O-N 2.98Å; A146-D209 PolarHBondContact N-OD2 3.25Å; A146-D209 VanDerWaalsContact N-OD2 3.09Å
147	G	76.4	Confident	78.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.4	-37.3	178.6	0	0	0	0	0	113.5	S144 L145 M150 L151	S144-G147 PolarHBondContact O-N 2.86Å; S144-G147 PolarHBondContact OG-N 3.46Å; L145-G147 VanDerWaalsContact C-N 3.34Å; L145-G147 PolarHBondContact O-N 3.26Å; G147-M150 PolarHBondContact O-N 3.38Å; G147-L151 PolarHBondContact O-N 3.38Å; G147-L151 VanDerWaalsContact O-N 3.11Å
148	L	80.5	Confident	79.2	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-67.5	-43.5	174.9	-78	168.7	0	0	0	112.2	L143 S144 L145 A146 M150 L151 I152 W175 L176 M215 T218	L143-L148 HydrophobicContact CD1-CD1 3.97Å; L143-L148 HydrophobicContact CD1-CD2 4.48Å; L143-L148 HydrophobicContact CD1-CG 4.21Å; S144-L148 PolarHBondContact O-N 3.31Å; L145-L148 PolarHBondContact O-N 2.78Å; A146-L148 PolarHBondContact O-N 3.31Å; L148-M150 VanDerWaalsContact C-N 3.26Å; L148-M150 PolarHBondContact O-N 2.98Å; L148-L151 PolarHBondContact O-N 2.7Å; L148-I152 WeakPolarHBondContact O-CG1 3.47Å; L148-I152 PolarHBondContact O-N 3.12Å; L148-W175 HydrophobicContact CD2-CE3 4.03Å; L148-W175 HydrophobicContact CD2-CZ3 4.15Å; L148-W175 HydrophobicContact CG-CE3 4.39Å; L148-W175 HydrophobicContact CG-CZ3 4.04Å; L148-L176 HydrophobicContact CD1-CD1 4.01Å; L148-L176 HydrophobicContact CD2-CB 4.22Å; L148-M215 HydrophobicContact CD1-CE 3.5Å; L148-M215 HydrophobicContact CD1-SD 3.99Å; L148-T218 HydrophobicContact CB-CG2 4.01Å
149	K	82.8	Confident	79.5	Confident	112 Å²	112	40.3 Å²	40.3	49%	0.487	21%	0.209	S	C	.	.	H	α-helix	trans	-60.5	-39.1	175.8	-74.7	-178.1	175.6	-178.2	0	111.7	L145 A146 I152 S153 T218	L145-K149 WeakPolarHBondContact O-CG 3.42Å; L145-K149 PolarHBondContact O-N 3.36Å; A146-K149 PolarHBondContact O-N 3.33Å; K149-I152 PolarHBondContact O-N 2.84Å; K149-S153 WeakPolarHBondContact O-CB 3.31Å; K149-S153 PolarHBondContact O-N 3.47Å; K149-T218 HydrophobicContact CG-CG2 3.86Å
150	M	82.7	Confident	79.8	Confident	6 Å²	6	39.5 Å²	39.5	3%	0.03	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-44.9	175.5	175.7	-162.6	69.1	0	0	112.2	F57 L77 D78 V81 A146 G147 L148 S153 S154	F57-M150 HydrophobicContact CE1-CE 4.11Å; F57-M150 HydrophobicContact CE1-SD 3.78Å; F57-M150 HydrophobicContact CZ-CE 4.06Å; F57-M150 HydrophobicContact CZ-SD 4.33Å; L77-M150 HydrophobicContact CD2-CG 3.99Å; L77-M150 HydrophobicContact CD2-SD 3.37Å; L77-M150 WeakPolarHBondContact CD2-SD 3.49Å; L77-M150 HydrophobicContact CG-CG 4.31Å; L77-M150 HydrophobicContact CG-SD 3.66Å; D78-M150 VanDerWaalsContact OD1-CA 3.24Å; D78-M150 WeakPolarHBondContact OD1-CA 3.28Å; D78-M150 VanDerWaalsContact OD1-CG 3.31Å; D78-M150 WeakPolarHBondContact OD1-CG 3.19Å; V81-M150 HydrophobicContact CB-CE 4.5Å; V81-M150 HydrophobicContact CB-CG 4.48Å; V81-M150 HydrophobicContact CB-SD 4.38Å; V81-M150 HydrophobicContact CG1-CE 4.38Å; V81-M150 HydrophobicContact CG2-CE 3.73Å; V81-M150 HydrophobicContact CG2-CG 4.21Å; V81-M150 HydrophobicContact CG2-SD 3.51Å; V81-M150 VanDerWaalsContact CG2-SD 3.51Å; A146-M150 WeakPolarHBondContact O-CB 3.38Å; A146-M150 PolarHBondContact O-N 2.98Å; G147-M150 PolarHBondContact O-N 3.38Å; L148-M150 VanDerWaalsContact C-N 3.26Å; L148-M150 PolarHBondContact O-N 2.98Å; M150-S153 PolarHBondContact O-N 2.98Å; M150-S154 WeakPolarHBondContact O-CB 3.4Å; M150-S154 PolarHBondContact O-N 3.45Å; M150-S154 PolarHBondContact O-OG 2.8Å
151	L	85.6	Confident	80.4	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-41.4	175.9	-73	170.2	0	0	0	112	V81 F85 G147 L148 S154 M155 I168 A172 W175	V81-L151 HydrophobicContact CG1-CD2 3.91Å; F85-L151 HydrophobicContact CE2-CD2 4.23Å; G147-L151 PolarHBondContact O-N 3.38Å; G147-L151 VanDerWaalsContact O-N 3.11Å; L148-L151 PolarHBondContact O-N 2.7Å; L151-S154 WeakPolarHBondContact O-CB 3.39Å; L151-S154 PolarHBondContact O-N 3.14Å; L151-M155 WeakPolarHBondContact O-CG 3.46Å; L151-M155 PolarHBondContact O-N 3.14Å; L151-I168 HydrophobicContact CB-CG2 4.44Å; L151-I168 HydrophobicContact CD2-CG2 4.07Å; L151-A172 HydrophobicContact CB-CB 4.1Å; L151-A172 HydrophobicContact CD1-CB 3.94Å; L151-W175 HydrophobicContact CD1-CE3 3.73Å; L151-W175 HydrophobicContact CD1-CZ3 4.03Å
152	I	86.6	Confident	81.2	Confident	17 Å²	17	38.6 Å²	38.6	9%	0.087	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-44.5	175.3	-68.9	166.5	0	0	0	110.8	L148 K149 S154 M155 N156 T218 L222 N225	L148-I152 WeakPolarHBondContact O-CG1 3.47Å; L148-I152 PolarHBondContact O-N 3.12Å; K149-I152 PolarHBondContact O-N 2.84Å; I152-S154 VanDerWaalsContact C-N 3.34Å; I152-S154 PolarHBondContact O-N 3.47Å; I152-M155 WeakPolarHBondContact O-CB 3.2Å; I152-M155 PolarHBondContact O-N 3.02Å; I152-N156 PolarHBondContact O-N 2.9Å; I152-N156 VanDerWaalsContact O-N 3.09Å; I152-N156 PolarHBondContact O-ND2 3.08Å; I152-T218 HydrophobicContact CD1-CG2 3.63Å; I152-T218 WeakPolarHBondContact CD1-O 3.47Å; I152-L222 HydrophobicContact CD1-CB 3.93Å; I152-L222 HydrophobicContact CG1-CB 4.11Å; I152-L222 HydrophobicContact CG1-CD1 4.06Å; I152-N225 WeakPolarHBondContact CG2-ND2 3.47Å
153	S	85.3	Confident	82.1	Confident	35 Å²	35	38.3 Å²	38.3	25%	0.245	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-42.2	176.2	-169.7	0	0	0	0	111.6	D78 K149 M150 M155 N156 L157	D78-S153 VanDerWaalsContact CG-OG 3.23Å; D78-S153 WeakPolarHBondContact OD2-CB 3.49Å; D78-S153 PolarHBondContact OD2-OG 3.38Å; K149-S153 WeakPolarHBondContact O-CB 3.31Å; K149-S153 PolarHBondContact O-N 3.47Å; M150-S153 PolarHBondContact O-N 2.98Å; S153-M155 VanDerWaalsContact C-N 3.32Å; S153-M155 PolarHBondContact O-N 3.36Å; S153-N156 CarbonylContact O-C 3.57Å; S153-N156 WeakPolarHBondContact O-CA 3.44Å; S153-N156 WeakPolarHBondContact O-CB 3.41Å; S153-N156 PolarHBondContact O-N 3.5Å; S153-L157 WeakPolarHBondContact O-CG 3.4Å; S153-L157 PolarHBondContact O-N 3.1Å
154	S	85.8	Confident	82.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-38.1	174.8	-56.4	0	0	0	0	112.5	D78 M150 L151 I152 N156 L157 A158	D78-S154 PolarHBondContact O-OG 2.97Å; M150-S154 WeakPolarHBondContact O-CB 3.4Å; M150-S154 PolarHBondContact O-N 3.45Å; M150-S154 PolarHBondContact O-OG 2.8Å; L151-S154 WeakPolarHBondContact O-CB 3.39Å; L151-S154 PolarHBondContact O-N 3.14Å; I152-S154 VanDerWaalsContact C-N 3.34Å; I152-S154 PolarHBondContact O-N 3.47Å; S154-N156 VanDerWaalsContact C-N 3.32Å; S154-L157 PolarHBondContact O-N 3.4Å; S154-A158 PolarHBondContact O-N 2.93Å
155	M	86.8	Confident	83.4	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-61.7	-41.4	172	-70.2	173	56.4	0	0	111.5	L151 I152 S153 L157 A158 R165 I168 A169 L222 N225	L151-M155 WeakPolarHBondContact O-CG 3.46Å; L151-M155 PolarHBondContact O-N 3.14Å; I152-M155 WeakPolarHBondContact O-CB 3.2Å; I152-M155 PolarHBondContact O-N 3.02Å; S153-M155 VanDerWaalsContact C-N 3.32Å; S153-M155 PolarHBondContact O-N 3.36Å; M155-L157 VanDerWaalsContact C-N 3.33Å; M155-A158 PolarHBondContact O-N 3.38Å; M155-R165 HydrophobicContact CB-CG 4.31Å; M155-R165 WeakPolarHBondContact O-CD 3.44Å; M155-I168 HydrophobicContact CG-CB 3.71Å; M155-I168 HydrophobicContact CG-CG2 3.35Å; M155-I168 HydrophobicContact SD-CG2 4.28Å; M155-A169 HydrophobicContact CE-CB 3.61Å; M155-A169 HydrophobicContact SD-CB 4.02Å; M155-L222 HydrophobicContact CE-CD1 4.46Å; M155-L222 HydrophobicContact SD-CD1 3.8Å; M155-N225 HydrophobicContact CE-CB 4.07Å
156	N	86.5	Confident	84.1	Confident	69 Å²	69	39.3 Å²	39.3	37%	0.369	21%	0.209	S	C	.	.	H	α-helix	trans	-70.8	-27	178.9	-69.5	-28.8	0	0	0	113	I152 S153 S154 A158 R159	I152-N156 PolarHBondContact O-N 2.9Å; I152-N156 VanDerWaalsContact O-N 3.09Å; I152-N156 PolarHBondContact O-ND2 3.08Å; S153-N156 CarbonylContact O-C 3.57Å; S153-N156 WeakPolarHBondContact O-CA 3.44Å; S153-N156 WeakPolarHBondContact O-CB 3.41Å; S153-N156 PolarHBondContact O-N 3.5Å; S154-N156 VanDerWaalsContact C-N 3.32Å; N156-A158 VanDerWaalsContact C-N 3.33Å; N156-R159 VanDerWaalsContact O-CG 3.29Å; N156-R159 WeakPolarHBondContact O-CG 3.47Å; N156-R159 PolarHBondContact O-NE 2.97Å
157	L	84.9	Confident	84.9	Confident	72 Å²	72	38.3 Å²	38.3	38%	0.377	19%	0.194	S	C	.	.	H	α-helix	trans	-70.8	-31.3	170.5	-69.6	172.7	0	0	0	111.6	D78 W79 F82 S153 S154 M155 R159	D78-L157 HydrophobicContact CB-CD1 3.93Å; W79-L157 HydrophobicContact CE3-CD1 4.41Å; F82-L157 HydrophobicContact CB-CB 4.29Å; F82-L157 HydrophobicContact CB-CD1 4.18Å; F82-L157 HydrophobicContact CD1-CB 4.36Å; F82-L157 HydrophobicContact CD2-CB 4.19Å; F82-L157 HydrophobicContact CG-CB 4Å; S153-L157 WeakPolarHBondContact O-CG 3.4Å; S153-L157 PolarHBondContact O-N 3.1Å; S154-L157 PolarHBondContact O-N 3.4Å; M155-L157 VanDerWaalsContact C-N 3.33Å; L157-R159 PolarHBondContact O-N 3.18Å
158	A	84.7	Confident	85.6	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.008	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	32.3	179.3	0	0	0	0	0	114.7	F82 S154 M155 N156 G160 M161 R165 I168	F82-A158 HydrophobicContact CD2-CB 3.88Å; F82-A158 HydrophobicContact CE2-CB 3.67Å; S154-A158 PolarHBondContact O-N 2.93Å; M155-A158 PolarHBondContact O-N 3.38Å; N156-A158 VanDerWaalsContact C-N 3.33Å; A158-G160 VanDerWaalsContact C-N 3.3Å; A158-G160 PolarHBondContact O-N 3.47Å; A158-M161 PolarHBondContact O-N 3.5Å; A158-M161 VanDerWaalsContact O-N 3.1Å; A158-R165 HydrophobicContact CB-CB 3.93Å; A158-R165 HydrophobicContact CB-CG 4.41Å; A158-R165 PolarHBondContact O-NH1 3.47Å; A158-I168 HydrophobicContact CB-CD1 4.33Å
159	R	79.2	Confident	86	Confident	196 Å²	196	38.2 Å²	38.2	74%	0.74	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-37.5	-176	-86	168.9	-168.9	-161.7	2.3	114.1	N156 L157 R165	N156-R159 VanDerWaalsContact O-CG 3.29Å; N156-R159 WeakPolarHBondContact O-CG 3.47Å; N156-R159 PolarHBondContact O-NE 2.97Å; L157-R159 PolarHBondContact O-N 3.18Å; R159-R165 VanDerWaalsContact C-NH1 3.29Å; R159-R165 PolarHBondContact O-NH1 3.31Å
160	G	78.4	Confident	86.4	Confident	66 Å²	66	34.5 Å²	34.5	68%	0.68	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	1	178	0	0	0	0	0	115.7	A158	A158-G160 VanDerWaalsContact C-N 3.3Å; A158-G160 PolarHBondContact O-N 3.47Å
161	M	84.7	Confident	86.7	Confident	25 Å²	25	35.8 Å²	35.8	12%	0.123	19%	0.185	C	C	.	.			trans	-121.6	83.7	-172.1	-60.1	-168.6	79.8	0	0	111	F82 T86 D93 I94 L104 A158 H163 T164 R165	F82-M161 HydrophobicContact CE2-SD 4.23Å; F82-M161 HydrophobicContact CZ-SD 4.04Å; T86-M161 HydrophobicContact CG2-CE 3.39Å; T86-M161 HydrophobicContact CG2-SD 3.64Å; D93-M161 HydrophobicContact CB-CB 4.17Å; D93-M161 HydrophobicContact CB-CE 3.58Å; D93-M161 HydrophobicContact CB-CG 4.3Å; I94-M161 HydrophobicContact CD1-CE 4.38Å; I94-M161 HydrophobicContact CG1-CE 4.02Å; L104-M161 HydrophobicContact CD1-SD 4.31Å; A158-M161 PolarHBondContact O-N 3.5Å; A158-M161 VanDerWaalsContact O-N 3.1Å; M161-H163 PolarHBondContact O-N 3.47Å; M161-T164 PolarHBondContact O-N 2.91Å; M161-R165 WeakPolarHBondContact O-CB 3.48Å; M161-R165 PolarHBondContact O-N 3.38Å
162	H	86.3	Confident	86.9	Confident	44 Å²	44	35.4 Å²	35.4	20%	0.204	18%	0.183	C	C	.	.	H	α-helix	trans	-62.1	-43.1	-170.5	-64.2	-57.2	0	0	0	113.5	R165 K166 N231 I234	H162-R165 PolarHBondContact ND1-NH2 2.68Å; H162-K166 WeakPolarHBondContact O-CB 3.26Å; H162-K166 PolarHBondContact O-N 3.06Å; H162-N231 WeakPolarHBondContact CB-ND2 3.43Å; H162-N231 PolarHBondContact ND1-ND2 2.99Å; H162-I234 WeakPolarHBondContact O-CD1 3.36Å
163	H	86.2	Confident	87	Confident	57 Å²	57	34.6 Å²	34.6	26%	0.264	18%	0.179	S	C	.	.	H	α-helix	trans	-68.4	-42.3	179.8	-171.3	-87.8	0	0	0	111	Y89 S92 D93 M161 K166 Q167	Y89-H163 PolarHBondContact O-ND1 3.27Å; S92-H163 WeakPolarHBondContact OG-CB 3.33Å; D93-H163 WeakPolarHBondContact OD1-CB 3.44Å; D93-H163 PolarHBondContact OD1-N 3.17Å; D93-H163 VanDerWaalsContact OD1-N 3.09Å; D93-H163 WeakPolarHBondContact OD2-CB 3.44Å; D93-H163 PolarHBondContact OD2-N 2.95Å; M161-H163 PolarHBondContact O-N 3.47Å; H163-K166 WeakPolarHBondContact O-CB 3.44Å; H163-K166 PolarHBondContact O-N 2.93Å; H163-Q167 WeakPolarHBondContact O-CG 3.46Å; H163-Q167 PolarHBondContact O-N 3.13Å; H163-Q167 VanDerWaalsContact O-N 3.11Å
164	T	88.3	Confident	87.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-49.4	176.5	-54.9	0	0	0	0	111.7	F85 G90 D93 M161 K166 Q167 I168	F85-T164 HydrophobicContact CB-CG2 4.05Å; G90-T164 WeakPolarHBondContact CA-OG1 3.19Å; D93-T164 PolarHBondContact OD2-N 3.24Å; D93-T164 PolarHBondContact OD2-OG1 2.6Å; M161-T164 PolarHBondContact O-N 2.91Å; T164-K166 VanDerWaalsContact C-N 3.31Å; T164-K166 PolarHBondContact O-N 3.46Å; T164-Q167 PolarHBondContact O-N 3.41Å; T164-Q167 VanDerWaalsContact O-N 3.09Å; T164-I168 HydrophobicContact CG2-CD1 4.11Å; T164-I168 WeakPolarHBondContact O-CG1 3.42Å; T164-I168 PolarHBondContact O-N 3.43Å
165	R	89.8	Confident	87	Confident	13 Å²	13	36 Å²	36	5%	0.049	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-40.2	178.6	-169.7	168.1	66.6	-123.3	13.8	112.1	M155 A158 R159 M161 H162 Q167 I168 A169 D229 N230 I234	M155-R165 HydrophobicContact CB-CG 4.31Å; M155-R165 WeakPolarHBondContact O-CD 3.44Å; A158-R165 HydrophobicContact CB-CB 3.93Å; A158-R165 HydrophobicContact CB-CG 4.41Å; A158-R165 PolarHBondContact O-NH1 3.47Å; R159-R165 VanDerWaalsContact C-NH1 3.29Å; R159-R165 PolarHBondContact O-NH1 3.31Å; M161-R165 WeakPolarHBondContact O-CB 3.48Å; M161-R165 PolarHBondContact O-N 3.38Å; H162-R165 PolarHBondContact ND1-NH2 2.68Å; R165-Q167 VanDerWaalsContact C-N 3.33Å; R165-Q167 PolarHBondContact O-N 2.92Å; R165-I168 PolarHBondContact O-N 2.64Å; R165-A169 WeakPolarHBondContact O-CB 3.41Å; R165-A169 PolarHBondContact O-N 3.41Å; R165-D229 IonicContact CZ-OD1 2.68Å; R165-D229 IonicContact CZ-OD2 3.19Å; R165-D229 IonicContact NE-OD1 3.71Å; R165-D229 IonicContact NE-OD2 3.36Å; R165-D229 PolarHBondContact NE-OD2 3.32Å; R165-D229 IonicContact NH2-OD1 3.84Å; R165-D229 PolarHBondContact NH2-OD1 3.05Å; R165-D229 IonicContact NH2-OD2 2.75Å; R165-D229 PolarHBondContact NH2-OD2 3.47Å; R165-N230 PolarHBondContact NH2-OD1 2.84Å; R165-I234 HydrophobicContact CB-CD1 4.07Å; R165-I234 HydrophobicContact CG-CD1 4.22Å
166	K	90.1	Very high	87	Confident	42 Å²	42	36 Å²	36	18%	0.183	18%	0.183	C	C	.	.	H	α-helix	trans	-56	-47.5	173	-169.2	174.6	179	169.1	0	111.8	H162 H163 T164 A169 L170 S233 I234	H162-K166 WeakPolarHBondContact O-CB 3.26Å; H162-K166 PolarHBondContact O-N 3.06Å; H163-K166 WeakPolarHBondContact O-CB 3.44Å; H163-K166 PolarHBondContact O-N 2.93Å; T164-K166 VanDerWaalsContact C-N 3.31Å; T164-K166 PolarHBondContact O-N 3.46Å; K166-A169 WeakPolarHBondContact O-CB 3.16Å; K166-A169 PolarHBondContact O-N 3.33Å; K166-L170 HydrophobicContact CG-CD1 4.3Å; K166-L170 VanDerWaalsContact O-CG 3.28Å; K166-L170 WeakPolarHBondContact O-CG 3.37Å; K166-L170 PolarHBondContact O-N 2.95Å; K166-S233 WeakPolarHBondContact CE-O 3.38Å; K166-S233 PolarHBondContact NZ-O 3.18Å; K166-S233 PolarHBondContact NZ-OG 3.45Å; K166-I234 HydrophobicContact CB-CD1 4.39Å; K166-I234 HydrophobicContact CB-CG1 3.92Å; K166-I234 HydrophobicContact CG-CG1 4.3Å
167	Q	91.3	Very high	86.9	Confident	38 Å²	38	33 Å²	33	18%	0.178	17%	0.167	C	C	.	.	H	α-helix	trans	-67.2	-44	-178.1	-64.8	-64.3	-20.8	0	0	111.2	F85 Y89 H163 T164 R165 A169 L170 H171	F85-Q167 HydrophobicContact CD1-CB 4.34Å; Y89-Q167 HydrophobicContact CD1-CB 4.47Å; Y89-Q167 HydrophobicContact CD1-CG 3.87Å; Y89-Q167 HydrophobicContact CD2-CB 3.6Å; Y89-Q167 HydrophobicContact CD2-CG 3.89Å; Y89-Q167 HydrophobicContact CE1-CG 4.38Å; Y89-Q167 HydrophobicContact CE2-CB 3.99Å; Y89-Q167 HydrophobicContact CE2-CG 4.39Å; Y89-Q167 HydrophobicContact CG-CB 3.86Å; Y89-Q167 HydrophobicContact CG-CG 3.59Å; H163-Q167 WeakPolarHBondContact O-CG 3.46Å; H163-Q167 PolarHBondContact O-N 3.13Å; H163-Q167 VanDerWaalsContact O-N 3.11Å; T164-Q167 PolarHBondContact O-N 3.41Å; T164-Q167 VanDerWaalsContact O-N 3.09Å; R165-Q167 VanDerWaalsContact C-N 3.33Å; R165-Q167 PolarHBondContact O-N 2.92Å; Q167-A169 VanDerWaalsContact C-N 3.28Å; Q167-A169 PolarHBondContact O-N 3.35Å; Q167-L170 PolarHBondContact O-N 3.25Å; Q167-H171 WeakPolarHBondContact O-CB 3.37Å; Q167-H171 PolarHBondContact O-CD2 3.24Å; Q167-H171 PolarHBondContact O-N 3.46Å
168	I	90.7	Very high	86.7	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.8	-44.5	175.7	-57.5	165	0	0	0	110.3	F85 L151 M155 A158 T164 R165 H171 A172	F85-I168 HydrophobicContact CB-CD1 3.98Å; F85-I168 HydrophobicContact CB-CG1 3.63Å; F85-I168 HydrophobicContact CD1-CB 4.27Å; F85-I168 HydrophobicContact CD1-CG1 3.44Å; F85-I168 VanDerWaalsContact CD1-CG1 3.44Å; F85-I168 HydrophobicContact CD2-CG1 4.09Å; F85-I168 HydrophobicContact CE1-CB 4.46Å; F85-I168 HydrophobicContact CE1-CG1 4.07Å; F85-I168 HydrophobicContact CG-CD1 4.28Å; F85-I168 HydrophobicContact CG-CG1 3.45Å; F85-I168 VanDerWaalsContact CG-CG1 3.45Å; L151-I168 HydrophobicContact CB-CG2 4.44Å; L151-I168 HydrophobicContact CD2-CG2 4.07Å; M155-I168 HydrophobicContact CG-CB 3.71Å; M155-I168 HydrophobicContact CG-CG2 3.35Å; M155-I168 HydrophobicContact SD-CG2 4.28Å; A158-I168 HydrophobicContact CB-CD1 4.33Å; T164-I168 HydrophobicContact CG2-CD1 4.11Å; T164-I168 WeakPolarHBondContact O-CG1 3.42Å; T164-I168 PolarHBondContact O-N 3.43Å; R165-I168 PolarHBondContact O-N 2.64Å; I168-H171 PolarHBondContact O-N 3.38Å; I168-A172 VanDerWaalsContact O-CB 3.31Å; I168-A172 WeakPolarHBondContact O-CB 3.41Å; I168-A172 PolarHBondContact O-N 3.39Å
169	A	90.4	Very high	86.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-47.9	177.3	0	0	0	0	0	112.7	M155 R165 K166 Q167 H171 A172 V173 T238	M155-A169 HydrophobicContact CE-CB 3.61Å; M155-A169 HydrophobicContact SD-CB 4.02Å; R165-A169 WeakPolarHBondContact O-CB 3.41Å; R165-A169 PolarHBondContact O-N 3.41Å; K166-A169 WeakPolarHBondContact O-CB 3.16Å; K166-A169 PolarHBondContact O-N 3.33Å; Q167-A169 VanDerWaalsContact C-N 3.28Å; Q167-A169 PolarHBondContact O-N 3.35Å; A169-H171 PolarHBondContact O-N 2.97Å; A169-A172 PolarHBondContact O-N 3.36Å; A169-V173 VanDerWaalsContact O-CG2 3.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.4Å; A169-V173 PolarHBondContact O-N 3.42Å; A169-T238 HydrophobicContact CB-CG2 3.79Å
170	L	89.7	Confident	86	Confident	34 Å²	34	26.5 Å²	26.5	18%	0.178	14%	0.144	C	C	.	.	H	α-helix	trans	-59.5	-47.4	177.7	-69.3	173.8	0	0	0	111.3	K166 Q167 V173 D174 T238 P241	K166-L170 HydrophobicContact CG-CD1 4.3Å; K166-L170 VanDerWaalsContact O-CG 3.28Å; K166-L170 WeakPolarHBondContact O-CG 3.37Å; K166-L170 PolarHBondContact O-N 2.95Å; Q167-L170 PolarHBondContact O-N 3.25Å; L170-V173 PolarHBondContact O-N 2.77Å; L170-D174 VanDerWaalsContact O-CB 3.3Å; L170-D174 WeakPolarHBondContact O-CB 3.45Å; L170-D174 PolarHBondContact O-N 3Å; L170-T238 HydrophobicContact CD2-CG2 4.32Å; L170-P241 HydrophobicContact CD2-CG 3.61Å
171	H	89.4	Confident	85.6	Confident	33 Å²	33	27.6 Å²	27.6	15%	0.153	13%	0.131	C	C	.	.	H	α-helix	trans	-65.9	-39.8	179.9	-81.6	-85.7	0	0	0	112.3	F85 Y89 Q167 I168 A169 W175	F85-H171 HydrophobicContact CE1-CB 3.93Å; F85-H171 AromaticContact CE1-CD2 3.51Å; F85-H171 AromaticContact CE1-CG 3.81Å; F85-H171 HydrophobicContact CZ-CB 3.89Å; Y89-H171 AromaticContact CE2-NE2 3.87Å; Y89-H171 AromaticContact CZ-NE2 3.72Å; Y89-H171 PolarHBondContact OH-NE2 3.44Å; Q167-H171 WeakPolarHBondContact O-CB 3.37Å; Q167-H171 PolarHBondContact O-CD2 3.24Å; Q167-H171 PolarHBondContact O-N 3.46Å; I168-H171 PolarHBondContact O-N 3.38Å; A169-H171 PolarHBondContact O-N 2.97Å; H171-W175 WeakPolarHBondContact O-CB 3.48Å; H171-W175 PolarHBondContact O-N 3.28Å
172	A	89.9	Confident	84.5	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.4	-45.5	176.5	0	0	0	0	0	112.1	L151 I168 A169 L176 L222	L151-A172 HydrophobicContact CB-CB 4.1Å; L151-A172 HydrophobicContact CD1-CB 3.94Å; I168-A172 VanDerWaalsContact O-CB 3.31Å; I168-A172 WeakPolarHBondContact O-CB 3.41Å; I168-A172 PolarHBondContact O-N 3.39Å; A169-A172 PolarHBondContact O-N 3.36Å; A172-L176 WeakPolarHBondContact O-CB 3.22Å; A172-L176 PolarHBondContact O-N 3.05Å; A172-L222 HydrophobicContact CB-CD1 3.88Å; A172-L222 HydrophobicContact CB-CD2 4.1Å
173	V	89.5	Confident	82.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67.1	-42.8	178.3	175.2	0	0	0	0	111.2	A169 L170 T177 L222 P241 L242 L245	A169-V173 VanDerWaalsContact O-CG2 3.32Å; A169-V173 WeakPolarHBondContact O-CG2 3.4Å; A169-V173 PolarHBondContact O-N 3.42Å; L170-V173 PolarHBondContact O-N 2.77Å; V173-T177 WeakPolarHBondContact O-CB 3.31Å; V173-T177 PolarHBondContact O-N 3.06Å; V173-T177 PolarHBondContact O-OG1 2.87Å; V173-L222 HydrophobicContact CG2-CD2 4.06Å; V173-L222 HydrophobicContact CG2-CG 4.31Å; V173-P241 HydrophobicContact CB-CB 4.22Å; V173-P241 HydrophobicContact CG1-CB 3.61Å; V173-L242 HydrophobicContact CG1-CD2 4.22Å; V173-L242 HydrophobicContact CG2-CD2 3.97Å; V173-L245 HydrophobicContact CG1-CB 4.16Å; V173-L245 HydrophobicContact CG1-CD2 4.36Å
174	D	86.2	Confident	80.5	Confident	57 Å²	57	29.7 Å²	29.7	31%	0.305	16%	0.163	S	C	.	.	H	α-helix	trans	-62.8	-45.1	176.7	-89.1	4.8	0	0	0	112.2	R139 L170 T177 F178	R139-D174 IonicContact CZ-OD2 3.47Å; R139-D174 IonicContact NH1-OD2 3.45Å; R139-D174 PolarHBondContact NH1-OD2 3.45Å; R139-D174 IonicContact NH2-OD2 2.69Å; L170-D174 VanDerWaalsContact O-CB 3.3Å; L170-D174 WeakPolarHBondContact O-CB 3.45Å; L170-D174 PolarHBondContact O-N 3Å; D174-T177 PolarHBondContact O-N 3.26Å; D174-F178 VanDerWaalsContact O-CB 3.28Å; D174-F178 WeakPolarHBondContact O-CB 3.26Å; D174-F178 PolarHBondContact O-N 3.19Å
175	W	84.5	Confident	77.7	Confident	8 Å²	8	32.8 Å²	32.8	3%	0.03	20%	0.195	C	C	.	.	H	α-helix	trans	-64.8	-43.9	-179.6	-176.5	52.9	0	0	0	111.2	R139 L141 P142 L143 L148 L151 H171 T177 F178 G179	R139-W175 PolarHBondContact O-NE1 2.92Å; L141-W175 PolarHBondContact O-NE1 3.38Å; P142-W175 WeakPolarHBondContact O-CZ2 3.45Å; L143-W175 HydrophobicContact CD1-CD2 4.33Å; L143-W175 HydrophobicContact CD1-CE3 4.24Å; L143-W175 HydrophobicContact CD1-CZ3 4.37Å; L148-W175 HydrophobicContact CD2-CE3 4.03Å; L148-W175 HydrophobicContact CD2-CZ3 4.15Å; L148-W175 HydrophobicContact CG-CE3 4.39Å; L148-W175 HydrophobicContact CG-CZ3 4.04Å; L151-W175 HydrophobicContact CD1-CE3 3.73Å; L151-W175 HydrophobicContact CD1-CZ3 4.03Å; H171-W175 WeakPolarHBondContact O-CB 3.48Å; H171-W175 PolarHBondContact O-N 3.28Å; W175-T177 PolarHBondContact O-N 2.86Å; W175-F178 PolarHBondContact O-N 3.23Å; W175-G179 PolarHBondContact O-N 3.27Å
176	L	85.9	Confident	74.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.7	-46.6	171.8	176.3	62.5	0	0	0	111.7	L143 L148 A172 L180 M215 V219 L222 L245	L143-L176 HydrophobicContact CD1-CD1 4.22Å; L143-L176 HydrophobicContact CD2-CD1 3.97Å; L148-L176 HydrophobicContact CD1-CD1 4.01Å; L148-L176 HydrophobicContact CD2-CB 4.22Å; A172-L176 WeakPolarHBondContact O-CB 3.22Å; A172-L176 PolarHBondContact O-N 3.05Å; L176-L180 HydrophobicContact CD1-CD1 4.01Å; L176-L180 HydrophobicContact CD1-CG 4.28Å; L176-L180 HydrophobicContact CG-CD1 4.17Å; L176-L180 WeakPolarHBondContact O-CB 3.45Å; L176-L180 VanDerWaalsContact O-CG 3.26Å; L176-L180 WeakPolarHBondContact O-CG 3.45Å; L176-L180 PolarHBondContact O-N 3.37Å; L176-L180 VanDerWaalsContact O-N 3.08Å; L176-M215 HydrophobicContact CD1-CE 3.5Å; L176-M215 VanDerWaalsContact CD1-CE 3.5Å; L176-V219 HydrophobicContact CD1-CG2 4.09Å; L176-V219 HydrophobicContact CD2-CB 4.42Å; L176-V219 HydrophobicContact CD2-CG1 4Å; L176-V219 HydrophobicContact CD2-CG2 3.74Å; L176-L222 HydrophobicContact CD2-CD2 4.22Å; L176-L245 HydrophobicContact CB-CD1 4.43Å; L176-L245 HydrophobicContact CD2-CD1 3.55Å; L176-L245 HydrophobicContact CD2-CD2 3.68Å; L176-L245 HydrophobicContact CD2-CG 4.27Å; L176-L245 HydrophobicContact CG-CD1 3.6Å
177	T	84.4	Confident	72.1	Confident	7 Å²	7	37.8 Å²	37.8	4%	0.043	24%	0.243	C	C	.	.	H	α-helix	trans	-64	-43.4	-179	-56.3	0	0	0	0	111.3	V173 D174 W175 Q181 L245 Q248	V173-T177 WeakPolarHBondContact O-CB 3.31Å; V173-T177 PolarHBondContact O-N 3.06Å; V173-T177 PolarHBondContact O-OG1 2.87Å; D174-T177 PolarHBondContact O-N 3.26Å; W175-T177 PolarHBondContact O-N 2.86Å; T177-Q181 WeakPolarHBondContact O-CG 3.44Å; T177-Q181 PolarHBondContact O-N 2.89Å; T177-Q181 VanDerWaalsContact O-N 3.12Å; T177-L245 WeakPolarHBondContact OG1-CA 3.47Å; T177-L245 WeakPolarHBondContact OG1-CB 3.48Å; T177-Q248 HydrophobicContact CG2-CG 4.06Å
178	F	80.3	Confident	69.2	Low	92 Å²	92	46.3 Å²	46.3	40%	0.404	28%	0.279	S	S	.	.	H	α-helix	trans	-68.1	-43.2	179.6	-177.8	-97.3	0	0	0	112.1	D174 W175 L180 Q181 T182	D174-F178 VanDerWaalsContact O-CB 3.28Å; D174-F178 WeakPolarHBondContact O-CB 3.26Å; D174-F178 PolarHBondContact O-N 3.19Å; W175-F178 PolarHBondContact O-N 3.23Å; F178-L180 VanDerWaalsContact C-N 3.33Å; F178-L180 PolarHBondContact O-N 2.99Å; F178-Q181 PolarHBondContact O-N 3.3Å; F178-Q181 VanDerWaalsContact O-N 3.11Å; F178-T182 HydrophobicContact CD1-CG2 4.16Å; F178-T182 HydrophobicContact CD2-CG2 4.16Å; F178-T182 HydrophobicContact CE1-CG2 3.69Å; F178-T182 HydrophobicContact CE2-CG2 3.69Å; F178-T182 HydrophobicContact CG-CG2 4.39Å; F178-T182 HydrophobicContact CZ-CG2 3.45Å; F178-T182 VanDerWaalsContact CZ-CG2 3.45Å; F178-T182 PolarHBondContact O-N 3.17Å; F178-T182 PolarHBondContact O-OG1 3.13Å
179	G	74.9	Confident	66.4	Low	4 Å²	4	49.6 Å²	49.6	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-45.5	175.2	0	0	0	0	0	111.7	W175 Q181 T182 D183	W175-G179 PolarHBondContact O-N 3.27Å; G179-Q181 VanDerWaalsContact C-N 3.28Å; G179-Q181 PolarHBondContact O-N 3.48Å; G179-T182 PolarHBondContact O-N 3.3Å; G179-T182 PolarHBondContact O-OG1 3.09Å; G179-D183 PolarHBondContact O-N 3.23Å; G179-D183 VanDerWaalsContact O-N 3.15Å
180	L	74.6	Confident	63.5	Low	36 Å²	36	56.2 Å²	56.2	19%	0.188	35%	0.347	C	S	.	.	H	α-helix	trans	-64.3	-28.6	175.8	-68.1	172.9	0	0	0	113.7	L143 L176 F178 P204 L245 Q248 L249	L143-L180 HydrophobicContact CD2-CD2 4.48Å; L143-L180 HydrophobicContact CD2-CG 4.48Å; L176-L180 HydrophobicContact CD1-CD1 4.01Å; L176-L180 HydrophobicContact CD1-CG 4.28Å; L176-L180 HydrophobicContact CG-CD1 4.17Å; L176-L180 WeakPolarHBondContact O-CB 3.45Å; L176-L180 VanDerWaalsContact O-CG 3.26Å; L176-L180 WeakPolarHBondContact O-CG 3.45Å; L176-L180 PolarHBondContact O-N 3.37Å; L176-L180 VanDerWaalsContact O-N 3.08Å; F178-L180 VanDerWaalsContact C-N 3.33Å; F178-L180 PolarHBondContact O-N 2.99Å; L180-P204 HydrophobicContact CD2-CB 4.39Å; L180-L245 HydrophobicContact CD1-CD1 3.91Å; L180-Q248 HydrophobicContact CB-CB 4.08Å; L180-Q248 HydrophobicContact CB-CG 4.46Å; L180-Q248 HydrophobicContact CD1-CB 4.23Å; L180-L249 HydrophobicContact CD1-CD2 4.31Å
181	Q	70.2	Confident	60.5	Low	89 Å²	89	59.6 Å²	59.6	42%	0.416	38%	0.38	S	S	.	.	H	α-helix	trans	-78.9	-38.1	177.1	-77.9	176.5	-1.1	0	0	113.3	T177 F178 G179 Q248	T177-Q181 WeakPolarHBondContact O-CG 3.44Å; T177-Q181 PolarHBondContact O-N 2.89Å; T177-Q181 VanDerWaalsContact O-N 3.12Å; F178-Q181 PolarHBondContact O-N 3.3Å; F178-Q181 VanDerWaalsContact O-N 3.11Å; G179-Q181 VanDerWaalsContact C-N 3.28Å; G179-Q181 PolarHBondContact O-N 3.48Å; Q181-Q248 VanDerWaalsContact CG-CD 3.42Å; Q181-Q248 HydrophobicContact CG-CG 4.01Å
182	T	62	Low	57.4	Low	21 Å²	21	63.7 Å²	63.7	13%	0.129	41%	0.412	C	S	.	.	H	α-helix	trans	-86.4	-32.2	-170.3	44.2	0	0	0	0	113.3	F178 G179 G184 G185 V187	F178-T182 HydrophobicContact CD1-CG2 4.16Å; F178-T182 HydrophobicContact CD2-CG2 4.16Å; F178-T182 HydrophobicContact CE1-CG2 3.69Å; F178-T182 HydrophobicContact CE2-CG2 3.69Å; F178-T182 HydrophobicContact CG-CG2 4.39Å; F178-T182 HydrophobicContact CZ-CG2 3.45Å; F178-T182 VanDerWaalsContact CZ-CG2 3.45Å; F178-T182 PolarHBondContact O-N 3.17Å; F178-T182 PolarHBondContact O-OG1 3.13Å; G179-T182 PolarHBondContact O-N 3.3Å; G179-T182 PolarHBondContact O-OG1 3.09Å; T182-G184 VanDerWaalsContact C-N 3.28Å; T182-G184 PolarHBondContact O-N 3.35Å; T182-G185 PolarHBondContact O-N 2.95Å; T182-V187 HydrophobicContact CG2-CG2 3.77Å
183	D	49.2	Very low	54.6	Low	85 Å²	85	69 Å²	69	46%	0.455	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-0.7	179.8	-64	-30.7	0	0	0	113.3	G179	G179-D183 PolarHBondContact O-N 3.23Å; G179-D183 VanDerWaalsContact O-N 3.15Å
184	G	38.7	Very low	51.6	Low	65 Å²	65	80.1 Å²	80.1	67%	0.67	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	2.3	169.9	0	0	0	0	0	115.2	T182	T182-G184 VanDerWaalsContact C-N 3.28Å; T182-G184 PolarHBondContact O-N 3.35Å
185	G	29.8	Very low	48.8	Very low	65 Å²	65	85.9 Å²	85.9	67%	0.67	51%	0.511	S	S	*	.	S	Bend	trans	127.2	98.2	177.8	0	0	0	0	0	113.5	T182	T182-G185 PolarHBondContact O-N 2.95Å
186	G	28.8	Very low	46.1	Very low	64 Å²	64	91.4 Å²	91.4	66%	0.66	55%	0.546	S	S	*	.			trans	94.6	88.5	155.8	0	0	0	0	0	115.8	K188	G186-K188 PolarHBondContact O-N 3.33Å; G186-K188 VanDerWaalsContact O-N 3.09Å
187	V	33.8	Very low	43.6	Very low	96 Å²	96	100.9 Å²	100.9	58%	0.582	59%	0.59	S	S	*	*			trans	-65.1	105.6	160.5	177.9	0	0	0	0	109.2	T182 A189	T182-V187 HydrophobicContact CG2-CG2 3.77Å; V187-A189 HydrophobicContact CG1-CB 4.03Å
188	K	30.7	Very low	40.9	Very low	217 Å²	217	110.6 Å²	110.6	94%	0.943	63%	0.632	S	S	*	*			trans	-96.9	83.2	152.9	-82.5	-173.3	178.4	177.9	0	108.6	G186	G186-K188 PolarHBondContact O-N 3.33Å; G186-K188 VanDerWaalsContact O-N 3.09Å
189	A	31.5	Very low	38.5	Very low	68 Å²	68	111.3 Å²	111.3	56%	0.562	65%	0.648	S	S	*	*			trans	-112.9	99	152.9	0	0	0	0	0	106.9	V187	V187-A189 HydrophobicContact CG1-CB 4.03Å
190	T	29.1	Very low	36.3	Very low	140 Å²	140	116.1 Å²	116.1	86%	0.859	68%	0.682	S	S	*	*	S	Bend	trans	53.3	112.7	158.9	51.1	0	0	0	0	119.7
191	A	27.6	Very low	34.3	Very low	105 Å²	105	120.8 Å²	120.8	87%	0.868	71%	0.712	S	S	*	*			trans	86	95.2	158.3	0	0	0	0	0	119.7
192	S	24.5	Very low	32.7	Very low	118 Å²	118	123.7 Å²	123.7	83%	0.825	74%	0.736	S	S	*	*			trans	137.7	132.2	135.8	-161.4	0	0	0	0	112.9
193	P	31	Very low	31.8	Very low	113 Å²	113	130 Å²	130	73%	0.734	76%	0.764	S	S	*	*			trans	-99.8	120.4	-175	35	-25.1	0	0	0	111.7
194	R	26.3	Very low	31.9	Very low	232 Å²	232	129.9 Å²	129.9	88%	0.875	77%	0.767	S	S	*	*			trans	-178.3	140.6	143.2	-105.1	166.3	-170.2	-175.8	3.7	112
195	F	27.8	Very low	32.5	Very low	178 Å²	178	135.1 Å²	135.1	78%	0.781	77%	0.772	S	S	*	*			trans	97.4	92.7	165.7	-68.7	-75.4	0	0	0	120.7
196	T	27.6	Very low	34	Very low	124 Å²	124	134.9 Å²	134.9	76%	0.761	76%	0.755	S	S	*	*				49.4	113.6	125	56.4	0	0	0	0	121.2
197	Q	33.3	Very low	35.8	Very low	199 Å²	199	132.8 Å²	132.8	93%	0.93	73%	0.73	S	S	*	*			trans	-57.5	133.7	162.9	-73.2	170.3	-31.4	0	0	113.2
198	K	27.6	Very low	37.1	Very low	212 Å²	212	135.2 Å²	135.2	92%	0.922	74%	0.735	S	S	*	*			trans	-138.4	151.5	146.4	-90.4	-173.5	179.8	177.5	0	110.2
199	S	28.5	Very low	38.9	Very low	106 Å²	106	128.6 Å²	128.6	74%	0.741	71%	0.71	S	S	*	*			trans	-85.1	162.4	-154.3	47.5	0	0	0	0	116.8
200	S	30.6	Very low	40.7	Very low	106 Å²	106	126.3 Å²	126.3	74%	0.741	69%	0.69	S	S	*	*			trans	68.5	106	149.6	66.2	0	0	0	0	119.6
201	T	32.1	Very low	43	Very low	134 Å²	134	123.4 Å²	123.4	82%	0.822	67%	0.672	S	S	*	*			trans	-156.1	127.1	133.3	-41.9	0	0	0	0	110.5	Q203	T201-Q203 VanDerWaalsContact C-N 3.29Å; T201-Q203 PolarHBondContact O-N 2.76Å
202	T	37	Very low	45.3	Very low	150 Å²	150	122.8 Å²	122.8	92%	0.92	66%	0.659	S	S	*	*			trans	-87.3	30.8	-177.4	16.3	0	0	0	0	113.7
203	Q	42.4	Very low	48.1	Very low	153 Å²	153	121 Å²	121	72%	0.715	64%	0.638	S	S	*	*	S	Bend	trans	-132.2	128.6	170.4	-68.1	-155.9	-5.4	0	0	110	T201 F205	T201-Q203 VanDerWaalsContact C-N 3.29Å; T201-Q203 PolarHBondContact O-N 2.76Å; Q203-F205 PolarHBondContact O-N 2.93Å
204	P	50.2	Low	50.5	Low	82 Å²	82	117.1 Å²	117.1	53%	0.532	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-61.6	125.9	169.3	26.1	-30.1	0	0	0	107.7	L180 L206	L180-P204 HydrophobicContact CD2-CB 4.39Å; P204-L206 PolarHBondContact O-N 3.14Å
205	F	51.6	Low	53.1	Low	175 Å²	175	106.8 Å²	106.8	77%	0.768	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-58	121.8	177.2	-141	-94.8	0	0	0	108	Q203	Q203-F205 PolarHBondContact O-N 2.93Å
206	L	62.1	Low	55.9	Low	60 Å²	60	99.3 Å²	99.3	31%	0.314	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-81.3	141.2	177	-82.4	152.3	0	0	0	109.1	P204 P212 M215	P204-L206 PolarHBondContact O-N 3.14Å; L206-P212 HydrophobicContact CD1-CB 3.93Å; L206-P212 HydrophobicContact CD1-CG 3.48Å; L206-P212 VanDerWaalsContact CD1-CG 3.48Å; L206-M215 HydrophobicContact CD2-CB 3.76Å; L206-M215 HydrophobicContact CD2-CG 3.95Å
207	P	65.6	Low	58.7	Low	20 Å²	20	97.1 Å²	97.1	13%	0.13	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-50.7	141.8	170.4	-27.2	33.4	0	0	0	111.7	L143 D209 S210	L143-P207 HydrophobicContact CB-CG 4.48Å; L143-P207 HydrophobicContact CG-CG 4.3Å; L143-P207 WeakPolarHBondContact O-CG 3.15Å; P207-D209 WeakPolarHBondContact CB-OD1 3.23Å; P207-D209 PolarHBondContact O-N 3.42Å; P207-S210 WeakPolarHBondContact CD-OG 3.31Å; P207-S210 PolarHBondContact O-N 3.24Å; P207-S210 PolarHBondContact O-OG 3.2Å
208	E	62.5	Low	61.2	Low	148 Å²	148	88 Å²	88	69%	0.692	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-25.1	-178.8	-69.4	-173.1	171.6	0	0	113.4	K54	K54-E208 IonicContact NZ-OE2 2.62Å; K54-E208 PolarHBondContact NZ-OE2 3.02Å
209	D	67.8	Low	64	Low	78 Å²	78	78.4 Å²	78.4	42%	0.417	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	8.2	-179.4	68.3	-29.1	0	0	0	114	L145 A146 P207	L145-D209 WeakPolarHBondContact CB-OD2 3.4Å; L145-D209 PolarHBondContact N-OD1 3.37Å; L145-D209 PolarHBondContact N-OD2 3.46Å; A146-D209 PolarHBondContact N-OD2 3.25Å; A146-D209 VanDerWaalsContact N-OD2 3.09Å; P207-D209 WeakPolarHBondContact CB-OD1 3.23Å; P207-D209 PolarHBondContact O-N 3.42Å
210	S	70	Confident	66.9	Low	19 Å²	19	75.2 Å²	75.2	13%	0.133	41%	0.414	C	S	.	.			trans	-132	141.1	-171.7	76.3	0	0	0	0	114.7	P207	P207-S210 WeakPolarHBondContact CD-OG 3.31Å; P207-S210 PolarHBondContact O-N 3.24Å; P207-S210 PolarHBondContact O-OG 3.2Å
211	T	77.9	Confident	69.6	Low	80 Å²	80	73.4 Å²	73.4	49%	0.491	40%	0.396	S	S	.	.			trans	-92.4	155.6	160	66.6	0	0	0	0	110	E213 S214 M215	T211-E213 PolarHBondContact O-N 3.33Å; T211-E213 VanDerWaalsContact O-N 3.08Å; T211-S214 PolarHBondContact N-OG 3.17Å; T211-S214 PolarHBondContact O-N 3.04Å; T211-S214 VanDerWaalsContact O-N 3.08Å; T211-S214 PolarHBondContact O-OG 2.83Å; T211-S214 WeakPolarHBondContact OG1-CB 3.28Å; T211-S214 PolarHBondContact OG1-N 2.85Å; T211-S214 VanDerWaalsContact OG1-N 3.15Å; T211-S214 PolarHBondContact OG1-OG 3.39Å; T211-S214 VanDerWaalsContact OG1-OG 3.12Å; T211-M215 PolarHBondContact O-N 3.08Å
212	P	75.4	Confident	72.4	Confident	92 Å²	92	67.1 Å²	67.1	60%	0.597	36%	0.358	S	S	*	.	H	α-helix	trans	-51.2	-37	176.7	-20.7	25.2	0	0	0	113	L206 F216	L206-P212 HydrophobicContact CD1-CB 3.93Å; L206-P212 HydrophobicContact CD1-CG 3.48Å; L206-P212 VanDerWaalsContact CD1-CG 3.48Å; P212-F216 WeakPolarHBondContact O-CB 3.48Å; P212-F216 PolarHBondContact O-N 3.5Å
213	E	83.1	Confident	74.9	Confident	81 Å²	81	60.1 Å²	60.1	38%	0.379	31%	0.314	S	S	.	.	H	α-helix	trans	-73.4	-43.9	179.9	-169.7	59.4	-155.4	0	0	112.5	T211 M215 F216 M217 R256	T211-E213 PolarHBondContact O-N 3.33Å; T211-E213 VanDerWaalsContact O-N 3.08Å; E213-M215 VanDerWaalsContact C-N 3.29Å; E213-M215 PolarHBondContact O-N 3.05Å; E213-F216 PolarHBondContact O-N 3.34Å; E213-M217 WeakPolarHBondContact O-CG 3.29Å; E213-M217 PolarHBondContact O-N 2.87Å; E213-R256 IonicContact OE1-CZ 2.79Å; E213-R256 IonicContact OE1-NH1 2.65Å; E213-R256 PolarHBondContact OE1-NH1 2.89Å; E213-R256 IonicContact OE1-NH2 2.81Å; E213-R256 PolarHBondContact OE1-NH2 2.87Å; E213-R256 IonicContact OE2-CZ 3.24Å; E213-R256 IonicContact OE2-NH1 3.89Å; E213-R256 PolarHBondContact OE2-NH1 3.15Å; E213-R256 IonicContact OE2-NH2 2.82Å
214	S	81	Confident	77.1	Confident	31 Å²	31	54.3 Å²	54.3	22%	0.217	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-36.7	177.4	67.2	0	0	0	0	112.4	T211 T218	T211-S214 PolarHBondContact N-OG 3.17Å; T211-S214 PolarHBondContact O-N 3.04Å; T211-S214 VanDerWaalsContact O-N 3.08Å; T211-S214 PolarHBondContact O-OG 2.83Å; T211-S214 WeakPolarHBondContact OG1-CB 3.28Å; T211-S214 PolarHBondContact OG1-N 2.85Å; T211-S214 VanDerWaalsContact OG1-N 3.15Å; T211-S214 PolarHBondContact OG1-OG 3.39Å; T211-S214 VanDerWaalsContact OG1-OG 3.12Å; S214-T218 PolarHBondContact O-N 3.46Å; S214-T218 VanDerWaalsContact O-N 3.13Å; S214-T218 PolarHBondContact O-OG1 3.17Å
215	M	81.9	Confident	78.9	Confident	15 Å²	15	52.6 Å²	52.6	7%	0.074	27%	0.272	C	S	.	.	H	α-helix	trans	-68.2	-46	175	-170.8	62.7	176.1	0	0	110.3	L143 L145 L148 L176 L206 T211 E213 M217 T218 V219	L143-M215 HydrophobicContact CD2-CE 3.76Å; L143-M215 HydrophobicContact CG-CE 4.31Å; L145-M215 HydrophobicContact CD1-SD 4.12Å; L148-M215 HydrophobicContact CD1-CE 3.5Å; L148-M215 HydrophobicContact CD1-SD 3.99Å; L176-M215 HydrophobicContact CD1-CE 3.5Å; L176-M215 VanDerWaalsContact CD1-CE 3.5Å; L206-M215 HydrophobicContact CD2-CB 3.76Å; L206-M215 HydrophobicContact CD2-CG 3.95Å; T211-M215 PolarHBondContact O-N 3.08Å; E213-M215 VanDerWaalsContact C-N 3.29Å; E213-M215 PolarHBondContact O-N 3.05Å; M215-M217 VanDerWaalsContact C-N 3.34Å; M215-M217 PolarHBondContact O-N 3.26Å; M215-T218 PolarHBondContact O-N 3.27Å; M215-V219 HydrophobicContact CE-CG2 4.11Å; M215-V219 HydrophobicContact CG-CG2 4.38Å; M215-V219 WeakPolarHBondContact O-CB 3.43Å; M215-V219 VanDerWaalsContact O-CG2 3.29Å; M215-V219 WeakPolarHBondContact O-CG2 3.34Å; M215-V219 PolarHBondContact O-N 3.14Å; M215-V219 HydrophobicContact SD-CG2 4.44Å
216	F	85.6	Confident	80.7	Confident	20 Å²	20	44.2 Å²	44.2	9%	0.088	24%	0.236	C	C	.	.	H	α-helix	trans	-56.4	-47.2	175.3	175.2	-100.2	0	0	0	112.2	P212 E213 T218 V219 K220 T253 R256 L257 L260	P212-F216 WeakPolarHBondContact O-CB 3.48Å; P212-F216 PolarHBondContact O-N 3.5Å; E213-F216 PolarHBondContact O-N 3.34Å; F216-T218 VanDerWaalsContact C-N 3.33Å; F216-T218 PolarHBondContact O-N 2.86Å; F216-V219 PolarHBondContact O-N 3.3Å; F216-K220 HydrophobicContact CE1-CD 4.5Å; F216-K220 WeakPolarHBondContact O-CB 3.42Å; F216-K220 PolarHBondContact O-N 2.99Å; F216-T253 HydrophobicContact CD2-CG2 3.78Å; F216-T253 HydrophobicContact CE2-CG2 3.82Å; F216-R256 HydrophobicContact CE1-CG 4.18Å; F216-R256 VanDerWaalsContact CE1-CZ 3.41Å; F216-R256 HydrophobicContact CE2-CB 4.36Å; F216-R256 HydrophobicContact CE2-CG 4.29Å; F216-R256 HydrophobicContact CZ-CB 4.17Å; F216-R256 VanDerWaalsContact CZ-CD 3.49Å; F216-R256 HydrophobicContact CZ-CG 3.66Å; F216-L257 HydrophobicContact CE2-CD2 4.11Å; F216-L257 HydrophobicContact CE2-CG 4.19Å; F216-L257 HydrophobicContact CZ-CD2 4.23Å; F216-L260 HydrophobicContact CE1-CD1 4.15Å; F216-L260 HydrophobicContact CZ-CD1 3.83Å
217	M	86.9	Confident	81.8	Confident	79 Å²	79	41.6 Å²	41.6	39%	0.389	22%	0.222	S	C	.	.	H	α-helix	trans	-60.5	-42.7	178.9	-73.2	-61.4	-139.8	0	0	112.1	E213 M215 K220 D221	E213-M217 WeakPolarHBondContact O-CG 3.29Å; E213-M217 PolarHBondContact O-N 2.87Å; M215-M217 VanDerWaalsContact C-N 3.34Å; M215-M217 PolarHBondContact O-N 3.26Å; M217-K220 WeakPolarHBondContact O-CB 3.35Å; M217-K220 PolarHBondContact O-N 3.45Å; M217-K220 HydrophobicContact SD-CD 4.34Å; M217-K220 PolarHBondContact SD-NZ 2.82Å; M217-K220 VanDerWaalsContact SD-NZ 3.41Å; M217-D221 PolarHBondContact O-N 2.73Å
218	T	84.5	Confident	82.8	Confident	7 Å²	7	43 Å²	43	4%	0.043	23%	0.23	C	C	.	.	H	α-helix	trans	-69.8	-41.2	-179.7	-53.1	0	0	0	0	112	L145 L148 K149 I152 S214 M215 F216 K220 D221 L222	L145-T218 HydrophobicContact CD1-CG2 4.14Å; L145-T218 VanDerWaalsContact CD1-OG1 3.25Å; L145-T218 WeakPolarHBondContact CD1-OG1 3.47Å; L148-T218 HydrophobicContact CB-CG2 4.01Å; K149-T218 HydrophobicContact CG-CG2 3.86Å; I152-T218 HydrophobicContact CD1-CG2 3.63Å; I152-T218 WeakPolarHBondContact CD1-O 3.47Å; S214-T218 PolarHBondContact O-N 3.46Å; S214-T218 VanDerWaalsContact O-N 3.13Å; S214-T218 PolarHBondContact O-OG1 3.17Å; M215-T218 PolarHBondContact O-N 3.27Å; F216-T218 VanDerWaalsContact C-N 3.33Å; F216-T218 PolarHBondContact O-N 2.86Å; T218-K220 VanDerWaalsContact C-N 3.33Å; T218-D221 PolarHBondContact O-N 3.4Å; T218-L222 PolarHBondContact O-N 2.81Å
219	V	88	Confident	84	Confident	11 Å²	11	36.6 Å²	36.6	7%	0.067	20%	0.201	C	C	.	.	H	α-helix	trans	-63.8	-41.6	174.5	172.4	0	0	0	0	110.7	L176 M215 F216 D221 L222 I223 L245	L176-V219 HydrophobicContact CD1-CG2 4.09Å; L176-V219 HydrophobicContact CD2-CB 4.42Å; L176-V219 HydrophobicContact CD2-CG1 4Å; L176-V219 HydrophobicContact CD2-CG2 3.74Å; M215-V219 HydrophobicContact CE-CG2 4.11Å; M215-V219 HydrophobicContact CG-CG2 4.38Å; M215-V219 WeakPolarHBondContact O-CB 3.43Å; M215-V219 VanDerWaalsContact O-CG2 3.29Å; M215-V219 WeakPolarHBondContact O-CG2 3.34Å; M215-V219 PolarHBondContact O-N 3.14Å; M215-V219 HydrophobicContact SD-CG2 4.44Å; F216-V219 PolarHBondContact O-N 3.3Å; V219-D221 VanDerWaalsContact C-N 3.35Å; V219-L222 PolarHBondContact O-N 3.3Å; V219-I223 HydrophobicContact CG1-CD1 3.77Å; V219-I223 HydrophobicContact CG1-CG1 4.42Å; V219-I223 WeakPolarHBondContact O-CD1 3.32Å; V219-I223 WeakPolarHBondContact O-CG1 3.44Å; V219-I223 PolarHBondContact O-N 3.32Å; V219-L245 HydrophobicContact CG1-CD2 4.47Å
220	K	88.8	Confident	84.8	Confident	39 Å²	39	38.1 Å²	38.1	17%	0.17	21%	0.209	C	C	.	.	H	α-helix	trans	-59.5	-45	174.6	179.4	-148.3	70.4	179	0	111	F216 M217 T218 I223 W224 L257 L260	F216-K220 HydrophobicContact CE1-CD 4.5Å; F216-K220 WeakPolarHBondContact O-CB 3.42Å; F216-K220 PolarHBondContact O-N 2.99Å; M217-K220 WeakPolarHBondContact O-CB 3.35Å; M217-K220 PolarHBondContact O-N 3.45Å; M217-K220 HydrophobicContact SD-CD 4.34Å; M217-K220 PolarHBondContact SD-NZ 2.82Å; M217-K220 VanDerWaalsContact SD-NZ 3.41Å; T218-K220 VanDerWaalsContact C-N 3.33Å; K220-I223 PolarHBondContact O-N 3.36Å; K220-W224 PolarHBondContact O-N 3.44Å; K220-L257 HydrophobicContact CG-CD2 4.45Å; K220-L260 HydrophobicContact CD-CD1 4.03Å; K220-L260 HydrophobicContact CG-CD1 4.33Å
221	D	87.2	Confident	85.6	Confident	68 Å²	68	39.2 Å²	39.2	36%	0.364	21%	0.213	S	C	.	.	H	α-helix	trans	-65.7	-38.8	178.8	-65.2	-14.9	0	0	0	111.9	M217 T218 V219 W224 N225	M217-D221 PolarHBondContact O-N 2.73Å; T218-D221 PolarHBondContact O-N 3.4Å; V219-D221 VanDerWaalsContact C-N 3.35Å; D221-W224 PolarHBondContact O-N 3.47Å; D221-N225 WeakPolarHBondContact O-CB 3.34Å; D221-N225 VanDerWaalsContact O-CG 3.31Å; D221-N225 PolarHBondContact O-N 3.24Å; D221-N225 PolarHBondContact O-ND2 2.7Å
222	L	90.2	Very high	85.8	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-61.1	-47	172.6	178.3	62.1	0	0	0	111.8	I152 M155 A172 V173 L176 T218 V219 W224 N225 C226	I152-L222 HydrophobicContact CD1-CB 3.93Å; I152-L222 HydrophobicContact CG1-CB 4.11Å; I152-L222 HydrophobicContact CG1-CD1 4.06Å; M155-L222 HydrophobicContact CE-CD1 4.46Å; M155-L222 HydrophobicContact SD-CD1 3.8Å; A172-L222 HydrophobicContact CB-CD1 3.88Å; A172-L222 HydrophobicContact CB-CD2 4.1Å; V173-L222 HydrophobicContact CG2-CD2 4.06Å; V173-L222 HydrophobicContact CG2-CG 4.31Å; L176-L222 HydrophobicContact CD2-CD2 4.22Å; T218-L222 PolarHBondContact O-N 2.81Å; V219-L222 PolarHBondContact O-N 3.3Å; L222-W224 VanDerWaalsContact C-N 3.34Å; L222-W224 PolarHBondContact O-N 3.4Å; L222-N225 PolarHBondContact O-N 3.46Å; L222-C226 PolarHBondContact O-N 3.15Å; L222-C226 VanDerWaalsContact O-N 3.14Å; L222-C226 PolarHBondContact O-SG 2.79Å
223	I	90	Very high	86.2	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-58.9	-48.1	178.4	-68.8	162.5	0	0	0	109.9	V219 K220 C226 C227 L242 F246 L257 I282	V219-I223 HydrophobicContact CG1-CD1 3.77Å; V219-I223 HydrophobicContact CG1-CG1 4.42Å; V219-I223 WeakPolarHBondContact O-CD1 3.32Å; V219-I223 WeakPolarHBondContact O-CG1 3.44Å; V219-I223 PolarHBondContact O-N 3.32Å; K220-I223 PolarHBondContact O-N 3.36Å; I223-C226 PolarHBondContact O-N 2.95Å; I223-C227 PolarHBondContact O-N 2.89Å; I223-C227 VanDerWaalsContact O-N 3.15Å; I223-C227 PolarHBondContact O-SG 3.37Å; I223-L242 HydrophobicContact CG1-CD2 3.96Å; I223-F246 HydrophobicContact CD1-CE1 3.78Å; I223-F246 HydrophobicContact CG1-CE1 4.24Å; I223-F246 HydrophobicContact CG2-CZ 4.4Å; I223-L257 HydrophobicContact CD1-CD1 4.02Å; I223-L257 HydrophobicContact CD1-CD2 4.23Å; I223-I282 HydrophobicContact CG2-CD1 3.3Å
224	W	89	Confident	86.4	Confident	31 Å²	31	36 Å²	36	12%	0.117	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-44.8	-179.8	-69.2	141.2	0	0	0	112.3	K220 D221 L222 C226 C227 T228 L260 S261 I264 V279 I282	K220-W224 PolarHBondContact O-N 3.44Å; D221-W224 PolarHBondContact O-N 3.47Å; L222-W224 VanDerWaalsContact C-N 3.34Å; L222-W224 PolarHBondContact O-N 3.4Å; W224-C226 PolarHBondContact O-N 2.84Å; W224-C226 VanDerWaalsContact O-N 3.15Å; W224-C227 VanDerWaalsContact CZ3-SG 3.58Å; W224-C227 PolarHBondContact O-N 2.77Å; W224-T228 HydrophobicContact CE3-CG2 4.27Å; W224-T228 PolarHBondContact O-N 3.22Å; W224-T228 PolarHBondContact O-OG1 3.28Å; W224-L260 HydrophobicContact CZ2-CB 4.42Å; W224-S261 WeakPolarHBondContact CH2-OG 3.36Å; W224-I264 HydrophobicContact CD2-CD1 4.34Å; W224-I264 HydrophobicContact CH2-CD1 4.09Å; W224-I264 HydrophobicContact CZ2-CD1 3.68Å; W224-I264 HydrophobicContact CZ3-CD1 4.5Å; W224-V279 HydrophobicContact CE3-CG2 4.46Å; W224-V279 HydrophobicContact CZ3-CG1 4.39Å; W224-V279 HydrophobicContact CZ3-CG2 4.06Å; W224-I282 HydrophobicContact CZ3-CD1 4.49Å; W224-I282 HydrophobicContact CZ3-CG2 4.48Å
225	N	87.4	Confident	86.7	Confident	46 Å²	46	35.1 Å²	35.1	25%	0.246	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-30.5	175.6	-73.9	-27.3	0	0	0	113.3	I152 M155 D221 L222	I152-N225 WeakPolarHBondContact CG2-ND2 3.47Å; M155-N225 HydrophobicContact CE-CB 4.07Å; D221-N225 WeakPolarHBondContact O-CB 3.34Å; D221-N225 VanDerWaalsContact O-CG 3.31Å; D221-N225 PolarHBondContact O-N 3.24Å; D221-N225 PolarHBondContact O-ND2 2.7Å; L222-N225 PolarHBondContact O-N 3.46Å
226	C	89.7	Confident	86.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-75.8	-41.3	177.6	-66	0	0	0	0	112.9	L222 I223 W224 T238 L242	L222-C226 PolarHBondContact O-N 3.15Å; L222-C226 VanDerWaalsContact O-N 3.14Å; L222-C226 PolarHBondContact O-SG 2.79Å; I223-C226 PolarHBondContact O-N 2.95Å; W224-C226 PolarHBondContact O-N 2.84Å; W224-C226 VanDerWaalsContact O-N 3.15Å; C226-T238 HydrophobicContact CB-CG2 4.19Å; C226-L242 HydrophobicContact CB-CD1 4.14Å
227	C	86.4	Confident	86.7	Confident	5 Å²	5	38.6 Å²	38.6	3%	0.034	20%	0.2	C	C	.	.	H	α-helix	trans	-95.9	-20.5	-174.4	66	0	0	0	0	114.8	I223 W224 D229 R235 G278 I282	I223-C227 PolarHBondContact O-N 2.89Å; I223-C227 VanDerWaalsContact O-N 3.15Å; I223-C227 PolarHBondContact O-SG 3.37Å; W224-C227 VanDerWaalsContact CZ3-SG 3.58Å; W224-C227 PolarHBondContact O-N 2.77Å; C227-D229 VanDerWaalsContact C-N 3.31Å; C227-R235 WeakPolarHBondContact O-CD 3.3Å; C227-G278 VanDerWaalsContact O-CA 3.27Å; C227-G278 WeakPolarHBondContact O-CA 3.06Å; C227-I282 HydrophobicContact CB-CD1 3.33Å; C227-I282 HydrophobicContact CB-CG1 3.55Å; C227-I282 WeakPolarHBondContact SG-CD1 3.45Å
228	T	86	Confident	86.7	Confident	48 Å²	48	34.9 Å²	34.9	29%	0.294	18%	0.182	S	C	.	.	S	Bend	trans	-96.7	13.6	174.1	68.9	0	0	0	0	112	W224 V275 V279	W224-T228 HydrophobicContact CE3-CG2 4.27Å; W224-T228 PolarHBondContact O-N 3.22Å; W224-T228 PolarHBondContact O-OG1 3.28Å; T228-V275 HydrophobicContact CG2-CG1 3.81Å; T228-V279 HydrophobicContact CG2-CG2 4.07Å
229	D	87.2	Confident	86.7	Confident	14 Å²	14	36 Å²	36	8%	0.075	19%	0.187	C	C	.	.			trans	-63.3	142.5	174.4	-161	-72.9	0	0	0	110.7	R165 C227 N231 I234 R235	R165-D229 IonicContact CZ-OD1 2.68Å; R165-D229 IonicContact CZ-OD2 3.19Å; R165-D229 IonicContact NE-OD1 3.71Å; R165-D229 IonicContact NE-OD2 3.36Å; R165-D229 PolarHBondContact NE-OD2 3.32Å; R165-D229 IonicContact NH2-OD1 3.84Å; R165-D229 PolarHBondContact NH2-OD1 3.05Å; R165-D229 IonicContact NH2-OD2 2.75Å; R165-D229 PolarHBondContact NH2-OD2 3.47Å; C227-D229 VanDerWaalsContact C-N 3.31Å; D229-N231 VanDerWaalsContact C-N 3.26Å; D229-N231 PolarHBondContact O-N 3.42Å; D229-N231 WeakPolarHBondContact OD1-CB 3.38Å; D229-N231 PolarHBondContact OD1-N 2.92Å; D229-I234 HydrophobicContact CB-CB 4.31Å; D229-I234 HydrophobicContact CB-CG2 4.22Å; D229-R235 HydrophobicContact CB-CG 4.27Å; D229-R235 WeakPolarHBondContact O-CD 3.39Å; D229-R235 PolarHBondContact O-NH1 3.12Å
230	N	85.3	Confident	86.5	Confident	110 Å²	110	37.2 Å²	37.2	59%	0.588	20%	0.202	S	C	*	.	S	Bend	trans	-64.3	-31.2	177.1	60.1	-9.1	0	0	0	112.2	R165 R235	R165-N230 PolarHBondContact NH2-OD1 2.84Å; N230-R235 PolarHBondContact O-NH1 3.06Å
231	N	85.9	Confident	86.3	Confident	43 Å²	43	36.6 Å²	36.6	23%	0.23	20%	0.202	C	C	.	.			trans	-87.5	118.6	-177.9	-167.4	-48.9	0	0	0	112.9	H162 D229 S233 I234 R235	H162-N231 WeakPolarHBondContact CB-ND2 3.43Å; H162-N231 PolarHBondContact ND1-ND2 2.99Å; D229-N231 VanDerWaalsContact C-N 3.26Å; D229-N231 PolarHBondContact O-N 3.42Å; D229-N231 WeakPolarHBondContact OD1-CB 3.38Å; D229-N231 PolarHBondContact OD1-N 2.92Å; N231-S233 VanDerWaalsContact C-N 3.26Å; N231-S233 PolarHBondContact O-N 3.12Å; N231-S233 WeakPolarHBondContact OD1-CB 3.36Å; N231-S233 PolarHBondContact OD1-N 3.45Å; N231-I234 HydrophobicContact CB-CD1 4.14Å; N231-I234 HydrophobicContact CB-CG1 4.12Å; N231-I234 PolarHBondContact O-N 3.1Å; N231-I234 VanDerWaalsContact O-N 3.09Å; N231-R235 PolarHBondContact O-N 3.38Å
232	R	83.4	Confident	86.3	Confident	136 Å²	136	33.4 Å²	33.4	51%	0.513	19%	0.185	S	C	.	.	H	α-helix	trans	-60.6	-29.9	-180	-170.7	170.5	-178.2	-101	-4.1	113.8	I234 R235 M236 E277	R232-I234 VanDerWaalsContact C-N 3.27Å; R232-I234 PolarHBondContact O-N 3.11Å; R232-R235 PolarHBondContact O-N 2.93Å; R232-M236 HydrophobicContact CG-CG 3.98Å; R232-M236 WeakPolarHBondContact O-CB 3.44Å; R232-M236 WeakPolarHBondContact O-CG 3.31Å; R232-M236 PolarHBondContact O-N 2.98Å; R232-E277 IonicContact NE-OE1 3.69Å; R232-E277 PolarHBondContact NE-OE1 3.39Å
233	S	83.2	Confident	86	Confident	47 Å²	47	35.3 Å²	35.3	33%	0.329	19%	0.192	S	C	.	.	H	α-helix	trans	-66.1	-30.8	177.6	-171.9	0	0	0	0	112.4	K166 N231 G237	K166-S233 WeakPolarHBondContact CE-O 3.38Å; K166-S233 PolarHBondContact NZ-O 3.18Å; K166-S233 PolarHBondContact NZ-OG 3.45Å; N231-S233 VanDerWaalsContact C-N 3.26Å; N231-S233 PolarHBondContact O-N 3.12Å; N231-S233 WeakPolarHBondContact OD1-CB 3.36Å; N231-S233 PolarHBondContact OD1-N 3.45Å; S233-G237 WeakPolarHBondContact O-CA 3.34Å; S233-G237 PolarHBondContact O-N 2.9Å
234	I	86.4	Confident	85.6	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-75.4	-51.6	175.6	-56.8	-175.6	0	0	0	109.4	H162 R165 K166 D229 N231 R232 M236 G237 T238	H162-I234 WeakPolarHBondContact O-CD1 3.36Å; R165-I234 HydrophobicContact CB-CD1 4.07Å; R165-I234 HydrophobicContact CG-CD1 4.22Å; K166-I234 HydrophobicContact CB-CD1 4.39Å; K166-I234 HydrophobicContact CB-CG1 3.92Å; K166-I234 HydrophobicContact CG-CG1 4.3Å; D229-I234 HydrophobicContact CB-CB 4.31Å; D229-I234 HydrophobicContact CB-CG2 4.22Å; N231-I234 HydrophobicContact CB-CD1 4.14Å; N231-I234 HydrophobicContact CB-CG1 4.12Å; N231-I234 PolarHBondContact O-N 3.1Å; N231-I234 VanDerWaalsContact O-N 3.09Å; R232-I234 VanDerWaalsContact C-N 3.27Å; R232-I234 PolarHBondContact O-N 3.11Å; I234-M236 VanDerWaalsContact C-N 3.34Å; I234-M236 PolarHBondContact O-N 3.42Å; I234-G237 PolarHBondContact O-N 3.15Å; I234-T238 HydrophobicContact CG2-CG2 4.24Å; I234-T238 WeakPolarHBondContact O-CB 3.24Å; I234-T238 WeakPolarHBondContact O-CG2 3.49Å; I234-T238 PolarHBondContact O-N 3.38Å; I234-T238 PolarHBondContact O-OG1 3.28Å
235	R	87.3	Confident	85.4	Confident	14 Å²	14	35.6 Å²	35.6	5%	0.053	20%	0.199	C	C	.	.	H	α-helix	trans	-53	-51.2	176.6	-60.1	-163.1	-62.5	-84.1	10.6	111.7	C227 D229 N230 N231 R232 T238 L239 E277	C227-R235 WeakPolarHBondContact O-CD 3.3Å; D229-R235 HydrophobicContact CB-CG 4.27Å; D229-R235 WeakPolarHBondContact O-CD 3.39Å; D229-R235 PolarHBondContact O-NH1 3.12Å; N230-R235 PolarHBondContact O-NH1 3.06Å; N231-R235 PolarHBondContact O-N 3.38Å; R232-R235 PolarHBondContact O-N 2.93Å; R235-T238 PolarHBondContact O-OG1 3.14Å; R235-L239 WeakPolarHBondContact O-CG 3.39Å; R235-L239 PolarHBondContact O-N 2.9Å; R235-E277 IonicContact CZ-OE2 3.09Å; R235-E277 IonicContact NE-OE2 3.94Å; R235-E277 IonicContact NH2-OE2 2.69Å; R235-E277 PolarHBondContact NH2-OE2 3.1Å
236	M	83.4	Confident	85.2	Confident	83 Å²	83	33.5 Å²	33.5	41%	0.409	19%	0.188	S	C	.	.	H	α-helix	trans	-72.1	-34.4	-179.1	-65.4	-57.1	-58	0	0	113.5	R232 I234 L239	R232-M236 HydrophobicContact CG-CG 3.98Å; R232-M236 WeakPolarHBondContact O-CB 3.44Å; R232-M236 WeakPolarHBondContact O-CG 3.31Å; R232-M236 PolarHBondContact O-N 2.98Å; I234-M236 VanDerWaalsContact C-N 3.34Å; I234-M236 PolarHBondContact O-N 3.42Å; M236-L239 HydrophobicContact CE-CD1 4.04Å; M236-L239 HydrophobicContact SD-CD1 3.73Å
237	G	84	Confident	84.5	Confident	25 Å²	25	33.8 Å²	33.8	26%	0.258	19%	0.191	S	C	.	.	H	α-helix	trans	-70.6	-33	179.4	0	0	0	0	0	113.5	S233 I234 P241	S233-G237 WeakPolarHBondContact O-CA 3.34Å; S233-G237 PolarHBondContact O-N 2.9Å; I234-G237 PolarHBondContact O-N 3.15Å; G237-P241 WeakPolarHBondContact O-CD 3.16Å
238	T	87.2	Confident	84	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-86	-19.6	-178.2	55.4	0	0	0	0	113.5	A169 L170 C226 I234 R235 G240 P241 L242	A169-T238 HydrophobicContact CB-CG2 3.79Å; L170-T238 HydrophobicContact CD2-CG2 4.32Å; C226-T238 HydrophobicContact CB-CG2 4.19Å; I234-T238 HydrophobicContact CG2-CG2 4.24Å; I234-T238 WeakPolarHBondContact O-CB 3.24Å; I234-T238 WeakPolarHBondContact O-CG2 3.49Å; I234-T238 PolarHBondContact O-N 3.38Å; I234-T238 PolarHBondContact O-OG1 3.28Å; R235-T238 PolarHBondContact O-OG1 3.14Å; T238-G240 VanDerWaalsContact C-N 3.28Å; T238-G240 PolarHBondContact O-N 3.31Å; T238-P241 VanDerWaalsContact O-CD 3.28Å; T238-P241 WeakPolarHBondContact O-CD 3.22Å; T238-L242 WeakPolarHBondContact O-CB 3.29Å; T238-L242 VanDerWaalsContact O-CG 3.28Å; T238-L242 WeakPolarHBondContact O-CG 3.33Å; T238-L242 PolarHBondContact O-N 3.31Å
239	L	85	Confident	83.7	Confident	30 Å²	30	35.3 Å²	35.3	16%	0.157	20%	0.195	C	C	.	.	H	α-helix	trans	-54	-39.6	178.2	-89.9	164.7	0	0	0	113.7	R235 M236 Y243 D281 V285	R235-L239 WeakPolarHBondContact O-CG 3.39Å; R235-L239 PolarHBondContact O-N 2.9Å; M236-L239 HydrophobicContact CE-CD1 4.04Å; M236-L239 HydrophobicContact SD-CD1 3.73Å; L239-Y243 PolarHBondContact O-N 3.19Å; L239-D281 HydrophobicContact CD1-CB 4.14Å; L239-D281 HydrophobicContact CD2-CB 4.25Å; L239-V285 HydrophobicContact CD2-CG2 3.7Å
240	G	83	Confident	83.2	Confident	36 Å²	36	37.7 Å²	37.7	37%	0.371	21%	0.213	S	C	.	.	H	α-helix	trans	-64.2	-56.6	177.9	0	0	0	0	0	112.8	T238 L242 Y243 S244	T238-G240 VanDerWaalsContact C-N 3.28Å; T238-G240 PolarHBondContact O-N 3.31Å; G240-L242 VanDerWaalsContact C-N 3.33Å; G240-L242 PolarHBondContact O-N 3.24Å; G240-Y243 WeakPolarHBondContact O-CB 2.92Å; G240-Y243 PolarHBondContact O-N 3.17Å; G240-Y243 VanDerWaalsContact O-N 3.17Å; G240-S244 PolarHBondContact O-N 3.44Å
241	P	85.1	Confident	82.6	Confident	26 Å²	26	34.5 Å²	34.5	17%	0.169	20%	0.197	C	C	.	.	H	α-helix	trans	-56.3	-41.9	172.8	-29.6	36.2	0	0	0	113.8	L170 V173 G237 T238 Y243 S244 L245	L170-P241 HydrophobicContact CD2-CG 3.61Å; V173-P241 HydrophobicContact CB-CB 4.22Å; V173-P241 HydrophobicContact CG1-CB 3.61Å; G237-P241 WeakPolarHBondContact O-CD 3.16Å; T238-P241 VanDerWaalsContact O-CD 3.28Å; T238-P241 WeakPolarHBondContact O-CD 3.22Å; P241-Y243 VanDerWaalsContact C-N 3.28Å; P241-Y243 PolarHBondContact O-N 3.35Å; P241-S244 WeakPolarHBondContact O-CA 3.09Å; P241-S244 VanDerWaalsContact O-CB 3.28Å; P241-S244 WeakPolarHBondContact O-CB 3.38Å; P241-S244 PolarHBondContact O-N 3.28Å; P241-L245 PolarHBondContact O-N 3.22Å
242	L	88.2	Confident	82.2	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-60.8	-37.5	175.9	-74.9	173.6	0	0	0	112.1	V173 I223 C226 T238 G240 S244 L245 F246 I282	V173-L242 HydrophobicContact CG1-CD2 4.22Å; V173-L242 HydrophobicContact CG2-CD2 3.97Å; I223-L242 HydrophobicContact CG1-CD2 3.96Å; C226-L242 HydrophobicContact CB-CD1 4.14Å; T238-L242 WeakPolarHBondContact O-CB 3.29Å; T238-L242 VanDerWaalsContact O-CG 3.28Å; T238-L242 WeakPolarHBondContact O-CG 3.33Å; T238-L242 PolarHBondContact O-N 3.31Å; G240-L242 VanDerWaalsContact C-N 3.33Å; G240-L242 PolarHBondContact O-N 3.24Å; L242-S244 VanDerWaalsContact C-N 3.29Å; L242-S244 PolarHBondContact O-N 3.48Å; L242-L245 HydrophobicContact CD2-CD2 4.17Å; L242-L245 WeakPolarHBondContact O-CB 3.31Å; L242-L245 PolarHBondContact O-N 3.07Å; L242-F246 HydrophobicContact CB-CE2 4.26Å; L242-F246 HydrophobicContact CB-CZ 4.2Å; L242-F246 WeakPolarHBondContact O-CD1 3.4Å; L242-F246 VanDerWaalsContact O-CD2 3.29Å; L242-F246 WeakPolarHBondContact O-CD2 3.36Å; L242-F246 WeakPolarHBondContact O-CG 3.48Å; L242-F246 PolarHBondContact O-N 3.36Å; L242-I282 HydrophobicContact CD1-CD1 3.99Å
243	Y	83.1	Confident	82.2	Confident	42 Å²	42	33.7 Å²	33.7	17%	0.165	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-38.9	173.7	-177	-111.5	0	0	0	112.4	L239 G240 P241 G247 V285 R289 M309	L239-Y243 PolarHBondContact O-N 3.19Å; G240-Y243 WeakPolarHBondContact O-CB 2.92Å; G240-Y243 PolarHBondContact O-N 3.17Å; G240-Y243 VanDerWaalsContact O-N 3.17Å; P241-Y243 VanDerWaalsContact C-N 3.28Å; P241-Y243 PolarHBondContact O-N 3.35Å; Y243-G247 PolarHBondContact O-N 3.47Å; Y243-V285 HydrophobicContact CD2-CG1 3.42Å; Y243-V285 VanDerWaalsContact CD2-CG1 3.42Å; Y243-V285 HydrophobicContact CE2-CG1 4.34Å; Y243-V285 HydrophobicContact CG-CG1 4.16Å; Y243-R289 HydrophobicContact CE2-CG 4.23Å; Y243-M309 HydrophobicContact CE1-CE 3.85Å; Y243-M309 HydrophobicContact CE2-CE 4.23Å; Y243-M309 VanDerWaalsContact CZ-CE 3.5Å; Y243-M309 WeakPolarHBondContact OH-CE 3.41Å
244	S	81.1	Confident	82.2	Confident	40 Å²	40	31.4 Å²	31.4	28%	0.28	19%	0.189	S	C	.	.	H	α-helix	trans	-64.7	-44.2	174.2	-167.5	0	0	0	0	111.6	G240 P241 L242 F246 G247	G240-S244 PolarHBondContact O-N 3.44Å; P241-S244 WeakPolarHBondContact O-CA 3.09Å; P241-S244 VanDerWaalsContact O-CB 3.28Å; P241-S244 WeakPolarHBondContact O-CB 3.38Å; P241-S244 PolarHBondContact O-N 3.28Å; L242-S244 VanDerWaalsContact C-N 3.29Å; L242-S244 PolarHBondContact O-N 3.48Å; S244-F246 PolarHBondContact O-N 3.4Å; S244-G247 VanDerWaalsContact O-CA 3.31Å; S244-G247 WeakPolarHBondContact O-CA 3.48Å; S244-G247 PolarHBondContact O-N 3.17Å
245	L	84.6	Confident	82	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.3	-48.4	175.6	175.9	62.9	0	0	0	111.8	V173 L176 T177 L180 V219 P241 L242 G247 Q248 L249	V173-L245 HydrophobicContact CG1-CB 4.16Å; V173-L245 HydrophobicContact CG1-CD2 4.36Å; L176-L245 HydrophobicContact CB-CD1 4.43Å; L176-L245 HydrophobicContact CD2-CD1 3.55Å; L176-L245 HydrophobicContact CD2-CD2 3.68Å; L176-L245 HydrophobicContact CD2-CG 4.27Å; L176-L245 HydrophobicContact CG-CD1 3.6Å; T177-L245 WeakPolarHBondContact OG1-CA 3.47Å; T177-L245 WeakPolarHBondContact OG1-CB 3.48Å; L180-L245 HydrophobicContact CD1-CD1 3.91Å; V219-L245 HydrophobicContact CG1-CD2 4.47Å; P241-L245 PolarHBondContact O-N 3.22Å; L242-L245 HydrophobicContact CD2-CD2 4.17Å; L242-L245 WeakPolarHBondContact O-CB 3.31Å; L242-L245 PolarHBondContact O-N 3.07Å; L245-G247 PolarHBondContact O-N 2.86Å; L245-G247 VanDerWaalsContact O-N 3.09Å; L245-Q248 WeakPolarHBondContact O-CB 3.27Å; L245-Q248 PolarHBondContact O-N 3.23Å; L245-L249 PolarHBondContact O-N 3.09Å
246	F	83.6	Confident	81.9	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-17.6	176.2	-58.3	-24.5	0	0	0	112.8	I223 L242 S244 Q248 L249 L257 I282 V285 L286 R289	I223-F246 HydrophobicContact CD1-CE1 3.78Å; I223-F246 HydrophobicContact CG1-CE1 4.24Å; I223-F246 HydrophobicContact CG2-CZ 4.4Å; L242-F246 HydrophobicContact CB-CE2 4.26Å; L242-F246 HydrophobicContact CB-CZ 4.2Å; L242-F246 WeakPolarHBondContact O-CD1 3.4Å; L242-F246 VanDerWaalsContact O-CD2 3.29Å; L242-F246 WeakPolarHBondContact O-CD2 3.36Å; L242-F246 WeakPolarHBondContact O-CG 3.48Å; L242-F246 PolarHBondContact O-N 3.36Å; S244-F246 PolarHBondContact O-N 3.4Å; F246-Q248 VanDerWaalsContact C-N 3.27Å; F246-L249 HydrophobicContact CD1-CD1 3.85Å; F246-L257 HydrophobicContact CE1-CD1 4.39Å; F246-I282 HydrophobicContact CZ-CG2 4.28Å; F246-V285 HydrophobicContact CD2-CG1 3.73Å; F246-V285 HydrophobicContact CE2-CB 4.38Å; F246-V285 HydrophobicContact CE2-CG1 3.9Å; F246-L286 HydrophobicContact CD1-CD2 4.05Å; F246-L286 HydrophobicContact CD2-CD2 3.75Å; F246-L286 HydrophobicContact CD2-CG 4.39Å; F246-L286 HydrophobicContact CE1-CD2 4.05Å; F246-L286 HydrophobicContact CE2-CD2 3.75Å; F246-L286 HydrophobicContact CE2-CG 4.06Å; F246-L286 HydrophobicContact CG-CD2 3.91Å; F246-L286 HydrophobicContact CZ-CD2 3.9Å; F246-L286 HydrophobicContact CZ-CG 4.36Å; F246-R289 HydrophobicContact CB-CG 4.4Å
247	G	74.9	Confident	82.1	Confident	7 Å²	7	32.8 Å²	32.8	7%	0.072	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-30.1	168	0	0	0	0	0	114.1	Y243 S244 L245 L314	Y243-G247 PolarHBondContact O-N 3.47Å; S244-G247 VanDerWaalsContact O-CA 3.31Å; S244-G247 WeakPolarHBondContact O-CA 3.48Å; S244-G247 PolarHBondContact O-N 3.17Å; L245-G247 PolarHBondContact O-N 2.86Å; L245-G247 VanDerWaalsContact O-N 3.09Å; G247-L314 VanDerWaalsContact CA-CD2 3.48Å
248	Q	77.2	Confident	82.3	Confident	61 Å²	61	31.8 Å²	31.8	29%	0.285	18%	0.18	S	C	.	.	H	α-helix	trans	-97.1	-13.5	-176.3	-51.9	-53	-43.6	0	0	113.6	T177 L180 Q181 L245 F246	T177-Q248 HydrophobicContact CG2-CG 4.06Å; L180-Q248 HydrophobicContact CB-CB 4.08Å; L180-Q248 HydrophobicContact CB-CG 4.46Å; L180-Q248 HydrophobicContact CD1-CB 4.23Å; Q181-Q248 VanDerWaalsContact CG-CD 3.42Å; Q181-Q248 HydrophobicContact CG-CG 4.01Å; L245-Q248 WeakPolarHBondContact O-CB 3.27Å; L245-Q248 PolarHBondContact O-N 3.23Å; F246-Q248 VanDerWaalsContact C-N 3.27Å
249	L	78.6	Confident	82.2	Confident	24 Å²	24	36.6 Å²	36.6	13%	0.126	20%	0.2	C	C	.	.	S	Bend	trans	-80.1	147.3	-177	-62.3	-178.1	0	0	0	112.3	L180 L245 F246 T253 I254 L257	L180-L249 HydrophobicContact CD1-CD2 4.31Å; L245-L249 PolarHBondContact O-N 3.09Å; F246-L249 HydrophobicContact CD1-CD1 3.85Å; L249-T253 HydrophobicContact CB-CG2 4.37Å; L249-T253 HydrophobicContact CD1-CG2 4.12Å; L249-T253 HydrophobicContact CD2-CG2 4.43Å; L249-I254 HydrophobicContact CB-CG1 4.26Å; L249-L257 HydrophobicContact CD1-CD1 4.01Å
250	S	77.5	Confident	82.2	Confident	63 Å²	63	37.1 Å²	37.1	44%	0.441	20%	0.203	S	C	.	.			trans	-65.2	153.7	174.8	84.6	0	0	0	0	111.9	N252 T253 I254	S250-N252 VanDerWaalsContact C-N 3.25Å; S250-N252 PolarHBondContact O-N 2.89Å; S250-T253 WeakPolarHBondContact O-CB 3.43Å; S250-T253 PolarHBondContact O-N 2.92Å; S250-T253 VanDerWaalsContact O-N 3.07Å; S250-T253 PolarHBondContact OG-N 3.27Å; S250-T253 PolarHBondContact OG-OG1 2.78Å; S250-I254 PolarHBondContact O-N 3.3Å
251	T	73	Confident	82.5	Confident	44 Å²	44	35.4 Å²	35.4	27%	0.27	19%	0.186	S	C	.	.	H	α-helix	trans	-55.8	-39.9	175.8	-48.8	0	0	0	0	112.4	T253 I254 I255 C317 F319	T251-T253 VanDerWaalsContact C-N 3.32Å; T251-T253 PolarHBondContact O-N 2.91Å; T251-I254 PolarHBondContact O-N 3.24Å; T251-I255 HydrophobicContact CG2-CD1 4.07Å; T251-I255 VanDerWaalsContact O-CG1 3.31Å; T251-I255 WeakPolarHBondContact O-CG1 3.42Å; T251-I255 PolarHBondContact O-N 3.18Å; T251-C317 HydrophobicContact CG2-CB 3.99Å; T251-C317 WeakPolarHBondContact OG1-CB 3.44Å; T251-F319 HydrophobicContact CG2-CD2 4.31Å
252	N	77.3	Confident	82.4	Confident	128 Å²	128	34.5 Å²	34.5	68%	0.684	18%	0.18	S	C	*	.	H	α-helix	trans	-63.3	-39	178.2	-72.7	-19.6	0	0	0	111.8	S250 I255 R256	S250-N252 VanDerWaalsContact C-N 3.25Å; S250-N252 PolarHBondContact O-N 2.89Å; N252-I255 PolarHBondContact O-N 3.22Å; N252-R256 WeakPolarHBondContact O-CB 3.02Å; N252-R256 PolarHBondContact O-N 3.1Å
253	T	82.6	Confident	82.2	Confident	33 Å²	33	39 Å²	39	20%	0.202	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-44.6	175.7	-50.4	0	0	0	0	111.3	F216 L249 S250 T251 I255 R256 L257	F216-T253 HydrophobicContact CD2-CG2 3.78Å; F216-T253 HydrophobicContact CE2-CG2 3.82Å; L249-T253 HydrophobicContact CB-CG2 4.37Å; L249-T253 HydrophobicContact CD1-CG2 4.12Å; L249-T253 HydrophobicContact CD2-CG2 4.43Å; S250-T253 WeakPolarHBondContact O-CB 3.43Å; S250-T253 PolarHBondContact O-N 2.92Å; S250-T253 VanDerWaalsContact O-N 3.07Å; S250-T253 PolarHBondContact OG-N 3.27Å; S250-T253 PolarHBondContact OG-OG1 2.78Å; T251-T253 VanDerWaalsContact C-N 3.32Å; T251-T253 PolarHBondContact O-N 2.91Å; T253-I255 PolarHBondContact O-N 3.13Å; T253-R256 PolarHBondContact O-N 3.26Å; T253-L257 HydrophobicContact CG2-CD1 4.43Å; T253-L257 WeakPolarHBondContact O-CG 3.36Å; T253-L257 PolarHBondContact O-N 2.87Å
254	I	83.3	Confident	82.2	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-44.7	177.3	-66.5	173.2	0	0	0	110.6	L249 S250 T251 R256 L257 I258 L286 R289 L290	L249-I254 HydrophobicContact CB-CG1 4.26Å; S250-I254 PolarHBondContact O-N 3.3Å; T251-I254 PolarHBondContact O-N 3.24Å; I254-R256 VanDerWaalsContact C-N 3.31Å; I254-R256 PolarHBondContact O-N 3.01Å; I254-L257 PolarHBondContact O-N 3.5Å; I254-I258 HydrophobicContact CG2-CD1 3.94Å; I254-I258 WeakPolarHBondContact O-CG1 3.37Å; I254-I258 PolarHBondContact O-N 3.3Å; I254-L286 HydrophobicContact CG2-CD2 4.29Å; I254-R289 HydrophobicContact CD1-CB 4.34Å; I254-L290 HydrophobicContact CG2-CD2 4.37Å
255	I	81	Confident	82.2	Confident	26 Å²	26	38.6 Å²	38.6	13%	0.133	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-42.1	177.3	-66.9	163	0	0	0	110.9	T251 N252 T253 L257 I258 K259 F319	T251-I255 HydrophobicContact CG2-CD1 4.07Å; T251-I255 VanDerWaalsContact O-CG1 3.31Å; T251-I255 WeakPolarHBondContact O-CG1 3.42Å; T251-I255 PolarHBondContact O-N 3.18Å; N252-I255 PolarHBondContact O-N 3.22Å; T253-I255 PolarHBondContact O-N 3.13Å; I255-L257 VanDerWaalsContact C-N 3.35Å; I255-I258 PolarHBondContact O-N 3.07Å; I255-K259 HydrophobicContact CG2-CD 4.43Å; I255-K259 WeakPolarHBondContact O-CG 3.31Å; I255-K259 PolarHBondContact O-N 2.97Å; I255-F319 HydrophobicContact CD1-CD2 4.29Å; I255-F319 HydrophobicContact CD1-CE2 3.58Å; I255-F319 HydrophobicContact CD1-CZ 4.47Å; I255-F319 HydrophobicContact CG1-CE2 4.28Å
256	R	86.2	Confident	81.9	Confident	98 Å²	98	42.6 Å²	42.6	37%	0.37	22%	0.216	S	C	.	.	H	α-helix	trans	-63.5	-41.4	177.9	-167.2	174.3	178	-170.3	-3.6	111.6	E213 F216 N252 T253 I254 K259 L260	E213-R256 IonicContact OE1-CZ 2.79Å; E213-R256 IonicContact OE1-NH1 2.65Å; E213-R256 PolarHBondContact OE1-NH1 2.89Å; E213-R256 IonicContact OE1-NH2 2.81Å; E213-R256 PolarHBondContact OE1-NH2 2.87Å; E213-R256 IonicContact OE2-CZ 3.24Å; E213-R256 IonicContact OE2-NH1 3.89Å; E213-R256 PolarHBondContact OE2-NH1 3.15Å; E213-R256 IonicContact OE2-NH2 2.82Å; F216-R256 HydrophobicContact CE1-CG 4.18Å; F216-R256 VanDerWaalsContact CE1-CZ 3.41Å; F216-R256 HydrophobicContact CE2-CB 4.36Å; F216-R256 HydrophobicContact CE2-CG 4.29Å; F216-R256 HydrophobicContact CZ-CB 4.17Å; F216-R256 VanDerWaalsContact CZ-CD 3.49Å; F216-R256 HydrophobicContact CZ-CG 3.66Å; N252-R256 WeakPolarHBondContact O-CB 3.02Å; N252-R256 PolarHBondContact O-N 3.1Å; T253-R256 PolarHBondContact O-N 3.26Å; I254-R256 VanDerWaalsContact C-N 3.31Å; I254-R256 PolarHBondContact O-N 3.01Å; R256-K259 PolarHBondContact O-N 3.01Å; R256-L260 WeakPolarHBondContact O-CG 3.35Å; R256-L260 PolarHBondContact O-N 2.99Å; R256-L260 VanDerWaalsContact O-N 3.07Å
257	L	88.3	Confident	81.6	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-42.2	174.3	-71.4	171.4	0	0	0	111.9	F216 K220 I223 F246 L249 T253 I254 I255 K259 L260 S261 L286	F216-L257 HydrophobicContact CE2-CD2 4.11Å; F216-L257 HydrophobicContact CE2-CG 4.19Å; F216-L257 HydrophobicContact CZ-CD2 4.23Å; K220-L257 HydrophobicContact CG-CD2 4.45Å; I223-L257 HydrophobicContact CD1-CD1 4.02Å; I223-L257 HydrophobicContact CD1-CD2 4.23Å; F246-L257 HydrophobicContact CE1-CD1 4.39Å; L249-L257 HydrophobicContact CD1-CD1 4.01Å; T253-L257 HydrophobicContact CG2-CD1 4.43Å; T253-L257 WeakPolarHBondContact O-CG 3.36Å; T253-L257 PolarHBondContact O-N 2.87Å; I254-L257 PolarHBondContact O-N 3.5Å; I255-L257 VanDerWaalsContact C-N 3.35Å; L257-K259 PolarHBondContact O-N 3.4Å; L257-L260 PolarHBondContact O-N 2.99Å; L257-S261 PolarHBondContact O-N 2.93Å; L257-S261 PolarHBondContact O-OG 3.35Å; L257-S261 VanDerWaalsContact O-OG 3.1Å; L257-L286 HydrophobicContact CB-CD1 3.82Å; L257-L286 HydrophobicContact CB-CD2 4.36Å; L257-L286 HydrophobicContact CD1-CD2 4.22Å
258	I	86.8	Confident	80.8	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.015	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-47.4	175.9	-69.4	168	0	0	0	110.5	I254 I255 L260 S261 V262 L283 L286 L287 L290 L328	I254-I258 HydrophobicContact CG2-CD1 3.94Å; I254-I258 WeakPolarHBondContact O-CG1 3.37Å; I254-I258 PolarHBondContact O-N 3.3Å; I255-I258 PolarHBondContact O-N 3.07Å; I258-L260 VanDerWaalsContact C-N 3.3Å; I258-L260 PolarHBondContact O-N 3.44Å; I258-S261 WeakPolarHBondContact O-CB 3.47Å; I258-S261 PolarHBondContact O-N 3.23Å; I258-V262 HydrophobicContact CG2-CG2 4.41Å; I258-V262 VanDerWaalsContact O-CG2 3.3Å; I258-V262 WeakPolarHBondContact O-CG2 3.3Å; I258-V262 PolarHBondContact O-N 2.92Å; I258-L283 HydrophobicContact CG1-CD1 4.46Å; I258-L283 HydrophobicContact CG2-CD1 4.03Å; I258-L286 HydrophobicContact CD1-CB 4.22Å; I258-L286 HydrophobicContact CG1-CB 3.78Å; I258-L286 HydrophobicContact CG1-CD1 4.1Å; I258-L287 HydrophobicContact CD1-CD2 4.47Å; I258-L290 HydrophobicContact CD1-CD1 3.53Å; I258-L290 HydrophobicContact CD1-CG 4.19Å; I258-L328 HydrophobicContact CG2-CD1 3.81Å
259	K	85.3	Confident	79.9	Confident	102 Å²	102	59 Å²	59	44%	0.443	30%	0.3	S	S	.	.	H	α-helix	trans	-57.8	-43.3	177.6	-72.9	-179.6	178.9	-175.6	0	111.8	I255 R256 L257 V262 E263 Y323	I255-K259 HydrophobicContact CG2-CD 4.43Å; I255-K259 WeakPolarHBondContact O-CG 3.31Å; I255-K259 PolarHBondContact O-N 2.97Å; R256-K259 PolarHBondContact O-N 3.01Å; L257-K259 PolarHBondContact O-N 3.4Å; K259-V262 PolarHBondContact O-N 3.46Å; K259-E263 WeakPolarHBondContact O-CG 3.48Å; K259-E263 PolarHBondContact O-N 2.94Å; K259-Y323 WeakPolarHBondContact CE-OH 3.38Å
260	L	86.7	Confident	78.7	Confident	42 Å²	42	65 Å²	65	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-64.2	-43.5	176.1	-72.1	165.4	0	0	0	112.5	F216 K220 W224 R256 L257 I258 V262 E263 I264	F216-L260 HydrophobicContact CE1-CD1 4.15Å; F216-L260 HydrophobicContact CZ-CD1 3.83Å; K220-L260 HydrophobicContact CD-CD1 4.03Å; K220-L260 HydrophobicContact CG-CD1 4.33Å; W224-L260 HydrophobicContact CZ2-CB 4.42Å; R256-L260 WeakPolarHBondContact O-CG 3.35Å; R256-L260 PolarHBondContact O-N 2.99Å; R256-L260 VanDerWaalsContact O-N 3.07Å; L257-L260 PolarHBondContact O-N 2.99Å; I258-L260 VanDerWaalsContact C-N 3.3Å; I258-L260 PolarHBondContact O-N 3.44Å; L260-V262 PolarHBondContact O-N 3.19Å; L260-E263 PolarHBondContact O-N 2.69Å; L260-I264 VanDerWaalsContact O-CG1 3.31Å; L260-I264 WeakPolarHBondContact O-CG1 3.39Å; L260-I264 PolarHBondContact O-N 2.76Å
261	S	87.6	Confident	77.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-57.6	-40.6	173.4	-59.6	0	0	0	0	111.5	W224 L257 I258 L265	W224-S261 WeakPolarHBondContact CH2-OG 3.36Å; L257-S261 PolarHBondContact O-N 2.93Å; L257-S261 PolarHBondContact O-OG 3.35Å; L257-S261 VanDerWaalsContact O-OG 3.1Å; I258-S261 WeakPolarHBondContact O-CB 3.47Å; I258-S261 PolarHBondContact O-N 3.23Å; S261-L265 WeakPolarHBondContact O-CG 3.27Å; S261-L265 PolarHBondContact O-N 2.87Å
262	V	83.8	Confident	78.1	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.042	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-46.7	178.1	174.1	0	0	0	0	111.1	I258 K259 L260 I264 L265 E266 R331 L332 M335	I258-V262 HydrophobicContact CG2-CG2 4.41Å; I258-V262 VanDerWaalsContact O-CG2 3.3Å; I258-V262 WeakPolarHBondContact O-CG2 3.3Å; I258-V262 PolarHBondContact O-N 2.92Å; K259-V262 PolarHBondContact O-N 3.46Å; L260-V262 PolarHBondContact O-N 3.19Å; V262-I264 VanDerWaalsContact C-N 3.31Å; V262-I264 PolarHBondContact O-N 3.07Å; V262-L265 PolarHBondContact O-N 2.76Å; V262-E266 HydrophobicContact CG1-CG 4.38Å; V262-E266 WeakPolarHBondContact CG1-OE1 3.48Å; V262-E266 WeakPolarHBondContact O-CG 3.46Å; V262-E266 PolarHBondContact O-N 3.48Å; V262-R331 HydrophobicContact CG1-CG 4.36Å; V262-L332 HydrophobicContact CG2-CD2 3.52Å; V262-L332 HydrophobicContact CG2-CG 4.31Å; V262-M335 HydrophobicContact CB-CE 4.13Å; V262-M335 HydrophobicContact CG1-CE 3.73Å; V262-M335 HydrophobicContact CG2-CE 4.5Å; V262-M335 WeakPolarHBondContact O-CE 3.41Å
263	E	83.9	Confident	78.2	Confident	95 Å²	95	59.8 Å²	59.8	44%	0.444	32%	0.315	S	S	.	.	H	α-helix	trans	-61.6	-37.1	178.4	-74	168.7	-166.5	0	0	112.8	K259 L260 E266	K259-E263 WeakPolarHBondContact O-CG 3.48Å; K259-E263 PolarHBondContact O-N 2.94Å; L260-E263 PolarHBondContact O-N 2.69Å; E263-E266 PolarHBondContact O-N 3.07Å
264	I	82.4	Confident	78.2	Confident	48 Å²	48	61.7 Å²	61.7	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-45.6	176.9	-68.8	165	0	0	0	110.7	W224 L260 V262 E266 K267 V279	W224-I264 HydrophobicContact CD2-CD1 4.34Å; W224-I264 HydrophobicContact CH2-CD1 4.09Å; W224-I264 HydrophobicContact CZ2-CD1 3.68Å; W224-I264 HydrophobicContact CZ3-CD1 4.5Å; L260-I264 VanDerWaalsContact O-CG1 3.31Å; L260-I264 WeakPolarHBondContact O-CG1 3.39Å; L260-I264 PolarHBondContact O-N 2.76Å; V262-I264 VanDerWaalsContact C-N 3.31Å; V262-I264 PolarHBondContact O-N 3.07Å; I264-E266 VanDerWaalsContact C-N 3.29Å; I264-E266 PolarHBondContact O-N 3.08Å; I264-K267 PolarHBondContact O-N 3.39Å; I264-V279 HydrophobicContact CG2-CG1 4.38Å; I264-V279 HydrophobicContact CG2-CG2 4.15Å
265	L	80.8	Confident	78.2	Confident	25 Å²	25	63.3 Å²	63.3	13%	0.131	33%	0.332	C	S	.	.	H	α-helix	trans	-75.4	-16.2	-178.5	-69.1	171.8	0	0	0	113.2	S261 V262 T276 V279 I280 L283 M335	S261-L265 WeakPolarHBondContact O-CG 3.27Å; S261-L265 PolarHBondContact O-N 2.87Å; V262-L265 PolarHBondContact O-N 2.76Å; L265-T276 HydrophobicContact CD2-CG2 4.07Å; L265-V279 HydrophobicContact CD1-CG1 4.02Å; L265-V279 HydrophobicContact CD2-CB 4.25Å; L265-V279 HydrophobicContact CD2-CG1 4.05Å; L265-V279 HydrophobicContact CG-CB 4.48Å; L265-V279 HydrophobicContact CG-CG1 3.74Å; L265-I280 HydrophobicContact CD1-CG1 4.13Å; L265-I280 HydrophobicContact CD2-CG1 4.06Å; L265-L283 HydrophobicContact CD1-CD2 4.04Å; L265-M335 HydrophobicContact CB-CE 3.23Å; L265-M335 HydrophobicContact CB-CG 4.35Å; L265-M335 HydrophobicContact CB-SD 3.4Å; L265-M335 WeakPolarHBondContact CB-SD 3.48Å; L265-M335 HydrophobicContact CD1-CE 4.07Å; L265-M335 HydrophobicContact CD1-SD 3.86Å; L265-M335 HydrophobicContact CG-CE 4.28Å; L265-M335 HydrophobicContact CG-SD 4.26Å
266	E	79.1	Confident	78.4	Confident	85 Å²	85	63.1 Å²	63.1	40%	0.397	33%	0.332	S	S	.	.	H	α-helix	trans	-78.6	-18.2	172.5	-79.5	174.9	176.9	0	0	112.6	V262 E263 I264 R331 M335	V262-E266 HydrophobicContact CG1-CG 4.38Å; V262-E266 WeakPolarHBondContact CG1-OE1 3.48Å; V262-E266 WeakPolarHBondContact O-CG 3.46Å; V262-E266 PolarHBondContact O-N 3.48Å; E263-E266 PolarHBondContact O-N 3.07Å; I264-E266 VanDerWaalsContact C-N 3.29Å; I264-E266 PolarHBondContact O-N 3.08Å; E266-R331 IonicContact OE1-CZ 2.65Å; E266-R331 IonicContact OE1-NE 3.97Å; E266-R331 PolarHBondContact OE1-NE 2.95Å; E266-R331 IonicContact OE1-NH2 2.84Å; E266-R331 PolarHBondContact OE1-NH2 3.42Å; E266-R331 IonicContact OE2-CZ 3.96Å; E266-R331 IonicContact OE2-NE 3.2Å; E266-R331 IonicContact OE2-NH2 3.41Å; E266-R331 PolarHBondContact OE2-NH2 3.08Å; E266-M335 HydrophobicContact CG-CE 4.03Å; E266-M335 HydrophobicContact CG-CG 4.38Å
267	K	77.4	Confident	78.4	Confident	132 Å²	132	58.9 Å²	58.9	57%	0.574	32%	0.316	S	S	*	.			trans	-73.6	127.9	180	-71	-179.1	-179.5	-171.8	0	110.6	I264 E269	I264-K267 PolarHBondContact O-N 3.39Å; K267-E269 VanDerWaalsContact C-N 3.26Å; K267-E269 PolarHBondContact O-N 2.94Å
268	P	58.7	Low	78.3	Confident	130 Å²	130	58.9 Å²	58.9	84%	0.844	32%	0.317	S	S	*	.			trans	-77.1	-9.5	-178.8	30.7	-35.1	0	0	0	113.9	V270	P268-V270 PolarHBondContact O-N 3.3Å
269	E	58.4	Low	78.4	Confident	151 Å²	151	58.8 Å²	58.8	71%	0.706	32%	0.316	S	S	*	.	S	Bend	trans	-61.4	128	176.7	-69.7	173.1	-178.7	0	0	109.3	K267 C271	K267-E269 VanDerWaalsContact C-N 3.26Å; K267-E269 PolarHBondContact O-N 2.94Å; E269-C271 VanDerWaalsContact C-N 3.28Å; E269-C271 PolarHBondContact O-N 3.43Å
270	V	51.7	Low	78.5	Confident	149 Å²	149	54 Å²	54	90%	0.903	30%	0.296	S	S	*	.			trans	-57.8	87.9	-174.1	-175.5	0	0	0	0	109.8	P268 A272	P268-V270 PolarHBondContact O-N 3.3Å; V270-A272 PolarHBondContact O-N 3.36Å
271	C	62.6	Low	78.4	Confident	51 Å²	51	52.6 Å²	52.6	35%	0.345	29%	0.288	S	S	.	.			trans	-68.6	127.6	165.6	-71	0	0	0	0	106.4	E269 V275 T276	E269-C271 VanDerWaalsContact C-N 3.28Å; E269-C271 PolarHBondContact O-N 3.43Å; C271-V275 HydrophobicContact CB-CB 4.32Å; C271-V275 HydrophobicContact CB-CG1 4.2Å; C271-T276 PolarHBondContact O-OG1 2.7Å
272	A	75.9	Confident	78.4	Confident	50 Å²	50	52.6 Å²	52.6	41%	0.413	29%	0.288	S	S	.	.			trans	-47.9	145.7	174.2	0	0	0	0	0	110.2	V270 E274 V275 T276	V270-A272 PolarHBondContact O-N 3.36Å; A272-E274 WeakPolarHBondContact CB-OE2 3.4Å; A272-E274 PolarHBondContact O-N 2.71Å; A272-V275 HydrophobicContact CB-CG2 4.24Å; A272-V275 WeakPolarHBondContact O-CB 3.48Å; A272-V275 PolarHBondContact O-N 2.93Å; A272-T276 PolarHBondContact O-N 3.05Å; A272-T276 VanDerWaalsContact O-N 3.11Å; A272-T276 PolarHBondContact O-OG1 3.02Å
273	S	79.9	Confident	78.7	Confident	25 Å²	25	52.3 Å²	52.3	18%	0.175	29%	0.287	C	S	.	.	H	α-helix	trans	-56.6	-29.4	-170.7	81.5	0	0	0	0	112.6	E277	S273-E277 PolarHBondContact O-N 2.74Å
274	E	82	Confident	78.8	Confident	73 Å²	73	48.2 Å²	48.2	34%	0.341	27%	0.267	S	S	.	.	H	α-helix	trans	-67.9	-44.4	177.6	-57.5	71.7	-149.1	0	0	112	A272 T276 E277 G278	A272-E274 WeakPolarHBondContact CB-OE2 3.4Å; A272-E274 PolarHBondContact O-N 2.71Å; E274-T276 VanDerWaalsContact C-N 3.34Å; E274-E277 PolarHBondContact O-N 3.2Å; E274-G278 PolarHBondContact O-N 3.21Å
275	V	83.8	Confident	78.9	Confident	35 Å²	35	46.8 Å²	46.8	21%	0.212	26%	0.261	C	S	.	.	H	α-helix	trans	-65.1	-44.8	177.4	176	0	0	0	0	109.1	T228 C271 A272 G278 V279	T228-V275 HydrophobicContact CG2-CG1 3.81Å; C271-V275 HydrophobicContact CB-CB 4.32Å; C271-V275 HydrophobicContact CB-CG1 4.2Å; A272-V275 HydrophobicContact CB-CG2 4.24Å; A272-V275 WeakPolarHBondContact O-CB 3.48Å; A272-V275 PolarHBondContact O-N 2.93Å; V275-G278 PolarHBondContact O-N 2.95Å; V275-V279 HydrophobicContact CG1-CG2 4.43Å; V275-V279 VanDerWaalsContact O-CG2 3.3Å; V275-V279 WeakPolarHBondContact O-CG2 2.98Å; V275-V279 PolarHBondContact O-N 2.85Å
276	T	85.4	Confident	79.2	Confident	21 Å²	21	45.6 Å²	45.6	13%	0.129	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-46.7	178	-55.4	0	0	0	0	111.3	L265 C271 A272 E274 G278 V279 I280 L339 V347	L265-T276 HydrophobicContact CD2-CG2 4.07Å; C271-T276 PolarHBondContact O-OG1 2.7Å; A272-T276 PolarHBondContact O-N 3.05Å; A272-T276 VanDerWaalsContact O-N 3.11Å; A272-T276 PolarHBondContact O-OG1 3.02Å; E274-T276 VanDerWaalsContact C-N 3.34Å; T276-G278 VanDerWaalsContact C-N 3.34Å; T276-G278 PolarHBondContact O-N 3.18Å; T276-V279 PolarHBondContact O-N 3.13Å; T276-I280 HydrophobicContact CG2-CD1 3.84Å; T276-I280 WeakPolarHBondContact O-CB 3.49Å; T276-I280 WeakPolarHBondContact O-CD1 3.15Å; T276-I280 WeakPolarHBondContact O-CG1 3.47Å; T276-I280 PolarHBondContact O-N 3.36Å; T276-I280 VanDerWaalsContact O-N 3.09Å; T276-L339 HydrophobicContact CG2-CD2 4.07Å; T276-V347 HydrophobicContact CG2-CG1 3.8Å; T276-V347 HydrophobicContact CG2-CG2 4.34Å
277	E	85	Confident	79.3	Confident	10 Å²	10	41.7 Å²	41.7	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-55.1	-49.4	173.7	-178.6	-167.1	-161.8	0	0	111.2	R232 R235 S273 E274 I280 D281 I346	R232-E277 IonicContact NE-OE1 3.69Å; R232-E277 PolarHBondContact NE-OE1 3.39Å; R235-E277 IonicContact CZ-OE2 3.09Å; R235-E277 IonicContact NE-OE2 3.94Å; R235-E277 IonicContact NH2-OE2 2.69Å; R235-E277 PolarHBondContact NH2-OE2 3.1Å; S273-E277 PolarHBondContact O-N 2.74Å; E274-E277 PolarHBondContact O-N 3.2Å; E277-I280 PolarHBondContact O-N 2.85Å; E277-D281 PolarHBondContact O-N 3.39Å; E277-I346 HydrophobicContact CB-CG2 4.41Å; E277-I346 HydrophobicContact CG-CG2 3.75Å; E277-I346 WeakPolarHBondContact OE1-CG2 3.19Å
278	G	86.9	Confident	79.3	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-42.7	-176.6	0	0	0	0	0	114.3	C227 E274 V275 T276 I280 D281 I282	C227-G278 VanDerWaalsContact O-CA 3.27Å; C227-G278 WeakPolarHBondContact O-CA 3.06Å; E274-G278 PolarHBondContact O-N 3.21Å; V275-G278 PolarHBondContact O-N 2.95Å; T276-G278 VanDerWaalsContact C-N 3.34Å; T276-G278 PolarHBondContact O-N 3.18Å; G278-I280 VanDerWaalsContact C-N 3.34Å; G278-D281 PolarHBondContact O-N 3.1Å; G278-I282 PolarHBondContact O-N 2.88Å
279	V	88.6	Confident	80	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-65.1	-40.3	176.1	177.5	0	0	0	0	110.7	W224 T228 I264 L265 V275 T276 I282 L283	W224-V279 HydrophobicContact CE3-CG2 4.46Å; W224-V279 HydrophobicContact CZ3-CG1 4.39Å; W224-V279 HydrophobicContact CZ3-CG2 4.06Å; T228-V279 HydrophobicContact CG2-CG2 4.07Å; I264-V279 HydrophobicContact CG2-CG1 4.38Å; I264-V279 HydrophobicContact CG2-CG2 4.15Å; L265-V279 HydrophobicContact CD1-CG1 4.02Å; L265-V279 HydrophobicContact CD2-CB 4.25Å; L265-V279 HydrophobicContact CD2-CG1 4.05Å; L265-V279 HydrophobicContact CG-CB 4.48Å; L265-V279 HydrophobicContact CG-CG1 3.74Å; V275-V279 HydrophobicContact CG1-CG2 4.43Å; V275-V279 VanDerWaalsContact O-CG2 3.3Å; V275-V279 WeakPolarHBondContact O-CG2 2.98Å; V275-V279 PolarHBondContact O-N 2.85Å; T276-V279 PolarHBondContact O-N 3.13Å; V279-I282 PolarHBondContact O-N 3.26Å; V279-L283 WeakPolarHBondContact O-CB 3.25Å; V279-L283 PolarHBondContact O-N 3.32Å
280	I	87.7	Confident	80.7	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.015	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-44.3	175.4	-68	168.3	0	0	0	110.8	L265 T276 E277 G278 L283 N284 L339 V347 A350 V354	L265-I280 HydrophobicContact CD1-CG1 4.13Å; L265-I280 HydrophobicContact CD2-CG1 4.06Å; T276-I280 HydrophobicContact CG2-CD1 3.84Å; T276-I280 WeakPolarHBondContact O-CB 3.49Å; T276-I280 WeakPolarHBondContact O-CD1 3.15Å; T276-I280 WeakPolarHBondContact O-CG1 3.47Å; T276-I280 PolarHBondContact O-N 3.36Å; T276-I280 VanDerWaalsContact O-N 3.09Å; E277-I280 PolarHBondContact O-N 2.85Å; G278-I280 VanDerWaalsContact C-N 3.34Å; I280-L283 PolarHBondContact O-N 2.93Å; I280-N284 WeakPolarHBondContact O-CB 3.37Å; I280-N284 PolarHBondContact O-N 3.45Å; I280-L339 HydrophobicContact CD1-CD1 3.74Å; I280-L339 HydrophobicContact CG1-CD1 4.29Å; I280-V347 HydrophobicContact CD1-CG1 4.05Å; I280-A350 HydrophobicContact CB-CB 4.33Å; I280-A350 HydrophobicContact CG2-CB 3.58Å; I280-A350 WeakPolarHBondContact CG2-O 3.4Å; I280-V354 HydrophobicContact CB-CG2 4.49Å; I280-V354 HydrophobicContact CG2-CB 4.16Å; I280-V354 HydrophobicContact CG2-CG2 3.33Å; I280-V354 WeakPolarHBondContact O-CG2 3.25Å
281	D	85.1	Confident	81.3	Confident	11 Å²	11	22 Å²	22	6%	0.059	12%	0.123	C	C	.	.	H	α-helix	trans	-66.7	-38.2	179.2	-86.2	-27.4	0	0	0	112.2	L239 E277 G278 N284 V285 R353	L239-D281 HydrophobicContact CD1-CB 4.14Å; L239-D281 HydrophobicContact CD2-CB 4.25Å; E277-D281 PolarHBondContact O-N 3.39Å; G278-D281 PolarHBondContact O-N 3.1Å; D281-N284 VanDerWaalsContact O-CB 3.25Å; D281-N284 WeakPolarHBondContact O-CB 3.41Å; D281-N284 PolarHBondContact O-N 3.18Å; D281-V285 WeakPolarHBondContact O-CG2 3.36Å; D281-V285 PolarHBondContact O-N 3.33Å; D281-V285 VanDerWaalsContact O-N 3.14Å; D281-R353 IonicContact OD1-NH1 3.71Å; D281-R353 PolarHBondContact OD1-NH1 2.98Å
282	I	88	Confident	81.1	Confident	1 Å²	1	20 Å²	20	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-63.7	-46.2	171.2	-74.2	-153.3	0	0	0	111.4	I223 W224 C227 L242 F246 G278 V279 N284 V285 L286	I223-I282 HydrophobicContact CG2-CD1 3.3Å; W224-I282 HydrophobicContact CZ3-CD1 4.49Å; W224-I282 HydrophobicContact CZ3-CG2 4.48Å; C227-I282 HydrophobicContact CB-CD1 3.33Å; C227-I282 HydrophobicContact CB-CG1 3.55Å; C227-I282 WeakPolarHBondContact SG-CD1 3.45Å; L242-I282 HydrophobicContact CD1-CD1 3.99Å; F246-I282 HydrophobicContact CZ-CG2 4.28Å; G278-I282 PolarHBondContact O-N 2.88Å; V279-I282 PolarHBondContact O-N 3.26Å; I282-N284 PolarHBondContact O-N 3.04Å; I282-V285 PolarHBondContact O-N 2.84Å; I282-L286 HydrophobicContact CG2-CD1 3.66Å; I282-L286 HydrophobicContact CG2-CG 4.04Å; I282-L286 WeakPolarHBondContact O-CG 3.49Å; I282-L286 PolarHBondContact O-N 2.86Å
