X2JDZ6_DROME Loading...

Phospholipid-transporting ATPase

AlphaFold DB , UniProt , Accession X2JDZ6, Species DROME (Drosophila melanogaster, Fruit fly), Gene DmCG31729, Length 1,076 aa.

						>X2JDZ6_DROME|X2JDZ6|DmCG31729
MAEPQGFGGKSADFEVQHESYSCWRKWFRPRELRARTVNLGRVNTEKFPPNEIRNQKYNFITFLPLVLFEQFRFFLNLYFLLMALSQFIPDIRIGYPYTYWGPLGFVLMVTICREAVDDLRRHQRDHEVNSQKYKRLSSTNISGYEMVPSSKLKVGDVIIVEKNERVPADLILLRTSDRSGSVFVRTDQLDGETDWKPRLAVPYTQKLSRDSELHSIDASFYVEKPQNDIHSFIATFCMADGSEDTGLSVENTLWANTVVAAGTATGIVIYTGCETRSVMNNSQPRSKVGLLDMEINGLTKVLFCAVLGLSLVMMMLKGFGGPWYRYMFRFVLLFSYIIPISLRVNLDMGKAFYSWQMQNDSNIQGTVVRSTTIPEELGRISYVLTDKTGTLTQNEMVFKKIHLGIVSHDADTFHHIGQMIQKLSGNILQQQQGSLSSSSSGGDSTKPMMFGNRMRRPEGWREWEAVRALALCHNVTPVSDDEDNRSVSTASTVTGGNNSPTKSVINIEAPGSTDTEHQYQAASPDEIALVKWTEQVGLTLIARDLNTMTLQVKTPSEDNDILLHYQILQLFPFTSESKRMGIIVRESKTGQITFYLKGADVVMSSIVQYNDWLSEESGNMAREGLRTLVVAKKVLTEEQYSDFETRYNAARLSITDRVAKVAAVTESLERELELLCLTGVEDRLQENVRPTLELLRNAGVRVWMLTGDKLETACCIAKSSQLIGRNQGLHVLRSVKTRTDAHQELNSFRRKQGHALVISGESLEVCLQYYRPEFLELATASPAVVCCRCSPTQKAQVVALIQKHTGKRTCAVGDGGNDVSMIQQADAGVGIEGREGRQASLAGDFSIPQFSHIAKLLLIHGRRSYKRSAALSQFVIHRGLIITTLQAVFSAVFYLSSVALYQGFLMVGYSTLYTMFPVFSLVLDQDITSETAVTYPELYKDLSKGRSLSYKTFFIWVLISIYQGGVIMYGALILFVDEFIHIVAISFSALIMTELIMVALTVRTWHRLMVLAELFSLALYLISLAVLHEYFDWEFIWSYDFLWKVSLITLVSCLPLYIIKFLRKKCSPPSYLKLS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	28.6	Very low	251 Å²	251	143.9 Å²	143.9	100%	1.236	86%	0.862	S	S	*	*				0	128.3	0	-116.8	175.2	174.9	0	0	107.4
2	A	30.8	Very low	28.3	Very low	111 Å²	111	138.4 Å²	138.4	92%	0.917	84%	0.844	S	S	*	*			trans	77.3	105.2	-173.2	0	0	0	0	0	116.9
3	E	29	Very low	28	Very low	192 Å²	192	139.8 Å²	139.8	90%	0.897	84%	0.843	S	S	*	*			trans	-82.5	179.4	174	-111	-165.3	162.9	0	0	112.1
4	P	41.4	Very low	28	Very low	111 Å²	111	144 Å²	144	72%	0.721	85%	0.845	S	S	*	*			trans	-108.3	161.6	-136.7	39.4	-27.8	0	0	0	114.3
5	Q	27.2	Very low	27.8	Very low	184 Å²	184	144 Å²	144	86%	0.86	83%	0.834	S	S	*	*			trans	-110.3	110.5	160.5	-76.6	-170.3	-7.9	0	0	109.7
6	G	28.7	Very low	27.8	Very low	73 Å²	73	142.8 Å²	142.8	75%	0.753	83%	0.829	S	S	*	*			trans	-70.7	129.6	170.3	0	0	0	0	0	111
7	F	26	Very low	27.6	Very low	195 Å²	195	143.5 Å²	143.5	86%	0.855	82%	0.823	S	S	*	*			trans	-121.7	109.9	157.4	-101	-87.9	0	0	0	107.6	G9	F7-G9 PolarHBondContact O-N 3.43Å
8	G	25.9	Very low	27.6	Very low	74 Å²	74	145.1 Å²	145.1	76%	0.763	82%	0.821	S	S	*	*			trans	-60.2	117.5	170.1	0	0	0	0	0	109.7	K10	G8-K10 PolarHBondContact O-N 3.5Å; G8-K10 VanDerWaalsContact O-N 3.09Å
9	G	23.9	Very low	27.6	Very low	80 Å²	80	146.2 Å²	146.2	83%	0.825	82%	0.819	S	S	*	*			trans	-67	103.8	173.4	0	0	0	0	0	110.1	F7 S11	F7-G9 PolarHBondContact O-N 3.43Å; G9-S11 PolarHBondContact O-N 3.31Å
10	K	26	Very low	27.7	Very low	198 Å²	198	143.9 Å²	143.9	86%	0.861	81%	0.813	S	S	*	*			trans	-68.8	118.5	155.7	-76.7	-178.3	176	178.6	0	107.2	G8 A12	G8-K10 PolarHBondContact O-N 3.5Å; G8-K10 VanDerWaalsContact O-N 3.09Å; K10-A12 PolarHBondContact O-N 3.45Å
11	S	24.5	Very low	28.1	Very low	114 Å²	114	144.8 Å²	144.8	80%	0.797	81%	0.805	S	S	*	*			trans	-49.4	103.2	165	37.5	0	0	0	0	109.6	G9 D13	G9-S11 PolarHBondContact O-N 3.31Å; S11-D13 PolarHBondContact O-N 3.22Å
12	A	24.9	Very low	28.3	Very low	78 Å²	78	138.1 Å²	138.1	65%	0.645	78%	0.783	S	S	*	*			trans	-80.8	102.2	173.5	0	0	0	0	0	108.4	K10 F14	K10-A12 PolarHBondContact O-N 3.45Å; A12-F14 PolarHBondContact O-N 3.45Å
13	D	25	Very low	28.3	Very low	156 Å²	156	138.1 Å²	138.1	83%	0.834	78%	0.775	S	S	*	*			trans	-59.4	119.5	160	-75.4	-38.4	0	0	0	108.6	S11 E15	S11-D13 PolarHBondContact O-N 3.22Å; D13-E15 PolarHBondContact O-N 3.24Å
14	F	26.9	Very low	28.5	Very low	199 Å²	199	138 Å²	138	87%	0.873	77%	0.767	S	S	*	*			trans	-73.8	90.5	178.8	-90.1	-95.7	0	0	0	110.3	A12 V16	A12-F14 PolarHBondContact O-N 3.45Å; F14-V16 PolarHBondContact O-N 3.38Å
15	E	25.8	Very low	28.1	Very low	144 Å²	144	140.2 Å²	140.2	67%	0.673	76%	0.76	S	S	*	*			trans	-70	109.8	157.4	-112.8	-178	162.4	0	0	108.4	D13 Q17 R25	D13-E15 PolarHBondContact O-N 3.24Å; E15-Q17 PolarHBondContact O-N 3.19Å; E15-R25 IonicContact OE1-CZ 3.34Å; E15-R25 IonicContact OE1-NH1 2.58Å; E15-R25 IonicContact OE1-NH2 2.95Å; E15-R25 PolarHBondContact OE1-NH2 3.2Å
16	V	27.6	Very low	28.4	Very low	124 Å²	124	140 Å²	140	75%	0.752	76%	0.756	S	S	*	*			trans	-69.4	116.8	170.8	174.1	0	0	0	0	108.4	F14 H18	F14-V16 PolarHBondContact O-N 3.38Å; V16-H18 PolarHBondContact O-N 3.44Å
17	Q	24.7	Very low	29	Very low	155 Å²	155	148 Å²	148	72%	0.724	76%	0.764	S	S	*	*			trans	-54.4	117.1	177.3	-72.3	171.1	-51.7	0	0	112.5	E15	E15-Q17 PolarHBondContact O-N 3.19Å
18	H	27.8	Very low	29.9	Very low	173 Å²	173	146 Å²	146	80%	0.801	76%	0.755	S	S	*	*			trans	-124.3	89.1	145	-95	-73.4	0	0	0	107.1	V16 S20	V16-H18 PolarHBondContact O-N 3.44Å; H18-S20 PolarHBondContact O-N 3.32Å
19	E	27.4	Very low	30.8	Very low	165 Å²	165	152.3 Å²	152.3	77%	0.771	76%	0.756	S	S	*	*			trans	-72.3	87.3	175	-76	-179.6	154.2	0	0	110.4
20	S	29.2	Very low	32.4	Very low	101 Å²	101	154.2 Å²	154.2	71%	0.706	75%	0.754	S	S	*	*			trans	-166.2	42	160	-88	0	0	0	0	113.6	H18	H18-S20 PolarHBondContact O-N 3.32Å
21	Y	35.3	Very low	34.3	Very low	163 Å²	163	151.6 Å²	151.6	64%	0.639	74%	0.739	S	S	*	*			trans	-146.9	67.9	173.8	-62.2	-75.8	0	0	0	112.5
22	S	36.3	Very low	36.8	Very low	111 Å²	111	153 Å²	153	78%	0.776	73%	0.732	S	S	*	*	S	Bend	trans	-82.9	-34.8	-176.6	177.9	0	0	0	0	114.3
23	C	31.1	Very low	39.6	Very low	111 Å²	111	152.8 Å²	152.8	75%	0.75	72%	0.72	S	S	*	*	S	Bend	trans	-83.2	-28.6	-173.2	-70.5	0	0	0	0	115
24	W	32.8	Very low	42.6	Very low	190 Å²	190	153.4 Å²	153.4	72%	0.72	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-79.4	-19.4	-175.2	-68.6	87.9	0	0	0	113.9	K26	W24-K26 VanDerWaalsContact C-N 3.33Å; W24-K26 PolarHBondContact O-N 3.44Å
25	R	32.8	Very low	45.5	Very low	157 Å²	157	145.9 Å²	145.9	59%	0.592	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-71.5	-19.1	-178.8	-104.6	-174.3	178	-160.6	-1.3	114.5	E15 W27 F28 R29	E15-R25 IonicContact OE1-CZ 3.34Å; E15-R25 IonicContact OE1-NH1 2.58Å; E15-R25 IonicContact OE1-NH2 2.95Å; E15-R25 PolarHBondContact OE1-NH2 3.2Å; R25-W27 VanDerWaalsContact C-N 3.32Å; R25-W27 PolarHBondContact O-N 3.32Å; R25-F28 CarbonylContact O-C 3.59Å; R25-F28 PolarHBondContact O-N 3.47Å; R25-R29 PolarHBondContact O-N 2.91Å
26	K	34.8	Very low	48.5	Very low	178 Å²	178	139.5 Å²	139.5	77%	0.774	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-69.6	-27.6	179	-90.9	-175.6	177.6	178.1	0	113.3	W24	W24-K26 VanDerWaalsContact C-N 3.33Å; W24-K26 PolarHBondContact O-N 3.44Å
27	W	40.6	Very low	51.4	Low	241 Å²	241	136.4 Å²	136.4	91%	0.913	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-16.3	176.7	-82.4	38.1	0	0	0	113.3	R25	R25-W27 VanDerWaalsContact C-N 3.32Å; R25-W27 PolarHBondContact O-N 3.32Å
28	F	45.3	Very low	54.5	Low	154 Å²	154	129 Å²	129	68%	0.675	60%	0.602	S	S	*	*			trans	-122.6	51.5	-178.7	-66.9	-84.2	0	0	0	111.4	R25	R25-F28 CarbonylContact O-C 3.59Å; R25-F28 PolarHBondContact O-N 3.47Å
29	R	43.8	Very low	57.4	Low	206 Å²	206	123 Å²	123	78%	0.777	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-68.3	130.9	166.9	-83.4	-172.7	173.2	-173.3	-2.2	108.8	R25 R31	R25-R29 PolarHBondContact O-N 2.91Å; R29-R31 PolarHBondContact O-N 3.45Å
30	P	57.7	Low	60	Low	120 Å²	120	115.2 Å²	115.2	78%	0.779	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-57.6	135.4	171.7	24.2	-32.2	0	0	0	109.3	E32	P30-E32 PolarHBondContact O-N 3Å
31	R	66.5	Low	61.9	Low	144 Å²	144	112.6 Å²	112.6	54%	0.543	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-64.6	126.1	-179	-170.7	176.8	170.9	169.2	0.7	108.8	R29 L33 K47	R29-R31 PolarHBondContact O-N 3.45Å; R31-L33 PolarHBondContact O-N 3.28Å; R31-K47 PolarHBondContact NH2-O 3.22Å
32	E	76.1	Confident	63.7	Low	142 Å²	142	112.3 Å²	112.3	66%	0.664	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-68.6	122.9	175.5	-75.4	179.5	174.8	0	0	110.3	P30 R34	P30-E32 PolarHBondContact O-N 3Å; E32-R34 IonicContact OE2-CZ 2.71Å; E32-R34 IonicContact OE2-NE 3.56Å; E32-R34 IonicContact OE2-NH2 3.63Å; E32-R34 PolarHBondContact OE2-NH2 3.46Å
33	L	84.9	Confident	65.4	Low	74 Å²	74	113.7 Å²	113.7	39%	0.387	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-77.5	125.9	174.8	-60.8	175.3	0	0	0	109.6	R31 P226 E275 M280	R31-L33 PolarHBondContact O-N 3.28Å; L33-P226 HydrophobicContact CD2-CB 4.38Å; L33-P226 HydrophobicContact CD2-CG 4.22Å; L33-E275 HydrophobicContact CD2-CG 4.26Å; L33-M280 HydrophobicContact CD1-CE 3.93Å
34	R	86.6	Confident	67.4	Low	169 Å²	169	109.7 Å²	109.7	64%	0.638	50%	0.501	S	S	*	.			trans	-125.6	151.7	-178.1	-62.2	-177.9	-177.6	-179.4	-0.7	111	E32	E32-R34 IonicContact OE2-CZ 2.71Å; E32-R34 IonicContact OE2-NE 3.56Å; E32-R34 IonicContact OE2-NH2 3.63Å; E32-R34 PolarHBondContact OE2-NH2 3.46Å
35	A	88.4	Confident	69.2	Low	41 Å²	41	107.4 Å²	107.4	34%	0.339	51%	0.509	S	S	.	.			trans	-62.4	152.1	164.9	0	0	0	0	0	109.4	V223	A35-V223 WeakPolarHBondContact CA-O 3.41Å; A35-V223 WeakPolarHBondContact CB-O 3.5Å
36	R	88.8	Confident	71.4	Confident	11 Å²	11	105.1 Å²	105.1	4%	0.042	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.8	-172.3	67.7	-170.4	66.9	-175.3	-1.5	111.8	V38 F48 V223 E275	R36-V38 HydrophobicContact CG-CG2 4.16Å; R36-F48 HydrophobicContact CB-CE1 4.15Å; R36-F48 HydrophobicContact CB-CZ 4.35Å; R36-F48 HydrophobicContact CG-CE1 4.47Å; R36-V223 HydrophobicContact CG-CB 4.41Å; R36-V223 PolarHBondContact N-O 3.07Å; R36-V223 PolarHBondContact O-N 3.07Å; R36-E275 IonicContact CZ-OE2 2.85Å; R36-E275 IonicContact NH1-OE2 3.81Å; R36-E275 PolarHBondContact NH1-OE2 3.4Å; R36-E275 IonicContact NH2-OE1 3.75Å; R36-E275 PolarHBondContact NH2-OE1 2.85Å; R36-E275 IonicContact NH2-OE2 3.46Å; R36-E275 PolarHBondContact NH2-OE2 3.16Å
37	T	89.2	Confident	73.7	Confident	59 Å²	59	105.8 Å²	105.8	36%	0.362	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.8	169.9	-55.1	0	0	0	0	109.1	F221	T37-F221 CarbonylContact C-O 3.57Å; T37-F221 VanDerWaalsContact CA-O 3.28Å; T37-F221 WeakPolarHBondContact CA-O 3.47Å
38	V	89.4	Confident	76	Confident	0 Å²	0	96.3 Å²	96.3	0%	0	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.1	178	-176.5	0	0	0	0	108.2	R36 V155 S220 F221 V223 I268 I270	R36-V38 HydrophobicContact CG-CG2 4.16Å; V38-V155 HydrophobicContact CG1-CG1 4.06Å; V38-V155 HydrophobicContact CG2-CG1 3.69Å; V38-S220 WeakPolarHBondContact O-CA 3.45Å; V38-F221 HydrophobicContact CB-CB 4.49Å; V38-F221 PolarHBondContact N-O 3.02Å; V38-F221 PolarHBondContact O-N 3.1Å; V38-V223 HydrophobicContact CG2-CG2 4.48Å; V38-I268 HydrophobicContact CG1-CD1 3.81Å; V38-I268 HydrophobicContact CG1-CG1 4.27Å; V38-I270 HydrophobicContact CG2-CG2 4.42Å
39	N	87.5	Confident	78.1	Confident	46 Å²	46	89.5 Å²	89.5	25%	0.246	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	141.9	179.2	-57.8	-43.5	0	0	0	111.5	R42 N44 S220	N39-R42 HydrophobicContact CB-CB 3.99Å; N39-N44 PolarHBondContact N-OD1 3.04Å; N39-N44 PolarHBondContact ND2-OD1 2.91Å; N39-S220 WeakPolarHBondContact OD1-CB 3.49Å
40	L	83.7	Confident	80.3	Confident	1 Å²	1	83.4 Å²	83.4	1%	0.005	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	134.4	168	-171.2	68	0	0	0	108.5	R42 V158 L174 I217 A219 F221 I268	L40-R42 PolarHBondContact O-N 3.33Å; L40-V158 HydrophobicContact CD1-CG2 3.86Å; L40-L174 HydrophobicContact CD1-CD1 3.86Å; L40-I217 HydrophobicContact CD2-CB 4.13Å; L40-I217 HydrophobicContact CD2-CG2 4.17Å; L40-A219 HydrophobicContact CB-CB 4.37Å; L40-A219 WeakPolarHBondContact CB-O 3.29Å; L40-A219 HydrophobicContact CD2-CB 4.44Å; L40-A219 PolarHBondContact N-O 3.36Å; L40-F221 HydrophobicContact CB-CE2 4.29Å; L40-I268 HydrophobicContact CD1-CD1 3.93Å
41	G	69.2	Low	81.9	Confident	47 Å²	47	78 Å²	78	49%	0.485	40%	0.396	S	S	.	.	S	Bend	trans	73.5	-11.9	179	0	0	0	0	0	116.2
42	R	73.1	Confident	82.9	Confident	156 Å²	156	76.2 Å²	76.2	59%	0.589	39%	0.394	S	S	*	.	S	Bend	trans	-116.3	148.3	176.3	-66.8	-177.6	175.5	171.6	1.9	112.8	N39 L40 N44 D218	N39-R42 HydrophobicContact CB-CB 3.99Å; L40-R42 PolarHBondContact O-N 3.33Å; R42-N44 PolarHBondContact O-N 2.86Å; R42-D218 WeakPolarHBondContact CD-OD1 3.28Å; R42-D218 VanDerWaalsContact CZ-CG 3.44Å; R42-D218 IonicContact CZ-OD1 2.86Å; R42-D218 IonicContact CZ-OD2 2.86Å; R42-D218 IonicContact NE-OD1 3.17Å; R42-D218 PolarHBondContact NE-OD1 3.39Å; R42-D218 IonicContact NE-OD2 3.89Å; R42-D218 IonicContact NH1-OD1 2.75Å; R42-D218 IonicContact NH1-OD2 2.77Å; R42-D218 VanDerWaalsContact NH2-CG 3.32Å; R42-D218 IonicContact NH2-OD1 2.93Å; R42-D218 PolarHBondContact NH2-OD1 2.94Å; R42-D218 IonicContact NH2-OD2 3.64Å; R42-D218 PolarHBondContact NH2-OD2 3.17Å
43	V	70.4	Confident	83.2	Confident	140 Å²	140	72 Å²	72	85%	0.848	38%	0.375	S	S	*	.			trans	-71.6	123.6	176.3	-174.2	0	0	0	0	109.7
44	N	74.2	Confident	82.8	Confident	28 Å²	28	75.3 Å²	75.3	15%	0.15	38%	0.382	C	S	.	.			trans	-68.3	133.8	173	-70.6	-35.6	0	0	0	110.8	N39 R42 F48 V155	N39-N44 PolarHBondContact N-OD1 3.04Å; N39-N44 PolarHBondContact ND2-OD1 2.91Å; R42-N44 PolarHBondContact O-N 2.86Å; N44-F48 HydrophobicContact CB-CE2 4.22Å; N44-V155 PolarHBondContact ND2-O 2.87Å
45	T	69.9	Low	82.3	Confident	142 Å²	142	70.8 Å²	70.8	87%	0.871	37%	0.371	S	S	*	.			trans	-83.6	-20.8	178.2	50.7	0	0	0	0	112.8
46	E	79.8	Confident	81.6	Confident	108 Å²	108	71 Å²	71	51%	0.505	37%	0.365	S	S	.	.	S	Bend	trans	-76.5	143.6	179.9	-67.2	-168	165.6	0	0	112.8	F48	E46-F48 HydrophobicContact CB-CE1 4.18Å; E46-F48 HydrophobicContact CB-CE2 3.82Å; E46-F48 HydrophobicContact CB-CZ 3.56Å; E46-F48 WeakPolarHBondContact O-CD2 3.33Å; E46-F48 WeakPolarHBondContact OE2-CZ 3.28Å
47	K	82.7	Confident	80.8	Confident	193 Å²	193	73 Å²	73	84%	0.839	37%	0.374	S	S	*	.			trans	-92.1	111.9	178.7	-70.4	-174.7	-179.7	179.2	0	111.5	R31	R31-K47 PolarHBondContact NH2-O 3.22Å
48	F	88.3	Confident	80.4	Confident	42 Å²	42	70.8 Å²	70.8	18%	0.184	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-98.4	156.9	176.8	-59.2	-66.1	0	0	0	112.1	R36 N44 E46 V155	R36-F48 HydrophobicContact CB-CE1 4.15Å; R36-F48 HydrophobicContact CB-CZ 4.35Å; R36-F48 HydrophobicContact CG-CE1 4.47Å; N44-F48 HydrophobicContact CB-CE2 4.22Å; E46-F48 HydrophobicContact CB-CE1 4.18Å; E46-F48 HydrophobicContact CB-CE2 3.82Å; E46-F48 HydrophobicContact CB-CZ 3.56Å; E46-F48 WeakPolarHBondContact O-CD2 3.33Å; E46-F48 WeakPolarHBondContact OE2-CZ 3.28Å; F48-V155 HydrophobicContact CB-CB 4.14Å; F48-V155 HydrophobicContact CB-CG2 3.65Å; F48-V155 HydrophobicContact CD1-CG2 4.32Å; F48-V155 HydrophobicContact CD2-CB 3.48Å; F48-V155 VanDerWaalsContact CD2-CB 3.48Å; F48-V155 HydrophobicContact CD2-CG1 3.79Å; F48-V155 HydrophobicContact CD2-CG2 3.91Å; F48-V155 HydrophobicContact CE2-CB 4Å; F48-V155 HydrophobicContact CE2-CG1 3.77Å; F48-V155 HydrophobicContact CG-CB 3.83Å; F48-V155 HydrophobicContact CG-CG1 4.23Å; F48-V155 HydrophobicContact CG-CG2 3.68Å; F48-V155 HydrophobicContact CZ-CG1 4.24Å
49	P	89.3	Confident	80.1	Confident	10 Å²	10	74.6 Å²	74.6	7%	0.065	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-62.7	147.1	174.6	26.8	-32.4	0	0	0	111.6	T272 E275	P49-T272 PolarHBondContact O-OG1 3.17Å; P49-E275 WeakPolarHBondContact CD-OE2 3.19Å; P49-E275 HydrophobicContact CG-CB 4.42Å; P49-E275 VanDerWaalsContact CG-CD 3.42Å; P49-E275 HydrophobicContact CG-CG 3.8Å; P49-E275 WeakPolarHBondContact CG-OE2 3.44Å
50	P	90.6	Very high	79.8	Confident	79 Å²	79	81.6 Å²	81.6	51%	0.513	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-66.6	153.7	175.6	30	-35.1	0	0	0	111	E52	P50-E52 HydrophobicContact CB-CG 4.32Å; P50-E52 PolarHBondContact O-N 3.08Å
51	N	91.5	Very high	79.9	Confident	7 Å²	7	88 Å²	88	4%	0.037	44%	0.44	C	S	.	.	S	Bend	trans	-81.4	47.7	176.7	-162.6	43.2	0	0	0	112.6	S150 S151 L153 P168 T272 G273	N51-S150 WeakPolarHBondContact CB-O 3.49Å; N51-S150 PolarHBondContact ND2-O 2.73Å; N51-S150 VanDerWaalsContact ND2-O 3.11Å; N51-S150 PolarHBondContact ND2-OG 2.83Å; N51-S151 WeakPolarHBondContact O-CA 3.26Å; N51-L153 HydrophobicContact CB-CB 4.38Å; N51-L153 WeakPolarHBondContact CB-O 3.48Å; N51-P168 PolarHBondContact ND2-O 2.8Å; N51-T272 HydrophobicContact CB-CG2 4.09Å; N51-G273 PolarHBondContact OD1-N 3.11Å
52	E	87.8	Confident	80.8	Confident	106 Å²	106	88.5 Å²	88.5	50%	0.495	43%	0.434	S	S	.	.			trans	-103.2	126.1	-179.7	-72.6	179.6	-177.1	0	0	110.5	P50	P50-E52 HydrophobicContact CB-CG 4.32Å; P50-E52 PolarHBondContact O-N 3.08Å
53	I	81.6	Confident	81.5	Confident	53 Å²	53	82.9 Å²	82.9	27%	0.272	41%	0.414	S	S	.	.			trans	-85.7	122.3	168.9	-64.7	168.5	0	0	0	107.6	N55 V129 N130	I53-N55 WeakPolarHBondContact CG2-ND2 3.35Å; I53-V129 HydrophobicContact CD1-CG1 3.69Å; I53-N130 PolarHBondContact N-OD1 3.24Å; I53-N130 PolarHBondContact O-ND2 2.98Å
54	R	77.6	Confident	82.4	Confident	143 Å²	143	80.5 Å²	80.5	54%	0.54	40%	0.396	S	S	.	.			trans	-130.2	99.2	-179.5	-163.7	176.1	-171.9	178.1	2.4	110.7	Q56 N59	R54-Q56 HydrophobicContact CG-CB 4.39Å; R54-N59 PolarHBondContact NH2-OD1 3.45Å
55	N	74.4	Confident	83.1	Confident	74 Å²	74	83.1 Å²	83.1	40%	0.396	42%	0.415	S	S	.	.			trans	-98.9	-2.2	177.2	-61.8	-55.6	0	0	0	113.1	I53 D126	I53-N55 WeakPolarHBondContact CG2-ND2 3.35Å; N55-D126 WeakPolarHBondContact CB-OD1 3.4Å; N55-D126 PolarHBondContact N-OD2 2.79Å; N55-D126 PolarHBondContact ND2-OD1 2.8Å
56	Q	74.7	Confident	83.9	Confident	46 Å²	46	79.9 Å²	79.9	22%	0.215	39%	0.392	C	S	.	.			trans	-56	137.7	170.5	-64.1	-175.5	-62.5	0	0	111.1	R54 H123 D126	R54-Q56 HydrophobicContact CG-CB 4.39Å; Q56-H123 HydrophobicContact CG-CB 4.32Å; Q56-H123 VanDerWaalsContact NE2-CB 3.29Å; Q56-H123 VanDerWaalsContact NE2-CG 3.33Å; Q56-H123 PolarHBondContact NE2-ND1 2.91Å; Q56-D126 PolarHBondContact N-OD2 3.26Å
57	K	72.1	Confident	84.2	Confident	54 Å²	54	74.8 Å²	74.8	24%	0.235	37%	0.368	C	S	.	.	S	Bend	trans	-80.3	-34.4	174.5	-67.9	176.4	-178.9	175.5	0	111.4	E115 D119 S287	K57-E115 IonicContact NZ-OE1 3.67Å; K57-E115 PolarHBondContact NZ-OE1 3.32Å; K57-D119 PolarHBondContact N-OD1 3.01Å; K57-S287 PolarHBondContact NZ-OG 3.24Å
58	Y	80.9	Confident	84.4	Confident	11 Å²	11	68 Å²	68	4%	0.043	34%	0.341	C	S	.	.			trans	-122.4	155	-168.8	-45.5	-74.2	0	0	0	111.2	F63 L66 V67 E70 E115 D119	Y58-F63 AromaticContact CD2-CD2 3.74Å; Y58-F63 HydrophobicContact CD2-CD2 3.74Å; Y58-F63 HydrophobicContact CD2-CE2 4.16Å; Y58-F63 AromaticContact CG-CD2 3.88Å; Y58-F63 HydrophobicContact CG-CD2 3.88Å; Y58-L66 HydrophobicContact CD1-CB 3.86Å; Y58-L66 HydrophobicContact CD1-CD1 4.05Å; Y58-L66 HydrophobicContact CE1-CB 3.92Å; Y58-V67 HydrophobicContact CD1-CG2 4.3Å; Y58-V67 HydrophobicContact CD2-CG2 4.4Å; Y58-V67 HydrophobicContact CE1-CG2 3.92Å; Y58-V67 HydrophobicContact CE2-CG2 4.04Å; Y58-E70 PolarHBondContact OH-OE2 2.95Å; Y58-E115 HydrophobicContact CE2-CG 3.61Å; Y58-E115 PolarHBondContact OH-OE1 3.4Å; Y58-D119 HydrophobicContact CD2-CB 4.26Å
59	N	82.8	Confident	84.3	Confident	81 Å²	81	72 Å²	72	43%	0.433	36%	0.358	S	S	.	.			trans	-103.3	161.2	165.4	-163.3	7.8	0	0	0	108.2	R54 I61 T62 F63	R54-N59 PolarHBondContact NH2-OD1 3.45Å; N59-I61 PolarHBondContact O-N 3.08Å; N59-I61 VanDerWaalsContact O-N 3.08Å; N59-T62 HydrophobicContact CB-CG2 4.38Å; N59-T62 WeakPolarHBondContact CB-OG1 3.41Å; N59-T62 PolarHBondContact N-OG1 3.18Å; N59-T62 CarbonylContact O-C 3.58Å; N59-T62 PolarHBondContact O-N 3.4Å; N59-T62 PolarHBondContact O-OG1 3.01Å; N59-F63 WeakPolarHBondContact O-CB 3.44Å; N59-F63 PolarHBondContact O-N 3.5Å
60	F	81.9	Confident	84	Confident	192 Å²	192	74.1 Å²	74.1	84%	0.842	37%	0.367	S	S	*	.	H	α-helix	trans	-51.4	-40.7	-176.9	-177.2	-98.6	0	0	0	113.2
61	I	86.3	Confident	83.7	Confident	135 Å²	135	71.2 Å²	71.2	69%	0.692	35%	0.347	S	S	*	.	H	α-helix	trans	-78.4	-37.1	179	-58.2	172.1	0	0	0	111.9	N59 P65	N59-I61 PolarHBondContact O-N 3.08Å; N59-I61 VanDerWaalsContact O-N 3.08Å; I61-P65 VanDerWaalsContact O-CD 3.3Å; I61-P65 WeakPolarHBondContact O-CD 3.32Å
62	T	87	Confident	83.4	Confident	58 Å²	58	73 Å²	73	36%	0.356	36%	0.355	S	S	.	.	H	α-helix	trans	-85	-14.6	-174.7	65.5	0	0	0	0	112.9	N59 P65 L66	N59-T62 HydrophobicContact CB-CG2 4.38Å; N59-T62 WeakPolarHBondContact CB-OG1 3.41Å; N59-T62 PolarHBondContact N-OG1 3.18Å; N59-T62 CarbonylContact O-C 3.58Å; N59-T62 PolarHBondContact O-N 3.4Å; N59-T62 PolarHBondContact O-OG1 3.01Å; T62-P65 WeakPolarHBondContact O-CD 3.47Å; T62-L66 WeakPolarHBondContact O-CB 3.27Å; T62-L66 WeakPolarHBondContact O-CD1 3.49Å; T62-L66 WeakPolarHBondContact O-CG 3.48Å; T62-L66 PolarHBondContact O-N 3.27Å
63	F	88.4	Confident	83.2	Confident	38 Å²	38	75.5 Å²	75.5	17%	0.167	36%	0.359	C	S	.	.	H	α-helix	trans	-53.5	-61.9	-179.5	176.5	-104.5	0	0	0	112.1	Y58 N59 V67 I112 E115 A116	Y58-F63 AromaticContact CD2-CD2 3.74Å; Y58-F63 HydrophobicContact CD2-CD2 3.74Å; Y58-F63 HydrophobicContact CD2-CE2 4.16Å; Y58-F63 AromaticContact CG-CD2 3.88Å; Y58-F63 HydrophobicContact CG-CD2 3.88Å; N59-F63 WeakPolarHBondContact O-CB 3.44Å; N59-F63 PolarHBondContact O-N 3.5Å; F63-V67 HydrophobicContact CD2-CG2 3.85Å; F63-V67 HydrophobicContact CE2-CG2 3.69Å; F63-V67 HydrophobicContact CG-CG2 4.44Å; F63-V67 HydrophobicContact CZ-CG2 4.15Å; F63-V67 VanDerWaalsContact O-CB 3.22Å; F63-V67 WeakPolarHBondContact O-CB 3.35Å; F63-V67 WeakPolarHBondContact O-CG2 3.1Å; F63-V67 PolarHBondContact O-N 3.48Å; F63-I112 HydrophobicContact CE1-CG2 3.76Å; F63-I112 HydrophobicContact CZ-CG2 4.06Å; F63-E115 HydrophobicContact CE2-CB 4.4Å; F63-E115 HydrophobicContact CE2-CG 4.35Å; F63-A116 HydrophobicContact CE1-CB 4.18Å; F63-A116 HydrophobicContact CE2-CB 4.23Å; F63-A116 HydrophobicContact CZ-CB 3.57Å
64	L	89.1	Confident	83.1	Confident	91 Å²	91	74.2 Å²	74.2	48%	0.476	35%	0.352	S	S	.	.	H	α-helix	trans	-64.1	-47.5	-174.4	-174.1	68.8	0	0	0	112.9	L68 I112	L64-L68 HydrophobicContact CD1-CD1 4.03Å; L64-L68 HydrophobicContact CD1-CG 4.19Å; L64-L68 HydrophobicContact CG-CD1 3.95Å; L64-L68 HydrophobicContact CG-CG 4.47Å; L64-L68 WeakPolarHBondContact O-CB 3.5Å; L64-L68 VanDerWaalsContact O-CG 3.24Å; L64-L68 WeakPolarHBondContact O-CG 3.44Å; L64-L68 PolarHBondContact O-N 2.93Å; L64-I112 HydrophobicContact CD1-CD1 4.02Å
65	P	89.1	Confident	83.5	Confident	82 Å²	82	70 Å²	70	53%	0.532	34%	0.337	S	S	.	.	H	α-helix	trans	-63.6	-42.6	179	-23.4	34.7	0	0	0	113.9	I61 T62 F69	I61-P65 VanDerWaalsContact O-CD 3.3Å; I61-P65 WeakPolarHBondContact O-CD 3.32Å; T62-P65 WeakPolarHBondContact O-CD 3.47Å; P65-F69 WeakPolarHBondContact O-CB 3.26Å; P65-F69 PolarHBondContact O-N 3.11Å
66	L	85.3	Confident	83.8	Confident	75 Å²	75	67.1 Å²	67.1	39%	0.393	32%	0.322	S	S	.	.	H	α-helix	trans	-70.2	-43.3	179.8	-76	162.2	0	0	0	111.4	Y58 T62 L68 F69 E70	Y58-L66 HydrophobicContact CD1-CB 3.86Å; Y58-L66 HydrophobicContact CD1-CD1 4.05Å; Y58-L66 HydrophobicContact CE1-CB 3.92Å; T62-L66 WeakPolarHBondContact O-CB 3.27Å; T62-L66 WeakPolarHBondContact O-CD1 3.49Å; T62-L66 WeakPolarHBondContact O-CG 3.48Å; T62-L66 PolarHBondContact O-N 3.27Å; L66-L68 PolarHBondContact O-N 3.41Å; L66-F69 PolarHBondContact O-N 2.98Å; L66-E70 WeakPolarHBondContact O-CG 3.15Å; L66-E70 PolarHBondContact O-N 3.06Å
67	V	86.3	Confident	84.2	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.006	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-45.2	178.3	171.1	0	0	0	0	110.3	Y58 F63 F69 E70 Q71 I112 E115	Y58-V67 HydrophobicContact CD1-CG2 4.3Å; Y58-V67 HydrophobicContact CD2-CG2 4.4Å; Y58-V67 HydrophobicContact CE1-CG2 3.92Å; Y58-V67 HydrophobicContact CE2-CG2 4.04Å; F63-V67 HydrophobicContact CD2-CG2 3.85Å; F63-V67 HydrophobicContact CE2-CG2 3.69Å; F63-V67 HydrophobicContact CG-CG2 4.44Å; F63-V67 HydrophobicContact CZ-CG2 4.15Å; F63-V67 VanDerWaalsContact O-CB 3.22Å; F63-V67 WeakPolarHBondContact O-CB 3.35Å; F63-V67 WeakPolarHBondContact O-CG2 3.1Å; F63-V67 PolarHBondContact O-N 3.48Å; V67-F69 VanDerWaalsContact C-N 3.34Å; V67-F69 PolarHBondContact O-N 3.29Å; V67-E70 PolarHBondContact O-N 2.93Å; V67-Q71 HydrophobicContact CG1-CG 4.43Å; V67-Q71 WeakPolarHBondContact O-CG 3.45Å; V67-Q71 PolarHBondContact O-N 3.48Å; V67-I112 HydrophobicContact CG1-CG1 3.96Å; V67-E115 HydrophobicContact CG2-CG 4.01Å
68	L	87.6	Confident	85	Confident	50 Å²	50	66 Å²	66	26%	0.262	32%	0.319	S	S	.	.	H	α-helix	trans	-61.4	-43	175.5	-71.6	174.4	0	0	0	111.7	L64 L66 E70 Q71 F72 I112	L64-L68 HydrophobicContact CD1-CD1 4.03Å; L64-L68 HydrophobicContact CD1-CG 4.19Å; L64-L68 HydrophobicContact CG-CD1 3.95Å; L64-L68 HydrophobicContact CG-CG 4.47Å; L64-L68 WeakPolarHBondContact O-CB 3.5Å; L64-L68 VanDerWaalsContact O-CG 3.24Å; L64-L68 WeakPolarHBondContact O-CG 3.44Å; L64-L68 PolarHBondContact O-N 2.93Å; L66-L68 PolarHBondContact O-N 3.41Å; L68-E70 PolarHBondContact O-N 3.34Å; L68-Q71 PolarHBondContact O-N 3.26Å; L68-F72 HydrophobicContact CB-CD2 4.37Å; L68-F72 HydrophobicContact CB-CE2 4.3Å; L68-F72 HydrophobicContact CD2-CE2 4.1Å; L68-F72 WeakPolarHBondContact O-CD2 3.43Å; L68-F72 PolarHBondContact O-N 3.01Å; L68-I112 HydrophobicContact CD2-CD1 4.05Å
69	F	86.8	Confident	85.3	Confident	125 Å²	125	65.9 Å²	65.9	55%	0.548	32%	0.319	S	S	.	.	H	α-helix	trans	-60.4	-44	175.4	-179.8	-98.8	0	0	0	112.1	P65 L66 V67 Q71 F72 R73	P65-F69 WeakPolarHBondContact O-CB 3.26Å; P65-F69 PolarHBondContact O-N 3.11Å; L66-F69 PolarHBondContact O-N 2.98Å; V67-F69 VanDerWaalsContact C-N 3.34Å; V67-F69 PolarHBondContact O-N 3.29Å; F69-Q71 PolarHBondContact O-N 3.28Å; F69-F72 PolarHBondContact O-N 3.46Å; F69-R73 PolarHBondContact O-N 2.95Å
70	E	81.5	Confident	85.5	Confident	56 Å²	56	62.6 Å²	62.6	26%	0.262	30%	0.301	S	S	.	.	H	α-helix	trans	-64.5	-38.2	176.9	-76.4	-171.7	149.8	0	0	112.6	Y58 L66 V67 L68 R73 F74	Y58-E70 PolarHBondContact OH-OE2 2.95Å; L66-E70 WeakPolarHBondContact O-CG 3.15Å; L66-E70 PolarHBondContact O-N 3.06Å; V67-E70 PolarHBondContact O-N 2.93Å; L68-E70 PolarHBondContact O-N 3.34Å; E70-R73 WeakPolarHBondContact O-CB 3.38Å; E70-F74 WeakPolarHBondContact O-CD2 3.46Å
71	Q	84.3	Confident	85.8	Confident	18 Å²	18	55.3 Å²	55.3	8%	0.084	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-44.6	175.4	-67.7	-52.8	-35.9	0	0	111.4	V67 L68 F69 R73 F74 N77 L108	V67-Q71 HydrophobicContact CG1-CG 4.43Å; V67-Q71 WeakPolarHBondContact O-CG 3.45Å; V67-Q71 PolarHBondContact O-N 3.48Å; L68-Q71 PolarHBondContact O-N 3.26Å; F69-Q71 PolarHBondContact O-N 3.28Å; Q71-R73 VanDerWaalsContact C-N 3.3Å; Q71-R73 PolarHBondContact O-N 2.87Å; Q71-F74 PolarHBondContact O-N 3.31Å; Q71-N77 VanDerWaalsContact O-CB 3.28Å; Q71-N77 WeakPolarHBondContact O-CB 3.41Å; Q71-N77 PolarHBondContact O-ND2 2.87Å; Q71-N77 PolarHBondContact OE1-ND2 2.72Å; Q71-L108 HydrophobicContact CB-CD2 4.35Å
72	F	87	Confident	86	Confident	45 Å²	45	53.6 Å²	53.6	20%	0.197	26%	0.262	C	S	.	.	H	α-helix	trans	-78.7	-9.4	-179.5	-66.3	-55.8	0	0	0	114.4	L68 F69 F74 N77 L81 L108	L68-F72 HydrophobicContact CB-CD2 4.37Å; L68-F72 HydrophobicContact CB-CE2 4.3Å; L68-F72 HydrophobicContact CD2-CE2 4.1Å; L68-F72 WeakPolarHBondContact O-CD2 3.43Å; L68-F72 PolarHBondContact O-N 3.01Å; F69-F72 PolarHBondContact O-N 3.46Å; F72-F74 PolarHBondContact O-N 2.91Å; F72-N77 HydrophobicContact CD1-CB 4.02Å; F72-N77 HydrophobicContact CE1-CB 4.43Å; F72-L81 HydrophobicContact CD1-CB 4.26Å; F72-L81 HydrophobicContact CD1-CD2 4.05Å; F72-L81 HydrophobicContact CD2-CD2 4.43Å; F72-L81 HydrophobicContact CE1-CB 3.77Å; F72-L81 HydrophobicContact CE1-CD1 4.46Å; F72-L81 HydrophobicContact CE1-CD2 3.83Å; F72-L81 HydrophobicContact CE1-CG 4.23Å; F72-L81 HydrophobicContact CE2-CD2 4.21Å; F72-L81 HydrophobicContact CG-CD2 4.36Å; F72-L81 HydrophobicContact CZ-CB 4.4Å; F72-L81 HydrophobicContact CZ-CD1 4.26Å; F72-L81 HydrophobicContact CZ-CD2 3.91Å; F72-L81 HydrophobicContact CZ-CG 4.42Å; F72-L108 HydrophobicContact CE1-CD2 4.41Å; F72-L108 HydrophobicContact CZ-CD1 3.87Å; F72-L108 HydrophobicContact CZ-CD2 4.14Å
73	R	83.5	Confident	86	Confident	157 Å²	157	52 Å²	52	59%	0.592	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.7	167.4	-172.6	-179.2	66	167.8	-1.9	112	F69 E70 Q71	F69-R73 PolarHBondContact O-N 2.95Å; E70-R73 WeakPolarHBondContact O-CB 3.38Å; Q71-R73 VanDerWaalsContact C-N 3.3Å; Q71-R73 PolarHBondContact O-N 2.87Å
74	F	79.6	Confident	86.1	Confident	27 Å²	27	50.2 Å²	50.2	12%	0.118	24%	0.243	C	C	.	.	S	Bend	trans	-79.6	128.8	175	-64.5	-80.8	0	0	0	110.7	E70 Q71 F72 L76 N77 L78 V289	E70-F74 WeakPolarHBondContact O-CD2 3.46Å; Q71-F74 PolarHBondContact O-N 3.31Å; F72-F74 PolarHBondContact O-N 2.91Å; F74-L76 PolarHBondContact O-N 3.06Å; F74-L76 VanDerWaalsContact O-N 3.17Å; F74-N77 PolarHBondContact O-N 3.39Å; F74-N77 VanDerWaalsContact O-N 3.1Å; F74-L78 PolarHBondContact O-N 2.71Å; F74-V289 HydrophobicContact CE1-CG1 4.13Å; F74-V289 HydrophobicContact CZ-CG1 4.14Å; F74-V289 HydrophobicContact CZ-CG2 4.14Å
75	F	84.6	Confident	86.2	Confident	54 Å²	54	49.6 Å²	49.6	24%	0.237	24%	0.24	C	C	.	.	H	α-helix	trans	-55.2	-38.3	-176.9	176.2	-99.9	0	0	0	112.4	N77 L78 Y79 N297 T300 K301 F304	F75-N77 PolarHBondContact O-N 3.41Å; F75-L78 PolarHBondContact O-N 3.25Å; F75-Y79 VanDerWaalsContact O-CB 3.28Å; F75-Y79 WeakPolarHBondContact O-CB 3.2Å; F75-Y79 PolarHBondContact O-N 3.24Å; F75-N297 WeakPolarHBondContact CB-OD1 3.24Å; F75-T300 HydrophobicContact CD1-CG2 4.05Å; F75-T300 HydrophobicContact CE1-CG2 4.24Å; F75-K301 HydrophobicContact CD1-CG 3.8Å; F75-K301 HydrophobicContact CE1-CG 4.07Å; F75-K301 HydrophobicContact CG-CG 4.19Å; F75-F304 HydrophobicContact CE1-CB 3.89Å; F75-F304 HydrophobicContact CE1-CG 4.11Å; F75-F304 HydrophobicContact CZ-CB 3.94Å; F75-F304 AromaticContact CZ-CD1 3.73Å; F75-F304 HydrophobicContact CZ-CD1 3.73Å; F75-F304 HydrophobicContact CZ-CD2 4.1Å; F75-F304 HydrophobicContact CZ-CE1 4.23Å; F75-F304 AromaticContact CZ-CG 3.64Å; F75-F304 HydrophobicContact CZ-CG 3.64Å
76	L	81.4	Confident	86.2	Confident	13 Å²	13	46.7 Å²	46.7	7%	0.068	22%	0.222	C	C	.	.	H	α-helix	trans	-56.3	-47.9	177.7	-178	69.3	0	0	0	112.7	F74 Y79 F80 T300 I339 R344	F74-L76 PolarHBondContact O-N 3.06Å; F74-L76 VanDerWaalsContact O-N 3.17Å; L76-Y79 PolarHBondContact O-N 3.44Å; L76-F80 HydrophobicContact CD1-CD2 4.48Å; L76-F80 HydrophobicContact CD1-CE2 3.54Å; L76-F80 HydrophobicContact CD1-CZ 3.69Å; L76-F80 HydrophobicContact CD2-CE2 4.41Å; L76-F80 HydrophobicContact CG-CD2 4.33Å; L76-F80 HydrophobicContact CG-CE2 3.66Å; L76-F80 HydrophobicContact CG-CZ 4.34Å; L76-F80 WeakPolarHBondContact O-CD2 3.39Å; L76-F80 PolarHBondContact O-N 3.43Å; L76-T300 HydrophobicContact CB-CG2 4.32Å; L76-T300 HydrophobicContact CD1-CG2 3.59Å; L76-I339 HydrophobicContact CD1-CG2 3.45Å; L76-I339 VanDerWaalsContact CD1-CG2 3.45Å; L76-R344 HydrophobicContact CD2-CB 4.21Å
77	N	83.6	Confident	86.4	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-73.7	-38.6	-177.6	-69.5	-18.2	0	0	0	111.5	Q71 F72 F74 F75 Y79 F80 L81	Q71-N77 VanDerWaalsContact O-CB 3.28Å; Q71-N77 WeakPolarHBondContact O-CB 3.41Å; Q71-N77 PolarHBondContact O-ND2 2.87Å; Q71-N77 PolarHBondContact OE1-ND2 2.72Å; F72-N77 HydrophobicContact CD1-CB 4.02Å; F72-N77 HydrophobicContact CE1-CB 4.43Å; F74-N77 PolarHBondContact O-N 3.39Å; F74-N77 VanDerWaalsContact O-N 3.1Å; F75-N77 PolarHBondContact O-N 3.41Å; N77-Y79 VanDerWaalsContact C-N 3.31Å; N77-Y79 PolarHBondContact O-N 3.02Å; N77-F80 PolarHBondContact O-N 3.38Å; N77-L81 PolarHBondContact O-N 3.44Å; N77-L81 VanDerWaalsContact O-N 3.09Å
78	L	87.6	Confident	86.6	Confident	72 Å²	72	48.7 Å²	48.7	38%	0.377	23%	0.227	S	C	.	.	H	α-helix	trans	-60.6	-42.4	174.3	-178.4	63.7	0	0	0	111.5	F74 F75 F80 L81 L82	F74-L78 PolarHBondContact O-N 2.71Å; F75-L78 PolarHBondContact O-N 3.25Å; L78-F80 PolarHBondContact O-N 3.47Å; L78-L81 PolarHBondContact O-N 3.24Å; L78-L82 HydrophobicContact CG-CD1 4.34Å; L78-L82 WeakPolarHBondContact O-CG 3.36Å; L78-L82 PolarHBondContact O-N 3.01Å
79	Y	87.6	Confident	86.7	Confident	9 Å²	9	50.1 Å²	50.1	4%	0.035	24%	0.235	C	C	.	.	H	α-helix	trans	-57.7	-47.7	176.5	169.3	-103.3	0	0	0	112	F75 L76 N77 L81 L82 M83 F304 S336 I339	F75-Y79 VanDerWaalsContact O-CB 3.28Å; F75-Y79 WeakPolarHBondContact O-CB 3.2Å; F75-Y79 PolarHBondContact O-N 3.24Å; L76-Y79 PolarHBondContact O-N 3.44Å; N77-Y79 VanDerWaalsContact C-N 3.31Å; N77-Y79 PolarHBondContact O-N 3.02Å; Y79-L81 VanDerWaalsContact C-N 3.34Å; Y79-L81 PolarHBondContact O-N 3.25Å; Y79-L82 PolarHBondContact O-N 3.47Å; Y79-M83 HydrophobicContact CD2-CG 4.27Å; Y79-M83 HydrophobicContact CE1-CG 4.1Å; Y79-M83 HydrophobicContact CE2-CG 3.83Å; Y79-M83 HydrophobicContact CE2-SD 3.98Å; Y79-M83 VanDerWaalsContact O-CG 3.3Å; Y79-M83 WeakPolarHBondContact O-CG 3.42Å; Y79-M83 PolarHBondContact O-N 3.42Å; Y79-F304 AromaticContact CD2-CD2 3.65Å; Y79-F304 HydrophobicContact CD2-CD2 3.65Å; Y79-F304 AromaticContact CD2-CE2 3.79Å; Y79-F304 HydrophobicContact CD2-CE2 3.79Å; Y79-F304 AromaticContact CE2-CD2 3.53Å; Y79-F304 HydrophobicContact CE2-CD2 3.53Å; Y79-F304 AromaticContact CE2-CE2 3.73Å; Y79-F304 HydrophobicContact CE2-CE2 3.73Å; Y79-S336 WeakPolarHBondContact OH-CA 3.41Å; Y79-S336 WeakPolarHBondContact OH-CB 3.48Å; Y79-S336 PolarHBondContact OH-O 3.23Å; Y79-I339 HydrophobicContact CD1-CB 4.47Å; Y79-I339 HydrophobicContact CD1-CD1 4.14Å; Y79-I339 HydrophobicContact CD1-CG2 4.41Å; Y79-I339 HydrophobicContact CE1-CB 3.91Å; Y79-I339 HydrophobicContact CE1-CD1 3.81Å; Y79-I339 HydrophobicContact CE1-CG1 4.26Å; Y79-I339 HydrophobicContact CE1-CG2 4.33Å; Y79-I339 HydrophobicContact CE2-CD1 4.5Å
80	F	86.6	Confident	86.7	Confident	13 Å²	13	48.7 Å²	48.7	6%	0.057	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-35.5	178.4	-64.3	-44.6	0	0	0	113.4	L76 N77 L78 M83 A84 L104 I339 I341	L76-F80 HydrophobicContact CD1-CD2 4.48Å; L76-F80 HydrophobicContact CD1-CE2 3.54Å; L76-F80 HydrophobicContact CD1-CZ 3.69Å; L76-F80 HydrophobicContact CD2-CE2 4.41Å; L76-F80 HydrophobicContact CG-CD2 4.33Å; L76-F80 HydrophobicContact CG-CE2 3.66Å; L76-F80 HydrophobicContact CG-CZ 4.34Å; L76-F80 WeakPolarHBondContact O-CD2 3.39Å; L76-F80 PolarHBondContact O-N 3.43Å; N77-F80 PolarHBondContact O-N 3.38Å; L78-F80 PolarHBondContact O-N 3.47Å; F80-M83 PolarHBondContact O-N 3.03Å; F80-A84 WeakPolarHBondContact O-CB 3.49Å; F80-A84 PolarHBondContact O-N 3.37Å; F80-L104 HydrophobicContact CB-CD1 3.98Å; F80-I339 HydrophobicContact CE1-CB 4.44Å; F80-I339 HydrophobicContact CE1-CG2 4.14Å; F80-I339 VanDerWaalsContact CE1-O 3.26Å; F80-I339 WeakPolarHBondContact CE1-O 3.37Å; F80-I339 HydrophobicContact CZ-CG2 3.81Å; F80-I339 WeakPolarHBondContact CZ-O 3.3Å; F80-I341 HydrophobicContact CD1-CD1 4.24Å; F80-I341 HydrophobicContact CD1-CG1 3.48Å; F80-I341 VanDerWaalsContact CD1-CG1 3.48Å; F80-I341 HydrophobicContact CD2-CG1 4.24Å; F80-I341 HydrophobicContact CD2-CG2 4.47Å; F80-I341 HydrophobicContact CE1-CB 4.26Å; F80-I341 HydrophobicContact CE1-CD1 4.45Å; F80-I341 HydrophobicContact CE1-CG1 3.35Å; F80-I341 HydrophobicContact CE2-CB 4.29Å; F80-I341 HydrophobicContact CE2-CG1 4.12Å; F80-I341 HydrophobicContact CE2-CG2 4.45Å; F80-I341 HydrophobicContact CG-CG1 3.95Å; F80-I341 VanDerWaalsContact CZ-CA 3.4Å; F80-I341 HydrophobicContact CZ-CB 4.1Å; F80-I341 HydrophobicContact CZ-CG1 3.69Å
81	L	89.6	Confident	86.8	Confident	39 Å²	39	50.6 Å²	50.6	20%	0.204	25%	0.25	C	C	.	.	H	α-helix	trans	-61.4	-47.2	173.5	-179.7	64.3	0	0	0	111.2	F72 N77 L78 Y79 M83 A84 L85 W101 L104	F72-L81 HydrophobicContact CD1-CB 4.26Å; F72-L81 HydrophobicContact CD1-CD2 4.05Å; F72-L81 HydrophobicContact CD2-CD2 4.43Å; F72-L81 HydrophobicContact CE1-CB 3.77Å; F72-L81 HydrophobicContact CE1-CD1 4.46Å; F72-L81 HydrophobicContact CE1-CD2 3.83Å; F72-L81 HydrophobicContact CE1-CG 4.23Å; F72-L81 HydrophobicContact CE2-CD2 4.21Å; F72-L81 HydrophobicContact CG-CD2 4.36Å; F72-L81 HydrophobicContact CZ-CB 4.4Å; F72-L81 HydrophobicContact CZ-CD1 4.26Å; F72-L81 HydrophobicContact CZ-CD2 3.91Å; F72-L81 HydrophobicContact CZ-CG 4.42Å; N77-L81 PolarHBondContact O-N 3.44Å; N77-L81 VanDerWaalsContact O-N 3.09Å; L78-L81 PolarHBondContact O-N 3.24Å; Y79-L81 VanDerWaalsContact C-N 3.34Å; Y79-L81 PolarHBondContact O-N 3.25Å; L81-M83 VanDerWaalsContact C-N 3.29Å; L81-M83 PolarHBondContact O-N 2.87Å; L81-A84 PolarHBondContact O-N 3.27Å; L81-L85 HydrophobicContact CD1-CD1 4.22Å; L81-L85 HydrophobicContact CD1-CG 4.34Å; L81-L85 HydrophobicContact CG-CD1 3.98Å; L81-L85 WeakPolarHBondContact O-CB 3.32Å; L81-L85 VanDerWaalsContact O-CG 3.29Å; L81-L85 WeakPolarHBondContact O-CG 3.35Å; L81-L85 PolarHBondContact O-N 3.19Å; L81-W101 HydrophobicContact CD1-CH2 4.29Å; L81-L104 HydrophobicContact CD1-CD2 4.34Å
82	L	89.9	Confident	87	Confident	99 Å²	99	50.8 Å²	50.8	52%	0.518	25%	0.251	S	S	.	.	H	α-helix	trans	-61.4	-39.1	177.1	-67.7	173.4	0	0	0	111.6	L78 Y79 S86	L78-L82 HydrophobicContact CG-CD1 4.34Å; L78-L82 WeakPolarHBondContact O-CG 3.36Å; L78-L82 PolarHBondContact O-N 3.01Å; Y79-L82 PolarHBondContact O-N 3.47Å; L82-S86 PolarHBondContact O-N 3.07Å
83	M	87.5	Confident	86.9	Confident	24 Å²	24	53.6 Å²	53.6	12%	0.118	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-42.2	176.4	-64.1	-77.7	66.2	0	0	113	Y79 F80 L81 S86 Q87 L333	Y79-M83 HydrophobicContact CD2-CG 4.27Å; Y79-M83 HydrophobicContact CE1-CG 4.1Å; Y79-M83 HydrophobicContact CE2-CG 3.83Å; Y79-M83 HydrophobicContact CE2-SD 3.98Å; Y79-M83 VanDerWaalsContact O-CG 3.3Å; Y79-M83 WeakPolarHBondContact O-CG 3.42Å; Y79-M83 PolarHBondContact O-N 3.42Å; F80-M83 PolarHBondContact O-N 3.03Å; L81-M83 VanDerWaalsContact C-N 3.29Å; L81-M83 PolarHBondContact O-N 2.87Å; M83-S86 PolarHBondContact O-N 3.46Å; M83-S86 PolarHBondContact O-OG 2.85Å; M83-Q87 PolarHBondContact O-NE2 2.87Å; M83-L333 HydrophobicContact CE-CD2 3.3Å; M83-L333 HydrophobicContact CE-CG 4.37Å; M83-L333 HydrophobicContact SD-CD2 3.68Å
84	A	88.6	Confident	86.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-42	175.9	0	0	0	0	0	112.2	F80 L81 S86 Q87 W101 L104	F80-A84 WeakPolarHBondContact O-CB 3.49Å; F80-A84 PolarHBondContact O-N 3.37Å; L81-A84 PolarHBondContact O-N 3.27Å; A84-S86 VanDerWaalsContact C-N 3.34Å; A84-S86 PolarHBondContact O-N 2.63Å; A84-Q87 PolarHBondContact O-N 3Å; A84-W101 HydrophobicContact CB-CD2 4Å; A84-W101 HydrophobicContact CB-CG 4.34Å; A84-W101 HydrophobicContact CB-CH2 4.45Å; A84-W101 HydrophobicContact CB-CZ2 3.89Å; A84-W101 PolarHBondContact O-NE1 3.44Å; A84-W101 VanDerWaalsContact O-NE1 3.07Å; A84-L104 HydrophobicContact CB-CD2 3.89Å
85	L	91.3	Very high	86.7	Confident	79 Å²	79	47 Å²	47	41%	0.414	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-37.8	176.9	-73.2	170.2	0	0	0	112.4	L81 Q87 F88 W101	L81-L85 HydrophobicContact CD1-CD1 4.22Å; L81-L85 HydrophobicContact CD1-CG 4.34Å; L81-L85 HydrophobicContact CG-CD1 3.98Å; L81-L85 WeakPolarHBondContact O-CB 3.32Å; L81-L85 VanDerWaalsContact O-CG 3.29Å; L81-L85 WeakPolarHBondContact O-CG 3.35Å; L81-L85 PolarHBondContact O-N 3.19Å; L85-Q87 PolarHBondContact O-N 3.22Å; L85-F88 HydrophobicContact CD2-CD2 4.33Å; L85-F88 HydrophobicContact CD2-CE2 4.23Å; L85-F88 WeakPolarHBondContact O-CB 3.33Å; L85-F88 PolarHBondContact O-N 2.78Å; L85-F88 VanDerWaalsContact O-N 3.15Å; L85-W101 HydrophobicContact CD2-CH2 4.11Å; L85-W101 HydrophobicContact CD2-CZ2 3.92Å; L85-W101 HydrophobicContact CG-CH2 4.5Å; L85-W101 HydrophobicContact CG-CZ2 4.27Å
86	S	90.3	Very high	86.7	Confident	20 Å²	20	50.4 Å²	50.4	14%	0.14	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-23.5	178.9	71.9	0	0	0	0	113.8	L82 M83 A84 F88 I89 L333	L82-S86 PolarHBondContact O-N 3.07Å; M83-S86 PolarHBondContact O-N 3.46Å; M83-S86 PolarHBondContact O-OG 2.85Å; A84-S86 VanDerWaalsContact C-N 3.34Å; A84-S86 PolarHBondContact O-N 2.63Å; S86-F88 PolarHBondContact O-N 3.25Å; S86-I89 WeakPolarHBondContact O-CB 2.88Å; S86-I89 PolarHBondContact O-N 3.45Å; S86-I89 VanDerWaalsContact O-N 3.14Å; S86-L333 WeakPolarHBondContact OG-CD2 3.48Å
87	Q	89.1	Confident	86.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.8	178.5	-56.5	-48.3	-56.9	0	0	113.7	M83 A84 L85 I89 R93 Y100 L333	M83-Q87 PolarHBondContact O-NE2 2.87Å; A84-Q87 PolarHBondContact O-N 3Å; L85-Q87 PolarHBondContact O-N 3.22Å; Q87-I89 PolarHBondContact O-N 2.86Å; Q87-R93 PolarHBondContact O-NE 2.73Å; Q87-R93 PolarHBondContact O-NH2 3.04Å; Q87-Y100 HydrophobicContact CG-CD1 4.31Å; Q87-Y100 HydrophobicContact CG-CD2 3.57Å; Q87-Y100 HydrophobicContact CG-CE2 3.93Å; Q87-Y100 HydrophobicContact CG-CG 3.78Å; Q87-L333 VanDerWaalsContact NE2-CD2 3.28Å
88	F	90.2	Very high	87	Confident	118 Å²	118	56.5 Å²	56.5	52%	0.518	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-21.1	172.4	-67.7	-52.6	0	0	0	112.6	L85 S86 P90 W101	L85-F88 HydrophobicContact CD2-CD2 4.33Å; L85-F88 HydrophobicContact CD2-CE2 4.23Å; L85-F88 WeakPolarHBondContact O-CB 3.33Å; L85-F88 PolarHBondContact O-N 2.78Å; L85-F88 VanDerWaalsContact O-N 3.15Å; S86-F88 PolarHBondContact O-N 3.25Å; F88-P90 VanDerWaalsContact O-CD 3.23Å; F88-P90 WeakPolarHBondContact O-CD 3.2Å; F88-W101 HydrophobicContact CD2-CZ2 4.41Å; F88-W101 AromaticContact CE2-CE2 3.73Å; F88-W101 HydrophobicContact CE2-CH2 4.45Å; F88-W101 AromaticContact CE2-CZ2 3.43Å; F88-W101 HydrophobicContact CE2-CZ2 3.43Å; F88-W101 VanDerWaalsContact CE2-CZ2 3.43Å; F88-W101 AromaticContact CE2-NE1 3.68Å; F88-W101 AromaticContact CZ-CE2 3.74Å; F88-W101 AromaticContact CZ-CZ2 3.88Å; F88-W101 HydrophobicContact CZ-CZ2 3.88Å; F88-W101 AromaticContact CZ-NE1 3.5Å
89	I	90.1	Very high	86.8	Confident	81 Å²	81	53.7 Å²	53.7	42%	0.415	27%	0.269	S	S	.	.			trans	-80.5	111.3	177.7	-55.3	174.6	0	0	0	108.9	S86 Q87 D91 I92 R93	S86-I89 WeakPolarHBondContact O-CB 2.88Å; S86-I89 PolarHBondContact O-N 3.45Å; S86-I89 VanDerWaalsContact O-N 3.14Å; Q87-I89 PolarHBondContact O-N 2.86Å; I89-D91 VanDerWaalsContact C-N 3.29Å; I89-D91 HydrophobicContact CG2-CB 4.37Å; I89-D91 PolarHBondContact O-N 2.84Å; I89-I92 HydrophobicContact CB-CG1 4.5Å; I89-I92 HydrophobicContact CD1-CD1 4.34Å; I89-I92 HydrophobicContact CG2-CD1 4.07Å; I89-I92 HydrophobicContact CG2-CG1 3.91Å; I89-I92 PolarHBondContact O-N 2.94Å; I89-R93 PolarHBondContact O-N 2.85Å
90	P	85.9	Confident	86.6	Confident	95 Å²	95	53.7 Å²	53.7	62%	0.617	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-60.7	-37	-174.9	-23.9	35.6	0	0	0	113.3	F88 I92 R93	F88-P90 VanDerWaalsContact O-CD 3.23Å; F88-P90 WeakPolarHBondContact O-CD 3.2Å; P90-I92 PolarHBondContact O-N 3.24Å; P90-R93 PolarHBondContact O-N 3.13Å
91	D	84.4	Confident	86.6	Confident	95 Å²	95	57.2 Å²	57.2	51%	0.508	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-64.5	-21.5	-176.9	-72.3	-12.7	0	0	0	114.5	I89 R326	I89-D91 VanDerWaalsContact C-N 3.29Å; I89-D91 HydrophobicContact CG2-CB 4.37Å; I89-D91 PolarHBondContact O-N 2.84Å; D91-R326 IonicContact OD2-CZ 2.74Å
92	I	87.8	Confident	86.4	Confident	22 Å²	22	57.4 Å²	57.4	11%	0.113	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-116.3	-4	-174.9	-41	179	0	0	0	110.7	I89 P90 I94 F329 R330 L333	I89-I92 HydrophobicContact CB-CG1 4.5Å; I89-I92 HydrophobicContact CD1-CD1 4.34Å; I89-I92 HydrophobicContact CG2-CD1 4.07Å; I89-I92 HydrophobicContact CG2-CG1 3.91Å; I89-I92 PolarHBondContact O-N 2.94Å; P90-I92 PolarHBondContact O-N 3.24Å; I92-I94 WeakPolarHBondContact O-CG1 3.38Å; I92-I94 PolarHBondContact O-N 3.29Å; I92-F329 HydrophobicContact CD1-CB 4.1Å; I92-F329 HydrophobicContact CD1-CD2 4.41Å; I92-F329 HydrophobicContact CD1-CG 4.34Å; I92-F329 HydrophobicContact CG2-CB 3.5Å; I92-F329 VanDerWaalsContact CG2-CB 3.5Å; I92-R330 HydrophobicContact CG2-CG 4Å; I92-L333 HydrophobicContact CG2-CD1 3.67Å; I92-L333 WeakPolarHBondContact O-CD1 3.24Å
93	R	85.8	Confident	85.9	Confident	105 Å²	105	54 Å²	54	40%	0.396	28%	0.277	S	S	.	.			trans	-64.1	134.6	-178.5	-173.6	-178.7	-65.7	163.8	2.7	111.2	Q87 I89 P90 G95	Q87-R93 PolarHBondContact O-NE 2.73Å; Q87-R93 PolarHBondContact O-NH2 3.04Å; I89-R93 PolarHBondContact O-N 2.85Å; P90-R93 PolarHBondContact O-N 3.13Å; R93-G95 VanDerWaalsContact CG-O 3.3Å; R93-G95 WeakPolarHBondContact CG-O 3.41Å
94	I	81.6	Confident	85.8	Confident	24 Å²	24	53 Å²	53	12%	0.123	27%	0.272	C	S	.	.			trans	-117.4	-37.8	-179.3	-54.5	-166	0	0	0	112.1	I92 R330 L333 L334 A900	I92-I94 WeakPolarHBondContact O-CG1 3.38Å; I92-I94 PolarHBondContact O-N 3.29Å; I94-R330 HydrophobicContact CD1-CB 3.94Å; I94-R330 HydrophobicContact CD1-CG 4.22Å; I94-R330 WeakPolarHBondContact CD1-O 3.26Å; I94-R330 HydrophobicContact CG1-CG 4.32Å; I94-L333 HydrophobicContact CD1-CB 3.48Å; I94-L333 VanDerWaalsContact CD1-CB 3.48Å; I94-L333 HydrophobicContact CD1-CD1 4.19Å; I94-L333 HydrophobicContact CD1-CG 4.49Å; I94-L333 HydrophobicContact CG1-CB 4.22Å; I94-L333 HydrophobicContact CG1-CD1 4.15Å; I94-L334 HydrophobicContact CD1-CD1 4.31Å; I94-L334 HydrophobicContact CD1-CD2 4.11Å; I94-L334 HydrophobicContact CD1-CG 3.64Å; I94-L334 HydrophobicContact CG2-CD2 3.73Å; I94-L334 HydrophobicContact CG2-CG 4.38Å; I94-A900 HydrophobicContact CG2-CB 3.86Å
95	G	77.6	Confident	85.8	Confident	21 Å²	21	54.9 Å²	54.9	22%	0.216	29%	0.291	C	S	.	.	S	Bend	trans	-130.7	-176.1	-179.8	0	0	0	0	0	111.8	R93	R93-G95 VanDerWaalsContact CG-O 3.3Å; R93-G95 WeakPolarHBondContact CG-O 3.41Å
96	Y	84.3	Confident	85.4	Confident	126 Å²	126	56.6 Å²	56.6	49%	0.494	30%	0.295	S	S	.	.			trans	-71.1	139.3	177.4	-59.4	-77.8	0	0	0	111.3	Y98 T99	Y96-Y98 HydrophobicContact CD1-CE1 4.19Å; Y96-Y98 AromaticContact CD2-CE1 3.84Å; Y96-Y98 HydrophobicContact CD2-CE1 3.84Å; Y96-Y98 HydrophobicContact CG-CD1 4.18Å; Y96-Y98 AromaticContact CG-CE1 3.47Å; Y96-Y98 HydrophobicContact CG-CE1 3.47Å; Y96-Y98 VanDerWaalsContact CG-CE1 3.47Å; Y96-Y98 PolarHBondContact O-N 3.2Å; Y96-Y98 VanDerWaalsContact O-N 3.08Å; Y96-T99 PolarHBondContact O-N 2.78Å; Y96-T99 PolarHBondContact O-OG1 3.23Å
97	P	85.3	Confident	85	Confident	43 Å²	43	56 Å²	56	28%	0.279	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-32.4	-178.8	-28.3	35.3	0	0	0	114.6	T99 Y100 W101	P97-T99 PolarHBondContact O-N 3.01Å; P97-Y100 PolarHBondContact O-N 3.04Å; P97-W101 PolarHBondContact O-N 2.93Å; P97-W101 VanDerWaalsContact O-N 3.1Å
98	Y	85.9	Confident	84.9	Confident	102 Å²	102	57.2 Å²	57.2	40%	0.4	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-25.4	-179.8	72.8	-100.8	0	0	0	113.2	Y96 Y100 G102 V908	Y96-Y98 HydrophobicContact CD1-CE1 4.19Å; Y96-Y98 AromaticContact CD2-CE1 3.84Å; Y96-Y98 HydrophobicContact CD2-CE1 3.84Å; Y96-Y98 HydrophobicContact CG-CD1 4.18Å; Y96-Y98 AromaticContact CG-CE1 3.47Å; Y96-Y98 HydrophobicContact CG-CE1 3.47Å; Y96-Y98 VanDerWaalsContact CG-CE1 3.47Å; Y96-Y98 PolarHBondContact O-N 3.2Å; Y96-Y98 VanDerWaalsContact O-N 3.08Å; Y98-Y100 PolarHBondContact O-N 3.36Å; Y98-G102 WeakPolarHBondContact O-CA 3.26Å; Y98-G102 PolarHBondContact O-N 3.45Å; Y98-V908 HydrophobicContact CE2-CG2 4.4Å
99	T	82.6	Confident	84.7	Confident	13 Å²	13	56.9 Å²	56.9	8%	0.08	30%	0.299	C	S	.	.	H	α-helix	trans	-71.6	-17.1	-179.8	65	0	0	0	0	112.8	Y96 P97 P103 V908	Y96-T99 PolarHBondContact O-N 2.78Å; Y96-T99 PolarHBondContact O-OG1 3.23Å; P97-T99 PolarHBondContact O-N 3.01Å; T99-P103 WeakPolarHBondContact O-CD 3.39Å; T99-P103 WeakPolarHBondContact O-CG 3.38Å; T99-V908 HydrophobicContact CG2-CG2 3.92Å
100	Y	83.8	Confident	84.4	Confident	9 Å²	9	55.4 Å²	55.4	4%	0.035	29%	0.294	C	S	.	.	H	α-helix	trans	-105.5	-47	177.7	-65.6	-95.9	0	0	0	111.4	Q87 P97 Y98 L104 Y337	Q87-Y100 HydrophobicContact CG-CD1 4.31Å; Q87-Y100 HydrophobicContact CG-CD2 3.57Å; Q87-Y100 HydrophobicContact CG-CE2 3.93Å; Q87-Y100 HydrophobicContact CG-CG 3.78Å; P97-Y100 PolarHBondContact O-N 3.04Å; Y98-Y100 PolarHBondContact O-N 3.36Å; Y100-L104 WeakPolarHBondContact O-CB 3.32Å; Y100-L104 PolarHBondContact O-N 3.14Å; Y100-Y337 PolarHBondContact OH-OH 3.37Å
101	W	87.6	Confident	84.1	Confident	86 Å²	86	51.3 Å²	51.3	33%	0.326	27%	0.267	S	S	.	.	H	α-helix	trans	-72.1	-34.1	-178.8	-78	96.8	0	0	0	113.4	L81 A84 L85 F88 P97 G105	L81-W101 HydrophobicContact CD1-CH2 4.29Å; A84-W101 HydrophobicContact CB-CD2 4Å; A84-W101 HydrophobicContact CB-CG 4.34Å; A84-W101 HydrophobicContact CB-CH2 4.45Å; A84-W101 HydrophobicContact CB-CZ2 3.89Å; A84-W101 PolarHBondContact O-NE1 3.44Å; A84-W101 VanDerWaalsContact O-NE1 3.07Å; L85-W101 HydrophobicContact CD2-CH2 4.11Å; L85-W101 HydrophobicContact CD2-CZ2 3.92Å; L85-W101 HydrophobicContact CG-CH2 4.5Å; L85-W101 HydrophobicContact CG-CZ2 4.27Å; F88-W101 HydrophobicContact CD2-CZ2 4.41Å; F88-W101 AromaticContact CE2-CE2 3.73Å; F88-W101 HydrophobicContact CE2-CH2 4.45Å; F88-W101 AromaticContact CE2-CZ2 3.43Å; F88-W101 HydrophobicContact CE2-CZ2 3.43Å; F88-W101 VanDerWaalsContact CE2-CZ2 3.43Å; F88-W101 AromaticContact CE2-NE1 3.68Å; F88-W101 AromaticContact CZ-CE2 3.74Å; F88-W101 AromaticContact CZ-CZ2 3.88Å; F88-W101 HydrophobicContact CZ-CZ2 3.88Å; F88-W101 AromaticContact CZ-NE1 3.5Å; P97-W101 PolarHBondContact O-N 2.93Å; P97-W101 VanDerWaalsContact O-N 3.1Å; W101-G105 PolarHBondContact O-N 3.28Å
102	G	84.6	Confident	84.2	Confident	43 Å²	43	48.4 Å²	48.4	44%	0.443	25%	0.251	S	S	.	.	H	α-helix	trans	-60.1	-58.4	178.6	0	0	0	0	0	112.5	Y98 L104 G105 F106	Y98-G102 WeakPolarHBondContact O-CA 3.26Å; Y98-G102 PolarHBondContact O-N 3.45Å; G102-L104 PolarHBondContact O-N 3.31Å; G102-G105 PolarHBondContact O-N 3.24Å; G102-F106 PolarHBondContact O-N 2.67Å
103	P	80.3	Confident	84.1	Confident	28 Å²	28	50.5 Å²	50.5	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-44.2	177.5	-26.9	36.3	0	0	0	113.3	T99 F106 V107 I341	T99-P103 WeakPolarHBondContact O-CD 3.39Å; T99-P103 WeakPolarHBondContact O-CG 3.38Å; P103-F106 PolarHBondContact O-N 2.96Å; P103-V107 WeakPolarHBondContact O-CG2 3.44Å; P103-V107 PolarHBondContact O-N 3.29Å; P103-I341 HydrophobicContact CB-CD1 4.16Å; P103-I341 HydrophobicContact CB-CG2 3.95Å
104	L	84.9	Confident	83.9	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-61.3	-45.6	178.5	179.1	62.1	0	0	0	111.8	F80 L81 A84 Y100 G102 F106 V107 L108	F80-L104 HydrophobicContact CB-CD1 3.98Å; L81-L104 HydrophobicContact CD1-CD2 4.34Å; A84-L104 HydrophobicContact CB-CD2 3.89Å; Y100-L104 WeakPolarHBondContact O-CB 3.32Å; Y100-L104 PolarHBondContact O-N 3.14Å; G102-L104 PolarHBondContact O-N 3.31Å; L104-F106 VanDerWaalsContact C-N 3.34Å; L104-F106 PolarHBondContact O-N 2.98Å; L104-V107 PolarHBondContact O-N 2.91Å; L104-L108 HydrophobicContact CD1-CD1 4.04Å; L104-L108 HydrophobicContact CD1-CG 4.21Å; L104-L108 HydrophobicContact CG-CD1 4.01Å; L104-L108 WeakPolarHBondContact O-CB 3.31Å; L104-L108 WeakPolarHBondContact O-CG 3.44Å; L104-L108 PolarHBondContact O-N 3.05Å
105	G	87.5	Confident	83.8	Confident	38 Å²	38	47.7 Å²	47.7	39%	0.392	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-42.3	176.5	0	0	0	0	0	112.2	W101 G102 L108 M109	W101-G105 PolarHBondContact O-N 3.28Å; G102-G105 PolarHBondContact O-N 3.24Å; G105-L108 PolarHBondContact O-N 2.92Å; G105-M109 VanDerWaalsContact O-CB 3.23Å; G105-M109 WeakPolarHBondContact O-CB 3.25Å; G105-M109 PolarHBondContact O-N 3.07Å
106	F	84.7	Confident	84.2	Confident	115 Å²	115	48 Å²	48	50%	0.504	26%	0.256	S	S	.	.	H	α-helix	trans	-62.8	-47	175.4	179.8	-101.8	0	0	0	112.4	G102 P103 L104 L108 M109 V110 V345	G102-F106 PolarHBondContact O-N 2.67Å; P103-F106 PolarHBondContact O-N 2.96Å; L104-F106 VanDerWaalsContact C-N 3.34Å; L104-F106 PolarHBondContact O-N 2.98Å; F106-L108 PolarHBondContact O-N 2.92Å; F106-M109 PolarHBondContact O-N 3.48Å; F106-V110 HydrophobicContact CE1-CG2 4.11Å; F106-V110 HydrophobicContact CE2-CG2 4.13Å; F106-V110 HydrophobicContact CZ-CG2 3.91Å; F106-V110 WeakPolarHBondContact O-CG2 3.43Å; F106-V110 PolarHBondContact O-N 3.25Å; F106-V345 HydrophobicContact CE1-CG1 4.14Å
107	V	81.6	Confident	84.2	Confident	9 Å²	9	45.2 Å²	45.2	6%	0.055	25%	0.252	C	S	.	.	H	α-helix	trans	-58.4	-50.7	177.4	-179.3	0	0	0	0	110.4	P103 L104 M109 V110 T111 I341 R344 V345	P103-V107 WeakPolarHBondContact O-CG2 3.44Å; P103-V107 PolarHBondContact O-N 3.29Å; L104-V107 PolarHBondContact O-N 2.91Å; V107-M109 VanDerWaalsContact C-N 3.35Å; V107-M109 PolarHBondContact O-N 3.26Å; V107-V110 PolarHBondContact O-N 2.92Å; V107-T111 WeakPolarHBondContact O-CG2 3.46Å; V107-T111 PolarHBondContact O-N 3.48Å; V107-T111 VanDerWaalsContact O-N 3.07Å; V107-T111 PolarHBondContact O-OG1 3.47Å; V107-I341 HydrophobicContact CG2-CG2 3.77Å; V107-R344 HydrophobicContact CG1-CB 4.38Å; V107-R344 HydrophobicContact CG1-CG 4.25Å; V107-V345 HydrophobicContact CB-CG2 3.87Å; V107-V345 HydrophobicContact CG1-CG2 3.83Å; V107-V345 HydrophobicContact CG2-CG2 3.31Å
108	L	85.6	Confident	83.7	Confident	24 Å²	24	44.6 Å²	44.6	13%	0.126	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-43.7	-179.7	-70.2	172.9	0	0	0	111.1	Q71 F72 L104 G105 F106 V110 T111 I112	Q71-L108 HydrophobicContact CB-CD2 4.35Å; F72-L108 HydrophobicContact CE1-CD2 4.41Å; F72-L108 HydrophobicContact CZ-CD1 3.87Å; F72-L108 HydrophobicContact CZ-CD2 4.14Å; L104-L108 HydrophobicContact CD1-CD1 4.04Å; L104-L108 HydrophobicContact CD1-CG 4.21Å; L104-L108 HydrophobicContact CG-CD1 4.01Å; L104-L108 WeakPolarHBondContact O-CB 3.31Å; L104-L108 WeakPolarHBondContact O-CG 3.44Å; L104-L108 PolarHBondContact O-N 3.05Å; G105-L108 PolarHBondContact O-N 2.92Å; F106-L108 PolarHBondContact O-N 2.92Å; L108-V110 PolarHBondContact O-N 3.41Å; L108-T111 WeakPolarHBondContact CA-OG1 3.32Å; L108-T111 PolarHBondContact O-N 3.31Å; L108-T111 PolarHBondContact O-OG1 3.33Å; L108-I112 HydrophobicContact CB-CD1 4.46Å; L108-I112 WeakPolarHBondContact O-CB 3.5Å; L108-I112 WeakPolarHBondContact O-CD1 3.48Å; L108-I112 WeakPolarHBondContact O-CG1 3.45Å; L108-I112 PolarHBondContact O-N 2.83Å
109	M	87.6	Confident	83.5	Confident	112 Å²	112	40.3 Å²	40.3	55%	0.552	23%	0.23	S	C	*	.	H	α-helix	trans	-57.6	-49.3	177.1	-178.5	-174.5	133.2	0	0	111.7	G105 F106 V107 T111 I112 C113	G105-M109 VanDerWaalsContact O-CB 3.23Å; G105-M109 WeakPolarHBondContact O-CB 3.25Å; G105-M109 PolarHBondContact O-N 3.07Å; F106-M109 PolarHBondContact O-N 3.48Å; V107-M109 VanDerWaalsContact C-N 3.35Å; V107-M109 PolarHBondContact O-N 3.26Å; M109-T111 VanDerWaalsContact C-N 3.31Å; M109-T111 PolarHBondContact O-N 3.12Å; M109-I112 PolarHBondContact O-N 3.32Å; M109-C113 WeakPolarHBondContact O-CB 3.33Å; M109-C113 PolarHBondContact O-N 3.16Å; M109-C113 PolarHBondContact O-SG 2.83Å
110	V	82.6	Confident	83.6	Confident	50 Å²	50	44.7 Å²	44.7	30%	0.303	25%	0.253	S	S	.	.	H	α-helix	trans	-59.4	-43.4	178.2	172.2	0	0	0	0	111	F106 V107 L108 R114	F106-V110 HydrophobicContact CE1-CG2 4.11Å; F106-V110 HydrophobicContact CE2-CG2 4.13Å; F106-V110 HydrophobicContact CZ-CG2 3.91Å; F106-V110 WeakPolarHBondContact O-CG2 3.43Å; F106-V110 PolarHBondContact O-N 3.25Å; V107-V110 PolarHBondContact O-N 2.92Å; L108-V110 PolarHBondContact O-N 3.41Å; V110-R114 WeakPolarHBondContact O-CB 3.4Å; V110-R114 PolarHBondContact O-N 2.85Å
111	T	79.4	Confident	83.4	Confident	9 Å²	9	51 Å²	51	6%	0.055	28%	0.277	C	S	.	.	H	α-helix	trans	-66.4	-41.4	178.5	59.3	0	0	0	0	113	V107 L108 M109 R114 E115	V107-T111 WeakPolarHBondContact O-CG2 3.46Å; V107-T111 PolarHBondContact O-N 3.48Å; V107-T111 VanDerWaalsContact O-N 3.07Å; V107-T111 PolarHBondContact O-OG1 3.47Å; L108-T111 WeakPolarHBondContact CA-OG1 3.32Å; L108-T111 PolarHBondContact O-N 3.31Å; L108-T111 PolarHBondContact O-OG1 3.33Å; M109-T111 VanDerWaalsContact C-N 3.31Å; M109-T111 PolarHBondContact O-N 3.12Å; T111-R114 PolarHBondContact O-N 2.66Å; T111-E115 PolarHBondContact O-N 2.75Å
112	I	86.8	Confident	82.9	Confident	34 Å²	34	49.3 Å²	49.3	17%	0.174	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-46.1	178.9	-68.4	164.6	0	0	0	110.2	F63 L64 V67 L68 L108 M109 R114 E115 A116	F63-I112 HydrophobicContact CE1-CG2 3.76Å; F63-I112 HydrophobicContact CZ-CG2 4.06Å; L64-I112 HydrophobicContact CD1-CD1 4.02Å; V67-I112 HydrophobicContact CG1-CG1 3.96Å; L68-I112 HydrophobicContact CD2-CD1 4.05Å; L108-I112 HydrophobicContact CB-CD1 4.46Å; L108-I112 WeakPolarHBondContact O-CB 3.5Å; L108-I112 WeakPolarHBondContact O-CD1 3.48Å; L108-I112 WeakPolarHBondContact O-CG1 3.45Å; L108-I112 PolarHBondContact O-N 2.83Å; M109-I112 PolarHBondContact O-N 3.32Å; I112-R114 VanDerWaalsContact C-N 3.3Å; I112-R114 PolarHBondContact O-N 3.05Å; I112-E115 PolarHBondContact O-N 3.42Å; I112-A116 WeakPolarHBondContact O-CB 3.25Å; I112-A116 PolarHBondContact O-N 3.48Å
113	C	86.3	Confident	82.9	Confident	65 Å²	65	51.2 Å²	51.2	44%	0.439	27%	0.267	S	S	.	.	H	α-helix	trans	-59.4	-42.7	177.3	-72.7	0	0	0	0	111.6	M109 A116 V117	M109-C113 WeakPolarHBondContact O-CB 3.33Å; M109-C113 PolarHBondContact O-N 3.16Å; M109-C113 PolarHBondContact O-SG 2.83Å; C113-A116 WeakPolarHBondContact O-CB 3.5Å; C113-A116 PolarHBondContact O-N 3.39Å; C113-V117 WeakPolarHBondContact O-CG2 3.34Å; C113-V117 PolarHBondContact O-N 2.97Å
114	R	80.5	Confident	83.1	Confident	49 Å²	49	56.3 Å²	56.3	19%	0.185	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-50.7	176.3	175	-174.1	161.4	-177.6	7.1	112.1	V110 T111 I112 A116 V117 D118 D348 T372	V110-R114 WeakPolarHBondContact O-CB 3.4Å; V110-R114 PolarHBondContact O-N 2.85Å; T111-R114 PolarHBondContact O-N 2.66Å; I112-R114 VanDerWaalsContact C-N 3.3Å; I112-R114 PolarHBondContact O-N 3.05Å; R114-A116 PolarHBondContact O-N 3.49Å; R114-V117 PolarHBondContact O-N 2.97Å; R114-V117 VanDerWaalsContact O-N 3.17Å; R114-D118 PolarHBondContact O-N 2.69Å; R114-D348 IonicContact NH1-OD1 2.81Å; R114-D348 PolarHBondContact NH1-OD1 3.23Å; R114-T372 PolarHBondContact NE-OG1 3.41Å; R114-T372 PolarHBondContact NH2-O 2.89Å; R114-T372 VanDerWaalsContact NH2-O 3.16Å; R114-T372 PolarHBondContact NH2-OG1 2.85Å
115	E	81.1	Confident	82.7	Confident	21 Å²	21	59.8 Å²	59.8	10%	0.098	30%	0.301	C	S	.	.	H	α-helix	trans	-63.5	-34.5	179.7	-164.3	72.1	-151.9	0	0	111.1	K57 Y58 F63 V67 T111 I112 D118 D119	K57-E115 IonicContact NZ-OE1 3.67Å; K57-E115 PolarHBondContact NZ-OE1 3.32Å; Y58-E115 HydrophobicContact CE2-CG 3.61Å; Y58-E115 PolarHBondContact OH-OE1 3.4Å; F63-E115 HydrophobicContact CE2-CB 4.4Å; F63-E115 HydrophobicContact CE2-CG 4.35Å; V67-E115 HydrophobicContact CG2-CG 4.01Å; T111-E115 PolarHBondContact O-N 2.75Å; I112-E115 PolarHBondContact O-N 3.42Å; E115-D118 PolarHBondContact O-N 3.22Å; E115-D119 PolarHBondContact O-N 2.86Å
116	A	85.4	Confident	82.4	Confident	28 Å²	28	58.4 Å²	58.4	23%	0.231	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-46.2	173.4	0	0	0	0	0	111.8	F63 I112 C113 R114 D118 D119 L120	F63-A116 HydrophobicContact CE1-CB 4.18Å; F63-A116 HydrophobicContact CE2-CB 4.23Å; F63-A116 HydrophobicContact CZ-CB 3.57Å; I112-A116 WeakPolarHBondContact O-CB 3.25Å; I112-A116 PolarHBondContact O-N 3.48Å; C113-A116 WeakPolarHBondContact O-CB 3.5Å; C113-A116 PolarHBondContact O-N 3.39Å; R114-A116 PolarHBondContact O-N 3.49Å; A116-D118 VanDerWaalsContact C-N 3.32Å; A116-D118 PolarHBondContact O-N 2.97Å; A116-D119 PolarHBondContact O-N 2.61Å; A116-L120 WeakPolarHBondContact O-CB 3.42Å; A116-L120 VanDerWaalsContact O-CG 3.23Å; A116-L120 WeakPolarHBondContact O-CG 3.44Å; A116-L120 PolarHBondContact O-N 3.44Å
117	V	83.3	Confident	82.5	Confident	67 Å²	67	58.5 Å²	58.5	41%	0.406	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-42.9	177	169.9	0	0	0	0	110.9	C113 R114 L120 R121	C113-V117 WeakPolarHBondContact O-CG2 3.34Å; C113-V117 PolarHBondContact O-N 2.97Å; R114-V117 PolarHBondContact O-N 2.97Å; R114-V117 VanDerWaalsContact O-N 3.17Å; V117-L120 PolarHBondContact O-N 3.13Å; V117-R121 WeakPolarHBondContact O-CG 3.46Å; V117-R121 PolarHBondContact O-N 2.86Å
118	D	76.4	Confident	82.7	Confident	30 Å²	30	64.7 Å²	64.7	16%	0.16	32%	0.315	C	S	.	.	H	α-helix	trans	-66.3	-39.9	179.7	-73.6	-18.3	0	0	0	112.2	R114 E115 A116 R121 R122	R114-D118 PolarHBondContact O-N 2.69Å; E115-D118 PolarHBondContact O-N 3.22Å; A116-D118 VanDerWaalsContact C-N 3.32Å; A116-D118 PolarHBondContact O-N 2.97Å; D118-R121 IonicContact OD1-NH1 2.99Å; D118-R122 WeakPolarHBondContact O-CG 3.49Å; D118-R122 PolarHBondContact O-N 2.93Å
119	D	81.5	Confident	82.5	Confident	13 Å²	13	66.6 Å²	66.6	7%	0.07	33%	0.327	C	S	.	.	H	α-helix	trans	-74.6	-32.9	177.4	-156.7	65.8	0	0	0	112.7	K57 Y58 E115 A116 R122 H123	K57-D119 PolarHBondContact N-OD1 3.01Å; Y58-D119 HydrophobicContact CD2-CB 4.26Å; E115-D119 PolarHBondContact O-N 2.86Å; A116-D119 PolarHBondContact O-N 2.61Å; D119-R122 WeakPolarHBondContact O-CB 3.07Å; D119-R122 PolarHBondContact O-N 3.01Å; D119-H123 PolarHBondContact O-N 3.1Å
120	L	84.2	Confident	82.6	Confident	105 Å²	105	62.3 Å²	62.3	55%	0.55	31%	0.307	S	S	.	.	H	α-helix	trans	-62.8	-42.2	171.3	-76.9	172.2	0	0	0	111.9	A116 V117 R122 H123 Q124	A116-L120 WeakPolarHBondContact O-CB 3.42Å; A116-L120 VanDerWaalsContact O-CG 3.23Å; A116-L120 WeakPolarHBondContact O-CG 3.44Å; A116-L120 PolarHBondContact O-N 3.44Å; V117-L120 PolarHBondContact O-N 3.13Å; L120-R122 VanDerWaalsContact C-N 3.3Å; L120-R122 PolarHBondContact O-N 2.9Å; L120-H123 WeakPolarHBondContact O-CB 3.41Å; L120-H123 PolarHBondContact O-N 3.42Å; L120-Q124 WeakPolarHBondContact O-CG 3.33Å; L120-Q124 PolarHBondContact O-N 2.87Å
121	R	79.3	Confident	82.9	Confident	142 Å²	142	62.4 Å²	62.4	54%	0.536	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-34.9	173.9	-73.8	171.8	177.1	171.3	-2.9	112.1	V117 D118 R125	V117-R121 WeakPolarHBondContact O-CG 3.46Å; V117-R121 PolarHBondContact O-N 2.86Å; D118-R121 IonicContact OD1-NH1 2.99Å; R121-R125 WeakPolarHBondContact O-CG 3.5Å; R121-R125 PolarHBondContact O-N 3.02Å; R121-R125 PolarHBondContact O-NE 3.39Å
122	R	77.8	Confident	83.4	Confident	49 Å²	49	65.8 Å²	65.8	19%	0.185	33%	0.325	C	S	.	.	H	α-helix	trans	-64.7	-44.9	171.5	-69.2	171.6	-173.7	-138.6	-1.9	111.1	D118 D119 L120 Q124 R125 D126	D118-R122 WeakPolarHBondContact O-CG 3.49Å; D118-R122 PolarHBondContact O-N 2.93Å; D119-R122 WeakPolarHBondContact O-CB 3.07Å; D119-R122 PolarHBondContact O-N 3.01Å; L120-R122 VanDerWaalsContact C-N 3.3Å; L120-R122 PolarHBondContact O-N 2.9Å; R122-Q124 PolarHBondContact O-N 2.94Å; R122-R125 PolarHBondContact O-N 3.39Å; R122-D126 PolarHBondContact O-N 3.42Å
123	H	83.3	Confident	83.7	Confident	84 Å²	84	70.6 Å²	70.6	39%	0.389	35%	0.345	S	S	.	.	H	α-helix	trans	-59.1	-44.7	178.3	-170.9	59.3	0	0	0	113.1	Q56 D119 L120 R125 D126 H127	Q56-H123 HydrophobicContact CG-CB 4.32Å; Q56-H123 VanDerWaalsContact NE2-CB 3.29Å; Q56-H123 VanDerWaalsContact NE2-CG 3.33Å; Q56-H123 PolarHBondContact NE2-ND1 2.91Å; D119-H123 PolarHBondContact O-N 3.1Å; L120-H123 WeakPolarHBondContact O-CB 3.41Å; L120-H123 PolarHBondContact O-N 3.42Å; H123-R125 VanDerWaalsContact C-N 3.29Å; H123-R125 PolarHBondContact O-N 2.85Å; H123-D126 PolarHBondContact O-N 2.85Å; H123-H127 WeakPolarHBondContact O-CB 3.23Å; H123-H127 PolarHBondContact O-N 2.9Å
124	Q	84.6	Confident	84	Confident	135 Å²	135	67.8 Å²	67.8	63%	0.631	33%	0.325	S	S	*	.	H	α-helix	trans	-59.5	-40.9	178.3	-73	173.6	-6.4	0	0	111.9	L120 R122 H127 E128	L120-Q124 WeakPolarHBondContact O-CG 3.33Å; L120-Q124 PolarHBondContact O-N 2.87Å; R122-Q124 PolarHBondContact O-N 2.94Å; Q124-H127 PolarHBondContact O-N 2.81Å; Q124-E128 PolarHBondContact O-N 3.01Å
125	R	76.9	Confident	84.6	Confident	76 Å²	76	67.2 Å²	67.2	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-68.7	-44	176.9	-67.4	-175.1	-67	173.5	6.4	112.5	R121 R122 H123 H127 E128 V129 L842	R121-R125 WeakPolarHBondContact O-CG 3.5Å; R121-R125 PolarHBondContact O-N 3.02Å; R121-R125 PolarHBondContact O-NE 3.39Å; R122-R125 PolarHBondContact O-N 3.39Å; H123-R125 VanDerWaalsContact C-N 3.29Å; H123-R125 PolarHBondContact O-N 2.85Å; R125-H127 VanDerWaalsContact C-N 3.26Å; R125-H127 PolarHBondContact O-N 2.8Å; R125-E128 WeakPolarHBondContact O-CB 3.38Å; R125-E128 PolarHBondContact O-N 3.39Å; R125-V129 PolarHBondContact O-N 3.49Å; R125-L842 PolarHBondContact NH1-O 3.08Å
126	D	82.6	Confident	85.1	Confident	9 Å²	9	69.1 Å²	69.1	5%	0.048	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-40.3	175.7	-70.2	-13.1	0	0	0	110.3	N55 Q56 R122 H123 V129 N130	N55-D126 WeakPolarHBondContact CB-OD1 3.4Å; N55-D126 PolarHBondContact N-OD2 2.79Å; N55-D126 PolarHBondContact ND2-OD1 2.8Å; Q56-D126 PolarHBondContact N-OD2 3.26Å; R122-D126 PolarHBondContact O-N 3.42Å; H123-D126 PolarHBondContact O-N 2.85Å; D126-V129 PolarHBondContact O-N 3.27Å; D126-N130 WeakPolarHBondContact O-CB 3.05Å; D126-N130 PolarHBondContact O-N 2.89Å; D126-N130 PolarHBondContact O-ND2 2.93Å
127	H	86.6	Confident	85.2	Confident	117 Å²	117	68.3 Å²	68.3	54%	0.542	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-43.5	175.8	-178	-80.6	0	0	0	112.1	H123 Q124 R125 V129 N130 S131	H123-H127 WeakPolarHBondContact O-CB 3.23Å; H123-H127 PolarHBondContact O-N 2.9Å; Q124-H127 PolarHBondContact O-N 2.81Å; R125-H127 VanDerWaalsContact C-N 3.26Å; R125-H127 PolarHBondContact O-N 2.8Å; H127-V129 PolarHBondContact O-N 3.34Å; H127-N130 PolarHBondContact O-N 2.84Å; H127-S131 WeakPolarHBondContact O-CB 3.18Å; H127-S131 PolarHBondContact O-N 2.81Å; H127-S131 PolarHBondContact O-OG 3.08Å; H127-S131 VanDerWaalsContact O-OG 3.04Å
128	E	84.7	Confident	85.1	Confident	140 Å²	140	65.9 Å²	65.9	65%	0.654	31%	0.308	S	S	*	.	H	α-helix	trans	-56	-52.3	177.1	-172.2	178.7	-177.9	0	0	111.3	Q124 R125 S131 Q132	Q124-E128 PolarHBondContact O-N 3.01Å; R125-E128 WeakPolarHBondContact O-CB 3.38Å; R125-E128 PolarHBondContact O-N 3.39Å; E128-S131 PolarHBondContact O-N 3.47Å; E128-S131 PolarHBondContact O-OG 3.48Å; E128-Q132 PolarHBondContact O-N 3.31Å
129	V	81.5	Confident	84.7	Confident	63 Å²	63	69.1 Å²	69.1	38%	0.382	33%	0.333	S	S	.	.	H	α-helix	trans	-65	-43.9	179.4	-178.3	0	0	0	0	111.8	I53 R125 D126 H127 S131 Q132	I53-V129 HydrophobicContact CD1-CG1 3.69Å; R125-V129 PolarHBondContact O-N 3.49Å; D126-V129 PolarHBondContact O-N 3.27Å; H127-V129 PolarHBondContact O-N 3.34Å; V129-S131 PolarHBondContact O-N 2.83Å; V129-Q132 WeakPolarHBondContact O-CB 3.18Å; V129-Q132 PolarHBondContact O-N 3.03Å
130	N	89.2	Confident	84	Confident	23 Å²	23	74.4 Å²	74.4	12%	0.123	37%	0.366	C	S	.	.	H	α-helix	trans	-67.9	-24.2	-180	-71.9	-29.8	0	0	0	112.8	I53 D126 H127 S150 S151	I53-N130 PolarHBondContact N-OD1 3.24Å; I53-N130 PolarHBondContact O-ND2 2.98Å; D126-N130 WeakPolarHBondContact O-CB 3.05Å; D126-N130 PolarHBondContact O-N 2.89Å; D126-N130 PolarHBondContact O-ND2 2.93Å; H127-N130 PolarHBondContact O-N 2.84Å; N130-S150 PolarHBondContact O-N 3.46Å; N130-S151 PolarHBondContact O-N 2.96Å; N130-S151 PolarHBondContact O-OG 3.32Å
131	S	90.6	Very high	83.4	Confident	52 Å²	52	72.7 Å²	72.7	36%	0.364	36%	0.357	S	S	.	.	H	α-helix	trans	-86.1	-8.6	-179.9	73.2	0	0	0	0	114.5	H127 E128 V129 K133	H127-S131 WeakPolarHBondContact O-CB 3.18Å; H127-S131 PolarHBondContact O-N 2.81Å; H127-S131 PolarHBondContact O-OG 3.08Å; H127-S131 VanDerWaalsContact O-OG 3.04Å; E128-S131 PolarHBondContact O-N 3.47Å; E128-S131 PolarHBondContact O-OG 3.48Å; V129-S131 PolarHBondContact O-N 2.83Å; S131-K133 PolarHBondContact O-N 2.97Å
132	Q	89.4	Confident	82.6	Confident	79 Å²	79	74.8 Å²	74.8	37%	0.369	38%	0.377	S	S	.	.			trans	-58.8	132.5	177.2	-170	176	3.4	0	0	110.3	E128 V129 Y134 P149 S150	E128-Q132 PolarHBondContact O-N 3.31Å; V129-Q132 WeakPolarHBondContact O-CB 3.18Å; V129-Q132 PolarHBondContact O-N 3.03Å; Q132-Y134 HydrophobicContact CB-CE2 4.06Å; Q132-Y134 HydrophobicContact CG-CE2 3.86Å; Q132-Y134 PolarHBondContact NE2-OH 3.17Å; Q132-Y134 PolarHBondContact OE1-OH 3.35Å; Q132-Y134 VanDerWaalsContact OE1-OH 3.08Å; Q132-P149 CarbonylContact O-C 3.59Å; Q132-P149 WeakPolarHBondContact O-CA 3.48Å; Q132-S150 PolarHBondContact O-N 3.45Å
133	K	92.4	Very high	81.8	Confident	136 Å²	136	75.9 Å²	75.9	59%	0.591	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	139.6	-173.4	-61.4	178.8	-179.8	176.2	0	110.9	S131 M147 V148	S131-K133 PolarHBondContact O-N 2.97Å; K133-M147 HydrophobicContact CB-CE 3.77Å; K133-V148 WeakPolarHBondContact CA-O 3.3Å
134	Y	92.7	Very high	81.5	Confident	6 Å²	6	73.2 Å²	73.2	2%	0.024	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	151.5	179.3	-70.5	-81.9	0	0	0	111.1	Q132 R136 M147 V148 L153 E165 R166 P168	Q132-Y134 HydrophobicContact CB-CE2 4.06Å; Q132-Y134 HydrophobicContact CG-CE2 3.86Å; Q132-Y134 PolarHBondContact NE2-OH 3.17Å; Q132-Y134 PolarHBondContact OE1-OH 3.35Å; Q132-Y134 VanDerWaalsContact OE1-OH 3.08Å; Y134-R136 PolarHBondContact O-N 3.36Å; Y134-M147 WeakPolarHBondContact O-CA 3.38Å; Y134-V148 PolarHBondContact N-O 3.08Å; Y134-V148 PolarHBondContact O-N 3.26Å; Y134-L153 HydrophobicContact CD2-CD1 4.25Å; Y134-L153 HydrophobicContact CG-CD1 4.41Å; Y134-E165 WeakPolarHBondContact CD1-OE1 3.47Å; Y134-E165 HydrophobicContact CE1-CG 4.1Å; Y134-E165 WeakPolarHBondContact CE1-OE1 3.46Å; Y134-R166 WeakPolarHBondContact CE1-O 3.31Å; Y134-R166 PolarHBondContact OH-O 3.02Å; Y134-P168 HydrophobicContact CD1-CB 4.23Å; Y134-P168 HydrophobicContact CD1-CG 3.83Å; Y134-P168 HydrophobicContact CD2-CB 3.89Å; Y134-P168 HydrophobicContact CD2-CG 4.19Å; Y134-P168 HydrophobicContact CE1-CB 3.97Å; Y134-P168 HydrophobicContact CE1-CG 3.92Å; Y134-P168 HydrophobicContact CE2-CB 3.62Å; Y134-P168 HydrophobicContact CE2-CG 4.27Å; Y134-P168 HydrophobicContact CG-CB 4.19Å; Y134-P168 HydrophobicContact CG-CG 3.97Å
135	K	92.8	Very high	81.5	Confident	36 Å²	36	71.3 Å²	71.3	16%	0.157	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	110.6	176.6	-67.6	178	-167.8	-174.3	0	109.8	Y145 M147 I159 I160 E162	K135-Y145 HydrophobicContact CB-CD2 4.29Å; K135-Y145 HydrophobicContact CD-CD2 4.24Å; K135-Y145 HydrophobicContact CD-CE2 4.21Å; K135-Y145 HydrophobicContact CG-CD2 3.97Å; K135-Y145 HydrophobicContact CG-CE2 4.25Å; K135-M147 HydrophobicContact CB-SD 4.37Å; K135-M147 HydrophobicContact CG-CE 4.34Å; K135-M147 HydrophobicContact CG-SD 3.43Å; K135-M147 WeakPolarHBondContact CG-SD 3.41Å; K135-I159 CarbonylContact O-C 3.59Å; K135-I159 VanDerWaalsContact O-CA 3.27Å; K135-I159 WeakPolarHBondContact O-CA 3.45Å; K135-I160 HydrophobicContact CB-CB 4.08Å; K135-I160 PolarHBondContact O-N 2.96Å; K135-E162 IonicContact NZ-OE1 3.54Å; K135-E162 PolarHBondContact NZ-OE1 3.33Å; K135-E162 IonicContact NZ-OE2 2.61Å; K135-E162 PolarHBondContact NZ-OE2 2.91Å
136	R	91.6	Very high	82.2	Confident	61 Å²	61	71.2 Å²	71.2	23%	0.23	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128.4	171.2	-176	-179.9	66.9	167.9	-0	109.8	Y134 S138 Y145 E146 V148 D157 V158	Y134-R136 PolarHBondContact O-N 3.36Å; R136-S138 PolarHBondContact O-N 3.02Å; R136-Y145 CarbonylContact O-C 3.52Å; R136-Y145 VanDerWaalsContact O-CA 3.25Å; R136-Y145 WeakPolarHBondContact O-CA 3.21Å; R136-Y145 WeakPolarHBondContact O-CB 3.25Å; R136-E146 IonicContact CZ-OE2 3.17Å; R136-E146 PolarHBondContact N-O 3.39Å; R136-E146 IonicContact NE-OE2 2.66Å; R136-E146 IonicContact NH2-OE2 2.71Å; R136-E146 PolarHBondContact NH2-OE2 2.75Å; R136-E146 PolarHBondContact O-N 3.42Å; R136-V148 HydrophobicContact CB-CG2 4.01Å; R136-D157 HydrophobicContact CG-CB 4.33Å; R136-D157 IonicContact NH1-OD1 3.98Å; R136-D157 IonicContact NH1-OD2 3.68Å; R136-V158 CarbonylContact C-O 3.48Å; R136-V158 WeakPolarHBondContact CA-O 3.49Å
137	L	87.4	Confident	82.6	Confident	12 Å²	12	75 Å²	75	6%	0.063	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	123.2	176	-169.1	77	0	0	0	109.7	G144 V158 I160 D211 L214 H215	L137-G144 WeakPolarHBondContact CD1-O 3.36Å; L137-V158 HydrophobicContact CB-CB 4.02Å; L137-V158 HydrophobicContact CB-CG1 3.97Å; L137-V158 HydrophobicContact CD2-CB 4.31Å; L137-V158 HydrophobicContact CD2-CG1 3.9Å; L137-V158 PolarHBondContact N-O 2.92Å; L137-I160 HydrophobicContact CD1-CD1 4.21Å; L137-D211 HydrophobicContact CD1-CB 4.03Å; L137-D211 VanDerWaalsContact CD2-O 3.3Å; L137-D211 WeakPolarHBondContact CD2-O 3.43Å; L137-L214 HydrophobicContact CD2-CB 4.29Å; L137-L214 HydrophobicContact CD2-CD1 4.38Å; L137-H215 WeakPolarHBondContact CD2-NE2 3.33Å; L137-H215 PolarHBondContact O-NE2 3.37Å
138	S	81.9	Confident	82.9	Confident	16 Å²	16	69.8 Å²	69.8	11%	0.112	37%	0.372	C	S	.	.			trans	-124.2	127.2	-178.1	-179.5	0	0	0	0	110.6	R136 T140 G144	R136-S138 PolarHBondContact O-N 3.02Å; S138-T140 PolarHBondContact O-N 3.07Å; S138-T140 PolarHBondContact OG-N 2.88Å; S138-T140 PolarHBondContact OG-OG1 3.39Å; S138-T140 VanDerWaalsContact OG-OG1 3.07Å; S138-G144 PolarHBondContact N-O 3.01Å
139	S	68.6	Low	83.3	Confident	97 Å²	97	64.8 Å²	64.8	68%	0.678	35%	0.352	S	S	*	.	S	Bend	trans	-73.3	-14.7	176.6	-174.4	0	0	0	0	113.2
140	T	66.6	Low	83.8	Confident	125 Å²	125	62.1 Å²	62.1	77%	0.767	34%	0.336	S	S	*	.	S	Bend	trans	-100.8	-13.5	-172	54.8	0	0	0	0	114.2	S138	S138-T140 PolarHBondContact O-N 3.07Å; S138-T140 PolarHBondContact OG-N 2.88Å; S138-T140 PolarHBondContact OG-OG1 3.39Å; S138-T140 VanDerWaalsContact OG-OG1 3.07Å
141	N	70.1	Confident	83.9	Confident	68 Å²	68	62.4 Å²	62.4	36%	0.364	34%	0.34	S	S	.	.	S	Bend	trans	-96	141.5	-177.6	-80.5	-17.2	0	0	0	112.4	S143 G144	N141-S143 PolarHBondContact O-N 2.82Å; N141-G144 PolarHBondContact O-N 3.21Å
142	I	63.1	Low	84	Confident	187 Å²	187	66.5 Å²	66.5	96%	0.959	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-30.7	178.2	-57.9	167.8	0	0	0	111.7	G144	I142-G144 VanDerWaalsContact C-N 3.31Å; I142-G144 PolarHBondContact O-N 3.48Å
143	S	61.7	Low	84.2	Confident	72 Å²	72	62.8 Å²	62.8	50%	0.503	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-6.8	176.8	51	0	0	0	0	114.5	N141 Y145	N141-S143 PolarHBondContact O-N 2.82Å; S143-Y145 WeakPolarHBondContact O-CD1 3.44Å; S143-Y145 WeakPolarHBondContact O-CE1 3.48Å; S143-Y145 PolarHBondContact O-N 3.28Å; S143-Y145 VanDerWaalsContact O-N 3.15Å; S143-Y145 PolarHBondContact OG-O 2.86Å
144	G	77.1	Confident	84.1	Confident	27 Å²	27	63.1 Å²	63.1	28%	0.278	34%	0.335	S	S	.	.	S	Bend	trans	75.4	-13.7	-177.1	0	0	0	0	0	115.7	L137 S138 N141 I142	L137-G144 WeakPolarHBondContact CD1-O 3.36Å; S138-G144 PolarHBondContact N-O 3.01Å; N141-G144 PolarHBondContact O-N 3.21Å; I142-G144 VanDerWaalsContact C-N 3.31Å; I142-G144 PolarHBondContact O-N 3.48Å
145	Y	84.6	Confident	84.1	Confident	95 Å²	95	63.5 Å²	63.5	37%	0.373	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	159.4	176.8	63.3	-89.6	0	0	0	112.6	K135 R136 S143	K135-Y145 HydrophobicContact CB-CD2 4.29Å; K135-Y145 HydrophobicContact CD-CD2 4.24Å; K135-Y145 HydrophobicContact CD-CE2 4.21Å; K135-Y145 HydrophobicContact CG-CD2 3.97Å; K135-Y145 HydrophobicContact CG-CE2 4.25Å; R136-Y145 CarbonylContact O-C 3.52Å; R136-Y145 VanDerWaalsContact O-CA 3.25Å; R136-Y145 WeakPolarHBondContact O-CA 3.21Å; R136-Y145 WeakPolarHBondContact O-CB 3.25Å; S143-Y145 WeakPolarHBondContact O-CD1 3.44Å; S143-Y145 WeakPolarHBondContact O-CE1 3.48Å; S143-Y145 PolarHBondContact O-N 3.28Å; S143-Y145 VanDerWaalsContact O-N 3.15Å; S143-Y145 PolarHBondContact OG-O 2.86Å
146	E	90.6	Very high	83.9	Confident	74 Å²	74	62.8 Å²	62.8	35%	0.346	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.5	177	-171.5	-172.8	173.2	0	0	110	R136 V148	R136-E146 IonicContact CZ-OE2 3.17Å; R136-E146 PolarHBondContact N-O 3.39Å; R136-E146 IonicContact NE-OE2 2.66Å; R136-E146 IonicContact NH2-OE2 2.71Å; R136-E146 PolarHBondContact NH2-OE2 2.75Å; R136-E146 PolarHBondContact O-N 3.42Å; E146-V148 HydrophobicContact CB-CG2 4.27Å; E146-V148 HydrophobicContact CG-CG2 3.97Å; E146-V148 PolarHBondContact O-N 3.15Å
147	M	91.3	Very high	83.9	Confident	90 Å²	90	61.2 Å²	61.2	44%	0.443	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	113.3	173.5	-64.9	-59.7	-66.5	0	0	110.1	K133 Y134 K135	K133-M147 HydrophobicContact CB-CE 3.77Å; Y134-M147 WeakPolarHBondContact O-CA 3.38Å; K135-M147 HydrophobicContact CB-SD 4.37Å; K135-M147 HydrophobicContact CG-CE 4.34Å; K135-M147 HydrophobicContact CG-SD 3.43Å; K135-M147 WeakPolarHBondContact CG-SD 3.41Å
148	V	92.5	Very high	84.1	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.036	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.8	-175.7	-177.6	0	0	0	0	110	K133 Y134 R136 E146 K152	K133-V148 WeakPolarHBondContact CA-O 3.3Å; Y134-V148 PolarHBondContact N-O 3.08Å; Y134-V148 PolarHBondContact O-N 3.26Å; R136-V148 HydrophobicContact CB-CG2 4.01Å; E146-V148 HydrophobicContact CB-CG2 4.27Å; E146-V148 HydrophobicContact CG-CG2 3.97Å; E146-V148 PolarHBondContact O-N 3.15Å; V148-K152 HydrophobicContact CG1-CB 3.53Å
149	P	93.9	Very high	84.6	Confident	35 Å²	35	60.1 Å²	60.1	23%	0.227	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	146.3	171.9	-22.5	32.5	0	0	0	112.3	Q132 S151 K152	Q132-P149 CarbonylContact O-C 3.59Å; Q132-P149 WeakPolarHBondContact O-CA 3.48Å; P149-S151 PolarHBondContact O-N 3.16Å; P149-S151 VanDerWaalsContact O-N 3.16Å; P149-K152 HydrophobicContact CG-CD 4.43Å; P149-K152 PolarHBondContact O-N 3.22Å
150	S	91.8	Very high	85.8	Confident	8 Å²	8	56.6 Å²	56.6	6%	0.056	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-50	-42.9	-179.8	-171.3	0	0	0	0	112.7	N51 N130 Q132 K152 L153	N51-S150 WeakPolarHBondContact CB-O 3.49Å; N51-S150 PolarHBondContact ND2-O 2.73Å; N51-S150 VanDerWaalsContact ND2-O 3.11Å; N51-S150 PolarHBondContact ND2-OG 2.83Å; N130-S150 PolarHBondContact O-N 3.46Å; Q132-S150 PolarHBondContact O-N 3.45Å; S150-K152 PolarHBondContact O-N 3.43Å; S150-L153 WeakPolarHBondContact O-CB 3.38Å; S150-L153 PolarHBondContact O-N 3.19Å
151	S	92.3	Very high	87.1	Confident	28 Å²	28	50.7 Å²	50.7	20%	0.196	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-61.3	-25.1	179.4	55.7	0	0	0	0	115	N51 N130 P149	N51-S151 WeakPolarHBondContact O-CA 3.26Å; N130-S151 PolarHBondContact O-N 2.96Å; N130-S151 PolarHBondContact O-OG 3.32Å; P149-S151 PolarHBondContact O-N 3.16Å; P149-S151 VanDerWaalsContact O-N 3.16Å
152	K	92.4	Very high	88.1	Confident	138 Å²	138	51.3 Å²	51.3	60%	0.6	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-91.1	-5.8	-178.3	-68.7	-169.5	-176.8	178.6	0	113.5	V148 P149 S150	V148-K152 HydrophobicContact CG1-CB 3.53Å; P149-K152 HydrophobicContact CG-CD 4.43Å; P149-K152 PolarHBondContact O-N 3.22Å; S150-K152 PolarHBondContact O-N 3.43Å
153	L	91.9	Very high	89.3	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.243	C	C	.	.			trans	-67.4	136.6	175.9	-64.3	175	0	0	0	110.8	N51 Y134 S150 I159 P168	N51-L153 HydrophobicContact CB-CB 4.38Å; N51-L153 WeakPolarHBondContact CB-O 3.48Å; Y134-L153 HydrophobicContact CD2-CD1 4.25Å; Y134-L153 HydrophobicContact CG-CD1 4.41Å; S150-L153 WeakPolarHBondContact O-CB 3.38Å; S150-L153 PolarHBondContact O-N 3.19Å; L153-I159 HydrophobicContact CD2-CG2 3.84Å; L153-P168 HydrophobicContact CD1-CB 3.69Å; L153-P168 HydrophobicContact CD1-CG 3.57Å
154	K	92	Very high	90.5	Very high	144 Å²	144	48.4 Å²	48.4	63%	0.626	24%	0.244	S	C	*	.			trans	-125.8	156.6	-178.8	-64.3	179.2	-176.5	177.6	0	111.1	G156 D157 V269	K154-G156 PolarHBondContact O-N 3.29Å; K154-D157 PolarHBondContact N-OD2 3.36Å; K154-D157 VanDerWaalsContact O-CB 3.3Å; K154-D157 WeakPolarHBondContact O-CB 3.35Å; K154-D157 PolarHBondContact O-N 3.12Å; K154-V269 WeakPolarHBondContact O-CB 3.48Å
155	V	91.6	Very high	91	Very high	13 Å²	13	48.8 Å²	48.8	8%	0.079	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	127.1	172.1	176.5	0	0	0	0	110	V38 N44 F48 V269 T272	V38-V155 HydrophobicContact CG1-CG1 4.06Å; V38-V155 HydrophobicContact CG2-CG1 3.69Å; N44-V155 PolarHBondContact ND2-O 2.87Å; F48-V155 HydrophobicContact CB-CB 4.14Å; F48-V155 HydrophobicContact CB-CG2 3.65Å; F48-V155 HydrophobicContact CD1-CG2 4.32Å; F48-V155 HydrophobicContact CD2-CB 3.48Å; F48-V155 VanDerWaalsContact CD2-CB 3.48Å; F48-V155 HydrophobicContact CD2-CG1 3.79Å; F48-V155 HydrophobicContact CD2-CG2 3.91Å; F48-V155 HydrophobicContact CE2-CB 4Å; F48-V155 HydrophobicContact CE2-CG1 3.77Å; F48-V155 HydrophobicContact CG-CB 3.83Å; F48-V155 HydrophobicContact CG-CG1 4.23Å; F48-V155 HydrophobicContact CG-CG2 3.68Å; F48-V155 HydrophobicContact CZ-CG1 4.24Å; V155-V269 WeakPolarHBondContact CA-O 3.28Å; V155-T272 HydrophobicContact CG2-CG2 3.96Å
156	G	89.6	Confident	91.3	Very high	21 Å²	21	47.1 Å²	47.1	22%	0.216	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	97.4	-12.4	-173.3	0	0	0	0	0	114.8	K154 V269	K154-G156 PolarHBondContact O-N 3.29Å; G156-V269 PolarHBondContact N-O 3.45Å
157	D	90.6	Very high	91.4	Very high	29 Å²	29	43.6 Å²	43.6	16%	0.155	22%	0.215	C	C	.	.			trans	-66.1	138.1	171.7	-75	-28.4	0	0	0	109.9	R136 K154 V269	R136-D157 HydrophobicContact CG-CB 4.33Å; R136-D157 IonicContact NH1-OD1 3.98Å; R136-D157 IonicContact NH1-OD2 3.68Å; K154-D157 PolarHBondContact N-OD2 3.36Å; K154-D157 VanDerWaalsContact O-CB 3.3Å; K154-D157 WeakPolarHBondContact O-CB 3.35Å; K154-D157 PolarHBondContact O-N 3.12Å; D157-V269 HydrophobicContact CB-CG2 4.33Å; D157-V269 WeakPolarHBondContact O-CG2 3.47Å; D157-V269 PolarHBondContact O-N 3.36Å
158	V	92	Very high	91.4	Very high	4 Å²	4	40 Å²	40	2%	0.024	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.7	172.6	179.7	0	0	0	0	108.2	L40 R136 L137 L174 L214 T266 G267 I268	L40-V158 HydrophobicContact CD1-CG2 3.86Å; R136-V158 CarbonylContact C-O 3.48Å; R136-V158 WeakPolarHBondContact CA-O 3.49Å; L137-V158 HydrophobicContact CB-CB 4.02Å; L137-V158 HydrophobicContact CB-CG1 3.97Å; L137-V158 HydrophobicContact CD2-CB 4.31Å; L137-V158 HydrophobicContact CD2-CG1 3.9Å; L137-V158 PolarHBondContact N-O 2.92Å; V158-L174 HydrophobicContact CG1-CD1 4.3Å; V158-L174 HydrophobicContact CG2-CD1 4.3Å; V158-L214 HydrophobicContact CG1-CD1 4.41Å; V158-T266 HydrophobicContact CG1-CG2 3.68Å; V158-G267 CarbonylContact C-O 3.52Å; V158-G267 WeakPolarHBondContact CA-O 3.4Å; V158-I268 HydrophobicContact CG2-CB 4.45Å
159	I	93.4	Very high	91.5	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.6	-177.1	67.4	172.5	0	0	0	111.6	K135 L153 V161 P168 L171 T266 G267 V269	K135-I159 CarbonylContact O-C 3.59Å; K135-I159 VanDerWaalsContact O-CA 3.27Å; K135-I159 WeakPolarHBondContact O-CA 3.45Å; L153-I159 HydrophobicContact CD2-CG2 3.84Å; I159-V161 HydrophobicContact CD1-CG2 4.17Å; I159-V161 HydrophobicContact CG1-CG2 4.28Å; I159-P168 HydrophobicContact CD1-CG 3.36Å; I159-L171 HydrophobicContact CD1-CD1 3.63Å; I159-L171 HydrophobicContact CD1-CD2 3.56Å; I159-L171 HydrophobicContact CD1-CG 4.21Å; I159-L171 HydrophobicContact CG1-CD1 3.73Å; I159-L171 HydrophobicContact CG1-CD2 3.93Å; I159-L171 HydrophobicContact CG1-CG 4.49Å; I159-T266 WeakPolarHBondContact O-CA 3.48Å; I159-G267 PolarHBondContact N-O 2.74Å; I159-G267 PolarHBondContact O-N 2.87Å; I159-V269 HydrophobicContact CD1-CG2 4.28Å; I159-V269 HydrophobicContact CG1-CG2 4.44Å; I159-V269 HydrophobicContact CG2-CG2 4.2Å
160	I	93	Very high	91.6	Very high	23 Å²	23	38 Å²	38	12%	0.118	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.1	175.9	-53.8	171.5	0	0	0	106.8	K135 L137 T266	K135-I160 HydrophobicContact CB-CB 4.08Å; K135-I160 PolarHBondContact O-N 2.96Å; L137-I160 HydrophobicContact CD1-CD1 4.21Å; I160-T266 HydrophobicContact CG1-CG2 4.18Å
161	V	93.4	Very high	91.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.2	-180	-173	0	0	0	0	108.4	I159 E165 V167 L171 V260 A265	I159-V161 HydrophobicContact CD1-CG2 4.17Å; I159-V161 HydrophobicContact CG1-CG2 4.28Å; V161-E165 HydrophobicContact CG1-CB 3.87Å; V161-E165 HydrophobicContact CG1-CG 4.25Å; V161-V167 HydrophobicContact CG1-CG2 4.35Å; V161-L171 HydrophobicContact CG2-CD1 4.19Å; V161-V260 HydrophobicContact CB-CG2 4.15Å; V161-V260 HydrophobicContact CG1-CB 4.33Å; V161-V260 HydrophobicContact CG1-CG2 3.59Å; V161-A265 PolarHBondContact N-O 3.38Å; V161-A265 PolarHBondContact O-N 2.8Å
162	E	92	Very high	91.9	Very high	81 Å²	81	36.3 Å²	36.3	38%	0.379	17%	0.174	S	C	.	.			trans	-89	169.7	-177.9	-62.1	-166.6	139.7	0	0	112.8	K135 N164 E165	K135-E162 IonicContact NZ-OE1 3.54Å; K135-E162 PolarHBondContact NZ-OE1 3.33Å; K135-E162 IonicContact NZ-OE2 2.61Å; K135-E162 PolarHBondContact NZ-OE2 2.91Å; E162-N164 PolarHBondContact O-N 3.45Å; E162-E165 PolarHBondContact N-OE2 2.77Å; E162-E165 VanDerWaalsContact O-CB 3.24Å; E162-E165 WeakPolarHBondContact O-CB 3.36Å; E162-E165 PolarHBondContact O-N 3.22Å
163	K	88.3	Confident	91.9	Very high	99 Å²	99	29.8 Å²	29.8	43%	0.43	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	135.2	173.9	-173.1	-172.6	175	-173.4	0	109.9	E165 A261 G263	K163-E165 PolarHBondContact O-N 3.14Å; K163-A261 WeakPolarHBondContact CG-O 3.32Å; K163-G263 PolarHBondContact N-O 2.93Å
164	N	85.7	Confident	92	Very high	100 Å²	100	29.7 Å²	29.7	54%	0.535	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	10.3	-176.7	-61.8	-45.1	0	0	0	115.7	E162 V260	E162-N164 PolarHBondContact O-N 3.45Å; N164-V260 WeakPolarHBondContact CA-O 3.28Å; N164-V260 PolarHBondContact N-O 3.2Å
165	E	88.9	Confident	92	Very high	34 Å²	34	24.8 Å²	24.8	16%	0.159	12%	0.123	C	C	.	.	P	Polyproline II helix	trans	-89.3	145.5	174.6	-164	177.7	-172.9	0	0	111.3	Y134 V161 E162 K163 V260	Y134-E165 WeakPolarHBondContact CD1-OE1 3.47Å; Y134-E165 HydrophobicContact CE1-CG 4.1Å; Y134-E165 WeakPolarHBondContact CE1-OE1 3.46Å; V161-E165 HydrophobicContact CG1-CB 3.87Å; V161-E165 HydrophobicContact CG1-CG 4.25Å; E162-E165 PolarHBondContact N-OE2 2.77Å; E162-E165 VanDerWaalsContact O-CB 3.24Å; E162-E165 WeakPolarHBondContact O-CB 3.36Å; E162-E165 PolarHBondContact O-N 3.22Å; K163-E165 PolarHBondContact O-N 3.14Å; E165-V260 PolarHBondContact O-N 3.39Å
166	R	89.6	Confident	91.9	Very high	61 Å²	61	24.4 Å²	24.4	23%	0.23	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-81.4	141.9	176.6	-77.9	178.8	-176.1	-102.6	-4.3	110.3	Y134 P168 T258 V259 E836	Y134-R166 WeakPolarHBondContact CE1-O 3.31Å; Y134-R166 PolarHBondContact OH-O 3.02Å; R166-P168 WeakPolarHBondContact O-CD 3.31Å; R166-T258 WeakPolarHBondContact CA-O 3.33Å; R166-V259 HydrophobicContact CG-CG2 3.82Å; R166-E836 PolarHBondContact NH2-O 3.47Å
167	V	93.1	Very high	91.8	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-77.3	122.9	176.2	175.5	0	0	0	0	109.6	V161 A169 L171 L254 W255 A256 N257 T258 V260	V161-V167 HydrophobicContact CG1-CG2 4.35Å; V167-A169 WeakPolarHBondContact CG1-O 3.4Å; V167-L171 HydrophobicContact CG1-CD1 3.82Å; V167-L171 HydrophobicContact CG1-CG 3.87Å; V167-L254 HydrophobicContact CG1-CB 4.11Å; V167-L254 HydrophobicContact CG2-CB 4.1Å; V167-L254 HydrophobicContact CG2-CD1 4.42Å; V167-W255 WeakPolarHBondContact CB-O 3.39Å; V167-W255 WeakPolarHBondContact CG1-O 3.43Å; V167-A256 WeakPolarHBondContact O-CA 3.29Å; V167-N257 PolarHBondContact O-N 3.45Å; V167-T258 WeakPolarHBondContact CG2-O 3.45Å; V167-T258 PolarHBondContact N-O 3.24Å; V167-V260 HydrophobicContact CG2-CG2 4.33Å
168	P	92.1	Very high	91.4	Very high	14 Å²	14	28.9 Å²	28.9	9%	0.091	15%	0.145	C	C	.	.			trans	-81.6	-18.8	-170.7	29.1	-35.3	0	0	0	115.7	N51 Y134 L153 I159 R166	N51-P168 PolarHBondContact ND2-O 2.8Å; Y134-P168 HydrophobicContact CD1-CB 4.23Å; Y134-P168 HydrophobicContact CD1-CG 3.83Å; Y134-P168 HydrophobicContact CD2-CB 3.89Å; Y134-P168 HydrophobicContact CD2-CG 4.19Å; Y134-P168 HydrophobicContact CE1-CB 3.97Å; Y134-P168 HydrophobicContact CE1-CG 3.92Å; Y134-P168 HydrophobicContact CE2-CB 3.62Å; Y134-P168 HydrophobicContact CE2-CG 4.27Å; Y134-P168 HydrophobicContact CG-CB 4.19Å; Y134-P168 HydrophobicContact CG-CG 3.97Å; L153-P168 HydrophobicContact CD1-CB 3.69Å; L153-P168 HydrophobicContact CD1-CG 3.57Å; I159-P168 HydrophobicContact CD1-CG 3.36Å; R166-P168 WeakPolarHBondContact O-CD 3.31Å
169	A	94.1	Very high	90.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-157	167.1	-174.4	0	0	0	0	0	108.8	V167 L171 V269 Y271 T272	V167-A169 WeakPolarHBondContact CG1-O 3.4Å; A169-L171 HydrophobicContact CB-CD2 4.4Å; A169-L171 WeakPolarHBondContact O-CD2 2.99Å; A169-L171 WeakPolarHBondContact O-CG 3.09Å; A169-L171 PolarHBondContact O-N 2.98Å; A169-V269 HydrophobicContact CB-CG1 3.81Å; A169-Y271 WeakPolarHBondContact CB-O 3.39Å; A169-T272 HydrophobicContact CB-CG2 4.3Å
170	D	94.9	Very high	90.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	127.6	177	-68.5	-12.2	0	0	0	109.3	W255 A256 I270 Y271 R277	D170-W255 HydrophobicContact CB-CE3 4.09Å; D170-W255 HydrophobicContact CB-CZ3 4.42Å; D170-A256 WeakPolarHBondContact OD1-CB 3.45Å; D170-A256 PolarHBondContact OD1-N 3.33Å; D170-I270 HydrophobicContact CB-CD1 4.43Å; D170-I270 HydrophobicContact CB-CG1 4.08Å; D170-I270 WeakPolarHBondContact O-CG1 3.39Å; D170-I270 PolarHBondContact O-N 2.81Å; D170-Y271 HydrophobicContact CB-CD2 3.92Å; D170-Y271 HydrophobicContact CB-CG 4.47Å; D170-Y271 PolarHBondContact N-O 3.06Å; D170-Y271 VanDerWaalsContact N-O 3.12Å; D170-Y271 PolarHBondContact O-N 2.9Å; D170-R277 PolarHBondContact OD2-N 3.32Å; D170-R277 IonicContact OD2-NH1 3.89Å