283	L	88.7	Confident	80	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-56.8	-41.5	177.5	177.9	61	0	0	0	110.9	I258 L265 V279 I280 V285 L286 L287 L332 V354	I258-L283 HydrophobicContact CG1-CD1 4.46Å; I258-L283 HydrophobicContact CG2-CD1 4.03Å; L265-L283 HydrophobicContact CD1-CD2 4.04Å; V279-L283 WeakPolarHBondContact O-CB 3.25Å; V279-L283 PolarHBondContact O-N 3.32Å; I280-L283 PolarHBondContact O-N 2.93Å; L283-V285 VanDerWaalsContact C-N 3.33Å; L283-V285 PolarHBondContact O-N 2.81Å; L283-L286 PolarHBondContact O-N 3.38Å; L283-L287 HydrophobicContact CD1-CD1 4.21Å; L283-L287 HydrophobicContact CD1-CG 4.15Å; L283-L287 HydrophobicContact CG-CD1 4.07Å; L283-L287 HydrophobicContact CG-CG 4.45Å; L283-L287 WeakPolarHBondContact O-CB 3.38Å; L283-L287 VanDerWaalsContact O-CG 3.22Å; L283-L287 WeakPolarHBondContact O-CG 3.4Å; L283-L287 PolarHBondContact O-N 3.41Å; L283-L332 HydrophobicContact CD2-CD2 3.79Å; L283-V354 HydrophobicContact CD2-CG1 3.92Å; L283-V354 HydrophobicContact CG-CG1 4.06Å
284	N	86.5	Confident	78.5	Confident	8 Å²	8	25.7 Å²	25.7	4%	0.043	13%	0.13	C	C	.	.	H	α-helix	trans	-55.2	-47.3	173.5	-168.2	27.8	0	0	0	112.1	I280 D281 I282 R288 R353 V354 T357	I280-N284 WeakPolarHBondContact O-CB 3.37Å; I280-N284 PolarHBondContact O-N 3.45Å; D281-N284 VanDerWaalsContact O-CB 3.25Å; D281-N284 WeakPolarHBondContact O-CB 3.41Å; D281-N284 PolarHBondContact O-N 3.18Å; I282-N284 PolarHBondContact O-N 3.04Å; N284-R288 VanDerWaalsContact O-CG 3.29Å; N284-R288 WeakPolarHBondContact O-CG 3.3Å; N284-R288 PolarHBondContact O-N 3.41Å; N284-R288 VanDerWaalsContact O-N 3.09Å; N284-R353 WeakPolarHBondContact ND2-CD 3.03Å; N284-V354 HydrophobicContact CB-CG2 3.59Å; N284-T357 VanDerWaalsContact OD1-CB 3.31Å; N284-T357 WeakPolarHBondContact OD1-CB 3.47Å; N284-T357 WeakPolarHBondContact OD1-CG2 3.42Å; N284-T357 PolarHBondContact OD1-OG1 3.17Å
285	V	84.6	Confident	77.1	Confident	18 Å²	18	26.7 Å²	26.7	11%	0.109	14%	0.135	C	C	.	.	H	α-helix	trans	-70.2	-40.9	-177.6	178	0	0	0	0	111.2	L239 Y243 F246 D281 I282 L283 R288	L239-V285 HydrophobicContact CD2-CG2 3.7Å; Y243-V285 HydrophobicContact CD2-CG1 3.42Å; Y243-V285 VanDerWaalsContact CD2-CG1 3.42Å; Y243-V285 HydrophobicContact CE2-CG1 4.34Å; Y243-V285 HydrophobicContact CG-CG1 4.16Å; F246-V285 HydrophobicContact CD2-CG1 3.73Å; F246-V285 HydrophobicContact CE2-CB 4.38Å; F246-V285 HydrophobicContact CE2-CG1 3.9Å; D281-V285 WeakPolarHBondContact O-CG2 3.36Å; D281-V285 PolarHBondContact O-N 3.33Å; D281-V285 VanDerWaalsContact O-N 3.14Å; I282-V285 PolarHBondContact O-N 2.84Å; L283-V285 VanDerWaalsContact C-N 3.33Å; L283-V285 PolarHBondContact O-N 2.81Å; V285-R288 WeakPolarHBondContact O-CB 3.49Å; V285-R288 PolarHBondContact O-N 3.34Å
286	L	86.2	Confident	75.2	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-46.8	175	-69.6	171.7	0	0	0	111.4	F246 I254 L257 I258 I282 L283 R288 R289	F246-L286 HydrophobicContact CD1-CD2 4.05Å; F246-L286 HydrophobicContact CD2-CD2 3.75Å; F246-L286 HydrophobicContact CD2-CG 4.39Å; F246-L286 HydrophobicContact CE1-CD2 4.05Å; F246-L286 HydrophobicContact CE2-CD2 3.75Å; F246-L286 HydrophobicContact CE2-CG 4.06Å; F246-L286 HydrophobicContact CG-CD2 3.91Å; F246-L286 HydrophobicContact CZ-CD2 3.9Å; F246-L286 HydrophobicContact CZ-CG 4.36Å; I254-L286 HydrophobicContact CG2-CD2 4.29Å; L257-L286 HydrophobicContact CB-CD1 3.82Å; L257-L286 HydrophobicContact CB-CD2 4.36Å; L257-L286 HydrophobicContact CD1-CD2 4.22Å; I258-L286 HydrophobicContact CD1-CB 4.22Å; I258-L286 HydrophobicContact CG1-CB 3.78Å; I258-L286 HydrophobicContact CG1-CD1 4.1Å; I282-L286 HydrophobicContact CG2-CD1 3.66Å; I282-L286 HydrophobicContact CG2-CG 4.04Å; I282-L286 WeakPolarHBondContact O-CG 3.49Å; I282-L286 PolarHBondContact O-N 2.86Å; L283-L286 PolarHBondContact O-N 3.38Å; L286-R288 PolarHBondContact O-N 2.94Å; L286-R289 WeakPolarHBondContact O-CB 3.22Å; L286-R289 PolarHBondContact O-N 2.99Å
287	L	82.6	Confident	73	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-59.4	-35.7	175.9	-72.7	171.8	0	0	0	111.8	I258 L283 R289 L290 L328 L332 V354 T357 C358 R361	I258-L287 HydrophobicContact CD1-CD2 4.47Å; L283-L287 HydrophobicContact CD1-CD1 4.21Å; L283-L287 HydrophobicContact CD1-CG 4.15Å; L283-L287 HydrophobicContact CG-CD1 4.07Å; L283-L287 HydrophobicContact CG-CG 4.45Å; L283-L287 WeakPolarHBondContact O-CB 3.38Å; L283-L287 VanDerWaalsContact O-CG 3.22Å; L283-L287 WeakPolarHBondContact O-CG 3.4Å; L283-L287 PolarHBondContact O-N 3.41Å; L287-R289 PolarHBondContact O-N 3.46Å; L287-R289 VanDerWaalsContact O-N 3.17Å; L287-L290 HydrophobicContact CD2-CD1 4.37Å; L287-L290 PolarHBondContact O-N 3.18Å; L287-L290 VanDerWaalsContact O-N 3.15Å; L287-L328 HydrophobicContact CD2-CD2 3.58Å; L287-L332 HydrophobicContact CD1-CD1 4.26Å; L287-L332 HydrophobicContact CD2-CD1 4.16Å; L287-V354 HydrophobicContact CD1-CG1 3.83Å; L287-T357 HydrophobicContact CB-CG2 4.15Å; L287-C358 HydrophobicContact CD1-CB 4.05Å; L287-R361 PolarHBondContact O-NH1 3.42Å
288	R	78	Confident	70.7	Confident	102 Å²	102	44.9 Å²	44.9	39%	0.385	22%	0.215	S	C	.	.	H	α-helix	trans	-62	-22.8	177.6	-77.7	172.2	-174.7	-140.1	-3.5	113.8	N284 V285 L286 T357 R361	N284-R288 VanDerWaalsContact O-CG 3.29Å; N284-R288 WeakPolarHBondContact O-CG 3.3Å; N284-R288 PolarHBondContact O-N 3.41Å; N284-R288 VanDerWaalsContact O-N 3.09Å; V285-R288 WeakPolarHBondContact O-CB 3.49Å; V285-R288 PolarHBondContact O-N 3.34Å; L286-R288 PolarHBondContact O-N 2.94Å; R288-T357 HydrophobicContact CG-CG2 3.67Å; R288-R361 PolarHBondContact O-NH1 3.42Å; R288-R361 PolarHBondContact O-NH2 3.34Å; R288-R361 VanDerWaalsContact O-NH2 3.15Å
289	R	73.2	Confident	68.2	Low	9 Å²	9	48 Å²	48	3%	0.034	24%	0.237	C	C	.	.	H	α-helix	trans	-81.8	-20.7	177.9	-66	-69.8	-64.6	139.1	5.2	113.9	Y243 F246 I254 L286 L287 V291 L314 S315 C317	Y243-R289 HydrophobicContact CE2-CG 4.23Å; F246-R289 HydrophobicContact CB-CG 4.4Å; I254-R289 HydrophobicContact CD1-CB 4.34Å; L286-R289 WeakPolarHBondContact O-CB 3.22Å; L286-R289 PolarHBondContact O-N 2.99Å; L287-R289 PolarHBondContact O-N 3.46Å; L287-R289 VanDerWaalsContact O-N 3.17Å; R289-V291 PolarHBondContact O-N 2.93Å; R289-L314 PolarHBondContact NH1-O 2.91Å; R289-S315 PolarHBondContact NH2-O 2.66Å; R289-C317 PolarHBondContact O-N 2.8Å
290	L	71.2	Confident	65.5	Low	5 Å²	5	60 Å²	60	3%	0.026	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	101.5	178.7	-65.3	178.4	0	0	0	110.6	I254 I258 L287 F319 R361	I254-L290 HydrophobicContact CG2-CD2 4.37Å; I258-L290 HydrophobicContact CD1-CD1 3.53Å; I258-L290 HydrophobicContact CD1-CG 4.19Å; L287-L290 HydrophobicContact CD2-CD1 4.37Å; L287-L290 PolarHBondContact O-N 3.18Å; L287-L290 VanDerWaalsContact O-N 3.15Å; L290-F319 HydrophobicContact CD2-CD2 4.41Å; L290-R361 WeakPolarHBondContact O-CD 3.46Å; L290-R361 PolarHBondContact O-NH1 3.35Å
291	V	64.3	Low	62.8	Low	31 Å²	31	64.6 Å²	64.6	19%	0.188	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.2	177.9	-178.1	0	0	0	0	109.3	R289 S293 A316 C317	R289-V291 PolarHBondContact O-N 2.93Å; V291-S293 PolarHBondContact O-N 3.34Å; V291-A316 HydrophobicContact CB-CB 3.86Å; V291-A316 HydrophobicContact CG2-CB 3.62Å; V291-C317 PolarHBondContact N-O 2.66Å
292	P	58.4	Low	60.1	Low	9 Å²	9	68.6 Å²	68.6	6%	0.058	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	134.1	175.7	-20.2	31.1	0	0	0	110.6	E294 Q295 A321 R361	P292-E294 PolarHBondContact O-N 3.05Å; P292-Q295 PolarHBondContact O-N 2.99Å; P292-A321 HydrophobicContact CB-CB 4.37Å; P292-R361 HydrophobicContact CG-CB 4.34Å; P292-R361 WeakPolarHBondContact CG-O 3.48Å
293	S	53	Low	57.3	Low	48 Å²	48	76.7 Å²	76.7	34%	0.336	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.6	-173.5	-58	0	0	0	0	114.2	V291 F319	V291-S293 PolarHBondContact O-N 3.34Å; S293-F319 PolarHBondContact N-O 3.39Å; S293-F319 VanDerWaalsContact N-O 3.15Å; S293-F319 PolarHBondContact OG-N 2.89Å; S293-F319 PolarHBondContact OG-O 3.43Å
294	E	50.1	Low	54.4	Low	147 Å²	147	81.7 Å²	81.7	69%	0.687	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-27.7	-177.4	-67.8	171.4	177.4	0	0	113.7	P292 L296 Y297	P292-E294 PolarHBondContact O-N 3.05Å; E294-L296 PolarHBondContact O-N 3.13Å; E294-Y297 PolarHBondContact O-N 3.27Å
295	Q	50.6	Low	51.6	Low	95 Å²	95	83.1 Å²	83.1	44%	0.444	43%	0.433	S	S	.	.	H	α-helix	trans	-75.6	-9	-178.5	-74.9	-178	-13.3	0	0	114.2	P292 Y297 S299	P292-Q295 PolarHBondContact O-N 2.99Å; Q295-Y297 VanDerWaalsContact C-N 3.32Å; Q295-S299 PolarHBondContact O-OG 3.38Å
296	L	45.8	Very low	48.9	Very low	87 Å²	87	90.1 Å²	90.1	46%	0.455	47%	0.47	S	S	.	.	H	α-helix	trans	-79.2	-14.3	176.5	-74.5	167.6	0	0	0	113.2	E294	E294-L296 PolarHBondContact O-N 3.13Å
297	Y	39.2	Very low	46.3	Very low	214 Å²	214	95.2 Å²	95.2	84%	0.839	50%	0.501	S	S	*	.	H	α-helix	trans	-86.3	-26.2	177.1	-84.5	-82	0	0	0	113.5	E294 Q295	E294-Y297 PolarHBondContact O-N 3.27Å; Q295-Y297 VanDerWaalsContact C-N 3.32Å
298	D	35.4	Very low	44	Very low	146 Å²	146	102.5 Å²	102.5	78%	0.781	54%	0.539	S	S	*	.	H	α-helix	trans	-103	-9.1	-177.2	-75.4	-27.9	0	0	0	115.2	R300	D298-R300 PolarHBondContact O-N 3.02Å
299	S	34.4	Very low	41.9	Very low	68 Å²	68	101.7 Å²	101.7	48%	0.476	54%	0.541	S	S	.	.			trans	-87	66.8	-179.1	45.4	0	0	0	0	113.2	Q295 T301	Q295-S299 PolarHBondContact O-OG 3.38Å; S299-T301 VanDerWaalsContact C-N 3.25Å
300	R	33.1	Very low	40	Very low	254 Å²	254	106.2 Å²	106.2	96%	0.958	57%	0.574	S	S	*	*			trans	-82.7	-3.5	151.6	-83.1	-169.5	-169.3	-179	5	112.8	D298 S302	D298-R300 PolarHBondContact O-N 3.02Å; R300-S302 PolarHBondContact O-N 3.47Å
301	T	30.8	Very low	38.4	Very low	99 Å²	99	115.2 Å²	115.2	61%	0.607	61%	0.613	S	S	*	*	S	Bend	trans	-84.1	107.5	171	37.8	0	0	0	0	109.3	S299 L303	S299-T301 VanDerWaalsContact C-N 3.25Å; T301-L303 PolarHBondContact O-N 3Å
302	S	27	Very low	37.1	Very low	94 Å²	94	116.6 Å²	116.6	66%	0.657	62%	0.621	S	S	*	*			trans	-48.3	122.6	170.8	51.8	0	0	0	0	109.9	R300 S304	R300-S302 PolarHBondContact O-N 3.47Å; S302-S304 PolarHBondContact O-N 3.46Å
303	L	30.5	Very low	36.3	Very low	171 Å²	171	124.8 Å²	124.8	90%	0.895	66%	0.664	S	S	*	*			trans	-63.4	85.5	164.6	-114.7	92.9	0	0	0	108.1	T301 G305	T301-L303 PolarHBondContact O-N 3Å; L303-G305 PolarHBondContact O-N 3.1Å
304	S	26.8	Very low	36	Very low	107 Å²	107	124 Å²	124	75%	0.748	66%	0.656	S	S	*	*			trans	-76.8	78.3	172.9	169.4	0	0	0	0	108.5	S302	S302-S304 PolarHBondContact O-N 3.46Å
305	G	29.4	Very low	35.9	Very low	37 Å²	37	121.5 Å²	121.5	38%	0.381	66%	0.655	S	S	.	*			trans	-136.7	107.9	167.8	0	0	0	0	0	108.9	L303 T307	L303-G305 PolarHBondContact O-N 3.1Å; G305-T307 PolarHBondContact O-N 3.27Å
306	N	26.9	Very low	36	Very low	166 Å²	166	118.8 Å²	118.8	89%	0.888	65%	0.649	S	S	*	*			trans	-68.8	59.8	176.7	-79.7	-19.5	0	0	0	112.3
307	T	31.3	Very low	36.4	Very low	107 Å²	107	115.1 Å²	115.1	66%	0.656	63%	0.631	S	S	*	*	S	Bend	trans	-132.5	88.1	177.2	9.7	0	0	0	0	109.1	G305 M309	G305-T307 PolarHBondContact O-N 3.27Å; T307-M309 WeakPolarHBondContact O-CB 3.45Å; T307-M309 WeakPolarHBondContact O-CG 3.44Å; T307-M309 PolarHBondContact O-N 3.42Å
308	L	34	Very low	37.2	Very low	156 Å²	156	112.2 Å²	112.2	82%	0.817	62%	0.622	S	S	*	*	S	Bend	trans	52.4	-3.9	167.1	-137.8	79.5	0	0	0	118.4
309	M	33.5	Very low	38.6	Very low	86 Å²	86	106.6 Å²	106.6	42%	0.424	59%	0.591	S	S	.	*			trans	-90.9	-20.1	-169.2	-74	-92	152.2	0	0	113.1	Y243 T307 K311	Y243-M309 HydrophobicContact CE1-CE 3.85Å; Y243-M309 HydrophobicContact CE2-CE 4.23Å; Y243-M309 VanDerWaalsContact CZ-CE 3.5Å; Y243-M309 WeakPolarHBondContact OH-CE 3.41Å; T307-M309 WeakPolarHBondContact O-CB 3.45Å; T307-M309 WeakPolarHBondContact O-CG 3.44Å; T307-M309 PolarHBondContact O-N 3.42Å; M309-K311 VanDerWaalsContact C-N 3.26Å; M309-K311 PolarHBondContact O-N 2.91Å
310	S	34.1	Very low	39.9	Very low	104 Å²	104	106.4 Å²	106.4	73%	0.727	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-3	-172.4	57.8	0	0	0	0	115
311	K	37	Very low	41.3	Very low	194 Å²	194	95.5 Å²	95.5	84%	0.843	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-5.7	-178	-76.2	-171.1	176.1	-178.1	0	115.5	M309	M309-K311 VanDerWaalsContact C-N 3.26Å; M309-K311 PolarHBondContact O-N 2.91Å
312	T	38.6	Very low	42.9	Very low	59 Å²	59	97.5 Å²	97.5	36%	0.362	56%	0.556	S	S	.	*			trans	-125.5	97.5	-177.1	54.4	0	0	0	0	111	L314	T312-L314 HydrophobicContact CG2-CD1 4.1Å; T312-L314 PolarHBondContact O-N 2.66Å
313	N	40.4	Very low	45	Very low	181 Å²	181	95.2 Å²	95.2	97%	0.968	53%	0.534	S	S	*	.			trans	-66	59.6	163.5	-76.7	-25.8	0	0	0	110.5
314	L	46.9	Very low	46.9	Very low	31 Å²	31	87.3 Å²	87.3	16%	0.162	49%	0.493	C	S	.	.			trans	-87.9	108.7	-179.9	-82.8	163.7	0	0	0	109.2	G247 R289 T312 A316	G247-L314 VanDerWaalsContact CA-CD2 3.48Å; R289-L314 PolarHBondContact NH1-O 2.91Å; T312-L314 HydrophobicContact CG2-CD1 4.1Å; T312-L314 PolarHBondContact O-N 2.66Å; L314-A316 PolarHBondContact O-N 3.45Å; L314-A316 VanDerWaalsContact O-N 3.11Å
315	S	47.8	Very low	49	Very low	96 Å²	96	85.3 Å²	85.3	67%	0.671	47%	0.471	S	S	*	.			trans	-45.1	116.2	-177.6	57.4	0	0	0	0	111.6	R289	R289-S315 PolarHBondContact NH2-O 2.66Å
316	A	53.9	Low	51.2	Low	37 Å²	37	88.6 Å²	88.6	31%	0.306	48%	0.48	S	S	.	.			trans	-65.2	137.7	177.5	0	0	0	0	0	110.6	V291 L314 K318	V291-A316 HydrophobicContact CB-CB 3.86Å; V291-A316 HydrophobicContact CG2-CB 3.62Å; L314-A316 PolarHBondContact O-N 3.45Å; L314-A316 VanDerWaalsContact O-N 3.11Å; A316-K318 PolarHBondContact O-N 2.67Å
317	C	54.2	Low	53.7	Low	11 Å²	11	86.6 Å²	86.6	7%	0.074	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	111.9	178	-67.8	0	0	0	0	109.1	T251 R289 V291 F319	T251-C317 HydrophobicContact CG2-CB 3.99Å; T251-C317 WeakPolarHBondContact OG1-CB 3.44Å; R289-C317 PolarHBondContact O-N 2.8Å; V291-C317 PolarHBondContact N-O 2.66Å; C317-F319 PolarHBondContact O-N 2.84Å
318	K	56	Low	55.9	Low	153 Å²	153	82.2 Å²	82.2	67%	0.665	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	129.1	175.8	-70.6	-175.6	-179.8	-178.3	0	109.6	A316	A316-K318 PolarHBondContact O-N 2.67Å
319	F	63.5	Low	58.2	Low	27 Å²	27	75.7 Å²	75.7	12%	0.118	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154	-177.5	-157.7	-95.2	0	0	0	110.8	T251 I255 L290 S293 C317 Y323 V324	T251-F319 HydrophobicContact CG2-CD2 4.31Å; I255-F319 HydrophobicContact CD1-CD2 4.29Å; I255-F319 HydrophobicContact CD1-CE2 3.58Å; I255-F319 HydrophobicContact CD1-CZ 4.47Å; I255-F319 HydrophobicContact CG1-CE2 4.28Å; L290-F319 HydrophobicContact CD2-CD2 4.41Å; S293-F319 PolarHBondContact N-O 3.39Å; S293-F319 VanDerWaalsContact N-O 3.15Å; S293-F319 PolarHBondContact OG-N 2.89Å; S293-F319 PolarHBondContact OG-O 3.43Å; C317-F319 PolarHBondContact O-N 2.84Å; F319-Y323 HydrophobicContact CD1-CD1 4.43Å; F319-Y323 VanDerWaalsContact CE1-CB 3.4Å; F319-Y323 AromaticContact CE1-CD1 3.14Å; F319-Y323 HydrophobicContact CE1-CD1 3.14Å; F319-Y323 HydrophobicContact CE1-CE1 4.07Å; F319-Y323 AromaticContact CE1-CG 3.5Å; F319-Y323 HydrophobicContact CE1-CG 3.5Å; F319-Y323 VanDerWaalsContact CE1-CG 3.5Å; F319-Y323 HydrophobicContact CE2-CD1 4.33Å; F319-Y323 AromaticContact CZ-CD1 3.07Å; F319-Y323 HydrophobicContact CZ-CD1 3.07Å; F319-Y323 HydrophobicContact CZ-CD2 4.16Å; F319-Y323 AromaticContact CZ-CE1 3.66Å; F319-Y323 HydrophobicContact CZ-CE1 3.66Å; F319-Y323 AromaticContact CZ-CG 3.34Å; F319-Y323 HydrophobicContact CZ-CG 3.34Å; F319-V324 HydrophobicContact CD1-CG2 3.63Å; F319-V324 HydrophobicContact CE1-CG2 3.81Å
320	S	62.1	Low	60.6	Low	64 Å²	64	74.5 Å²	74.5	45%	0.448	40%	0.402	S	S	.	.			trans	-77.7	127.6	173.8	77.5	0	0	0	0	109.2	E322 Y323	S320-E322 PolarHBondContact O-N 2.65Å; S320-E322 VanDerWaalsContact O-N 3.16Å; S320-Y323 PolarHBondContact O-N 3.2Å
321	A	62	Low	62.9	Low	26 Å²	26	75.4 Å²	75.4	22%	0.215	39%	0.389	C	S	.	.	H	α-helix	trans	-55.9	-33.4	178.7	0	0	0	0	0	111.5	P292 Y323 V324 Q325	P292-A321 HydrophobicContact CB-CB 4.37Å; A321-Y323 PolarHBondContact O-N 3.23Å; A321-V324 PolarHBondContact O-N 3.4Å; A321-Q325 WeakPolarHBondContact O-CB 3.26Å; A321-Q325 PolarHBondContact O-N 3.34Å
322	E	65.4	Low	65	Low	140 Å²	140	66.2 Å²	66.2	65%	0.654	35%	0.349	S	S	*	.	H	α-helix	trans	-59	-41.6	-179.8	-68.6	-174.5	159.2	0	0	114.4	S320 Q325 N326	S320-E322 PolarHBondContact O-N 2.65Å; S320-E322 VanDerWaalsContact O-N 3.16Å; E322-Q325 PolarHBondContact O-N 3.16Å; E322-N326 WeakPolarHBondContact O-CB 3.34Å; E322-N326 PolarHBondContact O-N 3.31Å; E322-N326 PolarHBondContact O-ND2 3.27Å
323	Y	70.9	Confident	67.2	Low	46 Å²	46	64.5 Å²	64.5	18%	0.18	34%	0.34	C	S	.	.	H	α-helix	trans	-72.2	-34.9	-179.5	164.6	-68	0	0	0	111.8	K259 F319 S320 A321 Q327 L328	K259-Y323 WeakPolarHBondContact CE-OH 3.38Å; F319-Y323 HydrophobicContact CD1-CD1 4.43Å; F319-Y323 VanDerWaalsContact CE1-CB 3.4Å; F319-Y323 AromaticContact CE1-CD1 3.14Å; F319-Y323 HydrophobicContact CE1-CD1 3.14Å; F319-Y323 HydrophobicContact CE1-CE1 4.07Å; F319-Y323 AromaticContact CE1-CG 3.5Å; F319-Y323 HydrophobicContact CE1-CG 3.5Å; F319-Y323 VanDerWaalsContact CE1-CG 3.5Å; F319-Y323 HydrophobicContact CE2-CD1 4.33Å; F319-Y323 AromaticContact CZ-CD1 3.07Å; F319-Y323 HydrophobicContact CZ-CD1 3.07Å; F319-Y323 HydrophobicContact CZ-CD2 4.16Å; F319-Y323 AromaticContact CZ-CE1 3.66Å; F319-Y323 HydrophobicContact CZ-CE1 3.66Å; F319-Y323 AromaticContact CZ-CG 3.34Å; F319-Y323 HydrophobicContact CZ-CG 3.34Å; S320-Y323 PolarHBondContact O-N 3.2Å; A321-Y323 PolarHBondContact O-N 3.23Å; Y323-Q327 HydrophobicContact CD2-CB 4.31Å; Y323-Q327 HydrophobicContact CD2-CG 4.46Å; Y323-Q327 HydrophobicContact CE2-CB 4.49Å; Y323-Q327 WeakPolarHBondContact O-CB 3.34Å; Y323-Q327 PolarHBondContact O-N 2.96Å; Y323-Q327 VanDerWaalsContact O-N 3.09Å; Y323-L328 HydrophobicContact CD1-CB 4.45Å; Y323-L328 HydrophobicContact CE1-CB 4.24Å; Y323-L328 HydrophobicContact CE1-CD1 4.02Å; Y323-L328 PolarHBondContact O-N 3.01Å
324	V	69.8	Low	69.1	Low	6 Å²	6	60.3 Å²	60.3	4%	0.036	32%	0.321	C	S	.	.	I	π-helix	trans	-66.2	-46.1	175.4	178	0	0	0	0	109.8	F319 A321 F329 R361	F319-V324 HydrophobicContact CD1-CG2 3.63Å; F319-V324 HydrophobicContact CE1-CG2 3.81Å; A321-V324 PolarHBondContact O-N 3.4Å; V324-F329 VanDerWaalsContact O-CB 3.25Å; V324-F329 WeakPolarHBondContact O-CB 3.35Å; V324-F329 PolarHBondContact O-N 3.11Å; V324-R361 HydrophobicContact CG1-CB 4.12Å
325	Q	71.5	Confident	70.8	Confident	65 Å²	65	59.4 Å²	59.4	30%	0.304	32%	0.316	S	S	.	.	I	π-helix	trans	-71.6	-43.7	-176.6	-172.2	172.7	-18.6	0	0	112.9	A321 E322 P330 T366	A321-Q325 WeakPolarHBondContact O-CB 3.26Å; A321-Q325 PolarHBondContact O-N 3.34Å; E322-Q325 PolarHBondContact O-N 3.16Å; Q325-P330 WeakPolarHBondContact O-CD 3.47Å; Q325-T366 PolarHBondContact NE2-OG1 3.46Å
326	N	76.4	Confident	72.5	Confident	105 Å²	105	55 Å²	55	56%	0.561	29%	0.285	S	S	*	.	I	π-helix	trans	-95.1	-23.1	-169.5	-60	-23.4	0	0	0	113.9	E322	E322-N326 WeakPolarHBondContact O-CB 3.34Å; E322-N326 PolarHBondContact O-N 3.31Å; E322-N326 PolarHBondContact O-ND2 3.27Å
327	Q	78.8	Confident	73.9	Confident	124 Å²	124	55 Å²	55	58%	0.579	28%	0.281	S	S	*	.	I	π-helix	trans	-117.7	-52.6	-177.4	-62.5	-173.6	6	0	0	112.6	Y323	Y323-Q327 HydrophobicContact CD2-CB 4.31Å; Y323-Q327 HydrophobicContact CD2-CG 4.46Å; Y323-Q327 HydrophobicContact CE2-CB 4.49Å; Y323-Q327 WeakPolarHBondContact O-CB 3.34Å; Y323-Q327 PolarHBondContact O-N 2.96Å; Y323-Q327 VanDerWaalsContact O-N 3.09Å
328	L	77.8	Confident	75.4	Confident	15 Å²	15	59.7 Å²	59.7	8%	0.079	31%	0.305	C	S	.	.	I	π-helix	trans	-73.1	-47.8	-171.6	-161.3	89.6	0	0	0	112.2	I258 L287 Y323 R331 L332	I258-L328 HydrophobicContact CG2-CD1 3.81Å; L287-L328 HydrophobicContact CD2-CD2 3.58Å; Y323-L328 HydrophobicContact CD1-CB 4.45Å; Y323-L328 HydrophobicContact CE1-CB 4.24Å; Y323-L328 HydrophobicContact CE1-CD1 4.02Å; Y323-L328 PolarHBondContact O-N 3.01Å; L328-R331 PolarHBondContact O-N 2.85Å; L328-L332 HydrophobicContact CD2-CD1 3.74Å; L328-L332 HydrophobicContact CG-CD1 3.73Å; L328-L332 HydrophobicContact CG-CG 4.41Å; L328-L332 WeakPolarHBondContact O-CB 3.41Å; L328-L332 WeakPolarHBondContact O-CG 3.44Å; L328-L332 PolarHBondContact O-N 3.3Å
329	F	82	Confident	76.8	Confident	19 Å²	19	53.8 Å²	53.8	8%	0.083	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-46.7	-175.6	177.9	-101.8	0	0	0	113	V324 R331 L332 S333 Y355 C358 L359 T366 V370	V324-F329 VanDerWaalsContact O-CB 3.25Å; V324-F329 WeakPolarHBondContact O-CB 3.35Å; V324-F329 PolarHBondContact O-N 3.11Å; F329-R331 VanDerWaalsContact C-N 3.34Å; F329-R331 PolarHBondContact O-N 3.31Å; F329-L332 PolarHBondContact O-N 3.28Å; F329-S333 WeakPolarHBondContact O-CB 3.35Å; F329-S333 PolarHBondContact O-N 3.28Å; F329-Y355 HydrophobicContact CE2-CE1 4.35Å; F329-Y355 HydrophobicContact CZ-CE1 4.36Å; F329-Y355 AromaticContact CZ-CZ 3.99Å; F329-C358 HydrophobicContact CD2-CB 4.42Å; F329-L359 HydrophobicContact CE1-CD1 4.48Å; F329-L359 HydrophobicContact CE2-CB 4.13Å; F329-L359 HydrophobicContact CE2-CD1 3.77Å; F329-L359 HydrophobicContact CZ-CD1 3.73Å; F329-T366 HydrophobicContact CE1-CG2 4.3Å; F329-V370 HydrophobicContact CE1-CG2 4.01Å; F329-V370 HydrophobicContact CZ-CG2 3.76Å
330	P	83	Confident	77.9	Confident	61 Å²	61	52.5 Å²	52.5	40%	0.396	28%	0.275	S	S	.	.	H	α-helix	trans	-59.4	-43.7	177.9	-25.6	35.5	0	0	0	112.5	Q325 S333 T334	Q325-P330 WeakPolarHBondContact O-CD 3.47Å; P330-S333 PolarHBondContact O-N 3.31Å; P330-T334 PolarHBondContact O-N 3.39Å; P330-T334 PolarHBondContact O-OG1 3.2Å
331	R	81.8	Confident	79	Confident	123 Å²	123	54 Å²	54	46%	0.464	28%	0.275	S	S	.	.	H	α-helix	trans	-66.9	-44.8	-179.8	-168.9	171.4	175.8	-177.4	-3.6	112.1	V262 E266 L328 F329 M335	V262-R331 HydrophobicContact CG1-CG 4.36Å; E266-R331 IonicContact OE1-CZ 2.65Å; E266-R331 IonicContact OE1-NE 3.97Å; E266-R331 PolarHBondContact OE1-NE 2.95Å; E266-R331 IonicContact OE1-NH2 2.84Å; E266-R331 PolarHBondContact OE1-NH2 3.42Å; E266-R331 IonicContact OE2-CZ 3.96Å; E266-R331 IonicContact OE2-NE 3.2Å; E266-R331 IonicContact OE2-NH2 3.41Å; E266-R331 PolarHBondContact OE2-NH2 3.08Å; L328-R331 PolarHBondContact O-N 2.85Å; F329-R331 VanDerWaalsContact C-N 3.34Å; F329-R331 PolarHBondContact O-N 3.31Å; R331-M335 PolarHBondContact O-N 2.68Å
332	L	82.6	Confident	80	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-65.6	-38.1	175.1	-78.4	174.2	0	0	0	112.3	V262 L283 L287 L328 F329 T334 M335 I336 C358	V262-L332 HydrophobicContact CG2-CD2 3.52Å; V262-L332 HydrophobicContact CG2-CG 4.31Å; L283-L332 HydrophobicContact CD2-CD2 3.79Å; L287-L332 HydrophobicContact CD1-CD1 4.26Å; L287-L332 HydrophobicContact CD2-CD1 4.16Å; L328-L332 HydrophobicContact CD2-CD1 3.74Å; L328-L332 HydrophobicContact CG-CD1 3.73Å; L328-L332 HydrophobicContact CG-CG 4.41Å; L328-L332 WeakPolarHBondContact O-CB 3.41Å; L328-L332 WeakPolarHBondContact O-CG 3.44Å; L328-L332 PolarHBondContact O-N 3.3Å; F329-L332 PolarHBondContact O-N 3.28Å; L332-T334 PolarHBondContact O-N 2.85Å; L332-M335 PolarHBondContact O-N 3.01Å; L332-I336 HydrophobicContact CB-CD1 4.16Å; L332-I336 HydrophobicContact CD2-CD1 4.35Å; L332-I336 VanDerWaalsContact O-CB 3.26Å; L332-I336 WeakPolarHBondContact O-CB 3.46Å; L332-I336 WeakPolarHBondContact O-CD1 3.49Å; L332-I336 WeakPolarHBondContact O-CG1 3.35Å; L332-I336 PolarHBondContact O-N 3.2Å; L332-C358 HydrophobicContact CD1-CB 4.43Å
333	S	83.8	Confident	80.8	Confident	23 Å²	23	53 Å²	53	16%	0.161	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-50	-177.6	-179.4	0	0	0	0	111.1	F329 P330 T337 Y355	F329-S333 WeakPolarHBondContact O-CB 3.35Å; F329-S333 PolarHBondContact O-N 3.28Å; P330-S333 PolarHBondContact O-N 3.31Å; S333-T337 WeakPolarHBondContact O-CB 3.43Å; S333-T337 PolarHBondContact O-N 3.13Å; S333-T337 PolarHBondContact O-OG1 3.31Å; S333-Y355 WeakPolarHBondContact OG-CE2 3.32Å; S333-Y355 PolarHBondContact OG-OH 3.07Å; S333-Y355 VanDerWaalsContact OG-OH 3.12Å
334	T	81.3	Confident	81.4	Confident	92 Å²	92	55.6 Å²	55.6	56%	0.564	29%	0.286	S	S	*	.	H	α-helix	trans	-64	-42.2	-178.9	-43.9	0	0	0	0	112.1	P330 L332 T337 N338	P330-T334 PolarHBondContact O-N 3.39Å; P330-T334 PolarHBondContact O-OG1 3.2Å; L332-T334 PolarHBondContact O-N 2.85Å; T334-T337 WeakPolarHBondContact CA-OG1 3.37Å; T334-T337 PolarHBondContact O-OG1 3.36Å; T334-N338 PolarHBondContact O-N 2.92Å
335	M	81.5	Confident	82	Confident	12 Å²	12	60 Å²	60	6%	0.059	31%	0.306	C	S	.	.	H	α-helix	trans	-72	-43.3	-179.9	175.2	-114.4	-89.7	0	0	112.2	V262 L265 E266 R331 L332 T337 N338 L339	V262-M335 HydrophobicContact CB-CE 4.13Å; V262-M335 HydrophobicContact CG1-CE 3.73Å; V262-M335 HydrophobicContact CG2-CE 4.5Å; V262-M335 WeakPolarHBondContact O-CE 3.41Å; L265-M335 HydrophobicContact CB-CE 3.23Å; L265-M335 HydrophobicContact CB-CG 4.35Å; L265-M335 HydrophobicContact CB-SD 3.4Å; L265-M335 WeakPolarHBondContact CB-SD 3.48Å; L265-M335 HydrophobicContact CD1-CE 4.07Å; L265-M335 HydrophobicContact CD1-SD 3.86Å; L265-M335 HydrophobicContact CG-CE 4.28Å; L265-M335 HydrophobicContact CG-SD 4.26Å; E266-M335 HydrophobicContact CG-CE 4.03Å; E266-M335 HydrophobicContact CG-CG 4.38Å; R331-M335 PolarHBondContact O-N 2.68Å; L332-M335 PolarHBondContact O-N 3.01Å; M335-T337 VanDerWaalsContact C-N 3.29Å; M335-T337 PolarHBondContact O-N 3.35Å; M335-N338 WeakPolarHBondContact O-CB 3.26Å; M335-N338 PolarHBondContact O-N 3Å; M335-N338 VanDerWaalsContact O-N 3.16Å; M335-L339 PolarHBondContact O-N 2.67Å
336	I	84.3	Confident	82.5	Confident	4 Å²	4	61 Å²	61	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-66.7	-32.7	179.6	-66.2	169	0	0	0	111.4	L332 N338 L339 F340 A351 V354 Y355	L332-I336 HydrophobicContact CB-CD1 4.16Å; L332-I336 HydrophobicContact CD2-CD1 4.35Å; L332-I336 VanDerWaalsContact O-CB 3.26Å; L332-I336 WeakPolarHBondContact O-CB 3.46Å; L332-I336 WeakPolarHBondContact O-CD1 3.49Å; L332-I336 WeakPolarHBondContact O-CG1 3.35Å; L332-I336 PolarHBondContact O-N 3.2Å; I336-N338 VanDerWaalsContact C-N 3.27Å; I336-N338 PolarHBondContact O-N 3.09Å; I336-L339 WeakPolarHBondContact O-CB 3.25Å; I336-L339 PolarHBondContact O-N 3.16Å; I336-L339 VanDerWaalsContact O-N 3.09Å; I336-F340 HydrophobicContact CG2-CD1 4.48Å; I336-F340 HydrophobicContact CG2-CE1 3.75Å; I336-F340 HydrophobicContact CG2-CZ 4.28Å; I336-F340 WeakPolarHBondContact O-CD1 3.47Å; I336-F340 PolarHBondContact O-N 3.32Å; I336-A351 HydrophobicContact CG2-CB 3.87Å; I336-A351 VanDerWaalsContact CG2-O 3.31Å; I336-A351 WeakPolarHBondContact CG2-O 3.36Å; I336-V354 HydrophobicContact CD1-CB 4.27Å; I336-V354 HydrophobicContact CD1-CG1 3.62Å; I336-Y355 HydrophobicContact CB-CD2 4.21Å; I336-Y355 HydrophobicContact CG2-CD2 3.98Å
337	T	84	Confident	82.9	Confident	38 Å²	38	56.2 Å²	56.2	23%	0.233	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-27.9	175.2	31.9	0	0	0	0	112.9	S333 T334 M335 L339 F340	S333-T337 WeakPolarHBondContact O-CB 3.43Å; S333-T337 PolarHBondContact O-N 3.13Å; S333-T337 PolarHBondContact O-OG1 3.31Å; T334-T337 WeakPolarHBondContact CA-OG1 3.37Å; T334-T337 PolarHBondContact O-OG1 3.36Å; M335-T337 VanDerWaalsContact C-N 3.29Å; M335-T337 PolarHBondContact O-N 3.35Å; T337-L339 VanDerWaalsContact C-N 3.31Å; T337-L339 PolarHBondContact O-N 3.01Å; T337-F340 HydrophobicContact CG2-CD2 3.95Å; T337-F340 HydrophobicContact CG2-CE2 3.78Å; T337-F340 HydrophobicContact CG2-CZ 4.49Å; T337-F340 WeakPolarHBondContact O-CB 3.5Å; T337-F340 PolarHBondContact O-N 3.5Å
338	N	84.4	Confident	83.3	Confident	108 Å²	108	50.5 Å²	50.5	58%	0.578	26%	0.259	S	S	*	.	H	α-helix	trans	-65.1	-37.5	170.2	-66.6	-21.3	0	0	0	111.4	T334 M335 I336 F340 Q341	T334-N338 PolarHBondContact O-N 2.92Å; M335-N338 WeakPolarHBondContact O-CB 3.26Å; M335-N338 PolarHBondContact O-N 3Å; M335-N338 VanDerWaalsContact O-N 3.16Å; I336-N338 VanDerWaalsContact C-N 3.27Å; I336-N338 PolarHBondContact O-N 3.09Å; N338-F340 PolarHBondContact O-N 3.28Å; N338-Q341 PolarHBondContact O-N 3.31Å; N338-Q341 VanDerWaalsContact O-N 3.13Å
339	L	85.1	Confident	83.6	Confident	29 Å²	29	55.2 Å²	55.2	15%	0.152	28%	0.28	C	S	.	.	H	α-helix	trans	-68.3	-17.8	177.9	-63	171.1	0	0	0	113.3	T276 I280 M335 I336 T337 Q341 S342 V347 A351	T276-L339 HydrophobicContact CG2-CD2 4.07Å; I280-L339 HydrophobicContact CD1-CD1 3.74Å; I280-L339 HydrophobicContact CG1-CD1 4.29Å; M335-L339 PolarHBondContact O-N 2.67Å; I336-L339 WeakPolarHBondContact O-CB 3.25Å; I336-L339 PolarHBondContact O-N 3.16Å; I336-L339 VanDerWaalsContact O-N 3.09Å; T337-L339 VanDerWaalsContact C-N 3.31Å; T337-L339 PolarHBondContact O-N 3.01Å; L339-Q341 PolarHBondContact O-N 2.88Å; L339-S342 VanDerWaalsContact O-CB 3.28Å; L339-S342 WeakPolarHBondContact O-CB 3.37Å; L339-S342 PolarHBondContact O-N 3.05Å; L339-S342 VanDerWaalsContact O-N 3.15Å; L339-V347 HydrophobicContact CB-CG1 4.49Å; L339-V347 HydrophobicContact CD2-CG1 4.28Å; L339-A351 HydrophobicContact CB-CB 3.91Å
340	F	86.8	Confident	83.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-19.9	172.7	-68.6	-1.8	0	0	0	112.6	I336 T337 N338 R348 A351 V352 Y355 Y405 F406 S409 L410 L413	I336-F340 HydrophobicContact CG2-CD1 4.48Å; I336-F340 HydrophobicContact CG2-CE1 3.75Å; I336-F340 HydrophobicContact CG2-CZ 4.28Å; I336-F340 WeakPolarHBondContact O-CD1 3.47Å; I336-F340 PolarHBondContact O-N 3.32Å; T337-F340 HydrophobicContact CG2-CD2 3.95Å; T337-F340 HydrophobicContact CG2-CE2 3.78Å; T337-F340 HydrophobicContact CG2-CZ 4.49Å; T337-F340 WeakPolarHBondContact O-CB 3.5Å; T337-F340 PolarHBondContact O-N 3.5Å; N338-F340 PolarHBondContact O-N 3.28Å; F340-R348 WeakPolarHBondContact O-CD 3.39Å; F340-A351 HydrophobicContact CD1-CB 3.99Å; F340-A351 HydrophobicContact CE1-CB 3.96Å; F340-V352 HydrophobicContact CD1-CG2 4.22Å; F340-V352 HydrophobicContact CE1-CB 4.47Å; F340-V352 HydrophobicContact CE1-CG2 3.66Å; F340-V352 HydrophobicContact CZ-CG2 4Å; F340-Y355 HydrophobicContact CZ-CD2 4.36Å; F340-Y355 HydrophobicContact CZ-CG 4.45Å; F340-Y405 CarbonylContact O-C 3.29Å; F340-Y405 VanDerWaalsContact O-C 3.29Å; F340-Y405 VanDerWaalsContact O-O 3.13Å; F340-F406 HydrophobicContact CB-CD2 3.77Å; F340-F406 HydrophobicContact CB-CE2 4.16Å; F340-F406 HydrophobicContact CD2-CE2 4.26Å; F340-F406 PolarHBondContact O-N 2.86Å; F340-S409 VanDerWaalsContact CG-CB 3.49Å; F340-S409 PolarHBondContact O-OG 2.89Å; F340-L410 HydrophobicContact CD2-CD2 4.18Å; F340-L410 HydrophobicContact CE2-CD2 4.17Å; F340-L413 HydrophobicContact CE2-CD2 4.09Å; F340-L413 HydrophobicContact CZ-CD2 4.26Å
341	Q	85.3	Confident	84	Confident	96 Å²	96	51.6 Å²	51.6	45%	0.449	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-3.2	178.3	-54.6	-170.2	3.8	0	0	113.4	N338 L339 N403 F406	N338-Q341 PolarHBondContact O-N 3.31Å; N338-Q341 VanDerWaalsContact O-N 3.13Å; L339-Q341 PolarHBondContact O-N 2.88Å; Q341-N403 PolarHBondContact O-ND2 3.36Å; Q341-F406 HydrophobicContact CG-CB 4.11Å; Q341-F406 HydrophobicContact CG-CD2 3.7Å; Q341-F406 HydrophobicContact CG-CG 4.24Å
342	S	84	Confident	84.3	Confident	29 Å²	29	46 Å²	46	20%	0.203	24%	0.238	C	C	.	.			trans	-58.6	142.2	-178.4	-179.3	0	0	0	0	112	L339 H344 R348	L339-S342 VanDerWaalsContact O-CB 3.28Å; L339-S342 WeakPolarHBondContact O-CB 3.37Å; L339-S342 PolarHBondContact O-N 3.05Å; L339-S342 VanDerWaalsContact O-N 3.15Å; S342-H344 PolarHBondContact O-N 3.16Å; S342-H344 PolarHBondContact OG-N 3.35Å; S342-R348 VanDerWaalsContact O-CD 3.26Å; S342-R348 WeakPolarHBondContact O-CD 2.95Å; S342-R348 PolarHBondContact O-NH1 2.92Å
343	N	81.2	Confident	84.4	Confident	117 Å²	117	50.5 Å²	50.5	63%	0.626	26%	0.255	S	S	*	.	S	Bend	trans	-67.4	-24.1	175.6	-67.3	-19.1	0	0	0	112.4	R348 Y405	N343-R348 VanDerWaalsContact C-NH1 3.3Å; N343-R348 PolarHBondContact O-NH1 3.32Å; N343-Y405 WeakPolarHBondContact OD1-CE2 3.34Å
344	H	83.8	Confident	84.6	Confident	99 Å²	99	49.5 Å²	49.5	46%	0.458	25%	0.247	S	C	.	.			trans	-88.3	117.1	-176.9	-59.8	-84	0	0	0	112.3	S342 I346 V347 R348	S342-H344 PolarHBondContact O-N 3.16Å; S342-H344 PolarHBondContact OG-N 3.35Å; H344-I346 VanDerWaalsContact C-N 3.25Å; H344-I346 PolarHBondContact O-N 3.16Å; H344-V347 HydrophobicContact CB-CB 4.32Å; H344-V347 HydrophobicContact CB-CG2 3.99Å; H344-V347 PolarHBondContact O-N 3.16Å; H344-R348 PolarHBondContact O-N 3.19Å
345	F	82.3	Confident	84.9	Confident	100 Å²	100	45.8 Å²	45.8	44%	0.439	22%	0.223	S	C	.	.	H	α-helix	trans	-55.1	-38	179.1	171.6	-108.1	0	0	0	113.6	V347 R348 K349	F345-V347 PolarHBondContact O-N 3.22Å; F345-R348 PolarHBondContact O-N 3.39Å; F345-K349 HydrophobicContact CE1-CD 4.2Å; F345-K349 HydrophobicContact CZ-CD 4.16Å; F345-K349 WeakPolarHBondContact O-CB 3.39Å; F345-K349 PolarHBondContact O-N 3.38Å
346	I	81.5	Confident	85.1	Confident	86 Å²	86	47 Å²	47	44%	0.441	23%	0.229	S	C	.	.	H	α-helix	trans	-62.9	-44.3	-178.7	-60.1	173.6	0	0	0	110.7	E277 H344 K349 A350	E277-I346 HydrophobicContact CB-CG2 4.41Å; E277-I346 HydrophobicContact CG-CG2 3.75Å; E277-I346 WeakPolarHBondContact OE1-CG2 3.19Å; H344-I346 VanDerWaalsContact C-N 3.25Å; H344-I346 PolarHBondContact O-N 3.16Å; I346-K349 PolarHBondContact O-N 2.98Å; I346-A350 WeakPolarHBondContact O-CB 3.44Å; I346-A350 PolarHBondContact O-N 3.37Å
347	V	85.7	Confident	85.1	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-46.6	177	176.3	0	0	0	0	110.5	T276 I280 L339 H344 F345 K349 A350 A351	T276-V347 HydrophobicContact CG2-CG1 3.8Å; T276-V347 HydrophobicContact CG2-CG2 4.34Å; I280-V347 HydrophobicContact CD1-CG1 4.05Å; L339-V347 HydrophobicContact CB-CG1 4.49Å; L339-V347 HydrophobicContact CD2-CG1 4.28Å; H344-V347 HydrophobicContact CB-CB 4.32Å; H344-V347 HydrophobicContact CB-CG2 3.99Å; H344-V347 PolarHBondContact O-N 3.16Å; F345-V347 PolarHBondContact O-N 3.22Å; V347-K349 PolarHBondContact O-N 3.47Å; V347-A350 PolarHBondContact O-N 3.36Å; V347-A351 VanDerWaalsContact O-CB 3.28Å; V347-A351 WeakPolarHBondContact O-CB 3.4Å; V347-A351 PolarHBondContact O-N 3.21Å
348	R	87	Confident	85.1	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.015	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-45	178	-62.8	-162.9	-59.9	-86	3.4	112.4	F340 S342 N343 H344 F345 A350 A351 V352 Y405 E408	F340-R348 WeakPolarHBondContact O-CD 3.39Å; S342-R348 VanDerWaalsContact O-CD 3.26Å; S342-R348 WeakPolarHBondContact O-CD 2.95Å; S342-R348 PolarHBondContact O-NH1 2.92Å; N343-R348 VanDerWaalsContact C-NH1 3.3Å; N343-R348 PolarHBondContact O-NH1 3.32Å; H344-R348 PolarHBondContact O-N 3.19Å; F345-R348 PolarHBondContact O-N 3.39Å; R348-A350 PolarHBondContact O-N 2.85Å; R348-A351 WeakPolarHBondContact O-CB 3.37Å; R348-A351 PolarHBondContact O-N 3.23Å; R348-V352 WeakPolarHBondContact O-CG2 3.44Å; R348-V352 PolarHBondContact O-N 3.5Å; R348-Y405 VanDerWaalsContact CZ-CD1 3.46Å; R348-E408 IonicContact CZ-OE2 2.71Å; R348-E408 IonicContact NE-OE2 3.46Å; R348-E408 PolarHBondContact NE-OE2 3.43Å; R348-E408 IonicContact NH2-OE2 3.78Å; R348-E408 PolarHBondContact NH2-OE2 2.91Å
349	K	84.2	Confident	85	Confident	115 Å²	115	40.6 Å²	40.6	50%	0.5	20%	0.195	S	C	.	.	H	α-helix	trans	-63.9	-41.5	177.9	-175.6	177.4	-179.2	177.1	0	112.1	F345 I346 V347 R353	F345-K349 HydrophobicContact CE1-CD 4.2Å; F345-K349 HydrophobicContact CZ-CD 4.16Å; F345-K349 WeakPolarHBondContact O-CB 3.39Å; F345-K349 PolarHBondContact O-N 3.38Å; I346-K349 PolarHBondContact O-N 2.98Å; V347-K349 PolarHBondContact O-N 3.47Å; K349-R353 PolarHBondContact O-N 3.06Å
350	A	84	Confident	84.7	Confident	4 Å²	4	40.8 Å²	40.8	3%	0.033	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-41.9	176.7	0	0	0	0	0	111.2	I280 I346 V347 R348 V352 R353 V354	I280-A350 HydrophobicContact CB-CB 4.33Å; I280-A350 HydrophobicContact CG2-CB 3.58Å; I280-A350 WeakPolarHBondContact CG2-O 3.4Å; I346-A350 WeakPolarHBondContact O-CB 3.44Å; I346-A350 PolarHBondContact O-N 3.37Å; V347-A350 PolarHBondContact O-N 3.36Å; R348-A350 PolarHBondContact O-N 2.85Å; A350-V352 PolarHBondContact O-N 3.49Å; A350-R353 WeakPolarHBondContact O-CB 3.05Å; A350-R353 PolarHBondContact O-N 3.24Å; A350-R353 VanDerWaalsContact O-N 3.14Å; A350-V354 PolarHBondContact O-N 2.69Å
351	A	88.7	Confident	84.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.7	-51.1	175.7	0	0	0	0	0	111.8	I336 L339 F340 V347 R348 R353 V354 Y355	I336-A351 HydrophobicContact CG2-CB 3.87Å; I336-A351 VanDerWaalsContact CG2-O 3.31Å; I336-A351 WeakPolarHBondContact CG2-O 3.36Å; L339-A351 HydrophobicContact CB-CB 3.91Å; F340-A351 HydrophobicContact CD1-CB 3.99Å; F340-A351 HydrophobicContact CE1-CB 3.96Å; V347-A351 VanDerWaalsContact O-CB 3.28Å; V347-A351 WeakPolarHBondContact O-CB 3.4Å; V347-A351 PolarHBondContact O-N 3.21Å; R348-A351 WeakPolarHBondContact O-CB 3.37Å; R348-A351 PolarHBondContact O-N 3.23Å; A351-R353 VanDerWaalsContact C-N 3.27Å; A351-R353 PolarHBondContact O-N 3.41Å; A351-V354 PolarHBondContact O-N 2.7Å; A351-Y355 WeakPolarHBondContact O-CB 3.31Å; A351-Y355 PolarHBondContact O-N 2.9Å
352	V	88.3	Confident	83.7	Confident	6 Å²	6	38.6 Å²	38.6	4%	0.036	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-38.8	176.5	174.7	0	0	0	0	111.4	F340 R348 A350 Y355 L356 T412 L413	F340-V352 HydrophobicContact CD1-CG2 4.22Å; F340-V352 HydrophobicContact CE1-CB 4.47Å; F340-V352 HydrophobicContact CE1-CG2 3.66Å; F340-V352 HydrophobicContact CZ-CG2 4Å; R348-V352 WeakPolarHBondContact O-CG2 3.44Å; R348-V352 PolarHBondContact O-N 3.5Å; A350-V352 PolarHBondContact O-N 3.49Å; V352-Y355 WeakPolarHBondContact O-CB 3.31Å; V352-Y355 PolarHBondContact O-N 3.45Å; V352-L356 HydrophobicContact CG1-CD1 3.94Å; V352-L356 WeakPolarHBondContact O-CD1 3.3Å; V352-L356 VanDerWaalsContact O-CG 3.3Å; V352-L356 WeakPolarHBondContact O-CG 3.15Å; V352-L356 PolarHBondContact O-N 3.03Å; V352-T412 HydrophobicContact CG1-CG2 4.26Å; V352-L413 HydrophobicContact CG1-CB 4.2Å; V352-L413 HydrophobicContact CG1-CD1 4.35Å
353	R	86.4	Confident	83.4	Confident	96 Å²	96	39.4 Å²	39.4	36%	0.362	19%	0.193	S	C	.	.	H	α-helix	trans	-65.1	-44.2	178.6	-174.5	-168	-64.5	157.6	-3.1	112.3	D281 N284 K349 A350 A351 T357	D281-R353 IonicContact OD1-NH1 3.71Å; D281-R353 PolarHBondContact OD1-NH1 2.98Å; N284-R353 WeakPolarHBondContact ND2-CD 3.03Å; K349-R353 PolarHBondContact O-N 3.06Å; A350-R353 WeakPolarHBondContact O-CB 3.05Å; A350-R353 PolarHBondContact O-N 3.24Å; A350-R353 VanDerWaalsContact O-N 3.14Å; A351-R353 VanDerWaalsContact C-N 3.27Å; A351-R353 PolarHBondContact O-N 3.41Å; R353-T357 WeakPolarHBondContact O-CB 3.31Å; R353-T357 PolarHBondContact O-N 3.43Å; R353-T357 PolarHBondContact O-OG1 3.39Å
354	V	86.1	Confident	83.1	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-66.3	-42.8	177.3	172.2	0	0	0	0	110.8	I280 L283 N284 L287 I336 A350 A351 L356 T357 C358	I280-V354 HydrophobicContact CB-CG2 4.49Å; I280-V354 HydrophobicContact CG2-CB 4.16Å; I280-V354 HydrophobicContact CG2-CG2 3.33Å; I280-V354 WeakPolarHBondContact O-CG2 3.25Å; L283-V354 HydrophobicContact CD2-CG1 3.92Å; L283-V354 HydrophobicContact CG-CG1 4.06Å; N284-V354 HydrophobicContact CB-CG2 3.59Å; L287-V354 HydrophobicContact CD1-CG1 3.83Å; I336-V354 HydrophobicContact CD1-CB 4.27Å; I336-V354 HydrophobicContact CD1-CG1 3.62Å; A350-V354 PolarHBondContact O-N 2.69Å; A351-V354 PolarHBondContact O-N 2.7Å; V354-L356 VanDerWaalsContact C-N 3.33Å; V354-L356 PolarHBondContact O-N 3.28Å; V354-T357 PolarHBondContact O-N 3.12Å; V354-T357 VanDerWaalsContact O-N 3.09Å; V354-C358 PolarHBondContact O-N 3.48Å
355	Y	89	Confident	82.9	Confident	15 Å²	15	40.3 Å²	40.3	6%	0.059	20%	0.201	C	C	.	.	H	α-helix	trans	-53.4	-51.5	175.7	-165.5	-83.8	0	0	0	111.4	F329 S333 I336 F340 A351 V352 T357 C358 L359 V370 L413	F329-Y355 HydrophobicContact CE2-CE1 4.35Å; F329-Y355 HydrophobicContact CZ-CE1 4.36Å; F329-Y355 AromaticContact CZ-CZ 3.99Å; S333-Y355 WeakPolarHBondContact OG-CE2 3.32Å; S333-Y355 PolarHBondContact OG-OH 3.07Å; S333-Y355 VanDerWaalsContact OG-OH 3.12Å; I336-Y355 HydrophobicContact CB-CD2 4.21Å; I336-Y355 HydrophobicContact CG2-CD2 3.98Å; F340-Y355 HydrophobicContact CZ-CD2 4.36Å; F340-Y355 HydrophobicContact CZ-CG 4.45Å; A351-Y355 WeakPolarHBondContact O-CB 3.31Å; A351-Y355 PolarHBondContact O-N 2.9Å; V352-Y355 WeakPolarHBondContact O-CB 3.31Å; V352-Y355 PolarHBondContact O-N 3.45Å; Y355-T357 VanDerWaalsContact C-N 3.31Å; Y355-T357 PolarHBondContact O-N 3.4Å; Y355-C358 PolarHBondContact O-N 2.98Å; Y355-L359 WeakPolarHBondContact O-CB 3.08Å; Y355-L359 PolarHBondContact O-N 2.99Å; Y355-V370 HydrophobicContact CE1-CG1 3.91Å; Y355-L413 HydrophobicContact CD1-CD1 3.59Å; Y355-L413 HydrophobicContact CD1-CD2 4.06Å; Y355-L413 HydrophobicContact CD1-CG 4.5Å; Y355-L413 HydrophobicContact CE1-CD1 4.09Å; Y355-L413 HydrophobicContact CE1-CD2 3.95Å; Y355-L413 HydrophobicContact CG-CD1 4.41Å
356	L	85.5	Confident	82.8	Confident	36 Å²	36	36.1 Å²	36.1	19%	0.188	18%	0.184	C	C	.	.	H	α-helix	trans	-63.8	-35.4	177.8	-71.9	166.1	0	0	0	112.9	V352 V354 L359 S360 L413 L417	V352-L356 HydrophobicContact CG1-CD1 3.94Å; V352-L356 WeakPolarHBondContact O-CD1 3.3Å; V352-L356 VanDerWaalsContact O-CG 3.3Å; V352-L356 WeakPolarHBondContact O-CG 3.15Å; V352-L356 PolarHBondContact O-N 3.03Å; V354-L356 VanDerWaalsContact C-N 3.33Å; V354-L356 PolarHBondContact O-N 3.28Å; L356-L359 PolarHBondContact O-N 3.38Å; L356-S360 WeakPolarHBondContact O-CB 3.42Å; L356-S360 PolarHBondContact O-N 2.63Å; L356-L413 HydrophobicContact CD2-CD1 3.72Å; L356-L413 HydrophobicContact CG-CD1 3.9Å; L356-L417 HydrophobicContact CD2-CD2 3.64Å; L356-L417 HydrophobicContact CD2-CG 4.25Å
357	T	84.1	Confident	82.8	Confident	14 Å²	14	32.4 Å²	32.4	9%	0.086	17%	0.165	C	C	.	.	H	α-helix	trans	-68.5	-42.4	178.3	-60.8	0	0	0	0	110.8	N284 L287 R288 R353 V354 Y355 S360	N284-T357 VanDerWaalsContact OD1-CB 3.31Å; N284-T357 WeakPolarHBondContact OD1-CB 3.47Å; N284-T357 WeakPolarHBondContact OD1-CG2 3.42Å; N284-T357 PolarHBondContact OD1-OG1 3.17Å; L287-T357 HydrophobicContact CB-CG2 4.15Å; R288-T357 HydrophobicContact CG-CG2 3.67Å; R353-T357 WeakPolarHBondContact O-CB 3.31Å; R353-T357 PolarHBondContact O-N 3.43Å; R353-T357 PolarHBondContact O-OG1 3.39Å; V354-T357 PolarHBondContact O-N 3.12Å; V354-T357 VanDerWaalsContact O-N 3.09Å; Y355-T357 VanDerWaalsContact C-N 3.31Å; Y355-T357 PolarHBondContact O-N 3.4Å; T357-S360 PolarHBondContact O-N 2.87Å; T357-S360 PolarHBondContact O-OG 3.16Å
358	C	83.1	Confident	82.6	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.014	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-48.8	172.8	-166	0	0	0	0	111	L287 F329 L332 V354 Y355 S360 R361	L287-C358 HydrophobicContact CD1-CB 4.05Å; F329-C358 HydrophobicContact CD2-CB 4.42Å; L332-C358 HydrophobicContact CD1-CB 4.43Å; V354-C358 PolarHBondContact O-N 3.48Å; Y355-C358 PolarHBondContact O-N 2.98Å; C358-S360 PolarHBondContact O-N 2.89Å; C358-R361 WeakPolarHBondContact O-CB 3.35Å; C358-R361 PolarHBondContact O-N 2.91Å
359	L	83.3	Confident	82.5	Confident	1 Å²	1	43 Å²	43	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-31.2	179.9	-172.1	66.3	0	0	0	112.6	F329 Y355 L356 R361 C362 T366 F367 V370 L417	F329-L359 HydrophobicContact CE1-CD1 4.48Å; F329-L359 HydrophobicContact CE2-CB 4.13Å; F329-L359 HydrophobicContact CE2-CD1 3.77Å; F329-L359 HydrophobicContact CZ-CD1 3.73Å; Y355-L359 WeakPolarHBondContact O-CB 3.08Å; Y355-L359 PolarHBondContact O-N 2.99Å; L356-L359 PolarHBondContact O-N 3.38Å; L359-R361 PolarHBondContact O-N 2.99Å; L359-R361 VanDerWaalsContact O-N 3.08Å; L359-C362 HydrophobicContact CD1-CB 4.49Å; L359-C362 PolarHBondContact O-N 2.86Å; L359-C362 VanDerWaalsContact O-N 3.1Å; L359-T366 HydrophobicContact CD1-CG2 4.12Å; L359-F367 HydrophobicContact CD2-CD2 3.56Å; L359-F367 HydrophobicContact CD2-CE2 3.57Å; L359-F367 HydrophobicContact CD2-CG 4.16Å; L359-F367 HydrophobicContact CD2-CZ 4.22Å; L359-F367 HydrophobicContact CG-CD2 3.6Å; L359-F367 HydrophobicContact CG-CE2 3.92Å; L359-F367 HydrophobicContact CG-CG 4.41Å; L359-V370 HydrophobicContact CD1-CB 4.26Å; L359-V370 HydrophobicContact CD1-CG2 3.83Å; L359-V370 HydrophobicContact CD2-CB 4.24Å; L359-V370 HydrophobicContact CD2-CG1 3.98Å; L359-L417 HydrophobicContact CD2-CD2 3.34Å
360	S	78.8	Confident	82.6	Confident	33 Å²	33	38.3 Å²	38.3	23%	0.231	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-13.7	176.1	77.8	0	0	0	0	114.7	L356 T357 C358	L356-S360 WeakPolarHBondContact O-CB 3.42Å; L356-S360 PolarHBondContact O-N 2.63Å; T357-S360 PolarHBondContact O-N 2.87Å; T357-S360 PolarHBondContact O-OG 3.16Å; C358-S360 PolarHBondContact O-N 2.89Å
361	R	75.3	Confident	82.7	Confident	41 Å²	41	38.1 Å²	38.1	16%	0.155	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-5.4	178.5	-50.6	-55.8	162.5	107.7	-12.9	113.3	L287 R288 L290 P292 V324 C358 L359	L287-R361 PolarHBondContact O-NH1 3.42Å; R288-R361 PolarHBondContact O-NH1 3.42Å; R288-R361 PolarHBondContact O-NH2 3.34Å; R288-R361 VanDerWaalsContact O-NH2 3.15Å; L290-R361 WeakPolarHBondContact O-CD 3.46Å; L290-R361 PolarHBondContact O-NH1 3.35Å; P292-R361 HydrophobicContact CG-CB 4.34Å; P292-R361 WeakPolarHBondContact CG-O 3.48Å; V324-R361 HydrophobicContact CG1-CB 4.12Å; C358-R361 WeakPolarHBondContact O-CB 3.35Å; C358-R361 PolarHBondContact O-N 2.91Å; L359-R361 PolarHBondContact O-N 2.99Å; L359-R361 VanDerWaalsContact O-N 3.08Å
362	C	76.3	Confident	82.6	Confident	9 Å²	9	41.9 Å²	41.9	6%	0.061	21%	0.211	C	C	.	.	S	Bend	trans	-85.2	170.8	171.5	-57.2	0	0	0	0	110.4	L359 T366	L359-C362 HydrophobicContact CD1-CB 4.49Å; L359-C362 PolarHBondContact O-N 2.86Å; L359-C362 VanDerWaalsContact O-N 3.1Å; C362-T366 HydrophobicContact CB-CG2 4.04Å
363	S	75.9	Confident	82.6	Confident	46 Å²	46	46.5 Å²	46.5	32%	0.322	23%	0.232	S	C	.	.			trans	-64.3	157.8	173.3	71.9	0	0	0	0	111.6	D365 T366 F367	S363-D365 PolarHBondContact O-N 3.18Å; S363-T366 PolarHBondContact O-N 2.67Å; S363-T366 PolarHBondContact OG-N 3.1Å; S363-T366 PolarHBondContact OG-OG1 3.21Å; S363-F367 PolarHBondContact O-N 2.99Å
364	N	76.7	Confident	82.6	Confident	122 Å²	122	42.2 Å²	42.2	65%	0.652	22%	0.217	S	C	*	.	H	α-helix	trans	-61.7	-24.2	175.9	-78.3	-26	0	0	0	112.6	F367 K368	N364-F367 VanDerWaalsContact O-CB 3.31Å; N364-F367 WeakPolarHBondContact O-CB 3.29Å; N364-F367 PolarHBondContact O-N 2.9Å; N364-K368 PolarHBondContact O-N 3.05Å; N364-K368 VanDerWaalsContact O-N 3.15Å
365	D	78.8	Confident	82.6	Confident	112 Å²	112	42.2 Å²	42.2	60%	0.599	22%	0.217	S	C	*	.	H	α-helix	trans	-70.3	-43.6	177.3	-63.8	-33.6	0	0	0	111.3	S363 F367 K368 E369	S363-D365 PolarHBondContact O-N 3.18Å; D365-F367 PolarHBondContact O-N 3.49Å; D365-K368 PolarHBondContact O-N 3.45Å; D365-K368 VanDerWaalsContact O-N 3.13Å; D365-E369 PolarHBondContact O-N 3.09Å
366	T	80.7	Confident	82.5	Confident	12 Å²	12	43.6 Å²	43.6	7%	0.074	23%	0.227	C	C	.	.	H	α-helix	trans	-59.3	-35.9	171.2	-48.2	0	0	0	0	111.2	Q325 F329 L359 C362 S363 K368 E369 V370	Q325-T366 PolarHBondContact NE2-OG1 3.46Å; F329-T366 HydrophobicContact CE1-CG2 4.3Å; L359-T366 HydrophobicContact CD1-CG2 4.12Å; C362-T366 HydrophobicContact CB-CG2 4.04Å; S363-T366 PolarHBondContact O-N 2.67Å; S363-T366 PolarHBondContact OG-N 3.1Å; S363-T366 PolarHBondContact OG-OG1 3.21Å; T366-K368 PolarHBondContact O-N 2.89Å; T366-E369 PolarHBondContact O-N 3.44Å; T366-V370 HydrophobicContact CG2-CG2 4.32Å; T366-V370 WeakPolarHBondContact O-CB 3.01Å; T366-V370 VanDerWaalsContact O-CG2 3.26Å; T366-V370 WeakPolarHBondContact O-CG2 3.12Å; T366-V370 PolarHBondContact O-N 3.12Å
367	F	81.1	Confident	82.5	Confident	9 Å²	9	44.2 Å²	44.2	4%	0.039	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-43	176.7	-156.2	-78.4	0	0	0	112.3	L359 S363 N364 D365 L371 L417 K420 V421	L359-F367 HydrophobicContact CD2-CD2 3.56Å; L359-F367 HydrophobicContact CD2-CE2 3.57Å; L359-F367 HydrophobicContact CD2-CG 4.16Å; L359-F367 HydrophobicContact CD2-CZ 4.22Å; L359-F367 HydrophobicContact CG-CD2 3.6Å; L359-F367 HydrophobicContact CG-CE2 3.92Å; L359-F367 HydrophobicContact CG-CG 4.41Å; S363-F367 PolarHBondContact O-N 2.99Å; N364-F367 VanDerWaalsContact O-CB 3.31Å; N364-F367 WeakPolarHBondContact O-CB 3.29Å; N364-F367 PolarHBondContact O-N 2.9Å; D365-F367 PolarHBondContact O-N 3.49Å; F367-L371 WeakPolarHBondContact O-CB 3.36Å; F367-L371 PolarHBondContact O-N 3.38Å; F367-L371 VanDerWaalsContact O-N 3.09Å; F367-L417 HydrophobicContact CD1-CD2 4.28Å; F367-L417 HydrophobicContact CE1-CB 3.91Å; F367-L417 HydrophobicContact CE1-CD2 3.51Å; F367-L417 HydrophobicContact CE1-CG 4.31Å; F367-L417 WeakPolarHBondContact CE1-O 3.46Å; F367-L417 HydrophobicContact CE2-CD2 3.84Å; F367-L417 HydrophobicContact CZ-CB 4.27Å; F367-L417 HydrophobicContact CZ-CD2 3.26Å; F367-L417 HydrophobicContact CZ-CG 4.34Å; F367-K420 HydrophobicContact CE1-CB 4.08Å; F367-K420 HydrophobicContact CE2-CD 3.64Å; F367-K420 HydrophobicContact CE2-CG 4.5Å; F367-K420 HydrophobicContact CZ-CB 3.74Å; F367-K420 HydrophobicContact CZ-CD 3.62Å; F367-K420 HydrophobicContact CZ-CG 4.09Å; F367-V421 HydrophobicContact CD1-CG2 3.4Å; F367-V421 VanDerWaalsContact CD1-CG2 3.4Å; F367-V421 HydrophobicContact CE1-CG2 3.51Å
368	K	81.2	Confident	82.6	Confident	95 Å²	95	43.5 Å²	43.5	41%	0.413	23%	0.226	S	C	.	.	H	α-helix	trans	-68.9	-39.9	177	-69.2	173.3	-174.7	168.4	0	111.9	N364 D365 T366 L371 L372	N364-K368 PolarHBondContact O-N 3.05Å; N364-K368 VanDerWaalsContact O-N 3.15Å; D365-K368 PolarHBondContact O-N 3.45Å; D365-K368 VanDerWaalsContact O-N 3.13Å; T366-K368 PolarHBondContact O-N 2.89Å; K368-L371 PolarHBondContact O-N 3.16Å; K368-L372 WeakPolarHBondContact O-CB 3.32Å; K368-L372 PolarHBondContact O-N 3.26Å
369	E	85.6	Confident	82.6	Confident	135 Å²	135	44 Å²	44	63%	0.631	23%	0.23	S	C	*	.	H	α-helix	trans	-62.8	-46.6	177.5	-172	177.5	-170	0	0	111.5	D365 T366 L371 L372 Q373	D365-E369 PolarHBondContact O-N 3.09Å; T366-E369 PolarHBondContact O-N 3.44Å; E369-L371 VanDerWaalsContact C-N 3.33Å; E369-L371 PolarHBondContact O-N 3.36Å; E369-L372 WeakPolarHBondContact O-CB 3.43Å; E369-L372 PolarHBondContact O-N 3.47Å; E369-L372 VanDerWaalsContact O-N 3.16Å; E369-Q373 PolarHBondContact O-N 3.39Å
370	V	85.8	Confident	82.7	Confident	15 Å²	15	48.3 Å²	48.3	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-38.3	176.5	171.5	0	0	0	0	111.6	F329 Y355 L359 T366 Q373 T374 L417	F329-V370 HydrophobicContact CE1-CG2 4.01Å; F329-V370 HydrophobicContact CZ-CG2 3.76Å; Y355-V370 HydrophobicContact CE1-CG1 3.91Å; L359-V370 HydrophobicContact CD1-CB 4.26Å; L359-V370 HydrophobicContact CD1-CG2 3.83Å; L359-V370 HydrophobicContact CD2-CB 4.24Å; L359-V370 HydrophobicContact CD2-CG1 3.98Å; T366-V370 HydrophobicContact CG2-CG2 4.32Å; T366-V370 WeakPolarHBondContact O-CB 3.01Å; T366-V370 VanDerWaalsContact O-CG2 3.26Å; T366-V370 WeakPolarHBondContact O-CG2 3.12Å; T366-V370 PolarHBondContact O-N 3.12Å; V370-Q373 PolarHBondContact O-N 2.89Å; V370-T374 WeakPolarHBondContact O-CB 3.46Å; V370-T374 PolarHBondContact O-N 2.97Å; V370-T374 PolarHBondContact O-OG1 3.18Å; V370-L417 HydrophobicContact CG1-CD1 4.12Å
371	L	85.9	Confident	82.8	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-47.1	172.6	175.2	60.8	0	0	0	111	F367 K368 E369 Q373 T374 V375 L417 I418 V421 P427	F367-L371 WeakPolarHBondContact O-CB 3.36Å; F367-L371 PolarHBondContact O-N 3.38Å; F367-L371 VanDerWaalsContact O-N 3.09Å; K368-L371 PolarHBondContact O-N 3.16Å; E369-L371 VanDerWaalsContact C-N 3.33Å; E369-L371 PolarHBondContact O-N 3.36Å; L371-Q373 VanDerWaalsContact C-N 3.33Å; L371-Q373 PolarHBondContact O-N 3.03Å; L371-T374 PolarHBondContact O-N 3.43Å; L371-V375 HydrophobicContact CD1-CG2 4.03Å; L371-V375 VanDerWaalsContact O-CG2 3.29Å; L371-V375 WeakPolarHBondContact O-CG2 3.48Å; L371-V375 PolarHBondContact O-N 3.07Å; L371-L417 HydrophobicContact CB-CB 4.37Å; L371-L417 HydrophobicContact CB-CD1 4.19Å; L371-L417 HydrophobicContact CD1-CB 3.81Å; L371-L417 HydrophobicContact CD1-CD1 4.22Å; L371-I418 HydrophobicContact CD1-CG1 3.89Å; L371-I418 HydrophobicContact CD2-CG1 4.4Å; L371-V421 HydrophobicContact CD2-CB 4.48Å; L371-V421 HydrophobicContact CD2-CG2 4.04Å; L371-P427 HydrophobicContact CD2-CG 3.73Å; L371-P427 HydrophobicContact CG-CG 3.78Å
372	L	86.3	Confident	82.8	Confident	78 Å²	78	46.1 Å²	46.1	41%	0.408	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-44.1	178.2	-176.4	69.4	0	0	0	111.5	K368 E369 V375 T376 P427 N429	K368-L372 WeakPolarHBondContact O-CB 3.32Å; K368-L372 PolarHBondContact O-N 3.26Å; E369-L372 WeakPolarHBondContact O-CB 3.43Å; E369-L372 PolarHBondContact O-N 3.47Å; E369-L372 VanDerWaalsContact O-N 3.16Å; L372-V375 PolarHBondContact O-N 3.22Å; L372-T376 WeakPolarHBondContact O-CB 3.47Å; L372-T376 PolarHBondContact O-N 3.2Å; L372-T376 PolarHBondContact O-OG1 3.44Å; L372-P427 HydrophobicContact CD1-CB 4.05Å; L372-N429 WeakPolarHBondContact CD1-ND2 3.44Å
373	Q	88.1	Confident	82.6	Confident	103 Å²	103	49.5 Å²	49.5	48%	0.481	26%	0.257	S	S	.	.	H	α-helix	trans	-62.7	-49	176.5	-173.1	60.5	38.1	0	0	111.3	E369 V370 L371 V375 T376 D377	E369-Q373 PolarHBondContact O-N 3.39Å; V370-Q373 PolarHBondContact O-N 2.89Å; L371-Q373 VanDerWaalsContact C-N 3.33Å; L371-Q373 PolarHBondContact O-N 3.03Å; Q373-V375 VanDerWaalsContact C-N 3.28Å; Q373-V375 PolarHBondContact O-N 3.19Å; Q373-T376 WeakPolarHBondContact O-CB 3.37Å; Q373-T376 PolarHBondContact O-N 3.07Å; Q373-D377 PolarHBondContact NE2-OD1 3.35Å; Q373-D377 VanDerWaalsContact O-CG 3.32Å; Q373-D377 PolarHBondContact O-N 2.91Å
374	T	86.6	Confident	82.3	Confident	6 Å²	6	53.6 Å²	53.6	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-40.7	179.7	-53.8	0	0	0	0	111.6	V370 L371 L378 L410 L413 C414	V370-T374 WeakPolarHBondContact O-CB 3.46Å; V370-T374 PolarHBondContact O-N 2.97Å; V370-T374 PolarHBondContact O-OG1 3.18Å; L371-T374 PolarHBondContact O-N 3.43Å; T374-L378 HydrophobicContact CG2-CD1 4.38Å; T374-L378 WeakPolarHBondContact O-CG 3.43Å; T374-L378 PolarHBondContact O-N 2.92Å; T374-L378 VanDerWaalsContact O-N 3.1Å; T374-L410 HydrophobicContact CG2-CD2 4.37Å; T374-L413 HydrophobicContact CG2-CD2 4.39Å; T374-C414 HydrophobicContact CG2-CB 3.92Å
375	V	85.8	Confident	81.5	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-43.5	175.7	173.9	0	0	0	0	110.7	L371 L372 Q373 D377 L378 C379 N429 L433	L371-V375 HydrophobicContact CD1-CG2 4.03Å; L371-V375 VanDerWaalsContact O-CG2 3.29Å; L371-V375 WeakPolarHBondContact O-CG2 3.48Å; L371-V375 PolarHBondContact O-N 3.07Å; L372-V375 PolarHBondContact O-N 3.22Å; Q373-V375 VanDerWaalsContact C-N 3.28Å; Q373-V375 PolarHBondContact O-N 3.19Å; V375-D377 PolarHBondContact O-N 3.09Å; V375-L378 PolarHBondContact O-N 3.19Å; V375-C379 PolarHBondContact O-N 3.01Å; V375-C379 PolarHBondContact O-SG 3.19Å; V375-N429 HydrophobicContact CG1-CB 4.42Å; V375-N429 VanDerWaalsContact CG1-CG 3.48Å; V375-N429 WeakPolarHBondContact CG1-ND2 3.49Å; V375-N429 WeakPolarHBondContact CG1-OD1 3.33Å; V375-L433 HydrophobicContact CG1-CB 3.88Å; V375-L433 HydrophobicContact CG1-CD1 4.4Å; V375-L433 HydrophobicContact CG1-CD2 4.41Å; V375-L433 HydrophobicContact CG1-CG 4.45Å; V375-L433 HydrophobicContact CG2-CD2 4.04Å
376	T	87.6	Confident	80.4	Confident	44 Å²	44	45 Å²	45	27%	0.27	23%	0.226	S	C	.	.	H	α-helix	trans	-63.3	-42.4	179.3	-53.7	0	0	0	0	111.4	L372 Q373 L378 C379 M380 N429	L372-T376 WeakPolarHBondContact O-CB 3.47Å; L372-T376 PolarHBondContact O-N 3.2Å; L372-T376 PolarHBondContact O-OG1 3.44Å; Q373-T376 WeakPolarHBondContact O-CB 3.37Å; Q373-T376 PolarHBondContact O-N 3.07Å; T376-L378 PolarHBondContact O-N 3.3Å; T376-C379 PolarHBondContact O-N 3.47Å; T376-M380 HydrophobicContact CG2-CE 3.98Å; T376-M380 HydrophobicContact CG2-CG 4.41Å; T376-M380 WeakPolarHBondContact O-CB 3.4Å; T376-M380 WeakPolarHBondContact O-CG 3.37Å; T376-M380 PolarHBondContact O-N 2.87Å; T376-N429 PolarHBondContact OG1-ND2 3.09Å
377	D	85.7	Confident	79	Confident	49 Å²	49	52.2 Å²	52.2	26%	0.262	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-42.5	176.9	-66.4	-21.6	0	0	0	111.7	Q373 V375 M380 N381	Q373-D377 PolarHBondContact NE2-OD1 3.35Å; Q373-D377 VanDerWaalsContact O-CG 3.32Å; Q373-D377 PolarHBondContact O-N 2.91Å; V375-D377 PolarHBondContact O-N 3.09Å; D377-M380 PolarHBondContact O-N 3.2Å; D377-N381 WeakPolarHBondContact O-CB 3.37Å; D377-N381 PolarHBondContact O-N 3.49Å; D377-N381 PolarHBondContact O-ND2 3.37Å
378	L	85.1	Confident	77.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-40.6	175.7	-76.7	170.8	0	0	0	112.3	T374 V375 T376 A382 L410 L411 C414 L433 Y441	T374-L378 HydrophobicContact CG2-CD1 4.38Å; T374-L378 WeakPolarHBondContact O-CG 3.43Å; T374-L378 PolarHBondContact O-N 2.92Å; T374-L378 VanDerWaalsContact O-N 3.1Å; V375-L378 PolarHBondContact O-N 3.19Å; T376-L378 PolarHBondContact O-N 3.3Å; L378-A382 PolarHBondContact O-N 3.35Å; L378-L410 HydrophobicContact CD2-CB 3.79Å; L378-L410 HydrophobicContact CD2-CD1 4.3Å; L378-L410 HydrophobicContact CG-CB 4.23Å; L378-L411 HydrophobicContact CD1-CD2 4.11Å; L378-L411 HydrophobicContact CD2-CD2 3.99Å; L378-L411 HydrophobicContact CD2-CG 4.06Å; L378-C414 HydrophobicContact CD1-CB 3.94Å; L378-L433 HydrophobicContact CB-CD1 4.21Å; L378-L433 HydrophobicContact CD1-CD1 4.03Å; L378-Y441 HydrophobicContact CD2-CE1 4.49Å; L378-Y441 HydrophobicContact CD2-CE2 4.4Å; L378-Y441 PolarHBondContact O-OH 3Å
379	C	85	Confident	75.6	Confident	12 Å²	12	54.6 Å²	54.6	8%	0.081	28%	0.277	C	S	.	.	H	α-helix	trans	-68.2	-48	176.2	-67.3	0	0	0	0	111.1	V375 T376 N381 A382 D383	V375-C379 PolarHBondContact O-N 3.01Å; V375-C379 PolarHBondContact O-SG 3.19Å; T376-C379 PolarHBondContact O-N 3.47Å; C379-N381 VanDerWaalsContact C-N 3.31Å; C379-N381 PolarHBondContact O-N 3.27Å; C379-A382 CarbonylContact O-C 3.54Å; C379-A382 WeakPolarHBondContact O-CA 3.44Å; C379-A382 WeakPolarHBondContact O-CB 3Å; C379-A382 PolarHBondContact O-N 2.86Å; C379-D383 PolarHBondContact O-N 3.45Å
380	M	83.8	Confident	73.5	Confident	91 Å²	91	56.7 Å²	56.7	45%	0.448	29%	0.287	S	S	.	.	H	α-helix	trans	-60.6	-38.4	177.7	-77.1	-149.5	-90.9	0	0	112.6	T376 D377 A382 D383 K384	T376-M380 HydrophobicContact CG2-CE 3.98Å; T376-M380 HydrophobicContact CG2-CG 4.41Å; T376-M380 WeakPolarHBondContact O-CB 3.4Å; T376-M380 WeakPolarHBondContact O-CG 3.37Å; T376-M380 PolarHBondContact O-N 2.87Å; D377-M380 PolarHBondContact O-N 3.2Å; M380-A382 VanDerWaalsContact C-N 3.25Å; M380-A382 PolarHBondContact O-N 3.14Å; M380-D383 PolarHBondContact O-N 2.66Å; M380-K384 WeakPolarHBondContact O-CB 3.18Å; M380-K384 VanDerWaalsContact O-CG 3.29Å; M380-K384 WeakPolarHBondContact O-CG 3.47Å; M380-K384 PolarHBondContact O-N 3.31Å
381	N	80.5	Confident	71	Confident	28 Å²	28	63 Å²	63	15%	0.15	32%	0.32	C	S	.	.	H	α-helix	trans	-64.3	-32.1	174.7	-75.3	-12.4	0	0	0	112.3	D377 C379 Q385 N407	D377-N381 WeakPolarHBondContact O-CB 3.37Å; D377-N381 PolarHBondContact O-N 3.49Å; D377-N381 PolarHBondContact O-ND2 3.37Å; C379-N381 VanDerWaalsContact C-N 3.31Å; C379-N381 PolarHBondContact O-N 3.27Å; N381-Q385 WeakPolarHBondContact O-CG 3.42Å; N381-N407 PolarHBondContact ND2-OD1 3.3Å
382	A	76	Confident	68.6	Low	0 Å²	0	69.6 Å²	69.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-77.5	-38.8	174.4	0	0	0	0	0	112.3	L378 C379 M380 Q385 S386 C436 F440 Y441	L378-A382 PolarHBondContact O-N 3.35Å; C379-A382 CarbonylContact O-C 3.54Å; C379-A382 WeakPolarHBondContact O-CA 3.44Å; C379-A382 WeakPolarHBondContact O-CB 3Å; C379-A382 PolarHBondContact O-N 2.86Å; M380-A382 VanDerWaalsContact C-N 3.25Å; M380-A382 PolarHBondContact O-N 3.14Å; A382-Q385 WeakPolarHBondContact O-CA 3.39Å; A382-Q385 VanDerWaalsContact O-CB 3.3Å; A382-Q385 WeakPolarHBondContact O-CB 3.24Å; A382-Q385 PolarHBondContact O-N 2.71Å; A382-Q385 VanDerWaalsContact O-N 3.08Å; A382-S386 PolarHBondContact O-N 2.87Å; A382-C436 HydrophobicContact CB-CB 3.97Å; A382-F440 HydrophobicContact CB-CB 4.46Å; A382-F440 HydrophobicContact CB-CD2 3.72Å; A382-F440 HydrophobicContact CB-CE2 4.21Å; A382-F440 HydrophobicContact CB-CG 4.2Å; A382-Y441 HydrophobicContact CB-CE2 4.23Å
383	D	72.7	Confident	66.4	Low	80 Å²	80	68.2 Å²	68.2	43%	0.428	35%	0.352	S	S	.	.	H	α-helix	trans	-68	-41	-178.9	-67.8	-24	0	0	0	111.8	C379 M380 Q385 S386 E387	C379-D383 PolarHBondContact O-N 3.45Å; M380-D383 PolarHBondContact O-N 2.66Å; D383-Q385 PolarHBondContact O-N 2.76Å; D383-Q385 VanDerWaalsContact O-N 3.11Å; D383-S386 WeakPolarHBondContact O-CA 3.24Å; D383-S386 WeakPolarHBondContact O-CB 3.36Å; D383-S386 PolarHBondContact O-N 3.49Å; D383-S386 PolarHBondContact O-OG 3.47Å; D383-E387 PolarHBondContact O-N 3.37Å
384	K	69.7	Low	64.5	Low	132 Å²	132	65.2 Å²	65.2	57%	0.574	34%	0.342	S	S	*	.	H	α-helix	trans	-55.5	-28.3	170.6	-74.8	173	-175.9	173.6	0	112.8	M380	M380-K384 WeakPolarHBondContact O-CB 3.18Å; M380-K384 VanDerWaalsContact O-CG 3.29Å; M380-K384 WeakPolarHBondContact O-CG 3.47Å; M380-K384 PolarHBondContact O-N 3.31Å
385	Q	60.3	Low	62.5	Low	11 Å²	11	67.5 Å²	67.5	5%	0.051	36%	0.358	C	S	.	.	H	α-helix	trans	-77	-48.6	173.3	-65.8	-61.7	-40.3	0	0	109.4	N381 A382 D383 E387 T388 Y389	N381-Q385 WeakPolarHBondContact O-CG 3.42Å; A382-Q385 WeakPolarHBondContact O-CA 3.39Å; A382-Q385 VanDerWaalsContact O-CB 3.3Å; A382-Q385 WeakPolarHBondContact O-CB 3.24Å; A382-Q385 PolarHBondContact O-N 2.71Å; A382-Q385 VanDerWaalsContact O-N 3.08Å; D383-Q385 PolarHBondContact O-N 2.76Å; D383-Q385 VanDerWaalsContact O-N 3.11Å; Q385-E387 VanDerWaalsContact C-N 3.28Å; Q385-E387 PolarHBondContact O-N 3.3Å; Q385-E387 VanDerWaalsContact O-N 3.14Å; Q385-T388 VanDerWaalsContact O-CB 3.29Å; Q385-T388 WeakPolarHBondContact O-CB 3.35Å; Q385-T388 PolarHBondContact O-N 3.41Å; Q385-T388 PolarHBondContact O-OG1 2.99Å; Q385-Y389 HydrophobicContact CB-CE2 4.01Å; Q385-Y389 WeakPolarHBondContact O-CD2 3.3Å; Q385-Y389 VanDerWaalsContact O-CE2 3.31Å; Q385-Y389 WeakPolarHBondContact O-CE2 3.43Å
386	S	56	Low	60.5	Low	42 Å²	42	72.8 Å²	72.8	29%	0.294	39%	0.386	S	S	.	.	H	α-helix	trans	-51.5	-35.4	-176.6	80.5	0	0	0	0	115.6	A382 D383 T388 Y389	A382-S386 PolarHBondContact O-N 2.87Å; D383-S386 WeakPolarHBondContact O-CA 3.24Å; D383-S386 WeakPolarHBondContact O-CB 3.36Å; D383-S386 PolarHBondContact O-N 3.49Å; D383-S386 PolarHBondContact O-OG 3.47Å; S386-T388 PolarHBondContact O-N 2.91Å; S386-Y389 PolarHBondContact O-N 3.49Å
387	E	50.3	Low	58.8	Low	164 Å²	164	71.1 Å²	71.1	77%	0.766	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.8	175.9	-70.9	-178.8	168.1	0	0	113	D383 Q385	D383-E387 PolarHBondContact O-N 3.37Å; Q385-E387 VanDerWaalsContact C-N 3.28Å; Q385-E387 PolarHBondContact O-N 3.3Å; Q385-E387 VanDerWaalsContact O-N 3.14Å
388	T	47.2	Very low	57	Low	101 Å²	101	77.7 Å²	77.7	62%	0.62	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.1	176.1	-22	0	0	0	0	113.1	Q385 S386	Q385-T388 VanDerWaalsContact O-CB 3.29Å; Q385-T388 WeakPolarHBondContact O-CB 3.35Å; Q385-T388 PolarHBondContact O-N 3.41Å; Q385-T388 PolarHBondContact O-OG1 2.99Å; S386-T388 PolarHBondContact O-N 2.91Å
389	Y	43.1	Very low	55.4	Low	53 Å²	53	81.2 Å²	81.2	21%	0.208	43%	0.429	C	S	.	.			trans	-109.1	9.6	-167.2	-69.6	-89.9	0	0	0	115	Q385 S386 D391 N396	Q385-Y389 HydrophobicContact CB-CE2 4.01Å; Q385-Y389 WeakPolarHBondContact O-CD2 3.3Å; Q385-Y389 VanDerWaalsContact O-CE2 3.31Å; Q385-Y389 WeakPolarHBondContact O-CE2 3.43Å; S386-Y389 PolarHBondContact O-N 3.49Å; Y389-D391 PolarHBondContact O-N 3.11Å; Y389-N396 WeakPolarHBondContact CE1-O 3.26Å; Y389-N396 PolarHBondContact OH-O 2.82Å
390	Q	42	Very low	54.1	Low	179 Å²	179	82 Å²	82	84%	0.836	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.7	-170.7	-107.9	-178	0.9	0	0	115.4
391	D	33.8	Very low	52.8	Low	147 Å²	147	87.3 Å²	87.3	79%	0.786	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	-10.8	-170.6	-87.2	-24.9	0	0	0	119.1	Y389	Y389-D391 PolarHBondContact O-N 3.11Å
392	N	34.6	Very low	51.9	Low	140 Å²	140	87.2 Å²	87.2	75%	0.749	45%	0.452	S	S	*	.	S	Bend	trans	-157.5	158	174.4	-87	-52	0	0	0	113.2
393	S	40.6	Very low	52	Low	49 Å²	49	89.7 Å²	89.7	34%	0.343	47%	0.465	S	S	.	.			trans	-33.1	156.9	179.4	41.2	0	0	0	0	116.1	S395	S393-S395 PolarHBondContact O-N 3.25Å; S393-S395 PolarHBondContact O-OG 2.69Å
394	P	48	Very low	52.4	Low	41 Å²	41	87.9 Å²	87.9	27%	0.266	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	36.6	-175.9	31.2	-38.2	0	0	0	114.8	F397 L519	P394-F397 HydrophobicContact CB-CE2 4.03Å; P394-F397 WeakPolarHBondContact O-CD2 3.38Å; P394-F397 WeakPolarHBondContact O-CE2 3.36Å; P394-L519 HydrophobicContact CG-CD2 3.36Å
395	S	44	Very low	53.1	Low	53 Å²	53	84.6 Å²	84.6	37%	0.371	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-19.3	-176.6	48.7	0	0	0	0	114	S393	S393-S395 PolarHBondContact O-N 3.25Å; S393-S395 PolarHBondContact O-OG 2.69Å
396	N	44.9	Very low	54.4	Low	112 Å²	112	86.1 Å²	86.1	60%	0.599	45%	0.449	S	S	*	.			trans	-113.7	69.6	-172.7	-66.9	6.2	0	0	0	112.3	Y389 E398	Y389-N396 WeakPolarHBondContact CE1-O 3.26Å; Y389-N396 PolarHBondContact OH-O 2.82Å; N396-E398 PolarHBondContact O-N 3.09Å
397	F	51.5	Low	55.9	Low	9 Å²	9	84.1 Å²	84.1	4%	0.039	44%	0.435	C	S	.	.			trans	-80.4	7.3	175.1	-90.3	-86.4	0	0	0	114.1	P394 S399 W400 F440 G443 W523	P394-F397 HydrophobicContact CB-CE2 4.03Å; P394-F397 WeakPolarHBondContact O-CD2 3.38Å; P394-F397 WeakPolarHBondContact O-CE2 3.36Å; F397-S399 PolarHBondContact O-N 2.94Å; F397-W400 HydrophobicContact CD1-CZ2 4.47Å; F397-W400 AromaticContact CD1-NE1 3.53Å; F397-W400 HydrophobicContact CE1-CZ2 4.33Å; F397-F440 WeakPolarHBondContact CE1-O 3.31Å; F397-G443 WeakPolarHBondContact CD1-O 3.37Å; F397-G443 WeakPolarHBondContact CG-O 3.48Å; F397-W523 HydrophobicContact CE2-CB 4.14Å; F397-W523 AromaticContact CE2-CD1 3.9Å; F397-W523 HydrophobicContact CE2-CG 4.41Å
398	E	47.9	Very low	57.8	Low	187 Å²	187	76.8 Å²	76.8	87%	0.874	40%	0.401	S	S	*	.			trans	-78.5	-15.1	-168.6	-74.9	-179.6	166	0	0	115.2	N396	N396-E398 PolarHBondContact O-N 3.09Å
399	S	50.8	Low	59.8	Low	74 Å²	74	72 Å²	72	52%	0.517	37%	0.371	S	S	.	.			trans	-113.7	47.3	-171.6	61.8	0	0	0	0	115.1	F397 K401	F397-S399 PolarHBondContact O-N 2.94Å; S399-K401 PolarHBondContact O-N 3.07Å
400	W	58	Low	62.1	Low	30 Å²	30	69.7 Å²	69.7	11%	0.114	36%	0.363	C	S	.	.			trans	-67.8	108.3	170.8	-79.6	57.3	0	0	0	110.3	F397 S402 F440 Y441 H444	F397-W400 HydrophobicContact CD1-CZ2 4.47Å; F397-W400 AromaticContact CD1-NE1 3.53Å; F397-W400 HydrophobicContact CE1-CZ2 4.33Å; W400-S402 PolarHBondContact O-N 3.26Å; W400-F440 HydrophobicContact CH2-CB 4.06Å; W400-F440 HydrophobicContact CZ2-CB 4.02Å; W400-Y441 AromaticContact CH2-CD1 3.76Å; W400-Y441 HydrophobicContact CH2-CD1 3.76Å; W400-Y441 AromaticContact CH2-CE1 3.8Å; W400-Y441 HydrophobicContact CH2-CE1 3.8Å; W400-Y441 HydrophobicContact CH2-CG 4.45Å; W400-Y441 HydrophobicContact CZ3-CD1 4.04Å; W400-Y441 AromaticContact CZ3-CE1 3.7Å; W400-Y441 HydrophobicContact CZ3-CE1 3.7Å; W400-H444 AromaticContact CD2-CD2 3.34Å; W400-H444 AromaticContact CD2-NE2 3.23Å; W400-H444 AromaticContact CE2-CD2 3.41Å; W400-H444 VanDerWaalsContact CE2-CD2 3.41Å; W400-H444 AromaticContact CE2-NE2 3.82Å; W400-H444 AromaticContact CE3-CD2 3.25Å; W400-H444 AromaticContact CE3-NE2 3.12Å; W400-H444 AromaticContact CG-NE2 3.75Å; W400-H444 AromaticContact CH2-CD2 3.38Å; W400-H444 WeakPolarHBondContact CH2-CD2 3.44Å; W400-H444 HydrophobicContact CZ2-CB 4.4Å; W400-H444 AromaticContact CZ2-CD2 3.42Å; W400-H444 VanDerWaalsContact CZ2-CD2 3.42Å; W400-H444 WeakPolarHBondContact CZ2-CD2 3.36Å; W400-H444 AromaticContact CZ3-CD2 3.29Å; W400-H444 WeakPolarHBondContact CZ3-CD2 3.14Å; W400-H444 AromaticContact CZ3-NE2 3.64Å
401	K	56.8	Low	64.4	Low	201 Å²	201	61.2 Å²	61.2	87%	0.874	32%	0.323	S	S	*	.			trans	-68.3	-14	175.2	-71.5	-177.1	179	175.5	0	113.8	S399	S399-K401 PolarHBondContact O-N 3.07Å
402	S	62.6	Low	67	Low	26 Å²	26	56.1 Å²	56.1	18%	0.182	30%	0.297	C	S	.	.	S	Bend	trans	-95.5	139.2	-178.8	61.9	0	0	0	0	111.2	W400 N407	W400-S402 PolarHBondContact O-N 3.26Å; S402-N407 PolarHBondContact OG-ND2 2.62Å
403	N	76.9	Confident	69.7	Low	53 Å²	53	49.6 Å²	49.6	28%	0.283	26%	0.262	S	S	.	.			trans	-57.9	121.2	178.5	-178.8	-20.5	0	0	0	109.7	Q341 Y405 F406 N407	Q341-N403 PolarHBondContact O-ND2 3.36Å; N403-Y405 PolarHBondContact O-N 3.29Å; N403-Y405 VanDerWaalsContact OD1-CB 3.31Å; N403-Y405 WeakPolarHBondContact OD1-CB 3.34Å; N403-Y405 VanDerWaalsContact OD1-CD2 3.24Å; N403-Y405 WeakPolarHBondContact OD1-CD2 3.36Å; N403-Y405 PolarHBondContact OD1-N 3.27Å; N403-F406 HydrophobicContact CB-CB 4.33Å; N403-F406 WeakPolarHBondContact O-CB 3.42Å; N403-F406 PolarHBondContact O-N 2.65Å; N403-F406 VanDerWaalsContact O-N 3.13Å; N403-N407 PolarHBondContact O-N 3.29Å
404	P	80.9	Confident	72	Confident	42 Å²	42	47.2 Å²	47.2	27%	0.273	25%	0.246	S	C	.	.	H	α-helix	trans	-59.7	-31	-177.2	24.1	-34.5	0	0	0	112.7	N407 E408 V449	P404-N407 PolarHBondContact O-N 2.77Å; P404-E408 PolarHBondContact O-N 2.91Å; P404-V449 HydrophobicContact CB-CG2 4.02Å; P404-V449 WeakPolarHBondContact O-CG2 3.33Å
405	Y	85.8	Confident	74	Confident	63 Å²	63	46.9 Å²	46.9	25%	0.247	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-34.1	179.7	-57.3	-45.2	0	0	0	113	F340 N343 R348 N403 E408 S409 Y448	F340-Y405 CarbonylContact O-C 3.29Å; F340-Y405 VanDerWaalsContact O-C 3.29Å; F340-Y405 VanDerWaalsContact O-O 3.13Å; N343-Y405 WeakPolarHBondContact OD1-CE2 3.34Å; R348-Y405 VanDerWaalsContact CZ-CD1 3.46Å; N403-Y405 PolarHBondContact O-N 3.29Å; N403-Y405 VanDerWaalsContact OD1-CB 3.31Å; N403-Y405 WeakPolarHBondContact OD1-CB 3.34Å; N403-Y405 VanDerWaalsContact OD1-CD2 3.24Å; N403-Y405 WeakPolarHBondContact OD1-CD2 3.36Å; N403-Y405 PolarHBondContact OD1-N 3.27Å; Y405-E408 PolarHBondContact O-N 2.84Å; Y405-S409 PolarHBondContact O-N 3.32Å; Y405-S409 VanDerWaalsContact O-N 3.08Å; Y405-S409 PolarHBondContact O-OG 2.73Å; Y405-Y448 HydrophobicContact CE1-CD2 4.33Å; Y405-Y448 HydrophobicContact CE1-CE2 4.5Å
406	F	87.7	Confident	76	Confident	42 Å²	42	46.1 Å²	46.1	18%	0.184	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-48.3	175.9	-173.1	-109.8	0	0	0	111	F340 Q341 N403 E408 S409 L410	F340-F406 HydrophobicContact CB-CD2 3.77Å; F340-F406 HydrophobicContact CB-CE2 4.16Å; F340-F406 HydrophobicContact CD2-CE2 4.26Å; F340-F406 PolarHBondContact O-N 2.86Å; Q341-F406 HydrophobicContact CG-CB 4.11Å; Q341-F406 HydrophobicContact CG-CD2 3.7Å; Q341-F406 HydrophobicContact CG-CG 4.24Å; N403-F406 HydrophobicContact CB-CB 4.33Å; N403-F406 WeakPolarHBondContact O-CB 3.42Å; N403-F406 PolarHBondContact O-N 2.65Å; N403-F406 VanDerWaalsContact O-N 3.13Å; F406-E408 VanDerWaalsContact C-N 3.34Å; F406-E408 PolarHBondContact O-N 3.46Å; F406-S409 PolarHBondContact O-N 3.39Å; F406-L410 HydrophobicContact CD1-CD1 3.79Å; F406-L410 HydrophobicContact CD1-CG 4.31Å; F406-L410 HydrophobicContact CE1-CD1 3.29Å; F406-L410 HydrophobicContact CE1-CG 3.99Å; F406-L410 HydrophobicContact CZ-CD1 3.76Å; F406-L410 HydrophobicContact CZ-CD2 4.26Å; F406-L410 HydrophobicContact CZ-CG 4.09Å; F406-L410 PolarHBondContact O-N 2.92Å
407	N	87.5	Confident	77.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-41	177.9	-69.3	-29.1	0	0	0	111.5	N381 S402 N403 P404 S409 L410 L411 Y441 V449	N381-N407 PolarHBondContact ND2-OD1 3.3Å; S402-N407 PolarHBondContact OG-ND2 2.62Å; N403-N407 PolarHBondContact O-N 3.29Å; P404-N407 PolarHBondContact O-N 2.77Å; N407-S409 VanDerWaalsContact C-N 3.34Å; N407-S409 PolarHBondContact O-N 2.84Å; N407-L410 PolarHBondContact O-N 3.18Å; N407-L411 WeakPolarHBondContact O-CB 3.46Å; N407-L411 WeakPolarHBondContact O-CD1 3.43Å; N407-L411 WeakPolarHBondContact O-CG 3.21Å; N407-L411 PolarHBondContact O-N 2.87Å; N407-Y441 HydrophobicContact CB-CE1 4.11Å; N407-V449 HydrophobicContact CB-CG2 4.37Å
408	E	89.7	Confident	79.5	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.047	21%	0.205	C	C	.	.	H	α-helix	trans	-56.9	-46.1	174.3	-177	-125.9	150.8	0	0	112.2	R348 P404 Y405 F406 L411 T412 V449 S452	R348-E408 IonicContact CZ-OE2 2.71Å; R348-E408 IonicContact NE-OE2 3.46Å; R348-E408 PolarHBondContact NE-OE2 3.43Å; R348-E408 IonicContact NH2-OE2 3.78Å; R348-E408 PolarHBondContact NH2-OE2 2.91Å; P404-E408 PolarHBondContact O-N 2.91Å; Y405-E408 PolarHBondContact O-N 2.84Å; F406-E408 VanDerWaalsContact C-N 3.34Å; F406-E408 PolarHBondContact O-N 3.46Å; E408-L411 PolarHBondContact O-N 3.24Å; E408-T412 WeakPolarHBondContact O-CB 3.35Å; E408-T412 PolarHBondContact O-N 3.03Å; E408-T412 PolarHBondContact O-OG1 3.03Å; E408-V449 HydrophobicContact CB-CG2 4.42Å; E408-S452 WeakPolarHBondContact CG-OG 3.47Å
409	S	89	Confident	81.1	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.007	18%	0.179	C	C	.	.	H	α-helix	trans	-66.1	-44.2	179.3	-58.6	0	0	0	0	111.8	F340 Y405 F406 N407 T412 L413	F340-S409 VanDerWaalsContact CG-CB 3.49Å; F340-S409 PolarHBondContact O-OG 2.89Å; Y405-S409 PolarHBondContact O-N 3.32Å; Y405-S409 VanDerWaalsContact O-N 3.08Å; Y405-S409 PolarHBondContact O-OG 2.73Å; F406-S409 PolarHBondContact O-N 3.39Å; N407-S409 VanDerWaalsContact C-N 3.34Å; N407-S409 PolarHBondContact O-N 2.84Å; S409-T412 PolarHBondContact O-N 3.46Å; S409-L413 WeakPolarHBondContact O-CB 3.35Å; S409-L413 PolarHBondContact O-N 2.94Å
410	L	90.3	Very high	82.4	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-62.7	-42	176.2	-73.1	-176.2	0	0	0	112.4	F340 T374 L378 F406 N407 T412 L413 C414	F340-L410 HydrophobicContact CD2-CD2 4.18Å; F340-L410 HydrophobicContact CE2-CD2 4.17Å; T374-L410 HydrophobicContact CG2-CD2 4.37Å; L378-L410 HydrophobicContact CD2-CB 3.79Å; L378-L410 HydrophobicContact CD2-CD1 4.3Å; L378-L410 HydrophobicContact CG-CB 4.23Å; F406-L410 HydrophobicContact CD1-CD1 3.79Å; F406-L410 HydrophobicContact CD1-CG 4.31Å; F406-L410 HydrophobicContact CE1-CD1 3.29Å; F406-L410 HydrophobicContact CE1-CG 3.99Å; F406-L410 HydrophobicContact CZ-CD1 3.76Å; F406-L410 HydrophobicContact CZ-CD2 4.26Å; F406-L410 HydrophobicContact CZ-CG 4.09Å; F406-L410 PolarHBondContact O-N 2.92Å; N407-L410 PolarHBondContact O-N 3.18Å; L410-T412 VanDerWaalsContact C-N 3.3Å; L410-T412 PolarHBondContact O-N 3.33Å; L410-L413 PolarHBondContact O-N 3.26Å; L410-C414 VanDerWaalsContact O-CB 3.26Å; L410-C414 WeakPolarHBondContact O-CB 3.43Å; L410-C414 PolarHBondContact O-N 2.97Å
411	L	90.8	Very high	83.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-40.7	175.4	-71.5	167.1	0	0	0	111.2	L378 N407 E408 R415 L437 Y441 V449 A453 L456	L378-L411 HydrophobicContact CD1-CD2 4.11Å; L378-L411 HydrophobicContact CD2-CD2 3.99Å; L378-L411 HydrophobicContact CD2-CG 4.06Å; N407-L411 WeakPolarHBondContact O-CB 3.46Å; N407-L411 WeakPolarHBondContact O-CD1 3.43Å; N407-L411 WeakPolarHBondContact O-CG 3.21Å; N407-L411 PolarHBondContact O-N 2.87Å; E408-L411 PolarHBondContact O-N 3.24Å; L411-R415 WeakPolarHBondContact O-CB 3.29Å; L411-R415 PolarHBondContact O-N 3.04Å; L411-L437 HydrophobicContact CD2-CD2 3.7Å; L411-Y441 HydrophobicContact CD1-CD1 4.06Å; L411-Y441 HydrophobicContact CD1-CG 4.41Å; L411-Y441 HydrophobicContact CD2-CG 4.47Å; L411-V449 HydrophobicContact CD1-CG1 3.79Å; L411-A453 HydrophobicContact CD1-CB 4.08Å; L411-L456 HydrophobicContact CD2-CD2 3.61Å
412	T	89.2	Confident	83.8	Confident	40 Å²	40	28.8 Å²	28.8	25%	0.245	15%	0.152	C	C	.	.	H	α-helix	trans	-68.5	-39.6	177.8	-56.4	0	0	0	0	112.2	V352 E408 S409 L410 S416 S452	V352-T412 HydrophobicContact CG1-CG2 4.26Å; E408-T412 WeakPolarHBondContact O-CB 3.35Å; E408-T412 PolarHBondContact O-N 3.03Å; E408-T412 PolarHBondContact O-OG1 3.03Å; S409-T412 PolarHBondContact O-N 3.46Å; L410-T412 VanDerWaalsContact C-N 3.3Å; L410-T412 PolarHBondContact O-N 3.33Å; T412-S416 PolarHBondContact O-N 3.41Å; T412-S416 PolarHBondContact O-OG 3.39Å; T412-S452 PolarHBondContact OG1-OG 3.47Å
413	L	89.9	Confident	84	Confident	3 Å²	3	30.9 Å²	30.9	2%	0.016	16%	0.159	C	C	.	.	H	α-helix	trans	-62	-55	173	177.4	62.4	0	0	0	110.1	F340 V352 Y355 L356 T374 S409 L410 R415 S416 L417	F340-L413 HydrophobicContact CE2-CD2 4.09Å; F340-L413 HydrophobicContact CZ-CD2 4.26Å; V352-L413 HydrophobicContact CG1-CB 4.2Å; V352-L413 HydrophobicContact CG1-CD1 4.35Å; Y355-L413 HydrophobicContact CD1-CD1 3.59Å; Y355-L413 HydrophobicContact CD1-CD2 4.06Å; Y355-L413 HydrophobicContact CD1-CG 4.5Å; Y355-L413 HydrophobicContact CE1-CD1 4.09Å; Y355-L413 HydrophobicContact CE1-CD2 3.95Å; Y355-L413 HydrophobicContact CG-CD1 4.41Å; L356-L413 HydrophobicContact CD2-CD1 3.72Å; L356-L413 HydrophobicContact CG-CD1 3.9Å; T374-L413 HydrophobicContact CG2-CD2 4.39Å; S409-L413 WeakPolarHBondContact O-CB 3.35Å; S409-L413 PolarHBondContact O-N 2.94Å; L410-L413 PolarHBondContact O-N 3.26Å; L413-R415 VanDerWaalsContact C-N 3.26Å; L413-R415 PolarHBondContact O-N 2.96Å; L413-S416 WeakPolarHBondContact O-CB 3.43Å; L413-S416 PolarHBondContact O-N 3.28Å; L413-L417 HydrophobicContact CD1-CD1 4.29Å; L413-L417 HydrophobicContact CD1-CD2 4.39Å; L413-L417 HydrophobicContact CD1-CG 4.19Å; L413-L417 HydrophobicContact CG-CD1 4.02Å; L413-L417 HydrophobicContact CG-CG 4.33Å; L413-L417 WeakPolarHBondContact O-CG 3.34Å; L413-L417 PolarHBondContact O-N 3.4Å
414	C	90.1	Very high	83.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-52.8	-44	178.7	-173.6	0	0	0	0	111.7	T374 L378 L410 S416 L417 I418 L456	T374-C414 HydrophobicContact CG2-CB 3.92Å; L378-C414 HydrophobicContact CD1-CB 3.94Å; L410-C414 VanDerWaalsContact O-CB 3.26Å; L410-C414 WeakPolarHBondContact O-CB 3.43Å; L410-C414 PolarHBondContact O-N 2.97Å; C414-S416 VanDerWaalsContact C-N 3.33Å; C414-S416 PolarHBondContact O-N 3.47Å; C414-L417 PolarHBondContact O-N 3.46Å; C414-I418 WeakPolarHBondContact O-CG1 3.47Å; C414-I418 PolarHBondContact O-N 2.84Å; C414-L456 HydrophobicContact CB-CD1 4.33Å; C414-L456 HydrophobicContact CB-CD2 4.07Å
415	R	89.9	Confident	82.7	Confident	34 Å²	34	35.3 Å²	35.3	13%	0.128	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-46.6	175.9	-178.4	-168.5	-177.7	-172.8	4.7	112.1	L411 L413 K419 S455 L456 T459	L411-R415 WeakPolarHBondContact O-CB 3.29Å; L411-R415 PolarHBondContact O-N 3.04Å; L413-R415 VanDerWaalsContact C-N 3.26Å; L413-R415 PolarHBondContact O-N 2.96Å; R415-K419 WeakPolarHBondContact O-CG 3.45Å; R415-K419 PolarHBondContact O-N 2.93Å; R415-K419 VanDerWaalsContact O-N 3.11Å; R415-S455 PolarHBondContact NE-O 3.1Å; R415-S455 PolarHBondContact NH1-OG 2.96Å; R415-L456 HydrophobicContact CB-CB 4.31Å; R415-L456 HydrophobicContact CB-CD1 3.93Å; R415-T459 HydrophobicContact CG-CG2 4.36Å; R415-T459 WeakPolarHBondContact CG-OG1 3.25Å; R415-T459 PolarHBondContact NE-OG1 3.42Å
416	S	86.1	Confident	82.1	Confident	36 Å²	36	34.6 Å²	34.6	25%	0.252	19%	0.189	S	C	.	.	H	α-helix	trans	-70.5	-35.7	-177.2	-56.4	0	0	0	0	111.6	T412 L413 C414 K420	T412-S416 PolarHBondContact O-N 3.41Å; T412-S416 PolarHBondContact O-OG 3.39Å; L413-S416 WeakPolarHBondContact O-CB 3.43Å; L413-S416 PolarHBondContact O-N 3.28Å; C414-S416 VanDerWaalsContact C-N 3.33Å; C414-S416 PolarHBondContact O-N 3.47Å; S416-K420 PolarHBondContact O-N 3.45Å
417	L	85.2	Confident	81.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-49.2	173.9	-63.9	177.2	0	0	0	111.1	L356 L359 F367 V370 L371 L413 C414 K419 K420 V421	L356-L417 HydrophobicContact CD2-CD2 3.64Å; L356-L417 HydrophobicContact CD2-CG 4.25Å; L359-L417 HydrophobicContact CD2-CD2 3.34Å; F367-L417 HydrophobicContact CD1-CD2 4.28Å; F367-L417 HydrophobicContact CE1-CB 3.91Å; F367-L417 HydrophobicContact CE1-CD2 3.51Å; F367-L417 HydrophobicContact CE1-CG 4.31Å; F367-L417 WeakPolarHBondContact CE1-O 3.46Å; F367-L417 HydrophobicContact CE2-CD2 3.84Å; F367-L417 HydrophobicContact CZ-CB 4.27Å; F367-L417 HydrophobicContact CZ-CD2 3.26Å; F367-L417 HydrophobicContact CZ-CG 4.34Å; V370-L417 HydrophobicContact CG1-CD1 4.12Å; L371-L417 HydrophobicContact CB-CB 4.37Å; L371-L417 HydrophobicContact CB-CD1 4.19Å; L371-L417 HydrophobicContact CD1-CB 3.81Å; L371-L417 HydrophobicContact CD1-CD1 4.22Å; L413-L417 HydrophobicContact CD1-CD1 4.29Å; L413-L417 HydrophobicContact CD1-CD2 4.39Å; L413-L417 HydrophobicContact CD1-CG 4.19Å; L413-L417 HydrophobicContact CG-CD1 4.02Å; L413-L417 HydrophobicContact CG-CG 4.33Å; L413-L417 WeakPolarHBondContact O-CG 3.34Å; L413-L417 PolarHBondContact O-N 3.4Å; C414-L417 PolarHBondContact O-N 3.46Å; L417-K419 VanDerWaalsContact C-N 3.32Å; L417-K419 PolarHBondContact O-N 2.56Å; L417-K420 PolarHBondContact O-N 2.67Å; L417-V421 WeakPolarHBondContact O-CG2 3.25Å; L417-V421 PolarHBondContact O-N 2.7Å
418	I	84.6	Confident	80.6	Confident	5 Å²	5	38 Å²	38	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-59.6	-42.1	178.7	-71.4	173.5	0	0	0	111.8	L371 C414 K420 V421 G422 L426 L433 L456 T459 L460	L371-I418 HydrophobicContact CD1-CG1 3.89Å; L371-I418 HydrophobicContact CD2-CG1 4.4Å; C414-I418 WeakPolarHBondContact O-CG1 3.47Å; C414-I418 PolarHBondContact O-N 2.84Å; I418-K420 PolarHBondContact O-N 2.75Å; I418-V421 PolarHBondContact O-N 3.24Å; I418-G422 PolarHBondContact O-N 3.48Å; I418-G422 VanDerWaalsContact O-N 3.17Å; I418-L426 HydrophobicContact CG1-CD2 4.1Å; I418-L426 HydrophobicContact CG2-CD2 4.03Å; I418-L433 HydrophobicContact CD1-CD2 4.37Å; I418-L456 HydrophobicContact CD1-CD1 3.74Å; I418-T459 HydrophobicContact CG2-CG2 4.11Å; I418-L460 HydrophobicContact CD1-CD2 3.82Å; I418-L460 HydrophobicContact CD1-CG 4.23Å; I418-L460 HydrophobicContact CG2-CD2 4.33Å
419	K	82	Confident	79.9	Confident	77 Å²	77	38.6 Å²	38.6	34%	0.335	22%	0.221	S	C	.	.	H	α-helix	trans	-57.9	-32.6	176.3	-78.8	-175	177.6	-177	0	113.1	R415 L417 T459	R415-K419 WeakPolarHBondContact O-CG 3.45Å; R415-K419 PolarHBondContact O-N 2.93Å; R415-K419 VanDerWaalsContact O-N 3.11Å; L417-K419 VanDerWaalsContact C-N 3.32Å; L417-K419 PolarHBondContact O-N 2.56Å; K419-T459 HydrophobicContact CD-CG2 4.39Å; K419-T459 HydrophobicContact CG-CG2 3.5Å; K419-T459 VanDerWaalsContact CG-CG2 3.5Å
420	K	77.3	Confident	79.2	Confident	115 Å²	115	38.7 Å²	38.7	50%	0.5	22%	0.222	S	C	.	.	H	α-helix	trans	-87.6	-35	-175.7	-165	174.2	173.4	-160.6	0	112.9	F367 S416 L417 I418	F367-K420 HydrophobicContact CE1-CB 4.08Å; F367-K420 HydrophobicContact CE2-CD 3.64Å; F367-K420 HydrophobicContact CE2-CG 4.5Å; F367-K420 HydrophobicContact CZ-CB 3.74Å; F367-K420 HydrophobicContact CZ-CD 3.62Å; F367-K420 HydrophobicContact CZ-CG 4.09Å; S416-K420 PolarHBondContact O-N 3.45Å; L417-K420 PolarHBondContact O-N 2.67Å; I418-K420 PolarHBondContact O-N 2.75Å
421	V	76.2	Confident	78.5	Confident	22 Å²	22	38.6 Å²	38.6	13%	0.133	22%	0.222	C	C	.	.	H	α-helix	trans	-71.3	-34.7	178.5	173.6	0	0	0	0	111.7	F367 L371 L417 I418 S425	F367-V421 HydrophobicContact CD1-CG2 3.4Å; F367-V421 VanDerWaalsContact CD1-CG2 3.4Å; F367-V421 HydrophobicContact CE1-CG2 3.51Å; L371-V421 HydrophobicContact CD2-CB 4.48Å; L371-V421 HydrophobicContact CD2-CG2 4.04Å; L417-V421 WeakPolarHBondContact O-CG2 3.25Å; L417-V421 PolarHBondContact O-N 2.7Å; I418-V421 PolarHBondContact O-N 3.24Å; V421-S425 VanDerWaalsContact CG1-O 3.3Å; V421-S425 WeakPolarHBondContact CG1-O 3.46Å; V421-S425 WeakPolarHBondContact CG1-OG 3.11Å; V421-S425 PolarHBondContact O-OG 3.45Å
422	G	68.3	Low	77.9	Confident	30 Å²	30	41.4 Å²	41.4	31%	0.309	24%	0.237	S	C	.	.			trans	74.2	175	-175	0	0	0	0	0	113	I418 T424	I418-G422 PolarHBondContact O-N 3.48Å; I418-G422 VanDerWaalsContact O-N 3.17Å; G422-T424 PolarHBondContact O-N 2.97Å
423	E	65.7	Low	77.7	Confident	71 Å²	71	39.5 Å²	39.5	33%	0.332	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-68.4	-33.5	-170.5	-167.3	179.5	-165.7	0	0	113.4	S425 L426	E423-S425 PolarHBondContact O-N 3.48Å; E423-L426 HydrophobicContact CG-CD1 4.49Å
424	T	64.2	Low	77.5	Confident	146 Å²	146	39.7 Å²	39.7	90%	0.896	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-71.2	-13.7	-171	51.9	0	0	0	0	114.4	G422	G422-T424 PolarHBondContact O-N 2.97Å
425	S	68.2	Low	77.1	Confident	41 Å²	41	40.7 Å²	40.7	29%	0.287	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-132.7	28.1	-175.7	53.2	0	0	0	0	114.1	V421 E423	V421-S425 VanDerWaalsContact CG1-O 3.3Å; V421-S425 WeakPolarHBondContact CG1-O 3.46Å; V421-S425 WeakPolarHBondContact CG1-OG 3.11Å; V421-S425 PolarHBondContact O-OG 3.45Å; E423-S425 PolarHBondContact O-N 3.48Å
426	L	72.5	Confident	76.9	Confident	48 Å²	48	39.5 Å²	39.5	25%	0.251	23%	0.228	S	C	.	.			trans	-64.4	142.3	173	-76.6	166	0	0	0	112	I418 E423 T430	I418-L426 HydrophobicContact CG1-CD2 4.1Å; I418-L426 HydrophobicContact CG2-CD2 4.03Å; E423-L426 HydrophobicContact CG-CD1 4.49Å; L426-T430 HydrophobicContact CD2-CG2 4.41Å
427	P	72	Confident	76.9	Confident	20 Å²	20	37.8 Å²	37.8	13%	0.13	22%	0.216	C	C	.	.			trans	-58	154.5	175.6	-25.5	33.9	0	0	0	114.1	L371 L372 N429 T430	L371-P427 HydrophobicContact CD2-CG 3.73Å; L371-P427 HydrophobicContact CG-CG 3.78Å; L372-P427 HydrophobicContact CD1-CB 4.05Å; P427-N429 VanDerWaalsContact C-N 3.3Å; P427-N429 WeakPolarHBondContact CB-OD1 3.48Å; P427-N429 PolarHBondContact O-N 3.34Å; P427-T430 WeakPolarHBondContact O-CB 3.48Å; P427-T430 PolarHBondContact O-N 2.93Å; P427-T430 PolarHBondContact O-OG1 3.2Å
428	S	71.1	Confident	76.9	Confident	94 Å²	94	37.9 Å²	37.9	66%	0.657	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.5	175.2	51.2	0	0	0	0	113.3	T430 T684	S428-T430 PolarHBondContact O-N 3.5Å; S428-T684 WeakPolarHBondContact O-CG2 3.48Å
429	N	75.3	Confident	76.7	Confident	22 Å²	22	39.9 Å²	39.9	12%	0.118	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	5.5	177.9	66.9	-6.1	0	0	0	114	L372 V375 T376 P427 G431 D432 L433	L372-N429 WeakPolarHBondContact CD1-ND2 3.44Å; V375-N429 HydrophobicContact CG1-CB 4.42Å; V375-N429 VanDerWaalsContact CG1-CG 3.48Å; V375-N429 WeakPolarHBondContact CG1-ND2 3.49Å; V375-N429 WeakPolarHBondContact CG1-OD1 3.33Å; T376-N429 PolarHBondContact OG1-ND2 3.09Å; P427-N429 VanDerWaalsContact C-N 3.3Å; P427-N429 WeakPolarHBondContact CB-OD1 3.48Å; P427-N429 PolarHBondContact O-N 3.34Å; N429-G431 PolarHBondContact O-N 2.86Å; N429-G431 VanDerWaalsContact O-N 3.15Å; N429-D432 PolarHBondContact O-N 3.4Å; N429-L433 PolarHBondContact O-N 3.15Å; N429-L433 VanDerWaalsContact O-N 3.15Å
430	T	74.5	Confident	76.7	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.018	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-25.2	177.1	-44.3	0	0	0	0	112	L426 P427 S428 Q434 L460	L426-T430 HydrophobicContact CD2-CG2 4.41Å; P427-T430 WeakPolarHBondContact O-CB 3.48Å; P427-T430 PolarHBondContact O-N 2.93Å; P427-T430 PolarHBondContact O-OG1 3.2Å; S428-T430 PolarHBondContact O-N 3.5Å; T430-Q434 VanDerWaalsContact O-CG 3.23Å; T430-Q434 WeakPolarHBondContact O-CG 3.28Å; T430-Q434 PolarHBondContact O-N 3.08Å; T430-L460 HydrophobicContact CG2-CD2 3.69Å
431	G	75.3	Confident	77.2	Confident	3 Å²	3	32.3 Å²	32.3	3%	0.031	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-40.1	171.9	0	0	0	0	0	112.9	N429 Q434 N435	N429-G431 PolarHBondContact O-N 2.86Å; N429-G431 VanDerWaalsContact O-N 3.15Å; G431-Q434 WeakPolarHBondContact O-CB 3.4Å; G431-Q434 PolarHBondContact O-N 3.12Å; G431-N435 PolarHBondContact O-N 3.47Å; G431-N435 PolarHBondContact O-ND2 3.21Å
432	D	79.2	Confident	77.6	Confident	60 Å²	60	31.3 Å²	31.3	32%	0.321	19%	0.189	S	C	.	.	H	α-helix	trans	-69.3	-42.2	178.2	-56.5	-39.3	0	0	0	110.6	N429 Q434 N435 C436 S682	N429-D432 PolarHBondContact O-N 3.4Å; D432-Q434 VanDerWaalsContact C-N 3.26Å; D432-Q434 PolarHBondContact O-N 3.21Å; D432-N435 WeakPolarHBondContact O-CB 3.49Å; D432-N435 PolarHBondContact O-N 3.49Å; D432-C436 PolarHBondContact O-N 3.2Å; D432-C436 PolarHBondContact O-SG 3.3Å; D432-S682 VanDerWaalsContact OD1-CB 3.23Å; D432-S682 WeakPolarHBondContact OD1-CB 3.49Å
433	L	84.3	Confident	78.3	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-53.6	-44.2	172.5	-177.5	64.4	0	0	0	112	V375 L378 I418 N429 N435 C436 L437 L456 L460	V375-L433 HydrophobicContact CG1-CB 3.88Å; V375-L433 HydrophobicContact CG1-CD1 4.4Å; V375-L433 HydrophobicContact CG1-CD2 4.41Å; V375-L433 HydrophobicContact CG1-CG 4.45Å; V375-L433 HydrophobicContact CG2-CD2 4.04Å; L378-L433 HydrophobicContact CB-CD1 4.21Å; L378-L433 HydrophobicContact CD1-CD1 4.03Å; I418-L433 HydrophobicContact CD1-CD2 4.37Å; N429-L433 PolarHBondContact O-N 3.15Å; N429-L433 VanDerWaalsContact O-N 3.15Å; L433-N435 VanDerWaalsContact C-N 3.34Å; L433-N435 PolarHBondContact O-N 3.22Å; L433-C436 PolarHBondContact O-N 3.23Å; L433-L437 HydrophobicContact CD1-CG 4.44Å; L433-L437 HydrophobicContact CG-CD1 4.08Å; L433-L437 HydrophobicContact CG-CG 4.43Å; L433-L437 WeakPolarHBondContact O-CB 3.23Å; L433-L437 VanDerWaalsContact O-CG 3.25Å; L433-L437 WeakPolarHBondContact O-CG 3.15Å; L433-L437 PolarHBondContact O-N 3.19Å; L433-L456 HydrophobicContact CD2-CD2 4.47Å; L433-L460 HydrophobicContact CD2-CD1 4.29Å
434	Q	84.5	Confident	79.2	Confident	6 Å²	6	26.6 Å²	26.6	3%	0.028	16%	0.159	C	C	.	.	H	α-helix	trans	-62.5	-42.1	178.9	-72.5	164.8	2.2	0	0	111.7	T430 G431 D432 L437 V438 L460 R470 L474	T430-Q434 VanDerWaalsContact O-CG 3.23Å; T430-Q434 WeakPolarHBondContact O-CG 3.28Å; T430-Q434 PolarHBondContact O-N 3.08Å; G431-Q434 WeakPolarHBondContact O-CB 3.4Å; G431-Q434 PolarHBondContact O-N 3.12Å; D432-Q434 VanDerWaalsContact C-N 3.26Å; D432-Q434 PolarHBondContact O-N 3.21Å; Q434-L437 PolarHBondContact O-N 2.91Å; Q434-V438 WeakPolarHBondContact O-CG2 3.26Å; Q434-V438 PolarHBondContact O-N 3.14Å; Q434-V438 VanDerWaalsContact O-N 3.13Å; Q434-L460 HydrophobicContact CG-CD1 4.03Å; Q434-R470 VanDerWaalsContact CD-NH2 3.28Å; Q434-L474 HydrophobicContact CG-CD2 4.16Å
435	N	83.1	Confident	79.9	Confident	22 Å²	22	22.5 Å²	22.5	12%	0.118	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-44.5	175.5	-67.6	-37.1	0	0	0	110.9	G431 D432 L433 L437 V438 N439	G431-N435 PolarHBondContact O-N 3.47Å; G431-N435 PolarHBondContact O-ND2 3.21Å; D432-N435 WeakPolarHBondContact O-CB 3.49Å; D432-N435 PolarHBondContact O-N 3.49Å; L433-N435 VanDerWaalsContact C-N 3.34Å; L433-N435 PolarHBondContact O-N 3.22Å; N435-L437 PolarHBondContact O-N 3.43Å; N435-V438 PolarHBondContact O-N 3.49Å; N435-N439 VanDerWaalsContact O-CB 3.26Å; N435-N439 WeakPolarHBondContact O-CB 3.4Å; N435-N439 VanDerWaalsContact O-CG 3.3Å; N435-N439 PolarHBondContact O-N 3.48Å; N435-N439 PolarHBondContact O-ND2 2.9Å
436	C	85.3	Confident	80.6	Confident	8 Å²	8	21.5 Å²	21.5	5%	0.054	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-41.6	177.8	-63.9	0	0	0	0	112.1	A382 D432 L433 F440 Y441	A382-C436 HydrophobicContact CB-CB 3.97Å; D432-C436 PolarHBondContact O-N 3.2Å; D432-C436 PolarHBondContact O-SG 3.3Å; L433-C436 PolarHBondContact O-N 3.23Å; C436-F440 WeakPolarHBondContact O-CB 3.44Å; C436-F440 PolarHBondContact O-N 3.44Å; C436-Y441 HydrophobicContact CB-CE2 4.36Å; C436-Y441 PolarHBondContact O-N 3.47Å
437	L	86.8	Confident	81.2	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-49	176.5	-73.7	169.9	0	0	0	111.7	L411 L433 Q434 N435 Y441 L442 A453 L456 Y457 L460	L411-L437 HydrophobicContact CD2-CD2 3.7Å; L433-L437 HydrophobicContact CD1-CG 4.44Å; L433-L437 HydrophobicContact CG-CD1 4.08Å; L433-L437 HydrophobicContact CG-CG 4.43Å; L433-L437 WeakPolarHBondContact O-CB 3.23Å; L433-L437 VanDerWaalsContact O-CG 3.25Å; L433-L437 WeakPolarHBondContact O-CG 3.15Å; L433-L437 PolarHBondContact O-N 3.19Å; Q434-L437 PolarHBondContact O-N 2.91Å; N435-L437 PolarHBondContact O-N 3.43Å; L437-Y441 HydrophobicContact CD2-CD2 4.15Å; L437-Y441 HydrophobicContact CD2-CG 4.45Å; L437-Y441 PolarHBondContact O-N 2.94Å; L437-L442 WeakPolarHBondContact O-CB 3.14Å; L437-L442 VanDerWaalsContact O-CG 3.32Å; L437-L442 WeakPolarHBondContact O-CG 3.46Å; L437-L442 PolarHBondContact O-N 3.36Å; L437-A453 HydrophobicContact CD2-CB 4Å; L437-L456 HydrophobicContact CD1-CD2 4.09Å; L437-L456 HydrophobicContact CD1-CG 4.04Å; L437-L456 HydrophobicContact CD2-CD2 4.06Å; L437-Y457 HydrophobicContact CB-CD2 4.09Å; L437-Y457 HydrophobicContact CD1-CD2 4.07Å; L437-L460 HydrophobicContact CD1-CD1 4.04Å
438	V	83.9	Confident	81.8	Confident	2 Å²	2	27 Å²	27	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-72.4	-35.3	-175.6	170.9	0	0	0	0	112.8	Q434 N435 L442 Y457 K477 R527	Q434-V438 WeakPolarHBondContact O-CG2 3.26Å; Q434-V438 PolarHBondContact O-N 3.14Å; Q434-V438 VanDerWaalsContact O-N 3.13Å; N435-V438 PolarHBondContact O-N 3.49Å; V438-L442 HydrophobicContact CG2-CD1 4.42Å; V438-Y457 HydrophobicContact CG2-CD2 4.22Å; V438-Y457 HydrophobicContact CG2-CE2 3.49Å; V438-Y457 VanDerWaalsContact CG2-CE2 3.49Å; V438-K477 WeakPolarHBondContact CG1-O 3.35Å; V438-R527 VanDerWaalsContact CG1-NH2 3.28Å; V438-R527 PolarHBondContact O-NE 2.91Å; V438-R527 PolarHBondContact O-NH2 3.32Å
439	N	81.3	Confident	82.6	Confident	48 Å²	48	22.5 Å²	22.5	26%	0.257	12%	0.116	S	C	.	.	H	α-helix	trans	-86.1	-33.2	-175.7	-68	-28.3	0	0	0	113	N435	N435-N439 VanDerWaalsContact O-CB 3.26Å; N435-N439 WeakPolarHBondContact O-CB 3.4Å; N435-N439 VanDerWaalsContact O-CG 3.3Å; N435-N439 PolarHBondContact O-N 3.48Å; N435-N439 PolarHBondContact O-ND2 2.9Å
440	F	82.3	Confident	83.2	Confident	32 Å²	32	21.9 Å²	21.9	14%	0.14	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-61.1	-171.7	-54.3	-77.1	0	0	0	112.8	A382 F397 W400 C436 L442 G443 H444	A382-F440 HydrophobicContact CB-CB 4.46Å; A382-F440 HydrophobicContact CB-CD2 3.72Å; A382-F440 HydrophobicContact CB-CE2 4.21Å; A382-F440 HydrophobicContact CB-CG 4.2Å; F397-F440 WeakPolarHBondContact CE1-O 3.31Å; W400-F440 HydrophobicContact CH2-CB 4.06Å; W400-F440 HydrophobicContact CZ2-CB 4.02Å; C436-F440 WeakPolarHBondContact O-CB 3.44Å; C436-F440 PolarHBondContact O-N 3.44Å; F440-L442 PolarHBondContact O-N 3.1Å; F440-G443 CarbonylContact O-C 3.29Å; F440-G443 PolarHBondContact O-N 3.11Å; F440-G443 VanDerWaalsContact O-N 3.12Å; F440-H444 PolarHBondContact O-N 2.77Å
441	Y	86.7	Confident	83.8	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-70.7	-33.9	-167.3	-67.4	-71.8	0	0	0	114.7	L378 A382 W400 N407 L411 C436 L437 G443 H444 V449	L378-Y441 HydrophobicContact CD2-CE1 4.49Å; L378-Y441 HydrophobicContact CD2-CE2 4.4Å; L378-Y441 PolarHBondContact O-OH 3Å; A382-Y441 HydrophobicContact CB-CE2 4.23Å; W400-Y441 AromaticContact CH2-CD1 3.76Å; W400-Y441 HydrophobicContact CH2-CD1 3.76Å; W400-Y441 AromaticContact CH2-CE1 3.8Å; W400-Y441 HydrophobicContact CH2-CE1 3.8Å; W400-Y441 HydrophobicContact CH2-CG 4.45Å; W400-Y441 HydrophobicContact CZ3-CD1 4.04Å; W400-Y441 AromaticContact CZ3-CE1 3.7Å; W400-Y441 HydrophobicContact CZ3-CE1 3.7Å; N407-Y441 HydrophobicContact CB-CE1 4.11Å; L411-Y441 HydrophobicContact CD1-CD1 4.06Å; L411-Y441 HydrophobicContact CD1-CG 4.41Å; L411-Y441 HydrophobicContact CD2-CG 4.47Å; C436-Y441 HydrophobicContact CB-CE2 4.36Å; C436-Y441 PolarHBondContact O-N 3.47Å; L437-Y441 HydrophobicContact CD2-CD2 4.15Å; L437-Y441 HydrophobicContact CD2-CG 4.45Å; L437-Y441 PolarHBondContact O-N 2.94Å; Y441-G443 PolarHBondContact O-N 2.82Å; Y441-H444 WeakPolarHBondContact O-CB 3.46Å; Y441-H444 PolarHBondContact O-N 3.37Å; Y441-V449 HydrophobicContact CD1-CG1 3.72Å
442	L	85.9	Confident	84.4	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.005	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-65.4	-29.1	173.8	-72	-178.4	0	0	0	112	L437 V438 F440 R450 A453 C454 G526 R527 M530	L437-L442 WeakPolarHBondContact O-CB 3.14Å; L437-L442 VanDerWaalsContact O-CG 3.32Å; L437-L442 WeakPolarHBondContact O-CG 3.46Å; L437-L442 PolarHBondContact O-N 3.36Å; V438-L442 HydrophobicContact CG2-CD1 4.42Å; F440-L442 PolarHBondContact O-N 3.1Å; L442-R450 WeakPolarHBondContact O-CD 3.23Å; L442-R450 WeakPolarHBondContact O-CG 3.34Å; L442-A453 HydrophobicContact CD2-CB 4.13Å; L442-C454 HydrophobicContact CD2-CB 4.49Å; L442-C454 VanDerWaalsContact CD2-SG 3.55Å; L442-G526 WeakPolarHBondContact O-CA 2.89Å; L442-R527 HydrophobicContact CD1-CG 4.35Å; L442-M530 HydrophobicContact CD1-CG 3.82Å; L442-M530 HydrophobicContact CD2-CG 3.57Å; L442-M530 HydrophobicContact CD2-SD 4.34Å; L442-M530 HydrophobicContact CG-CG 4.39Å
443	G	82.8	Confident	85	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-96.4	6.9	178.7	0	0	0	0	0	115.6	F397 F440 Y441 T522	F397-G443 WeakPolarHBondContact CD1-O 3.37Å; F397-G443 WeakPolarHBondContact CG-O 3.48Å; F440-G443 CarbonylContact O-C 3.29Å; F440-G443 PolarHBondContact O-N 3.11Å; F440-G443 VanDerWaalsContact O-N 3.12Å; Y441-G443 PolarHBondContact O-N 2.82Å; G443-T522 WeakPolarHBondContact O-CB 3.33Å; G443-T522 PolarHBondContact O-OG1 3.27Å
444	H	84.2	Confident	85.3	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.009	12%	0.116	C	C	.	.			trans	-57.7	145.9	-176.8	-167.7	-65.4	0	0	0	112.1	W400 F440 Y441 S446 V449 R450	W400-H444 AromaticContact CD2-CD2 3.34Å; W400-H444 AromaticContact CD2-NE2 3.23Å; W400-H444 AromaticContact CE2-CD2 3.41Å; W400-H444 VanDerWaalsContact CE2-CD2 3.41Å; W400-H444 AromaticContact CE2-NE2 3.82Å; W400-H444 AromaticContact CE3-CD2 3.25Å; W400-H444 AromaticContact CE3-NE2 3.12Å; W400-H444 AromaticContact CG-NE2 3.75Å; W400-H444 AromaticContact CH2-CD2 3.38Å; W400-H444 WeakPolarHBondContact CH2-CD2 3.44Å; W400-H444 HydrophobicContact CZ2-CB 4.4Å; W400-H444 AromaticContact CZ2-CD2 3.42Å; W400-H444 VanDerWaalsContact CZ2-CD2 3.42Å; W400-H444 WeakPolarHBondContact CZ2-CD2 3.36Å; W400-H444 AromaticContact CZ3-CD2 3.29Å; W400-H444 WeakPolarHBondContact CZ3-CD2 3.14Å; W400-H444 AromaticContact CZ3-NE2 3.64Å; F440-H444 PolarHBondContact O-N 2.77Å; Y441-H444 WeakPolarHBondContact O-CB 3.46Å; Y441-H444 PolarHBondContact O-N 3.37Å; H444-S446 WeakPolarHBondContact ND1-CB 3.5Å; H444-S446 PolarHBondContact ND1-N 3.32Å; H444-V449 HydrophobicContact CB-CB 4.11Å; H444-V449 HydrophobicContact CB-CG1 3.89Å; H444-R450 HydrophobicContact CB-CG 4.29Å; H444-R450 VanDerWaalsContact O-CD 3.28Å; H444-R450 WeakPolarHBondContact O-CD 3.31Å; H444-R450 VanDerWaalsContact O-CG 3.28Å; H444-R450 WeakPolarHBondContact O-CG 3.41Å; H444-R450 PolarHBondContact O-NH1 3.26Å
445	S	78.9	Confident	85.6	Confident	60 Å²	60	23.6 Å²	23.6	42%	0.42	12%	0.124	S	C	.	.	S	Bend	trans	-62	-46.5	178.6	56.1	0	0	0	0	113.6	Q447 R450	S445-Q447 PolarHBondContact O-N 2.99Å; S445-R450 VanDerWaalsContact C-NH1 3.33Å; S445-R450 PolarHBondContact O-NH1 3.48Å
446	S	82.7	Confident	85.9	Confident	21 Å²	21	22.6 Å²	22.6	15%	0.147	12%	0.119	C	C	.	.	S	Bend	trans	-64.8	125.5	170.6	-177.2	0	0	0	0	113.9	H444 Y448 V449 R450	H444-S446 WeakPolarHBondContact ND1-CB 3.5Å; H444-S446 PolarHBondContact ND1-N 3.32Å; S446-Y448 VanDerWaalsContact C-N 3.32Å; S446-Y448 PolarHBondContact O-N 2.72Å; S446-Y448 PolarHBondContact OG-N 2.85Å; S446-V449 PolarHBondContact O-N 2.88Å; S446-R450 PolarHBondContact O-N 3.32Å
447	Q	84.7	Confident	86.2	Confident	62 Å²	62	22.2 Å²	22.2	29%	0.29	12%	0.116	S	C	.	.	H	α-helix	trans	-61.7	-36	174.8	177.7	71.6	-34.1	0	0	113.2	S445 V449 R450 N451	S445-Q447 PolarHBondContact O-N 2.99Å; Q447-V449 VanDerWaalsContact C-N 3.35Å; Q447-V449 PolarHBondContact O-N 3.19Å; Q447-R450 PolarHBondContact O-N 2.93Å; Q447-R450 VanDerWaalsContact OE1-CZ 3.24Å; Q447-N451 VanDerWaalsContact O-CG 3.32Å; Q447-N451 PolarHBondContact O-N 3.43Å
448	Y	84.4	Confident	86.3	Confident	120 Å²	120	22.3 Å²	22.3	47%	0.471	12%	0.117	S	C	.	.	H	α-helix	trans	-62.6	-44.2	-179.2	-56.7	-68.2	0	0	0	111.2	Y405 S446 N451 S452	Y405-Y448 HydrophobicContact CE1-CD2 4.33Å; Y405-Y448 HydrophobicContact CE1-CE2 4.5Å; S446-Y448 VanDerWaalsContact C-N 3.32Å; S446-Y448 PolarHBondContact O-N 2.72Å; S446-Y448 PolarHBondContact OG-N 2.85Å; Y448-N451 PolarHBondContact O-N 3.37Å; Y448-S452 PolarHBondContact O-N 2.86Å; Y448-S452 PolarHBondContact O-OG 2.89Å
449	V	87.5	Confident	86.4	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-44.1	176.3	-178.4	0	0	0	0	110.5	P404 N407 E408 L411 Y441 H444 S446 Q447 N451 S452 A453	P404-V449 HydrophobicContact CB-CG2 4.02Å; P404-V449 WeakPolarHBondContact O-CG2 3.33Å; N407-V449 HydrophobicContact CB-CG2 4.37Å; E408-V449 HydrophobicContact CB-CG2 4.42Å; L411-V449 HydrophobicContact CD1-CG1 3.79Å; Y441-V449 HydrophobicContact CD1-CG1 3.72Å; H444-V449 HydrophobicContact CB-CB 4.11Å; H444-V449 HydrophobicContact CB-CG1 3.89Å; S446-V449 PolarHBondContact O-N 2.88Å; Q447-V449 VanDerWaalsContact C-N 3.35Å; Q447-V449 PolarHBondContact O-N 3.19Å; V449-N451 VanDerWaalsContact C-N 3.35Å; V449-N451 PolarHBondContact O-N 3.39Å; V449-S452 PolarHBondContact O-N 3.38Å; V449-A453 WeakPolarHBondContact O-CB 3.45Å; V449-A453 PolarHBondContact O-N 3.44Å
450	R	88.1	Confident	86.6	Confident	9 Å²	9	20.6 Å²	20.6	3%	0.034	11%	0.108	C	C	.	.	H	α-helix	trans	-58.1	-45.8	176	-66.6	-160	-63	-78.5	11.1	111.7	L442 H444 S445 S446 Q447 A453 C454 E525	L442-R450 WeakPolarHBondContact O-CD 3.23Å; L442-R450 WeakPolarHBondContact O-CG 3.34Å; H444-R450 HydrophobicContact CB-CG 4.29Å; H444-R450 VanDerWaalsContact O-CD 3.28Å; H444-R450 WeakPolarHBondContact O-CD 3.31Å; H444-R450 VanDerWaalsContact O-CG 3.28Å; H444-R450 WeakPolarHBondContact O-CG 3.41Å; H444-R450 PolarHBondContact O-NH1 3.26Å; S445-R450 VanDerWaalsContact C-NH1 3.33Å; S445-R450 PolarHBondContact O-NH1 3.48Å; S446-R450 PolarHBondContact O-N 3.32Å; Q447-R450 PolarHBondContact O-N 2.93Å; Q447-R450 VanDerWaalsContact OE1-CZ 3.24Å; R450-A453 PolarHBondContact O-N 2.98Å; R450-C454 WeakPolarHBondContact O-CB 3.37Å; R450-C454 PolarHBondContact O-N 2.82Å; R450-C454 PolarHBondContact O-SG 2.84Å; R450-E525 IonicContact CZ-OE2 2.84Å; R450-E525 IonicContact NE-OE2 2.68Å; R450-E525 PolarHBondContact NE-OE2 3.44Å; R450-E525 IonicContact NH2-OE2 2.93Å; R450-E525 PolarHBondContact NH2-OE2 3.34Å
451	N	87.5	Confident	86.8	Confident	64 Å²	64	19.2 Å²	19.2	34%	0.342	10%	0.102	S	C	.	.	H	α-helix	trans	-64.7	-42.9	-179.8	-72.7	-14.9	0	0	0	112.6	Q447 Y448 V449 C454 S455 R529	Q447-N451 VanDerWaalsContact O-CG 3.32Å; Q447-N451 PolarHBondContact O-N 3.43Å; Y448-N451 PolarHBondContact O-N 3.37Å; V449-N451 VanDerWaalsContact C-N 3.35Å; V449-N451 PolarHBondContact O-N 3.39Å; N451-C454 PolarHBondContact O-N 3.14Å; N451-S455 WeakPolarHBondContact O-CB 3.45Å; N451-S455 PolarHBondContact O-N 3.39Å; N451-S455 PolarHBondContact O-OG 3.41Å; N451-S455 VanDerWaalsContact O-OG 3.14Å; N451-R529 PolarHBondContact OD1-NH1 2.92Å
452	S	87.7	Confident	86.6	Confident	14 Å²	14	21.8 Å²	21.8	10%	0.098	12%	0.115	C	C	.	.	H	α-helix	trans	-69.4	-38.7	177.3	-67.9	0	0	0	0	112.1	E408 T412 Y448 V449 S455 L456	E408-S452 WeakPolarHBondContact CG-OG 3.47Å; T412-S452 PolarHBondContact OG1-OG 3.47Å; Y448-S452 PolarHBondContact O-N 2.86Å; Y448-S452 PolarHBondContact O-OG 2.89Å; V449-S452 PolarHBondContact O-N 3.38Å; S452-S455 WeakPolarHBondContact O-CB 3.22Å; S452-S455 PolarHBondContact O-N 2.71Å; S452-L456 WeakPolarHBondContact O-CB 3.45Å; S452-L456 PolarHBondContact O-N 3.14Å
453	A	91.7	Very high	86.3	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.7	-43.7	172.7	0	0	0	0	0	111.3	L411 L437 L442 V449 R450 S455 L456 Y457	L411-A453 HydrophobicContact CD1-CB 4.08Å; L437-A453 HydrophobicContact CD2-CB 4Å; L442-A453 HydrophobicContact CD2-CB 4.13Å; V449-A453 WeakPolarHBondContact O-CB 3.45Å; V449-A453 PolarHBondContact O-N 3.44Å; R450-A453 PolarHBondContact O-N 2.98Å; A453-S455 VanDerWaalsContact C-N 3.32Å; A453-S455 PolarHBondContact O-N 3.08Å; A453-L456 PolarHBondContact O-N 3Å; A453-Y457 WeakPolarHBondContact O-CB 3.49Å; A453-Y457 PolarHBondContact O-N 3.02Å
454	C	91.4	Very high	86.1	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.02	13%	0.126	C	C	.	.	H	α-helix	trans	-60.1	-45.4	176	-72.4	0	0	0	0	111.4	L442 R450 N451 L456 Y457 L458 M530 L533	L442-C454 HydrophobicContact CD2-CB 4.49Å; L442-C454 VanDerWaalsContact CD2-SG 3.55Å; R450-C454 WeakPolarHBondContact O-CB 3.37Å; R450-C454 PolarHBondContact O-N 2.82Å; R450-C454 PolarHBondContact O-SG 2.84Å; N451-C454 PolarHBondContact O-N 3.14Å; C454-L456 PolarHBondContact O-N 2.75Å; C454-Y457 PolarHBondContact O-N 2.93Å; C454-L458 VanDerWaalsContact O-CB 3.25Å; C454-L458 WeakPolarHBondContact O-CB 3.5Å; C454-L458 PolarHBondContact O-N 2.79Å; C454-M530 WeakPolarHBondContact CA-SD 3.38Å; C454-M530 HydrophobicContact CB-CG 4.32Å; C454-M530 HydrophobicContact CB-SD 3.35Å; C454-M530 WeakPolarHBondContact CB-SD 3.16Å; C454-L533 HydrophobicContact CB-CD1 3.94Å
455	S	90.4	Very high	85.8	Confident	28 Å²	28	24.7 Å²	24.7	20%	0.196	14%	0.136	C	C	.	.	H	α-helix	trans	-61.8	-39.9	177.6	-78	0	0	0	0	113.5	R415 N451 S452 A453 T459	R415-S455 PolarHBondContact NE-O 3.1Å; R415-S455 PolarHBondContact NH1-OG 2.96Å; N451-S455 WeakPolarHBondContact O-CB 3.45Å; N451-S455 PolarHBondContact O-N 3.39Å; N451-S455 PolarHBondContact O-OG 3.41Å; N451-S455 VanDerWaalsContact O-OG 3.14Å; S452-S455 WeakPolarHBondContact O-CB 3.22Å; S452-S455 PolarHBondContact O-N 2.71Å; A453-S455 VanDerWaalsContact C-N 3.32Å; A453-S455 PolarHBondContact O-N 3.08Å; S455-T459 PolarHBondContact O-N 3.38Å; S455-T459 PolarHBondContact O-OG1 2.69Å
456	L	90.7	Very high	85.6	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.7	-49.5	176	174.8	56.8	0	0	0	111.1	L411 C414 R415 I418 L433 L437 S452 A453 C454 L458 T459 L460	L411-L456 HydrophobicContact CD2-CD2 3.61Å; C414-L456 HydrophobicContact CB-CD1 4.33Å; C414-L456 HydrophobicContact CB-CD2 4.07Å; R415-L456 HydrophobicContact CB-CB 4.31Å; R415-L456 HydrophobicContact CB-CD1 3.93Å; I418-L456 HydrophobicContact CD1-CD1 3.74Å; L433-L456 HydrophobicContact CD2-CD2 4.47Å; L437-L456 HydrophobicContact CD1-CD2 4.09Å; L437-L456 HydrophobicContact CD1-CG 4.04Å; L437-L456 HydrophobicContact CD2-CD2 4.06Å; S452-L456 WeakPolarHBondContact O-CB 3.45Å; S452-L456 PolarHBondContact O-N 3.14Å; A453-L456 PolarHBondContact O-N 3Å; C454-L456 PolarHBondContact O-N 2.75Å; L456-L458 VanDerWaalsContact C-N 3.3Å; L456-L458 PolarHBondContact O-N 2.85Å; L456-T459 WeakPolarHBondContact O-CA 3.33Å; L456-T459 WeakPolarHBondContact O-CB 3.37Å; L456-T459 PolarHBondContact O-N 2.65Å; L456-L460 PolarHBondContact O-N 2.85Å
457	Y	90.7	Very high	85.3	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60.1	-41.7	178.6	-164.3	-78.9	0	0	0	111.6	L437 V438 A453 C454 T459 L460 F461 L474 I478 M530	L437-Y457 HydrophobicContact CB-CD2 4.09Å; L437-Y457 HydrophobicContact CD1-CD2 4.07Å; V438-Y457 HydrophobicContact CG2-CD2 4.22Å; V438-Y457 HydrophobicContact CG2-CE2 3.49Å; V438-Y457 VanDerWaalsContact CG2-CE2 3.49Å; A453-Y457 WeakPolarHBondContact O-CB 3.49Å; A453-Y457 PolarHBondContact O-N 3.02Å; C454-Y457 PolarHBondContact O-N 2.93Å; Y457-T459 VanDerWaalsContact C-N 3.26Å; Y457-T459 PolarHBondContact O-N 2.8Å; Y457-L460 WeakPolarHBondContact O-CB 3.45Å; Y457-L460 PolarHBondContact O-N 3.31Å; Y457-F461 WeakPolarHBondContact O-CB 3.44Å; Y457-F461 PolarHBondContact O-N 3.01Å; Y457-L474 HydrophobicContact CE1-CB 4.27Å; Y457-L474 WeakPolarHBondContact OH-CA 3.24Å; Y457-L474 WeakPolarHBondContact OH-CB 3.37Å; Y457-L474 PolarHBondContact OH-O 3.23Å; Y457-I478 HydrophobicContact CD1-CD1 4.5Å; Y457-I478 HydrophobicContact CE1-CD1 3.77Å; Y457-I478 HydrophobicContact CE1-CG1 4.03Å; Y457-M530 HydrophobicContact CD1-CE 3.5Å; Y457-M530 VanDerWaalsContact CD1-CE 3.5Å; Y457-M530 HydrophobicContact CE1-CE 4.45Å; Y457-M530 HydrophobicContact CG-CE 4.05Å
458	L	89	Confident	84.9	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-34.6	175.9	-174.3	62.8	0	0	0	112.1	C454 L456 F461 I462 M530 L533 V534 F568	C454-L458 VanDerWaalsContact O-CB 3.25Å; C454-L458 WeakPolarHBondContact O-CB 3.5Å; C454-L458 PolarHBondContact O-N 2.79Å; L456-L458 VanDerWaalsContact C-N 3.3Å; L456-L458 PolarHBondContact O-N 2.85Å; L458-F461 WeakPolarHBondContact O-CB 3.41Å; L458-F461 PolarHBondContact O-N 2.65Å; L458-I462 HydrophobicContact CD1-CD1 4.38Å; L458-I462 HydrophobicContact CD1-CG1 4.45Å; L458-I462 HydrophobicContact CG-CD1 3.95Å; L458-I462 HydrophobicContact CG-CG1 4.44Å; L458-I462 VanDerWaalsContact O-CG1 3.28Å; L458-I462 WeakPolarHBondContact O-CG1 3.17Å; L458-I462 PolarHBondContact O-N 3.44Å; L458-M530 HydrophobicContact CB-CE 4.15Å; L458-L533 HydrophobicContact CD2-CB 4.27Å; L458-V534 HydrophobicContact CD1-CG2 4.11Å; L458-F568 HydrophobicContact CD2-CE1 4.11Å; L458-F568 HydrophobicContact CD2-CE2 4.22Å; L458-F568 HydrophobicContact CD2-CZ 3.44Å; L458-F568 VanDerWaalsContact CD2-CZ 3.44Å
459	T	86.4	Confident	84.5	Confident	12 Å²	12	27.8 Å²	27.8	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-66.4	-44.1	176	-58.1	0	0	0	0	110.7	R415 I418 K419 S455 L456 Y457 F461 I462 S463	R415-T459 HydrophobicContact CG-CG2 4.36Å; R415-T459 WeakPolarHBondContact CG-OG1 3.25Å; R415-T459 PolarHBondContact NE-OG1 3.42Å; I418-T459 HydrophobicContact CG2-CG2 4.11Å; K419-T459 HydrophobicContact CD-CG2 4.39Å; K419-T459 HydrophobicContact CG-CG2 3.5Å; K419-T459 VanDerWaalsContact CG-CG2 3.5Å; S455-T459 PolarHBondContact O-N 3.38Å; S455-T459 PolarHBondContact O-OG1 2.69Å; L456-T459 WeakPolarHBondContact O-CA 3.33Å; L456-T459 WeakPolarHBondContact O-CB 3.37Å; L456-T459 PolarHBondContact O-N 2.65Å; Y457-T459 VanDerWaalsContact C-N 3.26Å; Y457-T459 PolarHBondContact O-N 2.8Å; T459-F461 VanDerWaalsContact C-N 3.28Å; T459-F461 PolarHBondContact O-N 3.2Å; T459-I462 PolarHBondContact O-N 2.86Å; T459-S463 PolarHBondContact O-N 3.33Å; T459-S463 PolarHBondContact O-OG 2.54Å
460	L	85.4	Confident	84	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-60	-38.7	172.5	-75	169.4	0	0	0	112.1	I418 T430 L433 Q434 L437 L456 Y457 S463 A464	I418-L460 HydrophobicContact CD1-CD2 3.82Å; I418-L460 HydrophobicContact CD1-CG 4.23Å; I418-L460 HydrophobicContact CG2-CD2 4.33Å; T430-L460 HydrophobicContact CG2-CD2 3.69Å; L433-L460 HydrophobicContact CD2-CD1 4.29Å; Q434-L460 HydrophobicContact CG-CD1 4.03Å; L437-L460 HydrophobicContact CD1-CD1 4.04Å; L456-L460 PolarHBondContact O-N 2.85Å; Y457-L460 WeakPolarHBondContact O-CB 3.45Å; Y457-L460 PolarHBondContact O-N 3.31Å; L460-S463 VanDerWaalsContact C-OG 3.3Å; L460-S463 VanDerWaalsContact CA-OG 3.32Å; L460-S463 WeakPolarHBondContact CA-OG 3.46Å; L460-S463 PolarHBondContact O-OG 2.98Å; L460-A464 PolarHBondContact O-N 3.4Å
461	F	85.6	Confident	83.7	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.009	15%	0.154	C	C	.	.	H	α-helix	trans	-66.7	-46.2	176.8	-173.1	-82.7	0	0	0	112.1	Y457 L458 T459 A464 I471 L474 V534 L538	Y457-F461 WeakPolarHBondContact O-CB 3.44Å; Y457-F461 PolarHBondContact O-N 3.01Å; L458-F461 WeakPolarHBondContact O-CB 3.41Å; L458-F461 PolarHBondContact O-N 2.65Å; T459-F461 VanDerWaalsContact C-N 3.28Å; T459-F461 PolarHBondContact O-N 3.2Å; F461-A464 WeakPolarHBondContact O-CB 3.36Å; F461-A464 PolarHBondContact O-N 2.89Å; F461-A464 VanDerWaalsContact O-N 3.15Å; F461-I471 HydrophobicContact CE1-CG2 4.43Å; F461-I471 HydrophobicContact CE2-CB 4.45Å; F461-I471 HydrophobicContact CE2-CG2 3.8Å; F461-I471 HydrophobicContact CZ-CB 4.35Å; F461-I471 HydrophobicContact CZ-CG1 4.38Å; F461-I471 HydrophobicContact CZ-CG2 3.48Å; F461-I471 VanDerWaalsContact CZ-CG2 3.48Å; F461-L474 HydrophobicContact CB-CD1 4.35Å; F461-L474 HydrophobicContact CD2-CB 3.96Å; F461-L474 HydrophobicContact CD2-CD1 4.17Å; F461-L474 HydrophobicContact CE2-CB 4.44Å; F461-V534 HydrophobicContact CD1-CG1 4.23Å; F461-V534 HydrophobicContact CD1-CG2 4.35Å; F461-V534 HydrophobicContact CD2-CG1 4.18Å; F461-V534 HydrophobicContact CD2-CG2 4.07Å; F461-V534 HydrophobicContact CE1-CG1 3.67Å; F461-V534 HydrophobicContact CE2-CG1 3.59Å; F461-V534 HydrophobicContact CE2-CG2 4.31Å; F461-V534 HydrophobicContact CG-CG1 4.46Å; F461-V534 HydrophobicContact CG-CG2 4.09Å; F461-V534 HydrophobicContact CZ-CG1 3.3Å; F461-L538 HydrophobicContact CE1-CD1 4.3Å; F461-L538 HydrophobicContact CE1-CD2 3.74Å; F461-L538 HydrophobicContact CE1-CG 3.81Å; F461-L538 HydrophobicContact CZ-CD1 3.98Å; F461-L538 HydrophobicContact CZ-CD2 4Å; F461-L538 HydrophobicContact CZ-CG 4.01Å
462	I	82.7	Confident	83.2	Confident	55 Å²	55	27.1 Å²	27.1	28%	0.282	14%	0.142	S	C	.	.	H	α-helix	trans	-66.3	-38.8	178.1	-68.2	166.8	0	0	0	110.8	L458 T459 A464 S465	L458-I462 HydrophobicContact CD1-CD1 4.38Å; L458-I462 HydrophobicContact CD1-CG1 4.45Å; L458-I462 HydrophobicContact CG-CD1 3.95Å; L458-I462 HydrophobicContact CG-CG1 4.44Å; L458-I462 VanDerWaalsContact O-CG1 3.28Å; L458-I462 WeakPolarHBondContact O-CG1 3.17Å; L458-I462 PolarHBondContact O-N 3.44Å; T459-I462 PolarHBondContact O-N 2.86Å; I462-A464 PolarHBondContact O-N 3.49Å; I462-S465 WeakPolarHBondContact O-CB 3.25Å; I462-S465 PolarHBondContact O-N 3.14Å; I462-S465 PolarHBondContact O-OG 3.47Å
463	S	79.5	Confident	82.9	Confident	29 Å²	29	27.3 Å²	27.3	20%	0.203	14%	0.14	C	C	.	.	H	α-helix	trans	-60.7	-32.9	174.2	54.3	0	0	0	0	111.8	T459 L460 S465	T459-S463 PolarHBondContact O-N 3.33Å; T459-S463 PolarHBondContact O-OG 2.54Å; L460-S463 VanDerWaalsContact C-OG 3.3Å; L460-S463 VanDerWaalsContact CA-OG 3.32Å; L460-S463 WeakPolarHBondContact CA-OG 3.46Å; L460-S463 PolarHBondContact O-OG 2.98Å; S463-S465 PolarHBondContact O-N 3.11Å
464	A	79.3	Confident	82.5	Confident	3 Å²	3	27.3 Å²	27.3	3%	0.025	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-77.2	4.8	176	0	0	0	0	0	114.4	L460 F461 I462 K466 N467 R470 I471 L474	L460-A464 PolarHBondContact O-N 3.4Å; F461-A464 WeakPolarHBondContact O-CB 3.36Å; F461-A464 PolarHBondContact O-N 2.89Å; F461-A464 VanDerWaalsContact O-N 3.15Å; I462-A464 PolarHBondContact O-N 3.49Å; A464-K466 PolarHBondContact O-N 3.36Å; A464-K466 VanDerWaalsContact O-N 3.08Å; A464-N467 CarbonylContact O-C 3.57Å; A464-N467 PolarHBondContact O-N 2.84Å; A464-R470 HydrophobicContact CB-CB 4.01Å; A464-R470 HydrophobicContact CB-CG 3.55Å; A464-I471 WeakPolarHBondContact O-CG1 3.36Å; A464-L474 HydrophobicContact CB-CD1 4.05Å
465	S	77.2	Confident	82.1	Confident	31 Å²	31	27.4 Å²	27.4	22%	0.217	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-58.7	-24.8	-174.3	55.7	0	0	0	0	114.4	I462 S463	I462-S465 WeakPolarHBondContact O-CB 3.25Å; I462-S465 PolarHBondContact O-N 3.14Å; I462-S465 PolarHBondContact O-OG 3.47Å; S463-S465 PolarHBondContact O-N 3.11Å
466	K	74.4	Confident	81.7	Confident	183 Å²	183	27.8 Å²	27.8	80%	0.796	14%	0.141	S	C	*	.	G	3₁₀ helix	trans	-79.6	-18	176.6	-64.9	-177.7	179.8	-179.8	0	113.4	A464	A464-K466 PolarHBondContact O-N 3.36Å; A464-K466 VanDerWaalsContact O-N 3.08Å
467	N	77.4	Confident	81.3	Confident	71 Å²	71	28.7 Å²	28.7	38%	0.38	15%	0.145	S	C	.	.			trans	-115.7	97.7	-178.4	-172.5	-24.5	0	0	0	111.1	A464 N469 R470 I471	A464-N467 CarbonylContact O-C 3.57Å; A464-N467 PolarHBondContact O-N 2.84Å; N467-N469 VanDerWaalsContact C-N 3.25Å; N467-N469 PolarHBondContact O-N 2.81Å; N467-N469 PolarHBondContact OD1-N 3.25Å; N467-N469 VanDerWaalsContact OD1-N 3.16Å; N467-R470 HydrophobicContact CB-CB 3.87Å; N467-R470 WeakPolarHBondContact O-CB 3.28Å; N467-R470 PolarHBondContact O-N 3.48Å; N467-R470 PolarHBondContact OD1-N 2.73Å; N467-I471 PolarHBondContact O-N 2.79Å; N467-I471 VanDerWaalsContact O-N 3.09Å
468	P	75.3	Confident	81	Confident	28 Å²	28	28.7 Å²	28.7	18%	0.182	15%	0.145	C	C	.	.	H	α-helix	trans	-62.5	-29.4	-176.4	24.2	-33.6	0	0	0	113.3	I471 R472 I649 L652	P468-I471 PolarHBondContact O-N 3.47Å; P468-R472 WeakPolarHBondContact O-CG 3.46Å; P468-R472 PolarHBondContact O-N 3.1Å; P468-R472 VanDerWaalsContact O-N 3.08Å; P468-I649 HydrophobicContact CB-CG1 3.69Å; P468-L652 HydrophobicContact CB-CD1 3.73Å; P468-L652 HydrophobicContact CG-CD1 3.33Å
469	N	76.9	Confident	80.5	Confident	47 Å²	47	29.5 Å²	29.5	25%	0.251	15%	0.149	S	C	.	.	H	α-helix	trans	-70	-36.6	175.8	-68.3	-33.8	0	0	0	111.6	N467 R472 Y473	N467-N469 VanDerWaalsContact C-N 3.25Å; N467-N469 PolarHBondContact O-N 2.81Å; N467-N469 PolarHBondContact OD1-N 3.25Å; N467-N469 VanDerWaalsContact OD1-N 3.16Å; N469-R472 PolarHBondContact O-N 3.36Å; N469-Y473 PolarHBondContact O-N 2.94Å
470	R	77.6	Confident	80.1	Confident	37 Å²	37	31 Å²	31	14%	0.14	16%	0.155	C	C	.	.	H	α-helix	trans	-67.9	-38.1	175	-170.8	59.9	163.3	164.6	-1.9	111.7	Q434 A464 N467 Y473 L474	Q434-R470 VanDerWaalsContact CD-NH2 3.28Å; A464-R470 HydrophobicContact CB-CB 4.01Å; A464-R470 HydrophobicContact CB-CG 3.55Å; N467-R470 HydrophobicContact CB-CB 3.87Å; N467-R470 WeakPolarHBondContact O-CB 3.28Å; N467-R470 PolarHBondContact O-N 3.48Å; N467-R470 PolarHBondContact OD1-N 2.73Å; R470-Y473 WeakPolarHBondContact O-CB 3.48Å; R470-Y473 PolarHBondContact O-N 3.21Å; R470-L474 HydrophobicContact CG-CD1 4.43Å; R470-L474 WeakPolarHBondContact O-CG 3.49Å; R470-L474 PolarHBondContact O-N 2.87Å
471	I	80.8	Confident	79.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.6	-50.3	171.7	-69.8	172.6	0	0	0	110.8	F461 A464 N467 P468 Y473 L474 L475 V645 I649	F461-I471 HydrophobicContact CE1-CG2 4.43Å; F461-I471 HydrophobicContact CE2-CB 4.45Å; F461-I471 HydrophobicContact CE2-CG2 3.8Å; F461-I471 HydrophobicContact CZ-CB 4.35Å; F461-I471 HydrophobicContact CZ-CG1 4.38Å; F461-I471 HydrophobicContact CZ-CG2 3.48Å; F461-I471 VanDerWaalsContact CZ-CG2 3.48Å; A464-I471 WeakPolarHBondContact O-CG1 3.36Å; N467-I471 PolarHBondContact O-N 2.79Å; N467-I471 VanDerWaalsContact O-N 3.09Å; P468-I471 PolarHBondContact O-N 3.47Å; I471-Y473 VanDerWaalsContact C-N 3.28Å; I471-Y473 PolarHBondContact O-N 3.47Å; I471-L474 PolarHBondContact O-N 3.22Å; I471-L475 PolarHBondContact O-N 3.4Å; I471-V645 HydrophobicContact CD1-CG1 3.61Å; I471-I649 HydrophobicContact CD1-CD1 4.23Å; I471-I649 HydrophobicContact CG2-CD1 4.07Å
472	R	78.1	Confident	79.3	Confident	21 Å²	21	39.1 Å²	39.1	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-59.6	-40.8	178.5	-71.3	-179.5	-176.1	172.2	-1.4	111.8	P468 N469 L475 N476 I649 D653 L691 M699	P468-R472 WeakPolarHBondContact O-CG 3.46Å; P468-R472 PolarHBondContact O-N 3.1Å; P468-R472 VanDerWaalsContact O-N 3.08Å; N469-R472 PolarHBondContact O-N 3.36Å; R472-L475 PolarHBondContact O-N 3.02Å; R472-N476 VanDerWaalsContact O-CB 3.3Å; R472-N476 WeakPolarHBondContact O-CB 3.37Å; R472-N476 PolarHBondContact O-N 3.18Å; R472-I649 PolarHBondContact NH2-O 2.91Å; R472-D653 IonicContact CZ-OD1 3.51Å; R472-D653 IonicContact NE-OD1 3.83Å; R472-D653 IonicContact NH1-OD1 3.73Å; R472-D653 PolarHBondContact NH1-OD1 3.46Å; R472-D653 VanDerWaalsContact NH2-CG 3.28Å; R472-D653 IonicContact NH2-OD1 2.67Å; R472-D653 PolarHBondContact NH2-OD1 3.28Å; R472-L691 HydrophobicContact CB-CD2 4.48Å; R472-M699 HydrophobicContact CB-CE 4.06Å; R472-M699 HydrophobicContact CG-CE 3.96Å
473	Y	80.5	Confident	79.1	Confident	18 Å²	18	42.5 Å²	42.5	7%	0.071	21%	0.205	C	C	.	.	H	α-helix	trans	-58.5	-51.5	175.5	-178.1	-106.6	0	0	0	113.2	N469 R470 I471 L475 N476 K477 V686 L691	N469-Y473 PolarHBondContact O-N 2.94Å; R470-Y473 WeakPolarHBondContact O-CB 3.48Å; R470-Y473 PolarHBondContact O-N 3.21Å; I471-Y473 VanDerWaalsContact C-N 3.28Å; I471-Y473 PolarHBondContact O-N 3.47Å; Y473-L475 VanDerWaalsContact C-N 3.33Å; Y473-L475 PolarHBondContact O-N 3.14Å; Y473-N476 PolarHBondContact O-N 3.28Å; Y473-K477 HydrophobicContact CD1-CG 4.27Å; Y473-K477 HydrophobicContact CD2-CG 4.38Å; Y473-K477 HydrophobicContact CE1-CG 3.91Å; Y473-K477 HydrophobicContact CE2-CG 4.11Å; Y473-K477 WeakPolarHBondContact O-CB 3.46Å; Y473-K477 WeakPolarHBondContact O-CG 3.33Å; Y473-K477 PolarHBondContact O-N 3.45Å; Y473-K477 VanDerWaalsContact OH-CE 3.27Å; Y473-K477 WeakPolarHBondContact OH-CE 3.47Å; Y473-V686 HydrophobicContact CD2-CG2 4.34Å; Y473-V686 HydrophobicContact CE2-CG2 4.32Å; Y473-L691 VanDerWaalsContact CA-CD2 3.43Å; Y473-L691 HydrophobicContact CD2-CD1 3.38Å; Y473-L691 HydrophobicContact CD2-CD2 3.99Å; Y473-L691 HydrophobicContact CD2-CG 3.96Å; Y473-L691 HydrophobicContact CE2-CD1 4.27Å; Y473-L691 HydrophobicContact CG-CD1 3.86Å; Y473-L691 HydrophobicContact CG-CD2 4.32Å
474	L	83.2	Confident	79	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-44.6	-178.6	-67.8	173.6	0	0	0	110.2	Q434 Y457 F461 A464 R470 I471 N476 K477 I478	Q434-L474 HydrophobicContact CG-CD2 4.16Å; Y457-L474 HydrophobicContact CE1-CB 4.27Å; Y457-L474 WeakPolarHBondContact OH-CA 3.24Å; Y457-L474 WeakPolarHBondContact OH-CB 3.37Å; Y457-L474 PolarHBondContact OH-O 3.23Å; F461-L474 HydrophobicContact CB-CD1 4.35Å; F461-L474 HydrophobicContact CD2-CB 3.96Å; F461-L474 HydrophobicContact CD2-CD1 4.17Å; F461-L474 HydrophobicContact CE2-CB 4.44Å; A464-L474 HydrophobicContact CB-CD1 4.05Å; R470-L474 HydrophobicContact CG-CD1 4.43Å; R470-L474 WeakPolarHBondContact O-CG 3.49Å; R470-L474 PolarHBondContact O-N 2.87Å; I471-L474 PolarHBondContact O-N 3.22Å; L474-N476 PolarHBondContact O-N 3.44Å; L474-K477 PolarHBondContact O-N 2.9Å; L474-I478 WeakPolarHBondContact O-CG1 3.45Å; L474-I478 PolarHBondContact O-N 2.93Å
475	L	83.2	Confident	78.9	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-45.9	177.1	-159.3	82	0	0	0	112	I471 R472 Y473 K477 I478 V534 M696 M699 I703	I471-L475 PolarHBondContact O-N 3.4Å; R472-L475 PolarHBondContact O-N 3.02Å; Y473-L475 VanDerWaalsContact C-N 3.33Å; Y473-L475 PolarHBondContact O-N 3.14Å; L475-K477 VanDerWaalsContact C-N 3.29Å; L475-K477 PolarHBondContact O-N 2.67Å; L475-I478 PolarHBondContact O-N 3.21Å; L475-V534 HydrophobicContact CD1-CG1 3.73Å; L475-M696 HydrophobicContact CD2-CE 3.71Å; L475-M696 HydrophobicContact CD2-SD 3.83Å; L475-M699 HydrophobicContact CB-SD 4.12Å; L475-M699 HydrophobicContact CD2-CB 3.8Å; L475-M699 HydrophobicContact CD2-CE 3.98Å; L475-M699 HydrophobicContact CD2-CG 4.42Å; L475-M699 HydrophobicContact CD2-SD 3.85Å; L475-M699 HydrophobicContact CG-SD 4.33Å; L475-I703 HydrophobicContact CD1-CD1 4.27Å; L475-I703 HydrophobicContact CD2-CD1 4.04Å; L475-I703 HydrophobicContact CG-CD1 4.15Å
476	N	82.3	Confident	79	Confident	37 Å²	37	47 Å²	47	20%	0.198	22%	0.219	C	C	.	.	H	α-helix	trans	-66.6	-31.8	179.3	-167.4	47.4	0	0	0	112.3	R472 Y473 L474 I478 L479 E480 I694 M699	R472-N476 VanDerWaalsContact O-CB 3.3Å; R472-N476 WeakPolarHBondContact O-CB 3.37Å; R472-N476 PolarHBondContact O-N 3.18Å; Y473-N476 PolarHBondContact O-N 3.28Å; L474-N476 PolarHBondContact O-N 3.44Å; N476-I478 VanDerWaalsContact C-N 3.32Å; N476-I478 PolarHBondContact O-N 3.44Å; N476-L479 WeakPolarHBondContact O-CB 3.37Å; N476-L479 PolarHBondContact O-N 3.27Å; N476-L479 VanDerWaalsContact O-N 3.13Å; N476-E480 PolarHBondContact O-N 3.46Å; N476-I694 WeakPolarHBondContact OD1-CD1 3.28Å; N476-M699 HydrophobicContact CB-SD 3.84Å
477	K	82.2	Confident	78.9	Confident	18 Å²	18	44.9 Å²	44.9	8%	0.078	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-36	176.2	-83.4	-70.1	-179	178.4	0	112.7	V438 Y473 L474 L475 L479 E480	V438-K477 WeakPolarHBondContact CG1-O 3.35Å; Y473-K477 HydrophobicContact CD1-CG 4.27Å; Y473-K477 HydrophobicContact CD2-CG 4.38Å; Y473-K477 HydrophobicContact CE1-CG 3.91Å; Y473-K477 HydrophobicContact CE2-CG 4.11Å; Y473-K477 WeakPolarHBondContact O-CB 3.46Å; Y473-K477 WeakPolarHBondContact O-CG 3.33Å; Y473-K477 PolarHBondContact O-N 3.45Å; Y473-K477 VanDerWaalsContact OH-CE 3.27Å; Y473-K477 WeakPolarHBondContact OH-CE 3.47Å; L474-K477 PolarHBondContact O-N 2.9Å; L475-K477 VanDerWaalsContact C-N 3.29Å; L475-K477 PolarHBondContact O-N 2.67Å; K477-L479 PolarHBondContact O-N 3.33Å; K477-E480 WeakPolarHBondContact CD-OE2 3.42Å; K477-E480 WeakPolarHBondContact CE-OE2 3.35Å; K477-E480 IonicContact NZ-OE2 3.55Å; K477-E480 PolarHBondContact NZ-OE2 3.37Å; K477-E480 VanDerWaalsContact O-CB 3.27Å; K477-E480 WeakPolarHBondContact O-CB 3.36Å; K477-E480 PolarHBondContact O-N 3.35Å
478	I	83.4	Confident	78.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.6	-31.3	175.5	-53.1	166.6	0	0	0	111	Y457 L474 L475 N476 E480 R527 M530 Y531	Y457-I478 HydrophobicContact CD1-CD1 4.5Å; Y457-I478 HydrophobicContact CE1-CD1 3.77Å; Y457-I478 HydrophobicContact CE1-CG1 4.03Å; L474-I478 WeakPolarHBondContact O-CG1 3.45Å; L474-I478 PolarHBondContact O-N 2.93Å; L475-I478 PolarHBondContact O-N 3.21Å; N476-I478 VanDerWaalsContact C-N 3.32Å; N476-I478 PolarHBondContact O-N 3.44Å; I478-E480 VanDerWaalsContact C-N 3.3Å; I478-E480 PolarHBondContact O-N 3.22Å; I478-R527 HydrophobicContact CG2-CB 3.92Å; I478-R527 HydrophobicContact CG2-CG 4.03Å; I478-R527 PolarHBondContact O-NH1 3.41Å; I478-M530 HydrophobicContact CD1-CB 4.13Å; I478-Y531 HydrophobicContact CB-CE1 3.74Å; I478-Y531 HydrophobicContact CD1-CE1 4.31Å; I478-Y531 HydrophobicContact CG2-CD1 4.29Å; I478-Y531 HydrophobicContact CG2-CE1 3.57Å; I478-Y531 HydrophobicContact CG2-CE2 3.99Å; I478-Y531 WeakPolarHBondContact CG2-OH 3.21Å; I478-Y531 PolarHBondContact O-OH 3.13Å
479	L	78.3	Confident	79	Confident	20 Å²	20	41.2 Å²	41.2	11%	0.105	20%	0.196	C	C	.	.	H	α-helix	trans	-77.6	-12	177.8	-71.9	167.6	0	0	0	113.5	N476 K477 K481 W482 Y531 M699 I703 L706	N476-L479 WeakPolarHBondContact O-CB 3.37Å; N476-L479 PolarHBondContact O-N 3.27Å; N476-L479 VanDerWaalsContact O-N 3.13Å; K477-L479 PolarHBondContact O-N 3.33Å; L479-K481 PolarHBondContact O-N 3.11Å; L479-W482 PolarHBondContact O-N 3.48Å; L479-Y531 VanDerWaalsContact CA-OH 3.3Å; L479-Y531 WeakPolarHBondContact CA-OH 3.36Å; L479-Y531 HydrophobicContact CD2-CE1 4.42Å; L479-Y531 WeakPolarHBondContact CD2-OH 3.27Å; L479-Y531 HydrophobicContact CG-CE1 4.3Å; L479-Y531 WeakPolarHBondContact CG-OH 3.26Å; L479-Y531 PolarHBondContact N-OH 3.35Å; L479-Y531 VanDerWaalsContact N-OH 3.11Å; L479-M699 HydrophobicContact CD1-CB 4.09Å; L479-M699 HydrophobicContact CD1-CG 4.03Å; L479-I703 HydrophobicContact CD1-CG1 4.3Å; L479-I703 HydrophobicContact CD2-CG1 3.95Å; L479-I703 HydrophobicContact CG-CG1 4.38Å; L479-L706 HydrophobicContact CD2-CD1 3.56Å
480	E	79	Confident	79.3	Confident	43 Å²	43	42 Å²	42	20%	0.201	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	131.6	-172.4	-156.9	-170.8	141.5	0	0	111.5	N476 K477 I478 W482 R527	N476-E480 PolarHBondContact O-N 3.46Å; K477-E480 WeakPolarHBondContact CD-OE2 3.42Å; K477-E480 WeakPolarHBondContact CE-OE2 3.35Å; K477-E480 IonicContact NZ-OE2 3.55Å; K477-E480 PolarHBondContact NZ-OE2 3.37Å; K477-E480 VanDerWaalsContact O-CB 3.27Å; K477-E480 WeakPolarHBondContact O-CB 3.36Å; K477-E480 PolarHBondContact O-N 3.35Å; I478-E480 VanDerWaalsContact C-N 3.3Å; I478-E480 PolarHBondContact O-N 3.22Å; E480-W482 PolarHBondContact O-N 3.4Å; E480-R527 PolarHBondContact O-NH1 3.2Å
481	K	74.2	Confident	79.5	Confident	159 Å²	159	41.6 Å²	41.6	69%	0.691	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	14.4	-177.4	-50.6	176.9	-176.4	176.5	0	115	L479	L479-K481 PolarHBondContact O-N 3.11Å
482	W	78.9	Confident	79.4	Confident	17 Å²	17	43 Å²	43	6%	0.064	21%	0.212	C	C	.	.			trans	-112.9	97.3	175	-155.5	-9.6	0	0	0	111.6	L479 E480 W523 R524 R527 M528 Y531 L706	L479-W482 PolarHBondContact O-N 3.48Å; E480-W482 PolarHBondContact O-N 3.4Å; W482-W523 HydrophobicContact CB-CH2 3.89Å; W482-W523 HydrophobicContact CB-CZ3 4.22Å; W482-W523 HydrophobicContact CD2-CH2 4.11Å; W482-W523 AromaticContact CD2-CZ3 3.55Å; W482-W523 HydrophobicContact CD2-CZ3 3.55Å; W482-W523 HydrophobicContact CE3-CH2 4.24Å; W482-W523 AromaticContact CE3-CZ3 3.71Å; W482-W523 HydrophobicContact CE3-CZ3 3.71Å; W482-W523 AromaticContact CG-CH2 3.98Å; W482-W523 HydrophobicContact CG-CH2 3.98Å; W482-W523 AromaticContact CG-CZ3 3.8Å; W482-W523 HydrophobicContact CG-CZ3 3.8Å; W482-W523 HydrophobicContact CZ3-CZ3 4.31Å; W482-R524 HydrophobicContact CH2-CB 3.64Å; W482-R524 HydrophobicContact CH2-CG 3.9Å; W482-R524 WeakPolarHBondContact CH2-O 3.08Å; W482-R524 HydrophobicContact CZ2-CB 3.65Å; W482-R524 HydrophobicContact CZ2-CG 3.45Å; W482-R524 VanDerWaalsContact CZ2-CG 3.45Å; W482-R527 HydrophobicContact CE3-CB 4.18Å; W482-R527 HydrophobicContact CZ3-CB 3.57Å; W482-M528 HydrophobicContact CH2-CE 3.82Å; W482-M528 HydrophobicContact CH2-CG 3.97Å; W482-M528 HydrophobicContact CZ2-CE 4.31Å; W482-M528 HydrophobicContact CZ3-CE 4.33Å; W482-Y531 HydrophobicContact CZ3-CE2 4.28Å; W482-L706 HydrophobicContact CB-CD1 4.42Å; W482-L706 HydrophobicContact CD2-CD1 3.95Å; W482-L706 HydrophobicContact CD2-CD2 4.14Å; W482-L706 HydrophobicContact CE3-CD1 4.14Å; W482-L706 HydrophobicContact CG-CD1 4.08Å; W482-L706 HydrophobicContact CG-CD2 3.99Å
483	Q	78.8	Confident	79.3	Confident	126 Å²	126	42.7 Å²	42.7	59%	0.589	21%	0.212	S	C	*	.			trans	-91.3	139.5	176.4	-64.5	-173.1	-1.7	0	0	111.1
484	V	77.1	Confident	78.8	Confident	31 Å²	31	44.2 Å²	44.2	19%	0.188	23%	0.225	C	C	.	.			trans	-76	132.1	175.1	177	0	0	0	0	109.7	Q486 V489 R705 L706	V484-Q486 VanDerWaalsContact C-N 3.34Å; V484-Q486 HydrophobicContact CG1-CG 4.26Å; V484-Q486 PolarHBondContact O-N 3.02Å; V484-V489 HydrophobicContact CG1-CG2 4.29Å; V484-R705 HydrophobicContact CG1-CB 3.78Å; V484-R705 HydrophobicContact CG2-CB 3.94Å; V484-L706 HydrophobicContact CB-CD2 4.27Å; V484-L706 HydrophobicContact CG2-CD2 3.52Å; V484-L706 HydrophobicContact CG2-CG 3.59Å
485	K	78.4	Confident	78.1	Confident	72 Å²	72	50.7 Å²	50.7	31%	0.313	25%	0.253	S	S	.	.			trans	-76.5	83.8	166.5	-68.3	-178.8	176	-177.3	0	110.4	D487 V488 V489 E709	K485-D487 PolarHBondContact O-N 2.99Å; K485-D487 VanDerWaalsContact O-N 3.16Å; K485-V488 HydrophobicContact CB-CB 4.3Å; K485-V488 HydrophobicContact CB-CG2 4.01Å; K485-V488 HydrophobicContact CD-CG2 4.29Å; K485-V488 PolarHBondContact O-N 3.22Å; K485-V488 VanDerWaalsContact O-N 3.09Å; K485-V489 PolarHBondContact O-N 3.11Å; K485-E709 PolarHBondContact N-OE2 3.38Å
486	Q	78.6	Confident	77.2	Confident	53 Å²	53	51.8 Å²	51.8	25%	0.248	26%	0.259	C	S	.	.	H	α-helix	trans	-57	-33.8	-175	-68.4	-168.4	6.9	0	0	113.1	V484 V488 V489 L490	V484-Q486 VanDerWaalsContact C-N 3.34Å; V484-Q486 HydrophobicContact CG1-CG 4.26Å; V484-Q486 PolarHBondContact O-N 3.02Å; Q486-V488 VanDerWaalsContact C-N 3.28Å; Q486-V488 PolarHBondContact O-N 2.97Å; Q486-V489 PolarHBondContact O-N 3.39Å; Q486-L490 HydrophobicContact CB-CD1 4.36Å; Q486-L490 WeakPolarHBondContact O-CB 3.28Å; Q486-L490 PolarHBondContact O-N 2.84Å
487	D	73.5	Confident	76	Confident	139 Å²	139	52 Å²	52	74%	0.743	26%	0.26	S	S	*	.	H	α-helix	trans	-64.2	-32.8	-179.5	-53.8	-38	0	0	0	112.5	K485 S491	K485-D487 PolarHBondContact O-N 2.99Å; K485-D487 VanDerWaalsContact O-N 3.16Å; D487-S491 WeakPolarHBondContact O-CB 3.41Å; D487-S491 PolarHBondContact O-N 3.11Å; D487-S491 PolarHBondContact O-OG 3.18Å
488	V	75.3	Confident	74.5	Confident	23 Å²	23	57.5 Å²	57.5	14%	0.139	28%	0.284	C	S	.	.	H	α-helix	trans	-76.7	-38.8	177.8	179.1	0	0	0	0	110.7	K485 Q486 S491 L496 L712	K485-V488 HydrophobicContact CB-CB 4.3Å; K485-V488 HydrophobicContact CB-CG2 4.01Å; K485-V488 HydrophobicContact CD-CG2 4.29Å; K485-V488 PolarHBondContact O-N 3.22Å; K485-V488 VanDerWaalsContact O-N 3.09Å; Q486-V488 VanDerWaalsContact C-N 3.28Å; Q486-V488 PolarHBondContact O-N 2.97Å; V488-S491 PolarHBondContact O-OG 3.02Å; V488-L496 HydrophobicContact CG1-CD2 4.43Å; V488-L712 HydrophobicContact CG1-CD1 3.55Å
489	V	79.4	Confident	72.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-80.5	-32.1	-172.8	173.2	0	0	0	0	112.4	V484 K485 Q486 R705 V708 E709 M756	V484-V489 HydrophobicContact CG1-CG2 4.29Å; K485-V489 PolarHBondContact O-N 3.11Å; Q486-V489 PolarHBondContact O-N 3.39Å; V489-R705 HydrophobicContact CG1-CB 4.46Å; V489-R705 HydrophobicContact CG1-CG 4.39Å; V489-V708 HydrophobicContact CG1-CG1 4.09Å; V489-E709 HydrophobicContact CG2-CB 3.93Å; V489-M756 HydrophobicContact CG1-CG 3.38Å; V489-M756 HydrophobicContact CG1-SD 3.58Å; V489-M756 VanDerWaalsContact CG1-SD 3.58Å; V489-M756 PolarHBondContact O-N 3.26Å
490	L	83.4	Confident	71.3	Confident	63 Å²	63	63.8 Å²	63.8	33%	0.33	31%	0.314	S	S	.	.	H	α-helix	trans	-104.8	-6.9	-175.5	-60.2	176.4	0	0	0	114.1	Q486 T754 M756	Q486-L490 HydrophobicContact CB-CD1 4.36Å; Q486-L490 WeakPolarHBondContact O-CB 3.28Å; Q486-L490 PolarHBondContact O-N 2.84Å; L490-T754 VanDerWaalsContact O-CG2 3.29Å; L490-T754 WeakPolarHBondContact O-CG2 3.5Å; L490-M756 HydrophobicContact CD2-CB 4.37Å; L490-M756 HydrophobicContact CD2-CG 3.76Å
491	S	80.5	Confident	69.4	Low	28 Å²	28	65.8 Å²	65.8	20%	0.196	33%	0.325	C	S	.	.	S	Bend	trans	-69.2	145.5	175.6	47.4	0	0	0	0	111.2	D487 V488 L493 L496	D487-S491 WeakPolarHBondContact O-CB 3.41Å; D487-S491 PolarHBondContact O-N 3.11Å; D487-S491 PolarHBondContact O-OG 3.18Å; V488-S491 PolarHBondContact O-OG 3.02Å; S491-L493 PolarHBondContact O-N 3.48Å; S491-L496 WeakPolarHBondContact OG-CD1 3.15Å
492	P	79	Confident	67.8	Low	29 Å²	29	65.5 Å²	65.5	19%	0.188	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-52.6	133.6	169.1	-28.5	36	0	0	0	111.2	S494 K495 L496 P752	P492-S494 PolarHBondContact O-N 3.14Å; P492-K495 HydrophobicContact CB-CG 4.37Å; P492-K495 HydrophobicContact CG-CD 4.38Å; P492-K495 WeakPolarHBondContact O-CB 3.35Å; P492-K495 PolarHBondContact O-N 2.83Å; P492-L496 PolarHBondContact O-N 2.71Å; P492-P752 HydrophobicContact CB-CB 4.13Å; P492-P752 HydrophobicContact CB-CG 3.64Å; P492-P752 HydrophobicContact CG-CG 3.82Å
493	L	76.1	Confident	66	Low	15 Å²	15	68.1 Å²	68.1	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-57.2	-33.7	179.8	-79.8	163.3	0	0	0	112.6	S491 K495 L496 L497 P753 M755 F833 I834	S491-L493 PolarHBondContact O-N 3.48Å; L493-K495 VanDerWaalsContact C-N 3.28Å; L493-K495 PolarHBondContact O-N 3.44Å; L493-L496 WeakPolarHBondContact O-CB 3.39Å; L493-L496 PolarHBondContact O-N 2.97Å; L493-L497 VanDerWaalsContact O-CG 3.31Å; L493-L497 WeakPolarHBondContact O-CG 3.18Å; L493-L497 PolarHBondContact O-N 3.09Å; L493-P753 WeakPolarHBondContact CB-O 3.46Å; L493-P753 HydrophobicContact CD1-CB 4.22Å; L493-P753 HydrophobicContact CD1-CG 4.34Å; L493-P753 WeakPolarHBondContact CG-O 3.43Å; L493-P753 PolarHBondContact N-O 2.77Å; L493-M755 HydrophobicContact CD2-CG 3.92Å; L493-M755 HydrophobicContact CD2-SD 3.82Å; L493-F833 HydrophobicContact CD1-CE2 4.45Å; L493-F833 HydrophobicContact CD1-CZ 4.05Å; L493-F833 HydrophobicContact CD2-CZ 4.12Å; L493-I834 HydrophobicContact CD1-CD1 3.27Å; L493-I834 HydrophobicContact CD1-CG1 4.33Å
494	S	70.1	Confident	64.2	Low	51 Å²	51	67.7 Å²	67.7	36%	0.357	34%	0.343	S	S	.	.	H	α-helix	trans	-56	-42	174.2	54.1	0	0	0	0	112.1	P492 L497 F498	P492-S494 PolarHBondContact O-N 3.14Å; S494-L497 PolarHBondContact O-N 3.19Å; S494-F498 WeakPolarHBondContact O-CD2 3.07Å; S494-F498 PolarHBondContact O-N 3.4Å
495	K	68	Low	62.3	Low	137 Å²	137	72.4 Å²	72.4	60%	0.596	37%	0.371	S	S	*	.	H	α-helix	trans	-69	-35.4	178.4	-67.5	-173.4	-179.7	179.9	0	112.9	P492 L493 L497 Q499	P492-K495 HydrophobicContact CB-CG 4.37Å; P492-K495 HydrophobicContact CG-CD 4.38Å; P492-K495 WeakPolarHBondContact O-CB 3.35Å; P492-K495 PolarHBondContact O-N 2.83Å; L493-K495 VanDerWaalsContact C-N 3.28Å; L493-K495 PolarHBondContact O-N 3.44Å; K495-L497 VanDerWaalsContact C-N 3.34Å; K495-Q499 PolarHBondContact O-N 2.96Å
496	L	64.5	Low	60.1	Low	27 Å²	27	74.3 Å²	74.3	14%	0.141	39%	0.39	C	S	.	.	H	α-helix	trans	-66.2	-36.7	174.2	-88	152.1	0	0	0	111.9	V488 S491 P492 L493	V488-L496 HydrophobicContact CG1-CD2 4.43Å; S491-L496 WeakPolarHBondContact OG-CD1 3.15Å; P492-L496 PolarHBondContact O-N 2.71Å; L493-L496 WeakPolarHBondContact O-CB 3.39Å; L493-L496 PolarHBondContact O-N 2.97Å
497	L	57.5	Low	57.9	Low	40 Å²	40	77.5 Å²	77.5	21%	0.209	41%	0.413	C	S	.	.	H	α-helix	trans	-71.5	-40.1	177.9	-70	163.2	0	0	0	112.6	L493 S494 K495 I500 T924 L932	L493-L497 VanDerWaalsContact O-CG 3.31Å; L493-L497 WeakPolarHBondContact O-CG 3.18Å; L493-L497 PolarHBondContact O-N 3.09Å; S494-L497 PolarHBondContact O-N 3.19Å; K495-L497 VanDerWaalsContact C-N 3.34Å; L497-I500 PolarHBondContact O-N 3.23Å; L497-T924 HydrophobicContact CD1-CG2 4.36Å; L497-T924 HydrophobicContact CD2-CG2 4.13Å; L497-L932 HydrophobicContact CD2-CB 4.46Å; L497-L932 HydrophobicContact CD2-CD1 4.26Å; L497-L932 HydrophobicContact CD2-CD2 3.49Å; L497-L932 VanDerWaalsContact CD2-CD2 3.49Å; L497-L932 HydrophobicContact CD2-CG 4.27Å
498	F	50.3	Low	55.9	Low	134 Å²	134	77.5 Å²	77.5	59%	0.588	42%	0.42	S	S	*	.	H	α-helix	trans	-69.3	-34.2	-178	-89.6	-75.2	0	0	0	114.1	S494 I500 N501	S494-F498 WeakPolarHBondContact O-CD2 3.07Å; S494-F498 PolarHBondContact O-N 3.4Å; F498-I500 PolarHBondContact O-N 3.38Å; F498-N501 PolarHBondContact O-N 3.21Å; F498-N501 VanDerWaalsContact O-N 3.15Å
499	Q	48.4	Very low	53.7	Low	134 Å²	134	87 Å²	87	63%	0.626	45%	0.453	S	S	*	.	H	α-helix	trans	-61.8	-17.9	179	-79.2	-177.6	-13.7	0	0	113.8	K495	K495-Q499 PolarHBondContact O-N 2.96Å
500	I	46.1	Very low	51.4	Low	19 Å²	19	95.6 Å²	95.6	10%	0.097	49%	0.494	C	S	.	.	H	α-helix	trans	-85.7	-32.3	-180	-59.3	169.9	0	0	0	111.2	L497 F498 T503 L929 L932 Q933	L497-I500 PolarHBondContact O-N 3.23Å; F498-I500 PolarHBondContact O-N 3.38Å; I500-T503 PolarHBondContact O-OG1 3.44Å; I500-L929 HydrophobicContact CD1-CD2 4.22Å; I500-L932 HydrophobicContact CD1-CB 3.44Å; I500-L932 VanDerWaalsContact CD1-CB 3.44Å; I500-L932 HydrophobicContact CD1-CD1 4.31Å; I500-L932 WeakPolarHBondContact CG2-O 3.3Å; I500-Q933 HydrophobicContact CG2-CB 4.28Å; I500-Q933 HydrophobicContact CG2-CG 3.68Å
501	N	38.8	Very low	48.7	Very low	84 Å²	84	97.2 Å²	97.2	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-83.9	-23.5	-173.2	-73.9	-21.5	0	0	0	114.8	F498 T503	F498-N501 PolarHBondContact O-N 3.21Å; F498-N501 VanDerWaalsContact O-N 3.15Å; N501-T503 VanDerWaalsContact C-N 3.3Å; N501-T503 PolarHBondContact O-N 3.04Å
502	E	40.4	Very low	46.6	Very low	153 Å²	153	100.6 Å²	100.6	72%	0.715	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-80.2	-3.9	-175.4	-72.7	-172.3	164.5	0	0	114.6
503	T	41.8	Very low	44.7	Very low	73 Å²	73	102.4 Å²	102.4	45%	0.448	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-88	0.7	-173	51.7	0	0	0	0	115.8	I500 N501 M511	I500-T503 PolarHBondContact O-OG1 3.44Å; N501-T503 VanDerWaalsContact C-N 3.3Å; N501-T503 PolarHBondContact O-N 3.04Å; T503-M511 HydrophobicContact CG2-SD 4.36Å
504	E	40.3	Very low	43.1	Very low	117 Å²	117	104.8 Å²	104.8	55%	0.547	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-89.6	-8.4	-174.9	-73.6	-166.6	152.7	0	0	116.4	Q936	E504-Q936 PolarHBondContact OE1-NE2 3.43Å
505	T	38	Very low	42	Very low	129 Å²	129	103.2 Å²	103.2	79%	0.791	54%	0.54	S	S	*	.	S	Bend	trans	-121.5	-0.9	-170.9	46	0	0	0	0	119.2
506	T	31.3	Very low	40.9	Very low	113 Å²	113	106.7 Å²	106.7	69%	0.693	55%	0.549	S	S	*	.	S	Bend	trans	-151.1	107	174.2	49.9	0	0	0	0	112.7
507	T	33.4	Very low	40.4	Very low	120 Å²	120	106.5 Å²	106.5	74%	0.736	55%	0.55	S	S	*	*			trans	52.1	142.2	167.4	54	0	0	0	0	117.3	R509	T507-R509 PolarHBondContact O-N 3Å
508	P	31.8	Very low	40.4	Very low	138 Å²	138	112.8 Å²	112.8	90%	0.896	58%	0.576	S	S	*	*			trans	-74.7	71.6	177.8	33.1	-33.2	0	0	0	109	E510	P508-E510 PolarHBondContact O-N 3.41Å
509	R	29.5	Very low	41.2	Very low	222 Å²	222	108.1 Å²	108.1	84%	0.838	56%	0.557	S	S	*	*			trans	-85.4	107.2	166.9	-149.6	176.3	-167.6	178.1	3.2	105.1	T507 M511	T507-R509 PolarHBondContact O-N 3Å; R509-M511 PolarHBondContact O-N 3.4Å; R509-M511 VanDerWaalsContact O-N 3.12Å
510	E	29.4	Very low	42.5	Very low	181 Å²	181	102.5 Å²	102.5	85%	0.846	53%	0.532	S	S	*	.			trans	-4.5	101.7	172.7	-67.3	177	154.6	0	0	112.7	P508 P512	P508-E510 PolarHBondContact O-N 3.41Å; E510-P512 WeakPolarHBondContact O-CD 3.2Å
511	M	28.1	Very low	44.1	Very low	98 Å²	98	106.7 Å²	106.7	48%	0.483	55%	0.547	S	S	.	.			trans	-36.9	120.4	161.4	-97.2	-85.8	-148	0	0	107.1	T503 R509 S513	T503-M511 HydrophobicContact CG2-SD 4.36Å; R509-M511 PolarHBondContact O-N 3.4Å; R509-M511 VanDerWaalsContact O-N 3.12Å; M511-S513 PolarHBondContact O-N 3.22Å
512	P	35.5	Very low	46.1	Very low	99 Å²	99	103.1 Å²	103.1	64%	0.643	53%	0.528	S	S	*	.			trans	-66.5	88.6	168.3	26	-28.7	0	0	0	105.1	E510 P514	E510-P512 WeakPolarHBondContact O-CD 3.2Å; P512-P514 WeakPolarHBondContact O-CA 3.04Å; P512-P514 WeakPolarHBondContact O-CD 3.45Å; P512-P514 WeakPolarHBondContact O-CG 3.04Å
513	S	38.8	Very low	48.2	Very low	67 Å²	67	96.3 Å²	96.3	47%	0.469	50%	0.496	S	S	.	.			trans	-43.3	97.1	-177.7	141.4	0	0	0	0	108.3	M511 V515 R516	M511-S513 PolarHBondContact O-N 3.22Å; S513-V515 PolarHBondContact O-N 2.86Å; S513-R516 WeakPolarHBondContact OG-CB 3.23Å; S513-R516 PolarHBondContact OG-N 2.83Å
514	P	42.6	Very low	50.3	Low	64 Å²	64	93.4 Å²	93.4	42%	0.416	48%	0.477	S	S	.	.	S	Bend	trans	-72.4	-27	-160.1	-16.5	28.1	0	0	0	110.7	P512	P512-P514 WeakPolarHBondContact O-CA 3.04Å; P512-P514 WeakPolarHBondContact O-CD 3.45Å; P512-P514 WeakPolarHBondContact O-CG 3.04Å
515	V	48.3	Very low	52.5	Low	19 Å²	19	88 Å²	88	12%	0.115	45%	0.452	C	S	.	.	S	Bend	trans	-144.1	26	-173.3	-160.4	0	0	0	0	114.2	S513 S517 L929	S513-V515 PolarHBondContact O-N 2.86Å; V515-S517 VanDerWaalsContact C-N 3.28Å; V515-S517 PolarHBondContact O-N 3.32Å; V515-L929 HydrophobicContact CB-CD1 3.84Å; V515-L929 HydrophobicContact CG2-CD1 3.47Å; V515-L929 VanDerWaalsContact CG2-CD1 3.47Å
516	R	45.1	Very low	54.9	Low	210 Å²	210	81.9 Å²	81.9	79%	0.792	41%	0.414	S	S	*	.			trans	-73.2	92.2	158.1	-79.5	-173.5	173.3	-178.1	-1.4	108.7	S513 K518	S513-R516 WeakPolarHBondContact OG-CB 3.23Å; S513-R516 PolarHBondContact OG-N 2.83Å; R516-K518 PolarHBondContact O-N 3.48Å
517	S	52.8	Low	57.6	Low	22 Å²	22	76.6 Å²	76.6	15%	0.154	38%	0.381	C	S	.	.			trans	-60.7	136	167.7	79.8	0	0	0	0	108.1	V515 L519 R524	V515-S517 VanDerWaalsContact C-N 3.28Å; V515-S517 PolarHBondContact O-N 3.32Å; S517-L519 PolarHBondContact O-N 3.36Å; S517-L519 PolarHBondContact OG-O 2.78Å; S517-R524 PolarHBondContact OG-NE 2.92Å; S517-R524 VanDerWaalsContact OG-NE 3.08Å; S517-R524 PolarHBondContact OG-NH2 3.42Å
518	K	57.6	Low	60.4	Low	172 Å²	172	70.9 Å²	70.9	75%	0.748	35%	0.346	S	S	*	.	S	Bend	trans	-61	-8	173	-66.3	-174.6	178.2	-175.4	0	113.3	R516	R516-K518 PolarHBondContact O-N 3.48Å
519	L	66.6	Low	63.2	Low	36 Å²	36	65.7 Å²	65.7	19%	0.188	31%	0.309	C	S	.	.	S	Bend	trans	-92	139.5	-178.7	-58.3	167.1	0	0	0	109.6	P394 S517 W523 R524	P394-L519 HydrophobicContact CG-CD2 3.36Å; S517-L519 PolarHBondContact O-N 3.36Å; S517-L519 PolarHBondContact OG-O 2.78Å; L519-W523 HydrophobicContact CB-CE3 4.34Å; L519-W523 HydrophobicContact CD1-CE3 4.32Å; L519-W523 HydrophobicContact CD1-CH2 4.18Å; L519-W523 HydrophobicContact CD1-CZ3 3.76Å; L519-W523 HydrophobicContact CD2-CH2 4.46Å; L519-W523 HydrophobicContact CD2-CZ3 4.45Å; L519-W523 HydrophobicContact CG-CZ3 4.49Å; L519-R524 HydrophobicContact CB-CG 4.33Å
520	S	76.5	Confident	66.1	Low	16 Å²	16	55.1 Å²	55.1	11%	0.112	27%	0.269	C	S	.	.			trans	-61.1	147.4	176.2	79.4	0	0	0	0	111.3	T522 W523 R524	S520-T522 VanDerWaalsContact C-N 3.28Å; S520-T522 PolarHBondContact O-N 2.96Å; S520-T522 PolarHBondContact OG-OG1 3.14Å; S520-W523 PolarHBondContact O-N 3.04Å; S520-W523 WeakPolarHBondContact OG-CB 3.38Å; S520-W523 PolarHBondContact OG-N 3.45Å; S520-W523 VanDerWaalsContact OG-N 3.14Å; S520-R524 PolarHBondContact O-N 3.49Å
521	W	80.3	Confident	69	Low	107 Å²	107	46.7 Å²	46.7	41%	0.405	23%	0.229	S	C	.	.	H	α-helix	trans	-65	-34	176.8	69.6	-94.9	0	0	0	111.5	W523 R524 E525 N715	W521-W523 VanDerWaalsContact C-N 3.34Å; W521-W523 PolarHBondContact O-N 2.93Å; W521-R524 PolarHBondContact O-N 3.4Å; W521-E525 HydrophobicContact CE3-CB 4.44Å; W521-E525 WeakPolarHBondContact CZ3-OE2 3.02Å; W521-E525 WeakPolarHBondContact O-CB 3.4Å; W521-E525 PolarHBondContact O-N 3.19Å; W521-N715 HydrophobicContact CB-CB 4.46Å; W521-N715 VanDerWaalsContact CD2-ND2 3.34Å
522	T	80.9	Confident	72.1	Confident	10 Å²	10	43.3 Å²	43.3	6%	0.061	21%	0.212	C	C	.	.	H	α-helix	trans	-63.1	-40	177.2	57.5	0	0	0	0	112.1	G443 S520 E525 G526	G443-T522 WeakPolarHBondContact O-CB 3.33Å; G443-T522 PolarHBondContact O-OG1 3.27Å; S520-T522 VanDerWaalsContact C-N 3.28Å; S520-T522 PolarHBondContact O-N 2.96Å; S520-T522 PolarHBondContact OG-OG1 3.14Å; T522-E525 PolarHBondContact O-N 2.93Å; T522-G526 PolarHBondContact O-N 2.98Å; T522-G526 VanDerWaalsContact O-N 3.08Å
523	W	84.5	Confident	74.6	Confident	10 Å²	10	39.9 Å²	39.9	4%	0.038	19%	0.187	C	C	.	.	H	α-helix	trans	-63.3	-42.9	175.6	-176.1	99.5	0	0	0	112	F397 W482 L519 S520 W521 R527	F397-W523 HydrophobicContact CE2-CB 4.14Å; F397-W523 AromaticContact CE2-CD1 3.9Å; F397-W523 HydrophobicContact CE2-CG 4.41Å; W482-W523 HydrophobicContact CB-CH2 3.89Å; W482-W523 HydrophobicContact CB-CZ3 4.22Å; W482-W523 HydrophobicContact CD2-CH2 4.11Å; W482-W523 AromaticContact CD2-CZ3 3.55Å; W482-W523 HydrophobicContact CD2-CZ3 3.55Å; W482-W523 HydrophobicContact CE3-CH2 4.24Å; W482-W523 AromaticContact CE3-CZ3 3.71Å; W482-W523 HydrophobicContact CE3-CZ3 3.71Å; W482-W523 AromaticContact CG-CH2 3.98Å; W482-W523 HydrophobicContact CG-CH2 3.98Å; W482-W523 AromaticContact CG-CZ3 3.8Å; W482-W523 HydrophobicContact CG-CZ3 3.8Å; W482-W523 HydrophobicContact CZ3-CZ3 4.31Å; L519-W523 HydrophobicContact CB-CE3 4.34Å; L519-W523 HydrophobicContact CD1-CE3 4.32Å; L519-W523 HydrophobicContact CD1-CH2 4.18Å; L519-W523 HydrophobicContact CD1-CZ3 3.76Å; L519-W523 HydrophobicContact CD2-CH2 4.46Å; L519-W523 HydrophobicContact CD2-CZ3 4.45Å; L519-W523 HydrophobicContact CG-CZ3 4.49Å; S520-W523 PolarHBondContact O-N 3.04Å; S520-W523 WeakPolarHBondContact OG-CB 3.38Å; S520-W523 PolarHBondContact OG-N 3.45Å; S520-W523 VanDerWaalsContact OG-N 3.14Å; W521-W523 VanDerWaalsContact C-N 3.34Å; W521-W523 PolarHBondContact O-N 2.93Å; W523-R527 VanDerWaalsContact CH2-NH1 3.27Å; W523-R527 WeakPolarHBondContact O-CG 2.95Å; W523-R527 PolarHBondContact O-N 3.19Å
524	R	85.9	Confident	77.1	Confident	11 Å²	11	36.7 Å²	36.7	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-68.4	-41.5	176.5	-66.6	-174.1	-73.2	152	2.3	111.3	W482 S517 L519 S520 W521 R527 M528 D713 L718	W482-R524 HydrophobicContact CH2-CB 3.64Å; W482-R524 HydrophobicContact CH2-CG 3.9Å; W482-R524 WeakPolarHBondContact CH2-O 3.08Å; W482-R524 HydrophobicContact CZ2-CB 3.65Å; W482-R524 HydrophobicContact CZ2-CG 3.45Å; W482-R524 VanDerWaalsContact CZ2-CG 3.45Å; S517-R524 PolarHBondContact OG-NE 2.92Å; S517-R524 VanDerWaalsContact OG-NE 3.08Å; S517-R524 PolarHBondContact OG-NH2 3.42Å; L519-R524 HydrophobicContact CB-CG 4.33Å; S520-R524 PolarHBondContact O-N 3.49Å; W521-R524 PolarHBondContact O-N 3.4Å; R524-R527 PolarHBondContact O-N 2.65Å; R524-M528 WeakPolarHBondContact O-CB 3.18Å; R524-M528 WeakPolarHBondContact O-CG 3.4Å; R524-M528 PolarHBondContact O-N 2.87Å; R524-D713 IonicContact CZ-OD2 3.16Å; R524-D713 IonicContact NH1-OD2 3.49Å; R524-D713 PolarHBondContact NH1-OD2 3.43Å; R524-D713 IonicContact NH2-OD1 2.79Å; R524-D713 IonicContact NH2-OD2 2.77Å; R524-D713 PolarHBondContact NH2-OD2 3.32Å; R524-L718 HydrophobicContact CB-CD1 3.84Å; R524-L718 HydrophobicContact CB-CD2 4.05Å
525	E	86.2	Confident	79.3	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.019	15%	0.146	C	C	.	.	H	α-helix	trans	-62.8	-51.1	-177.7	-169.2	-156.7	178	0	0	111.5	R450 W521 T522 R527 M528 R529 L718	R450-E525 IonicContact CZ-OE2 2.84Å; R450-E525 IonicContact NE-OE2 2.68Å; R450-E525 PolarHBondContact NE-OE2 3.44Å; R450-E525 IonicContact NH2-OE2 2.93Å; R450-E525 PolarHBondContact NH2-OE2 3.34Å; W521-E525 HydrophobicContact CE3-CB 4.44Å; W521-E525 WeakPolarHBondContact CZ3-OE2 3.02Å; W521-E525 WeakPolarHBondContact O-CB 3.4Å; W521-E525 PolarHBondContact O-N 3.19Å; T522-E525 PolarHBondContact O-N 2.93Å; E525-R527 VanDerWaalsContact C-N 3.32Å; E525-R527 PolarHBondContact O-N 2.87Å; E525-M528 WeakPolarHBondContact O-CB 3.47Å; E525-M528 PolarHBondContact O-N 2.99Å; E525-R529 WeakPolarHBondContact O-CG 3.31Å; E525-R529 PolarHBondContact O-N 3.47Å; E525-R529 IonicContact OE1-CZ 3.46Å; E525-R529 IonicContact OE1-NE 3.66Å; E525-R529 PolarHBondContact OE1-NE 3.35Å; E525-R529 IonicContact OE1-NH2 2.82Å; E525-R529 PolarHBondContact OE1-NH2 3.4Å; E525-L718 HydrophobicContact CB-CD1 4.2Å
526	G	87.1	Confident	81.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-35.5	-178.3	0	0	0	0	0	113.5	L442 T522 R529 M530	L442-G526 WeakPolarHBondContact O-CA 2.89Å; T522-G526 PolarHBondContact O-N 2.98Å; T522-G526 VanDerWaalsContact O-N 3.08Å; G526-R529 PolarHBondContact O-N 3.27Å; G526-M530 PolarHBondContact O-N 3.19Å; G526-M530 VanDerWaalsContact O-N 3.09Å
527	R	89.9	Confident	83.2	Confident	2 Å²	2	27 Å²	27	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-69.6	-40	173	-71.5	-177.3	175	-154.3	9.5	112.1	V438 L442 I478 E480 W482 W523 R524 E525 R529 M530 Y531	V438-R527 VanDerWaalsContact CG1-NH2 3.28Å; V438-R527 PolarHBondContact O-NE 2.91Å; V438-R527 PolarHBondContact O-NH2 3.32Å; L442-R527 HydrophobicContact CD1-CG 4.35Å; I478-R527 HydrophobicContact CG2-CB 3.92Å; I478-R527 HydrophobicContact CG2-CG 4.03Å; I478-R527 PolarHBondContact O-NH1 3.41Å; E480-R527 PolarHBondContact O-NH1 3.2Å; W482-R527 HydrophobicContact CE3-CB 4.18Å; W482-R527 HydrophobicContact CZ3-CB 3.57Å; W523-R527 VanDerWaalsContact CH2-NH1 3.27Å; W523-R527 WeakPolarHBondContact O-CG 2.95Å; W523-R527 PolarHBondContact O-N 3.19Å; R524-R527 PolarHBondContact O-N 2.65Å; E525-R527 VanDerWaalsContact C-N 3.32Å; E525-R527 PolarHBondContact O-N 2.87Å; R527-R529 VanDerWaalsContact C-N 3.32Å; R527-R529 PolarHBondContact O-N 3.49Å; R527-M530 PolarHBondContact O-N 2.8Å; R527-Y531 VanDerWaalsContact O-CD2 3.27Å; R527-Y531 WeakPolarHBondContact O-CD2 3.46Å; R527-Y531 PolarHBondContact O-N 3.36Å; R527-Y531 VanDerWaalsContact O-N 3.14Å
528	M	90.6	Very high	84.9	Confident	0 Å²	0	26 Å²	26	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.3	-43.3	171.3	-85.1	-63.5	161.1	0	0	112	W482 R524 E525 M530 Y531 Y532 L706 A707 C710 L718 T725	W482-M528 HydrophobicContact CH2-CE 3.82Å; W482-M528 HydrophobicContact CH2-CG 3.97Å; W482-M528 HydrophobicContact CZ2-CE 4.31Å; W482-M528 HydrophobicContact CZ3-CE 4.33Å; R524-M528 WeakPolarHBondContact O-CB 3.18Å; R524-M528 WeakPolarHBondContact O-CG 3.4Å; R524-M528 PolarHBondContact O-N 2.87Å; E525-M528 WeakPolarHBondContact O-CB 3.47Å; E525-M528 PolarHBondContact O-N 2.99Å; M528-M530 VanDerWaalsContact C-N 3.28Å; M528-M530 PolarHBondContact O-N 2.72Å; M528-Y531 PolarHBondContact O-N 3.31Å; M528-Y531 VanDerWaalsContact O-N 3.14Å; M528-Y531 HydrophobicContact SD-CD2 4.12Å; M528-Y532 PolarHBondContact O-N 3.15Å; M528-L706 HydrophobicContact CE-CB 3.52Å; M528-L706 WeakPolarHBondContact CE-O 3.43Å; M528-A707 VanDerWaalsContact CE-CA 3.45Å; M528-A707 HydrophobicContact CE-CB 4.05Å; M528-A707 VanDerWaalsContact CE-N 3.27Å; M528-A707 HydrophobicContact SD-CB 4Å; M528-C710 HydrophobicContact CE-CB 4.42Å; M528-L718 HydrophobicContact CG-CD1 4.2Å; M528-T725 PolarHBondContact O-OG1 3.06Å; M528-T725 HydrophobicContact SD-CG2 3.93Å
529	R	90.4	Very high	86.2	Confident	30 Å²	30	17.9 Å²	17.9	11%	0.113	8%	0.079	C	C	.	.	H	α-helix	trans	-57.1	-44.1	175.2	-73.8	172.6	176	-126.4	-7	112.3	N451 E525 G526 R527 Y531 Y532 L533	N451-R529 PolarHBondContact OD1-NH1 2.92Å; E525-R529 WeakPolarHBondContact O-CG 3.31Å; E525-R529 PolarHBondContact O-N 3.47Å; E525-R529 IonicContact OE1-CZ 3.46Å; E525-R529 IonicContact OE1-NE 3.66Å; E525-R529 PolarHBondContact OE1-NE 3.35Å; E525-R529 IonicContact OE1-NH2 2.82Å; E525-R529 PolarHBondContact OE1-NH2 3.4Å; G526-R529 PolarHBondContact O-N 3.27Å; R527-R529 VanDerWaalsContact C-N 3.32Å; R527-R529 PolarHBondContact O-N 3.49Å; R529-Y531 VanDerWaalsContact C-N 3.32Å; R529-Y531 PolarHBondContact O-N 3.38Å; R529-Y532 HydrophobicContact CB-CE1 3.91Å; R529-Y532 HydrophobicContact CG-CE1 3.8Å; R529-Y532 WeakPolarHBondContact O-CD1 3.48Å; R529-Y532 PolarHBondContact O-N 2.73Å; R529-L533 WeakPolarHBondContact O-CB 3.3Å; R529-L533 VanDerWaalsContact O-CG 3.31Å; R529-L533 WeakPolarHBondContact O-CG 3.42Å; R529-L533 PolarHBondContact O-N 2.95Å; R529-L533 VanDerWaalsContact O-N 3.1Å
530	M	91.5	Very high	87.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63	-36.6	177.5	-77.9	-50.8	-52.6	0	0	113.7	L442 C454 Y457 L458 I478 G526 R527 M528 L533 V534	L442-M530 HydrophobicContact CD1-CG 3.82Å; L442-M530 HydrophobicContact CD2-CG 3.57Å; L442-M530 HydrophobicContact CD2-SD 4.34Å; L442-M530 HydrophobicContact CG-CG 4.39Å; C454-M530 WeakPolarHBondContact CA-SD 3.38Å; C454-M530 HydrophobicContact CB-CG 4.32Å; C454-M530 HydrophobicContact CB-SD 3.35Å; C454-M530 WeakPolarHBondContact CB-SD 3.16Å; Y457-M530 HydrophobicContact CD1-CE 3.5Å; Y457-M530 VanDerWaalsContact CD1-CE 3.5Å; Y457-M530 HydrophobicContact CE1-CE 4.45Å; Y457-M530 HydrophobicContact CG-CE 4.05Å; L458-M530 HydrophobicContact CB-CE 4.15Å; I478-M530 HydrophobicContact CD1-CB 4.13Å; G526-M530 PolarHBondContact O-N 3.19Å; G526-M530 VanDerWaalsContact O-N 3.09Å; R527-M530 PolarHBondContact O-N 2.8Å; M528-M530 VanDerWaalsContact C-N 3.28Å; M528-M530 PolarHBondContact O-N 2.72Å; M530-L533 PolarHBondContact O-N 3.24Å; M530-L533 HydrophobicContact SD-CD1 4.21Å; M530-V534 HydrophobicContact CE-CG2 3.9Å; M530-V534 VanDerWaalsContact O-CB 3.3Å; M530-V534 WeakPolarHBondContact O-CB 3.36Å; M530-V534 VanDerWaalsContact O-CG2 3.25Å; M530-V534 WeakPolarHBondContact O-CG2 3.48Å; M530-V534 PolarHBondContact O-N 2.77Å
531	Y	90.7	Very high	87.4	Confident	3 Å²	3	24.5 Å²	24.5	1%	0.012	10%	0.101	C	C	.	.	H	α-helix	trans	-62.4	-48.9	177.2	-69.3	-50.2	0	0	0	112.7	I478 L479 W482 R527 M528 R529 L533 V534 A535 I703	I478-Y531 HydrophobicContact CB-CE1 3.74Å; I478-Y531 HydrophobicContact CD1-CE1 4.31Å; I478-Y531 HydrophobicContact CG2-CD1 4.29Å; I478-Y531 HydrophobicContact CG2-CE1 3.57Å; I478-Y531 HydrophobicContact CG2-CE2 3.99Å; I478-Y531 WeakPolarHBondContact CG2-OH 3.21Å; I478-Y531 PolarHBondContact O-OH 3.13Å; L479-Y531 VanDerWaalsContact CA-OH 3.3Å; L479-Y531 WeakPolarHBondContact CA-OH 3.36Å; L479-Y531 HydrophobicContact CD2-CE1 4.42Å; L479-Y531 WeakPolarHBondContact CD2-OH 3.27Å; L479-Y531 HydrophobicContact CG-CE1 4.3Å; L479-Y531 WeakPolarHBondContact CG-OH 3.26Å; L479-Y531 PolarHBondContact N-OH 3.35Å; L479-Y531 VanDerWaalsContact N-OH 3.11Å; W482-Y531 HydrophobicContact CZ3-CE2 4.28Å; R527-Y531 VanDerWaalsContact O-CD2 3.27Å; R527-Y531 WeakPolarHBondContact O-CD2 3.46Å; R527-Y531 PolarHBondContact O-N 3.36Å; R527-Y531 VanDerWaalsContact O-N 3.14Å; M528-Y531 PolarHBondContact O-N 3.31Å; M528-Y531 VanDerWaalsContact O-N 3.14Å; M528-Y531 HydrophobicContact SD-CD2 4.12Å; R529-Y531 VanDerWaalsContact C-N 3.32Å; R529-Y531 PolarHBondContact O-N 3.38Å; Y531-L533 VanDerWaalsContact C-N 3.35Å; Y531-L533 PolarHBondContact O-N 3.24Å; Y531-V534 PolarHBondContact O-N 3.24Å; Y531-A535 VanDerWaalsContact O-CB 3.28Å; Y531-A535 WeakPolarHBondContact O-CB 3.14Å; Y531-A535 PolarHBondContact O-N 3.21Å; Y531-I703 HydrophobicContact CD1-CD1 3.52Å; Y531-I703 HydrophobicContact CD1-CG1 3.72Å; Y531-I703 HydrophobicContact CD1-CG2 3.95Å; Y531-I703 HydrophobicContact CD2-CG1 4.47Å; Y531-I703 HydrophobicContact CD2-CG2 3.83Å; Y531-I703 HydrophobicContact CE1-CD1 3.61Å; Y531-I703 HydrophobicContact CE1-CG1 3.57Å; Y531-I703 HydrophobicContact CE2-CG1 4.35Å; Y531-I703 HydrophobicContact CE2-CG2 4.4Å; Y531-I703 HydrophobicContact CG-CD1 4.31Å; Y531-I703 HydrophobicContact CG-CG1 4.2Å; Y531-I703 HydrophobicContact CG-CG2 3.6Å
532	Y	91.5	Very high	87.5	Confident	28 Å²	28	19.9 Å²	19.9	11%	0.11	8%	0.084	C	C	.	.	H	α-helix	trans	-68.2	-36.1	-179.7	81.8	-113.6	0	0	0	111.9	M528 R529 A535 R536 K724	M528-Y532 PolarHBondContact O-N 3.15Å; R529-Y532 HydrophobicContact CB-CE1 3.91Å; R529-Y532 HydrophobicContact CG-CE1 3.8Å; R529-Y532 WeakPolarHBondContact O-CD1 3.48Å; R529-Y532 PolarHBondContact O-N 2.73Å; Y532-A535 PolarHBondContact O-N 3.3Å; Y532-R536 WeakPolarHBondContact O-CB 2.93Å; Y532-R536 PolarHBondContact O-N 3.04Å; Y532-K724 HydrophobicContact CD1-CB 3.97Å; Y532-K724 HydrophobicContact CE1-CB 4.31Å; Y532-K724 HydrophobicContact CE1-CD 4.4Å; Y532-K724 HydrophobicContact CG-CB 4.16Å
533	L	89.5	Confident	87.4	Confident	26 Å²	26	20.9 Å²	20.9	14%	0.136	9%	0.089	C	C	.	.	H	α-helix	trans	-64.9	-42.7	176.2	-74	174.9	0	0	0	112.5	C454 L458 R529 M530 Y531 S537	C454-L533 HydrophobicContact CB-CD1 3.94Å; L458-L533 HydrophobicContact CD2-CB 4.27Å; R529-L533 WeakPolarHBondContact O-CB 3.3Å; R529-L533 VanDerWaalsContact O-CG 3.31Å; R529-L533 WeakPolarHBondContact O-CG 3.42Å; R529-L533 PolarHBondContact O-N 2.95Å; R529-L533 VanDerWaalsContact O-N 3.1Å; M530-L533 PolarHBondContact O-N 3.24Å; M530-L533 HydrophobicContact SD-CD1 4.21Å; Y531-L533 VanDerWaalsContact C-N 3.35Å; Y531-L533 PolarHBondContact O-N 3.24Å; L533-S537 WeakPolarHBondContact O-CB 3.5Å; L533-S537 PolarHBondContact O-N 3.4Å; L533-S537 PolarHBondContact O-OG 3.41Å
534	V	90.6	Very high	87.1	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-65.5	-47.8	175.6	165	0	0	0	0	110.3	L458 F461 L475 M530 Y531 R536 S537 L538	L458-V534 HydrophobicContact CD1-CG2 4.11Å; F461-V534 HydrophobicContact CD1-CG1 4.23Å; F461-V534 HydrophobicContact CD1-CG2 4.35Å; F461-V534 HydrophobicContact CD2-CG1 4.18Å; F461-V534 HydrophobicContact CD2-CG2 4.07Å; F461-V534 HydrophobicContact CE1-CG1 3.67Å; F461-V534 HydrophobicContact CE2-CG1 3.59Å; F461-V534 HydrophobicContact CE2-CG2 4.31Å; F461-V534 HydrophobicContact CG-CG1 4.46Å; F461-V534 HydrophobicContact CG-CG2 4.09Å; F461-V534 HydrophobicContact CZ-CG1 3.3Å; L475-V534 HydrophobicContact CD1-CG1 3.73Å; M530-V534 HydrophobicContact CE-CG2 3.9Å; M530-V534 VanDerWaalsContact O-CB 3.3Å; M530-V534 WeakPolarHBondContact O-CB 3.36Å; M530-V534 VanDerWaalsContact O-CG2 3.25Å; M530-V534 WeakPolarHBondContact O-CG2 3.48Å; M530-V534 PolarHBondContact O-N 2.77Å; Y531-V534 PolarHBondContact O-N 3.24Å; V534-R536 PolarHBondContact O-N 3.39Å; V534-S537 PolarHBondContact O-N 3.32Å; V534-S537 VanDerWaalsContact O-N 3.14Å; V534-L538 HydrophobicContact CG1-CD1 4.06Å; V534-L538 HydrophobicContact CG1-CG 4.42Å; V534-L538 PolarHBondContact O-N 2.94Å
535	A	88.6	Confident	86.6	Confident	2 Å²	2	25.1 Å²	25.1	2%	0.017	11%	0.111	C	C	.	.	H	α-helix	trans	-59.5	-47.1	180	0	0	0	0	0	111.8	Y531 Y532 S537 L538 V539 D728 V729 L732	Y531-A535 VanDerWaalsContact O-CB 3.28Å; Y531-A535 WeakPolarHBondContact O-CB 3.14Å; Y531-A535 PolarHBondContact O-N 3.21Å; Y532-A535 PolarHBondContact O-N 3.3Å; A535-S537 VanDerWaalsContact C-N 3.3Å; A535-S537 PolarHBondContact O-N 2.9Å; A535-L538 PolarHBondContact O-N 2.67Å; A535-V539 WeakPolarHBondContact O-CG2 3.47Å; A535-V539 PolarHBondContact O-N 3.1Å; A535-D728 HydrophobicContact CB-CB 4.13Å; A535-V729 HydrophobicContact CB-CG2 3.99Å; A535-L732 HydrophobicContact CB-CB 4.1Å; A535-L732 HydrophobicContact CB-CD2 3.95Å
536	R	89.5	Confident	85.8	Confident	75 Å²	75	25.5 Å²	25.5	28%	0.283	11%	0.114	S	C	.	.	H	α-helix	trans	-59.4	-40.2	175.3	-171.6	177.7	-64.4	171.8	0.4	112.5	Y532 V534 R540 D728	Y532-R536 WeakPolarHBondContact O-CB 2.93Å; Y532-R536 PolarHBondContact O-N 3.04Å; V534-R536 PolarHBondContact O-N 3.39Å; R536-R540 WeakPolarHBondContact O-CB 3.21Å; R536-R540 VanDerWaalsContact O-CG 3.3Å; R536-R540 WeakPolarHBondContact O-CG 3.28Å; R536-R540 PolarHBondContact O-N 3.19Å; R536-D728 IonicContact CZ-OD1 3.28Å; R536-D728 IonicContact CZ-OD2 2.7Å; R536-D728 IonicContact NE-OD1 3.19Å; R536-D728 PolarHBondContact NE-OD1 2.95Å; R536-D728 IonicContact NE-OD2 3.01Å; R536-D728 PolarHBondContact NE-OD2 3.23Å; R536-D728 IonicContact NH2-OD1 3.05Å; R536-D728 IonicContact NH2-OD2 3.12Å; R536-D728 PolarHBondContact NH2-OD2 3.21Å
537	S	86.8	Confident	84.9	Confident	11 Å²	11	28.3 Å²	28.3	8%	0.077	13%	0.126	C	C	.	.	H	α-helix	trans	-71.5	-39.3	-179.6	-59.9	0	0	0	0	112.4	L533 V534 A535 R540 L541	L533-S537 WeakPolarHBondContact O-CB 3.5Å; L533-S537 PolarHBondContact O-N 3.4Å; L533-S537 PolarHBondContact O-OG 3.41Å; V534-S537 PolarHBondContact O-N 3.32Å; V534-S537 VanDerWaalsContact O-N 3.14Å; A535-S537 VanDerWaalsContact C-N 3.3Å; A535-S537 PolarHBondContact O-N 2.9Å; S537-R540 PolarHBondContact O-N 3.42Å; S537-L541 WeakPolarHBondContact O-CB 3.06Å; S537-L541 WeakPolarHBondContact O-CD1 3.4Å; S537-L541 WeakPolarHBondContact O-CG 2.98Å; S537-L541 PolarHBondContact O-N 3.3Å
538	L	87.9	Confident	83.7	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-45.9	174.4	-78.2	174.8	0	0	0	112	F461 V534 A535 R540 L541 H542 V645 L646 M696 L732	F461-L538 HydrophobicContact CE1-CD1 4.3Å; F461-L538 HydrophobicContact CE1-CD2 3.74Å; F461-L538 HydrophobicContact CE1-CG 3.81Å; F461-L538 HydrophobicContact CZ-CD1 3.98Å; F461-L538 HydrophobicContact CZ-CD2 4Å; F461-L538 HydrophobicContact CZ-CG 4.01Å; V534-L538 HydrophobicContact CG1-CD1 4.06Å; V534-L538 HydrophobicContact CG1-CG 4.42Å; V534-L538 PolarHBondContact O-N 2.94Å; A535-L538 PolarHBondContact O-N 2.67Å; L538-R540 VanDerWaalsContact C-N 3.34Å; L538-R540 PolarHBondContact O-N 3.26Å; L538-L541 PolarHBondContact O-N 2.78Å; L538-H542 WeakPolarHBondContact O-CB 3.07Å; L538-H542 PolarHBondContact O-N 2.95Å; L538-V645 HydrophobicContact CD2-CG1 4.18Å; L538-L646 HydrophobicContact CB-CD2 4.29Å; L538-L646 HydrophobicContact CD2-CD2 4.49Å; L538-M696 HydrophobicContact CD1-CE 4.18Å; L538-L732 HydrophobicContact CB-CD1 3.98Å; L538-L732 HydrophobicContact CD1-CD1 4.31Å; L538-L732 HydrophobicContact CD1-CD2 3.88Å
539	V	85.8	Confident	81.8	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.018	15%	0.153	C	C	.	.	H	α-helix	trans	-62.9	-42.2	176.2	175.3	0	0	0	0	110.7	A535 H542 L543 R731 L732	A535-V539 WeakPolarHBondContact O-CG2 3.47Å; A535-V539 PolarHBondContact O-N 3.1Å; V539-H542 WeakPolarHBondContact O-CB 3.47Å; V539-H542 PolarHBondContact O-N 3.17Å; V539-L543 HydrophobicContact CG1-CD1 3.87Å; V539-L543 HydrophobicContact CG1-CG 4.28Å; V539-L543 WeakPolarHBondContact O-CG 2.96Å; V539-L543 PolarHBondContact O-N 3.19Å; V539-R731 HydrophobicContact CG1-CG 4.33Å; V539-R731 HydrophobicContact CG2-CG 4.41Å; V539-L732 HydrophobicContact CG2-CB 4.01Å; V539-L732 HydrophobicContact CG2-CD1 3.97Å
540	R	84.2	Confident	79.8	Confident	147 Å²	147	34.3 Å²	34.3	56%	0.555	16%	0.159	S	C	*	.	H	α-helix	trans	-62	-43.9	175.8	-78.3	176.5	179.3	171.7	-1.6	112.7	R536 S537 L538 H542 L543 K544	R536-R540 WeakPolarHBondContact O-CB 3.21Å; R536-R540 VanDerWaalsContact O-CG 3.3Å; R536-R540 WeakPolarHBondContact O-CG 3.28Å; R536-R540 PolarHBondContact O-N 3.19Å; S537-R540 PolarHBondContact O-N 3.42Å; L538-R540 VanDerWaalsContact C-N 3.34Å; L538-R540 PolarHBondContact O-N 3.26Å; R540-H542 VanDerWaalsContact C-N 3.33Å; R540-L543 PolarHBondContact O-N 3.17Å; R540-K544 VanDerWaalsContact O-CB 3.29Å; R540-K544 WeakPolarHBondContact O-CB 3.5Å; R540-K544 PolarHBondContact O-N 3.18Å
541	L	82.4	Confident	77.3	Confident	43 Å²	43	36 Å²	36	23%	0.225	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-42.5	176.1	-82.1	156.8	0	0	0	111.2	S537 L538 K544 V545	S537-L541 WeakPolarHBondContact O-CB 3.06Å; S537-L541 WeakPolarHBondContact O-CD1 3.4Å; S537-L541 WeakPolarHBondContact O-CG 2.98Å; S537-L541 PolarHBondContact O-N 3.3Å; L538-L541 PolarHBondContact O-N 2.78Å; L541-K544 PolarHBondContact O-N 3.35Å; L541-V545 WeakPolarHBondContact O-CG2 2.82Å; L541-V545 PolarHBondContact O-N 3.45Å
542	H	83.6	Confident	74.6	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.046	20%	0.197	C	C	.	.	H	α-helix	trans	-60	-55.4	175.5	178.9	74.3	0	0	0	111.4	L538 V539 R540 K544 V545 L546 T644 L646 W735	L538-H542 WeakPolarHBondContact O-CB 3.07Å; L538-H542 PolarHBondContact O-N 2.95Å; V539-H542 WeakPolarHBondContact O-CB 3.47Å; V539-H542 PolarHBondContact O-N 3.17Å; R540-H542 VanDerWaalsContact C-N 3.33Å; H542-K544 VanDerWaalsContact C-N 3.29Å; H542-K544 PolarHBondContact O-N 3.33Å; H542-V545 PolarHBondContact O-N 2.87Å; H542-L546 WeakPolarHBondContact O-CG 3.45Å; H542-L546 PolarHBondContact O-N 3.21Å; H542-T644 PolarHBondContact CE1-OG1 2.83Å; H542-T644 VanDerWaalsContact ND1-CB 3.33Å; H542-T644 WeakPolarHBondContact ND1-CB 3.31Å; H542-T644 PolarHBondContact ND1-OG1 3.37Å; H542-L646 HydrophobicContact CB-CD1 3.7Å; H542-L646 HydrophobicContact CB-CG 4.05Å; H542-W735 AromaticContact CD2-CE3 3.64Å; H542-W735 AromaticContact NE2-CE3 3.47Å
543	L	78.9	Confident	71.9	Confident	31 Å²	31	43.1 Å²	43.1	16%	0.162	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-36.5	179.9	-68.1	172.6	0	0	0	112.6	V539 R540 L546 H547 W735 I799	V539-L543 HydrophobicContact CG1-CD1 3.87Å; V539-L543 HydrophobicContact CG1-CG 4.28Å; V539-L543 WeakPolarHBondContact O-CG 2.96Å; V539-L543 PolarHBondContact O-N 3.19Å; R540-L543 PolarHBondContact O-N 3.17Å; L543-L546 HydrophobicContact CD2-CD1 4.37Å; L543-L546 PolarHBondContact O-N 2.73Å; L543-H547 PolarHBondContact O-CD2 3.37Å; L543-H547 PolarHBondContact O-N 2.91Å; L543-W735 HydrophobicContact CD2-CE3 4.38Å; L543-W735 HydrophobicContact CD2-CH2 3.75Å; L543-W735 HydrophobicContact CD2-CZ2 3.9Å; L543-W735 HydrophobicContact CD2-CZ3 4.01Å; L543-I799 HydrophobicContact CD2-CD1 4.11Å
544	K	78.6	Confident	68.8	Low	72 Å²	72	46.4 Å²	46.4	31%	0.313	26%	0.256	S	S	.	.	H	α-helix	trans	-60.8	-47	177.2	-171.5	-178.7	-177.9	-106.2	0	111.7	R540 L541 H542 L546 H547 E548 I564	R540-K544 VanDerWaalsContact O-CB 3.29Å; R540-K544 WeakPolarHBondContact O-CB 3.5Å; R540-K544 PolarHBondContact O-N 3.18Å; L541-K544 PolarHBondContact O-N 3.35Å; H542-K544 VanDerWaalsContact C-N 3.29Å; H542-K544 PolarHBondContact O-N 3.33Å; K544-L546 VanDerWaalsContact C-N 3.34Å; K544-H547 PolarHBondContact O-N 2.58Å; K544-E548 WeakPolarHBondContact CE-OE1 3.48Å; K544-E548 IonicContact NZ-OE1 3.6Å; K544-E548 PolarHBondContact NZ-OE1 3.49Å; K544-E548 IonicContact NZ-OE2 3.89Å; K544-E548 PolarHBondContact NZ-OE2 3.15Å; K544-E548 WeakPolarHBondContact O-CG 3.45Å; K544-E548 PolarHBondContact O-N 3.22Å; K544-I564 HydrophobicContact CD-CD1 3.93Å; K544-I564 VanDerWaalsContact CE-CD1 3.45Å
545	V	74.4	Confident	65.6	Low	39 Å²	39	51 Å²	51	24%	0.236	29%	0.288	C	S	.	.	H	α-helix	trans	-67.5	-37.5	179.3	175.9	0	0	0	0	110.7	L541 H542 H547 E548 L549 T644	L541-V545 WeakPolarHBondContact O-CG2 2.82Å; L541-V545 PolarHBondContact O-N 3.45Å; H542-V545 PolarHBondContact O-N 2.87Å; V545-H547 VanDerWaalsContact C-N 3.33Å; V545-H547 PolarHBondContact O-N 3.43Å; V545-E548 PolarHBondContact O-N 2.88Å; V545-L549 HydrophobicContact CG1-CD1 3.61Å; V545-L549 HydrophobicContact CG1-CG 4.12Å; V545-L549 WeakPolarHBondContact O-CB 3.37Å; V545-L549 VanDerWaalsContact O-CG 3.27Å; V545-L549 WeakPolarHBondContact O-CG 3.41Å; V545-L549 PolarHBondContact O-N 3.13Å; V545-T644 HydrophobicContact CB-CG2 3.94Å; V545-T644 HydrophobicContact CG1-CG2 3.78Å
546	L	69.6	Low	62.8	Low	12 Å²	12	55.5 Å²	55.5	6%	0.063	32%	0.317	C	S	.	.	H	α-helix	trans	-57.9	-45	173.3	-65.2	-176	0	0	0	111.7	H542 L543 K544 E548 T644 W735 I799	H542-L546 WeakPolarHBondContact O-CG 3.45Å; H542-L546 PolarHBondContact O-N 3.21Å; L543-L546 HydrophobicContact CD2-CD1 4.37Å; L543-L546 PolarHBondContact O-N 2.73Å; K544-L546 VanDerWaalsContact C-N 3.34Å; L546-E548 PolarHBondContact O-N 2.87Å; L546-T644 HydrophobicContact CD2-CG2 3.77Å; L546-T644 HydrophobicContact CG-CG2 4.19Å; L546-W735 HydrophobicContact CD1-CZ3 4.01Å; L546-I799 HydrophobicContact CB-CD1 3.4Å; L546-I799 VanDerWaalsContact CB-CD1 3.4Å; L546-I799 HydrophobicContact CD1-CD1 3.91Å; L546-I799 HydrophobicContact CD1-CG2 4.12Å; L546-I799 HydrophobicContact CG-CD1 4.3Å
547	H	67.6	Low	59.7	Low	58 Å²	58	58.6 Å²	58.6	27%	0.269	34%	0.338	S	S	.	.	H	α-helix	trans	-69.7	-27.9	176.6	-74.4	-59.4	0	0	0	114.6	L543 K544 V545 R795	L543-H547 PolarHBondContact O-CD2 3.37Å; L543-H547 PolarHBondContact O-N 2.91Å; K544-H547 PolarHBondContact O-N 2.58Å; V545-H547 VanDerWaalsContact C-N 3.33Å; V545-H547 PolarHBondContact O-N 3.43Å; H547-R795 PolarHBondContact O-NE 2.91Å
548	E	64.3	Low	56.7	Low	71 Å²	71	64.6 Å²	64.6	33%	0.332	37%	0.374	S	S	.	.	H	α-helix	trans	-76.8	-35.1	178.6	-77	173.9	171	0	0	111.7	K544 V545 L546 D550 A551	K544-E548 WeakPolarHBondContact CE-OE1 3.48Å; K544-E548 IonicContact NZ-OE1 3.6Å; K544-E548 PolarHBondContact NZ-OE1 3.49Å; K544-E548 IonicContact NZ-OE2 3.89Å; K544-E548 PolarHBondContact NZ-OE2 3.15Å; K544-E548 WeakPolarHBondContact O-CG 3.45Å; K544-E548 PolarHBondContact O-N 3.22Å; V545-E548 PolarHBondContact O-N 2.88Å; L546-E548 PolarHBondContact O-N 2.87Å; E548-D550 PolarHBondContact O-N 2.98Å; E548-A551 PolarHBondContact O-N 3.48Å
549	L	51.9	Low	53.7	Low	46 Å²	46	68.5 Å²	68.5	24%	0.241	40%	0.401	C	S	.	.	H	α-helix	trans	-73.2	-24.5	-176	-72.4	170	0	0	0	115.3	V545 A551 Y642	V545-L549 HydrophobicContact CG1-CD1 3.61Å; V545-L549 HydrophobicContact CG1-CG 4.12Å; V545-L549 WeakPolarHBondContact O-CB 3.37Å; V545-L549 VanDerWaalsContact O-CG 3.27Å; V545-L549 WeakPolarHBondContact O-CG 3.41Å; V545-L549 PolarHBondContact O-N 3.13Å; L549-A551 PolarHBondContact O-N 3.42Å; L549-Y642 WeakPolarHBondContact CD1-O 2.98Å; L549-Y642 HydrophobicContact CD2-CD2 3.89Å; L549-Y642 HydrophobicContact CD2-CG 3.79Å
550	D	47.2	Very low	50.8	Low	42 Å²	42	77.6 Å²	77.6	23%	0.225	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-10.6	176.2	-71.4	-22.8	0	0	0	113	E548	E548-D550 PolarHBondContact O-N 2.98Å
551	A	39.8	Very low	47.9	Very low	36 Å²	36	76.4 Å²	76.4	30%	0.298	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-24.6	-178.1	0	0	0	0	0	114.4	E548 L549 G553	E548-A551 PolarHBondContact O-N 3.48Å; L549-A551 PolarHBondContact O-N 3.42Å; A551-G553 VanDerWaalsContact C-N 3.31Å; A551-G553 PolarHBondContact O-N 3.44Å
552	D	33.8	Very low	45	Very low	99 Å²	99	78 Å²	78	53%	0.529	46%	0.463	S	S	.	.			trans	-90.4	63.9	-167.8	-76.9	-5.7	0	0	0	112.9
553	G	36	Very low	42.2	Very low	80 Å²	80	82.8 Å²	82.8	83%	0.825	50%	0.496	S	S	*	.	S	Bend	trans	-82	1.4	144.6	0	0	0	0	0	112.7	A551	A551-G553 VanDerWaalsContact C-N 3.31Å; A551-G553 PolarHBondContact O-N 3.44Å
554	C	24.2	Very low	39.5	Very low	96 Å²	96	86.2 Å²	86.2	65%	0.649	51%	0.514	S	S	*	.	S	Bend	trans	-129.7	124.8	176.4	-75.9	0	0	0	0	109.4
555	S	23.7	Very low	36.9	Very low	96 Å²	96	87.3 Å²	87.3	67%	0.671	53%	0.531	S	S	*	.			trans	-13.9	131.2	177.9	51.1	0	0	0	0	118.1	I557	S555-I557 PolarHBondContact O-N 2.85Å; S555-I557 VanDerWaalsContact O-N 3.11Å
556	P	28.2	Very low	34.4	Very low	97 Å²	97	87.5 Å²	87.5	63%	0.63	53%	0.533	S	S	*	.			trans	-73.8	109.4	175.3	31.1	-30.4	0	0	0	108.9	T558	P556-T558 PolarHBondContact O-N 3.32Å
557	I	24.3	Very low	32.2	Very low	141 Å²	141	92.2 Å²	92.2	72%	0.723	56%	0.562	S	S	*	*			trans	-75.8	116.6	164.7	-64.6	174	0	0	0	106.8	S555 S559	S555-I557 PolarHBondContact O-N 2.85Å; S555-I557 VanDerWaalsContact O-N 3.11Å; I557-S559 PolarHBondContact O-N 2.88Å
558	T	24	Very low	30.3	Very low	137 Å²	137	92.9 Å²	92.9	84%	0.84	56%	0.564	S	S	*	*			trans	-37.4	105.2	155	45.5	0	0	0	0	111	P556	P556-T558 PolarHBondContact O-N 3.32Å