171	L	95.3	Very high	89.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.9	-174.6	-39.1	175.6	0	0	0	112.7	I159 V161 V167 A169 T253 L254 I268 V269	I159-L171 HydrophobicContact CD1-CD1 3.63Å; I159-L171 HydrophobicContact CD1-CD2 3.56Å; I159-L171 HydrophobicContact CD1-CG 4.21Å; I159-L171 HydrophobicContact CG1-CD1 3.73Å; I159-L171 HydrophobicContact CG1-CD2 3.93Å; I159-L171 HydrophobicContact CG1-CG 4.49Å; V161-L171 HydrophobicContact CG2-CD1 4.19Å; V167-L171 HydrophobicContact CG1-CD1 3.82Å; V167-L171 HydrophobicContact CG1-CG 3.87Å; A169-L171 HydrophobicContact CB-CD2 4.4Å; A169-L171 WeakPolarHBondContact O-CD2 2.99Å; A169-L171 WeakPolarHBondContact O-CG 3.09Å; A169-L171 PolarHBondContact O-N 2.98Å; L171-T253 VanDerWaalsContact O-CA 3.26Å; L171-T253 WeakPolarHBondContact O-CA 3.4Å; L171-T253 WeakPolarHBondContact O-CB 3.45Å; L171-L254 HydrophobicContact CB-CB 4.19Å; L171-L254 HydrophobicContact CD1-CB 4.29Å; L171-L254 HydrophobicContact CD1-CD1 4.2Å; L171-L254 HydrophobicContact CG-CB 4.41Å; L171-L254 PolarHBondContact N-O 3.36Å; L171-L254 PolarHBondContact O-N 3.33Å; L171-I268 CarbonylContact C-O 3.59Å; L171-I268 WeakPolarHBondContact CA-O 3.38Å; L171-V269 HydrophobicContact CD2-CB 4.15Å; L171-V269 HydrophobicContact CD2-CG2 3.56Å
172	I	95.1	Very high	89.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.4	159.2	-64.3	174.4	0	0	0	108.7	L174 V202 F221 V223 F233 A235 L248 T253 G267 I268 I270	I172-L174 PolarHBondContact O-N 2.86Å; I172-V202 HydrophobicContact CG2-CG2 4.31Å; I172-F221 HydrophobicContact CD1-CB 4.22Å; I172-F221 HydrophobicContact CD1-CD1 3.69Å; I172-F221 HydrophobicContact CD1-CE1 4.34Å; I172-F221 HydrophobicContact CD1-CG 4.09Å; I172-F221 HydrophobicContact CG2-CD1 4.31Å; I172-F221 HydrophobicContact CG2-CE1 3.91Å; I172-V223 HydrophobicContact CD1-CG2 4.2Å; I172-F233 HydrophobicContact CD1-CE1 4.36Å; I172-F233 HydrophobicContact CD1-CZ 4Å; I172-F233 HydrophobicContact CG1-CE1 4.29Å; I172-F233 HydrophobicContact CG1-CZ 4.06Å; I172-A235 HydrophobicContact CD1-CB 4.41Å; I172-L248 HydrophobicContact CD1-CD1 4.24Å; I172-L248 HydrophobicContact CG2-CD1 3.92Å; I172-T253 HydrophobicContact CG1-CG2 4.41Å; I172-G267 CarbonylContact O-C 3.4Å; I172-G267 WeakPolarHBondContact O-CA 3.32Å; I172-I268 HydrophobicContact CB-CG2 3.89Å; I172-I268 PolarHBondContact N-O 2.99Å; I172-I268 PolarHBondContact O-N 3.18Å; I172-I270 HydrophobicContact CD1-CG2 3.67Å; I172-I270 HydrophobicContact CG1-CD1 4.06Å; I172-I270 HydrophobicContact CG1-CG2 3.77Å
173	L	94.4	Very high	89	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	115.4	-176.6	-171.8	63.9	0	0	0	110.9	T176 V183 R199 A201 V202 N252 L254 A265	L173-T176 HydrophobicContact CD1-CG2 4.05Å; L173-T176 HydrophobicContact CD2-CG2 3.78Å; L173-T176 HydrophobicContact CG-CG2 4.13Å; L173-V183 HydrophobicContact CD1-CG1 4.41Å; L173-V183 HydrophobicContact CD2-CG1 3.55Å; L173-R199 HydrophobicContact CD2-CB 3.99Å; L173-A201 HydrophobicContact CD2-CB 4.32Å; L173-A201 HydrophobicContact CG-CB 4.1Å; L173-V202 PolarHBondContact O-N 2.88Å; L173-V202 VanDerWaalsContact O-N 3.08Å; L173-N252 PolarHBondContact N-O 2.87Å; L173-L254 HydrophobicContact CD1-CD1 3.99Å; L173-A265 HydrophobicContact CD1-CB 3.63Å
174	L	92.3	Very high	89	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-40.9	-179.2	-59.7	179.5	0	0	0	111.8	L40 V158 I172 T205 L214 F221 T266 I268	L40-L174 HydrophobicContact CD1-CD1 3.86Å; V158-L174 HydrophobicContact CG1-CD1 4.3Å; V158-L174 HydrophobicContact CG2-CD1 4.3Å; I172-L174 PolarHBondContact O-N 2.86Å; L174-T205 VanDerWaalsContact O-CB 3.3Å; L174-T205 WeakPolarHBondContact O-CB 3.4Å; L174-T205 PolarHBondContact O-OG1 3.12Å; L174-L214 HydrophobicContact CB-CD1 4.42Å; L174-L214 HydrophobicContact CB-CD2 4.2Å; L174-L214 HydrophobicContact CD1-CD1 4.29Å; L174-L214 HydrophobicContact CD1-CD2 4.27Å; L174-F221 HydrophobicContact CD2-CE1 4.29Å; L174-F221 HydrophobicContact CD2-CE2 4.16Å; L174-F221 HydrophobicContact CD2-CZ 3.47Å; L174-F221 VanDerWaalsContact CD2-CZ 3.47Å; L174-T266 WeakPolarHBondContact CA-O 3.49Å; L174-T266 WeakPolarHBondContact CB-O 3.4Å; L174-T266 PolarHBondContact N-O 3.04Å; L174-I268 HydrophobicContact CD1-CB 4.02Å; L174-I268 HydrophobicContact CD1-CG2 4.28Å; L174-I268 HydrophobicContact CD2-CG2 4.07Å; L174-I268 HydrophobicContact CG-CB 4.45Å; L174-I268 HydrophobicContact CG-CG2 4.24Å
175	R	91.8	Very high	89.1	Confident	41 Å²	41	34.4 Å²	34.4	16%	0.155	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	153.3	-174.8	-174.8	176	157.7	99.5	-6.8	111.3	Q206 L208 S209 D211 T266	R175-Q206 VanDerWaalsContact CA-OE1 3.26Å; R175-L208 PolarHBondContact NH1-O 2.98Å; R175-S209 PolarHBondContact NH2-O 3.1Å; R175-D211 WeakPolarHBondContact CD-OD1 3.18Å; R175-D211 IonicContact CZ-OD1 3.69Å; R175-D211 IonicContact NE-OD1 3.07Å; R175-D211 PolarHBondContact NE-OD1 2.96Å; R175-D211 IonicContact NH2-OD1 3.58Å; R175-T266 PolarHBondContact N-O 3.12Å; R175-T266 PolarHBondContact O-N 3.32Å
176	T	91.3	Very high	88.9	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.031	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	162.4	175.2	62.2	0	0	0	0	111.2	L173 D178 G181 V183 A201 Q206 T264	L173-T176 HydrophobicContact CD1-CG2 4.05Å; L173-T176 HydrophobicContact CD2-CG2 3.78Å; L173-T176 HydrophobicContact CG-CG2 4.13Å; T176-D178 PolarHBondContact O-N 2.87Å; T176-D178 PolarHBondContact OG1-O 3.16Å; T176-G181 WeakPolarHBondContact OG1-CA 3.41Å; T176-V183 HydrophobicContact CG2-CB 3.76Å; T176-V183 HydrophobicContact CG2-CG1 3.99Å; T176-A201 HydrophobicContact CG2-CB 4.25Å; T176-Q206 PolarHBondContact O-NE2 3.08Å; T176-Q206 PolarHBondContact OG1-OE1 2.61Å; T176-T264 VanDerWaalsContact CA-O 3.28Å; T176-T264 WeakPolarHBondContact CA-O 3.47Å
177	S	86.4	Confident	88.4	Confident	75 Å²	75	34 Å²	34	52%	0.524	17%	0.167	S	C	.	.	S	Bend	trans	-62	-28	172.6	52.2	0	0	0	0	113.6	G263 T264	S177-G263 VanDerWaalsContact OG-CA 3.28Å; S177-G263 WeakPolarHBondContact OG-CA 3.44Å; S177-T264 WeakPolarHBondContact CB-OG1 3.46Å; S177-T264 PolarHBondContact N-O 2.72Å; S177-T264 VanDerWaalsContact N-O 3.12Å; S177-T264 PolarHBondContact OG-N 3.22Å
178	D	82.7	Confident	87.4	Confident	69 Å²	69	34.7 Å²	34.7	37%	0.369	17%	0.171	S	C	.	.	S	Bend	trans	-81.6	136.4	-179.3	-175.7	14.8	0	0	0	111.2	T176 S180 G181 S182 Q206	T176-D178 PolarHBondContact O-N 2.87Å; T176-D178 PolarHBondContact OG1-O 3.16Å; D178-S180 PolarHBondContact O-N 2.88Å; D178-S180 PolarHBondContact OD1-N 2.98Å; D178-S180 WeakPolarHBondContact OD2-CB 3.45Å; D178-S180 PolarHBondContact OD2-OG 2.8Å; D178-G181 PolarHBondContact O-N 3.35Å; D178-S182 PolarHBondContact OD2-OG 3.48Å; D178-Q206 PolarHBondContact O-NE2 2.91Å
179	R	78.9	Confident	86.4	Confident	241 Å²	241	34.3 Å²	34.3	91%	0.909	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.1	179	-68.2	-173	179.6	-175.6	1.2	112.6	G181	R179-G181 PolarHBondContact O-N 2.87Å
180	S	78.3	Confident	85.5	Confident	77 Å²	77	35 Å²	35	54%	0.538	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.6	175.8	81.1	0	0	0	0	113.3	D178 S182	D178-S180 PolarHBondContact O-N 2.88Å; D178-S180 PolarHBondContact OD1-N 2.98Å; D178-S180 WeakPolarHBondContact OD2-CB 3.45Å; D178-S180 PolarHBondContact OD2-OG 2.8Å; S180-S182 VanDerWaalsContact C-N 3.35Å; S180-S182 WeakPolarHBondContact OG-CB 2.99Å; S180-S182 PolarHBondContact OG-N 3.25Å; S180-S182 PolarHBondContact OG-OG 3.35Å; S180-S182 VanDerWaalsContact OG-OG 3.12Å
181	G	83	Confident	84.4	Confident	3 Å²	3	35.9 Å²	35.9	3%	0.031	18%	0.176	C	C	.	.			trans	83.5	8.4	-172.9	0	0	0	0	0	114.1	T176 D178 R179 L200 A201	T176-G181 WeakPolarHBondContact OG1-CA 3.41Å; D178-G181 PolarHBondContact O-N 3.35Å; R179-G181 PolarHBondContact O-N 2.87Å; G181-L200 WeakPolarHBondContact O-CA 3.46Å; G181-A201 PolarHBondContact O-N 3.4Å
182	S	85.4	Confident	82.9	Confident	27 Å²	27	36.1 Å²	36.1	19%	0.189	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	142.1	-176.4	83.3	0	0	0	0	113.3	D178 S180 R199	D178-S182 PolarHBondContact OD2-OG 3.48Å; S180-S182 VanDerWaalsContact C-N 3.35Å; S180-S182 WeakPolarHBondContact OG-CB 2.99Å; S180-S182 PolarHBondContact OG-N 3.25Å; S180-S182 PolarHBondContact OG-OG 3.35Å; S180-S182 VanDerWaalsContact OG-OG 3.12Å; S182-R199 CarbonylContact C-O 3.59Å; S182-R199 WeakPolarHBondContact CA-O 3.48Å
183	V	88.6	Confident	81.7	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145.6	170.5	70.1	0	0	0	0	109.3	L173 T176 P198 R199 V260 A262 A265	L173-V183 HydrophobicContact CD1-CG1 4.41Å; L173-V183 HydrophobicContact CD2-CG1 3.55Å; T176-V183 HydrophobicContact CG2-CB 3.76Å; T176-V183 HydrophobicContact CG2-CG1 3.99Å; V183-P198 CarbonylContact O-C 3.58Å; V183-R199 HydrophobicContact CG1-CB 3.76Å; V183-R199 PolarHBondContact N-O 3.1Å; V183-R199 PolarHBondContact O-N 3.07Å; V183-V260 HydrophobicContact CG2-CG1 3.78Å; V183-A262 WeakPolarHBondContact CG2-O 3.4Å; V183-A265 HydrophobicContact CG2-CB 4.33Å
184	F	86.8	Confident	80.3	Confident	73 Å²	73	40.7 Å²	40.7	32%	0.32	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.3	177.1	-67.4	-82.4	0	0	0	110.5	W196 P198 A261 A262	F184-W196 HydrophobicContact CB-CB 4.44Å; F184-W196 HydrophobicContact CB-CE3 4.14Å; F184-W196 HydrophobicContact CD1-CB 4.32Å; F184-W196 HydrophobicContact CG-CE3 4.46Å; F184-P198 HydrophobicContact CD1-CB 4.29Å; F184-P198 HydrophobicContact CE1-CB 4.01Å; F184-A261 HydrophobicContact CB-CB 4.25Å; F184-A261 WeakPolarHBondContact O-CB 3.42Å; F184-A261 PolarHBondContact O-N 3.02Å; F184-A262 HydrophobicContact CB-CB 4.39Å; F184-A262 HydrophobicContact CD2-CB 4.31Å
185	V	88.8	Confident	79.3	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	146.9	176.6	-62.3	0	0	0	0	111.8	T187 K197 R199 L254 V259 V260	V185-T187 HydrophobicContact CG2-CG2 4.24Å; V185-K197 HydrophobicContact CG2-CB 4.18Å; V185-K197 PolarHBondContact N-O 3.42Å; V185-K197 PolarHBondContact O-N 2.88Å; V185-R199 HydrophobicContact CG1-CG 4.21Å; V185-R199 HydrophobicContact CG2-CG 3.7Å; V185-L254 HydrophobicContact CB-CD2 4.44Å; V185-L254 HydrophobicContact CG1-CD2 3.29Å; V185-V259 CarbonylContact C-O 3.53Å; V185-V259 WeakPolarHBondContact CA-O 3.39Å; V185-V260 HydrophobicContact CG1-CG2 4.42Å
186	R	83.4	Confident	78.7	Confident	83 Å²	83	44.5 Å²	44.5	31%	0.313	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129	169.5	-64.2	-176	-68.5	176.2	-5.6	109.6	D188 T258 V259 A261	R186-D188 WeakPolarHBondContact CB-OD1 3.34Å; R186-T258 WeakPolarHBondContact O-CB 3.48Å; R186-V259 HydrophobicContact CB-CB 4.4Å; R186-V259 PolarHBondContact N-O 3.24Å; R186-V259 VanDerWaalsContact NH2-CG1 3.31Å; R186-V259 PolarHBondContact O-N 3.42Å; R186-V259 VanDerWaalsContact O-N 3.17Å; R186-A261 HydrophobicContact CG-CB 4.03Å
187	T	80.6	Confident	78.3	Confident	3 Å²	3	46 Å²	46	2%	0.018	23%	0.226	C	C	.	.			trans	-116.1	10.1	179	62	0	0	0	0	113.2	V185 Q189 L190 D191 K197 T258	V185-T187 HydrophobicContact CG2-CG2 4.24Å; T187-Q189 PolarHBondContact O-N 3.2Å; T187-L190 WeakPolarHBondContact O-CA 3.5Å; T187-L190 PolarHBondContact O-N 3.47Å; T187-D191 PolarHBondContact O-N 3.3Å; T187-D191 PolarHBondContact OG1-OD1 2.74Å; T187-D191 PolarHBondContact OG1-OD2 2.71Å; T187-D191 VanDerWaalsContact OG1-OD2 3.08Å; T187-K197 HydrophobicContact CG2-CD 3.93Å; T187-K197 HydrophobicContact CG2-CG 4.49Å; T187-K197 WeakPolarHBondContact OG1-CE 3.05Å; T187-K197 PolarHBondContact OG1-NZ 2.83Å; T187-T258 HydrophobicContact CG2-CG2 3.99Å
188	D	71.2	Confident	78.2	Confident	14 Å²	14	46 Å²	46	8%	0.075	23%	0.225	C	C	.	.	H	α-helix	trans	-43.1	-42.5	176.2	60	-48.3	0	0	0	112.8	R186 L190 G192 E193 E836	R186-D188 WeakPolarHBondContact CB-OD1 3.34Å; D188-L190 VanDerWaalsContact C-N 3.32Å; D188-L190 PolarHBondContact O-N 3.16Å; D188-G192 WeakPolarHBondContact O-CA 3.41Å; D188-G192 PolarHBondContact O-N 2.99Å; D188-E193 VanDerWaalsContact CA-O 3.29Å; D188-E193 WeakPolarHBondContact CA-O 3.44Å; D188-E193 PolarHBondContact N-O 3.45Å; D188-E836 WeakPolarHBondContact OD2-CG 3.41Å
189	Q	72.3	Confident	78.5	Confident	6 Å²	6	43.6 Å²	43.6	3%	0.028	21%	0.21	C	C	.	.	H	α-helix	trans	-71.9	-19.5	179.3	-62.7	-50.3	-63.9	0	0	115.4	T187 G817 N818 E836	T187-Q189 PolarHBondContact O-N 3.2Å; Q189-G817 CarbonylContact O-C 3.51Å; Q189-N818 PolarHBondContact O-N 2.97Å; Q189-E836 VanDerWaalsContact CD-O 3.23Å; Q189-E836 PolarHBondContact NE2-O 3.34Å
190	L	74.9	Confident	79.1	Confident	14 Å²	14	35.4 Å²	35.4	7%	0.073	18%	0.184	C	C	.	.	H	α-helix	trans	-101.9	-47.6	-173.2	-141.2	89.6	0	0	0	111.7	T187 D188 I230 W255	T187-L190 WeakPolarHBondContact O-CA 3.5Å; T187-L190 PolarHBondContact O-N 3.47Å; D188-L190 VanDerWaalsContact C-N 3.32Å; D188-L190 PolarHBondContact O-N 3.16Å; L190-I230 HydrophobicContact CD2-CB 3.92Å; L190-I230 HydrophobicContact CD2-CD1 4.2Å; L190-I230 HydrophobicContact CD2-CG2 3.48Å; L190-I230 VanDerWaalsContact CD2-CG2 3.48Å; L190-I230 HydrophobicContact CG-CG2 4.33Å; L190-W255 HydrophobicContact CD2-CB 4.15Å; L190-W255 HydrophobicContact CD2-CG 4.3Å
191	D	70.5	Confident	79.7	Confident	20 Å²	20	32 Å²	32	11%	0.107	16%	0.161	C	C	.	.	H	α-helix	trans	-116.6	-10.4	-177.1	51.9	27.9	0	0	0	114.4	T187 E193 K197 I230	T187-D191 PolarHBondContact O-N 3.3Å; T187-D191 PolarHBondContact OG1-OD1 2.74Å; T187-D191 PolarHBondContact OG1-OD2 2.71Å; T187-D191 VanDerWaalsContact OG1-OD2 3.08Å; D191-E193 VanDerWaalsContact C-N 3.26Å; D191-E193 WeakPolarHBondContact OD1-CB 3.45Å; D191-E193 PolarHBondContact OD1-N 2.99Å; D191-K197 IonicContact OD2-NZ 2.89Å; D191-K197 PolarHBondContact OD2-NZ 2.86Å; D191-I230 HydrophobicContact CB-CD1 3.77Å
192	G	64.2	Low	80.1	Confident	4 Å²	4	32 Å²	32	4%	0.041	16%	0.16	C	C	.	.			trans	78	6.5	-176.3	0	0	0	0	0	114.2	D188 N818	D188-G192 WeakPolarHBondContact O-CA 3.41Å; D188-G192 PolarHBondContact O-N 2.99Å; G192-N818 WeakPolarHBondContact CA-ND2 3.39Å
193	E	70.2	Confident	80.1	Confident	67 Å²	67	34.5 Å²	34.5	31%	0.313	18%	0.176	S	C	.	.			trans	-81.4	132.4	175.6	-63.8	-173	167.4	0	0	110.4	D188 D191 K197	D188-E193 VanDerWaalsContact CA-O 3.29Å; D188-E193 WeakPolarHBondContact CA-O 3.44Å; D188-E193 PolarHBondContact N-O 3.45Å; D191-E193 VanDerWaalsContact C-N 3.26Å; D191-E193 WeakPolarHBondContact OD1-CB 3.45Å; D191-E193 PolarHBondContact OD1-N 2.99Å; E193-K197 WeakPolarHBondContact OE2-CE 3.25Å; E193-K197 IonicContact OE2-NZ 2.96Å; E193-K197 PolarHBondContact OE2-NZ 3.21Å
194	T	65.6	Low	80	Confident	29 Å²	29	39.3 Å²	39.3	18%	0.178	19%	0.194	C	C	.	.			trans	-85.8	-15.3	-179.6	56.8	0	0	0	0	113.1	T389 N395	T194-T389 HydrophobicContact CG2-CG2 3.75Å; T194-N395 WeakPolarHBondContact CG2-ND2 3.26Å; T194-N395 WeakPolarHBondContact CG2-OD1 3.31Å
195	D	71.3	Confident	79.9	Confident	56 Å²	56	35.8 Å²	35.8	30%	0.299	18%	0.179	S	C	.	.	S	Bend	trans	-71.6	138.3	-177.3	-65.7	-24.4	0	0	0	110.4	A523	D195-A523 WeakPolarHBondContact CA-O 3.43Å
196	W	79.2	Confident	79.9	Confident	65 Å²	65	37 Å²	37	25%	0.246	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-76.1	130.6	176.8	-66.3	7.1	0	0	0	109.8	F184 A261 Q521 A523	F184-W196 HydrophobicContact CB-CB 4.44Å; F184-W196 HydrophobicContact CB-CE3 4.14Å; F184-W196 HydrophobicContact CD1-CB 4.32Å; F184-W196 HydrophobicContact CG-CE3 4.46Å; W196-A261 HydrophobicContact CD2-CB 4Å; W196-A261 HydrophobicContact CE3-CB 4.08Å; W196-A261 HydrophobicContact CH2-CB 4.43Å; W196-A261 HydrophobicContact CZ2-CB 4.37Å; W196-A261 HydrophobicContact CZ3-CB 4.3Å; W196-Q521 HydrophobicContact CH2-CB 4.48Å; W196-Q521 HydrophobicContact CH2-CG 4.06Å; W196-Q521 HydrophobicContact CZ3-CB 4.33Å; W196-Q521 HydrophobicContact CZ3-CG 4.25Å; W196-A523 PolarHBondContact N-O 3.41Å
197	K	81.3	Confident	80	Confident	36 Å²	36	41.4 Å²	41.4	16%	0.157	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.4	-177.8	-61	-170.7	-178.2	-176.3	0	110.3	V185 T187 D191 E193	V185-K197 HydrophobicContact CG2-CB 4.18Å; V185-K197 PolarHBondContact N-O 3.42Å; V185-K197 PolarHBondContact O-N 2.88Å; T187-K197 HydrophobicContact CG2-CD 3.93Å; T187-K197 HydrophobicContact CG2-CG 4.49Å; T187-K197 WeakPolarHBondContact OG1-CE 3.05Å; T187-K197 PolarHBondContact OG1-NZ 2.83Å; D191-K197 IonicContact OD2-NZ 2.89Å; D191-K197 PolarHBondContact OD2-NZ 2.86Å; E193-K197 WeakPolarHBondContact OE2-CE 3.25Å; E193-K197 IonicContact OE2-NZ 2.96Å; E193-K197 PolarHBondContact OE2-NZ 3.21Å
198	P	84.8	Confident	80.1	Confident	76 Å²	76	43 Å²	43	49%	0.494	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	139.4	172.6	30.2	-33.1	0	0	0	110	V183 F184	V183-P198 CarbonylContact O-C 3.58Å; F184-P198 HydrophobicContact CD1-CB 4.29Å; F184-P198 HydrophobicContact CE1-CB 4.01Å
199	R	89.7	Confident	80.4	Confident	19 Å²	19	46.1 Å²	46.1	7%	0.072	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	145.6	171.8	-58.7	-62.1	-170	-176.3	15.6	109.2	L173 S182 V183 V185 V250 E251 T253 L254	L173-R199 HydrophobicContact CD2-CB 3.99Å; S182-R199 CarbonylContact C-O 3.59Å; S182-R199 WeakPolarHBondContact CA-O 3.48Å; V183-R199 HydrophobicContact CG1-CB 3.76Å; V183-R199 PolarHBondContact N-O 3.1Å; V183-R199 PolarHBondContact O-N 3.07Å; V185-R199 HydrophobicContact CG1-CG 4.21Å; V185-R199 HydrophobicContact CG2-CG 3.7Å; R199-V250 VanDerWaalsContact CZ-O 3.3Å; R199-V250 VanDerWaalsContact NH1-CG1 3.33Å; R199-V250 PolarHBondContact NH1-O 3.37Å; R199-E251 CarbonylContact C-O 3.56Å; R199-E251 WeakPolarHBondContact CA-O 3.44Å; R199-E251 WeakPolarHBondContact CB-O 2.84Å; R199-E251 WeakPolarHBondContact CD-O 3.25Å; R199-T253 VanDerWaalsContact CD-O 3.3Å; R199-T253 WeakPolarHBondContact CD-O 3.44Å; R199-T253 PolarHBondContact NE-O 2.73Å; R199-L254 HydrophobicContact CG-CD2 4.06Å
200	L	90.6	Very high	80.7	Confident	69 Å²	69	54 Å²	54	36%	0.361	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	127.5	-174.4	-67.5	171.7	0	0	0	110.5	G181 E251 N252	G181-L200 WeakPolarHBondContact O-CA 3.46Å; L200-E251 PolarHBondContact N-O 2.97Å; L200-N252 WeakPolarHBondContact O-CA 3.21Å; L200-N252 PolarHBondContact O-ND2 2.89Å
201	A	92.4	Very high	81	Confident	6 Å²	6	55.2 Å²	55.2	5%	0.05	27%	0.273	C	S	.	.			trans	-64.8	156.7	173	0	0	0	0	0	111.6	L173 T176 G181 P203 Q206	L173-A201 HydrophobicContact CD2-CB 4.32Å; L173-A201 HydrophobicContact CG-CB 4.1Å; T176-A201 HydrophobicContact CG2-CB 4.25Å; G181-A201 PolarHBondContact O-N 3.4Å; A201-P203 WeakPolarHBondContact O-CD 3.48Å; A201-Q206 HydrophobicContact CB-CB 4.29Å
202	V	90.5	Very high	81.2	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.006	29%	0.291	C	S	.	.			trans	-58.9	123.7	171.6	176.9	0	0	0	0	109.3	I172 L173 Y204 T205 Q206 F237 L248	I172-V202 HydrophobicContact CG2-CG2 4.31Å; L173-V202 PolarHBondContact O-N 2.88Å; L173-V202 VanDerWaalsContact O-N 3.08Å; V202-Y204 PolarHBondContact O-N 2.83Å; V202-Y204 VanDerWaalsContact O-N 3.11Å; V202-T205 WeakPolarHBondContact CB-OG1 3.2Å; V202-T205 PolarHBondContact O-N 2.61Å; V202-T205 PolarHBondContact O-OG1 2.91Å; V202-Q206 PolarHBondContact O-N 3.2Å; V202-Q206 VanDerWaalsContact O-N 3.07Å; V202-F237 HydrophobicContact CG1-CD1 4.17Å; V202-F237 HydrophobicContact CG1-CE1 4.29Å; V202-F237 HydrophobicContact CG1-CG 4.42Å; V202-L248 HydrophobicContact CG2-CD1 4.25Å; V202-L248 HydrophobicContact CG2-CD2 3.74Å
203	P	86	Confident	81.9	Confident	81 Å²	81	60.3 Å²	60.3	53%	0.526	30%	0.303	S	S	.	.	H	α-helix	trans	-59.2	-30.7	-171	-28.5	35	0	0	0	114.7	A201 K207	A201-P203 WeakPolarHBondContact O-CD 3.48Å; P203-K207 WeakPolarHBondContact O-CG 3.11Å
204	Y	84.8	Confident	82.4	Confident	102 Å²	102	57.1 Å²	57.1	40%	0.4	29%	0.288	S	S	.	.	H	α-helix	trans	-69.8	-49.8	179.1	-174.1	-89	0	0	0	111.6	V202 Q206 K207 I217 M239	V202-Y204 PolarHBondContact O-N 2.83Å; V202-Y204 VanDerWaalsContact O-N 3.11Å; Y204-Q206 VanDerWaalsContact C-N 3.33Å; Y204-Q206 PolarHBondContact O-N 3.4Å; Y204-K207 PolarHBondContact O-N 3.06Å; Y204-I217 HydrophobicContact CE1-CD1 4.27Å; Y204-M239 HydrophobicContact CD1-CE 4.2Å; Y204-M239 HydrophobicContact CD1-SD 4.32Å; Y204-M239 HydrophobicContact CE1-CE 3.47Å; Y204-M239 VanDerWaalsContact CE1-CE 3.47Å; Y204-M239 HydrophobicContact CE1-SD 4.15Å; Y204-M239 HydrophobicContact CE2-CE 4.3Å
205	T	85.9	Confident	82.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-72.8	-25.6	-177.8	48.2	0	0	0	0	112.7	L174 V202 K207 L208 L214 I217	L174-T205 VanDerWaalsContact O-CB 3.3Å; L174-T205 WeakPolarHBondContact O-CB 3.4Å; L174-T205 PolarHBondContact O-OG1 3.12Å; V202-T205 WeakPolarHBondContact CB-OG1 3.2Å; V202-T205 PolarHBondContact O-N 2.61Å; V202-T205 PolarHBondContact O-OG1 2.91Å; T205-K207 VanDerWaalsContact C-N 3.26Å; T205-K207 PolarHBondContact O-N 3.39Å; T205-L208 WeakPolarHBondContact O-CB 3.39Å; T205-L208 WeakPolarHBondContact O-CD1 3.36Å; T205-L208 VanDerWaalsContact O-CG 3.3Å; T205-L208 WeakPolarHBondContact O-CG 3.27Å; T205-L208 PolarHBondContact O-N 3.47Å; T205-L214 HydrophobicContact CG2-CD2 3.93Å; T205-I217 HydrophobicContact CG2-CD1 4.32Å
206	Q	88.1	Confident	83.2	Confident	26 Å²	26	60.4 Å²	60.4	12%	0.121	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-28.9	173.9	-172.5	60.6	32.3	0	0	112.8	R175 T176 D178 A201 V202 Y204 L208	R175-Q206 VanDerWaalsContact CA-OE1 3.26Å; T176-Q206 PolarHBondContact O-NE2 3.08Å; T176-Q206 PolarHBondContact OG1-OE1 2.61Å; D178-Q206 PolarHBondContact O-NE2 2.91Å; A201-Q206 HydrophobicContact CB-CB 4.29Å; V202-Q206 PolarHBondContact O-N 3.2Å; V202-Q206 VanDerWaalsContact O-N 3.07Å; Y204-Q206 VanDerWaalsContact C-N 3.33Å; Y204-Q206 PolarHBondContact O-N 3.4Å; Q206-L208 PolarHBondContact O-N 3.23Å
207	K	85	Confident	83.2	Confident	176 Å²	176	58.1 Å²	58.1	77%	0.765	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-13	179.3	-69.4	172.6	-175.7	178.2	0	114	P203 Y204 T205	P203-K207 WeakPolarHBondContact O-CG 3.11Å; Y204-K207 PolarHBondContact O-N 3.06Å; T205-K207 VanDerWaalsContact C-N 3.26Å; T205-K207 PolarHBondContact O-N 3.39Å
208	L	82.7	Confident	83.3	Confident	37 Å²	37	58.9 Å²	58.9	19%	0.194	31%	0.308	C	S	.	.	S	Bend	trans	-62.4	162.2	179	-62.6	171.3	0	0	0	111.2	R175 T205 Q206 E213 L214 I217	R175-L208 PolarHBondContact NH1-O 2.98Å; T205-L208 WeakPolarHBondContact O-CB 3.39Å; T205-L208 WeakPolarHBondContact O-CD1 3.36Å; T205-L208 VanDerWaalsContact O-CG 3.3Å; T205-L208 WeakPolarHBondContact O-CG 3.27Å; T205-L208 PolarHBondContact O-N 3.47Å; Q206-L208 PolarHBondContact O-N 3.23Å; L208-E213 HydrophobicContact CD1-CB 4.4Å; L208-E213 HydrophobicContact CD2-CB 4.33Å; L208-L214 HydrophobicContact CD1-CD2 3.64Å; L208-L214 HydrophobicContact CD1-CG 4.17Å; L208-I217 HydrophobicContact CD1-CD1 3.46Å; L208-I217 VanDerWaalsContact CD1-CD1 3.46Å; L208-I217 HydrophobicContact CD2-CD1 4.1Å; L208-I217 HydrophobicContact CG-CD1 4.29Å
209	S	77.4	Confident	83.3	Confident	78 Å²	78	55.4 Å²	55.4	55%	0.545	29%	0.286	S	S	.	.	S	Bend	trans	-91.3	-34.2	-179.8	81.7	0	0	0	0	111.8	R175 E213	R175-S209 PolarHBondContact NH2-O 3.1Å; S209-E213 PolarHBondContact N-OE2 2.93Å; S209-E213 PolarHBondContact OG-OE1 2.96Å
210	R	80.3	Confident	83.3	Confident	173 Å²	173	55.9 Å²	55.9	65%	0.653	29%	0.293	S	S	*	.			trans	-139.7	148.6	-176.8	-66.9	178.5	179.8	164.2	0.9	112.1	S212 E213	R210-S212 PolarHBondContact O-N 3.4Å; R210-E213 WeakPolarHBondContact O-CB 3.38Å; R210-E213 PolarHBondContact O-N 3.49Å; R210-E213 VanDerWaalsContact O-N 3.07Å
211	D	80	Confident	83.3	Confident	38 Å²	38	52.6 Å²	52.6	20%	0.203	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-60.4	-29.9	177.1	-66.5	30.9	0	0	0	112.3	L137 R175 E213 L214 T266	L137-D211 HydrophobicContact CD1-CB 4.03Å; L137-D211 VanDerWaalsContact CD2-O 3.3Å; L137-D211 WeakPolarHBondContact CD2-O 3.43Å; R175-D211 WeakPolarHBondContact CD-OD1 3.18Å; R175-D211 IonicContact CZ-OD1 3.69Å; R175-D211 IonicContact NE-OD1 3.07Å; R175-D211 PolarHBondContact NE-OD1 2.96Å; R175-D211 IonicContact NH2-OD1 3.58Å; D211-E213 PolarHBondContact O-N 3.17Å; D211-L214 HydrophobicContact CB-CD1 4.46Å; D211-L214 VanDerWaalsContact O-CB 3.24Å; D211-L214 WeakPolarHBondContact O-CB 3.41Å; D211-L214 WeakPolarHBondContact O-CG 3.31Å; D211-L214 PolarHBondContact O-N 3.43Å; D211-L214 VanDerWaalsContact O-N 3.08Å; D211-T266 PolarHBondContact OD2-OG1 3.38Å
212	S	75.9	Confident	83.3	Confident	71 Å²	71	58.1 Å²	58.1	50%	0.497	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-60.3	-25.9	176.1	53.6	0	0	0	0	113.9	R210 L214	R210-S212 PolarHBondContact O-N 3.4Å; S212-L214 PolarHBondContact O-N 2.85Å
213	E	77.6	Confident	83.4	Confident	61 Å²	61	58 Å²	58	29%	0.285	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-72	-17.2	178.4	-64.3	169.7	-176.7	0	0	112	L208 S209 R210 D211 H215 S216	L208-E213 HydrophobicContact CD1-CB 4.4Å; L208-E213 HydrophobicContact CD2-CB 4.33Å; S209-E213 PolarHBondContact N-OE2 2.93Å; S209-E213 PolarHBondContact OG-OE1 2.96Å; R210-E213 WeakPolarHBondContact O-CB 3.38Å; R210-E213 PolarHBondContact O-N 3.49Å; R210-E213 VanDerWaalsContact O-N 3.07Å; D211-E213 PolarHBondContact O-N 3.17Å; E213-H215 PolarHBondContact O-N 3.4Å; E213-S216 PolarHBondContact O-N 2.91Å; E213-S216 PolarHBondContact O-OG 3.32Å
214	L	81.7	Confident	83.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-61	-29.5	177.6	-69.2	168.1	0	0	0	112.8	L137 V158 L174 T205 L208 D211 S212 S216 T266	L137-L214 HydrophobicContact CD2-CB 4.29Å; L137-L214 HydrophobicContact CD2-CD1 4.38Å; V158-L214 HydrophobicContact CG1-CD1 4.41Å; L174-L214 HydrophobicContact CB-CD1 4.42Å; L174-L214 HydrophobicContact CB-CD2 4.2Å; L174-L214 HydrophobicContact CD1-CD1 4.29Å; L174-L214 HydrophobicContact CD1-CD2 4.27Å; T205-L214 HydrophobicContact CG2-CD2 3.93Å; L208-L214 HydrophobicContact CD1-CD2 3.64Å; L208-L214 HydrophobicContact CD1-CG 4.17Å; D211-L214 HydrophobicContact CB-CD1 4.46Å; D211-L214 VanDerWaalsContact O-CB 3.24Å; D211-L214 WeakPolarHBondContact O-CB 3.41Å; D211-L214 WeakPolarHBondContact O-CG 3.31Å; D211-L214 PolarHBondContact O-N 3.43Å; D211-L214 VanDerWaalsContact O-N 3.08Å; S212-L214 PolarHBondContact O-N 2.85Å; L214-S216 VanDerWaalsContact C-N 3.31Å; L214-T266 HydrophobicContact CD1-CG2 3.79Å
215	H	76.1	Confident	84.1	Confident	56 Å²	56	55.9 Å²	55.9	26%	0.259	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-74.7	-20.3	176.9	-76.6	-62.8	0	0	0	113.5	L137 E213 I217	L137-H215 WeakPolarHBondContact CD2-NE2 3.33Å; L137-H215 PolarHBondContact O-NE2 3.37Å; E213-H215 PolarHBondContact O-N 3.4Å; H215-I217 VanDerWaalsContact C-N 3.33Å
216	S	76.5	Confident	84.3	Confident	98 Å²	98	56 Å²	56	69%	0.685	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-84.2	-9.1	178.5	63.5	0	0	0	0	113.8	E213 L214	E213-S216 PolarHBondContact O-N 2.91Å; E213-S216 PolarHBondContact O-OG 3.32Å; L214-S216 VanDerWaalsContact C-N 3.31Å
217	I	80.1	Confident	84.3	Confident	16 Å²	16	57.8 Å²	57.8	8%	0.082	29%	0.29	C	S	.	.			trans	-87.4	122.6	-179.7	-63.3	173.8	0	0	0	109.3	L40 Y204 T205 L208 H215 A219 M239	L40-I217 HydrophobicContact CD2-CB 4.13Å; L40-I217 HydrophobicContact CD2-CG2 4.17Å; Y204-I217 HydrophobicContact CE1-CD1 4.27Å; T205-I217 HydrophobicContact CG2-CD1 4.32Å; L208-I217 HydrophobicContact CD1-CD1 3.46Å; L208-I217 VanDerWaalsContact CD1-CD1 3.46Å; L208-I217 HydrophobicContact CD2-CD1 4.1Å; L208-I217 HydrophobicContact CG-CD1 4.29Å; H215-I217 VanDerWaalsContact C-N 3.33Å; I217-A219 HydrophobicContact CG2-CB 3.76Å; I217-A219 PolarHBondContact O-N 3.5Å; I217-M239 HydrophobicContact CG2-CE 4.04Å; I217-M239 HydrophobicContact CG2-SD 3.97Å
218	D	82.4	Confident	84.1	Confident	52 Å²	52	53.5 Å²	53.5	28%	0.278	28%	0.275	S	S	.	.			trans	-89.7	89.3	170.5	-165	28.2	0	0	0	109.6	R42 A240	R42-D218 WeakPolarHBondContact CD-OD1 3.28Å; R42-D218 VanDerWaalsContact CZ-CG 3.44Å; R42-D218 IonicContact CZ-OD1 2.86Å; R42-D218 IonicContact CZ-OD2 2.86Å; R42-D218 IonicContact NE-OD1 3.17Å; R42-D218 PolarHBondContact NE-OD1 3.39Å; R42-D218 IonicContact NE-OD2 3.89Å; R42-D218 IonicContact NH1-OD1 2.75Å; R42-D218 IonicContact NH1-OD2 2.77Å; R42-D218 VanDerWaalsContact NH2-CG 3.32Å; R42-D218 IonicContact NH2-OD1 2.93Å; R42-D218 PolarHBondContact NH2-OD1 2.94Å; R42-D218 IonicContact NH2-OD2 3.64Å; R42-D218 PolarHBondContact NH2-OD2 3.17Å; D218-A240 HydrophobicContact CB-CB 4.06Å; D218-A240 VanDerWaalsContact O-CB 3.3Å; D218-A240 WeakPolarHBondContact O-CB 3.4Å; D218-A240 PolarHBondContact O-N 2.8Å; D218-A240 VanDerWaalsContact O-N 3.08Å; D218-A240 WeakPolarHBondContact OD2-CB 3.46Å
219	A	86.4	Confident	84.1	Confident	3 Å²	3	54.9 Å²	54.9	3%	0.025	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	158.2	179.2	0	0	0	0	0	111.3	L40 I217 F237 C238 M239	L40-A219 HydrophobicContact CB-CB 4.37Å; L40-A219 WeakPolarHBondContact CB-O 3.29Å; L40-A219 HydrophobicContact CD2-CB 4.44Å; L40-A219 PolarHBondContact N-O 3.36Å; I217-A219 HydrophobicContact CG2-CB 3.76Å; I217-A219 PolarHBondContact O-N 3.5Å; A219-F237 HydrophobicContact CB-CD2 4.38Å; A219-F237 HydrophobicContact CB-CE2 3.45Å; A219-F237 VanDerWaalsContact CB-CE2 3.45Å; A219-F237 HydrophobicContact CB-CZ 3.76Å; A219-C238 WeakPolarHBondContact CA-O 3.48Å; A219-M239 HydrophobicContact CB-SD 3.72Å
220	S	89.4	Confident	84.4	Confident	30 Å²	30	52.2 Å²	52.2	21%	0.21	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	145.7	177	65	0	0	0	0	110.9	V38 N39 C238	V38-S220 WeakPolarHBondContact O-CA 3.45Å; N39-S220 WeakPolarHBondContact OD1-CB 3.49Å; S220-C238 PolarHBondContact N-O 2.79Å; S220-C238 PolarHBondContact O-N 2.9Å
221	F	90.9	Very high	84.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	115	175.7	-63.9	-91.1	0	0	0	108.2	T37 V38 L40 I172 L174 V223 T236 F237 L248 I268	T37-F221 CarbonylContact C-O 3.57Å; T37-F221 VanDerWaalsContact CA-O 3.28Å; T37-F221 WeakPolarHBondContact CA-O 3.47Å; V38-F221 HydrophobicContact CB-CB 4.49Å; V38-F221 PolarHBondContact N-O 3.02Å; V38-F221 PolarHBondContact O-N 3.1Å; L40-F221 HydrophobicContact CB-CE2 4.29Å; I172-F221 HydrophobicContact CD1-CB 4.22Å; I172-F221 HydrophobicContact CD1-CD1 3.69Å; I172-F221 HydrophobicContact CD1-CE1 4.34Å; I172-F221 HydrophobicContact CD1-CG 4.09Å; I172-F221 HydrophobicContact CG2-CD1 4.31Å; I172-F221 HydrophobicContact CG2-CE1 3.91Å; L174-F221 HydrophobicContact CD2-CE1 4.29Å; L174-F221 HydrophobicContact CD2-CE2 4.16Å; L174-F221 HydrophobicContact CD2-CZ 3.47Å; L174-F221 VanDerWaalsContact CD2-CZ 3.47Å; F221-V223 HydrophobicContact CB-CG2 4Å; F221-T236 WeakPolarHBondContact CA-O 3.27Å; F221-F237 HydrophobicContact CD1-CB 4.37Å; F221-F237 AromaticContact CD1-CD2 3.84Å; F221-F237 HydrophobicContact CD1-CD2 3.84Å; F221-F237 HydrophobicContact CE1-CB 4.26Å; F221-F237 AromaticContact CE1-CD2 3.28Å; F221-F237 HydrophobicContact CE1-CD2 3.28Å; F221-F237 AromaticContact CE1-CE2 3.94Å; F221-F237 HydrophobicContact CE1-CE2 3.94Å; F221-F237 HydrophobicContact CE1-CG 4.14Å; F221-F237 HydrophobicContact CE2-CD2 4.13Å; F221-F237 HydrophobicContact CE2-CE2 4.15Å; F221-F237 HydrophobicContact CG-CD2 4.47Å; F221-F237 AromaticContact CZ-CD2 3.43Å; F221-F237 HydrophobicContact CZ-CD2 3.43Å; F221-F237 VanDerWaalsContact CZ-CD2 3.43Å; F221-F237 AromaticContact CZ-CE2 3.58Å; F221-F237 HydrophobicContact CZ-CE2 3.58Å; F221-L248 HydrophobicContact CD1-CD1 3.77Å; F221-L248 HydrophobicContact CE1-CD1 3.85Å; F221-I268 HydrophobicContact CD2-CD1 4.34Å; F221-I268 HydrophobicContact CD2-CG2 4.34Å; F221-I268 HydrophobicContact CE2-CD1 4.29Å; F221-I268 HydrophobicContact CE2-CG2 4.05Å; F221-I268 HydrophobicContact CZ-CG2 4.36Å
222	Y	92.2	Very high	84.9	Confident	121 Å²	121	49.5 Å²	49.5	48%	0.475	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	111.5	167.5	-177.6	-102.6	0	0	0	108.8	A235 T236	Y222-A235 CarbonylContact O-C 3.5Å; Y222-A235 WeakPolarHBondContact O-CA 3.48Å; Y222-A235 WeakPolarHBondContact O-CB 3.46Å; Y222-T236 PolarHBondContact N-O 2.84Å; Y222-T236 PolarHBondContact O-N 3.44Å
223	V	92.8	Very high	85.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	139.5	-173.2	-165.1	0	0	0	0	109.5	A35 R36 V38 I172 F221 F233 A235 I270 Y271	A35-V223 WeakPolarHBondContact CA-O 3.41Å; A35-V223 WeakPolarHBondContact CB-O 3.5Å; R36-V223 HydrophobicContact CG-CB 4.41Å; R36-V223 PolarHBondContact N-O 3.07Å; R36-V223 PolarHBondContact O-N 3.07Å; V38-V223 HydrophobicContact CG2-CG2 4.48Å; I172-V223 HydrophobicContact CD1-CG2 4.2Å; F221-V223 HydrophobicContact CB-CG2 4Å; V223-F233 HydrophobicContact CG1-CE2 3.53Å; V223-F233 HydrophobicContact CG1-CZ 3.74Å; V223-A235 HydrophobicContact CG1-CB 4.39Å; V223-A235 HydrophobicContact CG2-CB 4.33Å; V223-I270 HydrophobicContact CG1-CD1 4.19Å; V223-I270 HydrophobicContact CG2-CG2 4.15Å; V223-Y271 HydrophobicContact CG1-CE1 4.41Å; V223-Y271 HydrophobicContact CG1-CE2 4.35Å; V223-Y271 VanDerWaalsContact CG1-OH 3.25Å; V223-Y271 WeakPolarHBondContact CG1-OH 3.3Å
224	E	93.1	Very high	86.4	Confident	29 Å²	29	49.1 Å²	49.1	14%	0.136	25%	0.252	C	S	.	.			trans	-58.5	174.4	175.4	66.3	172.8	153.1	0	0	113.7	Q227 F233 I234 Y271 R277	E224-Q227 PolarHBondContact OE2-NE2 2.67Å; E224-F233 VanDerWaalsContact OE1-CA 3.3Å; E224-F233 WeakPolarHBondContact OE1-CA 3.29Å; E224-I234 PolarHBondContact N-O 3.43Å; E224-I234 PolarHBondContact OE1-N 3.07Å; E224-Y271 PolarHBondContact O-OH 2.88Å; E224-R277 IonicContact OE1-NH2 2.67Å
225	K	91.4	Very high	86.9	Confident	108 Å²	108	49.2 Å²	49.2	47%	0.47	25%	0.253	S	S	.	.			trans	-67.5	147.6	172.6	65.4	-176.7	179.5	-179.6	0	109.9	Q227	K225-Q227 HydrophobicContact CG-CG 4.19Å; K225-Q227 WeakPolarHBondContact O-CG 3.22Å; K225-Q227 PolarHBondContact O-N 2.81Å
226	P	90.5	Very high	87.6	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.026	25%	0.253	C	S	.	.			trans	-54.2	130	171.6	-22.2	29.3	0	0	0	111.3	L33 Y271 E275 M280	L33-P226 HydrophobicContact CD2-CB 4.38Å; L33-P226 HydrophobicContact CD2-CG 4.22Å; P226-Y271 HydrophobicContact CB-CD1 4.46Å; P226-Y271 HydrophobicContact CB-CE1 4.33Å; P226-Y271 HydrophobicContact CG-CD1 3.76Å; P226-Y271 HydrophobicContact CG-CE1 3.6Å; P226-Y271 HydrophobicContact CG-CG 4.48Å; P226-E275 HydrophobicContact CB-CB 4.29Å; P226-E275 HydrophobicContact CG-CB 4.06Å; P226-E275 HydrophobicContact CG-CG 4.23Å; P226-M280 HydrophobicContact CB-SD 3.97Å
227	Q	88.1	Confident	88.3	Confident	63 Å²	63	44.1 Å²	44.1	29%	0.294	22%	0.221	S	C	.	.			trans	-130	159.6	176.9	-53.9	-162.8	38	0	0	109.7	E224 K225 R277	E224-Q227 PolarHBondContact OE2-NE2 2.67Å; K225-Q227 HydrophobicContact CG-CG 4.19Å; K225-Q227 WeakPolarHBondContact O-CG 3.22Å; K225-Q227 PolarHBondContact O-N 2.81Å; Q227-R277 WeakPolarHBondContact O-CG 3.36Å
228	N	81.2	Confident	88.7	Confident	86 Å²	86	44.8 Å²	44.8	46%	0.46	23%	0.227	S	C	.	.	S	Bend	trans	-78.4	-21.1	177.4	59.5	-19.3	0	0	0	113.4	I230 N281	N228-I230 PolarHBondContact O-N 3.3Å; N228-N281 PolarHBondContact O-ND2 3.15Å
229	D	83	Confident	88.7	Confident	66 Å²	66	43.2 Å²	43.2	35%	0.353	22%	0.218	S	C	.	.			trans	-67.5	127.4	179	-171.3	2.4	0	0	0	111.8	H231 S232 R277	D229-H231 PolarHBondContact OD1-N 3.5Å; D229-S232 WeakPolarHBondContact OD2-CB 3.34Å; D229-S232 PolarHBondContact OD2-OG 3.47Å; D229-R277 WeakPolarHBondContact O-CD 3.28Å; D229-R277 PolarHBondContact O-NE 3.24Å
230	I	83.5	Confident	88	Confident	21 Å²	21	46 Å²	46	11%	0.108	24%	0.241	C	C	.	.	S	Bend	trans	-93.5	-15.5	-178	61.3	171.5	0	0	0	112.8	L190 D191 N228 W255 R277	L190-I230 HydrophobicContact CD2-CB 3.92Å; L190-I230 HydrophobicContact CD2-CD1 4.2Å; L190-I230 HydrophobicContact CD2-CG2 3.48Å; L190-I230 VanDerWaalsContact CD2-CG2 3.48Å; L190-I230 HydrophobicContact CG-CG2 4.33Å; D191-I230 HydrophobicContact CB-CD1 3.77Å; N228-I230 PolarHBondContact O-N 3.3Å; I230-W255 PolarHBondContact O-NE1 2.88Å; I230-W255 VanDerWaalsContact O-NE1 3.07Å; I230-R277 HydrophobicContact CG2-CB 4.31Å
231	H	84.3	Confident	86.9	Confident	119 Å²	119	50.8 Å²	50.8	55%	0.551	26%	0.264	S	S	*	.	S	Bend	trans	-100.3	-4	-178.6	-59.5	-60.3	0	0	0	113.1	D229 V250	D229-H231 PolarHBondContact OD1-N 3.5Å; H231-V250 WeakPolarHBondContact O-CG2 3.46Å
232	S	86.2	Confident	85.5	Confident	36 Å²	36	54.1 Å²	54.1	25%	0.252	30%	0.299	S	S	.	.			trans	-118.2	132.6	173.8	76.6	0	0	0	0	111.3	D229 V250 R277	D229-S232 WeakPolarHBondContact OD2-CB 3.34Å; D229-S232 PolarHBondContact OD2-OG 3.47Å; S232-V250 VanDerWaalsContact C-CG2 3.46Å; S232-R277 PolarHBondContact O-NH2 3.1Å; S232-R277 VanDerWaalsContact O-NH2 3.12Å
233	F	91.8	Very high	84.3	Confident	7 Å²	7	51 Å²	51	3%	0.031	29%	0.294	C	S	.	.			trans	-154.1	130.9	169.5	-179.9	-109.8	0	0	0	109.4	I172 V223 E224 A235 V250 T253 W255 I270	I172-F233 HydrophobicContact CD1-CE1 4.36Å; I172-F233 HydrophobicContact CD1-CZ 4Å; I172-F233 HydrophobicContact CG1-CE1 4.29Å; I172-F233 HydrophobicContact CG1-CZ 4.06Å; V223-F233 HydrophobicContact CG1-CE2 3.53Å; V223-F233 HydrophobicContact CG1-CZ 3.74Å; E224-F233 VanDerWaalsContact OE1-CA 3.3Å; E224-F233 WeakPolarHBondContact OE1-CA 3.29Å; F233-A235 HydrophobicContact CD1-CB 4.49Å; F233-A235 HydrophobicContact CE1-CB 3.56Å; F233-A235 HydrophobicContact CE2-CB 4.45Å; F233-A235 HydrophobicContact CZ-CB 3.56Å; F233-V250 HydrophobicContact CB-CB 4.37Å; F233-V250 HydrophobicContact CB-CG2 3.5Å; F233-V250 VanDerWaalsContact CB-CG2 3.5Å; F233-T253 HydrophobicContact CD1-CG2 3.29Å; F233-T253 HydrophobicContact CD2-CG2 4.46Å; F233-T253 HydrophobicContact CE1-CG2 3.27Å; F233-T253 HydrophobicContact CE2-CG2 4.43Å; F233-T253 HydrophobicContact CG-CG2 3.9Å; F233-T253 HydrophobicContact CZ-CG2 3.86Å; F233-W255 HydrophobicContact CB-CH2 3.74Å; F233-W255 HydrophobicContact CB-CZ2 4.01Å; F233-W255 HydrophobicContact CD1-CH2 4.4Å; F233-W255 AromaticContact CD2-CH2 3.73Å; F233-W255 HydrophobicContact CD2-CH2 3.73Å; F233-W255 HydrophobicContact CD2-CZ3 4.41Å; F233-W255 HydrophobicContact CE2-CH2 4.36Å; F233-W255 AromaticContact CG-CH2 3.7Å; F233-W255 HydrophobicContact CG-CH2 3.7Å; F233-W255 HydrophobicContact CG-CZ2 4.45Å; F233-I270 HydrophobicContact CE2-CD1 3.71Å; F233-I270 HydrophobicContact CZ-CD1 3.78Å
234	I	92.1	Very high	83.4	Confident	117 Å²	117	59.7 Å²	59.7	60%	0.6	34%	0.335	S	S	*	.			trans	-129.5	122.4	175.2	-55.2	170.9	0	0	0	108.2	E224	E224-I234 PolarHBondContact N-O 3.43Å; E224-I234 PolarHBondContact OE1-N 3.07Å
235	A	92.7	Very high	82.8	Confident	2 Å²	2	63.2 Å²	63.2	2%	0.017	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	159.6	168.9	0	0	0	0	0	110.8	I172 Y222 V223 F233 L248	I172-A235 HydrophobicContact CD1-CB 4.41Å; Y222-A235 CarbonylContact O-C 3.5Å; Y222-A235 WeakPolarHBondContact O-CA 3.48Å; Y222-A235 WeakPolarHBondContact O-CB 3.46Å; V223-A235 HydrophobicContact CG1-CB 4.39Å; V223-A235 HydrophobicContact CG2-CB 4.33Å; F233-A235 HydrophobicContact CD1-CB 4.49Å; F233-A235 HydrophobicContact CE1-CB 3.56Å; F233-A235 HydrophobicContact CE2-CB 4.45Å; F233-A235 HydrophobicContact CZ-CB 3.56Å; A235-L248 HydrophobicContact CB-CB 4.17Å; A235-L248 HydrophobicContact CB-CD1 4.4Å; A235-L248 PolarHBondContact N-O 2.88Å; A235-L248 PolarHBondContact O-N 2.98Å
236	T	91.8	Very high	82.6	Confident	43 Å²	43	60.8 Å²	60.8	26%	0.264	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.1	174.7	-51.6	0	0	0	0	108.9	F221 Y222 D245	F221-T236 WeakPolarHBondContact CA-O 3.27Å; Y222-T236 PolarHBondContact N-O 2.84Å; Y222-T236 PolarHBondContact O-N 3.44Å; T236-D245 HydrophobicContact CG2-CB 3.75Å
237	F	91.1	Very high	82.6	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.018	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.2	171.1	177.1	-112.7	0	0	0	109.5	V202 A219 F221 M239 D245 T246 L248	V202-F237 HydrophobicContact CG1-CD1 4.17Å; V202-F237 HydrophobicContact CG1-CE1 4.29Å; V202-F237 HydrophobicContact CG1-CG 4.42Å; A219-F237 HydrophobicContact CB-CD2 4.38Å; A219-F237 HydrophobicContact CB-CE2 3.45Å; A219-F237 VanDerWaalsContact CB-CE2 3.45Å; A219-F237 HydrophobicContact CB-CZ 3.76Å; F221-F237 HydrophobicContact CD1-CB 4.37Å; F221-F237 AromaticContact CD1-CD2 3.84Å; F221-F237 HydrophobicContact CD1-CD2 3.84Å; F221-F237 HydrophobicContact CE1-CB 4.26Å; F221-F237 AromaticContact CE1-CD2 3.28Å; F221-F237 HydrophobicContact CE1-CD2 3.28Å; F221-F237 AromaticContact CE1-CE2 3.94Å; F221-F237 HydrophobicContact CE1-CE2 3.94Å; F221-F237 HydrophobicContact CE1-CG 4.14Å; F221-F237 HydrophobicContact CE2-CD2 4.13Å; F221-F237 HydrophobicContact CE2-CE2 4.15Å; F221-F237 HydrophobicContact CG-CD2 4.47Å; F221-F237 AromaticContact CZ-CD2 3.43Å; F221-F237 HydrophobicContact CZ-CD2 3.43Å; F221-F237 VanDerWaalsContact CZ-CD2 3.43Å; F221-F237 AromaticContact CZ-CE2 3.58Å; F221-F237 HydrophobicContact CZ-CE2 3.58Å; F237-M239 HydrophobicContact CD1-CG 4.38Å; F237-M239 HydrophobicContact CE1-CG 3.65Å; F237-M239 HydrophobicContact CE1-SD 3.55Å; F237-M239 VanDerWaalsContact CE1-SD 3.55Å; F237-M239 HydrophobicContact CE2-SD 4.32Å; F237-M239 HydrophobicContact CZ-CG 4.01Å; F237-M239 HydrophobicContact CZ-SD 3.33Å; F237-M239 WeakPolarHBondContact CZ-SD 3.38Å; F237-D245 WeakPolarHBondContact O-CA 3.46Å; F237-T246 PolarHBondContact N-O 3.44Å; F237-T246 PolarHBondContact O-N 3.48Å; F237-L248 HydrophobicContact CB-CD1 4.15Å; F237-L248 HydrophobicContact CB-CG 4.3Å
238	C	87.8	Confident	82.7	Confident	29 Å²	29	60.9 Å²	60.9	20%	0.196	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	123.7	-177.5	-62.1	0	0	0	0	109.9	A219 S220 D245	A219-C238 WeakPolarHBondContact CA-O 3.48Å; S220-C238 PolarHBondContact N-O 2.79Å; S220-C238 PolarHBondContact O-N 2.9Å; C238-D245 WeakPolarHBondContact CA-OD1 3.45Å; C238-D245 VanDerWaalsContact SG-CG 3.59Å; C238-D245 PolarHBondContact SG-OD1 2.96Å
239	M	81.9	Confident	83.2	Confident	19 Å²	19	59.2 Å²	59.2	9%	0.094	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	143.4	176.1	-69.3	-74.8	-69.8	0	0	110.4	Y204 I217 A219 F237 D241 S243	Y204-M239 HydrophobicContact CD1-CE 4.2Å; Y204-M239 HydrophobicContact CD1-SD 4.32Å; Y204-M239 HydrophobicContact CE1-CE 3.47Å; Y204-M239 VanDerWaalsContact CE1-CE 3.47Å; Y204-M239 HydrophobicContact CE1-SD 4.15Å; Y204-M239 HydrophobicContact CE2-CE 4.3Å; I217-M239 HydrophobicContact CG2-CE 4.04Å; I217-M239 HydrophobicContact CG2-SD 3.97Å; A219-M239 HydrophobicContact CB-SD 3.72Å; F237-M239 HydrophobicContact CD1-CG 4.38Å; F237-M239 HydrophobicContact CE1-CG 3.65Å; F237-M239 HydrophobicContact CE1-SD 3.55Å; F237-M239 VanDerWaalsContact CE1-SD 3.55Å; F237-M239 HydrophobicContact CE2-SD 4.32Å; F237-M239 HydrophobicContact CZ-CG 4.01Å; F237-M239 HydrophobicContact CZ-SD 3.33Å; F237-M239 WeakPolarHBondContact CZ-SD 3.38Å; M239-D241 PolarHBondContact O-N 2.93Å; M239-S243 WeakPolarHBondContact CB-OG 3.27Å; M239-S243 WeakPolarHBondContact CG-OG 3.4Å
240	A	72.1	Confident	83.6	Confident	62 Å²	62	57.3 Å²	57.3	51%	0.512	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-21.8	176.1	0	0	0	0	0	113.2	D218 G242	D218-A240 HydrophobicContact CB-CB 4.06Å; D218-A240 VanDerWaalsContact O-CB 3.3Å; D218-A240 WeakPolarHBondContact O-CB 3.4Å; D218-A240 PolarHBondContact O-N 2.8Å; D218-A240 VanDerWaalsContact O-N 3.08Å; D218-A240 WeakPolarHBondContact OD2-CB 3.46Å; A240-G242 VanDerWaalsContact C-N 3.26Å; A240-G242 PolarHBondContact O-N 3.12Å
241	D	67.3	Low	83.9	Confident	130 Å²	130	61.5 Å²	61.5	70%	0.695	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	3.1	-173.5	-60.3	-16.6	0	0	0	114.2	M239	M239-D241 PolarHBondContact O-N 2.93Å
242	G	61.1	Low	84.3	Confident	71 Å²	71	56.7 Å²	56.7	73%	0.732	35%	0.349	S	S	*	.			trans	78.2	14.3	177.7	0	0	0	0	0	115.6	A240	A240-G242 VanDerWaalsContact C-N 3.26Å; A240-G242 PolarHBondContact O-N 3.12Å
243	S	66.9	Low	84.7	Confident	54 Å²	54	55 Å²	55	38%	0.378	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-70	153.9	169	57.9	0	0	0	0	111.8	M239 D245	M239-S243 WeakPolarHBondContact CB-OG 3.27Å; M239-S243 WeakPolarHBondContact CG-OG 3.4Å; S243-D245 PolarHBondContact O-N 3.01Å
244	E	72.6	Confident	84.8	Confident	184 Å²	184	54.6 Å²	54.6	86%	0.86	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-52.7	131.7	-179	-68.8	-172.5	163.5	0	0	113	T246	E244-T246 PolarHBondContact O-N 2.74Å
245	D	82.1	Confident	84.9	Confident	103 Å²	103	49.2 Å²	49.2	55%	0.551	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-60.6	129.5	174.8	-75.2	-21.1	0	0	0	110.5	T236 F237 C238 S243	T236-D245 HydrophobicContact CG2-CB 3.75Å; F237-D245 WeakPolarHBondContact O-CA 3.46Å; C238-D245 WeakPolarHBondContact CA-OD1 3.45Å; C238-D245 VanDerWaalsContact SG-CG 3.59Å; C238-D245 PolarHBondContact SG-OD1 2.96Å; S243-D245 PolarHBondContact O-N 3.01Å
246	T	86.1	Confident	84.7	Confident	56 Å²	56	49.3 Å²	49.3	34%	0.344	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.8	179.4	-52.4	0	0	0	0	110.2	F237 E244	F237-T246 PolarHBondContact N-O 3.44Å; F237-T246 PolarHBondContact O-N 3.48Å; E244-T246 PolarHBondContact O-N 2.74Å
247	G	90.2	Very high	84.4	Confident	62 Å²	62	48.9 Å²	48.9	64%	0.639	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	133.4	172.1	0	0	0	0	0	111.5