559	S	25.9	Very low	28.4	Very low	83 Å²	83	94 Å²	94	58%	0.58	58%	0.576	S	S	*	*			trans	-138.6	100.8	163.1	67.2	0	0	0	0	109.7	I557 D561	I557-S559 PolarHBondContact O-N 2.88Å; S559-D561 PolarHBondContact O-N 2.92Å
560	E	24.9	Very low	27	Very low	194 Å²	194	99.4 Å²	99.4	91%	0.907	61%	0.605	S	S	*	*			trans	-68.9	7	168.6	-68.6	-170	136.5	0	0	113.1	S562	E560-S562 PolarHBondContact O-N 3.49Å
561	D	23.1	Very low	25.8	Very low	122 Å²	122	103 Å²	103	65%	0.652	62%	0.624	S	S	*	*			trans	-100.8	46.6	-176.1	-76.6	-30.9	0	0	0	114.1	S559	S559-D561 PolarHBondContact O-N 2.92Å
562	S	21.7	Very low	25.1	Very low	76 Å²	76	107.2 Å²	107.2	53%	0.531	63%	0.634	S	S	.	*			trans	-125.5	60.1	165.4	62.6	0	0	0	0	112.5	E560 I564	E560-S562 PolarHBondContact O-N 3.49Å; S562-I564 PolarHBondContact O-N 3.3Å
563	C	23.4	Very low	24.6	Very low	111 Å²	111	107.4 Å²	107.4	75%	0.75	64%	0.642	S	S	*	*			trans	-65.9	82.1	148.9	-80.2	0	0	0	0	108.5	S565	C563-S565 PolarHBondContact O-N 3.03Å
564	I	23.6	Very low	24.1	Very low	103 Å²	103	109.5 Å²	109.5	53%	0.528	63%	0.631	S	S	.	*			trans	-52.7	115.4	164	-67.4	160.2	0	0	0	106.5	K544 S562 P566	K544-I564 HydrophobicContact CD-CD1 3.93Å; K544-I564 VanDerWaalsContact CE-CD1 3.45Å; S562-I564 PolarHBondContact O-N 3.3Å; I564-P566 WeakPolarHBondContact O-CD 3.16Å
565	S	22.7	Very low	24.1	Very low	95 Å²	95	116.7 Å²	116.7	66%	0.664	64%	0.644	S	S	*	*			trans	-73.7	107.8	157.3	-69.7	0	0	0	0	107.1	C563 T567	C563-S565 PolarHBondContact O-N 3.03Å; S565-T567 PolarHBondContact O-N 3.35Å; S565-T567 VanDerWaalsContact O-N 3.14Å
566	P	23.7	Very low	24.2	Very low	43 Å²	43	117 Å²	117	28%	0.279	64%	0.642	S	S	.	*			trans	-76.5	92.5	147.8	33.8	-28.4	0	0	0	104	I564 F568	I564-P566 WeakPolarHBondContact O-CD 3.16Å; P566-F568 HydrophobicContact CB-CD2 3.79Å; P566-F568 HydrophobicContact CB-CE2 3.56Å; P566-F568 HydrophobicContact CB-CZ 4.27Å; P566-F568 HydrophobicContact CG-CD2 3.99Å; P566-F568 HydrophobicContact CG-CE2 3.54Å; P566-F568 HydrophobicContact CG-CZ 4.47Å; P566-F568 WeakPolarHBondContact O-CD2 3.43Å; P566-F568 PolarHBondContact O-N 3.2Å
567	T	22.8	Very low	24.1	Very low	111 Å²	111	116.5 Å²	116.5	68%	0.681	63%	0.634	S	S	*	*			trans	-63.6	96.2	153.5	-30.7	0	0	0	0	103.9	S565 T569	S565-T567 PolarHBondContact O-N 3.35Å; S565-T567 VanDerWaalsContact O-N 3.14Å; T567-T569 HydrophobicContact CG2-CG2 4.45Å; T567-T569 PolarHBondContact O-N 3.31Å
568	F	26.6	Very low	24	Very low	71 Å²	71	115.2 Å²	115.2	31%	0.311	64%	0.636	S	S	.	*			trans	-68.6	85.4	168.3	-77.6	-95.5	0	0	0	106	L458 P566	L458-F568 HydrophobicContact CD2-CE1 4.11Å; L458-F568 HydrophobicContact CD2-CE2 4.22Å; L458-F568 HydrophobicContact CD2-CZ 3.44Å; L458-F568 VanDerWaalsContact CD2-CZ 3.44Å; P566-F568 HydrophobicContact CB-CD2 3.79Å; P566-F568 HydrophobicContact CB-CE2 3.56Å; P566-F568 HydrophobicContact CB-CZ 4.27Å; P566-F568 HydrophobicContact CG-CD2 3.99Å; P566-F568 HydrophobicContact CG-CE2 3.54Å; P566-F568 HydrophobicContact CG-CZ 4.47Å; P566-F568 WeakPolarHBondContact O-CD2 3.43Å; P566-F568 PolarHBondContact O-N 3.2Å
569	T	24.5	Very low	23.9	Very low	96 Å²	96	113.4 Å²	113.4	59%	0.589	63%	0.625	S	S	*	*			trans	-98.5	120.5	153.5	44.6	0	0	0	0	104.8	T567 D571	T567-T569 HydrophobicContact CG2-CG2 4.45Å; T567-T569 PolarHBondContact O-N 3.31Å; T569-D571 PolarHBondContact O-N 3.09Å
570	D	23.1	Very low	23.8	Very low	158 Å²	158	114.7 Å²	114.7	85%	0.845	63%	0.634	S	S	*	*			trans	-66.7	16	175.7	-81.7	-38.5	0	0	0	112.9
571	D	22	Very low	23.7	Very low	117 Å²	117	110.7 Å²	110.7	63%	0.626	63%	0.628	S	S	*	*			trans	-108.7	114.7	-178.5	-76.9	-39.9	0	0	0	111.9	T569	T569-D571 PolarHBondContact O-N 3.09Å
572	Y	25.2	Very low	23.6	Very low	126 Å²	126	112.1 Å²	112.1	49%	0.494	64%	0.635	S	S	.	*			trans	81.4	124.6	141.8	-79	-70.5	0	0	0	124.7	F1232	Y572-F1232 HydrophobicContact CD1-CD1 4.34Å; Y572-F1232 AromaticContact CD1-CE1 3.58Å; Y572-F1232 HydrophobicContact CD1-CE1 3.58Å; Y572-F1232 AromaticContact CD1-CZ 3.95Å; Y572-F1232 HydrophobicContact CD1-CZ 3.95Å; Y572-F1232 HydrophobicContact CD2-CZ 4.09Å; Y572-F1232 AromaticContact CE1-CD1 3.24Å; Y572-F1232 HydrophobicContact CE1-CD1 3.24Å; Y572-F1232 HydrophobicContact CE1-CD2 4.38Å; Y572-F1232 AromaticContact CE1-CE1 2.8Å; Y572-F1232 HydrophobicContact CE1-CE1 2.8Å; Y572-F1232 HydrophobicContact CE1-CE2 4.05Å; Y572-F1232 HydrophobicContact CE1-CG 4.08Å; Y572-F1232 AromaticContact CE1-CZ 3.28Å; Y572-F1232 HydrophobicContact CE1-CZ 3.28Å; Y572-F1232 HydrophobicContact CE2-CD2 4.34Å; Y572-F1232 AromaticContact CE2-CE1 3.89Å; Y572-F1232 HydrophobicContact CE2-CE1 3.89Å; Y572-F1232 AromaticContact CE2-CE2 3.63Å; Y572-F1232 HydrophobicContact CE2-CE2 3.63Å; Y572-F1232 AromaticContact CE2-CZ 3.37Å; Y572-F1232 HydrophobicContact CE2-CZ 3.37Å; Y572-F1232 HydrophobicContact CG-CE1 4.42Å; Y572-F1232 HydrophobicContact CG-CZ 4.36Å; Y572-F1232 AromaticContact CZ-CD1 3.38Å; Y572-F1232 AromaticContact CZ-CD2 3.65Å; Y572-F1232 AromaticContact CZ-CE1 3.01Å; Y572-F1232 AromaticContact CZ-CE2 3.29Å; Y572-F1232 AromaticContact CZ-CG 3.74Å; Y572-F1232 AromaticContact CZ-CZ 2.95Å; Y572-F1232 WeakPolarHBondContact OH-CD1 3.49Å; Y572-F1232 WeakPolarHBondContact OH-CD2 3.35Å; Y572-F1232 WeakPolarHBondContact OH-CE1 3.48Å; Y572-F1232 WeakPolarHBondContact OH-CE2 3.26Å; Y572-F1232 WeakPolarHBondContact OH-CG 3.4Å; Y572-F1232 WeakPolarHBondContact OH-CZ 3.33Å
573	S	23.9	Very low	23.7	Very low	102 Å²	102	115.2 Å²	115.2	71%	0.713	65%	0.646	S	S	*	*			trans	85.4	112.9	137	68.5	0	0	0	0	118.8	R575	S573-R575 PolarHBondContact O-N 3.31Å
574	Q	24.7	Very low	23.7	Very low	124 Å²	124	117.5 Å²	117.5	58%	0.579	65%	0.65	S	S	*	*			trans	-46	117.5	158.5	-67.5	179.7	-34.1	0	0	109.2	T576	Q574-T576 PolarHBondContact O-N 3.41Å
575	R	24.8	Very low	23.7	Very low	247 Å²	247	120 Å²	120	93%	0.932	66%	0.664	S	S	*	*			trans	-65.7	103.4	167.1	-87.7	-176.1	-176.5	175.5	0.4	108.4	S573	S573-R575 PolarHBondContact O-N 3.31Å
576	T	25.3	Very low	23.8	Very low	102 Å²	102	122.4 Å²	122.4	63%	0.626	67%	0.669	S	S	*	*			trans	-77.6	134.1	162.7	-26.7	0	0	0	0	108.9	Q574 C578	Q574-T576 PolarHBondContact O-N 3.41Å; T576-C578 PolarHBondContact O-N 3.02Å
577	L	25.4	Very low	23.8	Very low	87 Å²	87	128.1 Å²	128.1	46%	0.455	69%	0.692	S	S	.	*			trans	-72	119.2	173.9	-74.4	143.6	0	0	0	109.6	T579 T796	L577-T579 PolarHBondContact O-N 3.49Å; L577-T796 WeakPolarHBondContact CD1-O 3.3Å; L577-T796 VanDerWaalsContact CD2-CB 3.5Å; L577-T796 HydrophobicContact CD2-CG2 3.55Å; L577-T796 WeakPolarHBondContact CD2-O 3.14Å
578	C	22.5	Very low	23.8	Very low	114 Å²	114	133.3 Å²	133.3	77%	0.77	71%	0.705	S	S	*	*			trans	-85.3	105.5	168.3	-72.6	0	0	0	0	109.3	T576	T576-C578 PolarHBondContact O-N 3.02Å
579	T	21.7	Very low	23.6	Very low	99 Å²	99	133.3 Å²	133.3	61%	0.607	73%	0.725	S	S	*	*			trans	-120.6	102.2	153.2	53.3	0	0	0	0	108.6	L577 K780	L577-T579 PolarHBondContact O-N 3.49Å; T579-K780 PolarHBondContact OG1-NZ 3.34Å
580	S	24	Very low	23.5	Very low	110 Å²	110	139 Å²	139	77%	0.769	74%	0.742	S	S	*	*			trans	-152	107	150.7	65.6	0	0	0	0	109.1	N582	S580-N582 PolarHBondContact O-N 2.94Å
581	S	22.4	Very low	23.6	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	74%	0.738	S	S	*	*			trans	-60.6	128.9	151.1	62.9	0	0	0	0	107.6
582	N	22.7	Very low	23.8	Very low	152 Å²	152	136.7 Å²	136.7	81%	0.813	75%	0.745	S	S	*	*			trans	-147	127.6	142.4	-110.6	-17.4	0	0	0	110.9	S580	S580-N582 PolarHBondContact O-N 2.94Å
583	N	22.1	Very low	23.9	Very low	140 Å²	140	137.3 Å²	137.3	75%	0.749	76%	0.761	S	S	*	*			trans	-46.2	129.8	168.2	-63.1	-44.3	0	0	0	110.9
584	N	24.6	Very low	24.1	Very low	159 Å²	159	137.9 Å²	137.9	85%	0.85	76%	0.762	S	S	*	*				-166.2	127.5	118.1	-88.2	-24.8	0	0	0	110.8
585	L	22.9	Very low	24	Very low	156 Å²	156	142 Å²	142	82%	0.817	78%	0.778	S	S	*	*			trans	-45	139.4	169.4	-80.7	73.4	0	0	0	112.2
586	L	25	Very low	24.2	Very low	145 Å²	145	135.6 Å²	135.6	76%	0.759	77%	0.772	S	S	*	*				-172.4	118.7	103.4	-93	165	0	0	0	112.5
587	Q	23	Very low	24.3	Very low	163 Å²	163	138.3 Å²	138.3	76%	0.762	78%	0.782	S	S	*	*			trans	45.4	107.7	146.5	-76	171.5	-16	0	0	121
588	F	22.9	Very low	24.4	Very low	221 Å²	221	139.2 Å²	139.2	97%	0.969	79%	0.793	S	S	*	*				-176.2	121.1	119.9	-87.9	-72.2	0	0	0	103.5
589	G	23.7	Very low	24.7	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	80%	0.796	S	S	*	*			cis	154.4	81.5	24.2	0	0	0	0	0	103.9	S591	G589-S591 PolarHBondContact O-N 2.87Å
590	F	22.5	Very low	24.9	Very low	217 Å²	217	140 Å²	140	95%	0.952	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.8	120.3	177.9	-78.7	-83.9	0	0	0	109.4
591	S	24.3	Very low	25	Very low	108 Å²	108	143.3 Å²	143.3	76%	0.755	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-95.7	129.7	157.3	-141.5	0	0	0	0	108.1	G589	G589-S591 PolarHBondContact O-N 2.87Å
592	P	25.9	Very low	25.1	Very low	118 Å²	118	146.1 Å²	146.1	77%	0.766	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-80.9	122.7	-172.8	31.8	-30.8	0	0	0	109.8
593	V	27.1	Very low	25.5	Very low	138 Å²	138	144.5 Å²	144.5	84%	0.836	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-90	132.5	165.8	179.8	0	0	0	0	108.5
594	P	27.7	Very low	25.7	Very low	114 Å²	114	145.4 Å²	145.4	74%	0.74	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-76.8	152.7	-167.6	-8.1	26	0	0	0	112.7	S596	P594-S596 PolarHBondContact O-N 3.05Å
595	K	23.9	Very low	26	Very low	211 Å²	211	142.9 Å²	142.9	92%	0.917	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-47	120.3	169.7	-63.6	172.8	178.5	176.5	0	111.6
596	S	28	Very low	26.2	Very low	113 Å²	113	143.2 Å²	143.2	79%	0.79	80%	0.804	S	S	*	*			trans	-127	113.9	154.9	61.1	0	0	0	0	109	P594	P594-S596 PolarHBondContact O-N 3.05Å
597	N	27.7	Very low	26.5	Very low	158 Å²	158	148.1 Å²	148.1	85%	0.845	81%	0.812	S	S	*	*			trans	-64.9	149.8	168.4	-73.7	-27.4	0	0	0	110.5
598	P	26.7	Very low	26.6	Very low	107 Å²	107	152.4 Å²	152.4	70%	0.695	82%	0.821	S	S	*	*			trans	-90.4	162.6	-170.4	37	-34.5	0	0	0	112.5	V600	P598-V600 PolarHBondContact O-N 3.17Å
599	P	29.9	Very low	26.8	Very low	128 Å²	128	146.5 Å²	146.5	83%	0.831	81%	0.813	S	S	*	*			trans	-85.5	107.9	163.3	32.6	-25.4	0	0	0	110.1
600	V	25.2	Very low	27.2	Very low	102 Å²	102	149 Å²	149	62%	0.618	82%	0.817	S	S	*	*			trans	-11.7	128.4	142.8	177.2	0	0	0	0	116.1	P598 F602	P598-V600 PolarHBondContact O-N 3.17Å; V600-F602 HydrophobicContact CG1-CD2 3.2Å; V600-F602 HydrophobicContact CG1-CE2 3.59Å; V600-F602 HydrophobicContact CG1-CG 4.22Å; V600-F602 HydrophobicContact CG2-CE2 4.49Å
601	L	27.2	Very low	27.3	Very low	178 Å²	178	144.2 Å²	144.2	93%	0.932	81%	0.805	S	S	*	*			trans	-132.7	108.4	139.6	-105.8	164.8	0	0	0	108.2
602	F	24.3	Very low	27.5	Very low	171 Å²	171	147.2 Å²	147.2	75%	0.75	81%	0.813	S	S	*	*			trans	-77.2	143.9	173.2	-87.4	-83.1	0	0	0	111.3	V600	V600-F602 HydrophobicContact CG1-CD2 3.2Å; V600-F602 HydrophobicContact CG1-CE2 3.59Å; V600-F602 HydrophobicContact CG1-CG 4.22Å; V600-F602 HydrophobicContact CG2-CE2 4.49Å
603	S	30.1	Very low	27.4	Very low	118 Å²	118	150.9 Å²	150.9	83%	0.825	82%	0.816	S	S	*	*			trans	170.5	122.2	139.7	-68.8	0	0	0	0	106.1
604	N	27	Very low	27.5	Very low	158 Å²	158	150.3 Å²	150.3	85%	0.845	82%	0.819	S	S	*	*			cis	-166.8	136.7	3.5	-145.9	1.7	0	0	0	104.9
605	P	29.9	Very low	27.3	Very low	106 Å²	106	150.6 Å²	150.6	69%	0.688	82%	0.823	S	S	*	*			trans	-100.2	136.1	177.1	34.4	-25.5	0	0	0	111.2
606	D	28.1	Very low	27.6	Very low	164 Å²	164	145 Å²	145	88%	0.877	82%	0.817	S	S	*	*			trans	-158.4	107.3	157.8	-108.3	-24.1	0	0	0	112
607	R	30.9	Very low	27.5	Very low	247 Å²	247	145.2 Å²	145.2	93%	0.932	82%	0.818	S	S	*	*			trans	157.3	96	134.5	-87.5	-177.9	177.9	-172	0.2	111.2
608	R	25.4	Very low	27.4	Very low	253 Å²	253	142.7 Å²	142.7	96%	0.955	81%	0.813	S	S	*	*			trans	-94.2	140.3	144.6	-87	-178.3	178.9	172.6	0.3	107.9
609	A	28.3	Very low	27.4	Very low	97 Å²	97	146.9 Å²	146.9	80%	0.802	82%	0.823	S	S	*	*			trans	-130.9	149.6	150.9	0	0	0	0	0	108.2
610	P	31.7	Very low	27.8	Very low	123 Å²	123	146 Å²	146	80%	0.799	82%	0.817	S	S	*	*			trans	-113.2	166.3	-142.5	34.2	-20.1	0	0	0	115.2
611	V	24.3	Very low	27.7	Very low	116 Å²	116	146.9 Å²	146.9	70%	0.703	82%	0.823	S	S	*	*			trans	-32.4	135.5	163.4	178.8	0	0	0	0	114.4	K613	V611-K613 HydrophobicContact CG1-CG 4.31Å
612	N	28.3	Very low	27.5	Very low	172 Å²	172	146.7 Å²	146.7	92%	0.92	82%	0.817	S	S	*	*			trans	-131.8	118.6	143.1	-99.7	-15.1	0	0	0	110.2
613	K	24.7	Very low	27.4	Very low	194 Å²	194	143.9 Å²	143.9	84%	0.843	82%	0.819	S	S	*	*			trans	-88.7	135.8	165	-78.2	176.9	173.7	178.5	0	108	V611	V611-K613 HydrophobicContact CG1-CG 4.31Å
614	S	27.9	Very low	27.3	Very low	126 Å²	126	143.6 Å²	143.6	88%	0.881	82%	0.817	S	S	*	*			trans	-153.4	125.2	147.9	46.8	0	0	0	0	109
615	S	25	Very low	27.4	Very low	120 Å²	120	142.4 Å²	142.4	84%	0.839	82%	0.817	S	S	*	*			trans	-118.3	127.3	-178.8	43.6	0	0	0	0	109.3
616	A	29.5	Very low	27	Very low	95 Å²	95	143 Å²	143	79%	0.785	82%	0.819	S	S	*	*			trans	-162.4	107.3	152	0	0	0	0	0	106.1
617	S	24.9	Very low	26.8	Very low	117 Å²	117	142.6 Å²	142.6	82%	0.818	81%	0.81	S	S	*	*				59.2	119.4	100.8	-177.9	0	0	0	0	112
618	S	27.1	Very low	26.5	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	81%	0.807	S	S	*	*			cis	-170.4	139.4	35.7	41.8	0	0	0	0	112.5
619	Q	26.7	Very low	26.5	Very low	195 Å²	195	135.9 Å²	135.9	91%	0.911	80%	0.797	S	S	*	*			trans	57.1	153.3	143.2	-78.7	-159.7	-24.5	0	0	123.6
620	P	36.5	Very low	26.4	Very low	109 Å²	109	139.5 Å²	139.5	71%	0.708	80%	0.798	S	S	*	*			trans	-111.7	169.5	-142.3	41.2	-31.4	0	0	0	114.3
621	V	24.4	Very low	26	Very low	122 Å²	122	138 Å²	138	74%	0.739	80%	0.804	S	S	*	*			trans	171.1	130.2	136.6	154	0	0	0	0	110.5
622	E	22.7	Very low	25.9	Very low	174 Å²	174	135.2 Å²	135.2	81%	0.813	80%	0.799	S	S	*	*			trans	53.8	139.3	152.2	-70.7	169.9	179.5	0	0	124.5
623	S	23	Very low	25.7	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	80%	0.8	S	S	*	*			trans	99.1	111.8	148.5	69.9	0	0	0	0	119.1
624	S	27.6	Very low	25.7	Very low	112 Å²	112	136.3 Å²	136.3	78%	0.783	80%	0.803	S	S	*	*			trans	30.8	144.1	147.6	-48.5	0	0	0	0	120.9
625	P	27.9	Very low	25.5	Very low	132 Å²	132	135 Å²	135	86%	0.857	79%	0.794	S	S	*	*			trans	-131.2	115.2	142	32.7	-17.2	0	0	0	112.9
626	T	21.4	Very low	25.6	Very low	119 Å²	119	134.6 Å²	134.6	73%	0.73	79%	0.791	S	S	*	*			trans	-71	134.6	145.1	10.4	0	0	0	0	109.5
627	F	24.4	Very low	25.5	Very low	156 Å²	156	141.2 Å²	141.2	68%	0.684	80%	0.796	S	S	*	*			trans	59.1	123.2	155.7	-79.1	-89.7	0	0	0	120.4	Q629	F627-Q629 HydrophobicContact CD1-CG 4.27Å; F627-Q629 HydrophobicContact CE1-CG 4.22Å
628	F	25.6	Very low	25.8	Very low	196 Å²	196	144 Å²	144	86%	0.86	80%	0.796	S	S	*	*				-141	109.8	115.6	-109.5	-80.1	0	0	0	110.9	Q630	F628-Q630 PolarHBondContact O-N 3.43Å
629	Q	24.9	Very low	26.1	Very low	162 Å²	162	148.3 Å²	148.3	76%	0.757	80%	0.801	S	S	*	*			trans	-63.8	116.5	153.3	-84.7	174.6	-15.1	0	0	107.6	F627	F627-Q629 HydrophobicContact CD1-CG 4.27Å; F627-Q629 HydrophobicContact CE1-CG 4.22Å
630	Q	25.9	Very low	26.7	Very low	174 Å²	174	143.4 Å²	143.4	81%	0.813	79%	0.788	S	S	*	*			trans	-124.5	114.4	149.3	-87.5	-169.2	-2.9	0	0	108.4	F628 G632	F628-Q630 PolarHBondContact O-N 3.43Å; Q630-G632 VanDerWaalsContact C-N 3.33Å; Q630-G632 PolarHBondContact O-N 3.23Å
631	G	22.8	Very low	27.4	Very low	90 Å²	90	142.3 Å²	142.3	93%	0.928	78%	0.776	S	S	*	*			trans	-62.5	93.5	168.9	0	0	0	0	0	110
632	G	23	Very low	29.1	Very low	58 Å²	58	144 Å²	144	60%	0.598	77%	0.77	S	S	*	*			trans	-92.7	116.4	159.6	0	0	0	0	0	108.6	Q630 L634	Q630-G632 VanDerWaalsContact C-N 3.33Å; Q630-G632 PolarHBondContact O-N 3.23Å; G632-L634 VanDerWaalsContact C-N 3.31Å; G632-L634 PolarHBondContact O-N 3.03Å
633	K	23.6	Very low	31.4	Very low	217 Å²	217	138.4 Å²	138.4	94%	0.943	75%	0.746	S	S	*	*			trans	-51.7	98.9	160.3	-83	174.5	174.3	173.9	0	107.9	S635	K633-S635 PolarHBondContact O-N 3.09Å
634	L	24.7	Very low	34	Very low	172 Å²	172	133.1 Å²	133.1	90%	0.901	71%	0.709	S	S	*	*			trans	-63.8	104.2	169.6	-91.9	149.3	0	0	0	107.3	G632 S636	G632-L634 VanDerWaalsContact C-N 3.31Å; G632-L634 PolarHBondContact O-N 3.03Å; L634-S636 PolarHBondContact O-N 2.9Å
635	S	23.9	Very low	36.5	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	68%	0.678	S	S	*	*			trans	-53.5	128.6	169.2	67.1	0	0	0	0	108.8	K633 R637	K633-S635 PolarHBondContact O-N 3.09Å; S635-R637 PolarHBondContact O-N 3.17Å
636	S	27.5	Very low	39.1	Very low	112 Å²	112	122.7 Å²	122.7	78%	0.783	64%	0.637	S	S	*	*			trans	-62.4	66.3	175.1	55.7	0	0	0	0	112.8	L634	L634-S636 PolarHBondContact O-N 2.9Å
637	R	26.3	Very low	41.9	Very low	234 Å²	234	118 Å²	118	88%	0.883	61%	0.607	S	S	*	*			trans	-95.4	82.3	153.7	-97.4	-176.8	170.2	179.6	-2.7	106.6	S635 K639	S635-R637 PolarHBondContact O-N 3.17Å; R637-K639 PolarHBondContact O-N 2.89Å
638	Q	31.4	Very low	44.6	Very low	176 Å²	176	113.6 Å²	113.6	82%	0.822	59%	0.591	S	S	*	*			trans	-52.1	108.2	167.6	-82.5	162.5	-46.6	0	0	108.4	S640	Q638-S640 VanDerWaalsContact C-N 3.3Å; Q638-S640 PolarHBondContact O-N 3.3Å
639	K	34.3	Very low	47.3	Very low	194 Å²	194	104.3 Å²	104.3	84%	0.843	55%	0.55	S	S	*	*			trans	-55.6	107.2	143.2	-82.9	-179.5	173.8	-178.2	0	104.2	R637 I641	R637-K639 PolarHBondContact O-N 2.89Å; K639-I641 PolarHBondContact O-N 3.07Å
640	S	37.9	Very low	50	Low	92 Å²	92	97.9 Å²	97.9	64%	0.643	52%	0.519	S	S	*	.			trans	-65.6	90.3	173.1	60.6	0	0	0	0	107	Q638 Y642	Q638-S640 VanDerWaalsContact C-N 3.3Å; Q638-S640 PolarHBondContact O-N 3.3Å; S640-Y642 PolarHBondContact O-N 3.32Å
641	I	52.7	Low	52.5	Low	87 Å²	87	91.5 Å²	91.5	45%	0.446	49%	0.492	S	S	.	.			trans	-61.7	112.1	170.1	-61.4	171.1	0	0	0	104.5	K639 L643	K639-I641 PolarHBondContact O-N 3.07Å; I641-L643 PolarHBondContact O-N 2.99Å
642	Y	59.8	Low	55.1	Low	157 Å²	157	90 Å²	90	62%	0.616	46%	0.462	S	S	*	.			trans	-61.8	105.3	174.7	-88	-89.1	0	0	0	108	L549 S640	L549-Y642 WeakPolarHBondContact CD1-O 2.98Å; L549-Y642 HydrophobicContact CD2-CD2 3.89Å; L549-Y642 HydrophobicContact CD2-CG 3.79Å; S640-Y642 PolarHBondContact O-N 3.32Å
643	L	70	Confident	57.6	Low	57 Å²	57	88 Å²	88	30%	0.298	44%	0.438	S	S	.	.			trans	-73.7	130.6	177.6	-69.3	161.4	0	0	0	109	I641 E647 N648 V651 P869	I641-L643 PolarHBondContact O-N 2.99Å; L643-E647 WeakPolarHBondContact CA-OE2 3.43Å; L643-E647 HydrophobicContact CB-CB 4.2Å; L643-E647 HydrophobicContact CD2-CB 3.69Å; L643-N648 VanDerWaalsContact CB-OD1 3.25Å; L643-N648 WeakPolarHBondContact CB-OD1 3.33Å; L643-N648 WeakPolarHBondContact CD1-OD1 3.28Å; L643-N648 PolarHBondContact O-ND2 3.49Å; L643-N648 VanDerWaalsContact O-ND2 3.12Å; L643-V651 HydrophobicContact CD1-CG2 4.17Å; L643-P869 HydrophobicContact CD2-CB 4.34Å; L643-P869 HydrophobicContact CD2-CG 4.15Å
644	T	79.3	Confident	60	Low	1 Å²	1	80 Å²	80	1%	0.006	41%	0.405	C	S	.	.			trans	-64.7	166	169.7	65.6	0	0	0	0	110.9	H542 V545 L546 L646 E647 N648	H542-T644 PolarHBondContact CE1-OG1 2.83Å; H542-T644 VanDerWaalsContact ND1-CB 3.33Å; H542-T644 WeakPolarHBondContact ND1-CB 3.31Å; H542-T644 PolarHBondContact ND1-OG1 3.37Å; V545-T644 HydrophobicContact CB-CG2 3.94Å; V545-T644 HydrophobicContact CG1-CG2 3.78Å; L546-T644 HydrophobicContact CD2-CG2 3.77Å; L546-T644 HydrophobicContact CG-CG2 4.19Å; T644-L646 VanDerWaalsContact C-N 3.26Å; T644-L646 PolarHBondContact O-N 3.07Å; T644-E647 WeakPolarHBondContact CB-OE2 3.39Å; T644-E647 WeakPolarHBondContact CG2-OE2 3.49Å; T644-E647 PolarHBondContact N-OE2 3.04Å; T644-E647 PolarHBondContact O-N 2.9Å; T644-E647 VanDerWaalsContact OG1-CD 3.29Å; T644-E647 VanDerWaalsContact OG1-CG 3.22Å; T644-E647 WeakPolarHBondContact OG1-CG 2.98Å; T644-E647 PolarHBondContact OG1-N 2.98Å; T644-E647 PolarHBondContact OG1-OE2 3.47Å; T644-N648 PolarHBondContact O-N 3.48Å; T644-N648 PolarHBondContact O-ND2 3.35Å
645	V	78.7	Confident	62.1	Low	22 Å²	22	77 Å²	77	13%	0.133	39%	0.387	C	S	.	.	H	α-helix	trans	-54.2	-42.7	176.9	176.6	0	0	0	0	111.9	I471 L538 I649	I471-V645 HydrophobicContact CD1-CG1 3.61Å; L538-V645 HydrophobicContact CD2-CG1 4.18Å; V645-I649 HydrophobicContact CG1-CD1 4.06Å; V645-I649 VanDerWaalsContact O-CG1 3.28Å; V645-I649 WeakPolarHBondContact O-CG1 3.48Å; V645-I649 PolarHBondContact O-N 3.35Å; V645-I649 VanDerWaalsContact O-N 3.1Å
646	L	82.1	Confident	63.7	Low	2 Å²	2	76.8 Å²	76.8	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-68.4	-42.4	179.4	-66	-177.4	0	0	0	112.4	L538 H542 T644 N648 I649 R650 L732 W735 Y736	L538-L646 HydrophobicContact CB-CD2 4.29Å; L538-L646 HydrophobicContact CD2-CD2 4.49Å; H542-L646 HydrophobicContact CB-CD1 3.7Å; H542-L646 HydrophobicContact CB-CG 4.05Å; T644-L646 VanDerWaalsContact C-N 3.26Å; T644-L646 PolarHBondContact O-N 3.07Å; L646-N648 VanDerWaalsContact C-N 3.35Å; L646-I649 PolarHBondContact O-N 3.32Å; L646-R650 WeakPolarHBondContact O-CB 3.43Å; L646-R650 PolarHBondContact O-N 3.25Å; L646-L732 HydrophobicContact CD1-CD1 3.9Å; L646-L732 HydrophobicContact CD2-CD1 3.7Å; L646-L732 HydrophobicContact CG-CD1 4.48Å; L646-W735 HydrophobicContact CD1-CB 4.4Å; L646-Y736 HydrophobicContact CB-CD2 4.35Å; L646-Y736 HydrophobicContact CD2-CD2 4.3Å
647	E	81.5	Confident	64.9	Low	21 Å²	21	77.7 Å²	77.7	10%	0.098	36%	0.361	C	S	.	.	H	α-helix	trans	-65	-40.4	177.8	-64.6	164.2	149.4	0	0	110.7	L643 T644 I649 R650 V651 R866 F870	L643-E647 WeakPolarHBondContact CA-OE2 3.43Å; L643-E647 HydrophobicContact CB-CB 4.2Å; L643-E647 HydrophobicContact CD2-CB 3.69Å; T644-E647 WeakPolarHBondContact CB-OE2 3.39Å; T644-E647 WeakPolarHBondContact CG2-OE2 3.49Å; T644-E647 PolarHBondContact N-OE2 3.04Å; T644-E647 PolarHBondContact O-N 2.9Å; T644-E647 VanDerWaalsContact OG1-CD 3.29Å; T644-E647 VanDerWaalsContact OG1-CG 3.22Å; T644-E647 WeakPolarHBondContact OG1-CG 2.98Å; T644-E647 PolarHBondContact OG1-N 2.98Å; T644-E647 PolarHBondContact OG1-OE2 3.47Å; E647-I649 PolarHBondContact O-N 3.05Å; E647-R650 WeakPolarHBondContact O-CB 3.36Å; E647-R650 PolarHBondContact O-N 3.3Å; E647-R650 VanDerWaalsContact O-N 3.08Å; E647-V651 WeakPolarHBondContact O-CG2 3.26Å; E647-V651 PolarHBondContact O-N 3.31Å; E647-R866 IonicContact OE1-CZ 3.97Å; E647-R866 IonicContact OE1-NE 2.77Å; E647-R866 IonicContact OE1-NH2 2.65Å; E647-R866 PolarHBondContact OE1-NH2 2.89Å; E647-R866 IonicContact OE2-NH2 3.69Å; E647-R866 PolarHBondContact OE2-NH2 3.08Å; E647-F870 HydrophobicContact CB-CE2 4.02Å; E647-F870 HydrophobicContact CB-CZ 4.14Å; E647-F870 HydrophobicContact CG-CE2 4.05Å; E647-F870 WeakPolarHBondContact O-CZ 3.36Å
648	N	81.3	Confident	66	Low	64 Å²	64	73.5 Å²	73.5	34%	0.342	36%	0.356	S	S	.	.	H	α-helix	trans	-59.9	-43.5	173.7	-77.8	-42.9	0	0	0	112.4	L643 T644 L646 R650 L652	L643-N648 VanDerWaalsContact CB-OD1 3.25Å; L643-N648 WeakPolarHBondContact CB-OD1 3.33Å; L643-N648 WeakPolarHBondContact CD1-OD1 3.28Å; L643-N648 PolarHBondContact O-ND2 3.49Å; L643-N648 VanDerWaalsContact O-ND2 3.12Å; T644-N648 PolarHBondContact O-N 3.48Å; T644-N648 PolarHBondContact O-ND2 3.35Å; L646-N648 VanDerWaalsContact C-N 3.35Å; N648-R650 VanDerWaalsContact C-N 3.28Å; N648-R650 PolarHBondContact O-N 3.35Å; N648-L652 WeakPolarHBondContact O-CG 3.48Å; N648-L652 PolarHBondContact O-N 3.35Å
649	I	81	Confident	66.7	Low	0 Å²	0	73.5 Å²	73.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-63	-38.1	174.8	-66.4	166.1	0	0	0	110.5	P468 I471 R472 V645 L646 E647 L652 D653 M696 Y736	P468-I649 HydrophobicContact CB-CG1 3.69Å; I471-I649 HydrophobicContact CD1-CD1 4.23Å; I471-I649 HydrophobicContact CG2-CD1 4.07Å; R472-I649 PolarHBondContact NH2-O 2.91Å; V645-I649 HydrophobicContact CG1-CD1 4.06Å; V645-I649 VanDerWaalsContact O-CG1 3.28Å; V645-I649 WeakPolarHBondContact O-CG1 3.48Å; V645-I649 PolarHBondContact O-N 3.35Å; V645-I649 VanDerWaalsContact O-N 3.1Å; L646-I649 PolarHBondContact O-N 3.32Å; E647-I649 PolarHBondContact O-N 3.05Å; I649-L652 PolarHBondContact O-N 3.07Å; I649-D653 PolarHBondContact O-N 3.47Å; I649-D653 VanDerWaalsContact O-N 3.09Å; I649-M696 HydrophobicContact CG2-CB 3.8Å; I649-M696 HydrophobicContact CG2-CG 3.96Å; I649-M696 HydrophobicContact CG2-SD 4.42Å; I649-Y736 HydrophobicContact CB-CE2 4.26Å; I649-Y736 HydrophobicContact CG2-CE2 3.91Å
650	R	81.1	Confident	66.9	Low	28 Å²	28	70.4 Å²	70.4	11%	0.106	34%	0.341	C	S	.	.	H	α-helix	trans	-69.5	-42.3	179.9	-168	176.1	-176.2	-163	-3.5	112.5	L646 E647 N648 L652 D653 N654 Y736 D737 D739 F870	L646-R650 WeakPolarHBondContact O-CB 3.43Å; L646-R650 PolarHBondContact O-N 3.25Å; E647-R650 WeakPolarHBondContact O-CB 3.36Å; E647-R650 PolarHBondContact O-N 3.3Å; E647-R650 VanDerWaalsContact O-N 3.08Å; N648-R650 VanDerWaalsContact C-N 3.28Å; N648-R650 PolarHBondContact O-N 3.35Å; R650-L652 VanDerWaalsContact C-N 3.29Å; R650-L652 PolarHBondContact O-N 2.9Å; R650-D653 PolarHBondContact O-N 3.11Å; R650-D653 VanDerWaalsContact O-N 3.14Å; R650-N654 PolarHBondContact O-N 3.35Å; R650-Y736 HydrophobicContact CB-CE2 3.85Å; R650-Y736 HydrophobicContact CG-CE2 4.46Å; R650-D737 IonicContact CZ-OD1 3.34Å; R650-D737 IonicContact CZ-OD2 3.62Å; R650-D737 VanDerWaalsContact CZ-OD2 3.27Å; R650-D737 IonicContact NE-OD2 3.39Å; R650-D737 PolarHBondContact NE-OD2 3.01Å; R650-D737 IonicContact NH1-OD1 3.27Å; R650-D737 IonicContact NH2-OD1 2.73Å; R650-D737 PolarHBondContact NH2-OD1 3.39Å; R650-D737 IonicContact NH2-OD2 2.73Å; R650-D737 PolarHBondContact NH2-OD2 3.44Å; R650-D739 IonicContact NH2-OD2 3.31Å; R650-F870 HydrophobicContact CB-CE1 4.39Å; R650-F870 HydrophobicContact CB-CE2 4.33Å; R650-F870 HydrophobicContact CB-CZ 3.91Å; R650-F870 HydrophobicContact CG-CE1 4.27Å; R650-F870 HydrophobicContact CG-CE2 4.37Å; R650-F870 HydrophobicContact CG-CZ 4.12Å
651	V	80.1	Confident	66.6	Low	39 Å²	39	71.6 Å²	71.6	24%	0.236	35%	0.347	C	S	.	.	H	α-helix	trans	-53.4	-50.2	172.9	173.1	0	0	0	0	109.9	L643 E647 D653 N654 E655 F870	L643-V651 HydrophobicContact CD1-CG2 4.17Å; E647-V651 WeakPolarHBondContact O-CG2 3.26Å; E647-V651 PolarHBondContact O-N 3.31Å; V651-D653 VanDerWaalsContact C-N 3.3Å; V651-D653 PolarHBondContact O-N 2.98Å; V651-N654 PolarHBondContact O-N 3.45Å; V651-N654 VanDerWaalsContact O-N 3.12Å; V651-E655 HydrophobicContact CG1-CG 4.26Å; V651-E655 WeakPolarHBondContact O-CG 3.46Å; V651-E655 PolarHBondContact O-N 2.85Å; V651-F870 HydrophobicContact CB-CE1 4.43Å; V651-F870 HydrophobicContact CG2-CE1 3.54Å; V651-F870 HydrophobicContact CG2-CZ 3.69Å
652	L	75.9	Confident	65.6	Low	59 Å²	59	74.9 Å²	74.9	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-64.2	-30.8	180	-71.3	170.1	0	0	0	113.7	P468 N648 I649 R650	P468-L652 HydrophobicContact CB-CD1 3.73Å; P468-L652 HydrophobicContact CG-CD1 3.33Å; N648-L652 WeakPolarHBondContact O-CG 3.48Å; N648-L652 PolarHBondContact O-N 3.35Å; I649-L652 PolarHBondContact O-N 3.07Å; R650-L652 VanDerWaalsContact C-N 3.29Å; R650-L652 PolarHBondContact O-N 2.9Å
653	D	75.7	Confident	64.3	Low	16 Å²	16	72.1 Å²	72.1	9%	0.086	37%	0.374	C	S	.	.	H	α-helix	trans	-73.8	-35.6	173.5	-92.7	-1.9	0	0	0	112.1	R472 I649 R650 V651 R656 M696 Y736	R472-D653 IonicContact CZ-OD1 3.51Å; R472-D653 IonicContact NE-OD1 3.83Å; R472-D653 IonicContact NH1-OD1 3.73Å; R472-D653 PolarHBondContact NH1-OD1 3.46Å; R472-D653 VanDerWaalsContact NH2-CG 3.28Å; R472-D653 IonicContact NH2-OD1 2.67Å; R472-D653 PolarHBondContact NH2-OD1 3.28Å; I649-D653 PolarHBondContact O-N 3.47Å; I649-D653 VanDerWaalsContact O-N 3.09Å; R650-D653 PolarHBondContact O-N 3.11Å; R650-D653 VanDerWaalsContact O-N 3.14Å; V651-D653 VanDerWaalsContact C-N 3.3Å; V651-D653 PolarHBondContact O-N 2.98Å; D653-R656 WeakPolarHBondContact O-CB 3.32Å; D653-M696 VanDerWaalsContact OD2-CB 3.3Å; D653-M696 WeakPolarHBondContact OD2-CB 3.37Å; D653-M696 PolarHBondContact OD2-N 2.62Å; D653-Y736 PolarHBondContact OD2-OH 3.48Å
654	N	74.3	Confident	62.6	Low	49 Å²	49	77.5 Å²	77.5	26%	0.262	40%	0.395	S	S	.	.	H	α-helix	trans	-77.2	-43	-178.4	-76	-18.4	0	0	0	113.1	R650 V651 R656 K657	R650-N654 PolarHBondContact O-N 3.35Å; V651-N654 PolarHBondContact O-N 3.45Å; V651-N654 VanDerWaalsContact O-N 3.12Å; N654-R656 PolarHBondContact O-N 2.9Å; N654-K657 PolarHBondContact O-N 3.28Å
655	E	68.6	Low	60.3	Low	109 Å²	109	84.4 Å²	84.4	51%	0.509	44%	0.438	S	S	.	.	H	α-helix	trans	-56.1	-21	174.5	-73.3	-176.3	170.4	0	0	112.8	V651	V651-E655 HydrophobicContact CG1-CG 4.26Å; V651-E655 WeakPolarHBondContact O-CG 3.46Å; V651-E655 PolarHBondContact O-N 2.85Å
656	R	58.7	Low	58	Low	94 Å²	94	92.6 Å²	92.6	36%	0.355	48%	0.475	S	S	.	.	H	α-helix	trans	-78.7	-31.4	177.4	-155	175.2	178	-134.4	-13.3	113.3	D653 N654 N692 S693	D653-R656 WeakPolarHBondContact O-CB 3.32Å; N654-R656 PolarHBondContact O-N 2.9Å; R656-N692 PolarHBondContact NE-O 3.41Å; R656-N692 PolarHBondContact NH1-O 3.34Å; R656-N692 PolarHBondContact NH2-O 3.41Å; R656-S693 PolarHBondContact NH1-O 3.27Å; R656-S693 PolarHBondContact NH2-O 3.42Å
657	K	51.9	Low	55.7	Low	130 Å²	130	94 Å²	94	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-67.6	-40.2	176.9	-78.2	-178	178.1	172.8	0	111.1	N654 K659 Q660	N654-K657 PolarHBondContact O-N 3.28Å; K657-K659 PolarHBondContact O-N 3.47Å; K657-Q660 PolarHBondContact O-N 2.95Å
658	D	48.7	Very low	53.5	Low	146 Å²	146	100.4 Å²	100.4	78%	0.781	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-16.6	-176.4	-66	-24.6	0	0	0	113.8
659	K	46.2	Very low	51.3	Low	176 Å²	176	102.9 Å²	102.9	77%	0.765	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-5.1	178.7	-68.7	-179.4	-178.5	172.5	0	114.5	K657	K657-K659 PolarHBondContact O-N 3.47Å
660	Q	38.3	Very low	49.1	Very low	129 Å²	129	111.2 Å²	111.2	60%	0.603	56%	0.556	S	S	*	*	S	Bend	trans	-95.8	121.8	174.2	-77	-155.2	-22.2	0	0	111.1	K657 V662	K657-Q660 PolarHBondContact O-N 2.95Å; Q660-V662 PolarHBondContact O-N 2.79Å
661	P	32.2	Very low	46.9	Very low	117 Å²	117	116.9 Å²	116.9	76%	0.76	58%	0.577	S	S	*	*			trans	-65.1	136.4	179.7	26.7	-32.1	0	0	0	110.4	S663	P661-S663 VanDerWaalsContact C-N 3.33Å; P661-S663 PolarHBondContact O-N 3.41Å
662	V	32	Very low	44.6	Very low	157 Å²	157	118.2 Å²	118.2	95%	0.952	58%	0.583	S	S	*	*	S	Bend	trans	-57.5	85.3	-176.6	-174.4	0	0	0	0	110.9	Q660	Q660-V662 PolarHBondContact O-N 2.79Å
663	S	31.6	Very low	42.5	Very low	98 Å²	98	119.2 Å²	119.2	69%	0.685	60%	0.595	S	S	*	*			trans	-152.8	129	157.9	72.4	0	0	0	0	110.9	P661	P661-S663 VanDerWaalsContact C-N 3.33Å; P661-S663 PolarHBondContact O-N 3.41Å
664	K	34.5	Very low	40.3	Very low	170 Å²	170	125 Å²	125	74%	0.739	62%	0.624	S	S	*	*			trans	90.4	79.2	171.5	-56	-177.8	177.9	178.7	0	117.6	Q666	K664-Q666 PolarHBondContact O-N 2.75Å
665	T	31.1	Very low	38.2	Very low	146 Å²	146	126.7 Å²	126.7	90%	0.896	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	17.4	162.1	-29.1	0	0	0	0	114.1
666	Q	30.9	Very low	36.2	Very low	194 Å²	194	126.4 Å²	126.4	91%	0.907	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	12	-174.1	-80.1	-171.2	-14.4	0	0	116	K664	K664-Q666 PolarHBondContact O-N 2.75Å
667	S	35	Very low	34.7	Very low	31 Å²	31	125 Å²	125	22%	0.217	66%	0.662	C	S	.	*			trans	-125.4	11.5	-171.7	102.1	0	0	0	0	117.6	I669 R671	S667-I669 PolarHBondContact O-N 2.9Å; S667-R671 PolarHBondContact OG-NE 2.88Å; S667-R671 PolarHBondContact OG-NH2 3.35Å
668	W	34.2	Very low	33.7	Very low	157 Å²	157	122.6 Å²	122.6	60%	0.595	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-31.5	-173.8	-72.4	5.5	0	0	0	113.6
669	I	35.5	Very low	32.8	Very low	116 Å²	116	121.5 Å²	121.5	60%	0.595	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-33.1	179.7	-63.5	173.4	0	0	0	112.1	S667	S667-I669 PolarHBondContact O-N 2.9Å
670	K	34.4	Very low	32.1	Very low	174 Å²	174	117.5 Å²	117.5	76%	0.757	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-77.2	-15.6	178.3	-94.2	-176.8	177	178.3	0	115	L672 S673	K670-L672 VanDerWaalsContact C-N 3.34Å; K670-S673 PolarHBondContact O-OG 2.97Å
671	R	35.8	Very low	31.8	Very low	147 Å²	147	114.3 Å²	114.3	56%	0.555	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-82	-12.1	179.5	-72.9	-173.7	-166.4	176.5	7	113.8	S667 S673	S667-R671 PolarHBondContact OG-NE 2.88Å; S667-R671 PolarHBondContact OG-NH2 3.35Å; R671-S673 VanDerWaalsContact C-N 3.33Å
672	L	31.7	Very low	32	Very low	68 Å²	68	111.9 Å²	111.9	36%	0.356	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-80.5	-8.6	179.8	-71.2	167.7	0	0	0	113.9	K670	K670-L672 VanDerWaalsContact C-N 3.34Å
673	S	31	Very low	32.2	Very low	79 Å²	79	112 Å²	112	55%	0.552	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-95	-2.9	178.6	58.7	0	0	0	0	114.6	K670 R671	K670-S673 PolarHBondContact O-OG 2.97Å; R671-S673 VanDerWaalsContact C-N 3.33Å
674	I	29.1	Very low	32.6	Very low	138 Å²	138	109.9 Å²	109.9	71%	0.708	59%	0.593	S	S	*	*			trans	-121.7	69.8	-175.7	-46.5	175.5	0	0	0	109.3
675	V	31.5	Very low	32.7	Very low	85 Å²	85	108.7 Å²	108.7	52%	0.515	60%	0.595	S	S	.	*			trans	-128.6	68.4	160.5	-171.6	0	0	0	0	107.5	I694	V675-I694 HydrophobicContact CG2-CD1 4.36Å
676	S	26.6	Very low	32.9	Very low	102 Å²	102	104.2 Å²	104.2	71%	0.713	57%	0.567	S	S	*	*			trans	-118.8	95.2	166.5	-61.8	0	0	0	0	106.1
677	G	27.4	Very low	33.1	Very low	66 Å²	66	97.5 Å²	97.5	68%	0.68	55%	0.55	S	S	*	*			trans	142.5	69	175.7	0	0	0	0	0	114.3
678	L	30.2	Very low	33.2	Very low	78 Å²	78	103 Å²	103	41%	0.408	57%	0.572	S	S	.	*			trans	-127.5	105.1	144.6	-88.2	103.3	0	0	0	107.4
679	T	30.4	Very low	33.3	Very low	123 Å²	123	102.5 Å²	102.5	76%	0.755	58%	0.58	S	S	*	*			trans	-59.7	142	166.5	39.6	0	0	0	0	109.2	T681	T679-T681 PolarHBondContact O-N 2.9Å
680	S	30	Very low	33.6	Very low	92 Å²	92	102.6 Å²	102.6	64%	0.643	58%	0.578	S	S	*	*			trans	-58.6	99.3	-179.2	50.2	0	0	0	0	111.5
681	T	33	Very low	34	Very low	62 Å²	62	95.9 Å²	95.9	38%	0.38	55%	0.55	S	S	.	*			trans	-92.8	111.6	168	45.3	0	0	0	0	109.5	T679 K683	T679-T681 PolarHBondContact O-N 2.9Å; T681-K683 PolarHBondContact O-N 3.45Å; T681-K683 VanDerWaalsContact O-N 3.13Å
682	S	36.7	Very low	34.5	Very low	66 Å²	66	92.4 Å²	92.4	46%	0.462	54%	0.543	S	S	.	.			trans	-74.7	18.3	-178.7	45.9	0	0	0	0	114.6	D432	D432-S682 VanDerWaalsContact OD1-CB 3.23Å; D432-S682 WeakPolarHBondContact OD1-CB 3.49Å
683	K	36.3	Very low	35.7	Very low	161 Å²	161	92.5 Å²	92.5	70%	0.7	55%	0.55	S	S	*	.			trans	-94.4	117	-176.9	-69.2	-176.6	179.5	177.7	0	111.2	T681 N685	T681-K683 PolarHBondContact O-N 3.45Å; T681-K683 VanDerWaalsContact O-N 3.13Å; K683-N685 PolarHBondContact O-N 3.3Å
684	T	39.7	Very low	37.3	Very low	53 Å²	53	90.4 Å²	90.4	33%	0.325	53%	0.532	S	S	.	.	S	Bend	trans	-60.3	-23.8	171.8	44	0	0	0	0	113.3	S428 V686	S428-T684 WeakPolarHBondContact O-CG2 3.48Å; T684-V686 PolarHBondContact O-N 3.09Å
685	N	37	Very low	39.6	Very low	144 Å²	144	85.4 Å²	85.4	77%	0.77	51%	0.509	S	S	*	.	S	Bend	trans	-89.4	87.8	168	-78.6	-17.7	0	0	0	109.5	K683 G687	K683-N685 PolarHBondContact O-N 3.3Å; N685-G687 PolarHBondContact O-N 3.2Å; N685-G687 VanDerWaalsContact O-N 3.11Å
686	V	35.8	Very low	42.1	Very low	52 Å²	52	81.3 Å²	81.3	32%	0.315	48%	0.484	S	S	.	.			trans	-71.8	109.7	165.8	-169	0	0	0	0	108.2	Y473 T684 L691	Y473-V686 HydrophobicContact CD2-CG2 4.34Å; Y473-V686 HydrophobicContact CE2-CG2 4.32Å; T684-V686 PolarHBondContact O-N 3.09Å; V686-L691 HydrophobicContact CB-CD1 3.73Å; V686-L691 HydrophobicContact CG1-CB 4.46Å; V686-L691 HydrophobicContact CG1-CD1 3.17Å; V686-L691 HydrophobicContact CG1-CG 4.3Å; V686-L691 HydrophobicContact CG2-CD1 3.8Å
687	G	34.9	Very low	44.9	Very low	54 Å²	54	78.2 Å²	78.2	56%	0.557	46%	0.458	S	S	*	.			trans	-56.7	147	167.7	0	0	0	0	0	111	N685 L689	N685-G687 PolarHBondContact O-N 3.2Å; N685-G687 VanDerWaalsContact O-N 3.11Å; G687-L689 PolarHBondContact O-N 3.2Å
688	H	36.5	Very low	47.5	Very low	147 Å²	147	76.5 Å²	76.5	68%	0.681	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-9.4	-176.5	-106	-76.8	0	0	0	116.6	N692	H688-N692 VanDerWaalsContact O-CG 3.25Å; H688-N692 PolarHBondContact O-ND2 2.84Å; H688-N692 PolarHBondContact O-OD1 3.09Å
689	L	35.9	Very low	50.2	Low	145 Å²	145	72.9 Å²	72.9	76%	0.759	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-36.7	-165.6	-110	80.4	0	0	0	115.9	G687 N692	G687-L689 PolarHBondContact O-N 3.2Å; L689-N692 PolarHBondContact O-ND2 3.38Å
690	E	41.6	Very low	52.9	Low	118 Å²	118	67.1 Å²	67.1	55%	0.551	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-29.8	-168.6	-71.6	-177.9	170.5	0	0	114	N692	E690-N692 PolarHBondContact O-N 3.24Å
691	L	43.9	Very low	55.7	Low	33 Å²	33	63.9 Å²	63.9	17%	0.173	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-81.5	-3.7	178.6	-104.7	138.4	0	0	0	114.5	R472 Y473 V686 S693	R472-L691 HydrophobicContact CB-CD2 4.48Å; Y473-L691 VanDerWaalsContact CA-CD2 3.43Å; Y473-L691 HydrophobicContact CD2-CD1 3.38Å; Y473-L691 HydrophobicContact CD2-CD2 3.99Å; Y473-L691 HydrophobicContact CD2-CG 3.96Å; Y473-L691 HydrophobicContact CE2-CD1 4.27Å; Y473-L691 HydrophobicContact CG-CD1 3.86Å; Y473-L691 HydrophobicContact CG-CD2 4.32Å; V686-L691 HydrophobicContact CB-CD1 3.73Å; V686-L691 HydrophobicContact CG1-CB 4.46Å; V686-L691 HydrophobicContact CG1-CD1 3.17Å; V686-L691 HydrophobicContact CG1-CG 4.3Å; V686-L691 HydrophobicContact CG2-CD1 3.8Å; L691-S693 PolarHBondContact O-N 2.95Å; L691-S693 VanDerWaalsContact O-N 3.1Å
692	N	46.1	Very low	58.2	Low	74 Å²	74	62.1 Å²	62.1	40%	0.396	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-60.9	-22.8	-178	-77.9	-30.2	0	0	0	111.6	R656 H688 L689 E690 I694	R656-N692 PolarHBondContact NE-O 3.41Å; R656-N692 PolarHBondContact NH1-O 3.34Å; R656-N692 PolarHBondContact NH2-O 3.41Å; H688-N692 VanDerWaalsContact O-CG 3.25Å; H688-N692 PolarHBondContact O-ND2 2.84Å; H688-N692 PolarHBondContact O-OD1 3.09Å; L689-N692 PolarHBondContact O-ND2 3.38Å; E690-N692 PolarHBondContact O-N 3.24Å; N692-I694 PolarHBondContact O-N 2.89Å
693	S	55.7	Low	60.8	Low	71 Å²	71	59.1 Å²	59.1	50%	0.497	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-66.7	-39.6	-162.6	57.7	0	0	0	0	117	R656 L691	R656-S693 PolarHBondContact NH1-O 3.27Å; R656-S693 PolarHBondContact NH2-O 3.42Å; L691-S693 PolarHBondContact O-N 2.95Å; L691-S693 VanDerWaalsContact O-N 3.1Å
694	I	64.9	Low	63.3	Low	34 Å²	34	51.5 Å²	51.5	17%	0.174	29%	0.291	C	S	.	.			trans	-112.3	121.9	-164.5	-61	171.8	0	0	0	111.9	N476 V675 N692 S698 M699	N476-I694 WeakPolarHBondContact OD1-CD1 3.28Å; V675-I694 HydrophobicContact CG2-CD1 4.36Å; N692-I694 PolarHBondContact O-N 2.89Å; I694-S698 WeakPolarHBondContact CG2-OG 3.48Å; I694-M699 HydrophobicContact CG2-CG 3.5Å; I694-M699 VanDerWaalsContact CG2-CG 3.5Å; I694-M699 HydrophobicContact CG2-SD 4.27Å
695	S	78	Confident	65.7	Low	33 Å²	33	50.3 Å²	50.3	23%	0.231	28%	0.281	C	S	.	.			trans	-74.8	153.4	178.3	65.2	0	0	0	0	111.9	K697 S698 M699	S695-K697 PolarHBondContact O-N 2.5Å; S695-S698 PolarHBondContact N-OG 3.04Å; S695-S698 PolarHBondContact O-N 3.14Å; S695-S698 PolarHBondContact O-OG 3.43Å; S695-S698 PolarHBondContact OG-N 3.08Å; S695-S698 PolarHBondContact OG-OG 3.28Å; S695-M699 PolarHBondContact O-N 2.86Å
696	M	83.5	Confident	68.3	Low	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.4	-39.3	176.7	-171	69.5	-173.1	0	0	111	L475 L538 I649 D653 S698 M699 L700 L732 Y736	L475-M696 HydrophobicContact CD2-CE 3.71Å; L475-M696 HydrophobicContact CD2-SD 3.83Å; L538-M696 HydrophobicContact CD1-CE 4.18Å; I649-M696 HydrophobicContact CG2-CB 3.8Å; I649-M696 HydrophobicContact CG2-CG 3.96Å; I649-M696 HydrophobicContact CG2-SD 4.42Å; D653-M696 VanDerWaalsContact OD2-CB 3.3Å; D653-M696 WeakPolarHBondContact OD2-CB 3.37Å; D653-M696 PolarHBondContact OD2-N 2.62Å; M696-S698 PolarHBondContact O-N 3.07Å; M696-M699 PolarHBondContact O-N 3.08Å; M696-M699 HydrophobicContact SD-CE 3.88Å; M696-L700 HydrophobicContact CE-CD1 4.45Å; M696-L700 HydrophobicContact CE-CD2 4.01Å; M696-L700 HydrophobicContact CE-CG 4.21Å; M696-L700 HydrophobicContact CG-CD1 4.2Å; M696-L700 HydrophobicContact CG-CG 4.42Å; M696-L700 WeakPolarHBondContact O-CG 3.38Å; M696-L700 PolarHBondContact O-N 2.86Å; M696-L732 HydrophobicContact CE-CD2 4.2Å; M696-Y736 HydrophobicContact CB-CE1 4.21Å; M696-Y736 HydrophobicContact CB-CE2 4.37Å; M696-Y736 HydrophobicContact CG-CE1 4.25Å; M696-Y736 HydrophobicContact CG-CE2 4.15Å
697	K	85.9	Confident	70.9	Confident	36 Å²	36	41 Å²	41	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-49.1	-56.8	171.2	176.7	-179.3	177.8	175	0	111.2	S695 M699 L700 F701 L740 E743	S695-K697 PolarHBondContact O-N 2.5Å; K697-M699 VanDerWaalsContact C-N 3.29Å; K697-M699 PolarHBondContact O-N 3.1Å; K697-L700 PolarHBondContact O-N 3.25Å; K697-F701 HydrophobicContact CD-CE2 4.39Å; K697-F701 HydrophobicContact CG-CD2 3.81Å; K697-F701 HydrophobicContact CG-CE2 3.79Å; K697-F701 VanDerWaalsContact O-CD2 3.3Å; K697-F701 WeakPolarHBondContact O-CD2 3.35Å; K697-F701 PolarHBondContact O-N 2.88Å; K697-F701 VanDerWaalsContact O-N 3.07Å; K697-L740 HydrophobicContact CB-CD1 4.39Å; K697-L740 HydrophobicContact CB-CD2 4.35Å; K697-L740 HydrophobicContact CD-CD2 3.43Å; K697-L740 VanDerWaalsContact CD-CD2 3.43Å; K697-L740 HydrophobicContact CG-CD1 4.26Å; K697-L740 HydrophobicContact CG-CD2 3.6Å; K697-E743 WeakPolarHBondContact CE-OE2 3.48Å; K697-E743 IonicContact NZ-OE1 2.96Å; K697-E743 PolarHBondContact NZ-OE1 3.3Å; K697-E743 IonicContact NZ-OE2 3.24Å; K697-E743 PolarHBondContact NZ-OE2 2.94Å
698	S	82.4	Confident	73.4	Confident	30 Å²	30	38.4 Å²	38.4	21%	0.21	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-34.7	-176.1	60.6	0	0	0	0	113.1	I694 S695 M696 S702	I694-S698 WeakPolarHBondContact CG2-OG 3.48Å; S695-S698 PolarHBondContact N-OG 3.04Å; S695-S698 PolarHBondContact O-N 3.14Å; S695-S698 PolarHBondContact O-OG 3.43Å; S695-S698 PolarHBondContact OG-N 3.08Å; S695-S698 PolarHBondContact OG-OG 3.28Å; M696-S698 PolarHBondContact O-N 3.07Å; S698-S702 WeakPolarHBondContact O-CB 3.46Å; S698-S702 PolarHBondContact O-N 3.3Å; S698-S702 PolarHBondContact O-OG 3.27Å
699	M	85.6	Confident	75.8	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-47	174.6	-67.3	-174.1	-74	0	0	111.7	R472 L475 N476 L479 I694 S695 M696 K697 F701 S702 I703	R472-M699 HydrophobicContact CB-CE 4.06Å; R472-M699 HydrophobicContact CG-CE 3.96Å; L475-M699 HydrophobicContact CB-SD 4.12Å; L475-M699 HydrophobicContact CD2-CB 3.8Å; L475-M699 HydrophobicContact CD2-CE 3.98Å; L475-M699 HydrophobicContact CD2-CG 4.42Å; L475-M699 HydrophobicContact CD2-SD 3.85Å; L475-M699 HydrophobicContact CG-SD 4.33Å; N476-M699 HydrophobicContact CB-SD 3.84Å; L479-M699 HydrophobicContact CD1-CB 4.09Å; L479-M699 HydrophobicContact CD1-CG 4.03Å; I694-M699 HydrophobicContact CG2-CG 3.5Å; I694-M699 VanDerWaalsContact CG2-CG 3.5Å; I694-M699 HydrophobicContact CG2-SD 4.27Å; S695-M699 PolarHBondContact O-N 2.86Å; M696-M699 PolarHBondContact O-N 3.08Å; M696-M699 HydrophobicContact SD-CE 3.88Å; K697-M699 VanDerWaalsContact C-N 3.29Å; K697-M699 PolarHBondContact O-N 3.1Å; M699-F701 VanDerWaalsContact C-N 3.33Å; M699-F701 PolarHBondContact O-N 2.88Å; M699-S702 PolarHBondContact O-N 3.27Å; M699-S702 VanDerWaalsContact O-N 3.11Å; M699-I703 VanDerWaalsContact O-CG1 3.23Å; M699-I703 WeakPolarHBondContact O-CG1 3.15Å; M699-I703 PolarHBondContact O-N 3.31Å
700	L	88.5	Confident	78.2	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-58.6	-43.9	178.7	-68.7	173.2	0	0	0	112.1	M696 K697 S702 I703 L704 V729 L732 I733 Y736	M696-L700 HydrophobicContact CE-CD1 4.45Å; M696-L700 HydrophobicContact CE-CD2 4.01Å; M696-L700 HydrophobicContact CE-CG 4.21Å; M696-L700 HydrophobicContact CG-CD1 4.2Å; M696-L700 HydrophobicContact CG-CG 4.42Å; M696-L700 WeakPolarHBondContact O-CG 3.38Å; M696-L700 PolarHBondContact O-N 2.86Å; K697-L700 PolarHBondContact O-N 3.25Å; L700-S702 PolarHBondContact O-N 3.1Å; L700-I703 PolarHBondContact O-N 2.99Å; L700-L704 WeakPolarHBondContact O-CB 3.42Å; L700-L704 PolarHBondContact O-N 3.18Å; L700-V729 HydrophobicContact CD2-CG1 4.14Å; L700-L732 HydrophobicContact CD2-CD2 3.55Å; L700-L732 HydrophobicContact CD2-CG 4.11Å; L700-I733 HydrophobicContact CB-CD1 4.42Å; L700-I733 HydrophobicContact CB-CG1 4.11Å; L700-I733 HydrophobicContact CD1-CG1 4.1Å; L700-I733 HydrophobicContact CG-CG1 4.5Å; L700-Y736 HydrophobicContact CD1-CD1 3.95Å; L700-Y736 HydrophobicContact CD1-CG 4.35Å
701	F	87.2	Confident	80.2	Confident	24 Å²	24	19.5 Å²	19.5	11%	0.105	11%	0.111	C	C	.	.	H	α-helix	trans	-63.2	-40.4	174.6	-86.7	-80.4	0	0	0	112.7	K697 M699 L704 R705 L740 M744	K697-F701 HydrophobicContact CD-CE2 4.39Å; K697-F701 HydrophobicContact CG-CD2 3.81Å; K697-F701 HydrophobicContact CG-CE2 3.79Å; K697-F701 VanDerWaalsContact O-CD2 3.3Å; K697-F701 WeakPolarHBondContact O-CD2 3.35Å; K697-F701 PolarHBondContact O-N 2.88Å; K697-F701 VanDerWaalsContact O-N 3.07Å; M699-F701 VanDerWaalsContact C-N 3.33Å; M699-F701 PolarHBondContact O-N 2.88Å; F701-L704 PolarHBondContact O-N 3.17Å; F701-R705 WeakPolarHBondContact O-CB 3.37Å; F701-R705 VanDerWaalsContact O-CG 3.27Å; F701-R705 WeakPolarHBondContact O-CG 3.47Å; F701-R705 PolarHBondContact O-N 3.4Å; F701-L740 HydrophobicContact CE2-CD2 4.3Å; F701-M744 HydrophobicContact CD1-CG 4.4Å; F701-M744 HydrophobicContact CE1-CG 3.31Å; F701-M744 HydrophobicContact CE1-SD 3.9Å; F701-M744 HydrophobicContact CZ-CG 3.58Å; F701-M744 HydrophobicContact CZ-SD 4.23Å
702	S	87	Confident	81.9	Confident	26 Å²	26	18.2 Å²	18.2	18%	0.182	11%	0.105	C	C	.	.	H	α-helix	trans	-66.2	-44.7	179.1	-57.6	0	0	0	0	110.9	S698 M699 L700 L704 R705 L706	S698-S702 WeakPolarHBondContact O-CB 3.46Å; S698-S702 PolarHBondContact O-N 3.3Å; S698-S702 PolarHBondContact O-OG 3.27Å; M699-S702 PolarHBondContact O-N 3.27Å; M699-S702 VanDerWaalsContact O-N 3.11Å; L700-S702 PolarHBondContact O-N 3.1Å; S702-L704 VanDerWaalsContact C-N 3.34Å; S702-L704 PolarHBondContact O-N 3.35Å; S702-R705 PolarHBondContact O-N 3.38Å; S702-L706 WeakPolarHBondContact O-CG 3.21Å; S702-L706 PolarHBondContact O-N 3.33Å
703	I	89.7	Confident	83.5	Confident	3 Å²	3	15.4 Å²	15.4	2%	0.015	9%	0.089	C	C	.	.	H	α-helix	trans	-60.4	-45.8	175.6	-65.5	164.7	0	0	0	110.5	L475 L479 Y531 M699 L700 R705 L706 A707 T725 V729	L475-I703 HydrophobicContact CD1-CD1 4.27Å; L475-I703 HydrophobicContact CD2-CD1 4.04Å; L475-I703 HydrophobicContact CG-CD1 4.15Å; L479-I703 HydrophobicContact CD1-CG1 4.3Å; L479-I703 HydrophobicContact CD2-CG1 3.95Å; L479-I703 HydrophobicContact CG-CG1 4.38Å; Y531-I703 HydrophobicContact CD1-CD1 3.52Å; Y531-I703 HydrophobicContact CD1-CG1 3.72Å; Y531-I703 HydrophobicContact CD1-CG2 3.95Å; Y531-I703 HydrophobicContact CD2-CG1 4.47Å; Y531-I703 HydrophobicContact CD2-CG2 3.83Å; Y531-I703 HydrophobicContact CE1-CD1 3.61Å; Y531-I703 HydrophobicContact CE1-CG1 3.57Å; Y531-I703 HydrophobicContact CE2-CG1 4.35Å; Y531-I703 HydrophobicContact CE2-CG2 4.4Å; Y531-I703 HydrophobicContact CG-CD1 4.31Å; Y531-I703 HydrophobicContact CG-CG1 4.2Å; Y531-I703 HydrophobicContact CG-CG2 3.6Å; M699-I703 VanDerWaalsContact O-CG1 3.23Å; M699-I703 WeakPolarHBondContact O-CG1 3.15Å; M699-I703 PolarHBondContact O-N 3.31Å; L700-I703 PolarHBondContact O-N 2.99Å; I703-R705 PolarHBondContact O-N 3.34Å; I703-L706 PolarHBondContact O-N 2.96Å; I703-A707 WeakPolarHBondContact O-CB 3.41Å; I703-A707 PolarHBondContact O-N 3.06Å; I703-T725 HydrophobicContact CG2-CG2 3.91Å; I703-V729 HydrophobicContact CG2-CG1 4.37Å; I703-V729 HydrophobicContact CG2-CG2 3.81Å
704	L	90.1	Very high	84.2	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.1	-46.1	179.5	-174.2	70.9	0	0	0	111.2	L700 F701 S702 L706 A707 V708 I726 I733 M744 M756 L763	L700-L704 WeakPolarHBondContact O-CB 3.42Å; L700-L704 PolarHBondContact O-N 3.18Å; F701-L704 PolarHBondContact O-N 3.17Å; S702-L704 VanDerWaalsContact C-N 3.34Å; S702-L704 PolarHBondContact O-N 3.35Å; L704-L706 VanDerWaalsContact C-N 3.34Å; L704-L706 PolarHBondContact O-N 2.96Å; L704-A707 WeakPolarHBondContact O-CB 3.36Å; L704-A707 PolarHBondContact O-N 3.45Å; L704-A707 VanDerWaalsContact O-N 3.14Å; L704-V708 VanDerWaalsContact O-CG2 3.29Å; L704-V708 WeakPolarHBondContact O-CG2 3.49Å; L704-V708 PolarHBondContact O-N 3.33Å; L704-I726 HydrophobicContact CD1-CG1 4.34Å; L704-I726 HydrophobicContact CD1-CG2 4.26Å; L704-I733 HydrophobicContact CD2-CD1 4.4Å; L704-M744 HydrophobicContact CD2-CE 3.16Å; L704-M744 HydrophobicContact CD2-SD 3.8Å; L704-M756 HydrophobicContact CD2-CE 4.07Å; L704-L763 HydrophobicContact CD1-CD1 4.14Å; L704-L763 HydrophobicContact CD2-CD2 4.46Å
705	R	90.4	Very high	85	Confident	28 Å²	28	18.3 Å²	18.3	11%	0.106	10%	0.096	C	C	.	.	H	α-helix	trans	-61.9	-40.5	177.3	-71.1	172.9	-178.2	-172.6	0.4	112.4	V484 V489 F701 S702 I703 A707 V708 E709 M756	V484-R705 HydrophobicContact CG1-CB 3.78Å; V484-R705 HydrophobicContact CG2-CB 3.94Å; V489-R705 HydrophobicContact CG1-CB 4.46Å; V489-R705 HydrophobicContact CG1-CG 4.39Å; F701-R705 WeakPolarHBondContact O-CB 3.37Å; F701-R705 VanDerWaalsContact O-CG 3.27Å; F701-R705 WeakPolarHBondContact O-CG 3.47Å; F701-R705 PolarHBondContact O-N 3.4Å; S702-R705 PolarHBondContact O-N 3.38Å; I703-R705 PolarHBondContact O-N 3.34Å; R705-A707 VanDerWaalsContact C-N 3.33Å; R705-V708 PolarHBondContact O-N 3.44Å; R705-E709 PolarHBondContact O-N 3.15Å; R705-M756 HydrophobicContact CG-CE 4.4Å; R705-M756 HydrophobicContact CG-SD 3.86Å
706	L	89.7	Confident	85	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-63.1	-40.3	173.7	-72.4	174.5	0	0	0	111.7	L479 W482 V484 M528 S702 I703 L704 V708 E709 C710	L479-L706 HydrophobicContact CD2-CD1 3.56Å; W482-L706 HydrophobicContact CB-CD1 4.42Å; W482-L706 HydrophobicContact CD2-CD1 3.95Å; W482-L706 HydrophobicContact CD2-CD2 4.14Å; W482-L706 HydrophobicContact CE3-CD1 4.14Å; W482-L706 HydrophobicContact CG-CD1 4.08Å; W482-L706 HydrophobicContact CG-CD2 3.99Å; V484-L706 HydrophobicContact CB-CD2 4.27Å; V484-L706 HydrophobicContact CG2-CD2 3.52Å; V484-L706 HydrophobicContact CG2-CG 3.59Å; M528-L706 HydrophobicContact CE-CB 3.52Å; M528-L706 WeakPolarHBondContact CE-O 3.43Å; S702-L706 WeakPolarHBondContact O-CG 3.21Å; S702-L706 PolarHBondContact O-N 3.33Å; I703-L706 PolarHBondContact O-N 2.96Å; L704-L706 VanDerWaalsContact C-N 3.34Å; L704-L706 PolarHBondContact O-N 2.96Å; L706-V708 VanDerWaalsContact C-N 3.34Å; L706-E709 WeakPolarHBondContact O-CB 3.25Å; L706-E709 PolarHBondContact O-N 3.02Å; L706-C710 WeakPolarHBondContact O-CB 3.49Å; L706-C710 PolarHBondContact O-N 3.29Å; L706-C710 PolarHBondContact O-SG 3.33Å
707	A	90.9	Very high	84.8	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.1	-42.6	179.1	0	0	0	0	0	110.2	M528 I703 L704 R705 E709 C710 T711 A722 T725 I726	M528-A707 VanDerWaalsContact CE-CA 3.45Å; M528-A707 HydrophobicContact CE-CB 4.05Å; M528-A707 VanDerWaalsContact CE-N 3.27Å; M528-A707 HydrophobicContact SD-CB 4Å; I703-A707 WeakPolarHBondContact O-CB 3.41Å; I703-A707 PolarHBondContact O-N 3.06Å; L704-A707 WeakPolarHBondContact O-CB 3.36Å; L704-A707 PolarHBondContact O-N 3.45Å; L704-A707 VanDerWaalsContact O-N 3.14Å; R705-A707 VanDerWaalsContact C-N 3.33Å; A707-E709 PolarHBondContact O-N 3.26Å; A707-C710 PolarHBondContact O-N 3.18Å; A707-T711 WeakPolarHBondContact O-CG2 3.06Å; A707-T711 PolarHBondContact O-N 3.25Å; A707-A722 WeakPolarHBondContact O-CB 3.46Å; A707-T725 HydrophobicContact CB-CG2 3.9Å; A707-I726 HydrophobicContact CB-CD1 4.49Å; A707-I726 HydrophobicContact CB-CG1 3.74Å
708	V	88.7	Confident	84.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.2	-45.6	173.4	174.7	0	0	0	0	111.5	V489 L704 R705 L706 C710 T711 I726 M755 M756 A759	V489-V708 HydrophobicContact CG1-CG1 4.09Å; L704-V708 VanDerWaalsContact O-CG2 3.29Å; L704-V708 WeakPolarHBondContact O-CG2 3.49Å; L704-V708 PolarHBondContact O-N 3.33Å; R705-V708 PolarHBondContact O-N 3.44Å; L706-V708 VanDerWaalsContact C-N 3.34Å; V708-C710 VanDerWaalsContact C-N 3.3Å; V708-C710 PolarHBondContact O-N 3.33Å; V708-T711 PolarHBondContact O-N 3.17Å; V708-T711 VanDerWaalsContact O-N 3.17Å; V708-T711 PolarHBondContact O-OG1 3.02Å; V708-I726 HydrophobicContact CG2-CD1 4.23Å; V708-M755 HydrophobicContact CG1-CB 3.61Å; V708-M755 HydrophobicContact CG1-CE 4.07Å; V708-M756 HydrophobicContact CG2-SD 4.16Å; V708-A759 HydrophobicContact CG2-CB 3.4Å; V708-A759 VanDerWaalsContact CG2-CB 3.4Å
709	E	86.5	Confident	84.9	Confident	7 Å²	7	21.5 Å²	21.5	3%	0.033	11%	0.113	C	C	.	.	H	α-helix	trans	-57.2	-43.8	174	-173.4	-176.5	153.8	0	0	111.6	K485 V489 R705 L706 A707 T711 L712	K485-E709 PolarHBondContact N-OE2 3.38Å; V489-E709 HydrophobicContact CG2-CB 3.93Å; R705-E709 PolarHBondContact O-N 3.15Å; L706-E709 WeakPolarHBondContact O-CB 3.25Å; L706-E709 PolarHBondContact O-N 3.02Å; A707-E709 PolarHBondContact O-N 3.26Å; E709-T711 VanDerWaalsContact C-N 3.29Å; E709-T711 PolarHBondContact O-N 3.26Å; E709-L712 WeakPolarHBondContact O-CB 3.16Å; E709-L712 PolarHBondContact O-N 2.87Å
710	C	86.3	Confident	84.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-71.2	-19.4	-179.7	-66.2	0	0	0	0	113.9	M528 L706 A707 V708 L712 D713 L718 A722	M528-C710 HydrophobicContact CE-CB 4.42Å; L706-C710 WeakPolarHBondContact O-CB 3.49Å; L706-C710 PolarHBondContact O-N 3.29Å; L706-C710 PolarHBondContact O-SG 3.33Å; A707-C710 PolarHBondContact O-N 3.18Å; V708-C710 VanDerWaalsContact C-N 3.3Å; V708-C710 PolarHBondContact O-N 3.33Å; C710-L712 PolarHBondContact O-N 3.43Å; C710-D713 WeakPolarHBondContact O-CB 3.47Å; C710-D713 PolarHBondContact O-N 3Å; C710-L718 HydrophobicContact CB-CD1 4.12Å; C710-L718 HydrophobicContact CB-CD2 4.43Å; C710-L718 HydrophobicContact CB-CG 4.1Å; C710-A722 HydrophobicContact CB-CB 3.63Å
711	T	83.6	Confident	84.8	Confident	5 Å²	5	25.1 Å²	25.1	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-69	-19.2	172.6	58	0	0	0	0	113.4	A707 V708 E709 D713 R719 A722 I726	A707-T711 WeakPolarHBondContact O-CG2 3.06Å; A707-T711 PolarHBondContact O-N 3.25Å; V708-T711 PolarHBondContact O-N 3.17Å; V708-T711 VanDerWaalsContact O-N 3.17Å; V708-T711 PolarHBondContact O-OG1 3.02Å; E709-T711 VanDerWaalsContact C-N 3.29Å; E709-T711 PolarHBondContact O-N 3.26Å; T711-D713 VanDerWaalsContact C-N 3.32Å; T711-R719 VanDerWaalsContact O-CD 3.3Å; T711-R719 WeakPolarHBondContact O-CD 2.9Å; T711-A722 HydrophobicContact CG2-CB 3.94Å; T711-I726 HydrophobicContact CG2-CD1 3.59Å
712	L	79.9	Confident	85	Confident	7 Å²	7	24 Å²	24	4%	0.037	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-11.7	177.8	-65.7	159	0	0	0	112.9	V488 E709 C710 M755 P927 L929	V488-L712 HydrophobicContact CG1-CD1 3.55Å; E709-L712 WeakPolarHBondContact O-CB 3.16Å; E709-L712 PolarHBondContact O-N 2.87Å; C710-L712 PolarHBondContact O-N 3.43Å; L712-M755 HydrophobicContact CD1-CG 4.26Å; L712-M755 HydrophobicContact CD2-CE 4.03Å; L712-M755 HydrophobicContact CD2-CG 4.24Å; L712-M755 HydrophobicContact CD2-SD 4.05Å; L712-M755 HydrophobicContact CG-CE 4.11Å; L712-P927 WeakPolarHBondContact CD2-O 3.33Å; L712-L929 HydrophobicContact CB-CD1 4.44Å; L712-L929 WeakPolarHBondContact O-CD1 3.39Å; L712-L929 PolarHBondContact O-N 3.21Å
713	D	78.5	Confident	85	Confident	14 Å²	14	24.6 Å²	24.6	8%	0.075	13%	0.125	C	C	.	.	S	Bend	trans	-72.1	153.2	-171.4	-157.6	-83.6	0	0	0	113.3	R524 C710 T711 N715 L718 R719	R524-D713 IonicContact CZ-OD2 3.16Å; R524-D713 IonicContact NH1-OD2 3.49Å; R524-D713 PolarHBondContact NH1-OD2 3.43Å; R524-D713 IonicContact NH2-OD1 2.79Å; R524-D713 IonicContact NH2-OD2 2.77Å; R524-D713 PolarHBondContact NH2-OD2 3.32Å; C710-D713 WeakPolarHBondContact O-CB 3.47Å; C710-D713 PolarHBondContact O-N 3Å; T711-D713 VanDerWaalsContact C-N 3.32Å; D713-N715 VanDerWaalsContact C-N 3.33Å; D713-N715 PolarHBondContact O-N 2.97Å; D713-N715 PolarHBondContact OD1-N 2.96Å; D713-L718 HydrophobicContact CB-CD2 3.96Å; D713-R719 WeakPolarHBondContact O-CD 3.42Å; D713-R719 VanDerWaalsContact O-CG 3.23Å; D713-R719 WeakPolarHBondContact O-CG 3.37Å; D713-R719 PolarHBondContact O-NH1 2.65Å
714	E	71.8	Confident	85.1	Confident	125 Å²	125	27.8 Å²	27.8	58%	0.584	14%	0.138	S	C	*	.	S	Bend	trans	-74.1	-21.6	179.5	-69	176.8	-177.6	0	0	113	R719	E714-R719 PolarHBondContact O-NH1 3Å
715	N	80.9	Confident	85.1	Confident	41 Å²	41	27.8 Å²	27.8	22%	0.219	14%	0.138	C	C	.	.			trans	-80.8	121.6	-179.2	-173	-77.4	0	0	0	113.3	W521 D713 G717 L718 R719	W521-N715 HydrophobicContact CB-CB 4.46Å; W521-N715 VanDerWaalsContact CD2-ND2 3.34Å; D713-N715 VanDerWaalsContact C-N 3.33Å; D713-N715 PolarHBondContact O-N 2.97Å; D713-N715 PolarHBondContact OD1-N 2.96Å; N715-G717 PolarHBondContact O-N 2.96Å; N715-G717 WeakPolarHBondContact OD1-CA 3.47Å; N715-G717 PolarHBondContact OD1-N 3.08Å; N715-L718 HydrophobicContact CB-CB 4.15Å; N715-L718 PolarHBondContact O-N 3.45Å; N715-L718 PolarHBondContact OD1-N 3.2Å; N715-R719 WeakPolarHBondContact O-CG 3.14Å; N715-R719 PolarHBondContact O-N 3.11Å
716	D	77.5	Confident	85.2	Confident	113 Å²	113	26.4 Å²	26.4	60%	0.604	13%	0.133	S	C	*	.	H	α-helix	trans	-60.7	-43	-178.2	-67.5	24.4	0	0	0	113.3	L718 R719 H720	D716-L718 PolarHBondContact O-N 3.32Å; D716-R719 PolarHBondContact O-N 3.43Å; D716-R719 IonicContact OD1-CZ 3.52Å; D716-R719 IonicContact OD1-NH1 3.12Å; D716-R719 PolarHBondContact OD1-NH1 2.91Å; D716-R719 IonicContact OD1-NH2 3.76Å; D716-R719 PolarHBondContact OD1-NH2 3.4Å; D716-R719 IonicContact OD2-NH2 2.93Å; D716-H720 WeakPolarHBondContact O-CB 3.2Å; D716-H720 PolarHBondContact O-N 3.05Å
717	G	79.3	Confident	85.2	Confident	23 Å²	23	28.3 Å²	28.3	24%	0.237	14%	0.144	C	C	.	.	H	α-helix	trans	-64.8	-38.7	179.5	0	0	0	0	0	112.8	N715 S721	N715-G717 PolarHBondContact O-N 2.96Å; N715-G717 WeakPolarHBondContact OD1-CA 3.47Å; N715-G717 PolarHBondContact OD1-N 3.08Å; G717-S721 WeakPolarHBondContact O-CB 3.45Å; G717-S721 PolarHBondContact O-N 3.3Å; G717-S721 VanDerWaalsContact O-N 3.07Å; G717-S721 PolarHBondContact O-OG 2.7Å
718	L	85.7	Confident	85.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68.5	-45.7	174.3	179.9	58.6	0	0	0	111.5	R524 E525 M528 C710 D713 N715 D716 H720 S721 A722	R524-L718 HydrophobicContact CB-CD1 3.84Å; R524-L718 HydrophobicContact CB-CD2 4.05Å; E525-L718 HydrophobicContact CB-CD1 4.2Å; M528-L718 HydrophobicContact CG-CD1 4.2Å; C710-L718 HydrophobicContact CB-CD1 4.12Å; C710-L718 HydrophobicContact CB-CD2 4.43Å; C710-L718 HydrophobicContact CB-CG 4.1Å; D713-L718 HydrophobicContact CB-CD2 3.96Å; N715-L718 HydrophobicContact CB-CB 4.15Å; N715-L718 PolarHBondContact O-N 3.45Å; N715-L718 PolarHBondContact OD1-N 3.2Å; D716-L718 PolarHBondContact O-N 3.32Å; L718-H720 PolarHBondContact O-N 3.45Å; L718-S721 PolarHBondContact O-N 3.22Å; L718-A722 WeakPolarHBondContact O-CB 3.24Å; L718-A722 PolarHBondContact O-N 3.44Å
719	R	84.6	Confident	85.4	Confident	30 Å²	30	29.2 Å²	29.2	11%	0.113	15%	0.148	C	C	.	.	H	α-helix	trans	-59.8	-45	176.6	-74.1	-160.1	-55.1	-79.7	-0	112	T711 D713 E714 N715 D716 S721 A722 Q723	T711-R719 VanDerWaalsContact O-CD 3.3Å; T711-R719 WeakPolarHBondContact O-CD 2.9Å; D713-R719 WeakPolarHBondContact O-CD 3.42Å; D713-R719 VanDerWaalsContact O-CG 3.23Å; D713-R719 WeakPolarHBondContact O-CG 3.37Å; D713-R719 PolarHBondContact O-NH1 2.65Å; E714-R719 PolarHBondContact O-NH1 3Å; N715-R719 WeakPolarHBondContact O-CG 3.14Å; N715-R719 PolarHBondContact O-N 3.11Å; D716-R719 PolarHBondContact O-N 3.43Å; D716-R719 IonicContact OD1-CZ 3.52Å; D716-R719 IonicContact OD1-NH1 3.12Å; D716-R719 PolarHBondContact OD1-NH1 2.91Å; D716-R719 IonicContact OD1-NH2 3.76Å; D716-R719 PolarHBondContact OD1-NH2 3.4Å; D716-R719 IonicContact OD2-NH2 2.93Å; R719-S721 PolarHBondContact O-N 3.45Å; R719-A722 WeakPolarHBondContact O-CB 3.44Å; R719-A722 PolarHBondContact O-N 3.05Å; R719-Q723 WeakPolarHBondContact O-CB 3.39Å; R719-Q723 PolarHBondContact O-N 3.11Å
720	H	85.3	Confident	85.5	Confident	78 Å²	78	28.9 Å²	28.9	36%	0.361	15%	0.147	S	C	.	.	H	α-helix	trans	-60.1	-46.6	176.9	-176.2	49.2	0	0	0	111.7	D716 L718 A722 Q723 K724	D716-H720 WeakPolarHBondContact O-CB 3.2Å; D716-H720 PolarHBondContact O-N 3.05Å; L718-H720 PolarHBondContact O-N 3.45Å; H720-A722 VanDerWaalsContact C-N 3.31Å; H720-A722 PolarHBondContact O-N 3.27Å; H720-Q723 PolarHBondContact O-N 3.4Å; H720-K724 VanDerWaalsContact CE1-CE 3.41Å; H720-K724 WeakPolarHBondContact CE1-CE 3.28Å; H720-K724 WeakPolarHBondContact NE2-CE 3.31Å; H720-K724 PolarHBondContact NE2-NZ 2.89Å; H720-K724 VanDerWaalsContact NE2-NZ 3.16Å; H720-K724 PolarHBondContact O-N 3.2Å
721	S	87.8	Confident	85.6	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.014	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-41.5	176.8	-61	0	0	0	0	111.2	G717 L718 R719 T725	G717-S721 WeakPolarHBondContact O-CB 3.45Å; G717-S721 PolarHBondContact O-N 3.3Å; G717-S721 VanDerWaalsContact O-N 3.07Å; G717-S721 PolarHBondContact O-OG 2.7Å; L718-S721 PolarHBondContact O-N 3.22Å; R719-S721 PolarHBondContact O-N 3.45Å; S721-T725 WeakPolarHBondContact O-CB 3.49Å; S721-T725 PolarHBondContact O-N 3.18Å; S721-T725 PolarHBondContact O-OG1 3.39Å
722	A	90	Very high	85.9	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.4	-43.4	176.8	0	0	0	0	0	112.6	A707 C710 T711 L718 R719 H720 K724 T725 I726	A707-A722 WeakPolarHBondContact O-CB 3.46Å; C710-A722 HydrophobicContact CB-CB 3.63Å; T711-A722 HydrophobicContact CG2-CB 3.94Å; L718-A722 WeakPolarHBondContact O-CB 3.24Å; L718-A722 PolarHBondContact O-N 3.44Å; R719-A722 WeakPolarHBondContact O-CB 3.44Å; R719-A722 PolarHBondContact O-N 3.05Å; H720-A722 VanDerWaalsContact C-N 3.31Å; H720-A722 PolarHBondContact O-N 3.27Å; A722-K724 VanDerWaalsContact C-N 3.35Å; A722-K724 PolarHBondContact O-N 3.29Å; A722-T725 CarbonylContact O-C 3.57Å; A722-T725 WeakPolarHBondContact O-CA 3.21Å; A722-T725 WeakPolarHBondContact O-CB 3.46Å; A722-T725 PolarHBondContact O-N 2.86Å; A722-T725 VanDerWaalsContact O-N 3.11Å; A722-I726 WeakPolarHBondContact O-CG1 3.5Å; A722-I726 PolarHBondContact O-N 2.9Å
723	Q	88.5	Confident	86.4	Confident	40 Å²	40	33.3 Å²	33.3	19%	0.187	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-39.8	178.6	-172	70.5	-23.9	0	0	111.6	R719 H720 I726 N727 Y758 K762	R719-Q723 WeakPolarHBondContact O-CB 3.39Å; R719-Q723 PolarHBondContact O-N 3.11Å; H720-Q723 PolarHBondContact O-N 3.4Å; Q723-I726 PolarHBondContact O-N 3.35Å; Q723-N727 PolarHBondContact O-N 2.97Å; Q723-N727 PolarHBondContact O-OD1 3.18Å; Q723-Y758 PolarHBondContact NE2-OH 3.5Å; Q723-Y758 VanDerWaalsContact NE2-OH 3.08Å; Q723-Y758 PolarHBondContact OE1-OH 3.28Å; Q723-K762 VanDerWaalsContact NE2-CE 3.28Å; Q723-K762 PolarHBondContact O-NZ 2.96Å
724	K	90.4	Very high	86.8	Confident	69 Å²	69	33.1 Å²	33.1	30%	0.3	16%	0.161	S	C	.	.	H	α-helix	trans	-63.5	-42.8	169.9	-76.5	179.6	173.2	173.3	0	111.8	Y532 H720 A722 I726 N727 D728	Y532-K724 HydrophobicContact CD1-CB 3.97Å; Y532-K724 HydrophobicContact CE1-CB 4.31Å; Y532-K724 HydrophobicContact CE1-CD 4.4Å; Y532-K724 HydrophobicContact CG-CB 4.16Å; H720-K724 VanDerWaalsContact CE1-CE 3.41Å; H720-K724 WeakPolarHBondContact CE1-CE 3.28Å; H720-K724 WeakPolarHBondContact NE2-CE 3.31Å; H720-K724 PolarHBondContact NE2-NZ 2.89Å; H720-K724 VanDerWaalsContact NE2-NZ 3.16Å; H720-K724 PolarHBondContact O-N 3.2Å; A722-K724 VanDerWaalsContact C-N 3.35Å; A722-K724 PolarHBondContact O-N 3.29Å; K724-I726 PolarHBondContact O-N 2.99Å; K724-N727 PolarHBondContact O-N 2.97Å; K724-D728 PolarHBondContact O-N 3.12Å
725	T	91.9	Very high	87.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60	-44	175.3	-60.1	0	0	0	0	112.3	M528 I703 A707 S721 A722 N727 D728 V729	M528-T725 PolarHBondContact O-OG1 3.06Å; M528-T725 HydrophobicContact SD-CG2 3.93Å; I703-T725 HydrophobicContact CG2-CG2 3.91Å; A707-T725 HydrophobicContact CB-CG2 3.9Å; S721-T725 WeakPolarHBondContact O-CB 3.49Å; S721-T725 PolarHBondContact O-N 3.18Å; S721-T725 PolarHBondContact O-OG1 3.39Å; A722-T725 CarbonylContact O-C 3.57Å; A722-T725 WeakPolarHBondContact O-CA 3.21Å; A722-T725 WeakPolarHBondContact O-CB 3.46Å; A722-T725 PolarHBondContact O-N 2.86Å; A722-T725 VanDerWaalsContact O-N 3.11Å; T725-N727 VanDerWaalsContact C-N 3.27Å; T725-N727 PolarHBondContact O-N 3.37Å; T725-D728 PolarHBondContact O-N 2.69Å; T725-V729 HydrophobicContact CG2-CG2 3.61Å; T725-V729 WeakPolarHBondContact O-CB 3.4Å; T725-V729 WeakPolarHBondContact O-CG2 3.4Å; T725-V729 PolarHBondContact O-N 2.81Å
726	I	92.3	Very high	87.7	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.4	-42.8	175.8	-66.3	168	0	0	0	110.6	L704 A707 V708 T711 A722 Q723 K724 G730 Y758 K762 L763	L704-I726 HydrophobicContact CD1-CG1 4.34Å; L704-I726 HydrophobicContact CD1-CG2 4.26Å; A707-I726 HydrophobicContact CB-CD1 4.49Å; A707-I726 HydrophobicContact CB-CG1 3.74Å; V708-I726 HydrophobicContact CG2-CD1 4.23Å; T711-I726 HydrophobicContact CG2-CD1 3.59Å; A722-I726 WeakPolarHBondContact O-CG1 3.5Å; A722-I726 PolarHBondContact O-N 2.9Å; Q723-I726 PolarHBondContact O-N 3.35Å; K724-I726 PolarHBondContact O-N 2.99Å; I726-G730 WeakPolarHBondContact O-CA 3.38Å; I726-G730 PolarHBondContact O-N 2.74Å; I726-Y758 HydrophobicContact CD1-CE1 4.45Å; I726-K762 HydrophobicContact CG2-CD 3.89Å; I726-L763 HydrophobicContact CG2-CD1 3.8Å
727	N	89.8	Confident	88	Confident	41 Å²	41	22.6 Å²	22.6	22%	0.219	11%	0.106	C	C	.	.	H	α-helix	trans	-68.1	-52.9	-179.6	-69.6	-0.6	0	0	0	112.4	Q723 K724 T725 G730 R731 K762	Q723-N727 PolarHBondContact O-N 2.97Å; Q723-N727 PolarHBondContact O-OD1 3.18Å; K724-N727 PolarHBondContact O-N 2.97Å; T725-N727 VanDerWaalsContact C-N 3.27Å; T725-N727 PolarHBondContact O-N 3.37Å; N727-G730 PolarHBondContact O-N 2.7Å; N727-R731 WeakPolarHBondContact O-CB 3.44Å; N727-R731 PolarHBondContact O-N 3.45Å; N727-K762 WeakPolarHBondContact OD1-CE 3.42Å; N727-K762 PolarHBondContact OD1-NZ 3.3Å
728	D	90.9	Very high	88.1	Confident	16 Å²	16	21.7 Å²	21.7	9%	0.086	10%	0.096	C	C	.	.	H	α-helix	trans	-71.5	-38.6	-176	-75	-60.6	0	0	0	112.1	A535 R536 K724 T725 R731 L732	A535-D728 HydrophobicContact CB-CB 4.13Å; R536-D728 IonicContact CZ-OD1 3.28Å; R536-D728 IonicContact CZ-OD2 2.7Å; R536-D728 IonicContact NE-OD1 3.19Å; R536-D728 PolarHBondContact NE-OD1 2.95Å; R536-D728 IonicContact NE-OD2 3.01Å; R536-D728 PolarHBondContact NE-OD2 3.23Å; R536-D728 IonicContact NH2-OD1 3.05Å; R536-D728 IonicContact NH2-OD2 3.12Å; R536-D728 PolarHBondContact NH2-OD2 3.21Å; K724-D728 PolarHBondContact O-N 3.12Å; T725-D728 PolarHBondContact O-N 2.69Å; D728-R731 PolarHBondContact O-N 3.16Å; D728-L732 PolarHBondContact O-N 3.09Å
729	V	91.5	Very high	88	Confident	2 Å²	2	26 Å²	26	1%	0.012	12%	0.12	C	C	.	.	H	α-helix	trans	-70.2	-38.9	174.5	176.9	0	0	0	0	110.3	A535 L700 I703 T725 R731 L732 I733	A535-V729 HydrophobicContact CB-CG2 3.99Å; L700-V729 HydrophobicContact CD2-CG1 4.14Å; I703-V729 HydrophobicContact CG2-CG1 4.37Å; I703-V729 HydrophobicContact CG2-CG2 3.81Å; T725-V729 HydrophobicContact CG2-CG2 3.61Å; T725-V729 WeakPolarHBondContact O-CB 3.4Å; T725-V729 WeakPolarHBondContact O-CG2 3.4Å; T725-V729 PolarHBondContact O-N 2.81Å; V729-R731 VanDerWaalsContact C-N 3.31Å; V729-R731 PolarHBondContact O-N 2.94Å; V729-L732 CarbonylContact O-C 3.58Å; V729-L732 WeakPolarHBondContact O-CB 3.49Å; V729-L732 PolarHBondContact O-N 3.15Å; V729-L732 VanDerWaalsContact O-N 3.13Å; V729-I733 HydrophobicContact CG1-CD1 4.12Å; V729-I733 HydrophobicContact CG1-CG1 4.43Å; V729-I733 WeakPolarHBondContact O-CG1 3.48Å; V729-I733 PolarHBondContact O-N 3.35Å
730	G	88.8	Confident	88	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57.8	-44.6	172	0	0	0	0	0	112.1	I726 N727 I733 R734	I726-G730 WeakPolarHBondContact O-CA 3.38Å; I726-G730 PolarHBondContact O-N 2.74Å; N727-G730 PolarHBondContact O-N 2.7Å; G730-I733 PolarHBondContact O-N 3.4Å; G730-R734 WeakPolarHBondContact O-CG 3.43Å; G730-R734 PolarHBondContact O-N 2.95Å; G730-R734 VanDerWaalsContact O-N 3.09Å
731	R	89.1	Confident	88.1	Confident	99 Å²	99	21.3 Å²	21.3	37%	0.374	10%	0.099	S	C	.	.	H	α-helix	trans	-61.3	-43.3	172.4	-170.6	177.2	-175.8	176.7	2.4	111.9	V539 N727 D728 V729 I733 R734 W735	V539-R731 HydrophobicContact CG1-CG 4.33Å; V539-R731 HydrophobicContact CG2-CG 4.41Å; N727-R731 WeakPolarHBondContact O-CB 3.44Å; N727-R731 PolarHBondContact O-N 3.45Å; D728-R731 PolarHBondContact O-N 3.16Å; V729-R731 VanDerWaalsContact C-N 3.31Å; V729-R731 PolarHBondContact O-N 2.94Å; R731-I733 PolarHBondContact O-N 3.23Å; R731-R734 PolarHBondContact O-N 3.34Å; R731-W735 VanDerWaalsContact O-CD1 3.3Å; R731-W735 PolarHBondContact O-N 3.18Å; R731-W735 VanDerWaalsContact O-N 3.16Å
732	L	90.1	Very high	88	Confident	4 Å²	4	22 Å²	22	2%	0.021	10%	0.103	C	C	.	.	H	α-helix	trans	-61.6	-41.9	176	177.1	62.2	0	0	0	112.1	A535 L538 V539 L646 M696 L700 D728 V729 R734 W735 Y736	A535-L732 HydrophobicContact CB-CB 4.1Å; A535-L732 HydrophobicContact CB-CD2 3.95Å; L538-L732 HydrophobicContact CB-CD1 3.98Å; L538-L732 HydrophobicContact CD1-CD1 4.31Å; L538-L732 HydrophobicContact CD1-CD2 3.88Å; V539-L732 HydrophobicContact CG2-CB 4.01Å; V539-L732 HydrophobicContact CG2-CD1 3.97Å; L646-L732 HydrophobicContact CD1-CD1 3.9Å; L646-L732 HydrophobicContact CD2-CD1 3.7Å; L646-L732 HydrophobicContact CG-CD1 4.48Å; M696-L732 HydrophobicContact CE-CD2 4.2Å; L700-L732 HydrophobicContact CD2-CD2 3.55Å; L700-L732 HydrophobicContact CD2-CG 4.11Å; D728-L732 PolarHBondContact O-N 3.09Å; V729-L732 CarbonylContact O-C 3.58Å; V729-L732 WeakPolarHBondContact O-CB 3.49Å; V729-L732 PolarHBondContact O-N 3.15Å; V729-L732 VanDerWaalsContact O-N 3.13Å; L732-R734 PolarHBondContact O-N 3.26Å; L732-W735 PolarHBondContact O-N 3.35Å; L732-Y736 WeakPolarHBondContact O-CB 3.35Å; L732-Y736 PolarHBondContact O-N 2.99Å
733	I	89.8	Confident	87.9	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-58.2	-48.8	176.1	-71.1	166.6	0	0	0	109.9	L700 L704 V729 G730 R731 W735 Y736 D737 L740 M744 L763	L700-I733 HydrophobicContact CB-CD1 4.42Å; L700-I733 HydrophobicContact CB-CG1 4.11Å; L700-I733 HydrophobicContact CD1-CG1 4.1Å; L700-I733 HydrophobicContact CG-CG1 4.5Å; L704-I733 HydrophobicContact CD2-CD1 4.4Å; V729-I733 HydrophobicContact CG1-CD1 4.12Å; V729-I733 HydrophobicContact CG1-CG1 4.43Å; V729-I733 WeakPolarHBondContact O-CG1 3.48Å; V729-I733 PolarHBondContact O-N 3.35Å; G730-I733 PolarHBondContact O-N 3.4Å; R731-I733 PolarHBondContact O-N 3.23Å; I733-W735 VanDerWaalsContact C-N 3.29Å; I733-W735 PolarHBondContact O-N 3.02Å; I733-Y736 PolarHBondContact O-N 3.26Å; I733-D737 CarbonylContact O-C 3.55Å; I733-D737 PolarHBondContact O-N 3.29Å; I733-L740 HydrophobicContact CG2-CB 3.88Å; I733-M744 HydrophobicContact CD1-SD 4.33Å; I733-L763 HydrophobicContact CD1-CD2 4.21Å
734	R	87.4	Confident	87.8	Confident	10 Å²	10	23 Å²	23	4%	0.038	11%	0.107	C	C	.	.	H	α-helix	trans	-59.1	-36.2	179.6	-68.4	-167.7	-56.8	-93.1	3.5	113.5	G730 R731 L732 L741 L763 D766 E770 N801 L804	G730-R734 WeakPolarHBondContact O-CG 3.43Å; G730-R734 PolarHBondContact O-N 2.95Å; G730-R734 VanDerWaalsContact O-N 3.09Å; R731-R734 PolarHBondContact O-N 3.34Å; L732-R734 PolarHBondContact O-N 3.26Å; R734-L741 HydrophobicContact CG-CD2 3.94Å; R734-L763 PolarHBondContact NH1-O 3.42Å; R734-D766 VanDerWaalsContact NH1-CB 3.34Å; R734-E770 IonicContact CZ-OE2 2.75Å; R734-E770 IonicContact NE-OE2 3.14Å; R734-E770 PolarHBondContact NE-OE2 3.04Å; R734-E770 VanDerWaalsContact NE-OE2 3.15Å; R734-E770 IonicContact NH2-OE2 3.66Å; R734-E770 PolarHBondContact NH2-OE2 2.93Å; R734-E770 VanDerWaalsContact NH2-OE2 3.09Å; R734-N801 PolarHBondContact O-ND2 2.84Å; R734-L804 HydrophobicContact CB-CD1 4.5Å; R734-L804 HydrophobicContact CG-CD1 4.1Å; R734-L804 HydrophobicContact CG-CD2 4.48Å
735	W	85.7	Confident	87.8	Confident	26 Å²	26	19.7 Å²	19.7	10%	0.098	9%	0.093	C	C	.	.	H	α-helix	trans	-89.5	-24.4	-179.6	-78	93.6	0	0	0	113.9	H542 L543 L546 L646 R731 L732 I733 E770 I799 N801	H542-W735 AromaticContact CD2-CE3 3.64Å; H542-W735 AromaticContact NE2-CE3 3.47Å; L543-W735 HydrophobicContact CD2-CE3 4.38Å; L543-W735 HydrophobicContact CD2-CH2 3.75Å; L543-W735 HydrophobicContact CD2-CZ2 3.9Å; L543-W735 HydrophobicContact CD2-CZ3 4.01Å; L546-W735 HydrophobicContact CD1-CZ3 4.01Å; L646-W735 HydrophobicContact CD1-CB 4.4Å; R731-W735 VanDerWaalsContact O-CD1 3.3Å; R731-W735 PolarHBondContact O-N 3.18Å; R731-W735 VanDerWaalsContact O-N 3.16Å; L732-W735 PolarHBondContact O-N 3.35Å; I733-W735 VanDerWaalsContact C-N 3.29Å; I733-W735 PolarHBondContact O-N 3.02Å; W735-E770 PolarHBondContact NE1-OE1 3.46Å; W735-I799 HydrophobicContact CH2-CB 4.25Å; W735-I799 HydrophobicContact CH2-CG2 4.01Å; W735-I799 HydrophobicContact CZ3-CG2 4.3Å; W735-N801 HydrophobicContact CH2-CB 4Å; W735-N801 HydrophobicContact CZ2-CB 3.98Å; W735-N801 HydrophobicContact CZ3-CB 4.34Å
736	Y	85.7	Confident	87.6	Confident	11 Å²	11	23.1 Å²	23.1	4%	0.043	11%	0.114	C	C	.	.	H	α-helix	trans	-74.3	-54.4	176	176.3	-111.2	0	0	0	111.1	L646 I649 R650 D653 M696 L700 L732 I733 L740	L646-Y736 HydrophobicContact CB-CD2 4.35Å; L646-Y736 HydrophobicContact CD2-CD2 4.3Å; I649-Y736 HydrophobicContact CB-CE2 4.26Å; I649-Y736 HydrophobicContact CG2-CE2 3.91Å; R650-Y736 HydrophobicContact CB-CE2 3.85Å; R650-Y736 HydrophobicContact CG-CE2 4.46Å; D653-Y736 PolarHBondContact OD2-OH 3.48Å; M696-Y736 HydrophobicContact CB-CE1 4.21Å; M696-Y736 HydrophobicContact CB-CE2 4.37Å; M696-Y736 HydrophobicContact CG-CE1 4.25Å; M696-Y736 HydrophobicContact CG-CE2 4.15Å; L700-Y736 HydrophobicContact CD1-CD1 3.95Å; L700-Y736 HydrophobicContact CD1-CG 4.35Å; L732-Y736 WeakPolarHBondContact O-CB 3.35Å; L732-Y736 PolarHBondContact O-N 2.99Å; I733-Y736 PolarHBondContact O-N 3.26Å; Y736-L740 HydrophobicContact CD1-CD1 3.74Å; Y736-L740 HydrophobicContact CE1-CD1 4.09Å
737	D	83.2	Confident	87.4	Confident	21 Å²	21	27.3 Å²	27.3	11%	0.112	14%	0.136	C	C	.	.			trans	-159.5	106.2	179.2	-173.3	-7.8	0	0	0	109.6	R650 I733 D739 L740	R650-D737 IonicContact CZ-OD1 3.34Å; R650-D737 IonicContact CZ-OD2 3.62Å; R650-D737 VanDerWaalsContact CZ-OD2 3.27Å; R650-D737 IonicContact NE-OD2 3.39Å; R650-D737 PolarHBondContact NE-OD2 3.01Å; R650-D737 IonicContact NH1-OD1 3.27Å; R650-D737 IonicContact NH2-OD1 2.73Å; R650-D737 PolarHBondContact NH2-OD1 3.39Å; R650-D737 IonicContact NH2-OD2 2.73Å; R650-D737 PolarHBondContact NH2-OD2 3.44Å; I733-D737 CarbonylContact O-C 3.55Å; I733-D737 PolarHBondContact O-N 3.29Å; D737-D739 PolarHBondContact O-N 3.09Å; D737-D739 VanDerWaalsContact OD1-CB 3.32Å; D737-D739 WeakPolarHBondContact OD1-CB 3.25Å; D737-D739 PolarHBondContact OD1-N 3.37Å; D737-L740 HydrophobicContact CB-CD1 3.93Å; D737-L740 HydrophobicContact CB-CG 3.83Å; D737-L740 VanDerWaalsContact O-CB 3.32Å; D737-L740 WeakPolarHBondContact O-CB 3.15Å; D737-L740 PolarHBondContact O-N 3.37Å
738	A	81.9	Confident	87.4	Confident	4 Å²	4	25.9 Å²	25.9	3%	0.033	13%	0.128	C	C	.	.	H	α-helix	trans	-58.6	-28.2	179.7	0	0	0	0	0	112.6	L740 L741 L742 A803 L804	A738-L740 PolarHBondContact O-N 3.04Å; A738-L741 WeakPolarHBondContact O-CB 3.18Å; A738-L741 PolarHBondContact O-N 2.97Å; A738-L742 PolarHBondContact O-N 2.91Å; A738-A803 HydrophobicContact CB-CB 3.86Å; A738-L804 HydrophobicContact CB-CB 4.36Å
739	D	83.4	Confident	87.2	Confident	92 Å²	92	25.6 Å²	25.6	49%	0.492	13%	0.126	S	C	.	.	H	α-helix	trans	-64	-24.7	178.9	-60	-35.7	0	0	0	111.8	R650 D737 L742 E743	R650-D739 IonicContact NH2-OD2 3.31Å; D737-D739 PolarHBondContact O-N 3.09Å; D737-D739 VanDerWaalsContact OD1-CB 3.32Å; D737-D739 WeakPolarHBondContact OD1-CB 3.25Å; D737-D739 PolarHBondContact OD1-N 3.37Å; D739-L742 PolarHBondContact O-N 2.91Å; D739-E743 WeakPolarHBondContact O-CB 3.03Å; D739-E743 PolarHBondContact O-N 3.39Å
740	L	85.4	Confident	87	Confident	8 Å²	8	28.3 Å²	28.3	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-68.8	-36.3	174.9	-60.1	-179.1	0	0	0	112.4	K697 F701 I733 Y736 D737 A738 M744	K697-L740 HydrophobicContact CB-CD1 4.39Å; K697-L740 HydrophobicContact CB-CD2 4.35Å; K697-L740 HydrophobicContact CD-CD2 3.43Å; K697-L740 VanDerWaalsContact CD-CD2 3.43Å; K697-L740 HydrophobicContact CG-CD1 4.26Å; K697-L740 HydrophobicContact CG-CD2 3.6Å; F701-L740 HydrophobicContact CE2-CD2 4.3Å; I733-L740 HydrophobicContact CG2-CB 3.88Å; Y736-L740 HydrophobicContact CD1-CD1 3.74Å; Y736-L740 HydrophobicContact CE1-CD1 4.09Å; D737-L740 HydrophobicContact CB-CD1 3.93Å; D737-L740 HydrophobicContact CB-CG 3.83Å; D737-L740 VanDerWaalsContact O-CB 3.32Å; D737-L740 WeakPolarHBondContact O-CB 3.15Å; D737-L740 PolarHBondContact O-N 3.37Å; A738-L740 PolarHBondContact O-N 3.04Å; L740-M744 WeakPolarHBondContact O-CG 3.5Å; L740-M744 PolarHBondContact O-N 2.99Å
741	L	86.4	Confident	86.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67.2	-42.2	173.7	177.4	62.9	0	0	0	109.9	R734 A738 E743 M744 I745 L763 L804 L808	R734-L741 HydrophobicContact CG-CD2 3.94Å; A738-L741 WeakPolarHBondContact O-CB 3.18Å; A738-L741 PolarHBondContact O-N 2.97Å; L741-E743 VanDerWaalsContact C-N 3.33Å; L741-E743 PolarHBondContact O-N 3.27Å; L741-M744 WeakPolarHBondContact O-CB 3.32Å; L741-M744 PolarHBondContact O-N 3.19Å; L741-M744 VanDerWaalsContact O-N 3.14Å; L741-I745 HydrophobicContact CD1-CD1 4.45Å; L741-I745 HydrophobicContact CD1-CG1 4.38Å; L741-I745 HydrophobicContact CG-CD1 4.05Å; L741-I745 HydrophobicContact CG-CG1 4.41Å; L741-I745 VanDerWaalsContact O-CG1 3.29Å; L741-I745 WeakPolarHBondContact O-CG1 2.86Å; L741-I745 PolarHBondContact O-N 2.98Å; L741-L763 HydrophobicContact CD1-CB 3.77Å; L741-L763 HydrophobicContact CD1-CD2 4.08Å; L741-L804 HydrophobicContact CD2-CD1 3.61Å; L741-L808 HydrophobicContact CD2-CD2 4.27Å
742	L	85.5	Confident	86.4	Confident	18 Å²	18	30.6 Å²	30.6	9%	0.094	17%	0.166	C	C	.	.	H	α-helix	trans	-61.1	-44.5	177.3	-57.1	171.6	0	0	0	111.1	A738 D739 M744 I745 T746 G807 L808 I813	A738-L742 PolarHBondContact O-N 2.91Å; D739-L742 PolarHBondContact O-N 2.91Å; L742-M744 VanDerWaalsContact C-N 3.31Å; L742-M744 PolarHBondContact O-N 3.46Å; L742-I745 PolarHBondContact O-N 2.94Å; L742-T746 WeakPolarHBondContact O-CG2 3.3Å; L742-T746 PolarHBondContact O-N 3.14Å; L742-T746 PolarHBondContact O-OG1 2.88Å; L742-G807 VanDerWaalsContact CD1-CA 3.44Å; L742-G807 WeakPolarHBondContact CD2-O 3.48Å; L742-L808 HydrophobicContact CD2-CD2 4.32Å; L742-I813 HydrophobicContact CB-CD1 4.14Å; L742-I813 HydrophobicContact CD1-CD1 4.11Å; L742-I813 HydrophobicContact CD2-CD1 3.86Å; L742-I813 HydrophobicContact CD2-CG2 4.03Å; L742-I813 HydrophobicContact CG-CD1 4.24Å
743	E	87.5	Confident	86.2	Confident	58 Å²	58	30.9 Å²	30.9	27%	0.271	17%	0.168	S	C	.	.	H	α-helix	trans	-58.2	-44.1	173.4	-176.2	177.4	170.3	0	0	111.1	K697 D739 L741 I745 T746 L747	K697-E743 WeakPolarHBondContact CE-OE2 3.48Å; K697-E743 IonicContact NZ-OE1 2.96Å; K697-E743 PolarHBondContact NZ-OE1 3.3Å; K697-E743 IonicContact NZ-OE2 3.24Å; K697-E743 PolarHBondContact NZ-OE2 2.94Å; D739-E743 WeakPolarHBondContact O-CB 3.03Å; D739-E743 PolarHBondContact O-N 3.39Å; L741-E743 VanDerWaalsContact C-N 3.33Å; L741-E743 PolarHBondContact O-N 3.27Å; E743-I745 PolarHBondContact O-N 3.3Å; E743-T746 WeakPolarHBondContact CA-OG1 3.48Å; E743-T746 PolarHBondContact O-N 3.47Å; E743-T746 PolarHBondContact O-OG1 2.76Å; E743-L747 HydrophobicContact CG-CD1 3.48Å; E743-L747 VanDerWaalsContact CG-CD1 3.48Å; E743-L747 WeakPolarHBondContact O-CB 3.25Å; E743-L747 VanDerWaalsContact O-CD1 3.28Å; E743-L747 WeakPolarHBondContact O-CD1 3.47Å; E743-L747 PolarHBondContact O-N 3.35Å
744	M	88	Confident	86.2	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-44.6	174.5	-78.7	179.1	61	0	0	113.3	F701 L704 I733 L740 L741 L742 T746 L747 H748 M756 T760 L763	F701-M744 HydrophobicContact CD1-CG 4.4Å; F701-M744 HydrophobicContact CE1-CG 3.31Å; F701-M744 HydrophobicContact CE1-SD 3.9Å; F701-M744 HydrophobicContact CZ-CG 3.58Å; F701-M744 HydrophobicContact CZ-SD 4.23Å; L704-M744 HydrophobicContact CD2-CE 3.16Å; L704-M744 HydrophobicContact CD2-SD 3.8Å; I733-M744 HydrophobicContact CD1-SD 4.33Å; L740-M744 WeakPolarHBondContact O-CG 3.5Å; L740-M744 PolarHBondContact O-N 2.99Å; L741-M744 WeakPolarHBondContact O-CB 3.32Å; L741-M744 PolarHBondContact O-N 3.19Å; L741-M744 VanDerWaalsContact O-N 3.14Å; L742-M744 VanDerWaalsContact C-N 3.31Å; L742-M744 PolarHBondContact O-N 3.46Å; M744-T746 VanDerWaalsContact C-N 3.31Å; M744-T746 PolarHBondContact O-N 2.87Å; M744-L747 PolarHBondContact O-N 2.81Å; M744-H748 WeakPolarHBondContact O-CB 3.43Å; M744-H748 PolarHBondContact O-N 3.46Å; M744-M756 HydrophobicContact CE-CE 4.26Å; M744-T760 HydrophobicContact CB-CG2 4.11Å; M744-L763 HydrophobicContact CE-CD2 3.93Å; M744-L763 HydrophobicContact SD-CD2 4.16Å
745	I	89.1	Confident	86.1	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-57.6	-49.3	177.4	-67.4	170.2	0	0	0	108.7	L741 L742 E743 L747 M749 T760 L764 L808 M816 W817	L741-I745 HydrophobicContact CD1-CD1 4.45Å; L741-I745 HydrophobicContact CD1-CG1 4.38Å; L741-I745 HydrophobicContact CG-CD1 4.05Å; L741-I745 HydrophobicContact CG-CG1 4.41Å; L741-I745 VanDerWaalsContact O-CG1 3.29Å; L741-I745 WeakPolarHBondContact O-CG1 2.86Å; L741-I745 PolarHBondContact O-N 2.98Å; L742-I745 PolarHBondContact O-N 2.94Å; E743-I745 PolarHBondContact O-N 3.3Å; I745-L747 PolarHBondContact O-N 2.96Å; I745-M749 HydrophobicContact CB-SD 4.49Å; I745-M749 HydrophobicContact CG2-CG 4.33Å; I745-M749 HydrophobicContact CG2-SD 3.71Å; I745-M749 VanDerWaalsContact O-CB 3.32Å; I745-M749 WeakPolarHBondContact O-CB 3.35Å; I745-M749 PolarHBondContact O-N 3.13Å; I745-M749 VanDerWaalsContact O-N 3.13Å; I745-T760 HydrophobicContact CB-CG2 4.44Å; I745-T760 HydrophobicContact CG1-CG2 3.93Å; I745-L764 HydrophobicContact CD1-CD1 4.17Å; I745-L808 HydrophobicContact CD1-CD2 3.64Å; I745-M816 HydrophobicContact CB-CE 4.45Å; I745-M816 HydrophobicContact CG2-CE 3.45Å; I745-M816 VanDerWaalsContact CG2-CE 3.45Å; I745-W817 HydrophobicContact CG2-CB 3.77Å; I745-W817 HydrophobicContact CG2-CG 4.43Å
746	T	88.5	Confident	86.3	Confident	72 Å²	72	29.6 Å²	29.6	44%	0.442	16%	0.164	S	C	.	.	H	α-helix	trans	-65.4	-31.8	179.5	60.3	0	0	0	0	114.3	L742 E743 M744 M816	L742-T746 WeakPolarHBondContact O-CG2 3.3Å; L742-T746 PolarHBondContact O-N 3.14Å; L742-T746 PolarHBondContact O-OG1 2.88Å; E743-T746 WeakPolarHBondContact CA-OG1 3.48Å; E743-T746 PolarHBondContact O-N 3.47Å; E743-T746 PolarHBondContact O-OG1 2.76Å; M744-T746 VanDerWaalsContact C-N 3.31Å; M744-T746 PolarHBondContact O-N 2.87Å; T746-M816 HydrophobicContact CG2-CE 3.77Å; T746-M816 HydrophobicContact CG2-SD 4.1Å
747	L	88.3	Confident	86.5	Confident	88 Å²	88	29 Å²	29	46%	0.461	16%	0.162	S	C	.	.	H	α-helix	trans	-89.7	-28.4	-177.1	-94.2	116.1	0	0	0	114.6	E743 M744 I745	E743-L747 HydrophobicContact CG-CD1 3.48Å; E743-L747 VanDerWaalsContact CG-CD1 3.48Å; E743-L747 WeakPolarHBondContact O-CB 3.25Å; E743-L747 VanDerWaalsContact O-CD1 3.28Å; E743-L747 WeakPolarHBondContact O-CD1 3.47Å; E743-L747 PolarHBondContact O-N 3.35Å; M744-L747 PolarHBondContact O-N 2.81Å; I745-L747 PolarHBondContact O-N 2.96Å
748	H	88.9	Confident	86.8	Confident	12 Å²	12	28.7 Å²	28.7	6%	0.056	16%	0.159	C	C	.	.	H	α-helix	trans	-120.8	-13.2	-166.7	-64.5	-50.5	0	0	0	114.5	M744 V750 M756 S757 T760	M744-H748 WeakPolarHBondContact O-CB 3.43Å; M744-H748 PolarHBondContact O-N 3.46Å; H748-V750 PolarHBondContact O-N 3.14Å; H748-M756 HydrophobicContact CB-CB 4.07Å; H748-S757 WeakPolarHBondContact O-CA 3.35Å; H748-S757 VanDerWaalsContact O-CB 3.32Å; H748-S757 WeakPolarHBondContact O-CB 3.27Å; H748-S757 PolarHBondContact O-OG 3.2Å; H748-T760 WeakPolarHBondContact CB-OG1 3.29Å
749	M	88.1	Confident	87.1	Confident	10 Å²	10	28.5 Å²	28.5	5%	0.049	16%	0.157	C	C	.	.	S	Bend	trans	-81.5	79.6	165.2	-63.7	-166.9	67.8	0	0	108.9	I745 T760 L761 L764 W817 C820 Y824	I745-M749 HydrophobicContact CB-SD 4.49Å; I745-M749 HydrophobicContact CG2-CG 4.33Å; I745-M749 HydrophobicContact CG2-SD 3.71Å; I745-M749 VanDerWaalsContact O-CB 3.32Å; I745-M749 WeakPolarHBondContact O-CB 3.35Å; I745-M749 PolarHBondContact O-N 3.13Å; I745-M749 VanDerWaalsContact O-N 3.13Å; M749-T760 HydrophobicContact CG-CG2 4.09Å; M749-L761 HydrophobicContact CE-CD2 3.67Å; M749-L761 HydrophobicContact CE-CG 4.29Å; M749-L764 HydrophobicContact SD-CD2 4.33Å; M749-W817 HydrophobicContact CE-CB 4.05Å; M749-W817 HydrophobicContact SD-CB 3.69Å; M749-C820 HydrophobicContact CB-CB 4.27Å; M749-C820 HydrophobicContact CE-CB 3.68Å; M749-Y824 HydrophobicContact CE-CE2 4.21Å
750	V	86.6	Confident	87.5	Confident	59 Å²	59	24.1 Å²	24.1	36%	0.358	13%	0.134	S	C	.	.			trans	-122.8	156.4	-176.5	-64.9	0	0	0	0	110.7	H748 P752 T754 Y824	H748-V750 PolarHBondContact O-N 3.14Å; V750-P752 CarbonylContact O-C 3.45Å; V750-T754 HydrophobicContact CG2-CG2 4.38Å; V750-Y824 PolarHBondContact N-OH 2.88Å; V750-Y824 VanDerWaalsContact N-OH 3.09Å; V750-Y824 PolarHBondContact O-OH 2.85Å
751	D	82.5	Confident	87.8	Confident	86 Å²	86	23.7 Å²	23.7	46%	0.46	13%	0.132	S	C	.	.	S	Bend	trans	-113	126.8	173.2	-175.2	38	0	0	0	109.5	Q823	D751-Q823 VanDerWaalsContact CG-NE2 3.26Å; D751-Q823 PolarHBondContact OD2-NE2 3.41Å
752	P	82.7	Confident	88	Confident	61 Å²	61	23.8 Å²	23.8	40%	0.396	13%	0.132	S	C	.	.	S	Bend	cis	-69.5	150.4	-1.9	28.8	-36.3	0	0	0	114.4	P492 V750	P492-P752 HydrophobicContact CB-CB 4.13Å; P492-P752 HydrophobicContact CB-CG 3.64Å; P492-P752 HydrophobicContact CG-CG 3.82Å; V750-P752 CarbonylContact O-C 3.45Å
753	P	86.8	Confident	88.3	Confident	9 Å²	9	22.9 Å²	22.9	6%	0.058	13%	0.127	C	C	.	.			trans	-68.2	149.3	-175.8	27.1	-34.2	0	0	0	112.9	L493 Y824 T830 I834	L493-P753 WeakPolarHBondContact CB-O 3.46Å; L493-P753 HydrophobicContact CD1-CB 4.22Å; L493-P753 HydrophobicContact CD1-CG 4.34Å; L493-P753 WeakPolarHBondContact CG-O 3.43Å; L493-P753 PolarHBondContact N-O 2.77Å; P753-Y824 HydrophobicContact CB-CD1 4.39Å; P753-Y824 HydrophobicContact CB-CE1 3.85Å; P753-Y824 HydrophobicContact CG-CD1 4.47Å; P753-Y824 HydrophobicContact CG-CE1 4.27Å; P753-T830 HydrophobicContact CG-CG2 4.17Å; P753-I834 HydrophobicContact CB-CD1 3.65Å; P753-I834 HydrophobicContact CG-CD1 4.22Å
754	T	88.5	Confident	88.5	Confident	10 Å²	10	20.1 Å²	20.1	6%	0.061	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-117.9	172.1	178.9	66.5	0	0	0	0	110.8	L490 V750 M756 S757 Y758	L490-T754 VanDerWaalsContact O-CG2 3.29Å; L490-T754 WeakPolarHBondContact O-CG2 3.5Å; V750-T754 HydrophobicContact CG2-CG2 4.38Å; T754-M756 PolarHBondContact O-N 3.37Å; T754-M756 PolarHBondContact OG1-N 3.2Å; T754-S757 PolarHBondContact N-OG 3.22Å; T754-S757 WeakPolarHBondContact O-CA 3.28Å; T754-S757 WeakPolarHBondContact O-CB 3.44Å; T754-S757 PolarHBondContact O-N 3.35Å; T754-S757 PolarHBondContact O-OG 3.2Å; T754-S757 PolarHBondContact OG1-N 2.72Å; T754-S757 PolarHBondContact OG1-OG 3.16Å; T754-S757 VanDerWaalsContact OG1-OG 3.04Å; T754-Y758 PolarHBondContact O-N 3Å
755	M	85.7	Confident	88.7	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-63.8	-26	171.1	-78.9	-60.5	-60.4	0	0	112.9	L493 V708 L712 S757 Y758 A759 F833 P927	L493-M755 HydrophobicContact CD2-CG 3.92Å; L493-M755 HydrophobicContact CD2-SD 3.82Å; V708-M755 HydrophobicContact CG1-CB 3.61Å; V708-M755 HydrophobicContact CG1-CE 4.07Å; L712-M755 HydrophobicContact CD1-CG 4.26Å; L712-M755 HydrophobicContact CD2-CE 4.03Å; L712-M755 HydrophobicContact CD2-CG 4.24Å; L712-M755 HydrophobicContact CD2-SD 4.05Å; L712-M755 HydrophobicContact CG-CE 4.11Å; M755-S757 VanDerWaalsContact C-N 3.35Å; M755-Y758 HydrophobicContact CE-CD1 4.09Å; M755-Y758 WeakPolarHBondContact O-CB 3.49Å; M755-Y758 PolarHBondContact O-N 3.46Å; M755-A759 PolarHBondContact O-N 2.67Å; M755-F833 HydrophobicContact SD-CE2 4.45Å; M755-F833 HydrophobicContact SD-CZ 4.13Å; M755-P927 HydrophobicContact CE-CB 3.95Å; M755-P927 HydrophobicContact SD-CB 4.33Å
756	M	89.2	Confident	88.6	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70.6	-29.5	168.6	-75.2	-58.9	-57.8	0	0	113.2	V489 L490 L704 R705 V708 M744 H748 T754 Y758 A759 T760	V489-M756 HydrophobicContact CG1-CG 3.38Å; V489-M756 HydrophobicContact CG1-SD 3.58Å; V489-M756 VanDerWaalsContact CG1-SD 3.58Å; V489-M756 PolarHBondContact O-N 3.26Å; L490-M756 HydrophobicContact CD2-CB 4.37Å; L490-M756 HydrophobicContact CD2-CG 3.76Å; L704-M756 HydrophobicContact CD2-CE 4.07Å; R705-M756 HydrophobicContact CG-CE 4.4Å; R705-M756 HydrophobicContact CG-SD 3.86Å; V708-M756 HydrophobicContact CG2-SD 4.16Å; M744-M756 HydrophobicContact CE-CE 4.26Å; H748-M756 HydrophobicContact CB-CB 4.07Å; T754-M756 PolarHBondContact O-N 3.37Å; T754-M756 PolarHBondContact OG1-N 3.2Å; M756-Y758 VanDerWaalsContact C-N 3.3Å; M756-A759 PolarHBondContact O-N 3.33Å; M756-T760 WeakPolarHBondContact O-CB 3.43Å; M756-T760 PolarHBondContact O-N 3.18Å; M756-T760 PolarHBondContact O-OG1 2.73Å
757	S	90.2	Very high	88.5	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.4	-41.7	172.9	-47.1	0	0	0	0	110.2	H748 T754 M755 T760 L761	H748-S757 WeakPolarHBondContact O-CA 3.35Å; H748-S757 VanDerWaalsContact O-CB 3.32Å; H748-S757 WeakPolarHBondContact O-CB 3.27Å; H748-S757 PolarHBondContact O-OG 3.2Å; T754-S757 PolarHBondContact N-OG 3.22Å; T754-S757 WeakPolarHBondContact O-CA 3.28Å; T754-S757 WeakPolarHBondContact O-CB 3.44Å; T754-S757 PolarHBondContact O-N 3.35Å; T754-S757 PolarHBondContact O-OG 3.2Å; T754-S757 PolarHBondContact OG1-N 2.72Å; T754-S757 PolarHBondContact OG1-OG 3.16Å; T754-S757 VanDerWaalsContact OG1-OG 3.04Å; M755-S757 VanDerWaalsContact C-N 3.35Å; S757-T760 PolarHBondContact O-N 2.86Å; S757-L761 WeakPolarHBondContact O-CB 3.34Å; S757-L761 WeakPolarHBondContact O-CG 3.38Å; S757-L761 PolarHBondContact O-N 2.91Å
758	Y	89.1	Confident	88.4	Confident	13 Å²	13	14 Å²	14	5%	0.051	8%	0.079	C	C	.	.	H	α-helix	trans	-57.9	-50.5	171.7	164.5	-104.8	0	0	0	112.9	Q723 I726 T754 M755 M756 T760 L761 K762 F833 L837	Q723-Y758 PolarHBondContact NE2-OH 3.5Å; Q723-Y758 VanDerWaalsContact NE2-OH 3.08Å; Q723-Y758 PolarHBondContact OE1-OH 3.28Å; I726-Y758 HydrophobicContact CD1-CE1 4.45Å; T754-Y758 PolarHBondContact O-N 3Å; M755-Y758 HydrophobicContact CE-CD1 4.09Å; M755-Y758 WeakPolarHBondContact O-CB 3.49Å; M755-Y758 PolarHBondContact O-N 3.46Å; M756-Y758 VanDerWaalsContact C-N 3.3Å; Y758-T760 VanDerWaalsContact C-N 3.31Å; Y758-T760 PolarHBondContact O-N 3.48Å; Y758-L761 PolarHBondContact O-N 3.35Å; Y758-K762 WeakPolarHBondContact O-CB 3.44Å; Y758-K762 PolarHBondContact O-N 2.65Å; Y758-F833 AromaticContact CD2-CD2 3.53Å; Y758-F833 HydrophobicContact CD2-CD2 3.53Å; Y758-F833 AromaticContact CD2-CE2 3.88Å; Y758-F833 HydrophobicContact CD2-CE2 3.88Å; Y758-F833 HydrophobicContact CE2-CD2 4.1Å; Y758-F833 HydrophobicContact CG-CD2 4.15Å; Y758-F833 HydrophobicContact CG-CE2 4.02Å; Y758-L837 HydrophobicContact CD2-CD1 3.45Å; Y758-L837 VanDerWaalsContact CD2-CD1 3.45Å; Y758-L837 HydrophobicContact CE2-CD1 3.53Å
759	A	89.3	Confident	88.2	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-60	-44.7	179.2	0	0	0	0	0	111.5	V708 M755 M756 K762 L763	V708-A759 HydrophobicContact CG2-CB 3.4Å; V708-A759 VanDerWaalsContact CG2-CB 3.4Å; M755-A759 PolarHBondContact O-N 2.67Å; M756-A759 PolarHBondContact O-N 3.33Å; A759-K762 WeakPolarHBondContact O-CB 3.37Å; A759-K762 PolarHBondContact O-N 2.68Å; A759-L763 WeakPolarHBondContact O-CD1 3.49Å; A759-L763 PolarHBondContact O-N 3.04Å
760	T	92	Very high	87.7	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.6	-44.2	-178.6	-53.8	0	0	0	0	111.4	M744 I745 H748 M749 M756 S757 Y758 K762 L763 L764	M744-T760 HydrophobicContact CB-CG2 4.11Å; I745-T760 HydrophobicContact CB-CG2 4.44Å; I745-T760 HydrophobicContact CG1-CG2 3.93Å; H748-T760 WeakPolarHBondContact CB-OG1 3.29Å; M749-T760 HydrophobicContact CG-CG2 4.09Å; M756-T760 WeakPolarHBondContact O-CB 3.43Å; M756-T760 PolarHBondContact O-N 3.18Å; M756-T760 PolarHBondContact O-OG1 2.73Å; S757-T760 PolarHBondContact O-N 2.86Å; Y758-T760 VanDerWaalsContact C-N 3.31Å; Y758-T760 PolarHBondContact O-N 3.48Å; T760-K762 VanDerWaalsContact C-N 3.3Å; T760-K762 PolarHBondContact O-N 3.22Å; T760-L763 PolarHBondContact O-N 3.33Å; T760-L764 WeakPolarHBondContact O-CB 3.44Å; T760-L764 PolarHBondContact O-N 2.96Å
761	L	91.3	Very high	87.4	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-60.4	-39.6	173	-83	166.8	0	0	0	112.2	M749 S757 Y758 L764 R765 Y824 I834 L837	M749-L761 HydrophobicContact CE-CD2 3.67Å; M749-L761 HydrophobicContact CE-CG 4.29Å; S757-L761 WeakPolarHBondContact O-CB 3.34Å; S757-L761 WeakPolarHBondContact O-CG 3.38Å; S757-L761 PolarHBondContact O-N 2.91Å; Y758-L761 PolarHBondContact O-N 3.35Å; L761-L764 PolarHBondContact O-N 2.85Å; L761-R765 WeakPolarHBondContact O-CB 3.33Å; L761-R765 PolarHBondContact O-N 3.06Å; L761-Y824 HydrophobicContact CD1-CD2 3.89Å; L761-Y824 HydrophobicContact CD1-CE2 3.96Å; L761-I834 HydrophobicContact CD1-CG2 3.6Å; L761-L837 HydrophobicContact CB-CB 4.33Å; L761-L837 HydrophobicContact CB-CD1 4.35Å
762	K	90.6	Very high	87	Confident	1 Å²	1	9.6 Å²	9.6	0%	0.004	6%	0.057	C	C	.	.	H	α-helix	trans	-65.8	-42.6	177.4	-162.3	-178.5	-177.7	-150.8	0	111.8	Q723 I726 N727 Y758 A759 T760 L764 R765 D766 L837	Q723-K762 VanDerWaalsContact NE2-CE 3.28Å; Q723-K762 PolarHBondContact O-NZ 2.96Å; I726-K762 HydrophobicContact CG2-CD 3.89Å; N727-K762 WeakPolarHBondContact OD1-CE 3.42Å; N727-K762 PolarHBondContact OD1-NZ 3.3Å; Y758-K762 WeakPolarHBondContact O-CB 3.44Å; Y758-K762 PolarHBondContact O-N 2.65Å; A759-K762 WeakPolarHBondContact O-CB 3.37Å; A759-K762 PolarHBondContact O-N 2.68Å; T760-K762 VanDerWaalsContact C-N 3.3Å; T760-K762 PolarHBondContact O-N 3.22Å; K762-L764 VanDerWaalsContact C-N 3.34Å; K762-R765 PolarHBondContact O-N 2.76Å; K762-D766 WeakPolarHBondContact O-CB 3.44Å; K762-D766 PolarHBondContact O-N 2.8Å; K762-L837 HydrophobicContact CB-CD1 4.29Å
763	L	91.2	Very high	86.3	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.8	-38.8	174.5	-90	73.2	0	0	0	112.2	L704 I726 I733 R734 L741 M744 A759 T760 G767	L704-L763 HydrophobicContact CD1-CD1 4.14Å; L704-L763 HydrophobicContact CD2-CD2 4.46Å; I726-L763 HydrophobicContact CG2-CD1 3.8Å; I733-L763 HydrophobicContact CD1-CD2 4.21Å; R734-L763 PolarHBondContact NH1-O 3.42Å; L741-L763 HydrophobicContact CD1-CB 3.77Å; L741-L763 HydrophobicContact CD1-CD2 4.08Å; M744-L763 HydrophobicContact CE-CD2 3.93Å; M744-L763 HydrophobicContact SD-CD2 4.16Å; A759-L763 WeakPolarHBondContact O-CD1 3.49Å; A759-L763 PolarHBondContact O-N 3.04Å; T760-L763 PolarHBondContact O-N 3.33Å; L763-G767 PolarHBondContact O-N 3.33Å
764	L	92.4	Very high	85.5	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.5	-51.5	174.6	175.1	62.6	0	0	0	111	I745 M749 T760 L761 K762 D766 G767 L768 L808 W817	I745-L764 HydrophobicContact CD1-CD1 4.17Å; M749-L764 HydrophobicContact SD-CD2 4.33Å; T760-L764 WeakPolarHBondContact O-CB 3.44Å; T760-L764 PolarHBondContact O-N 2.96Å; L761-L764 PolarHBondContact O-N 2.85Å; K762-L764 VanDerWaalsContact C-N 3.34Å; L764-D766 VanDerWaalsContact C-N 3.28Å; L764-D766 PolarHBondContact O-N 3.45Å; L764-G767 WeakPolarHBondContact O-CA 3.29Å; L764-G767 PolarHBondContact O-N 2.83Å; L764-G767 VanDerWaalsContact O-N 3.07Å; L764-L768 HydrophobicContact CD1-CD1 4.34Å; L764-L768 HydrophobicContact CD1-CG 4.32Å; L764-L768 HydrophobicContact CG-CD1 4.24Å; L764-L768 WeakPolarHBondContact O-CG 3.34Å; L764-L768 PolarHBondContact O-N 3.22Å; L764-L808 HydrophobicContact CD1-CD1 4.4Å; L764-L808 HydrophobicContact CD1-CD2 3.62Å; L764-W817 HydrophobicContact CD1-CD2 4.47Å; L764-W817 HydrophobicContact CD2-CB 4.31Å; L764-W817 HydrophobicContact CD2-CD2 4.01Å; L764-W817 HydrophobicContact CD2-CE3 3.83Å; L764-W817 HydrophobicContact CD2-CG 4.21Å
765	R	90.7	Very high	84.4	Confident	9 Å²	9	14.7 Å²	14.7	3%	0.034	8%	0.076	C	C	.	.	H	α-helix	trans	-51.7	-48.2	174.7	175.9	-153.4	60.6	162.1	6.2	111.1	L761 K762 G767 L768 S769 E840 D1237	L761-R765 WeakPolarHBondContact O-CB 3.33Å; L761-R765 PolarHBondContact O-N 3.06Å; K762-R765 PolarHBondContact O-N 2.76Å; R765-G767 VanDerWaalsContact C-N 3.33Å; R765-G767 PolarHBondContact O-N 3.43Å; R765-L768 PolarHBondContact O-N 3.48Å; R765-S769 WeakPolarHBondContact O-CB 3.32Å; R765-S769 PolarHBondContact O-N 2.96Å; R765-E840 WeakPolarHBondContact CD-OE2 3.43Å; R765-E840 HydrophobicContact CG-CB 4.34Å; R765-E840 IonicContact NH1-OE2 2.85Å; R765-D1237 IonicContact CZ-OD2 2.84Å; R765-D1237 IonicContact NH1-OD1 2.69Å; R765-D1237 IonicContact NH1-OD2 2.56Å; R765-D1237 PolarHBondContact NH1-OD2 3.48Å; R765-D1237 IonicContact NH2-OD2 3.17Å; R765-D1237 PolarHBondContact NH2-OD2 2.71Å
766	D	87	Confident	83.2	Confident	23 Å²	23	20.6 Å²	20.6	12%	0.123	10%	0.103	C	C	.	.	H	α-helix	trans	-65.8	-37.2	-179.4	-71	-3.4	0	0	0	111.9	R734 K762 L764 S769 E770	R734-D766 VanDerWaalsContact NH1-CB 3.34Å; K762-D766 WeakPolarHBondContact O-CB 3.44Å; K762-D766 PolarHBondContact O-N 2.8Å; L764-D766 VanDerWaalsContact C-N 3.28Å; L764-D766 PolarHBondContact O-N 3.45Å; D766-S769 PolarHBondContact O-N 3.19Å; D766-E770 WeakPolarHBondContact O-CB 3.34Å; D766-E770 PolarHBondContact O-N 3.41Å
767	G	86.4	Confident	82	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.5	-47	172.6	0	0	0	0	0	112.3	L763 L764 R765 S769 E770 L771	L763-G767 PolarHBondContact O-N 3.33Å; L764-G767 WeakPolarHBondContact O-CA 3.29Å; L764-G767 PolarHBondContact O-N 2.83Å; L764-G767 VanDerWaalsContact O-N 3.07Å; R765-G767 VanDerWaalsContact C-N 3.33Å; R765-G767 PolarHBondContact O-N 3.43Å; G767-S769 VanDerWaalsContact C-N 3.31Å; G767-S769 PolarHBondContact O-N 3.31Å; G767-E770 WeakPolarHBondContact O-CB 3.44Å; G767-E770 PolarHBondContact O-N 3.33Å; G767-L771 WeakPolarHBondContact O-CG 3.4Å; G767-L771 PolarHBondContact O-N 3.15Å; G767-L771 VanDerWaalsContact O-N 3.09Å
768	L	87.8	Confident	80.9	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.7	-37.5	175.4	-65.6	173.1	0	0	0	111.7	L764 R765 L771 C772 F809 C841 R844 L848	L764-L768 HydrophobicContact CD1-CD1 4.34Å; L764-L768 HydrophobicContact CD1-CG 4.32Å; L764-L768 HydrophobicContact CG-CD1 4.24Å; L764-L768 WeakPolarHBondContact O-CG 3.34Å; L764-L768 PolarHBondContact O-N 3.22Å; R765-L768 PolarHBondContact O-N 3.48Å; L768-L771 PolarHBondContact O-N 3.34Å; L768-C772 PolarHBondContact O-N 2.88Å; L768-C772 PolarHBondContact O-SG 3.38Å; L768-F809 HydrophobicContact CD2-CZ 3.9Å; L768-C841 HydrophobicContact CD1-CB 4.03Å; L768-R844 HydrophobicContact CB-CB 4.04Å; L768-R844 HydrophobicContact CD1-CB 4.4Å; L768-L848 HydrophobicContact CB-CD1 4.42Å; L768-L848 HydrophobicContact CD2-CD1 3.91Å
769	S	83	Confident	79.7	Confident	30 Å²	30	23.8 Å²	23.8	21%	0.21	12%	0.119	C	C	.	.	H	α-helix	trans	-64.4	-44	175.3	-167.3	0	0	0	0	112	R765 D766 G767 L771 C772 M773 R844	R765-S769 WeakPolarHBondContact O-CB 3.32Å; R765-S769 PolarHBondContact O-N 2.96Å; D766-S769 PolarHBondContact O-N 3.19Å; G767-S769 VanDerWaalsContact C-N 3.31Å; G767-S769 PolarHBondContact O-N 3.31Å; S769-L771 PolarHBondContact O-N 3.46Å; S769-C772 WeakPolarHBondContact O-CB 3.39Å; S769-C772 PolarHBondContact O-N 3.47Å; S769-C772 VanDerWaalsContact O-N 3.11Å; S769-M773 WeakPolarHBondContact O-CG 3.43Å; S769-M773 PolarHBondContact O-N 3.21Å; S769-R844 PolarHBondContact OG-NH1 3.36Å
770	E	79.1	Confident	78.6	Confident	26 Å²	26	27 Å²	27	12%	0.121	13%	0.133	C	C	.	.	H	α-helix	trans	-57.5	-41	174.7	-170.2	166.5	-179.2	0	0	110.5	R734 W735 D766 G767 M773 Y774	R734-E770 IonicContact CZ-OE2 2.75Å; R734-E770 IonicContact NE-OE2 3.14Å; R734-E770 PolarHBondContact NE-OE2 3.04Å; R734-E770 VanDerWaalsContact NE-OE2 3.15Å; R734-E770 IonicContact NH2-OE2 3.66Å; R734-E770 PolarHBondContact NH2-OE2 2.93Å; R734-E770 VanDerWaalsContact NH2-OE2 3.09Å; W735-E770 PolarHBondContact NE1-OE1 3.46Å; D766-E770 WeakPolarHBondContact O-CB 3.34Å; D766-E770 PolarHBondContact O-N 3.41Å; G767-E770 WeakPolarHBondContact O-CB 3.44Å; G767-E770 PolarHBondContact O-N 3.33Å; E770-M773 PolarHBondContact O-N 2.64Å; E770-Y774 HydrophobicContact CG-CE2 4.38Å; E770-Y774 WeakPolarHBondContact O-CD2 3.46Å; E770-Y774 WeakPolarHBondContact O-CE2 3.41Å
771	L	79.6	Confident	77.4	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-67.7	-34.8	175.5	-66.2	177.2	0	0	0	113.8	G767 L768 S769 M773 Y774 L800 L805 F809 L848	G767-L771 WeakPolarHBondContact O-CG 3.4Å; G767-L771 PolarHBondContact O-N 3.15Å; G767-L771 VanDerWaalsContact O-N 3.09Å; L768-L771 PolarHBondContact O-N 3.34Å; S769-L771 PolarHBondContact O-N 3.46Å; L771-M773 VanDerWaalsContact C-N 3.27Å; L771-M773 PolarHBondContact O-N 2.81Å; L771-Y774 HydrophobicContact CD2-CD2 4.48Å; L771-Y774 HydrophobicContact CD2-CE2 4.31Å; L771-Y774 PolarHBondContact O-N 2.61Å; L771-L800 HydrophobicContact CD2-CD1 4.07Å; L771-L805 HydrophobicContact CD1-CD1 3.93Å; L771-L805 HydrophobicContact CD2-CB 4.49Å; L771-L805 HydrophobicContact CD2-CD1 4.01Å; L771-F809 HydrophobicContact CD1-CE2 3.74Å; L771-L848 HydrophobicContact CB-CD1 4.09Å; L771-L848 HydrophobicContact CB-CD2 4.13Å
772	C	74.5	Confident	76.2	Confident	16 Å²	16	32 Å²	32	11%	0.108	16%	0.156	C	C	.	.	H	α-helix	trans	-66.1	-28.6	176.3	-66.1	0	0	0	0	112.6	L768 S769 Y774 D775	L768-C772 PolarHBondContact O-N 2.88Å; L768-C772 PolarHBondContact O-SG 3.38Å; S769-C772 WeakPolarHBondContact O-CB 3.39Å; S769-C772 PolarHBondContact O-N 3.47Å; S769-C772 VanDerWaalsContact O-N 3.11Å; C772-Y774 VanDerWaalsContact C-N 3.26Å; C772-Y774 PolarHBondContact O-N 3.34Å; C772-D775 PolarHBondContact O-N 2.76Å
773	M	68.7	Low	75.1	Confident	135 Å²	135	37.9 Å²	37.9	67%	0.665	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-15.6	-177.6	-68.1	-67.2	-63.9	0	0	113.9	S769 E770 L771 D775	S769-M773 WeakPolarHBondContact O-CG 3.43Å; S769-M773 PolarHBondContact O-N 3.21Å; E770-M773 PolarHBondContact O-N 2.64Å; L771-M773 VanDerWaalsContact C-N 3.27Å; L771-M773 PolarHBondContact O-N 2.81Å; M773-D775 PolarHBondContact O-N 2.86Å
774	Y	69.7	Low	74.1	Confident	19 Å²	19	41.5 Å²	41.5	8%	0.075	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	10.5	177.4	-59	-76.6	0	0	0	113.5	E770 L771 C772 E776 I777 L778 P798 I799 L800	E770-Y774 HydrophobicContact CG-CE2 4.38Å; E770-Y774 WeakPolarHBondContact O-CD2 3.46Å; E770-Y774 WeakPolarHBondContact O-CE2 3.41Å; L771-Y774 HydrophobicContact CD2-CD2 4.48Å; L771-Y774 HydrophobicContact CD2-CE2 4.31Å; L771-Y774 PolarHBondContact O-N 2.61Å; C772-Y774 VanDerWaalsContact C-N 3.26Å; C772-Y774 PolarHBondContact O-N 3.34Å; Y774-E776 VanDerWaalsContact C-N 3.34Å; Y774-E776 PolarHBondContact O-N 3.07Å; Y774-I777 HydrophobicContact CD1-CD1 3.66Å; Y774-I777 HydrophobicContact CE1-CD1 4.49Å; Y774-I777 PolarHBondContact O-N 3.44Å; Y774-I777 VanDerWaalsContact O-N 3.1Å; Y774-L778 WeakPolarHBondContact O-CG 3.19Å; Y774-L778 PolarHBondContact O-N 2.99Å; Y774-P798 HydrophobicContact CD1-CB 4.05Å; Y774-P798 HydrophobicContact CE1-CB 3.74Å; Y774-I799 PolarHBondContact OH-O 3.31Å; Y774-L800 HydrophobicContact CD1-CD1 4.37Å; Y774-L800 HydrophobicContact CD2-CD1 3.66Å; Y774-L800 HydrophobicContact CE1-CD1 4.34Å; Y774-L800 HydrophobicContact CE2-CD1 3.64Å; Y774-L800 HydrophobicContact CG-CD1 4.07Å
775	D	63.9	Low	72.9	Confident	33 Å²	33	47 Å²	47	18%	0.176	24%	0.236	C	C	.	.	H	α-helix	trans	-54.7	-45.6	-179.1	-151.1	-7.8	0	0	0	112.7	C772 M773 I777 L778 Q779 R851	C772-D775 PolarHBondContact O-N 2.76Å; M773-D775 PolarHBondContact O-N 2.86Å; D775-I777 VanDerWaalsContact C-N 3.27Å; D775-I777 PolarHBondContact O-N 3.37Å; D775-L778 PolarHBondContact O-N 2.95Å; D775-Q779 WeakPolarHBondContact O-CB 3.03Å; D775-Q779 WeakPolarHBondContact O-CG 3.39Å; D775-Q779 PolarHBondContact O-N 3.41Å; D775-Q779 PolarHBondContact OD1-NE2 3.41Å; D775-R851 IonicContact OD1-CZ 3.05Å; D775-R851 IonicContact OD1-NE 3.42Å; D775-R851 IonicContact OD1-NH1 3.32Å; D775-R851 PolarHBondContact OD1-NH1 3.49Å; D775-R851 IonicContact OD1-NH2 3.44Å; D775-R851 PolarHBondContact OD1-NH2 3.41Å; D775-R851 IonicContact OD2-CZ 3.62Å; D775-R851 IonicContact OD2-NH1 2.69Å; D775-R851 PolarHBondContact OD2-NH1 2.87Å; D775-R851 IonicContact OD2-NH2 2.75Å; D775-R851 PolarHBondContact OD2-NH2 3.02Å
776	E	61.9	Low	71.9	Confident	125 Å²	125	47.6 Å²	47.6	58%	0.584	25%	0.245	S	C	*	.	H	α-helix	trans	-64.2	-31.9	179.5	-67.2	-177	176	0	0	112.6	Y774 K780	Y774-E776 VanDerWaalsContact C-N 3.34Å; Y774-E776 PolarHBondContact O-N 3.07Å; E776-K780 WeakPolarHBondContact O-CG 3.33Å; E776-K780 PolarHBondContact O-N 3.4Å
777	I	64.3	Low	71.1	Confident	15 Å²	15	47.3 Å²	47.3	8%	0.077	24%	0.243	C	C	.	.	H	α-helix	trans	-77.6	-45.5	179.7	-57.5	167.7	0	0	0	110	Y774 D775 Q779 K780 E781 V797 P798	Y774-I777 HydrophobicContact CD1-CD1 3.66Å; Y774-I777 HydrophobicContact CE1-CD1 4.49Å; Y774-I777 PolarHBondContact O-N 3.44Å; Y774-I777 VanDerWaalsContact O-N 3.1Å; D775-I777 VanDerWaalsContact C-N 3.27Å; D775-I777 PolarHBondContact O-N 3.37Å; I777-Q779 PolarHBondContact O-N 2.7Å; I777-K780 PolarHBondContact O-N 2.78Å; I777-K780 VanDerWaalsContact O-N 3.09Å; I777-E781 PolarHBondContact O-N 3.15Å; I777-V797 HydrophobicContact CD1-CG1 3.68Å; I777-V797 HydrophobicContact CG1-CG1 4.03Å; I777-V797 HydrophobicContact CG2-CG1 3.97Å; I777-P798 HydrophobicContact CD1-CB 3.7Å; I777-P798 VanDerWaalsContact CD1-CD 3.4Å; I777-P798 HydrophobicContact CD1-CG 3.59Å; I777-P798 HydrophobicContact CG1-CG 4.36Å
778	L	66	Low	70.2	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-40.5	175.9	-71.8	162.2	0	0	0	110.6	Y774 D775 K780 E781 E782 R851 N854 L855 V858	Y774-L778 WeakPolarHBondContact O-CG 3.19Å; Y774-L778 PolarHBondContact O-N 2.99Å; D775-L778 PolarHBondContact O-N 2.95Å; L778-K780 PolarHBondContact O-N 3.39Å; L778-E781 PolarHBondContact O-N 3.34Å; L778-E782 WeakPolarHBondContact O-CG 3.32Å; L778-E782 PolarHBondContact O-N 3.2Å; L778-R851 HydrophobicContact CD1-CB 4.29Å; L778-N854 HydrophobicContact CD2-CB 3.75Å; L778-L855 HydrophobicContact CD1-CD1 4.44Å; L778-L855 HydrophobicContact CD1-CD2 3.85Å; L778-L855 HydrophobicContact CD1-CG 3.85Å; L778-L855 HydrophobicContact CD2-CD2 4.03Å; L778-L855 HydrophobicContact CD2-CG 3.99Å; L778-L855 HydrophobicContact CG-CD2 4.31Å; L778-V858 HydrophobicContact CD2-CG2 3.98Å
779	Q	63.6	Low	69.2	Low	58 Å²	58	52.9 Å²	52.9	27%	0.271	27%	0.269	S	S	.	.	H	α-helix	trans	-62.2	-41.3	175.1	-75.5	173.7	37.5	0	0	112.5	D775 I777 E783	D775-Q779 WeakPolarHBondContact O-CB 3.03Å; D775-Q779 WeakPolarHBondContact O-CG 3.39Å; D775-Q779 PolarHBondContact O-N 3.41Å; D775-Q779 PolarHBondContact OD1-NE2 3.41Å; I777-Q779 PolarHBondContact O-N 2.7Å; Q779-E783 WeakPolarHBondContact O-CG 3.48Å; Q779-E783 PolarHBondContact O-N 3.03Å; Q779-E783 VanDerWaalsContact O-N 3.09Å
780	K	66.2	Low	68.3	Low	68 Å²	68	57.1 Å²	57.1	30%	0.296	28%	0.284	S	S	.	.	H	α-helix	trans	-71.6	-32.9	176.6	-72.8	-171.2	179.2	-174.1	0	112.8	T579 E776 I777 L778 E783 E784 F787	T579-K780 PolarHBondContact OG1-NZ 3.34Å; E776-K780 WeakPolarHBondContact O-CG 3.33Å; E776-K780 PolarHBondContact O-N 3.4Å; I777-K780 PolarHBondContact O-N 2.78Å; I777-K780 VanDerWaalsContact O-N 3.09Å; L778-K780 PolarHBondContact O-N 3.39Å; K780-E783 PolarHBondContact O-N 3.3Å; K780-E784 PolarHBondContact O-N 3.05Å; K780-F787 HydrophobicContact CB-CD1 3.61Å; K780-F787 HydrophobicContact CB-CD2 3.97Å; K780-F787 HydrophobicContact CB-CE1 3.71Å; K780-F787 HydrophobicContact CB-CE2 4.06Å; K780-F787 HydrophobicContact CB-CG 3.77Å; K780-F787 HydrophobicContact CB-CZ 3.96Å; K780-F787 HydrophobicContact CD-CD1 4.47Å; K780-F787 HydrophobicContact CD-CD2 4.36Å; K780-F787 HydrophobicContact CD-CE1 3.75Å; K780-F787 HydrophobicContact CD-CE2 3.62Å; K780-F787 HydrophobicContact CD-CZ 3.29Å; K780-F787 HydrophobicContact CG-CE1 4.39Å; K780-F787 HydrophobicContact CG-CE2 4.39Å; K780-F787 HydrophobicContact CG-CZ 4.26Å
781	E	67.5	Low	67.5	Low	16 Å²	16	60.2 Å²	60.2	8%	0.075	30%	0.295	C	S	.	.	H	α-helix	trans	-68.4	-37.7	173.7	-164.4	67.8	-155.1	0	0	112.2	I777 L778 E784 P785 G786 F787 T788 V858	I777-E781 PolarHBondContact O-N 3.15Å; L778-E781 PolarHBondContact O-N 3.34Å; E781-E784 CarbonylContact O-C 3.57Å; E781-E784 VanDerWaalsContact O-C 3.29Å; E781-P785 WeakPolarHBondContact O-CA 3.37Å; E781-G786 WeakPolarHBondContact OE1-CA 3.35Å; E781-G786 PolarHBondContact OE1-N 3.01Å; E781-F787 WeakPolarHBondContact OE2-CB 3.47Å; E781-F787 PolarHBondContact OE2-N 3.3Å; E781-T788 VanDerWaalsContact OE2-CB 3.22Å; E781-T788 WeakPolarHBondContact OE2-CB 3.42Å; E781-T788 PolarHBondContact OE2-N 3.34Å; E781-T788 PolarHBondContact OE2-OG1 3.49Å; E781-V858 HydrophobicContact CB-CG2 4.33Å; E781-V858 HydrophobicContact CG-CG2 3.95Å
782	E	65.9	Low	66.4	Low	88 Å²	88	60.4 Å²	60.4	41%	0.411	30%	0.297	S	S	.	.	H	α-helix	trans	-65.6	-39.6	173	-77.1	-176.2	165.3	0	0	112.1	L778 N854 M1048	L778-E782 WeakPolarHBondContact O-CG 3.32Å; L778-E782 PolarHBondContact O-N 3.2Å; E782-N854 PolarHBondContact OE1-ND2 3.44Å; E782-M1048 WeakPolarHBondContact OE1-CE 3.29Å
783	E	68.5	Low	65.3	Low	125 Å²	125	64.4 Å²	64.4	58%	0.584	32%	0.316	S	S	*	.	H	α-helix	trans	-72	-40.9	178.2	-75.4	173.6	-161.7	0	0	112.6	Q779 K780 R970	Q779-E783 WeakPolarHBondContact O-CG 3.48Å; Q779-E783 PolarHBondContact O-N 3.03Å; Q779-E783 VanDerWaalsContact O-N 3.09Å; K780-E783 PolarHBondContact O-N 3.3Å; E783-R970 IonicContact OE1-CZ 3.95Å; E783-R970 IonicContact OE1-NH1 3.38Å; E783-R970 PolarHBondContact OE1-NH1 3.49Å; E783-R970 IonicContact OE1-NH2 3.74Å; E783-R970 PolarHBondContact OE1-NH2 3.4Å
784	E	69.1	Low	64.5	Low	76 Å²	76	64.7 Å²	64.7	36%	0.355	31%	0.314	S	S	.	.	S	Bend	trans	-131.8	90	-179.4	-165.3	-177.8	179.6	0	0	109.3	K780 E781 G786 F787 K790	K780-E784 PolarHBondContact O-N 3.05Å; E781-E784 CarbonylContact O-C 3.57Å; E781-E784 VanDerWaalsContact O-C 3.29Å; E784-G786 PolarHBondContact O-N 3.25Å; E784-F787 HydrophobicContact CB-CB 4.33Å; E784-F787 WeakPolarHBondContact O-CB 3.46Å; E784-F787 PolarHBondContact O-N 3.48Å; E784-K790 IonicContact OE1-NZ 2.67Å; E784-K790 PolarHBondContact OE1-NZ 3.09Å
785	P	68	Low	63.7	Low	115 Å²	115	70.1 Å²	70.1	75%	0.747	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	125.2	178.1	19.1	-29.1	0	0	0	110.4	E781	E781-P785 WeakPolarHBondContact O-CA 3.37Å
786	G	68.5	Low	63.2	Low	21 Å²	21	71.3 Å²	71.3	22%	0.216	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.9	4.7	-168.8	0	0	0	0	0	114.5	E781 E784 T788 E789 K790	E781-G786 WeakPolarHBondContact OE1-CA 3.35Å; E781-G786 PolarHBondContact OE1-N 3.01Å; E784-G786 PolarHBondContact O-N 3.25Å; G786-T788 VanDerWaalsContact C-N 3.32Å; G786-T788 PolarHBondContact O-N 3.13Å; G786-E789 WeakPolarHBondContact O-CB 3.29Å; G786-E789 PolarHBondContact O-N 2.92Å; G786-K790 PolarHBondContact O-N 3.28Å
787	F	71.3	Confident	62.9	Low	18 Å²	18	65.8 Å²	65.8	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-55.2	-46.3	177.4	174.4	-93	0	0	0	111.9	K780 E781 E784 E789 K790 Y791 V797	K780-F787 HydrophobicContact CB-CD1 3.61Å; K780-F787 HydrophobicContact CB-CD2 3.97Å; K780-F787 HydrophobicContact CB-CE1 3.71Å; K780-F787 HydrophobicContact CB-CE2 4.06Å; K780-F787 HydrophobicContact CB-CG 3.77Å; K780-F787 HydrophobicContact CB-CZ 3.96Å; K780-F787 HydrophobicContact CD-CD1 4.47Å; K780-F787 HydrophobicContact CD-CD2 4.36Å; K780-F787 HydrophobicContact CD-CE1 3.75Å; K780-F787 HydrophobicContact CD-CE2 3.62Å; K780-F787 HydrophobicContact CD-CZ 3.29Å; K780-F787 HydrophobicContact CG-CE1 4.39Å; K780-F787 HydrophobicContact CG-CE2 4.39Å; K780-F787 HydrophobicContact CG-CZ 4.26Å; E781-F787 WeakPolarHBondContact OE2-CB 3.47Å; E781-F787 PolarHBondContact OE2-N 3.3Å; E784-F787 HydrophobicContact CB-CB 4.33Å; E784-F787 WeakPolarHBondContact O-CB 3.46Å; E784-F787 PolarHBondContact O-N 3.48Å; F787-E789 VanDerWaalsContact C-N 3.29Å; F787-E789 PolarHBondContact O-N 3.17Å; F787-K790 PolarHBondContact O-N 3.25Å; F787-Y791 AromaticContact CD2-CD2 3.4Å; F787-Y791 HydrophobicContact CD2-CD2 3.4Å; F787-Y791 VanDerWaalsContact CD2-CD2 3.4Å; F787-Y791 AromaticContact CD2-CE2 3.62Å; F787-Y791 HydrophobicContact CD2-CE2 3.62Å; F787-Y791 HydrophobicContact CD2-CG 4.38Å; F787-Y791 HydrophobicContact CE1-CD2 4.41Å; F787-Y791 AromaticContact CE2-CD2 3.18Å; F787-Y791 HydrophobicContact CE2-CD2 3.18Å; F787-Y791 AromaticContact CE2-CE2 3.36Å; F787-Y791 HydrophobicContact CE2-CE2 3.36Å; F787-Y791 AromaticContact CE2-CG 3.83Å; F787-Y791 HydrophobicContact CE2-CG 3.83Å; F787-Y791 HydrophobicContact CG-CD2 4.1Å; F787-Y791 AromaticContact CZ-CD2 3.72Å; F787-Y791 HydrophobicContact CZ-CD2 3.72Å; F787-Y791 HydrophobicContact CZ-CE2 4.26Å; F787-Y791 AromaticContact CZ-CG 3.91Å; F787-Y791 HydrophobicContact CZ-CG 3.91Å; F787-Y791 WeakPolarHBondContact O-CB 3.49Å; F787-Y791 WeakPolarHBondContact O-CD2 3.23Å; F787-Y791 PolarHBondContact O-N 2.93Å; F787-V797 HydrophobicContact CE1-CG2 4.34Å
788	T	67.6	Low	62.8	Low	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.5	-41	-179.3	-53.1	0	0	0	0	110.1	E781 G786 A792 V858 W862 M865	E781-T788 VanDerWaalsContact OE2-CB 3.22Å; E781-T788 WeakPolarHBondContact OE2-CB 3.42Å; E781-T788 PolarHBondContact OE2-N 3.34Å; E781-T788 PolarHBondContact OE2-OG1 3.49Å; G786-T788 VanDerWaalsContact C-N 3.32Å; G786-T788 PolarHBondContact O-N 3.13Å; T788-A792 WeakPolarHBondContact O-CB 3.45Å; T788-A792 PolarHBondContact O-N 3.35Å; T788-V858 HydrophobicContact CG2-CG1 4.31Å; T788-W862 VanDerWaalsContact CG2-NE1 3.33Å; T788-M865 HydrophobicContact CG2-CE 4.3Å
789	E	66.5	Low	62.9	Low	117 Å²	117	68.1 Å²	68.1	55%	0.547	33%	0.334	S	S	.	.	H	α-helix	trans	-66.8	-39.7	177.7	-145.2	174.6	-155.4	0	0	111.7	G786 F787 M865	G786-E789 WeakPolarHBondContact O-CB 3.29Å; G786-E789 PolarHBondContact O-N 2.92Å; F787-E789 VanDerWaalsContact C-N 3.29Å; F787-E789 PolarHBondContact O-N 3.17Å; E789-M865 HydrophobicContact CG-SD 4.35Å
790	K	65.2	Low	63.3	Low	119 Å²	119	65.8 Å²	65.8	52%	0.517	32%	0.323	S	S	.	.	H	α-helix	trans	-68.5	-41	176	-91.9	175.9	172.3	167.8	0	113.7	E784 G786 F787	E784-K790 IonicContact OE1-NZ 2.67Å; E784-K790 PolarHBondContact OE1-NZ 3.09Å; G786-K790 PolarHBondContact O-N 3.28Å; F787-K790 PolarHBondContact O-N 3.25Å
791	Y	60.5	Low	64	Low	90 Å²	90	63.2 Å²	63.2	35%	0.353	31%	0.312	S	S	.	.	H	α-helix	trans	-103.2	-10.8	-167.9	-78.4	-85.5	0	0	0	115.1	F787 I793 F794	F787-Y791 AromaticContact CD2-CD2 3.4Å; F787-Y791 HydrophobicContact CD2-CD2 3.4Å; F787-Y791 VanDerWaalsContact CD2-CD2 3.4Å; F787-Y791 AromaticContact CD2-CE2 3.62Å; F787-Y791 HydrophobicContact CD2-CE2 3.62Å; F787-Y791 HydrophobicContact CD2-CG 4.38Å; F787-Y791 HydrophobicContact CE1-CD2 4.41Å; F787-Y791 AromaticContact CE2-CD2 3.18Å; F787-Y791 HydrophobicContact CE2-CD2 3.18Å; F787-Y791 AromaticContact CE2-CE2 3.36Å; F787-Y791 HydrophobicContact CE2-CE2 3.36Å; F787-Y791 AromaticContact CE2-CG 3.83Å; F787-Y791 HydrophobicContact CE2-CG 3.83Å; F787-Y791 HydrophobicContact CG-CD2 4.1Å; F787-Y791 AromaticContact CZ-CD2 3.72Å; F787-Y791 HydrophobicContact CZ-CD2 3.72Å; F787-Y791 HydrophobicContact CZ-CE2 4.26Å; F787-Y791 AromaticContact CZ-CG 3.91Å; F787-Y791 HydrophobicContact CZ-CG 3.91Å; F787-Y791 WeakPolarHBondContact O-CB 3.49Å; F787-Y791 WeakPolarHBondContact O-CD2 3.23Å; F787-Y791 PolarHBondContact O-N 2.93Å; Y791-I793 PolarHBondContact O-N 3.43Å; Y791-F794 HydrophobicContact CD1-CB 4.41Å; Y791-F794 HydrophobicContact CD1-CD2 4.28Å; Y791-F794 PolarHBondContact O-N 2.88Å
792	A	56.9	Low	64.5	Low	8 Å²	8	63.1 Å²	63.1	7%	0.066	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-51.9	-34.8	166.4	0	0	0	0	0	111.3	T788 F794 M865	T788-A792 WeakPolarHBondContact O-CB 3.45Å; T788-A792 PolarHBondContact O-N 3.35Å; A792-F794 VanDerWaalsContact C-N 3.31Å; A792-F794 PolarHBondContact O-N 2.82Å; A792-M865 HydrophobicContact CB-CE 3.96Å; A792-M865 HydrophobicContact CB-SD 3.82Å
793	I	51.9	Low	65.1	Low	99 Å²	99	60.4 Å²	60.4	51%	0.508	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-65.1	-29.5	178.5	-53.4	173.5	0	0	0	112.7	Y791	Y791-I793 PolarHBondContact O-N 3.43Å
794	F	51.1	Low	65.8	Low	142 Å²	142	54.6 Å²	54.6	62%	0.623	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-96.1	13.1	-170.6	-71.5	-75.9	0	0	0	115	Y791 A792 T796	Y791-F794 HydrophobicContact CD1-CB 4.41Å; Y791-F794 HydrophobicContact CD1-CD2 4.28Å; Y791-F794 PolarHBondContact O-N 2.88Å; A792-F794 VanDerWaalsContact C-N 3.31Å; A792-F794 PolarHBondContact O-N 2.82Å; F794-T796 PolarHBondContact O-N 3.27Å; F794-T796 VanDerWaalsContact O-N 3.11Å
795	R	52.8	Low	66.5	Low	132 Å²	132	51 Å²	51	50%	0.498	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	18.9	176.3	-61.5	-174	174.4	174.1	4	115.7	H547	H547-R795 PolarHBondContact O-NE 2.91Å
796	T	53.4	Low	67	Low	58 Å²	58	46.3 Å²	46.3	36%	0.356	23%	0.229	S	C	.	.			trans	-104.6	-6	-176.6	44.4	0	0	0	0	114.3	L577 F794	L577-T796 WeakPolarHBondContact CD1-O 3.3Å; L577-T796 VanDerWaalsContact CD2-CB 3.5Å; L577-T796 HydrophobicContact CD2-CG2 3.55Å; L577-T796 WeakPolarHBondContact CD2-O 3.14Å; F794-T796 PolarHBondContact O-N 3.27Å; F794-T796 VanDerWaalsContact O-N 3.11Å
797	V	56	Low	67.6	Low	9 Å²	9	45.7 Å²	45.7	6%	0.055	22%	0.223	C	C	.	.	S	Bend	trans	-104	127.6	-172.1	-171.7	0	0	0	0	110.5	I777 F787 I799	I777-V797 HydrophobicContact CD1-CG1 3.68Å; I777-V797 HydrophobicContact CG1-CG1 4.03Å; I777-V797 HydrophobicContact CG2-CG1 3.97Å; F787-V797 HydrophobicContact CE1-CG2 4.34Å; V797-I799 PolarHBondContact O-N 3.49Å
798	P	61.6	Low	68.2	Low	59 Å²	59	44.9 Å²	44.9	38%	0.383	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-54.2	131.6	170.2	-23.7	27.5	0	0	0	112.2	Y774 I777 L800	Y774-P798 HydrophobicContact CD1-CB 4.05Å; Y774-P798 HydrophobicContact CE1-CB 3.74Å; I777-P798 HydrophobicContact CD1-CB 3.7Å; I777-P798 VanDerWaalsContact CD1-CD 3.4Å; I777-P798 HydrophobicContact CD1-CG 3.59Å; I777-P798 HydrophobicContact CG1-CG 4.36Å; P798-L800 PolarHBondContact O-N 3.31Å
799	I	69.6	Low	69.1	Low	13 Å²	13	44.9 Å²	44.9	7%	0.067	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-77.4	123.3	-178.3	-60.2	155.1	0	0	0	109.8	L543 L546 W735 Y774 V797 W862	L543-I799 HydrophobicContact CD2-CD1 4.11Å; L546-I799 HydrophobicContact CB-CD1 3.4Å; L546-I799 VanDerWaalsContact CB-CD1 3.4Å; L546-I799 HydrophobicContact CD1-CD1 3.91Å; L546-I799 HydrophobicContact CD1-CG2 4.12Å; L546-I799 HydrophobicContact CG-CD1 4.3Å; W735-I799 HydrophobicContact CH2-CB 4.25Å; W735-I799 HydrophobicContact CH2-CG2 4.01Å; W735-I799 HydrophobicContact CZ3-CG2 4.3Å; Y774-I799 PolarHBondContact OH-O 3.31Å; V797-I799 PolarHBondContact O-N 3.49Å; I799-W862 HydrophobicContact CB-CH2 4.21Å; I799-W862 HydrophobicContact CB-CZ2 4.5Å; I799-W862 HydrophobicContact CG1-CH2 3.79Å; I799-W862 HydrophobicContact CG1-CZ2 4.36Å; I799-W862 HydrophobicContact CG1-CZ3 4.43Å; I799-W862 HydrophobicContact CG2-CE3 4.48Å; I799-W862 HydrophobicContact CG2-CH2 4.04Å; I799-W862 HydrophobicContact CG2-CZ3 4.02Å
800	L	72.4	Confident	69.9	Low	9 Å²	9	40.8 Å²	40.8	5%	0.047	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-75.7	128.1	177.1	-176.3	65.4	0	0	0	111	L771 Y774 P798 V802 L805 L855 V858 A859	L771-L800 HydrophobicContact CD2-CD1 4.07Å; Y774-L800 HydrophobicContact CD1-CD1 4.37Å; Y774-L800 HydrophobicContact CD2-CD1 3.66Å; Y774-L800 HydrophobicContact CE1-CD1 4.34Å; Y774-L800 HydrophobicContact CE2-CD1 3.64Å; Y774-L800 HydrophobicContact CG-CD1 4.07Å; P798-L800 PolarHBondContact O-N 3.31Å; L800-V802 VanDerWaalsContact C-N 3.34Å; L800-V802 HydrophobicContact CB-CG2 4.48Å; L800-V802 HydrophobicContact CD2-CG2 4.27Å; L800-V802 HydrophobicContact CG-CG2 4.28Å; L800-V802 PolarHBondContact O-N 2.79Å; L800-L805 HydrophobicContact CD2-CD2 4.47Å; L800-L855 HydrophobicContact CD1-CD2 4.21Å; L800-L855 HydrophobicContact CD2-CD2 4.47Å; L800-V858 HydrophobicContact CD2-CG1 4.06Å; L800-A859 HydrophobicContact CD2-CB 3.81Å
801	N	79.9	Confident	70.5	Confident	13 Å²	13	38.5 Å²	38.5	7%	0.07	20%	0.201	C	C	.	.			trans	-79.1	84.8	171.2	-171.2	-20.2	0	0	0	110.3	R734 W735 A803 L804 L805	R734-N801 PolarHBondContact O-ND2 2.84Å; W735-N801 HydrophobicContact CH2-CB 4Å; W735-N801 HydrophobicContact CZ2-CB 3.98Å; W735-N801 HydrophobicContact CZ3-CB 4.34Å; N801-A803 VanDerWaalsContact C-N 3.33Å; N801-A803 PolarHBondContact O-N 2.86Å; N801-L804 HydrophobicContact CB-CB 4.09Å; N801-L804 PolarHBondContact O-N 3.02Å; N801-L804 PolarHBondContact OD1-N 3.39Å; N801-L805 PolarHBondContact O-N 3.19Å
802	V	78.5	Confident	71.6	Confident	15 Å²	15	40.7 Å²	40.7	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-38	-174.7	177.6	0	0	0	0	112.7	L800 L804 L805 Y806 A859 W862 E863	L800-V802 VanDerWaalsContact C-N 3.34Å; L800-V802 HydrophobicContact CB-CG2 4.48Å; L800-V802 HydrophobicContact CD2-CG2 4.27Å; L800-V802 HydrophobicContact CG-CG2 4.28Å; L800-V802 PolarHBondContact O-N 2.79Å; V802-L804 VanDerWaalsContact C-N 3.35Å; V802-L804 PolarHBondContact O-N 3.45Å; V802-L805 PolarHBondContact O-N 3.01Å; V802-Y806 HydrophobicContact CG1-CD2 3.76Å; V802-Y806 HydrophobicContact CG1-CE2 3.14Å; V802-Y806 VanDerWaalsContact O-CD2 3.32Å; V802-Y806 WeakPolarHBondContact O-CD2 3.03Å; V802-Y806 PolarHBondContact O-N 3.36Å; V802-Y806 VanDerWaalsContact O-N 3.15Å; V802-A859 HydrophobicContact CG1-CB 3.96Å; V802-A859 HydrophobicContact CG2-CB 4.02Å; V802-W862 HydrophobicContact CG2-CB 3.96Å; V802-E863 HydrophobicContact CG1-CG 3.88Å; V802-E863 WeakPolarHBondContact CG1-OE1 3.46Å
803	A	78.7	Confident	73	Confident	31 Å²	31	41.8 Å²	41.8	26%	0.256	22%	0.223	S	C	.	.	H	α-helix	trans	-64	-40.2	179	0	0	0	0	0	112.2	A738 N801 G807	A738-A803 HydrophobicContact CB-CB 3.86Å; N801-A803 VanDerWaalsContact C-N 3.33Å; N801-A803 PolarHBondContact O-N 2.86Å; A803-G807 PolarHBondContact O-N 3Å
804	L	82.2	Confident	74.7	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-63.5	-43.1	175.3	-179.7	70.5	0	0	0	111.9	R734 A738 L741 N801 V802 G807 L808	R734-L804 HydrophobicContact CB-CD1 4.5Å; R734-L804 HydrophobicContact CG-CD1 4.1Å; R734-L804 HydrophobicContact CG-CD2 4.48Å; A738-L804 HydrophobicContact CB-CB 4.36Å; L741-L804 HydrophobicContact CD2-CD1 3.61Å; N801-L804 HydrophobicContact CB-CB 4.09Å; N801-L804 PolarHBondContact O-N 3.02Å; N801-L804 PolarHBondContact OD1-N 3.39Å; V802-L804 VanDerWaalsContact C-N 3.35Å; V802-L804 PolarHBondContact O-N 3.45Å; L804-G807 PolarHBondContact O-N 2.92Å; L804-L808 HydrophobicContact CD1-CD1 3.76Å; L804-L808 HydrophobicContact CD1-CG 3.98Å; L804-L808 HydrophobicContact CD2-CD1 4.5Å; L804-L808 HydrophobicContact CG-CD1 3.87Å; L804-L808 HydrophobicContact CG-CG 4.35Å; L804-L808 WeakPolarHBondContact O-CG 3.37Å; L804-L808 PolarHBondContact O-N 2.91Å
805	L	83.6	Confident	76.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.4	-49.7	179.5	-177	72.9	0	0	0	111.2	L771 L800 N801 V802 G807 F809 L855 A859 L880	L771-L805 HydrophobicContact CD1-CD1 3.93Å; L771-L805 HydrophobicContact CD2-CB 4.49Å; L771-L805 HydrophobicContact CD2-CD1 4.01Å; L800-L805 HydrophobicContact CD2-CD2 4.47Å; N801-L805 PolarHBondContact O-N 3.19Å; V802-L805 PolarHBondContact O-N 3.01Å; L805-G807 VanDerWaalsContact C-N 3.35Å; L805-G807 PolarHBondContact O-N 3.49Å; L805-F809 HydrophobicContact CD1-CD2 3.83Å; L805-F809 HydrophobicContact CD1-CE2 3.96Å; L805-F809 WeakPolarHBondContact O-CD2 3.46Å; L805-F809 PolarHBondContact O-N 3.16Å; L805-L855 HydrophobicContact CD1-CB 4.35Å; L805-L855 HydrophobicContact CD1-CD1 4.26Å; L805-L855 HydrophobicContact CD2-CB 4.05Å; L805-A859 HydrophobicContact CD2-CB 3.78Å; L805-L880 HydrophobicContact CD1-CD1 4.4Å; L805-L880 HydrophobicContact CD2-CD1 3.74Å; L805-L880 HydrophobicContact CG-CD1 3.88Å; L805-L880 HydrophobicContact CG-CD2 4.07Å; L805-L880 WeakPolarHBondContact O-CD2 3.06Å
806	Y	79.6	Confident	78.3	Confident	17 Å²	17	32.2 Å²	32.2	7%	0.067	18%	0.18	C	C	.	.	H	α-helix	trans	-66	-36.5	177.5	-69.4	-51.2	0	0	0	113.6	V802 S810 A859 Y875 R878 L880	V802-Y806 HydrophobicContact CG1-CD2 3.76Å; V802-Y806 HydrophobicContact CG1-CE2 3.14Å; V802-Y806 VanDerWaalsContact O-CD2 3.32Å; V802-Y806 WeakPolarHBondContact O-CD2 3.03Å; V802-Y806 PolarHBondContact O-N 3.36Å; V802-Y806 VanDerWaalsContact O-N 3.15Å; Y806-S810 PolarHBondContact O-N 3.49Å; Y806-A859 WeakPolarHBondContact OH-CB 3.22Å; Y806-Y875 HydrophobicContact CE1-CE2 4.11Å; Y806-Y875 AromaticContact CE1-CZ 3.86Å; Y806-Y875 WeakPolarHBondContact CE1-OH 3.44Å; Y806-Y875 HydrophobicContact CE2-CD2 4.34Å; Y806-Y875 AromaticContact CE2-CE2 3.72Å; Y806-Y875 HydrophobicContact CE2-CE2 3.72Å; Y806-Y875 AromaticContact CZ-CE2 3.24Å; Y806-Y875 AromaticContact CZ-CZ 3.42Å; Y806-Y875 VanDerWaalsContact CZ-CZ 3.42Å; Y806-Y875 VanDerWaalsContact CZ-OH 3.26Å; Y806-Y875 WeakPolarHBondContact OH-CE2 3.4Å; Y806-Y875 PolarHBondContact OH-OH 2.89Å; Y806-R878 HydrophobicContact CD1-CB 3.98Å; Y806-R878 HydrophobicContact CE1-CB 4.32Å; Y806-R878 HydrophobicContact CG-CB 4.46Å; Y806-L880 HydrophobicContact CD1-CD2 3.47Å; Y806-L880 VanDerWaalsContact CD1-CD2 3.47Å; Y806-L880 HydrophobicContact CD1-CG 4.02Å; Y806-L880 HydrophobicContact CE1-CD1 4.28Å; Y806-L880 HydrophobicContact CE1-CD2 3.81Å; Y806-L880 HydrophobicContact CE1-CG 3.89Å; Y806-L880 HydrophobicContact CG-CD2 4.41Å
807	G	80	Confident	80.1	Confident	8 Å²	8	29.4 Å²	29.4	8%	0.082	16%	0.163	C	C	.	.	H	α-helix	trans	-61.6	-55.8	178.2	0	0	0	0	0	111.9	L742 A803 L804 L805 F809 S810	L742-G807 VanDerWaalsContact CD1-CA 3.44Å; L742-G807 WeakPolarHBondContact CD2-O 3.48Å; A803-G807 PolarHBondContact O-N 3Å; L804-G807 PolarHBondContact O-N 2.92Å; L805-G807 VanDerWaalsContact C-N 3.35Å; L805-G807 PolarHBondContact O-N 3.49Å; G807-F809 VanDerWaalsContact C-N 3.34Å; G807-F809 PolarHBondContact O-N 3.29Å; G807-S810 PolarHBondContact O-N 3.13Å; G807-S810 PolarHBondContact O-OG 3.09Å
808	L	85	Confident	81.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.3	-32.7	-171.7	-71	179.2	0	0	0	113.7	L741 L742 I745 L764 L804 W817	L741-L808 HydrophobicContact CD2-CD2 4.27Å; L742-L808 HydrophobicContact CD2-CD2 4.32Å; I745-L808 HydrophobicContact CD1-CD2 3.64Å; L764-L808 HydrophobicContact CD1-CD1 4.4Å; L764-L808 HydrophobicContact CD1-CD2 3.62Å; L804-L808 HydrophobicContact CD1-CD1 3.76Å; L804-L808 HydrophobicContact CD1-CG 3.98Å; L804-L808 HydrophobicContact CD2-CD1 4.5Å; L804-L808 HydrophobicContact CG-CD1 3.87Å; L804-L808 HydrophobicContact CG-CG 4.35Å; L804-L808 WeakPolarHBondContact O-CG 3.37Å; L804-L808 PolarHBondContact O-N 2.91Å; L808-W817 PolarHBondContact O-NE1 3.3Å; L808-W817 VanDerWaalsContact O-NE1 3.09Å
809	F	85.3	Confident	83.2	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	31.4	-178.8	-58.6	-67.5	0	0	0	112.7	L768 L771 L805 G807 W817 L848 L852 L880 D881 L882	L768-F809 HydrophobicContact CD2-CZ 3.9Å; L771-F809 HydrophobicContact CD1-CE2 3.74Å; L805-F809 HydrophobicContact CD1-CD2 3.83Å; L805-F809 HydrophobicContact CD1-CE2 3.96Å; L805-F809 WeakPolarHBondContact O-CD2 3.46Å; L805-F809 PolarHBondContact O-N 3.16Å; G807-F809 VanDerWaalsContact C-N 3.34Å; G807-F809 PolarHBondContact O-N 3.29Å; F809-W817 HydrophobicContact CE1-CZ2 4.33Å; F809-L848 HydrophobicContact CZ-CD1 4.07Å; F809-L852 HydrophobicContact CB-CD2 4.36Å; F809-L852 HydrophobicContact CD1-CD2 4.02Å; F809-L852 HydrophobicContact CD2-CD2 3.58Å; F809-L852 HydrophobicContact CE1-CD2 4.16Å; F809-L852 HydrophobicContact CE2-CD2 3.73Å; F809-L852 HydrophobicContact CG-CD2 3.72Å; F809-L852 HydrophobicContact CZ-CD2 4.01Å; F809-L880 HydrophobicContact CB-CB 4.49Å; F809-L880 HydrophobicContact CB-CD2 3.89Å; F809-D881 PolarHBondContact O-N 3.34Å; F809-L882 HydrophobicContact CD1-CD1 3.33Å; F809-L882 HydrophobicContact CD1-CG 4.08Å; F809-L882 HydrophobicContact CE1-CD1 3.44Å; F809-L882 VanDerWaalsContact CE1-CD1 3.44Å; F809-L882 HydrophobicContact CG-CD1 4.45Å
810	S	83.3	Confident	84.2	Confident	32 Å²	32	30.7 Å²	30.7	22%	0.224	17%	0.165	C	C	.	.	S	Bend	trans	-76.5	137.7	159	59.9	0	0	0	0	108.7	Y806 G807 D812 I813 S814	Y806-S810 PolarHBondContact O-N 3.49Å; G807-S810 PolarHBondContact O-N 3.13Å; G807-S810 PolarHBondContact O-OG 3.09Å; S810-D812 VanDerWaalsContact C-N 3.3Å; S810-D812 PolarHBondContact O-N 2.92Å; S810-I813 PolarHBondContact O-N 3.32Å; S810-I813 VanDerWaalsContact OG-CB 3.31Å; S810-I813 WeakPolarHBondContact OG-CB 3.24Å; S810-I813 WeakPolarHBondContact OG-CD1 3.4Å; S810-I813 VanDerWaalsContact OG-CG1 3.28Å; S810-I813 WeakPolarHBondContact OG-CG1 3.4Å; S810-S814 PolarHBondContact O-N 3.48Å; S810-S814 PolarHBondContact O-OG 3.2Å
811	P	78.1	Confident	85.1	Confident	71 Å²	71	30.3 Å²	30.3	46%	0.461	16%	0.163	S	C	.	.	H	α-helix	trans	-56.4	-41.5	-165.7	16.3	-29.7	0	0	0	113.4	S814 R815	P811-S814 PolarHBondContact O-OG 3.06Å; P811-R815 WeakPolarHBondContact O-CB 2.96Å; P811-R815 PolarHBondContact O-N 3.31Å
812	D	82.8	Confident	85.7	Confident	135 Å²	135	31.4 Å²	31.4	72%	0.722	17%	0.167	S	C	*	.	H	α-helix	trans	-68.3	-41.8	179.7	-60.9	-36.3	0	0	0	112.2	S810 M816	S810-D812 VanDerWaalsContact C-N 3.3Å; S810-D812 PolarHBondContact O-N 2.92Å; D812-M816 WeakPolarHBondContact O-CB 2.94Å; D812-M816 PolarHBondContact O-N 3.4Å
813	I	86.3	Confident	86.3	Confident	31 Å²	31	34.6 Å²	34.6	16%	0.159	18%	0.181	C	C	.	.	H	α-helix	trans	-74.7	-44.3	-176.8	-60.4	-177.6	0	0	0	110.2	L742 S810 R815 M816 W817	L742-I813 HydrophobicContact CB-CD1 4.14Å; L742-I813 HydrophobicContact CD1-CD1 4.11Å; L742-I813 HydrophobicContact CD2-CD1 3.86Å; L742-I813 HydrophobicContact CD2-CG2 4.03Å; L742-I813 HydrophobicContact CG-CD1 4.24Å; S810-I813 PolarHBondContact O-N 3.32Å; S810-I813 VanDerWaalsContact OG-CB 3.31Å; S810-I813 WeakPolarHBondContact OG-CB 3.24Å; S810-I813 WeakPolarHBondContact OG-CD1 3.4Å; S810-I813 VanDerWaalsContact OG-CG1 3.28Å; S810-I813 WeakPolarHBondContact OG-CG1 3.4Å; I813-R815 VanDerWaalsContact C-N 3.34Å; I813-R815 PolarHBondContact O-N 2.88Å; I813-M816 PolarHBondContact O-N 3.45Å; I813-W817 PolarHBondContact O-N 2.82Å
814	S	88.4	Confident	86.9	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-57.7	-45.8	177.6	53.5	0	0	0	0	112.5	S810 P811 W817 L818	S810-S814 PolarHBondContact O-N 3.48Å; S810-S814 PolarHBondContact O-OG 3.2Å; P811-S814 PolarHBondContact O-OG 3.06Å; S814-W817 VanDerWaalsContact CA-NE1 3.33Å; S814-L818 VanDerWaalsContact O-CB 3.27Å; S814-L818 WeakPolarHBondContact O-CB 3.19Å; S814-L818 WeakPolarHBondContact O-CD1 3.33Å; S814-L818 VanDerWaalsContact O-CG 3.26Å; S814-L818 WeakPolarHBondContact O-CG 3.3Å; S814-L818 PolarHBondContact O-N 3.05Å; S814-L818 VanDerWaalsContact O-N 3.09Å
815	R	89	Confident	87.2	Confident	113 Å²	113	33 Å²	33	43%	0.426	17%	0.169	S	C	.	.	H	α-helix	trans	-60.2	-48.6	176.2	174.2	172.7	-76.8	163.5	-8	111.3	P811 I813 L818 Q819 D883 D886	P811-R815 WeakPolarHBondContact O-CB 2.96Å; P811-R815 PolarHBondContact O-N 3.31Å; I813-R815 VanDerWaalsContact C-N 3.34Å; I813-R815 PolarHBondContact O-N 2.88Å; R815-L818 PolarHBondContact O-N 3.47Å; R815-Q819 HydrophobicContact CG-CG 4.34Å; R815-Q819 WeakPolarHBondContact O-CB 3.21Å; R815-Q819 VanDerWaalsContact O-CG 3.28Å; R815-Q819 WeakPolarHBondContact O-CG 2.78Å; R815-Q819 PolarHBondContact O-N 2.99Å; R815-D883 IonicContact CZ-OD2 3.15Å; R815-D883 IonicContact NE-OD2 3.83Å; R815-D883 IonicContact NH2-OD2 2.72Å; R815-D883 PolarHBondContact NH2-OD2 2.84Å; R815-D886 VanDerWaalsContact CG-OD2 3.25Å; R815-D886 WeakPolarHBondContact CG-OD2 3.48Å; R815-D886 IonicContact CZ-OD2 3.46Å; R815-D886 IonicContact NE-OD2 2.7Å; R815-D886 PolarHBondContact NE-OD2 3.18Å
816	M	90.3	Very high	87.3	Confident	57 Å²	57	35.5 Å²	35.5	28%	0.281	18%	0.181	S	C	.	.	H	α-helix	trans	-59.3	-51.8	-177.3	-176.4	-164	68.2	0	0	112.4	I745 T746 D812 I813 L818 Q819 C820	I745-M816 HydrophobicContact CB-CE 4.45Å; I745-M816 HydrophobicContact CG2-CE 3.45Å; I745-M816 VanDerWaalsContact CG2-CE 3.45Å; T746-M816 HydrophobicContact CG2-CE 3.77Å; T746-M816 HydrophobicContact CG2-SD 4.1Å; D812-M816 WeakPolarHBondContact O-CB 2.94Å; D812-M816 PolarHBondContact O-N 3.4Å; I813-M816 PolarHBondContact O-N 3.45Å; M816-L818 PolarHBondContact O-N 2.98Å; M816-Q819 PolarHBondContact O-N 3.11Å; M816-C820 PolarHBondContact O-N 3.25Å; M816-C820 PolarHBondContact O-SG 3.36Å
817	W	92	Very high	87.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-72.9	-28.3	-177.9	65.9	-108.3	0	0	0	113.1	I745 M749 L764 L808 F809 I813 S814 C821 T845	I745-W817 HydrophobicContact CG2-CB 3.77Å; I745-W817 HydrophobicContact CG2-CG 4.43Å; M749-W817 HydrophobicContact CE-CB 4.05Å; M749-W817 HydrophobicContact SD-CB 3.69Å; L764-W817 HydrophobicContact CD1-CD2 4.47Å; L764-W817 HydrophobicContact CD2-CB 4.31Å; L764-W817 HydrophobicContact CD2-CD2 4.01Å; L764-W817 HydrophobicContact CD2-CE3 3.83Å; L764-W817 HydrophobicContact CD2-CG 4.21Å; L808-W817 PolarHBondContact O-NE1 3.3Å; L808-W817 VanDerWaalsContact O-NE1 3.09Å; F809-W817 HydrophobicContact CE1-CZ2 4.33Å; I813-W817 PolarHBondContact O-N 2.82Å; S814-W817 VanDerWaalsContact CA-NE1 3.33Å; W817-C821 WeakPolarHBondContact O-CB 3.5Å; W817-C821 PolarHBondContact O-N 3.48Å; W817-C821 PolarHBondContact O-SG 3.22Å; W817-T845 HydrophobicContact CH2-CG2 3.85Å; W817-T845 WeakPolarHBondContact CH2-OG1 3.38Å
818	L	90.7	Very high	87.3	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-65.8	-45.8	172.6	-80.6	169.1	0	0	0	111.9	S814 R815 M816 C820 C821 Q822 T845 L882 D886 V887 C890	S814-L818 VanDerWaalsContact O-CB 3.27Å; S814-L818 WeakPolarHBondContact O-CB 3.19Å; S814-L818 WeakPolarHBondContact O-CD1 3.33Å; S814-L818 VanDerWaalsContact O-CG 3.26Å; S814-L818 WeakPolarHBondContact O-CG 3.3Å; S814-L818 PolarHBondContact O-N 3.05Å; S814-L818 VanDerWaalsContact O-N 3.09Å; R815-L818 PolarHBondContact O-N 3.47Å; M816-L818 PolarHBondContact O-N 2.98Å; L818-C820 PolarHBondContact O-N 3.36Å; L818-C821 WeakPolarHBondContact O-CB 3.19Å; L818-C821 PolarHBondContact O-N 3.3Å; L818-Q822 PolarHBondContact O-N 2.92Å; L818-T845 HydrophobicContact CD2-CG2 4.29Å; L818-L882 HydrophobicContact CD1-CD2 3.68Å; L818-D886 HydrophobicContact CB-CB 4.47Å; L818-D886 HydrophobicContact CD1-CB 4.24Å; L818-V887 HydrophobicContact CD1-CG2 4.13Å; L818-C890 HydrophobicContact CD2-CB 4.42Å
819	Q	91	Very high	86.8	Confident	87 Å²	87	46.4 Å²	46.4	41%	0.407	25%	0.251	S	S	.	.	H	α-helix	trans	-63.5	-41.3	177.3	-72.6	178.1	-4.6	0	0	111.5	R815 M816 Q822 Q823 D886	R815-Q819 HydrophobicContact CG-CG 4.34Å; R815-Q819 WeakPolarHBondContact O-CB 3.21Å; R815-Q819 VanDerWaalsContact O-CG 3.28Å; R815-Q819 WeakPolarHBondContact O-CG 2.78Å; R815-Q819 PolarHBondContact O-N 2.99Å; M816-Q819 PolarHBondContact O-N 3.11Å; Q819-Q822 WeakPolarHBondContact O-CB 3.32Å; Q819-Q822 PolarHBondContact O-N 3.35Å; Q819-Q823 WeakPolarHBondContact O-CB 3.43Å; Q819-Q823 PolarHBondContact O-N 2.94Å; Q819-D886 PolarHBondContact NE2-OD1 3.21Å; Q819-D886 VanDerWaalsContact NE2-OD1 3.1Å
820	C	91.1	Very high	86.6	Confident	19 Å²	19	47 Å²	47	13%	0.128	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-41.4	172.5	-72	0	0	0	0	112.5	M749 M816 L818 Q822 Q823 Y824	M749-C820 HydrophobicContact CB-CB 4.27Å; M749-C820 HydrophobicContact CE-CB 3.68Å; M816-C820 PolarHBondContact O-N 3.25Å; M816-C820 PolarHBondContact O-SG 3.36Å; L818-C820 PolarHBondContact O-N 3.36Å; C820-Q822 VanDerWaalsContact C-N 3.34Å; C820-Q822 PolarHBondContact O-N 2.9Å; C820-Q823 PolarHBondContact O-N 3.48Å; C820-Y824 HydrophobicContact CB-CE2 4.46Å; C820-Y824 VanDerWaalsContact O-CD2 3.31Å; C820-Y824 WeakPolarHBondContact O-CD2 3.28Å; C820-Y824 VanDerWaalsContact O-CG 3.27Å; C820-Y824 PolarHBondContact O-N 2.81Å
821	C	91.7	Very high	86.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-44.4	174.6	-71.8	0	0	0	0	111.1	W817 L818 Q823 Y824 I825	W817-C821 WeakPolarHBondContact O-CB 3.5Å; W817-C821 PolarHBondContact O-N 3.48Å; W817-C821 PolarHBondContact O-SG 3.22Å; L818-C821 WeakPolarHBondContact O-CB 3.19Å; L818-C821 PolarHBondContact O-N 3.3Å; C821-Q823 VanDerWaalsContact C-N 3.34Å; C821-Q823 PolarHBondContact O-N 3.45Å; C821-Y824 PolarHBondContact O-N 3.21Å; C821-I825 VanDerWaalsContact O-CD1 3.31Å; C821-I825 WeakPolarHBondContact O-CD1 3.41Å; C821-I825 WeakPolarHBondContact O-CG1 3.3Å; C821-I825 PolarHBondContact O-N 2.95Å; C821-I825 VanDerWaalsContact O-N 3.1Å
822	Q	92.7	Very high	86.7	Confident	37 Å²	37	42.4 Å²	42.4	17%	0.173	22%	0.224	C	C	.	.	H	α-helix	trans	-58.1	-47.4	175.6	-176.9	-173.6	4.5	0	0	110.7	L818 Q819 C820 Y824 I825 L826 E889 C890	L818-Q822 PolarHBondContact O-N 2.92Å; Q819-Q822 WeakPolarHBondContact O-CB 3.32Å; Q819-Q822 PolarHBondContact O-N 3.35Å; C820-Q822 VanDerWaalsContact C-N 3.34Å; C820-Q822 PolarHBondContact O-N 2.9Å; Q822-Y824 PolarHBondContact O-N 2.69Å; Q822-I825 PolarHBondContact O-N 3.36Å; Q822-I825 VanDerWaalsContact O-N 3.14Å; Q822-L826 HydrophobicContact CG-CD1 3.76Å; Q822-L826 HydrophobicContact CG-CG 4.3Å; Q822-L826 WeakPolarHBondContact O-CB 3.32Å; Q822-L826 VanDerWaalsContact O-CG 3.31Å; Q822-L826 WeakPolarHBondContact O-CG 3.19Å; Q822-L826 PolarHBondContact O-N 3.05Å; Q822-E889 PolarHBondContact NE2-O 2.94Å; Q822-C890 HydrophobicContact CB-CB 4.35Å
823	Q	91.1	Very high	86.7	Confident	82 Å²	82	36.8 Å²	36.8	38%	0.383	19%	0.193	S	C	.	.	H	α-helix	trans	-59.9	-44.4	179.1	-169.8	175.8	7	0	0	112.5	D751 Q819 C820 C821 I825 L826 D827	D751-Q823 VanDerWaalsContact CG-NE2 3.26Å; D751-Q823 PolarHBondContact OD2-NE2 3.41Å; Q819-Q823 WeakPolarHBondContact O-CB 3.43Å; Q819-Q823 PolarHBondContact O-N 2.94Å; C820-Q823 PolarHBondContact O-N 3.48Å; C821-Q823 VanDerWaalsContact C-N 3.34Å; C821-Q823 PolarHBondContact O-N 3.45Å; Q823-I825 VanDerWaalsContact C-N 3.26Å; Q823-I825 PolarHBondContact O-N 2.99Å; Q823-L826 PolarHBondContact O-N 2.85Å; Q823-D827 WeakPolarHBondContact O-CB 3.46Å; Q823-D827 PolarHBondContact O-N 3.02Å
824	Y	90.2	Very high	86.8	Confident	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-22.9	177.1	-63.7	-28.5	0	0	0	114.3	M749 V750 P753 L761 C820 C821 Q822 I834 S835	M749-Y824 HydrophobicContact CE-CE2 4.21Å; V750-Y824 PolarHBondContact N-OH 2.88Å; V750-Y824 VanDerWaalsContact N-OH 3.09Å; V750-Y824 PolarHBondContact O-OH 2.85Å; P753-Y824 HydrophobicContact CB-CD1 4.39Å; P753-Y824 HydrophobicContact CB-CE1 3.85Å; P753-Y824 HydrophobicContact CG-CD1 4.47Å; P753-Y824 HydrophobicContact CG-CE1 4.27Å; L761-Y824 HydrophobicContact CD1-CD2 3.89Å; L761-Y824 HydrophobicContact CD1-CE2 3.96Å; C820-Y824 HydrophobicContact CB-CE2 4.46Å; C820-Y824 VanDerWaalsContact O-CD2 3.31Å; C820-Y824 WeakPolarHBondContact O-CD2 3.28Å; C820-Y824 VanDerWaalsContact O-CG 3.27Å; C820-Y824 PolarHBondContact O-N 2.81Å; C821-Y824 PolarHBondContact O-N 3.21Å; Q822-Y824 PolarHBondContact O-N 2.69Å; Y824-I834 HydrophobicContact CD2-CG2 3.89Å; Y824-I834 HydrophobicContact CE2-CG2 4.46Å; Y824-I834 HydrophobicContact CG-CG2 3.95Å; Y824-S835 PolarHBondContact O-OG 2.85Å
825	I	88.3	Confident	86.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-81.3	-39.1	174.7	-64.4	163.9	0	0	0	110	C821 Q822 Q823 I839 G893 V894 F897 R900	C821-I825 VanDerWaalsContact O-CD1 3.31Å; C821-I825 WeakPolarHBondContact O-CD1 3.41Å; C821-I825 WeakPolarHBondContact O-CG1 3.3Å; C821-I825 PolarHBondContact O-N 2.95Å; C821-I825 VanDerWaalsContact O-N 3.1Å; Q822-I825 PolarHBondContact O-N 3.36Å; Q822-I825 VanDerWaalsContact O-N 3.14Å; Q823-I825 VanDerWaalsContact C-N 3.26Å; Q823-I825 PolarHBondContact O-N 2.99Å; I825-I839 HydrophobicContact CD1-CG1 4.08Å; I825-I839 HydrophobicContact CG1-CG1 4.02Å; I825-I839 HydrophobicContact CG2-CG1 4.4Å; I825-G893 WeakPolarHBondContact CG2-O 3.13Å; I825-V894 HydrophobicContact CD1-CG2 4.11Å; I825-F897 HydrophobicContact CG2-CB 3.68Å; I825-F897 HydrophobicContact CG2-CD2 4.42Å; I825-F897 HydrophobicContact CG2-CG 4.29Å; I825-R900 PolarHBondContact O-NH1 2.58Å
826	L	86.8	Confident	86.6	Confident	51 Å²	51	30.8 Å²	30.8	27%	0.267	17%	0.171	S	C	.	.	H	α-helix	trans	-78.3	-32.3	-177.9	-70.2	178	0	0	0	113.5	Q822 Q823 S828 E896 R900	Q822-L826 HydrophobicContact CG-CD1 3.76Å; Q822-L826 HydrophobicContact CG-CG 4.3Å; Q822-L826 WeakPolarHBondContact O-CB 3.32Å; Q822-L826 VanDerWaalsContact O-CG 3.31Å; Q822-L826 WeakPolarHBondContact O-CG 3.19Å; Q822-L826 PolarHBondContact O-N 3.05Å; Q823-L826 PolarHBondContact O-N 2.85Å; L826-S828 PolarHBondContact O-N 3.5Å; L826-E896 HydrophobicContact CD2-CB 4.15Å; L826-E896 HydrophobicContact CD2-CG 4.47Å; L826-E896 WeakPolarHBondContact CD2-OE2 3.22Å; L826-R900 PolarHBondContact O-NH1 2.92Å; L826-R900 PolarHBondContact O-NH2 3.25Å
827	D	82.9	Confident	86.6	Confident	45 Å²	45	28.4 Å²	28.4	24%	0.241	16%	0.159	C	C	.	.			trans	-74.1	120.7	179.8	174.2	27.8	0	0	0	111.7	Q823 T829 T830	Q823-D827 WeakPolarHBondContact O-CB 3.46Å; Q823-D827 PolarHBondContact O-N 3.02Å; D827-T829 VanDerWaalsContact CG-OG1 3.27Å; D827-T829 PolarHBondContact O-N 3.09Å; D827-T829 PolarHBondContact OD1-N 3.38Å; D827-T829 PolarHBondContact OD1-OG1 2.86Å; D827-T829 PolarHBondContact OD2-OG1 3.32Å; D827-T830 PolarHBondContact O-N 3.34Å; D827-T830 PolarHBondContact OD2-N 3.29Å; D827-T830 PolarHBondContact OD2-OG1 3.47Å
828	S	75.5	Confident	86.6	Confident	98 Å²	98	28.4 Å²	28.4	69%	0.685	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-15.8	177.5	55.2	0	0	0	0	113.7	L826	L826-S828 PolarHBondContact O-N 3.5Å
829	T	75.6	Confident	86.5	Confident	112 Å²	112	28.5 Å²	28.5	69%	0.687	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-10.5	179.2	76	0	0	0	0	113.1	D827	D827-T829 VanDerWaalsContact CG-OG1 3.27Å; D827-T829 PolarHBondContact O-N 3.09Å; D827-T829 PolarHBondContact OD1-N 3.38Å; D827-T829 PolarHBondContact OD1-OG1 2.86Å; D827-T829 PolarHBondContact OD2-OG1 3.32Å
830	T	81.4	Confident	86.5	Confident	11 Å²	11	24.8 Å²	24.8	7%	0.067	14%	0.142	C	C	.	.	S	Bend	trans	-73	139.8	177.7	-69.1	0	0	0	0	111.3	P753 D827 I834	P753-T830 HydrophobicContact CG-CG2 4.17Å; D827-T830 PolarHBondContact O-N 3.34Å; D827-T830 PolarHBondContact OD2-N 3.29Å; D827-T830 PolarHBondContact OD2-OG1 3.47Å; T830-I834 HydrophobicContact CG2-CB 3.94Å; T830-I834 HydrophobicContact CG2-CG2 3.82Å
831	A	80.7	Confident	86.5	Confident	4 Å²	4	23.9 Å²	23.9	3%	0.033	14%	0.136	C	C	.	.			trans	-62.7	136.7	179.1	0	0	0	0	0	112.5	F833 I834 S835 T924	A831-F833 VanDerWaalsContact C-N 3.26Å; A831-F833 HydrophobicContact CB-CD1 3.96Å; A831-F833 HydrophobicContact CB-CE1 3.56Å; A831-F833 HydrophobicContact CB-CE2 4.49Å; A831-F833 HydrophobicContact CB-CZ 3.86Å; A831-F833 PolarHBondContact O-N 3.42Å; A831-F833 VanDerWaalsContact O-N 3.15Å; A831-I834 WeakPolarHBondContact O-CB 3.31Å; A831-I834 PolarHBondContact O-N 2.95Å; A831-S835 PolarHBondContact O-N 2.93Å; A831-T924 HydrophobicContact CB-CG2 4.31Å
832	L	81.7	Confident	86.4	Confident	3 Å²	3	24 Å²	24	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-56.4	-35.4	-176.5	-80.8	179.9	0	0	0	113.7	I834 S835 T836 F897 M921 T924 Q925 F946	L832-I834 PolarHBondContact O-N 2.9Å; L832-S835 PolarHBondContact O-N 3.42Å; L832-T836 VanDerWaalsContact O-CB 3.31Å; L832-T836 WeakPolarHBondContact O-CB 3.44Å; L832-T836 PolarHBondContact O-N 2.85Å; L832-T836 PolarHBondContact O-OG1 2.75Å; L832-F897 HydrophobicContact CD2-CE2 4.06Å; L832-F897 HydrophobicContact CD2-CZ 3.74Å; L832-M921 HydrophobicContact CD1-CE 4.17Å; L832-M921 HydrophobicContact CD1-CG 3.83Å; L832-M921 WeakPolarHBondContact CD1-O 3.39Å; L832-M921 HydrophobicContact CD2-CE 4.21Å; L832-M921 HydrophobicContact CD2-CG 3.82Å; L832-M921 HydrophobicContact CD2-SD 4.07Å; L832-M921 HydrophobicContact CG-CG 3.69Å; L832-M921 WeakPolarHBondContact CG-O 3.32Å; L832-T924 PolarHBondContact N-O 2.86Å; L832-T924 PolarHBondContact N-OG1 3.09Å; L832-Q925 HydrophobicContact CD1-CG 3.8Å; L832-F946 HydrophobicContact CD1-CD2 4.21Å; L832-F946 HydrophobicContact CD1-CE2 3.9Å; L832-F946 HydrophobicContact CD1-CZ 4.27Å; L832-F946 HydrophobicContact CD2-CE2 4.11Å; L832-F946 HydrophobicContact CD2-CZ 4Å
833	F	83	Confident	86.2	Confident	18 Å²	18	22.4 Å²	22.4	8%	0.079	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-28.6	177.9	65.9	-105.3	0	0	0	112.7	L493 M755 Y758 A831 L837 T924 P927	L493-F833 HydrophobicContact CD1-CE2 4.45Å; L493-F833 HydrophobicContact CD1-CZ 4.05Å; L493-F833 HydrophobicContact CD2-CZ 4.12Å; M755-F833 HydrophobicContact SD-CE2 4.45Å; M755-F833 HydrophobicContact SD-CZ 4.13Å; Y758-F833 AromaticContact CD2-CD2 3.53Å; Y758-F833 HydrophobicContact CD2-CD2 3.53Å; Y758-F833 AromaticContact CD2-CE2 3.88Å; Y758-F833 HydrophobicContact CD2-CE2 3.88Å; Y758-F833 HydrophobicContact CE2-CD2 4.1Å; Y758-F833 HydrophobicContact CG-CD2 4.15Å; Y758-F833 HydrophobicContact CG-CE2 4.02Å; A831-F833 VanDerWaalsContact C-N 3.26Å; A831-F833 HydrophobicContact CB-CD1 3.96Å; A831-F833 HydrophobicContact CB-CE1 3.56Å; A831-F833 HydrophobicContact CB-CE2 4.49Å; A831-F833 HydrophobicContact CB-CZ 3.86Å; A831-F833 PolarHBondContact O-N 3.42Å; A831-F833 VanDerWaalsContact O-N 3.15Å; F833-L837 WeakPolarHBondContact O-CG 3.24Å; F833-L837 PolarHBondContact O-N 2.96Å; F833-T924 WeakPolarHBondContact CD1-O 3.36Å; F833-T924 PolarHBondContact N-O 3.5Å; F833-T924 VanDerWaalsContact N-O 3.13Å; F833-P927 HydrophobicContact CD1-CB 4.24Å; F833-P927 HydrophobicContact CD2-CB 4.46Å; F833-P927 HydrophobicContact CE1-CB 4.08Å; F833-P927 HydrophobicContact CE2-CB 4.27Å; F833-P927 HydrophobicContact CG-CB 4.47Å; F833-P927 HydrophobicContact CZ-CB 4.1Å
834	I	87.9	Confident	86	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-77.8	-48.2	174.8	-65.2	-165.1	0	0	0	110.3	L493 P753 L761 Y824 T830 A831 L832 T836 L837 S838	L493-I834 HydrophobicContact CD1-CD1 3.27Å; L493-I834 HydrophobicContact CD1-CG1 4.33Å; P753-I834 HydrophobicContact CB-CD1 3.65Å; P753-I834 HydrophobicContact CG-CD1 4.22Å; L761-I834 HydrophobicContact CD1-CG2 3.6Å; Y824-I834 HydrophobicContact CD2-CG2 3.89Å; Y824-I834 HydrophobicContact CE2-CG2 4.46Å; Y824-I834 HydrophobicContact CG-CG2 3.95Å; T830-I834 HydrophobicContact CG2-CB 3.94Å; T830-I834 HydrophobicContact CG2-CG2 3.82Å; A831-I834 WeakPolarHBondContact O-CB 3.31Å; A831-I834 PolarHBondContact O-N 2.95Å; L832-I834 PolarHBondContact O-N 2.9Å; I834-T836 VanDerWaalsContact C-N 3.28Å; I834-T836 PolarHBondContact O-N 3.37Å; I834-L837 PolarHBondContact O-N 2.84Å; I834-S838 PolarHBondContact O-N 2.69Å; I834-S838 PolarHBondContact O-OG 2.85Å
835	S	88.3	Confident	85.9	Confident	4 Å²	4	19.6 Å²	19.6	3%	0.028	12%	0.115	C	C	.	.	H	α-helix	trans	-60.6	-40.5	178.8	-49.4	0	0	0	0	110.8	Y824 A831 L832 L837 S838 I839	Y824-S835 PolarHBondContact O-OG 2.85Å; A831-S835 PolarHBondContact O-N 2.93Å; L832-S835 PolarHBondContact O-N 3.42Å; S835-L837 PolarHBondContact O-N 3.11Å; S835-S838 PolarHBondContact O-N 3.48Å; S835-I839 VanDerWaalsContact O-CG1 3.26Å; S835-I839 WeakPolarHBondContact O-CG1 3.46Å; S835-I839 PolarHBondContact O-N 3.29Å
836	T	86.6	Confident	85.7	Confident	16 Å²	16	19.7 Å²	19.7	10%	0.098	12%	0.116	C	C	.	.	H	α-helix	trans	-61.4	-42.9	176.3	-54.7	0	0	0	0	112.3	L832 I834 I839 E840 L950 K953	L832-T836 VanDerWaalsContact O-CB 3.31Å; L832-T836 WeakPolarHBondContact O-CB 3.44Å; L832-T836 PolarHBondContact O-N 2.85Å; L832-T836 PolarHBondContact O-OG1 2.75Å; I834-T836 VanDerWaalsContact C-N 3.28Å; I834-T836 PolarHBondContact O-N 3.37Å; T836-I839 PolarHBondContact O-N 2.73Å; T836-E840 PolarHBondContact O-N 3.18Å; T836-E840 VanDerWaalsContact O-N 3.12Å; T836-L950 HydrophobicContact CG2-CD1 4.4Å; T836-K953 HydrophobicContact CG2-CD 3.68Å
837	L	88.4	Confident	85.4	Confident	7 Å²	7	17.3 Å²	17.3	4%	0.037	10%	0.104	C	C	.	.	H	α-helix	trans	-67.1	-38.2	175.8	-75.6	174.4	0	0	0	111.9	Y758 L761 K762 F833 I834 S835 I839 E840 C841	Y758-L837 HydrophobicContact CD2-CD1 3.45Å; Y758-L837 VanDerWaalsContact CD2-CD1 3.45Å; Y758-L837 HydrophobicContact CE2-CD1 3.53Å; L761-L837 HydrophobicContact CB-CB 4.33Å; L761-L837 HydrophobicContact CB-CD1 4.35Å; K762-L837 HydrophobicContact CB-CD1 4.29Å; F833-L837 WeakPolarHBondContact O-CG 3.24Å; F833-L837 PolarHBondContact O-N 2.96Å; I834-L837 PolarHBondContact O-N 2.84Å; S835-L837 PolarHBondContact O-N 3.11Å; L837-I839 VanDerWaalsContact C-N 3.34Å; L837-E840 WeakPolarHBondContact O-CB 3.35Å; L837-E840 PolarHBondContact O-N 3.5Å; L837-C841 PolarHBondContact O-N 2.93Å; L837-C841 PolarHBondContact O-SG 3.44Å; L837-C841 VanDerWaalsContact O-SG 3.4Å
838	S	92	Very high	85.2	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.9	-40.6	177.4	-54.9	0	0	0	0	111.2	I834 S835 E840 C841 A842	I834-S838 PolarHBondContact O-N 2.69Å; I834-S838 PolarHBondContact O-OG 2.85Å; S835-S838 PolarHBondContact O-N 3.48Å; S838-E840 PolarHBondContact O-N 3.4Å; S838-C841 PolarHBondContact O-N 3.14Å; S838-A842 WeakPolarHBondContact O-CB 3.34Å; S838-A842 PolarHBondContact O-N 3.01Å
839	I	90.3	Very high	85.5	Confident	4 Å²	4	10.7 Å²	10.7	2%	0.021	6%	0.061	C	C	.	.	H	α-helix	trans	-60.3	-44.1	172.4	-67.1	164.5	0	0	0	110.8	I825 S835 T836 L837 C841 A842 L843 V894 F897 L954	I825-I839 HydrophobicContact CD1-CG1 4.08Å; I825-I839 HydrophobicContact CG1-CG1 4.02Å; I825-I839 HydrophobicContact CG2-CG1 4.4Å; S835-I839 VanDerWaalsContact O-CG1 3.26Å; S835-I839 WeakPolarHBondContact O-CG1 3.46Å; S835-I839 PolarHBondContact O-N 3.29Å; T836-I839 PolarHBondContact O-N 2.73Å; L837-I839 VanDerWaalsContact C-N 3.34Å; I839-C841 PolarHBondContact O-N 3.07Å; I839-A842 PolarHBondContact O-N 3.01Å; I839-L843 HydrophobicContact CG2-CD1 3.76Å; I839-L843 HydrophobicContact CG2-CG 4.32Å; I839-L843 WeakPolarHBondContact O-CB 3.45Å; I839-L843 VanDerWaalsContact O-CG 3.31Å; I839-L843 WeakPolarHBondContact O-CG 3.33Å; I839-L843 PolarHBondContact O-N 3.44Å; I839-V894 HydrophobicContact CG1-CG1 4.42Å; I839-V894 HydrophobicContact CG1-CG2 4.23Å; I839-V894 HydrophobicContact CG2-CG1 3.94Å; I839-V894 HydrophobicContact CG2-CG2 4.33Å; I839-F897 HydrophobicContact CD1-CD1 3.5Å; I839-F897 VanDerWaalsContact CD1-CD1 3.5Å; I839-F897 HydrophobicContact CD1-CE1 3.63Å; I839-F897 HydrophobicContact CD1-CG 3.96Å; I839-F897 HydrophobicContact CD1-CZ 4.23Å; I839-L954 HydrophobicContact CG2-CD2 4.07Å
840	E	89.4	Confident	85.6	Confident	9 Å²	9	6.3 Å²	6.3	4%	0.042	3%	0.032	C	C	.	.	H	α-helix	trans	-61.9	-42.3	176.6	-73.6	-179.6	-132.5	0	0	112.3	R765 T836 L837 S838 R844 K953	R765-E840 WeakPolarHBondContact CD-OE2 3.43Å; R765-E840 HydrophobicContact CG-CB 4.34Å; R765-E840 IonicContact NH1-OE2 2.85Å; T836-E840 PolarHBondContact O-N 3.18Å; T836-E840 VanDerWaalsContact O-N 3.12Å; L837-E840 WeakPolarHBondContact O-CB 3.35Å; L837-E840 PolarHBondContact O-N 3.5Å; S838-E840 PolarHBondContact O-N 3.4Å; E840-R844 WeakPolarHBondContact O-CB 3.34Å; E840-R844 WeakPolarHBondContact O-CG 3.2Å; E840-R844 PolarHBondContact O-N 3.31Å; E840-K953 WeakPolarHBondContact OE1-CD 3.46Å; E840-K953 WeakPolarHBondContact OE1-CE 3.31Å; E840-K953 IonicContact OE1-NZ 3.27Å; E840-K953 PolarHBondContact OE1-NZ 2.94Å
841	C	91.2	Very high	85.3	Confident	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-62.1	-46.3	175.3	-69.3	0	0	0	0	111.5	L768 L837 S838 I839 L843 R844 T845	L768-C841 HydrophobicContact CD1-CB 4.03Å; L837-C841 PolarHBondContact O-N 2.93Å; L837-C841 PolarHBondContact O-SG 3.44Å; L837-C841 VanDerWaalsContact O-SG 3.4Å; S838-C841 PolarHBondContact O-N 3.14Å; I839-C841 PolarHBondContact O-N 3.07Å; C841-L843 PolarHBondContact O-N 2.98Å; C841-R844 PolarHBondContact O-N 3.03Å; C841-T845 WeakPolarHBondContact O-CB 3.36Å; C841-T845 PolarHBondContact O-N 3.17Å; C841-T845 PolarHBondContact O-OG1 3.26Å
842	A	90.8	Very high	85.2	Confident	2 Å²	2	6.6 Å²	6.6	2%	0.017	3%	0.032	C	C	.	.	H	α-helix	trans	-59.3	-48.5	178.7	0	0	0	0	0	111.7	S838 I839 T845 L846 I891 V894	S838-A842 WeakPolarHBondContact O-CB 3.34Å; S838-A842 PolarHBondContact O-N 3.01Å; I839-A842 PolarHBondContact O-N 3.01Å; A842-T845 WeakPolarHBondContact O-CB 3.35Å; A842-T845 PolarHBondContact O-N 3.35Å; A842-L846 PolarHBondContact O-N 3.45Å; A842-I891 HydrophobicContact CB-CD1 4.15Å; A842-V894 HydrophobicContact CB-CG2 4.26Å
843	L	88	Confident	84.9	Confident	3 Å²	3	8.7 Å²	8.7	2%	0.016	5%	0.046	C	C	.	.	H	α-helix	trans	-67.6	-38.8	-179.8	-67.2	172.6	0	0	0	112.6	I839 C841 T845 L846 C847 I891 L954 V957 L958 L983	I839-L843 HydrophobicContact CG2-CD1 3.76Å; I839-L843 HydrophobicContact CG2-CG 4.32Å; I839-L843 WeakPolarHBondContact O-CB 3.45Å; I839-L843 VanDerWaalsContact O-CG 3.31Å; I839-L843 WeakPolarHBondContact O-CG 3.33Å; I839-L843 PolarHBondContact O-N 3.44Å; C841-L843 PolarHBondContact O-N 2.98Å; L843-T845 VanDerWaalsContact C-N 3.29Å; L843-T845 PolarHBondContact O-N 3.37Å; L843-L846 WeakPolarHBondContact O-CB 3.28Å; L843-L846 PolarHBondContact O-N 3.09Å; L843-C847 PolarHBondContact O-N 3.26Å; L843-C847 PolarHBondContact O-SG 2.69Å; L843-I891 HydrophobicContact CD2-CD1 4.03Å; L843-L954 HydrophobicContact CD1-CD2 3.25Å; L843-V957 HydrophobicContact CB-CB 4.41Å; L843-V957 HydrophobicContact CB-CG1 3.66Å; L843-L958 HydrophobicContact CD2-CD2 4.17Å; L843-L983 HydrophobicContact CD2-CD2 3.96Å
844	R	87	Confident	84.5	Confident	24 Å²	24	9.7 Å²	9.7	9%	0.091	5%	0.053	C	C	.	.	H	α-helix	trans	-65.3	-35.6	174.7	-73.7	174.6	-175.3	-81.9	4.8	111.7	L768 S769 E840 C841 C847 L848 V957	L768-R844 HydrophobicContact CB-CB 4.04Å; L768-R844 HydrophobicContact CD1-CB 4.4Å; S769-R844 PolarHBondContact OG-NH1 3.36Å; E840-R844 WeakPolarHBondContact O-CB 3.34Å; E840-R844 WeakPolarHBondContact O-CG 3.2Å; E840-R844 PolarHBondContact O-N 3.31Å; C841-R844 PolarHBondContact O-N 3.03Å; R844-C847 WeakPolarHBondContact O-CB 3.42Å; R844-C847 PolarHBondContact O-N 2.94Å; R844-L848 WeakPolarHBondContact O-CG 3.05Å; R844-L848 PolarHBondContact O-N 3.48Å; R844-L848 VanDerWaalsContact O-N 3.07Å; R844-V957 HydrophobicContact CG-CG1 3.83Å; R844-V957 HydrophobicContact CG-CG2 4.2Å
845	T	87.6	Confident	84	Confident	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62.9	-47.7	174.5	-52.4	0	0	0	0	110.5	W817 L818 C841 A842 L843 C847 L848 V849 L882 V887	W817-T845 HydrophobicContact CH2-CG2 3.85Å; W817-T845 WeakPolarHBondContact CH2-OG1 3.38Å; L818-T845 HydrophobicContact CD2-CG2 4.29Å; C841-T845 WeakPolarHBondContact O-CB 3.36Å; C841-T845 PolarHBondContact O-N 3.17Å; C841-T845 PolarHBondContact O-OG1 3.26Å; A842-T845 WeakPolarHBondContact O-CB 3.35Å; A842-T845 PolarHBondContact O-N 3.35Å; L843-T845 VanDerWaalsContact C-N 3.29Å; L843-T845 PolarHBondContact O-N 3.37Å; T845-C847 PolarHBondContact O-N 3.36Å; T845-L848 PolarHBondContact O-N 3.04Å; T845-V849 VanDerWaalsContact O-CG2 3.24Å; T845-V849 WeakPolarHBondContact O-CG2 3.13Å; T845-V849 PolarHBondContact O-N 2.72Å; T845-V849 VanDerWaalsContact O-N 3.09Å; T845-L882 HydrophobicContact CG2-CD1 4.18Å; T845-L882 HydrophobicContact CG2-CD2 4.34Å; T845-V887 HydrophobicContact CG2-CG2 4.36Å
846	L	84.5	Confident	83.4	Confident	2 Å²	2	11.3 Å²	11.3	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-54.5	-41.1	173.8	-176.7	66.2	0	0	0	111.8	A842 L843 L848 V887 I891 Y961 I982 L983	A842-L846 PolarHBondContact O-N 3.45Å; L843-L846 WeakPolarHBondContact O-CB 3.28Å; L843-L846 PolarHBondContact O-N 3.09Å; L846-L848 VanDerWaalsContact C-N 3.28Å; L846-L848 PolarHBondContact O-N 3.36Å; L846-V887 HydrophobicContact CD1-CG1 4.36Å; L846-I891 HydrophobicContact CB-CD1 4.34Å; L846-I891 HydrophobicContact CD2-CD1 4.23Å; L846-I891 HydrophobicContact CD2-CG1 4.45Å; L846-Y961 HydrophobicContact CD2-CE1 4.36Å; L846-Y961 HydrophobicContact CG-CE1 4.1Å; L846-I982 HydrophobicContact CD1-CD1 4.13Å; L846-L983 HydrophobicContact CD2-CD1 4.06Å; L846-L983 HydrophobicContact CD2-CD2 4.25Å; L846-L983 HydrophobicContact CD2-CG 4.07Å
847	C	79.8	Confident	82.8	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.007	8%	0.084	C	C	.	.	H	α-helix	trans	-65.5	-29.7	176.8	-60.9	0	0	0	0	113.1	L843 R844 T845 H850 Y961	L843-C847 PolarHBondContact O-N 3.26Å; L843-C847 PolarHBondContact O-SG 2.69Å; R844-C847 WeakPolarHBondContact O-CB 3.42Å; R844-C847 PolarHBondContact O-N 2.94Å; T845-C847 PolarHBondContact O-N 3.36Å; C847-H850 PolarHBondContact O-CE1 2.68Å; C847-H850 PolarHBondContact O-ND1 3.2Å; C847-H850 VanDerWaalsContact O-ND1 3.11Å; C847-Y961 HydrophobicContact CB-CD2 4.26Å; C847-Y961 HydrophobicContact CB-CG 4.36Å; C847-Y961 WeakPolarHBondContact SG-CB 3.5Å
848	L	80.2	Confident	82.2	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-87.7	-22.6	-177.3	-72.5	169.2	0	0	0	113.8	L768 L771 F809 R844 T845 L846 H850 R851 L852 L855	L768-L848 HydrophobicContact CB-CD1 4.42Å; L768-L848 HydrophobicContact CD2-CD1 3.91Å; L771-L848 HydrophobicContact CB-CD1 4.09Å; L771-L848 HydrophobicContact CB-CD2 4.13Å; F809-L848 HydrophobicContact CZ-CD1 4.07Å; R844-L848 WeakPolarHBondContact O-CG 3.05Å; R844-L848 PolarHBondContact O-N 3.48Å; R844-L848 VanDerWaalsContact O-N 3.07Å; T845-L848 PolarHBondContact O-N 3.04Å; L846-L848 VanDerWaalsContact C-N 3.28Å; L846-L848 PolarHBondContact O-N 3.36Å; L848-H850 PolarHBondContact O-N 2.7Å; L848-R851 WeakPolarHBondContact O-CA 3.5Å; L848-R851 WeakPolarHBondContact O-CB 3.4Å; L848-R851 PolarHBondContact O-N 3.12Å; L848-L852 PolarHBondContact O-N 3.4Å; L848-L855 HydrophobicContact CD2-CD1 4.27Å
849	V	81.4	Confident	81.5	Confident	4 Å²	4	15.2 Å²	15.2	2%	0.024	8%	0.084	C	C	.	.	H	α-helix	trans	-54.1	-48.7	-169.2	-177	0	0	0	0	113.2	T845 R851 L852 V887 L1053 L1057	T845-V849 VanDerWaalsContact O-CG2 3.24Å; T845-V849 WeakPolarHBondContact O-CG2 3.13Å; T845-V849 PolarHBondContact O-N 2.72Å; T845-V849 VanDerWaalsContact O-N 3.09Å; V849-R851 PolarHBondContact O-N 3.45Å; V849-R851 VanDerWaalsContact O-N 3.14Å; V849-L852 PolarHBondContact O-N 2.93Å; V849-V887 HydrophobicContact CG2-CG1 4.5Å; V849-L1053 HydrophobicContact CG1-CB 4.39Å; V849-L1057 HydrophobicContact CB-CD1 4.17Å; V849-L1057 HydrophobicContact CG1-CD1 3.45Å; V849-L1057 VanDerWaalsContact CG1-CD1 3.45Å; V849-L1057 HydrophobicContact CG2-CD1 4.22Å
850	H	77.3	Confident	80.6	Confident	21 Å²	21	16.6 Å²	16.6	10%	0.097	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-15.8	179.8	72.7	-75.4	0	0	0	114.1	C847 L848 Y961 V975 N1051 L1054	C847-H850 PolarHBondContact O-CE1 2.68Å; C847-H850 PolarHBondContact O-ND1 3.2Å; C847-H850 VanDerWaalsContact O-ND1 3.11Å; L848-H850 PolarHBondContact O-N 2.7Å; H850-Y961 AromaticContact CE1-CD2 3.79Å; H850-Y961 AromaticContact CE1-CE2 3.63Å; H850-Y961 AromaticContact ND1-CE2 3.49Å; H850-Y961 WeakPolarHBondContact ND1-CE2 3.33Å; H850-V975 HydrophobicContact CB-CB 4.46Å; H850-V975 HydrophobicContact CB-CG1 4.01Å; H850-V975 HydrophobicContact CB-CG2 3.55Å; H850-N1051 PolarHBondContact O-ND2 3.18Å; H850-L1054 HydrophobicContact CB-CD1 4.31Å
851	R	76	Confident	79.8	Confident	16 Å²	16	17.3 Å²	17.3	6%	0.06	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-12.1	-175.4	-56.5	-178.1	-178.7	175.7	-3.5	113.2	D775 L778 L848 V849 S853 N854 L855	D775-R851 IonicContact OD1-CZ 3.05Å; D775-R851 IonicContact OD1-NE 3.42Å; D775-R851 IonicContact OD1-NH1 3.32Å; D775-R851 PolarHBondContact OD1-NH1 3.49Å; D775-R851 IonicContact OD1-NH2 3.44Å; D775-R851 PolarHBondContact OD1-NH2 3.41Å; D775-R851 IonicContact OD2-CZ 3.62Å; D775-R851 IonicContact OD2-NH1 2.69Å; D775-R851 PolarHBondContact OD2-NH1 2.87Å; D775-R851 IonicContact OD2-NH2 2.75Å; D775-R851 PolarHBondContact OD2-NH2 3.02Å; L778-R851 HydrophobicContact CD1-CB 4.29Å; L848-R851 WeakPolarHBondContact O-CA 3.5Å; L848-R851 WeakPolarHBondContact O-CB 3.4Å; L848-R851 PolarHBondContact O-N 3.12Å; V849-R851 PolarHBondContact O-N 3.45Å; V849-R851 VanDerWaalsContact O-N 3.14Å; R851-S853 VanDerWaalsContact C-N 3.28Å; R851-S853 PolarHBondContact O-N 2.98Å; R851-N854 PolarHBondContact O-N 3.09Å; R851-L855 HydrophobicContact CB-CD1 4.16Å; R851-L855 WeakPolarHBondContact O-CB 3.45Å; R851-L855 WeakPolarHBondContact O-CG 3.37Å; R851-L855 PolarHBondContact O-N 2.88Å
852	L	78.7	Confident	78.8	Confident	5 Å²	5	18.1 Å²	18.1	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-60.1	-37	-173.6	-77.3	160.3	0	0	0	113.1	F809 L848 V849 L855 S856 L882	F809-L852 HydrophobicContact CB-CD2 4.36Å; F809-L852 HydrophobicContact CD1-CD2 4.02Å; F809-L852 HydrophobicContact CD2-CD2 3.58Å; F809-L852 HydrophobicContact CE1-CD2 4.16Å; F809-L852 HydrophobicContact CE2-CD2 3.73Å; F809-L852 HydrophobicContact CG-CD2 3.72Å; F809-L852 HydrophobicContact CZ-CD2 4.01Å; L848-L852 PolarHBondContact O-N 3.4Å; V849-L852 PolarHBondContact O-N 2.93Å; L852-L855 PolarHBondContact O-N 3.25Å; L852-S856 WeakPolarHBondContact O-CB 3.47Å; L852-S856 PolarHBondContact O-N 3.04Å; L852-L882 HydrophobicContact CD1-CB 4.22Å; L852-L882 HydrophobicContact CD1-CD1 3.31Å; L852-L882 HydrophobicContact CD1-CG 4.4Å
853	S	74.5	Confident	77.9	Confident	46 Å²	46	19.1 Å²	19.1	32%	0.322	11%	0.106	S	C	.	.	H	α-helix	trans	-64.3	-46	175.8	49.8	0	0	0	0	112.3	R851 S856 L857 N1051	R851-S853 VanDerWaalsContact C-N 3.28Å; R851-S853 PolarHBondContact O-N 2.98Å; S853-S856 WeakPolarHBondContact O-CB 3.4Å; S853-S856 PolarHBondContact O-N 3.46Å; S853-L857 PolarHBondContact O-N 3Å; S853-L857 VanDerWaalsContact O-N 3.11Å; S853-N1051 VanDerWaalsContact CB-OD1 3.26Å; S853-N1051 WeakPolarHBondContact CB-OD1 3.4Å; S853-N1051 VanDerWaalsContact OG-CG 3.27Å; S853-N1051 PolarHBondContact OG-ND2 3.38Å; S853-N1051 PolarHBondContact OG-OD1 3.12Å
854	N	73.8	Confident	77.1	Confident	40 Å²	40	24.9 Å²	24.9	21%	0.214	14%	0.137	C	C	.	.	H	α-helix	trans	-68.3	-39.9	176.1	-65.3	-20.8	0	0	0	111.9	L778 E782 R851 S856 L857 V858	L778-N854 HydrophobicContact CD2-CB 3.75Å; E782-N854 PolarHBondContact OE1-ND2 3.44Å; R851-N854 PolarHBondContact O-N 3.09Å; N854-S856 VanDerWaalsContact C-N 3.3Å; N854-S856 PolarHBondContact O-N 3.03Å; N854-L857 WeakPolarHBondContact O-CB 3.41Å; N854-L857 PolarHBondContact O-N 2.93Å; N854-L857 VanDerWaalsContact O-N 3.14Å; N854-V858 WeakPolarHBondContact O-CG2 3.4Å; N854-V858 PolarHBondContact O-N 3.12Å
855	L	77.2	Confident	76.2	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-38.6	174.4	-82.3	167.9	0	0	0	111.5	L778 L800 L805 L848 R851 L852 A859	L778-L855 HydrophobicContact CD1-CD1 4.44Å; L778-L855 HydrophobicContact CD1-CD2 3.85Å; L778-L855 HydrophobicContact CD1-CG 3.85Å; L778-L855 HydrophobicContact CD2-CD2 4.03Å; L778-L855 HydrophobicContact CD2-CG 3.99Å; L778-L855 HydrophobicContact CG-CD2 4.31Å; L800-L855 HydrophobicContact CD1-CD2 4.21Å; L800-L855 HydrophobicContact CD2-CD2 4.47Å; L805-L855 HydrophobicContact CD1-CB 4.35Å; L805-L855 HydrophobicContact CD1-CD1 4.26Å; L805-L855 HydrophobicContact CD2-CB 4.05Å; L848-L855 HydrophobicContact CD2-CD1 4.27Å; R851-L855 HydrophobicContact CB-CD1 4.16Å; R851-L855 WeakPolarHBondContact O-CB 3.45Å; R851-L855 WeakPolarHBondContact O-CG 3.37Å; R851-L855 PolarHBondContact O-N 2.88Å; L852-L855 PolarHBondContact O-N 3.25Å; L855-A859 WeakPolarHBondContact O-CB 3.39Å; L855-A859 PolarHBondContact O-N 2.74Å
856	S	76.9	Confident	75.3	Confident	36 Å²	36	28.8 Å²	28.8	25%	0.252	16%	0.155	S	C	.	.	H	α-helix	trans	-56.3	-51.3	169.9	147.6	0	0	0	0	110.3	L852 S853 N854 V858 A859 C860 Y875	L852-S856 WeakPolarHBondContact O-CB 3.47Å; L852-S856 PolarHBondContact O-N 3.04Å; S853-S856 WeakPolarHBondContact O-CB 3.4Å; S853-S856 PolarHBondContact O-N 3.46Å; N854-S856 VanDerWaalsContact C-N 3.3Å; N854-S856 PolarHBondContact O-N 3.03Å; S856-V858 PolarHBondContact O-N 3.48Å; S856-A859 PolarHBondContact O-N 2.95Å; S856-C860 PolarHBondContact O-N 3.37Å; S856-C860 PolarHBondContact O-SG 2.66Å; S856-Y875 PolarHBondContact O-OH 3.23Å
857	L	73.7	Confident	74.4	Confident	100 Å²	100	32.5 Å²	32.5	52%	0.524	18%	0.179	S	C	.	.	H	α-helix	trans	-62.4	-46.9	-177.6	-162.2	114.7	0	0	0	112.2	S853 N854 A859 C860 T861	S853-L857 PolarHBondContact O-N 3Å; S853-L857 VanDerWaalsContact O-N 3.11Å; N854-L857 WeakPolarHBondContact O-CB 3.41Å; N854-L857 PolarHBondContact O-N 2.93Å; N854-L857 VanDerWaalsContact O-N 3.14Å; L857-A859 VanDerWaalsContact C-N 3.3Å; L857-A859 PolarHBondContact O-N 3.13Å; L857-C860 VanDerWaalsContact O-CB 3.28Å; L857-C860 WeakPolarHBondContact O-CB 3.49Å; L857-C860 PolarHBondContact O-N 3Å; L857-T861 PolarHBondContact O-N 2.69Å; L857-T861 VanDerWaalsContact O-N 3.1Å
858	V	74.9	Confident	73.8	Confident	6 Å²	6	34.5 Å²	34.5	4%	0.036	19%	0.189	C	C	.	.	H	α-helix	trans	-61.3	-41.4	175.8	173.4	0	0	0	0	110.6	L778 E781 T788 L800 N854 S856 C860 T861 W862	L778-V858 HydrophobicContact CD2-CG2 3.98Å; E781-V858 HydrophobicContact CB-CG2 4.33Å; E781-V858 HydrophobicContact CG-CG2 3.95Å; T788-V858 HydrophobicContact CG2-CG1 4.31Å; L800-V858 HydrophobicContact CD2-CG1 4.06Å; N854-V858 WeakPolarHBondContact O-CG2 3.4Å; N854-V858 PolarHBondContact O-N 3.12Å; S856-V858 PolarHBondContact O-N 3.48Å; V858-C860 VanDerWaalsContact C-N 3.34Å; V858-C860 PolarHBondContact O-N 3.11Å; V858-T861 PolarHBondContact O-N 3.22Å; V858-T861 VanDerWaalsContact O-N 3.17Å; V858-T861 PolarHBondContact O-OG1 3.05Å; V858-W862 PolarHBondContact O-N 2.94Å
859	A	77.1	Confident	73.1	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.7	-31.8	177.8	0	0	0	0	0	112.8	L800 V802 L805 Y806 L855 S856 L857 E863	L800-A859 HydrophobicContact CD2-CB 3.81Å; V802-A859 HydrophobicContact CG1-CB 3.96Å; V802-A859 HydrophobicContact CG2-CB 4.02Å; L805-A859 HydrophobicContact CD2-CB 3.78Å; Y806-A859 WeakPolarHBondContact OH-CB 3.22Å; L855-A859 WeakPolarHBondContact O-CB 3.39Å; L855-A859 PolarHBondContact O-N 2.74Å; S856-A859 PolarHBondContact O-N 2.95Å; L857-A859 VanDerWaalsContact C-N 3.3Å; L857-A859 PolarHBondContact O-N 3.13Å; A859-E863 PolarHBondContact O-N 3.31Å
860	C	73.4	Confident	72.5	Confident	32 Å²	32	39.2 Å²	39.2	22%	0.216	22%	0.215	C	C	.	.	H	α-helix	trans	-58.7	-50.3	167.2	-63	0	0	0	0	111	S856 L857 V858 W862 E863 N864 Y875	S856-C860 PolarHBondContact O-N 3.37Å; S856-C860 PolarHBondContact O-SG 2.66Å; L857-C860 VanDerWaalsContact O-CB 3.28Å; L857-C860 WeakPolarHBondContact O-CB 3.49Å; L857-C860 PolarHBondContact O-N 3Å; V858-C860 VanDerWaalsContact C-N 3.34Å; V858-C860 PolarHBondContact O-N 3.11Å; C860-W862 VanDerWaalsContact C-N 3.32Å; C860-W862 PolarHBondContact O-N 2.73Å; C860-E863 PolarHBondContact O-N 3.45Å; C860-N864 WeakPolarHBondContact O-CB 3.38Å; C860-N864 VanDerWaalsContact O-CG 3.22Å; C860-N864 PolarHBondContact O-N 2.85Å; C860-N864 PolarHBondContact O-ND2 2.89Å; C860-Y875 HydrophobicContact CB-CE1 4.42Å; C860-Y875 HydrophobicContact CB-CE2 4.2Å; C860-Y875 WeakPolarHBondContact SG-CE1 3.38Å; C860-Y875 PolarHBondContact SG-OH 2.77Å
861	T	71.2	Confident	72	Confident	25 Å²	25	39.7 Å²	39.7	15%	0.153	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-41.7	-176.9	60.9	0	0	0	0	111.3	L857 V858 N864 M865	L857-T861 PolarHBondContact O-N 2.69Å; L857-T861 VanDerWaalsContact O-N 3.1Å; V858-T861 PolarHBondContact O-N 3.22Å; V858-T861 VanDerWaalsContact O-N 3.17Å; V858-T861 PolarHBondContact O-OG1 3.05Å; T861-N864 PolarHBondContact O-N 3.2Å; T861-M865 WeakPolarHBondContact O-CG 3.45Å; T861-M865 PolarHBondContact O-N 3.41Å
862	W	71.5	Confident	71	Confident	17 Å²	17	46.6 Å²	46.6	6%	0.064	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-45.7	175.3	-95.1	97.5	0	0	0	113.3	T788 I799 V802 V858 C860 N864 M865 R866	T788-W862 VanDerWaalsContact CG2-NE1 3.33Å; I799-W862 HydrophobicContact CB-CH2 4.21Å; I799-W862 HydrophobicContact CB-CZ2 4.5Å; I799-W862 HydrophobicContact CG1-CH2 3.79Å; I799-W862 HydrophobicContact CG1-CZ2 4.36Å; I799-W862 HydrophobicContact CG1-CZ3 4.43Å; I799-W862 HydrophobicContact CG2-CE3 4.48Å; I799-W862 HydrophobicContact CG2-CH2 4.04Å; I799-W862 HydrophobicContact CG2-CZ3 4.02Å; V802-W862 HydrophobicContact CG2-CB 3.96Å; V858-W862 PolarHBondContact O-N 2.94Å; C860-W862 VanDerWaalsContact C-N 3.32Å; C860-W862 PolarHBondContact O-N 2.73Å; W862-N864 VanDerWaalsContact C-N 3.29Å; W862-N864 PolarHBondContact O-N 3.33Å; W862-M865 HydrophobicContact CD2-CE 4.19Å; W862-M865 HydrophobicContact CG-CE 4.28Å; W862-M865 PolarHBondContact O-N 3.48Å; W862-R866 PolarHBondContact O-N 2.84Å
863	E	71.6	Confident	69.8	Low	23 Å²	23	50.7 Å²	50.7	11%	0.107	28%	0.28	C	S	.	.	H	α-helix	trans	-66.2	-31.9	176.8	-96.5	-171.6	-169.7	0	0	112.6	V802 A859 C860 R866 P867 Y875 R878	V802-E863 HydrophobicContact CG1-CG 3.88Å; V802-E863 WeakPolarHBondContact CG1-OE1 3.46Å; A859-E863 PolarHBondContact O-N 3.31Å; C860-E863 PolarHBondContact O-N 3.45Å; E863-R866 CarbonylContact O-C 3.59Å; E863-P867 VanDerWaalsContact O-CA 3.24Å; E863-P867 WeakPolarHBondContact O-CA 3.33Å; E863-P867 WeakPolarHBondContact O-CD 3.5Å; E863-Y875 HydrophobicContact CB-CD2 4.48Å; E863-Y875 VanDerWaalsContact OE2-CD2 3.25Å; E863-Y875 WeakPolarHBondContact OE2-CD2 3.48Å; E863-R878 IonicContact OE1-NH1 2.8Å
864	N	70.9	Confident	68.6	Low	123 Å²	123	52.7 Å²	52.7	66%	0.658	29%	0.292	S	S	*	.	H	α-helix	trans	-67.8	-38.4	174.2	-71.2	-22.5	0	0	0	111.9	C860 T861 W862	C860-N864 WeakPolarHBondContact O-CB 3.38Å; C860-N864 VanDerWaalsContact O-CG 3.22Å; C860-N864 PolarHBondContact O-N 2.85Å; C860-N864 PolarHBondContact O-ND2 2.89Å; T861-N864 PolarHBondContact O-N 3.2Å; W862-N864 VanDerWaalsContact C-N 3.29Å; W862-N864 PolarHBondContact O-N 3.33Å
865	M	67.6	Low	67.5	Low	62 Å²	62	52.8 Å²	52.8	31%	0.305	29%	0.29	S	S	.	.	H	α-helix	trans	-69.2	-43.2	174.7	-70.7	-171.3	-72.8	0	0	111.7	T788 E789 A792 T861 W862	T788-M865 HydrophobicContact CG2-CE 4.3Å; E789-M865 HydrophobicContact CG-SD 4.35Å; A792-M865 HydrophobicContact CB-CE 3.96Å; A792-M865 HydrophobicContact CB-SD 3.82Å; T861-M865 WeakPolarHBondContact O-CG 3.45Å; T861-M865 PolarHBondContact O-N 3.41Å; W862-M865 HydrophobicContact CD2-CE 4.19Å; W862-M865 HydrophobicContact CG-CE 4.28Å; W862-M865 PolarHBondContact O-N 3.48Å
866	R	68.7	Low	66.2	Low	45 Å²	45	58.2 Å²	58.2	17%	0.17	33%	0.328	C	S	.	.	S	Bend	trans	-137.3	93.9	178.9	-172.3	-173.3	174	122.1	0.5	110.8	E647 W862 E863 N868	E647-R866 IonicContact OE1-CZ 3.97Å; E647-R866 IonicContact OE1-NE 2.77Å; E647-R866 IonicContact OE1-NH2 2.65Å; E647-R866 PolarHBondContact OE1-NH2 2.89Å; E647-R866 IonicContact OE2-NH2 3.69Å; E647-R866 PolarHBondContact OE2-NH2 3.08Å; W862-R866 PolarHBondContact O-N 2.84Å; E863-R866 CarbonylContact O-C 3.59Å; R866-N868 PolarHBondContact O-N 3.02Å
867	P	65.2	Low	65	Low	79 Å²	79	63.3 Å²	63.3	51%	0.513	35%	0.348	S	S	.	.			trans	-60.3	134.8	175.8	-21.8	31.5	0	0	0	110.3	E863 P869	E863-P867 VanDerWaalsContact O-CA 3.24Å; E863-P867 WeakPolarHBondContact O-CA 3.33Å; E863-P867 WeakPolarHBondContact O-CD 3.5Å; P867-P869 WeakPolarHBondContact O-CD 3.29Å; P867-P869 VanDerWaalsContact O-N 3.17Å