248	L	91.8	Very high	84.3	Confident	8 Å²	8	48.8 Å²	48.8	4%	0.042	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141.3	177.1	-58	180	0	0	0	110.2	I172 V202 F221 A235 F237 N252	I172-L248 HydrophobicContact CD1-CD1 4.24Å; I172-L248 HydrophobicContact CG2-CD1 3.92Å; V202-L248 HydrophobicContact CG2-CD1 4.25Å; V202-L248 HydrophobicContact CG2-CD2 3.74Å; F221-L248 HydrophobicContact CD1-CD1 3.77Å; F221-L248 HydrophobicContact CE1-CD1 3.85Å; A235-L248 HydrophobicContact CB-CB 4.17Å; A235-L248 HydrophobicContact CB-CD1 4.4Å; A235-L248 PolarHBondContact N-O 2.88Å; A235-L248 PolarHBondContact O-N 2.98Å; F237-L248 HydrophobicContact CB-CD1 4.15Å; F237-L248 HydrophobicContact CB-CG 4.3Å; L248-N252 HydrophobicContact CB-CB 4.37Å; L248-N252 HydrophobicContact CD2-CB 4.26Å
249	S	91.8	Very high	84.4	Confident	51 Å²	51	47.8 Å²	47.8	36%	0.357	30%	0.298	S	S	.	.			trans	-120.1	-176.8	179.7	75.9	0	0	0	0	111.1	E251 N252	S249-E251 PolarHBondContact O-N 3.07Å; S249-E251 VanDerWaalsContact O-N 3.14Å; S249-E251 PolarHBondContact OG-N 3.5Å; S249-N252 PolarHBondContact N-OD1 3.42Å; S249-N252 PolarHBondContact O-N 3.25Å
250	V	89.8	Confident	84.8	Confident	26 Å²	26	46.9 Å²	46.9	16%	0.158	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-55.9	-27.9	175.5	177.5	0	0	0	0	112.3	R199 H231 S232 F233 N252 T253 W255	R199-V250 VanDerWaalsContact CZ-O 3.3Å; R199-V250 VanDerWaalsContact NH1-CG1 3.33Å; R199-V250 PolarHBondContact NH1-O 3.37Å; H231-V250 WeakPolarHBondContact O-CG2 3.46Å; S232-V250 VanDerWaalsContact C-CG2 3.46Å; F233-V250 HydrophobicContact CB-CB 4.37Å; F233-V250 HydrophobicContact CB-CG2 3.5Å; F233-V250 VanDerWaalsContact CB-CG2 3.5Å; V250-N252 PolarHBondContact O-N 3.26Å; V250-T253 PolarHBondContact O-N 2.94Å; V250-T253 PolarHBondContact O-OG1 3.26Å; V250-W255 HydrophobicContact CG1-CZ2 4.26Å
251	E	90	Very high	85.3	Confident	108 Å²	108	44.1 Å²	44.1	51%	0.505	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-63.8	-21.3	177.5	-63.9	-177	177.4	0	0	112.7	R199 L200 S249	R199-E251 CarbonylContact C-O 3.56Å; R199-E251 WeakPolarHBondContact CA-O 3.44Å; R199-E251 WeakPolarHBondContact CB-O 2.84Å; R199-E251 WeakPolarHBondContact CD-O 3.25Å; L200-E251 PolarHBondContact N-O 2.97Å; S249-E251 PolarHBondContact O-N 3.07Å; S249-E251 VanDerWaalsContact O-N 3.14Å; S249-E251 PolarHBondContact OG-N 3.5Å
252	N	93.8	Very high	86	Confident	18 Å²	18	38.8 Å²	38.8	10%	0.096	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-95.3	13.6	-177.6	-52.7	107.5	0	0	0	113.8	L173 L200 L248 S249 V250	L173-N252 PolarHBondContact N-O 2.87Å; L200-N252 WeakPolarHBondContact O-CA 3.21Å; L200-N252 PolarHBondContact O-ND2 2.89Å; L248-N252 HydrophobicContact CB-CB 4.37Å; L248-N252 HydrophobicContact CD2-CB 4.26Å; S249-N252 PolarHBondContact N-OD1 3.42Å; S249-N252 PolarHBondContact O-N 3.25Å; V250-N252 PolarHBondContact O-N 3.26Å
253	T	94.3	Very high	87.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	157.5	-173.6	65.7	0	0	0	0	114.5	L171 I172 R199 F233 V250 W255	L171-T253 VanDerWaalsContact O-CA 3.26Å; L171-T253 WeakPolarHBondContact O-CA 3.4Å; L171-T253 WeakPolarHBondContact O-CB 3.45Å; I172-T253 HydrophobicContact CG1-CG2 4.41Å; R199-T253 VanDerWaalsContact CD-O 3.3Å; R199-T253 WeakPolarHBondContact CD-O 3.44Å; R199-T253 PolarHBondContact NE-O 2.73Å; F233-T253 HydrophobicContact CD1-CG2 3.29Å; F233-T253 HydrophobicContact CD2-CG2 4.46Å; F233-T253 HydrophobicContact CE1-CG2 3.27Å; F233-T253 HydrophobicContact CE2-CG2 4.43Å; F233-T253 HydrophobicContact CG-CG2 3.9Å; F233-T253 HydrophobicContact CZ-CG2 3.86Å; V250-T253 PolarHBondContact O-N 2.94Å; V250-T253 PolarHBondContact O-OG1 3.26Å; T253-W255 VanDerWaalsContact CB-CH2 3.43Å; T253-W255 VanDerWaalsContact CB-CZ3 3.42Å; T253-W255 HydrophobicContact CG2-CH2 3.58Å; T253-W255 HydrophobicContact CG2-CZ2 4.39Å; T253-W255 HydrophobicContact CG2-CZ3 3.79Å; T253-W255 WeakPolarHBondContact OG1-CH2 3.37Å; T253-W255 WeakPolarHBondContact OG1-CZ2 3.49Å; T253-W255 WeakPolarHBondContact OG1-CZ3 3.41Å
254	L	93.9	Very high	88.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	117.6	170.5	-62.8	177.8	0	0	0	108.6	V167 L171 L173 V185 R199 A265	V167-L254 HydrophobicContact CG1-CB 4.11Å; V167-L254 HydrophobicContact CG2-CB 4.1Å; V167-L254 HydrophobicContact CG2-CD1 4.42Å; L171-L254 HydrophobicContact CB-CB 4.19Å; L171-L254 HydrophobicContact CD1-CB 4.29Å; L171-L254 HydrophobicContact CD1-CD1 4.2Å; L171-L254 HydrophobicContact CG-CB 4.41Å; L171-L254 PolarHBondContact N-O 3.36Å; L171-L254 PolarHBondContact O-N 3.33Å; L173-L254 HydrophobicContact CD1-CD1 3.99Å; V185-L254 HydrophobicContact CB-CD2 4.44Å; V185-L254 HydrophobicContact CG1-CD2 3.29Å; R199-L254 HydrophobicContact CG-CD2 4.06Å; L254-A265 HydrophobicContact CD1-CB 3.76Å
255	W	93.3	Very high	89.1	Confident	3 Å²	3	27.9 Å²	27.9	1%	0.011	18%	0.18	C	C	.	.			trans	-83.2	147.6	180	-54.2	145.7	0	0	0	111.5	V167 D170 L190 I230 F233 V250 T253 T258 R277	V167-W255 WeakPolarHBondContact CB-O 3.39Å; V167-W255 WeakPolarHBondContact CG1-O 3.43Å; D170-W255 HydrophobicContact CB-CE3 4.09Å; D170-W255 HydrophobicContact CB-CZ3 4.42Å; L190-W255 HydrophobicContact CD2-CB 4.15Å; L190-W255 HydrophobicContact CD2-CG 4.3Å; I230-W255 PolarHBondContact O-NE1 2.88Å; I230-W255 VanDerWaalsContact O-NE1 3.07Å; F233-W255 HydrophobicContact CB-CH2 3.74Å; F233-W255 HydrophobicContact CB-CZ2 4.01Å; F233-W255 HydrophobicContact CD1-CH2 4.4Å; F233-W255 AromaticContact CD2-CH2 3.73Å; F233-W255 HydrophobicContact CD2-CH2 3.73Å; F233-W255 HydrophobicContact CD2-CZ3 4.41Å; F233-W255 HydrophobicContact CE2-CH2 4.36Å; F233-W255 AromaticContact CG-CH2 3.7Å; F233-W255 HydrophobicContact CG-CH2 3.7Å; F233-W255 HydrophobicContact CG-CZ2 4.45Å; V250-W255 HydrophobicContact CG1-CZ2 4.26Å; T253-W255 VanDerWaalsContact CB-CH2 3.43Å; T253-W255 VanDerWaalsContact CB-CZ3 3.42Å; T253-W255 HydrophobicContact CG2-CH2 3.58Å; T253-W255 HydrophobicContact CG2-CZ2 4.39Å; T253-W255 HydrophobicContact CG2-CZ3 3.79Å; T253-W255 WeakPolarHBondContact OG1-CH2 3.37Å; T253-W255 WeakPolarHBondContact OG1-CZ2 3.49Å; T253-W255 WeakPolarHBondContact OG1-CZ3 3.41Å; W255-T258 HydrophobicContact CB-CG2 3.94Å; W255-T258 WeakPolarHBondContact O-CB 3.3Å; W255-T258 WeakPolarHBondContact O-CG2 3.43Å; W255-T258 PolarHBondContact O-N 3.12Å; W255-T258 VanDerWaalsContact O-N 3.13Å; W255-T258 PolarHBondContact O-OG1 2.52Å; W255-R277 VanDerWaalsContact CH2-CZ 3.48Å
256	A	90.1	Very high	89.7	Confident	4 Å²	4	23 Å²	23	3%	0.033	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	142.9	174	0	0	0	0	0	110.9	V167 D170 T258 T276	V167-A256 WeakPolarHBondContact O-CA 3.29Å; D170-A256 WeakPolarHBondContact OD1-CB 3.45Å; D170-A256 PolarHBondContact OD1-N 3.33Å; A256-T258 PolarHBondContact O-N 2.99Å; A256-T276 HydrophobicContact CB-CG2 4.02Å
257	N	85.3	Confident	90	Very high	34 Å²	34	20.4 Å²	20.4	18%	0.182	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-0.8	-174.7	-71.3	-41.7	0	0	0	117.2	V167 S278 Q839	V167-N257 PolarHBondContact O-N 3.45Å; N257-S278 PolarHBondContact ND2-OG 2.79Å; N257-Q839 PolarHBondContact OD1-NE2 3.46Å
258	T	89	Confident	90.2	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.018	11%	0.107	C	C	.	.			trans	-71.5	156.3	166.5	62.8	0	0	0	0	110.7	R166 V167 R186 T187 W255 A256	R166-T258 WeakPolarHBondContact CA-O 3.33Å; V167-T258 WeakPolarHBondContact CG2-O 3.45Å; V167-T258 PolarHBondContact N-O 3.24Å; R186-T258 WeakPolarHBondContact O-CB 3.48Å; T187-T258 HydrophobicContact CG2-CG2 3.99Å; W255-T258 HydrophobicContact CB-CG2 3.94Å; W255-T258 WeakPolarHBondContact O-CB 3.3Å; W255-T258 WeakPolarHBondContact O-CG2 3.43Å; W255-T258 PolarHBondContact O-N 3.12Å; W255-T258 VanDerWaalsContact O-N 3.13Å; W255-T258 PolarHBondContact O-OG1 2.52Å; A256-T258 PolarHBondContact O-N 2.99Å
259	V	88.7	Confident	90.3	Very high	8 Å²	8	17 Å²	17	5%	0.048	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129	-179.6	-177.3	0	0	0	0	109.9	R166 V185 R186 A261	R166-V259 HydrophobicContact CG-CG2 3.82Å; V185-V259 CarbonylContact C-O 3.53Å; V185-V259 WeakPolarHBondContact CA-O 3.39Å; R186-V259 HydrophobicContact CB-CB 4.4Å; R186-V259 PolarHBondContact N-O 3.24Å; R186-V259 VanDerWaalsContact NH2-CG1 3.31Å; R186-V259 PolarHBondContact O-N 3.42Å; R186-V259 VanDerWaalsContact O-N 3.17Å; V259-A261 PolarHBondContact O-N 2.99Å
260	V	89.9	Confident	90.4	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	117.6	172.3	177.6	0	0	0	0	108.5	V161 N164 E165 V167 V183 V185 A265	V161-V260 HydrophobicContact CB-CG2 4.15Å; V161-V260 HydrophobicContact CG1-CB 4.33Å; V161-V260 HydrophobicContact CG1-CG2 3.59Å; N164-V260 WeakPolarHBondContact CA-O 3.28Å; N164-V260 PolarHBondContact N-O 3.2Å; E165-V260 PolarHBondContact O-N 3.39Å; V167-V260 HydrophobicContact CG2-CG2 4.33Å; V183-V260 HydrophobicContact CG2-CG1 3.78Å; V185-V260 HydrophobicContact CG1-CG2 4.42Å; V260-A265 HydrophobicContact CG2-CB 4.31Å
261	A	83.2	Confident	90.6	Very high	4 Å²	4	13.4 Å²	13.4	3%	0.033	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-38.5	-172	0	0	0	0	0	112.7	K163 F184 R186 W196 V259	K163-A261 WeakPolarHBondContact CG-O 3.32Å; F184-A261 HydrophobicContact CB-CB 4.25Å; F184-A261 WeakPolarHBondContact O-CB 3.42Å; F184-A261 PolarHBondContact O-N 3.02Å; R186-A261 HydrophobicContact CG-CB 4.03Å; W196-A261 HydrophobicContact CD2-CB 4Å; W196-A261 HydrophobicContact CE3-CB 4.08Å; W196-A261 HydrophobicContact CH2-CB 4.43Å; W196-A261 HydrophobicContact CZ2-CB 4.37Å; W196-A261 HydrophobicContact CZ3-CB 4.3Å; V259-A261 PolarHBondContact O-N 2.99Å
262	A	83.1	Confident	90.8	Very high	17 Å²	17	8.3 Å²	8.3	14%	0.14	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	140.2	-177.1	0	0	0	0	0	110.5	V183 F184	V183-A262 WeakPolarHBondContact CG2-O 3.4Å; F184-A262 HydrophobicContact CB-CB 4.39Å; F184-A262 HydrophobicContact CD2-CB 4.31Å
263	G	83.2	Confident	90.5	Very high	30 Å²	30	7.5 Å²	7.5	31%	0.309	5%	0.053	S	C	.	.	S	Bend	trans	78.8	-174.6	-176.5	0	0	0	0	0	113.9	K163 S177	K163-G263 PolarHBondContact N-O 2.93Å; S177-G263 VanDerWaalsContact OG-CA 3.28Å; S177-G263 WeakPolarHBondContact OG-CA 3.44Å
264	T	89.5	Confident	90.1	Very high	51 Å²	51	11.3 Å²	11.3	31%	0.313	8%	0.079	S	C	.	.			trans	-114.3	146.4	170.6	62.6	0	0	0	0	110	T176 S177	T176-T264 VanDerWaalsContact CA-O 3.28Å; T176-T264 WeakPolarHBondContact CA-O 3.47Å; S177-T264 WeakPolarHBondContact CB-OG1 3.46Å; S177-T264 PolarHBondContact N-O 2.72Å; S177-T264 VanDerWaalsContact N-O 3.12Å; S177-T264 PolarHBondContact OG-N 3.22Å
265	A	92.8	Very high	90	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	125.8	-178.2	0	0	0	0	0	111	V161 L173 V183 L254 V260	V161-A265 PolarHBondContact N-O 3.38Å; V161-A265 PolarHBondContact O-N 2.8Å; L173-A265 HydrophobicContact CD1-CB 3.63Å; V183-A265 HydrophobicContact CG2-CB 4.33Å; L254-A265 HydrophobicContact CD1-CB 3.76Å; V260-A265 HydrophobicContact CG2-CB 4.31Å
266	T	93.8	Very high	89.8	Confident	1 Å²	1	11.7 Å²	11.7	1%	0.006	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.5	173.5	-57	0	0	0	0	108.5	V158 I159 I160 L174 R175 D211 L214	V158-T266 HydrophobicContact CG1-CG2 3.68Å; I159-T266 WeakPolarHBondContact O-CA 3.48Å; I160-T266 HydrophobicContact CG1-CG2 4.18Å; L174-T266 WeakPolarHBondContact CA-O 3.49Å; L174-T266 WeakPolarHBondContact CB-O 3.4Å; L174-T266 PolarHBondContact N-O 3.04Å; R175-T266 PolarHBondContact N-O 3.12Å; R175-T266 PolarHBondContact O-N 3.32Å; D211-T266 PolarHBondContact OD2-OG1 3.38Å; L214-T266 HydrophobicContact CD1-CG2 3.79Å
267	G	93.5	Very high	89.7	Confident	0 Å²	0	11.6 Å²	11.6	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	157.3	-173.9	0	0	0	0	0	113.9	V158 I159 I172	V158-G267 CarbonylContact C-O 3.52Å; V158-G267 WeakPolarHBondContact CA-O 3.4Å; I159-G267 PolarHBondContact N-O 2.74Å; I159-G267 PolarHBondContact O-N 2.87Å; I172-G267 CarbonylContact O-C 3.4Å; I172-G267 WeakPolarHBondContact O-CA 3.32Å
268	I	93.7	Very high	89.5	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	133.9	176.7	-173.9	170.2	0	0	0	110.9	V38 L40 V158 L171 I172 L174 F221 I270	V38-I268 HydrophobicContact CG1-CD1 3.81Å; V38-I268 HydrophobicContact CG1-CG1 4.27Å; L40-I268 HydrophobicContact CD1-CD1 3.93Å; V158-I268 HydrophobicContact CG2-CB 4.45Å; L171-I268 CarbonylContact C-O 3.59Å; L171-I268 WeakPolarHBondContact CA-O 3.38Å; I172-I268 HydrophobicContact CB-CG2 3.89Å; I172-I268 PolarHBondContact N-O 2.99Å; I172-I268 PolarHBondContact O-N 3.18Å; L174-I268 HydrophobicContact CD1-CB 4.02Å; L174-I268 HydrophobicContact CD1-CG2 4.28Å; L174-I268 HydrophobicContact CD2-CG2 4.07Å; L174-I268 HydrophobicContact CG-CB 4.45Å; L174-I268 HydrophobicContact CG-CG2 4.24Å; F221-I268 HydrophobicContact CD2-CD1 4.34Å; F221-I268 HydrophobicContact CD2-CG2 4.34Å; F221-I268 HydrophobicContact CE2-CD1 4.29Å; F221-I268 HydrophobicContact CE2-CG2 4.05Å; F221-I268 HydrophobicContact CZ-CG2 4.36Å; I268-I270 PolarHBondContact O-N 3.39Å
269	V	94.5	Very high	89.1	Confident	0 Å²	0	13 Å²	13	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.6	179.7	179.7	0	0	0	0	110.8	K154 V155 G156 D157 I159 A169 L171 T272	K154-V269 WeakPolarHBondContact O-CB 3.48Å; V155-V269 WeakPolarHBondContact CA-O 3.28Å; G156-V269 PolarHBondContact N-O 3.45Å; D157-V269 HydrophobicContact CB-CG2 4.33Å; D157-V269 WeakPolarHBondContact O-CG2 3.47Å; D157-V269 PolarHBondContact O-N 3.36Å; I159-V269 HydrophobicContact CD1-CG2 4.28Å; I159-V269 HydrophobicContact CG1-CG2 4.44Å; I159-V269 HydrophobicContact CG2-CG2 4.2Å; A169-V269 HydrophobicContact CB-CG1 3.81Å; L171-V269 HydrophobicContact CD2-CB 4.15Å; L171-V269 HydrophobicContact CD2-CG2 3.56Å; V269-T272 HydrophobicContact CG1-CG2 3.43Å; V269-T272 VanDerWaalsContact CG1-CG2 3.43Å
270	I	94.1	Very high	88.8	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-38.1	179.9	53.7	162.7	0	0	0	113.9	V38 D170 I172 V223 F233 I268	V38-I270 HydrophobicContact CG2-CG2 4.42Å; D170-I270 HydrophobicContact CB-CD1 4.43Å; D170-I270 HydrophobicContact CB-CG1 4.08Å; D170-I270 WeakPolarHBondContact O-CG1 3.39Å; D170-I270 PolarHBondContact O-N 2.81Å; I172-I270 HydrophobicContact CD1-CG2 3.67Å; I172-I270 HydrophobicContact CG1-CD1 4.06Å; I172-I270 HydrophobicContact CG1-CG2 3.77Å; V223-I270 HydrophobicContact CG1-CD1 4.19Å; V223-I270 HydrophobicContact CG2-CG2 4.15Å; F233-I270 HydrophobicContact CE2-CD1 3.71Å; F233-I270 HydrophobicContact CZ-CD1 3.78Å; I268-I270 PolarHBondContact O-N 3.39Å
271	Y	93.7	Very high	88.1	Confident	1 Å²	1	16.6 Å²	16.6	0%	0.004	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141	176.7	-49.8	-58.9	0	0	0	110.6	A169 D170 V223 E224 P226	A169-Y271 WeakPolarHBondContact CB-O 3.39Å; D170-Y271 HydrophobicContact CB-CD2 3.92Å; D170-Y271 HydrophobicContact CB-CG 4.47Å; D170-Y271 PolarHBondContact N-O 3.06Å; D170-Y271 VanDerWaalsContact N-O 3.12Å; D170-Y271 PolarHBondContact O-N 2.9Å; V223-Y271 HydrophobicContact CG1-CE1 4.41Å; V223-Y271 HydrophobicContact CG1-CE2 4.35Å; V223-Y271 VanDerWaalsContact CG1-OH 3.25Å; V223-Y271 WeakPolarHBondContact CG1-OH 3.3Å; E224-Y271 PolarHBondContact O-OH 2.88Å; P226-Y271 HydrophobicContact CB-CD1 4.46Å; P226-Y271 HydrophobicContact CB-CE1 4.33Å; P226-Y271 HydrophobicContact CG-CD1 3.76Å; P226-Y271 HydrophobicContact CG-CE1 3.6Å; P226-Y271 HydrophobicContact CG-CG 4.48Å
272	T	93.3	Very high	87.6	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	12%	0.121	C	C	.	.			trans	-130	151.2	-174.2	45.8	0	0	0	0	111.6	P49 N51 V155 A169 V269 C274 E275	P49-T272 PolarHBondContact O-OG1 3.17Å; N51-T272 HydrophobicContact CB-CG2 4.09Å; V155-T272 HydrophobicContact CG2-CG2 3.96Å; A169-T272 HydrophobicContact CB-CG2 4.3Å; V269-T272 HydrophobicContact CG1-CG2 3.43Å; V269-T272 VanDerWaalsContact CG1-CG2 3.43Å; T272-C274 PolarHBondContact O-N 3.33Å; T272-E275 PolarHBondContact O-N 3.18Å; T272-E275 VanDerWaalsContact O-N 3.16Å
273	G	88.6	Confident	86.7	Confident	2 Å²	2	20.3 Å²	20.3	2%	0.021	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	55.3	-120.9	173	0	0	0	0	0	113.3	N51 E275 T276	N51-G273 PolarHBondContact OD1-N 3.11Å; G273-E275 PolarHBondContact O-N 3.36Å; G273-T276 PolarHBondContact O-N 2.88Å; G273-T276 PolarHBondContact O-OG1 3.18Å
274	C	85.8	Confident	85.9	Confident	79 Å²	79	27.5 Å²	27.5	53%	0.534	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-68.4	-11.9	-176.3	61.1	0	0	0	0	115.3	T272	T272-C274 PolarHBondContact O-N 3.33Å
275	E	90.5	Very high	84.6	Confident	8 Å²	8	27.7 Å²	27.7	4%	0.037	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-94.6	-4	177.6	-68.1	177.1	166.2	0	0	112.9	L33 R36 P49 P226 T272 G273	L33-E275 HydrophobicContact CD2-CG 4.26Å; R36-E275 IonicContact CZ-OE2 2.85Å; R36-E275 IonicContact NH1-OE2 3.81Å; R36-E275 PolarHBondContact NH1-OE2 3.4Å; R36-E275 IonicContact NH2-OE1 3.75Å; R36-E275 PolarHBondContact NH2-OE1 2.85Å; R36-E275 IonicContact NH2-OE2 3.46Å; R36-E275 PolarHBondContact NH2-OE2 3.16Å; P49-E275 WeakPolarHBondContact CD-OE2 3.19Å; P49-E275 HydrophobicContact CG-CB 4.42Å; P49-E275 VanDerWaalsContact CG-CD 3.42Å; P49-E275 HydrophobicContact CG-CG 3.8Å; P49-E275 WeakPolarHBondContact CG-OE2 3.44Å; P226-E275 HydrophobicContact CB-CB 4.29Å; P226-E275 HydrophobicContact CG-CB 4.06Å; P226-E275 HydrophobicContact CG-CG 4.23Å; T272-E275 PolarHBondContact O-N 3.18Å; T272-E275 VanDerWaalsContact O-N 3.16Å; G273-E275 PolarHBondContact O-N 3.36Å
276	T	89.8	Confident	83.5	Confident	4 Å²	4	32 Å²	32	3%	0.025	17%	0.172	C	C	.	.	S	Bend	trans	-71.1	143.1	175	60.7	0	0	0	0	110.9	A256 G273 S278 V279 M280	A256-T276 HydrophobicContact CB-CG2 4.02Å; G273-T276 PolarHBondContact O-N 2.88Å; G273-T276 PolarHBondContact O-OG1 3.18Å; T276-S278 PolarHBondContact O-N 2.96Å; T276-V279 PolarHBondContact O-N 3.34Å; T276-V279 VanDerWaalsContact O-N 3.12Å; T276-V279 WeakPolarHBondContact OG1-CG2 3.46Å; T276-M280 WeakPolarHBondContact O-CG 3.2Å; T276-M280 PolarHBondContact O-N 3.4Å
277	R	86.9	Confident	82.4	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-56.8	-35.4	178	-74	178.4	169.8	82.3	-2.7	113.2	D170 E224 Q227 D229 I230 S232 W255 M280 N281	D170-R277 PolarHBondContact OD2-N 3.32Å; D170-R277 IonicContact OD2-NH1 3.89Å; E224-R277 IonicContact OE1-NH2 2.67Å; Q227-R277 WeakPolarHBondContact O-CG 3.36Å; D229-R277 WeakPolarHBondContact O-CD 3.28Å; D229-R277 PolarHBondContact O-NE 3.24Å; I230-R277 HydrophobicContact CG2-CB 4.31Å; S232-R277 PolarHBondContact O-NH2 3.1Å; S232-R277 VanDerWaalsContact O-NH2 3.12Å; W255-R277 VanDerWaalsContact CH2-CZ 3.48Å; R277-M280 PolarHBondContact O-N 3.4Å; R277-N281 WeakPolarHBondContact O-CB 3.31Å; R277-N281 PolarHBondContact O-N 3.15Å; R277-N281 VanDerWaalsContact O-N 3.09Å; R277-N281 PolarHBondContact O-ND2 2.87Å
278	S	82.3	Confident	81.9	Confident	10 Å²	10	35.3 Å²	35.3	7%	0.07	19%	0.193	C	C	.	.	H	α-helix	trans	-62.4	-44.5	177.8	-176.8	0	0	0	0	111.9	N257 T276 N282	N257-S278 PolarHBondContact ND2-OG 2.79Å; T276-S278 PolarHBondContact O-N 2.96Å; S278-N282 PolarHBondContact O-N 3.31Å; S278-N282 PolarHBondContact O-ND2 3.01Å
279	V	81	Confident	81.3	Confident	56 Å²	56	37.3 Å²	37.3	34%	0.339	21%	0.205	S	C	.	.	H	α-helix	trans	-74.6	-37.1	178.9	177.3	0	0	0	0	111.5	T276 N281 N282	T276-V279 PolarHBondContact O-N 3.34Å; T276-V279 VanDerWaalsContact O-N 3.12Å; T276-V279 WeakPolarHBondContact OG1-CG2 3.46Å; V279-N281 VanDerWaalsContact C-N 3.25Å; V279-N281 PolarHBondContact O-N 3.46Å; V279-N282 PolarHBondContact O-N 3.49Å; V279-N282 VanDerWaalsContact O-N 3.08Å
280	M	80.8	Confident	80.9	Confident	60 Å²	60	37.3 Å²	37.3	30%	0.296	21%	0.205	S	C	.	.	H	α-helix	trans	-64.4	-28.3	177.3	-69	-178.2	71.6	0	0	113.3	L33 P226 T276 R277	L33-M280 HydrophobicContact CD1-CE 3.93Å; P226-M280 HydrophobicContact CB-SD 3.97Å; T276-M280 WeakPolarHBondContact O-CG 3.2Å; T276-M280 PolarHBondContact O-N 3.4Å; R277-M280 PolarHBondContact O-N 3.4Å
281	N	75.9	Confident	80.7	Confident	23 Å²	23	39.4 Å²	39.4	12%	0.123	22%	0.216	C	C	.	.	H	α-helix	trans	-85.4	-13.3	174.1	-78.4	-61.8	0	0	0	113.6	N228 R277 V279	N228-N281 PolarHBondContact O-ND2 3.15Å; R277-N281 WeakPolarHBondContact O-CB 3.31Å; R277-N281 PolarHBondContact O-N 3.15Å; R277-N281 VanDerWaalsContact O-N 3.09Å; R277-N281 PolarHBondContact O-ND2 2.87Å; V279-N281 VanDerWaalsContact C-N 3.25Å; V279-N281 PolarHBondContact O-N 3.46Å
282	N	72.2	Confident	80.5	Confident	58 Å²	58	39.4 Å²	39.4	31%	0.31	22%	0.216	S	C	.	.	S	Bend	trans	-80.8	137.3	175	-82.1	-25.4	0	0	0	111.3	S278 V279	S278-N282 PolarHBondContact O-N 3.31Å; S278-N282 PolarHBondContact O-ND2 3.01Å; V279-N282 PolarHBondContact O-N 3.49Å; V279-N282 VanDerWaalsContact O-N 3.08Å
283	S	64.9	Low	80.3	Confident	41 Å²	41	40 Å²	40	29%	0.287	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-72.4	154.5	172.7	-63.6	0	0	0	0	110.9	S821 Q824	S283-S821 WeakPolarHBondContact OG-CB 3.36Å; S283-Q824 VanDerWaalsContact C-OE1 3.25Å; S283-Q824 PolarHBondContact O-OE1 3.01Å
284	Q	65.8	Low	80.3	Confident	181 Å²	181	44.2 Å²	44.2	85%	0.846	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-73.2	134.3	172.9	-69.6	-174.1	-1.6	0	0	110	R286	Q284-R286 PolarHBondContact O-N 3.28Å; Q284-R286 VanDerWaalsContact O-N 3.12Å
285	P	63.2	Low	80.6	Confident	56 Å²	56	42.8 Å²	42.8	36%	0.364	23%	0.225	S	C	.	.			trans	-65.9	114.6	-178.4	24.9	-32.6	0	0	0	110.9
286	R	70.4	Confident	80.6	Confident	89 Å²	89	42.8 Å²	42.8	34%	0.336	23%	0.225	S	C	.	.			trans	-90.9	147.7	177.4	69.9	-175.5	-172.7	165.7	12.8	112.5	Q284 K288 Q824 Q825 A826	Q284-R286 PolarHBondContact O-N 3.28Å; Q284-R286 VanDerWaalsContact O-N 3.12Å; R286-K288 HydrophobicContact CG-CG 4.16Å; R286-K288 PolarHBondContact O-N 3.14Å; R286-Q824 PolarHBondContact NE-O 3.39Å; R286-Q825 PolarHBondContact NH1-O 2.9Å; R286-Q825 VanDerWaalsContact NH2-C 3.29Å; R286-Q825 PolarHBondContact NH2-O 3.32Å; R286-A826 PolarHBondContact NH2-O 2.83Å
287	S	70.6	Confident	80.6	Confident	54 Å²	54	43.8 Å²	43.8	38%	0.378	23%	0.23	S	C	.	.			trans	-80.5	111.2	168	-158.2	0	0	0	0	109.5	K57	K57-S287 PolarHBondContact NZ-OG 3.24Å
288	K	81.4	Confident	80.7	Confident	17 Å²	17	44.6 Å²	44.6	7%	0.074	24%	0.239	C	C	.	.			trans	-80.8	133.7	-178.1	-56.5	-171.1	-169.5	-174.1	0	110.4	R286 T373 I374 I823 Q824 A826 D827 D845	R286-K288 HydrophobicContact CG-CG 4.16Å; R286-K288 PolarHBondContact O-N 3.14Å; K288-T373 PolarHBondContact O-OG1 3.45Å; K288-T373 VanDerWaalsContact O-OG1 3.08Å; K288-I374 HydrophobicContact CB-CG2 3.92Å; K288-I374 HydrophobicContact CD-CD1 4.23Å; K288-I823 PolarHBondContact NZ-O 3.27Å; K288-Q824 VanDerWaalsContact CE-O 3.26Å; K288-Q824 WeakPolarHBondContact CE-O 3.27Å; K288-A826 VanDerWaalsContact CE-O 3.26Å; K288-A826 WeakPolarHBondContact CE-O 3.45Å; K288-A826 PolarHBondContact NZ-O 3.35Å; K288-D827 WeakPolarHBondContact CD-O 3.3Å; K288-D845 VanDerWaalsContact CD-OD2 3.3Å; K288-D845 WeakPolarHBondContact CD-OD2 3.41Å; K288-D845 WeakPolarHBondContact CE-OD2 3.37Å; K288-D845 IonicContact NZ-OD1 3.25Å; K288-D845 IonicContact NZ-OD2 3.54Å; K288-D845 PolarHBondContact NZ-OD2 2.82Å
289	V	82.3	Confident	81.2	Confident	43 Å²	43	44.4 Å²	44.4	26%	0.261	24%	0.238	S	C	.	.			trans	-115.2	136	178.3	-177.3	0	0	0	0	109	F74 D293 M294	F74-V289 HydrophobicContact CE1-CG1 4.13Å; F74-V289 HydrophobicContact CZ-CG1 4.14Å; F74-V289 HydrophobicContact CZ-CG2 4.14Å; V289-D293 HydrophobicContact CG1-CB 4.13Å; V289-M294 HydrophobicContact CB-CE 4.25Å; V289-M294 HydrophobicContact CG1-CE 3.86Å
290	G	85.6	Confident	81.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.222	C	C	.	.			trans	-68.5	148.6	179	0	0	0	0	0	113.5	L292 D293 M294 E377	G290-L292 VanDerWaalsContact C-N 3.28Å; G290-D293 PolarHBondContact O-N 3.09Å; G290-M294 PolarHBondContact O-N 3.01Å; G290-E377 VanDerWaalsContact CA-OE1 3.29Å; G290-E377 WeakPolarHBondContact CA-OE1 3.45Å
291	L	90	Very high	82.1	Confident	43 Å²	43	43.8 Å²	43.8	23%	0.225	23%	0.229	C	C	.	.	H	α-helix	trans	-56.4	-43.5	165.4	-172.5	56.6	0	0	0	111.4	D293 M294 E295 E377 R809	L291-D293 VanDerWaalsContact C-N 3.28Å; L291-D293 PolarHBondContact O-N 2.97Å; L291-M294 CarbonylContact O-C 3.49Å; L291-M294 WeakPolarHBondContact O-CA 3.4Å; L291-M294 WeakPolarHBondContact O-CB 3.4Å; L291-M294 PolarHBondContact O-N 3.02Å; L291-E295 HydrophobicContact CD1-CG 4.47Å; L291-E295 HydrophobicContact CG-CG 4.28Å; L291-E295 WeakPolarHBondContact O-CG 3.42Å; L291-E295 PolarHBondContact O-N 3.46Å; L291-E377 WeakPolarHBondContact CA-OE1 3.41Å; L291-E377 WeakPolarHBondContact CB-OE1 3.3Å; L291-E377 WeakPolarHBondContact CB-OE2 3.43Å; L291-E377 PolarHBondContact N-OE1 3.22Å; L291-E377 PolarHBondContact N-OE2 3.39Å; L291-R809 VanDerWaalsContact CA-NH2 3.3Å; L291-R809 VanDerWaalsContact CD1-NH2 3.28Å
292	L	90.3	Very high	82.9	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-40.7	-178.1	-174.9	149.1	0	0	0	110.7	G290 M294 E295 I296 E376 Y866 L949	G290-L292 VanDerWaalsContact C-N 3.28Å; L292-M294 VanDerWaalsContact C-N 3.31Å; L292-M294 PolarHBondContact O-N 3.39Å; L292-E295 PolarHBondContact O-N 2.81Å; L292-I296 HydrophobicContact CD2-CD1 3.37Å; L292-I296 HydrophobicContact CD2-CG1 4.12Å; L292-I296 HydrophobicContact CG-CD1 4.38Å; L292-I296 WeakPolarHBondContact O-CB 3.39Å; L292-I296 VanDerWaalsContact O-CG1 3.3Å; L292-I296 WeakPolarHBondContact O-CG1 3.4Å; L292-I296 PolarHBondContact O-N 3.42Å; L292-E376 HydrophobicContact CB-CG 4.19Å; L292-E376 WeakPolarHBondContact CD2-OE2 3.47Å; L292-Y866 HydrophobicContact CD1-CD2 3.88Å; L292-Y866 HydrophobicContact CD1-CE2 3.94Å; L292-L949 HydrophobicContact CG-CD2 4.02Å
293	D	89	Confident	83.9	Confident	14 Å²	14	42.7 Å²	42.7	8%	0.075	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-40.5	172.9	-72.4	-23.4	0	0	0	112.1	V289 G290 L291 N297 R344 K351	V289-D293 HydrophobicContact CG1-CB 4.13Å; G290-D293 PolarHBondContact O-N 3.09Å; L291-D293 VanDerWaalsContact C-N 3.28Å; L291-D293 PolarHBondContact O-N 2.97Å; D293-N297 VanDerWaalsContact O-CB 3.31Å; D293-N297 WeakPolarHBondContact O-CB 3.37Å; D293-N297 PolarHBondContact O-N 3.31Å; D293-R344 IonicContact OD1-NH1 3.07Å; D293-R344 IonicContact OD2-NH1 3.93Å; D293-K351 IonicContact OD1-NZ 3.97Å; D293-K351 PolarHBondContact OD1-NZ 3.31Å; D293-K351 IonicContact OD2-NZ 3.92Å; D293-K351 PolarHBondContact OD2-NZ 3.08Å
294	M	88.6	Confident	85.2	Confident	90 Å²	90	43.4 Å²	43.4	44%	0.443	22%	0.223	S	C	.	.	H	α-helix	trans	-69.8	-39.8	177.3	-66.1	-63.8	-170.8	0	0	112.5	V289 G290 L291 L292 N297 G298	V289-M294 HydrophobicContact CB-CE 4.25Å; V289-M294 HydrophobicContact CG1-CE 3.86Å; G290-M294 PolarHBondContact O-N 3.01Å; L291-M294 CarbonylContact O-C 3.49Å; L291-M294 WeakPolarHBondContact O-CA 3.4Å; L291-M294 WeakPolarHBondContact O-CB 3.4Å; L291-M294 PolarHBondContact O-N 3.02Å; L292-M294 VanDerWaalsContact C-N 3.31Å; L292-M294 PolarHBondContact O-N 3.39Å; M294-N297 WeakPolarHBondContact O-CB 3.39Å; M294-N297 PolarHBondContact O-N 2.86Å; M294-G298 PolarHBondContact O-N 3.35Å
295	E	90.9	Very high	86.6	Confident	49 Å²	49	38.8 Å²	38.8	23%	0.229	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-46.5	174.4	-72.9	176.1	168	0	0	110.4	L291 L292 N297 G298 L299 R380 L949	L291-E295 HydrophobicContact CD1-CG 4.47Å; L291-E295 HydrophobicContact CG-CG 4.28Å; L291-E295 WeakPolarHBondContact O-CG 3.42Å; L291-E295 PolarHBondContact O-N 3.46Å; L292-E295 PolarHBondContact O-N 2.81Å; E295-N297 PolarHBondContact O-N 3.07Å; E295-G298 WeakPolarHBondContact O-CA 3.1Å; E295-G298 PolarHBondContact O-N 3.34Å; E295-G298 VanDerWaalsContact O-N 3.09Å; E295-L299 PolarHBondContact O-N 3.31Å; E295-R380 IonicContact OE1-NH2 3.66Å; E295-L949 HydrophobicContact CB-CD2 4.2Å
296	I	90.1	Very high	88	Confident	7 Å²	7	38.4 Å²	38.4	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-44.8	174.8	-70.5	178.8	0	0	0	111	L292 G298 L299 T300 L343 L347 S873 L949	L292-I296 HydrophobicContact CD2-CD1 3.37Å; L292-I296 HydrophobicContact CD2-CG1 4.12Å; L292-I296 HydrophobicContact CG-CD1 4.38Å; L292-I296 WeakPolarHBondContact O-CB 3.39Å; L292-I296 VanDerWaalsContact O-CG1 3.3Å; L292-I296 WeakPolarHBondContact O-CG1 3.4Å; L292-I296 PolarHBondContact O-N 3.42Å; I296-G298 PolarHBondContact O-N 2.73Å; I296-L299 PolarHBondContact O-N 2.97Å; I296-T300 PolarHBondContact O-N 2.79Å; I296-T300 PolarHBondContact O-OG1 2.92Å; I296-L343 HydrophobicContact CG2-CD2 3.75Å; I296-L347 HydrophobicContact CD1-CD1 3.38Å; I296-S873 WeakPolarHBondContact CD1-OG 3.37Å; I296-L949 HydrophobicContact CD1-CD2 4.43Å; I296-L949 HydrophobicContact CG1-CD2 3.75Å
297	N	89.6	Confident	89.1	Confident	25 Å²	25	34.2 Å²	34.2	13%	0.134	20%	0.196	C	C	.	.	H	α-helix	trans	-58.9	-35.7	176	-171.5	55	0	0	0	111.7	F75 D293 M294 E295 K301	F75-N297 WeakPolarHBondContact CB-OD1 3.24Å; D293-N297 VanDerWaalsContact O-CB 3.31Å; D293-N297 WeakPolarHBondContact O-CB 3.37Å; D293-N297 PolarHBondContact O-N 3.31Å; M294-N297 WeakPolarHBondContact O-CB 3.39Å; M294-N297 PolarHBondContact O-N 2.86Å; E295-N297 PolarHBondContact O-N 3.07Å; N297-K301 WeakPolarHBondContact O-CG 3.21Å; N297-K301 PolarHBondContact O-N 3.45Å
298	G	90.8	Very high	90.2	Very high	19 Å²	19	35.5 Å²	35.5	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-45.8	170.7	0	0	0	0	0	113.3	M294 E295 I296 K301 V302	M294-G298 PolarHBondContact O-N 3.35Å; E295-G298 WeakPolarHBondContact O-CA 3.1Å; E295-G298 PolarHBondContact O-N 3.34Å; E295-G298 VanDerWaalsContact O-N 3.09Å; I296-G298 PolarHBondContact O-N 2.73Å; G298-K301 PolarHBondContact O-N 3.39Å; G298-V302 PolarHBondContact O-N 3.2Å
299	L	91.1	Very high	90.8	Very high	7 Å²	7	36.3 Å²	36.3	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-64.1	-40.4	176.3	-64.2	178.3	0	0	0	112.2	E295 I296 K301 V302 L303 L949 Y951 F954	E295-L299 PolarHBondContact O-N 3.31Å; I296-L299 PolarHBondContact O-N 2.97Å; L299-K301 VanDerWaalsContact C-N 3.3Å; L299-K301 PolarHBondContact O-N 2.9Å; L299-V302 WeakPolarHBondContact O-CB 3.28Å; L299-V302 PolarHBondContact O-N 3.3Å; L299-V302 VanDerWaalsContact O-N 3.09Å; L299-L303 PolarHBondContact O-N 2.94Å; L299-L949 HydrophobicContact CD1-CD1 4.12Å; L299-L949 HydrophobicContact CD1-CG 4.22Å; L299-Y951 HydrophobicContact CD2-CD1 3.74Å; L299-Y951 HydrophobicContact CD2-CE1 3.67Å; L299-F954 HydrophobicContact CB-CD2 4.47Å; L299-F954 HydrophobicContact CB-CE2 4.34Å; L299-F954 HydrophobicContact CD1-CB 4.43Å; L299-F954 HydrophobicContact CD1-CD2 4Å; L299-F954 HydrophobicContact CD1-CG 4.37Å; L299-F954 HydrophobicContact CD2-CB 4.07Å; L299-F954 HydrophobicContact CD2-CD1 4.03Å; L299-F954 HydrophobicContact CD2-CD2 4Å; L299-F954 HydrophobicContact CD2-CE1 4.47Å; L299-F954 HydrophobicContact CD2-CE2 4.44Å; L299-F954 HydrophobicContact CD2-CG 3.76Å; L299-F954 HydrophobicContact CG-CD2 4.39Å
300	T	89.9	Confident	91.3	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-59.2	-39.3	175.6	-61.6	0	0	0	0	112	F75 L76 I296 V302 L303 F304 I339	F75-T300 HydrophobicContact CD1-CG2 4.05Å; F75-T300 HydrophobicContact CE1-CG2 4.24Å; L76-T300 HydrophobicContact CB-CG2 4.32Å; L76-T300 HydrophobicContact CD1-CG2 3.59Å; I296-T300 PolarHBondContact O-N 2.79Å; I296-T300 PolarHBondContact O-OG1 2.92Å; T300-V302 VanDerWaalsContact C-N 3.34Å; T300-V302 PolarHBondContact O-N 2.76Å; T300-L303 PolarHBondContact O-N 3.26Å; T300-F304 WeakPolarHBondContact O-CB 3.3Å; T300-F304 PolarHBondContact O-N 2.95Å; T300-I339 HydrophobicContact CG2-CD1 3.96Å; T300-I339 HydrophobicContact CG2-CG2 3.84Å
301	K	91.8	Very high	91.7	Very high	102 Å²	102	36.9 Å²	36.9	44%	0.443	21%	0.212	S	C	.	.	H	α-helix	trans	-63.1	-40.1	174.3	-69.8	171.3	-175.1	-177.5	0	111.9	F75 N297 G298 L299 F304 C305	F75-K301 HydrophobicContact CD1-CG 3.8Å; F75-K301 HydrophobicContact CE1-CG 4.07Å; F75-K301 HydrophobicContact CG-CG 4.19Å; N297-K301 WeakPolarHBondContact O-CG 3.21Å; N297-K301 PolarHBondContact O-N 3.45Å; G298-K301 PolarHBondContact O-N 3.39Å; L299-K301 VanDerWaalsContact C-N 3.3Å; L299-K301 PolarHBondContact O-N 2.9Å; K301-F304 PolarHBondContact O-N 2.91Å; K301-C305 PolarHBondContact O-N 2.78Å; K301-C305 PolarHBondContact O-SG 3.2Å; K301-C305 VanDerWaalsContact O-SG 3.39Å
302	V	92.9	Very high	91.9	Very high	51 Å²	51	38.2 Å²	38.2	31%	0.309	22%	0.219	S	C	.	.	H	α-helix	trans	-63.7	-44.9	175.4	175.9	0	0	0	0	110.9	G298 L299 T300 F304 C305 A306 Y951 F954	G298-V302 PolarHBondContact O-N 3.2Å; L299-V302 WeakPolarHBondContact O-CB 3.28Å; L299-V302 PolarHBondContact O-N 3.3Å; L299-V302 VanDerWaalsContact O-N 3.09Å; T300-V302 VanDerWaalsContact C-N 3.34Å; T300-V302 PolarHBondContact O-N 2.76Å; V302-F304 VanDerWaalsContact C-N 3.32Å; V302-F304 PolarHBondContact O-N 3.4Å; V302-C305 PolarHBondContact O-N 2.85Å; V302-A306 PolarHBondContact O-N 3.5Å; V302-Y951 HydrophobicContact CG2-CE1 4.11Å; V302-F954 HydrophobicContact CG1-CE1 4.36Å
303	L	92	Very high	92	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-40.5	175.5	-70.5	174.9	0	0	0	112	L299 T300 A306 V307 I338 I339 I877 L881 F954	L299-L303 PolarHBondContact O-N 2.94Å; T300-L303 PolarHBondContact O-N 3.26Å; L303-A306 CarbonylContact O-C 3.5Å; L303-A306 WeakPolarHBondContact O-CA 3.39Å; L303-A306 WeakPolarHBondContact O-CB 3.45Å; L303-A306 PolarHBondContact O-N 3.07Å; L303-A306 VanDerWaalsContact O-N 3.11Å; L303-V307 WeakPolarHBondContact O-CG2 3.4Å; L303-V307 PolarHBondContact O-N 3.48Å; L303-I338 HydrophobicContact CD2-CD1 4.03Å; L303-I338 HydrophobicContact CD2-CG1 4.16Å; L303-I339 HydrophobicContact CB-CD1 4.23Å; L303-I339 HydrophobicContact CB-CG1 3.95Å; L303-I339 HydrophobicContact CD1-CG1 4.5Å; L303-I877 HydrophobicContact CD1-CG2 4Å; L303-L881 HydrophobicContact CD2-CD2 4.07Å; L303-F954 HydrophobicContact CD1-CE2 4.25Å; L303-F954 HydrophobicContact CD1-CZ 4.42Å; L303-F954 HydrophobicContact CD2-CE2 4.07Å; L303-F954 HydrophobicContact CD2-CZ 3.58Å; L303-F954 HydrophobicContact CG-CE2 4.14Å; L303-F954 HydrophobicContact CG-CZ 3.81Å
304	F	92.8	Very high	92.1	Very high	56 Å²	56	41.5 Å²	41.5	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-44.7	175.9	176.2	-101.4	0	0	0	112.2	F75 Y79 T300 K301 V302 A306 V307 L308 I339	F75-F304 HydrophobicContact CE1-CB 3.89Å; F75-F304 HydrophobicContact CE1-CG 4.11Å; F75-F304 HydrophobicContact CZ-CB 3.94Å; F75-F304 AromaticContact CZ-CD1 3.73Å; F75-F304 HydrophobicContact CZ-CD1 3.73Å; F75-F304 HydrophobicContact CZ-CD2 4.1Å; F75-F304 HydrophobicContact CZ-CE1 4.23Å; F75-F304 AromaticContact CZ-CG 3.64Å; F75-F304 HydrophobicContact CZ-CG 3.64Å; Y79-F304 AromaticContact CD2-CD2 3.65Å; Y79-F304 HydrophobicContact CD2-CD2 3.65Å; Y79-F304 AromaticContact CD2-CE2 3.79Å; Y79-F304 HydrophobicContact CD2-CE2 3.79Å; Y79-F304 AromaticContact CE2-CD2 3.53Å; Y79-F304 HydrophobicContact CE2-CD2 3.53Å; Y79-F304 AromaticContact CE2-CE2 3.73Å; Y79-F304 HydrophobicContact CE2-CE2 3.73Å; T300-F304 WeakPolarHBondContact O-CB 3.3Å; T300-F304 PolarHBondContact O-N 2.95Å; K301-F304 PolarHBondContact O-N 2.91Å; V302-F304 VanDerWaalsContact C-N 3.32Å; V302-F304 PolarHBondContact O-N 3.4Å; F304-A306 PolarHBondContact O-N 3.38Å; F304-V307 WeakPolarHBondContact O-CB 3.21Å; F304-V307 PolarHBondContact O-N 3.34Å; F304-L308 HydrophobicContact CD1-CD1 4.19Å; F304-L308 HydrophobicContact CE1-CD1 3.54Å; F304-L308 HydrophobicContact CE1-CG 4.22Å; F304-L308 HydrophobicContact CZ-CD1 3.81Å; F304-L308 HydrophobicContact CZ-CD2 4.37Å; F304-L308 HydrophobicContact CZ-CG 4.19Å; F304-L308 PolarHBondContact O-N 2.62Å; F304-L308 VanDerWaalsContact O-N 3.13Å; F304-I339 HydrophobicContact CB-CD1 4.06Å
305	C	94.4	Very high	92.3	Very high	84 Å²	84	37.3 Å²	37.3	57%	0.568	22%	0.218	S	C	*	.	H	α-helix	trans	-60.3	-37.1	172.9	-67.1	0	0	0	0	111.8	K301 V302 L308 G309	K301-C305 PolarHBondContact O-N 2.78Å; K301-C305 PolarHBondContact O-SG 3.2Å; K301-C305 VanDerWaalsContact O-SG 3.39Å; V302-C305 PolarHBondContact O-N 2.85Å; C305-L308 PolarHBondContact O-N 3Å; C305-G309 PolarHBondContact O-N 2.83Å
306	A	92.6	Very high	92.4	Very high	49 Å²	49	40 Å²	40	41%	0.405	23%	0.233	S	C	.	.	H	α-helix	trans	-65.5	-37.8	175.1	0	0	0	0	0	112.6	V302 L303 F304 G309 L310	V302-A306 PolarHBondContact O-N 3.5Å; L303-A306 CarbonylContact O-C 3.5Å; L303-A306 WeakPolarHBondContact O-CA 3.39Å; L303-A306 WeakPolarHBondContact O-CB 3.45Å; L303-A306 PolarHBondContact O-N 3.07Å; L303-A306 VanDerWaalsContact O-N 3.11Å; F304-A306 PolarHBondContact O-N 3.38Å; A306-G309 PolarHBondContact O-N 3.29Å; A306-L310 VanDerWaalsContact O-CB 3.3Å; A306-L310 WeakPolarHBondContact O-CB 3.38Å; A306-L310 PolarHBondContact O-N 3.29Å
307	V	93.4	Very high	92.4	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-58.5	-50.7	172.3	174.6	0	0	0	0	110.8	L303 F304 G309 L310 S311 V332 F335 I338	L303-V307 WeakPolarHBondContact O-CG2 3.4Å; L303-V307 PolarHBondContact O-N 3.48Å; F304-V307 WeakPolarHBondContact O-CB 3.21Å; F304-V307 PolarHBondContact O-N 3.34Å; V307-G309 VanDerWaalsContact C-N 3.32Å; V307-G309 PolarHBondContact O-N 2.95Å; V307-L310 PolarHBondContact O-N 2.58Å; V307-S311 WeakPolarHBondContact O-CB 3.43Å; V307-S311 PolarHBondContact O-N 2.72Å; V307-S311 PolarHBondContact O-OG 2.74Å; V307-V332 HydrophobicContact CG1-CB 4.37Å; V307-V332 HydrophobicContact CG1-CG1 3.98Å; V307-F335 HydrophobicContact CG1-CB 4.16Å; V307-I338 HydrophobicContact CG2-CB 4.42Å; V307-I338 HydrophobicContact CG2-CG2 3.22Å
308	L	94.2	Very high	92.4	Very high	80 Å²	80	47.5 Å²	47.5	42%	0.419	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-43.2	-179.2	-65.5	-179	0	0	0	111.1	F304 C305 L312 V332	F304-L308 HydrophobicContact CD1-CD1 4.19Å; F304-L308 HydrophobicContact CE1-CD1 3.54Å; F304-L308 HydrophobicContact CE1-CG 4.22Å; F304-L308 HydrophobicContact CZ-CD1 3.81Å; F304-L308 HydrophobicContact CZ-CD2 4.37Å; F304-L308 HydrophobicContact CZ-CG 4.19Å; F304-L308 PolarHBondContact O-N 2.62Å; F304-L308 VanDerWaalsContact O-N 3.13Å; C305-L308 PolarHBondContact O-N 3Å; L308-L312 VanDerWaalsContact O-CB 3.32Å; L308-L312 WeakPolarHBondContact O-CB 3.45Å; L308-L312 PolarHBondContact O-N 2.97Å; L308-V332 HydrophobicContact CD2-CG2 4.04Å
309	G	94.9	Very high	92.3	Very high	34 Å²	34	48 Å²	48	35%	0.351	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-48.4	176.2	0	0	0	0	0	112.8	C305 A306 V307 S311 L312 V313	C305-G309 PolarHBondContact O-N 2.83Å; A306-G309 PolarHBondContact O-N 3.29Å; V307-G309 VanDerWaalsContact C-N 3.32Å; V307-G309 PolarHBondContact O-N 2.95Å; G309-S311 PolarHBondContact O-N 3.22Å; G309-L312 WeakPolarHBondContact O-CB 3.18Å; G309-L312 PolarHBondContact O-N 3.15Å; G309-V313 WeakPolarHBondContact O-CG2 3.42Å; G309-V313 PolarHBondContact O-N 3.04Å
310	L	92.6	Very high	92.2	Very high	54 Å²	54	53 Å²	53	28%	0.283	30%	0.295	S	S	.	.	H	α-helix	trans	-63.9	-42.9	179.9	-176.1	63.9	0	0	0	111.7	A306 V307 L312 V313 M314 F335 T884 A888	A306-L310 VanDerWaalsContact O-CB 3.3Å; A306-L310 WeakPolarHBondContact O-CB 3.38Å; A306-L310 PolarHBondContact O-N 3.29Å; V307-L310 PolarHBondContact O-N 2.58Å; L310-L312 VanDerWaalsContact C-N 3.32Å; L310-L312 PolarHBondContact O-N 3.48Å; L310-V313 PolarHBondContact O-N 3.27Å; L310-M314 WeakPolarHBondContact O-CG 3.38Å; L310-M314 PolarHBondContact O-N 3.25Å; L310-F335 HydrophobicContact CB-CD2 4.2Å; L310-F335 HydrophobicContact CB-CE2 4.46Å; L310-F335 HydrophobicContact CD2-CB 4.41Å; L310-F335 HydrophobicContact CD2-CD1 4.05Å; L310-F335 HydrophobicContact CD2-CD2 3.68Å; L310-F335 HydrophobicContact CD2-CE1 4.22Å; L310-F335 HydrophobicContact CD2-CE2 3.88Å; L310-F335 HydrophobicContact CD2-CG 3.78Å; L310-F335 HydrophobicContact CD2-CZ 4.15Å; L310-F335 HydrophobicContact CG-CD2 3.76Å; L310-F335 HydrophobicContact CG-CE2 3.68Å; L310-F335 HydrophobicContact CG-CG 4.38Å; L310-F335 HydrophobicContact CG-CZ 4.23Å; L310-T884 HydrophobicContact CD2-CG2 4.29Å; L310-A888 HydrophobicContact CD2-CB 4.18Å
311	S	93.6	Very high	91.8	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.007	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-39.3	174.8	-64.1	0	0	0	0	112.5	V307 G309 M314 M315 F331 V332 F335	V307-S311 WeakPolarHBondContact O-CB 3.43Å; V307-S311 PolarHBondContact O-N 2.72Å; V307-S311 PolarHBondContact O-OG 2.74Å; G309-S311 PolarHBondContact O-N 3.22Å; S311-M314 PolarHBondContact O-N 3.44Å; S311-M315 WeakPolarHBondContact O-CB 3.28Å; S311-M315 PolarHBondContact O-N 3.07Å; S311-F331 PolarHBondContact OG-O 3.49Å; S311-V332 VanDerWaalsContact OG-CA 3.23Å; S311-V332 WeakPolarHBondContact OG-CA 3.1Å; S311-V332 WeakPolarHBondContact OG-CG2 3.49Å; S311-V332 PolarHBondContact OG-N 3.48Å; S311-F335 WeakPolarHBondContact OG-CD2 3.46Å
312	L	93.9	Very high	91.4	Very high	71 Å²	71	53.8 Å²	53.8	37%	0.372	33%	0.332	S	S	.	.	H	α-helix	trans	-65	-44.3	175.4	-177.7	65.7	0	0	0	111.1	L308 G309 L310 M314 M315 M316	L308-L312 VanDerWaalsContact O-CB 3.32Å; L308-L312 WeakPolarHBondContact O-CB 3.45Å; L308-L312 PolarHBondContact O-N 2.97Å; G309-L312 WeakPolarHBondContact O-CB 3.18Å; G309-L312 PolarHBondContact O-N 3.15Å; L310-L312 VanDerWaalsContact C-N 3.32Å; L310-L312 PolarHBondContact O-N 3.48Å; L312-M314 PolarHBondContact O-N 3.23Å; L312-M315 PolarHBondContact O-N 3.07Å; L312-M316 HydrophobicContact CD1-CE 4.04Å; L312-M316 HydrophobicContact CD2-CE 3.9Å; L312-M316 HydrophobicContact CG-CE 3.82Å; L312-M316 HydrophobicContact CG-CG 4.5Å; L312-M316 HydrophobicContact CG-SD 4.33Å; L312-M316 WeakPolarHBondContact O-CB 3.3Å; L312-M316 WeakPolarHBondContact O-CG 3.47Å; L312-M316 PolarHBondContact O-N 3.46Å
313	V	93.4	Very high	91.2	Very high	75 Å²	75	53.6 Å²	53.6	46%	0.455	33%	0.333	S	S	.	.	H	α-helix	trans	-59.8	-47	176.1	169.9	0	0	0	0	110.7	G309 L310 M315 M316 L317	G309-V313 WeakPolarHBondContact O-CG2 3.42Å; G309-V313 PolarHBondContact O-N 3.04Å; L310-V313 PolarHBondContact O-N 3.27Å; V313-M315 VanDerWaalsContact C-N 3.29Å; V313-M315 PolarHBondContact O-N 3.15Å; V313-M316 PolarHBondContact O-N 3.35Å; V313-L317 HydrophobicContact CG1-CD1 4Å; V313-L317 HydrophobicContact CG1-CG 4.41Å; V313-L317 VanDerWaalsContact O-CG 3.31Å; V313-L317 WeakPolarHBondContact O-CG 3.43Å; V313-L317 PolarHBondContact O-N 3.39Å
314	M	91.4	Very high	91	Very high	10 Å²	10	58.6 Å²	58.6	5%	0.049	35%	0.351	C	S	.	.	H	α-helix	trans	-60.5	-39.3	176.2	-70.2	-58.5	-166.3	0	0	112.3	L310 S311 L312 K318 F331 F335 A888 A892 L896	L310-M314 WeakPolarHBondContact O-CG 3.38Å; L310-M314 PolarHBondContact O-N 3.25Å; S311-M314 PolarHBondContact O-N 3.44Å; L312-M314 PolarHBondContact O-N 3.23Å; M314-K318 VanDerWaalsContact O-CB 3.3Å; M314-K318 WeakPolarHBondContact O-CB 3.41Å; M314-K318 PolarHBondContact O-N 3.04Å; M314-F331 HydrophobicContact CB-CD1 4.2Å; M314-F331 HydrophobicContact CB-CD2 4.01Å; M314-F331 HydrophobicContact CB-CE1 4.23Å; M314-F331 HydrophobicContact CB-CE2 4.03Å; M314-F331 HydrophobicContact CB-CG 4.11Å; M314-F331 HydrophobicContact CB-CZ 4.13Å; M314-F335 HydrophobicContact CB-CE2 4.5Å; M314-F335 HydrophobicContact CE-CZ 3.91Å; M314-F335 HydrophobicContact CG-CE2 3.72Å; M314-F335 HydrophobicContact CG-CZ 3.82Å; M314-A888 HydrophobicContact CE-CB 3.87Å; M314-A888 WeakPolarHBondContact CE-O 3.27Å; M314-A892 HydrophobicContact CE-CB 4.28Å; M314-L896 HydrophobicContact SD-CD2 3.74Å
315	M	92.4	Very high	90.8	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-68.3	-40.6	177	-167.7	64.1	-121.7	0	0	112.2	S311 L312 V313 K318 G319 F320 W324 M328	S311-M315 WeakPolarHBondContact O-CB 3.28Å; S311-M315 PolarHBondContact O-N 3.07Å; L312-M315 PolarHBondContact O-N 3.07Å; V313-M315 VanDerWaalsContact C-N 3.29Å; V313-M315 PolarHBondContact O-N 3.15Å; M315-K318 HydrophobicContact CE-CB 4.48Å; M315-K318 PolarHBondContact O-N 3.15Å; M315-G319 WeakPolarHBondContact CE-O 3.18Å; M315-G319 PolarHBondContact O-N 3.27Å; M315-F320 HydrophobicContact CG-CD1 4.34Å; M315-F320 HydrophobicContact CG-CE1 4.08Å; M315-W324 HydrophobicContact CE-CB 3.59Å; M315-W324 HydrophobicContact SD-CB 4.11Å; M315-W324 VanDerWaalsContact SD-O 3.33Å; M315-M328 HydrophobicContact CG-CB 4.33Å; M315-M328 HydrophobicContact SD-CB 4.42Å
316	M	91.9	Very high	90.6	Very high	107 Å²	107	60.9 Å²	60.9	53%	0.527	35%	0.347	S	S	.	.	H	α-helix	trans	-62.5	-44.8	175.5	-75.5	179.5	174.1	0	0	111.4	L312 V313 K318 G319 F320	L312-M316 HydrophobicContact CD1-CE 4.04Å; L312-M316 HydrophobicContact CD2-CE 3.9Å; L312-M316 HydrophobicContact CG-CE 3.82Å; L312-M316 HydrophobicContact CG-CG 4.5Å; L312-M316 HydrophobicContact CG-SD 4.33Å; L312-M316 WeakPolarHBondContact O-CB 3.3Å; L312-M316 WeakPolarHBondContact O-CG 3.47Å; L312-M316 PolarHBondContact O-N 3.46Å; V313-M316 PolarHBondContact O-N 3.35Å; M316-K318 VanDerWaalsContact C-N 3.32Å; M316-K318 PolarHBondContact O-N 3.24Å; M316-G319 PolarHBondContact O-N 3.44Å; M316-F320 HydrophobicContact CG-CE2 3.99Å; M316-F320 HydrophobicContact CG-CZ 3.79Å