868	N	68.8	Low	64.4	Low	43 Å²	43	62 Å²	62	23%	0.23	34%	0.336	C	S	.	.			trans	-62.8	118.6	175.4	-179.4	-11.3	0	0	0	109.1	R866 F870 S871	R866-N868 PolarHBondContact O-N 3.02Å; N868-F870 PolarHBondContact O-N 2.68Å; N868-F870 PolarHBondContact OD1-N 3.28Å; N868-F870 VanDerWaalsContact OD1-N 3.12Å; N868-S871 PolarHBondContact O-N 3.42Å; N868-S871 VanDerWaalsContact O-N 3.13Å
869	P	65.4	Low	63.7	Low	51 Å²	51	69.8 Å²	69.8	33%	0.331	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.3	-174	23.5	-32.2	0	0	0	113.9	L643 P867	L643-P869 HydrophobicContact CD2-CB 4.34Å; L643-P869 HydrophobicContact CD2-CG 4.15Å; P867-P869 WeakPolarHBondContact O-CD 3.29Å; P867-P869 VanDerWaalsContact O-N 3.17Å
870	F	69	Low	63.4	Low	52 Å²	52	70.9 Å²	70.9	23%	0.228	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-0.2	-178.8	-53.2	-75.4	0	0	0	114.1	E647 R650 V651 N868	E647-F870 HydrophobicContact CB-CE2 4.02Å; E647-F870 HydrophobicContact CB-CZ 4.14Å; E647-F870 HydrophobicContact CG-CE2 4.05Å; E647-F870 WeakPolarHBondContact O-CZ 3.36Å; R650-F870 HydrophobicContact CB-CE1 4.39Å; R650-F870 HydrophobicContact CB-CE2 4.33Å; R650-F870 HydrophobicContact CB-CZ 3.91Å; R650-F870 HydrophobicContact CG-CE1 4.27Å; R650-F870 HydrophobicContact CG-CE2 4.37Å; R650-F870 HydrophobicContact CG-CZ 4.12Å; V651-F870 HydrophobicContact CB-CE1 4.43Å; V651-F870 HydrophobicContact CG2-CE1 3.54Å; V651-F870 HydrophobicContact CG2-CZ 3.69Å; N868-F870 PolarHBondContact O-N 2.68Å; N868-F870 PolarHBondContact OD1-N 3.28Å; N868-F870 VanDerWaalsContact OD1-N 3.12Å
871	S	65.6	Low	63.2	Low	31 Å²	31	72.7 Å²	72.7	22%	0.217	38%	0.382	C	S	.	.			trans	-100.4	112.9	-175.9	178.3	0	0	0	0	111.1	N868 R878	N868-S871 PolarHBondContact O-N 3.42Å; N868-S871 VanDerWaalsContact O-N 3.13Å; S871-R878 PolarHBondContact OG-NH2 3.04Å
872	N	54.3	Low	63.7	Low	162 Å²	162	71.7 Å²	71.7	87%	0.866	38%	0.376	S	S	*	.			trans	-86.6	-8	176.3	-70.4	-17.4	0	0	0	114
873	L	53.9	Low	64.2	Low	91 Å²	91	73 Å²	73	48%	0.476	38%	0.384	S	S	.	.	S	Bend	trans	-93.6	125.5	-176.5	-86.9	127	0	0	0	111.2
874	P	50.7	Low	64.8	Low	88 Å²	88	72 Å²	72	57%	0.571	38%	0.38	S	S	*	.			trans	-63.9	139.1	169.8	-15.3	28	0	0	0	111.3	S876 Q877	P874-S876 PolarHBondContact O-N 3.34Å; P874-Q877 PolarHBondContact O-N 2.92Å
875	Y	49.4	Very low	65.6	Low	42 Å²	42	69.8 Å²	69.8	17%	0.165	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-51.5	-32.4	-174.9	-167.7	-73.7	0	0	0	114.8	Y806 S856 C860 E863 Q877 R878	Y806-Y875 HydrophobicContact CE1-CE2 4.11Å; Y806-Y875 AromaticContact CE1-CZ 3.86Å; Y806-Y875 WeakPolarHBondContact CE1-OH 3.44Å; Y806-Y875 HydrophobicContact CE2-CD2 4.34Å; Y806-Y875 AromaticContact CE2-CE2 3.72Å; Y806-Y875 HydrophobicContact CE2-CE2 3.72Å; Y806-Y875 AromaticContact CZ-CE2 3.24Å; Y806-Y875 AromaticContact CZ-CZ 3.42Å; Y806-Y875 VanDerWaalsContact CZ-CZ 3.42Å; Y806-Y875 VanDerWaalsContact CZ-OH 3.26Å; Y806-Y875 WeakPolarHBondContact OH-CE2 3.4Å; Y806-Y875 PolarHBondContact OH-OH 2.89Å; S856-Y875 PolarHBondContact O-OH 3.23Å; C860-Y875 HydrophobicContact CB-CE1 4.42Å; C860-Y875 HydrophobicContact CB-CE2 4.2Å; C860-Y875 WeakPolarHBondContact SG-CE1 3.38Å; C860-Y875 PolarHBondContact SG-OH 2.77Å; E863-Y875 HydrophobicContact CB-CD2 4.48Å; E863-Y875 VanDerWaalsContact OE2-CD2 3.25Å; E863-Y875 WeakPolarHBondContact OE2-CD2 3.48Å; Y875-Q877 PolarHBondContact O-N 3.17Å; Y875-R878 PolarHBondContact O-N 3.43Å
876	S	49.8	Very low	66.5	Low	114 Å²	114	67.6 Å²	67.6	80%	0.797	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-57.3	-9	-174.2	60.2	0	0	0	0	115.1	P874	P874-S876 PolarHBondContact O-N 3.34Å
877	Q	52.5	Low	67.4	Low	143 Å²	143	65.6 Å²	65.6	67%	0.668	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-104.6	-10.7	177.7	-66.8	-176.4	-14.7	0	0	115.1	P874 Y875 K879	P874-Q877 PolarHBondContact O-N 2.92Å; Y875-Q877 PolarHBondContact O-N 3.17Å; Q877-K879 PolarHBondContact O-N 3.49Å
878	R	60.8	Low	68.5	Low	74 Å²	74	62 Å²	62	28%	0.279	33%	0.327	S	S	.	.			trans	-95.5	92.3	-178.5	-67.9	-173.8	-177.1	157.4	5.1	110.7	Y806 E863 S871 Y875	Y806-R878 HydrophobicContact CD1-CB 3.98Å; Y806-R878 HydrophobicContact CE1-CB 4.32Å; Y806-R878 HydrophobicContact CG-CB 4.46Å; E863-R878 IonicContact OE1-NH1 2.8Å; S871-R878 PolarHBondContact OG-NH2 3.04Å; Y875-R878 PolarHBondContact O-N 3.43Å
879	K	60.8	Low	69.4	Low	169 Å²	169	63.3 Å²	63.3	74%	0.735	33%	0.332	S	S	*	.			trans	-80.7	125.7	167.1	-90.3	-174.2	172	-173.1	0	109.7	Q877	Q877-K879 PolarHBondContact O-N 3.49Å
880	L	70.9	Confident	70.6	Confident	22 Å²	22	61 Å²	61	12%	0.115	32%	0.316	C	S	.	.			trans	-74.7	118.1	158.8	-60.6	173.6	0	0	0	106.2	L805 Y806 F809	L805-L880 HydrophobicContact CD1-CD1 4.4Å; L805-L880 HydrophobicContact CD2-CD1 3.74Å; L805-L880 HydrophobicContact CG-CD1 3.88Å; L805-L880 HydrophobicContact CG-CD2 4.07Å; L805-L880 WeakPolarHBondContact O-CD2 3.06Å; Y806-L880 HydrophobicContact CD1-CD2 3.47Å; Y806-L880 VanDerWaalsContact CD1-CD2 3.47Å; Y806-L880 HydrophobicContact CD1-CG 4.02Å; Y806-L880 HydrophobicContact CE1-CD1 4.28Å; Y806-L880 HydrophobicContact CE1-CD2 3.81Å; Y806-L880 HydrophobicContact CE1-CG 3.89Å; Y806-L880 HydrophobicContact CG-CD2 4.41Å; F809-L880 HydrophobicContact CB-CB 4.49Å; F809-L880 HydrophobicContact CB-CD2 3.89Å
881	D	69.5	Low	71.6	Confident	71 Å²	71	58.6 Å²	58.6	38%	0.38	31%	0.306	S	S	.	.			trans	-140.1	148.8	179.1	-140.1	-16.9	0	0	0	109.8	F809	F809-D881 PolarHBondContact O-N 3.34Å
882	L	80.2	Confident	72.7	Confident	4 Å²	4	61 Å²	61	2%	0.021	31%	0.313	C	S	.	.			trans	-147.5	121	-170.2	-136.3	164.2	0	0	0	107.9	F809 L818 T845 L852 A884 V887 L1053	F809-L882 HydrophobicContact CD1-CD1 3.33Å; F809-L882 HydrophobicContact CD1-CG 4.08Å; F809-L882 HydrophobicContact CE1-CD1 3.44Å; F809-L882 VanDerWaalsContact CE1-CD1 3.44Å; F809-L882 HydrophobicContact CG-CD1 4.45Å; L818-L882 HydrophobicContact CD1-CD2 3.68Å; T845-L882 HydrophobicContact CG2-CD1 4.18Å; T845-L882 HydrophobicContact CG2-CD2 4.34Å; L852-L882 HydrophobicContact CD1-CB 4.22Å; L852-L882 HydrophobicContact CD1-CD1 3.31Å; L852-L882 HydrophobicContact CD1-CG 4.4Å; L882-A884 PolarHBondContact O-N 3.17Å; L882-V887 HydrophobicContact CD2-CG2 3.34Å; L882-L1053 HydrophobicContact CB-CD1 4.42Å; L882-L1053 WeakPolarHBondContact O-CD2 3.33Å
883	D	82.7	Confident	74.3	Confident	44 Å²	44	53.3 Å²	53.3	24%	0.235	27%	0.272	C	S	.	.			trans	-70.7	118.1	-179	-169.1	-29.3	0	0	0	110	R815 N885 D886 V887	R815-D883 IonicContact CZ-OD2 3.15Å; R815-D883 IonicContact NE-OD2 3.83Å; R815-D883 IonicContact NH2-OD2 2.72Å; R815-D883 PolarHBondContact NH2-OD2 2.84Å; D883-N885 PolarHBondContact O-N 3.09Å; D883-N885 WeakPolarHBondContact OD1-CB 3.13Å; D883-N885 PolarHBondContact OD1-N 3.06Å; D883-D886 HydrophobicContact CB-CB 4.13Å; D883-D886 VanDerWaalsContact CB-OD2 3.3Å; D883-D886 WeakPolarHBondContact CB-OD2 2.89Å; D883-D886 PolarHBondContact O-N 3.03Å; D883-V887 PolarHBondContact O-N 3.06Å
884	A	84.2	Confident	76	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-33.2	179.2	0	0	0	0	0	112.4	L882 V888 E1056 L1057 I1060	L882-A884 PolarHBondContact O-N 3.17Å; A884-V888 WeakPolarHBondContact O-CG2 3.27Å; A884-V888 PolarHBondContact O-N 3.23Å; A884-V888 VanDerWaalsContact O-N 3.16Å; A884-E1056 HydrophobicContact CB-CB 4.34Å; A884-E1056 HydrophobicContact CB-CG 3.94Å; A884-L1057 HydrophobicContact CB-CD1 4.41Å; A884-L1057 HydrophobicContact CB-CG 3.97Å; A884-I1060 HydrophobicContact CB-CD1 3.61Å
885	N	86.8	Confident	77.8	Confident	77 Å²	77	45.9 Å²	45.9	41%	0.412	23%	0.228	S	C	.	.	H	α-helix	trans	-69.3	-45	177.5	-68.3	-54.9	0	0	0	111.5	D883 V887 V888 E889 I1060	D883-N885 PolarHBondContact O-N 3.09Å; D883-N885 WeakPolarHBondContact OD1-CB 3.13Å; D883-N885 PolarHBondContact OD1-N 3.06Å; N885-V887 PolarHBondContact O-N 3.22Å; N885-V888 PolarHBondContact O-N 3.14Å; N885-V888 VanDerWaalsContact O-N 3.13Å; N885-E889 WeakPolarHBondContact O-CB 3.37Å; N885-E889 WeakPolarHBondContact O-CG 3.46Å; N885-E889 PolarHBondContact O-N 3.45Å; N885-I1060 WeakPolarHBondContact OD1-CD1 3.28Å
886	D	87.5	Confident	79.6	Confident	17 Å²	17	48 Å²	48	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-36.5	179.5	-72.1	-43.4	0	0	0	110.9	R815 L818 Q819 D883 C890	R815-D886 VanDerWaalsContact CG-OD2 3.25Å; R815-D886 WeakPolarHBondContact CG-OD2 3.48Å; R815-D886 IonicContact CZ-OD2 3.46Å; R815-D886 IonicContact NE-OD2 2.7Å; R815-D886 PolarHBondContact NE-OD2 3.18Å; L818-D886 HydrophobicContact CB-CB 4.47Å; L818-D886 HydrophobicContact CD1-CB 4.24Å; Q819-D886 PolarHBondContact NE2-OD1 3.21Å; Q819-D886 VanDerWaalsContact NE2-OD1 3.1Å; D883-D886 HydrophobicContact CB-CB 4.13Å; D883-D886 VanDerWaalsContact CB-OD2 3.3Å; D883-D886 WeakPolarHBondContact CB-OD2 2.89Å; D883-D886 PolarHBondContact O-N 3.03Å; D886-C890 VanDerWaalsContact O-CB 3.29Å; D886-C890 WeakPolarHBondContact O-CB 3.45Å; D886-C890 PolarHBondContact O-N 3.47Å
887	V	87.8	Confident	81.4	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-66	-48.5	174.1	178.2	0	0	0	0	111.6	L818 T845 L846 V849 L882 D883 N885 E889 C890 I891	L818-V887 HydrophobicContact CD1-CG2 4.13Å; T845-V887 HydrophobicContact CG2-CG2 4.36Å; L846-V887 HydrophobicContact CD1-CG1 4.36Å; V849-V887 HydrophobicContact CG2-CG1 4.5Å; L882-V887 HydrophobicContact CD2-CG2 3.34Å; D883-V887 PolarHBondContact O-N 3.06Å; N885-V887 PolarHBondContact O-N 3.22Å; V887-E889 PolarHBondContact O-N 3.36Å; V887-C890 PolarHBondContact O-N 3Å; V887-I891 WeakPolarHBondContact O-CG1 3.22Å; V887-I891 PolarHBondContact O-N 2.89Å
888	V	86.8	Confident	83	Confident	5 Å²	5	36.5 Å²	36.5	3%	0.03	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-43.5	-178.7	170.5	0	0	0	0	111	A884 N885 C890 I891 K892 I982 L1057 I1060	A884-V888 WeakPolarHBondContact O-CG2 3.27Å; A884-V888 PolarHBondContact O-N 3.23Å; A884-V888 VanDerWaalsContact O-N 3.16Å; N885-V888 PolarHBondContact O-N 3.14Å; N885-V888 VanDerWaalsContact O-N 3.13Å; V888-C890 PolarHBondContact O-N 3.03Å; V888-I891 PolarHBondContact O-N 3.06Å; V888-K892 HydrophobicContact CG1-CD 4.45Å; V888-K892 WeakPolarHBondContact O-CG 3.28Å; V888-K892 PolarHBondContact O-N 3.04Å; V888-I982 HydrophobicContact CG2-CD1 4.4Å; V888-L1057 HydrophobicContact CG2-CD2 3.69Å; V888-I1060 HydrophobicContact CB-CG2 4.31Å; V888-I1060 HydrophobicContact CG1-CG2 4.11Å; V888-I1060 HydrophobicContact CG2-CG2 3.95Å
889	E	88.7	Confident	84.2	Confident	70 Å²	70	37.7 Å²	37.7	33%	0.327	18%	0.182	S	C	.	.	H	α-helix	trans	-63.6	-39.2	176.9	-71.5	-55.7	132.9	0	0	112.2	Q822 N885 V887 I891 K892 G893	Q822-E889 PolarHBondContact NE2-O 2.94Å; N885-E889 WeakPolarHBondContact O-CB 3.37Å; N885-E889 WeakPolarHBondContact O-CG 3.46Å; N885-E889 PolarHBondContact O-N 3.45Å; V887-E889 PolarHBondContact O-N 3.36Å; E889-I891 PolarHBondContact O-N 3.34Å; E889-K892 PolarHBondContact O-N 3.35Å; E889-K892 IonicContact OE1-NZ 3.61Å; E889-K892 PolarHBondContact OE1-NZ 2.96Å; E889-G893 PolarHBondContact O-N 2.76Å
890	C	89.9	Confident	85.1	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-63.2	-42	173.6	-161	0	0	0	0	111.9	L818 Q822 D886 V887 V888 G893 V894	L818-C890 HydrophobicContact CD2-CB 4.42Å; Q822-C890 HydrophobicContact CB-CB 4.35Å; D886-C890 VanDerWaalsContact O-CB 3.29Å; D886-C890 WeakPolarHBondContact O-CB 3.45Å; D886-C890 PolarHBondContact O-N 3.47Å; V887-C890 PolarHBondContact O-N 3Å; V888-C890 PolarHBondContact O-N 3.03Å; C890-G893 PolarHBondContact O-N 3.14Å; C890-V894 PolarHBondContact O-N 3.37Å
891	I	90.3	Very high	85.6	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-70.1	-35.4	176.5	-59.9	-64.8	0	0	0	112.1	A842 L843 L846 V887 V888 E889 G893 V894 V895 I982 L983	A842-I891 HydrophobicContact CB-CD1 4.15Å; L843-I891 HydrophobicContact CD2-CD1 4.03Å; L846-I891 HydrophobicContact CB-CD1 4.34Å; L846-I891 HydrophobicContact CD2-CD1 4.23Å; L846-I891 HydrophobicContact CD2-CG1 4.45Å; V887-I891 WeakPolarHBondContact O-CG1 3.22Å; V887-I891 PolarHBondContact O-N 2.89Å; V888-I891 PolarHBondContact O-N 3.06Å; E889-I891 PolarHBondContact O-N 3.34Å; I891-G893 PolarHBondContact O-N 2.89Å; I891-V894 HydrophobicContact CD1-CG2 4.5Å; I891-V894 WeakPolarHBondContact O-CA 3.5Å; I891-V894 VanDerWaalsContact O-CB 3.3Å; I891-V894 WeakPolarHBondContact O-CB 3.33Å; I891-V894 PolarHBondContact O-N 2.56Å; I891-V895 PolarHBondContact O-N 2.75Å; I891-I982 HydrophobicContact CB-CG2 3.91Å; I891-I982 HydrophobicContact CG1-CG2 4.24Å; I891-I982 HydrophobicContact CG2-CG2 3.62Å; I891-L983 HydrophobicContact CG2-CD2 3.99Å
892	K	89.4	Confident	86.1	Confident	82 Å²	82	29.8 Å²	29.8	36%	0.357	14%	0.142	S	C	.	.	H	α-helix	trans	-57.2	-40.6	169.3	-74.8	176.3	-176.5	171	0	111	V888 E889 V894 V895 E896	V888-K892 HydrophobicContact CG1-CD 4.45Å; V888-K892 WeakPolarHBondContact O-CG 3.28Å; V888-K892 PolarHBondContact O-N 3.04Å; E889-K892 PolarHBondContact O-N 3.35Å; E889-K892 IonicContact OE1-NZ 3.61Å; E889-K892 PolarHBondContact OE1-NZ 2.96Å; K892-V894 VanDerWaalsContact C-N 3.29Å; K892-V894 PolarHBondContact O-N 3.15Å; K892-V895 WeakPolarHBondContact O-CA 3.41Å; K892-V895 WeakPolarHBondContact O-CB 3.37Å; K892-V895 PolarHBondContact O-N 3.44Å; K892-E896 PolarHBondContact O-N 2.91Å
893	G	87.6	Confident	86.2	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-55.8	-41	170.7	0	0	0	0	0	113.1	I825 E889 C890 I891 V895 E896 F897	I825-G893 WeakPolarHBondContact CG2-O 3.13Å; E889-G893 PolarHBondContact O-N 2.76Å; C890-G893 PolarHBondContact O-N 3.14Å; I891-G893 PolarHBondContact O-N 2.89Å; G893-V895 VanDerWaalsContact C-N 3.33Å; G893-V895 PolarHBondContact O-N 3.35Å; G893-E896 PolarHBondContact O-N 3.46Å; G893-F897 WeakPolarHBondContact O-CB 3.29Å; G893-F897 PolarHBondContact O-N 3.3Å
894	V	89.9	Confident	86.2	Confident	6 Å²	6	30.1 Å²	30.1	4%	0.036	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-38.9	174.9	-176.7	0	0	0	0	111.7	I825 I839 A842 C890 I891 K892 F897 A898 I986	I825-V894 HydrophobicContact CD1-CG2 4.11Å; I839-V894 HydrophobicContact CG1-CG1 4.42Å; I839-V894 HydrophobicContact CG1-CG2 4.23Å; I839-V894 HydrophobicContact CG2-CG1 3.94Å; I839-V894 HydrophobicContact CG2-CG2 4.33Å; A842-V894 HydrophobicContact CB-CG2 4.26Å; C890-V894 PolarHBondContact O-N 3.37Å; I891-V894 HydrophobicContact CD1-CG2 4.5Å; I891-V894 WeakPolarHBondContact O-CA 3.5Å; I891-V894 VanDerWaalsContact O-CB 3.3Å; I891-V894 WeakPolarHBondContact O-CB 3.33Å; I891-V894 PolarHBondContact O-N 2.56Å; K892-V894 VanDerWaalsContact C-N 3.29Å; K892-V894 PolarHBondContact O-N 3.15Å; V894-F897 PolarHBondContact O-N 3.49Å; V894-A898 PolarHBondContact O-N 3.14Å; V894-I986 HydrophobicContact CG1-CD1 4.26Å
895	V	88	Confident	85.7	Confident	16 Å²	16	31.3 Å²	31.3	10%	0.097	15%	0.148	C	C	.	.	H	α-helix	trans	-64.4	-46.6	175.6	176.6	0	0	0	0	110.6	I891 K892 G893 F897 A898 Q899 P985 I986 Y989	I891-V895 PolarHBondContact O-N 2.75Å; K892-V895 WeakPolarHBondContact O-CA 3.41Å; K892-V895 WeakPolarHBondContact O-CB 3.37Å; K892-V895 PolarHBondContact O-N 3.44Å; G893-V895 VanDerWaalsContact C-N 3.33Å; G893-V895 PolarHBondContact O-N 3.35Å; V895-F897 VanDerWaalsContact C-N 3.28Å; V895-F897 PolarHBondContact O-N 3.44Å; V895-A898 WeakPolarHBondContact O-CB 3.36Å; V895-A898 PolarHBondContact O-N 2.92Å; V895-A898 VanDerWaalsContact O-N 3.13Å; V895-Q899 PolarHBondContact O-N 3.07Å; V895-P985 HydrophobicContact CG1-CB 3.85Å; V895-P985 WeakPolarHBondContact CG1-O 3.49Å; V895-P985 HydrophobicContact CG2-CB 4.11Å; V895-I986 HydrophobicContact CG2-CB 4.22Å; V895-Y989 HydrophobicContact CG1-CD2 4.36Å; V895-Y989 HydrophobicContact CG1-CE2 3.88Å
896	E	87.3	Confident	85	Confident	88 Å²	88	28.2 Å²	28.2	41%	0.411	13%	0.134	S	C	.	.	H	α-helix	trans	-62.8	-35.1	176.7	-70.7	-176	-154.1	0	0	112.3	L826 K892 G893 Q899 R900	L826-E896 HydrophobicContact CD2-CB 4.15Å; L826-E896 HydrophobicContact CD2-CG 4.47Å; L826-E896 WeakPolarHBondContact CD2-OE2 3.22Å; K892-E896 PolarHBondContact O-N 2.91Å; G893-E896 PolarHBondContact O-N 3.46Å; E896-Q899 WeakPolarHBondContact O-CB 3.5Å; E896-Q899 PolarHBondContact O-N 3.21Å; E896-R900 WeakPolarHBondContact O-CG 3.46Å; E896-R900 PolarHBondContact O-N 2.89Å
897	F	87.4	Confident	84.2	Confident	12 Å²	12	33.6 Å²	33.6	5%	0.053	17%	0.17	C	C	.	.	H	α-helix	trans	-65.1	-43.7	172.5	-177.2	-90.2	0	0	0	111.6	I825 L832 I839 G893 V894 V895 Q899 R900 I901 F946 L950	I825-F897 HydrophobicContact CG2-CB 3.68Å; I825-F897 HydrophobicContact CG2-CD2 4.42Å; I825-F897 HydrophobicContact CG2-CG 4.29Å; L832-F897 HydrophobicContact CD2-CE2 4.06Å; L832-F897 HydrophobicContact CD2-CZ 3.74Å; I839-F897 HydrophobicContact CD1-CD1 3.5Å; I839-F897 VanDerWaalsContact CD1-CD1 3.5Å; I839-F897 HydrophobicContact CD1-CE1 3.63Å; I839-F897 HydrophobicContact CD1-CG 3.96Å; I839-F897 HydrophobicContact CD1-CZ 4.23Å; G893-F897 WeakPolarHBondContact O-CB 3.29Å; G893-F897 PolarHBondContact O-N 3.3Å; V894-F897 PolarHBondContact O-N 3.49Å; V895-F897 VanDerWaalsContact C-N 3.28Å; V895-F897 PolarHBondContact O-N 3.44Å; F897-Q899 VanDerWaalsContact C-N 3.29Å; F897-Q899 PolarHBondContact O-N 3.31Å; F897-R900 WeakPolarHBondContact O-CB 3.33Å; F897-R900 PolarHBondContact O-N 3.43Å; F897-I901 HydrophobicContact CD1-CD1 3.92Å; F897-I901 HydrophobicContact CE1-CD1 3.47Å; F897-I901 VanDerWaalsContact CE1-CD1 3.47Å; F897-I901 HydrophobicContact CZ-CD1 4.19Å; F897-F946 HydrophobicContact CE1-CZ 4.4Å; F897-F946 HydrophobicContact CZ-CZ 4.27Å; F897-L950 HydrophobicContact CE1-CD2 4.31Å
898	A	86.2	Confident	83	Confident	2 Å²	2	38 Å²	38	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-63.3	-36.1	175.2	0	0	0	0	0	112.1	V894 V895 R900 I901 I986 W993	V894-A898 PolarHBondContact O-N 3.14Å; V895-A898 WeakPolarHBondContact O-CB 3.36Å; V895-A898 PolarHBondContact O-N 2.92Å; V895-A898 VanDerWaalsContact O-N 3.13Å; A898-R900 VanDerWaalsContact C-N 3.25Å; A898-R900 PolarHBondContact O-N 3.48Å; A898-I901 CarbonylContact O-C 3.56Å; A898-I901 WeakPolarHBondContact O-CA 3.26Å; A898-I901 PolarHBondContact O-N 3.39Å; A898-I986 HydrophobicContact CB-CD1 4.02Å; A898-I986 HydrophobicContact CB-CG1 3.64Å; A898-W993 HydrophobicContact CB-CZ2 4.36Å
899	Q	86	Confident	82	Confident	100 Å²	100	40.3 Å²	40.3	47%	0.467	21%	0.209	S	C	.	.	H	α-helix	trans	-60.1	-32.8	174.4	178.1	175.9	7.3	0	0	112.9	V895 E896 F897 I901 Y989	V895-Q899 PolarHBondContact O-N 3.07Å; E896-Q899 WeakPolarHBondContact O-CB 3.5Å; E896-Q899 PolarHBondContact O-N 3.21Å; F897-Q899 VanDerWaalsContact C-N 3.29Å; F897-Q899 PolarHBondContact O-N 3.31Å; Q899-I901 PolarHBondContact O-N 3.42Å; Q899-Y989 HydrophobicContact CB-CD1 3.99Å; Q899-Y989 HydrophobicContact CB-CD2 4.27Å; Q899-Y989 HydrophobicContact CB-CE1 3.63Å; Q899-Y989 HydrophobicContact CB-CE2 3.94Å; Q899-Y989 HydrophobicContact CB-CG 4.29Å; Q899-Y989 HydrophobicContact CG-CD1 4.21Å; Q899-Y989 HydrophobicContact CG-CE1 3.51Å
900	R	80.7	Confident	81.1	Confident	75 Å²	75	41 Å²	41	28%	0.283	21%	0.212	S	C	.	.	H	α-helix	trans	-68.5	-25.1	174.3	-63.5	167.4	-159.7	-169	-3	112.3	I825 L826 E896 F897 A898 D902 V915	I825-R900 PolarHBondContact O-NH1 2.58Å; L826-R900 PolarHBondContact O-NH1 2.92Å; L826-R900 PolarHBondContact O-NH2 3.25Å; E896-R900 WeakPolarHBondContact O-CG 3.46Å; E896-R900 PolarHBondContact O-N 2.89Å; F897-R900 WeakPolarHBondContact O-CB 3.33Å; F897-R900 PolarHBondContact O-N 3.43Å; A898-R900 VanDerWaalsContact C-N 3.25Å; A898-R900 PolarHBondContact O-N 3.48Å; R900-D902 VanDerWaalsContact C-N 3.25Å; R900-D902 PolarHBondContact O-N 2.93Å; R900-V915 WeakPolarHBondContact O-CG2 3.49Å
901	I	80.3	Confident	80.3	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.221	C	C	.	.			trans	-93.2	53.7	177.8	-48.7	166.4	0	0	0	109.1	F897 A898 Q899 V903 L913 F946 L950 W993	F897-I901 HydrophobicContact CD1-CD1 3.92Å; F897-I901 HydrophobicContact CE1-CD1 3.47Å; F897-I901 VanDerWaalsContact CE1-CD1 3.47Å; F897-I901 HydrophobicContact CZ-CD1 4.19Å; A898-I901 CarbonylContact O-C 3.56Å; A898-I901 WeakPolarHBondContact O-CA 3.26Å; A898-I901 PolarHBondContact O-N 3.39Å; Q899-I901 PolarHBondContact O-N 3.42Å; I901-V903 HydrophobicContact CG2-CG2 4.38Å; I901-V903 PolarHBondContact O-N 3.21Å; I901-L913 HydrophobicContact CB-CD2 4.44Å; I901-L913 HydrophobicContact CG2-CD1 4.3Å; I901-L913 HydrophobicContact CG2-CD2 3.97Å; I901-F946 HydrophobicContact CD1-CE1 3.62Å; I901-F946 HydrophobicContact CD1-CZ 3.93Å; I901-F946 HydrophobicContact CG1-CE1 4.24Å; I901-L950 HydrophobicContact CD1-CD2 3.88Å; I901-W993 HydrophobicContact CB-CZ2 4.25Å; I901-W993 HydrophobicContact CD1-CZ2 4.01Å; I901-W993 HydrophobicContact CG2-CZ2 4.32Å; I901-W993 PolarHBondContact O-NE1 2.9Å
902	D	81.3	Confident	79.4	Confident	19 Å²	19	46 Å²	46	10%	0.102	24%	0.239	C	C	.	.			trans	-87.3	102.7	172.7	-174.6	28.5	0	0	0	110.1	R900 K904 L913	R900-D902 VanDerWaalsContact C-N 3.25Å; R900-D902 PolarHBondContact O-N 2.93Å; D902-K904 WeakPolarHBondContact OD2-CE 3.33Å; D902-K904 IonicContact OD2-NZ 3.55Å; D902-K904 PolarHBondContact OD2-NZ 3.15Å; D902-L913 VanDerWaalsContact C-CD2 3.49Å; D902-L913 VanDerWaalsContact O-CD2 3.31Å; D902-L913 WeakPolarHBondContact O-CD2 3.44Å
903	V	82	Confident	78.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	124.2	-175	-173.6	0	0	0	0	110.6	I901 P911 L913 L943 T992 L995 A996	I901-V903 HydrophobicContact CG2-CG2 4.38Å; I901-V903 PolarHBondContact O-N 3.21Å; V903-P911 HydrophobicContact CG1-CB 3.82Å; V903-L913 HydrophobicContact CB-CD2 4.44Å; V903-L913 HydrophobicContact CG2-CD2 3.79Å; V903-L943 HydrophobicContact CG1-CD2 4.04Å; V903-L943 HydrophobicContact CG2-CD2 4.2Å; V903-T992 PolarHBondContact N-OG1 3.4Å; V903-T992 WeakPolarHBondContact O-CB 3.44Å; V903-L995 HydrophobicContact CG1-CB 3.93Å; V903-A996 HydrophobicContact CG1-CB 4.15Å; V903-A996 HydrophobicContact CG2-CB 4.14Å
904	K	82	Confident	77.6	Confident	56 Å²	56	48 Å²	48	24%	0.243	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	155.6	176.1	-68	178.8	-178.6	159.6	0	111.2	D902 I912 N914	D902-K904 WeakPolarHBondContact OD2-CE 3.33Å; D902-K904 IonicContact OD2-NZ 3.55Å; D902-K904 PolarHBondContact OD2-NZ 3.15Å; K904-I912 PolarHBondContact N-O 2.85Å; K904-I912 PolarHBondContact O-N 2.82Å; K904-N914 PolarHBondContact NZ-ND2 3.19Å
905	L	74.6	Confident	76.4	Confident	26 Å²	26	50.3 Å²	50.3	14%	0.136	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	124.4	171.8	-66.8	172.5	0	0	0	109.8	L995 P1000 Q1084 L1085	L905-L995 HydrophobicContact CD1-CD2 4.42Å; L905-P1000 HydrophobicContact CD1-CG 4.25Å; L905-P1000 HydrophobicContact CD2-CG 4.35Å; L905-Q1084 HydrophobicContact CD1-CB 4.4Å; L905-Q1084 VanDerWaalsContact N-OE1 3.11Å; L905-L1085 HydrophobicContact CD1-CD2 3.84Å; L905-L1085 HydrophobicContact CD1-CG 4.45Å
906	G	72.1	Confident	75	Confident	11 Å²	11	54.6 Å²	54.6	11%	0.113	31%	0.305	C	S	.	.			trans	-71.4	176	174	0	0	0	0	0	113.5	T908 N909 E910	G906-T908 PolarHBondContact O-N 3.29Å; G906-T908 VanDerWaalsContact O-N 3.15Å; G906-N909 WeakPolarHBondContact O-CA 3.28Å; G906-N909 PolarHBondContact O-N 3.15Å; G906-E910 PolarHBondContact N-O 3.29Å
907	P	70.3	Confident	73.9	Confident	130 Å²	130	54.5 Å²	54.5	84%	0.844	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.4	176	24.7	-32.9	0	0	0	113.3
908	T	62.7	Low	72.7	Confident	94 Å²	94	55.4 Å²	55.4	58%	0.577	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	5.4	173.8	54.1	0	0	0	0	113.4	G906 E910	G906-T908 PolarHBondContact O-N 3.29Å; G906-T908 VanDerWaalsContact O-N 3.15Å; T908-E910 PolarHBondContact O-N 3.43Å
909	N	66.5	Low	71.5	Confident	55 Å²	55	61.3 Å²	61.3	29%	0.294	34%	0.338	S	S	.	.	S	Bend	trans	63.6	14.4	-176.3	-51.1	-55.2	0	0	0	115.5	G906 Y1088	G906-N909 WeakPolarHBondContact O-CA 3.28Å; G906-N909 PolarHBondContact O-N 3.15Å; N909-Y1088 HydrophobicContact CB-CD2 3.52Å; N909-Y1088 HydrophobicContact CB-CE2 3.42Å; N909-Y1088 VanDerWaalsContact CB-CE2 3.42Å; N909-Y1088 VanDerWaalsContact CG-CE2 3.42Å; N909-Y1088 WeakPolarHBondContact ND2-CD2 3.45Å; N909-Y1088 WeakPolarHBondContact ND2-CE2 3.44Å; N909-Y1088 WeakPolarHBondContact OD1-CD2 3.47Å
910	E	68.9	Low	70.5	Confident	83 Å²	83	62.5 Å²	62.5	39%	0.388	34%	0.342	S	S	.	.			trans	-77.5	146.7	165.7	-62.1	-170	154.4	0	0	109.7	G906 T908 I912 K940	G906-E910 PolarHBondContact N-O 3.29Å; T908-E910 PolarHBondContact O-N 3.43Å; E910-I912 PolarHBondContact O-N 2.99Å; E910-K940 IonicContact OE1-NZ 3.42Å; E910-K940 PolarHBondContact OE1-NZ 3.1Å; E910-K940 IonicContact OE2-NZ 2.84Å
911	P	72.1	Confident	69.8	Low	29 Å²	29	60.8 Å²	60.8	19%	0.188	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	117.7	176.8	30.1	-33.5	0	0	0	109.9	V903 L943 P999	V903-P911 HydrophobicContact CG1-CB 3.82Å; P911-L943 HydrophobicContact CB-CD2 4.08Å; P911-L943 HydrophobicContact CG-CD2 4.48Å; P911-P999 HydrophobicContact CG-CB 4.3Å
912	I	72.3	Confident	69.1	Low	79 Å²	79	60.8 Å²	60.8	41%	0.405	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144.5	-179.3	-53.5	-175	0	0	0	109.2	K904 E910	K904-I912 PolarHBondContact N-O 2.85Å; K904-I912 PolarHBondContact O-N 2.82Å; E910-I912 PolarHBondContact O-N 2.99Å
913	L	73	Confident	68.2	Low	8 Å²	8	61.6 Å²	61.6	4%	0.042	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	144	167.8	-77.4	-179.4	0	0	0	110.7	I901 D902 V903 V915 F918 M921 L943	I901-L913 HydrophobicContact CB-CD2 4.44Å; I901-L913 HydrophobicContact CG2-CD1 4.3Å; I901-L913 HydrophobicContact CG2-CD2 3.97Å; D902-L913 VanDerWaalsContact C-CD2 3.49Å; D902-L913 VanDerWaalsContact O-CD2 3.31Å; D902-L913 WeakPolarHBondContact O-CD2 3.44Å; V903-L913 HydrophobicContact CB-CD2 4.44Å; V903-L913 HydrophobicContact CG2-CD2 3.79Å; L913-V915 PolarHBondContact O-N 3.47Å; L913-F918 HydrophobicContact CB-CD2 4.21Å; L913-F918 HydrophobicContact CB-CG 4.39Å; L913-F918 HydrophobicContact CD1-CD2 3.45Å; L913-F918 VanDerWaalsContact CD1-CD2 3.45Å; L913-F918 HydrophobicContact CD1-CE2 3.41Å; L913-F918 VanDerWaalsContact CD1-CE2 3.41Å; L913-F918 HydrophobicContact CD1-CG 4.38Å; L913-F918 HydrophobicContact CD1-CZ 4.34Å; L913-F918 HydrophobicContact CG-CD2 4.27Å; L913-F918 HydrophobicContact CG-CE2 4.29Å; L913-M921 HydrophobicContact CD1-CE 4.37Å; L913-L943 HydrophobicContact CD1-CD1 3.58Å; L913-L943 HydrophobicContact CG-CD1 3.97Å; L913-L943 HydrophobicContact CG-CD2 4.19Å
914	N	65.4	Low	67.6	Low	119 Å²	119	62.1 Å²	62.1	64%	0.636	35%	0.345	S	S	*	.	S	Bend	trans	-70.8	17.1	179.5	-111.7	9.4	0	0	0	114.6	K904	K904-N914 PolarHBondContact NZ-ND2 3.19Å
915	V	66.2	Low	66.8	Low	53 Å²	53	60.7 Å²	60.7	32%	0.321	34%	0.339	S	S	.	.			trans	-106.4	120.7	-173.6	-176.4	0	0	0	0	110	R900 L913 D917 F918	R900-V915 WeakPolarHBondContact O-CG2 3.49Å; L913-V915 PolarHBondContact O-N 3.47Å; V915-D917 PolarHBondContact O-N 3.09Å; V915-D917 VanDerWaalsContact O-N 3.07Å; V915-F918 PolarHBondContact O-N 3.22Å
916	A	57.9	Low	66.4	Low	107 Å²	107	62.1 Å²	62.1	88%	0.884	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-22.4	-175.5	0	0	0	0	0	114.6
917	D	63.4	Low	65.8	Low	85 Å²	85	62.6 Å²	62.6	46%	0.455	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	26.9	-178.3	-76.8	-55.1	0	0	0	113.6	V915 H919 K920 M921	V915-D917 PolarHBondContact O-N 3.09Å; V915-D917 VanDerWaalsContact O-N 3.07Å; D917-H919 VanDerWaalsContact C-N 3.3Å; D917-H919 PolarHBondContact O-N 3.41Å; D917-K920 HydrophobicContact CB-CB 4.42Å; D917-K920 HydrophobicContact CB-CD 4.36Å; D917-K920 WeakPolarHBondContact O-CB 3.41Å; D917-K920 PolarHBondContact O-N 3.33Å; D917-K920 WeakPolarHBondContact OD1-CD 3.41Å; D917-K920 WeakPolarHBondContact OD1-CE 3.33Å; D917-K920 IonicContact OD1-NZ 3.18Å; D917-K920 PolarHBondContact OD1-NZ 3.14Å; D917-M921 PolarHBondContact O-N 3.14Å
918	F	62.4	Low	65.6	Low	32 Å²	32	58.1 Å²	58.1	14%	0.14	31%	0.312	C	S	.	.	H	α-helix	trans	-50.8	-44.2	-177.1	171.8	-115.6	0	0	0	114.2	L913 V915 K920 M921 M922 L943	L913-F918 HydrophobicContact CB-CD2 4.21Å; L913-F918 HydrophobicContact CB-CG 4.39Å; L913-F918 HydrophobicContact CD1-CD2 3.45Å; L913-F918 VanDerWaalsContact CD1-CD2 3.45Å; L913-F918 HydrophobicContact CD1-CE2 3.41Å; L913-F918 VanDerWaalsContact CD1-CE2 3.41Å; L913-F918 HydrophobicContact CD1-CG 4.38Å; L913-F918 HydrophobicContact CD1-CZ 4.34Å; L913-F918 HydrophobicContact CG-CD2 4.27Å; L913-F918 HydrophobicContact CG-CE2 4.29Å; V915-F918 PolarHBondContact O-N 3.22Å; F918-K920 VanDerWaalsContact C-N 3.33Å; F918-K920 PolarHBondContact O-N 3.36Å; F918-M921 HydrophobicContact CD2-CE 4.05Å; F918-M921 HydrophobicContact CE2-CE 4.31Å; F918-M921 WeakPolarHBondContact O-CB 3.48Å; F918-M921 PolarHBondContact O-N 3.45Å; F918-M921 VanDerWaalsContact O-N 3.14Å; F918-M922 HydrophobicContact CD1-CG 4.32Å; F918-M922 HydrophobicContact CD2-CG 3.68Å; F918-M922 HydrophobicContact CD2-SD 4.32Å; F918-M922 HydrophobicContact CE1-CG 3.84Å; F918-M922 HydrophobicContact CE2-CE 4.16Å; F918-M922 HydrophobicContact CE2-CG 3.11Å; F918-M922 HydrophobicContact CE2-SD 3.33Å; F918-M922 WeakPolarHBondContact CE2-SD 3.37Å; F918-M922 HydrophobicContact CG-CG 4.28Å; F918-M922 HydrophobicContact CZ-CE 3.75Å; F918-M922 HydrophobicContact CZ-CG 3.23Å; F918-M922 HydrophobicContact CZ-SD 3.56Å; F918-M922 VanDerWaalsContact CZ-SD 3.56Å; F918-M922 WeakPolarHBondContact O-CG 3.36Å; F918-M922 PolarHBondContact O-N 2.88Å; F918-L943 HydrophobicContact CE2-CD1 3.76Å; F918-L943 HydrophobicContact CZ-CB 3.86Å; F918-L943 HydrophobicContact CZ-CD1 3.75Å; F918-L943 HydrophobicContact CZ-CG 4.29Å
919	H	62.7	Low	65.2	Low	125 Å²	125	55.1 Å²	55.1	58%	0.579	29%	0.292	S	S	*	.	H	α-helix	trans	-61.3	-40.7	178.8	-86.3	-61.8	0	0	0	112.4	D917 M921 M922 I923	D917-H919 VanDerWaalsContact C-N 3.3Å; D917-H919 PolarHBondContact O-N 3.41Å; H919-M921 VanDerWaalsContact C-N 3.33Å; H919-M922 PolarHBondContact O-N 3.32Å; H919-I923 WeakPolarHBondContact O-CD1 3.45Å; H919-I923 VanDerWaalsContact O-CG1 3.23Å; H919-I923 WeakPolarHBondContact O-CG1 3.19Å; H919-I923 PolarHBondContact O-N 3.5Å
920	K	63.6	Low	64.4	Low	126 Å²	126	55.3 Å²	55.3	55%	0.548	30%	0.297	S	S	.	.	H	α-helix	trans	-65.8	-38.1	174.6	-65.5	-179.5	-170.5	149.6	0	111.5	D917 F918	D917-K920 HydrophobicContact CB-CB 4.42Å; D917-K920 HydrophobicContact CB-CD 4.36Å; D917-K920 WeakPolarHBondContact O-CB 3.41Å; D917-K920 PolarHBondContact O-N 3.33Å; D917-K920 WeakPolarHBondContact OD1-CD 3.41Å; D917-K920 WeakPolarHBondContact OD1-CE 3.33Å; D917-K920 IonicContact OD1-NZ 3.18Å; D917-K920 PolarHBondContact OD1-NZ 3.14Å; F918-K920 VanDerWaalsContact C-N 3.33Å; F918-K920 PolarHBondContact O-N 3.36Å
921	M	65.7	Low	63.5	Low	38 Å²	38	53.2 Å²	53.2	19%	0.187	29%	0.291	C	S	.	.	H	α-helix	trans	-60.7	-49.1	175.7	-161.1	-175	75.4	0	0	110.6	L832 L913 D917 F918 H919 I923 T924	L832-M921 HydrophobicContact CD1-CE 4.17Å; L832-M921 HydrophobicContact CD1-CG 3.83Å; L832-M921 WeakPolarHBondContact CD1-O 3.39Å; L832-M921 HydrophobicContact CD2-CE 4.21Å; L832-M921 HydrophobicContact CD2-CG 3.82Å; L832-M921 HydrophobicContact CD2-SD 4.07Å; L832-M921 HydrophobicContact CG-CG 3.69Å; L832-M921 WeakPolarHBondContact CG-O 3.32Å; L913-M921 HydrophobicContact CD1-CE 4.37Å; D917-M921 PolarHBondContact O-N 3.14Å; F918-M921 HydrophobicContact CD2-CE 4.05Å; F918-M921 HydrophobicContact CE2-CE 4.31Å; F918-M921 WeakPolarHBondContact O-CB 3.48Å; F918-M921 PolarHBondContact O-N 3.45Å; F918-M921 VanDerWaalsContact O-N 3.14Å; H919-M921 VanDerWaalsContact C-N 3.33Å; M921-I923 PolarHBondContact O-N 2.93Å; M921-T924 PolarHBondContact O-N 3.48Å; M921-T924 VanDerWaalsContact O-N 3.08Å; M921-T924 PolarHBondContact O-OG1 3.43Å
922	M	65.9	Low	62.4	Low	2 Å²	2	52.7 Å²	52.7	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-32.2	-176.3	-69.6	-68.1	-80.7	0	0	114.6	F918 H919 T924 Q925 C941 S942 F946	F918-M922 HydrophobicContact CD1-CG 4.32Å; F918-M922 HydrophobicContact CD2-CG 3.68Å; F918-M922 HydrophobicContact CD2-SD 4.32Å; F918-M922 HydrophobicContact CE1-CG 3.84Å; F918-M922 HydrophobicContact CE2-CE 4.16Å; F918-M922 HydrophobicContact CE2-CG 3.11Å; F918-M922 HydrophobicContact CE2-SD 3.33Å; F918-M922 WeakPolarHBondContact CE2-SD 3.37Å; F918-M922 HydrophobicContact CG-CG 4.28Å; F918-M922 HydrophobicContact CZ-CE 3.75Å; F918-M922 HydrophobicContact CZ-CG 3.23Å; F918-M922 HydrophobicContact CZ-SD 3.56Å; F918-M922 VanDerWaalsContact CZ-SD 3.56Å; F918-M922 WeakPolarHBondContact O-CG 3.36Å; F918-M922 PolarHBondContact O-N 2.88Å; H919-M922 PolarHBondContact O-N 3.32Å; M922-T924 PolarHBondContact O-N 3.46Å; M922-Q925 WeakPolarHBondContact O-CB 3.45Å; M922-Q925 WeakPolarHBondContact O-CG 3.33Å; M922-Q925 PolarHBondContact O-N 3.11Å; M922-Q925 PolarHBondContact SD-NE2 2.96Å; M922-C941 HydrophobicContact CB-CB 4.4Å; M922-C941 WeakPolarHBondContact CE-O 3.28Å; M922-S942 WeakPolarHBondContact CE-O 3.45Å; M922-F946 HydrophobicContact CE-CB 3.81Å; M922-F946 HydrophobicContact SD-CB 3.92Å; M922-F946 HydrophobicContact SD-CD1 4.31Å; M922-F946 HydrophobicContact SD-CG 4.1Å
923	I	63.2	Low	61.1	Low	35 Å²	35	53.6 Å²	53.6	18%	0.179	29%	0.29	C	S	.	.	H	α-helix	trans	-56.2	-32.4	173.2	-77.5	169	0	0	0	110.7	H919 M921 Q925 C931 L932	H919-I923 WeakPolarHBondContact O-CD1 3.45Å; H919-I923 VanDerWaalsContact O-CG1 3.23Å; H919-I923 WeakPolarHBondContact O-CG1 3.19Å; H919-I923 PolarHBondContact O-N 3.5Å; M921-I923 PolarHBondContact O-N 2.93Å; I923-Q925 VanDerWaalsContact C-N 3.32Å; I923-Q925 PolarHBondContact O-N 3.05Å; I923-C931 WeakPolarHBondContact CG2-O 3.33Å; I923-L932 HydrophobicContact CG2-CD2 4.17Å
924	T	69.2	Low	59.7	Low	11 Å²	11	55.2 Å²	55.2	7%	0.067	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	19.2	-178.3	71.4	0	0	0	0	115.1	L497 A831 L832 F833 M921 M922 K926	L497-T924 HydrophobicContact CD1-CG2 4.36Å; L497-T924 HydrophobicContact CD2-CG2 4.13Å; A831-T924 HydrophobicContact CB-CG2 4.31Å; L832-T924 PolarHBondContact N-O 2.86Å; L832-T924 PolarHBondContact N-OG1 3.09Å; F833-T924 WeakPolarHBondContact CD1-O 3.36Å; F833-T924 PolarHBondContact N-O 3.5Å; F833-T924 VanDerWaalsContact N-O 3.13Å; M921-T924 PolarHBondContact O-N 3.48Å; M921-T924 VanDerWaalsContact O-N 3.08Å; M921-T924 PolarHBondContact O-OG1 3.43Å; M922-T924 PolarHBondContact O-N 3.46Å; T924-K926 VanDerWaalsContact C-N 3.33Å
925	Q	64.4	Low	58.7	Low	26 Å²	26	53 Å²	53	12%	0.121	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.1	176.7	-83.2	-176.9	47.7	0	0	114.4	L832 M922 I923 F946	L832-Q925 HydrophobicContact CD1-CG 3.8Å; M922-Q925 WeakPolarHBondContact O-CB 3.45Å; M922-Q925 WeakPolarHBondContact O-CG 3.33Å; M922-Q925 PolarHBondContact O-N 3.11Å; M922-Q925 PolarHBondContact SD-NE2 2.96Å; I923-Q925 VanDerWaalsContact C-N 3.32Å; I923-Q925 PolarHBondContact O-N 3.05Å; Q925-F946 HydrophobicContact CG-CD2 4.08Å
926	K	66.4	Low	57.5	Low	57 Å²	57	58.6 Å²	58.6	25%	0.248	32%	0.316	C	S	.	.	S	Bend	trans	-130.4	148.6	-178.2	-60.6	-169.2	-169.4	178	0	109.6	T924 Y928	T924-K926 VanDerWaalsContact C-N 3.33Å; K926-Y928 VanDerWaalsContact C-N 3.3Å; K926-Y928 HydrophobicContact CB-CD1 3.88Å; K926-Y928 HydrophobicContact CB-CE1 3.61Å; K926-Y928 HydrophobicContact CD-CD1 4.42Å; K926-Y928 HydrophobicContact CD-CE1 3.37Å; K926-Y928 WeakPolarHBondContact CD-OH 3.46Å; K926-Y928 HydrophobicContact CG-CE1 4.13Å; K926-Y928 PolarHBondContact NZ-OH 2.95Å; K926-Y928 PolarHBondContact O-N 3.48Å
927	P	60.7	Low	56.4	Low	20 Å²	20	57.7 Å²	57.7	13%	0.13	30%	0.302	C	S	.	.	S	Bend	trans	-85.3	18.4	-171.5	34.2	-37	0	0	0	114.6	L712 M755 F833	L712-P927 WeakPolarHBondContact CD2-O 3.33Å; M755-P927 HydrophobicContact CE-CB 3.95Å; M755-P927 HydrophobicContact SD-CB 4.33Å; F833-P927 HydrophobicContact CD1-CB 4.24Å; F833-P927 HydrophobicContact CD2-CB 4.46Å; F833-P927 HydrophobicContact CE1-CB 4.08Å; F833-P927 HydrophobicContact CE2-CB 4.27Å; F833-P927 HydrophobicContact CG-CB 4.47Å; F833-P927 HydrophobicContact CZ-CB 4.1Å
928	Y	65.5	Low	55.2	Low	36 Å²	36	60.1 Å²	60.1	14%	0.141	32%	0.321	C	S	.	.	S	Bend	trans	-115	150.1	-174.4	60.1	-100.3	0	0	0	114.3	K926 S930 C931	K926-Y928 VanDerWaalsContact C-N 3.3Å; K926-Y928 HydrophobicContact CB-CD1 3.88Å; K926-Y928 HydrophobicContact CB-CE1 3.61Å; K926-Y928 HydrophobicContact CD-CD1 4.42Å; K926-Y928 HydrophobicContact CD-CE1 3.37Å; K926-Y928 WeakPolarHBondContact CD-OH 3.46Å; K926-Y928 HydrophobicContact CG-CE1 4.13Å; K926-Y928 PolarHBondContact NZ-OH 2.95Å; K926-Y928 PolarHBondContact O-N 3.48Å; Y928-S930 VanDerWaalsContact CD2-OG 3.28Å; Y928-S930 WeakPolarHBondContact CD2-OG 3.47Å; Y928-S930 WeakPolarHBondContact CE2-OG 3.46Å; Y928-S930 PolarHBondContact O-N 3.01Å; Y928-C931 HydrophobicContact CD2-CB 4.41Å; Y928-C931 HydrophobicContact CE2-CB 4.25Å; Y928-C931 WeakPolarHBondContact CE2-SG 3.42Å; Y928-C931 PolarHBondContact O-N 2.94Å; Y928-C931 VanDerWaalsContact O-N 3.1Å
929	L	53.9	Low	54.2	Low	31 Å²	31	61.3 Å²	61.3	16%	0.162	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-58	-38	-163.1	-88.3	152	0	0	0	115.6	I500 V515 L712 C931 L932	I500-L929 HydrophobicContact CD1-CD2 4.22Å; V515-L929 HydrophobicContact CB-CD1 3.84Å; V515-L929 HydrophobicContact CG2-CD1 3.47Å; V515-L929 VanDerWaalsContact CG2-CD1 3.47Å; L712-L929 HydrophobicContact CB-CD1 4.44Å; L712-L929 WeakPolarHBondContact O-CD1 3.39Å; L712-L929 PolarHBondContact O-N 3.21Å; L929-C931 VanDerWaalsContact C-N 3.26Å; L929-C931 PolarHBondContact O-N 2.89Å; L929-L932 WeakPolarHBondContact O-CA 3.28Å; L929-L932 WeakPolarHBondContact O-CB 3.35Å; L929-L932 PolarHBondContact O-N 2.93Å
930	S	49.9	Very low	53.4	Low	59 Å²	59	61.9 Å²	61.9	41%	0.413	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-68.6	-24	-179.7	49.1	0	0	0	0	113.3	Y928 L932	Y928-S930 VanDerWaalsContact CD2-OG 3.28Å; Y928-S930 WeakPolarHBondContact CD2-OG 3.47Å; Y928-S930 WeakPolarHBondContact CE2-OG 3.46Å; Y928-S930 PolarHBondContact O-N 3.01Å; S930-L932 VanDerWaalsContact C-N 3.27Å
931	C	49.6	Very low	52.8	Low	39 Å²	39	58.7 Å²	58.7	26%	0.264	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-77.9	-12.3	170	-72.8	0	0	0	0	113.2	I923 Y928 L929	I923-C931 WeakPolarHBondContact CG2-O 3.33Å; Y928-C931 HydrophobicContact CD2-CB 4.41Å; Y928-C931 HydrophobicContact CE2-CB 4.25Å; Y928-C931 WeakPolarHBondContact CE2-SG 3.42Å; Y928-C931 PolarHBondContact O-N 2.94Å; Y928-C931 VanDerWaalsContact O-N 3.1Å; L929-C931 VanDerWaalsContact C-N 3.26Å; L929-C931 PolarHBondContact O-N 2.89Å
932	L	48.8	Very low	52.7	Low	18 Å²	18	58.2 Å²	58.2	9%	0.094	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-95.5	-6	-177.5	-58.7	-179.1	0	0	0	113.5	L497 I500 I923 L929 S930	L497-L932 HydrophobicContact CD2-CB 4.46Å; L497-L932 HydrophobicContact CD2-CD1 4.26Å; L497-L932 HydrophobicContact CD2-CD2 3.49Å; L497-L932 VanDerWaalsContact CD2-CD2 3.49Å; L497-L932 HydrophobicContact CD2-CG 4.27Å; I500-L932 HydrophobicContact CD1-CB 3.44Å; I500-L932 VanDerWaalsContact CD1-CB 3.44Å; I500-L932 HydrophobicContact CD1-CD1 4.31Å; I500-L932 WeakPolarHBondContact CG2-O 3.3Å; I923-L932 HydrophobicContact CG2-CD2 4.17Å; L929-L932 WeakPolarHBondContact O-CA 3.28Å; L929-L932 WeakPolarHBondContact O-CB 3.35Å; L929-L932 PolarHBondContact O-N 2.93Å; S930-L932 VanDerWaalsContact C-N 3.27Å
933	Q	44.6	Very low	53.1	Low	98 Å²	98	58.5 Å²	58.5	46%	0.458	33%	0.332	S	S	.	.	S	Bend	trans	-82.4	139.6	171.3	-72.5	-177.9	-23.4	0	0	110.6	I500	I500-Q933 HydrophobicContact CG2-CB 4.28Å; I500-Q933 HydrophobicContact CG2-CG 3.68Å
934	P	44.1	Very low	53.7	Low	42 Å²	42	57.2 Å²	57.2	27%	0.273	33%	0.326	S	S	.	.			trans	-59.7	129.9	170.1	24.3	-30.4	0	0	0	108.7	Q936	P934-Q936 PolarHBondContact O-N 2.84Å
935	P	44	Very low	53.9	Low	73 Å²	73	59.6 Å²	59.6	47%	0.474	33%	0.334	S	S	.	.			trans	-64.4	112.7	-177.9	23.8	-31.3	0	0	0	109.7	S937 A939	P935-S937 PolarHBondContact O-N 3.47Å; P935-A939 HydrophobicContact CB-CB 4.42Å
936	Q	42.4	Very low	54.6	Low	171 Å²	171	58.7 Å²	58.7	80%	0.799	33%	0.33	S	S	*	.	S	Bend	trans	-72.1	-8.2	176.3	-72.6	-172.4	-15.4	0	0	113.2	E504 P934	E504-Q936 PolarHBondContact OE1-NE2 3.43Å; P934-Q936 PolarHBondContact O-N 2.84Å
937	S	35	Very low	55.4	Low	87 Å²	87	56 Å²	56	61%	0.608	32%	0.318	S	S	*	.	S	Bend	trans	-153.3	130.3	165.9	69.9	0	0	0	0	111.2	P935 A939	P935-S937 PolarHBondContact O-N 3.47Å; S937-A939 PolarHBondContact O-N 3.19Å
938	T	37.2	Very low	56.4	Low	137 Å²	137	57.1 Å²	57.1	84%	0.84	32%	0.321	S	S	*	.			trans	29.8	16.2	154	55.6	0	0	0	0	122.7	K940	T938-K940 VanDerWaalsContact C-N 3.3Å; T938-K940 PolarHBondContact O-N 2.91Å
939	A	40.5	Very low	57.1	Low	57 Å²	57	58.3 Å²	58.3	47%	0.471	33%	0.327	S	S	.	.			trans	-71.7	90	171.4	0	0	0	0	0	108	P935 S937 C941	P935-A939 HydrophobicContact CB-CB 4.42Å; S937-A939 PolarHBondContact O-N 3.19Å; A939-C941 PolarHBondContact O-N 3.37Å
940	K	46.9	Very low	58.6	Low	137 Å²	137	57.2 Å²	57.2	60%	0.596	32%	0.321	S	S	*	.			trans	-64.3	83	173	-75.4	-172.7	177.9	-175	0	107.8	E910 T938 S942	E910-K940 IonicContact OE1-NZ 3.42Å; E910-K940 PolarHBondContact OE1-NZ 3.1Å; E910-K940 IonicContact OE2-NZ 2.84Å; T938-K940 VanDerWaalsContact C-N 3.3Å; T938-K940 PolarHBondContact O-N 2.91Å; K940-S942 WeakPolarHBondContact O-CA 3.4Å; K940-S942 PolarHBondContact O-N 3.17Å
941	C	51.5	Low	60.3	Low	59 Å²	59	54.5 Å²	54.5	40%	0.399	30%	0.302	S	S	.	.			trans	-55	99.9	172.7	-154.4	0	0	0	0	107.4	M922 A939 L943	M922-C941 HydrophobicContact CB-CB 4.4Å; M922-C941 WeakPolarHBondContact CE-O 3.28Å; A939-C941 PolarHBondContact O-N 3.37Å; C941-L943 PolarHBondContact O-N 2.92Å
942	S	62.8	Low	61.9	Low	27 Å²	27	54.6 Å²	54.6	19%	0.189	30%	0.301	C	S	.	.			trans	-77.4	120.4	-158.5	76.3	0	0	0	0	109.8	M922 K940 T944 Y945 F946 N1008	M922-S942 WeakPolarHBondContact CE-O 3.45Å; K940-S942 WeakPolarHBondContact O-CA 3.4Å; K940-S942 PolarHBondContact O-N 3.17Å; S942-T944 PolarHBondContact O-N 2.95Å; S942-Y945 PolarHBondContact O-N 3.35Å; S942-Y945 WeakPolarHBondContact OG-CB 3.27Å; S942-Y945 PolarHBondContact OG-N 3.42Å; S942-Y945 VanDerWaalsContact OG-N 3.12Å; S942-F946 PolarHBondContact O-N 3.44Å; S942-N1008 WeakPolarHBondContact CB-OD1 3.21Å; S942-N1008 PolarHBondContact OG-OD1 3.25Å
943	L	74.5	Confident	63.5	Low	8 Å²	8	55.8 Å²	55.8	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-45.2	-34.8	166.3	179.7	61.3	0	0	0	110.8	V903 P911 L913 F918 C941 F946 V947 A996	V903-L943 HydrophobicContact CG1-CD2 4.04Å; V903-L943 HydrophobicContact CG2-CD2 4.2Å; P911-L943 HydrophobicContact CB-CD2 4.08Å; P911-L943 HydrophobicContact CG-CD2 4.48Å; L913-L943 HydrophobicContact CD1-CD1 3.58Å; L913-L943 HydrophobicContact CG-CD1 3.97Å; L913-L943 HydrophobicContact CG-CD2 4.19Å; F918-L943 HydrophobicContact CE2-CD1 3.76Å; F918-L943 HydrophobicContact CZ-CB 3.86Å; F918-L943 HydrophobicContact CZ-CD1 3.75Å; F918-L943 HydrophobicContact CZ-CG 4.29Å; C941-L943 PolarHBondContact O-N 2.92Å; L943-F946 HydrophobicContact CD1-CD1 4.45Å; L943-F946 PolarHBondContact O-N 3.32Å; L943-V947 HydrophobicContact CD1-CG2 4.1Å; L943-V947 HydrophobicContact CG-CG2 4.34Å; L943-V947 WeakPolarHBondContact O-CG2 2.96Å; L943-V947 PolarHBondContact O-N 3.01Å; L943-A996 HydrophobicContact CD2-CB 3.81Å; L943-A996 HydrophobicContact CG-CB 3.74Å
944	T	75.4	Confident	65.4	Low	8 Å²	8	51.5 Å²	51.5	5%	0.049	29%	0.286	C	S	.	.	H	α-helix	trans	-51.8	-52.1	171.5	-50.4	0	0	0	0	113.5	S942 F948 A996 L997 P1009 R1014	S942-T944 PolarHBondContact O-N 2.95Å; T944-F948 WeakPolarHBondContact O-CB 3.37Å; T944-F948 PolarHBondContact O-N 2.71Å; T944-A996 WeakPolarHBondContact CA-O 3.28Å; T944-A996 WeakPolarHBondContact CB-O 3.3Å; T944-A996 PolarHBondContact OG1-O 3.14Å; T944-L997 HydrophobicContact CG2-CD2 4.36Å; T944-P1009 HydrophobicContact CG2-CG 4.11Å; T944-R1014 HydrophobicContact CG2-CG 4.1Å
945	Y	73.6	Confident	67.3	Low	62 Å²	62	50.4 Å²	50.4	24%	0.243	28%	0.277	C	S	.	.	H	α-helix	trans	-65.3	-40.8	-179.1	-176.7	-94.5	0	0	0	112	S942 F948 K949	S942-Y945 PolarHBondContact O-N 3.35Å; S942-Y945 WeakPolarHBondContact OG-CB 3.27Å; S942-Y945 PolarHBondContact OG-N 3.42Å; S942-Y945 VanDerWaalsContact OG-N 3.12Å; Y945-F948 WeakPolarHBondContact O-CB 3.1Å; Y945-F948 PolarHBondContact O-N 2.73Å; Y945-K949 HydrophobicContact CE1-CD 4.35Å; Y945-K949 WeakPolarHBondContact O-CB 3.31Å; Y945-K949 PolarHBondContact O-N 3.47Å
946	F	78.8	Confident	68.9	Low	7 Å²	7	49.6 Å²	49.6	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-60.7	-54.3	176.6	173.2	-118.3	0	0	0	112	L832 F897 I901 M922 Q925 S942 L943 F948 K949 L950	L832-F946 HydrophobicContact CD1-CD2 4.21Å; L832-F946 HydrophobicContact CD1-CE2 3.9Å; L832-F946 HydrophobicContact CD1-CZ 4.27Å; L832-F946 HydrophobicContact CD2-CE2 4.11Å; L832-F946 HydrophobicContact CD2-CZ 4Å; F897-F946 HydrophobicContact CE1-CZ 4.4Å; F897-F946 HydrophobicContact CZ-CZ 4.27Å; I901-F946 HydrophobicContact CD1-CE1 3.62Å; I901-F946 HydrophobicContact CD1-CZ 3.93Å; I901-F946 HydrophobicContact CG1-CE1 4.24Å; M922-F946 HydrophobicContact CE-CB 3.81Å; M922-F946 HydrophobicContact SD-CB 3.92Å; M922-F946 HydrophobicContact SD-CD1 4.31Å; M922-F946 HydrophobicContact SD-CG 4.1Å; Q925-F946 HydrophobicContact CG-CD2 4.08Å; S942-F946 PolarHBondContact O-N 3.44Å; L943-F946 HydrophobicContact CD1-CD1 4.45Å; L943-F946 PolarHBondContact O-N 3.32Å; F946-F948 VanDerWaalsContact C-N 3.28Å; F946-F948 PolarHBondContact O-N 3.27Å; F946-K949 PolarHBondContact O-N 3.49Å; F946-L950 HydrophobicContact CE1-CD2 4.38Å; F946-L950 HydrophobicContact CZ-CD2 4.08Å; F946-L950 WeakPolarHBondContact O-CB 3.46Å; F946-L950 PolarHBondContact O-N 3.08Å
947	V	83.1	Confident	70.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-40.3	179.9	174.9	0	0	0	0	110.1	L943 K949 L950 V951 W993 A996 L997	L943-V947 HydrophobicContact CD1-CG2 4.1Å; L943-V947 HydrophobicContact CG-CG2 4.34Å; L943-V947 WeakPolarHBondContact O-CG2 2.96Å; L943-V947 PolarHBondContact O-N 3.01Å; V947-K949 PolarHBondContact O-N 3.45Å; V947-L950 PolarHBondContact O-N 3.43Å; V947-V951 HydrophobicContact CG1-CG2 4.06Å; V947-V951 WeakPolarHBondContact O-CB 3.27Å; V947-V951 VanDerWaalsContact O-CG2 3.22Å; V947-V951 WeakPolarHBondContact O-CG2 3.44Å; V947-V951 PolarHBondContact O-N 2.73Å; V947-W993 HydrophobicContact CG1-CB 4.07Å; V947-W993 HydrophobicContact CG1-CD2 4.15Å; V947-W993 HydrophobicContact CG1-CE3 3.84Å; V947-W993 HydrophobicContact CG1-CG 4.28Å; V947-A996 HydrophobicContact CB-CB 4.36Å; V947-A996 HydrophobicContact CG2-CB 3.93Å; V947-L997 HydrophobicContact CB-CD2 4.21Å; V947-L997 HydrophobicContact CG1-CD1 4.13Å; V947-L997 HydrophobicContact CG1-CD2 4.03Å; V947-L997 HydrophobicContact CG1-CG 3.92Å
948	F	82.3	Confident	72.6	Confident	44 Å²	44	37.9 Å²	37.9	19%	0.193	21%	0.209	C	C	.	.	H	α-helix	trans	-55.6	-48.7	174.7	171	-91.1	0	0	0	112.3	T944 Y945 F946 T952 L997 A1013 A1017	T944-F948 WeakPolarHBondContact O-CB 3.37Å; T944-F948 PolarHBondContact O-N 2.71Å; Y945-F948 WeakPolarHBondContact O-CB 3.1Å; Y945-F948 PolarHBondContact O-N 2.73Å; F946-F948 VanDerWaalsContact C-N 3.28Å; F946-F948 PolarHBondContact O-N 3.27Å; F948-T952 WeakPolarHBondContact O-CB 3.27Å; F948-T952 PolarHBondContact O-N 3.25Å; F948-T952 PolarHBondContact O-OG1 3.01Å; F948-L997 HydrophobicContact CB-CD2 4Å; F948-A1013 HydrophobicContact CE2-CB 4.18Å; F948-A1017 HydrophobicContact CD2-CB 3.43Å; F948-A1017 VanDerWaalsContact CD2-CB 3.43Å; F948-A1017 HydrophobicContact CE2-CB 3.94Å; F948-A1017 HydrophobicContact CG-CB 4.43Å
949	K	80	Confident	74.3	Confident	61 Å²	61	33.2 Å²	33.2	27%	0.265	18%	0.176	S	C	.	.	H	α-helix	trans	-67.4	-42.4	-179.5	-168.6	171.8	-174.9	171.5	0	111.4	Y945 F946 V947 T952 K953	Y945-K949 HydrophobicContact CE1-CD 4.35Å; Y945-K949 WeakPolarHBondContact O-CB 3.31Å; Y945-K949 PolarHBondContact O-N 3.47Å; F946-K949 PolarHBondContact O-N 3.49Å; V947-K949 PolarHBondContact O-N 3.45Å; K949-T952 PolarHBondContact O-N 3.45Å; K949-K953 HydrophobicContact CG-CD 4.42Å; K949-K953 WeakPolarHBondContact O-CG 3.49Å; K949-K953 PolarHBondContact O-N 3.16Å; K949-K953 VanDerWaalsContact O-N 3.08Å
950	L	85	Confident	75.4	Confident	8 Å²	8	32.8 Å²	32.8	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-47.9	178.4	-173.3	59.5	0	0	0	111.4	T836 F897 I901 F946 V947 T952 K953 L954 W993	T836-L950 HydrophobicContact CG2-CD1 4.4Å; F897-L950 HydrophobicContact CE1-CD2 4.31Å; I901-L950 HydrophobicContact CD1-CD2 3.88Å; F946-L950 HydrophobicContact CE1-CD2 4.38Å; F946-L950 HydrophobicContact CZ-CD2 4.08Å; F946-L950 WeakPolarHBondContact O-CB 3.46Å; F946-L950 PolarHBondContact O-N 3.08Å; V947-L950 PolarHBondContact O-N 3.43Å; L950-T952 VanDerWaalsContact C-N 3.32Å; L950-T952 PolarHBondContact O-N 2.95Å; L950-K953 PolarHBondContact O-N 3.27Å; L950-K953 VanDerWaalsContact O-N 3.17Å; L950-L954 HydrophobicContact CD1-CG 4.42Å; L950-L954 HydrophobicContact CG-CD1 4.15Å; L950-L954 HydrophobicContact CG-CG 4.44Å; L950-L954 VanDerWaalsContact O-CG 3.32Å; L950-L954 WeakPolarHBondContact O-CG 3.37Å; L950-L954 PolarHBondContact O-N 3.46Å; L950-W993 HydrophobicContact CD2-CH2 3.34Å; L950-W993 HydrophobicContact CD2-CZ2 4.07Å; L950-W993 HydrophobicContact CD2-CZ3 3.9Å; L950-W993 HydrophobicContact CG-CH2 3.97Å; L950-W993 HydrophobicContact CG-CZ3 4.14Å
951	V	86.2	Confident	76.5	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-59.4	-43.2	177.1	169.8	0	0	0	0	111.4	V947 K953 L954 E955 W993 K1020 L1021	V947-V951 HydrophobicContact CG1-CG2 4.06Å; V947-V951 WeakPolarHBondContact O-CB 3.27Å; V947-V951 VanDerWaalsContact O-CG2 3.22Å; V947-V951 WeakPolarHBondContact O-CG2 3.44Å; V947-V951 PolarHBondContact O-N 2.73Å; V951-K953 VanDerWaalsContact C-N 3.31Å; V951-K953 PolarHBondContact O-N 2.83Å; V951-L954 PolarHBondContact O-N 3.4Å; V951-E955 WeakPolarHBondContact O-CB 3.5Å; V951-E955 PolarHBondContact O-N 2.98Å; V951-W993 HydrophobicContact CG2-CE3 3.65Å; V951-W993 HydrophobicContact CG2-CZ3 3.82Å; V951-K1020 HydrophobicContact CG1-CB 3.75Å; V951-L1021 HydrophobicContact CG1-CB 3.98Å; V951-L1021 HydrophobicContact CG2-CB 4.3Å; V951-L1021 HydrophobicContact CG2-CD1 4.06Å
952	T	83.2	Confident	77.3	Confident	42 Å²	42	23.8 Å²	23.8	26%	0.258	12%	0.124	S	C	.	.	H	α-helix	trans	-63.3	-38.9	178.8	-64.9	0	0	0	0	111.8	F948 K949 L950 S956 K1020	F948-T952 WeakPolarHBondContact O-CB 3.27Å; F948-T952 PolarHBondContact O-N 3.25Å; F948-T952 PolarHBondContact O-OG1 3.01Å; K949-T952 PolarHBondContact O-N 3.45Å; L950-T952 VanDerWaalsContact C-N 3.32Å; L950-T952 PolarHBondContact O-N 2.95Å; T952-S956 WeakPolarHBondContact O-CB 3.49Å; T952-S956 PolarHBondContact O-N 3.45Å; T952-S956 VanDerWaalsContact O-N 3.16Å; T952-K1020 PolarHBondContact OG1-NZ 3.14Å
953	K	82.3	Confident	77.3	Confident	42 Å²	42	24.3 Å²	24.3	18%	0.183	13%	0.127	C	C	.	.	H	α-helix	trans	-68.1	-48.1	175.3	-73.2	171.9	164.1	-141.4	0	112	T836 E840 K949 L950 V951 E955 S956 V957	T836-K953 HydrophobicContact CG2-CD 3.68Å; E840-K953 WeakPolarHBondContact OE1-CD 3.46Å; E840-K953 WeakPolarHBondContact OE1-CE 3.31Å; E840-K953 IonicContact OE1-NZ 3.27Å; E840-K953 PolarHBondContact OE1-NZ 2.94Å; K949-K953 HydrophobicContact CG-CD 4.42Å; K949-K953 WeakPolarHBondContact O-CG 3.49Å; K949-K953 PolarHBondContact O-N 3.16Å; K949-K953 VanDerWaalsContact O-N 3.08Å; L950-K953 PolarHBondContact O-N 3.27Å; L950-K953 VanDerWaalsContact O-N 3.17Å; V951-K953 VanDerWaalsContact C-N 3.31Å; V951-K953 PolarHBondContact O-N 2.83Å; K953-E955 PolarHBondContact O-N 3.44Å; K953-S956 PolarHBondContact O-N 2.84Å; K953-S956 PolarHBondContact O-OG 3.11Å; K953-V957 PolarHBondContact O-N 3Å
954	L	84.9	Confident	76.4	Confident	8 Å²	8	26.2 Å²	26.2	4%	0.042	14%	0.14	C	C	.	.	H	α-helix	trans	-58.3	-46.6	177.8	-69.7	176.2	0	0	0	111.9	I839 L843 L950 V951 S956 V957 L958 W993 L1024	I839-L954 HydrophobicContact CG2-CD2 4.07Å; L843-L954 HydrophobicContact CD1-CD2 3.25Å; L950-L954 HydrophobicContact CD1-CG 4.42Å; L950-L954 HydrophobicContact CG-CD1 4.15Å; L950-L954 HydrophobicContact CG-CG 4.44Å; L950-L954 VanDerWaalsContact O-CG 3.32Å; L950-L954 WeakPolarHBondContact O-CG 3.37Å; L950-L954 PolarHBondContact O-N 3.46Å; V951-L954 PolarHBondContact O-N 3.4Å; L954-S956 PolarHBondContact O-N 3.01Å; L954-V957 PolarHBondContact O-N 3.08Å; L954-L958 VanDerWaalsContact O-CB 3.31Å; L954-L958 WeakPolarHBondContact O-CB 3.42Å; L954-L958 PolarHBondContact O-N 2.79Å; L954-W993 HydrophobicContact CD1-CH2 4.03Å; L954-W993 HydrophobicContact CD1-CZ3 3.95Å; L954-L1024 HydrophobicContact CB-CD1 4.35Å; L954-L1024 HydrophobicContact CB-CD2 4.18Å; L954-L1024 HydrophobicContact CD1-CD2 4.34Å
955	E	83	Confident	75.5	Confident	20 Å²	20	29 Å²	29	9%	0.093	16%	0.16	C	C	.	.	H	α-helix	trans	-56.7	-50.9	175.9	-176.4	-157.9	-158.7	0	0	110.4	V951 K953 V957 L958 Y959 K1020 R1023	V951-E955 WeakPolarHBondContact O-CB 3.5Å; V951-E955 PolarHBondContact O-N 2.98Å; K953-E955 PolarHBondContact O-N 3.44Å; E955-V957 PolarHBondContact O-N 2.9Å; E955-L958 PolarHBondContact O-N 3.49Å; E955-Y959 HydrophobicContact CB-CD2 4.49Å; E955-Y959 HydrophobicContact CG-CD2 3.61Å; E955-Y959 HydrophobicContact CG-CE2 3.91Å; E955-Y959 HydrophobicContact CG-CG 4.1Å; E955-Y959 VanDerWaalsContact O-CB 3.25Å; E955-Y959 WeakPolarHBondContact O-CB 3.42Å; E955-Y959 WeakPolarHBondContact O-CD2 3.48Å; E955-Y959 PolarHBondContact O-N 3.04Å; E955-K1020 WeakPolarHBondContact OE2-CD 3.25Å; E955-K1020 WeakPolarHBondContact OE2-CE 3.3Å; E955-K1020 VanDerWaalsContact OE2-CG 3.25Å; E955-K1020 WeakPolarHBondContact OE2-CG 3.25Å; E955-K1020 IonicContact OE2-NZ 3.81Å; E955-K1020 PolarHBondContact OE2-NZ 3.5Å; E955-K1020 VanDerWaalsContact OE2-NZ 3.12Å; E955-R1023 IonicContact OE1-CZ 2.68Å; E955-R1023 IonicContact OE1-NH1 3.14Å; E955-R1023 PolarHBondContact OE1-NH1 3.29Å; E955-R1023 IonicContact OE1-NH2 3.74Å
956	S	78	Confident	74.4	Confident	56 Å²	56	30.6 Å²	30.6	39%	0.392	18%	0.176	S	C	.	.	H	α-helix	trans	-57.6	-34.9	-175.6	74.4	0	0	0	0	113.4	T952 K953 L954	T952-S956 WeakPolarHBondContact O-CB 3.49Å; T952-S956 PolarHBondContact O-N 3.45Å; T952-S956 VanDerWaalsContact O-N 3.16Å; K953-S956 PolarHBondContact O-N 2.84Å; K953-S956 PolarHBondContact O-OG 3.11Å; L954-S956 PolarHBondContact O-N 3.01Å
957	V	75.4	Confident	72.9	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.018	20%	0.203	C	C	.	.	H	α-helix	trans	-83.8	-52.6	179.6	-179	0	0	0	0	110.2	L843 R844 K953 L954 E955 Y959 S960	L843-V957 HydrophobicContact CB-CB 4.41Å; L843-V957 HydrophobicContact CB-CG1 3.66Å; R844-V957 HydrophobicContact CG-CG1 3.83Å; R844-V957 HydrophobicContact CG-CG2 4.2Å; K953-V957 PolarHBondContact O-N 3Å; L954-V957 PolarHBondContact O-N 3.08Å; E955-V957 PolarHBondContact O-N 2.9Å; V957-Y959 VanDerWaalsContact C-N 3.34Å; V957-Y959 PolarHBondContact O-N 3.5Å; V957-S960 PolarHBondContact O-N 2.74Å; V957-S960 PolarHBondContact O-OG 3.04Å
958	L	79.1	Confident	71.2	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-69.5	-28.2	-172.5	-73.7	172.8	0	0	0	113.5	L843 L954 E955 S960 Y961 L962 L983 L1024	L843-L958 HydrophobicContact CD2-CD2 4.17Å; L954-L958 VanDerWaalsContact O-CB 3.31Å; L954-L958 WeakPolarHBondContact O-CB 3.42Å; L954-L958 PolarHBondContact O-N 2.79Å; E955-L958 PolarHBondContact O-N 3.49Å; L958-S960 PolarHBondContact O-N 2.93Å; L958-Y961 CarbonylContact O-C 3.43Å; L958-Y961 PolarHBondContact O-N 3.15Å; L958-L962 PolarHBondContact O-N 3.3Å; L958-L983 HydrophobicContact CD1-CD1 4.41Å; L958-L983 HydrophobicContact CD2-CD1 3.43Å; L958-L983 VanDerWaalsContact CD2-CD1 3.43Å; L958-L1024 HydrophobicContact CB-CD1 3.93Å; L958-L1024 HydrophobicContact CD1-CD1 3.69Å; L958-L1024 HydrophobicContact CD1-CD2 4.34Å; L958-L1024 HydrophobicContact CD1-CG 4.21Å; L958-L1024 HydrophobicContact CG-CD1 4.41Å
959	Y	73.1	Confident	69.8	Low	39 Å²	39	44.3 Å²	44.3	15%	0.153	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.7	178.5	-96	-119.8	0	0	0	113.6	E955 V957 Y961 P964 R1023	E955-Y959 HydrophobicContact CB-CD2 4.49Å; E955-Y959 HydrophobicContact CG-CD2 3.61Å; E955-Y959 HydrophobicContact CG-CE2 3.91Å; E955-Y959 HydrophobicContact CG-CG 4.1Å; E955-Y959 VanDerWaalsContact O-CB 3.25Å; E955-Y959 WeakPolarHBondContact O-CB 3.42Å; E955-Y959 WeakPolarHBondContact O-CD2 3.48Å; E955-Y959 PolarHBondContact O-N 3.04Å; V957-Y959 VanDerWaalsContact C-N 3.34Å; V957-Y959 PolarHBondContact O-N 3.5Å; Y959-Y961 PolarHBondContact O-N 3.42Å; Y959-P964 VanDerWaalsContact CE1-CD 3.42Å; Y959-P964 HydrophobicContact CE1-CG 3.58Å; Y959-P964 VanDerWaalsContact OH-CG 3.31Å; Y959-P964 WeakPolarHBondContact OH-CG 3.18Å; Y959-R1023 HydrophobicContact CE2-CB 4.26Å; Y959-R1023 WeakPolarHBondContact OH-CB 3.33Å; Y959-R1023 WeakPolarHBondContact OH-CD 3.38Å; Y959-R1023 WeakPolarHBondContact OH-CG 3.42Å; Y959-R1023 PolarHBondContact OH-O 3.46Å; Y959-R1023 VanDerWaalsContact OH-O 3.1Å
960	S	64.3	Low	68.6	Low	49 Å²	49	45.8 Å²	45.8	34%	0.343	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-22.9	173.3	70.6	0	0	0	0	112.5	V957 L958	V957-S960 PolarHBondContact O-N 2.74Å; V957-S960 PolarHBondContact O-OG 3.04Å; L958-S960 PolarHBondContact O-N 2.93Å
961	Y	69.5	Low	67.4	Low	4 Å²	4	46.1 Å²	46.1	2%	0.016	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-30.7	-171.8	-173.3	-115.2	0	0	0	114.2	L846 C847 H850 L958 Y959 P971 V975	L846-Y961 HydrophobicContact CD2-CE1 4.36Å; L846-Y961 HydrophobicContact CG-CE1 4.1Å; C847-Y961 HydrophobicContact CB-CD2 4.26Å; C847-Y961 HydrophobicContact CB-CG 4.36Å; C847-Y961 WeakPolarHBondContact SG-CB 3.5Å; H850-Y961 AromaticContact CE1-CD2 3.79Å; H850-Y961 AromaticContact CE1-CE2 3.63Å; H850-Y961 AromaticContact ND1-CE2 3.49Å; H850-Y961 WeakPolarHBondContact ND1-CE2 3.33Å; L958-Y961 CarbonylContact O-C 3.43Å; L958-Y961 PolarHBondContact O-N 3.15Å; Y959-Y961 PolarHBondContact O-N 3.42Å; Y961-P971 WeakPolarHBondContact O-CG 3.37Å; Y961-V975 HydrophobicContact CD2-CG1 4.13Å; Y961-V975 HydrophobicContact CE2-CG1 3.19Å; Y961-V975 WeakPolarHBondContact OH-CG1 3.44Å; Y961-V975 PolarHBondContact OH-O 2.9Å
962	L	69.2	Low	66.6	Low	3 Å²	3	48.7 Å²	48.7	2%	0.016	28%	0.28	C	S	.	.	S	Bend	trans	-130	74.4	179.4	-64.3	173.7	0	0	0	109.9	L958 R976 L983 A1027 I1028 A1031	L958-L962 PolarHBondContact O-N 3.3Å; L962-R976 HydrophobicContact CD2-CB 4.3Å; L962-R976 HydrophobicContact CD2-CG 4.11Å; L962-L983 HydrophobicContact CD1-CD1 3.81Å; L962-A1027 HydrophobicContact CB-CB 4.21Å; L962-A1027 WeakPolarHBondContact O-CB 3.22Å; L962-I1028 HydrophobicContact CD1-CG1 4.29Å; L962-A1031 HydrophobicContact CD2-CB 3.83Å
963	P	62.3	Low	66	Low	37 Å²	37	50.1 Å²	50.1	24%	0.24	29%	0.289	C	S	.	.			trans	-62.2	139.9	177.3	-3.9	9.3	0	0	0	110	S965 P971 R976	P963-S965 PolarHBondContact O-N 3.12Å; P963-P971 HydrophobicContact CG-CG 4.3Å; P963-R976 VanDerWaalsContact CG-NH2 3.33Å; P963-R976 PolarHBondContact O-NH2 3.25Å
964	P	55.1	Low	65.6	Low	49 Å²	49	52.7 Å²	52.7	32%	0.318	31%	0.305	S	S	.	.	S	Bend	trans	-69.7	-16.8	-179.8	29.9	-38.8	0	0	0	113.1	Y959	Y959-P964 VanDerWaalsContact CE1-CD 3.42Å; Y959-P964 HydrophobicContact CE1-CG 3.58Å; Y959-P964 VanDerWaalsContact OH-CG 3.31Å; Y959-P964 WeakPolarHBondContact OH-CG 3.18Å
965	S	56.2	Low	65.2	Low	66 Å²	66	52.4 Å²	52.4	46%	0.462	30%	0.304	S	S	.	.	S	Bend	trans	-91	131.4	178.9	73.3	0	0	0	0	111.4	P963 N967 R976	P963-S965 PolarHBondContact O-N 3.12Å; S965-N967 PolarHBondContact O-N 3.41Å; S965-R976 PolarHBondContact O-NH2 2.79Å
966	V	50.5	Low	64.9	Low	96 Å²	96	53 Å²	53	58%	0.582	31%	0.305	S	S	*	.			trans	-73.3	65	170.2	-167.4	0	0	0	0	108.4	S968	V966-S968 PolarHBondContact O-N 2.97Å
967	N	48	Very low	65	Low	114 Å²	114	52.9 Å²	52.9	61%	0.61	30%	0.299	S	S	*	.			trans	-68.8	119.9	152.9	-93.3	-7.3	0	0	0	105.8	S965 N969 R976	S965-N967 PolarHBondContact O-N 3.41Å; N967-N969 PolarHBondContact O-N 2.92Å; N967-R976 PolarHBondContact O-NH1 2.85Å
968	S	47.7	Very low	65.4	Low	97 Å²	97	53 Å²	53	68%	0.678	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.6	-170	53.6	0	0	0	0	113.7	V966	V966-S968 PolarHBondContact O-N 2.97Å
969	N	52.4	Low	65.5	Low	128 Å²	128	52.6 Å²	52.6	68%	0.684	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-12.3	-167.1	-62.4	9.9	0	0	0	114.5	N967	N967-N969 PolarHBondContact O-N 2.92Å
970	R	55.2	Low	66.1	Low	91 Å²	91	50.8 Å²	50.8	34%	0.343	29%	0.291	S	S	.	.	S	Bend	trans	-151.4	142.6	-177.5	-70.5	-167.6	175.9	148	11	115.5	E783 R976	E783-R970 IonicContact OE1-CZ 3.95Å; E783-R970 IonicContact OE1-NH1 3.38Å; E783-R970 PolarHBondContact OE1-NH1 3.49Å; E783-R970 IonicContact OE1-NH2 3.74Å; E783-R970 PolarHBondContact OE1-NH2 3.4Å; R970-R976 PolarHBondContact O-NH1 3.2Å
971	P	60.5	Low	67.2	Low	16 Å²	16	48.8 Å²	48.8	10%	0.104	28%	0.277	C	S	.	.	S	Bend	cis	-61.6	164	-16.6	14.4	-15.7	0	0	0	110.8	Y961 P963 R976	Y961-P971 WeakPolarHBondContact O-CG 3.37Å; P963-P971 HydrophobicContact CG-CG 4.3Å; P971-R976 HydrophobicContact CB-CG 4.48Å; P971-R976 HydrophobicContact CG-CG 3.8Å
972	N	69	Low	68	Low	55 Å²	55	49.1 Å²	49.1	29%	0.294	28%	0.278	S	S	.	.			trans	-45.5	131.2	-179.1	178.9	-27.8	0	0	0	109.7	D974 V975 R976	N972-D974 PolarHBondContact O-N 3.44Å; N972-D974 VanDerWaalsContact O-N 3.14Å; N972-D974 PolarHBondContact OD1-N 3.12Å; N972-V975 HydrophobicContact CB-CB 4.31Å; N972-V975 HydrophobicContact CB-CG2 3.93Å; N972-V975 WeakPolarHBondContact O-CB 3.36Å; N972-V975 PolarHBondContact O-N 3.2Å; N972-R976 PolarHBondContact O-N 3.27Å
973	P	70	Confident	68.9	Low	71 Å²	71	49.1 Å²	49.1	46%	0.461	28%	0.278	S	S	.	.	H	α-helix	trans	-50.9	-36.7	-179.2	18.6	-32	0	0	0	113.2	R976 I977	P973-R976 PolarHBondContact O-N 2.86Å; P973-I977 WeakPolarHBondContact O-CB 3.42Å; P973-I977 WeakPolarHBondContact O-CD1 3.49Å; P973-I977 WeakPolarHBondContact O-CG1 3.4Å; P973-I977 PolarHBondContact O-N 3.08Å
974	D	73.8	Confident	70.2	Confident	96 Å²	96	47.3 Å²	47.3	51%	0.513	27%	0.267	S	S	.	.	H	α-helix	trans	-67.6	-37.5	179.2	-65.8	-21.3	0	0	0	112.5	N972 T978 L1054	N972-D974 PolarHBondContact O-N 3.44Å; N972-D974 VanDerWaalsContact O-N 3.14Å; N972-D974 PolarHBondContact OD1-N 3.12Å; D974-T978 WeakPolarHBondContact O-CB 3.25Å; D974-T978 PolarHBondContact O-N 2.86Å; D974-T978 PolarHBondContact O-OG1 3.5Å; D974-L1054 HydrophobicContact CB-CD2 4.4Å
975	V	76.7	Confident	72	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.018	26%	0.263	C	S	.	.	H	α-helix	trans	-66.7	-44.4	175.3	176.1	0	0	0	0	110.2	H850 Y961 N972 G979 L1054	H850-V975 HydrophobicContact CB-CB 4.46Å; H850-V975 HydrophobicContact CB-CG1 4.01Å; H850-V975 HydrophobicContact CB-CG2 3.55Å; Y961-V975 HydrophobicContact CD2-CG1 4.13Å; Y961-V975 HydrophobicContact CE2-CG1 3.19Å; Y961-V975 WeakPolarHBondContact OH-CG1 3.44Å; Y961-V975 PolarHBondContact OH-O 2.9Å; N972-V975 HydrophobicContact CB-CB 4.31Å; N972-V975 HydrophobicContact CB-CG2 3.93Å; N972-V975 WeakPolarHBondContact O-CB 3.36Å; N972-V975 PolarHBondContact O-N 3.2Å; V975-G979 PolarHBondContact O-N 3.03Å; V975-L1054 HydrophobicContact CG2-CD1 4.15Å; V975-L1054 HydrophobicContact CG2-CD2 3.54Å
976	R	76.6	Confident	73.6	Confident	32 Å²	32	44.1 Å²	44.1	12%	0.121	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-49.3	175	-84	-179	147.5	158.4	-4.6	111.4	L962 P963 S965 N967 R970 P971 N972 P973 G979 G980 A1031	L962-R976 HydrophobicContact CD2-CB 4.3Å; L962-R976 HydrophobicContact CD2-CG 4.11Å; P963-R976 VanDerWaalsContact CG-NH2 3.33Å; P963-R976 PolarHBondContact O-NH2 3.25Å; S965-R976 PolarHBondContact O-NH2 2.79Å; N967-R976 PolarHBondContact O-NH1 2.85Å; R970-R976 PolarHBondContact O-NH1 3.2Å; P971-R976 HydrophobicContact CB-CG 4.48Å; P971-R976 HydrophobicContact CG-CG 3.8Å; N972-R976 PolarHBondContact O-N 3.27Å; P973-R976 PolarHBondContact O-N 2.86Å; R976-G979 PolarHBondContact O-N 3.43Å; R976-G980 PolarHBondContact O-N 3.09Å; R976-A1031 WeakPolarHBondContact O-CB 3.49Å
977	I	80.4	Confident	75.5	Confident	53 Å²	53	39.5 Å²	39.5	27%	0.272	22%	0.216	S	C	.	.	H	α-helix	trans	-61.5	-49.5	-177.8	-70.9	164.3	0	0	0	110.3	P973 G979 G980 L981 A1031 P1033	P973-I977 WeakPolarHBondContact O-CB 3.42Å; P973-I977 WeakPolarHBondContact O-CD1 3.49Å; P973-I977 WeakPolarHBondContact O-CG1 3.4Å; P973-I977 PolarHBondContact O-N 3.08Å; I977-G979 PolarHBondContact O-N 2.95Å; I977-G980 PolarHBondContact O-N 2.98Å; I977-L981 HydrophobicContact CG2-CD1 3.92Å; I977-L981 HydrophobicContact CG2-CG 4.38Å; I977-L981 WeakPolarHBondContact O-CB 3.33Å; I977-L981 VanDerWaalsContact O-CG 3.31Å; I977-L981 WeakPolarHBondContact O-CG 3.47Å; I977-L981 PolarHBondContact O-N 3.23Å; I977-A1031 WeakPolarHBondContact CA-O 3.36Å; I977-P1033 HydrophobicContact CG2-CB 4.45Å; I977-P1033 HydrophobicContact CG2-CG 4.32Å
978	T	83.2	Confident	77.5	Confident	6 Å²	6	34.4 Å²	34.4	4%	0.037	19%	0.189	C	C	.	.	H	α-helix	trans	-60.4	-46.6	178.8	-58.1	0	0	0	0	111.5	D974 G980 L981 I982 L1054 L1057 A1058	D974-T978 WeakPolarHBondContact O-CB 3.25Å; D974-T978 PolarHBondContact O-N 2.86Å; D974-T978 PolarHBondContact O-OG1 3.5Å; T978-G980 PolarHBondContact O-N 2.92Å; T978-L981 PolarHBondContact O-N 3.47Å; T978-I982 HydrophobicContact CG2-CD1 3.84Å; T978-I982 WeakPolarHBondContact O-CD1 3.49Å; T978-I982 VanDerWaalsContact O-CG1 3.27Å; T978-I982 WeakPolarHBondContact O-CG1 3.12Å; T978-I982 PolarHBondContact O-N 2.95Å; T978-I982 VanDerWaalsContact O-N 3.08Å; T978-L1054 HydrophobicContact CG2-CD1 4.37Å; T978-L1057 HydrophobicContact CG2-CB 3.99Å; T978-A1058 HydrophobicContact CG2-CB 4.31Å; T978-A1058 WeakPolarHBondContact OG1-CB 3.3Å
979	G	82.3	Confident	79.5	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60	-44.4	175.1	0	0	0	0	0	113.8	V975 R976 I977 L983	V975-G979 PolarHBondContact O-N 3.03Å; R976-G979 PolarHBondContact O-N 3.43Å; I977-G979 PolarHBondContact O-N 2.95Å; G979-L983 WeakPolarHBondContact O-CB 3.4Å; G979-L983 WeakPolarHBondContact O-CG 3.5Å; G979-L983 PolarHBondContact O-N 3.1Å
980	G	84.7	Confident	81.2	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63	-42.9	177	0	0	0	0	0	112.4	R976 I977 T978 S984	R976-G980 PolarHBondContact O-N 3.09Å; I977-G980 PolarHBondContact O-N 2.98Å; T978-G980 PolarHBondContact O-N 2.92Å; G980-S984 VanDerWaalsContact O-CB 3.29Å; G980-S984 WeakPolarHBondContact O-CB 3.33Å; G980-S984 PolarHBondContact O-N 3.44Å
981	L	87.3	Confident	82.8	Confident	8 Å²	8	21.8 Å²	21.8	4%	0.042	12%	0.118	C	C	.	.	H	α-helix	trans	-61	-51.7	176.7	-75.1	170.6	0	0	0	111.3	I977 T978 L983 S984 L1032 P1033 A1061 Q1062 L1067	I977-L981 HydrophobicContact CG2-CD1 3.92Å; I977-L981 HydrophobicContact CG2-CG 4.38Å; I977-L981 WeakPolarHBondContact O-CB 3.33Å; I977-L981 VanDerWaalsContact O-CG 3.31Å; I977-L981 WeakPolarHBondContact O-CG 3.47Å; I977-L981 PolarHBondContact O-N 3.23Å; T978-L981 PolarHBondContact O-N 3.47Å; L981-L983 VanDerWaalsContact C-N 3.31Å; L981-L983 PolarHBondContact O-N 2.77Å; L981-S984 PolarHBondContact O-N 3.09Å; L981-S984 PolarHBondContact O-OG 3.28Å; L981-L1032 HydrophobicContact CD2-CD2 4.01Å; L981-L1032 HydrophobicContact CG-CD2 4.46Å; L981-P1033 HydrophobicContact CD2-CG 4.18Å; L981-A1061 HydrophobicContact CB-CB 4.01Å; L981-A1061 HydrophobicContact CD1-CB 4.41Å; L981-Q1062 HydrophobicContact CD1-CG 4.2Å; L981-L1067 HydrophobicContact CD2-CD1 4.02Å; L981-L1067 HydrophobicContact CD2-CD2 3.97Å; L981-L1067 HydrophobicContact CD2-CG 4.23Å
982	I	87	Confident	84.1	Confident	10 Å²	10	21.2 Å²	21.2	5%	0.051	11%	0.114	C	C	.	.	H	α-helix	trans	-62.5	-38	-177.9	-64.6	165.6	0	0	0	111.6	L846 V888 I891 T978 P985 L1057 A1061	L846-I982 HydrophobicContact CD1-CD1 4.13Å; V888-I982 HydrophobicContact CG2-CD1 4.4Å; I891-I982 HydrophobicContact CB-CG2 3.91Å; I891-I982 HydrophobicContact CG1-CG2 4.24Å; I891-I982 HydrophobicContact CG2-CG2 3.62Å; T978-I982 HydrophobicContact CG2-CD1 3.84Å; T978-I982 WeakPolarHBondContact O-CD1 3.49Å; T978-I982 VanDerWaalsContact O-CG1 3.27Å; T978-I982 WeakPolarHBondContact O-CG1 3.12Å; T978-I982 PolarHBondContact O-N 2.95Å; T978-I982 VanDerWaalsContact O-N 3.08Å; I982-P985 WeakPolarHBondContact O-CD 3.28Å; I982-L1057 HydrophobicContact CD1-CD2 3.27Å; I982-A1061 HydrophobicContact CD1-CB 4.31Å; I982-A1061 HydrophobicContact CG1-CB 3.66Å
983	L	88.3	Confident	85	Confident	3 Å²	3	18.8 Å²	18.8	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-83.9	-17.7	179.7	-68.9	167.6	0	0	0	113.5	L843 L846 I891 L958 L962 G979 L981 P985 I986 I1028	L843-L983 HydrophobicContact CD2-CD2 3.96Å; L846-L983 HydrophobicContact CD2-CD1 4.06Å; L846-L983 HydrophobicContact CD2-CD2 4.25Å; L846-L983 HydrophobicContact CD2-CG 4.07Å; I891-L983 HydrophobicContact CG2-CD2 3.99Å; L958-L983 HydrophobicContact CD1-CD1 4.41Å; L958-L983 HydrophobicContact CD2-CD1 3.43Å; L958-L983 VanDerWaalsContact CD2-CD1 3.43Å; L962-L983 HydrophobicContact CD1-CD1 3.81Å; G979-L983 WeakPolarHBondContact O-CB 3.4Å; G979-L983 WeakPolarHBondContact O-CG 3.5Å; G979-L983 PolarHBondContact O-N 3.1Å; L981-L983 VanDerWaalsContact C-N 3.31Å; L981-L983 PolarHBondContact O-N 2.77Å; L983-P985 VanDerWaalsContact C-N 3.31Å; L983-P985 VanDerWaalsContact O-N 3.17Å; L983-I986 WeakPolarHBondContact O-CB 3.31Å; L983-I986 WeakPolarHBondContact O-CG2 3.21Å; L983-I986 PolarHBondContact O-N 3.14Å; L983-I1028 HydrophobicContact CB-CD1 4.29Å; L983-I1028 HydrophobicContact CB-CG1 4.42Å; L983-I1028 HydrophobicContact CB-CG2 4.34Å
984	S	90.3	Very high	85.9	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-54.7	-33.7	-174.6	69.1	0	0	0	0	115.7	G980 L981 I986 L987 V1065 V1070	G980-S984 VanDerWaalsContact O-CB 3.29Å; G980-S984 WeakPolarHBondContact O-CB 3.33Å; G980-S984 PolarHBondContact O-N 3.44Å; L981-S984 PolarHBondContact O-N 3.09Å; L981-S984 PolarHBondContact O-OG 3.28Å; S984-I986 PolarHBondContact O-N 3.39Å; S984-I986 VanDerWaalsContact O-N 3.1Å; S984-L987 VanDerWaalsContact O-CB 3.3Å; S984-L987 WeakPolarHBondContact O-CB 3Å; S984-L987 WeakPolarHBondContact O-CG 3.49Å; S984-L987 PolarHBondContact O-N 2.93Å; S984-V1065 WeakPolarHBondContact OG-CG1 3.28Å; S984-V1070 VanDerWaalsContact O-CG1 3.31Å; S984-V1070 WeakPolarHBondContact O-CG1 3.19Å
985	P	91.4	Very high	86.3	Confident	37 Å²	37	10.9 Å²	10.9	24%	0.24	6%	0.055	C	C	.	.	G	3₁₀ helix	trans	-64	-15	176.8	-22.8	36.8	0	0	0	114.1	V895 I982 L983 L987 P988 Y989 V1065	V895-P985 HydrophobicContact CG1-CB 3.85Å; V895-P985 WeakPolarHBondContact CG1-O 3.49Å; V895-P985 HydrophobicContact CG2-CB 4.11Å; I982-P985 WeakPolarHBondContact O-CD 3.28Å; L983-P985 VanDerWaalsContact C-N 3.31Å; L983-P985 VanDerWaalsContact O-N 3.17Å; P985-L987 VanDerWaalsContact C-N 3.32Å; P985-P988 WeakPolarHBondContact O-CD 3.29Å; P985-Y989 WeakPolarHBondContact O-CE2 3.45Å; P985-V1065 HydrophobicContact CG-CG1 4.33Å; P985-V1065 HydrophobicContact CG-CG2 4.19Å
986	I	90.4	Very high	86.5	Confident	10 Å²	10	10.8 Å²	10.8	5%	0.051	5%	0.054	C	C	.	.	G	3₁₀ helix	trans	-74.4	-23.3	175	-149.4	174.5	0	0	0	112.7	V894 V895 A898 L983 S984 P988 Y989 L990 I1028	V894-I986 HydrophobicContact CG1-CD1 4.26Å; V895-I986 HydrophobicContact CG2-CB 4.22Å; A898-I986 HydrophobicContact CB-CD1 4.02Å; A898-I986 HydrophobicContact CB-CG1 3.64Å; L983-I986 WeakPolarHBondContact O-CB 3.31Å; L983-I986 WeakPolarHBondContact O-CG2 3.21Å; L983-I986 PolarHBondContact O-N 3.14Å; S984-I986 PolarHBondContact O-N 3.39Å; S984-I986 VanDerWaalsContact O-N 3.1Å; I986-P988 VanDerWaalsContact C-CD 3.49Å; I986-Y989 PolarHBondContact O-N 2.98Å; I986-L990 HydrophobicContact CG1-CG 4.42Å; I986-L990 HydrophobicContact CG2-CD1 3.82Å; I986-L990 HydrophobicContact CG2-CG 4.3Å; I986-L990 PolarHBondContact O-N 2.9Å; I986-I1028 HydrophobicContact CG2-CD1 3.87Å
987	L	90.6	Very high	86.6	Confident	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-55.9	-46.1	-170.6	-71.9	171	0	0	0	114.1	S984 P985 Y989 L990 F1025 I1028 I1029 L1032	S984-L987 VanDerWaalsContact O-CB 3.3Å; S984-L987 WeakPolarHBondContact O-CB 3Å; S984-L987 WeakPolarHBondContact O-CG 3.49Å; S984-L987 PolarHBondContact O-N 2.93Å; P985-L987 VanDerWaalsContact C-N 3.32Å; L987-Y989 PolarHBondContact O-N 2.82Å; L987-Y989 VanDerWaalsContact O-N 3.17Å; L987-L990 PolarHBondContact O-N 2.93Å; L987-F1025 HydrophobicContact CB-CE2 4.06Å; L987-F1025 HydrophobicContact CD2-CD2 3.48Å; L987-F1025 VanDerWaalsContact CD2-CD2 3.48Å; L987-F1025 HydrophobicContact CD2-CE2 3.63Å; L987-F1025 HydrophobicContact CD2-CG 4.11Å; L987-F1025 HydrophobicContact CD2-CZ 4.38Å; L987-F1025 HydrophobicContact CG-CE2 4.44Å; L987-I1028 HydrophobicContact CD1-CG2 3.93Å; L987-I1028 HydrophobicContact CD2-CB 3.96Å; L987-I1028 HydrophobicContact CD2-CD1 4.23Å; L987-I1028 HydrophobicContact CD2-CG2 3.93Å; L987-I1028 HydrophobicContact CG-CG2 3.94Å; L987-I1029 HydrophobicContact CD1-CG1 3.88Å; L987-I1029 HydrophobicContact CD2-CG1 4.16Å; L987-L1032 HydrophobicContact CD1-CD1 4.38Å
988	P	89.8	Confident	86.4	Confident	7 Å²	7	7.6 Å²	7.6	5%	0.045	4%	0.04	C	C	.	.	H	α-helix	trans	-58.4	-32.1	-178.3	-22.8	33.6	0	0	0	113.1	P985 I986 A1073 Q1077	P985-P988 WeakPolarHBondContact O-CD 3.29Å; I986-P988 VanDerWaalsContact C-CD 3.49Å; P988-A1073 HydrophobicContact CB-CB 4.12Å; P988-A1073 HydrophobicContact CG-CB 3.77Å; P988-Q1077 HydrophobicContact CB-CG 4.15Å
989	Y	89.1	Confident	85.8	Confident	45 Å²	45	8.2 Å²	8.2	18%	0.176	4%	0.044	C	C	.	.	H	α-helix	trans	-83.1	-31	-176.8	-49.7	-64.9	0	0	0	112.5	V895 Q899 P985 I986 L987 I991 T992 W993	V895-Y989 HydrophobicContact CG1-CD2 4.36Å; V895-Y989 HydrophobicContact CG1-CE2 3.88Å; Q899-Y989 HydrophobicContact CB-CD1 3.99Å; Q899-Y989 HydrophobicContact CB-CD2 4.27Å; Q899-Y989 HydrophobicContact CB-CE1 3.63Å; Q899-Y989 HydrophobicContact CB-CE2 3.94Å; Q899-Y989 HydrophobicContact CB-CG 4.29Å; Q899-Y989 HydrophobicContact CG-CD1 4.21Å; Q899-Y989 HydrophobicContact CG-CE1 3.51Å; P985-Y989 WeakPolarHBondContact O-CE2 3.45Å; I986-Y989 PolarHBondContact O-N 2.98Å; L987-Y989 PolarHBondContact O-N 2.82Å; L987-Y989 VanDerWaalsContact O-N 3.17Å; Y989-I991 PolarHBondContact O-N 3.24Å; Y989-T992 PolarHBondContact O-N 3.13Å; Y989-T992 PolarHBondContact O-OG1 3.26Å; Y989-W993 VanDerWaalsContact O-CD1 3.27Å
990	L	89	Confident	85	Confident	3 Å²	3	9.1 Å²	9.1	2%	0.016	5%	0.05	C	C	.	.	H	α-helix	trans	-66.9	-21.5	176.2	-66	-178.5	0	0	0	113.2	I986 L987 T992 W993 L1021 L1024 F1025 I1028	I986-L990 HydrophobicContact CG1-CG 4.42Å; I986-L990 HydrophobicContact CG2-CD1 3.82Å; I986-L990 HydrophobicContact CG2-CG 4.3Å; I986-L990 PolarHBondContact O-N 2.9Å; L987-L990 PolarHBondContact O-N 2.93Å; L990-T992 VanDerWaalsContact C-N 3.25Å; L990-T992 PolarHBondContact O-N 3.43Å; L990-W993 HydrophobicContact CD2-CD2 4.02Å; L990-W993 HydrophobicContact CD2-CE3 3.87Å; L990-W993 HydrophobicContact CD2-CH2 3.92Å; L990-W993 HydrophobicContact CD2-CZ2 4.08Å; L990-W993 HydrophobicContact CD2-CZ3 3.83Å; L990-W993 PolarHBondContact O-N 2.87Å; L990-L1021 HydrophobicContact CB-CD1 4.22Å; L990-L1021 HydrophobicContact CD2-CD1 4Å; L990-L1024 HydrophobicContact CD1-CD2 3.88Å; L990-F1025 HydrophobicContact CB-CD2 4.38Å; L990-I1028 HydrophobicContact CD1-CD1 4.47Å
991	I	88.7	Confident	83.9	Confident	3 Å²	3	11.6 Å²	11.6	2%	0.015	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.1	-179.7	-69.4	171.4	0	0	0	111.6	Y989 P994 F1025 C1074 Q1077 L1078 L1081 L1106	Y989-I991 PolarHBondContact O-N 3.24Å; I991-P994 WeakPolarHBondContact O-CD 3.32Å; I991-F1025 HydrophobicContact CD1-CE2 4.1Å; I991-F1025 HydrophobicContact CD1-CZ 4.09Å; I991-F1025 HydrophobicContact CG1-CE2 3.61Å; I991-F1025 HydrophobicContact CG1-CZ 3.92Å; I991-C1074 HydrophobicContact CD1-CB 3.98Å; I991-C1074 WeakPolarHBondContact CD1-O 3.35Å; I991-Q1077 HydrophobicContact CD1-CB 4.48Å; I991-L1078 HydrophobicContact CG2-CB 4.41Å; I991-L1078 HydrophobicContact CG2-CD1 4.05Å; I991-L1081 HydrophobicContact CG2-CD1 4.19Å; I991-L1081 VanDerWaalsContact O-CD1 3.22Å; I991-L1081 WeakPolarHBondContact O-CD1 3.49Å; I991-L1106 HydrophobicContact CG2-CD1 4.31Å
992	T	87.6	Confident	82.3	Confident	4 Å²	4	14.4 Å²	14.4	3%	0.025	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-19.6	-174.8	62.2	0	0	0	0	113.8	V903 Y989 L990 L995	V903-T992 PolarHBondContact N-OG1 3.4Å; V903-T992 WeakPolarHBondContact O-CB 3.44Å; Y989-T992 PolarHBondContact O-N 3.13Å; Y989-T992 PolarHBondContact O-OG1 3.26Å; L990-T992 VanDerWaalsContact C-N 3.25Å; L990-T992 PolarHBondContact O-N 3.43Å; T992-L995 VanDerWaalsContact O-CB 3.29Å; T992-L995 WeakPolarHBondContact O-CB 3.29Å; T992-L995 PolarHBondContact O-N 3.41Å; T992-L995 VanDerWaalsContact O-N 3.07Å
993	W	88.5	Confident	80.4	Confident	3 Å²	3	20.2 Å²	20.2	1%	0.011	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.9	-178.6	-72.1	21.1	0	0	0	116.3	A898 I901 V947 L950 V951 L954 Y989 L990 L995 A996 L997 L1021	A898-W993 HydrophobicContact CB-CZ2 4.36Å; I901-W993 HydrophobicContact CB-CZ2 4.25Å; I901-W993 HydrophobicContact CD1-CZ2 4.01Å; I901-W993 HydrophobicContact CG2-CZ2 4.32Å; I901-W993 PolarHBondContact O-NE1 2.9Å; V947-W993 HydrophobicContact CG1-CB 4.07Å; V947-W993 HydrophobicContact CG1-CD2 4.15Å; V947-W993 HydrophobicContact CG1-CE3 3.84Å; V947-W993 HydrophobicContact CG1-CG 4.28Å; L950-W993 HydrophobicContact CD2-CH2 3.34Å; L950-W993 HydrophobicContact CD2-CZ2 4.07Å; L950-W993 HydrophobicContact CD2-CZ3 3.9Å; L950-W993 HydrophobicContact CG-CH2 3.97Å; L950-W993 HydrophobicContact CG-CZ3 4.14Å; V951-W993 HydrophobicContact CG2-CE3 3.65Å; V951-W993 HydrophobicContact CG2-CZ3 3.82Å; L954-W993 HydrophobicContact CD1-CH2 4.03Å; L954-W993 HydrophobicContact CD1-CZ3 3.95Å; Y989-W993 VanDerWaalsContact O-CD1 3.27Å; L990-W993 HydrophobicContact CD2-CD2 4.02Å; L990-W993 HydrophobicContact CD2-CE3 3.87Å; L990-W993 HydrophobicContact CD2-CH2 3.92Å; L990-W993 HydrophobicContact CD2-CZ2 4.08Å; L990-W993 HydrophobicContact CD2-CZ3 3.83Å; L990-W993 PolarHBondContact O-N 2.87Å; W993-L995 PolarHBondContact O-N 3.3Å; W993-A996 WeakPolarHBondContact O-CB 3.13Å; W993-A996 PolarHBondContact O-N 2.99Å; W993-A996 VanDerWaalsContact O-N 3.1Å; W993-L997 PolarHBondContact O-N 3.4Å; W993-L1021 HydrophobicContact CB-CD2 3.63Å; W993-L1021 HydrophobicContact CE3-CD1 4.1Å
994	P	87.4	Confident	78.3	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-57.2	-29.7	172.3	-24	34.8	0	0	0	113.4	I991 A996 L997 L998 V1018 L1021 W1102	I991-P994 WeakPolarHBondContact O-CD 3.32Å; P994-A996 VanDerWaalsContact C-N 3.26Å; P994-A996 PolarHBondContact O-N 2.85Å; P994-L997 PolarHBondContact O-N 3.38Å; P994-L997 VanDerWaalsContact O-N 3.09Å; P994-L998 PolarHBondContact O-N 3.34Å; P994-V1018 HydrophobicContact CB-CG1 4.48Å; P994-L1021 HydrophobicContact CG-CD2 3.79Å; P994-W1102 HydrophobicContact CB-CD2 4.07Å; P994-W1102 HydrophobicContact CB-CE3 3.7Å; P994-W1102 HydrophobicContact CB-CH2 4.08Å; P994-W1102 HydrophobicContact CB-CZ2 4.44Å; P994-W1102 HydrophobicContact CB-CZ3 3.71Å; P994-W1102 HydrophobicContact CG-CE3 4.03Å; P994-W1102 HydrophobicContact CG-CZ3 4.06Å
995	L	83.1	Confident	76.1	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-62.9	-33.1	177.2	-63.9	173.7	0	0	0	112.2	V903 L905 T992 W993 P999 L1081 L1085 W1102	V903-L995 HydrophobicContact CG1-CB 3.93Å; L905-L995 HydrophobicContact CD1-CD2 4.42Å; T992-L995 VanDerWaalsContact O-CB 3.29Å; T992-L995 WeakPolarHBondContact O-CB 3.29Å; T992-L995 PolarHBondContact O-N 3.41Å; T992-L995 VanDerWaalsContact O-N 3.07Å; W993-L995 PolarHBondContact O-N 3.3Å; L995-P999 WeakPolarHBondContact O-CA 3.48Å; L995-L1081 HydrophobicContact CD1-CD1 3.95Å; L995-L1081 HydrophobicContact CD1-CG 4.4Å; L995-L1081 HydrophobicContact CD2-CD1 4.49Å; L995-L1081 HydrophobicContact CG-CD1 4.03Å; L995-L1085 HydrophobicContact CD2-CD1 4.04Å; L995-L1085 HydrophobicContact CD2-CD2 3.76Å; L995-L1085 HydrophobicContact CD2-CG 4.06Å; L995-W1102 HydrophobicContact CD2-CH2 4.18Å
996	A	80.3	Confident	73.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-73.3	-30.4	174.7	0	0	0	0	0	112.7	V903 L943 T944 V947 W993 P994	V903-A996 HydrophobicContact CG1-CB 4.15Å; V903-A996 HydrophobicContact CG2-CB 4.14Å; L943-A996 HydrophobicContact CD2-CB 3.81Å; L943-A996 HydrophobicContact CG-CB 3.74Å; T944-A996 WeakPolarHBondContact CA-O 3.28Å; T944-A996 WeakPolarHBondContact CB-O 3.3Å; T944-A996 PolarHBondContact OG1-O 3.14Å; V947-A996 HydrophobicContact CB-CB 4.36Å; V947-A996 HydrophobicContact CG2-CB 3.93Å; W993-A996 WeakPolarHBondContact O-CB 3.13Å; W993-A996 PolarHBondContact O-N 2.99Å; W993-A996 VanDerWaalsContact O-N 3.1Å; P994-A996 VanDerWaalsContact C-N 3.26Å; P994-A996 PolarHBondContact O-N 2.85Å
997	L	78.8	Confident	71.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-87.7	-37.3	-175.8	-66.2	174.4	0	0	0	112.8	T944 V947 F948 W993 P994 R1014 A1017 V1018	T944-L997 HydrophobicContact CG2-CD2 4.36Å; V947-L997 HydrophobicContact CB-CD2 4.21Å; V947-L997 HydrophobicContact CG1-CD1 4.13Å; V947-L997 HydrophobicContact CG1-CD2 4.03Å; V947-L997 HydrophobicContact CG1-CG 3.92Å; F948-L997 HydrophobicContact CB-CD2 4Å; W993-L997 PolarHBondContact O-N 3.4Å; P994-L997 PolarHBondContact O-N 3.38Å; P994-L997 VanDerWaalsContact O-N 3.09Å; L997-R1014 WeakPolarHBondContact O-CD 3.25Å; L997-A1017 HydrophobicContact CD1-CB 3.94Å; L997-A1017 HydrophobicContact CD2-CB 4.25Å; L997-V1018 HydrophobicContact CB-CG2 3.59Å; L997-V1018 HydrophobicContact CD1-CG2 3.74Å; L997-V1018 HydrophobicContact CG-CG2 4.33Å
998	L	76.9	Confident	70.1	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.099	26%	0.259	C	S	.	.	S	Bend	trans	-130.5	72.2	179.4	-68.9	174.8	0	0	0	109.5	P994 L1002 R1014 I1015 V1018 W1101	P994-L998 PolarHBondContact O-N 3.34Å; L998-L1002 HydrophobicContact CD2-CD1 4.11Å; L998-R1014 HydrophobicContact CD2-CB 4.18Å; L998-I1015 HydrophobicContact CD1-CG1 4.45Å; L998-I1015 HydrophobicContact CD2-CG1 4.33Å; L998-V1018 HydrophobicContact CD1-CB 4.34Å; L998-V1018 HydrophobicContact CD1-CG2 3.75Å; L998-V1018 HydrophobicContact CG-CG2 3.95Å; L998-W1101 HydrophobicContact CD1-CZ2 3.87Å
999	P	70.1	Confident	68.6	Low	18 Å²	18	51 Å²	51	12%	0.117	26%	0.264	C	S	.	.			trans	-64.4	145.7	176.2	27	-33.9	0	0	0	110.2	P911 L995 S1001 L1002	P911-P999 HydrophobicContact CG-CB 4.3Å; L995-P999 WeakPolarHBondContact O-CA 3.48Å; P999-S1001 VanDerWaalsContact C-N 3.26Å; P999-S1001 PolarHBondContact O-N 3.02Å; P999-L1002 HydrophobicContact CG-CD1 4.41Å; P999-L1002 WeakPolarHBondContact O-CD1 3.43Å
1000	P	65	Low	67.6	Low	20 Å²	20	52 Å²	52	13%	0.13	28%	0.279	C	S	.	.	S	Bend	trans	-61.6	-31.4	-177.3	-22.9	33.2	0	0	0	114.2	L905 L1002 L1085 Y1088 Y1089	L905-P1000 HydrophobicContact CD1-CG 4.25Å; L905-P1000 HydrophobicContact CD2-CG 4.35Å; P1000-L1002 VanDerWaalsContact C-N 3.29Å; P1000-L1002 PolarHBondContact O-N 2.99Å; P1000-L1002 VanDerWaalsContact O-N 3.1Å; P1000-L1085 HydrophobicContact CG-CD2 3.73Å; P1000-Y1088 HydrophobicContact CB-CD1 3.3Å; P1000-Y1088 HydrophobicContact CB-CD2 4.27Å; P1000-Y1088 HydrophobicContact CB-CE1 3.03Å; P1000-Y1088 HydrophobicContact CB-CE2 4.04Å; P1000-Y1088 HydrophobicContact CB-CG 3.92Å; P1000-Y1088 VanDerWaalsContact CB-CZ 3.42Å; P1000-Y1088 HydrophobicContact CG-CD1 3.96Å; P1000-Y1088 HydrophobicContact CG-CE1 4.15Å; P1000-Y1088 HydrophobicContact CG-CG 4.22Å; P1000-Y1089 HydrophobicContact CB-CE1 4.4Å
1001	S	62.4	Low	66.8	Low	51 Å²	51	58.5 Å²	58.5	36%	0.357	31%	0.307	S	S	.	.			trans	-85.9	52	-178	61.5	0	0	0	0	113.4	P999 D1003 Y1088	P999-S1001 VanDerWaalsContact C-N 3.26Å; P999-S1001 PolarHBondContact O-N 3.02Å; S1001-D1003 PolarHBondContact O-N 3.45Å; S1001-Y1088 PolarHBondContact N-OH 2.93Å
1002	L	54.6	Low	66	Low	67 Å²	67	63.9 Å²	63.9	35%	0.351	33%	0.331	S	S	.	.			trans	-83.9	57.2	-166.4	-141.3	140.7	0	0	0	112.8	L998 P999 P1000	L998-L1002 HydrophobicContact CD2-CD1 4.11Å; P999-L1002 HydrophobicContact CG-CD1 4.41Å; P999-L1002 WeakPolarHBondContact O-CD1 3.43Å; P1000-L1002 VanDerWaalsContact C-N 3.29Å; P1000-L1002 PolarHBondContact O-N 2.99Å; P1000-L1002 VanDerWaalsContact O-N 3.1Å
1003	D	45.3	Very low	65.2	Low	132 Å²	132	64.8 Å²	64.8	71%	0.706	34%	0.34	S	S	*	.			trans	-97.5	116.4	174.6	-94.2	-35.3	0	0	0	112.6	S1001 T1005	S1001-D1003 PolarHBondContact O-N 3.45Å; D1003-T1005 PolarHBondContact O-N 3.37Å
1004	K	45.8	Very low	64.6	Low	195 Å²	195	65.8 Å²	65.8	85%	0.848	34%	0.343	S	S	*	.			trans	38.8	48.8	147.9	-56.8	-176.2	-178.3	178.6	0	119.3
1005	T	42.8	Very low	64.2	Low	93 Å²	93	67.3 Å²	67.3	57%	0.571	35%	0.351	S	S	*	.			trans	-100.7	122	164.7	45	0	0	0	0	110.7	D1003 E1007 N1008	D1003-T1005 PolarHBondContact O-N 3.37Å; T1005-E1007 PolarHBondContact O-N 3.31Å; T1005-N1008 PolarHBondContact OG1-ND2 3.4Å
1006	L	42.6	Very low	64	Low	181 Å²	181	70.7 Å²	70.7	95%	0.948	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.6	-169.7	-117.7	84.3	0	0	0	115
1007	E	47.9	Very low	64	Low	163 Å²	163	70.7 Å²	70.7	76%	0.762	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	8.5	-167.7	-65.6	-175.7	163.4	0	0	114.9	T1005	T1005-E1007 PolarHBondContact O-N 3.31Å
1008	N	56.1	Low	64.3	Low	47 Å²	47	70.7 Å²	70.7	25%	0.251	37%	0.369	S	S	.	.	S	Bend	trans	-94.4	145.3	180	-84.2	-50.3	0	0	0	112	S942 T1005 S1010	S942-N1008 WeakPolarHBondContact CB-OD1 3.21Å; S942-N1008 PolarHBondContact OG-OD1 3.25Å; T1005-N1008 PolarHBondContact OG1-ND2 3.4Å; N1008-S1010 PolarHBondContact O-N 3.37Å
1009	P	59.2	Low	64.5	Low	24 Å²	24	71.9 Å²	71.9	16%	0.156	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-49.5	143.6	174.2	18.5	-29.9	0	0	0	110.2	T944 K1011 A1013 R1014	T944-P1009 HydrophobicContact CG2-CG 4.11Å; P1009-K1011 PolarHBondContact O-N 3.18Å; P1009-A1013 HydrophobicContact CB-CB 4.24Å; P1009-R1014 HydrophobicContact CB-CG 4.3Å; P1009-R1014 HydrophobicContact CG-CG 3.83Å; P1009-R1014 PolarHBondContact O-NE 3.26Å
1010	S	68.6	Low	65.1	Low	68 Å²	68	72.6 Å²	72.6	48%	0.476	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-48.3	145.5	-174	77	0	0	0	0	110.5	N1008 E1012 A1013 R1014	N1008-S1010 PolarHBondContact O-N 3.37Å; S1010-E1012 PolarHBondContact O-N 2.88Å; S1010-A1013 WeakPolarHBondContact O-CB 3.25Å; S1010-A1013 PolarHBondContact O-N 3.18Å; S1010-A1013 PolarHBondContact OG-N 3.42Å; S1010-R1014 PolarHBondContact O-N 2.75Å
1011	K	71.6	Confident	66.2	Low	139 Å²	139	71.8 Å²	71.8	60%	0.604	37%	0.368	S	S	*	.	H	α-helix	trans	-50.3	-35.6	-179.8	-175.3	179.2	177.4	-179.5	0	111.2	P1009 R1014 I1015	P1009-K1011 PolarHBondContact O-N 3.18Å; K1011-R1014 PolarHBondContact O-N 3.31Å; K1011-I1015 HydrophobicContact CG-CD1 4.06Å; K1011-I1015 VanDerWaalsContact O-CG1 3.26Å; K1011-I1015 WeakPolarHBondContact O-CG1 3.42Å; K1011-I1015 PolarHBondContact O-N 3.37Å
1012	E	71.5	Confident	67.3	Low	115 Å²	115	70.3 Å²	70.3	54%	0.537	36%	0.356	S	S	.	.	H	α-helix	trans	-63.9	-47.1	175	-61.7	175.5	173	0	0	113.1	S1010 R1014 I1015 L1016	S1010-E1012 PolarHBondContact O-N 2.88Å; E1012-R1014 VanDerWaalsContact C-N 3.3Å; E1012-R1014 PolarHBondContact O-N 2.97Å; E1012-I1015 PolarHBondContact O-N 3.23Å; E1012-L1016 WeakPolarHBondContact O-CB 3.32Å; E1012-L1016 PolarHBondContact O-N 2.72Å
1013	A	71.8	Confident	68.6	Low	24 Å²	24	69.7 Å²	69.7	20%	0.198	35%	0.349	C	S	.	.	H	α-helix	trans	-61.4	-38.8	176.9	0	0	0	0	0	111.8	F948 P1009 S1010 L1016 A1017	F948-A1013 HydrophobicContact CE2-CB 4.18Å; P1009-A1013 HydrophobicContact CB-CB 4.24Å; S1010-A1013 WeakPolarHBondContact O-CB 3.25Å; S1010-A1013 PolarHBondContact O-N 3.18Å; S1010-A1013 PolarHBondContact OG-N 3.42Å; A1013-L1016 PolarHBondContact O-N 3.19Å; A1013-A1017 PolarHBondContact O-N 3.19Å
1014	R	76	Confident	70.4	Confident	23 Å²	23	63.5 Å²	63.5	9%	0.087	32%	0.316	C	S	.	.	H	α-helix	trans	-67	-45.6	176.1	-69.2	-175.7	-76.1	162.7	-8.1	112.4	T944 L997 L998 P1009 S1010 K1011 E1012 L1016 A1017 V1018	T944-R1014 HydrophobicContact CG2-CG 4.1Å; L997-R1014 WeakPolarHBondContact O-CD 3.25Å; L998-R1014 HydrophobicContact CD2-CB 4.18Å; P1009-R1014 HydrophobicContact CB-CG 4.3Å; P1009-R1014 HydrophobicContact CG-CG 3.83Å; P1009-R1014 PolarHBondContact O-NE 3.26Å; S1010-R1014 PolarHBondContact O-N 2.75Å; K1011-R1014 PolarHBondContact O-N 3.31Å; E1012-R1014 VanDerWaalsContact C-N 3.3Å; E1012-R1014 PolarHBondContact O-N 2.97Å; R1014-L1016 VanDerWaalsContact C-N 3.28Å; R1014-L1016 PolarHBondContact O-N 3.26Å; R1014-A1017 PolarHBondContact O-N 2.93Å; R1014-V1018 PolarHBondContact O-N 3.35Å
1015	I	77.5	Confident	72.4	Confident	34 Å²	34	54.5 Å²	54.5	17%	0.174	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-42.3	174	-69.2	166.1	0	0	0	110.4	L998 K1011 E1012 A1017 V1018 R1019 W1101 A1289	L998-I1015 HydrophobicContact CD1-CG1 4.45Å; L998-I1015 HydrophobicContact CD2-CG1 4.33Å; K1011-I1015 HydrophobicContact CG-CD1 4.06Å; K1011-I1015 VanDerWaalsContact O-CG1 3.26Å; K1011-I1015 WeakPolarHBondContact O-CG1 3.42Å; K1011-I1015 PolarHBondContact O-N 3.37Å; E1012-I1015 PolarHBondContact O-N 3.23Å; I1015-A1017 VanDerWaalsContact C-N 3.33Å; I1015-A1017 PolarHBondContact O-N 2.94Å; I1015-V1018 PolarHBondContact O-N 2.89Å; I1015-R1019 WeakPolarHBondContact O-CG 3.36Å; I1015-R1019 PolarHBondContact O-N 3.29Å; I1015-W1101 HydrophobicContact CG2-CH2 4.37Å; I1015-W1101 HydrophobicContact CG2-CZ2 4.34Å; I1015-A1289 HydrophobicContact CG2-CB 4.16Å
1016	L	78.8	Confident	74.3	Confident	72 Å²	72	50.8 Å²	50.8	38%	0.377	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-43.1	176.5	-175.2	66.6	0	0	0	111.2	E1012 A1013 R1014 R1019 K1020	E1012-L1016 WeakPolarHBondContact O-CB 3.32Å; E1012-L1016 PolarHBondContact O-N 2.72Å; A1013-L1016 PolarHBondContact O-N 3.19Å; R1014-L1016 VanDerWaalsContact C-N 3.28Å; R1014-L1016 PolarHBondContact O-N 3.26Å; L1016-R1019 CarbonylContact O-C 3.24Å; L1016-R1019 WeakPolarHBondContact O-CB 3.38Å; L1016-R1019 PolarHBondContact O-N 3.03Å; L1016-K1020 VanDerWaalsContact O-CG 3.3Å; L1016-K1020 WeakPolarHBondContact O-CG 3.47Å; L1016-K1020 PolarHBondContact O-N 2.96Å
1017	A	80.5	Confident	76.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-40.7	177	0	0	0	0	0	113.2	F948 L997 A1013 R1014 I1015 R1019 K1020 L1021	F948-A1017 HydrophobicContact CD2-CB 3.43Å; F948-A1017 VanDerWaalsContact CD2-CB 3.43Å; F948-A1017 HydrophobicContact CE2-CB 3.94Å; F948-A1017 HydrophobicContact CG-CB 4.43Å; L997-A1017 HydrophobicContact CD1-CB 3.94Å; L997-A1017 HydrophobicContact CD2-CB 4.25Å; A1013-A1017 PolarHBondContact O-N 3.19Å; R1014-A1017 PolarHBondContact O-N 2.93Å; I1015-A1017 VanDerWaalsContact C-N 3.33Å; I1015-A1017 PolarHBondContact O-N 2.94Å; A1017-R1019 VanDerWaalsContact C-N 3.29Å; A1017-R1019 PolarHBondContact O-N 3.09Å; A1017-K1020 WeakPolarHBondContact O-CB 3.49Å; A1017-K1020 PolarHBondContact O-N 2.83Å; A1017-K1020 VanDerWaalsContact O-N 3.1Å; A1017-L1021 WeakPolarHBondContact O-CB 3.08Å; A1017-L1021 PolarHBondContact O-N 3.5Å
1018	V	84.4	Confident	78.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-41.5	171.9	175.8	0	0	0	0	110.3	P994 L997 L998 R1014 I1015 K1020 L1021 L1022 W1101 W1102	P994-V1018 HydrophobicContact CB-CG1 4.48Å; L997-V1018 HydrophobicContact CB-CG2 3.59Å; L997-V1018 HydrophobicContact CD1-CG2 3.74Å; L997-V1018 HydrophobicContact CG-CG2 4.33Å; L998-V1018 HydrophobicContact CD1-CB 4.34Å; L998-V1018 HydrophobicContact CD1-CG2 3.75Å; L998-V1018 HydrophobicContact CG-CG2 3.95Å; R1014-V1018 PolarHBondContact O-N 3.35Å; I1015-V1018 PolarHBondContact O-N 2.89Å; V1018-K1020 VanDerWaalsContact C-N 3.31Å; V1018-K1020 PolarHBondContact O-N 3.35Å; V1018-L1021 PolarHBondContact O-N 2.97Å; V1018-L1022 HydrophobicContact CG1-CD1 4.05Å; V1018-L1022 HydrophobicContact CG1-CG 4.32Å; V1018-L1022 VanDerWaalsContact O-CG 3.31Å; V1018-L1022 WeakPolarHBondContact O-CG 3.44Å; V1018-L1022 PolarHBondContact O-N 3.24Å; V1018-W1101 HydrophobicContact CB-CH2 4.01Å; V1018-W1101 HydrophobicContact CB-CZ2 4.5Å; V1018-W1101 HydrophobicContact CG1-CH2 3.58Å; V1018-W1101 HydrophobicContact CG1-CZ2 4.12Å; V1018-W1101 HydrophobicContact CG1-CZ3 4.29Å; V1018-W1102 HydrophobicContact CG1-CB 3.87Å; V1018-W1102 HydrophobicContact CG1-CG 4.31Å
1019	R	82	Confident	79.4	Confident	43 Å²	43	32.6 Å²	32.6	16%	0.162	17%	0.166	C	C	.	.	H	α-helix	trans	-62	-36.3	173.8	-73.8	-179.3	176.9	-178.9	0	112.8	I1015 L1016 A1017 R1023 W1101 E1290	I1015-R1019 WeakPolarHBondContact O-CG 3.36Å; I1015-R1019 PolarHBondContact O-N 3.29Å; L1016-R1019 CarbonylContact O-C 3.24Å; L1016-R1019 WeakPolarHBondContact O-CB 3.38Å; L1016-R1019 PolarHBondContact O-N 3.03Å; A1017-R1019 VanDerWaalsContact C-N 3.29Å; A1017-R1019 PolarHBondContact O-N 3.09Å; R1019-R1023 WeakPolarHBondContact O-CB 3.49Å; R1019-R1023 WeakPolarHBondContact O-CG 3.43Å; R1019-R1023 PolarHBondContact O-N 3.21Å; R1019-R1023 VanDerWaalsContact O-N 3.14Å; R1019-R1023 PolarHBondContact O-NE 2.93Å; R1019-W1101 HydrophobicContact CG-CH2 4.19Å; R1019-W1101 HydrophobicContact CG-CZ3 4.17Å; R1019-E1290 PolarHBondContact NH2-O 3.5Å
1020	K	82.8	Confident	80.5	Confident	33 Å²	33	35 Å²	35	14%	0.143	18%	0.177	C	C	.	.	H	α-helix	trans	-67	-43.1	175.3	-69.6	175.9	168.3	-149.8	0	111.2	V951 T952 E955 L1016 A1017 V1018 R1023 L1024	V951-K1020 HydrophobicContact CG1-CB 3.75Å; T952-K1020 PolarHBondContact OG1-NZ 3.14Å; E955-K1020 WeakPolarHBondContact OE2-CD 3.25Å; E955-K1020 WeakPolarHBondContact OE2-CE 3.3Å; E955-K1020 VanDerWaalsContact OE2-CG 3.25Å; E955-K1020 WeakPolarHBondContact OE2-CG 3.25Å; E955-K1020 IonicContact OE2-NZ 3.81Å; E955-K1020 PolarHBondContact OE2-NZ 3.5Å; E955-K1020 VanDerWaalsContact OE2-NZ 3.12Å; L1016-K1020 VanDerWaalsContact O-CG 3.3Å; L1016-K1020 WeakPolarHBondContact O-CG 3.47Å; L1016-K1020 PolarHBondContact O-N 2.96Å; A1017-K1020 WeakPolarHBondContact O-CB 3.49Å; A1017-K1020 PolarHBondContact O-N 2.83Å; A1017-K1020 VanDerWaalsContact O-N 3.1Å; V1018-K1020 VanDerWaalsContact C-N 3.31Å; V1018-K1020 PolarHBondContact O-N 3.35Å; K1020-R1023 VanDerWaalsContact CG-NH2 3.27Å; K1020-R1023 VanDerWaalsContact O-CB 3.25Å; K1020-R1023 WeakPolarHBondContact O-CB 3.4Å; K1020-R1023 PolarHBondContact O-N 2.83Å; K1020-L1024 PolarHBondContact O-N 3.14Å
1021	L	87.3	Confident	81.1	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-62.9	-48.5	176.8	178.5	65	0	0	0	112	V951 L990 W993 P994 A1017 V1018 R1023 L1024 F1025	V951-L1021 HydrophobicContact CG1-CB 3.98Å; V951-L1021 HydrophobicContact CG2-CB 4.3Å; V951-L1021 HydrophobicContact CG2-CD1 4.06Å; L990-L1021 HydrophobicContact CB-CD1 4.22Å; L990-L1021 HydrophobicContact CD2-CD1 4Å; W993-L1021 HydrophobicContact CB-CD2 3.63Å; W993-L1021 HydrophobicContact CE3-CD1 4.1Å; P994-L1021 HydrophobicContact CG-CD2 3.79Å; A1017-L1021 WeakPolarHBondContact O-CB 3.08Å; A1017-L1021 PolarHBondContact O-N 3.5Å; V1018-L1021 PolarHBondContact O-N 2.97Å; L1021-R1023 PolarHBondContact O-N 3.44Å; L1021-L1024 WeakPolarHBondContact O-CA 3.37Å; L1021-L1024 VanDerWaalsContact O-CB 3.24Å; L1021-L1024 WeakPolarHBondContact O-CB 3.45Å; L1021-L1024 PolarHBondContact O-N 3.32Å; L1021-F1025 PolarHBondContact O-N 2.97Å
1022	L	85.7	Confident	81.7	Confident	20 Å²	20	25.8 Å²	25.8	11%	0.105	13%	0.13	C	C	.	.	H	α-helix	trans	-59.7	-37.5	175.7	-69.4	170.9	0	0	0	111.7	V1018 L1024 F1025 A1026 W1101 W1102 A1105 L1106	V1018-L1022 HydrophobicContact CG1-CD1 4.05Å; V1018-L1022 HydrophobicContact CG1-CG 4.32Å; V1018-L1022 VanDerWaalsContact O-CG 3.31Å; V1018-L1022 WeakPolarHBondContact O-CG 3.44Å; V1018-L1022 PolarHBondContact O-N 3.24Å; L1022-L1024 VanDerWaalsContact C-N 3.34Å; L1022-F1025 PolarHBondContact O-N 3.44Å; L1022-A1026 WeakPolarHBondContact O-CB 3.35Å; L1022-A1026 PolarHBondContact O-N 3.43Å; L1022-W1101 HydrophobicContact CD1-CE3 4.48Å; L1022-W1101 HydrophobicContact CD1-CH2 4.46Å; L1022-W1101 HydrophobicContact CD1-CZ3 3.78Å; L1022-W1102 HydrophobicContact CD1-CB 4.03Å; L1022-A1105 HydrophobicContact CD1-CB 3.77Å; L1022-A1105 HydrophobicContact CD2-CB 4Å; L1022-A1105 HydrophobicContact CG-CB 4.43Å; L1022-L1106 HydrophobicContact CD2-CD2 3.67Å; L1022-L1106 HydrophobicContact CD2-CG 3.76Å
1023	R	81.9	Confident	82.1	Confident	53 Å²	53	22.6 Å²	22.6	20%	0.2	12%	0.119	C	C	.	.	H	α-helix	trans	-64.3	-36.5	174.5	-103.6	-172.6	-70.7	147.3	4	113	E955 Y959 R1019 K1020 L1021 A1027 Y1284	E955-R1023 IonicContact OE1-CZ 2.68Å; E955-R1023 IonicContact OE1-NH1 3.14Å; E955-R1023 PolarHBondContact OE1-NH1 3.29Å; E955-R1023 IonicContact OE1-NH2 3.74Å; Y959-R1023 HydrophobicContact CE2-CB 4.26Å; Y959-R1023 WeakPolarHBondContact OH-CB 3.33Å; Y959-R1023 WeakPolarHBondContact OH-CD 3.38Å; Y959-R1023 WeakPolarHBondContact OH-CG 3.42Å; Y959-R1023 PolarHBondContact OH-O 3.46Å; Y959-R1023 VanDerWaalsContact OH-O 3.1Å; R1019-R1023 WeakPolarHBondContact O-CB 3.49Å; R1019-R1023 WeakPolarHBondContact O-CG 3.43Å; R1019-R1023 PolarHBondContact O-N 3.21Å; R1019-R1023 VanDerWaalsContact O-N 3.14Å; R1019-R1023 PolarHBondContact O-NE 2.93Å; K1020-R1023 VanDerWaalsContact CG-NH2 3.27Å; K1020-R1023 VanDerWaalsContact O-CB 3.25Å; K1020-R1023 WeakPolarHBondContact O-CB 3.4Å; K1020-R1023 PolarHBondContact O-N 2.83Å; L1021-R1023 PolarHBondContact O-N 3.44Å; R1023-A1027 WeakPolarHBondContact O-CB 3.46Å; R1023-A1027 PolarHBondContact O-N 3.45Å; R1023-A1027 VanDerWaalsContact O-N 3.12Å; R1023-Y1284 PolarHBondContact NH1-OH 3.4Å
1024	L	84.4	Confident	82.4	Confident	3 Å²	3	23.2 Å²	23.2	2%	0.016	12%	0.119	C	C	.	.	H	α-helix	trans	-67.1	-48.1	173.3	-160.2	85.6	0	0	0	110.8	L954 L958 L990 K1020 L1021 L1022 A1026 A1027 I1028	L954-L1024 HydrophobicContact CB-CD1 4.35Å; L954-L1024 HydrophobicContact CB-CD2 4.18Å; L954-L1024 HydrophobicContact CD1-CD2 4.34Å; L958-L1024 HydrophobicContact CB-CD1 3.93Å; L958-L1024 HydrophobicContact CD1-CD1 3.69Å; L958-L1024 HydrophobicContact CD1-CD2 4.34Å; L958-L1024 HydrophobicContact CD1-CG 4.21Å; L958-L1024 HydrophobicContact CG-CD1 4.41Å; L990-L1024 HydrophobicContact CD1-CD2 3.88Å; K1020-L1024 PolarHBondContact O-N 3.14Å; L1021-L1024 WeakPolarHBondContact O-CA 3.37Å; L1021-L1024 VanDerWaalsContact O-CB 3.24Å; L1021-L1024 WeakPolarHBondContact O-CB 3.45Å; L1021-L1024 PolarHBondContact O-N 3.32Å; L1022-L1024 VanDerWaalsContact C-N 3.34Å; L1024-A1026 PolarHBondContact O-N 3.41Å; L1024-A1027 WeakPolarHBondContact O-CB 3.35Å; L1024-A1027 PolarHBondContact O-N 3.11Å; L1024-I1028 PolarHBondContact O-N 3.17Å; L1024-I1028 VanDerWaalsContact O-N 3.15Å
1025	F	87.2	Confident	81.9	Confident	5 Å²	5	25.7 Å²	25.7	2%	0.022	14%	0.137	C	C	.	.	H	α-helix	trans	-58.2	-47.8	178.4	-169	-96.7	0	0	0	111.3	L987 L990 I991 L1021 L1022 A1027 I1028 I1029 L1106 H1109	L987-F1025 HydrophobicContact CB-CE2 4.06Å; L987-F1025 HydrophobicContact CD2-CD2 3.48Å; L987-F1025 VanDerWaalsContact CD2-CD2 3.48Å; L987-F1025 HydrophobicContact CD2-CE2 3.63Å; L987-F1025 HydrophobicContact CD2-CG 4.11Å; L987-F1025 HydrophobicContact CD2-CZ 4.38Å; L987-F1025 HydrophobicContact CG-CE2 4.44Å; L990-F1025 HydrophobicContact CB-CD2 4.38Å; I991-F1025 HydrophobicContact CD1-CE2 4.1Å; I991-F1025 HydrophobicContact CD1-CZ 4.09Å; I991-F1025 HydrophobicContact CG1-CE2 3.61Å; I991-F1025 HydrophobicContact CG1-CZ 3.92Å; L1021-F1025 PolarHBondContact O-N 2.97Å; L1022-F1025 PolarHBondContact O-N 3.44Å; F1025-A1027 PolarHBondContact O-N 3.41Å; F1025-I1028 PolarHBondContact O-N 3.49Å; F1025-I1029 HydrophobicContact CD1-CD1 3.58Å; F1025-I1029 HydrophobicContact CE1-CD1 3.14Å; F1025-I1029 HydrophobicContact CE1-CG1 4.37Å; F1025-I1029 HydrophobicContact CE2-CD1 4.47Å; F1025-I1029 HydrophobicContact CG-CD1 4.42Å; F1025-I1029 HydrophobicContact CZ-CD1 3.65Å; F1025-I1029 WeakPolarHBondContact O-CG1 3.23Å; F1025-I1029 PolarHBondContact O-N 3.41Å; F1025-I1029 VanDerWaalsContact O-N 3.11Å; F1025-L1106 HydrophobicContact CD1-CD2 3.85Å; F1025-L1106 HydrophobicContact CD2-CD2 4.41Å; F1025-L1106 HydrophobicContact CE1-CD2 3.89Å; F1025-L1106 HydrophobicContact CE2-CD2 4.48Å; F1025-L1106 HydrophobicContact CG-CD2 4.12Å; F1025-L1106 HydrophobicContact CZ-CD2 4.22Å; F1025-H1109 AromaticContact CD1-CD2 3.82Å; F1025-H1109 HydrophobicContact CE1-CB 4.41Å
1026	A	83.6	Confident	80.7	Confident	16 Å²	16	30.5 Å²	30.5	13%	0.132	16%	0.163	C	C	.	.	H	α-helix	trans	-60.9	-42.2	175.7	0	0	0	0	0	112.6	L1022 L1024 I1028 I1029 L1030	L1022-A1026 WeakPolarHBondContact O-CB 3.35Å; L1022-A1026 PolarHBondContact O-N 3.43Å; L1024-A1026 PolarHBondContact O-N 3.41Å; A1026-I1028 PolarHBondContact O-N 2.85Å; A1026-I1029 PolarHBondContact O-N 2.74Å; A1026-L1030 VanDerWaalsContact O-CB 3.31Å; A1026-L1030 WeakPolarHBondContact O-CB 3.14Å; A1026-L1030 WeakPolarHBondContact O-CG 3.41Å; A1026-L1030 PolarHBondContact O-N 3.21Å
1027	A	82.1	Confident	79.4	Confident	7 Å²	7	32.8 Å²	32.8	6%	0.058	17%	0.169	C	C	.	.	H	α-helix	trans	-61.3	-42.7	-179.4	0	0	0	0	0	112.4	L962 R1023 L1024 F1025 A1031	L962-A1027 HydrophobicContact CB-CB 4.21Å; L962-A1027 WeakPolarHBondContact O-CB 3.22Å; R1023-A1027 WeakPolarHBondContact O-CB 3.46Å; R1023-A1027 PolarHBondContact O-N 3.45Å; R1023-A1027 VanDerWaalsContact O-N 3.12Å; L1024-A1027 WeakPolarHBondContact O-CB 3.35Å; L1024-A1027 PolarHBondContact O-N 3.11Å; F1025-A1027 PolarHBondContact O-N 3.41Å; A1027-A1031 WeakPolarHBondContact O-CB 3.05Å; A1027-A1031 PolarHBondContact O-N 2.79Å
1028	I	86.3	Confident	77.3	Confident	2 Å²	2	38 Å²	38	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-68.5	-46.4	177.8	-60.8	168.1	0	0	0	110.4	L962 L983 I986 L987 L990 L1024 F1025 A1026 L1030 A1031 L1032	L962-I1028 HydrophobicContact CD1-CG1 4.29Å; L983-I1028 HydrophobicContact CB-CD1 4.29Å; L983-I1028 HydrophobicContact CB-CG1 4.42Å; L983-I1028 HydrophobicContact CB-CG2 4.34Å; I986-I1028 HydrophobicContact CG2-CD1 3.87Å; L987-I1028 HydrophobicContact CD1-CG2 3.93Å; L987-I1028 HydrophobicContact CD2-CB 3.96Å; L987-I1028 HydrophobicContact CD2-CD1 4.23Å; L987-I1028 HydrophobicContact CD2-CG2 3.93Å; L987-I1028 HydrophobicContact CG-CG2 3.94Å; L990-I1028 HydrophobicContact CD1-CD1 4.47Å; L1024-I1028 PolarHBondContact O-N 3.17Å; L1024-I1028 VanDerWaalsContact O-N 3.15Å; F1025-I1028 PolarHBondContact O-N 3.49Å; A1026-I1028 PolarHBondContact O-N 2.85Å; I1028-L1030 PolarHBondContact O-N 2.75Å; I1028-A1031 WeakPolarHBondContact O-CB 3.3Å; I1028-A1031 PolarHBondContact O-N 3.35Å; I1028-A1031 VanDerWaalsContact O-N 3.15Å; I1028-L1032 PolarHBondContact O-N 3.02Å
1029	I	85	Confident	75	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-40	-179.7	-71	179.8	0	0	0	112.4	L987 F1025 A1026 A1031 L1032 H1109 R1112 L1113 I1116	L987-I1029 HydrophobicContact CD1-CG1 3.88Å; L987-I1029 HydrophobicContact CD2-CG1 4.16Å; F1025-I1029 HydrophobicContact CD1-CD1 3.58Å; F1025-I1029 HydrophobicContact CE1-CD1 3.14Å; F1025-I1029 HydrophobicContact CE1-CG1 4.37Å; F1025-I1029 HydrophobicContact CE2-CD1 4.47Å; F1025-I1029 HydrophobicContact CG-CD1 4.42Å; F1025-I1029 HydrophobicContact CZ-CD1 3.65Å; F1025-I1029 WeakPolarHBondContact O-CG1 3.23Å; F1025-I1029 PolarHBondContact O-N 3.41Å; F1025-I1029 VanDerWaalsContact O-N 3.11Å; A1026-I1029 PolarHBondContact O-N 2.74Å; I1029-A1031 PolarHBondContact O-N 2.97Å; I1029-L1032 PolarHBondContact O-N 3.34Å; I1029-H1109 HydrophobicContact CD1-CB 3.78Å; I1029-H1109 HydrophobicContact CG2-CB 4.47Å; I1029-R1112 HydrophobicContact CG2-CB 4.19Å; I1029-R1112 HydrophobicContact CG2-CG 3.51Å; I1029-L1113 HydrophobicContact CD1-CD1 4.28Å; I1029-L1113 HydrophobicContact CD1-CD2 3.95Å; I1029-L1113 HydrophobicContact CD1-CG 4.22Å; I1029-L1113 HydrophobicContact CG1-CD2 4.21Å; I1029-L1113 HydrophobicContact CG2-CD2 4.49Å; I1029-I1116 HydrophobicContact CG2-CD1 4.43Å
1030	L	81.8	Confident	72.8	Confident	75 Å²	75	51.2 Å²	51.2	39%	0.393	27%	0.265	S	S	.	.	H	α-helix	trans	-68.9	-22.6	179.1	-71.8	172.1	0	0	0	112.5	A1026 I1028	A1026-L1030 VanDerWaalsContact O-CB 3.31Å; A1026-L1030 WeakPolarHBondContact O-CB 3.14Å; A1026-L1030 WeakPolarHBondContact O-CG 3.41Å; A1026-L1030 PolarHBondContact O-N 3.21Å; I1028-L1030 PolarHBondContact O-N 2.75Å
1031	A	81.4	Confident	70.6	Confident	9 Å²	9	53.9 Å²	53.9	7%	0.074	29%	0.287	C	S	.	.	H	α-helix	trans	-78.5	-18.7	176.2	0	0	0	0	0	113.3	L962 R976 I977 A1027 I1028 I1029	L962-A1031 HydrophobicContact CD2-CB 3.83Å; R976-A1031 WeakPolarHBondContact O-CB 3.49Å; I977-A1031 WeakPolarHBondContact CA-O 3.36Å; A1027-A1031 WeakPolarHBondContact O-CB 3.05Å; A1027-A1031 PolarHBondContact O-N 2.79Å; I1028-A1031 WeakPolarHBondContact O-CB 3.3Å; I1028-A1031 PolarHBondContact O-N 3.35Å; I1028-A1031 VanDerWaalsContact O-N 3.15Å; I1029-A1031 PolarHBondContact O-N 2.97Å
1032	L	84.3	Confident	68.3	Low	4 Å²	4	61.1 Å²	61.1	2%	0.021	32%	0.319	C	S	.	.	S	Bend	trans	-71.2	142	-177.3	-71.7	174.9	0	0	0	113.5	L981 L987 I1028 I1029 L1067 R1112 I1116	L981-L1032 HydrophobicContact CD2-CD2 4.01Å; L981-L1032 HydrophobicContact CG-CD2 4.46Å; L987-L1032 HydrophobicContact CD1-CD1 4.38Å; I1028-L1032 PolarHBondContact O-N 3.02Å; I1029-L1032 PolarHBondContact O-N 3.34Å; L1032-L1067 HydrophobicContact CD1-CD2 4.33Å; L1032-L1067 HydrophobicContact CD2-CD2 3.74Å; L1032-R1112 PolarHBondContact O-NH2 2.82Å; L1032-I1116 HydrophobicContact CB-CD1 3.6Å; L1032-I1116 HydrophobicContact CB-CG1 4.16Å; L1032-I1116 HydrophobicContact CD1-CD1 3.88Å; L1032-I1116 HydrophobicContact CG-CD1 4.39Å
1033	P	80	Confident	65.7	Low	48 Å²	48	66.6 Å²	66.6	31%	0.312	35%	0.348	S	S	.	.			trans	-70.5	152.5	178.7	29.8	-33	0	0	0	111.8	I977 L981 L1067	I977-P1033 HydrophobicContact CG2-CB 4.45Å; I977-P1033 HydrophobicContact CG2-CG 4.32Å; L981-P1033 HydrophobicContact CD2-CG 4.18Å; P1033-L1067 HydrophobicContact CG-CD1 4.21Å
1034	I	77.2	Confident	63.5	Low	36 Å²	36	72.8 Å²	72.8	19%	0.185	38%	0.379	C	S	.	.			trans	-106.1	136.8	-179.7	-49.4	164.8	0	0	0	108.6	N1036 K1037 R1112 Q1115	I1034-N1036 PolarHBondContact O-N 2.83Å; I1034-K1037 HydrophobicContact CD1-CD 4.31Å; I1034-K1037 HydrophobicContact CD1-CG 4.46Å; I1034-K1037 PolarHBondContact O-N 3.36Å; I1034-R1112 VanDerWaalsContact CG1-CZ 3.44Å; I1034-R1112 VanDerWaalsContact CG1-NH2 3.3Å; I1034-Q1115 HydrophobicContact CG2-CB 3.94Å
1035	T	66.5	Low	61.1	Low	76 Å²	76	77 Å²	77	47%	0.466	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-29.6	-180	45.4	0	0	0	0	114.7	Q1115 I1116 P1118	T1035-Q1115 PolarHBondContact N-O 3.35Å; T1035-Q1115 PolarHBondContact OG1-O 3.43Å; T1035-I1116 VanDerWaalsContact CG2-O 3.27Å; T1035-I1116 WeakPolarHBondContact CG2-O 3.28Å; T1035-P1118 HydrophobicContact CG2-CG 4.25Å
1036	N	51	Low	58.6	Low	134 Å²	134	83.3 Å²	83.3	72%	0.717	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	11.1	-173.5	-70.7	-16.7	0	0	0	115.5	I1034 P1038	I1034-N1036 PolarHBondContact O-N 2.83Å; N1036-P1038 WeakPolarHBondContact O-CD 3.46Å
1037	K	51.5	Low	56.5	Low	120 Å²	120	87 Å²	87	52%	0.522	48%	0.479	S	S	.	.			trans	-78.6	118.7	172	-89.2	-178.3	170.5	-177.3	0	108.6	I1034 E1039 F1040	I1034-K1037 HydrophobicContact CD1-CD 4.31Å; I1034-K1037 HydrophobicContact CD1-CG 4.46Å; I1034-K1037 PolarHBondContact O-N 3.36Å; K1037-E1039 PolarHBondContact O-N 2.92Å; K1037-F1040 HydrophobicContact CD-CE2 4.05Å
1038	P	36.1	Very low	54.5	Low	111 Å²	111	91.5 Å²	91.5	72%	0.721	50%	0.5	S	S	*	.			trans	-57.2	139.4	166.2	27.6	-31	0	0	0	106.1	N1036 F1040	N1036-P1038 WeakPolarHBondContact O-CD 3.46Å; P1038-F1040 PolarHBondContact O-N 3.42Å
1039	E	36.6	Very low	52.6	Low	154 Å²	154	101.1 Å²	101.1	72%	0.72	54%	0.542	S	S	*	.			trans	-33.5	113.8	172.2	-65.7	-176	168.5	0	0	107.9	K1037 S1041 K1042	K1037-E1039 PolarHBondContact O-N 2.92Å; E1039-S1041 PolarHBondContact O-N 3.1Å; E1039-K1042 IonicContact OE2-NZ 2.83Å
1040	F	36.6	Very low	51	Low	166 Å²	166	106.8 Å²	106.8	73%	0.728	57%	0.572	S	S	*	*			trans	-49.1	115.7	171.6	-105.2	-91.7	0	0	0	104.7	K1037 P1038 K1042	K1037-F1040 HydrophobicContact CD-CE2 4.05Å; P1038-F1040 PolarHBondContact O-N 3.42Å; F1040-K1042 PolarHBondContact O-N 3.45Å
1041	S	36.4	Very low	50.3	Low	88 Å²	88	104.5 Å²	104.5	62%	0.615	56%	0.56	S	S	*	*			trans	-40.6	122	-176.9	49	0	0	0	0	107.9	E1039 N1043	E1039-S1041 PolarHBondContact O-N 3.1Å; S1041-N1043 PolarHBondContact O-N 3.11Å
1042	K	38.8	Very low	50	Low	157 Å²	157	107.3 Å²	107.3	68%	0.683	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	17.4	178.1	-77.1	170	172	152.9	0	114.5	E1039 F1040 S1045	E1039-K1042 IonicContact OE2-NZ 2.83Å; F1040-K1042 PolarHBondContact O-N 3.45Å; K1042-S1045 PolarHBondContact O-OG 3.49Å
1043	N	32.2	Very low	49.6	Very low	135 Å²	135	108.3 Å²	108.3	72%	0.722	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	10.3	-163.6	-68.4	-1.2	0	0	0	114.8	S1041	S1041-N1043 PolarHBondContact O-N 3.11Å
1044	E	34.5	Very low	49.6	Very low	182 Å²	182	106.8 Å²	106.8	85%	0.85	58%	0.578	S	S	*	*	S	Bend	trans	-123.8	16	166.4	-75.1	-172.1	163.5	0	0	113.5	T1046	E1044-T1046 PolarHBondContact O-N 3.23Å
1045	S	34.1	Very low	49.8	Very low	91 Å²	91	111.2 Å²	111.2	64%	0.636	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-78.1	7.9	177.5	61.1	0	0	0	0	114.6	K1042 A1047	K1042-S1045 PolarHBondContact O-OG 3.49Å; S1045-A1047 PolarHBondContact O-N 2.69Å
1046	T	34.8	Very low	50.6	Low	139 Å²	139	111.8 Å²	111.8	85%	0.853	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-78.9	5.8	-173.8	48.1	0	0	0	0	115.2	E1044	E1044-T1046 PolarHBondContact O-N 3.23Å
1047	A	39.3	Very low	52.1	Low	94 Å²	94	105.5 Å²	105.5	78%	0.777	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-117.7	-12	-175.9	0	0	0	0	0	116.8	S1045	S1045-A1047 PolarHBondContact O-N 2.69Å
1048	M	39.8	Very low	53.6	Low	100 Å²	100	100.7 Å²	100.7	49%	0.493	54%	0.542	S	S	.	.			trans	-115.2	101.5	174.8	-88.9	-156.8	156	0	0	111.9	E782 D1050	E782-M1048 WeakPolarHBondContact OE1-CE 3.29Å; M1048-D1050 PolarHBondContact O-N 3.47Å; M1048-D1050 VanDerWaalsContact O-N 3.13Å
1049	K	46.2	Very low	55.9	Low	204 Å²	204	97.9 Å²	97.9	89%	0.887	53%	0.525	S	S	*	.			trans	-55.2	112.1	160.9	-79.3	177.7	173	176.5	0	109.3	N1051	K1049-N1051 PolarHBondContact O-N 3.33Å
1050	D	51.9	Low	58.1	Low	119 Å²	119	92 Å²	92	64%	0.636	50%	0.498	S	S	*	.			trans	32	79.9	152.2	-64.6	-41.1	0	0	0	119	M1048 A1052 K1055	M1048-D1050 PolarHBondContact O-N 3.47Å; M1048-D1050 VanDerWaalsContact O-N 3.13Å; D1050-A1052 VanDerWaalsContact C-N 3.31Å; D1050-A1052 PolarHBondContact O-N 2.74Å; D1050-K1055 IonicContact OD1-NZ 3.89Å; D1050-K1055 PolarHBondContact OD1-NZ 3.02Å
1051	N	67.2	Low	60.2	Low	28 Å²	28	84.1 Å²	84.1	15%	0.15	46%	0.463	C	S	.	.			trans	-85.1	77.1	157.5	-125.9	-12.9	0	0	0	109.3	H850 S853 K1049 L1053 L1054 K1055	H850-N1051 PolarHBondContact O-ND2 3.18Å; S853-N1051 VanDerWaalsContact CB-OD1 3.26Å; S853-N1051 WeakPolarHBondContact CB-OD1 3.4Å; S853-N1051 VanDerWaalsContact OG-CG 3.27Å; S853-N1051 PolarHBondContact OG-ND2 3.38Å; S853-N1051 PolarHBondContact OG-OD1 3.12Å; K1049-N1051 PolarHBondContact O-N 3.33Å; N1051-L1053 VanDerWaalsContact C-N 3.3Å; N1051-L1053 PolarHBondContact O-N 3.34Å; N1051-L1054 HydrophobicContact CB-CB 4.21Å; N1051-L1054 PolarHBondContact O-N 3.43Å; N1051-L1054 VanDerWaalsContact O-N 3.16Å; N1051-K1055 PolarHBondContact O-N 3.26Å
1052	A	74.8	Confident	62.3	Low	67 Å²	67	86 Å²	86	55%	0.554	46%	0.463	S	S	*	.	H	α-helix	trans	-55	-42	-174.4	0	0	0	0	0	113	D1050 L1054 K1055 E1056	D1050-A1052 VanDerWaalsContact C-N 3.31Å; D1050-A1052 PolarHBondContact O-N 2.74Å; A1052-L1054 PolarHBondContact O-N 3.27Å; A1052-K1055 WeakPolarHBondContact O-CB 3.45Å; A1052-K1055 PolarHBondContact O-N 3.35Å; A1052-E1056 PolarHBondContact O-N 2.98Å
1053	L	76.3	Confident	64.4	Low	25 Å²	25	86.4 Å²	86.4	13%	0.131	47%	0.467	C	S	.	.	H	α-helix	trans	-60.9	-39	177.8	-79.4	170.6	0	0	0	113.4	V849 L882 N1051 E1056 L1057	V849-L1053 HydrophobicContact CG1-CB 4.39Å; L882-L1053 HydrophobicContact CB-CD1 4.42Å; L882-L1053 WeakPolarHBondContact O-CD2 3.33Å; N1051-L1053 VanDerWaalsContact C-N 3.3Å; N1051-L1053 PolarHBondContact O-N 3.34Å; L1053-E1056 PolarHBondContact O-N 3.31Å; L1053-L1057 WeakPolarHBondContact O-CB 3.2Å; L1053-L1057 PolarHBondContact O-N 3.39Å
1054	L	79.7	Confident	66.6	Low	17 Å²	17	82.5 Å²	82.5	9%	0.089	45%	0.45	C	S	.	.	H	α-helix	trans	-68.5	-38.4	177.6	-175.2	69	0	0	0	111	H850 D974 V975 T978 N1051 A1052 E1056 L1057 A1058	H850-L1054 HydrophobicContact CB-CD1 4.31Å; D974-L1054 HydrophobicContact CB-CD2 4.4Å; V975-L1054 HydrophobicContact CG2-CD1 4.15Å; V975-L1054 HydrophobicContact CG2-CD2 3.54Å; T978-L1054 HydrophobicContact CG2-CD1 4.37Å; N1051-L1054 HydrophobicContact CB-CB 4.21Å; N1051-L1054 PolarHBondContact O-N 3.43Å; N1051-L1054 VanDerWaalsContact O-N 3.16Å; A1052-L1054 PolarHBondContact O-N 3.27Å; L1054-E1056 VanDerWaalsContact C-N 3.33Å; L1054-L1057 PolarHBondContact O-N 3.14Å; L1054-A1058 VanDerWaalsContact O-CB 3.27Å; L1054-A1058 WeakPolarHBondContact O-CB 3.26Å; L1054-A1058 PolarHBondContact O-N 3.38Å
1055	K	81.4	Confident	68.7	Low	128 Å²	128	74.9 Å²	74.9	56%	0.557	42%	0.416	S	S	*	.	H	α-helix	trans	-63.8	-40.9	175.6	-69.3	177.7	179.7	171.2	0	111	D1050 N1051 A1052 A1058 S1059	D1050-K1055 IonicContact OD1-NZ 3.89Å; D1050-K1055 PolarHBondContact OD1-NZ 3.02Å; N1051-K1055 PolarHBondContact O-N 3.26Å; A1052-K1055 WeakPolarHBondContact O-CB 3.45Å; A1052-K1055 PolarHBondContact O-N 3.35Å; K1055-A1058 PolarHBondContact O-N 2.93Å; K1055-S1059 PolarHBondContact O-N 2.87Å
1056	E	83.4	Confident	71.1	Confident	88 Å²	88	76.9 Å²	76.9	41%	0.411	42%	0.415	S	S	.	.	H	α-helix	trans	-64.7	-48.9	176.7	-169	173.9	-177.1	0	0	111.6	A884 A1052 L1053 L1054 A1058 S1059 I1060	A884-E1056 HydrophobicContact CB-CB 4.34Å; A884-E1056 HydrophobicContact CB-CG 3.94Å; A1052-E1056 PolarHBondContact O-N 2.98Å; L1053-E1056 PolarHBondContact O-N 3.31Å; L1054-E1056 VanDerWaalsContact C-N 3.33Å; E1056-A1058 VanDerWaalsContact C-N 3.33Å; E1056-A1058 PolarHBondContact O-N 2.75Å; E1056-S1059 WeakPolarHBondContact O-CB 3.2Å; E1056-S1059 PolarHBondContact O-N 3.07Å; E1056-S1059 VanDerWaalsContact O-N 3.07Å; E1056-S1059 PolarHBondContact O-OG 3.27Å; E1056-I1060 HydrophobicContact CG-CD1 4.14Å; E1056-I1060 WeakPolarHBondContact O-CG1 3.5Å; E1056-I1060 PolarHBondContact O-N 3.11Å
1057	L	82.6	Confident	73.5	Confident	3 Å²	3	71.9 Å²	71.9	2%	0.016	38%	0.383	C	S	.	.	H	α-helix	trans	-57.9	-42.8	173.6	-104.2	146.6	0	0	0	112.8	V849 A884 V888 T978 I982 L1053 L1054 S1059 I1060 A1061	V849-L1057 HydrophobicContact CB-CD1 4.17Å; V849-L1057 HydrophobicContact CG1-CD1 3.45Å; V849-L1057 VanDerWaalsContact CG1-CD1 3.45Å; V849-L1057 HydrophobicContact CG2-CD1 4.22Å; A884-L1057 HydrophobicContact CB-CD1 4.41Å; A884-L1057 HydrophobicContact CB-CG 3.97Å; V888-L1057 HydrophobicContact CG2-CD2 3.69Å; T978-L1057 HydrophobicContact CG2-CB 3.99Å; I982-L1057 HydrophobicContact CD1-CD2 3.27Å; L1053-L1057 WeakPolarHBondContact O-CB 3.2Å; L1053-L1057 PolarHBondContact O-N 3.39Å; L1054-L1057 PolarHBondContact O-N 3.14Å; L1057-S1059 VanDerWaalsContact C-N 3.29Å; L1057-S1059 PolarHBondContact O-N 3.41Å; L1057-I1060 PolarHBondContact O-N 2.75Å; L1057-A1061 VanDerWaalsContact O-CB 3.23Å; L1057-A1061 WeakPolarHBondContact O-CB 3.31Å; L1057-A1061 PolarHBondContact O-N 2.95Å
1058	A	82.3	Confident	75.6	Confident	19 Å²	19	71.1 Å²	71.1	16%	0.157	36%	0.363	C	S	.	.	H	α-helix	trans	-61.4	-41.2	175.5	0	0	0	0	0	111	T978 L1054 K1055 E1056 A1061 Q1062	T978-A1058 HydrophobicContact CG2-CB 4.31Å; T978-A1058 WeakPolarHBondContact OG1-CB 3.3Å; L1054-A1058 VanDerWaalsContact O-CB 3.27Å; L1054-A1058 WeakPolarHBondContact O-CB 3.26Å; L1054-A1058 PolarHBondContact O-N 3.38Å; K1055-A1058 PolarHBondContact O-N 2.93Å; E1056-A1058 VanDerWaalsContact C-N 3.33Å; E1056-A1058 PolarHBondContact O-N 2.75Å; A1058-A1061 PolarHBondContact O-N 3.36Å; A1058-Q1062 WeakPolarHBondContact O-CB 3.18Å; A1058-Q1062 VanDerWaalsContact O-CG 3.26Å; A1058-Q1062 WeakPolarHBondContact O-CG 3.28Å; A1058-Q1062 PolarHBondContact O-N 3.12Å
1059	S	84.6	Confident	77.9	Confident	51 Å²	51	70.1 Å²	70.1	36%	0.357	36%	0.363	S	S	.	.	H	α-helix	trans	-63.7	-46.8	176.5	83.5	0	0	0	0	111.5	K1055 E1056 L1057 A1061 Q1062 H1063	K1055-S1059 PolarHBondContact O-N 2.87Å; E1056-S1059 WeakPolarHBondContact O-CB 3.2Å; E1056-S1059 PolarHBondContact O-N 3.07Å; E1056-S1059 VanDerWaalsContact O-N 3.07Å; E1056-S1059 PolarHBondContact O-OG 3.27Å; L1057-S1059 VanDerWaalsContact C-N 3.29Å; L1057-S1059 PolarHBondContact O-N 3.41Å; S1059-A1061 VanDerWaalsContact C-N 3.34Å; S1059-A1061 PolarHBondContact O-N 3.22Å; S1059-Q1062 PolarHBondContact O-N 3.33Å; S1059-H1063 PolarHBondContact O-N 3.17Å; S1059-H1063 VanDerWaalsContact O-N 3.17Å; S1059-H1063 PolarHBondContact O-ND1 3.18Å
1060	I	83.9	Confident	79.9	Confident	31 Å²	31	61.3 Å²	61.3	16%	0.159	33%	0.326	C	S	.	.	H	α-helix	trans	-64.1	-42.7	179.7	-64.4	160.3	0	0	0	110.2	A884 N885 V888 E1056 L1057 Q1062 H1063 S1064	A884-I1060 HydrophobicContact CB-CD1 3.61Å; N885-I1060 WeakPolarHBondContact OD1-CD1 3.28Å; V888-I1060 HydrophobicContact CB-CG2 4.31Å; V888-I1060 HydrophobicContact CG1-CG2 4.11Å; V888-I1060 HydrophobicContact CG2-CG2 3.95Å; E1056-I1060 HydrophobicContact CG-CD1 4.14Å; E1056-I1060 WeakPolarHBondContact O-CG1 3.5Å; E1056-I1060 PolarHBondContact O-N 3.11Å; L1057-I1060 PolarHBondContact O-N 2.75Å; I1060-Q1062 VanDerWaalsContact C-N 3.35Å; I1060-Q1062 PolarHBondContact O-N 3.2Å; I1060-H1063 PolarHBondContact O-N 3.06Å; I1060-S1064 VanDerWaalsContact O-CB 3.28Å; I1060-S1064 WeakPolarHBondContact O-CB 3.46Å; I1060-S1064 PolarHBondContact O-N 3.05Å; I1060-S1064 PolarHBondContact O-OG 2.81Å
1061	A	80.6	Confident	81.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.8	-41	178.5	0	0	0	0	0	112.2	L981 I982 L1057 A1058 S1059 V1065	L981-A1061 HydrophobicContact CB-CB 4.01Å; L981-A1061 HydrophobicContact CD1-CB 4.41Å; I982-A1061 HydrophobicContact CD1-CB 4.31Å; I982-A1061 HydrophobicContact CG1-CB 3.66Å; L1057-A1061 VanDerWaalsContact O-CB 3.23Å; L1057-A1061 WeakPolarHBondContact O-CB 3.31Å; L1057-A1061 PolarHBondContact O-N 2.95Å; A1058-A1061 PolarHBondContact O-N 3.36Å; S1059-A1061 VanDerWaalsContact C-N 3.34Å; S1059-A1061 PolarHBondContact O-N 3.22Å; A1061-V1065 PolarHBondContact O-N 3.15Å
1062	Q	80.9	Confident	82.6	Confident	128 Å²	128	56.9 Å²	56.9	60%	0.598	31%	0.306	S	S	*	.	H	α-helix	trans	-66.9	-33.9	178	-75.7	173.9	5.6	0	0	113.1	L981 A1058 S1059 I1060	L981-Q1062 HydrophobicContact CD1-CG 4.2Å; A1058-Q1062 WeakPolarHBondContact O-CB 3.18Å; A1058-Q1062 VanDerWaalsContact O-CG 3.26Å; A1058-Q1062 WeakPolarHBondContact O-CG 3.28Å; A1058-Q1062 PolarHBondContact O-N 3.12Å; S1059-Q1062 PolarHBondContact O-N 3.33Å; I1060-Q1062 VanDerWaalsContact C-N 3.35Å; I1060-Q1062 PolarHBondContact O-N 3.2Å
1063	H	82.2	Confident	83.2	Confident	166 Å²	166	55.5 Å²	55.5	77%	0.769	30%	0.295	S	S	*	.	H	α-helix	trans	-84.5	-27.3	179.4	-68.4	85	0	0	0	113.3	S1059 I1060	S1059-H1063 PolarHBondContact O-N 3.17Å; S1059-H1063 VanDerWaalsContact O-N 3.17Å; S1059-H1063 PolarHBondContact O-ND1 3.18Å; I1060-H1063 PolarHBondContact O-N 3.06Å
1064	S	77.4	Confident	83.8	Confident	53 Å²	53	54.4 Å²	54.4	37%	0.371	29%	0.289	S	S	.	.	H	α-helix	trans	-90.7	-20.6	-173.6	57	0	0	0	0	114.5	I1060	I1060-S1064 VanDerWaalsContact O-CB 3.28Å; I1060-S1064 WeakPolarHBondContact O-CB 3.46Å; I1060-S1064 PolarHBondContact O-N 3.05Å; I1060-S1064 PolarHBondContact O-OG 2.81Å
1065	V	79.8	Confident	84.2	Confident	21 Å²	21	53.9 Å²	53.9	13%	0.127	29%	0.287	C	S	.	.			trans	-117	110.7	-172.5	-178	0	0	0	0	111.2	S984 P985 A1061 L1067 V1070	S984-V1065 WeakPolarHBondContact OG-CG1 3.28Å; P985-V1065 HydrophobicContact CG-CG1 4.33Å; P985-V1065 HydrophobicContact CG-CG2 4.19Å; A1061-V1065 PolarHBondContact O-N 3.15Å; V1065-L1067 HydrophobicContact CG1-CD2 4.44Å; V1065-L1067 PolarHBondContact O-N 2.77Å; V1065-V1070 HydrophobicContact CG1-CG2 4.08Å
1066	E	84.5	Confident	84.5	Confident	133 Å²	133	50.4 Å²	50.4	62%	0.621	28%	0.282	S	S	*	.			trans	-89.2	101.3	173	-159.4	176.8	-146.6	0	0	110	E1068 T1069 V1070	E1066-E1068 VanDerWaalsContact C-N 3.27Å; E1066-E1068 PolarHBondContact O-N 3.08Å; E1066-T1069 WeakPolarHBondContact O-CB 3.2Å; E1066-T1069 PolarHBondContact O-N 2.95Å; E1066-T1069 VanDerWaalsContact O-N 3.11Å; E1066-T1069 PolarHBondContact OE2-OG1 3.45Å; E1066-V1070 PolarHBondContact O-N 3.29Å
1067	L	84.2	Confident	84.7	Confident	35 Å²	35	48 Å²	48	18%	0.183	27%	0.271	C	S	.	.	H	α-helix	trans	-60.3	-33.3	-172.1	-73.5	169.2	0	0	0	113.5	L981 L1032 P1033 V1065 T1069 V1070 V1071 I1116	L981-L1067 HydrophobicContact CD2-CD1 4.02Å; L981-L1067 HydrophobicContact CD2-CD2 3.97Å; L981-L1067 HydrophobicContact CD2-CG 4.23Å; L1032-L1067 HydrophobicContact CD1-CD2 4.33Å; L1032-L1067 HydrophobicContact CD2-CD2 3.74Å; P1033-L1067 HydrophobicContact CG-CD1 4.21Å; V1065-L1067 HydrophobicContact CG1-CD2 4.44Å; V1065-L1067 PolarHBondContact O-N 2.77Å; L1067-T1069 VanDerWaalsContact C-N 3.31Å; L1067-T1069 PolarHBondContact O-N 3.25Å; L1067-V1070 PolarHBondContact O-N 3.02Å; L1067-V1071 WeakPolarHBondContact O-CB 3.43Å; L1067-V1071 VanDerWaalsContact O-CG2 3.26Å; L1067-V1071 WeakPolarHBondContact O-CG2 3.45Å; L1067-V1071 PolarHBondContact O-N 3.21Å; L1067-I1116 HydrophobicContact CB-CG2 4.21Å; L1067-I1116 HydrophobicContact CD1-CG2 3.99Å; L1067-I1116 HydrophobicContact CD2-CG2 4.24Å; L1067-I1116 HydrophobicContact CG-CG2 4.39Å
1068	E	84.8	Confident	85	Confident	77 Å²	77	48.2 Å²	48.2	36%	0.36	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-39.4	177.4	-60.9	-165.3	166.2	0	0	112	E1066 S1072 A1117 F1119	E1066-E1068 VanDerWaalsContact C-N 3.27Å; E1066-E1068 PolarHBondContact O-N 3.08Å; E1068-S1072 VanDerWaalsContact O-CB 3.25Å; E1068-S1072 WeakPolarHBondContact O-CB 3.33Å; E1068-S1072 PolarHBondContact O-N 3.24Å; E1068-S1072 PolarHBondContact O-OG 2.91Å; E1068-A1117 HydrophobicContact CB-CB 4.38Å; E1068-A1117 HydrophobicContact CG-CB 3.99Å; E1068-F1119 WeakPolarHBondContact OE1-CD2 3.43Å; E1068-F1119 WeakPolarHBondContact OE1-CG 3.45Å
1069	T	87.9	Confident	85.2	Confident	80 Å²	80	50 Å²	50	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-66.7	-43.1	177.6	-57.1	0	0	0	0	110.6	E1066 L1067 S1072 A1073	E1066-T1069 WeakPolarHBondContact O-CB 3.2Å; E1066-T1069 PolarHBondContact O-N 2.95Å; E1066-T1069 VanDerWaalsContact O-N 3.11Å; E1066-T1069 PolarHBondContact OE2-OG1 3.45Å; L1067-T1069 VanDerWaalsContact C-N 3.31Å; L1067-T1069 PolarHBondContact O-N 3.25Å; T1069-S1072 PolarHBondContact O-N 3.08Å; T1069-A1073 WeakPolarHBondContact O-CB 3.44Å; T1069-A1073 PolarHBondContact O-N 2.87Å
1070	V	87.5	Confident	85.3	Confident	19 Å²	19	50.4 Å²	50.4	12%	0.115	28%	0.275	C	S	.	.	H	α-helix	trans	-63.9	-46.3	176.1	177.5	0	0	0	0	111.7	S984 V1065 E1066 L1067 A1073 C1074	S984-V1070 VanDerWaalsContact O-CG1 3.31Å; S984-V1070 WeakPolarHBondContact O-CG1 3.19Å; V1065-V1070 HydrophobicContact CG1-CG2 4.08Å; E1066-V1070 PolarHBondContact O-N 3.29Å; L1067-V1070 PolarHBondContact O-N 3.02Å; V1070-A1073 PolarHBondContact O-N 3Å; V1070-C1074 PolarHBondContact O-N 3.29Å; V1070-C1074 PolarHBondContact O-SG 3.25Å
1071	V	88.1	Confident	85.4	Confident	2 Å²	2	49 Å²	49	1%	0.012	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-42.4	179.7	172.8	0	0	0	0	110.9	L1067 A1073 C1074 F1075 L1113 I1116 A1117 A1120	L1067-V1071 WeakPolarHBondContact O-CB 3.43Å; L1067-V1071 VanDerWaalsContact O-CG2 3.26Å; L1067-V1071 WeakPolarHBondContact O-CG2 3.45Å; L1067-V1071 PolarHBondContact O-N 3.21Å; V1071-A1073 VanDerWaalsContact C-N 3.33Å; V1071-A1073 PolarHBondContact O-N 2.8Å; V1071-C1074 WeakPolarHBondContact O-CB 3.24Å; V1071-C1074 PolarHBondContact O-N 3.08Å; V1071-F1075 HydrophobicContact CG1-CD1 4.44Å; V1071-F1075 HydrophobicContact CG1-CD2 4.27Å; V1071-F1075 HydrophobicContact CG1-CE1 3.86Å; V1071-F1075 HydrophobicContact CG1-CE2 3.7Å; V1071-F1075 HydrophobicContact CG1-CZ 3.46Å; V1071-F1075 VanDerWaalsContact CG1-CZ 3.46Å; V1071-F1075 WeakPolarHBondContact O-CG 3.47Å; V1071-F1075 PolarHBondContact O-N 3.09Å; V1071-L1113 HydrophobicContact CG1-CB 3.93Å; V1071-L1113 HydrophobicContact CG2-CD2 3.99Å; V1071-I1116 HydrophobicContact CG2-CG2 4.47Å; V1071-A1117 HydrophobicContact CB-CB 3.81Å; V1071-A1117 HydrophobicContact CG1-CB 4.07Å; V1071-A1117 HydrophobicContact CG2-CB 3.77Å; V1071-A1120 HydrophobicContact CB-CB 4.32Å; V1071-A1120 HydrophobicContact CG1-CB 3.66Å
1072	S	87.1	Confident	85.5	Confident	51 Å²	51	49.1 Å²	49.1	36%	0.357	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-39.2	176.5	-59.8	0	0	0	0	111.9	E1068 T1069 F1075 A1076	E1068-S1072 VanDerWaalsContact O-CB 3.25Å; E1068-S1072 WeakPolarHBondContact O-CB 3.33Å; E1068-S1072 PolarHBondContact O-N 3.24Å; E1068-S1072 PolarHBondContact O-OG 2.91Å; T1069-S1072 PolarHBondContact O-N 3.08Å; S1072-F1075 PolarHBondContact O-N 2.91Å; S1072-A1076 PolarHBondContact O-N 2.98Å
1073	A	88	Confident	85.7	Confident	38 Å²	38	44.7 Å²	44.7	31%	0.314	25%	0.252	S	S	.	.	H	α-helix	trans	-64.9	-39.8	173.7	0	0	0	0	0	112.4	P988 T1069 V1070 V1071 F1075 A1076 Q1077	P988-A1073 HydrophobicContact CB-CB 4.12Å; P988-A1073 HydrophobicContact CG-CB 3.77Å; T1069-A1073 WeakPolarHBondContact O-CB 3.44Å; T1069-A1073 PolarHBondContact O-N 2.87Å; V1070-A1073 PolarHBondContact O-N 3Å; V1071-A1073 VanDerWaalsContact C-N 3.33Å; V1071-A1073 PolarHBondContact O-N 2.8Å; A1073-F1075 VanDerWaalsContact C-N 3.31Å; A1073-F1075 PolarHBondContact O-N 3.38Å; A1073-A1076 PolarHBondContact O-N 2.86Å; A1073-Q1077 WeakPolarHBondContact O-CG 3.45Å; A1073-Q1077 PolarHBondContact O-N 2.87Å
1074	C	88.8	Confident	85.6	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-42.8	173.3	-68.1	0	0	0	0	111.4	I991 V1070 V1071 L1078	I991-C1074 HydrophobicContact CD1-CB 3.98Å; I991-C1074 WeakPolarHBondContact CD1-O 3.35Å; V1070-C1074 PolarHBondContact O-N 3.29Å; V1070-C1074 PolarHBondContact O-SG 3.25Å; V1071-C1074 WeakPolarHBondContact O-CB 3.24Å; V1071-C1074 PolarHBondContact O-N 3.08Å; C1074-L1078 WeakPolarHBondContact O-CB 3.13Å; C1074-L1078 PolarHBondContact O-N 3.38Å
1075	F	88.4	Confident	85.6	Confident	7 Å²	7	35.7 Å²	35.7	3%	0.031	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-47.3	177.1	-67.5	-10.1	0	0	0	111.6	V1071 S1072 A1073 Q1077 L1078 E1079 L1110 L1113 M1114 A1120 P1122 I1125	V1071-F1075 HydrophobicContact CG1-CD1 4.44Å; V1071-F1075 HydrophobicContact CG1-CD2 4.27Å; V1071-F1075 HydrophobicContact CG1-CE1 3.86Å; V1071-F1075 HydrophobicContact CG1-CE2 3.7Å; V1071-F1075 HydrophobicContact CG1-CZ 3.46Å; V1071-F1075 VanDerWaalsContact CG1-CZ 3.46Å; V1071-F1075 WeakPolarHBondContact O-CG 3.47Å; V1071-F1075 PolarHBondContact O-N 3.09Å; S1072-F1075 PolarHBondContact O-N 2.91Å; A1073-F1075 VanDerWaalsContact C-N 3.31Å; A1073-F1075 PolarHBondContact O-N 3.38Å; F1075-Q1077 VanDerWaalsContact C-N 3.33Å; F1075-Q1077 PolarHBondContact O-N 2.81Å; F1075-L1078 PolarHBondContact O-N 3.36Å; F1075-E1079 WeakPolarHBondContact O-CB 3.45Å; F1075-E1079 PolarHBondContact O-N 3.11Å; F1075-L1110 HydrophobicContact CD1-CD2 3.64Å; F1075-L1110 HydrophobicContact CE1-CD2 3.31Å; F1075-L1110 HydrophobicContact CZ-CD2 4.12Å; F1075-L1113 HydrophobicContact CE1-CB 3.88Å; F1075-L1113 HydrophobicContact CE1-CD1 3.82Å; F1075-L1113 HydrophobicContact CZ-CB 4.01Å; F1075-M1114 HydrophobicContact CE2-SD 3.63Å; F1075-M1114 HydrophobicContact CZ-CG 4.31Å; F1075-M1114 HydrophobicContact CZ-SD 3.71Å; F1075-A1120 HydrophobicContact CD2-CB 4.01Å; F1075-A1120 HydrophobicContact CE2-CB 3.54Å; F1075-A1120 HydrophobicContact CZ-CB 4.46Å; F1075-P1122 HydrophobicContact CD2-CB 4.35Å; F1075-P1122 HydrophobicContact CE2-CB 4.06Å; F1075-P1122 HydrophobicContact CZ-CB 4.46Å; F1075-I1125 HydrophobicContact CB-CD1 3.73Å; F1075-I1125 HydrophobicContact CD1-CD1 4.18Å; F1075-I1125 HydrophobicContact CG-CD1 4.1Å; F1075-I1125 WeakPolarHBondContact O-CD1 3.38Å
1076	A	88.3	Confident	85.5	Confident	55 Å²	55	36 Å²	36	46%	0.455	21%	0.205	S	C	.	.	H	α-helix	trans	-59.8	-41.7	178.1	0	0	0	0	0	112.5	S1072 A1073 E1079 N1080	S1072-A1076 PolarHBondContact O-N 2.98Å; A1073-A1076 PolarHBondContact O-N 2.86Å; A1076-E1079 PolarHBondContact O-N 3.42Å; A1076-N1080 WeakPolarHBondContact O-CB 3.38Å; A1076-N1080 PolarHBondContact O-N 3.33Å
1077	Q	87.7	Confident	85.3	Confident	38 Å²	38	36.8 Å²	36.8	18%	0.178	21%	0.208	C	C	.	.	H	α-helix	trans	-69.3	-39.4	177.5	-73.5	-66.7	0.7	0	0	112.7	P988 I991 A1073 F1075 N1080 L1081	P988-Q1077 HydrophobicContact CB-CG 4.15Å; I991-Q1077 HydrophobicContact CD1-CB 4.48Å; A1073-Q1077 WeakPolarHBondContact O-CG 3.45Å; A1073-Q1077 PolarHBondContact O-N 2.87Å; F1075-Q1077 VanDerWaalsContact C-N 3.33Å; F1075-Q1077 PolarHBondContact O-N 2.81Å; Q1077-N1080 PolarHBondContact O-N 3.3Å; Q1077-L1081 WeakPolarHBondContact O-CB 3.45Å; Q1077-L1081 PolarHBondContact O-N 3.18Å
1078	L	87.9	Confident	84.7	Confident	6 Å²	6	38.3 Å²	38.3	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-39.5	175.1	-170.9	63.2	0	0	0	111.6	I991 C1074 F1075 L1081 V1082 L1106 L1110 I1125	I991-L1078 HydrophobicContact CG2-CB 4.41Å; I991-L1078 HydrophobicContact CG2-CD1 4.05Å; C1074-L1078 WeakPolarHBondContact O-CB 3.13Å; C1074-L1078 PolarHBondContact O-N 3.38Å; F1075-L1078 PolarHBondContact O-N 3.36Å; L1078-L1081 PolarHBondContact O-N 2.77Å; L1078-V1082 WeakPolarHBondContact O-CG2 3.41Å; L1078-V1082 PolarHBondContact O-N 3.04Å; L1078-L1106 HydrophobicContact CD1-CB 4.19Å; L1078-L1106 HydrophobicContact CD1-CD1 4.24Å; L1078-L1110 HydrophobicContact CD2-CD2 4.36Å; L1078-I1125 HydrophobicContact CB-CD1 4.22Å; L1078-I1125 HydrophobicContact CD2-CD1 4.26Å; L1078-I1125 HydrophobicContact CD2-CG2 4.47Å
1079	E	87.5	Confident	84.1	Confident	57 Å²	57	35.7 Å²	35.7	27%	0.266	20%	0.199	S	C	.	.	H	α-helix	trans	-59.2	-46.8	173.6	-174.3	-177.3	165	0	0	111.5	F1075 A1076 V1082 S1083 N1124 I1125 L1128	F1075-E1079 WeakPolarHBondContact O-CB 3.45Å; F1075-E1079 PolarHBondContact O-N 3.11Å; A1076-E1079 PolarHBondContact O-N 3.42Å; E1079-V1082 PolarHBondContact O-N 3.21Å; E1079-S1083 WeakPolarHBondContact O-CB 3.43Å; E1079-S1083 PolarHBondContact O-N 3.17Å; E1079-S1083 PolarHBondContact O-OG 2.91Å; E1079-N1124 HydrophobicContact CG-CB 4.24Å; E1079-N1124 WeakPolarHBondContact OE1-CB 3.45Å; E1079-N1124 PolarHBondContact OE1-ND2 3.25Å; E1079-N1124 WeakPolarHBondContact OE2-CB 3.42Å; E1079-N1124 PolarHBondContact OE2-ND2 3.28Å; E1079-I1125 HydrophobicContact CB-CG1 3.9Å; E1079-L1128 HydrophobicContact CG-CD1 3.71Å
1080	N	86.3	Confident	83.2	Confident	60 Å²	60	39 Å²	39	32%	0.321	21%	0.209	S	C	.	.	H	α-helix	trans	-63	-44.9	178.1	-170.6	5.6	0	0	0	111.6	A1076 Q1077 V1082 S1083 Q1084	A1076-N1080 WeakPolarHBondContact O-CB 3.38Å; A1076-N1080 PolarHBondContact O-N 3.33Å; Q1077-N1080 PolarHBondContact O-N 3.3Å; N1080-V1082 PolarHBondContact O-N 3.08Å; N1080-S1083 PolarHBondContact O-N 3.37Å; N1080-Q1084 WeakPolarHBondContact O-CG 3.36Å; N1080-Q1084 PolarHBondContact O-N 3.49Å; N1080-Q1084 PolarHBondContact OD1-NE2 3.15Å
1081	L	85.6	Confident	81.8	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-45.8	177.8	179.2	139.5	0	0	0	112.3	I991 L995 Q1077 L1078 S1083 Q1084 L1085 W1102 I1103	I991-L1081 HydrophobicContact CG2-CD1 4.19Å; I991-L1081 VanDerWaalsContact O-CD1 3.22Å; I991-L1081 WeakPolarHBondContact O-CD1 3.49Å; L995-L1081 HydrophobicContact CD1-CD1 3.95Å; L995-L1081 HydrophobicContact CD1-CG 4.4Å; L995-L1081 HydrophobicContact CD2-CD1 4.49Å; L995-L1081 HydrophobicContact CG-CD1 4.03Å; Q1077-L1081 WeakPolarHBondContact O-CB 3.45Å; Q1077-L1081 PolarHBondContact O-N 3.18Å; L1078-L1081 PolarHBondContact O-N 2.77Å; L1081-S1083 VanDerWaalsContact C-N 3.31Å; L1081-S1083 PolarHBondContact O-N 2.86Å; L1081-Q1084 PolarHBondContact O-N 3.09Å; L1081-L1085 HydrophobicContact CD2-CD1 3.79Å; L1081-L1085 HydrophobicContact CG-CD1 4.2Å; L1081-L1085 WeakPolarHBondContact O-CG 3.29Å; L1081-L1085 PolarHBondContact O-N 3.43Å; L1081-L1085 VanDerWaalsContact O-N 3.1Å; L1081-W1102 HydrophobicContact CD1-CH2 4.28Å; L1081-W1102 HydrophobicContact CD1-CZ3 4.21Å; L1081-W1102 HydrophobicContact CD2-CH2 3.94Å; L1081-W1102 HydrophobicContact CD2-CZ3 3.89Å; L1081-I1103 HydrophobicContact CD2-CG1 4.38Å
1082	V	83.4	Confident	80.2	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-39.6	177	171.5	0	0	0	0	110.7	L1078 E1079 N1080 L1085 N1086 I1094 I1103 L1128	L1078-V1082 WeakPolarHBondContact O-CG2 3.41Å; L1078-V1082 PolarHBondContact O-N 3.04Å; E1079-V1082 PolarHBondContact O-N 3.21Å; N1080-V1082 PolarHBondContact O-N 3.08Å; V1082-L1085 PolarHBondContact O-N 2.8Å; V1082-N1086 WeakPolarHBondContact O-CB 3.43Å; V1082-N1086 PolarHBondContact O-N 3.41Å; V1082-N1086 PolarHBondContact O-ND2 2.87Å; V1082-I1094 HydrophobicContact CG1-CD1 4.49Å; V1082-I1103 HydrophobicContact CG2-CG2 4.27Å; V1082-L1128 HydrophobicContact CG1-CB 4.38Å
1083	S	83.1	Confident	79.2	Confident	36 Å²	36	49 Å²	49	25%	0.252	26%	0.262	S	S	.	.	H	α-helix	trans	-64.6	-44.9	178.3	-60	0	0	0	0	112.4	E1079 N1080 L1081 L1085 N1086 Q1087	E1079-S1083 WeakPolarHBondContact O-CB 3.43Å; E1079-S1083 PolarHBondContact O-N 3.17Å; E1079-S1083 PolarHBondContact O-OG 2.91Å; N1080-S1083 PolarHBondContact O-N 3.37Å; L1081-S1083 VanDerWaalsContact C-N 3.31Å; L1081-S1083 PolarHBondContact O-N 2.86Å; S1083-L1085 PolarHBondContact O-N 3.12Å; S1083-N1086 PolarHBondContact O-N 3.3Å; S1083-Q1087 WeakPolarHBondContact O-CG 3.31Å; S1083-Q1087 PolarHBondContact O-N 2.77Å; S1083-Q1087 VanDerWaalsContact O-N 3.13Å
1084	Q	81.3	Confident	78.4	Confident	30 Å²	30	47.1 Å²	47.1	14%	0.14	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-43.5	176.7	-73.7	176.6	43.6	0	0	112	L905 N1080 L1081 Q1087 Y1088	L905-Q1084 HydrophobicContact CD1-CB 4.4Å; L905-Q1084 VanDerWaalsContact N-OE1 3.11Å; N1080-Q1084 WeakPolarHBondContact O-CG 3.36Å; N1080-Q1084 PolarHBondContact O-N 3.49Å; N1080-Q1084 PolarHBondContact OD1-NE2 3.15Å; L1081-Q1084 PolarHBondContact O-N 3.09Å; Q1084-Q1087 PolarHBondContact O-N 2.79Å; Q1084-Y1088 PolarHBondContact O-N 3.02Å
1085	L	77.9	Confident	77.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-72	-34.1	179.3	-72.8	170.7	0	0	0	112.5	L905 L995 P1000 L1081 V1082 S1083 Q1087 Y1088 Y1089 I1094 W1102 I1103	L905-L1085 HydrophobicContact CD1-CD2 3.84Å; L905-L1085 HydrophobicContact CD1-CG 4.45Å; L995-L1085 HydrophobicContact CD2-CD1 4.04Å; L995-L1085 HydrophobicContact CD2-CD2 3.76Å; L995-L1085 HydrophobicContact CD2-CG 4.06Å; P1000-L1085 HydrophobicContact CG-CD2 3.73Å; L1081-L1085 HydrophobicContact CD2-CD1 3.79Å; L1081-L1085 HydrophobicContact CG-CD1 4.2Å; L1081-L1085 WeakPolarHBondContact O-CG 3.29Å; L1081-L1085 PolarHBondContact O-N 3.43Å; L1081-L1085 VanDerWaalsContact O-N 3.1Å; V1082-L1085 PolarHBondContact O-N 2.8Å; S1083-L1085 PolarHBondContact O-N 3.12Å; L1085-Q1087 VanDerWaalsContact C-N 3.3Å; L1085-Q1087 PolarHBondContact O-N 3.15Å; L1085-Y1088 WeakPolarHBondContact O-CB 3.42Å; L1085-Y1088 PolarHBondContact O-N 2.91Å; L1085-Y1089 HydrophobicContact CB-CD2 4.34Å; L1085-Y1089 HydrophobicContact CB-CE2 4.34Å; L1085-Y1089 HydrophobicContact CD2-CE2 3.98Å; L1085-Y1089 WeakPolarHBondContact O-CD2 3.42Å; L1085-Y1089 PolarHBondContact O-N 3.27Å; L1085-I1094 HydrophobicContact CB-CD1 3.22Å; L1085-I1094 HydrophobicContact CB-CG1 4.04Å; L1085-I1094 HydrophobicContact CD1-CD1 3.79Å; L1085-I1094 HydrophobicContact CG-CD1 4.16Å; L1085-W1102 HydrophobicContact CD1-CH2 3.69Å; L1085-W1102 HydrophobicContact CD1-CZ2 3.99Å; L1085-I1103 HydrophobicContact CD1-CD1 3.69Å; L1085-I1103 HydrophobicContact CD1-CG1 4.49Å
1086	N	78	Confident	76.4	Confident	27 Å²	27	50.4 Å²	50.4	14%	0.144	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-40.6	172.3	-84.4	-20.3	0	0	0	111.7	V1082 S1083 Y1088 E1090 I1094 D1132	V1082-N1086 WeakPolarHBondContact O-CB 3.43Å; V1082-N1086 PolarHBondContact O-N 3.41Å; V1082-N1086 PolarHBondContact O-ND2 2.87Å; S1083-N1086 PolarHBondContact O-N 3.3Å; N1086-Y1088 VanDerWaalsContact C-N 3.3Å; N1086-Y1088 PolarHBondContact O-N 3.29Å; N1086-E1090 PolarHBondContact O-N 2.94Å; N1086-I1094 VanDerWaalsContact OD1-CB 3.3Å; N1086-I1094 WeakPolarHBondContact OD1-CB 3.32Å; N1086-D1132 PolarHBondContact OD1-OD1 3.13Å
1087	Q	78.9	Confident	75.5	Confident	149 Å²	149	48.7 Å²	48.7	70%	0.696	25%	0.251	S	S	*	.	H	α-helix	trans	-62.6	-38	174.2	-71.3	174.9	-2.8	0	0	112	S1083 Q1084 L1085	S1083-Q1087 WeakPolarHBondContact O-CG 3.31Å; S1083-Q1087 PolarHBondContact O-N 2.77Å; S1083-Q1087 VanDerWaalsContact O-N 3.13Å; Q1084-Q1087 PolarHBondContact O-N 2.79Å; L1085-Q1087 VanDerWaalsContact C-N 3.3Å; L1085-Q1087 PolarHBondContact O-N 3.15Å
1088	Y	73	Confident	74.5	Confident	67 Å²	67	52.7 Å²	52.7	26%	0.263	28%	0.279	S	S	.	.	H	α-helix	trans	-67.2	-47.4	178.1	178	-98.1	0	0	0	113	N909 P1000 S1001 Q1084 L1085 N1086 E1090	N909-Y1088 HydrophobicContact CB-CD2 3.52Å; N909-Y1088 HydrophobicContact CB-CE2 3.42Å; N909-Y1088 VanDerWaalsContact CB-CE2 3.42Å; N909-Y1088 VanDerWaalsContact CG-CE2 3.42Å; N909-Y1088 WeakPolarHBondContact ND2-CD2 3.45Å; N909-Y1088 WeakPolarHBondContact ND2-CE2 3.44Å; N909-Y1088 WeakPolarHBondContact OD1-CD2 3.47Å; P1000-Y1088 HydrophobicContact CB-CD1 3.3Å; P1000-Y1088 HydrophobicContact CB-CD2 4.27Å; P1000-Y1088 HydrophobicContact CB-CE1 3.03Å; P1000-Y1088 HydrophobicContact CB-CE2 4.04Å; P1000-Y1088 HydrophobicContact CB-CG 3.92Å; P1000-Y1088 VanDerWaalsContact CB-CZ 3.42Å; P1000-Y1088 HydrophobicContact CG-CD1 3.96Å; P1000-Y1088 HydrophobicContact CG-CE1 4.15Å; P1000-Y1088 HydrophobicContact CG-CG 4.22Å; S1001-Y1088 PolarHBondContact N-OH 2.93Å; Q1084-Y1088 PolarHBondContact O-N 3.02Å; L1085-Y1088 WeakPolarHBondContact O-CB 3.42Å; L1085-Y1088 PolarHBondContact O-N 2.91Å; N1086-Y1088 VanDerWaalsContact C-N 3.3Å; N1086-Y1088 PolarHBondContact O-N 3.29Å; Y1088-E1090 VanDerWaalsContact C-N 3.29Å; Y1088-E1090 PolarHBondContact O-N 3.46Å
1089	Y	71.8	Confident	73.8	Confident	23 Å²	23	52.7 Å²	52.7	9%	0.09	28%	0.279	C	S	.	.	H	α-helix	trans	-81.1	-6.6	-171.1	-70.8	-68	0	0	0	113.2	P1000 L1085 P1091 T1092 I1094 T1097 S1099	P1000-Y1089 HydrophobicContact CB-CE1 4.4Å; L1085-Y1089 HydrophobicContact CB-CD2 4.34Å; L1085-Y1089 HydrophobicContact CB-CE2 4.34Å; L1085-Y1089 HydrophobicContact CD2-CE2 3.98Å; L1085-Y1089 WeakPolarHBondContact O-CD2 3.42Å; L1085-Y1089 PolarHBondContact O-N 3.27Å; Y1089-P1091 CarbonylContact O-C 3.55Å; Y1089-T1092 CarbonylContact C-O 3.09Å; Y1089-T1092 WeakPolarHBondContact CB-O 3.18Å; Y1089-T1092 CarbonylContact O-C 3.55Å; Y1089-T1092 WeakPolarHBondContact O-CA 3.38Å; Y1089-T1092 VanDerWaalsContact O-CB 3.28Å; Y1089-T1092 WeakPolarHBondContact O-CB 3.41Å; Y1089-T1092 PolarHBondContact O-N 2.87Å; Y1089-T1092 PolarHBondContact O-OG1 3.39Å; Y1089-I1094 HydrophobicContact CD2-CG1 4.18Å; Y1089-I1094 HydrophobicContact CE2-CG1 4.39Å; Y1089-T1097 HydrophobicContact CD1-CG2 3.42Å; Y1089-T1097 VanDerWaalsContact CD1-CG2 3.42Å; Y1089-T1097 HydrophobicContact CD2-CG2 3.86Å; Y1089-T1097 HydrophobicContact CE1-CG2 3.7Å; Y1089-T1097 HydrophobicContact CE2-CG2 4.11Å; Y1089-T1097 HydrophobicContact CG-CG2 3.53Å; Y1089-S1099 PolarHBondContact OH-OG 3.02Å
1090	E	69.6	Low	73.4	Confident	150 Å²	150	50.1 Å²	50.1	70%	0.701	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	127.9	-179.1	-97.4	-173.1	171.4	0	0	112.8	N1086 Y1088	N1086-E1090 PolarHBondContact O-N 2.94Å; Y1088-E1090 VanDerWaalsContact C-N 3.29Å; Y1088-E1090 PolarHBondContact O-N 3.46Å
1091	P	56.9	Low	73.2	Confident	121 Å²	121	49.1 Å²	49.1	79%	0.786	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.2	-8.2	9.3	36	-34.9	0	0	0	114.7	Y1089	Y1089-P1091 CarbonylContact O-C 3.55Å
1092	T	54.3	Low	73	Confident	85 Å²	85	49.1 Å²	49.1	52%	0.521	26%	0.259	S	S	.	.	S	Bend	trans	-63.8	130.7	174.5	21.3	0	0	0	0	111.7	Y1089	Y1089-T1092 CarbonylContact C-O 3.09Å; Y1089-T1092 WeakPolarHBondContact CB-O 3.18Å; Y1089-T1092 CarbonylContact O-C 3.55Å; Y1089-T1092 WeakPolarHBondContact O-CA 3.38Å; Y1089-T1092 VanDerWaalsContact O-CB 3.28Å; Y1089-T1092 WeakPolarHBondContact O-CB 3.41Å; Y1089-T1092 PolarHBondContact O-N 2.87Å; Y1089-T1092 PolarHBondContact O-OG1 3.39Å
1093	R	66.3	Low	73	Confident	74 Å²	74	49 Å²	49	28%	0.279	26%	0.258	S	S	.	.			trans	-83.7	141.7	-173.2	-64.9	-77.5	175.4	177.5	-8.5	110.4	C1095 T1096 T1097 D1132 N1135	R1093-C1095 PolarHBondContact O-N 3.4Å; R1093-C1095 VanDerWaalsContact O-N 3.1Å; R1093-T1096 PolarHBondContact O-N 2.94Å; R1093-T1096 PolarHBondContact O-OG1 2.96Å; R1093-T1097 WeakPolarHBondContact O-CG2 3.41Å; R1093-D1132 WeakPolarHBondContact CB-OD2 3.42Å; R1093-D1132 VanDerWaalsContact CD-CG 3.49Å; R1093-D1132 WeakPolarHBondContact CD-O 3.38Å; R1093-D1132 WeakPolarHBondContact CD-OD1 3.22Å; R1093-D1132 IonicContact CZ-OD1 2.87Å; R1093-D1132 IonicContact NE-OD1 3.3Å; R1093-D1132 IonicContact NH1-OD1 2.8Å; R1093-D1132 PolarHBondContact NH1-OD1 3.09Å; R1093-N1135 PolarHBondContact NH1-ND2 3.49Å; R1093-N1135 VanDerWaalsContact NH2-CG 3.28Å; R1093-N1135 PolarHBondContact NH2-ND2 3.17Å
1094	I	71.7	Confident	72.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-56.1	-36.6	-175	-152.5	173.1	0	0	0	112.1	V1082 L1085 N1086 Y1089 T1096 T1097 I1103 D1132	V1082-I1094 HydrophobicContact CG1-CD1 4.49Å; L1085-I1094 HydrophobicContact CB-CD1 3.22Å; L1085-I1094 HydrophobicContact CB-CG1 4.04Å; L1085-I1094 HydrophobicContact CD1-CD1 3.79Å; L1085-I1094 HydrophobicContact CG-CD1 4.16Å; N1086-I1094 VanDerWaalsContact OD1-CB 3.3Å; N1086-I1094 WeakPolarHBondContact OD1-CB 3.32Å; Y1089-I1094 HydrophobicContact CD2-CG1 4.18Å; Y1089-I1094 HydrophobicContact CE2-CG1 4.39Å; I1094-T1096 PolarHBondContact O-N 3.38Å; I1094-T1096 VanDerWaalsContact O-N 3.09Å; I1094-T1097 PolarHBondContact O-N 3.26Å; I1094-T1097 VanDerWaalsContact O-N 3.08Å; I1094-T1097 PolarHBondContact O-OG1 3Å; I1094-I1103 HydrophobicContact CD1-CD1 3.35Å; I1094-I1103 HydrophobicContact CG1-CD1 3.69Å; I1094-D1132 WeakPolarHBondContact CG2-OD2 3.22Å; I1094-D1132 PolarHBondContact N-OD2 2.95Å
1095	C	69.9	Low	72.9	Confident	7 Å²	7	48.6 Å²	48.6	5%	0.047	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-66.1	-9.3	179.9	-66.1	0	0	0	0	113.9	R1093 D1132 V1133 A1297	R1093-C1095 PolarHBondContact O-N 3.4Å; R1093-C1095 VanDerWaalsContact O-N 3.1Å; C1095-D1132 PolarHBondContact N-OD2 3.05Å; C1095-V1133 HydrophobicContact CB-CG2 4.25Å; C1095-A1297 HydrophobicContact CB-CB 3.53Å
1096	T	65.9	Low	73.2	Confident	70 Å²	70	48.9 Å²	48.9	43%	0.429	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-112	1.4	178.2	59.6	0	0	0	0	113.3	R1093 I1094	R1093-T1096 PolarHBondContact O-N 2.94Å; R1093-T1096 PolarHBondContact O-OG1 2.96Å; I1094-T1096 PolarHBondContact O-N 3.38Å; I1094-T1096 VanDerWaalsContact O-N 3.09Å
1097	T	69	Low	73.6	Confident	19 Å²	19	47.7 Å²	47.7	12%	0.117	25%	0.251	C	S	.	.	S	Bend	trans	-96.2	165.3	-176.2	70.8	0	0	0	0	111.9	Y1089 R1093 I1094 S1099 W1100	Y1089-T1097 HydrophobicContact CD1-CG2 3.42Å; Y1089-T1097 VanDerWaalsContact CD1-CG2 3.42Å; Y1089-T1097 HydrophobicContact CD2-CG2 3.86Å; Y1089-T1097 HydrophobicContact CE1-CG2 3.7Å; Y1089-T1097 HydrophobicContact CE2-CG2 4.11Å; Y1089-T1097 HydrophobicContact CG-CG2 3.53Å; R1093-T1097 WeakPolarHBondContact O-CG2 3.41Å; I1094-T1097 PolarHBondContact O-N 3.26Å; I1094-T1097 VanDerWaalsContact O-N 3.08Å; I1094-T1097 PolarHBondContact O-OG1 3Å; T1097-S1099 PolarHBondContact O-N 3.19Å; T1097-S1099 VanDerWaalsContact O-N 3.12Å; T1097-S1099 PolarHBondContact OG1-N 3.23Å; T1097-W1100 WeakPolarHBondContact O-CB 3.3Å; T1097-W1100 PolarHBondContact O-N 2.97Å; T1097-W1100 VanDerWaalsContact O-N 3.14Å
1098	T	66.9	Low	73.8	Confident	122 Å²	122	43.5 Å²	43.5	75%	0.748	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-10.2	172.6	54.7	0	0	0	0	113.5	W1101	T1098-W1101 PolarHBondContact O-NE1 2.88Å
1099	S	73.5	Confident	74.3	Confident	6 Å²	6	41.9 Å²	41.9	4%	0.042	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-13	175.6	-67	0	0	0	0	113.4	Y1089 T1097 W1101 W1102 I1103	Y1089-S1099 PolarHBondContact OH-OG 3.02Å; T1097-S1099 PolarHBondContact O-N 3.19Å; T1097-S1099 VanDerWaalsContact O-N 3.12Å; T1097-S1099 PolarHBondContact OG1-N 3.23Å; S1099-W1101 VanDerWaalsContact C-N 3.3Å; S1099-W1101 PolarHBondContact O-N 3.37Å; S1099-W1102 VanDerWaalsContact CA-NE1 3.34Å; S1099-W1102 PolarHBondContact O-N 3.46Å; S1099-W1102 PolarHBondContact O-NE1 2.97Å; S1099-I1103 WeakPolarHBondContact O-CG1 3.49Å; S1099-I1103 PolarHBondContact O-N 3.48Å
1100	W	78.9	Confident	74.9	Confident	3 Å²	3	40.8 Å²	40.8	1%	0.011	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-34.1	-175.5	-179.8	-128.9	0	0	0	113.5	T1097 W1102 I1103 R1104 L1129 T1294 V1301	T1097-W1100 WeakPolarHBondContact O-CB 3.3Å; T1097-W1100 PolarHBondContact O-N 2.97Å; T1097-W1100 VanDerWaalsContact O-N 3.14Å; W1100-W1102 VanDerWaalsContact C-N 3.34Å; W1100-W1102 PolarHBondContact O-N 3.24Å; W1100-I1103 HydrophobicContact CE3-CB 4.13Å; W1100-I1103 HydrophobicContact CE3-CG2 4.05Å; W1100-I1103 HydrophobicContact CZ3-CB 4.4Å; W1100-I1103 HydrophobicContact CZ3-CG2 3.85Å; W1100-I1103 PolarHBondContact O-N 3.03Å; W1100-R1104 HydrophobicContact CD2-CB 4.32Å; W1100-R1104 HydrophobicContact CZ2-CB 4.23Å; W1100-R1104 WeakPolarHBondContact O-CB 3.49Å; W1100-R1104 PolarHBondContact O-N 3.28Å; W1100-L1129 HydrophobicContact CH2-CD2 3.9Å; W1100-L1129 HydrophobicContact CZ3-CD2 3.77Å; W1100-T1294 HydrophobicContact CG-CG2 4.28Å; W1100-V1301 HydrophobicContact CH2-CG2 3.97Å; W1100-V1301 HydrophobicContact CZ2-CG2 3.96Å
1101	W	80.9	Confident	75.5	Confident	40 Å²	40	34.2 Å²	34.2	15%	0.152	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-38.4	-175.4	71.5	-92.1	0	0	0	113.5	L998 I1015 V1018 R1019 L1022 T1098 S1099 A1105 I1292 T1294	L998-W1101 HydrophobicContact CD1-CZ2 3.87Å; I1015-W1101 HydrophobicContact CG2-CH2 4.37Å; I1015-W1101 HydrophobicContact CG2-CZ2 4.34Å; V1018-W1101 HydrophobicContact CB-CH2 4.01Å; V1018-W1101 HydrophobicContact CB-CZ2 4.5Å; V1018-W1101 HydrophobicContact CG1-CH2 3.58Å; V1018-W1101 HydrophobicContact CG1-CZ2 4.12Å; V1018-W1101 HydrophobicContact CG1-CZ3 4.29Å; R1019-W1101 HydrophobicContact CG-CH2 4.19Å; R1019-W1101 HydrophobicContact CG-CZ3 4.17Å; L1022-W1101 HydrophobicContact CD1-CE3 4.48Å; L1022-W1101 HydrophobicContact CD1-CH2 4.46Å; L1022-W1101 HydrophobicContact CD1-CZ3 3.78Å; T1098-W1101 PolarHBondContact O-NE1 2.88Å; S1099-W1101 VanDerWaalsContact C-N 3.3Å; S1099-W1101 PolarHBondContact O-N 3.37Å; W1101-A1105 PolarHBondContact O-N 3.45Å; W1101-I1292 HydrophobicContact CB-CB 4.12Å; W1101-I1292 HydrophobicContact CB-CD1 4.32Å; W1101-I1292 HydrophobicContact CB-CG2 4.04Å; W1101-I1292 HydrophobicContact CD2-CD1 3.99Å; W1101-I1292 HydrophobicContact CE3-CD1 3.58Å; W1101-I1292 HydrophobicContact CG-CD1 4.31Å; W1101-I1292 HydrophobicContact CZ3-CD1 4.23Å; W1101-T1294 HydrophobicContact CB-CG2 3.92Å
1102	W	82.4	Confident	76.7	Confident	1 Å²	1	30.9 Å²	30.9	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-85.3	-31.3	-179	61.4	-100.6	0	0	0	111.8	P994 L995 V1018 L1022 L1081 L1085 S1099 W1100 A1105 L1106	P994-W1102 HydrophobicContact CB-CD2 4.07Å; P994-W1102 HydrophobicContact CB-CE3 3.7Å; P994-W1102 HydrophobicContact CB-CH2 4.08Å; P994-W1102 HydrophobicContact CB-CZ2 4.44Å; P994-W1102 HydrophobicContact CB-CZ3 3.71Å; P994-W1102 HydrophobicContact CG-CE3 4.03Å; P994-W1102 HydrophobicContact CG-CZ3 4.06Å; L995-W1102 HydrophobicContact CD2-CH2 4.18Å; V1018-W1102 HydrophobicContact CG1-CB 3.87Å; V1018-W1102 HydrophobicContact CG1-CG 4.31Å; L1022-W1102 HydrophobicContact CD1-CB 4.03Å; L1081-W1102 HydrophobicContact CD1-CH2 4.28Å; L1081-W1102 HydrophobicContact CD1-CZ3 4.21Å; L1081-W1102 HydrophobicContact CD2-CH2 3.94Å; L1081-W1102 HydrophobicContact CD2-CZ3 3.89Å; L1085-W1102 HydrophobicContact CD1-CH2 3.69Å; L1085-W1102 HydrophobicContact CD1-CZ2 3.99Å; S1099-W1102 VanDerWaalsContact CA-NE1 3.34Å; S1099-W1102 PolarHBondContact O-N 3.46Å; S1099-W1102 PolarHBondContact O-NE1 2.97Å; W1100-W1102 VanDerWaalsContact C-N 3.34Å; W1100-W1102 PolarHBondContact O-N 3.24Å; W1102-A1105 PolarHBondContact O-N 3.41Å; W1102-L1106 HydrophobicContact CE3-CD1 4.14Å; W1102-L1106 HydrophobicContact CZ3-CD1 4.22Å; W1102-L1106 PolarHBondContact O-N 3.25Å; W1102-L1106 VanDerWaalsContact O-N 3.13Å
1103	I	83.2	Confident	78.2	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64	-46.2	170.7	-62	172	0	0	0	109.7	L1081 V1082 L1085 I1094 S1099 W1100 A1105 L1106 C1107	L1081-I1103 HydrophobicContact CD2-CG1 4.38Å; V1082-I1103 HydrophobicContact CG2-CG2 4.27Å; L1085-I1103 HydrophobicContact CD1-CD1 3.69Å; L1085-I1103 HydrophobicContact CD1-CG1 4.49Å; I1094-I1103 HydrophobicContact CD1-CD1 3.35Å; I1094-I1103 HydrophobicContact CG1-CD1 3.69Å; S1099-I1103 WeakPolarHBondContact O-CG1 3.49Å; S1099-I1103 PolarHBondContact O-N 3.48Å; W1100-I1103 HydrophobicContact CE3-CB 4.13Å; W1100-I1103 HydrophobicContact CE3-CG2 4.05Å; W1100-I1103 HydrophobicContact CZ3-CB 4.4Å; W1100-I1103 HydrophobicContact CZ3-CG2 3.85Å; W1100-I1103 PolarHBondContact O-N 3.03Å; I1103-A1105 VanDerWaalsContact C-N 3.28Å; I1103-A1105 PolarHBondContact O-N 3.1Å; I1103-L1106 WeakPolarHBondContact O-CB 3.48Å; I1103-L1106 PolarHBondContact O-N 2.89Å; I1103-L1106 VanDerWaalsContact O-N 3.09Å; I1103-C1107 PolarHBondContact O-N 3.21Å; I1103-C1107 PolarHBondContact O-SG 3.36Å; I1103-C1107 VanDerWaalsContact O-SG 3.33Å
1104	R	81.7	Confident	79	Confident	25 Å²	25	23.5 Å²	23.5	9%	0.094	13%	0.127	C	C	.	.	H	α-helix	trans	-55.5	-45	173.8	-179.8	-173.9	172.6	168.7	5	111.1	W1100 L1106 C1107 E1108 P1295 D1300	W1100-R1104 HydrophobicContact CD2-CB 4.32Å; W1100-R1104 HydrophobicContact CZ2-CB 4.23Å; W1100-R1104 WeakPolarHBondContact O-CB 3.49Å; W1100-R1104 PolarHBondContact O-N 3.28Å; R1104-L1106 VanDerWaalsContact C-N 3.28Å; R1104-L1106 PolarHBondContact O-N 3.02Å; R1104-C1107 CarbonylContact O-C 3.34Å; R1104-C1107 PolarHBondContact O-N 2.91Å; R1104-C1107 VanDerWaalsContact O-N 3.16Å; R1104-E1108 WeakPolarHBondContact O-CB 3.34Å; R1104-E1108 PolarHBondContact O-N 3.37Å; R1104-P1295 VanDerWaalsContact NH1-CG 3.28Å; R1104-D1300 IonicContact CZ-OD1 2.85Å; R1104-D1300 IonicContact CZ-OD2 3.15Å; R1104-D1300 IonicContact NE-OD2 3.74Å; R1104-D1300 VanDerWaalsContact NH1-CG 3.26Å; R1104-D1300 IonicContact NH1-OD1 3.34Å; R1104-D1300 PolarHBondContact NH1-OD1 3.25Å; R1104-D1300 IonicContact NH1-OD2 3.75Å; R1104-D1300 PolarHBondContact NH1-OD2 3.24Å; R1104-D1300 IonicContact NH2-OD1 3.64Å; R1104-D1300 PolarHBondContact NH2-OD1 3.21Å; R1104-D1300 IonicContact NH2-OD2 2.72Å
1105	A	80.9	Confident	79.5	Confident	31 Å²	31	25.4 Å²	25.4	26%	0.256	14%	0.136	S	C	.	.	H	α-helix	trans	-60.7	-36.7	178.6	0	0	0	0	0	112.5	L1022 W1101 W1102 I1103 H1109	L1022-A1105 HydrophobicContact CD1-CB 3.77Å; L1022-A1105 HydrophobicContact CD2-CB 4Å; L1022-A1105 HydrophobicContact CG-CB 4.43Å; W1101-A1105 PolarHBondContact O-N 3.45Å; W1102-A1105 PolarHBondContact O-N 3.41Å; I1103-A1105 VanDerWaalsContact C-N 3.28Å; I1103-A1105 PolarHBondContact O-N 3.1Å; A1105-H1109 PolarHBondContact O-CD2 3.27Å; A1105-H1109 VanDerWaalsContact O-CD2 3.26Å
1106	L	84.6	Confident	80.2	Confident	7 Å²	7	25.3 Å²	25.3	4%	0.037	14%	0.135	C	C	.	.	H	α-helix	trans	-67.5	-46.4	171.7	-67	170	0	0	0	111.4	I991 L1022 F1025 L1078 W1102 I1103 R1104 E1108 H1109	I991-L1106 HydrophobicContact CG2-CD1 4.31Å; L1022-L1106 HydrophobicContact CD2-CD2 3.67Å; L1022-L1106 HydrophobicContact CD2-CG 3.76Å; F1025-L1106 HydrophobicContact CD1-CD2 3.85Å; F1025-L1106 HydrophobicContact CD2-CD2 4.41Å; F1025-L1106 HydrophobicContact CE1-CD2 3.89Å; F1025-L1106 HydrophobicContact CE2-CD2 4.48Å; F1025-L1106 HydrophobicContact CG-CD2 4.12Å; F1025-L1106 HydrophobicContact CZ-CD2 4.22Å; L1078-L1106 HydrophobicContact CD1-CB 4.19Å; L1078-L1106 HydrophobicContact CD1-CD1 4.24Å; W1102-L1106 HydrophobicContact CE3-CD1 4.14Å; W1102-L1106 HydrophobicContact CZ3-CD1 4.22Å; W1102-L1106 PolarHBondContact O-N 3.25Å; W1102-L1106 VanDerWaalsContact O-N 3.13Å; I1103-L1106 WeakPolarHBondContact O-CB 3.48Å; I1103-L1106 PolarHBondContact O-N 2.89Å; I1103-L1106 VanDerWaalsContact O-N 3.09Å; R1104-L1106 VanDerWaalsContact C-N 3.28Å; R1104-L1106 PolarHBondContact O-N 3.02Å; L1106-E1108 VanDerWaalsContact C-N 3.27Å; L1106-E1108 PolarHBondContact O-N 3.01Å; L1106-H1109 PolarHBondContact O-N 3.29Å
1107	C	84.4	Confident	81	Confident	1 Å²	1	22 Å²	22	1%	0.007	12%	0.115	C	C	.	.	H	α-helix	trans	-62.9	-30.1	179.3	-68.5	0	0	0	0	113.2	I1103 R1104 H1109 L1110 L1304	I1103-C1107 PolarHBondContact O-N 3.21Å; I1103-C1107 PolarHBondContact O-SG 3.36Å; I1103-C1107 VanDerWaalsContact O-SG 3.33Å; R1104-C1107 CarbonylContact O-C 3.34Å; R1104-C1107 PolarHBondContact O-N 2.91Å; R1104-C1107 VanDerWaalsContact O-N 3.16Å; C1107-H1109 PolarHBondContact O-N 3.49Å; C1107-L1110 HydrophobicContact CB-CD1 4.07Å; C1107-L1110 VanDerWaalsContact O-CB 3.24Å; C1107-L1110 WeakPolarHBondContact O-CB 3.49Å; C1107-L1110 WeakPolarHBondContact O-CD1 3.44Å; C1107-L1110 VanDerWaalsContact O-CG 3.24Å; C1107-L1110 WeakPolarHBondContact O-CG 3.37Å; C1107-L1110 PolarHBondContact O-N 3.31Å; C1107-L1304 HydrophobicContact CB-CD2 3.74Å; C1107-L1304 WeakPolarHBondContact O-CD1 3.45Å
1108	E	83.3	Confident	81.3	Confident	61 Å²	61	22.4 Å²	22.4	29%	0.285	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.6	177.9	-167.8	62.6	-163	0	0	112.9	R1104 L1106 P1111 R1307	R1104-E1108 WeakPolarHBondContact O-CB 3.34Å; R1104-E1108 PolarHBondContact O-N 3.37Å; L1106-E1108 VanDerWaalsContact C-N 3.27Å; L1106-E1108 PolarHBondContact O-N 3.01Å; E1108-P1111 WeakPolarHBondContact O-CD 3.35Å; E1108-R1307 IonicContact OE1-CZ 3.76Å; E1108-R1307 VanDerWaalsContact OE1-CZ 3.28Å; E1108-R1307 IonicContact OE1-NH1 3.28Å; E1108-R1307 PolarHBondContact OE1-NH1 3.26Å; E1108-R1307 IonicContact OE1-NH2 2.92Å; E1108-R1307 PolarHBondContact OE1-NH2 3.26Å; E1108-R1307 IonicContact OE2-CZ 2.83Å; E1108-R1307 IonicContact OE2-NH1 3.81Å; E1108-R1307 IonicContact OE2-NH2 3.76Å; E1108-R1307 PolarHBondContact OE2-NH2 2.97Å
1109	H	84.1	Confident	81.9	Confident	33 Å²	33	22 Å²	22	15%	0.153	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-9	175.5	-63.9	-62.6	0	0	0	114.2	F1025 I1029 A1105 L1106 C1107 R1112 L1113	F1025-H1109 AromaticContact CD1-CD2 3.82Å; F1025-H1109 HydrophobicContact CE1-CB 4.41Å; I1029-H1109 HydrophobicContact CD1-CB 3.78Å; I1029-H1109 HydrophobicContact CG2-CB 4.47Å; A1105-H1109 PolarHBondContact O-CD2 3.27Å; A1105-H1109 VanDerWaalsContact O-CD2 3.26Å; L1106-H1109 PolarHBondContact O-N 3.29Å; C1107-H1109 PolarHBondContact O-N 3.49Å; H1109-R1112 WeakPolarHBondContact O-CB 3.49Å; H1109-R1112 PolarHBondContact O-N 3.03Å; H1109-L1113 WeakPolarHBondContact O-CG 3.47Å; H1109-L1113 PolarHBondContact O-N 3.32Å
1110	L	85.4	Confident	82.2	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-54	-45.7	178.9	-71.6	166.5	0	0	0	113.4	F1075 L1078 C1107 R1112 L1113 M1114 I1125 L1304 V1308	F1075-L1110 HydrophobicContact CD1-CD2 3.64Å; F1075-L1110 HydrophobicContact CE1-CD2 3.31Å; F1075-L1110 HydrophobicContact CZ-CD2 4.12Å; L1078-L1110 HydrophobicContact CD2-CD2 4.36Å; C1107-L1110 HydrophobicContact CB-CD1 4.07Å; C1107-L1110 VanDerWaalsContact O-CB 3.24Å; C1107-L1110 WeakPolarHBondContact O-CB 3.49Å; C1107-L1110 WeakPolarHBondContact O-CD1 3.44Å; C1107-L1110 VanDerWaalsContact O-CG 3.24Å; C1107-L1110 WeakPolarHBondContact O-CG 3.37Å; C1107-L1110 PolarHBondContact O-N 3.31Å; L1110-R1112 VanDerWaalsContact C-N 3.25Å; L1110-R1112 PolarHBondContact O-N 3.04Å; L1110-L1113 PolarHBondContact O-N 2.84Å; L1110-M1114 WeakPolarHBondContact O-CG 3.44Å; L1110-M1114 PolarHBondContact O-N 3.34Å; L1110-I1125 HydrophobicContact CD1-CG2 4.43Å; L1110-I1125 HydrophobicContact CD2-CD1 4.37Å; L1110-L1304 HydrophobicContact CD1-CD2 4.18Å; L1110-V1308 HydrophobicContact CB-CG2 3.65Å
1111	P	81.8	Confident	82.3	Confident	11 Å²	11	26 Å²	26	7%	0.071	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-37.7	177.8	-21.6	33	0	0	0	112	E1108 M1114 Q1115 L1304 R1307 V1308 Y1311	E1108-P1111 WeakPolarHBondContact O-CD 3.35Å; P1111-M1114 PolarHBondContact O-N 3.24Å; P1111-Q1115 WeakPolarHBondContact O-CG 3.44Å; P1111-Q1115 PolarHBondContact O-N 3.44Å; P1111-L1304 HydrophobicContact CG-CD1 4.16Å; P1111-R1307 HydrophobicContact CB-CB 4.25Å; P1111-R1307 HydrophobicContact CG-CB 3.81Å; P1111-V1308 HydrophobicContact CG-CG2 3.91Å; P1111-Y1311 HydrophobicContact CB-CD2 4.44Å; P1111-Y1311 HydrophobicContact CB-CE2 4.36Å
1112	R	81.6	Confident	82.2	Confident	51 Å²	51	24.2 Å²	24.2	19%	0.192	12%	0.121	C	C	.	.	H	α-helix	trans	-68.5	-40.8	177.6	179.5	56.3	176.5	-166.5	4.3	111.5	I1029 L1032 I1034 H1109 L1110 M1114 Q1115 I1116	I1029-R1112 HydrophobicContact CG2-CB 4.19Å; I1029-R1112 HydrophobicContact CG2-CG 3.51Å; L1032-R1112 PolarHBondContact O-NH2 2.82Å; I1034-R1112 VanDerWaalsContact CG1-CZ 3.44Å; I1034-R1112 VanDerWaalsContact CG1-NH2 3.3Å; H1109-R1112 WeakPolarHBondContact O-CB 3.49Å; H1109-R1112 PolarHBondContact O-N 3.03Å; L1110-R1112 VanDerWaalsContact C-N 3.25Å; L1110-R1112 PolarHBondContact O-N 3.04Å; R1112-M1114 VanDerWaalsContact C-N 3.32Å; R1112-Q1115 VanDerWaalsContact NH1-OE1 3.15Å; R1112-Q1115 WeakPolarHBondContact O-CB 3.41Å; R1112-Q1115 PolarHBondContact O-N 3.42Å; R1112-I1116 HydrophobicContact CG-CD1 4.16Å; R1112-I1116 WeakPolarHBondContact O-CD1 3.3Å; R1112-I1116 VanDerWaalsContact O-CG1 3.27Å; R1112-I1116 WeakPolarHBondContact O-CG1 3.36Å; R1112-I1116 PolarHBondContact O-N 2.88Å; R1112-I1116 VanDerWaalsContact O-N 3.16Å
1113	L	85	Confident	82.1	Confident	5 Å²	5	25.1 Å²	25.1	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-63.4	-38.6	175.2	-69.9	169.1	0	0	0	111.6	I1029 V1071 F1075 H1109 L1110 I1116 A1117	I1029-L1113 HydrophobicContact CD1-CD1 4.28Å; I1029-L1113 HydrophobicContact CD1-CD2 3.95Å; I1029-L1113 HydrophobicContact CD1-CG 4.22Å; I1029-L1113 HydrophobicContact CG1-CD2 4.21Å; I1029-L1113 HydrophobicContact CG2-CD2 4.49Å; V1071-L1113 HydrophobicContact CG1-CB 3.93Å; V1071-L1113 HydrophobicContact CG2-CD2 3.99Å; F1075-L1113 HydrophobicContact CE1-CB 3.88Å; F1075-L1113 HydrophobicContact CE1-CD1 3.82Å; F1075-L1113 HydrophobicContact CZ-CB 4.01Å; H1109-L1113 WeakPolarHBondContact O-CG 3.47Å; H1109-L1113 PolarHBondContact O-N 3.32Å; L1110-L1113 PolarHBondContact O-N 2.84Å; L1113-I1116 WeakPolarHBondContact O-CB 3.31Å; L1113-I1116 PolarHBondContact O-N 3.44Å; L1113-I1116 VanDerWaalsContact O-N 3.14Å; L1113-A1117 PolarHBondContact O-N 3.29Å
1114	M	84	Confident	81.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67.7	-33.6	173.9	-71.5	-52.9	-52.6	0	0	113.6	F1075 L1110 P1111 R1112 I1116 A1117 P1118 A1120 P1122 V1308	F1075-M1114 HydrophobicContact CE2-SD 3.63Å; F1075-M1114 HydrophobicContact CZ-CG 4.31Å; F1075-M1114 HydrophobicContact CZ-SD 3.71Å; L1110-M1114 WeakPolarHBondContact O-CG 3.44Å; L1110-M1114 PolarHBondContact O-N 3.34Å; P1111-M1114 PolarHBondContact O-N 3.24Å; R1112-M1114 VanDerWaalsContact C-N 3.32Å; M1114-I1116 PolarHBondContact O-N 3.22Å; M1114-A1117 CarbonylContact O-C 3.34Å; M1114-P1118 WeakPolarHBondContact O-CA 3.14Å; M1114-A1120 WeakPolarHBondContact CE-O 3.31Å; M1114-A1120 HydrophobicContact SD-CB 4.46Å; M1114-P1122 HydrophobicContact SD-CB 4.39Å; M1114-P1122 HydrophobicContact SD-CG 3.85Å; M1114-V1308 HydrophobicContact CG-CG1 3.94Å
1115	Q	82.9	Confident	82	Confident	39 Å²	39	27.2 Å²	27.2	18%	0.182	14%	0.139	C	C	.	.	H	α-helix	trans	-63	-33.4	170.5	-75.6	175.2	8.1	0	0	112.2	I1034 T1035 P1111 R1112 Y1311	I1034-Q1115 HydrophobicContact CG2-CB 3.94Å; T1035-Q1115 PolarHBondContact N-O 3.35Å; T1035-Q1115 PolarHBondContact OG1-O 3.43Å; P1111-Q1115 WeakPolarHBondContact O-CG 3.44Å; P1111-Q1115 PolarHBondContact O-N 3.44Å; R1112-Q1115 VanDerWaalsContact NH1-OE1 3.15Å; R1112-Q1115 WeakPolarHBondContact O-CB 3.41Å; R1112-Q1115 PolarHBondContact O-N 3.42Å; Q1115-Y1311 HydrophobicContact CG-CD1 3.41Å; Q1115-Y1311 VanDerWaalsContact CG-CD1 3.41Å; Q1115-Y1311 HydrophobicContact CG-CD2 4Å; Q1115-Y1311 HydrophobicContact CG-CE1 3.52Å; Q1115-Y1311 HydrophobicContact CG-CE2 4.13Å; Q1115-Y1311 HydrophobicContact CG-CG 3.66Å; Q1115-Y1311 VanDerWaalsContact NE2-CE1 3.35Å; Q1115-Y1311 PolarHBondContact NE2-OH 2.71Å; Q1115-Y1311 VanDerWaalsContact NE2-OH 3.08Å
1116	I	83	Confident	82	Confident	5 Å²	5	25.9 Å²	25.9	3%	0.026	13%	0.127	C	C	.	.	H	α-helix	trans	-77.4	-44.9	179.5	-63.4	158.7	0	0	0	110.3	I1029 L1032 T1035 L1067 V1071 R1112 L1113 M1114	I1029-I1116 HydrophobicContact CG2-CD1 4.43Å; L1032-I1116 HydrophobicContact CB-CD1 3.6Å; L1032-I1116 HydrophobicContact CB-CG1 4.16Å; L1032-I1116 HydrophobicContact CD1-CD1 3.88Å; L1032-I1116 HydrophobicContact CG-CD1 4.39Å; T1035-I1116 VanDerWaalsContact CG2-O 3.27Å; T1035-I1116 WeakPolarHBondContact CG2-O 3.28Å; L1067-I1116 HydrophobicContact CB-CG2 4.21Å; L1067-I1116 HydrophobicContact CD1-CG2 3.99Å; L1067-I1116 HydrophobicContact CD2-CG2 4.24Å; L1067-I1116 HydrophobicContact CG-CG2 4.39Å; V1071-I1116 HydrophobicContact CG2-CG2 4.47Å; R1112-I1116 HydrophobicContact CG-CD1 4.16Å; R1112-I1116 WeakPolarHBondContact O-CD1 3.3Å; R1112-I1116 VanDerWaalsContact O-CG1 3.27Å; R1112-I1116 WeakPolarHBondContact O-CG1 3.36Å; R1112-I1116 PolarHBondContact O-N 2.88Å; R1112-I1116 VanDerWaalsContact O-N 3.16Å; L1113-I1116 WeakPolarHBondContact O-CB 3.31Å; L1113-I1116 PolarHBondContact O-N 3.44Å; L1113-I1116 VanDerWaalsContact O-N 3.14Å; M1114-I1116 PolarHBondContact O-N 3.22Å
1117	A	83.7	Confident	81.7	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.008	15%	0.147	C	C	.	.			trans	-130.2	87.8	-179.2	0	0	0	0	0	111.1	E1068 V1071 L1113 M1114 F1119 A1120	E1068-A1117 HydrophobicContact CB-CB 4.38Å; E1068-A1117 HydrophobicContact CG-CB 3.99Å; V1071-A1117 HydrophobicContact CB-CB 3.81Å; V1071-A1117 HydrophobicContact CG1-CB 4.07Å; V1071-A1117 HydrophobicContact CG2-CB 3.77Å; L1113-A1117 PolarHBondContact O-N 3.29Å; M1114-A1117 CarbonylContact O-C 3.34Å; A1117-F1119 PolarHBondContact O-N 3.41Å; A1117-F1119 VanDerWaalsContact O-N 3.14Å; A1117-A1120 HydrophobicContact CB-CB 4.21Å; A1117-A1120 PolarHBondContact O-N 3.31Å
1118	P	76.1	Confident	81.4	Confident	28 Å²	28	33.2 Å²	33.2	18%	0.182	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.6	-176.8	-21.6	32.5	0	0	0	114.5	T1035 M1114	T1035-P1118 HydrophobicContact CG2-CG 4.25Å; M1114-P1118 WeakPolarHBondContact O-CA 3.14Å
1119	F	77.6	Confident	81.2	Confident	114 Å²	114	30.3 Å²	30.3	50%	0.5	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-10.8	-178.3	-63.6	-102.1	0	0	0	113.7	E1068 A1117 R1313	E1068-F1119 WeakPolarHBondContact OE1-CD2 3.43Å; E1068-F1119 WeakPolarHBondContact OE1-CG 3.45Å; A1117-F1119 PolarHBondContact O-N 3.41Å; A1117-F1119 VanDerWaalsContact O-N 3.14Å; F1119-R1313 VanDerWaalsContact CE1-NH1 3.28Å
1120	A	80.4	Confident	80.8	Confident	2 Å²	2	29.5 Å²	29.5	2%	0.017	14%	0.141	C	C	.	.	S	Bend	trans	-66.4	150.2	176.1	0	0	0	0	0	111	V1071 F1075 M1114 A1117 P1122	V1071-A1120 HydrophobicContact CB-CB 4.32Å; V1071-A1120 HydrophobicContact CG1-CB 3.66Å; F1075-A1120 HydrophobicContact CD2-CB 4.01Å; F1075-A1120 HydrophobicContact CE2-CB 3.54Å; F1075-A1120 HydrophobicContact CZ-CB 4.46Å; M1114-A1120 WeakPolarHBondContact CE-O 3.31Å; M1114-A1120 HydrophobicContact SD-CB 4.46Å; A1117-A1120 HydrophobicContact CB-CB 4.21Å; A1117-A1120 PolarHBondContact O-N 3.31Å; A1120-P1122 WeakPolarHBondContact O-CD 3.47Å
1121	N	80.3	Confident	80.3	Confident	91 Å²	91	35.3 Å²	35.3	49%	0.487	17%	0.166	S	C	.	.			trans	-106.5	101.9	-173.7	-174.6	-2.2	0	0	0	112.5	I1123	N1121-I1123 WeakPolarHBondContact OD1-CB 3.41Å; N1121-I1123 VanDerWaalsContact OD1-CD1 3.24Å; N1121-I1123 WeakPolarHBondContact OD1-CD1 3.49Å; N1121-I1123 WeakPolarHBondContact OD1-CG1 3.25Å; N1121-I1123 PolarHBondContact OD1-N 3.13Å
1122	P	80.4	Confident	79.9	Confident	1 Å²	1	35 Å²	35	1%	0.006	16%	0.163	C	C	.	.			trans	-87.4	1.2	178.1	35.5	-37.1	0	0	0	114.2	F1075 M1114 A1120 N1124 I1125 L1126 V1308	F1075-P1122 HydrophobicContact CD2-CB 4.35Å; F1075-P1122 HydrophobicContact CE2-CB 4.06Å; F1075-P1122 HydrophobicContact CZ-CB 4.46Å; M1114-P1122 HydrophobicContact SD-CB 4.39Å; M1114-P1122 HydrophobicContact SD-CG 3.85Å; A1120-P1122 WeakPolarHBondContact O-CD 3.47Å; P1122-N1124 VanDerWaalsContact C-N 3.33Å; P1122-N1124 PolarHBondContact O-N 3.23Å; P1122-I1125 PolarHBondContact O-N 3.25Å; P1122-L1126 HydrophobicContact CB-CD1 4.38Å; P1122-L1126 HydrophobicContact CG-CD1 4.32Å; P1122-L1126 PolarHBondContact O-N 3.38Å; P1122-L1126 VanDerWaalsContact O-N 3.16Å; P1122-V1308 HydrophobicContact CB-CG1 4.28Å; P1122-V1308 HydrophobicContact CG-CG1 3.92Å
1123	I	79	Confident	79.3	Confident	21 Å²	21	33 Å²	33	11%	0.108	16%	0.157	C	C	.	.	H	α-helix	trans	-56.6	-43.5	-166.3	-69	166.8	0	0	0	112.4	N1121 L1126 R1127 T1316 A1319 V1320 I1323	N1121-I1123 WeakPolarHBondContact OD1-CB 3.41Å; N1121-I1123 VanDerWaalsContact OD1-CD1 3.24Å; N1121-I1123 WeakPolarHBondContact OD1-CD1 3.49Å; N1121-I1123 WeakPolarHBondContact OD1-CG1 3.25Å; N1121-I1123 PolarHBondContact OD1-N 3.13Å; I1123-L1126 PolarHBondContact O-N 2.99Å; I1123-R1127 VanDerWaalsContact O-CB 3.29Å; I1123-R1127 WeakPolarHBondContact O-CB 3.41Å; I1123-R1127 PolarHBondContact O-N 3.08Å; I1123-T1316 HydrophobicContact CD1-CG2 3.77Å; I1123-T1316 HydrophobicContact CG1-CG2 3.65Å; I1123-A1319 HydrophobicContact CD1-CB 3.67Å; I1123-V1320 HydrophobicContact CG1-CG2 4.03Å; I1123-I1323 HydrophobicContact CG2-CD1 3.62Å
1124	N	80.4	Confident	78.3	Confident	66 Å²	66	36.8 Å²	36.8	35%	0.353	17%	0.171	S	C	.	.	H	α-helix	trans	-66.4	-41.4	-175	-69.4	-12.9	0	0	0	112.4	E1079 P1122 R1127 L1128	E1079-N1124 HydrophobicContact CG-CB 4.24Å; E1079-N1124 WeakPolarHBondContact OE1-CB 3.45Å; E1079-N1124 PolarHBondContact OE1-ND2 3.25Å; E1079-N1124 WeakPolarHBondContact OE2-CB 3.42Å; E1079-N1124 PolarHBondContact OE2-ND2 3.28Å; P1122-N1124 VanDerWaalsContact C-N 3.33Å; P1122-N1124 PolarHBondContact O-N 3.23Å; N1124-R1127 PolarHBondContact O-N 3.44Å; N1124-L1128 WeakPolarHBondContact O-CG 3.4Å; N1124-L1128 PolarHBondContact O-N 3.47Å
1125	I	83	Confident	77.1	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.015	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-48	176.5	-58.7	169.2	0	0	0	109.8	F1075 L1078 E1079 L1110 P1122 R1127 L1128 L1129	F1075-I1125 HydrophobicContact CB-CD1 3.73Å; F1075-I1125 HydrophobicContact CD1-CD1 4.18Å; F1075-I1125 HydrophobicContact CG-CD1 4.1Å; F1075-I1125 WeakPolarHBondContact O-CD1 3.38Å; L1078-I1125 HydrophobicContact CB-CD1 4.22Å; L1078-I1125 HydrophobicContact CD2-CD1 4.26Å; L1078-I1125 HydrophobicContact CD2-CG2 4.47Å; E1079-I1125 HydrophobicContact CB-CG1 3.9Å; L1110-I1125 HydrophobicContact CD1-CG2 4.43Å; L1110-I1125 HydrophobicContact CD2-CD1 4.37Å; P1122-I1125 PolarHBondContact O-N 3.25Å; I1125-R1127 VanDerWaalsContact C-N 3.3Å; I1125-R1127 PolarHBondContact O-N 3.44Å; I1125-L1128 PolarHBondContact O-N 3.35Å; I1125-L1129 HydrophobicContact CG2-CD1 3.99Å; I1125-L1129 HydrophobicContact CG2-CG 4.39Å; I1125-L1129 WeakPolarHBondContact O-CG 3.33Å; I1125-L1129 PolarHBondContact O-N 2.96Å
1126	L	80.1	Confident	75.5	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-43.2	177.7	-66.1	175.5	0	0	0	110.9	P1122 I1123 L1128 L1129 I1130 T1305 V1308 V1320	P1122-L1126 HydrophobicContact CB-CD1 4.38Å; P1122-L1126 HydrophobicContact CG-CD1 4.32Å; P1122-L1126 PolarHBondContact O-N 3.38Å; P1122-L1126 VanDerWaalsContact O-N 3.16Å; I1123-L1126 PolarHBondContact O-N 2.99Å; L1126-L1128 PolarHBondContact O-N 3.25Å; L1126-L1129 PolarHBondContact O-N 3.22Å; L1126-I1130 WeakPolarHBondContact O-CB 3.45Å; L1126-I1130 WeakPolarHBondContact O-CD1 3.38Å; L1126-I1130 WeakPolarHBondContact O-CG1 3.16Å; L1126-I1130 PolarHBondContact O-N 2.91Å; L1126-T1305 HydrophobicContact CD1-CG2 4.42Å; L1126-T1305 HydrophobicContact CD2-CG2 4.39Å; L1126-V1308 HydrophobicContact CD1-CG1 4.14Å; L1126-V1320 HydrophobicContact CD1-CG2 4.1Å
1127	R	79.9	Confident	73.7	Confident	119 Å²	119	48.3 Å²	48.3	45%	0.449	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-44.1	177	-170.2	-178	-102.3	145.6	-7.9	111.7	I1123 N1124 I1125 K1131 I1323	I1123-R1127 VanDerWaalsContact O-CB 3.29Å; I1123-R1127 WeakPolarHBondContact O-CB 3.41Å; I1123-R1127 PolarHBondContact O-N 3.08Å; N1124-R1127 PolarHBondContact O-N 3.44Å; I1125-R1127 VanDerWaalsContact C-N 3.3Å; I1125-R1127 PolarHBondContact O-N 3.44Å; R1127-K1131 WeakPolarHBondContact O-CB 3.32Å; R1127-K1131 PolarHBondContact O-N 3.04Å; R1127-I1323 HydrophobicContact CB-CD1 4.13Å; R1127-I1323 HydrophobicContact CG-CD1 4.22Å; R1127-I1323 HydrophobicContact CG-CG2 4.38Å
1128	L	77.1	Confident	71.7	Confident	43 Å²	43	54.2 Å²	54.2	23%	0.225	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-49.2	176.5	-76.1	171.6	0	0	0	111.3	E1079 V1082 N1124 I1125 L1126 K1131 D1132	E1079-L1128 HydrophobicContact CG-CD1 3.71Å; V1082-L1128 HydrophobicContact CG1-CB 4.38Å; N1124-L1128 WeakPolarHBondContact O-CG 3.4Å; N1124-L1128 PolarHBondContact O-N 3.47Å; I1125-L1128 PolarHBondContact O-N 3.35Å; L1126-L1128 PolarHBondContact O-N 3.25Å; L1128-K1131 PolarHBondContact O-N 3.48Å; L1128-D1132 WeakPolarHBondContact O-CB 3.35Å; L1128-D1132 PolarHBondContact O-N 2.91Å
1129	L	78.5	Confident	69.8	Low	0 Å²	0	60 Å²	60	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-45.5	179.5	-67.1	175.3	0	0	0	111.8	W1100 I1125 L1126 D1132 V1133 V1301 L1304	W1100-L1129 HydrophobicContact CH2-CD2 3.9Å; W1100-L1129 HydrophobicContact CZ3-CD2 3.77Å; I1125-L1129 HydrophobicContact CG2-CD1 3.99Å; I1125-L1129 HydrophobicContact CG2-CG 4.39Å; I1125-L1129 WeakPolarHBondContact O-CG 3.33Å; I1125-L1129 PolarHBondContact O-N 2.96Å; L1126-L1129 PolarHBondContact O-N 3.22Å; L1129-D1132 PolarHBondContact O-N 3.43Å; L1129-V1133 WeakPolarHBondContact O-CG2 3.27Å; L1129-V1133 PolarHBondContact O-N 3.37Å; L1129-V1133 VanDerWaalsContact O-N 3.13Å; L1129-V1301 HydrophobicContact CB-CG1 3.91Å; L1129-V1301 HydrophobicContact CB-CG2 4.33Å; L1129-L1304 HydrophobicContact CD1-CD2 4.44Å
1130	I	75.9	Confident	67.6	Low	17 Å²	17	59.3 Å²	59.3	9%	0.087	30%	0.3	C	S	.	.	H	α-helix	trans	-63.8	-44.3	178.7	-68.2	164.7	0	0	0	111	L1126 D1132 V1133 R1134 V1301 T1305 L1324 F1327	L1126-I1130 WeakPolarHBondContact O-CB 3.45Å; L1126-I1130 WeakPolarHBondContact O-CD1 3.38Å; L1126-I1130 WeakPolarHBondContact O-CG1 3.16Å; L1126-I1130 PolarHBondContact O-N 2.91Å; I1130-D1132 VanDerWaalsContact C-N 3.27Å; I1130-D1132 PolarHBondContact O-N 3.35Å; I1130-V1133 PolarHBondContact O-N 3.37Å; I1130-R1134 PolarHBondContact O-N 2.86Å; I1130-R1134 VanDerWaalsContact O-N 3.07Å; I1130-V1301 HydrophobicContact CG1-CG1 4.09Å; I1130-T1305 HydrophobicContact CD1-CG2 4.41Å; I1130-L1324 HydrophobicContact CD1-CD2 4.03Å; I1130-F1327 HydrophobicContact CG2-CD2 4.48Å