317	L	91.4	Very high	90.4	Very high	119 Å²	119	62.3 Å²	62.3	62%	0.623	34%	0.342	S	S	*	.	H	α-helix	trans	-65.1	-36	177	-68.6	174.1	0	0	0	112.1	V313 G319 L896	V313-L317 HydrophobicContact CG1-CD1 4Å; V313-L317 HydrophobicContact CG1-CG 4.41Å; V313-L317 VanDerWaalsContact O-CG 3.31Å; V313-L317 WeakPolarHBondContact O-CG 3.43Å; V313-L317 PolarHBondContact O-N 3.39Å; L317-G319 VanDerWaalsContact C-N 3.29Å; L317-L896 VanDerWaalsContact C-CD1 3.41Å; L317-L896 HydrophobicContact CB-CD1 3.7Å; L317-L896 HydrophobicContact CB-CD2 4.27Å; L317-L896 WeakPolarHBondContact O-CD1 3.35Å
318	K	88.8	Confident	90.2	Very high	70 Å²	70	64.4 Å²	64.4	30%	0.304	35%	0.352	S	S	.	.	H	α-helix	trans	-72.7	-26.9	178.4	-174.1	172.4	-173.6	154.7	0	112.2	M314 M315 M316 F331 L896	M314-K318 VanDerWaalsContact O-CB 3.3Å; M314-K318 WeakPolarHBondContact O-CB 3.41Å; M314-K318 PolarHBondContact O-N 3.04Å; M315-K318 HydrophobicContact CE-CB 4.48Å; M315-K318 PolarHBondContact O-N 3.15Å; M316-K318 VanDerWaalsContact C-N 3.32Å; M316-K318 PolarHBondContact O-N 3.24Å; K318-F331 HydrophobicContact CD-CE2 4.22Å; K318-F331 HydrophobicContact CD-CZ 4.42Å; K318-L896 HydrophobicContact CB-CB 4.02Å; K318-L896 HydrophobicContact CB-CD1 4.03Å; K318-L896 HydrophobicContact CD-CB 4.35Å; K318-L896 WeakPolarHBondContact CD-O 3.09Å; K318-L896 HydrophobicContact CG-CB 4.2Å; K318-L896 PolarHBondContact NZ-O 3Å
319	G	88.1	Confident	90.1	Very high	30 Å²	30	65.3 Å²	65.3	31%	0.309	35%	0.353	S	S	.	.			trans	87.4	147.9	-173.8	0	0	0	0	0	112.5	M315 M316 L317 G321	M315-G319 WeakPolarHBondContact CE-O 3.18Å; M315-G319 PolarHBondContact O-N 3.27Å; M316-G319 PolarHBondContact O-N 3.44Å; L317-G319 VanDerWaalsContact C-N 3.29Å; G319-G321 PolarHBondContact O-N 3.14Å
320	F	89.5	Confident	89.9	Confident	111 Å²	111	67 Å²	67	49%	0.487	35%	0.349	S	S	.	.	S	Bend	trans	-80.1	23.9	-175.2	-65	-86.1	0	0	0	114.4	M315 M316 W324	M315-F320 HydrophobicContact CG-CD1 4.34Å; M315-F320 HydrophobicContact CG-CE1 4.08Å; M316-F320 HydrophobicContact CG-CE2 3.99Å; M316-F320 HydrophobicContact CG-CZ 3.79Å; F320-W324 HydrophobicContact CD1-CB 4.23Å; F320-W324 HydrophobicContact CD1-CD2 4.27Å; F320-W324 HydrophobicContact CD1-CE3 4.39Å; F320-W324 HydrophobicContact CD1-CG 4.21Å
321	G	82.5	Confident	89.9	Confident	59 Å²	59	64.5 Å²	64.5	61%	0.608	34%	0.336	S	S	*	.			trans	-74.7	137.3	178.1	0	0	0	0	0	112.5	G319	G319-G321 PolarHBondContact O-N 3.14Å
322	G	82.9	Confident	89.8	Confident	60 Å²	60	65.1 Å²	65.1	62%	0.619	34%	0.34	S	S	*	.	S	Bend	trans	73.5	-155.4	178.5	0	0	0	0	0	113.8	W324	G322-W324 PolarHBondContact O-N 2.79Å
323	P	87.4	Confident	89.7	Confident	48 Å²	48	61.9 Å²	61.9	31%	0.312	32%	0.323	S	S	.	.	S	Bend	trans	-75.9	68.7	-178.8	32.9	-35.8	0	0	0	111.3	Y325 R326 Y327	P323-Y325 HydrophobicContact CB-CE1 4.01Å; P323-Y325 PolarHBondContact O-N 2.98Å; P323-R326 HydrophobicContact CB-CB 4.43Å; P323-R326 HydrophobicContact CB-CG 4Å; P323-R326 WeakPolarHBondContact O-CB 3.27Å; P323-R326 PolarHBondContact O-N 2.9Å; P323-Y327 HydrophobicContact CG-CE2 4.37Å; P323-Y327 PolarHBondContact O-N 3.39Å
324	W	88.8	Confident	89.5	Confident	110 Å²	110	58.6 Å²	58.6	42%	0.417	30%	0.302	S	S	.	.	H	α-helix	trans	-54	-36.2	-176.5	63.8	-94.6	0	0	0	112.9	M315 F320 G322 R326 Y327 M328	M315-W324 HydrophobicContact CE-CB 3.59Å; M315-W324 HydrophobicContact SD-CB 4.11Å; M315-W324 VanDerWaalsContact SD-O 3.33Å; F320-W324 HydrophobicContact CD1-CB 4.23Å; F320-W324 HydrophobicContact CD1-CD2 4.27Å; F320-W324 HydrophobicContact CD1-CE3 4.39Å; F320-W324 HydrophobicContact CD1-CG 4.21Å; G322-W324 PolarHBondContact O-N 2.79Å; W324-R326 VanDerWaalsContact C-N 3.3Å; W324-R326 PolarHBondContact O-N 2.74Å; W324-Y327 PolarHBondContact O-N 3.48Å; W324-M328 HydrophobicContact CE3-SD 4.43Å; W324-M328 HydrophobicContact CZ3-CE 4.03Å; W324-M328 HydrophobicContact CZ3-SD 3.92Å; W324-M328 WeakPolarHBondContact O-CB 3.4Å; W324-M328 PolarHBondContact O-N 3.1Å
325	Y	88.6	Confident	89.6	Confident	98 Å²	98	58.1 Å²	58.1	38%	0.384	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-37	178.7	64.9	-88.8	0	0	0	111.9	P323 M328 F329	P323-Y325 HydrophobicContact CB-CE1 4.01Å; P323-Y325 PolarHBondContact O-N 2.98Å; Y325-M328 PolarHBondContact O-N 3.48Å; Y325-F329 WeakPolarHBondContact O-CD2 3.45Å; Y325-F329 PolarHBondContact O-N 3.26Å
326	R	89.3	Confident	89.4	Confident	91 Å²	91	58.4 Å²	58.4	34%	0.343	30%	0.303	S	S	.	.	H	α-helix	trans	-65.3	-44.8	177.1	-60.4	-177	-170.2	171.2	-4.1	110.7	D91 P323 W324 R330	D91-R326 IonicContact OD2-CZ 2.74Å; P323-R326 HydrophobicContact CB-CB 4.43Å; P323-R326 HydrophobicContact CB-CG 4Å; P323-R326 WeakPolarHBondContact O-CB 3.27Å; P323-R326 PolarHBondContact O-N 2.9Å; W324-R326 VanDerWaalsContact C-N 3.3Å; W324-R326 PolarHBondContact O-N 2.74Å; R326-R330 WeakPolarHBondContact O-CB 3.42Å; R326-R330 VanDerWaalsContact O-CG 3.27Å; R326-R330 WeakPolarHBondContact O-CG 3.06Å; R326-R330 PolarHBondContact O-N 3.15Å
327	Y	89	Confident	89.2	Confident	78 Å²	78	56.4 Å²	56.4	31%	0.306	29%	0.289	S	S	.	.	H	α-helix	trans	-65.7	-40.9	176.5	-69.9	-64.6	0	0	0	112.1	P323 W324 R330 F331	P323-Y327 HydrophobicContact CG-CE2 4.37Å; P323-Y327 PolarHBondContact O-N 3.39Å; W324-Y327 PolarHBondContact O-N 3.48Å; Y327-R330 PolarHBondContact O-N 3.23Å; Y327-F331 WeakPolarHBondContact O-CD2 3.26Å; Y327-F331 PolarHBondContact O-N 2.92Å
328	M	90.3	Very high	89.2	Confident	45 Å²	45	51.2 Å²	51.2	22%	0.222	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-50.2	175.5	-175.3	-174.8	72.4	0	0	111.6	M315 W324 Y325 R330 F331 V332	M315-M328 HydrophobicContact CG-CB 4.33Å; M315-M328 HydrophobicContact SD-CB 4.42Å; W324-M328 HydrophobicContact CE3-SD 4.43Å; W324-M328 HydrophobicContact CZ3-CE 4.03Å; W324-M328 HydrophobicContact CZ3-SD 3.92Å; W324-M328 WeakPolarHBondContact O-CB 3.4Å; W324-M328 PolarHBondContact O-N 3.1Å; Y325-M328 PolarHBondContact O-N 3.48Å; M328-R330 VanDerWaalsContact C-N 3.29Å; M328-R330 PolarHBondContact O-N 3.26Å; M328-F331 PolarHBondContact O-N 2.95Å; M328-V332 WeakPolarHBondContact O-CG2 3.27Å; M328-V332 PolarHBondContact O-N 2.92Å
329	F	91.4	Very high	89.2	Confident	100 Å²	100	48 Å²	48	44%	0.439	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-34.4	176.5	-79.2	-68.1	0	0	0	112.2	I92 Y325 V332 L333	I92-F329 HydrophobicContact CD1-CB 4.1Å; I92-F329 HydrophobicContact CD1-CD2 4.41Å; I92-F329 HydrophobicContact CD1-CG 4.34Å; I92-F329 HydrophobicContact CG2-CB 3.5Å; I92-F329 VanDerWaalsContact CG2-CB 3.5Å; Y325-F329 WeakPolarHBondContact O-CD2 3.45Å; Y325-F329 PolarHBondContact O-N 3.26Å; F329-V332 PolarHBondContact O-N 2.97Å; F329-L333 WeakPolarHBondContact O-CG 3.48Å; F329-L333 PolarHBondContact O-N 3.38Å
330	R	90.9	Very high	89.2	Confident	70 Å²	70	47.1 Å²	47.1	26%	0.264	24%	0.237	S	C	.	.	H	α-helix	trans	-65	-40.7	172.9	-75	178.1	68.6	169.4	-0.9	112.3	I92 I94 R326 Y327 M328 L333 L334 S898	I92-R330 HydrophobicContact CG2-CG 4Å; I94-R330 HydrophobicContact CD1-CB 3.94Å; I94-R330 HydrophobicContact CD1-CG 4.22Å; I94-R330 WeakPolarHBondContact CD1-O 3.26Å; I94-R330 HydrophobicContact CG1-CG 4.32Å; R326-R330 WeakPolarHBondContact O-CB 3.42Å; R326-R330 VanDerWaalsContact O-CG 3.27Å; R326-R330 WeakPolarHBondContact O-CG 3.06Å; R326-R330 PolarHBondContact O-N 3.15Å; Y327-R330 PolarHBondContact O-N 3.23Å; M328-R330 VanDerWaalsContact C-N 3.29Å; M328-R330 PolarHBondContact O-N 3.26Å; R330-L333 PolarHBondContact O-N 3.33Å; R330-L334 WeakPolarHBondContact O-CG 3.47Å; R330-L334 PolarHBondContact O-N 2.96Å; R330-S898 PolarHBondContact NE-OG 3.32Å; R330-S898 PolarHBondContact NH2-O 3.11Å; R330-S898 PolarHBondContact NH2-OG 3.1Å
331	F	92.3	Very high	88.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-40.1	172.9	-73.1	-56.4	0	0	0	112.3	S311 M314 K318 Y327 M328 L333 L334 F335 L896	S311-F331 PolarHBondContact OG-O 3.49Å; M314-F331 HydrophobicContact CB-CD1 4.2Å; M314-F331 HydrophobicContact CB-CD2 4.01Å; M314-F331 HydrophobicContact CB-CE1 4.23Å; M314-F331 HydrophobicContact CB-CE2 4.03Å; M314-F331 HydrophobicContact CB-CG 4.11Å; M314-F331 HydrophobicContact CB-CZ 4.13Å; K318-F331 HydrophobicContact CD-CE2 4.22Å; K318-F331 HydrophobicContact CD-CZ 4.42Å; Y327-F331 WeakPolarHBondContact O-CD2 3.26Å; Y327-F331 PolarHBondContact O-N 2.92Å; M328-F331 PolarHBondContact O-N 2.95Å; F331-L333 VanDerWaalsContact C-N 3.28Å; F331-L333 PolarHBondContact O-N 2.63Å; F331-L334 HydrophobicContact CD1-CD1 4.16Å; F331-L334 PolarHBondContact O-N 2.86Å; F331-F335 HydrophobicContact CB-CD2 4.37Å; F331-F335 HydrophobicContact CB-CE2 4.05Å; F331-F335 HydrophobicContact CD1-CE2 4.19Å; F331-F335 HydrophobicContact CD1-CZ 4.21Å; F331-F335 HydrophobicContact CG-CE2 4.46Å; F331-F335 VanDerWaalsContact O-CD2 3.23Å; F331-F335 WeakPolarHBondContact O-CD2 3.45Å; F331-F335 WeakPolarHBondContact O-CG 3.18Å; F331-F335 PolarHBondContact O-N 3.04Å; F331-L896 WeakPolarHBondContact CZ-O 3.22Å
332	V	92.6	Very high	89	Confident	15 Å²	15	41.6 Å²	41.6	9%	0.091	20%	0.2	C	C	.	.	H	α-helix	trans	-58.4	-42.3	174.7	170.2	0	0	0	0	111.1	V307 L308 S311 M328 F329 S336	V307-V332 HydrophobicContact CG1-CB 4.37Å; V307-V332 HydrophobicContact CG1-CG1 3.98Å; L308-V332 HydrophobicContact CD2-CG2 4.04Å; S311-V332 VanDerWaalsContact OG-CA 3.23Å; S311-V332 WeakPolarHBondContact OG-CA 3.1Å; S311-V332 WeakPolarHBondContact OG-CG2 3.49Å; S311-V332 PolarHBondContact OG-N 3.48Å; M328-V332 WeakPolarHBondContact O-CG2 3.27Å; M328-V332 PolarHBondContact O-N 2.92Å; F329-V332 PolarHBondContact O-N 2.97Å; V332-S336 WeakPolarHBondContact O-CB 3.42Å; V332-S336 PolarHBondContact O-N 3.35Å
333	L	90.5	Very high	89.2	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-67.8	-42	176	-73	178.2	0	0	0	113.1	M83 S86 Q87 I92 I94 F329 R330 F331 F335 S336	M83-L333 HydrophobicContact CE-CD2 3.3Å; M83-L333 HydrophobicContact CE-CG 4.37Å; M83-L333 HydrophobicContact SD-CD2 3.68Å; S86-L333 WeakPolarHBondContact OG-CD2 3.48Å; Q87-L333 VanDerWaalsContact NE2-CD2 3.28Å; I92-L333 HydrophobicContact CG2-CD1 3.67Å; I92-L333 WeakPolarHBondContact O-CD1 3.24Å; I94-L333 HydrophobicContact CD1-CB 3.48Å; I94-L333 VanDerWaalsContact CD1-CB 3.48Å; I94-L333 HydrophobicContact CD1-CD1 4.19Å; I94-L333 HydrophobicContact CD1-CG 4.49Å; I94-L333 HydrophobicContact CG1-CB 4.22Å; I94-L333 HydrophobicContact CG1-CD1 4.15Å; F329-L333 WeakPolarHBondContact O-CG 3.48Å; F329-L333 PolarHBondContact O-N 3.38Å; R330-L333 PolarHBondContact O-N 3.33Å; F331-L333 VanDerWaalsContact C-N 3.28Å; F331-L333 PolarHBondContact O-N 2.63Å; L333-F335 VanDerWaalsContact C-N 3.3Å; L333-F335 PolarHBondContact O-N 3.45Å; L333-S336 VanDerWaalsContact O-CB 3.29Å; L333-S336 WeakPolarHBondContact O-CB 2.99Å; L333-S336 PolarHBondContact O-N 3.35Å; L333-S336 PolarHBondContact O-OG 3.22Å
334	L	90.2	Very high	89	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-61.1	-41.3	176.7	-75.3	164.6	0	0	0	112	I94 R330 F331 S336 Q887 A900	I94-L334 HydrophobicContact CD1-CD1 4.31Å; I94-L334 HydrophobicContact CD1-CD2 4.11Å; I94-L334 HydrophobicContact CD1-CG 3.64Å; I94-L334 HydrophobicContact CG2-CD2 3.73Å; I94-L334 HydrophobicContact CG2-CG 4.38Å; R330-L334 WeakPolarHBondContact O-CG 3.47Å; R330-L334 PolarHBondContact O-N 2.96Å; F331-L334 HydrophobicContact CD1-CD1 4.16Å; F331-L334 PolarHBondContact O-N 2.86Å; L334-S336 VanDerWaalsContact C-N 3.32Å; L334-Q887 HydrophobicContact CB-CG 4.18Å; L334-Q887 HydrophobicContact CD2-CG 4.38Å; L334-A900 HydrophobicContact CD2-CB 3.69Å
335	F	92.8	Very high	88.8	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-86.7	-2	-179.7	-55.5	-35.4	0	0	0	113.3	V307 L310 S311 M314 F331 L333 Y337 I338 T884 Q887 A888	V307-F335 HydrophobicContact CG1-CB 4.16Å; L310-F335 HydrophobicContact CB-CD2 4.2Å; L310-F335 HydrophobicContact CB-CE2 4.46Å; L310-F335 HydrophobicContact CD2-CB 4.41Å; L310-F335 HydrophobicContact CD2-CD1 4.05Å; L310-F335 HydrophobicContact CD2-CD2 3.68Å; L310-F335 HydrophobicContact CD2-CE1 4.22Å; L310-F335 HydrophobicContact CD2-CE2 3.88Å; L310-F335 HydrophobicContact CD2-CG 3.78Å; L310-F335 HydrophobicContact CD2-CZ 4.15Å; L310-F335 HydrophobicContact CG-CD2 3.76Å; L310-F335 HydrophobicContact CG-CE2 3.68Å; L310-F335 HydrophobicContact CG-CG 4.38Å; L310-F335 HydrophobicContact CG-CZ 4.23Å; S311-F335 WeakPolarHBondContact OG-CD2 3.46Å; M314-F335 HydrophobicContact CB-CE2 4.5Å; M314-F335 HydrophobicContact CE-CZ 3.91Å; M314-F335 HydrophobicContact CG-CE2 3.72Å; M314-F335 HydrophobicContact CG-CZ 3.82Å; F331-F335 HydrophobicContact CB-CD2 4.37Å; F331-F335 HydrophobicContact CB-CE2 4.05Å; F331-F335 HydrophobicContact CD1-CE2 4.19Å; F331-F335 HydrophobicContact CD1-CZ 4.21Å; F331-F335 HydrophobicContact CG-CE2 4.46Å; F331-F335 VanDerWaalsContact O-CD2 3.23Å; F331-F335 WeakPolarHBondContact O-CD2 3.45Å; F331-F335 WeakPolarHBondContact O-CG 3.18Å; F331-F335 PolarHBondContact O-N 3.04Å; L333-F335 VanDerWaalsContact C-N 3.3Å; L333-F335 PolarHBondContact O-N 3.45Å; F335-Y337 PolarHBondContact O-N 3.27Å; F335-I338 WeakPolarHBondContact O-CB 3.4Å; F335-I338 VanDerWaalsContact O-CG2 3.27Å; F335-I338 WeakPolarHBondContact O-CG2 3.5Å; F335-I338 PolarHBondContact O-N 3.26Å; F335-I338 VanDerWaalsContact O-N 3.17Å; F335-T884 HydrophobicContact CB-CG2 3.88Å; F335-T884 HydrophobicContact CD1-CG2 3.85Å; F335-T884 HydrophobicContact CG-CG2 4.16Å; F335-Q887 HydrophobicContact CD1-CG 4.33Å; F335-Q887 HydrophobicContact CE1-CG 4.1Å; F335-A888 HydrophobicContact CE1-CB 3.79Å; F335-A888 HydrophobicContact CZ-CB 4.14Å
336	S	89.1	Confident	88.8	Confident	8 Å²	8	29 Å²	29	6%	0.056	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-61.6	-26.6	179.1	70.1	0	0	0	0	113.7	Y79 V332 L333 L334 I338 I339	Y79-S336 WeakPolarHBondContact OH-CA 3.41Å; Y79-S336 WeakPolarHBondContact OH-CB 3.48Å; Y79-S336 PolarHBondContact OH-O 3.23Å; V332-S336 WeakPolarHBondContact O-CB 3.42Å; V332-S336 PolarHBondContact O-N 3.35Å; L333-S336 VanDerWaalsContact O-CB 3.29Å; L333-S336 WeakPolarHBondContact O-CB 2.99Å; L333-S336 PolarHBondContact O-N 3.35Å; L333-S336 PolarHBondContact O-OG 3.22Å; L334-S336 VanDerWaalsContact C-N 3.32Å; S336-I338 PolarHBondContact O-N 3.4Å; S336-I339 PolarHBondContact O-N 2.64Å; S336-I339 VanDerWaalsContact O-N 3.1Å
337	Y	87.3	Confident	88.8	Confident	64 Å²	64	24.9 Å²	24.9	25%	0.251	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-62.3	-11.8	177	-70.1	-71.5	0	0	0	114.3	Y100 F335 I339 G880 M907	Y100-Y337 PolarHBondContact OH-OH 3.37Å; F335-Y337 PolarHBondContact O-N 3.27Å; Y337-I339 PolarHBondContact O-N 2.83Å; Y337-G880 VanDerWaalsContact O-CA 3.3Å; Y337-G880 WeakPolarHBondContact O-CA 3.21Å; Y337-M907 HydrophobicContact CD1-CE 3.4Å; Y337-M907 HydrophobicContact CD2-CE 3.71Å; Y337-M907 HydrophobicContact CE1-CE 3.34Å; Y337-M907 HydrophobicContact CE2-CE 3.65Å; Y337-M907 HydrophobicContact CG-CE 3.58Å; Y337-M907 VanDerWaalsContact CZ-CE 3.47Å
338	I	91.2	Very high	88.7	Confident	11 Å²	11	21.7 Å²	21.7	6%	0.056	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-59.9	-27.9	172.4	-156.5	177.9	0	0	0	111.8	L303 V307 F335 S336 P340 L881 T884	L303-I338 HydrophobicContact CD2-CD1 4.03Å; L303-I338 HydrophobicContact CD2-CG1 4.16Å; V307-I338 HydrophobicContact CG2-CB 4.42Å; V307-I338 HydrophobicContact CG2-CG2 3.22Å; F335-I338 WeakPolarHBondContact O-CB 3.4Å; F335-I338 VanDerWaalsContact O-CG2 3.27Å; F335-I338 WeakPolarHBondContact O-CG2 3.5Å; F335-I338 PolarHBondContact O-N 3.26Å; F335-I338 VanDerWaalsContact O-N 3.17Å; S336-I338 PolarHBondContact O-N 3.4Å; I338-P340 WeakPolarHBondContact O-CD 3.49Å; I338-L881 HydrophobicContact CD1-CD2 3.51Å; I338-L881 HydrophobicContact CG1-CD2 3.36Å; I338-L881 HydrophobicContact CG1-CG 3.87Å; I338-T884 WeakPolarHBondContact CA-OG1 3.18Å; I338-T884 HydrophobicContact CB-CG2 4.11Å; I338-T884 WeakPolarHBondContact CB-OG1 3.06Å; I338-T884 HydrophobicContact CD1-CG2 4.38Å; I338-T884 HydrophobicContact CG1-CG2 4.36Å; I338-T884 PolarHBondContact N-OG1 3.09Å
339	I	89.3	Confident	88.6	Confident	3 Å²	3	23 Å²	23	2%	0.015	11%	0.108	C	C	.	.	S	Bend	trans	-102.9	94.8	173.9	-50.9	-178.1	0	0	0	107.5	L76 Y79 F80 T300 L303 F304 S336 Y337 I341	L76-I339 HydrophobicContact CD1-CG2 3.45Å; L76-I339 VanDerWaalsContact CD1-CG2 3.45Å; Y79-I339 HydrophobicContact CD1-CB 4.47Å; Y79-I339 HydrophobicContact CD1-CD1 4.14Å; Y79-I339 HydrophobicContact CD1-CG2 4.41Å; Y79-I339 HydrophobicContact CE1-CB 3.91Å; Y79-I339 HydrophobicContact CE1-CD1 3.81Å; Y79-I339 HydrophobicContact CE1-CG1 4.26Å; Y79-I339 HydrophobicContact CE1-CG2 4.33Å; Y79-I339 HydrophobicContact CE2-CD1 4.5Å; F80-I339 HydrophobicContact CE1-CB 4.44Å; F80-I339 HydrophobicContact CE1-CG2 4.14Å; F80-I339 VanDerWaalsContact CE1-O 3.26Å; F80-I339 WeakPolarHBondContact CE1-O 3.37Å; F80-I339 HydrophobicContact CZ-CG2 3.81Å; F80-I339 WeakPolarHBondContact CZ-O 3.3Å; T300-I339 HydrophobicContact CG2-CD1 3.96Å; T300-I339 HydrophobicContact CG2-CG2 3.84Å; L303-I339 HydrophobicContact CB-CD1 4.23Å; L303-I339 HydrophobicContact CB-CG1 3.95Å; L303-I339 HydrophobicContact CD1-CG1 4.5Å; F304-I339 HydrophobicContact CB-CD1 4.06Å; S336-I339 PolarHBondContact O-N 2.64Å; S336-I339 VanDerWaalsContact O-N 3.1Å; Y337-I339 PolarHBondContact O-N 2.83Å; I339-I341 PolarHBondContact O-N 2.61Å
340	P	87.2	Confident	88.6	Confident	10 Å²	10	18.2 Å²	18.2	7%	0.065	9%	0.087	C	C	.	.			trans	-70.8	124.7	-175	26.9	-36.5	0	0	0	112.2	I338 S342 L343 V876	I338-P340 WeakPolarHBondContact O-CD 3.49Å; P340-S342 PolarHBondContact O-N 3.11Å; P340-L343 HydrophobicContact CG-CB 4.26Å; P340-L343 VanDerWaalsContact O-CB 3.28Å; P340-L343 WeakPolarHBondContact O-CB 3.46Å; P340-L343 PolarHBondContact O-N 3.3Å; P340-L343 VanDerWaalsContact O-N 3.1Å; P340-V876 HydrophobicContact CB-CG1 3.9Å; P340-V876 HydrophobicContact CG-CG1 3.6Å; P340-V876 WeakPolarHBondContact CG-O 3.45Å
341	I	83.3	Confident	88.6	Confident	34 Å²	34	15 Å²	15	17%	0.174	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-36.8	177.7	-62.2	167.7	0	0	0	112	F80 P103 V107 I339 L343	F80-I341 HydrophobicContact CD1-CD1 4.24Å; F80-I341 HydrophobicContact CD1-CG1 3.48Å; F80-I341 VanDerWaalsContact CD1-CG1 3.48Å; F80-I341 HydrophobicContact CD2-CG1 4.24Å; F80-I341 HydrophobicContact CD2-CG2 4.47Å; F80-I341 HydrophobicContact CE1-CB 4.26Å; F80-I341 HydrophobicContact CE1-CD1 4.45Å; F80-I341 HydrophobicContact CE1-CG1 3.35Å; F80-I341 HydrophobicContact CE2-CB 4.29Å; F80-I341 HydrophobicContact CE2-CG1 4.12Å; F80-I341 HydrophobicContact CE2-CG2 4.45Å; F80-I341 HydrophobicContact CG-CG1 3.95Å; F80-I341 VanDerWaalsContact CZ-CA 3.4Å; F80-I341 HydrophobicContact CZ-CB 4.1Å; F80-I341 HydrophobicContact CZ-CG1 3.69Å; P103-I341 HydrophobicContact CB-CD1 4.16Å; P103-I341 HydrophobicContact CB-CG2 3.95Å; V107-I341 HydrophobicContact CG2-CG2 3.77Å; I339-I341 PolarHBondContact O-N 2.61Å; I341-L343 PolarHBondContact O-N 3.03Å; I341-L343 VanDerWaalsContact O-N 3.16Å
342	S	84.9	Confident	88.5	Confident	21 Å²	21	17.4 Å²	17.4	15%	0.147	10%	0.095	C	C	.	.	H	α-helix	trans	-70.7	-8.2	-178.1	73.8	0	0	0	0	114.4	P340 R344 V345 N346 R879	P340-S342 PolarHBondContact O-N 3.11Å; S342-R344 VanDerWaalsContact C-N 3.28Å; S342-R344 PolarHBondContact O-N 3.41Å; S342-V345 PolarHBondContact O-N 3.47Å; S342-N346 WeakPolarHBondContact O-CB 3.3Å; S342-N346 PolarHBondContact O-N 3.3Å; S342-R879 PolarHBondContact OG-NH2 3.29Å
343	L	87.2	Confident	88.5	Confident	2 Å²	2	19.1 Å²	19.1	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-56.1	-46	178.7	178.9	61.7	0	0	0	111.1	I296 P340 I341 L347 V876 I877	I296-L343 HydrophobicContact CG2-CD2 3.75Å; P340-L343 HydrophobicContact CG-CB 4.26Å; P340-L343 VanDerWaalsContact O-CB 3.28Å; P340-L343 WeakPolarHBondContact O-CB 3.46Å; P340-L343 PolarHBondContact O-N 3.3Å; P340-L343 VanDerWaalsContact O-N 3.1Å; I341-L343 PolarHBondContact O-N 3.03Å; I341-L343 VanDerWaalsContact O-N 3.16Å; L343-L347 HydrophobicContact CD1-CD1 3.9Å; L343-L347 HydrophobicContact CD1-CG 4.46Å; L343-L347 HydrophobicContact CG-CD1 4.1Å; L343-L347 WeakPolarHBondContact O-CD1 3.18Å; L343-L347 WeakPolarHBondContact O-CG 3.29Å; L343-L347 PolarHBondContact O-N 3.34Å; L343-V876 HydrophobicContact CB-CG1 3.86Å; L343-V876 HydrophobicContact CD1-CB 3.94Å; L343-V876 HydrophobicContact CD1-CG1 4.02Å; L343-I877 HydrophobicContact CD1-CG1 4.44Å; L343-I877 HydrophobicContact CD2-CD1 4.32Å; L343-I877 HydrophobicContact CD2-CG1 4.1Å
344	R	83.7	Confident	88.7	Confident	32 Å²	32	19.1 Å²	19.1	12%	0.121	10%	0.101	C	C	.	.	H	α-helix	trans	-64.6	-48	-179	-176.3	65.5	-165.7	-168	-0.4	111.6	L76 V107 D293 S342 L347 D348	L76-R344 HydrophobicContact CD2-CB 4.21Å; V107-R344 HydrophobicContact CG1-CB 4.38Å; V107-R344 HydrophobicContact CG1-CG 4.25Å; D293-R344 IonicContact OD1-NH1 3.07Å; D293-R344 IonicContact OD2-NH1 3.93Å; S342-R344 VanDerWaalsContact C-N 3.28Å; S342-R344 PolarHBondContact O-N 3.41Å; R344-L347 PolarHBondContact O-N 3.02Å; R344-D348 IonicContact CZ-OD1 2.94Å; R344-D348 IonicContact CZ-OD2 3.07Å; R344-D348 IonicContact NE-OD1 3.64Å; R344-D348 IonicContact NE-OD2 3.71Å; R344-D348 PolarHBondContact NE-OD2 3.08Å; R344-D348 IonicContact NH2-OD1 2.75Å; R344-D348 PolarHBondContact NH2-OD1 3.09Å; R344-D348 IonicContact NH2-OD2 2.89Å; R344-D348 PolarHBondContact O-N 3.14Å
345	V	83.9	Confident	88.8	Confident	14 Å²	14	18.9 Å²	18.9	9%	0.085	10%	0.101	C	C	.	.	H	α-helix	trans	-61.9	-47.2	-178.6	177.6	0	0	0	0	111.3	F106 V107 S342 L347 D348 M349	F106-V345 HydrophobicContact CE1-CG1 4.14Å; V107-V345 HydrophobicContact CB-CG2 3.87Å; V107-V345 HydrophobicContact CG1-CG2 3.83Å; V107-V345 HydrophobicContact CG2-CG2 3.31Å; S342-V345 PolarHBondContact O-N 3.47Å; V345-L347 VanDerWaalsContact C-N 3.29Å; V345-L347 PolarHBondContact O-N 3.46Å; V345-D348 PolarHBondContact O-N 2.83Å; V345-M349 HydrophobicContact CG1-CG 4.21Å; V345-M349 HydrophobicContact CG1-SD 3.72Å; V345-M349 WeakPolarHBondContact O-CB 3.48Å; V345-M349 WeakPolarHBondContact O-CG 3.44Å; V345-M349 PolarHBondContact O-N 2.76Å
346	N	88.7	Confident	88.8	Confident	3 Å²	3	26 Å²	26	2%	0.016	13%	0.127	C	C	.	.	H	α-helix	trans	-60.9	-39.9	180	-76.8	-19.2	0	0	0	111.7	S342 G350 L872 V876	S342-N346 WeakPolarHBondContact O-CB 3.3Å; S342-N346 PolarHBondContact O-N 3.3Å; N346-G350 PolarHBondContact O-N 2.89Å; N346-L872 HydrophobicContact CB-CD1 4.39Å; N346-L872 HydrophobicContact CB-CD2 4.18Å; N346-L872 HydrophobicContact CB-CG 4.4Å; N346-L872 WeakPolarHBondContact O-CD2 3.4Å; N346-V876 HydrophobicContact CB-CG2 4.36Å; N346-V876 WeakPolarHBondContact ND2-CG2 3.28Å
347	L	89.1	Confident	89	Confident	5 Å²	5	27.7 Å²	27.7	3%	0.026	14%	0.135	C	C	.	.	H	α-helix	trans	-69.5	-43.7	176.9	-69.7	167.7	0	0	0	112.3	I296 L343 R344 V345 G350 K351 L872 S873	I296-L347 HydrophobicContact CD1-CD1 3.38Å; L343-L347 HydrophobicContact CD1-CD1 3.9Å; L343-L347 HydrophobicContact CD1-CG 4.46Å; L343-L347 HydrophobicContact CG-CD1 4.1Å; L343-L347 WeakPolarHBondContact O-CD1 3.18Å; L343-L347 WeakPolarHBondContact O-CG 3.29Å; L343-L347 PolarHBondContact O-N 3.34Å; R344-L347 PolarHBondContact O-N 3.02Å; V345-L347 VanDerWaalsContact C-N 3.29Å; V345-L347 PolarHBondContact O-N 3.46Å; L347-G350 PolarHBondContact O-N 3.02Å; L347-K351 VanDerWaalsContact O-CG 3.24Å; L347-K351 WeakPolarHBondContact O-CG 3.3Å; L347-K351 PolarHBondContact O-N 2.87Å; L347-L872 HydrophobicContact CD2-CD2 4.21Å; L347-S873 VanDerWaalsContact CD2-OG 3.24Å; L347-S873 WeakPolarHBondContact CD2-OG 3.41Å
348	D	86.6	Confident	89.3	Confident	11 Å²	11	24.7 Å²	24.7	6%	0.059	12%	0.123	C	C	.	.	H	α-helix	trans	-64.4	-40.9	177.7	-79.3	-35.8	0	0	0	111.8	R114 R344 V345 K351 A352	R114-D348 IonicContact NH1-OD1 2.81Å; R114-D348 PolarHBondContact NH1-OD1 3.23Å; R344-D348 IonicContact CZ-OD1 2.94Å; R344-D348 IonicContact CZ-OD2 3.07Å; R344-D348 IonicContact NE-OD1 3.64Å; R344-D348 IonicContact NE-OD2 3.71Å; R344-D348 PolarHBondContact NE-OD2 3.08Å; R344-D348 IonicContact NH2-OD1 2.75Å; R344-D348 PolarHBondContact NH2-OD1 3.09Å; R344-D348 IonicContact NH2-OD2 2.89Å; R344-D348 PolarHBondContact O-N 3.14Å; V345-D348 PolarHBondContact O-N 2.83Å; D348-K351 PolarHBondContact O-N 3.27Å; D348-A352 PolarHBondContact O-N 2.95Å
349	M	87.9	Confident	89.4	Confident	72 Å²	72	28.4 Å²	28.4	36%	0.355	14%	0.14	S	C	.	.	H	α-helix	trans	-64.8	-40	172.6	-71.3	179	67.1	0	0	112	V345 A352 F353 F920	V345-M349 HydrophobicContact CG1-CG 4.21Å; V345-M349 HydrophobicContact CG1-SD 3.72Å; V345-M349 WeakPolarHBondContact O-CB 3.48Å; V345-M349 WeakPolarHBondContact O-CG 3.44Å; V345-M349 PolarHBondContact O-N 2.76Å; M349-A352 PolarHBondContact O-N 3.43Å; M349-F353 PolarHBondContact O-N 3.22Å; M349-F920 HydrophobicContact CB-CD2 4.48Å; M349-F920 HydrophobicContact CB-CE2 3.47Å; M349-F920 VanDerWaalsContact CB-CE2 3.47Å; M349-F920 HydrophobicContact CB-CZ 3.72Å; M349-F920 HydrophobicContact CE-CE1 4.37Å; M349-F920 HydrophobicContact CE-CE2 4.45Å; M349-F920 HydrophobicContact CE-CZ 4.16Å
350	G	91.7	Very high	89.5	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.6	-45.4	175.7	0	0	0	0	0	111.6	N346 L347 A352 F353 Y354	N346-G350 PolarHBondContact O-N 2.89Å; L347-G350 PolarHBondContact O-N 3.02Å; G350-A352 PolarHBondContact O-N 2.67Å; G350-F353 WeakPolarHBondContact O-CB 3.45Å; G350-F353 PolarHBondContact O-N 3.12Å; G350-Y354 WeakPolarHBondContact O-CD1 3.44Å; G350-Y354 WeakPolarHBondContact O-CD2 3.22Å; G350-Y354 WeakPolarHBondContact O-CE2 3.43Å; G350-Y354 PolarHBondContact O-N 3.46Å
351	K	91.4	Very high	89.8	Confident	1 Å²	1	34.7 Å²	34.7	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-60.9	-43.9	175.9	-67.9	170.1	-165.6	-159.9	0	112	D293 L347 D348 F353 Y354 S355 T372 T373 P375 E376	D293-K351 IonicContact OD1-NZ 3.97Å; D293-K351 PolarHBondContact OD1-NZ 3.31Å; D293-K351 IonicContact OD2-NZ 3.92Å; D293-K351 PolarHBondContact OD2-NZ 3.08Å; L347-K351 VanDerWaalsContact O-CG 3.24Å; L347-K351 WeakPolarHBondContact O-CG 3.3Å; L347-K351 PolarHBondContact O-N 2.87Å; D348-K351 PolarHBondContact O-N 3.27Å; K351-F353 VanDerWaalsContact C-N 3.31Å; K351-F353 PolarHBondContact O-N 3.27Å; K351-Y354 PolarHBondContact O-N 3.39Å; K351-S355 PolarHBondContact O-N 3.07Å; K351-S355 PolarHBondContact O-OG 3.29Å; K351-S355 VanDerWaalsContact O-OG 3.11Å; K351-T372 WeakPolarHBondContact CB-O 3.35Å; K351-T373 PolarHBondContact NZ-O 2.83Å; K351-P375 HydrophobicContact CB-CG 4.35Å; K351-E376 WeakPolarHBondContact CE-OE1 3.44Å; K351-E376 IonicContact NZ-OE1 3.51Å; K351-E376 PolarHBondContact NZ-OE1 2.81Å
352	A	89.8	Confident	90.1	Very high	52 Å²	52	37.2 Å²	37.2	43%	0.43	19%	0.194	S	C	.	.	H	α-helix	trans	-60	-42.4	175	0	0	0	0	0	111.8	D348 M349 G350 S355 W356	D348-A352 PolarHBondContact O-N 2.95Å; M349-A352 PolarHBondContact O-N 3.43Å; G350-A352 PolarHBondContact O-N 2.67Å; A352-S355 PolarHBondContact O-N 3.17Å; A352-W356 PolarHBondContact O-N 3.24Å
353	F	92.8	Very high	90.3	Very high	51 Å²	51	40.4 Å²	40.4	22%	0.224	21%	0.209	C	C	.	.	H	α-helix	trans	-63.9	-43.9	175.2	178.4	-90.7	0	0	0	112.4	M349 G350 K351 S355 W356 Q357 V923 L924	M349-F353 PolarHBondContact O-N 3.22Å; G350-F353 WeakPolarHBondContact O-CB 3.45Å; G350-F353 PolarHBondContact O-N 3.12Å; K351-F353 VanDerWaalsContact C-N 3.31Å; K351-F353 PolarHBondContact O-N 3.27Å; F353-S355 VanDerWaalsContact C-N 3.33Å; F353-S355 PolarHBondContact O-N 2.82Å; F353-W356 HydrophobicContact CD2-CE3 4.28Å; F353-W356 HydrophobicContact CE2-CE3 4.01Å; F353-W356 HydrophobicContact CE2-CZ3 4.01Å; F353-W356 HydrophobicContact CZ-CZ3 4.46Å; F353-W356 PolarHBondContact O-N 3.46Å; F353-Q357 HydrophobicContact CE1-CB 4.46Å; F353-Q357 WeakPolarHBondContact O-CB 3.37Å; F353-Q357 PolarHBondContact O-N 2.83Å; F353-V923 HydrophobicContact CB-CG1 3.91Å; F353-V923 HydrophobicContact CD1-CG1 3.15Å; F353-V923 HydrophobicContact CE1-CG1 3.8Å; F353-V923 HydrophobicContact CG-CG1 3.66Å; F353-L924 HydrophobicContact CE1-CD2 3.76Å; F353-L924 HydrophobicContact CE2-CD2 4.08Å; F353-L924 HydrophobicContact CZ-CD2 3.3Å
354	Y	94.4	Very high	90.4	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-42.9	176.7	-53.3	-35.6	0	0	0	111.4	G350 K351 W356 Q357 M358 P375 R868 S869 V923	G350-Y354 WeakPolarHBondContact O-CD1 3.44Å; G350-Y354 WeakPolarHBondContact O-CD2 3.22Å; G350-Y354 WeakPolarHBondContact O-CE2 3.43Å; G350-Y354 PolarHBondContact O-N 3.46Å; K351-Y354 PolarHBondContact O-N 3.39Å; Y354-W356 VanDerWaalsContact C-N 3.34Å; Y354-W356 PolarHBondContact O-N 3.16Å; Y354-Q357 PolarHBondContact O-N 3.19Å; Y354-M358 VanDerWaalsContact O-CG 3.27Å; Y354-M358 WeakPolarHBondContact O-CG 3.42Å; Y354-M358 PolarHBondContact O-N 2.85Å; Y354-P375 HydrophobicContact CD2-CB 4.35Å; Y354-R868 HydrophobicContact CE1-CB 3.97Å; Y354-R868 WeakPolarHBondContact OH-CB 3.21Å; Y354-S869 WeakPolarHBondContact CE2-OG 3.44Å; Y354-S869 PolarHBondContact OH-N 3.18Å; Y354-V923 HydrophobicContact CD1-CG1 4.15Å; Y354-V923 HydrophobicContact CE1-CB 4.25Å; Y354-V923 HydrophobicContact CE1-CG1 3.46Å; Y354-V923 VanDerWaalsContact CE1-CG1 3.46Å
355	S	92.6	Very high	90.5	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-61.6	-40.6	175.6	-62.7	0	0	0	0	112.4	K351 A352 F353 Q359 P375	K351-S355 PolarHBondContact O-N 3.07Å; K351-S355 PolarHBondContact O-OG 3.29Å; K351-S355 VanDerWaalsContact O-OG 3.11Å; A352-S355 PolarHBondContact O-N 3.17Å; F353-S355 VanDerWaalsContact C-N 3.33Å; F353-S355 PolarHBondContact O-N 2.82Å; S355-Q359 WeakPolarHBondContact O-CG 3.49Å; S355-Q359 PolarHBondContact O-N 3.29Å; S355-P375 WeakPolarHBondContact OG-CG 3.46Å
356	W	92.2	Very high	90.5	Very high	148 Å²	148	47.3 Å²	47.3	56%	0.561	26%	0.256	S	S	*	.	H	α-helix	trans	-65.1	-44	174.6	175.1	82.4	0	0	0	111.8	A352 F353 Y354 M358 Q359 N360	A352-W356 PolarHBondContact O-N 3.24Å; F353-W356 HydrophobicContact CD2-CE3 4.28Å; F353-W356 HydrophobicContact CE2-CE3 4.01Å; F353-W356 HydrophobicContact CE2-CZ3 4.01Å; F353-W356 HydrophobicContact CZ-CZ3 4.46Å; F353-W356 PolarHBondContact O-N 3.46Å; Y354-W356 VanDerWaalsContact C-N 3.34Å; Y354-W356 PolarHBondContact O-N 3.16Å; W356-M358 VanDerWaalsContact C-N 3.31Å; W356-M358 PolarHBondContact O-N 3.08Å; W356-Q359 PolarHBondContact O-N 3.42Å; W356-N360 PolarHBondContact O-N 2.91Å; W356-N360 VanDerWaalsContact O-N 3.14Å
357	Q	93.4	Very high	90.6	Very high	45 Å²	45	47.4 Å²	47.4	21%	0.21	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-37.4	178	-179.2	168.1	40.6	0	0	112.4	F353 Y354 D361	F353-Q357 HydrophobicContact CE1-CB 4.46Å; F353-Q357 WeakPolarHBondContact O-CB 3.37Å; F353-Q357 PolarHBondContact O-N 2.83Å; Y354-Q357 PolarHBondContact O-N 3.19Å; Q357-D361 PolarHBondContact O-N 3.04Å
358	M	94.3	Very high	90.7	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-65.4	-38.5	175.4	-71.7	167.3	-179.5	0	0	112.3	Y354 W356 V369 P375 L378 F846 L857 H861 S865	Y354-M358 VanDerWaalsContact O-CG 3.27Å; Y354-M358 WeakPolarHBondContact O-CG 3.42Å; Y354-M358 PolarHBondContact O-N 2.85Å; W356-M358 VanDerWaalsContact C-N 3.31Å; W356-M358 PolarHBondContact O-N 3.08Å; M358-V369 HydrophobicContact CB-CG2 3.78Å; M358-V369 HydrophobicContact SD-CG2 4.02Å; M358-P375 HydrophobicContact CE-CB 3.96Å; M358-L378 HydrophobicContact CE-CD1 3.76Å; M358-L378 HydrophobicContact SD-CD1 4.35Å; M358-F846 HydrophobicContact SD-CE1 4.03Å; M358-L857 HydrophobicContact CG-CD1 4.46Å; M358-L857 HydrophobicContact SD-CD1 4.29Å; M358-H861 HydrophobicContact CE-CB 3.61Å; M358-H861 HydrophobicContact CG-CB 3.83Å; M358-H861 HydrophobicContact SD-CB 4.46Å; M358-S865 WeakPolarHBondContact CE-OG 3.49Å
359	Q	92.8	Very high	90.8	Very high	89 Å²	89	49.6 Å²	49.6	42%	0.416	27%	0.27	S	S	.	.	H	α-helix	trans	-72	-29.9	-179.7	-70.8	176.7	44.6	0	0	112.9	S355 W356 V369	S355-Q359 WeakPolarHBondContact O-CG 3.49Å; S355-Q359 PolarHBondContact O-N 3.29Å; W356-Q359 PolarHBondContact O-N 3.42Å; Q359-V369 HydrophobicContact CG-CB 4.27Å; Q359-V369 HydrophobicContact CG-CG2 4Å; Q359-V369 PolarHBondContact NE2-O 2.8Å
360	N	92.6	Very high	90.6	Very high	119 Å²	119	49.1 Å²	49.1	64%	0.636	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	17	-176.1	-155.8	62	0	0	0	113.4	W356	W356-N360 PolarHBondContact O-N 2.91Å; W356-N360 VanDerWaalsContact O-N 3.14Å
361	D	93.3	Very high	90.2	Very high	26 Å²	26	50.1 Å²	50.1	14%	0.139	27%	0.271	C	S	.	.			trans	-81.4	122.8	177.8	-168.9	-20.6	0	0	0	111.2	Q357 N363 I364 H861	Q357-D361 PolarHBondContact O-N 3.04Å; D361-N363 PolarHBondContact O-N 2.85Å; D361-N363 WeakPolarHBondContact OD1-CB 3.48Å; D361-N363 PolarHBondContact OD1-N 2.59Å; D361-N363 PolarHBondContact OD1-ND2 3.44Å; D361-N363 VanDerWaalsContact OD1-ND2 3.12Å; D361-I364 HydrophobicContact CB-CG1 4.48Å; D361-I364 CarbonylContact O-C 3.6Å; D361-I364 PolarHBondContact O-N 3.07Å; D361-H861 IonicContact OD2-CD2 2.87Å; D361-H861 IonicContact OD2-CE1 3.22Å; D361-H861 PolarHBondContact OD2-CE1 3.02Å; D361-H861 VanDerWaalsContact OD2-CE1 3.25Å; D361-H861 IonicContact OD2-NE2 2.72Å; D361-H861 PolarHBondContact OD2-NE2 3Å
362	S	89.3	Confident	89.9	Confident	87 Å²	87	51.2 Å²	51.2	61%	0.608	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-65.5	-21.5	178.4	60.2	0	0	0	0	113.9	I364 Q365	S362-I364 VanDerWaalsContact C-N 3.35Å; S362-Q365 WeakPolarHBondContact O-CG 3.15Å
363	N	87.8	Confident	89.7	Confident	88 Å²	88	50 Å²	50	47%	0.471	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-84.2	-11.9	-179.8	-64.3	-68.4	0	0	0	113.7	D361 K856	D361-N363 PolarHBondContact O-N 2.85Å; D361-N363 WeakPolarHBondContact OD1-CB 3.48Å; D361-N363 PolarHBondContact OD1-N 2.59Å; D361-N363 PolarHBondContact OD1-ND2 3.44Å; D361-N363 VanDerWaalsContact OD1-ND2 3.12Å; N363-K856 HydrophobicContact CB-CD 4.34Å; N363-K856 PolarHBondContact O-NZ 3.35Å
364	I	89.3	Confident	89.6	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-138.1	47.3	-174.7	-28.3	-178.9	0	0	0	109.5	D361 S362 T367 H853 K856	D361-I364 HydrophobicContact CB-CG1 4.48Å; D361-I364 CarbonylContact O-C 3.6Å; D361-I364 PolarHBondContact O-N 3.07Å; S362-I364 VanDerWaalsContact C-N 3.35Å; I364-T367 WeakPolarHBondContact CG2-OG1 3.38Å; I364-T367 VanDerWaalsContact O-CB 3.3Å; I364-T367 WeakPolarHBondContact O-CB 3.49Å; I364-T367 PolarHBondContact O-N 3.46Å; I364-T367 PolarHBondContact O-OG1 3.11Å; I364-H853 HydrophobicContact CG2-CB 3.4Å; I364-H853 VanDerWaalsContact CG2-CB 3.4Å; I364-H853 WeakPolarHBondContact CG2-ND1 3.3Å; I364-K856 HydrophobicContact CD1-CB 3.69Å; I364-K856 HydrophobicContact CG1-CB 4.24Å; I364-K856 HydrophobicContact CG1-CD 4.25Å
365	Q	86.3	Confident	89.5	Confident	141 Å²	141	47.5 Å²	47.5	66%	0.659	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	143.7	-176.7	-64.4	-173.8	-4.3	0	0	111.5	S362 T367 P849	S362-Q365 WeakPolarHBondContact O-CG 3.15Å; Q365-T367 VanDerWaalsContact C-N 3.27Å; Q365-T367 PolarHBondContact O-N 3.21Å; Q365-P849 WeakPolarHBondContact O-CG 3.41Å
366	G	84.4	Confident	89.5	Confident	51 Å²	51	47.4 Å²	47.4	53%	0.526	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	2.4	-176.7	0	0	0	0	0	114.6	V368	G366-V368 PolarHBondContact O-N 3.02Å
367	T	90.9	Very high	89.6	Confident	4 Å²	4	40.5 Å²	40.5	3%	0.025	23%	0.228	C	C	.	.			trans	-71.4	126.9	174.3	-60.1	0	0	0	0	111.1	I364 Q365 S847 I848	I364-T367 WeakPolarHBondContact CG2-OG1 3.38Å; I364-T367 VanDerWaalsContact O-CB 3.3Å; I364-T367 WeakPolarHBondContact O-CB 3.49Å; I364-T367 PolarHBondContact O-N 3.46Å; I364-T367 PolarHBondContact O-OG1 3.11Å; Q365-T367 VanDerWaalsContact C-N 3.27Å; Q365-T367 PolarHBondContact O-N 3.21Å; T367-S847 CarbonylContact C-O 3.58Å; T367-S847 WeakPolarHBondContact CA-O 3.47Å; T367-S847 WeakPolarHBondContact CG2-O 3.43Å; T367-I848 HydrophobicContact CG2-CG2 4.06Å
368	V	90.2	Very high	89.6	Confident	54 Å²	54	38.4 Å²	38.4	33%	0.327	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.1	178	-178.4	0	0	0	0	109.8	G366 R370 F846 S847	G366-V368 PolarHBondContact O-N 3.02Å; V368-R370 HydrophobicContact CG1-CG 4.25Å; V368-F846 CarbonylContact O-C 3.52Å; V368-S847 PolarHBondContact N-O 2.84Å; V368-S847 PolarHBondContact O-N 2.65Å
369	V	90.1	Very high	89.6	Confident	9 Å²	9	38.3 Å²	38.3	6%	0.055	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	110.9	173.2	-174.9	0	0	0	0	108.6	M358 Q359 S371 F846	M358-V369 HydrophobicContact CB-CG2 3.78Å; M358-V369 HydrophobicContact SD-CG2 4.02Å; Q359-V369 HydrophobicContact CG-CB 4.27Å; Q359-V369 HydrophobicContact CG-CG2 4Å; Q359-V369 PolarHBondContact NE2-O 2.8Å; V369-S371 WeakPolarHBondContact CG1-O 3.39Å; V369-F846 HydrophobicContact CB-CD1 4.37Å; V369-F846 HydrophobicContact CG1-CD1 3.95Å; V369-F846 HydrophobicContact CG1-CE1 3.71Å; V369-F846 HydrophobicContact CG2-CD1 3.98Å; V369-F846 HydrophobicContact CG2-CE1 4.2Å
370	R	84.3	Confident	89.6	Confident	61 Å²	61	35 Å²	35	23%	0.23	20%	0.201	C	C	.	.			trans	-90	-33.3	179.5	-63.4	-165.9	169.1	89.1	-1.7	112.4	V368 S841 G844 D845	V368-R370 HydrophobicContact CG1-CG 4.25Å; R370-S841 VanDerWaalsContact CZ-C 3.43Å; R370-S841 VanDerWaalsContact CZ-OG 3.31Å; R370-S841 PolarHBondContact NH1-O 2.87Å; R370-S841 PolarHBondContact NH1-OG 3.42Å; R370-S841 PolarHBondContact NH2-OG 3.39Å; R370-G844 WeakPolarHBondContact CB-O 3.45Å; R370-G844 WeakPolarHBondContact CD-O 3.34Å; R370-D845 WeakPolarHBondContact CA-O 3.29Å; R370-D845 PolarHBondContact N-O 3.35Å
371	S	83.2	Confident	89.7	Confident	21 Å²	21	29.3 Å²	29.3	15%	0.147	17%	0.171	C	C	.	.			trans	-108.4	112.9	177	-171.9	0	0	0	0	111.1	V369 T373 D845	V369-S371 WeakPolarHBondContact CG1-O 3.39Å; S371-T373 VanDerWaalsContact C-N 3.32Å; S371-T373 PolarHBondContact OG-OG1 3.41Å; S371-D845 WeakPolarHBondContact CB-OD1 3.18Å; S371-D845 PolarHBondContact N-O 3.31Å
372	T	84.2	Confident	89.8	Confident	24 Å²	24	28.9 Å²	28.9	15%	0.147	17%	0.17	C	C	.	.	S	Bend	trans	-86.5	1.7	179.3	55.6	0	0	0	0	113	R114 K351	R114-T372 PolarHBondContact NE-OG1 3.41Å; R114-T372 PolarHBondContact NH2-O 2.89Å; R114-T372 VanDerWaalsContact NH2-O 3.16Å; R114-T372 PolarHBondContact NH2-OG1 2.85Å; K351-T372 WeakPolarHBondContact CB-O 3.35Å
373	T	84.9	Confident	90.1	Very high	26 Å²	26	24.8 Å²	24.8	16%	0.16	14%	0.141	C	C	.	.	S	Bend	trans	-87.7	-26.6	-175.4	55.1	0	0	0	0	113.9	K288 K351 S371 P375	K288-T373 PolarHBondContact O-OG1 3.45Å; K288-T373 VanDerWaalsContact O-OG1 3.08Å; K351-T373 PolarHBondContact NZ-O 2.83Å; S371-T373 VanDerWaalsContact C-N 3.32Å; S371-T373 PolarHBondContact OG-OG1 3.41Å; T373-P375 VanDerWaalsContact C-CD 3.45Å
374	I	91.4	Very high	90.5	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.005	12%	0.119	C	C	.	.			trans	-116.4	17.6	-169.4	63.9	166.8	0	0	0	118.1	K288 E376 E377 D827 A828 D845 F846	K288-I374 HydrophobicContact CB-CG2 3.92Å; K288-I374 HydrophobicContact CD-CD1 4.23Å; I374-E376 PolarHBondContact O-N 3.33Å; I374-E377 HydrophobicContact CB-CB 4.29Å; I374-E377 HydrophobicContact CB-CG 4Å; I374-E377 HydrophobicContact CG2-CG 4.25Å; I374-E377 WeakPolarHBondContact O-CB 3.25Å; I374-E377 PolarHBondContact O-N 2.79Å; I374-D827 WeakPolarHBondContact CD1-O 3.36Å; I374-A828 HydrophobicContact CD1-CB 4.31Å; I374-D845 HydrophobicContact CD1-CB 3.78Å; I374-D845 VanDerWaalsContact CD1-CG 3.5Å; I374-D845 WeakPolarHBondContact CD1-OD2 3.24Å; I374-F846 HydrophobicContact CD1-CE2 3.94Å; I374-F846 HydrophobicContact CG1-CE2 4.05Å; I374-F846 HydrophobicContact CG1-CZ 4.14Å
375	P	93.3	Very high	90.9	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-33.3	177.8	-30.9	35.8	0	0	0	115.4	K351 Y354 S355 M358 T373 L378 S865	K351-P375 HydrophobicContact CB-CG 4.35Å; Y354-P375 HydrophobicContact CD2-CB 4.35Å; S355-P375 WeakPolarHBondContact OG-CG 3.46Å; M358-P375 HydrophobicContact CE-CB 3.96Å; T373-P375 VanDerWaalsContact C-CD 3.45Å; P375-L378 WeakPolarHBondContact O-CB 3.49Å; P375-S865 WeakPolarHBondContact O-CB 3.43Å
376	E	92.7	Very high	91.3	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-23.2	-180	59.8	-160.7	176.2	0	0	114.6	L292 K351 I374 L378 G379 S869	L292-E376 HydrophobicContact CB-CG 4.19Å; L292-E376 WeakPolarHBondContact CD2-OE2 3.47Å; K351-E376 WeakPolarHBondContact CE-OE1 3.44Å; K351-E376 IonicContact NZ-OE1 3.51Å; K351-E376 PolarHBondContact NZ-OE1 2.81Å; I374-E376 PolarHBondContact O-N 3.33Å; E376-L378 PolarHBondContact O-N 3.2Å; E376-G379 PolarHBondContact O-N 2.67Å; E376-S869 WeakPolarHBondContact OE2-CB 3.42Å; E376-S869 PolarHBondContact OE2-OG 3Å
377	E	92.3	Very high	91.7	Very high	3 Å²	3	11.5 Å²	11.5	1%	0.014	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-66	-29.2	176.1	-68.1	-54	112.7	0	0	111.8	G290 L291 I374 G379 R380 I381 R809	G290-E377 VanDerWaalsContact CA-OE1 3.29Å; G290-E377 WeakPolarHBondContact CA-OE1 3.45Å; L291-E377 WeakPolarHBondContact CA-OE1 3.41Å; L291-E377 WeakPolarHBondContact CB-OE1 3.3Å; L291-E377 WeakPolarHBondContact CB-OE2 3.43Å; L291-E377 PolarHBondContact N-OE1 3.22Å; L291-E377 PolarHBondContact N-OE2 3.39Å; I374-E377 HydrophobicContact CB-CB 4.29Å; I374-E377 HydrophobicContact CB-CG 4Å; I374-E377 HydrophobicContact CG2-CG 4.25Å; I374-E377 WeakPolarHBondContact O-CB 3.25Å; I374-E377 PolarHBondContact O-N 2.79Å; E377-G379 PolarHBondContact O-N 3.02Å; E377-G379 VanDerWaalsContact O-N 3.13Å; E377-R380 PolarHBondContact O-N 3.06Å; E377-I381 PolarHBondContact O-N 2.9Å; E377-R809 WeakPolarHBondContact OE2-CD 3.23Å; E377-R809 IonicContact OE2-CZ 2.82Å; E377-R809 IonicContact OE2-NE 3.85Å; E377-R809 PolarHBondContact OE2-NE 3.08Å; E377-R809 IonicContact OE2-NH2 2.76Å
378	L	94.8	Very high	91.7	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-58.8	-23.8	175.6	-65.5	177.6	0	0	0	112.7	M358 P375 E376 R380 A828 F846 L857 L858 Y940	M358-L378 HydrophobicContact CE-CD1 3.76Å; M358-L378 HydrophobicContact SD-CD1 4.35Å; P375-L378 WeakPolarHBondContact O-CB 3.49Å; E376-L378 PolarHBondContact O-N 3.2Å; L378-R380 VanDerWaalsContact C-N 3.25Å; L378-R380 PolarHBondContact O-N 3.41Å; L378-A828 HydrophobicContact CD2-CB 4.03Å; L378-F846 HydrophobicContact CD1-CD1 4.22Å; L378-F846 HydrophobicContact CD1-CD2 4.49Å; L378-F846 HydrophobicContact CD1-CE1 3.64Å; L378-F846 HydrophobicContact CD1-CE2 3.95Å; L378-F846 HydrophobicContact CD1-CZ 3.49Å; L378-F846 VanDerWaalsContact CD1-CZ 3.49Å; L378-F846 HydrophobicContact CD2-CD2 4.1Å; L378-F846 HydrophobicContact CD2-CE2 3.72Å; L378-F846 HydrophobicContact CD2-CZ 4.13Å; L378-F846 HydrophobicContact CG-CE1 4.46Å; L378-F846 HydrophobicContact CG-CE2 3.92Å; L378-F846 HydrophobicContact CG-CZ 3.82Å; L378-L857 HydrophobicContact CD1-CD1 3.92Å; L378-L857 HydrophobicContact CD1-CD2 4.45Å; L378-L857 HydrophobicContact CD1-CG 3.96Å; L378-L858 HydrophobicContact CB-CD2 4.05Å; L378-L858 HydrophobicContact CD2-CD2 3.74Å; L378-L858 HydrophobicContact CG-CD2 4.48Å; L378-L858 WeakPolarHBondContact O-CD2 3.47Å; L378-Y940 PolarHBondContact O-OH 3.38Å
379	G	93.3	Very high	91.4	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	-80.7	-2.3	175.3	0	0	0	0	0	114.3	E376 E377 G862 L943	E376-G379 PolarHBondContact O-N 2.67Å; E377-G379 PolarHBondContact O-N 3.02Å; E377-G379 VanDerWaalsContact O-N 3.13Å; G379-G862 VanDerWaalsContact CA-O 3.27Å; G379-G862 WeakPolarHBondContact CA-O 3.39Å; G379-G862 PolarHBondContact N-O 3.36Å; G379-L943 WeakPolarHBondContact O-CB 3.49Å
380	R	93.2	Very high	91	Very high	18 Å²	18	8.9 Å²	8.9	7%	0.068	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128	-1.7	-169.4	-63.6	-65.5	-70.9	-121.1	-25	114.2	E295 E377 L378 S382 R809 Y866 Y940 L943 G946	E295-R380 IonicContact OE1-NH2 3.66Å; E377-R380 PolarHBondContact O-N 3.06Å; L378-R380 VanDerWaalsContact C-N 3.25Å; L378-R380 PolarHBondContact O-N 3.41Å; R380-S382 PolarHBondContact O-N 3.39Å; R380-R809 HydrophobicContact CB-CG 4.38Å; R380-Y866 HydrophobicContact CG-CD2 4.07Å; R380-Y866 HydrophobicContact CG-CE2 4.28Å; R380-Y866 HydrophobicContact CG-CG 4.33Å; R380-Y866 PolarHBondContact NH1-OH 2.97Å; R380-Y940 PolarHBondContact N-OH 2.9Å; R380-L943 WeakPolarHBondContact CD-O 3.08Å; R380-L943 VanDerWaalsContact CZ-O 3.29Å; R380-L943 PolarHBondContact NE-O 2.93Å; R380-L943 PolarHBondContact NH1-O 3.21Å; R380-G946 VanDerWaalsContact NH2-CA 3.35Å
381	I	95.4	Very high	91.2	Very high	1 Å²	1	6 Å²	6	1%	0.005	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	128.5	176.9	-60	-53.8	0	0	0	109.9	E377 Y383 V384 R809 C811 A828 L858 Y940	E377-I381 PolarHBondContact O-N 2.9Å; I381-Y383 VanDerWaalsContact CG2-O 3.28Å; I381-Y383 WeakPolarHBondContact CG2-O 3.17Å; I381-V384 HydrophobicContact CG2-CG2 3.97Å; I381-R809 HydrophobicContact CD1-CB 4.1Å; I381-C811 HydrophobicContact CB-CB 4.38Å; I381-C811 HydrophobicContact CD1-CB 3.95Å; I381-C811 HydrophobicContact CG1-CB 4.01Å; I381-C811 HydrophobicContact CG2-CB 3.48Å; I381-C811 VanDerWaalsContact CG2-CB 3.48Å; I381-A828 HydrophobicContact CD1-CB 4.03Å; I381-L858 HydrophobicContact CB-CD2 4.25Å; I381-L858 HydrophobicContact CG1-CD2 3.88Å; I381-Y940 PolarHBondContact N-OH 2.91Å; I381-Y940 VanDerWaalsContact N-OH 3.08Å; I381-Y940 WeakPolarHBondContact O-CE1 3.3Å; I381-Y940 PolarHBondContact O-OH 3.09Å
382	S	94.4	Very high	91.7	Very high	16 Å²	16	5 Å²	5	11%	0.112	3%	0.03	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-23.4	176.1	-58	0	0	0	0	112.8	R380 R702 R809	R380-S382 PolarHBondContact O-N 3.39Å; S382-R702 PolarHBondContact O-N 3.49Å; S382-R809 PolarHBondContact N-O 3.49Å
383	Y	96	Very high	92	Very high	2 Å²	2	3.8 Å²	3.8	1%	0.008	2%	0.023	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	132	175.9	-73.2	-87.4	0	0	0	109.7	I381 R702 W704 I802 T806 K808 R809 T810 C811	I381-Y383 VanDerWaalsContact CG2-O 3.28Å; I381-Y383 WeakPolarHBondContact CG2-O 3.17Å; Y383-R702 CarbonylContact C-O 3.59Å; Y383-R702 VanDerWaalsContact CA-O 3.31Å; Y383-R702 WeakPolarHBondContact CA-O 3.41Å; Y383-R702 HydrophobicContact CD1-CB 3.68Å; Y383-R702 HydrophobicContact CE1-CB 3.74Å; Y383-R702 HydrophobicContact CE1-CG 4.27Å; Y383-R702 HydrophobicContact CG-CB 4.49Å; Y383-R702 PolarHBondContact OH-NH1 3.06Å; Y383-W704 HydrophobicContact CE1-CZ2 4.38Å; Y383-W704 AromaticContact CE1-NE1 3.97Å; Y383-I802 HydrophobicContact CD1-CG2 4.19Å; Y383-I802 HydrophobicContact CD2-CG2 3.64Å; Y383-I802 HydrophobicContact CE1-CG2 4.35Å; Y383-I802 HydrophobicContact CE2-CG2 3.79Å; Y383-I802 HydrophobicContact CG-CG2 3.86Å; Y383-T806 HydrophobicContact CE2-CG2 4.05Å; Y383-K808 HydrophobicContact CD2-CB 4.2Å; Y383-K808 HydrophobicContact CE2-CB 4.16Å; Y383-K808 HydrophobicContact CE2-CD 3.92Å; Y383-R809 PolarHBondContact N-O 2.91Å; Y383-T810 CarbonylContact O-C 3.57Å; Y383-T810 WeakPolarHBondContact O-CA 3.24Å; Y383-C811 PolarHBondContact O-N 3.38Å
384	V	96.9	Very high	92	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.028	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.8	168.3	169.3	0	0	0	0	107.3	I381 V701 R702 V703 W704 C811 V813 I854 L858	I381-V384 HydrophobicContact CG2-CG2 3.97Å; V384-V701 HydrophobicContact CB-CG1 4.11Å; V384-V701 HydrophobicContact CG2-CG1 3.5Å; V384-R702 PolarHBondContact N-O 3.23Å; V384-V703 HydrophobicContact CB-CG2 4.37Å; V384-V703 HydrophobicContact CG1-CG1 4.46Å; V384-V703 CarbonylContact O-C 3.56Å; V384-V703 VanDerWaalsContact O-CA 3.27Å; V384-V703 WeakPolarHBondContact O-CA 3.19Å; V384-W704 PolarHBondContact O-N 3.38Å; V384-C811 CarbonylContact C-O 3.55Å; V384-C811 WeakPolarHBondContact CA-O 3.43Å; V384-C811 HydrophobicContact CG2-CB 4.11Å; V384-V813 HydrophobicContact CG1-CG2 4Å; V384-I854 HydrophobicContact CG1-CD1 4.26Å; V384-L858 HydrophobicContact CG2-CD1 4.16Å
385	L	96.8	Very high	91.4	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	124.8	171.9	-56.9	99.1	0	0	0	107.5	W704 L706 V798 V799 I802 T810 C811 A812 V813 M822	L385-W704 CarbonylContact C-O 3.58Å; L385-W704 WeakPolarHBondContact CA-O 3.12Å; L385-W704 HydrophobicContact CG-CB 4.5Å; L385-L706 HydrophobicContact CB-CD1 4.32Å; L385-L706 HydrophobicContact CD2-CD1 3.5Å; L385-L706 VanDerWaalsContact CD2-CD1 3.5Å; L385-L706 HydrophobicContact CD2-CG 4.19Å; L385-V798 HydrophobicContact CD2-CG1 4.12Å; L385-V799 HydrophobicContact CD1-CG2 4.04Å; L385-V799 HydrophobicContact CD2-CG2 3.75Å; L385-V799 HydrophobicContact CG-CG2 4.34Å; L385-I802 HydrophobicContact CD2-CD1 3.85Å; L385-T810 HydrophobicContact CD1-CG2 4.24Å; L385-C811 PolarHBondContact N-O 3.13Å; L385-A812 CarbonylContact O-C 3.47Å; L385-A812 VanDerWaalsContact O-CA 3.27Å; L385-A812 WeakPolarHBondContact O-CA 3.33Å; L385-V813 PolarHBondContact O-N 3.47Å; L385-M822 HydrophobicContact CB-SD 4.12Å
386	T	95.3	Very high	91	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	141	-175.9	-174.4	0	0	0	0	110.2	T391 L392 V703 W704 M705 L706 V813	T386-T391 VanDerWaalsContact OG1-CG2 3.22Å; T386-T391 WeakPolarHBondContact OG1-CG2 3.37Å; T386-L392 HydrophobicContact CG2-CD1 3.86Å; T386-L392 HydrophobicContact CG2-CD2 4.39Å; T386-L392 HydrophobicContact CG2-CG 4.3Å; T386-V703 HydrophobicContact CG2-CG1 3.95Å; T386-W704 PolarHBondContact N-O 3.13Å; T386-M705 WeakPolarHBondContact O-CA 3.24Å; T386-L706 PolarHBondContact O-N 3.47Å; T386-V813 WeakPolarHBondContact CA-O 3.43Å
387	D	92.5	Very high	90.7	Very high	2 Å²	2	12.3 Å²	12.3	1%	0.011	6%	0.063	C	C	.	.			trans	-74.3	165.8	163.1	-166.3	62.3	0	0	0	111.1	T389 L392 K795 V813 D819	D387-T389 PolarHBondContact OD2-N 3.29Å; D387-T389 VanDerWaalsContact OD2-O 3.1Å; D387-L392 WeakPolarHBondContact O-CG 3.49Å; D387-K795 IonicContact OD1-NZ 3.97Å; D387-K795 PolarHBondContact OD1-NZ 2.91Å; D387-V813 PolarHBondContact N-O 2.95Å; D387-D819 WeakPolarHBondContact CB-OD2 3.33Å
388	K	90.1	Very high	90.6	Very high	2 Å²	2	14 Å²	14	1%	0.009	7%	0.073	C	C	.	.	S	Bend	trans	-94.3	-57.8	179.6	-173.8	-126.5	69.6	154	0	111.3	L392 T393 D683 M705 T707 D709 T713 I717	K388-L392 PolarHBondContact O-N 3.01Å; K388-L392 VanDerWaalsContact O-N 3.08Å; K388-T393 PolarHBondContact O-N 3.33Å; K388-T393 VanDerWaalsContact O-N 3.09Å; K388-D683 IonicContact NZ-OD2 3.56Å; K388-D683 PolarHBondContact NZ-OD2 3.36Å; K388-M705 HydrophobicContact CB-CG 4.39Å; K388-M705 HydrophobicContact CB-SD 4.23Å; K388-M705 HydrophobicContact CG-SD 4.24Å; K388-T707 HydrophobicContact CB-CG2 4.35Å; K388-T707 WeakPolarHBondContact CB-OG1 3.43Å; K388-D709 HydrophobicContact CD-CB 4.42Å; K388-D709 VanDerWaalsContact CD-OD2 3.26Å; K388-D709 WeakPolarHBondContact CD-OD2 3.43Å; K388-D709 WeakPolarHBondContact CE-OD2 3.16Å; K388-D709 IonicContact NZ-OD2 3.57Å; K388-D709 PolarHBondContact NZ-OD2 3.28Å; K388-T713 HydrophobicContact CD-CG2 4.19Å; K388-I717 HydrophobicContact CD-CB 4.33Å; K388-I717 HydrophobicContact CD-CG1 3.83Å; K388-I717 HydrophobicContact CG-CB 3.99Å; K388-I717 HydrophobicContact CG-CG1 3.96Å; K388-I717 HydrophobicContact CG-CG2 3.79Å
389	T	84.6	Confident	90.5	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.012	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	133.1	-171.3	-57.6	0	0	0	0	108.2	T194 D387 T391 E836	T194-T389 HydrophobicContact CG2-CG2 3.75Å; D387-T389 PolarHBondContact OD2-N 3.29Å; D387-T389 VanDerWaalsContact OD2-O 3.1Å; T389-T391 PolarHBondContact O-N 2.98Å; T389-E836 WeakPolarHBondContact CG2-OE1 3.2Å
390	G	81.4	Confident	90.5	Very high	7 Å²	7	17.9 Å²	17.9	7%	0.072	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	-16.2	176.6	0	0	0	0	0	115.8	T393 Q686 D815	G390-T393 CarbonylContact C-O 3.57Å; G390-T393 VanDerWaalsContact CA-O 3.27Å; G390-T393 WeakPolarHBondContact CA-O 3.47Å; G390-T393 PolarHBondContact N-O 2.93Å; G390-Q686 PolarHBondContact O-NE2 2.59Å; G390-D815 WeakPolarHBondContact CA-OD2 3.22Å
391	T	89.8	Confident	90.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-60.2	175.8	-63.9	0	0	0	0	112.4	T386 T389 Q686 V813 G814 D815 I832 F851	T386-T391 VanDerWaalsContact OG1-CG2 3.22Å; T386-T391 WeakPolarHBondContact OG1-CG2 3.37Å; T389-T391 PolarHBondContact O-N 2.98Å; T391-Q686 PolarHBondContact O-NE2 2.85Å; T391-Q686 VanDerWaalsContact O-NE2 3.14Å; T391-Q686 PolarHBondContact O-OE1 3.37Å; T391-V813 HydrophobicContact CG2-CB 4.37Å; T391-V813 HydrophobicContact CG2-CG1 3.91Å; T391-G814 VanDerWaalsContact OG1-CA 3.32Å; T391-G814 WeakPolarHBondContact OG1-CA 3.37Å; T391-D815 PolarHBondContact OG1-N 3.46Å; T391-D815 PolarHBondContact OG1-OD1 3.46Å; T391-I832 HydrophobicContact CG2-CD1 3.81Å; T391-F851 HydrophobicContact CG2-CD2 3.96Å; T391-F851 HydrophobicContact CG2-CE2 4.44Å; T391-F851 WeakPolarHBondContact O-CB 3.48Å
392	L	92.2	Very high	90.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-30.8	175.5	-66.4	173.3	0	0	0	111.5	T386 D387 K388 L685 Q686 V689 M705 F851	T386-L392 HydrophobicContact CG2-CD1 3.86Å; T386-L392 HydrophobicContact CG2-CD2 4.39Å; T386-L392 HydrophobicContact CG2-CG 4.3Å; D387-L392 WeakPolarHBondContact O-CG 3.49Å; K388-L392 PolarHBondContact O-N 3.01Å; K388-L392 VanDerWaalsContact O-N 3.08Å; L392-L685 CarbonylContact O-C 3.55Å; L392-L685 WeakPolarHBondContact O-CA 3.38Å; L392-Q686 PolarHBondContact O-N 3.23Å; L392-V689 HydrophobicContact CD2-CG1 3.75Å; L392-M705 HydrophobicContact CD1-CE 3.51Å; L392-F851 HydrophobicContact CD2-CD1 4.03Å; L392-F851 HydrophobicContact CD2-CD2 4.05Å; L392-F851 HydrophobicContact CD2-CE1 3.78Å; L392-F851 HydrophobicContact CD2-CE2 3.8Å; L392-F851 HydrophobicContact CD2-CG 4.16Å; L392-F851 HydrophobicContact CD2-CZ 3.67Å
393	T	90.2	Very high	90.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	157.2	177.5	74.7	0	0	0	0	111.7	K388 G390 D683 R684 L685 I717	K388-T393 PolarHBondContact O-N 3.33Å; K388-T393 VanDerWaalsContact O-N 3.09Å; G390-T393 CarbonylContact C-O 3.57Å; G390-T393 VanDerWaalsContact CA-O 3.27Å; G390-T393 WeakPolarHBondContact CA-O 3.47Å; G390-T393 PolarHBondContact N-O 2.93Å; T393-D683 WeakPolarHBondContact CB-OD1 3.4Å; T393-D683 PolarHBondContact OG1-OD1 2.97Å; T393-R684 CarbonylContact C-O 3.44Å; T393-R684 VanDerWaalsContact CA-O 3.3Å; T393-R684 WeakPolarHBondContact CA-O 3.13Å; T393-R684 WeakPolarHBondContact CB-O 3.14Å; T393-L685 HydrophobicContact CG2-CD2 4.23Å; T393-I717 HydrophobicContact CG2-CD1 3.69Å; T393-I717 HydrophobicContact CG2-CG1 4.05Å; T393-I717 HydrophobicContact CG2-CG2 4.29Å
394	Q	86.1	Confident	90.1	Very high	57 Å²	57	18 Å²	18	27%	0.266	9%	0.089	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	0.8	174.1	-67.7	179.6	-17.5	0	0	112.3	E396 R684 Q686	Q394-E396 HydrophobicContact CB-CB 4.42Å; Q394-E396 PolarHBondContact O-N 3.17Å; Q394-R684 PolarHBondContact N-O 2.98Å; Q394-R684 VanDerWaalsContact OE1-CD 3.28Å; Q394-Q686 HydrophobicContact CG-CB 4.33Å; Q394-Q686 HydrophobicContact CG-CG 3.84Å
395	N	78.3	Confident	89.4	Confident	52 Å²	52	19 Å²	19	28%	0.278	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.3	38.9	-171.5	-160.1	7.2	0	0	0	111.8	T194 E836	T194-N395 WeakPolarHBondContact CG2-ND2 3.26Å; T194-N395 WeakPolarHBondContact CG2-OD1 3.31Å; N395-E836 PolarHBondContact ND2-OE1 3.46Å
396	E	84.4	Confident	88.6	Confident	78 Å²	78	25.9 Å²	25.9	36%	0.364	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	113	177.8	-172.7	-174	-160.6	0	0	108.4	Q394 V398 R684	Q394-E396 HydrophobicContact CB-CB 4.42Å; Q394-E396 PolarHBondContact O-N 3.17Å; E396-V398 HydrophobicContact CG-CG2 4.05Å; E396-R684 HydrophobicContact CB-CB 4.39Å; E396-R684 WeakPolarHBondContact O-CB 3.42Å; E396-R684 PolarHBondContact O-N 2.86Å; E396-R684 VanDerWaalsContact OE2-CD 3.3Å; E396-R684 WeakPolarHBondContact OE2-CD 3.31Å; E396-R684 IonicContact OE2-CZ 3.71Å; E396-R684 IonicContact OE2-NH1 3.84Å; E396-R684 PolarHBondContact OE2-NH1 3.12Å
397	M	87.4	Confident	88.2	Confident	19 Å²	19	28.9 Å²	28.9	9%	0.094	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.6	175.7	-61.5	-58.5	170.4	0	0	109.5	P525 D526 A529 R627 V681 E682 D683	M397-P525 HydrophobicContact CB-CB 4.45Å; M397-P525 HydrophobicContact CE-CG 4.17Å; M397-P525 HydrophobicContact CG-CB 3.76Å; M397-P525 HydrophobicContact CG-CG 3.92Å; M397-D526 WeakPolarHBondContact CG-OD1 3.47Å; M397-A529 HydrophobicContact CB-CB 3.79Å; M397-A529 VanDerWaalsContact O-CB 3.27Å; M397-A529 WeakPolarHBondContact O-CB 3.27Å; M397-R627 VanDerWaalsContact CE-NH2 3.31Å; M397-V681 HydrophobicContact CB-CG1 4.03Å; M397-E682 WeakPolarHBondContact CA-O 3.44Å; M397-D683 HydrophobicContact CE-CB 3.94Å; M397-D683 HydrophobicContact SD-CB 3.58Å; M397-D683 VanDerWaalsContact SD-CB 3.58Å
398	V	90.6	Very high	88	Confident	37 Å²	37	31.2 Å²	31.2	22%	0.224	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127	-177.5	-177.5	0	0	0	0	109.5	E396 K400 E682	E396-V398 HydrophobicContact CG-CG2 4.05Å; V398-K400 HydrophobicContact CG1-CD 4.18Å; V398-K400 PolarHBondContact O-N 3.37Å; V398-E682 PolarHBondContact N-O 2.91Å; V398-E682 PolarHBondContact O-N 3.45Å
399	F	92.8	Very high	88	Confident	10 Å²	10	31.9 Å²	31.9	4%	0.044	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	122.4	171.5	-167.5	-90.7	0	0	0	110	I402 F414 L470 L530 W533 T679 V681	F399-I402 HydrophobicContact CE1-CB 3.99Å; F399-I402 HydrophobicContact CE1-CG2 4.35Å; F399-I402 HydrophobicContact CZ-CB 3.81Å; F399-I402 HydrophobicContact CZ-CD1 4.38Å; F399-I402 HydrophobicContact CZ-CG1 4.43Å; F399-F414 HydrophobicContact CD1-CE1 4.25Å; F399-F414 AromaticContact CD1-CE2 3.85Å; F399-F414 HydrophobicContact CD1-CE2 3.85Å; F399-F414 AromaticContact CD1-CZ 3.47Å; F399-F414 HydrophobicContact CD1-CZ 3.47Å; F399-F414 VanDerWaalsContact CD1-CZ 3.47Å; F399-F414 HydrophobicContact CE1-CE1 4.05Å; F399-F414 HydrophobicContact CE1-CE2 4.45Å; F399-F414 AromaticContact CE1-CZ 3.71Å; F399-F414 HydrophobicContact CE1-CZ 3.71Å; F399-L470 HydrophobicContact CE2-CD1 4.46Å; F399-L470 HydrophobicContact CZ-CD1 4.46Å; F399-L530 HydrophobicContact CD2-CD2 3.42Å; F399-L530 VanDerWaalsContact CD2-CD2 3.42Å; F399-L530 HydrophobicContact CE2-CD2 3.38Å; F399-W533 HydrophobicContact CB-CB 3.7Å; F399-W533 HydrophobicContact CB-CG 3.85Å; F399-W533 HydrophobicContact CD1-CB 4.23Å; F399-W533 AromaticContact CD1-CD1 3.41Å; F399-W533 VanDerWaalsContact CD1-CD1 3.41Å; F399-W533 AromaticContact CD1-CD2 3.57Å; F399-W533 HydrophobicContact CD1-CD2 3.57Å; F399-W533 AromaticContact CD1-CE2 3.55Å; F399-W533 HydrophobicContact CD1-CE3 4.37Å; F399-W533 AromaticContact CD1-CG 3.46Å; F399-W533 HydrophobicContact CD1-CG 3.46Å; F399-W533 VanDerWaalsContact CD1-CG 3.46Å; F399-W533 HydrophobicContact CD1-CZ2 4.3Å; F399-W533 AromaticContact CD1-NE1 3.42Å; F399-W533 HydrophobicContact CD2-CD2 4.49Å; F399-W533 HydrophobicContact CD2-CG 4.42Å; F399-W533 AromaticContact CE1-CD2 3.62Å; F399-W533 HydrophobicContact CE1-CD2 3.62Å; F399-W533 AromaticContact CE1-CE2 3.38Å; F399-W533 HydrophobicContact CE1-CE3 4.11Å; F399-W533 HydrophobicContact CE1-CG 4.05Å; F399-W533 HydrophobicContact CE1-CH2 4.17Å; F399-W533 AromaticContact CE1-CZ2 3.67Å; F399-W533 HydrophobicContact CE1-CZ2 3.67Å; F399-W533 HydrophobicContact CE1-CZ3 4.38Å; F399-W533 AromaticContact CE1-NE1 3.69Å; F399-W533 HydrophobicContact CE2-CE3 4.43Å; F399-W533 HydrophobicContact CG-CB 3.92Å; F399-W533 AromaticContact CG-CD1 3.95Å; F399-W533 HydrophobicContact CG-CD2 4.01Å; F399-W533 AromaticContact CG-CG 3.66Å; F399-W533 HydrophobicContact CG-CG 3.66Å; F399-W533 HydrophobicContact CZ-CD2 4.08Å; F399-W533 HydrophobicContact CZ-CE3 4.12Å; F399-W533 HydrophobicContact CZ-CH2 4.3Å; F399-W533 HydrophobicContact CZ-CZ2 4.26Å; F399-W533 HydrophobicContact CZ-CZ3 4.24Å; F399-T679 HydrophobicContact CE2-CG2 3.73Å; F399-T679 HydrophobicContact CZ-CG2 3.88Å; F399-V681 HydrophobicContact CD2-CG2 4.21Å
400	K	92	Very high	88.2	Confident	72 Å²	72	35 Å²	35	31%	0.313	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-35.6	-173.5	-76.9	-54.8	-163.6	-177	0	114.6	V398 A411 F414 L626 G680 E682	V398-K400 HydrophobicContact CG1-CD 4.18Å; V398-K400 PolarHBondContact O-N 3.37Å; K400-A411 PolarHBondContact O-N 3.35Å; K400-F414 WeakPolarHBondContact O-CZ 3.39Å; K400-L626 HydrophobicContact CB-CD1 4.44Å; K400-L626 HydrophobicContact CB-CD2 3.92Å; K400-L626 HydrophobicContact CG-CD2 4.14Å; K400-G680 PolarHBondContact N-O 3.44Å; K400-E682 WeakPolarHBondContact CE-OE2 3.4Å; K400-E682 HydrophobicContact CG-CB 3.54Å; K400-E682 IonicContact NZ-OE2 2.68Å
401	K	93.1	Very high	88.3	Confident	18 Å²	18	36.9 Å²	36.9	8%	0.078	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	144.7	-171.1	-162.6	163.8	-169.8	166.6	0	112.2	H409 D410 M621 E624 L626 T679 G680	K401-H409 WeakPolarHBondContact CA-O 3.17Å; K401-D410 WeakPolarHBondContact CD-OD1 3.28Å; K401-D410 WeakPolarHBondContact CE-OD1 3.19Å; K401-D410 WeakPolarHBondContact CG-OD1 3.2Å; K401-D410 IonicContact NZ-OD1 3.45Å; K401-M621 HydrophobicContact CB-CE 4.43Å; K401-M621 HydrophobicContact CD-CE 3.88Å; K401-M621 HydrophobicContact CD-CG 4.29Å; K401-M621 HydrophobicContact CD-SD 4.48Å; K401-M621 HydrophobicContact CG-CE 3.83Å; K401-E624 IonicContact NZ-OE1 3.8Å; K401-E624 IonicContact NZ-OE2 2.85Å; K401-L626 HydrophobicContact CB-CD1 4.02Å; K401-L626 HydrophobicContact CD-CD1 4.38Å; K401-T679 CarbonylContact O-C 3.56Å; K401-T679 WeakPolarHBondContact O-CA 3.32Å; K401-G680 PolarHBondContact N-O 3.29Å; K401-G680 VanDerWaalsContact N-O 3.16Å; K401-G680 PolarHBondContact O-N 3.19Å
402	I	93.8	Very high	88.1	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	132.5	168.3	-171.8	169	0	0	0	109.9	F399 L404 S408 H409 F414 I417 A466 L470 W533 C677 L678 T679	F399-I402 HydrophobicContact CE1-CB 3.99Å; F399-I402 HydrophobicContact CE1-CG2 4.35Å; F399-I402 HydrophobicContact CZ-CB 3.81Å; F399-I402 HydrophobicContact CZ-CD1 4.38Å; F399-I402 HydrophobicContact CZ-CG1 4.43Å; I402-L404 HydrophobicContact CD1-CD2 4.31Å; I402-L404 HydrophobicContact CG1-CD2 4.37Å; I402-S408 CarbonylContact O-C 3.46Å; I402-S408 WeakPolarHBondContact O-CA 3.42Å; I402-H409 HydrophobicContact CG2-CB 3.74Å; I402-H409 PolarHBondContact N-O 3.49Å; I402-H409 PolarHBondContact O-N 3.41Å; I402-F414 HydrophobicContact CG2-CE1 4.3Å; I402-I417 HydrophobicContact CG2-CD1 3.96Å; I402-A466 HydrophobicContact CD1-CB 4.26Å; I402-L470 HydrophobicContact CD1-CD1 4.07Å; I402-W533 HydrophobicContact CD1-CH2 3.96Å; I402-W533 HydrophobicContact CD1-CZ3 4.49Å; I402-W533 HydrophobicContact CG2-CH2 4.47Å; I402-W533 HydrophobicContact CG2-CZ2 4.29Å; I402-C677 HydrophobicContact CD1-CB 4.04Å; I402-C677 HydrophobicContact CG1-CB 3.9Å; I402-L678 CarbonylContact C-O 3.49Å; I402-L678 WeakPolarHBondContact CA-O 3.23Å; I402-T679 HydrophobicContact CD1-CG2 4.44Å; I402-T679 HydrophobicContact CG1-CG2 4.28Å
403	H	93.3	Very high	87.9	Confident	16 Å²	16	46.3 Å²	46.3	7%	0.074	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.1	178.6	-166.9	-68.5	0	0	0	110	G405 W613 E617 M621 C677 L678	H403-G405 VanDerWaalsContact CE1-CA 3.41Å; H403-G405 WeakPolarHBondContact CE1-CA 3.47Å; H403-G405 PolarHBondContact CE1-N 2.98Å; H403-G405 PolarHBondContact CE1-O 2.86Å; H403-G405 WeakPolarHBondContact ND1-CA 3.45Å; H403-G405 PolarHBondContact ND1-N 3.18Å; H403-W613 HydrophobicContact CB-CZ3 4.15Å; H403-W613 AromaticContact CE1-CE3 3.57Å; H403-W613 AromaticContact CE1-CZ3 3.82Å; H403-W613 AromaticContact CG-CZ3 3.78Å; H403-W613 AromaticContact ND1-CE3 3.32Å; H403-W613 VanDerWaalsContact ND1-CE3 3.32Å; H403-W613 AromaticContact ND1-CH2 3.59Å; H403-W613 AromaticContact ND1-CZ3 3.07Å; H403-W613 WeakPolarHBondContact ND1-CZ3 3.25Å; H403-E617 IonicContact CD2-OE2 4Å; H403-M621 HydrophobicContact CB-CE 3.58Å; H403-C677 CarbonylContact O-C 3.06Å; H403-C677 VanDerWaalsContact O-CA 3.23Å; H403-C677 WeakPolarHBondContact O-CA 3.3Å; H403-C677 WeakPolarHBondContact O-CB 3.38Å; H403-L678 HydrophobicContact CB-CB 4.29Å; H403-L678 PolarHBondContact N-O 2.89Å; H403-L678 PolarHBondContact O-N 2.94Å
404	L	89.8	Confident	87.8	Confident	6 Å²	6	47.2 Å²	47.2	3%	0.031	26%	0.26	C	S	.	.			trans	-108	12.5	-174.2	-60.8	166.3	0	0	0	112.6	I402 I406 V407 R462 E463 A466 C677	I402-L404 HydrophobicContact CD1-CD2 4.31Å; I402-L404 HydrophobicContact CG1-CD2 4.37Å; L404-I406 PolarHBondContact O-N 3.32Å; L404-V407 PolarHBondContact N-O 2.98Å; L404-R462 PolarHBondContact O-NH1 3.31Å; L404-E463 HydrophobicContact CD1-CB 4.34Å; L404-E463 HydrophobicContact CD1-CG 3.58Å; L404-A466 HydrophobicContact CD2-CB 3.47Å; L404-A466 VanDerWaalsContact CD2-CB 3.47Å; L404-C677 HydrophobicContact CD2-CB 3.64Å
405	G	83.6	Confident	87.8	Confident	21 Å²	21	50.7 Å²	50.7	22%	0.216	28%	0.276	C	S	.	.	S	Bend	trans	94.3	-41.7	177.7	0	0	0	0	0	113.9	H403 W613	H403-G405 VanDerWaalsContact CE1-CA 3.41Å; H403-G405 WeakPolarHBondContact CE1-CA 3.47Å; H403-G405 PolarHBondContact CE1-N 2.98Å; H403-G405 PolarHBondContact CE1-O 2.86Å; H403-G405 WeakPolarHBondContact ND1-CA 3.45Å; H403-G405 PolarHBondContact ND1-N 3.18Å; G405-W613 VanDerWaalsContact CA-CZ2 3.42Å
406	I	80.3	Confident	88.1	Confident	144 Å²	144	53.3 Å²	53.3	74%	0.738	29%	0.286	S	S	*	.	S	Bend	trans	-100.9	-33	177.8	-52.2	172.4	0	0	0	110.9	L404	L404-I406 PolarHBondContact O-N 3.32Å
407	V	86	Confident	88.1	Confident	63 Å²	63	49.7 Å²	49.7	38%	0.382	27%	0.269	S	S	.	.			trans	-130.8	137.5	-174.8	-176.1	0	0	0	0	109.1	L404	L404-V407 PolarHBondContact N-O 2.98Å
408	S	87.9	Confident	87.9	Confident	51 Å²	51	49.1 Å²	49.1	36%	0.357	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.6	167.6	64.8	0	0	0	0	109.6	I402	I402-S408 CarbonylContact O-C 3.46Å; I402-S408 WeakPolarHBondContact O-CA 3.42Å
409	H	90.1	Very high	87.6	Confident	15 Å²	15	51.2 Å²	51.2	7%	0.069	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124.3	172.8	-63.7	-78.5	0	0	0	109.8	K401 I402 T413 F414 I417	K401-H409 WeakPolarHBondContact CA-O 3.17Å; I402-H409 HydrophobicContact CG2-CB 3.74Å; I402-H409 PolarHBondContact N-O 3.49Å; I402-H409 PolarHBondContact O-N 3.41Å; H409-T413 WeakPolarHBondContact CA-OG1 3.49Å; H409-T413 WeakPolarHBondContact CB-OG1 3.13Å; H409-F414 HydrophobicContact CB-CD1 4.28Å; H409-F414 HydrophobicContact CB-CE1 4.34Å; H409-I417 HydrophobicContact CB-CD1 3.88Å
410	D	89.4	Confident	87.1	Confident	68 Å²	68	52.8 Å²	52.8	36%	0.364	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	173.7	169.6	-63.6	-47.4	0	0	0	110.2	K401 D412 T413 F414	K401-D410 WeakPolarHBondContact CD-OD1 3.28Å; K401-D410 WeakPolarHBondContact CE-OD1 3.19Å; K401-D410 WeakPolarHBondContact CG-OD1 3.2Å; K401-D410 IonicContact NZ-OD1 3.45Å; D410-D412 PolarHBondContact O-N 3.04Å; D410-D412 VanDerWaalsContact O-N 3.08Å; D410-T413 PolarHBondContact N-OG1 2.67Å; D410-T413 PolarHBondContact O-N 3.49Å; D410-T413 PolarHBondContact O-OG1 2.68Å; D410-F414 VanDerWaalsContact O-CD1 3.3Å; D410-F414 WeakPolarHBondContact O-CD1 3.5Å; D410-F414 WeakPolarHBondContact O-CE1 3.43Å; D410-F414 PolarHBondContact O-N 3.28Å
411	A	83.8	Confident	86.6	Confident	46 Å²	46	49.4 Å²	49.4	38%	0.38	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-46.6	-41.1	-177.2	0	0	0	0	0	114.7	K400 T413 F414	K400-A411 PolarHBondContact O-N 3.35Å; A411-T413 PolarHBondContact O-N 3.29Å; A411-F414 HydrophobicContact CB-CE2 4.22Å; A411-F414 PolarHBondContact O-N 2.98Å
412	D	84.6	Confident	85.9	Confident	156 Å²	156	52 Å²	52	83%	0.834	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-70.1	-19.3	-178.6	-59.2	-31.6	0	0	0	113.1	D410	D410-D412 PolarHBondContact O-N 3.04Å; D410-D412 VanDerWaalsContact O-N 3.08Å
413	T	88	Confident	85.2	Confident	42 Å²	42	59 Å²	59	26%	0.258	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-104.1	-2.8	-175.9	64.3	0	0	0	0	113.8	H409 D410 A411 H415 H416	H409-T413 WeakPolarHBondContact CA-OG1 3.49Å; H409-T413 WeakPolarHBondContact CB-OG1 3.13Å; D410-T413 PolarHBondContact N-OG1 2.67Å; D410-T413 PolarHBondContact O-N 3.49Å; D410-T413 PolarHBondContact O-OG1 2.68Å; A411-T413 PolarHBondContact O-N 3.29Å; T413-H415 PolarHBondContact O-N 3.21Å; T413-H416 WeakPolarHBondContact O-CB 3.03Å; T413-H416 PolarHBondContact O-N 3.06Å
414	F	88.4	Confident	84.3	Confident	20 Å²	20	58.8 Å²	58.8	9%	0.088	31%	0.312	C	S	.	.	H	α-helix	trans	-60.9	-30.7	-178.9	-68.2	-19.8	0	0	0	113.6	F399 K400 I402 H409 D410 A411 H416 I417 G418 W533	F399-F414 HydrophobicContact CD1-CE1 4.25Å; F399-F414 AromaticContact CD1-CE2 3.85Å; F399-F414 HydrophobicContact CD1-CE2 3.85Å; F399-F414 AromaticContact CD1-CZ 3.47Å; F399-F414 HydrophobicContact CD1-CZ 3.47Å; F399-F414 VanDerWaalsContact CD1-CZ 3.47Å; F399-F414 HydrophobicContact CE1-CE1 4.05Å; F399-F414 HydrophobicContact CE1-CE2 4.45Å; F399-F414 AromaticContact CE1-CZ 3.71Å; F399-F414 HydrophobicContact CE1-CZ 3.71Å; K400-F414 WeakPolarHBondContact O-CZ 3.39Å; I402-F414 HydrophobicContact CG2-CE1 4.3Å; H409-F414 HydrophobicContact CB-CD1 4.28Å; H409-F414 HydrophobicContact CB-CE1 4.34Å; D410-F414 VanDerWaalsContact O-CD1 3.3Å; D410-F414 WeakPolarHBondContact O-CD1 3.5Å; D410-F414 WeakPolarHBondContact O-CE1 3.43Å; D410-F414 PolarHBondContact O-N 3.28Å; A411-F414 HydrophobicContact CB-CE2 4.22Å; A411-F414 PolarHBondContact O-N 2.98Å; F414-H416 PolarHBondContact O-N 2.82Å; F414-I417 HydrophobicContact CD1-CD1 4.29Å; F414-I417 WeakPolarHBondContact O-CB 3.41Å; F414-I417 PolarHBondContact O-N 3.26Å; F414-G418 PolarHBondContact O-N 3.47Å; F414-W533 HydrophobicContact CD1-CZ2 4.22Å; F414-W533 AromaticContact CD1-NE1 3.7Å; F414-W533 AromaticContact CD2-CD1 3.68Å; F414-W533 AromaticContact CD2-NE1 3.16Å; F414-W533 HydrophobicContact CE1-CZ2 4.32Å; F414-W533 AromaticContact CE1-NE1 3.8Å; F414-W533 AromaticContact CE2-CD1 3.64Å; F414-W533 AromaticContact CE2-NE1 3.26Å; F414-W533 VanDerWaalsContact CE2-NE1 3.26Å; F414-W533 AromaticContact CG-NE1 3.39Å; F414-W533 AromaticContact CZ-NE1 3.59Å
415	H	85.5	Confident	83.2	Confident	130 Å²	130	58.7 Å²	58.7	60%	0.602	31%	0.311	S	S	*	.	H	α-helix	trans	-60.1	-31.1	175.6	-173.4	-102	0	0	0	112.6	T413 I417 G418 Q419	T413-H415 PolarHBondContact O-N 3.21Å; H415-I417 VanDerWaalsContact C-N 3.31Å; H415-I417 PolarHBondContact O-N 3.25Å; H415-G418 PolarHBondContact O-N 2.73Å; H415-Q419 PolarHBondContact CE1-NE2 3.35Å; H415-Q419 PolarHBondContact ND1-NE2 2.99Å; H415-Q419 WeakPolarHBondContact O-CG 3.37Å; H415-Q419 PolarHBondContact O-N 3.03Å
416	H	86	Confident	82.2	Confident	106 Å²	106	59.1 Å²	59.1	49%	0.491	32%	0.316	S	S	.	.	H	α-helix	trans	-65.3	-37.1	175.3	-63.6	179	0	0	0	111.6	T413 F414 G418 Q419 M420	T413-H416 WeakPolarHBondContact O-CB 3.03Å; T413-H416 PolarHBondContact O-N 3.06Å; F414-H416 PolarHBondContact O-N 2.82Å; H416-G418 VanDerWaalsContact C-N 3.34Å; H416-Q419 PolarHBondContact O-N 3.16Å; H416-M420 WeakPolarHBondContact O-CG 3.41Å; H416-M420 PolarHBondContact O-N 2.63Å
417	I	84.4	Confident	81.4	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-44.4	175.1	-55	175	0	0	0	109.4	I402 H409 F414 H415 Q419 M420 I421 E463 V467 W533 V537	I402-I417 HydrophobicContact CG2-CD1 3.96Å; H409-I417 HydrophobicContact CB-CD1 3.88Å; F414-I417 HydrophobicContact CD1-CD1 4.29Å; F414-I417 WeakPolarHBondContact O-CB 3.41Å; F414-I417 PolarHBondContact O-N 3.26Å; H415-I417 VanDerWaalsContact C-N 3.31Å; H415-I417 PolarHBondContact O-N 3.25Å; I417-Q419 PolarHBondContact O-N 3.28Å; I417-M420 HydrophobicContact CG1-CE 4.43Å; I417-M420 PolarHBondContact O-N 3.06Å; I417-M420 VanDerWaalsContact O-N 3.11Å; I417-I421 HydrophobicContact CG2-CD1 4.18Å; I417-I421 HydrophobicContact CG2-CG1 4.4Å; I417-I421 WeakPolarHBondContact O-CG1 2.98Å; I417-I421 PolarHBondContact O-N 3.06Å; I417-E463 HydrophobicContact CG2-CB 4.38Å; I417-V467 HydrophobicContact CG2-CG2 3.86Å; I417-W533 HydrophobicContact CD1-CH2 4.38Å; I417-W533 HydrophobicContact CD1-CZ2 3.96Å; I417-V537 HydrophobicContact CB-CG1 3.69Å; I417-V537 HydrophobicContact CG2-CG1 3.42Å; I417-V537 VanDerWaalsContact CG2-CG1 3.42Å
418	G	83.4	Confident	80.3	Confident	8 Å²	8	56.5 Å²	56.5	8%	0.082	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-43.5	178.9	0	0	0	0	0	112.7	F414 H415 H416 M420 I421 Q422 V537	F414-G418 PolarHBondContact O-N 3.47Å; H415-G418 PolarHBondContact O-N 2.73Å; H416-G418 VanDerWaalsContact C-N 3.34Å; G418-M420 VanDerWaalsContact C-N 3.33Å; G418-M420 PolarHBondContact O-N 2.8Å; G418-I421 PolarHBondContact O-N 3.45Å; G418-Q422 WeakPolarHBondContact O-CG 3.14Å; G418-Q422 PolarHBondContact O-N 3.24Å; G418-V537 VanDerWaalsContact CA-O 3.26Å; G418-V537 WeakPolarHBondContact CA-O 3.37Å
419	Q	83.1	Confident	78.6	Confident	80 Å²	80	57 Å²	57	37%	0.374	30%	0.299	S	S	.	.	H	α-helix	trans	-61.4	-38.6	174	-71.2	-178.7	-12.3	0	0	112.8	H415 H416 I417 K423	H415-Q419 PolarHBondContact CE1-NE2 3.35Å; H415-Q419 PolarHBondContact ND1-NE2 2.99Å; H415-Q419 WeakPolarHBondContact O-CG 3.37Å; H415-Q419 PolarHBondContact O-N 3.03Å; H416-Q419 PolarHBondContact O-N 3.16Å; I417-Q419 PolarHBondContact O-N 3.28Å; Q419-K423 WeakPolarHBondContact O-CG 3.45Å; Q419-K423 PolarHBondContact O-N 2.79Å
420	M	82.6	Confident	76.7	Confident	43 Å²	43	63.2 Å²	63.2	21%	0.212	33%	0.328	C	S	.	.	H	α-helix	trans	-67.1	-42.3	176.6	-74.7	-172.2	-73.1	0	0	111.8	H416 I417 G418 Q422 K423 L424 E463	H416-M420 WeakPolarHBondContact O-CG 3.41Å; H416-M420 PolarHBondContact O-N 2.63Å; I417-M420 HydrophobicContact CG1-CE 4.43Å; I417-M420 PolarHBondContact O-N 3.06Å; I417-M420 VanDerWaalsContact O-N 3.11Å; G418-M420 VanDerWaalsContact C-N 3.33Å; G418-M420 PolarHBondContact O-N 2.8Å; M420-Q422 VanDerWaalsContact C-N 3.33Å; M420-Q422 PolarHBondContact O-N 3.19Å; M420-K423 PolarHBondContact O-N 2.74Å; M420-L424 WeakPolarHBondContact O-CB 3.36Å; M420-L424 WeakPolarHBondContact O-CG 3.38Å; M420-L424 PolarHBondContact O-N 2.85Å; M420-E463 HydrophobicContact CE-CB 4.42Å; M420-E463 HydrophobicContact CE-CG 3.7Å; M420-E463 HydrophobicContact SD-CG 4.44Å
421	I	81.6	Confident	74.9	Confident	1 Å²	1	67 Å²	67	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-61.2	-43.9	176.2	-67.5	-174.6	0	0	0	110.8	I417 G418 K423 L424 S425 W464 V467 V537 V553	I417-I421 HydrophobicContact CG2-CD1 4.18Å; I417-I421 HydrophobicContact CG2-CG1 4.4Å; I417-I421 WeakPolarHBondContact O-CG1 2.98Å; I417-I421 PolarHBondContact O-N 3.06Å; G418-I421 PolarHBondContact O-N 3.45Å; I421-K423 PolarHBondContact O-N 3.26Å; I421-L424 PolarHBondContact O-N 3.46Å; I421-S425 PolarHBondContact O-N 3.46Å; I421-S425 PolarHBondContact O-OG 3.14Å; I421-W464 HydrophobicContact CB-CE3 4.44Å; I421-W464 HydrophobicContact CD1-CE3 4.33Å; I421-W464 HydrophobicContact CG1-CE3 4.08Å; I421-W464 HydrophobicContact CG2-CE3 3.85Å; I421-W464 HydrophobicContact CG2-CZ3 3.65Å; I421-V467 HydrophobicContact CD1-CB 3.86Å; I421-V467 HydrophobicContact CD1-CG1 3.71Å; I421-V467 HydrophobicContact CD1-CG2 3.82Å; I421-V537 HydrophobicContact CD1-CG1 3.81Å; I421-V553 HydrophobicContact CG2-CG1 4.09Å
422	Q	78.2	Confident	73.1	Confident	74 Å²	74	69.4 Å²	69.4	35%	0.346	35%	0.347	S	S	.	.	H	α-helix	trans	-64.3	-37.9	176.3	-71.7	174.2	-3.7	0	0	113.1	G418 M420 S425 G426	G418-Q422 WeakPolarHBondContact O-CG 3.14Å; G418-Q422 PolarHBondContact O-N 3.24Å; M420-Q422 VanDerWaalsContact C-N 3.33Å; M420-Q422 PolarHBondContact O-N 3.19Å; Q422-S425 PolarHBondContact O-OG 2.88Å; Q422-G426 PolarHBondContact O-N 3.02Å
423	K	78.3	Confident	71.1	Confident	147 Å²	147	70 Å²	70	64%	0.639	35%	0.345	S	S	*	.	H	α-helix	trans	-67.3	-41.2	175.1	-75.3	175	-177.4	178.3	0	111.9	Q419 M420 I421 G426 N427	Q419-K423 WeakPolarHBondContact O-CG 3.45Å; Q419-K423 PolarHBondContact O-N 2.79Å; M420-K423 PolarHBondContact O-N 2.74Å; I421-K423 PolarHBondContact O-N 3.26Å; K423-G426 PolarHBondContact O-N 2.9Å; K423-N427 PolarHBondContact O-N 3.21Å
424	L	74.9	Confident	68.9	Low	12 Å²	12	70.9 Å²	70.9	6%	0.063	36%	0.362	C	S	.	.	H	α-helix	trans	-68.1	-37.9	178.8	-76.4	166.6	0	0	0	111.9	M420 I421 G426 N427 I428 P458 G460 W464	M420-L424 WeakPolarHBondContact O-CB 3.36Å; M420-L424 WeakPolarHBondContact O-CG 3.38Å; M420-L424 PolarHBondContact O-N 2.85Å; I421-L424 PolarHBondContact O-N 3.46Å; L424-G426 VanDerWaalsContact C-N 3.32Å; L424-G426 PolarHBondContact O-N 2.55Å; L424-N427 PolarHBondContact O-N 3.04Å; L424-I428 VanDerWaalsContact O-CG1 3.28Å; L424-I428 WeakPolarHBondContact O-CG1 3.26Å; L424-I428 PolarHBondContact O-N 3.47Å; L424-P458 HydrophobicContact CD2-CB 3.96Å; L424-P458 HydrophobicContact CD2-CG 3.9Å; L424-G460 WeakPolarHBondContact CD1-O 3.44Å; L424-W464 HydrophobicContact CD1-CB 3.91Å
425	S	67.6	Low	66.5	Low	3 Å²	3	74.9 Å²	74.9	2%	0.021	39%	0.392	C	S	.	.	H	α-helix	trans	-62.3	-39	176.2	69	0	0	0	0	112.2	I421 Q422 N427 I428 L429	I421-S425 PolarHBondContact O-N 3.46Å; I421-S425 PolarHBondContact O-OG 3.14Å; Q422-S425 PolarHBondContact O-OG 2.88Å; S425-N427 PolarHBondContact O-N 2.87Å; S425-I428 PolarHBondContact O-N 3.34Å; S425-L429 PolarHBondContact O-N 3.14Å
426	G	62.7	Low	64.2	Low	31 Å²	31	76.5 Å²	76.5	32%	0.32	41%	0.405	S	S	.	.	H	α-helix	trans	-61.4	-39.1	172.7	0	0	0	0	0	113.9	Q422 K423 L424 L429 Q430	Q422-G426 PolarHBondContact O-N 3.02Å; K423-G426 PolarHBondContact O-N 2.9Å; L424-G426 VanDerWaalsContact C-N 3.32Å; L424-G426 PolarHBondContact O-N 2.55Å; G426-L429 PolarHBondContact O-N 2.69Å; G426-Q430 PolarHBondContact O-N 3.33Å
427	N	63.8	Low	61.8	Low	94 Å²	94	76.5 Å²	76.5	50%	0.503	42%	0.417	S	S	.	.	H	α-helix	trans	-71	-34.4	176	-71.2	-21.5	0	0	0	112.6	K423 L424 S425 L429 Q430 Q431	K423-N427 PolarHBondContact O-N 3.21Å; L424-N427 PolarHBondContact O-N 3.04Å; S425-N427 PolarHBondContact O-N 2.87Å; N427-L429 VanDerWaalsContact C-N 3.35Å; N427-Q430 PolarHBondContact O-N 2.99Å; N427-Q431 PolarHBondContact O-N 3.26Å
428	I	61.3	Low	59.5	Low	58 Å²	58	82.3 Å²	82.3	30%	0.297	46%	0.457	S	S	.	.	H	α-helix	trans	-66.6	-37.3	175.4	-67.9	164.2	0	0	0	110.7	L424 S425 Q432	L424-I428 VanDerWaalsContact O-CG1 3.28Å; L424-I428 WeakPolarHBondContact O-CG1 3.26Å; L424-I428 PolarHBondContact O-N 3.47Å; S425-I428 PolarHBondContact O-N 3.34Å; I428-Q432 PolarHBondContact O-N 3.13Å
429	L	54	Low	57.1	Low	61 Å²	61	87.5 Å²	87.5	32%	0.319	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-40.4	172.6	-87.7	152.9	0	0	0	112.7	S425 G426 N427 Q432 T555 I562	S425-L429 PolarHBondContact O-N 3.14Å; G426-L429 PolarHBondContact O-N 2.69Å; N427-L429 VanDerWaalsContact C-N 3.35Å; L429-Q432 WeakPolarHBondContact O-CB 3.38Å; L429-Q432 PolarHBondContact O-N 2.84Å; L429-T555 HydrophobicContact CD1-CG2 4.41Å; L429-I562 HydrophobicContact CD1-CD1 3.53Å; L429-I562 HydrophobicContact CD1-CG1 3.9Å; L429-I562 HydrophobicContact CD2-CD1 4.43Å; L429-I562 HydrophobicContact CD2-CG1 4.43Å; L429-I562 HydrophobicContact CG-CD1 3.62Å; L429-I562 HydrophobicContact CG-CG1 4.11Å
430	Q	49.9	Very low	54.7	Low	146 Å²	146	89.2 Å²	89.2	68%	0.682	51%	0.513	S	S	*	.	H	α-helix	trans	-67.9	-34.9	178.3	-89.1	-179.4	-0.7	0	0	113.6	G426 N427 Q432 Q433	G426-Q430 PolarHBondContact O-N 3.33Å; N427-Q430 PolarHBondContact O-N 2.99Å; Q430-Q432 PolarHBondContact O-N 3.5Å; Q430-Q433 PolarHBondContact O-N 2.64Å
431	Q	51.2	Low	52.3	Low	148 Å²	148	93 Å²	93	69%	0.692	54%	0.544	S	S	*	.	H	α-helix	trans	-66.4	-25.4	172.8	-95.2	-178.6	-6.9	0	0	112.9	N427	N427-Q431 PolarHBondContact O-N 3.26Å
432	Q	45.4	Very low	49.9	Very low	95 Å²	95	96.7 Å²	96.7	44%	0.444	58%	0.582	S	S	.	*	H	α-helix	trans	-74.9	-25.4	179	-100.8	169.8	16.9	0	0	114.1	I428 L429 Q430	I428-Q432 PolarHBondContact O-N 3.13Å; L429-Q432 WeakPolarHBondContact O-CB 3.38Å; L429-Q432 PolarHBondContact O-N 2.84Å; Q430-Q432 PolarHBondContact O-N 3.5Å
433	Q	43.8	Very low	47.8	Very low	169 Å²	169	96.9 Å²	96.9	79%	0.79	60%	0.604	S	S	*	*	H	α-helix	trans	-86.5	-12.1	177	-76.7	-178.9	-0.6	0	0	113.9	Q430 S435	Q430-Q433 PolarHBondContact O-N 2.64Å; Q433-S435 PolarHBondContact O-N 2.85Å
434	G	40.4	Very low	45.4	Very low	60 Å²	60	97.5 Å²	97.5	62%	0.619	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-7.1	-175.8	0	0	0	0	0	116.5
435	S	38.7	Very low	43.8	Very low	104 Å²	104	101.5 Å²	101.5	73%	0.727	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	7.6	-173.6	58.1	0	0	0	0	115.3	Q433	Q433-S435 PolarHBondContact O-N 2.85Å
436	L	37.7	Very low	42	Very low	165 Å²	165	108.2 Å²	108.2	86%	0.864	69%	0.685	S	S	*	*	S	Bend	trans	-115.7	24.3	-175.5	-141.3	80.2	0	0	0	115.2
437	S	35.4	Very low	40.9	Very low	106 Å²	106	116.1 Å²	116.1	74%	0.741	71%	0.71	S	S	*	*			trans	-144.2	70.2	176.3	57.5	0	0	0	0	114.3
438	S	34.9	Very low	39.2	Very low	124 Å²	124	117.9 Å²	117.9	87%	0.867	73%	0.727	S	S	*	*			trans	-162.4	88.9	151.3	61.7	0	0	0	0	111.7
439	S	34.4	Very low	37.6	Very low	116 Å²	116	123.4 Å²	123.4	81%	0.811	75%	0.753	S	S	*	*			trans	-123.2	105	160.2	51.5	0	0	0	0	109.3
440	S	33.2	Very low	36.4	Very low	117 Å²	117	129.9 Å²	129.9	82%	0.818	78%	0.784	S	S	*	*			trans	-179.4	141.4	139.8	38.6	0	0	0	0	113.1
441	S	32	Very low	35.6	Very low	121 Å²	121	131.8 Å²	131.8	85%	0.846	79%	0.791	S	S	*	*			trans	73.5	104.7	165.5	62.9	0	0	0	0	120.4
442	G	31	Very low	34.8	Very low	79 Å²	79	128.2 Å²	128.2	81%	0.814	79%	0.794	S	S	*	*				101.7	105.5	109.9	0	0	0	0	0	118.2
443	G	34.3	Very low	34.2	Very low	79 Å²	79	130.5 Å²	130.5	81%	0.814	81%	0.809	S	S	*	*			trans	79.4	119.5	132.1	0	0	0	0	0	119.7
444	D	27.9	Very low	33.9	Very low	159 Å²	159	134.7 Å²	134.7	85%	0.85	82%	0.818	S	S	*	*			trans	99.9	137.5	144.9	-140.7	2.1	0	0	0	119.6
445	S	40	Very low	34	Very low	96 Å²	96	139.1 Å²	139.1	67%	0.671	82%	0.824	S	S	*	*			trans	-71	124.3	-175.6	54.3	0	0	0	0	112.3
446	T	30.3	Very low	34.3	Very low	145 Å²	145	145.6 Å²	145.6	89%	0.89	83%	0.833	S	S	*	*			trans	-173.9	143.1	144.4	18	0	0	0	0	110.6
447	K	38.5	Very low	35.6	Very low	197 Å²	197	145.1 Å²	145.1	86%	0.857	82%	0.82	S	S	*	*			trans	-45.3	141.9	-176.1	-62.6	169	175.3	175.6	0	113.9	M449	K447-M449 PolarHBondContact O-N 2.8Å
448	P	30	Very low	37.2	Very low	130 Å²	130	143.1 Å²	143.1	84%	0.844	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.8	118.1	160.1	21	-7.7	0	0	0	110.3
449	M	26.2	Very low	38.8	Very low	174 Å²	174	146 Å²	146	86%	0.857	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-53.3	143	159.7	-107.5	169.1	142	0	0	111	K447 F451	K447-M449 PolarHBondContact O-N 2.8Å; M449-F451 PolarHBondContact O-N 2.92Å
450	M	30.2	Very low	40.9	Very low	197 Å²	197	140.8 Å²	140.8	97%	0.97	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-54.4	124.1	165.9	-74.5	-158.4	-171	0	0	110.8
451	F	31.8	Very low	43.3	Very low	186 Å²	186	138.6 Å²	138.6	82%	0.816	74%	0.742	S	S	*	*			trans	-101.8	105.3	162.4	-106.6	-89.9	0	0	0	109.4	M449 N453	M449-F451 PolarHBondContact O-N 2.92Å; F451-N453 PolarHBondContact O-N 2.83Å
452	G	35.8	Very low	45.9	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	72%	0.718	S	S	*	*			trans	-75.4	108.9	156.6	0	0	0	0	0	108.7
453	N	31.1	Very low	48.6	Very low	143 Å²	143	135 Å²	135	77%	0.765	69%	0.687	S	S	*	*			trans	-126.9	104.3	160.3	-110.8	2.3	0	0	0	107.8	F451 M455	F451-N453 PolarHBondContact O-N 2.83Å; N453-M455 VanDerWaalsContact C-N 3.28Å; N453-M455 PolarHBondContact O-N 3.43Å
454	R	38.7	Very low	51.2	Low	257 Å²	257	131.9 Å²	131.9	97%	0.97	65%	0.65	S	S	*	*			trans	-66.8	92.1	167.3	-78.2	-179.2	176.7	178.1	-1.2	107.4	R456	R454-R456 PolarHBondContact O-N 3.08Å
455	M	41.4	Very low	54.2	Low	153 Å²	153	124.9 Å²	124.9	75%	0.754	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-51.8	126	171.3	-164.8	84.4	91.8	0	0	109	N453 R457	N453-M455 VanDerWaalsContact C-N 3.28Å; N453-M455 PolarHBondContact O-N 3.43Å; M455-R457 PolarHBondContact O-N 3.39Å
456	R	46.5	Very low	56.6	Low	240 Å²	240	120.3 Å²	120.3	91%	0.906	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-62.9	116.8	175.4	-169	175.8	178.9	175.2	-1.3	107.7	R454	R454-R456 PolarHBondContact O-N 3.08Å
457	R	65	Low	59.6	Low	155 Å²	155	113.4 Å²	113.4	59%	0.585	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-58.9	133.5	-177.8	-65.5	179.4	-178.2	178.9	-1.7	109.5	M455 W461	M455-R457 PolarHBondContact O-N 3.39Å; R457-W461 HydrophobicContact CB-CB 4.35Å; R457-W461 HydrophobicContact CB-CG 4.36Å
458	P	68.1	Low	62.2	Low	63 Å²	63	104.6 Å²	104.6	41%	0.409	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-65.9	154.8	178.7	25.5	-31.3	0	0	0	111.4	L424 W461	L424-P458 HydrophobicContact CD2-CB 3.96Å; L424-P458 HydrophobicContact CD2-CG 3.9Å; P458-W461 HydrophobicContact CG-CB 4.38Å; P458-W461 HydrophobicContact CG-CE3 4.06Å; P458-W461 VanDerWaalsContact O-CB 3.26Å; P458-W461 WeakPolarHBondContact O-CB 3.09Å; P458-W461 PolarHBondContact O-N 2.91Å
459	E	69.4	Low	65.2	Low	185 Å²	185	98.4 Å²	98.4	86%	0.864	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	134.3	173.9	-164.5	174.3	-178.1	0	0	109.7
460	G	76.9	Confident	68.4	Low	7 Å²	7	90.3 Å²	90.3	7%	0.072	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	1.1	-174.6	0	0	0	0	0	115.8	L424 R462 E463 W464	L424-G460 WeakPolarHBondContact CD1-O 3.44Å; G460-R462 PolarHBondContact O-N 3.28Å; G460-E463 WeakPolarHBondContact CA-OE2 3.19Å; G460-E463 WeakPolarHBondContact O-CB 3.06Å; G460-E463 PolarHBondContact O-N 3.49Å; G460-W464 PolarHBondContact O-N 3.48Å
461	W	84.1	Confident	71.4	Confident	71 Å²	71	81 Å²	81	27%	0.269	37%	0.374	S	S	.	.	H	α-helix	trans	-64	-35.9	-176.3	-178.6	-95.6	0	0	0	113.7	R457 P458 E465	R457-W461 HydrophobicContact CB-CB 4.35Å; R457-W461 HydrophobicContact CB-CG 4.36Å; P458-W461 HydrophobicContact CG-CB 4.38Å; P458-W461 HydrophobicContact CG-CE3 4.06Å; P458-W461 VanDerWaalsContact O-CB 3.26Å; P458-W461 WeakPolarHBondContact O-CB 3.09Å; P458-W461 PolarHBondContact O-N 2.91Å; W461-E465 HydrophobicContact CZ2-CG 4.24Å; W461-E465 PolarHBondContact NE1-OE1 2.95Å; W461-E465 WeakPolarHBondContact O-CG 3.18Å; W461-E465 PolarHBondContact O-N 3.43Å
462	R	86.1	Confident	74.4	Confident	92 Å²	92	72.1 Å²	72.1	35%	0.347	34%	0.335	S	S	.	.	H	α-helix	trans	-71.2	-38.3	-179	-64.2	-170.7	93.7	-171.6	5.7	111	L404 G460 E465 A466	L404-R462 PolarHBondContact O-NH1 3.31Å; G460-R462 PolarHBondContact O-N 3.28Å; R462-E465 PolarHBondContact O-N 2.75Å; R462-A466 WeakPolarHBondContact O-CB 3.49Å; R462-A466 PolarHBondContact O-N 2.87Å
463	E	89.1	Confident	77.1	Confident	31 Å²	31	68.7 Å²	68.7	15%	0.145	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-50.6	174.5	-64.3	72.9	-173.3	0	0	109.8	L404 I417 M420 G460 E465 A466 V467	L404-E463 HydrophobicContact CD1-CB 4.34Å; L404-E463 HydrophobicContact CD1-CG 3.58Å; I417-E463 HydrophobicContact CG2-CB 4.38Å; M420-E463 HydrophobicContact CE-CB 4.42Å; M420-E463 HydrophobicContact CE-CG 3.7Å; M420-E463 HydrophobicContact SD-CG 4.44Å; G460-E463 WeakPolarHBondContact CA-OE2 3.19Å; G460-E463 WeakPolarHBondContact O-CB 3.06Å; G460-E463 PolarHBondContact O-N 3.49Å; E463-E465 PolarHBondContact O-N 3.33Å; E463-A466 PolarHBondContact O-N 3.44Å; E463-V467 VanDerWaalsContact O-CG2 3.26Å; E463-V467 WeakPolarHBondContact O-CG2 3.44Å; E463-V467 PolarHBondContact O-N 3.07Å
464	W	88.3	Confident	80	Confident	14 Å²	14	62 Å²	62	5%	0.053	26%	0.263	C	S	.	.	H	α-helix	trans	-56.7	-47.4	175.1	171.4	-109.9	0	0	0	112.3	I421 L424 G460 A466 V467 R468 L539 V553 L564	I421-W464 HydrophobicContact CB-CE3 4.44Å; I421-W464 HydrophobicContact CD1-CE3 4.33Å; I421-W464 HydrophobicContact CG1-CE3 4.08Å; I421-W464 HydrophobicContact CG2-CE3 3.85Å; I421-W464 HydrophobicContact CG2-CZ3 3.65Å; L424-W464 HydrophobicContact CD1-CB 3.91Å; G460-W464 PolarHBondContact O-N 3.48Å; W464-A466 VanDerWaalsContact C-N 3.34Å; W464-A466 PolarHBondContact O-N 3.27Å; W464-V467 PolarHBondContact O-N 3.2Å; W464-R468 WeakPolarHBondContact O-CB 3.33Å; W464-R468 PolarHBondContact O-N 2.81Å; W464-L539 HydrophobicContact CH2-CD1 4.12Å; W464-L539 HydrophobicContact CZ3-CD1 4.22Å; W464-V553 HydrophobicContact CH2-CG2 3.84Å; W464-V553 HydrophobicContact CZ3-CG2 4.39Å; W464-L564 HydrophobicContact CH2-CD1 3.88Å; W464-L564 HydrophobicContact CZ2-CD1 3.95Å
465	E	90	Very high	82.4	Confident	12 Å²	12	52.3 Å²	52.3	6%	0.056	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-37.1	178.6	-75.1	-171.7	149.9	0	0	113.1	W461 R462 E463 A469 K633 L676	W461-E465 HydrophobicContact CZ2-CG 4.24Å; W461-E465 PolarHBondContact NE1-OE1 2.95Å; W461-E465 WeakPolarHBondContact O-CG 3.18Å; W461-E465 PolarHBondContact O-N 3.43Å; R462-E465 PolarHBondContact O-N 2.75Å; E463-E465 PolarHBondContact O-N 3.33Å; E465-A469 VanDerWaalsContact O-CB 3.32Å; E465-A469 WeakPolarHBondContact O-CB 3.35Å; E465-A469 PolarHBondContact O-N 2.93Å; E465-K633 IonicContact OE1-NZ 2.79Å; E465-K633 PolarHBondContact OE1-NZ 2.83Å; E465-K633 IonicContact OE2-NZ 2.68Å; E465-K633 PolarHBondContact OE2-NZ 2.9Å; E465-L676 HydrophobicContact CB-CD2 4.36Å
466	A	92.1	Very high	84.6	Confident	0 Å²	0	45 Å²	45	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.1	-47.4	176.7	0	0	0	0	0	111.9	I402 L404 R462 E463 W464 R468 A469 L470 C677	I402-A466 HydrophobicContact CD1-CB 4.26Å; L404-A466 HydrophobicContact CD2-CB 3.47Å; L404-A466 VanDerWaalsContact CD2-CB 3.47Å; R462-A466 WeakPolarHBondContact O-CB 3.49Å; R462-A466 PolarHBondContact O-N 2.87Å; E463-A466 PolarHBondContact O-N 3.44Å; W464-A466 VanDerWaalsContact C-N 3.34Å; W464-A466 PolarHBondContact O-N 3.27Å; A466-R468 VanDerWaalsContact C-N 3.33Å; A466-R468 PolarHBondContact O-N 3.2Å; A466-A469 PolarHBondContact O-N 2.9Å; A466-L470 WeakPolarHBondContact O-CG 3.42Å; A466-L470 PolarHBondContact O-N 2.71Å; A466-C677 HydrophobicContact CB-CB 4.01Å