1131	K	76.4	Confident	65.3	Low	122 Å²	122	66 Å²	66	53%	0.53	34%	0.341	S	S	.	.	H	α-helix	trans	-61	-38.3	176.4	-174.5	179.6	-179.7	-176.1	0	111.4	R1127 L1128 N1135	R1127-K1131 WeakPolarHBondContact O-CB 3.32Å; R1127-K1131 PolarHBondContact O-N 3.04Å; L1128-K1131 PolarHBondContact O-N 3.48Å; K1131-N1135 PolarHBondContact O-ND2 3.35Å
1132	D	73.2	Confident	62.8	Low	5 Å²	5	68.3 Å²	68.3	3%	0.027	35%	0.354	C	S	.	.	H	α-helix	trans	-69.1	-36.2	-178	-146.7	50.2	0	0	0	112.4	N1086 R1093 I1094 C1095 L1128 L1129 I1130	N1086-D1132 PolarHBondContact OD1-OD1 3.13Å; R1093-D1132 WeakPolarHBondContact CB-OD2 3.42Å; R1093-D1132 VanDerWaalsContact CD-CG 3.49Å; R1093-D1132 WeakPolarHBondContact CD-O 3.38Å; R1093-D1132 WeakPolarHBondContact CD-OD1 3.22Å; R1093-D1132 IonicContact CZ-OD1 2.87Å; R1093-D1132 IonicContact NE-OD1 3.3Å; R1093-D1132 IonicContact NH1-OD1 2.8Å; R1093-D1132 PolarHBondContact NH1-OD1 3.09Å; I1094-D1132 WeakPolarHBondContact CG2-OD2 3.22Å; I1094-D1132 PolarHBondContact N-OD2 2.95Å; C1095-D1132 PolarHBondContact N-OD2 3.05Å; L1128-D1132 WeakPolarHBondContact O-CB 3.35Å; L1128-D1132 PolarHBondContact O-N 2.91Å; L1129-D1132 PolarHBondContact O-N 3.43Å; I1130-D1132 VanDerWaalsContact C-N 3.27Å; I1130-D1132 PolarHBondContact O-N 3.35Å
1133	V	68.9	Low	60.4	Low	10 Å²	10	74.8 Å²	74.8	6%	0.061	39%	0.393	C	S	.	.	H	α-helix	trans	-76.8	-36.2	176.7	-172.6	0	0	0	0	113.1	C1095 L1129 I1130 N1135 K1136 A1297 L1298 V1301	C1095-V1133 HydrophobicContact CB-CG2 4.25Å; L1129-V1133 WeakPolarHBondContact O-CG2 3.27Å; L1129-V1133 PolarHBondContact O-N 3.37Å; L1129-V1133 VanDerWaalsContact O-N 3.13Å; I1130-V1133 PolarHBondContact O-N 3.37Å; V1133-N1135 PolarHBondContact O-N 2.91Å; V1133-K1136 VanDerWaalsContact O-CB 3.3Å; V1133-K1136 WeakPolarHBondContact O-CB 3.41Å; V1133-K1136 PolarHBondContact O-N 2.78Å; V1133-A1297 HydrophobicContact CG2-CB 4.14Å; V1133-L1298 HydrophobicContact CB-CD1 4.13Å; V1133-L1298 VanDerWaalsContact CG1-CA 3.48Å; V1133-L1298 HydrophobicContact CG1-CB 3.42Å; V1133-L1298 VanDerWaalsContact CG1-CB 3.42Å; V1133-L1298 HydrophobicContact CG1-CD1 3.38Å; V1133-L1298 HydrophobicContact CG1-CG 3.93Å; V1133-V1301 HydrophobicContact CG2-CB 4.29Å; V1133-V1301 HydrophobicContact CG2-CG2 3.96Å
1134	R	63.1	Low	58	Low	84 Å²	84	83 Å²	83	32%	0.317	43%	0.428	S	S	.	.	H	α-helix	trans	-65	-34.1	-174.4	-168	-175.8	-168.2	-155.3	8.8	114.1	I1130 K1136 S1137 D1328	I1130-R1134 PolarHBondContact O-N 2.86Å; I1130-R1134 VanDerWaalsContact O-N 3.07Å; R1134-K1136 PolarHBondContact O-N 3.26Å; R1134-S1137 PolarHBondContact O-N 3.34Å; R1134-S1137 PolarHBondContact O-OG 3.22Å; R1134-D1328 PolarHBondContact NH2-O 2.95Å
1135	N	59.8	Low	55.6	Low	61 Å²	61	87.8 Å²	87.8	33%	0.326	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-65.1	-5.4	-177.4	-72.1	-50.1	0	0	0	113.8	R1093 K1131 V1133 S1137	R1093-N1135 PolarHBondContact NH1-ND2 3.49Å; R1093-N1135 VanDerWaalsContact NH2-CG 3.28Å; R1093-N1135 PolarHBondContact NH2-ND2 3.17Å; K1131-N1135 PolarHBondContact O-ND2 3.35Å; V1133-N1135 PolarHBondContact O-N 2.91Å; N1135-S1137 VanDerWaalsContact C-N 3.26Å; N1135-S1137 PolarHBondContact O-N 3.06Å
1136	K	48.6	Very low	52.9	Low	133 Å²	133	94.2 Å²	94.2	58%	0.578	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-68.7	-18	168.5	-136.8	174.6	-172.1	-179.9	0	113.8	V1133 R1134	V1133-K1136 VanDerWaalsContact O-CB 3.3Å; V1133-K1136 WeakPolarHBondContact O-CB 3.41Å; V1133-K1136 PolarHBondContact O-N 2.78Å; R1134-K1136 PolarHBondContact O-N 3.26Å
1137	S	45.7	Very low	50.6	Low	92 Å²	92	101.3 Å²	101.3	64%	0.643	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-85.7	-7.7	-178	66.5	0	0	0	0	115.3	R1134 N1135	R1134-S1137 PolarHBondContact O-N 3.34Å; R1134-S1137 PolarHBondContact O-OG 3.22Å; N1135-S1137 VanDerWaalsContact C-N 3.26Å; N1135-S1137 PolarHBondContact O-N 3.06Å
1138	I	42.5	Very low	48	Very low	124 Å²	124	98.9 Å²	98.9	64%	0.636	54%	0.538	S	S	*	.			trans	-117.6	14.7	-170.1	-45.9	176.1	0	0	0	112.6	P1140	I1138-P1140 WeakPolarHBondContact O-CD 3.43Å
1139	L	36.2	Very low	45.7	Very low	151 Å²	151	106.2 Å²	106.2	79%	0.791	57%	0.571	S	S	*	*			trans	-80.3	116	172.8	-145.4	80	0	0	0	109.6	T1141	L1139-T1141 PolarHBondContact O-N 3.39Å
1140	P	31.3	Very low	43.6	Very low	98 Å²	98	115.4 Å²	115.4	64%	0.636	61%	0.614	S	S	*	*			trans	-69.6	134.6	-178.8	28.5	-30.6	0	0	0	109.4	I1138 N1142	I1138-P1140 WeakPolarHBondContact O-CD 3.43Å; P1140-N1142 PolarHBondContact O-N 3.31Å
1141	T	31.4	Very low	41.6	Very low	142 Å²	142	120 Å²	120	87%	0.871	64%	0.643	S	S	*	*	S	Bend	trans	-66.8	37.2	178.8	37.7	0	0	0	0	114.4	L1139	L1139-T1141 PolarHBondContact O-N 3.39Å
1142	N	27.6	Very low	39.7	Very low	141 Å²	141	120.7 Å²	120.7	75%	0.754	66%	0.657	S	S	*	*			trans	-131.8	79.1	179.2	-82	-24.4	0	0	0	111.4	P1140	P1140-N1142 PolarHBondContact O-N 3.31Å
1143	T	30.6	Very low	38	Very low	137 Å²	137	128 Å²	128	84%	0.84	69%	0.691	S	S	*	*			trans	-152.7	83.1	148.1	-7.6	0	0	0	0	108.9
1144	K	28.5	Very low	36.5	Very low	194 Å²	194	131.8 Å²	131.8	84%	0.843	72%	0.716	S	S	*	*			trans	-70.1	147.3	151	-79.2	179.8	173.8	177.4	0	107.5
1145	Q	28.9	Very low	35.6	Very low	166 Å²	166	131.8 Å²	131.8	78%	0.776	73%	0.725	S	S	*	*			trans	79.3	127	174.6	-54.9	176.7	-9.5	0	0	112.8
1146	N	26.8	Very low	34.9	Very low	138 Å²	138	134.8 Å²	134.8	74%	0.738	74%	0.735	S	S	*	*			cis	-161	130.6	12.6	-87	-32.3	0	0	0	106.9
1147	T	31	Very low	34.4	Very low	151 Å²	151	133.3 Å²	133.3	93%	0.926	73%	0.726	S	S	*	*			trans	-169	124.1	140.8	27.5	0	0	0	0	108.5
1148	G	25.8	Very low	34.4	Very low	67 Å²	67	132.6 Å²	132.6	69%	0.691	72%	0.718	S	S	*	*			trans	-76.9	164.3	-175.7	0	0	0	0	0	114.1
1149	H	30.2	Very low	34.6	Very low	198 Å²	198	133.7 Å²	133.7	92%	0.917	71%	0.714	S	S	*	*			trans	52.7	80.6	164	-63.9	-66.7	0	0	0	116.9
1150	Q	32.9	Very low	34.9	Very low	192 Å²	192	127.5 Å²	127.5	90%	0.897	69%	0.685	S	S	*	*			trans	-129.2	135.7	146.8	-76.2	-172.2	-2.3	0	0	111.1
1151	T	34.1	Very low	35.5	Very low	114 Å²	114	125.3 Å²	125.3	70%	0.699	67%	0.667	S	S	*	*			trans	-52.7	148.9	-166.8	37.1	0	0	0	0	116.6	E1153 P1154	T1151-E1153 PolarHBondContact O-N 3.5Å; T1151-P1154 VanDerWaalsContact O-CD 3.22Å; T1151-P1154 WeakPolarHBondContact O-CD 3.29Å
1152	V	37.1	Very low	36.5	Very low	137 Å²	137	124.4 Å²	124.4	83%	0.83	65%	0.653	S	S	*	*	S	Bend	trans	-73.6	16.7	-174.7	178.3	0	0	0	0	113.9
1153	E	36.8	Very low	37.7	Very low	158 Å²	158	122.9 Å²	122.9	74%	0.738	64%	0.638	S	S	*	*			trans	-79.3	-19.5	-179.6	-77.7	-157.7	135.6	0	0	118.3	T1151 T1155	T1151-E1153 PolarHBondContact O-N 3.5Å; E1153-T1155 VanDerWaalsContact C-N 3.26Å; E1153-T1155 PolarHBondContact O-N 3.15Å; E1153-T1155 VanDerWaalsContact O-N 3.14Å
1154	P	38	Very low	38.4	Very low	90 Å²	90	117.8 Å²	117.8	58%	0.584	61%	0.613	S	S	*	*	H	α-helix	trans	-74.3	-13.6	-166.6	27.4	-31.5	0	0	0	114	T1151 T1158	T1151-P1154 VanDerWaalsContact O-CD 3.22Å; T1151-P1154 WeakPolarHBondContact O-CD 3.29Å; P1154-T1158 PolarHBondContact O-OG1 3.41Å
1155	T	44.8	Very low	39.4	Very low	83 Å²	83	111.9 Å²	111.9	51%	0.509	59%	0.59	S	S	.	*	H	α-helix	trans	-82.1	-24.4	-171.8	49	0	0	0	0	115.1	E1153	E1153-T1155 VanDerWaalsContact C-N 3.26Å; E1153-T1155 PolarHBondContact O-N 3.15Å; E1153-T1155 VanDerWaalsContact O-N 3.14Å
1156	K	43.3	Very low	40.7	Very low	125 Å²	125	110.8 Å²	110.8	54%	0.543	58%	0.584	S	S	.	*	H	α-helix	trans	-72.4	-39.9	179.7	-71.7	-178	-179.4	175.4	0	112.3	A1160	K1156-A1160 PolarHBondContact O-N 3.13Å
1157	W	39.4	Very low	41.8	Very low	102 Å²	102	107.5 Å²	107.5	39%	0.386	57%	0.565	S	S	.	*	H	α-helix	trans	-70.3	-38.6	176.4	-75.9	97.8	0	0	0	111.7	R1159 A1160 L1161 K1195	W1157-R1159 VanDerWaalsContact C-N 3.31Å; W1157-R1159 PolarHBondContact O-N 3.22Å; W1157-A1160 PolarHBondContact O-N 3.48Å; W1157-L1161 HydrophobicContact CB-CD1 4.42Å; W1157-L1161 WeakPolarHBondContact O-CB 3.38Å; W1157-L1161 VanDerWaalsContact O-CD1 3.29Å; W1157-L1161 WeakPolarHBondContact O-CD1 3.44Å; W1157-L1161 WeakPolarHBondContact O-CG 3.42Å; W1157-L1161 PolarHBondContact O-N 3.45Å; W1157-K1195 HydrophobicContact CH2-CD 4.38Å
1158	T	45.7	Very low	42.5	Very low	76 Å²	76	101.9 Å²	101.9	47%	0.466	53%	0.534	S	S	.	.	H	α-helix	trans	-59	-41.3	-179.7	-18.2	0	0	0	0	112.3	P1154 L1161 E1162	P1154-T1158 PolarHBondContact O-OG1 3.41Å; T1158-L1161 WeakPolarHBondContact O-CB 3.45Å; T1158-L1161 PolarHBondContact O-N 3.13Å; T1158-E1162 PolarHBondContact O-N 2.89Å
1159	R	46.8	Very low	43.8	Very low	147 Å²	147	104.2 Å²	104.2	56%	0.555	53%	0.525	S	S	*	.	H	α-helix	trans	-71.9	-39.2	178.1	-74.9	-174.8	-178.5	175.5	1.4	113.4	W1157 L1161 E1162 Y1163	W1157-R1159 VanDerWaalsContact C-N 3.31Å; W1157-R1159 PolarHBondContact O-N 3.22Å; R1159-L1161 PolarHBondContact O-N 3.19Å; R1159-E1162 PolarHBondContact O-N 3.47Å; R1159-Y1163 WeakPolarHBondContact O-CB 3.35Å; R1159-Y1163 PolarHBondContact O-N 3.39Å
1160	A	42.5	Very low	44.9	Very low	21 Å²	21	97.4 Å²	97.4	17%	0.174	50%	0.5	C	S	.	.	H	α-helix	trans	-63.3	-31.3	172.9	0	0	0	0	0	112.6	K1156 W1157 G1164 I1198	K1156-A1160 PolarHBondContact O-N 3.13Å; W1157-A1160 PolarHBondContact O-N 3.48Å; A1160-G1164 PolarHBondContact O-N 3.46Å; A1160-I1198 HydrophobicContact CB-CD1 3.69Å
1161	L	43.5	Very low	45.7	Very low	53 Å²	53	93.4 Å²	93.4	28%	0.277	48%	0.479	S	S	.	.	H	α-helix	trans	-75.1	-41.3	174.1	-85.6	149.7	0	0	0	113.5	W1157 T1158 R1159 Y1163 G1164 L1165 V1293	W1157-L1161 HydrophobicContact CB-CD1 4.42Å; W1157-L1161 WeakPolarHBondContact O-CB 3.38Å; W1157-L1161 VanDerWaalsContact O-CD1 3.29Å; W1157-L1161 WeakPolarHBondContact O-CD1 3.44Å; W1157-L1161 WeakPolarHBondContact O-CG 3.42Å; W1157-L1161 PolarHBondContact O-N 3.45Å; T1158-L1161 WeakPolarHBondContact O-CB 3.45Å; T1158-L1161 PolarHBondContact O-N 3.13Å; R1159-L1161 PolarHBondContact O-N 3.19Å; L1161-Y1163 VanDerWaalsContact C-N 3.27Å; L1161-Y1163 PolarHBondContact O-N 3.23Å; L1161-G1164 PolarHBondContact O-N 2.96Å; L1161-L1165 WeakPolarHBondContact O-CB 3.39Å; L1161-L1165 PolarHBondContact O-N 3.33Å; L1161-V1293 HydrophobicContact CD1-CB 3.46Å; L1161-V1293 VanDerWaalsContact CD1-CB 3.46Å; L1161-V1293 HydrophobicContact CD1-CG1 3.67Å; L1161-V1293 HydrophobicContact CD1-CG2 3.35Å; L1161-V1293 HydrophobicContact CD2-CB 3.66Å; L1161-V1293 HydrophobicContact CD2-CG1 3.97Å; L1161-V1293 HydrophobicContact CD2-CG2 4.42Å; L1161-V1293 HydrophobicContact CG-CB 4.21Å; L1161-V1293 HydrophobicContact CG-CG1 4.43Å; L1161-V1293 HydrophobicContact CG-CG2 4.5Å
1162	E	52.3	Low	46.1	Very low	123 Å²	123	92.9 Å²	92.9	58%	0.575	47%	0.47	S	S	*	.	H	α-helix	trans	-60	-40	171.6	-80.6	178.8	158.2	0	0	111.5	T1158 R1159 L1165 Q1166	T1158-E1162 PolarHBondContact O-N 2.89Å; R1159-E1162 PolarHBondContact O-N 3.47Å; E1162-L1165 PolarHBondContact O-N 2.78Å; E1162-Q1166 WeakPolarHBondContact O-CB 3.5Å; E1162-Q1166 PolarHBondContact O-N 3.21Å
1163	Y	52.1	Low	46.8	Very low	109 Å²	109	94.3 Å²	94.3	43%	0.427	47%	0.468	S	S	.	.	H	α-helix	trans	-64	-47.9	174.7	-177.7	-89.9	0	0	0	111.8	R1159 L1161 L1165 Q1166 E1167 A1194 I1198	R1159-Y1163 WeakPolarHBondContact O-CB 3.35Å; R1159-Y1163 PolarHBondContact O-N 3.39Å; L1161-Y1163 VanDerWaalsContact C-N 3.27Å; L1161-Y1163 PolarHBondContact O-N 3.23Å; Y1163-L1165 VanDerWaalsContact C-N 3.31Å; Y1163-L1165 PolarHBondContact O-N 3.22Å; Y1163-Q1166 PolarHBondContact O-N 2.67Å; Y1163-E1167 WeakPolarHBondContact CE1-OE2 3.45Å; Y1163-E1167 VanDerWaalsContact CZ-OE2 3.22Å; Y1163-E1167 PolarHBondContact O-N 3.05Å; Y1163-E1167 PolarHBondContact OH-OE2 3.22Å; Y1163-A1194 HydrophobicContact CD1-CB 3.95Å; Y1163-A1194 HydrophobicContact CE1-CB 4.04Å; Y1163-I1198 HydrophobicContact CG-CD1 4.29Å
1164	G	46.6	Very low	47.5	Very low	30 Å²	30	92.6 Å²	92.6	31%	0.309	47%	0.468	S	S	.	.	H	α-helix	trans	-60.3	-37.4	175.2	0	0	0	0	0	113.5	A1160 L1161 A1168	A1160-G1164 PolarHBondContact O-N 3.46Å; L1161-G1164 PolarHBondContact O-N 2.96Å; G1164-A1168 VanDerWaalsContact O-CB 3.32Å; G1164-A1168 WeakPolarHBondContact O-CB 3.37Å; G1164-A1168 PolarHBondContact O-N 3.44Å
1165	L	48.8	Very low	47.7	Very low	70 Å²	70	95.6 Å²	95.6	37%	0.366	47%	0.471	S	S	.	.	H	α-helix	trans	-67.2	-42.2	173.9	-92.8	155.8	0	0	0	112.6	L1161 E1162 Y1163 K1169	L1161-L1165 WeakPolarHBondContact O-CB 3.39Å; L1161-L1165 PolarHBondContact O-N 3.33Å; E1162-L1165 PolarHBondContact O-N 2.78Å; Y1163-L1165 VanDerWaalsContact C-N 3.31Å; Y1163-L1165 PolarHBondContact O-N 3.22Å; L1165-K1169 WeakPolarHBondContact O-CB 3.45Å; L1165-K1169 WeakPolarHBondContact O-CG 3.31Å; L1165-K1169 PolarHBondContact O-N 3.39Å
1166	Q	56.3	Low	47.3	Very low	142 Å²	142	95.3 Å²	95.3	66%	0.664	49%	0.485	S	S	*	.	H	α-helix	trans	-65.6	-42.1	175.2	-84.6	-173.2	-11.3	0	0	111.8	E1162 Y1163 K1169 S1170	E1162-Q1166 WeakPolarHBondContact O-CB 3.5Å; E1162-Q1166 PolarHBondContact O-N 3.21Å; Y1163-Q1166 PolarHBondContact O-N 2.67Å; Q1166-K1169 PolarHBondContact O-N 3.45Å; Q1166-S1170 WeakPolarHBondContact O-CB 3.38Å; Q1166-S1170 PolarHBondContact O-N 3.29Å
1167	E	49.9	Very low	47.2	Very low	69 Å²	69	95 Å²	95	32%	0.322	50%	0.498	S	S	.	.	H	α-helix	trans	-69.7	-37.2	-179.5	-155.7	171.6	146	0	0	111.4	Y1163 S1170 K1171	Y1163-E1167 WeakPolarHBondContact CE1-OE2 3.45Å; Y1163-E1167 VanDerWaalsContact CZ-OE2 3.22Å; Y1163-E1167 PolarHBondContact O-N 3.05Å; Y1163-E1167 PolarHBondContact OH-OE2 3.22Å; E1167-S1170 PolarHBondContact O-N 3.15Å; E1167-S1170 PolarHBondContact O-OG 3.2Å; E1167-K1171 WeakPolarHBondContact O-CG 3.48Å; E1167-K1171 PolarHBondContact O-N 3.16Å; E1167-K1171 IonicContact OE1-NZ 2.61Å; E1167-K1171 PolarHBondContact OE1-NZ 2.81Å
1168	A	45.7	Very low	46.9	Very low	33 Å²	33	93.2 Å²	93.2	27%	0.273	50%	0.502	S	S	.	.	H	α-helix	trans	-62.9	-46.4	170.3	0	0	0	0	0	112.4	G1164 S1170 K1171 M1172	G1164-A1168 VanDerWaalsContact O-CB 3.32Å; G1164-A1168 WeakPolarHBondContact O-CB 3.37Å; G1164-A1168 PolarHBondContact O-N 3.44Å; A1168-S1170 VanDerWaalsContact C-N 3.3Å; A1168-S1170 PolarHBondContact O-N 3.17Å; A1168-K1171 PolarHBondContact O-N 3.46Å; A1168-M1172 WeakPolarHBondContact O-CG 3.38Å; A1168-M1172 PolarHBondContact O-N 2.97Å
1169	K	52.4	Low	46.4	Very low	117 Å²	117	94 Å²	94	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-59.4	-39.4	174.3	-83.5	-178.2	176.3	176.2	0	111.9	L1165 Q1166 M1172 Q1173	L1165-K1169 WeakPolarHBondContact O-CB 3.45Å; L1165-K1169 WeakPolarHBondContact O-CG 3.31Å; L1165-K1169 PolarHBondContact O-N 3.39Å; Q1166-K1169 PolarHBondContact O-N 3.45Å; K1169-M1172 PolarHBondContact O-N 2.68Å; K1169-Q1173 PolarHBondContact O-N 3.07Å
1170	S	54.9	Low	45.7	Very low	55 Å²	55	92.7 Å²	92.7	39%	0.385	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-42.4	177	79.5	0	0	0	0	112.3	Q1166 E1167 A1168 M1172 Q1173 V1174	Q1166-S1170 WeakPolarHBondContact O-CB 3.38Å; Q1166-S1170 PolarHBondContact O-N 3.29Å; E1167-S1170 PolarHBondContact O-N 3.15Å; E1167-S1170 PolarHBondContact O-OG 3.2Å; A1168-S1170 VanDerWaalsContact C-N 3.3Å; A1168-S1170 PolarHBondContact O-N 3.17Å; S1170-M1172 VanDerWaalsContact C-N 3.33Å; S1170-M1172 PolarHBondContact O-N 3.17Å; S1170-Q1173 PolarHBondContact O-N 2.93Å; S1170-V1174 WeakPolarHBondContact O-CG2 3.45Å; S1170-V1174 PolarHBondContact O-N 3.47Å
1171	K	48.2	Very low	45.1	Very low	108 Å²	108	99.4 Å²	99.4	47%	0.47	57%	0.566	S	S	.	*	H	α-helix	trans	-69.9	-29.5	177.6	-72.9	178	-177.1	167	0	112.4	E1167 A1168	E1167-K1171 WeakPolarHBondContact O-CG 3.48Å; E1167-K1171 PolarHBondContact O-N 3.16Å; E1167-K1171 IonicContact OE1-NZ 2.61Å; E1167-K1171 PolarHBondContact OE1-NZ 2.81Å; A1168-K1171 PolarHBondContact O-N 3.46Å
1172	M	43.2	Very low	44.8	Very low	102 Å²	102	104.9 Å²	104.9	50%	0.502	59%	0.587	S	S	.	*	H	α-helix	trans	-70.2	-38.2	171.4	-72.2	-170.7	108.2	0	0	112.4	A1168 K1169 S1170 V1174 K1175	A1168-M1172 WeakPolarHBondContact O-CG 3.38Å; A1168-M1172 PolarHBondContact O-N 2.97Å; K1169-M1172 PolarHBondContact O-N 2.68Å; S1170-M1172 VanDerWaalsContact C-N 3.33Å; S1170-M1172 PolarHBondContact O-N 3.17Å; M1172-V1174 VanDerWaalsContact C-N 3.35Å; M1172-V1174 PolarHBondContact O-N 3.27Å; M1172-K1175 PolarHBondContact O-N 3.05Å
1173	Q	50.5	Low	44	Very low	168 Å²	168	103.5 Å²	103.5	79%	0.785	58%	0.577	S	S	*	*	H	α-helix	trans	-67.3	-32.8	176.5	-76	-176.5	-3.9	0	0	113.1	K1169 S1170	K1169-Q1173 PolarHBondContact O-N 3.07Å; S1170-Q1173 PolarHBondContact O-N 2.93Å
1174	V	51.9	Low	43.2	Very low	122 Å²	122	106.2 Å²	106.2	74%	0.739	59%	0.594	S	S	*	*	H	α-helix	trans	-76.8	-19.7	-179.6	176.7	0	0	0	0	113.1	S1170 M1172	S1170-V1174 WeakPolarHBondContact O-CG2 3.45Å; S1170-V1174 PolarHBondContact O-N 3.47Å; M1172-V1174 VanDerWaalsContact C-N 3.35Å; M1172-V1174 PolarHBondContact O-N 3.27Å
1175	K	41.9	Very low	42.8	Very low	152 Å²	152	111.2 Å²	111.2	66%	0.661	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	11.3	-174.2	-98.7	-176.7	176.7	-177.2	0	116.1	M1172 S1177 S1178	M1172-K1175 PolarHBondContact O-N 3.05Å; K1175-S1177 PolarHBondContact O-N 3.43Å; K1175-S1178 PolarHBondContact O-N 3.07Å
1176	G	38.3	Very low	42.2	Very low	78 Å²	78	110 Å²	110	80%	0.804	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	0.2	179.7	0	0	0	0	0	116.7
1177	S	40.1	Very low	41.6	Very low	117 Å²	117	110.5 Å²	110.5	82%	0.818	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	-2	-175.9	53.2	0	0	0	0	116	K1175	K1175-S1177 PolarHBondContact O-N 3.43Å
1178	S	34.4	Very low	41.2	Very low	65 Å²	65	109.9 Å²	109.9	46%	0.455	60%	0.601	S	S	.	*	S	Bend	trans	-126.6	114	174.9	69.3	0	0	0	0	110.9	K1175 T1180	K1175-S1178 PolarHBondContact O-N 3.07Å; S1178-T1180 PolarHBondContact O-N 3.01Å
1179	G	34	Very low	41.4	Very low	92 Å²	92	110.4 Å²	110.4	95%	0.948	61%	0.61	S	S	*	*			trans	-66.9	42.4	-173.6	0	0	0	0	0	117
1180	T	32.9	Very low	41.1	Very low	121 Å²	121	109.4 Å²	109.4	74%	0.742	61%	0.607	S	S	*	*			trans	-120.4	86	171.6	25.1	0	0	0	0	110.1	S1178 K1182	S1178-T1180 PolarHBondContact O-N 3.01Å; T1180-K1182 PolarHBondContact O-N 3.27Å; T1180-K1182 VanDerWaalsContact O-N 3.11Å
1181	L	30	Very low	40.6	Very low	162 Å²	162	109.9 Å²	109.9	85%	0.848	60%	0.604	S	S	*	*			trans	-72.6	94.2	168.6	-83.2	154.2	0	0	0	109.6
1182	K	35.7	Very low	40.5	Very low	167 Å²	167	108.2 Å²	108.2	73%	0.726	60%	0.6	S	S	*	*			trans	-122	106.7	153.7	-91.6	-174	176.6	179	0	108.4	T1180 Q1184	T1180-K1182 PolarHBondContact O-N 3.27Å; T1180-K1182 VanDerWaalsContact O-N 3.11Å; K1182-Q1184 PolarHBondContact O-N 3.03Å
1183	Y	35.3	Very low	41.1	Very low	95 Å²	95	110.4 Å²	110.4	37%	0.373	61%	0.607	S	S	.	*			trans	-57.8	120.3	162.2	-171.8	-93.5	0	0	0	107.9	W1185	Y1183-W1185 AromaticContact CE1-CD1 3.92Å; Y1183-W1185 HydrophobicContact CE1-CD2 4.26Å; Y1183-W1185 HydrophobicContact CE1-CG 4.19Å; Y1183-W1185 AromaticContact CE1-NE1 3.81Å
1184	Q	36.7	Very low	41.2	Very low	166 Å²	166	103.3 Å²	103.3	78%	0.776	58%	0.577	S	S	*	*			trans	-116.8	123.4	168.6	-106.7	-177.7	-3.1	0	0	107.1	K1182	K1182-Q1184 PolarHBondContact O-N 3.03Å
1185	W	36.9	Very low	41	Very low	134 Å²	134	100.8 Å²	100.8	51%	0.508	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-53.7	143.3	171.9	-79.3	84.4	0	0	0	110.3	Y1183 K1187 I1292	Y1183-W1185 AromaticContact CE1-CD1 3.92Å; Y1183-W1185 HydrophobicContact CE1-CD2 4.26Å; Y1183-W1185 HydrophobicContact CE1-CG 4.19Å; Y1183-W1185 AromaticContact CE1-NE1 3.81Å; W1185-K1187 PolarHBondContact O-N 3.08Å; W1185-I1292 HydrophobicContact CH2-CG2 4.37Å
1186	P	37.4	Very low	41.8	Very low	46 Å²	46	98.1 Å²	98.1	30%	0.299	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-52	134.4	170.1	-21.2	30.9	0	0	0	109.4	E1190 I1191	P1186-E1190 HydrophobicContact CB-CB 4.49Å; P1186-I1191 HydrophobicContact CB-CD1 4.23Å; P1186-I1191 HydrophobicContact CB-CG1 3.9Å
1187	K	44.3	Very low	43	Very low	151 Å²	151	98.2 Å²	98.2	66%	0.657	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-63.4	146	177	-68.9	178.5	-179.6	175.7	0	108.2	W1185 G1189 E1190 I1191	W1185-K1187 PolarHBondContact O-N 3.08Å; K1187-G1189 PolarHBondContact O-N 2.64Å; K1187-E1190 HydrophobicContact CB-CG 4.4Å; K1187-E1190 PolarHBondContact N-OE2 3.5Å; K1187-E1190 WeakPolarHBondContact O-CA 3.38Å; K1187-E1190 WeakPolarHBondContact O-CB 3.45Å; K1187-E1190 PolarHBondContact O-N 3.23Å; K1187-I1191 PolarHBondContact O-N 3.45Å
1188	V	41.2	Very low	43.8	Very low	57 Å²	57	94.3 Å²	94.3	35%	0.345	50%	0.5	S	S	.	.	H	α-helix	trans	-48.5	-36.4	179.5	177.1	0	0	0	0	112.2	E1190 I1191 L1192 I1287	V1188-E1190 VanDerWaalsContact C-N 3.33Å; V1188-E1190 PolarHBondContact O-N 3.4Å; V1188-I1191 PolarHBondContact O-N 3.05Å; V1188-L1192 HydrophobicContact CG1-CD1 3.9Å; V1188-L1192 HydrophobicContact CG1-CG 4.37Å; V1188-L1192 WeakPolarHBondContact O-CB 3.33Å; V1188-L1192 WeakPolarHBondContact O-CG 3.46Å; V1188-L1192 PolarHBondContact O-N 3.22Å; V1188-I1287 HydrophobicContact CG2-CG2 3.97Å
1189	G	48.7	Very low	44.6	Very low	44 Å²	44	95.2 Å²	95.2	45%	0.454	50%	0.497	S	S	.	.	H	α-helix	trans	-66.7	-25.7	175.8	0	0	0	0	0	115.5	K1187 K1193	K1187-G1189 PolarHBondContact O-N 2.64Å; G1189-K1193 WeakPolarHBondContact O-CB 3.36Å; G1189-K1193 WeakPolarHBondContact O-CG 3.39Å; G1189-K1193 PolarHBondContact O-N 3.24Å; G1189-K1193 VanDerWaalsContact O-N 3.12Å
1190	E	47.6	Very low	46	Very low	95 Å²	95	96.3 Å²	96.3	44%	0.444	48%	0.476	S	S	.	.	H	α-helix	trans	-78.3	-39.5	176.4	-63.1	179	165.8	0	0	111	P1186 K1187 V1188 K1193 A1194	P1186-E1190 HydrophobicContact CB-CB 4.49Å; K1187-E1190 HydrophobicContact CB-CG 4.4Å; K1187-E1190 PolarHBondContact N-OE2 3.5Å; K1187-E1190 WeakPolarHBondContact O-CA 3.38Å; K1187-E1190 WeakPolarHBondContact O-CB 3.45Å; K1187-E1190 PolarHBondContact O-N 3.23Å; V1188-E1190 VanDerWaalsContact C-N 3.33Å; V1188-E1190 PolarHBondContact O-N 3.4Å; E1190-K1193 PolarHBondContact O-N 2.9Å; E1190-A1194 PolarHBondContact O-N 3.47Å
1191	I	44.5	Very low	47.2	Very low	65 Å²	65	96 Å²	96	33%	0.333	47%	0.466	S	S	.	.	H	α-helix	trans	-65.5	-44.1	174.3	-58.8	177	0	0	0	110.2	P1186 K1187 V1188 K1193 A1194 K1195	P1186-I1191 HydrophobicContact CB-CD1 4.23Å; P1186-I1191 HydrophobicContact CB-CG1 3.9Å; K1187-I1191 PolarHBondContact O-N 3.45Å; V1188-I1191 PolarHBondContact O-N 3.05Å; I1191-K1193 PolarHBondContact O-N 2.69Å; I1191-A1194 PolarHBondContact O-N 2.73Å; I1191-K1195 WeakPolarHBondContact O-CB 3.37Å; I1191-K1195 PolarHBondContact O-N 3.24Å
1192	L	45.3	Very low	48.3	Very low	74 Å²	74	93.5 Å²	93.5	39%	0.387	45%	0.446	S	S	.	.	H	α-helix	trans	-62	-41.5	175.9	-74.8	171.3	0	0	0	112	V1188 K1195 E1196 E1290	V1188-L1192 HydrophobicContact CG1-CD1 3.9Å; V1188-L1192 HydrophobicContact CG1-CG 4.37Å; V1188-L1192 WeakPolarHBondContact O-CB 3.33Å; V1188-L1192 WeakPolarHBondContact O-CG 3.46Å; V1188-L1192 PolarHBondContact O-N 3.22Å; L1192-K1195 PolarHBondContact O-N 3.04Å; L1192-E1196 WeakPolarHBondContact O-CB 3.4Å; L1192-E1196 PolarHBondContact O-N 2.98Å; L1192-E1290 WeakPolarHBondContact CD2-OE1 3.35Å
1193	K	55	Low	49.2	Very low	148 Å²	148	90 Å²	90	64%	0.643	43%	0.434	S	S	*	.	H	α-helix	trans	-63	-42.2	173.8	-86	-177.9	176.1	-176.7	0	112.4	G1189 E1190 I1191 E1196 T1197	G1189-K1193 WeakPolarHBondContact O-CB 3.36Å; G1189-K1193 WeakPolarHBondContact O-CG 3.39Å; G1189-K1193 PolarHBondContact O-N 3.24Å; G1189-K1193 VanDerWaalsContact O-N 3.12Å; E1190-K1193 PolarHBondContact O-N 2.9Å; I1191-K1193 PolarHBondContact O-N 2.69Å; K1193-E1196 PolarHBondContact O-N 3.27Å; K1193-T1197 WeakPolarHBondContact O-CB 3.4Å; K1193-T1197 PolarHBondContact O-N 3.43Å; K1193-T1197 PolarHBondContact O-OG1 3.4Å
1194	A	52.5	Low	50.1	Low	18 Å²	18	92.1 Å²	92.1	15%	0.149	45%	0.451	C	S	.	.	H	α-helix	trans	-63.9	-44.6	177.4	0	0	0	0	0	111.4	Y1163 E1190 I1191 E1196 T1197 I1198	Y1163-A1194 HydrophobicContact CD1-CB 3.95Å; Y1163-A1194 HydrophobicContact CE1-CB 4.04Å; E1190-A1194 PolarHBondContact O-N 3.47Å; I1191-A1194 PolarHBondContact O-N 2.73Å; A1194-E1196 PolarHBondContact O-N 3.26Å; A1194-T1197 PolarHBondContact O-N 2.93Å; A1194-I1198 VanDerWaalsContact O-CG1 3.29Å; A1194-I1198 WeakPolarHBondContact O-CG1 3.47Å; A1194-I1198 PolarHBondContact O-N 3.43Å
1195	K	49	Very low	50.7	Low	69 Å²	69	90.4 Å²	90.4	30%	0.3	44%	0.444	S	S	.	.	H	α-helix	trans	-55.4	-51.6	172.4	179.5	-169.5	168.3	-172.4	0	111.2	W1157 I1191 L1192 T1197 I1198 E1199	W1157-K1195 HydrophobicContact CH2-CD 4.38Å; I1191-K1195 WeakPolarHBondContact O-CB 3.37Å; I1191-K1195 PolarHBondContact O-N 3.24Å; L1192-K1195 PolarHBondContact O-N 3.04Å; K1195-T1197 PolarHBondContact O-N 3.07Å; K1195-I1198 PolarHBondContact O-N 3.24Å; K1195-E1199 WeakPolarHBondContact CE-OE1 3.26Å; K1195-E1199 IonicContact NZ-OE1 3.34Å; K1195-E1199 WeakPolarHBondContact O-CB 3.43Å; K1195-E1199 WeakPolarHBondContact O-CG 3.3Å; K1195-E1199 PolarHBondContact O-N 3.3Å
1196	E	58.6	Low	51.2	Low	97 Å²	97	87.9 Å²	87.9	45%	0.453	45%	0.446	S	S	.	.	H	α-helix	trans	-63.4	-32.7	-177.8	-147.1	-167.4	149.7	0	0	112	L1192 K1193 A1194 K1200	L1192-E1196 WeakPolarHBondContact O-CB 3.4Å; L1192-E1196 PolarHBondContact O-N 2.98Å; K1193-E1196 PolarHBondContact O-N 3.27Å; A1194-E1196 PolarHBondContact O-N 3.26Å; E1196-K1200 WeakPolarHBondContact O-CB 3.36Å; E1196-K1200 WeakPolarHBondContact O-CD 3.35Å; E1196-K1200 WeakPolarHBondContact O-CG 3.49Å; E1196-K1200 PolarHBondContact O-N 2.92Å; E1196-K1200 IonicContact OE1-NZ 3Å; E1196-K1200 PolarHBondContact OE1-NZ 2.92Å
1197	T	63.4	Low	51.5	Low	79 Å²	79	93.8 Å²	93.8	49%	0.485	47%	0.467	S	S	.	.	H	α-helix	trans	-72.8	-40.1	177.7	-51	0	0	0	0	111.6	K1193 A1194 K1195 K1200 Q1201	K1193-T1197 WeakPolarHBondContact O-CB 3.4Å; K1193-T1197 PolarHBondContact O-N 3.43Å; K1193-T1197 PolarHBondContact O-OG1 3.4Å; A1194-T1197 PolarHBondContact O-N 2.93Å; K1195-T1197 PolarHBondContact O-N 3.07Å; T1197-K1200 PolarHBondContact O-N 3.33Å; T1197-Q1201 PolarHBondContact O-N 2.94Å
1198	I	56.5	Low	51.1	Low	35 Å²	35	90 Å²	90	18%	0.179	47%	0.471	C	S	.	.	H	α-helix	trans	-71.5	-39	177.5	-68.4	168.4	0	0	0	111	A1160 Y1163 A1194 K1195 K1200 Q1201 Y1202	A1160-I1198 HydrophobicContact CB-CD1 3.69Å; Y1163-I1198 HydrophobicContact CG-CD1 4.29Å; A1194-I1198 VanDerWaalsContact O-CG1 3.29Å; A1194-I1198 WeakPolarHBondContact O-CG1 3.47Å; A1194-I1198 PolarHBondContact O-N 3.43Å; K1195-I1198 PolarHBondContact O-N 3.24Å; I1198-K1200 VanDerWaalsContact C-N 3.33Å; I1198-Q1201 PolarHBondContact O-N 3.29Å; I1198-Y1202 WeakPolarHBondContact O-CB 3.43Å; I1198-Y1202 PolarHBondContact O-N 2.96Å
1199	E	50.9	Low	50.7	Low	85 Å²	85	90.4 Å²	90.4	40%	0.397	49%	0.487	S	S	.	.	H	α-helix	trans	-61.4	-42.5	171.7	-76.5	176.8	166.7	0	0	111	K1195 Y1202 I1203	K1195-E1199 WeakPolarHBondContact CE-OE1 3.26Å; K1195-E1199 IonicContact NZ-OE1 3.34Å; K1195-E1199 WeakPolarHBondContact O-CB 3.43Å; K1195-E1199 WeakPolarHBondContact O-CG 3.3Å; K1195-E1199 PolarHBondContact O-N 3.3Å; E1199-Y1202 PolarHBondContact O-N 3.4Å; E1199-I1203 WeakPolarHBondContact O-CB 3.47Å; E1199-I1203 WeakPolarHBondContact O-CD1 3.16Å; E1199-I1203 WeakPolarHBondContact O-CG1 3.46Å; E1199-I1203 PolarHBondContact O-N 3.1Å
1200	K	64	Low	50.2	Low	114 Å²	114	96.4 Å²	96.4	50%	0.496	51%	0.506	S	S	.	.	H	α-helix	trans	-63.6	-39.8	174	-75.7	168.8	-171.4	165.3	0	112.7	E1196 T1197 I1198 L1204	E1196-K1200 WeakPolarHBondContact O-CB 3.36Å; E1196-K1200 WeakPolarHBondContact O-CD 3.35Å; E1196-K1200 WeakPolarHBondContact O-CG 3.49Å; E1196-K1200 PolarHBondContact O-N 2.92Å; E1196-K1200 IonicContact OE1-NZ 3Å; E1196-K1200 PolarHBondContact OE1-NZ 2.92Å; T1197-K1200 PolarHBondContact O-N 3.33Å; I1198-K1200 VanDerWaalsContact C-N 3.33Å; K1200-L1204 WeakPolarHBondContact O-CD1 3.27Å; K1200-L1204 PolarHBondContact O-N 2.93Å
1201	Q	58.6	Low	49.4	Very low	114 Å²	114	101 Å²	101	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-65.6	-42.9	174.4	-94.9	175.2	-30.8	0	0	112.4	T1197 I1198 I1203 L1204 E1205	T1197-Q1201 PolarHBondContact O-N 2.94Å; I1198-Q1201 PolarHBondContact O-N 3.29Å; Q1201-I1203 VanDerWaalsContact C-N 3.34Å; Q1201-I1203 PolarHBondContact O-N 3.31Å; Q1201-L1204 WeakPolarHBondContact O-CB 3.48Å; Q1201-L1204 PolarHBondContact O-N 2.89Å; Q1201-L1204 VanDerWaalsContact O-N 3.12Å; Q1201-E1205 WeakPolarHBondContact O-CG 3.26Å; Q1201-E1205 PolarHBondContact O-N 3.31Å
1202	Y	51.4	Low	49.1	Very low	110 Å²	110	103 Å²	103	43%	0.431	54%	0.542	S	S	.	.	H	α-helix	trans	-68.3	-34.4	178.7	-155.6	-91.9	0	0	0	112.2	I1198 E1199 L1204 E1205 S1206	I1198-Y1202 WeakPolarHBondContact O-CB 3.43Å; I1198-Y1202 PolarHBondContact O-N 2.96Å; E1199-Y1202 PolarHBondContact O-N 3.4Å; Y1202-L1204 VanDerWaalsContact C-N 3.31Å; Y1202-E1205 PolarHBondContact O-N 3.37Å; Y1202-S1206 VanDerWaalsContact O-CB 3.26Å; Y1202-S1206 WeakPolarHBondContact O-CB 3.23Å; Y1202-S1206 PolarHBondContact O-N 2.94Å; Y1202-S1206 PolarHBondContact O-OG 2.93Å
1203	I	56.3	Low	48.6	Very low	94 Å²	94	108.1 Å²	108.1	48%	0.482	57%	0.569	S	S	.	*	H	α-helix	trans	-68.2	-31.3	172.1	-67.8	164.7	0	0	0	111.1	E1199 Q1201 S1206 K1207	E1199-I1203 WeakPolarHBondContact O-CB 3.47Å; E1199-I1203 WeakPolarHBondContact O-CD1 3.16Å; E1199-I1203 WeakPolarHBondContact O-CG1 3.46Å; E1199-I1203 PolarHBondContact O-N 3.1Å; Q1201-I1203 VanDerWaalsContact C-N 3.34Å; Q1201-I1203 PolarHBondContact O-N 3.31Å; I1203-S1206 WeakPolarHBondContact CA-OG 3.19Å; I1203-S1206 PolarHBondContact O-OG 3.44Å; I1203-K1207 WeakPolarHBondContact O-CG 3.09Å
1204	L	53.9	Low	47.3	Very low	139 Å²	139	105.8 Å²	105.8	73%	0.728	57%	0.571	S	S	*	*	H	α-helix	trans	-72.5	-42.7	172	-107.9	101.1	0	0	0	112.4	K1200 Q1201 Y1202 K1207	K1200-L1204 WeakPolarHBondContact O-CD1 3.27Å; K1200-L1204 PolarHBondContact O-N 2.93Å; Q1201-L1204 WeakPolarHBondContact O-CB 3.48Å; Q1201-L1204 PolarHBondContact O-N 2.89Å; Q1201-L1204 VanDerWaalsContact O-N 3.12Å; Y1202-L1204 VanDerWaalsContact C-N 3.31Å; L1204-K1207 PolarHBondContact O-N 2.68Å
1205	E	49.7	Very low	46.1	Very low	131 Å²	131	109.8 Å²	109.8	61%	0.612	60%	0.598	S	S	*	*	H	α-helix	trans	-70.8	-36.6	-179.7	-73.2	177.6	176	0	0	112.3	Q1201 Y1202 K1207 G1208	Q1201-E1205 WeakPolarHBondContact O-CG 3.26Å; Q1201-E1205 PolarHBondContact O-N 3.31Å; Y1202-E1205 PolarHBondContact O-N 3.37Å; E1205-K1207 VanDerWaalsContact C-N 3.26Å; E1205-K1207 PolarHBondContact O-N 3.22Å; E1205-G1208 PolarHBondContact O-N 3.5Å
1206	S	46.4	Very low	45.1	Very low	80 Å²	80	113.9 Å²	113.9	56%	0.559	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-14.9	176.9	56.7	0	0	0	0	114.3	Y1202 I1203	Y1202-S1206 VanDerWaalsContact O-CB 3.26Å; Y1202-S1206 WeakPolarHBondContact O-CB 3.23Å; Y1202-S1206 PolarHBondContact O-N 2.94Å; Y1202-S1206 PolarHBondContact O-OG 2.93Å; I1203-S1206 WeakPolarHBondContact CA-OG 3.19Å; I1203-S1206 PolarHBondContact O-OG 3.44Å
1207	K	43.4	Very low	43.8	Very low	171 Å²	171	116.6 Å²	116.6	74%	0.743	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-1.1	172.4	-75.1	-178.5	177.2	-176.2	0	113.7	I1203 L1204 E1205	I1203-K1207 WeakPolarHBondContact O-CG 3.09Å; L1204-K1207 PolarHBondContact O-N 2.68Å; E1205-K1207 VanDerWaalsContact C-N 3.26Å; E1205-K1207 PolarHBondContact O-N 3.22Å
1208	G	35.4	Very low	42.1	Very low	71 Å²	71	119.1 Å²	119.1	73%	0.732	66%	0.655	S	S	*	*	S	Bend	trans	-98.9	2.7	-175.1	0	0	0	0	0	117.6	E1205	E1205-G1208 PolarHBondContact O-N 3.5Å
1209	G	34.6	Very low	40.7	Very low	66 Å²	66	124.5 Å²	124.5	68%	0.68	68%	0.684	S	S	*	*	S	Bend	trans	-131.1	121.6	-176.1	0	0	0	0	0	114
1210	I	36.7	Very low	39.6	Very low	169 Å²	169	126.5 Å²	126.5	87%	0.867	70%	0.702	S	S	*	*			trans	-80.3	122	-175.8	-65.7	170	0	0	0	111.8
1211	K	31.5	Very low	37.7	Very low	191 Å²	191	128.4 Å²	128.4	83%	0.83	72%	0.717	S	S	*	*			trans	23	168.2	142.3	-71.1	-172.3	176.7	-178.3	0	122.2
1212	P	38.2	Very low	36.2	Very low	108 Å²	108	128.7 Å²	128.7	70%	0.701	73%	0.729	S	S	*	*			cis	-139.5	166	-49.2	39.8	-22.6	0	0	0	113
1213	L	34.2	Very low	35	Very low	182 Å²	182	128.1 Å²	128.1	95%	0.953	74%	0.741	S	S	*	*			trans	-156.5	146.6	151.4	-130.5	104.8	0	0	0	112.8
1214	S	28.1	Very low	33.5	Very low	98 Å²	98	129.5 Å²	129.5	69%	0.685	76%	0.756	S	S	*	*			trans	-90.7	149.6	-158.8	53.1	0	0	0	0	116.6
1215	S	28.5	Very low	32.1	Very low	102 Å²	102	131.2 Å²	131.2	71%	0.713	76%	0.763	S	S	*	*				132.4	118.3	117.9	74.6	0	0	0	0	116.4
1216	N	26.2	Very low	31	Very low	155 Å²	155	130.6 Å²	130.6	83%	0.829	76%	0.764	S	S	*	*			trans	65	87.7	143.5	-57.9	-7.5	0	0	0	120.4
1217	I	32	Very low	30	Very low	154 Å²	154	136 Å²	136	79%	0.79	78%	0.78	S	S	*	*			trans	-138.4	132.3	137.4	-61.3	-175.9	0	0	0	107.7	D1219	I1217-D1219 PolarHBondContact O-N 2.89Å
1218	V	27.6	Very low	29.1	Very low	133 Å²	133	134.2 Å²	134.2	81%	0.806	77%	0.774	S	S	*	*			trans	-68.1	107.2	176.9	174.2	0	0	0	0	108.2
1219	D	28.2	Very low	28.5	Very low	148 Å²	148	139.3 Å²	139.3	79%	0.791	78%	0.779	S	S	*	*			trans	-100.8	113.2	170.5	-89.1	-31.6	0	0	0	109.3	I1217 D1221	I1217-D1219 PolarHBondContact O-N 2.89Å; D1219-D1221 PolarHBondContact O-N 2.83Å
1220	T	26	Very low	28	Very low	126 Å²	126	143.2 Å²	143.2	77%	0.773	78%	0.779	S	S	*	*			trans	-60.9	120	166.8	-45.9	0	0	0	0	109.1	P1222	T1220-P1222 WeakPolarHBondContact O-CD 3.42Å
1221	D	25.7	Very low	27.4	Very low	154 Å²	154	143.7 Å²	143.7	82%	0.824	77%	0.77	S	S	*	*			trans	-54.9	125.4	173.7	-80.6	-41.2	0	0	0	111.3	D1219 S1223	D1219-D1221 PolarHBondContact O-N 2.83Å; D1221-S1223 PolarHBondContact O-N 3.33Å
1222	P	26.2	Very low	27.1	Very low	120 Å²	120	140.8 Å²	140.8	78%	0.779	76%	0.758	S	S	*	*			trans	-78.9	113.5	160.3	30	-26.1	0	0	0	108.7	T1220	T1220-P1222 WeakPolarHBondContact O-CD 3.42Å
1223	S	25.8	Very low	26.4	Very low	99 Å²	99	142.7 Å²	142.7	69%	0.692	76%	0.755	S	S	*	*			trans	-44.3	137.8	168.5	174.3	0	0	0	0	112.7	D1221 M1225	D1221-S1223 PolarHBondContact O-N 3.33Å; S1223-M1225 PolarHBondContact O-N 3.19Å; S1223-M1225 VanDerWaalsContact O-N 3.16Å
1224	P	25.3	Very low	25.9	Very low	122 Å²	122	139.9 Å²	139.9	79%	0.792	75%	0.746	S	S	*	*			trans	-77.3	101.6	175.8	31.8	-29.5	0	0	0	109.1	D1226	P1224-D1226 PolarHBondContact O-N 3.25Å
1225	M	25.4	Very low	25.8	Very low	176 Å²	176	138.5 Å²	138.5	87%	0.867	73%	0.733	S	S	*	*			trans	-72.9	121.5	169.2	-100.5	-168.7	56	0	0	111	S1223	S1223-M1225 PolarHBondContact O-N 3.19Å; S1223-M1225 VanDerWaalsContact O-N 3.16Å
1226	D	25.7	Very low	25.8	Very low	117 Å²	117	137.5 Å²	137.5	63%	0.626	73%	0.726	S	S	*	*			trans	-28.2	120.3	170.6	-72.8	-43.8	0	0	0	116.8	P1224 E1228	P1224-D1226 PolarHBondContact O-N 3.25Å; D1226-E1228 VanDerWaalsContact C-N 3.29Å; D1226-E1228 PolarHBondContact O-N 2.87Å
1227	E	24.9	Very low	25.8	Very low	194 Å²	194	134 Å²	134	91%	0.907	71%	0.708	S	S	*	*	S	Bend	trans	-82.8	23.7	172.1	-89.6	-160.3	141.6	0	0	114.5
1228	E	24.2	Very low	25.6	Very low	134 Å²	134	130.9 Å²	130.9	63%	0.626	69%	0.692	S	S	*	*			trans	-105.2	9.1	-170.5	-137.1	173.7	-168.6	0	0	117.3	D1226 N1271	D1226-E1228 VanDerWaalsContact C-N 3.29Å; D1226-E1228 PolarHBondContact O-N 2.87Å; E1228-N1271 PolarHBondContact OE2-ND2 3.23Å
1229	Q	24.5	Very low	25.6	Very low	178 Å²	178	129.8 Å²	129.8	83%	0.832	68%	0.678	S	S	*	*			trans	-109.6	34.1	-173.5	-85.9	-174.5	-11.4	0	0	117.6
1230	H	24.1	Very low	25.5	Very low	148 Å²	148	129.6 Å²	129.6	69%	0.685	67%	0.673	S	S	*	*			trans	-132.4	70.2	175.1	-71.9	-56.5	0	0	0	114.8
1231	R	24	Very low	25.6	Very low	179 Å²	179	129.9 Å²	129.9	68%	0.675	67%	0.665	S	S	*	*			trans	-150.7	111.2	152.4	-66.8	-172.6	-138.5	-124.5	-3.2	108.2	R1278	R1231-R1278 VanDerWaalsContact NH2-NH1 3.16Å
1232	F	23.8	Very low	25.6	Very low	129 Å²	129	130.7 Å²	130.7	57%	0.566	66%	0.664	S	S	*	*			trans	178.6	132.4	137.9	-86.7	-54.7	0	0	0	108.1	Y572	Y572-F1232 HydrophobicContact CD1-CD1 4.34Å; Y572-F1232 AromaticContact CD1-CE1 3.58Å; Y572-F1232 HydrophobicContact CD1-CE1 3.58Å; Y572-F1232 AromaticContact CD1-CZ 3.95Å; Y572-F1232 HydrophobicContact CD1-CZ 3.95Å; Y572-F1232 HydrophobicContact CD2-CZ 4.09Å; Y572-F1232 AromaticContact CE1-CD1 3.24Å; Y572-F1232 HydrophobicContact CE1-CD1 3.24Å; Y572-F1232 HydrophobicContact CE1-CD2 4.38Å; Y572-F1232 AromaticContact CE1-CE1 2.8Å; Y572-F1232 HydrophobicContact CE1-CE1 2.8Å; Y572-F1232 HydrophobicContact CE1-CE2 4.05Å; Y572-F1232 HydrophobicContact CE1-CG 4.08Å; Y572-F1232 AromaticContact CE1-CZ 3.28Å; Y572-F1232 HydrophobicContact CE1-CZ 3.28Å; Y572-F1232 HydrophobicContact CE2-CD2 4.34Å; Y572-F1232 AromaticContact CE2-CE1 3.89Å; Y572-F1232 HydrophobicContact CE2-CE1 3.89Å; Y572-F1232 AromaticContact CE2-CE2 3.63Å; Y572-F1232 HydrophobicContact CE2-CE2 3.63Å; Y572-F1232 AromaticContact CE2-CZ 3.37Å; Y572-F1232 HydrophobicContact CE2-CZ 3.37Å; Y572-F1232 HydrophobicContact CG-CE1 4.42Å; Y572-F1232 HydrophobicContact CG-CZ 4.36Å; Y572-F1232 AromaticContact CZ-CD1 3.38Å; Y572-F1232 AromaticContact CZ-CD2 3.65Å; Y572-F1232 AromaticContact CZ-CE1 3.01Å; Y572-F1232 AromaticContact CZ-CE2 3.29Å; Y572-F1232 AromaticContact CZ-CG 3.74Å; Y572-F1232 AromaticContact CZ-CZ 2.95Å; Y572-F1232 WeakPolarHBondContact OH-CD1 3.49Å; Y572-F1232 WeakPolarHBondContact OH-CD2 3.35Å; Y572-F1232 WeakPolarHBondContact OH-CE1 3.48Å; Y572-F1232 WeakPolarHBondContact OH-CE2 3.26Å; Y572-F1232 WeakPolarHBondContact OH-CG 3.4Å; Y572-F1232 WeakPolarHBondContact OH-CZ 3.33Å
1233	F	25.1	Very low	25.5	Very low	149 Å²	149	130 Å²	130	65%	0.654	66%	0.657	S	S	*	*			trans	166.1	98.9	147.3	-88.2	-62.7	0	0	0	110	N1238	F1233-N1238 HydrophobicContact CE1-CB 4.16Å
1234	V	23.8	Very low	25.3	Very low	123 Å²	123	129.9 Å²	129.9	75%	0.745	66%	0.655	S	S	*	*			trans	-142.9	92.4	141	-179.9	0	0	0	0	107
1235	T	24.4	Very low	25.3	Very low	68 Å²	68	130.5 Å²	130.5	42%	0.417	65%	0.651	S	S	.	*	S	Bend		-172.5	122.7	129.1	38.7	0	0	0	0	107.2
1236	S	28.4	Very low	25.3	Very low	82 Å²	82	129.7 Å²	129.7	57%	0.573	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	132.2	172.8	52.7	0	0	0	0	111.2
1237	D	27.5	Very low	25.2	Very low	82 Å²	82	132.3 Å²	132.3	44%	0.439	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	114.4	4.8	175.4	-73.6	4.9	0	0	0	117.1	R765 E1239	R765-D1237 IonicContact CZ-OD2 2.84Å; R765-D1237 IonicContact NH1-OD1 2.69Å; R765-D1237 IonicContact NH1-OD2 2.56Å; R765-D1237 PolarHBondContact NH1-OD2 3.48Å; R765-D1237 IonicContact NH2-OD2 3.17Å; R765-D1237 PolarHBondContact NH2-OD2 2.71Å; D1237-E1239 PolarHBondContact O-N 3.3Å
1238	N	26.8	Very low	25.2	Very low	88 Å²	88	131.8 Å²	131.8	47%	0.471	66%	0.655	S	S	.	*			trans	-82.6	96.6	160.6	-79.3	0.7	0	0	0	109.3	F1233	F1233-N1238 HydrophobicContact CE1-CB 4.16Å
1239	E	28.4	Very low	25.2	Very low	110 Å²	110	133.2 Å²	133.2	51%	0.514	66%	0.662	S	S	.	*			trans	-47.9	138	152.2	-65.2	-173.9	154.6	0	0	108.1	D1237 E1241	D1237-E1239 PolarHBondContact O-N 3.3Å; E1239-E1241 PolarHBondContact O-N 3.42Å; E1239-E1241 VanDerWaalsContact O-N 3.14Å
1240	E	26.7	Very low	25.2	Very low	143 Å²	143	130.9 Å²	130.9	67%	0.668	65%	0.654	S	S	*	*			trans	-35.6	115.8	-174.9	-71.6	158.6	158.8	0	0	111.7	E1242	E1240-E1242 PolarHBondContact O-N 3Å
1241	E	27	Very low	25.2	Very low	132 Å²	132	133.8 Å²	133.8	62%	0.617	66%	0.661	S	S	*	*			trans	-65.6	82.1	163.2	-85.6	178.4	161.3	0	0	108	E1239 V1243	E1239-E1241 PolarHBondContact O-N 3.42Å; E1239-E1241 VanDerWaalsContact O-N 3.14Å; E1241-V1243 HydrophobicContact CB-CG2 4.3Å; E1241-V1243 PolarHBondContact O-N 3.37Å; E1241-V1243 VanDerWaalsContact O-N 3.08Å
1242	E	25.3	Very low	25.2	Very low	172 Å²	172	132 Å²	132	80%	0.804	66%	0.664	S	S	*	*			trans	-70.8	87.5	142.5	-85.8	-172.8	169	0	0	106.6	E1240 C1244	E1240-E1242 PolarHBondContact O-N 3Å; E1242-C1244 PolarHBondContact O-N 3.45Å
1243	V	24.3	Very low	25.4	Very low	104 Å²	104	131 Å²	131	63%	0.63	67%	0.674	S	S	*	*			trans	-64.9	84.6	154.6	173.7	0	0	0	0	105.9	E1241 I1245	E1241-V1243 HydrophobicContact CB-CG2 4.3Å; E1241-V1243 PolarHBondContact O-N 3.37Å; E1241-V1243 VanDerWaalsContact O-N 3.08Å; V1243-I1245 HydrophobicContact CG1-CD1 4.26Å; V1243-I1245 HydrophobicContact CG1-CG1 3.88Å; V1243-I1245 PolarHBondContact O-N 3.4Å
1244	C	22	Very low	25.3	Very low	97 Å²	97	129.2 Å²	129.2	66%	0.655	68%	0.68	S	S	*	*			trans	-63.2	84.1	154.6	-82.8	0	0	0	0	107.2	E1242 L1246	E1242-C1244 PolarHBondContact O-N 3.45Å; C1244-L1246 PolarHBondContact O-N 3.09Å; C1244-L1246 VanDerWaalsContact O-N 3.15Å
1245	I	24.3	Very low	25.5	Very low	136 Å²	136	129.1 Å²	129.1	70%	0.697	68%	0.684	S	S	*	*			trans	-64	102.5	140.2	-68.8	163.2	0	0	0	103.4	V1243 Q1247	V1243-I1245 HydrophobicContact CG1-CD1 4.26Å; V1243-I1245 HydrophobicContact CG1-CG1 3.88Å; V1243-I1245 PolarHBondContact O-N 3.4Å; I1245-Q1247 PolarHBondContact O-N 3.48Å
1246	L	25.1	Very low	25.5	Very low	158 Å²	158	130.3 Å²	130.3	83%	0.827	70%	0.696	S	S	*	*			trans	-56.9	92.2	160	-74.3	162.7	0	0	0	106.6	C1244 E1248	C1244-L1246 PolarHBondContact O-N 3.09Å; C1244-L1246 VanDerWaalsContact O-N 3.15Å; L1246-E1248 PolarHBondContact O-N 3.16Å
1247	Q	24.5	Very low	25.4	Very low	172 Å²	172	133 Å²	133	80%	0.804	70%	0.704	S	S	*	*			trans	-64.9	117.5	142.2	-102.8	170.3	-37.9	0	0	104.7	I1245 E1249	I1245-Q1247 PolarHBondContact O-N 3.48Å; Q1247-E1249 VanDerWaalsContact C-N 3.31Å; Q1247-E1249 PolarHBondContact O-N 3.02Å
1248	E	24.2	Very low	25.3	Very low	184 Å²	184	135.4 Å²	135.4	86%	0.86	72%	0.717	S	S	*	*			trans	-53.2	100.8	164.4	-80.3	173.1	144.1	0	0	107.7	L1246 L1250	L1246-E1248 PolarHBondContact O-N 3.16Å; E1248-L1250 VanDerWaalsContact C-N 3.26Å; E1248-L1250 PolarHBondContact O-N 3.38Å
1249	E	24.8	Very low	25.3	Very low	164 Å²	164	138.1 Å²	138.1	77%	0.766	73%	0.731	S	S	*	*			trans	-66.5	97	155.4	-79.3	-172.8	159.2	0	0	106.7	Q1247 Y1251	Q1247-E1249 VanDerWaalsContact C-N 3.31Å; Q1247-E1249 PolarHBondContact O-N 3.02Å; E1249-Y1251 VanDerWaalsContact C-N 3.32Å; E1249-Y1251 PolarHBondContact O-N 3.47Å
1250	L	24.8	Very low	25.1	Very low	129 Å²	129	140 Å²	140	68%	0.675	74%	0.744	S	S	*	*			trans	-66.3	93.8	168.3	-144	133.5	0	0	0	107.1	E1248 N1252	E1248-L1250 VanDerWaalsContact C-N 3.26Å; E1248-L1250 PolarHBondContact O-N 3.38Å; L1250-N1252 VanDerWaalsContact C-N 3.32Å; L1250-N1252 HydrophobicContact CD2-CB 4.34Å; L1250-N1252 WeakPolarHBondContact CD2-ND2 3.38Å; L1250-N1252 PolarHBondContact O-N 3.45Å
1251	Y	23.8	Very low	25.1	Very low	209 Å²	209	142.1 Å²	142.1	82%	0.82	76%	0.755	S	S	*	*			trans	-62.4	94.3	163.3	-90.9	-88	0	0	0	108.5	E1249	E1249-Y1251 VanDerWaalsContact C-N 3.32Å; E1249-Y1251 PolarHBondContact O-N 3.47Å
1252	N	24.8	Very low	24.9	Very low	140 Å²	140	144.2 Å²	144.2	75%	0.749	76%	0.764	S	S	*	*			trans	-102	99	162	-94.2	-4.7	0	0	0	109.2	L1250 S1254	L1250-N1252 VanDerWaalsContact C-N 3.32Å; L1250-N1252 HydrophobicContact CD2-CB 4.34Å; L1250-N1252 WeakPolarHBondContact CD2-ND2 3.38Å; L1250-N1252 PolarHBondContact O-N 3.45Å; N1252-S1254 PolarHBondContact O-N 3.34Å
1253	S	26.8	Very low	25.1	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	76%	0.763	S	S	*	*			trans	-77	105.7	158.5	52.2	0	0	0	0	109.6
1254	S	24.1	Very low	25	Very low	110 Å²	110	145.9 Å²	145.9	77%	0.769	77%	0.774	S	S	*	*			trans	38.1	114.6	143.1	65.7	0	0	0	0	120.8	N1252	N1252-S1254 PolarHBondContact O-N 3.34Å
1255	S	27.2	Very low	25.2	Very low	121 Å²	121	149.8 Å²	149.8	85%	0.846	78%	0.782	S	S	*	*				-162	144.7	123.8	62.8	0	0	0	0	110.8
1256	S	24.9	Very low	25.1	Very low	94 Å²	94	152 Å²	152	66%	0.657	79%	0.79	S	S	*	*			trans	-55.2	163.1	178.2	62.5	0	0	0	0	113.7
1257	D	26.8	Very low	25.2	Very low	139 Å²	139	153.6 Å²	153.6	74%	0.743	79%	0.793	S	S	*	*			cis	-160	171.3	40	-89.9	-58.2	0	0	0	111
1258	N	24	Very low	25.3	Very low	132 Å²	132	150.2 Å²	150.2	71%	0.706	79%	0.788	S	S	*	*			trans	-55	150	-169.9	-43.9	-61.9	0	0	0	118.7
1259	D	27.3	Very low	25.5	Very low	144 Å²	144	150.2 Å²	150.2	77%	0.77	79%	0.786	S	S	*	*				166.6	122.6	106.9	-82.1	-22.3	0	0	0	112.4
1260	D	24.5	Very low	25.6	Very low	149 Å²	149	148.1 Å²	148.1	80%	0.797	78%	0.779	S	S	*	*			trans	22.8	120.6	150.9	-57	-31.9	0	0	0	123
1261	E	27.4	Very low	25.6	Very low	189 Å²	189	146.9 Å²	146.9	88%	0.883	77%	0.773	S	S	*	*				171.2	137.4	107.5	-92	-170.1	176.7	0	0	113.2
1262	E	23.1	Very low	25.8	Very low	175 Å²	175	141.5 Å²	141.5	82%	0.818	76%	0.758	S	S	*	*			trans	1.9	130.9	164.1	-59.1	-179.2	148.6	0	0	122.1
1263	V	27.9	Very low	26	Very low	130 Å²	130	142.4 Å²	142.4	79%	0.788	76%	0.762	S	S	*	*				171.1	124.8	107.6	161.9	0	0	0	0	109.7
1264	Q	22.6	Very low	25.9	Very low	181 Å²	181	142.1 Å²	142.1	85%	0.846	76%	0.757	S	S	*	*			trans	-69.8	123.3	170.7	-72.9	168.7	-40.9	0	0	111.1
1265	E	25.7	Very low	25.9	Very low	180 Å²	180	147.3 Å²	147.3	84%	0.841	77%	0.766	S	S	*	*			trans	-129.3	117	153.2	-87.2	-171.3	160.6	0	0	110
1266	Q	24	Very low	25.8	Very low	183 Å²	183	150.4 Å²	150.4	86%	0.855	77%	0.767	S	S	*	*			trans	-107.9	93.4	-175.2	-162.2	165.7	2.2	0	0	105.7	S1268	Q1266-S1268 PolarHBondContact O-N 2.97Å
1267	E	26.6	Very low	25.7	Very low	190 Å²	190	155.3 Å²	155.3	89%	0.888	78%	0.779	S	S	*	*			trans	-80.5	103.1	176.3	-82.6	-168.9	150	0	0	110.6
1268	S	27.1	Very low	25.7	Very low	101 Å²	101	157.2 Å²	157.2	71%	0.706	78%	0.776	S	S	*	*			trans	-67.3	124.5	163.7	46.6	0	0	0	0	111.1	Q1266 D1270	Q1266-S1268 PolarHBondContact O-N 2.97Å; S1268-D1270 PolarHBondContact O-N 2.86Å
1269	K	26.7	Very low	25.7	Very low	185 Å²	185	156.9 Å²	156.9	80%	0.804	78%	0.779	S	S	*	*			trans	-69.8	109	170.4	-78.2	176	176.3	172.2	0	110.7
1270	D	28.6	Very low	25.6	Very low	119 Å²	119	158.5 Å²	158.5	64%	0.636	78%	0.781	S	S	*	*			trans	-91.5	116.1	169.4	-89.9	-22.7	0	0	0	112.3	S1268	S1268-D1270 PolarHBondContact O-N 2.86Å
1271	N	24.8	Very low	25.6	Very low	103 Å²	103	156.2 Å²	156.2	55%	0.551	78%	0.777	S	S	*	*			trans	-87.7	115	172.1	-99.8	-24.9	0	0	0	111	E1228	E1228-N1271 PolarHBondContact OE2-ND2 3.23Å
1272	L	27.4	Very low	25.5	Very low	96 Å²	96	154.9 Å²	154.9	50%	0.503	78%	0.775	S	S	.	*			trans	-151	92	168.8	-101.2	151.3	0	0	0	111.4
1273	I	28.1	Very low	25.6	Very low	159 Å²	159	155.9 Å²	155.9	82%	0.815	78%	0.777	S	S	*	*			trans	-106.1	132.4	163.1	-63	177.8	0	0	0	108.7
1274	P	25.3	Very low	25.6	Very low	104 Å²	104	156.5 Å²	156.5	68%	0.675	77%	0.766	S	S	*	*			trans	-72.6	142.7	-175.1	29.5	-33.6	0	0	0	112.7	Q1276	P1274-Q1276 PolarHBondContact O-N 2.93Å
1275	K	24.8	Very low	25.7	Very low	220 Å²	220	154.9 Å²	154.9	96%	0.957	76%	0.762	S	S	*	*			trans	-53.6	112.1	173.4	-73.3	174.3	176.2	174	0	111.1
1276	Q	24.4	Very low	25.8	Very low	185 Å²	185	151.6 Å²	151.6	86%	0.864	76%	0.756	S	S	*	*			trans	-113.6	130.3	162.2	-142.1	169	10.4	0	0	108.1	P1274 R1278	P1274-Q1276 PolarHBondContact O-N 2.93Å; Q1276-R1278 PolarHBondContact O-N 3.43Å
1277	E	22.2	Very low	26.1	Very low	197 Å²	197	147.4 Å²	147.4	92%	0.921	74%	0.739	S	S	*	*			trans	-49.8	114.8	-172.2	-71.4	167.9	140.4	0	0	112.2	V1279	E1277-V1279 PolarHBondContact O-N 3.06Å
1278	R	26.7	Very low	26.2	Very low	180 Å²	180	145.7 Å²	145.7	68%	0.679	73%	0.728	S	S	*	*			trans	-84.8	108.6	172.3	-81.7	-177	177.6	147.7	-2.9	109.4	R1231 Q1276 H1280	R1231-R1278 VanDerWaalsContact NH2-NH1 3.16Å; Q1276-R1278 PolarHBondContact O-N 3.43Å; R1278-H1280 PolarHBondContact O-N 3.47Å
1279	V	25	Very low	26.3	Very low	125 Å²	125	143 Å²	143	76%	0.758	71%	0.712	S	S	*	*			trans	-55.1	118.7	161.3	176.7	0	0	0	0	108.5	E1277 S1281	E1277-V1279 PolarHBondContact O-N 3.06Å; V1279-S1281 PolarHBondContact O-N 3.07Å
1280	H	23.8	Very low	26.5	Very low	178 Å²	178	136.8 Å²	136.8	82%	0.824	69%	0.686	S	S	*	*			trans	-72.2	105.7	176.9	-89.9	-74.8	0	0	0	110.3	R1278 L1282	R1278-H1280 PolarHBondContact O-N 3.47Å; H1280-L1282 PolarHBondContact O-N 3.29Å
1281	S	26.3	Very low	26.7	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	68%	0.684	S	S	*	*			trans	-73.1	112.2	156.5	52.7	0	0	0	0	108.5	V1279 F1283	V1279-S1281 PolarHBondContact O-N 3.07Å; S1281-F1283 PolarHBondContact O-N 3.02Å; S1281-F1283 VanDerWaalsContact O-N 3.11Å
1282	L	23.7	Very low	27.3	Very low	160 Å²	160	133.8 Å²	133.8	84%	0.838	68%	0.675	S	S	*	*			trans	-64.1	103.1	160.8	-81.1	148.4	0	0	0	106.8	H1280	H1280-L1282 PolarHBondContact O-N 3.29Å
1283	F	24.9	Very low	27.8	Very low	197 Å²	197	132.6 Å²	132.6	86%	0.864	67%	0.671	S	S	*	*	S	Bend	trans	170	135	140.9	-90	-67.5	0	0	0	111.1	S1281	S1281-F1283 PolarHBondContact O-N 3.02Å; S1281-F1283 VanDerWaalsContact O-N 3.11Å
1284	Y	27.8	Very low	28.6	Very low	142 Å²	142	126.9 Å²	126.9	56%	0.557	64%	0.644	S	S	*	*			trans	61	92.5	174.3	-116.6	-96.9	0	0	0	118.9	R1023	R1023-Y1284 PolarHBondContact NH1-OH 3.4Å
1285	I	25.6	Very low	29.4	Very low	147 Å²	147	123.1 Å²	123.1	75%	0.754	62%	0.619	S	S	*	*			trans	-76.9	120.2	161.1	-59.7	169.9	0	0	0	107.3	I1287	I1285-I1287 PolarHBondContact O-N 2.88Å; I1285-I1287 VanDerWaalsContact O-N 3.16Å
1286	P	28.1	Very low	30.7	Very low	112 Å²	112	115.9 Å²	115.9	73%	0.727	60%	0.595	S	S	*	*			trans	-68	114.8	169	5.5	8	0	0	0	107.4	K1288	P1286-K1288 PolarHBondContact O-N 3.15Å; P1286-K1288 VanDerWaalsContact O-N 3.13Å
1287	I	30.3	Very low	32.4	Very low	95 Å²	95	107.3 Å²	107.3	49%	0.487	56%	0.555	S	S	.	*			trans	-69.7	109.5	176.1	-60.7	169.8	0	0	0	107	V1188 I1285 A1289	V1188-I1287 HydrophobicContact CG2-CG2 3.97Å; I1285-I1287 PolarHBondContact O-N 2.88Å; I1285-I1287 VanDerWaalsContact O-N 3.16Å; I1287-A1289 PolarHBondContact O-N 3.36Å
1288	K	28.1	Very low	34.3	Very low	153 Å²	153	102.2 Å²	102.2	67%	0.665	53%	0.534	S	S	*	.			trans	-47.5	132.6	166.5	-79.7	-171.4	173.6	-171.5	0	108.4	P1286 E1290	P1286-K1288 PolarHBondContact O-N 3.15Å; P1286-K1288 VanDerWaalsContact O-N 3.13Å; K1288-E1290 VanDerWaalsContact C-N 3.28Å; K1288-E1290 PolarHBondContact O-N 3.43Å
1289	A	30	Very low	36.2	Very low	45 Å²	45	98.7 Å²	98.7	37%	0.372	53%	0.525	S	S	.	.			trans	-73.5	81.5	-176.1	0	0	0	0	0	110.4	I1015 I1287	I1015-A1289 HydrophobicContact CG2-CB 4.16Å; I1287-A1289 PolarHBondContact O-N 3.36Å
1290	E	30.8	Very low	38.2	Very low	54 Å²	54	93.4 Å²	93.4	25%	0.252	49%	0.493	S	S	.	.			trans	-74.2	146.7	170	-71.6	-175.9	173.3	0	0	111.1	R1019 L1192 K1288 I1292	R1019-E1290 PolarHBondContact NH2-O 3.5Å; L1192-E1290 WeakPolarHBondContact CD2-OE1 3.35Å; K1288-E1290 VanDerWaalsContact C-N 3.28Å; K1288-E1290 PolarHBondContact O-N 3.43Å; E1290-I1292 PolarHBondContact O-N 3.21Å
1291	P	32.9	Very low	40.5	Very low	92 Å²	92	85.1 Å²	85.1	60%	0.597	46%	0.455	S	S	*	.			trans	-63.5	116.1	174.5	25.3	-31.3	0	0	0	109.7	V1293	P1291-V1293 PolarHBondContact O-N 3.03Å; P1291-V1293 VanDerWaalsContact O-N 3.14Å
1292	I	36.9	Very low	42.6	Very low	68 Å²	68	83 Å²	83	35%	0.349	44%	0.435	S	S	.	.			trans	-72.6	106.5	173.1	-61	166.5	0	0	0	106.6	W1101 W1185 E1290 T1294	W1101-I1292 HydrophobicContact CB-CB 4.12Å; W1101-I1292 HydrophobicContact CB-CD1 4.32Å; W1101-I1292 HydrophobicContact CB-CG2 4.04Å; W1101-I1292 HydrophobicContact CD2-CD1 3.99Å; W1101-I1292 HydrophobicContact CE3-CD1 3.58Å; W1101-I1292 HydrophobicContact CG-CD1 4.31Å; W1101-I1292 HydrophobicContact CZ3-CD1 4.23Å; W1185-I1292 HydrophobicContact CH2-CG2 4.37Å; E1290-I1292 PolarHBondContact O-N 3.21Å; I1292-T1294 HydrophobicContact CG2-CG2 4.48Å; I1292-T1294 PolarHBondContact O-N 3.26Å
1293	V	37.6	Very low	45	Very low	71 Å²	71	78.6 Å²	78.6	43%	0.43	41%	0.41	S	S	.	.			trans	-78.3	114.3	165.7	178.7	0	0	0	0	108.1	L1161 P1291	L1161-V1293 HydrophobicContact CD1-CB 3.46Å; L1161-V1293 VanDerWaalsContact CD1-CB 3.46Å; L1161-V1293 HydrophobicContact CD1-CG1 3.67Å; L1161-V1293 HydrophobicContact CD1-CG2 3.35Å; L1161-V1293 HydrophobicContact CD2-CB 3.66Å; L1161-V1293 HydrophobicContact CD2-CG1 3.97Å; L1161-V1293 HydrophobicContact CD2-CG2 4.42Å; L1161-V1293 HydrophobicContact CG-CB 4.21Å; L1161-V1293 HydrophobicContact CG-CG1 4.43Å; L1161-V1293 HydrophobicContact CG-CG2 4.5Å; P1291-V1293 PolarHBondContact O-N 3.03Å; P1291-V1293 VanDerWaalsContact O-N 3.14Å
1294	T	44.7	Very low	47.5	Very low	39 Å²	39	69.6 Å²	69.6	24%	0.239	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-76.3	128	174.7	45.3	0	0	0	0	109.6	W1100 W1101 I1292	W1100-T1294 HydrophobicContact CG-CG2 4.28Å; W1101-T1294 HydrophobicContact CB-CG2 3.92Å; I1292-T1294 HydrophobicContact CG2-CG2 4.48Å; I1292-T1294 PolarHBondContact O-N 3.26Å
1295	P	42.2	Very low	49.7	Very low	25 Å²	25	62.9 Å²	62.9	16%	0.162	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-49.4	163	169.4	-8	-0.1	0	0	0	112.7	R1104 A1297 D1300	R1104-P1295 VanDerWaalsContact NH1-CG 3.28Å; P1295-A1297 PolarHBondContact O-N 3.2Å; P1295-D1300 WeakPolarHBondContact CG-OD2 3.34Å
1296	P	51.9	Low	52	Low	68 Å²	68	58 Å²	58	44%	0.442	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-53.4	116.6	177.5	21.4	-31.4	0	0	0	109.1	L1298 E1299	P1296-L1298 PolarHBondContact O-N 3.45Å; P1296-E1299 PolarHBondContact O-N 3.1Å
1297	A	60.7	Low	54.3	Low	4 Å²	4	55.2 Å²	55.2	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-54.8	-17.6	-169	0	0	0	0	0	114.9	C1095 V1133 P1295 V1301	C1095-A1297 HydrophobicContact CB-CB 3.53Å; V1133-A1297 HydrophobicContact CG2-CB 4.14Å; P1295-A1297 PolarHBondContact O-N 3.2Å; A1297-V1301 WeakPolarHBondContact O-CB 2.98Å; A1297-V1301 WeakPolarHBondContact O-CG2 3.31Å; A1297-V1301 PolarHBondContact O-N 3.13Å
1298	L	63.3	Low	56.4	Low	91 Å²	91	50.7 Å²	50.7	48%	0.476	27%	0.271	S	S	.	.	H	α-helix	trans	-66.8	-49.4	174.4	-169.5	65	0	0	0	113.8	V1133 P1296 D1300 V1301 L1302	V1133-L1298 HydrophobicContact CB-CD1 4.13Å; V1133-L1298 VanDerWaalsContact CG1-CA 3.48Å; V1133-L1298 HydrophobicContact CG1-CB 3.42Å; V1133-L1298 VanDerWaalsContact CG1-CB 3.42Å; V1133-L1298 HydrophobicContact CG1-CD1 3.38Å; V1133-L1298 HydrophobicContact CG1-CG 3.93Å; P1296-L1298 PolarHBondContact O-N 3.45Å; L1298-D1300 VanDerWaalsContact C-N 3.33Å; L1298-V1301 PolarHBondContact O-N 3.15Å; L1298-L1302 HydrophobicContact CD1-CD1 4.14Å; L1298-L1302 HydrophobicContact CD1-CG 4.4Å; L1298-L1302 HydrophobicContact CG-CD1 4Å; L1298-L1302 WeakPolarHBondContact O-CB 3.31Å; L1298-L1302 WeakPolarHBondContact O-CG 3.3Å; L1298-L1302 PolarHBondContact O-N 3.47Å
1299	E	65.8	Low	58.6	Low	105 Å²	105	43.7 Å²	43.7	49%	0.491	24%	0.24	S	C	.	.	H	α-helix	trans	-66.1	-41.8	-179.5	-67	-177.4	172.5	0	0	110.1	P1296 L1302 E1303	P1296-E1299 PolarHBondContact O-N 3.1Å; E1299-L1302 PolarHBondContact O-N 3.28Å; E1299-E1303 WeakPolarHBondContact O-CB 3.46Å; E1299-E1303 PolarHBondContact O-N 3.37Å
1300	D	67.7	Low	60.7	Low	15 Å²	15	45.9 Å²	45.9	8%	0.08	24%	0.243	C	C	.	.	H	α-helix	trans	-62.4	-46.4	177.1	-79	-26.9	0	0	0	112.7	R1104 P1295 L1298 L1304	R1104-D1300 IonicContact CZ-OD1 2.85Å; R1104-D1300 IonicContact CZ-OD2 3.15Å; R1104-D1300 IonicContact NE-OD2 3.74Å; R1104-D1300 VanDerWaalsContact NH1-CG 3.26Å; R1104-D1300 IonicContact NH1-OD1 3.34Å; R1104-D1300 PolarHBondContact NH1-OD1 3.25Å; R1104-D1300 IonicContact NH1-OD2 3.75Å; R1104-D1300 PolarHBondContact NH1-OD2 3.24Å; R1104-D1300 IonicContact NH2-OD1 3.64Å; R1104-D1300 PolarHBondContact NH2-OD1 3.21Å; R1104-D1300 IonicContact NH2-OD2 2.72Å; P1295-D1300 WeakPolarHBondContact CG-OD2 3.34Å; L1298-D1300 VanDerWaalsContact C-N 3.33Å; D1300-L1304 VanDerWaalsContact O-CB 3.22Å; D1300-L1304 WeakPolarHBondContact O-CB 3Å; D1300-L1304 PolarHBondContact O-N 3.47Å
1301	V	72	Confident	62.8	Low	4 Å²	4	47.2 Å²	47.2	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-69.2	-36.6	-179.2	169.9	0	0	0	0	110.8	W1100 L1129 I1130 V1133 A1297 L1298 T1305	W1100-V1301 HydrophobicContact CH2-CG2 3.97Å; W1100-V1301 HydrophobicContact CZ2-CG2 3.96Å; L1129-V1301 HydrophobicContact CB-CG1 3.91Å; L1129-V1301 HydrophobicContact CB-CG2 4.33Å; I1130-V1301 HydrophobicContact CG1-CG1 4.09Å; V1133-V1301 HydrophobicContact CG2-CB 4.29Å; V1133-V1301 HydrophobicContact CG2-CG2 3.96Å; A1297-V1301 WeakPolarHBondContact O-CB 2.98Å; A1297-V1301 WeakPolarHBondContact O-CG2 3.31Å; A1297-V1301 PolarHBondContact O-N 3.13Å; L1298-V1301 PolarHBondContact O-N 3.15Å; V1301-T1305 VanDerWaalsContact O-CB 3.32Å; V1301-T1305 WeakPolarHBondContact O-CB 3.47Å; V1301-T1305 PolarHBondContact O-N 3.09Å; V1301-T1305 PolarHBondContact O-OG1 3.35Å
1302	L	70.5	Confident	64.6	Low	56 Å²	56	43.2 Å²	43.2	29%	0.293	22%	0.22	S	C	.	.	H	α-helix	trans	-66.6	-46.4	175	-71.7	172.3	0	0	0	111.6	L1298 E1299 L1304 T1305 E1306	L1298-L1302 HydrophobicContact CD1-CD1 4.14Å; L1298-L1302 HydrophobicContact CD1-CG 4.4Å; L1298-L1302 HydrophobicContact CG-CD1 4Å; L1298-L1302 WeakPolarHBondContact O-CB 3.31Å; L1298-L1302 WeakPolarHBondContact O-CG 3.3Å; L1298-L1302 PolarHBondContact O-N 3.47Å; E1299-L1302 PolarHBondContact O-N 3.28Å; L1302-L1304 VanDerWaalsContact C-N 3.34Å; L1302-L1304 PolarHBondContact O-N 2.86Å; L1302-T1305 PolarHBondContact O-N 3.31Å; L1302-E1306 PolarHBondContact O-N 2.88Å
1303	E	73.9	Confident	66.2	Low	67 Å²	67	46.2 Å²	46.2	31%	0.313	23%	0.227	S	C	.	.	H	α-helix	trans	-62	-42.1	175.9	-175.3	-174.1	170.8	0	0	111.6	E1299 T1305 E1306 R1307	E1299-E1303 WeakPolarHBondContact O-CB 3.46Å; E1299-E1303 PolarHBondContact O-N 3.37Å; E1303-T1305 VanDerWaalsContact C-N 3.35Å; E1303-E1306 PolarHBondContact O-N 2.8Å; E1303-R1307 WeakPolarHBondContact O-CG 3.25Å; E1303-R1307 PolarHBondContact O-N 2.76Å
1304	L	76.2	Confident	67.5	Low	9 Å²	9	46.5 Å²	46.5	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-45.4	174.5	177.7	66.9	0	0	0	111.2	C1107 L1110 P1111 L1129 D1300 L1302 E1306 R1307 V1308	C1107-L1304 HydrophobicContact CB-CD2 3.74Å; C1107-L1304 WeakPolarHBondContact O-CD1 3.45Å; L1110-L1304 HydrophobicContact CD1-CD2 4.18Å; P1111-L1304 HydrophobicContact CG-CD1 4.16Å; L1129-L1304 HydrophobicContact CD1-CD2 4.44Å; D1300-L1304 VanDerWaalsContact O-CB 3.22Å; D1300-L1304 WeakPolarHBondContact O-CB 3Å; D1300-L1304 PolarHBondContact O-N 3.47Å; L1302-L1304 VanDerWaalsContact C-N 3.34Å; L1302-L1304 PolarHBondContact O-N 2.86Å; L1304-E1306 VanDerWaalsContact C-N 3.34Å; L1304-E1306 PolarHBondContact O-N 3.16Å; L1304-R1307 PolarHBondContact O-N 3.38Å; L1304-V1308 HydrophobicContact CD1-CG2 4.29Å; L1304-V1308 HydrophobicContact CG-CG2 4.46Å; L1304-V1308 VanDerWaalsContact O-CG2 3.29Å; L1304-V1308 WeakPolarHBondContact O-CG2 3.26Å; L1304-V1308 PolarHBondContact O-N 3.39Å
1305	T	74.9	Confident	68.6	Low	1 Å²	1	47.1 Å²	47.1	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-44.6	178	-56.6	0	0	0	0	110.5	L1126 I1130 V1301 L1302 E1303 R1307 V1308 L1309 V1320	L1126-T1305 HydrophobicContact CD1-CG2 4.42Å; L1126-T1305 HydrophobicContact CD2-CG2 4.39Å; I1130-T1305 HydrophobicContact CD1-CG2 4.41Å; V1301-T1305 VanDerWaalsContact O-CB 3.32Å; V1301-T1305 WeakPolarHBondContact O-CB 3.47Å; V1301-T1305 PolarHBondContact O-N 3.09Å; V1301-T1305 PolarHBondContact O-OG1 3.35Å; L1302-T1305 PolarHBondContact O-N 3.31Å; E1303-T1305 VanDerWaalsContact C-N 3.35Å; T1305-R1307 PolarHBondContact O-N 3.25Å; T1305-V1308 PolarHBondContact O-N 3.47Å; T1305-L1309 HydrophobicContact CG2-CD1 3.92Å; T1305-L1309 HydrophobicContact CG2-CG 4.32Å; T1305-L1309 WeakPolarHBondContact O-CB 3.42Å; T1305-L1309 WeakPolarHBondContact O-CG 3.08Å; T1305-L1309 PolarHBondContact O-N 3.43Å; T1305-V1320 HydrophobicContact CG2-CG1 3.99Å
1306	E	73.4	Confident	69.7	Low	43 Å²	43	47.1 Å²	47.1	20%	0.201	24%	0.244	C	C	.	.	H	α-helix	trans	-56.2	-48.7	174	-79.9	-173.9	-179.1	0	0	112.1	L1302 E1303 L1304 V1308 L1309 Q1310 S1334 L1335	L1302-E1306 PolarHBondContact O-N 2.88Å; E1303-E1306 PolarHBondContact O-N 2.8Å; L1304-E1306 VanDerWaalsContact C-N 3.34Å; L1304-E1306 PolarHBondContact O-N 3.16Å; E1306-V1308 PolarHBondContact O-N 3.38Å; E1306-L1309 PolarHBondContact O-N 2.57Å; E1306-Q1310 PolarHBondContact O-N 2.78Å; E1306-S1334 PolarHBondContact OE1-OG 3.36Å; E1306-L1335 HydrophobicContact CG-CD1 3.22Å
1307	R	76.6	Confident	70.3	Confident	55 Å²	55	44.3 Å²	44.3	21%	0.208	23%	0.226	C	C	.	.	H	α-helix	trans	-67.1	-35.6	-179.2	-71.7	-174.4	-66	152.2	-3.3	113.1	E1108 P1111 E1303 L1304 T1305 Y1311	E1108-R1307 IonicContact OE1-CZ 3.76Å; E1108-R1307 VanDerWaalsContact OE1-CZ 3.28Å; E1108-R1307 IonicContact OE1-NH1 3.28Å; E1108-R1307 PolarHBondContact OE1-NH1 3.26Å; E1108-R1307 IonicContact OE1-NH2 2.92Å; E1108-R1307 PolarHBondContact OE1-NH2 3.26Å; E1108-R1307 IonicContact OE2-CZ 2.83Å; E1108-R1307 IonicContact OE2-NH1 3.81Å; E1108-R1307 IonicContact OE2-NH2 3.76Å; E1108-R1307 PolarHBondContact OE2-NH2 2.97Å; P1111-R1307 HydrophobicContact CB-CB 4.25Å; P1111-R1307 HydrophobicContact CG-CB 3.81Å; E1303-R1307 WeakPolarHBondContact O-CG 3.25Å; E1303-R1307 PolarHBondContact O-N 2.76Å; L1304-R1307 PolarHBondContact O-N 3.38Å; T1305-R1307 PolarHBondContact O-N 3.25Å; R1307-Y1311 VanDerWaalsContact O-CD2 3.24Å; R1307-Y1311 WeakPolarHBondContact O-CD2 3.14Å; R1307-Y1311 VanDerWaalsContact O-CE2 3.31Å; R1307-Y1311 WeakPolarHBondContact O-CE2 3.15Å
1308	V	75.1	Confident	70.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.4	-45.3	175.3	171.9	0	0	0	0	110.1	L1110 P1111 M1114 P1122 L1126 L1304 T1305 E1306 Q1310 Y1311 C1312	L1110-V1308 HydrophobicContact CB-CG2 3.65Å; P1111-V1308 HydrophobicContact CG-CG2 3.91Å; M1114-V1308 HydrophobicContact CG-CG1 3.94Å; P1122-V1308 HydrophobicContact CB-CG1 4.28Å; P1122-V1308 HydrophobicContact CG-CG1 3.92Å; L1126-V1308 HydrophobicContact CD1-CG1 4.14Å; L1304-V1308 HydrophobicContact CD1-CG2 4.29Å; L1304-V1308 HydrophobicContact CG-CG2 4.46Å; L1304-V1308 VanDerWaalsContact O-CG2 3.29Å; L1304-V1308 WeakPolarHBondContact O-CG2 3.26Å; L1304-V1308 PolarHBondContact O-N 3.39Å; T1305-V1308 PolarHBondContact O-N 3.47Å; E1306-V1308 PolarHBondContact O-N 3.38Å; V1308-Q1310 PolarHBondContact O-N 3.04Å; V1308-Y1311 PolarHBondContact O-N 3.27Å; V1308-Y1311 VanDerWaalsContact O-N 3.15Å; V1308-C1312 PolarHBondContact O-SG 3.39Å; V1308-C1312 VanDerWaalsContact O-SG 3.37Å
1309	L	73.9	Confident	71	Confident	6 Å²	6	44.5 Å²	44.5	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-31	-178	-73.1	172.4	0	0	0	113.2	T1305 E1306 Y1311 C1312 V1317 V1320 Q1342	T1305-L1309 HydrophobicContact CG2-CD1 3.92Å; T1305-L1309 HydrophobicContact CG2-CG 4.32Å; T1305-L1309 WeakPolarHBondContact O-CB 3.42Å; T1305-L1309 WeakPolarHBondContact O-CG 3.08Å; T1305-L1309 PolarHBondContact O-N 3.43Å; E1306-L1309 PolarHBondContact O-N 2.57Å; L1309-Y1311 PolarHBondContact O-N 3.12Å; L1309-C1312 PolarHBondContact O-N 3.48Å; L1309-C1312 VanDerWaalsContact O-N 3.1Å; L1309-V1317 HydrophobicContact CD2-CB 4.36Å; L1309-V1317 HydrophobicContact CD2-CG1 4.48Å; L1309-V1317 HydrophobicContact CD2-CG2 4.03Å; L1309-V1320 HydrophobicContact CD1-CG1 4.07Å; L1309-V1320 HydrophobicContact CD2-CB 3.86Å; L1309-V1320 HydrophobicContact CD2-CG1 3.98Å; L1309-V1320 HydrophobicContact CD2-CG2 4.07Å; L1309-V1320 HydrophobicContact CG-CG1 4.44Å; L1309-Q1342 PolarHBondContact O-NE2 3.41Å; L1309-Q1342 PolarHBondContact O-OE1 3.44Å
1310	Q	74.5	Confident	70.9	Confident	90 Å²	90	39.5 Å²	39.5	42%	0.421	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-25.2	176.3	-74.5	176.8	5.5	0	0	114.2	E1306 V1308 Q1342	E1306-Q1310 PolarHBondContact O-N 2.78Å; V1308-Q1310 PolarHBondContact O-N 3.04Å; Q1310-Q1342 VanDerWaalsContact CA-NE2 3.31Å; Q1310-Q1342 PolarHBondContact O-NE2 3.31Å
1311	Y	74.4	Confident	70.7	Confident	82 Å²	82	42.8 Å²	42.8	32%	0.322	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-0.2	-176.5	-52	-75.7	0	0	0	113.3	P1111 Q1115 R1307 V1308 L1309	P1111-Y1311 HydrophobicContact CB-CD2 4.44Å; P1111-Y1311 HydrophobicContact CB-CE2 4.36Å; Q1115-Y1311 HydrophobicContact CG-CD1 3.41Å; Q1115-Y1311 VanDerWaalsContact CG-CD1 3.41Å; Q1115-Y1311 HydrophobicContact CG-CD2 4Å; Q1115-Y1311 HydrophobicContact CG-CE1 3.52Å; Q1115-Y1311 HydrophobicContact CG-CE2 4.13Å; Q1115-Y1311 HydrophobicContact CG-CG 3.66Å; Q1115-Y1311 VanDerWaalsContact NE2-CE1 3.35Å; Q1115-Y1311 PolarHBondContact NE2-OH 2.71Å; Q1115-Y1311 VanDerWaalsContact NE2-OH 3.08Å; R1307-Y1311 VanDerWaalsContact O-CD2 3.24Å; R1307-Y1311 WeakPolarHBondContact O-CD2 3.14Å; R1307-Y1311 VanDerWaalsContact O-CE2 3.31Å; R1307-Y1311 WeakPolarHBondContact O-CE2 3.15Å; V1308-Y1311 PolarHBondContact O-N 3.27Å; V1308-Y1311 VanDerWaalsContact O-N 3.15Å; L1309-Y1311 PolarHBondContact O-N 3.12Å
1312	C	71	Confident	70.6	Confident	8 Å²	8	48.4 Å²	48.4	5%	0.054	25%	0.247	C	C	.	.	S	Bend	trans	-83.1	151.6	178.9	-72.9	0	0	0	0	112.2	V1308 L1309 T1316 V1317	V1308-C1312 PolarHBondContact O-SG 3.39Å; V1308-C1312 VanDerWaalsContact O-SG 3.37Å; L1309-C1312 PolarHBondContact O-N 3.48Å; L1309-C1312 VanDerWaalsContact O-N 3.1Å; C1312-T1316 HydrophobicContact CB-CG2 4.3Å; C1312-V1317 HydrophobicContact CB-CG2 3.9Å
1313	R	70.1	Confident	70.3	Confident	131 Å²	131	46 Å²	46	49%	0.494	23%	0.234	S	C	.	.			trans	-67.7	155.2	170.6	-76.8	-174.2	167	-152.2	-11.5	112.3	F1119 G1315 T1316 V1317	F1119-R1313 VanDerWaalsContact CE1-NH1 3.28Å; R1313-G1315 PolarHBondContact O-N 2.9Å; R1313-G1315 VanDerWaalsContact O-N 3.12Å; R1313-T1316 WeakPolarHBondContact O-CB 3.37Å; R1313-T1316 PolarHBondContact O-N 3.04Å; R1313-V1317 WeakPolarHBondContact O-CG2 3.43Å; R1313-V1317 PolarHBondContact O-N 2.95Å
1314	P	65.6	Low	69.7	Low	77 Å²	77	44.2 Å²	44.2	50%	0.5	23%	0.227	S	C	.	.	H	α-helix	trans	-53.1	-36.7	-179.4	-26.3	33	0	0	0	114.3	V1317 T1318 L1346	P1314-V1317 PolarHBondContact O-N 2.97Å; P1314-T1318 WeakPolarHBondContact O-CB 3.29Å; P1314-T1318 PolarHBondContact O-N 3.3Å; P1314-T1318 PolarHBondContact O-OG1 3.15Å; P1314-L1346 HydrophobicContact CG-CD1 4.43Å
1315	G	66.1	Low	69.1	Low	52 Å²	52	47.5 Å²	47.5	54%	0.536	25%	0.251	S	S	.	.	H	α-helix	trans	-63.5	-44.2	177.1	0	0	0	0	0	113.1	R1313 T1318 A1319	R1313-G1315 PolarHBondContact O-N 2.9Å; R1313-G1315 VanDerWaalsContact O-N 3.12Å; G1315-T1318 PolarHBondContact O-N 3.31Å; G1315-A1319 PolarHBondContact O-N 2.98Å
1316	T	66.3	Low	68.3	Low	26 Å²	26	53.2 Å²	53.2	16%	0.16	28%	0.281	C	S	.	.	H	α-helix	trans	-66.3	-40.6	175.3	-42.6	0	0	0	0	111	I1123 C1312 R1313 T1318 A1319 V1320	I1123-T1316 HydrophobicContact CD1-CG2 3.77Å; I1123-T1316 HydrophobicContact CG1-CG2 3.65Å; C1312-T1316 HydrophobicContact CB-CG2 4.3Å; R1313-T1316 WeakPolarHBondContact O-CB 3.37Å; R1313-T1316 PolarHBondContact O-N 3.04Å; T1316-T1318 VanDerWaalsContact C-N 3.29Å; T1316-T1318 PolarHBondContact O-N 3.44Å; T1316-A1319 PolarHBondContact O-N 3.19Å; T1316-V1320 WeakPolarHBondContact O-CG2 3.41Å; T1316-V1320 PolarHBondContact O-N 3.29Å
1317	V	65.4	Low	67.2	Low	9 Å²	9	54 Å²	54	6%	0.055	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-40	174.6	177.2	0	0	0	0	110.9	L1309 C1312 R1313 P1314 V1320 R1321 I1339	L1309-V1317 HydrophobicContact CD2-CB 4.36Å; L1309-V1317 HydrophobicContact CD2-CG1 4.48Å; L1309-V1317 HydrophobicContact CD2-CG2 4.03Å; C1312-V1317 HydrophobicContact CB-CG2 3.9Å; R1313-V1317 WeakPolarHBondContact O-CG2 3.43Å; R1313-V1317 PolarHBondContact O-N 2.95Å; P1314-V1317 PolarHBondContact O-N 2.97Å; V1317-V1320 PolarHBondContact O-N 3.45Å; V1317-R1321 VanDerWaalsContact O-CB 3.23Å; V1317-R1321 WeakPolarHBondContact O-CB 3.41Å; V1317-R1321 PolarHBondContact O-N 2.82Å; V1317-I1339 HydrophobicContact CG1-CG2 4.03Å
1318	T	68.9	Low	65.7	Low	69 Å²	69	58.4 Å²	58.4	42%	0.423	31%	0.312	S	S	.	.	H	α-helix	trans	-66.6	-41.9	178.4	-52.7	0	0	0	0	111.7	P1314 G1315 T1316 R1321 Q1322	P1314-T1318 WeakPolarHBondContact O-CB 3.29Å; P1314-T1318 PolarHBondContact O-N 3.3Å; P1314-T1318 PolarHBondContact O-OG1 3.15Å; G1315-T1318 PolarHBondContact O-N 3.31Å; T1316-T1318 VanDerWaalsContact C-N 3.29Å; T1316-T1318 PolarHBondContact O-N 3.44Å; T1318-R1321 WeakPolarHBondContact O-CB 3.46Å; T1318-R1321 PolarHBondContact O-N 3.24Å; T1318-Q1322 PolarHBondContact O-N 3Å
1319	A	68.1	Low	64.4	Low	29 Å²	29	62 Å²	62	24%	0.24	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-40.6	176.4	0	0	0	0	0	112.4	I1123 G1315 T1316 Q1322 I1323	I1123-A1319 HydrophobicContact CD1-CB 3.67Å; G1315-A1319 PolarHBondContact O-N 2.98Å; T1316-A1319 PolarHBondContact O-N 3.19Å; A1319-Q1322 PolarHBondContact O-N 2.63Å; A1319-I1323 VanDerWaalsContact O-CG1 3.24Å; A1319-I1323 WeakPolarHBondContact O-CG1 3.49Å; A1319-I1323 PolarHBondContact O-N 2.88Å
1320	V	64.6	Low	63	Low	0 Å²	0	67.8 Å²	67.8	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-69.6	-35.4	174.4	179	0	0	0	0	111.1	I1123 L1126 T1305 L1309 T1316 V1317 I1323 L1324	I1123-V1320 HydrophobicContact CG1-CG2 4.03Å; L1126-V1320 HydrophobicContact CD1-CG2 4.1Å; T1305-V1320 HydrophobicContact CG2-CG1 3.99Å; L1309-V1320 HydrophobicContact CD1-CG1 4.07Å; L1309-V1320 HydrophobicContact CD2-CB 3.86Å; L1309-V1320 HydrophobicContact CD2-CG1 3.98Å; L1309-V1320 HydrophobicContact CD2-CG2 4.07Å; L1309-V1320 HydrophobicContact CG-CG1 4.44Å; T1316-V1320 WeakPolarHBondContact O-CG2 3.41Å; T1316-V1320 PolarHBondContact O-N 3.29Å; V1317-V1320 PolarHBondContact O-N 3.45Å; V1320-I1323 WeakPolarHBondContact O-CB 3.4Å; V1320-I1323 PolarHBondContact O-N 3.15Å; V1320-L1324 HydrophobicContact CG1-CD1 3.85Å; V1320-L1324 HydrophobicContact CG1-CG 4.39Å; V1320-L1324 WeakPolarHBondContact O-CB 3.42Å; V1320-L1324 WeakPolarHBondContact O-CD1 3.3Å; V1320-L1324 VanDerWaalsContact O-CG 3.26Å; V1320-L1324 WeakPolarHBondContact O-CG 3.48Å; V1320-L1324 PolarHBondContact O-N 3.13Å
1321	R	64.2	Low	61.6	Low	85 Å²	85	69.5 Å²	69.5	32%	0.321	39%	0.387	S	S	.	.	H	α-helix	trans	-62.7	-42.1	172.1	-174	-172.6	-100.5	169.4	-9.9	111.2	V1317 T1318 L1324 S1325 E1343	V1317-R1321 VanDerWaalsContact O-CB 3.23Å; V1317-R1321 WeakPolarHBondContact O-CB 3.41Å; V1317-R1321 PolarHBondContact O-N 2.82Å; T1318-R1321 WeakPolarHBondContact O-CB 3.46Å; T1318-R1321 PolarHBondContact O-N 3.24Å; R1321-L1324 CarbonylContact O-C 3.6Å; R1321-L1324 PolarHBondContact O-N 2.81Å; R1321-S1325 VanDerWaalsContact O-CB 3.31Å; R1321-S1325 WeakPolarHBondContact O-CB 3.46Å; R1321-S1325 PolarHBondContact O-N 3.42Å; R1321-S1325 PolarHBondContact O-OG 3.46Å; R1321-S1325 VanDerWaalsContact O-OG 3.1Å; R1321-E1343 IonicContact CZ-OE1 2.99Å; R1321-E1343 VanDerWaalsContact CZ-OE1 3.3Å; R1321-E1343 IonicContact NH1-OE1 3.09Å; R1321-E1343 PolarHBondContact NH1-OE1 3.16Å; R1321-E1343 IonicContact NH2-OE1 3.58Å; R1321-E1343 PolarHBondContact NH2-OE1 2.98Å; R1321-E1343 IonicContact NH2-OE2 3.75Å
1322	Q	68.5	Low	60.4	Low	122 Å²	122	69.4 Å²	69.4	57%	0.57	40%	0.397	S	S	*	.	H	α-helix	trans	-61.7	-45.8	174	-84.4	-179.1	-20.3	0	0	111.8	T1318 A1319 L1324 S1325 D1326	T1318-Q1322 PolarHBondContact O-N 3Å; A1319-Q1322 PolarHBondContact O-N 2.63Å; Q1322-L1324 PolarHBondContact O-N 3.5Å; Q1322-S1325 VanDerWaalsContact CA-OG 3.26Å; Q1322-S1325 WeakPolarHBondContact CA-OG 3.4Å; Q1322-S1325 PolarHBondContact O-N 3.33Å; Q1322-S1325 PolarHBondContact O-OG 2.82Å; Q1322-D1326 PolarHBondContact O-N 3.3Å
1323	I	65.2	Low	59.6	Low	4 Å²	4	72.8 Å²	72.8	2%	0.021	42%	0.42	C	S	.	.	H	α-helix	trans	-53.6	-58.7	172.5	-68.7	165.6	0	0	0	108.2	I1123 R1127 A1319 V1320 S1325 D1326 F1327	I1123-I1323 HydrophobicContact CG2-CD1 3.62Å; R1127-I1323 HydrophobicContact CB-CD1 4.13Å; R1127-I1323 HydrophobicContact CG-CD1 4.22Å; R1127-I1323 HydrophobicContact CG-CG2 4.38Å; A1319-I1323 VanDerWaalsContact O-CG1 3.24Å; A1319-I1323 WeakPolarHBondContact O-CG1 3.49Å; A1319-I1323 PolarHBondContact O-N 2.88Å; V1320-I1323 WeakPolarHBondContact O-CB 3.4Å; V1320-I1323 PolarHBondContact O-N 3.15Å; I1323-S1325 VanDerWaalsContact C-N 3.32Å; I1323-S1325 PolarHBondContact O-N 2.85Å; I1323-D1326 WeakPolarHBondContact O-CB 3.43Å; I1323-D1326 PolarHBondContact O-N 3.27Å; I1323-D1326 VanDerWaalsContact O-N 3.14Å; I1323-F1327 HydrophobicContact CG2-CD2 4Å; I1323-F1327 HydrophobicContact CG2-CE2 3.68Å; I1323-F1327 WeakPolarHBondContact O-CD2 3.42Å; I1323-F1327 VanDerWaalsContact O-CE2 3.31Å; I1323-F1327 WeakPolarHBondContact O-CE2 3.29Å
1324	L	61.3	Low	58.7	Low	31 Å²	31	69.8 Å²	69.8	16%	0.162	42%	0.419	C	S	.	.	H	α-helix	trans	-60.9	-33.7	-178.4	-68.9	160.8	0	0	0	114.2	I1130 V1320 R1321 Q1322 F1327 L1335	I1130-L1324 HydrophobicContact CD1-CD2 4.03Å; V1320-L1324 HydrophobicContact CG1-CD1 3.85Å; V1320-L1324 HydrophobicContact CG1-CG 4.39Å; V1320-L1324 WeakPolarHBondContact O-CB 3.42Å; V1320-L1324 WeakPolarHBondContact O-CD1 3.3Å; V1320-L1324 VanDerWaalsContact O-CG 3.26Å; V1320-L1324 WeakPolarHBondContact O-CG 3.48Å; V1320-L1324 PolarHBondContact O-N 3.13Å; R1321-L1324 CarbonylContact O-C 3.6Å; R1321-L1324 PolarHBondContact O-N 2.81Å; Q1322-L1324 PolarHBondContact O-N 3.5Å; L1324-F1327 CarbonylContact O-C 3.59Å; L1324-F1327 PolarHBondContact O-N 3.1Å; L1324-L1335 HydrophobicContact CD1-CD2 3.6Å; L1324-L1335 HydrophobicContact CD2-CD2 4.25Å; L1324-L1335 HydrophobicContact CG-CD2 4.43Å
1325	S	62.5	Low	58	Low	78 Å²	78	67.4 Å²	67.4	55%	0.545	40%	0.402	S	S	.	.	H	α-helix	trans	-73.8	-27.7	177.7	61.8	0	0	0	0	113	R1321 Q1322 I1323 F1327	R1321-S1325 VanDerWaalsContact O-CB 3.31Å; R1321-S1325 WeakPolarHBondContact O-CB 3.46Å; R1321-S1325 PolarHBondContact O-N 3.42Å; R1321-S1325 PolarHBondContact O-OG 3.46Å; R1321-S1325 VanDerWaalsContact O-OG 3.1Å; Q1322-S1325 VanDerWaalsContact CA-OG 3.26Å; Q1322-S1325 WeakPolarHBondContact CA-OG 3.4Å; Q1322-S1325 PolarHBondContact O-N 3.33Å; Q1322-S1325 PolarHBondContact O-OG 2.82Å; I1323-S1325 VanDerWaalsContact C-N 3.32Å; I1323-S1325 PolarHBondContact O-N 2.85Å; S1325-F1327 PolarHBondContact O-N 3.49Å
1326	D	58.7	Low	57.6	Low	120 Å²	120	68.9 Å²	68.9	64%	0.642	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-7.7	171.1	-64	-19.1	0	0	0	111.8	Q1322 I1323	Q1322-D1326 PolarHBondContact O-N 3.3Å; I1323-D1326 WeakPolarHBondContact O-CB 3.43Å; I1323-D1326 PolarHBondContact O-N 3.27Å; I1323-D1326 VanDerWaalsContact O-N 3.14Å
1327	F	49.5	Very low	57	Low	59 Å²	59	74.8 Å²	74.8	26%	0.259	42%	0.419	S	S	.	.	S	Bend	trans	-118.7	84.3	-176.8	-62.6	-74.1	0	0	0	111.8	I1130 I1323 L1324 S1325 S1329	I1130-F1327 HydrophobicContact CG2-CD2 4.48Å; I1323-F1327 HydrophobicContact CG2-CD2 4Å; I1323-F1327 HydrophobicContact CG2-CE2 3.68Å; I1323-F1327 WeakPolarHBondContact O-CD2 3.42Å; I1323-F1327 VanDerWaalsContact O-CE2 3.31Å; I1323-F1327 WeakPolarHBondContact O-CE2 3.29Å; L1324-F1327 CarbonylContact O-C 3.59Å; L1324-F1327 PolarHBondContact O-N 3.1Å; S1325-F1327 PolarHBondContact O-N 3.49Å; F1327-S1329 PolarHBondContact O-N 3.27Å; F1327-S1329 VanDerWaalsContact O-N 3.1Å
1328	D	46.2	Very low	56.2	Low	149 Å²	149	76.3 Å²	76.3	80%	0.797	43%	0.43	S	S	*	.			trans	-40.8	114.2	170.5	-75.2	-36.8	0	0	0	112.6	R1134	R1134-D1328 PolarHBondContact NH2-O 2.95Å
1329	S	47.6	Very low	55.4	Low	75 Å²	75	73.6 Å²	73.6	52%	0.524	41%	0.412	S	S	.	.			trans	-133.7	138.7	178.7	162.1	0	0	0	0	109.4	F1327 N1331	F1327-S1329 PolarHBondContact O-N 3.27Å; F1327-S1329 VanDerWaalsContact O-N 3.1Å; S1329-N1331 PolarHBondContact O-N 2.77Å; S1329-N1331 VanDerWaalsContact O-N 3.11Å
1330	P	43.5	Very low	54.7	Low	128 Å²	128	79.4 Å²	79.4	83%	0.831	43%	0.428	S	S	*	.	S	Bend	trans	-76.4	5.7	-170.6	-10.6	27.1	0	0	0	115.8
1331	N	46.1	Very low	54.1	Low	125 Å²	125	84.2 Å²	84.2	67%	0.668	45%	0.453	S	S	*	.			trans	-143.3	77.2	-178.1	-100	-26.1	0	0	0	112.8	S1329 S1333	S1329-N1331 PolarHBondContact O-N 2.77Å; S1329-N1331 VanDerWaalsContact O-N 3.11Å; N1331-S1333 VanDerWaalsContact C-N 3.27Å; N1331-S1333 PolarHBondContact O-N 2.93Å
1332	P	49.6	Very low	53.5	Low	81 Å²	81	81.6 Å²	81.6	53%	0.526	44%	0.444	S	S	.	.			trans	-75.6	-8.3	175.6	27.6	-31.7	0	0	0	114.1	S1334 E1336	P1332-S1334 PolarHBondContact O-N 3.5Å; P1332-E1336 VanDerWaalsContact O-CB 3.24Å; P1332-E1336 WeakPolarHBondContact O-CB 3.49Å; P1332-E1336 PolarHBondContact O-N 3.28Å
1333	S	54.5	Low	52.7	Low	79 Å²	79	80.8 Å²	80.8	55%	0.552	44%	0.44	S	S	*	.	H	α-helix	trans	-73.7	-26.8	-161.3	66.8	0	0	0	0	117	N1331	N1331-S1333 VanDerWaalsContact C-N 3.27Å; N1331-S1333 PolarHBondContact O-N 2.93Å
1334	S	51.5	Low	52.1	Low	67 Å²	67	83.6 Å²	83.6	47%	0.469	46%	0.46	S	S	.	.	H	α-helix	trans	-80.7	-42.4	175.9	70.7	0	0	0	0	112	E1306 P1332 K1337 S1338	E1306-S1334 PolarHBondContact OE1-OG 3.36Å; P1332-S1334 PolarHBondContact O-N 3.5Å; S1334-K1337 WeakPolarHBondContact O-CB 3.29Å; S1334-K1337 PolarHBondContact O-N 2.81Å; S1334-S1338 PolarHBondContact O-N 2.97Å; S1334-S1338 PolarHBondContact O-OG 3.02Å
1335	L	50.2	Low	51.5	Low	27 Å²	27	86.5 Å²	86.5	14%	0.141	48%	0.479	C	S	.	.	H	α-helix	trans	-71.7	-41.1	-175.6	-165.5	61.9	0	0	0	111.1	E1306 L1324 K1337 S1338 I1339	E1306-L1335 HydrophobicContact CG-CD1 3.22Å; L1324-L1335 HydrophobicContact CD1-CD2 3.6Å; L1324-L1335 HydrophobicContact CD2-CD2 4.25Å; L1324-L1335 HydrophobicContact CG-CD2 4.43Å; L1335-K1337 VanDerWaalsContact C-N 3.28Å; L1335-K1337 PolarHBondContact O-N 3.41Å; L1335-S1338 PolarHBondContact O-N 3.32Å; L1335-I1339 HydrophobicContact CG-CD1 4.27Å; L1335-I1339 VanDerWaalsContact O-CG1 3.23Å; L1335-I1339 WeakPolarHBondContact O-CG1 3.4Å; L1335-I1339 PolarHBondContact O-N 3.02Å
1336	E	56.9	Low	50.7	Low	83 Å²	83	86.9 Å²	86.9	39%	0.388	48%	0.475	S	S	.	.	H	α-helix	trans	-66.1	-32.2	174.9	-144.4	-171.6	154.8	0	0	111.7	P1332 R1340	P1332-E1336 VanDerWaalsContact O-CB 3.24Å; P1332-E1336 WeakPolarHBondContact O-CB 3.49Å; P1332-E1336 PolarHBondContact O-N 3.28Å; E1336-R1340 WeakPolarHBondContact O-CB 3.44Å; E1336-R1340 VanDerWaalsContact O-CG 3.26Å; E1336-R1340 WeakPolarHBondContact O-CG 3.46Å; E1336-R1340 PolarHBondContact O-N 3.11Å; E1336-R1340 IonicContact OE1-CZ 3.71Å; E1336-R1340 IonicContact OE1-NE 3.78Å; E1336-R1340 IonicContact OE1-NH2 3.92Å; E1336-R1340 PolarHBondContact OE1-NH2 2.99Å
1337	K	54.9	Low	50	Low	151 Å²	151	83.9 Å²	83.9	66%	0.657	47%	0.472	S	S	*	.	H	α-helix	trans	-65.7	-47.6	171.1	-101.5	-179.5	176.6	178.3	0	112	S1334 L1335 I1339 R1340 I1341	S1334-K1337 WeakPolarHBondContact O-CB 3.29Å; S1334-K1337 PolarHBondContact O-N 2.81Å; L1335-K1337 VanDerWaalsContact C-N 3.28Å; L1335-K1337 PolarHBondContact O-N 3.41Å; K1337-I1339 VanDerWaalsContact C-N 3.31Å; K1337-I1339 PolarHBondContact O-N 3.08Å; K1337-R1340 PolarHBondContact O-N 3.14Å; K1337-I1341 WeakPolarHBondContact O-CD1 3.44Å; K1337-I1341 WeakPolarHBondContact O-CG1 3.48Å; K1337-I1341 PolarHBondContact O-N 3.18Å
1338	S	47.5	Very low	49.6	Very low	41 Å²	41	89.2 Å²	89.2	29%	0.287	50%	0.497	S	S	.	.	H	α-helix	trans	-61.8	-39	178	-70.7	0	0	0	0	112.1	S1334 L1335 I1341 Q1342	S1334-S1338 PolarHBondContact O-N 2.97Å; S1334-S1338 PolarHBondContact O-OG 3.02Å; L1335-S1338 PolarHBondContact O-N 3.32Å; S1338-I1341 PolarHBondContact O-N 2.94Å; S1338-Q1342 PolarHBondContact O-N 2.88Å; S1338-Q1342 VanDerWaalsContact O-N 3.11Å
1339	I	52.5	Low	49.1	Very low	11 Å²	11	86.9 Å²	86.9	6%	0.056	49%	0.489	C	S	.	.	H	α-helix	trans	-73.2	-38.7	177.5	-54.7	161.3	0	0	0	111.6	V1317 L1335 K1337 I1341 Q1342 E1343	V1317-I1339 HydrophobicContact CG1-CG2 4.03Å; L1335-I1339 HydrophobicContact CG-CD1 4.27Å; L1335-I1339 VanDerWaalsContact O-CG1 3.23Å; L1335-I1339 WeakPolarHBondContact O-CG1 3.4Å; L1335-I1339 PolarHBondContact O-N 3.02Å; K1337-I1339 VanDerWaalsContact C-N 3.31Å; K1337-I1339 PolarHBondContact O-N 3.08Å; I1339-I1341 VanDerWaalsContact C-N 3.33Å; I1339-I1341 PolarHBondContact O-N 2.85Å; I1339-Q1342 WeakPolarHBondContact O-CB 3.16Å; I1339-Q1342 PolarHBondContact O-N 3.29Å; I1339-Q1342 VanDerWaalsContact O-N 3.16Å; I1339-E1343 PolarHBondContact O-N 2.81Å
1340	R	53.9	Low	48.3	Very low	151 Å²	151	93.3 Å²	93.3	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-63.6	-36.2	172.8	-77.3	-178.6	-165.2	-169.6	7.5	112.6	E1336 K1337 Q1342 E1343 S1344	E1336-R1340 WeakPolarHBondContact O-CB 3.44Å; E1336-R1340 VanDerWaalsContact O-CG 3.26Å; E1336-R1340 WeakPolarHBondContact O-CG 3.46Å; E1336-R1340 PolarHBondContact O-N 3.11Å; E1336-R1340 IonicContact OE1-CZ 3.71Å; E1336-R1340 IonicContact OE1-NE 3.78Å; E1336-R1340 IonicContact OE1-NH2 3.92Å; E1336-R1340 PolarHBondContact OE1-NH2 2.99Å; K1337-R1340 PolarHBondContact O-N 3.14Å; R1340-Q1342 VanDerWaalsContact C-N 3.32Å; R1340-E1343 PolarHBondContact O-N 3.28Å; R1340-S1344 WeakPolarHBondContact O-CB 3.39Å; R1340-S1344 PolarHBondContact O-N 2.68Å
1341	I	52.4	Low	47.7	Very low	101 Å²	101	91 Å²	91	52%	0.518	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-42.3	173.1	-69.5	163.2	0	0	0	109.7	K1337 S1338 I1339 S1344 V1345	K1337-I1341 WeakPolarHBondContact O-CD1 3.44Å; K1337-I1341 WeakPolarHBondContact O-CG1 3.48Å; K1337-I1341 PolarHBondContact O-N 3.18Å; S1338-I1341 PolarHBondContact O-N 2.94Å; I1339-I1341 VanDerWaalsContact C-N 3.33Å; I1339-I1341 PolarHBondContact O-N 2.85Å; I1341-S1344 PolarHBondContact O-N 3.22Å; I1341-S1344 PolarHBondContact O-OG 3.45Å; I1341-V1345 HydrophobicContact CG2-CG2 4.23Å; I1341-V1345 VanDerWaalsContact O-CG2 3.26Å; I1341-V1345 WeakPolarHBondContact O-CG2 3.45Å; I1341-V1345 PolarHBondContact O-N 2.96Å
1342	Q	50.1	Low	47	Very low	31 Å²	31	90.2 Å²	90.2	15%	0.145	50%	0.501	C	S	.	.	H	α-helix	trans	-65.8	-42.8	177.1	-124.3	-168.4	-10.6	0	0	113.2	L1309 Q1310 S1338 I1339 R1340 S1344 V1345 L1346	L1309-Q1342 PolarHBondContact O-NE2 3.41Å; L1309-Q1342 PolarHBondContact O-OE1 3.44Å; Q1310-Q1342 VanDerWaalsContact CA-NE2 3.31Å; Q1310-Q1342 PolarHBondContact O-NE2 3.31Å; S1338-Q1342 PolarHBondContact O-N 2.88Å; S1338-Q1342 VanDerWaalsContact O-N 3.11Å; I1339-Q1342 WeakPolarHBondContact O-CB 3.16Å; I1339-Q1342 PolarHBondContact O-N 3.29Å; I1339-Q1342 VanDerWaalsContact O-N 3.16Å; R1340-Q1342 VanDerWaalsContact C-N 3.32Å; Q1342-S1344 PolarHBondContact O-N 3.29Å; Q1342-V1345 PolarHBondContact O-N 3.11Å; Q1342-L1346 HydrophobicContact CG-CD1 4.46Å; Q1342-L1346 WeakPolarHBondContact O-CB 3.23Å; Q1342-L1346 PolarHBondContact O-N 3.02Å
1343	E	52	Low	46.1	Very low	104 Å²	104	93 Å²	93	49%	0.486	52%	0.516	S	S	.	.	H	α-helix	trans	-60.2	-35.2	172.8	-73.1	170.6	179.7	0	0	111.1	R1321 I1339 R1340 G1347	R1321-E1343 IonicContact CZ-OE1 2.99Å; R1321-E1343 VanDerWaalsContact CZ-OE1 3.3Å; R1321-E1343 IonicContact NH1-OE1 3.09Å; R1321-E1343 PolarHBondContact NH1-OE1 3.16Å; R1321-E1343 IonicContact NH2-OE1 3.58Å; R1321-E1343 PolarHBondContact NH2-OE1 2.98Å; R1321-E1343 IonicContact NH2-OE2 3.75Å; I1339-E1343 PolarHBondContact O-N 2.81Å; R1340-E1343 PolarHBondContact O-N 3.28Å; E1343-G1347 PolarHBondContact O-N 3.49Å
1344	S	52.2	Low	44.9	Very low	63 Å²	63	96.5 Å²	96.5	44%	0.441	53%	0.527	S	S	.	.	H	α-helix	trans	-73.6	-35.2	175.1	80.7	0	0	0	0	114.1	R1340 I1341 Q1342 H1348	R1340-S1344 WeakPolarHBondContact O-CB 3.39Å; R1340-S1344 PolarHBondContact O-N 2.68Å; I1341-S1344 PolarHBondContact O-N 3.22Å; I1341-S1344 PolarHBondContact O-OG 3.45Å; Q1342-S1344 PolarHBondContact O-N 3.29Å; S1344-H1348 PolarHBondContact O-CD2 3.38Å
1345	V	49.1	Very low	43.9	Very low	93 Å²	93	105.3 Å²	105.3	56%	0.564	56%	0.561	S	S	*	*	H	α-helix	trans	-76.8	-39	-179.5	171.4	0	0	0	0	111	I1341 Q1342 H1348	I1341-V1345 HydrophobicContact CG2-CG2 4.23Å; I1341-V1345 VanDerWaalsContact O-CG2 3.26Å; I1341-V1345 WeakPolarHBondContact O-CG2 3.45Å; I1341-V1345 PolarHBondContact O-N 2.96Å; Q1342-V1345 PolarHBondContact O-N 3.11Å; V1345-H1348 PolarHBondContact O-N 3.09Å
1346	L	45.6	Very low	43.6	Very low	86 Å²	86	109.3 Å²	109.3	45%	0.45	58%	0.582	S	S	.	*	H	α-helix	trans	-75.7	-25	174.6	-78.8	153.5	0	0	0	112.8	P1314 Q1342 H1348 T1349	P1314-L1346 HydrophobicContact CG-CD1 4.43Å; Q1342-L1346 HydrophobicContact CG-CD1 4.46Å; Q1342-L1346 WeakPolarHBondContact O-CB 3.23Å; Q1342-L1346 PolarHBondContact O-N 3.02Å; L1346-H1348 PolarHBondContact O-N 2.94Å; L1346-T1349 PolarHBondContact O-OG1 3.44Å
1347	G	44.4	Very low	42.9	Very low	57 Å²	57	110.6 Å²	110.6	59%	0.588	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-18.2	172.3	0	0	0	0	0	114.5	E1343	E1343-G1347 PolarHBondContact O-N 3.49Å
1348	H	41.7	Very low	42.2	Very low	170 Å²	170	108.4 Å²	108.4	79%	0.787	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-7.5	-179.9	-77.4	-47.9	0	0	0	115.1	S1344 V1345 L1346 K1350	S1344-H1348 PolarHBondContact O-CD2 3.38Å; V1345-H1348 PolarHBondContact O-N 3.09Å; L1346-H1348 PolarHBondContact O-N 2.94Å; H1348-K1350 VanDerWaalsContact C-N 3.34Å; H1348-K1350 PolarHBondContact O-N 2.87Å
1349	T	36.1	Very low	41.9	Very low	101 Å²	101	112.4 Å²	112.4	62%	0.62	61%	0.606	S	S	*	*			trans	-88.1	71.1	167.8	47.8	0	0	0	0	110.8	L1346 A1351	L1346-T1349 PolarHBondContact O-OG1 3.44Å; T1349-A1351 PolarHBondContact O-N 2.73Å; T1349-A1351 VanDerWaalsContact O-N 3.11Å
1350	K	30.5	Very low	41.2	Very low	210 Å²	210	118.7 Å²	118.7	91%	0.913	64%	0.64	S	S	*	*			trans	-72.5	85.5	152.3	-83.2	-174.4	176.7	-179.9	0	107.7	H1348	H1348-K1350 VanDerWaalsContact C-N 3.34Å; H1348-K1350 PolarHBondContact O-N 2.87Å
1351	A	30.7	Very low	40.4	Very low	80 Å²	80	116.5 Å²	116.5	66%	0.661	65%	0.645	S	S	*	*			trans	-99.3	141.9	154.7	0	0	0	0	0	107.7	T1349	T1349-A1351 PolarHBondContact O-N 2.73Å; T1349-A1351 VanDerWaalsContact O-N 3.11Å
1352	P	31.2	Very low	39.5	Very low	108 Å²	108	117.6 Å²	117.6	70%	0.701	65%	0.654	S	S	*	*			trans	-70.2	137.6	-163.5	30.3	-33.2	0	0	0	110.6	I1354	P1352-I1354 PolarHBondContact O-N 2.96Å
1353	V	29.4	Very low	38.7	Very low	140 Å²	140	124.3 Å²	124.3	85%	0.848	69%	0.693	S	S	*	*			trans	-60.6	103.4	160.3	177.3	0	0	0	0	106.5
1354	I	30.4	Very low	37.6	Very low	151 Å²	151	126 Å²	126	77%	0.774	71%	0.711	S	S	*	*			trans	-86.5	124.7	160	-60.4	178.5	0	0	0	105.8	P1352	P1352-I1354 PolarHBondContact O-N 2.96Å
1355	Q	30.3	Very low	36.3	Very low	253 Å²	253	131.7 Å²	131.7	100%	1.182	74%	0.735	S	S	*	*			trans	-54.7	0	175.3	-75.8	176	-44.9	0	0	113.3

Retrieved 1,355 of 1,355 residues in 323.9 ms (Link to these results)

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