467	V	92.5	Very high	86.5	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-63.1	-41.6	176.8	-179.1	0	0	0	0	110.5	I417 I421 E463 W464 A469 L470 A471 W533 T534 L539	I417-V467 HydrophobicContact CG2-CG2 3.86Å; I421-V467 HydrophobicContact CD1-CB 3.86Å; I421-V467 HydrophobicContact CD1-CG1 3.71Å; I421-V467 HydrophobicContact CD1-CG2 3.82Å; E463-V467 VanDerWaalsContact O-CG2 3.26Å; E463-V467 WeakPolarHBondContact O-CG2 3.44Å; E463-V467 PolarHBondContact O-N 3.07Å; W464-V467 PolarHBondContact O-N 3.2Å; V467-A469 PolarHBondContact O-N 3.32Å; V467-L470 PolarHBondContact O-N 3.39Å; V467-A471 WeakPolarHBondContact O-CB 3.23Å; V467-A471 PolarHBondContact O-N 3.39Å; V467-W533 HydrophobicContact CG1-CZ3 4.39Å; V467-W533 HydrophobicContact CG2-CH2 3.74Å; V467-W533 HydrophobicContact CG2-CZ3 3.94Å; V467-T534 HydrophobicContact CG1-CG2 3.99Å; V467-L539 HydrophobicContact CG1-CB 4.14Å; V467-L539 HydrophobicContact CG1-CD2 3.95Å
468	R	92.1	Very high	87.4	Confident	12 Å²	12	30 Å²	30	5%	0.045	15%	0.148	C	C	.	.	H	α-helix	trans	-61.5	-42.5	175	-173.7	176.8	73	165.7	2.1	112.3	W464 A466 L470 A471 L472 Y566 E587 Y596	W464-R468 WeakPolarHBondContact O-CB 3.33Å; W464-R468 PolarHBondContact O-N 2.81Å; A466-R468 VanDerWaalsContact C-N 3.33Å; A466-R468 PolarHBondContact O-N 3.2Å; R468-L470 VanDerWaalsContact C-N 3.33Å; R468-L470 PolarHBondContact O-N 3.42Å; R468-A471 PolarHBondContact O-N 2.99Å; R468-L472 HydrophobicContact CG-CD1 3.72Å; R468-L472 WeakPolarHBondContact O-CB 3.27Å; R468-L472 WeakPolarHBondContact O-CD1 3.38Å; R468-L472 VanDerWaalsContact O-CG 3.25Å; R468-L472 WeakPolarHBondContact O-CG 3.4Å; R468-L472 PolarHBondContact O-N 3.11Å; R468-L472 VanDerWaalsContact O-N 3.16Å; R468-Y566 WeakPolarHBondContact CD-OH 3.37Å; R468-E587 IonicContact NH1-OE2 2.72Å; R468-Y596 PolarHBondContact NE-OH 3.42Å; R468-Y596 PolarHBondContact NH2-OH 2.82Å
469	A	94	Very high	87.9	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-40.8	176.7	0	0	0	0	0	112	E465 A466 V467 L472 C473 Y596 V631 L676	E465-A469 VanDerWaalsContact O-CB 3.32Å; E465-A469 WeakPolarHBondContact O-CB 3.35Å; E465-A469 PolarHBondContact O-N 2.93Å; A466-A469 PolarHBondContact O-N 2.9Å; V467-A469 PolarHBondContact O-N 3.32Å; A469-L472 PolarHBondContact O-N 3.28Å; A469-C473 VanDerWaalsContact O-CB 3.25Å; A469-C473 WeakPolarHBondContact O-CB 3.47Å; A469-C473 PolarHBondContact O-N 3.29Å; A469-Y596 HydrophobicContact CB-CD1 3.49Å; A469-Y596 VanDerWaalsContact CB-CD1 3.49Å; A469-Y596 HydrophobicContact CB-CE1 3.47Å; A469-Y596 VanDerWaalsContact CB-CE1 3.47Å; A469-Y596 HydrophobicContact CB-CG 4.4Å; A469-V631 HydrophobicContact CB-CG1 3.78Å; A469-L676 HydrophobicContact CB-CD1 3.56Å
470	L	93.8	Very high	87.5	Confident	4 Å²	4	24 Å²	24	2%	0.021	13%	0.126	C	C	.	.	H	α-helix	trans	-66	-39.4	177.1	-71.9	171.7	0	0	0	112.7	F399 I402 A466 V467 R468 L472 L530 W533 T534 V631 T679	F399-L470 HydrophobicContact CE2-CD1 4.46Å; F399-L470 HydrophobicContact CZ-CD1 4.46Å; I402-L470 HydrophobicContact CD1-CD1 4.07Å; A466-L470 WeakPolarHBondContact O-CG 3.42Å; A466-L470 PolarHBondContact O-N 2.71Å; V467-L470 PolarHBondContact O-N 3.39Å; R468-L470 VanDerWaalsContact C-N 3.33Å; R468-L470 PolarHBondContact O-N 3.42Å; L470-L472 VanDerWaalsContact C-N 3.27Å; L470-L472 PolarHBondContact O-N 3.41Å; L470-L530 HydrophobicContact CD2-CD1 4.35Å; L470-L530 HydrophobicContact CD2-CD2 3.94Å; L470-W533 HydrophobicContact CD1-CE3 4.2Å; L470-W533 HydrophobicContact CD1-CH2 4.46Å; L470-W533 HydrophobicContact CD1-CZ3 3.63Å; L470-T534 HydrophobicContact CB-CG2 3.86Å; L470-V631 HydrophobicContact CD2-CG2 3.79Å; L470-T679 HydrophobicContact CD1-CG2 4Å; L470-T679 HydrophobicContact CD2-CG2 4.04Å
471	A	93.4	Very high	86.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-75.7	-9.6	177.1	0	0	0	0	0	114.3	V467 R468 H474 T534 L539 M549 L551	V467-A471 WeakPolarHBondContact O-CB 3.23Å; V467-A471 PolarHBondContact O-N 3.39Å; R468-A471 PolarHBondContact O-N 2.99Å; A471-H474 PolarHBondContact O-CD2 3.21Å; A471-H474 PolarHBondContact O-NE2 2.99Å; A471-T534 HydrophobicContact CB-CG2 4.07Å; A471-L539 HydrophobicContact CB-CD2 3.51Å; A471-L539 HydrophobicContact CB-CG 4.11Å; A471-M549 WeakPolarHBondContact O-CE 3.42Å; A471-L551 HydrophobicContact CB-CD1 3.9Å; A471-L551 HydrophobicContact CB-CD2 4.25Å
472	L	93.4	Very high	84.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-109.6	-40.4	179.5	-68.5	170.9	0	0	0	112.4	R468 A469 L470 H474 M549 L551 Y566 V585 Y596	R468-L472 HydrophobicContact CG-CD1 3.72Å; R468-L472 WeakPolarHBondContact O-CB 3.27Å; R468-L472 WeakPolarHBondContact O-CD1 3.38Å; R468-L472 VanDerWaalsContact O-CG 3.25Å; R468-L472 WeakPolarHBondContact O-CG 3.4Å; R468-L472 PolarHBondContact O-N 3.11Å; R468-L472 VanDerWaalsContact O-N 3.16Å; A469-L472 PolarHBondContact O-N 3.28Å; L470-L472 VanDerWaalsContact C-N 3.27Å; L470-L472 PolarHBondContact O-N 3.41Å; L472-H474 PolarHBondContact O-N 2.76Å; L472-M549 HydrophobicContact CD2-CE 4.1Å; L472-M549 HydrophobicContact CD2-SD 4.36Å; L472-L551 HydrophobicContact CD2-CD1 3.77Å; L472-L551 HydrophobicContact CD2-CG 4.37Å; L472-L551 HydrophobicContact CG-CD1 4.06Å; L472-Y566 HydrophobicContact CD1-CD1 4.16Å; L472-Y566 HydrophobicContact CD1-CE1 3.83Å; L472-Y566 HydrophobicContact CD1-CE2 4.46Å; L472-Y566 HydrophobicContact CD2-CD1 4.17Å; L472-Y566 HydrophobicContact CD2-CD2 3.69Å; L472-Y566 HydrophobicContact CD2-CE1 4.4Å; L472-Y566 HydrophobicContact CD2-CE2 3.94Å; L472-Y566 HydrophobicContact CD2-CG 3.8Å; L472-V585 HydrophobicContact CD1-CG2 4.3Å; L472-Y596 HydrophobicContact CB-CD2 4.42Å; L472-Y596 HydrophobicContact CB-CE2 4.42Å; L472-Y596 HydrophobicContact CD1-CE2 3.77Å
473	C	93.6	Very high	81.8	Confident	2 Å²	2	37 Å²	37	1%	0.014	20%	0.2	C	C	.	.	S	Bend	trans	-86.1	72.8	-176.2	-164.9	0	0	0	0	111.5	A469 I583 K598	A469-C473 VanDerWaalsContact O-CB 3.25Å; A469-C473 WeakPolarHBondContact O-CB 3.47Å; A469-C473 PolarHBondContact O-N 3.29Å; C473-I583 HydrophobicContact CB-CG2 4Å; C473-K598 VanDerWaalsContact O-CD 3.25Å; C473-K598 WeakPolarHBondContact O-CD 3.42Å; C473-K598 WeakPolarHBondContact O-CE 3.21Å; C473-K598 PolarHBondContact O-NZ 3.01Å
474	H	91.8	Very high	79.1	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.009	23%	0.231	C	C	.	.	S	Bend	trans	-155.4	175.5	174.9	63.7	72.4	0	0	0	111	A471 L472 V476 V531 L541 R544 M581	A471-H474 PolarHBondContact O-CD2 3.21Å; A471-H474 PolarHBondContact O-NE2 2.99Å; L472-H474 PolarHBondContact O-N 2.76Å; H474-V476 HydrophobicContact CB-CG2 4.06Å; H474-V476 PolarHBondContact CE1-O 3.16Å; H474-V476 WeakPolarHBondContact ND1-CB 3.47Å; H474-V476 PolarHBondContact ND1-N 3.01Å; H474-V476 PolarHBondContact ND1-O 2.82Å; H474-V531 HydrophobicContact CB-CG2 4.34Å; H474-V531 WeakPolarHBondContact CD2-CG2 3.35Å; H474-L541 WeakPolarHBondContact CE1-CD2 3.37Å; H474-R544 PolarHBondContact CE1-NH1 2.92Å; H474-R544 PolarHBondContact ND1-NH1 2.99Å; H474-R544 PolarHBondContact O-NH1 3.43Å; H474-R544 PolarHBondContact O-NH2 3.38Å; H474-M581 WeakPolarHBondContact O-CE 3.3Å
475	N	88.2	Confident	76.2	Confident	54 Å²	54	49.2 Å²	49.2	29%	0.289	27%	0.268	S	S	.	.			trans	-114.3	10.2	170.4	-79.7	-18.3	0	0	0	113.2	E527 R544 L571 M581	N475-E527 PolarHBondContact N-OE2 3.16Å; N475-R544 PolarHBondContact OD1-NH2 3.03Å; N475-R544 VanDerWaalsContact OD1-NH2 3.1Å; N475-L571 WeakPolarHBondContact OD1-CD1 3.31Å; N475-L571 VanDerWaalsContact OD1-CD2 3.29Å; N475-L571 WeakPolarHBondContact OD1-CD2 3.44Å; N475-M581 HydrophobicContact CB-CE 4.29Å; N475-M581 VanDerWaalsContact CG-CE 3.43Å; N475-M581 WeakPolarHBondContact OD1-CE 3.44Å
476	V	88.5	Confident	73.3	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.308	C	S	.	.			trans	-59.9	132.3	174.7	-173.5	0	0	0	0	111.9	H474 Y520 Q521 A522 E527 V531 L541 R544	H474-V476 HydrophobicContact CB-CG2 4.06Å; H474-V476 PolarHBondContact CE1-O 3.16Å; H474-V476 WeakPolarHBondContact ND1-CB 3.47Å; H474-V476 PolarHBondContact ND1-N 3.01Å; H474-V476 PolarHBondContact ND1-O 2.82Å; V476-Y520 HydrophobicContact CG1-CD1 3.77Å; V476-Y520 HydrophobicContact CG1-CG 3.88Å; V476-Q521 CarbonylContact C-O 3.56Å; V476-Q521 VanDerWaalsContact CA-O 3.28Å; V476-Q521 WeakPolarHBondContact CA-O 3.44Å; V476-A522 HydrophobicContact CB-CB 4.23Å; V476-A522 HydrophobicContact CG2-CB 3.72Å; V476-E527 HydrophobicContact CG2-CB 3.64Å; V476-V531 HydrophobicContact CB-CG2 4.02Å; V476-V531 HydrophobicContact CG1-CB 4.42Å; V476-V531 HydrophobicContact CG1-CG1 4.4Å; V476-V531 HydrophobicContact CG1-CG2 4.4Å; V476-V531 HydrophobicContact CG2-CB 4.33Å; V476-V531 HydrophobicContact CG2-CG2 3.69Å; V476-L541 HydrophobicContact CG1-CD2 4.48Å; V476-R544 WeakPolarHBondContact O-CD 3.21Å
477	T	86	Confident	70.2	Confident	60 Å²	60	64.8 Å²	64.8	37%	0.368	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	131.1	173.9	-53.3	0	0	0	0	109.4	Q521	T477-Q521 PolarHBondContact N-O 3.44Å; T477-Q521 PolarHBondContact O-N 2.82Å
478	P	85.2	Confident	67.2	Low	20 Å²	20	71.1 Å²	71.1	13%	0.13	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	146.2	173.2	28.5	-29.6	0	0	0	110.9	Y520 L541 I542	P478-Y520 HydrophobicContact CB-CD1 4.15Å; P478-Y520 HydrophobicContact CB-CE1 4.04Å; P478-L541 HydrophobicContact CG-CD2 4.46Å; P478-L541 HydrophobicContact CG-CG 4.32Å; P478-I542 WeakPolarHBondContact CG-O 3.36Å
479	V	77.2	Confident	64.1	Low	33 Å²	33	76 Å²	76	20%	0.2	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.6	178.6	-170.7	0	0	0	0	108.2	Q519 Q521	V479-Q519 HydrophobicContact CB-CB 4.47Å; V479-Q519 WeakPolarHBondContact CB-O 3.39Å; V479-Q519 WeakPolarHBondContact CG2-O 3.35Å; V479-Q519 PolarHBondContact N-O 2.94Å; V479-Q521 HydrophobicContact CG2-CB 4.11Å; V479-Q521 HydrophobicContact CG2-CG 3.37Å
480	S	60.8	Low	61	Low	89 Å²	89	82.6 Å²	82.6	62%	0.622	46%	0.455	S	S	*	.			trans	-94	126.2	171	-39.2	0	0	0	0	108.7	D482	S480-D482 PolarHBondContact O-N 3.18Å
481	D	48.8	Very low	57.8	Low	110 Å²	110	86.6 Å²	86.6	59%	0.588	49%	0.489	S	S	*	.			trans	-76.8	36.6	178	-75	-24.2	0	0	0	113.1	E483	D481-E483 PolarHBondContact O-N 3.05Å; D481-E483 VanDerWaalsContact O-N 3.16Å
482	D	41.3	Very low	54.6	Low	150 Å²	150	91.8 Å²	91.8	80%	0.802	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	6.2	-171.7	-80	-36.9	0	0	0	115	S480	S480-D482 PolarHBondContact O-N 3.18Å
483	E	37.4	Very low	51.5	Low	183 Å²	183	97.8 Å²	97.8	86%	0.855	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	-9.2	-179.8	-67.8	-156.7	151.5	0	0	116	D481 N485	D481-E483 PolarHBondContact O-N 3.05Å; D481-E483 VanDerWaalsContact O-N 3.16Å; E483-N485 PolarHBondContact O-N 3.03Å
484	D	32.1	Very low	48.4	Very low	147 Å²	147	103.5 Å²	103.5	79%	0.786	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	4.8	-170.6	-90.8	-12.5	0	0	0	115.8
485	N	27.4	Very low	45.3	Very low	155 Å²	155	110 Å²	110	83%	0.829	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	21.5	-177.1	-121.9	-3.5	0	0	0	116.8	E483	E483-N485 PolarHBondContact O-N 3.03Å
486	R	29.2	Very low	42.4	Very low	241 Å²	241	111.3 Å²	111.3	91%	0.909	66%	0.664	S	S	*	*			trans	-103.7	61.2	165	-73.7	-172.8	-179.4	174.9	3.1	111.8	V488	R486-V488 PolarHBondContact O-N 3.37Å
487	S	27.4	Very low	39.4	Very low	97 Å²	97	114.9 Å²	114.9	68%	0.678	70%	0.7	S	S	*	*			trans	-68.1	117.7	161.9	59.8	0	0	0	0	110	S489	S487-S489 PolarHBondContact O-N 3.14Å
488	V	30.2	Very low	36.6	Very low	134 Å²	134	119.4 Å²	119.4	81%	0.812	72%	0.722	S	S	*	*			trans	-41.3	113.6	171.4	177.4	0	0	0	0	111.7	R486	R486-V488 PolarHBondContact O-N 3.37Å
489	S	26.4	Very low	33.8	Very low	116 Å²	116	125.4 Å²	125.4	81%	0.811	75%	0.753	S	S	*	*			trans	-109.8	114.8	160.2	-64.9	0	0	0	0	108.6	S487	S487-S489 PolarHBondContact O-N 3.14Å
490	T	28.1	Very low	31.5	Very low	137 Å²	137	128.9 Å²	128.9	84%	0.84	78%	0.779	S	S	*	*			trans	-72.8	121	177.3	-13.8	0	0	0	0	110.4
491	A	26.9	Very low	30.1	Very low	89 Å²	89	130.9 Å²	130.9	74%	0.736	79%	0.79	S	S	*	*			trans	-172.7	109.3	147.6	0	0	0	0	0	112.8
492	S	27.5	Very low	29	Very low	108 Å²	108	132 Å²	132	76%	0.755	80%	0.801	S	S	*	*			trans	9.2	127.3	142	51	0	0	0	0	121.2
493	T	26.8	Very low	28.5	Very low	127 Å²	127	134.7 Å²	134.7	78%	0.779	81%	0.805	S	S	*	*				160	126.1	102.2	-52.9	0	0	0	0	112.7
494	V	30	Very low	27.9	Very low	121 Å²	121	131.3 Å²	131.3	73%	0.733	80%	0.802	S	S	*	*			trans	-4.2	127.5	156.7	-164.7	0	0	0	0	120.4
495	T	26.4	Very low	27.6	Very low	139 Å²	139	130 Å²	130	85%	0.853	80%	0.799	S	S	*	*				169.8	133.2	110.6	28.8	0	0	0	0	113.8
496	G	26.3	Very low	27.6	Very low	82 Å²	82	129.5 Å²	129.5	85%	0.845	80%	0.795	S	S	*	*			trans	82.5	108.1	135.6	0	0	0	0	0	122.7
497	G	25.7	Very low	27.2	Very low	75 Å²	75	124.4 Å²	124.4	77%	0.773	79%	0.786	S	S	*	*				89	112.3	119	0	0	0	0	0	122.8
498	N	26.6	Very low	27.3	Very low	154 Å²	154	127 Å²	127	82%	0.824	79%	0.791	S	S	*	*			trans	72.5	118.1	138.1	-67.6	-4.4	0	0	0	124.5
499	N	28.4	Very low	27.1	Very low	147 Å²	147	129 Å²	129	79%	0.786	79%	0.791	S	S	*	*			trans	58.2	120.5	131.5	-68.9	-6.1	0	0	0	123.8
500	S	28.1	Very low	27.2	Very low	105 Å²	105	128 Å²	128	73%	0.734	79%	0.789	S	S	*	*			trans	120.6	140.8	131.2	71.2	0	0	0	0	117
501	P	32.1	Very low	27.4	Very low	132 Å²	132	127.4 Å²	127.4	86%	0.857	79%	0.788	S	S	*	*			trans	-92.2	120	-173.7	34.9	-27.8	0	0	0	110.6
502	T	24.7	Very low	27.3	Very low	134 Å²	134	126.3 Å²	126.3	82%	0.822	79%	0.785	S	S	*	*			trans	-114	128.9	169.9	27.1	0	0	0	0	110.2	S504	T502-S504 PolarHBondContact O-N 3.38Å
503	K	30.9	Very low	27.6	Very low	205 Å²	205	126.7 Å²	126.7	89%	0.891	79%	0.788	S	S	*	*			trans	-50.7	119.4	172.4	-78.9	172.6	169.1	176.7	0	110	V505	K503-V505 PolarHBondContact O-N 3.21Å
504	S	25.5	Very low	27.7	Very low	112 Å²	112	126.1 Å²	126.1	78%	0.783	79%	0.785	S	S	*	*			trans	-78.2	103.8	169.3	53.9	0	0	0	0	109.7	T502	T502-S504 PolarHBondContact O-N 3.38Å
505	V	26.2	Very low	28	Very low	119 Å²	119	128.3 Å²	128.3	72%	0.721	79%	0.792	S	S	*	*			trans	-66.4	123.6	159.7	175.6	0	0	0	0	107	K503 N507	K503-V505 PolarHBondContact O-N 3.21Å; V505-N507 PolarHBondContact O-N 2.98Å
506	I	27.3	Very low	29	Very low	145 Å²	145	126.4 Å²	126.4	74%	0.744	78%	0.78	S	S	*	*			trans	-78.2	103.1	174	-59.8	171.4	0	0	0	106.7	I508	I506-I508 HydrophobicContact CG2-CG1 3.99Å
507	N	20.9	Very low	30.4	Very low	135 Å²	135	130.3 Å²	130.3	72%	0.722	78%	0.777	S	S	*	*			trans	-83.7	117.3	160.5	-85.1	-0.8	0	0	0	107.4	V505 E509	V505-N507 PolarHBondContact O-N 2.98Å; N507-E509 PolarHBondContact O-N 2.85Å
508	I	29.4	Very low	32.4	Very low	152 Å²	152	129.5 Å²	129.5	78%	0.779	75%	0.752	S	S	*	*			trans	-86.2	97.8	170.3	-58.2	174.2	0	0	0	106	I506	I506-I508 HydrophobicContact CG2-CG1 3.99Å
509	E	25.4	Very low	35	Very low	176 Å²	176	127 Å²	127	82%	0.822	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-83.6	135.2	159.4	-77.9	-179.3	171.8	0	0	108.4	N507	N507-E509 PolarHBondContact O-N 2.85Å
510	A	28.3	Very low	37.7	Very low	94 Å²	94	120.5 Å²	120.5	78%	0.777	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-60.4	132.2	-173.6	0	0	0	0	0	112.3
511	P	33.2	Very low	40.1	Very low	124 Å²	124	117.8 Å²	117.8	81%	0.805	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-83.5	125.9	169.5	32.2	-28.5	0	0	0	109.9
512	G	24.4	Very low	42.5	Very low	66 Å²	66	111.9 Å²	111.9	68%	0.68	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-71.4	135	172	0	0	0	0	0	112.9
513	S	33.9	Very low	44.7	Very low	117 Å²	117	108 Å²	108	82%	0.818	62%	0.62	S	S	*	*	S	Bend	trans	29.2	85	151.6	67.9	0	0	0	0	118.8
514	T	27.5	Very low	47	Very low	115 Å²	115	99.6 Å²	99.6	71%	0.706	59%	0.587	S	S	*	*			trans	-154.8	133.9	140.4	43.4	0	0	0	0	106.4	T516	T514-T516 VanDerWaalsContact C-N 3.26Å; T514-T516 PolarHBondContact O-N 2.89Å
515	D	36.9	Very low	49.7	Very low	166 Å²	166	95.7 Å²	95.7	89%	0.888	56%	0.559	S	S	*	*			trans	-53.8	89	169.1	-88.5	-39.7	0	0	0	109.4	E517	D515-E517 PolarHBondContact O-N 2.93Å; D515-E517 VanDerWaalsContact O-N 3.1Å
516	T	46.5	Very low	52.5	Low	99 Å²	99	91.2 Å²	91.2	61%	0.607	53%	0.531	S	S	*	.			trans	-73.4	99.7	169.8	33.7	0	0	0	0	107.1	T514 H518	T514-T516 VanDerWaalsContact C-N 3.26Å; T514-T516 PolarHBondContact O-N 2.89Å; T516-H518 PolarHBondContact O-N 2.85Å
517	E	56.2	Low	55.4	Low	165 Å²	165	85.3 Å²	85.3	77%	0.771	50%	0.501	S	S	*	.			trans	-58.9	106.2	172.1	-167.2	179.1	179.6	0	0	108.7	D515 Q519	D515-E517 PolarHBondContact O-N 2.93Å; D515-E517 VanDerWaalsContact O-N 3.1Å; E517-Q519 PolarHBondContact O-N 2.85Å
518	H	69.1	Low	58.6	Low	57 Å²	57	80.5 Å²	80.5	26%	0.264	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-67.8	116.2	179.2	-71.1	-65.7	0	0	0	109.8	T516 Y520 E535	T516-H518 PolarHBondContact O-N 2.85Å; H518-Y520 HydrophobicContact CB-CE1 4.46Å; H518-Y520 HydrophobicContact CB-CE2 4.47Å; H518-Y520 PolarHBondContact O-N 3.42Å; H518-E535 IonicContact CD2-OE1 2.63Å
519	Q	80	Confident	61.6	Low	102 Å²	102	73.6 Å²	73.6	48%	0.477	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	121.4	176.7	-164.5	171.1	75.9	0	0	110.1	V479 E517	V479-Q519 HydrophobicContact CB-CB 4.47Å; V479-Q519 WeakPolarHBondContact CB-O 3.39Å; V479-Q519 WeakPolarHBondContact CG2-O 3.35Å; V479-Q519 PolarHBondContact N-O 2.94Å; E517-Q519 PolarHBondContact O-N 2.85Å
520	Y	85.1	Confident	64.8	Low	11 Å²	11	65.4 Å²	65.4	4%	0.043	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	139.5	178.9	-68.7	-57.4	0	0	0	112	V476 P478 H518 V531 K532 E535 L541	V476-Y520 HydrophobicContact CG1-CD1 3.77Å; V476-Y520 HydrophobicContact CG1-CG 3.88Å; P478-Y520 HydrophobicContact CB-CD1 4.15Å; P478-Y520 HydrophobicContact CB-CE1 4.04Å; H518-Y520 HydrophobicContact CB-CE1 4.46Å; H518-Y520 HydrophobicContact CB-CE2 4.47Å; H518-Y520 PolarHBondContact O-N 3.42Å; Y520-V531 HydrophobicContact CD1-CG1 4.12Å; Y520-V531 HydrophobicContact CD2-CG1 4.22Å; Y520-V531 HydrophobicContact CE1-CG1 3.87Å; Y520-V531 HydrophobicContact CE2-CG1 3.94Å; Y520-V531 HydrophobicContact CG-CG1 4.31Å; Y520-K532 HydrophobicContact CD2-CG 3.75Å; Y520-K532 HydrophobicContact CE2-CG 4.19Å; Y520-E535 WeakPolarHBondContact CE2-OE2 3.34Å; Y520-L541 HydrophobicContact CD1-CD2 4.44Å; Y520-L541 HydrophobicContact CE1-CB 4.01Å; Y520-L541 HydrophobicContact CE1-CD2 4.17Å; Y520-L541 HydrophobicContact CE1-CG 4.45Å; Y520-L541 PolarHBondContact OH-O 3.07Å
521	Q	78.6	Confident	67.9	Low	47 Å²	47	61 Å²	61	22%	0.22	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.1	173.9	-74.6	178	13.6	0	0	111.1	W196 V476 T477 V479	W196-Q521 HydrophobicContact CH2-CB 4.48Å; W196-Q521 HydrophobicContact CH2-CG 4.06Å; W196-Q521 HydrophobicContact CZ3-CB 4.33Å; W196-Q521 HydrophobicContact CZ3-CG 4.25Å; V476-Q521 CarbonylContact C-O 3.56Å; V476-Q521 VanDerWaalsContact CA-O 3.28Å; V476-Q521 WeakPolarHBondContact CA-O 3.44Å; T477-Q521 PolarHBondContact N-O 3.44Å; T477-Q521 PolarHBondContact O-N 2.82Å; V479-Q521 HydrophobicContact CG2-CB 4.11Å; V479-Q521 HydrophobicContact CG2-CG 3.37Å
522	A	81.8	Confident	70.6	Confident	9 Å²	9	59.2 Å²	59.2	7%	0.074	35%	0.345	C	S	.	.			trans	-155.8	165.3	173.8	0	0	0	0	0	111.3	V476 S524 E527 I528	V476-A522 HydrophobicContact CB-CB 4.23Å; V476-A522 HydrophobicContact CG2-CB 3.72Å; A522-S524 VanDerWaalsContact C-N 3.28Å; A522-S524 PolarHBondContact O-N 2.85Å; A522-E527 HydrophobicContact CB-CB 4.46Å; A522-I528 HydrophobicContact CB-CD1 4.17Å; A522-I528 HydrophobicContact CB-CG1 3.72Å
523	A	72.7	Confident	73.9	Confident	51 Å²	51	56.2 Å²	56.2	42%	0.421	31%	0.313	S	S	.	.	S	Bend	trans	-68	-27.9	175.7	0	0	0	0	0	113.1	D195 W196	D195-A523 WeakPolarHBondContact CA-O 3.43Å; W196-A523 PolarHBondContact N-O 3.41Å
524	S	78.9	Confident	76.7	Confident	30 Å²	30	50.6 Å²	50.6	21%	0.21	27%	0.274	C	S	.	.			trans	-126.9	133.3	-178.3	-177.8	0	0	0	0	111.4	A522 D526 E527	A522-S524 VanDerWaalsContact C-N 3.28Å; A522-S524 PolarHBondContact O-N 2.85Å; S524-D526 PolarHBondContact O-N 2.9Å; S524-E527 PolarHBondContact O-N 3.26Å
525	P	80.9	Confident	79.7	Confident	30 Å²	30	47 Å²	47	20%	0.195	25%	0.249	C	C	.	.	H	α-helix	trans	-66.9	-24.3	178.5	28.5	-35.4	0	0	0	112.8	M397 E527 I528 A529	M397-P525 HydrophobicContact CB-CB 4.45Å; M397-P525 HydrophobicContact CE-CG 4.17Å; M397-P525 HydrophobicContact CG-CB 3.76Å; M397-P525 HydrophobicContact CG-CG 3.92Å; P525-E527 VanDerWaalsContact C-N 3.26Å; P525-E527 PolarHBondContact O-N 3.06Å; P525-I528 PolarHBondContact O-N 3.49Å; P525-A529 PolarHBondContact O-N 3.05Å
526	D	85.3	Confident	82.1	Confident	25 Å²	25	46.3 Å²	46.3	13%	0.134	24%	0.24	C	C	.	.	H	α-helix	trans	-61	-37.7	176.7	-63.1	18.4	0	0	0	110.3	M397 S524 A529 L530 R627	M397-D526 WeakPolarHBondContact CG-OD1 3.47Å; S524-D526 PolarHBondContact O-N 2.9Å; D526-A529 PolarHBondContact O-N 2.78Å; D526-L530 WeakPolarHBondContact O-CG 3.31Å; D526-L530 PolarHBondContact O-N 3.43Å; D526-R627 IonicContact OD1-NH1 3.89Å; D526-R627 PolarHBondContact OD1-NH1 2.89Å; D526-R627 IonicContact OD2-CZ 3.78Å; D526-R627 IonicContact OD2-NH1 3.94Å; D526-R627 PolarHBondContact OD2-NH1 2.96Å
527	E	88.4	Confident	84.1	Confident	21 Å²	21	41.9 Å²	41.9	10%	0.098	21%	0.213	C	C	.	.	H	α-helix	trans	-71.7	-37.6	176.5	-57.3	-160.7	146.9	0	0	112.8	N475 V476 A522 S524 P525 A529 L530 V531 M581 K598	N475-E527 PolarHBondContact N-OE2 3.16Å; V476-E527 HydrophobicContact CG2-CB 3.64Å; A522-E527 HydrophobicContact CB-CB 4.46Å; S524-E527 PolarHBondContact O-N 3.26Å; P525-E527 VanDerWaalsContact C-N 3.26Å; P525-E527 PolarHBondContact O-N 3.06Å; E527-A529 VanDerWaalsContact C-N 3.27Å; E527-A529 PolarHBondContact O-N 3.3Å; E527-L530 PolarHBondContact O-N 3Å; E527-V531 PolarHBondContact O-N 3.37Å; E527-M581 VanDerWaalsContact OE1-SD 3.34Å; E527-K598 WeakPolarHBondContact OE1-CE 3.43Å; E527-K598 IonicContact OE1-NZ 3.7Å; E527-K598 PolarHBondContact OE1-NZ 3.32Å
528	I	89	Confident	85.6	Confident	34 Å²	34	34.3 Å²	34.3	17%	0.174	18%	0.179	C	C	.	.	H	α-helix	trans	-61.2	-42.3	175.8	-61.3	175.4	0	0	0	109.4	A522 P525 L530 V531 K532	A522-I528 HydrophobicContact CB-CD1 4.17Å; A522-I528 HydrophobicContact CB-CG1 3.72Å; P525-I528 PolarHBondContact O-N 3.49Å; I528-L530 VanDerWaalsContact C-N 3.32Å; I528-L530 PolarHBondContact O-N 3.44Å; I528-V531 PolarHBondContact O-N 2.89Å; I528-K532 HydrophobicContact CG2-CD 3.97Å; I528-K532 HydrophobicContact CG2-CG 4.14Å; I528-K532 VanDerWaalsContact O-CB 3.31Å; I528-K532 WeakPolarHBondContact O-CB 3.34Å; I528-K532 VanDerWaalsContact O-CG 3.31Å; I528-K532 WeakPolarHBondContact O-CG 3.45Å; I528-K532 PolarHBondContact O-N 3.27Å
529	A	91	Very high	86.5	Confident	7 Å²	7	31.6 Å²	31.6	6%	0.058	17%	0.166	C	C	.	.	H	α-helix	trans	-61.2	-39.6	176.5	0	0	0	0	0	112.4	M397 P525 D526 E527 W533 V681	M397-A529 HydrophobicContact CB-CB 3.79Å; M397-A529 VanDerWaalsContact O-CB 3.27Å; M397-A529 WeakPolarHBondContact O-CB 3.27Å; P525-A529 PolarHBondContact O-N 3.05Å; D526-A529 PolarHBondContact O-N 2.78Å; E527-A529 VanDerWaalsContact C-N 3.27Å; E527-A529 PolarHBondContact O-N 3.3Å; A529-W533 WeakPolarHBondContact O-CB 3.31Å; A529-W533 PolarHBondContact O-N 2.81Å; A529-W533 VanDerWaalsContact O-N 3.08Å; A529-V681 HydrophobicContact CB-CG1 4.3Å
530	L	92.8	Very high	87	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-64.2	-48.3	176.3	-65.1	167.9	0	0	0	111.4	F399 L470 D526 E527 I528 W533 T534 L629 V681	F399-L530 HydrophobicContact CD2-CD2 3.42Å; F399-L530 VanDerWaalsContact CD2-CD2 3.42Å; F399-L530 HydrophobicContact CE2-CD2 3.38Å; L470-L530 HydrophobicContact CD2-CD1 4.35Å; L470-L530 HydrophobicContact CD2-CD2 3.94Å; D526-L530 WeakPolarHBondContact O-CG 3.31Å; D526-L530 PolarHBondContact O-N 3.43Å; E527-L530 PolarHBondContact O-N 3Å; I528-L530 VanDerWaalsContact C-N 3.32Å; I528-L530 PolarHBondContact O-N 3.44Å; L530-W533 WeakPolarHBondContact O-CB 3.3Å; L530-W533 PolarHBondContact O-N 2.81Å; L530-T534 WeakPolarHBondContact O-CG2 3.4Å; L530-T534 PolarHBondContact O-N 3.19Å; L530-L629 HydrophobicContact CD1-CD1 4.26Å; L530-V681 HydrophobicContact CD2-CG2 4.2Å
531	V	92.8	Very high	87.3	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71.4	-38.7	-177.4	176.4	0	0	0	0	112.2	H474 V476 Y520 E527 I528 W533 T534 E535 L541	H474-V531 HydrophobicContact CB-CG2 4.34Å; H474-V531 WeakPolarHBondContact CD2-CG2 3.35Å; V476-V531 HydrophobicContact CB-CG2 4.02Å; V476-V531 HydrophobicContact CG1-CB 4.42Å; V476-V531 HydrophobicContact CG1-CG1 4.4Å; V476-V531 HydrophobicContact CG1-CG2 4.4Å; V476-V531 HydrophobicContact CG2-CB 4.33Å; V476-V531 HydrophobicContact CG2-CG2 3.69Å; Y520-V531 HydrophobicContact CD1-CG1 4.12Å; Y520-V531 HydrophobicContact CD2-CG1 4.22Å; Y520-V531 HydrophobicContact CE1-CG1 3.87Å; Y520-V531 HydrophobicContact CE2-CG1 3.94Å; Y520-V531 HydrophobicContact CG-CG1 4.31Å; E527-V531 PolarHBondContact O-N 3.37Å; I528-V531 PolarHBondContact O-N 2.89Å; V531-W533 PolarHBondContact O-N 2.68Å; V531-T534 WeakPolarHBondContact CA-OG1 3.19Å; V531-T534 PolarHBondContact O-N 3.22Å; V531-T534 VanDerWaalsContact O-N 3.17Å; V531-T534 PolarHBondContact O-OG1 2.73Å; V531-E535 PolarHBondContact O-N 2.83Å; V531-L541 HydrophobicContact CG1-CB 4.07Å; V531-L541 HydrophobicContact CG1-CD2 4.2Å
532	K	91.4	Very high	87.8	Confident	87 Å²	87	26.8 Å²	26.8	38%	0.378	15%	0.146	S	C	.	.	H	α-helix	trans	-59.3	-38.1	171.1	-77.2	-171.7	173.6	-161.2	0	111.6	Y520 I528 E535 Q536	Y520-K532 HydrophobicContact CD2-CG 3.75Å; Y520-K532 HydrophobicContact CE2-CG 4.19Å; I528-K532 HydrophobicContact CG2-CD 3.97Å; I528-K532 HydrophobicContact CG2-CG 4.14Å; I528-K532 VanDerWaalsContact O-CB 3.31Å; I528-K532 WeakPolarHBondContact O-CB 3.34Å; I528-K532 VanDerWaalsContact O-CG 3.31Å; I528-K532 WeakPolarHBondContact O-CG 3.45Å; I528-K532 PolarHBondContact O-N 3.27Å; K532-E535 WeakPolarHBondContact O-CB 3.33Å; K532-E535 PolarHBondContact O-N 3.03Å; K532-Q536 WeakPolarHBondContact O-CG 3.37Å; K532-Q536 PolarHBondContact O-N 3.26Å
533	W	92.8	Very high	88	Confident	3 Å²	3	28.5 Å²	28.5	1%	0.011	16%	0.16	C	C	.	.	H	α-helix	trans	-68.6	-41.6	174.6	176.1	81.1	0	0	0	112.1	F399 I402 F414 I417 V467 L470 A529 L530 V531 E535 Q536 V537	F399-W533 HydrophobicContact CB-CB 3.7Å; F399-W533 HydrophobicContact CB-CG 3.85Å; F399-W533 HydrophobicContact CD1-CB 4.23Å; F399-W533 AromaticContact CD1-CD1 3.41Å; F399-W533 VanDerWaalsContact CD1-CD1 3.41Å; F399-W533 AromaticContact CD1-CD2 3.57Å; F399-W533 HydrophobicContact CD1-CD2 3.57Å; F399-W533 AromaticContact CD1-CE2 3.55Å; F399-W533 HydrophobicContact CD1-CE3 4.37Å; F399-W533 AromaticContact CD1-CG 3.46Å; F399-W533 HydrophobicContact CD1-CG 3.46Å; F399-W533 VanDerWaalsContact CD1-CG 3.46Å; F399-W533 HydrophobicContact CD1-CZ2 4.3Å; F399-W533 AromaticContact CD1-NE1 3.42Å; F399-W533 HydrophobicContact CD2-CD2 4.49Å; F399-W533 HydrophobicContact CD2-CG 4.42Å; F399-W533 AromaticContact CE1-CD2 3.62Å; F399-W533 HydrophobicContact CE1-CD2 3.62Å; F399-W533 AromaticContact CE1-CE2 3.38Å; F399-W533 HydrophobicContact CE1-CE3 4.11Å; F399-W533 HydrophobicContact CE1-CG 4.05Å; F399-W533 HydrophobicContact CE1-CH2 4.17Å; F399-W533 AromaticContact CE1-CZ2 3.67Å; F399-W533 HydrophobicContact CE1-CZ2 3.67Å; F399-W533 HydrophobicContact CE1-CZ3 4.38Å; F399-W533 AromaticContact CE1-NE1 3.69Å; F399-W533 HydrophobicContact CE2-CE3 4.43Å; F399-W533 HydrophobicContact CG-CB 3.92Å; F399-W533 AromaticContact CG-CD1 3.95Å; F399-W533 HydrophobicContact CG-CD2 4.01Å; F399-W533 AromaticContact CG-CG 3.66Å; F399-W533 HydrophobicContact CG-CG 3.66Å; F399-W533 HydrophobicContact CZ-CD2 4.08Å; F399-W533 HydrophobicContact CZ-CE3 4.12Å; F399-W533 HydrophobicContact CZ-CH2 4.3Å; F399-W533 HydrophobicContact CZ-CZ2 4.26Å; F399-W533 HydrophobicContact CZ-CZ3 4.24Å; I402-W533 HydrophobicContact CD1-CH2 3.96Å; I402-W533 HydrophobicContact CD1-CZ3 4.49Å; I402-W533 HydrophobicContact CG2-CH2 4.47Å; I402-W533 HydrophobicContact CG2-CZ2 4.29Å; F414-W533 HydrophobicContact CD1-CZ2 4.22Å; F414-W533 AromaticContact CD1-NE1 3.7Å; F414-W533 AromaticContact CD2-CD1 3.68Å; F414-W533 AromaticContact CD2-NE1 3.16Å; F414-W533 HydrophobicContact CE1-CZ2 4.32Å; F414-W533 AromaticContact CE1-NE1 3.8Å; F414-W533 AromaticContact CE2-CD1 3.64Å; F414-W533 AromaticContact CE2-NE1 3.26Å; F414-W533 VanDerWaalsContact CE2-NE1 3.26Å; F414-W533 AromaticContact CG-NE1 3.39Å; F414-W533 AromaticContact CZ-NE1 3.59Å; I417-W533 HydrophobicContact CD1-CH2 4.38Å; I417-W533 HydrophobicContact CD1-CZ2 3.96Å; V467-W533 HydrophobicContact CG1-CZ3 4.39Å; V467-W533 HydrophobicContact CG2-CH2 3.74Å; V467-W533 HydrophobicContact CG2-CZ3 3.94Å; L470-W533 HydrophobicContact CD1-CE3 4.2Å; L470-W533 HydrophobicContact CD1-CH2 4.46Å; L470-W533 HydrophobicContact CD1-CZ3 3.63Å; A529-W533 WeakPolarHBondContact O-CB 3.31Å; A529-W533 PolarHBondContact O-N 2.81Å; A529-W533 VanDerWaalsContact O-N 3.08Å; L530-W533 WeakPolarHBondContact O-CB 3.3Å; L530-W533 PolarHBondContact O-N 2.81Å; V531-W533 PolarHBondContact O-N 2.68Å; W533-E535 PolarHBondContact O-N 3.37Å; W533-Q536 WeakPolarHBondContact O-CB 3.5Å; W533-Q536 PolarHBondContact O-N 3.08Å; W533-Q536 VanDerWaalsContact O-N 3.12Å; W533-V537 HydrophobicContact CD2-CG2 4.06Å; W533-V537 HydrophobicContact CG-CG2 4.46Å; W533-V537 HydrophobicContact CH2-CG2 4.43Å; W533-V537 HydrophobicContact CZ2-CG2 3.82Å; W533-V537 VanDerWaalsContact O-CG2 3.31Å; W533-V537 WeakPolarHBondContact O-CG2 3.37Å; W533-V537 PolarHBondContact O-N 3.04Å
534	T	92.4	Very high	88.6	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.3	-37.3	176.2	60.5	0	0	0	0	111.7	V467 L470 A471 L530 V531 V537 G538 L539	V467-T534 HydrophobicContact CG1-CG2 3.99Å; L470-T534 HydrophobicContact CB-CG2 3.86Å; A471-T534 HydrophobicContact CB-CG2 4.07Å; L530-T534 WeakPolarHBondContact O-CG2 3.4Å; L530-T534 PolarHBondContact O-N 3.19Å; V531-T534 WeakPolarHBondContact CA-OG1 3.19Å; V531-T534 PolarHBondContact O-N 3.22Å; V531-T534 VanDerWaalsContact O-N 3.17Å; V531-T534 PolarHBondContact O-OG1 2.73Å; T534-V537 PolarHBondContact O-N 3.23Å; T534-G538 PolarHBondContact O-N 3.24Å; T534-L539 CarbonylContact C-O 3.5Å; T534-L539 CarbonylContact O-C 3.53Å; T534-L539 WeakPolarHBondContact O-CA 3.31Å; T534-L539 PolarHBondContact O-N 2.9Å; T534-L539 VanDerWaalsContact O-O 3.06Å; T534-L539 PolarHBondContact OG1-O 2.9Å
535	E	90	Very high	88.8	Confident	38 Å²	38	29.9 Å²	29.9	18%	0.178	16%	0.156	C	C	.	.	H	α-helix	trans	-60.3	-47.4	172	174.4	-177.7	-151.1	0	0	111.9	H518 Y520 V531 K532 W533 V537 G538 L539 T540	H518-E535 IonicContact CD2-OE1 2.63Å; Y520-E535 WeakPolarHBondContact CE2-OE2 3.34Å; V531-E535 PolarHBondContact O-N 2.83Å; K532-E535 WeakPolarHBondContact O-CB 3.33Å; K532-E535 PolarHBondContact O-N 3.03Å; W533-E535 PolarHBondContact O-N 3.37Å; E535-V537 PolarHBondContact O-N 2.85Å; E535-G538 PolarHBondContact O-N 3.06Å; E535-L539 PolarHBondContact N-O 2.85Å; E535-T540 HydrophobicContact CG-CG2 4.06Å
536	Q	88.6	Confident	88.8	Confident	152 Å²	152	36 Å²	36	71%	0.71	19%	0.186	S	C	*	.	H	α-helix	trans	-58.6	-33.8	177.2	-73.8	172.1	1	0	0	113	K532 W533 G538	K532-Q536 WeakPolarHBondContact O-CG 3.37Å; K532-Q536 PolarHBondContact O-N 3.26Å; W533-Q536 WeakPolarHBondContact O-CB 3.5Å; W533-Q536 PolarHBondContact O-N 3.08Å; W533-Q536 VanDerWaalsContact O-N 3.12Å; Q536-G538 VanDerWaalsContact C-N 3.28Å
537	V	88.7	Confident	88.8	Confident	7 Å²	7	39.5 Å²	39.5	4%	0.042	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.8	-179.5	-171.5	0	0	0	0	111.6	I417 G418 I421 W533 T534 E535	I417-V537 HydrophobicContact CB-CG1 3.69Å; I417-V537 HydrophobicContact CG2-CG1 3.42Å; I417-V537 VanDerWaalsContact CG2-CG1 3.42Å; G418-V537 VanDerWaalsContact CA-O 3.26Å; G418-V537 WeakPolarHBondContact CA-O 3.37Å; I421-V537 HydrophobicContact CD1-CG1 3.81Å; W533-V537 HydrophobicContact CD2-CG2 4.06Å; W533-V537 HydrophobicContact CG-CG2 4.46Å; W533-V537 HydrophobicContact CH2-CG2 4.43Å; W533-V537 HydrophobicContact CZ2-CG2 3.82Å; W533-V537 VanDerWaalsContact O-CG2 3.31Å; W533-V537 WeakPolarHBondContact O-CG2 3.37Å; W533-V537 PolarHBondContact O-N 3.04Å; T534-V537 PolarHBondContact O-N 3.23Å; E535-V537 PolarHBondContact O-N 2.85Å
538	G	86.5	Confident	88.9	Confident	5 Å²	5	41.4 Å²	41.4	5%	0.052	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.1	12.5	171.6	0	0	0	0	0	115.7	T534 E535 Q536 V553 K554	T534-G538 PolarHBondContact O-N 3.24Å; E535-G538 PolarHBondContact O-N 3.06Å; Q536-G538 VanDerWaalsContact C-N 3.28Å; G538-V553 WeakPolarHBondContact O-CA 3.37Å; G538-K554 PolarHBondContact O-N 2.79Å
539	L	89.3	Confident	89	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	94.2	173.1	-171.5	69	0	0	0	110.4	W464 V467 A471 T534 E535 L551 Q552 V553	W464-L539 HydrophobicContact CH2-CD1 4.12Å; W464-L539 HydrophobicContact CZ3-CD1 4.22Å; V467-L539 HydrophobicContact CG1-CB 4.14Å; V467-L539 HydrophobicContact CG1-CD2 3.95Å; A471-L539 HydrophobicContact CB-CD2 3.51Å; A471-L539 HydrophobicContact CB-CG 4.11Å; T534-L539 CarbonylContact C-O 3.5Å; T534-L539 CarbonylContact O-C 3.53Å; T534-L539 WeakPolarHBondContact O-CA 3.31Å; T534-L539 PolarHBondContact O-N 2.9Å; T534-L539 VanDerWaalsContact O-O 3.06Å; T534-L539 PolarHBondContact OG1-O 2.9Å; E535-L539 PolarHBondContact N-O 2.85Å; L539-L551 HydrophobicContact CD1-CB 4.08Å; L539-L551 HydrophobicContact CD1-CD1 4.26Å; L539-L551 HydrophobicContact CD2-CD1 4.15Å; L539-L551 HydrophobicContact CG-CD1 4.28Å; L539-Q552 CarbonylContact C-O 3.55Å; L539-Q552 WeakPolarHBondContact CA-O 3.43Å; L539-V553 HydrophobicContact CD1-CG2 3.75Å
540	T	90.9	Very high	89	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	137.1	-172.9	-54.2	0	0	0	0	111.3	E535 L551 Q552	E535-T540 HydrophobicContact CG-CG2 4.06Å; T540-L551 CarbonylContact O-C 3.5Å; T540-L551 WeakPolarHBondContact O-CA 3.38Å; T540-Q552 PolarHBondContact N-O 3.23Å; T540-Q552 PolarHBondContact O-N 3.47Å
541	L	90.6	Very high	88.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	111.9	170.2	176.4	72.7	0	0	0	109.6	H474 V476 P478 Y520 V531 R544 M549 L551	H474-L541 WeakPolarHBondContact CE1-CD2 3.37Å; V476-L541 HydrophobicContact CG1-CD2 4.48Å; P478-L541 HydrophobicContact CG-CD2 4.46Å; P478-L541 HydrophobicContact CG-CG 4.32Å; Y520-L541 HydrophobicContact CD1-CD2 4.44Å; Y520-L541 HydrophobicContact CE1-CB 4.01Å; Y520-L541 HydrophobicContact CE1-CD2 4.17Å; Y520-L541 HydrophobicContact CE1-CG 4.45Å; Y520-L541 PolarHBondContact OH-O 3.07Å; V531-L541 HydrophobicContact CG1-CB 4.07Å; V531-L541 HydrophobicContact CG1-CD2 4.2Å; L541-R544 HydrophobicContact CD1-CB 4.44Å; L541-M549 HydrophobicContact CD1-CE 3.9Å; L541-L551 HydrophobicContact CB-CD2 4.12Å; L541-L551 HydrophobicContact CD1-CD2 3.65Å
542	I	89.2	Confident	88.6	Confident	59 Å²	59	42.1 Å²	42.1	30%	0.303	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-46.8	179.9	-50.9	-178.4	0	0	0	111.2	P478 T550 Q552 L563	P478-I542 WeakPolarHBondContact CG-O 3.36Å; I542-T550 PolarHBondContact N-O 2.86Å; I542-T550 VanDerWaalsContact N-O 3.13Å; I542-Q552 HydrophobicContact CD1-CB 3.65Å; I542-Q552 HydrophobicContact CD1-CG 3.92Å; I542-Q552 VanDerWaalsContact CD1-OE1 3.28Å; I542-Q552 HydrophobicContact CG1-CB 3.75Å; I542-Q552 HydrophobicContact CG1-CG 4.48Å; I542-L563 HydrophobicContact CD1-CD2 3.38Å
543	A	86.3	Confident	88.4	Confident	45 Å²	45	38.1 Å²	38.1	37%	0.372	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	140	-171.9	0	0	0	0	0	110.9	T550	A543-T550 PolarHBondContact N-O 3.45Å; A543-T550 PolarHBondContact O-N 3.28Å
544	R	85.6	Confident	87.7	Confident	31 Å²	31	42 Å²	42	12%	0.117	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	130.5	173.3	176.7	-177.9	-176.7	116.9	-6.2	109.3	H474 N475 V476 L541 M549	H474-R544 PolarHBondContact CE1-NH1 2.92Å; H474-R544 PolarHBondContact ND1-NH1 2.99Å; H474-R544 PolarHBondContact O-NH1 3.43Å; H474-R544 PolarHBondContact O-NH2 3.38Å; N475-R544 PolarHBondContact OD1-NH2 3.03Å; N475-R544 VanDerWaalsContact OD1-NH2 3.1Å; V476-R544 WeakPolarHBondContact O-CD 3.21Å; L541-R544 HydrophobicContact CD1-CB 4.44Å; R544-M549 HydrophobicContact CB-CG 4.3Å; R544-M549 HydrophobicContact CG-CG 3.9Å; R544-M549 PolarHBondContact NH1-SD 3.39Å
545	D	82.8	Confident	86.6	Confident	80 Å²	80	42.8 Å²	42.8	43%	0.428	23%	0.225	S	C	.	.			trans	-120.9	-166.3	165.5	66.3	38.9	0	0	0	109.9	N547 T548	D545-N547 VanDerWaalsContact C-N 3.26Å; D545-N547 PolarHBondContact O-N 3.38Å; D545-N547 WeakPolarHBondContact OD1-CA 3.42Å; D545-N547 PolarHBondContact OD1-N 2.9Å; D545-T548 PolarHBondContact N-O 3.18Å; D545-T548 WeakPolarHBondContact OD1-CA 3.44Å; D545-T548 PolarHBondContact OD1-N 3.28Å; D545-T548 PolarHBondContact OD1-OG1 3.32Å; D545-T548 PolarHBondContact OD2-OG1 2.95Å
546	L	79.6	Confident	85.3	Confident	158 Å²	158	46.3 Å²	46.3	83%	0.827	25%	0.251	S	S	*	.	S	Bend	trans	-69.9	-21	179.6	-70.5	168.1	0	0	0	113.6
547	N	86.4	Confident	83.9	Confident	99 Å²	99	42.1 Å²	42.1	53%	0.529	24%	0.239	S	C	.	.	S	Bend	trans	-127.6	-12.6	-166.1	-70.5	62.4	0	0	0	113.4	D545 Q567 I568	D545-N547 VanDerWaalsContact C-N 3.26Å; D545-N547 PolarHBondContact O-N 3.38Å; D545-N547 WeakPolarHBondContact OD1-CA 3.42Å; D545-N547 PolarHBondContact OD1-N 2.9Å; N547-Q567 CarbonylContact O-C 3.56Å; N547-Q567 WeakPolarHBondContact O-CA 3.34Å; N547-I568 PolarHBondContact O-N 3.02Å
548	T	90	Very high	82.3	Confident	60 Å²	60	50.8 Å²	50.8	37%	0.368	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	148.4	-172.9	82.8	0	0	0	0	111.5	D545 Y566	D545-T548 PolarHBondContact N-O 3.18Å; D545-T548 WeakPolarHBondContact OD1-CA 3.44Å; D545-T548 PolarHBondContact OD1-N 3.28Å; D545-T548 PolarHBondContact OD1-OG1 3.32Å; D545-T548 PolarHBondContact OD2-OG1 2.95Å; T548-Y566 CarbonylContact C-O 3.47Å; T548-Y566 VanDerWaalsContact CA-O 3.25Å; T548-Y566 WeakPolarHBondContact CA-O 3.48Å
549	M	91.4	Very high	80.8	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	138	173.3	-74.2	176	71.8	0	0	109.6	A471 L472 L541 R544 Y566 I568 I583	A471-M549 WeakPolarHBondContact O-CE 3.42Å; L472-M549 HydrophobicContact CD2-CE 4.1Å; L472-M549 HydrophobicContact CD2-SD 4.36Å; L541-M549 HydrophobicContact CD1-CE 3.9Å; R544-M549 HydrophobicContact CB-CG 4.3Å; R544-M549 HydrophobicContact CG-CG 3.9Å; R544-M549 PolarHBondContact NH1-SD 3.39Å; M549-Y566 PolarHBondContact N-O 2.92Å; M549-Y566 PolarHBondContact O-N 2.93Å; M549-I568 HydrophobicContact CG-CD1 3.69Å; M549-I568 HydrophobicContact CG-CG1 4.01Å; M549-I568 HydrophobicContact SD-CD1 3.94Å; M549-I568 HydrophobicContact SD-CG1 4.08Å; M549-I583 HydrophobicContact SD-CD1 4.32Å
550	T	90.6	Very high	79.5	Confident	22 Å²	22	63 Å²	63	14%	0.135	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.2	175.4	-57.5	0	0	0	0	110	I542 A543 L563 L564 H565	I542-T550 PolarHBondContact N-O 2.86Å; I542-T550 VanDerWaalsContact N-O 3.13Å; A543-T550 PolarHBondContact N-O 3.45Å; A543-T550 PolarHBondContact O-N 3.28Å; T550-L563 HydrophobicContact CG2-CB 4.47Å; T550-L563 HydrophobicContact CG2-CD2 4.31Å; T550-L564 WeakPolarHBondContact CA-O 3.27Å; T550-H565 PolarHBondContact OG1-ND1 3.4Å; T550-H565 VanDerWaalsContact OG1-ND1 3.13Å
551	L	90.1	Very high	78.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	140.1	175.6	-57.5	-178.5	0	0	0	110.3	A471 L472 L539 T540 L541 L564 Y566	A471-L551 HydrophobicContact CB-CD1 3.9Å; A471-L551 HydrophobicContact CB-CD2 4.25Å; L472-L551 HydrophobicContact CD2-CD1 3.77Å; L472-L551 HydrophobicContact CD2-CG 4.37Å; L472-L551 HydrophobicContact CG-CD1 4.06Å; L539-L551 HydrophobicContact CD1-CB 4.08Å; L539-L551 HydrophobicContact CD1-CD1 4.26Å; L539-L551 HydrophobicContact CD2-CD1 4.15Å; L539-L551 HydrophobicContact CG-CD1 4.28Å; T540-L551 CarbonylContact O-C 3.5Å; T540-L551 WeakPolarHBondContact O-CA 3.38Å; L541-L551 HydrophobicContact CB-CD2 4.12Å; L541-L551 HydrophobicContact CD1-CD2 3.65Å; L551-L564 HydrophobicContact CB-CB 4.39Å; L551-L564 PolarHBondContact N-O 2.93Å; L551-L564 PolarHBondContact O-N 3.4Å; L551-Y566 HydrophobicContact CD1-CD2 4.48Å; L551-Y566 HydrophobicContact CD1-CE2 3.89Å; L551-Y566 HydrophobicContact CG-CD2 4.47Å; L551-Y566 HydrophobicContact CG-CE2 4.2Å
552	Q	88.3	Confident	78.2	Confident	39 Å²	39	66.3 Å²	66.3	18%	0.182	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132	170.7	-154.4	166.1	-6	0	0	109.5	L539 T540 I542 D561 L563	L539-Q552 CarbonylContact C-O 3.55Å; L539-Q552 WeakPolarHBondContact CA-O 3.43Å; T540-Q552 PolarHBondContact N-O 3.23Å; T540-Q552 PolarHBondContact O-N 3.47Å; I542-Q552 HydrophobicContact CD1-CB 3.65Å; I542-Q552 HydrophobicContact CD1-CG 3.92Å; I542-Q552 VanDerWaalsContact CD1-OE1 3.28Å; I542-Q552 HydrophobicContact CG1-CB 3.75Å; I542-Q552 HydrophobicContact CG1-CG 4.48Å; Q552-D561 HydrophobicContact CG-CB 4Å; Q552-D561 PolarHBondContact NE2-OD2 2.77Å; Q552-L563 HydrophobicContact CB-CD2 4.41Å; Q552-L563 HydrophobicContact CG-CD2 4.14Å
553	V	86.4	Confident	78.1	Confident	3 Å²	3	66.9 Å²	66.9	2%	0.018	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.6	166	-169.2	0	0	0	0	107.9	I421 W464 G538 L539 T555 I562 L564	I421-V553 HydrophobicContact CG2-CG1 4.09Å; W464-V553 HydrophobicContact CH2-CG2 3.84Å; W464-V553 HydrophobicContact CZ3-CG2 4.39Å; G538-V553 WeakPolarHBondContact O-CA 3.37Å; L539-V553 HydrophobicContact CD1-CG2 3.75Å; V553-T555 PolarHBondContact O-N 2.92Å; V553-I562 HydrophobicContact CB-CB 4.3Å; V553-I562 PolarHBondContact N-O 2.97Å; V553-I562 PolarHBondContact O-N 3Å; V553-L564 HydrophobicContact CG2-CD1 3.77Å; V553-L564 HydrophobicContact CG2-CG 4.18Å
554	K	77.6	Confident	78.1	Confident	85 Å²	85	65.5 Å²	65.5	37%	0.37	35%	0.35	S	S	.	.			trans	-68.2	127.3	177.1	-74.5	-171.1	176.1	-176	0	110.1	G538 D561	G538-K554 PolarHBondContact O-N 2.79Å; K554-D561 WeakPolarHBondContact CA-OD1 3.29Å
555	T	69.1	Low	78.4	Confident	16 Å²	16	68 Å²	68	10%	0.098	36%	0.363	C	S	.	.			trans	-106.8	156.2	175.5	56.1	0	0	0	0	111.6	L429 V553 S557 N560 D561 I562	L429-T555 HydrophobicContact CD1-CG2 4.41Å; V553-T555 PolarHBondContact O-N 2.92Å; T555-S557 PolarHBondContact O-N 2.86Å; T555-S557 VanDerWaalsContact O-N 3.11Å; T555-S557 PolarHBondContact OG1-O 3.37Å; T555-N560 VanDerWaalsContact OG1-C 3.29Å; T555-N560 PolarHBondContact OG1-O 3.21Å; T555-N560 VanDerWaalsContact OG1-O 3.08Å; T555-D561 PolarHBondContact N-OD1 3.23Å; T555-D561 PolarHBondContact OG1-OD1 3.06Å; T555-I562 HydrophobicContact CG2-CG1 4.37Å
556	P	62.5	Low	78.9	Confident	112 Å²	112	64.6 Å²	64.6	73%	0.727	34%	0.344	S	S	*	.	S	Bend	trans	-66.5	-8	-178	23.1	-32.7	0	0	0	115
557	S	59.2	Low	79.6	Confident	63 Å²	63	61 Å²	61	44%	0.441	32%	0.323	S	S	.	.	S	Bend	trans	-115.2	114	171.9	46.1	0	0	0	0	108.1	T555 D559 N560	T555-S557 PolarHBondContact O-N 2.86Å; T555-S557 VanDerWaalsContact O-N 3.11Å; T555-S557 PolarHBondContact OG1-O 3.37Å; S557-D559 PolarHBondContact O-N 2.99Å; S557-N560 PolarHBondContact O-N 3.25Å
558	E	56.2	Low	80	Confident	189 Å²	189	56.8 Å²	56.8	88%	0.883	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-16.3	-172.8	-68.8	-178.1	158.6	0	0	114.6
559	D	54.9	Low	80.1	Confident	156 Å²	156	55.4 Å²	55.4	83%	0.834	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.5	-177.8	-80.6	-27.5	0	0	0	115.9	S557	S557-D559 PolarHBondContact O-N 2.99Å
560	N	62.2	Low	80.1	Confident	106 Å²	106	57.2 Å²	57.2	57%	0.567	30%	0.299	S	S	*	.			trans	-134.4	43.6	-172.2	-81.7	-41.5	0	0	0	115.1	T555 S557 I562	T555-N560 VanDerWaalsContact OG1-C 3.29Å; T555-N560 PolarHBondContact OG1-O 3.21Å; T555-N560 VanDerWaalsContact OG1-O 3.08Å; S557-N560 PolarHBondContact O-N 3.25Å; N560-I562 PolarHBondContact O-N 3.12Å
561	D	72.3	Confident	80.1	Confident	54 Å²	54	58.7 Å²	58.7	29%	0.289	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-64.4	134	174.6	-78.4	-11.6	0	0	0	112.9	Q552 K554 T555	Q552-D561 HydrophobicContact CG-CB 4Å; Q552-D561 PolarHBondContact NE2-OD2 2.77Å; K554-D561 WeakPolarHBondContact CA-OD1 3.29Å; T555-D561 PolarHBondContact N-OD1 3.23Å; T555-D561 PolarHBondContact OG1-OD1 3.06Å
562	I	81.3	Confident	80.1	Confident	15 Å²	15	59.6 Å²	59.6	8%	0.077	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122.2	-177.7	-52.4	173.8	0	0	0	109.3	L429 V553 T555 N560 L564	L429-I562 HydrophobicContact CD1-CD1 3.53Å; L429-I562 HydrophobicContact CD1-CG1 3.9Å; L429-I562 HydrophobicContact CD2-CD1 4.43Å; L429-I562 HydrophobicContact CD2-CG1 4.43Å; L429-I562 HydrophobicContact CG-CD1 3.62Å; L429-I562 HydrophobicContact CG-CG1 4.11Å; V553-I562 HydrophobicContact CB-CB 4.3Å; V553-I562 PolarHBondContact N-O 2.97Å; V553-I562 PolarHBondContact O-N 3Å; T555-I562 HydrophobicContact CG2-CG1 4.37Å; N560-I562 PolarHBondContact O-N 3.12Å; I562-L564 HydrophobicContact CG2-CD2 4.19Å
563	L	86.8	Confident	80	Confident	72 Å²	72	61.5 Å²	61.5	38%	0.377	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	125.9	169.6	-59.7	179.6	0	0	0	111.3	I542 T550 Q552 K589	I542-L563 HydrophobicContact CD1-CD2 3.38Å; T550-L563 HydrophobicContact CG2-CB 4.47Å; T550-L563 HydrophobicContact CG2-CD2 4.31Å; Q552-L563 HydrophobicContact CB-CD2 4.41Å; Q552-L563 HydrophobicContact CG-CD2 4.14Å; L563-K589 PolarHBondContact O-NZ 3.38Å
564	L	87.6	Confident	79.9	Confident	15 Å²	15	66.4 Å²	66.4	8%	0.079	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	116.2	173	-59.7	177.4	0	0	0	109.2	W464 T550 L551 V553 I562 Y566	W464-L564 HydrophobicContact CH2-CD1 3.88Å; W464-L564 HydrophobicContact CZ2-CD1 3.95Å; T550-L564 WeakPolarHBondContact CA-O 3.27Å; L551-L564 HydrophobicContact CB-CB 4.39Å; L551-L564 PolarHBondContact N-O 2.93Å; L551-L564 PolarHBondContact O-N 3.4Å; V553-L564 HydrophobicContact CG2-CD1 3.77Å; V553-L564 HydrophobicContact CG2-CG 4.18Å; I562-L564 HydrophobicContact CG2-CD2 4.19Å; L564-Y566 HydrophobicContact CB-CD2 4.42Å; L564-Y566 HydrophobicContact CB-CE2 3.58Å
565	H	91.4	Very high	80.1	Confident	85 Å²	85	65.4 Å²	65.4	39%	0.394	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.4	178	-60.2	-67.7	0	0	0	110.9	T550 S588	T550-H565 PolarHBondContact OG1-ND1 3.4Å; T550-H565 VanDerWaalsContact OG1-ND1 3.13Å; H565-S588 WeakPolarHBondContact O-CB 3.32Å; H565-S588 PolarHBondContact O-N 3.43Å; H565-S588 PolarHBondContact O-OG 2.85Å
566	Y	93.4	Very high	80.2	Confident	7 Å²	7	68.3 Å²	68.3	3%	0.027	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140.7	177.5	-62.3	-91	0	0	0	110	R468 L472 T548 M549 L551 L564 R586 E587	R468-Y566 WeakPolarHBondContact CD-OH 3.37Å; L472-Y566 HydrophobicContact CD1-CD1 4.16Å; L472-Y566 HydrophobicContact CD1-CE1 3.83Å; L472-Y566 HydrophobicContact CD1-CE2 4.46Å; L472-Y566 HydrophobicContact CD2-CD1 4.17Å; L472-Y566 HydrophobicContact CD2-CD2 3.69Å; L472-Y566 HydrophobicContact CD2-CE1 4.4Å; L472-Y566 HydrophobicContact CD2-CE2 3.94Å; L472-Y566 HydrophobicContact CD2-CG 3.8Å; T548-Y566 CarbonylContact C-O 3.47Å; T548-Y566 VanDerWaalsContact CA-O 3.25Å; T548-Y566 WeakPolarHBondContact CA-O 3.48Å; M549-Y566 PolarHBondContact N-O 2.92Å; M549-Y566 PolarHBondContact O-N 2.93Å; L551-Y566 HydrophobicContact CD1-CD2 4.48Å; L551-Y566 HydrophobicContact CD1-CE2 3.89Å; L551-Y566 HydrophobicContact CG-CD2 4.47Å; L551-Y566 HydrophobicContact CG-CE2 4.2Å; L564-Y566 HydrophobicContact CB-CD2 4.42Å; L564-Y566 HydrophobicContact CB-CE2 3.58Å; Y566-R586 WeakPolarHBondContact CA-O 3.4Å; Y566-E587 HydrophobicContact CD1-CB 3.98Å; Y566-E587 HydrophobicContact CD1-CG 4.38Å; Y566-E587 HydrophobicContact CE1-CB 3.84Å; Y566-E587 HydrophobicContact CE1-CG 3.95Å
567	Q	94.3	Very high	80.8	Confident	82 Å²	82	72.1 Å²	72.1	38%	0.383	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	123.1	169.2	-173.6	-179.6	5.1	0	0	108.9	N547 L569 V585 R586	N547-Q567 CarbonylContact O-C 3.56Å; N547-Q567 WeakPolarHBondContact O-CA 3.34Å; Q567-L569 HydrophobicContact CG-CD2 4.24Å; Q567-L569 PolarHBondContact O-N 2.82Å; Q567-V585 CarbonylContact O-C 3.42Å; Q567-V585 WeakPolarHBondContact O-CA 3.39Å; Q567-R586 HydrophobicContact CB-CB 4.4Å; Q567-R586 PolarHBondContact N-O 3.42Å; Q567-R586 PolarHBondContact O-N 3.02Å
568	I	93.7	Very high	81.9	Confident	12 Å²	12	70.2 Å²	70.2	6%	0.062	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	114.4	171.6	-56.7	165.4	0	0	0	107.6	N547 M549 I583	N547-I568 PolarHBondContact O-N 3.02Å; M549-I568 HydrophobicContact CG-CD1 3.69Å; M549-I568 HydrophobicContact CG-CG1 4.01Å; M549-I568 HydrophobicContact SD-CD1 3.94Å; M549-I568 HydrophobicContact SD-CG1 4.08Å; I568-I583 HydrophobicContact CG1-CD1 4.21Å; I568-I583 HydrophobicContact CG2-CD1 4.08Å; I568-I583 HydrophobicContact CG2-CG1 4.11Å
569	L	92.7	Very high	83.5	Confident	30 Å²	30	65.1 Å²	65.1	16%	0.157	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-44.7	179.3	-68.2	-176.5	0	0	0	111.4	Q567 I584 R586 I593 Y641	Q567-L569 HydrophobicContact CG-CD2 4.24Å; Q567-L569 PolarHBondContact O-N 2.82Å; L569-I584 HydrophobicContact CB-CB 4.26Å; L569-I584 HydrophobicContact CB-CG2 3.99Å; L569-I584 HydrophobicContact CD1-CG2 4.04Å; L569-I584 PolarHBondContact N-O 2.83Å; L569-R586 HydrophobicContact CD1-CB 3.92Å; L569-R586 HydrophobicContact CD2-CB 4.48Å; L569-R586 HydrophobicContact CG-CB 4.14Å; L569-I593 HydrophobicContact CD1-CD1 4.07Å; L569-I593 HydrophobicContact CD1-CG1 4.2Å; L569-I593 HydrophobicContact CD1-CG2 4.08Å; L569-Y641 HydrophobicContact CB-CE2 3.99Å; L569-Y641 WeakPolarHBondContact CB-OH 3.31Å; L569-Y641 HydrophobicContact CD1-CD1 4.25Å; L569-Y641 HydrophobicContact CD1-CD2 4.28Å; L569-Y641 HydrophobicContact CD1-CE1 3.86Å; L569-Y641 HydrophobicContact CD1-CE2 3.89Å; L569-Y641 HydrophobicContact CD1-CG 4.46Å
570	Q	91.5	Very high	85.2	Confident	38 Å²	38	60.1 Å²	60.1	18%	0.178	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	141.3	177.7	-172.2	57.7	45.2	0	0	110.5	F572 I584 Y648	Q570-F572 HydrophobicContact CB-CE2 4.44Å; Q570-F572 HydrophobicContact CB-CZ 4.31Å; Q570-F572 HydrophobicContact CG-CE1 3.82Å; Q570-F572 HydrophobicContact CG-CE2 4Å; Q570-F572 HydrophobicContact CG-CZ 3.52Å; Q570-I584 HydrophobicContact CB-CB 4.31Å; Q570-I584 HydrophobicContact CB-CD1 4.12Å; Q570-I584 HydrophobicContact CB-CG1 4.38Å; Q570-I584 PolarHBondContact N-O 3.25Å; Q570-I584 PolarHBondContact O-N 3.21Å; Q570-Y648 VanDerWaalsContact CD-CE1 3.42Å; Q570-Y648 HydrophobicContact CG-CE1 4.12Å; Q570-Y648 PolarHBondContact NE2-OH 2.86Å; Q570-Y648 VanDerWaalsContact NE2-OH 3.16Å
571	L	89.9	Confident	86.7	Confident	54 Å²	54	55.2 Å²	55.2	28%	0.283	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.6	174.7	-173.8	71.7	0	0	0	109.7	N475 M581 I583	N475-L571 WeakPolarHBondContact OD1-CD1 3.31Å; N475-L571 VanDerWaalsContact OD1-CD2 3.29Å; N475-L571 WeakPolarHBondContact OD1-CD2 3.44Å; L571-M581 HydrophobicContact CD1-CE 3.67Å; L571-I583 HydrophobicContact CD1-CB 4.16Å; L571-I583 HydrophobicContact CD1-CD1 3.97Å; L571-I583 HydrophobicContact CD1-CG1 3.9Å
572	F	91	Very high	87.7	Confident	19 Å²	19	52.7 Å²	52.7	8%	0.083	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	97.3	172.2	-53.1	-78.6	0	0	0	107.9	Q570 M581 G582 I584 F595 F644 Y648 T666 L669	Q570-F572 HydrophobicContact CB-CE2 4.44Å; Q570-F572 HydrophobicContact CB-CZ 4.31Å; Q570-F572 HydrophobicContact CG-CE1 3.82Å; Q570-F572 HydrophobicContact CG-CE2 4Å; Q570-F572 HydrophobicContact CG-CZ 3.52Å; F572-M581 WeakPolarHBondContact O-CG 3.49Å; F572-G582 PolarHBondContact N-O 2.86Å; F572-G582 PolarHBondContact O-N 2.81Å; F572-I584 HydrophobicContact CE2-CD1 3.93Å; F572-I584 HydrophobicContact CE2-CG1 3.95Å; F572-I584 HydrophobicContact CZ-CD1 4.18Å; F572-F595 AromaticContact CD2-CE2 3.84Å; F572-F595 HydrophobicContact CD2-CE2 3.84Å; F572-F595 HydrophobicContact CE2-CD2 4.36Å; F572-F595 AromaticContact CE2-CE2 3.81Å; F572-F595 HydrophobicContact CE2-CE2 3.81Å; F572-F644 HydrophobicContact CE1-CZ 4.05Å; F572-F644 AromaticContact CZ-CE1 3.98Å; F572-F644 HydrophobicContact CZ-CE1 3.98Å; F572-F644 AromaticContact CZ-CZ 3.58Å; F572-F644 HydrophobicContact CZ-CZ 3.58Å; F572-Y648 AromaticContact CE1-CE2 3.84Å; F572-Y648 HydrophobicContact CE1-CE2 3.84Å; F572-T666 HydrophobicContact CD1-CG2 3.75Å; F572-T666 HydrophobicContact CE1-CG2 3.92Å; F572-T666 HydrophobicContact CG-CG2 4.26Å; F572-L669 HydrophobicContact CE2-CD1 4.28Å; F572-L669 HydrophobicContact CZ-CD1 4.09Å
573	P	85.4	Confident	88.4	Confident	79 Å²	79	52 Å²	52	51%	0.513	27%	0.265	S	S	.	.			trans	-64.9	153.9	-174.3	27.7	-34.7	0	0	0	111.4	T575	P573-T575 PolarHBondContact O-N 2.88Å
574	F	86.1	Confident	88.8	Confident	105 Å²	105	48.5 Å²	48.5	46%	0.461	25%	0.247	S	C	.	.			trans	-61.3	135.3	173	179.4	-91.6	0	0	0	111	K579 R580 M581	F574-K579 VanDerWaalsContact CE2-C 3.49Å; F574-R580 WeakPolarHBondContact CA-O 3.36Å; F574-M581 HydrophobicContact CB-CB 4.2Å
575	T	80.1	Confident	89.1	Confident	65 Å²	65	48 Å²	48	40%	0.399	24%	0.244	S	C	.	.			trans	-128.3	150.4	167	74.7	0	0	0	0	110.6	P573 E577 S578 K579	P573-T575 PolarHBondContact O-N 2.88Å; T575-E577 PolarHBondContact O-N 2.89Å; T575-S578 PolarHBondContact N-OG 3.47Å; T575-S578 PolarHBondContact O-N 3.02Å; T575-S578 PolarHBondContact O-OG 3.4Å; T575-S578 VanDerWaalsContact OG1-CB 3.32Å; T575-S578 WeakPolarHBondContact OG1-CB 3.45Å; T575-S578 PolarHBondContact OG1-N 3.39Å; T575-S578 VanDerWaalsContact OG1-N 3.14Å; T575-S578 PolarHBondContact OG1-OG 3.18Å; T575-K579 PolarHBondContact O-N 2.93Å
576	S	71.6	Confident	89.3	Confident	77 Å²	77	46.8 Å²	46.8	54%	0.538	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.7	178.7	-66.9	0	0	0	0	113.1	K579	S576-K579 WeakPolarHBondContact O-CG 3.27Å
577	E	75.9	Confident	89.2	Confident	191 Å²	191	47.7 Å²	47.7	89%	0.893	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-42.5	176.4	-65.2	-179.3	172.6	0	0	111.6	T575	T575-E577 PolarHBondContact O-N 2.89Å
578	S	82.7	Confident	88.8	Confident	23 Å²	23	47.5 Å²	47.5	16%	0.161	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-27.8	-179.1	76.2	0	0	0	0	113.2	T575 R580	T575-S578 PolarHBondContact N-OG 3.47Å; T575-S578 PolarHBondContact O-N 3.02Å; T575-S578 PolarHBondContact O-OG 3.4Å; T575-S578 VanDerWaalsContact OG1-CB 3.32Å; T575-S578 WeakPolarHBondContact OG1-CB 3.45Å; T575-S578 PolarHBondContact OG1-N 3.39Å; T575-S578 VanDerWaalsContact OG1-N 3.14Å; T575-S578 PolarHBondContact OG1-OG 3.18Å; S578-R580 WeakPolarHBondContact O-CG 3.41Å; S578-R580 PolarHBondContact O-N 3.12Å; S578-R580 VanDerWaalsContact O-N 3.15Å; S578-R580 PolarHBondContact O-NH1 3.49Å; S578-R580 PolarHBondContact OG-N 3.46Å; S578-R580 PolarHBondContact OG-O 2.87Å; S578-R580 VanDerWaalsContact OG-O 3.12Å
579	K	88.1	Confident	88.3	Confident	82 Å²	82	52.3 Å²	52.3	36%	0.357	27%	0.269	S	S	.	.			trans	50.7	29.3	-173.7	-56.2	-170.7	179.8	-169.7	0	114	F574 T575 S576 G599 A600 V603 E712	F574-K579 VanDerWaalsContact CE2-C 3.49Å; T575-K579 PolarHBondContact O-N 2.93Å; S576-K579 WeakPolarHBondContact O-CG 3.27Å; K579-G599 WeakPolarHBondContact O-CA 3.35Å; K579-A600 HydrophobicContact CB-CB 4.2Å; K579-A600 PolarHBondContact O-N 2.86Å; K579-V603 HydrophobicContact CB-CG2 4.2Å; K579-E712 IonicContact NZ-OE1 3.42Å; K579-E712 PolarHBondContact NZ-OE1 3.15Å
580	R	91.8	Very high	87.9	Confident	52 Å²	52	55.1 Å²	55.1	20%	0.196	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	158	-178.6	66.4	-168.2	177.1	-94.1	10.1	111.7	F574 S578 L597 K598 E670	F574-R580 WeakPolarHBondContact CA-O 3.36Å; S578-R580 WeakPolarHBondContact O-CG 3.41Å; S578-R580 PolarHBondContact O-N 3.12Å; S578-R580 VanDerWaalsContact O-N 3.15Å; S578-R580 PolarHBondContact O-NH1 3.49Å; S578-R580 PolarHBondContact OG-N 3.46Å; S578-R580 PolarHBondContact OG-O 2.87Å; S578-R580 VanDerWaalsContact OG-O 3.12Å; R580-L597 HydrophobicContact CB-CD1 4.45Å; R580-L597 HydrophobicContact CG-CD1 4.34Å; R580-K598 CarbonylContact C-O 3.55Å; R580-K598 VanDerWaalsContact CA-O 3.27Å; R580-K598 WeakPolarHBondContact CA-O 3.49Å; R580-K598 WeakPolarHBondContact CB-O 3.45Å; R580-E670 IonicContact CZ-OE1 3.41Å; R580-E670 IonicContact CZ-OE2 2.71Å; R580-E670 VanDerWaalsContact CZ-OE2 3.25Å; R580-E670 IonicContact NE-OE1 3.97Å; R580-E670 PolarHBondContact NE-OE1 3.26Å; R580-E670 IonicContact NE-OE2 3.7Å; R580-E670 PolarHBondContact NE-OE2 3.26Å; R580-E670 IonicContact NH2-OE1 2.85Å; R580-E670 IonicContact NH2-OE2 3.88Å; R580-E670 PolarHBondContact NH2-OE2 2.88Å
581	M	92.8	Very high	87.6	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	138.4	178.2	179.2	-169.8	179.3	0	0	109.2	H474 N475 E527 L571 F572 F574 L597 K598	H474-M581 WeakPolarHBondContact O-CE 3.3Å; N475-M581 HydrophobicContact CB-CE 4.29Å; N475-M581 VanDerWaalsContact CG-CE 3.43Å; N475-M581 WeakPolarHBondContact OD1-CE 3.44Å; E527-M581 VanDerWaalsContact OE1-SD 3.34Å; L571-M581 HydrophobicContact CD1-CE 3.67Å; F572-M581 WeakPolarHBondContact O-CG 3.49Å; F574-M581 HydrophobicContact CB-CB 4.2Å; M581-L597 WeakPolarHBondContact O-CA 3.36Å; M581-L597 WeakPolarHBondContact O-CD1 3.3Å; M581-K598 HydrophobicContact CB-CG 4.13Å; M581-K598 PolarHBondContact N-O 3.2Å; M581-K598 PolarHBondContact O-N 3.18Å; M581-K598 WeakPolarHBondContact SD-CE 3.47Å
582	G	93.8	Very high	87.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.8	177.3	0	0	0	0	0	113.2	F572 Y596	F572-G582 PolarHBondContact N-O 2.86Å; F572-G582 PolarHBondContact O-N 2.81Å; G582-Y596 CarbonylContact C-O 3.6Å; G582-Y596 WeakPolarHBondContact CA-O 3.36Å
583	I	95.1	Very high	87.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	138.4	173.3	-164.4	174.3	0	0	0	110.3	C473 M549 I568 L571 V585 F595 Y596	C473-I583 HydrophobicContact CB-CG2 4Å; M549-I583 HydrophobicContact SD-CD1 4.32Å; I568-I583 HydrophobicContact CG1-CD1 4.21Å; I568-I583 HydrophobicContact CG2-CD1 4.08Å; I568-I583 HydrophobicContact CG2-CG1 4.11Å; L571-I583 HydrophobicContact CD1-CB 4.16Å; L571-I583 HydrophobicContact CD1-CD1 3.97Å; L571-I583 HydrophobicContact CD1-CG1 3.9Å; I583-V585 HydrophobicContact CD1-CG1 3.87Å; I583-V585 HydrophobicContact CG1-CG1 3.9Å; I583-V585 HydrophobicContact CG2-CG1 4.38Å; I583-F595 WeakPolarHBondContact O-CA 3.41Å; I583-F595 WeakPolarHBondContact O-CD2 3.35Å; I583-Y596 HydrophobicContact CG2-CD2 4.4Å; I583-Y596 PolarHBondContact N-O 3.11Å; I583-Y596 PolarHBondContact O-N 2.92Å
584	I	95.7	Very high	88.3	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	122.3	169.9	-55.8	177	0	0	0	107.5	L569 Q570 F572 I593 F595 Y641 F644 L669	L569-I584 HydrophobicContact CB-CB 4.26Å; L569-I584 HydrophobicContact CB-CG2 3.99Å; L569-I584 HydrophobicContact CD1-CG2 4.04Å; L569-I584 PolarHBondContact N-O 2.83Å; Q570-I584 HydrophobicContact CB-CB 4.31Å; Q570-I584 HydrophobicContact CB-CD1 4.12Å; Q570-I584 HydrophobicContact CB-CG1 4.38Å; Q570-I584 PolarHBondContact N-O 3.25Å; Q570-I584 PolarHBondContact O-N 3.21Å; F572-I584 HydrophobicContact CE2-CD1 3.93Å; F572-I584 HydrophobicContact CE2-CG1 3.95Å; F572-I584 HydrophobicContact CZ-CD1 4.18Å; I584-I593 HydrophobicContact CG2-CG2 3.6Å; I584-F595 HydrophobicContact CG1-CB 4.29Å; I584-F595 HydrophobicContact CG1-CD2 3.67Å; I584-F595 HydrophobicContact CG1-CE2 4.47Å; I584-F595 HydrophobicContact CG1-CG 4.36Å; I584-Y641 HydrophobicContact CD1-CD2 4.37Å; I584-Y641 HydrophobicContact CD1-CE2 4.26Å; I584-Y641 HydrophobicContact CG2-CD2 4.12Å; I584-Y641 HydrophobicContact CG2-CE2 4.1Å; I584-F644 HydrophobicContact CD1-CD1 4.21Å; I584-F644 HydrophobicContact CD1-CE1 3.96Å; I584-L669 HydrophobicContact CD1-CD1 3.92Å
585	V	95	Very high	88.7	Confident	3 Å²	3	47 Å²	47	2%	0.018	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.1	179.7	-63.7	0	0	0	0	110.7	L472 Q567 I583 I593 T594 Y596	L472-V585 HydrophobicContact CD1-CG2 4.3Å; Q567-V585 CarbonylContact O-C 3.42Å; Q567-V585 WeakPolarHBondContact O-CA 3.39Å; I583-V585 HydrophobicContact CD1-CG1 3.87Å; I583-V585 HydrophobicContact CG1-CG1 3.9Å; I583-V585 HydrophobicContact CG2-CG1 4.38Å; V585-I593 WeakPolarHBondContact O-CA 3.47Å; V585-T594 PolarHBondContact N-O 3.34Å; V585-T594 PolarHBondContact O-N 3.16Å; V585-Y596 HydrophobicContact CG2-CD2 3.92Å; V585-Y596 HydrophobicContact CG2-CE2 3.71Å
586	R	94.3	Very high	89.5	Confident	61 Å²	61	44 Å²	44	23%	0.23	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.1	169.6	178.2	-176.6	-75.6	170.8	-7	108.7	Y566 Q567 L569 Q592 I593 E638	Y566-R586 WeakPolarHBondContact CA-O 3.4Å; Q567-R586 HydrophobicContact CB-CB 4.4Å; Q567-R586 PolarHBondContact N-O 3.42Å; Q567-R586 PolarHBondContact O-N 3.02Å; L569-R586 HydrophobicContact CD1-CB 3.92Å; L569-R586 HydrophobicContact CD2-CB 4.48Å; L569-R586 HydrophobicContact CG-CB 4.14Å; R586-Q592 WeakPolarHBondContact CA-O 3.46Å; R586-I593 HydrophobicContact CB-CG1 4.3Å; R586-I593 HydrophobicContact CG-CG1 4.32Å; R586-E638 IonicContact CZ-OE1 3.25Å; R586-E638 IonicContact CZ-OE2 2.61Å; R586-E638 IonicContact NH2-OE1 3.87Å; R586-E638 PolarHBondContact NH2-OE1 2.79Å; R586-E638 IonicContact NH2-OE2 2.67Å; R586-E638 PolarHBondContact NH2-OE2 3.19Å
587	E	91.7	Very high	90.7	Very high	25 Å²	25	40.4 Å²	40.4	12%	0.117	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	125	174.9	178.8	175.4	-151.1	0	0	110.3	R468 Y566 K589 T590 G591 Q592	R468-E587 IonicContact NH1-OE2 2.72Å; Y566-E587 HydrophobicContact CD1-CB 3.98Å; Y566-E587 HydrophobicContact CD1-CG 4.38Å; Y566-E587 HydrophobicContact CE1-CB 3.84Å; Y566-E587 HydrophobicContact CE1-CG 3.95Å; E587-K589 VanDerWaalsContact C-N 3.3Å; E587-K589 PolarHBondContact O-N 3.31Å; E587-T590 WeakPolarHBondContact CB-OG1 3.34Å; E587-T590 VanDerWaalsContact CD-OG1 3.28Å; E587-T590 HydrophobicContact CG-CG2 4.44Å; E587-T590 WeakPolarHBondContact CG-OG1 3.37Å; E587-T590 VanDerWaalsContact OE2-CG2 3.27Å; E587-T590 WeakPolarHBondContact OE2-CG2 3.46Å; E587-T590 PolarHBondContact OE2-OG1 3.39Å; E587-G591 VanDerWaalsContact O-CA 3.32Å; E587-G591 WeakPolarHBondContact O-CA 3.37Å; E587-G591 PolarHBondContact O-N 3.04Å; E587-Q592 PolarHBondContact N-O 3.24Å; E587-Q592 VanDerWaalsContact N-O 3.07Å
588	S	86.4	Confident	91.6	Very high	78 Å²	78	32 Å²	32	55%	0.545	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.6	-171	-58.9	0	0	0	0	114.1	H565	H565-S588 WeakPolarHBondContact O-CB 3.32Å; H565-S588 PolarHBondContact O-N 3.43Å; H565-S588 PolarHBondContact O-OG 2.85Å
589	K	83.3	Confident	92.1	Very high	114 Å²	114	31 Å²	31	50%	0.496	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-41.1	-178.4	-67.8	-175.3	-179.1	176.2	0	112.9	L563 E587	L563-K589 PolarHBondContact O-NZ 3.38Å; E587-K589 VanDerWaalsContact C-N 3.3Å; E587-K589 PolarHBondContact O-N 3.31Å
590	T	83.6	Confident	92.2	Very high	88 Å²	88	28.2 Å²	28.2	54%	0.54	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-19.1	-175.9	60.7	0	0	0	0	112.9	E587 Q592	E587-T590 WeakPolarHBondContact CB-OG1 3.34Å; E587-T590 VanDerWaalsContact CD-OG1 3.28Å; E587-T590 HydrophobicContact CG-CG2 4.44Å; E587-T590 WeakPolarHBondContact CG-OG1 3.37Å; E587-T590 VanDerWaalsContact OE2-CG2 3.27Å; E587-T590 WeakPolarHBondContact OE2-CG2 3.46Å; E587-T590 PolarHBondContact OE2-OG1 3.39Å; T590-Q592 PolarHBondContact O-N 2.99Å; T590-Q592 WeakPolarHBondContact OG1-CB 3.45Å; T590-Q592 PolarHBondContact OG1-N 2.92Å
591	G	85.4	Confident	92	Very high	42 Å²	42	27.6 Å²	27.6	43%	0.433	16%	0.157	S	C	.	.			trans	69.8	4.1	-170.8	0	0	0	0	0	113.8	E587 I593	E587-G591 VanDerWaalsContact O-CA 3.32Å; E587-G591 WeakPolarHBondContact O-CA 3.37Å; E587-G591 PolarHBondContact O-N 3.04Å; G591-I593 PolarHBondContact O-N 3Å
592	Q	90.3	Very high	91.6	Very high	76 Å²	76	32.7 Å²	32.7	36%	0.355	19%	0.188	S	C	.	.			trans	-71.2	128.5	-175.5	-173.8	175.5	47	0	0	111	R586 E587 T590 V635	R586-Q592 WeakPolarHBondContact CA-O 3.46Å; E587-Q592 PolarHBondContact N-O 3.24Å; E587-Q592 VanDerWaalsContact N-O 3.07Å; T590-Q592 PolarHBondContact O-N 2.99Å; T590-Q592 WeakPolarHBondContact OG1-CB 3.45Å; T590-Q592 PolarHBondContact OG1-N 2.92Å; Q592-V635 HydrophobicContact CG-CG1 4.07Å
593	I	94.8	Very high	91.5	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.015	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	123.4	172.3	-57.6	178.6	0	0	0	109.1	L569 I584 V585 R586 G591 L636 E638 Y641	L569-I593 HydrophobicContact CD1-CD1 4.07Å; L569-I593 HydrophobicContact CD1-CG1 4.2Å; L569-I593 HydrophobicContact CD1-CG2 4.08Å; I584-I593 HydrophobicContact CG2-CG2 3.6Å; V585-I593 WeakPolarHBondContact O-CA 3.47Å; R586-I593 HydrophobicContact CB-CG1 4.3Å; R586-I593 HydrophobicContact CG-CG1 4.32Å; G591-I593 PolarHBondContact O-N 3Å; I593-L636 HydrophobicContact CB-CB 4.38Å; I593-L636 HydrophobicContact CG2-CB 4.06Å; I593-L636 HydrophobicContact CG2-CD1 4.3Å; I593-L636 PolarHBondContact O-N 2.91Å; I593-E638 WeakPolarHBondContact CD1-OE2 3.33Å; I593-Y641 HydrophobicContact CD1-CD1 3.96Å; I593-Y641 HydrophobicContact CD1-CG 3.92Å; I593-Y641 HydrophobicContact CG2-CD2 4.5Å
594	T	95.4	Very high	91.3	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.8	177.3	-51.3	0	0	0	0	110.3	V585 Y596 K633	V585-T594 PolarHBondContact N-O 3.34Å; V585-T594 PolarHBondContact O-N 3.16Å; T594-Y596 HydrophobicContact CG2-CD1 4.32Å; T594-Y596 HydrophobicContact CG2-CD2 4.17Å; T594-Y596 HydrophobicContact CG2-CE1 3.9Å; T594-Y596 HydrophobicContact CG2-CE2 3.74Å; T594-Y596 HydrophobicContact CG2-CG 4.45Å; T594-K633 HydrophobicContact CG2-CB 4.08Å; T594-K633 HydrophobicContact CG2-CD 4.46Å
595	F	96.2	Very high	91	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	120.2	166.8	175.2	-127.7	0	0	0	109.1	F572 I583 I584 L597 K633 K634 L636 L669 E670 L673	F572-F595 AromaticContact CD2-CE2 3.84Å; F572-F595 HydrophobicContact CD2-CE2 3.84Å; F572-F595 HydrophobicContact CE2-CD2 4.36Å; F572-F595 AromaticContact CE2-CE2 3.81Å; F572-F595 HydrophobicContact CE2-CE2 3.81Å; I583-F595 WeakPolarHBondContact O-CA 3.41Å; I583-F595 WeakPolarHBondContact O-CD2 3.35Å; I584-F595 HydrophobicContact CG1-CB 4.29Å; I584-F595 HydrophobicContact CG1-CD2 3.67Å; I584-F595 HydrophobicContact CG1-CE2 4.47Å; I584-F595 HydrophobicContact CG1-CG 4.36Å; F595-L597 HydrophobicContact CE1-CB 4.3Å; F595-L597 HydrophobicContact CZ-CB 4.24Å; F595-L597 HydrophobicContact CZ-CD1 3.94Å; F595-K633 CarbonylContact O-C 3.57Å; F595-K633 WeakPolarHBondContact O-CA 3.43Å; F595-K634 HydrophobicContact CB-CB 4.42Å; F595-K634 HydrophobicContact CD1-CB 4.34Å; F595-K634 PolarHBondContact N-O 3.08Å; F595-K634 PolarHBondContact O-N 3.17Å; F595-L636 HydrophobicContact CB-CD1 4.16Å; F595-L669 HydrophobicContact CD1-CB 4.28Å; F595-L669 HydrophobicContact CE1-CB 3.95Å; F595-L669 HydrophobicContact CZ-CB 4.34Å; F595-E670 HydrophobicContact CE1-CG 4.46Å; F595-E670 HydrophobicContact CZ-CG 4.41Å; F595-L673 HydrophobicContact CD1-CD2 4.17Å; F595-L673 HydrophobicContact CE1-CD2 4Å
596	Y	96.5	Very high	90.8	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	140.5	171.5	-66.5	-74.9	0	0	0	109.8	R468 A469 L472 G582 I583 V585 T594 K633 L676	R468-Y596 PolarHBondContact NE-OH 3.42Å; R468-Y596 PolarHBondContact NH2-OH 2.82Å; A469-Y596 HydrophobicContact CB-CD1 3.49Å; A469-Y596 VanDerWaalsContact CB-CD1 3.49Å; A469-Y596 HydrophobicContact CB-CE1 3.47Å; A469-Y596 VanDerWaalsContact CB-CE1 3.47Å; A469-Y596 HydrophobicContact CB-CG 4.4Å; L472-Y596 HydrophobicContact CB-CD2 4.42Å; L472-Y596 HydrophobicContact CB-CE2 4.42Å; L472-Y596 HydrophobicContact CD1-CE2 3.77Å; G582-Y596 CarbonylContact C-O 3.6Å; G582-Y596 WeakPolarHBondContact CA-O 3.36Å; I583-Y596 HydrophobicContact CG2-CD2 4.4Å; I583-Y596 PolarHBondContact N-O 3.11Å; I583-Y596 PolarHBondContact O-N 2.92Å; V585-Y596 HydrophobicContact CG2-CD2 3.92Å; V585-Y596 HydrophobicContact CG2-CE2 3.71Å; T594-Y596 HydrophobicContact CG2-CD1 4.32Å; T594-Y596 HydrophobicContact CG2-CD2 4.17Å; T594-Y596 HydrophobicContact CG2-CE1 3.9Å; T594-Y596 HydrophobicContact CG2-CE2 3.74Å; T594-Y596 HydrophobicContact CG2-CG 4.45Å; Y596-K633 HydrophobicContact CD1-CB 3.67Å; Y596-K633 HydrophobicContact CE1-CB 3.78Å; Y596-K633 HydrophobicContact CE1-CD 4.39Å; Y596-L676 HydrophobicContact CD1-CD1 4.39Å; Y596-L676 HydrophobicContact CE1-CD1 4.19Å
597	L	95.6	Very high	90.7	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	129.6	177.3	-171	74.1	0	0	0	109.2	R580 M581 F595 M604 I607 A632 E670 L673	R580-L597 HydrophobicContact CB-CD1 4.45Å; R580-L597 HydrophobicContact CG-CD1 4.34Å; M581-L597 WeakPolarHBondContact O-CA 3.36Å; M581-L597 WeakPolarHBondContact O-CD1 3.3Å; F595-L597 HydrophobicContact CE1-CB 4.3Å; F595-L597 HydrophobicContact CZ-CB 4.24Å; F595-L597 HydrophobicContact CZ-CD1 3.94Å; L597-M604 HydrophobicContact CB-CE 4.26Å; L597-M604 HydrophobicContact CD2-CE 3.85Å; L597-M604 HydrophobicContact CD2-SD 3.6Å; L597-M604 VanDerWaalsContact CD2-SD 3.6Å; L597-M604 HydrophobicContact CG-CE 4Å; L597-M604 HydrophobicContact CG-SD 3.9Å; L597-I607 HydrophobicContact CD2-CD1 4.31Å; L597-I607 HydrophobicContact CD2-CG2 3.81Å; L597-A632 PolarHBondContact N-O 2.82Å; L597-A632 PolarHBondContact O-N 3.36Å; L597-E670 HydrophobicContact CD2-CG 4.29Å; L597-L673 HydrophobicContact CB-CD2 3.53Å; L597-L673 HydrophobicContact CD2-CD2 3.8Å; L597-L673 HydrophobicContact CG-CD2 4.33Å
598	K	95.1	Very high	90.7	Very high	13 Å²	13	39.5 Å²	39.5	6%	0.057	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.4	170.7	72.3	179.6	-179.5	-174.6	0	110.7	C473 E527 R580 M581 V630 V631	C473-K598 VanDerWaalsContact O-CD 3.25Å; C473-K598 WeakPolarHBondContact O-CD 3.42Å; C473-K598 WeakPolarHBondContact O-CE 3.21Å; C473-K598 PolarHBondContact O-NZ 3.01Å; E527-K598 WeakPolarHBondContact OE1-CE 3.43Å; E527-K598 IonicContact OE1-NZ 3.7Å; E527-K598 PolarHBondContact OE1-NZ 3.32Å; R580-K598 CarbonylContact C-O 3.55Å; R580-K598 VanDerWaalsContact CA-O 3.27Å; R580-K598 WeakPolarHBondContact CA-O 3.49Å; R580-K598 WeakPolarHBondContact CB-O 3.45Å; M581-K598 HydrophobicContact CB-CG 4.13Å; M581-K598 PolarHBondContact N-O 3.2Å; M581-K598 PolarHBondContact O-N 3.18Å; M581-K598 WeakPolarHBondContact SD-CE 3.47Å; K598-V630 CarbonylContact C-O 3.54Å; K598-V630 VanDerWaalsContact CA-O 3.26Å; K598-V630 WeakPolarHBondContact CA-O 3.49Å; K598-V631 HydrophobicContact CB-CG2 4.15Å
599	G	92.8	Very high	91	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171	-178.7	-179.8	0	0	0	0	0	114.4	K579 V630	K579-G599 WeakPolarHBondContact O-CA 3.35Å; G599-V630 PolarHBondContact N-O 2.71Å; G599-V630 PolarHBondContact O-N 3.1Å
600	A	89.9	Confident	91.1	Very high	24 Å²	24	45.1 Å²	45.1	20%	0.198	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	145.3	175.7	0	0	0	0	0	111.6	K579 V602 V603 M604	K579-A600 HydrophobicContact CB-CB 4.2Å; K579-A600 PolarHBondContact O-N 2.86Å; A600-V602 PolarHBondContact O-N 3.08Å; A600-V603 PolarHBondContact O-N 3.32Å; A600-M604 WeakPolarHBondContact O-CB 3.41Å; A600-M604 VanDerWaalsContact O-CG 3.27Å; A600-M604 WeakPolarHBondContact O-CG 3.46Å; A600-M604 PolarHBondContact O-N 3.38Å
601	D	88.3	Confident	91.3	Very high	39 Å²	39	43.5 Å²	43.5	21%	0.209	25%	0.245	C	C	.	.	H	α-helix	trans	-56.7	-43.9	-178	64.3	-31.2	0	0	0	113.5	V603 M604 S605 S618 V630	D601-V603 VanDerWaalsContact C-N 3.3Å; D601-V603 PolarHBondContact O-N 2.81Å; D601-M604 PolarHBondContact O-N 3.35Å; D601-S605 VanDerWaalsContact O-CB 3.29Å; D601-S605 WeakPolarHBondContact O-CB 3.1Å; D601-S605 PolarHBondContact O-N 2.93Å; D601-S618 WeakPolarHBondContact OD2-CB 3.4Å; D601-S618 PolarHBondContact OD2-OG 2.59Å; D601-V630 HydrophobicContact CB-CG2 3.86Å
602	V	85.6	Confident	91.3	Very high	110 Å²	110	47 Å²	47	67%	0.667	25%	0.254	S	S	*	.	H	α-helix	trans	-58.8	-41.1	178.8	-174.7	0	0	0	0	111.9	A600 S605	A600-V602 PolarHBondContact O-N 3.08Å; V602-S605 PolarHBondContact O-OG 3.39Å
603	V	89.9	Confident	91.3	Very high	34 Å²	34	45.6 Å²	45.6	21%	0.206	25%	0.245	C	C	.	.	H	α-helix	trans	-79.4	-42.9	-178.7	178.1	0	0	0	0	110.9	K579 A600 D601 S605 S606 I607	K579-V603 HydrophobicContact CB-CG2 4.2Å; A600-V603 PolarHBondContact O-N 3.32Å; D601-V603 VanDerWaalsContact C-N 3.3Å; D601-V603 PolarHBondContact O-N 2.81Å; V603-S605 VanDerWaalsContact C-N 3.29Å; V603-S605 PolarHBondContact O-N 2.85Å; V603-S606 PolarHBondContact O-N 3.04Å; V603-S606 PolarHBondContact O-OG 3.28Å; V603-S606 VanDerWaalsContact O-OG 3.1Å; V603-I607 HydrophobicContact CG1-CD1 3.93Å
604	M	92.3	Very high	91.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69.1	-29.4	-177.1	-69	-66.8	-68.9	0	0	111.9	L597 A600 D601 S606 I607 V608 V630 A632	L597-M604 HydrophobicContact CB-CE 4.26Å; L597-M604 HydrophobicContact CD2-CE 3.85Å; L597-M604 HydrophobicContact CD2-SD 3.6Å; L597-M604 VanDerWaalsContact CD2-SD 3.6Å; L597-M604 HydrophobicContact CG-CE 4Å; L597-M604 HydrophobicContact CG-SD 3.9Å; A600-M604 WeakPolarHBondContact O-CB 3.41Å; A600-M604 VanDerWaalsContact O-CG 3.27Å; A600-M604 WeakPolarHBondContact O-CG 3.46Å; A600-M604 PolarHBondContact O-N 3.38Å; D601-M604 PolarHBondContact O-N 3.35Å; M604-S606 PolarHBondContact O-N 2.61Å; M604-I607 PolarHBondContact O-N 3.42Å; M604-I607 HydrophobicContact SD-CD1 4.34Å; M604-V608 HydrophobicContact CE-CG1 4.08Å; M604-V608 WeakPolarHBondContact O-CG1 3.43Å; M604-V608 WeakPolarHBondContact O-CG2 3.46Å; M604-V608 PolarHBondContact O-N 2.96Å; M604-V630 HydrophobicContact CB-CB 3.64Å; M604-V630 HydrophobicContact CB-CG1 3.83Å; M604-V630 HydrophobicContact CB-CG2 4.14Å; M604-V630 HydrophobicContact CE-CG1 4.36Å; M604-V630 HydrophobicContact CG-CB 3.9Å; M604-V630 HydrophobicContact CG-CG1 4.39Å; M604-A632 HydrophobicContact CE-CB 3.78Å
605	S	89.4	Confident	90.7	Very high	71 Å²	71	49.9 Å²	49.9	50%	0.497	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-31.1	178.9	69.8	0	0	0	0	114.5	D601 V602 V603	D601-S605 VanDerWaalsContact O-CB 3.29Å; D601-S605 WeakPolarHBondContact O-CB 3.1Å; D601-S605 PolarHBondContact O-N 2.93Å; V602-S605 PolarHBondContact O-OG 3.39Å; V603-S605 VanDerWaalsContact C-N 3.29Å; V603-S605 PolarHBondContact O-N 2.85Å
606	S	89.8	Confident	90.3	Very high	101 Å²	101	56 Å²	56	71%	0.706	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-10.9	176.4	63.4	0	0	0	0	114.1	V603 M604	V603-S606 PolarHBondContact O-N 3.04Å; V603-S606 PolarHBondContact O-OG 3.28Å; V603-S606 VanDerWaalsContact O-OG 3.1Å; M604-S606 PolarHBondContact O-N 2.61Å
607	I	92.2	Very high	90	Very high	14 Å²	14	57.7 Å²	57.7	7%	0.072	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-39.3	-175.6	-68.1	172.5	0	0	0	110.8	L597 V603 M604 E670 E672 L673	L597-I607 HydrophobicContact CD2-CD1 4.31Å; L597-I607 HydrophobicContact CD2-CG2 3.81Å; V603-I607 HydrophobicContact CG1-CD1 3.93Å; M604-I607 PolarHBondContact O-N 3.42Å; M604-I607 HydrophobicContact SD-CD1 4.34Å; I607-E670 HydrophobicContact CG2-CB 4.21Å; I607-E670 WeakPolarHBondContact CG2-O 3.13Å; I607-E672 PolarHBondContact O-N 3.11Å; I607-E672 VanDerWaalsContact O-N 3.14Å; I607-L673 HydrophobicContact CG2-CD1 3.74Å; I607-L673 HydrophobicContact CG2-CG 4.46Å; I607-L673 PolarHBondContact O-N 3.19Å
608	V	92.9	Very high	89.6	Confident	13 Å²	13	58 Å²	58	8%	0.079	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-76.7	157.5	179.2	-58	0	0	0	0	111.2	M604 L614 V630 A632 L673 L675	M604-V608 HydrophobicContact CE-CG1 4.08Å; M604-V608 WeakPolarHBondContact O-CG1 3.43Å; M604-V608 WeakPolarHBondContact O-CG2 3.46Å; M604-V608 PolarHBondContact O-N 2.96Å; V608-L614 HydrophobicContact CG2-CD2 3.9Å; V608-V630 HydrophobicContact CG1-CG1 4.46Å; V608-A632 HydrophobicContact CG1-CB 3.66Å; V608-L673 WeakPolarHBondContact CA-O 3.24Å; V608-L675 HydrophobicContact CB-CB 4.37Å; V608-L675 HydrophobicContact CG1-CD1 4.49Å
609	Q	90.9	Very high	89.1	Confident	103 Å²	103	58.9 Å²	58.9	48%	0.481	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-57.2	149.1	170.2	-67.3	172.6	9.2	0	0	110.6	N611 E672 L673	Q609-N611 PolarHBondContact O-N 3.25Å; Q609-N611 PolarHBondContact O-ND2 3.39Å; Q609-E672 HydrophobicContact CG-CB 4.33Å; Q609-E672 PolarHBondContact NE2-O 3.11Å; Q609-L673 WeakPolarHBondContact CG-O 3.45Å; Q609-L673 PolarHBondContact N-O 2.89Å
610	Y	86.8	Confident	88.8	Confident	206 Å²	206	60.3 Å²	60.3	81%	0.808	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-54.8	131.2	179.9	178.3	-102	0	0	0	111.1	D612	Y610-D612 WeakPolarHBondContact CE1-OD1 3.11Å; Y610-D612 VanDerWaalsContact CZ-OD1 3.26Å; Y610-D612 PolarHBondContact OH-OD1 2.87Å; Y610-D612 VanDerWaalsContact OH-OD1 3.12Å
611	N	86.9	Confident	88.7	Confident	54 Å²	54	59.2 Å²	59.2	29%	0.289	32%	0.324	S	S	.	.			trans	-142.9	137.7	179.1	-76.9	-74.6	0	0	0	109.1	Q609 L614 L675	Q609-N611 PolarHBondContact O-N 3.25Å; Q609-N611 PolarHBondContact O-ND2 3.39Å; N611-L614 HydrophobicContact CB-CB 4.48Å; N611-L675 HydrophobicContact CB-CD2 4.09Å; N611-L675 WeakPolarHBondContact ND2-CB 3.36Å; N611-L675 WeakPolarHBondContact ND2-CD2 3.2Å
612	D	85.9	Confident	88.4	Confident	117 Å²	117	58.5 Å²	58.5	63%	0.626	32%	0.324	S	S	*	.	S	Bend	trans	-77.3	-27.2	-175	-60	-27.7	0	0	0	113.2	Y610	Y610-D612 WeakPolarHBondContact CE1-OD1 3.11Å; Y610-D612 VanDerWaalsContact CZ-OD1 3.26Å; Y610-D612 PolarHBondContact OH-OD1 2.87Å; Y610-D612 VanDerWaalsContact OH-OD1 3.12Å
613	W	90.4	Very high	88.1	Confident	45 Å²	45	61.6 Å²	61.6	17%	0.17	32%	0.323	C	S	.	.	S	Bend	trans	-96.1	-20.9	-168	64.1	-90.8	0	0	0	114.4	H403 G405 S615 E616 E617 L675 L678	H403-W613 HydrophobicContact CB-CZ3 4.15Å; H403-W613 AromaticContact CE1-CE3 3.57Å; H403-W613 AromaticContact CE1-CZ3 3.82Å; H403-W613 AromaticContact CG-CZ3 3.78Å; H403-W613 AromaticContact ND1-CE3 3.32Å; H403-W613 VanDerWaalsContact ND1-CE3 3.32Å; H403-W613 AromaticContact ND1-CH2 3.59Å; H403-W613 AromaticContact ND1-CZ3 3.07Å; H403-W613 WeakPolarHBondContact ND1-CZ3 3.25Å; G405-W613 VanDerWaalsContact CA-CZ2 3.42Å; W613-S615 PolarHBondContact O-N 3.45Å; W613-E616 PolarHBondContact O-N 3.11Å; W613-E617 HydrophobicContact CE3-CB 4Å; W613-E617 HydrophobicContact CE3-CG 4.02Å; W613-E617 HydrophobicContact CZ3-CB 4.42Å; W613-E617 WeakPolarHBondContact O-CB 3.4Å; W613-E617 PolarHBondContact O-N 3.24Å; W613-L675 HydrophobicContact CH2-CD2 3.94Å; W613-L675 HydrophobicContact CH2-CG 4.49Å; W613-L675 HydrophobicContact CZ2-CD2 3.37Å; W613-L675 HydrophobicContact CZ2-CG 4.05Å; W613-L678 HydrophobicContact CH2-CB 4.15Å; W613-L678 HydrophobicContact CZ3-CB 3.94Å; W613-L678 HydrophobicContact CZ3-CD2 4.33Å
614	L	90.3	Very high	87.7	Confident	9 Å²	9	64.7 Å²	64.7	5%	0.047	34%	0.335	C	S	.	.	H	α-helix	trans	-61	-45.2	-168	176.6	62.4	0	0	0	112.7	V608 N611 S618 V630 L675 L678	V608-L614 HydrophobicContact CG2-CD2 3.9Å; N611-L614 HydrophobicContact CB-CB 4.48Å; L614-S618 VanDerWaalsContact O-CB 3.28Å; L614-S618 WeakPolarHBondContact O-CB 3.45Å; L614-S618 PolarHBondContact O-N 3.4Å; L614-S618 PolarHBondContact O-OG 2.85Å; L614-V630 HydrophobicContact CD1-CG1 4.21Å; L614-V630 HydrophobicContact CD1-CG2 3.83Å; L614-V630 HydrophobicContact CD2-CG1 4.35Å; L614-L675 HydrophobicContact CB-CD2 4.24Å; L614-L675 HydrophobicContact CD1-CD1 4.48Å; L614-L675 HydrophobicContact CD1-CD2 4.25Å; L614-L675 HydrophobicContact CD2-CD2 4.24Å; L614-L675 HydrophobicContact CG-CD2 4.48Å; L614-L678 HydrophobicContact CD1-CB 4.4Å; L614-L678 HydrophobicContact CD1-CD1 4.24Å
615	S	87.1	Confident	87.2	Confident	89 Å²	89	64.9 Å²	64.9	62%	0.622	34%	0.337	S	S	*	.	H	α-helix	trans	-72.4	-35.1	-177.2	55	0	0	0	0	112.8	W613 S618 G619	W613-S615 PolarHBondContact O-N 3.45Å; S615-S618 PolarHBondContact O-OG 3.21Å; S615-G619 PolarHBondContact O-N 3.48Å
616	E	87.9	Confident	87.1	Confident	128 Å²	128	62 Å²	62	60%	0.598	32%	0.317	S	S	*	.	H	α-helix	trans	-70	-49	176.9	-174.9	171.7	-173.4	0	0	110.7	W613 G619 N620	W613-E616 PolarHBondContact O-N 3.11Å; E616-G619 CarbonylContact O-C 3.53Å; E616-G619 WeakPolarHBondContact O-CA 3.49Å; E616-G619 PolarHBondContact O-N 2.92Å; E616-N620 VanDerWaalsContact O-CG 3.31Å; E616-N620 PolarHBondContact O-N 3.08Å; E616-N620 PolarHBondContact O-OD1 2.66Å
617	E	89.7	Confident	87	Confident	39 Å²	39	59.2 Å²	59.2	18%	0.182	29%	0.29	C	S	.	.	H	α-helix	trans	-70.7	-35.6	-178.6	-72.6	-56.9	125.1	0	0	113	H403 W613 G619 N620 M621 L678	H403-E617 IonicContact CD2-OE2 4Å; W613-E617 HydrophobicContact CE3-CB 4Å; W613-E617 HydrophobicContact CE3-CG 4.02Å; W613-E617 HydrophobicContact CZ3-CB 4.42Å; W613-E617 WeakPolarHBondContact O-CB 3.4Å; W613-E617 PolarHBondContact O-N 3.24Å; E617-G619 VanDerWaalsContact C-N 3.27Å; E617-G619 PolarHBondContact O-N 3.22Å; E617-N620 WeakPolarHBondContact O-CB 3.3Å; E617-N620 PolarHBondContact O-N 3.02Å; E617-N620 PolarHBondContact OE1-ND2 2.89Å; E617-M621 WeakPolarHBondContact O-CG 3.49Å; E617-M621 PolarHBondContact O-N 3.42Å; E617-L678 HydrophobicContact CB-CD2 3.94Å
618	S	88.5	Confident	86.9	Confident	8 Å²	8	59.5 Å²	59.5	6%	0.056	29%	0.293	C	S	.	.	H	α-helix	trans	-62.5	-39.3	171.5	82.6	0	0	0	0	110.9	D601 L614 S615 N620 A622	D601-S618 WeakPolarHBondContact OD2-CB 3.4Å; D601-S618 PolarHBondContact OD2-OG 2.59Å; L614-S618 VanDerWaalsContact O-CB 3.28Å; L614-S618 WeakPolarHBondContact O-CB 3.45Å; L614-S618 PolarHBondContact O-N 3.4Å; L614-S618 PolarHBondContact O-OG 2.85Å; S615-S618 PolarHBondContact O-OG 3.21Å; S618-N620 PolarHBondContact O-N 3.44Å; S618-A622 VanDerWaalsContact O-CB 3.22Å; S618-A622 WeakPolarHBondContact O-CB 3.5Å; S618-A622 PolarHBondContact O-N 3.32Å
619	G	84.3	Confident	86.9	Confident	30 Å²	30	60.7 Å²	60.7	31%	0.309	30%	0.299	S	S	.	.	H	α-helix	trans	-62.1	-38.9	172	0	0	0	0	0	113.6	S615 E616 E617 R623	S615-G619 PolarHBondContact O-N 3.48Å; E616-G619 CarbonylContact O-C 3.53Å; E616-G619 WeakPolarHBondContact O-CA 3.49Å; E616-G619 PolarHBondContact O-N 2.92Å; E617-G619 VanDerWaalsContact C-N 3.27Å; E617-G619 PolarHBondContact O-N 3.22Å; G619-R623 VanDerWaalsContact O-CG 3.32Å; G619-R623 WeakPolarHBondContact O-CG 3.49Å; G619-R623 PolarHBondContact O-N 2.86Å
620	N	86.3	Confident	87.1	Confident	33 Å²	33	55.8 Å²	55.8	18%	0.176	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-52.5	176.2	-68.9	-17.8	0	0	0	111.3	E616 E617 S618 A622 R623 E624	E616-N620 VanDerWaalsContact O-CG 3.31Å; E616-N620 PolarHBondContact O-N 3.08Å; E616-N620 PolarHBondContact O-OD1 2.66Å; E617-N620 WeakPolarHBondContact O-CB 3.3Å; E617-N620 PolarHBondContact O-N 3.02Å; E617-N620 PolarHBondContact OE1-ND2 2.89Å; S618-N620 PolarHBondContact O-N 3.44Å; N620-A622 VanDerWaalsContact C-N 3.33Å; N620-A622 PolarHBondContact O-N 2.9Å; N620-R623 WeakPolarHBondContact O-CB 3.45Å; N620-R623 PolarHBondContact O-N 3.11Å; N620-R623 PolarHBondContact OD1-NH2 3.1Å; N620-E624 PolarHBondContact O-N 2.81Å; N620-E624 VanDerWaalsContact O-N 3.08Å
621	M	87.9	Confident	87.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-39.6	177.9	-67.4	-171.4	-170.3	0	0	112.3	K401 H403 E617 R623 E624 G625 L626 T628 L678	K401-M621 HydrophobicContact CB-CE 4.43Å; K401-M621 HydrophobicContact CD-CE 3.88Å; K401-M621 HydrophobicContact CD-CG 4.29Å; K401-M621 HydrophobicContact CD-SD 4.48Å; K401-M621 HydrophobicContact CG-CE 3.83Å; H403-M621 HydrophobicContact CB-CE 3.58Å; E617-M621 WeakPolarHBondContact O-CG 3.49Å; E617-M621 PolarHBondContact O-N 3.42Å; M621-R623 VanDerWaalsContact C-N 3.29Å; M621-R623 PolarHBondContact O-N 3Å; M621-E624 WeakPolarHBondContact O-CB 3.3Å; M621-E624 PolarHBondContact O-N 3.3Å; M621-G625 PolarHBondContact O-N 3.44Å; M621-G625 VanDerWaalsContact O-N 3.07Å; M621-L626 HydrophobicContact CB-CB 4.32Å; M621-L626 HydrophobicContact CB-CD1 4.33Å; M621-L626 HydrophobicContact CG-CD1 4.42Å; M621-L626 PolarHBondContact O-N 3.3Å; M621-T628 HydrophobicContact CB-CG2 3.47Å; M621-T628 VanDerWaalsContact CB-CG2 3.47Å; M621-T628 HydrophobicContact CG-CG2 4.4Å; M621-T628 HydrophobicContact SD-CG2 4.17Å; M621-L678 HydrophobicContact CE-CD2 3.77Å; M621-L678 HydrophobicContact CE-CG 4.05Å; M621-L678 HydrophobicContact SD-CD2 3.74Å; M621-L678 HydrophobicContact SD-CG 3.86Å
622	A	81.8	Confident	88	Confident	25 Å²	25	43.5 Å²	43.5	21%	0.207	22%	0.224	C	C	.	.	H	α-helix	trans	-68.4	-25.3	175.8	0	0	0	0	0	113.2	S618 N620 G625	S618-A622 VanDerWaalsContact O-CB 3.22Å; S618-A622 WeakPolarHBondContact O-CB 3.5Å; S618-A622 PolarHBondContact O-N 3.32Å; N620-A622 VanDerWaalsContact C-N 3.33Å; N620-A622 PolarHBondContact O-N 2.9Å; A622-G625 PolarHBondContact O-N 3.31Å
623	R	79.9	Confident	88.4	Confident	174 Å²	174	38.3 Å²	38.3	66%	0.657	20%	0.196	S	C	*	.	H	α-helix	trans	-75.3	-31.9	171.2	-79.1	-173.1	-72.9	173.4	-9.2	112.3	G619 N620 M621 G625	G619-R623 VanDerWaalsContact O-CG 3.32Å; G619-R623 WeakPolarHBondContact O-CG 3.49Å; G619-R623 PolarHBondContact O-N 2.86Å; N620-R623 WeakPolarHBondContact O-CB 3.45Å; N620-R623 PolarHBondContact O-N 3.11Å; N620-R623 PolarHBondContact OD1-NH2 3.1Å; M621-R623 VanDerWaalsContact C-N 3.29Å; M621-R623 PolarHBondContact O-N 3Å; R623-G625 PolarHBondContact O-N 3.5Å
624	E	80.8	Confident	88.7	Confident	99 Å²	99	38.9 Å²	38.9	46%	0.463	20%	0.2	S	C	.	.	H	α-helix	trans	-71.1	-16.9	169.9	-66.9	173.4	-166.3	0	0	112.1	K401 N620 M621 L626	K401-E624 IonicContact NZ-OE1 3.8Å; K401-E624 IonicContact NZ-OE2 2.85Å; N620-E624 PolarHBondContact O-N 2.81Å; N620-E624 VanDerWaalsContact O-N 3.08Å; M621-E624 WeakPolarHBondContact O-CB 3.3Å; M621-E624 PolarHBondContact O-N 3.3Å; E624-L626 HydrophobicContact CB-CG 4.3Å
625	G	81.1	Confident	88.8	Confident	4 Å²	4	41.7 Å²	41.7	4%	0.041	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	18.7	177.9	0	0	0	0	0	113.6	M621 A622 R623	M621-G625 PolarHBondContact O-N 3.44Å; M621-G625 VanDerWaalsContact O-N 3.07Å; A622-G625 PolarHBondContact O-N 3.31Å; R623-G625 PolarHBondContact O-N 3.5Å
626	L	87.4	Confident	89.1	Confident	11 Å²	11	38 Å²	38	6%	0.058	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-81.2	143.5	173.4	-55.1	178.6	0	0	0	110.2	K400 K401 M621 E624 E682	K400-L626 HydrophobicContact CB-CD1 4.44Å; K400-L626 HydrophobicContact CB-CD2 3.92Å; K400-L626 HydrophobicContact CG-CD2 4.14Å; K401-L626 HydrophobicContact CB-CD1 4.02Å; K401-L626 HydrophobicContact CD-CD1 4.38Å; M621-L626 HydrophobicContact CB-CB 4.32Å; M621-L626 HydrophobicContact CB-CD1 4.33Å; M621-L626 HydrophobicContact CG-CD1 4.42Å; M621-L626 PolarHBondContact O-N 3.3Å; E624-L626 HydrophobicContact CB-CG 4.3Å; L626-E682 HydrophobicContact CD2-CB 3.74Å; L626-E682 HydrophobicContact CD2-CG 4.31Å
627	R	87.9	Confident	89.4	Confident	42 Å²	42	35.5 Å²	35.5	16%	0.158	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119.5	167.2	-61.8	-175.2	-173.4	-178.9	6.3	108.7	M397 D526 G680 V681 D683	M397-R627 VanDerWaalsContact CE-NH2 3.31Å; D526-R627 IonicContact OD1-NH1 3.89Å; D526-R627 PolarHBondContact OD1-NH1 2.89Å; D526-R627 IonicContact OD2-CZ 3.78Å; D526-R627 IonicContact OD2-NH1 3.94Å; D526-R627 PolarHBondContact OD2-NH1 2.96Å; R627-G680 WeakPolarHBondContact O-CA 3.39Å; R627-V681 PolarHBondContact N-O 2.85Å; R627-V681 PolarHBondContact O-N 3.43Å; R627-D683 IonicContact NH2-OD2 3.07Å; R627-D683 PolarHBondContact NH2-OD2 3.04Å
628	T	90.3	Very high	89.4	Confident	20 Å²	20	38.6 Å²	38.6	12%	0.123	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129	-176.3	49.6	0	0	0	0	111.9	M621 L678 T679	M621-T628 HydrophobicContact CB-CG2 3.47Å; M621-T628 VanDerWaalsContact CB-CG2 3.47Å; M621-T628 HydrophobicContact CG-CG2 4.4Å; M621-T628 HydrophobicContact SD-CG2 4.17Å; T628-L678 HydrophobicContact CG2-CD1 4.37Å; T628-T679 CarbonylContact C-O 3.49Å; T628-T679 VanDerWaalsContact CA-O 3.25Å; T628-T679 WeakPolarHBondContact CA-O 3.48Å
629	L	92.9	Very high	89.6	Confident	39 Å²	39	46 Å²	46	20%	0.204	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.2	169.7	-67.4	171.1	0	0	0	110.2	L530 T679	L530-L629 HydrophobicContact CD1-CD1 4.26Å; L629-T679 WeakPolarHBondContact CB-OG1 3.46Å; L629-T679 PolarHBondContact N-O 2.89Å; L629-T679 PolarHBondContact O-N 3.49Å; L629-T679 PolarHBondContact O-OG1 3.02Å
630	V	95.1	Very high	90	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.6	177.4	-176.5	0	0	0	0	108.6	K598 G599 D601 M604 V608 L614 L675 L678	K598-V630 CarbonylContact C-O 3.54Å; K598-V630 VanDerWaalsContact CA-O 3.26Å; K598-V630 WeakPolarHBondContact CA-O 3.49Å; G599-V630 PolarHBondContact N-O 2.71Å; G599-V630 PolarHBondContact O-N 3.1Å; D601-V630 HydrophobicContact CB-CG2 3.86Å; M604-V630 HydrophobicContact CB-CB 3.64Å; M604-V630 HydrophobicContact CB-CG1 3.83Å; M604-V630 HydrophobicContact CB-CG2 4.14Å; M604-V630 HydrophobicContact CE-CG1 4.36Å; M604-V630 HydrophobicContact CG-CB 3.9Å; M604-V630 HydrophobicContact CG-CG1 4.39Å; V608-V630 HydrophobicContact CG1-CG1 4.46Å; L614-V630 HydrophobicContact CD1-CG1 4.21Å; L614-V630 HydrophobicContact CD1-CG2 3.83Å; L614-V630 HydrophobicContact CD2-CG1 4.35Å; V630-L675 HydrophobicContact CG1-CD1 3.34Å; V630-L678 HydrophobicContact CG2-CD1 3.79Å
631	V	96	Very high	90.3	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.8	178.7	-172.5	0	0	0	0	109.4	A469 L470 K598 L676 C677	A469-V631 HydrophobicContact CB-CG1 3.78Å; L470-V631 HydrophobicContact CD2-CG2 3.79Å; K598-V631 HydrophobicContact CB-CG2 4.15Å; V631-L676 WeakPolarHBondContact O-CB 3.4Å; V631-L676 PolarHBondContact O-N 3.35Å; V631-C677 PolarHBondContact N-O 3.09Å; V631-C677 PolarHBondContact O-N 2.91Å
632	A	96.1	Very high	90.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	160.1	-179	0	0	0	0	0	110.8	L597 M604 V608 L673 E674	L597-A632 PolarHBondContact N-O 2.82Å; L597-A632 PolarHBondContact O-N 3.36Å; M604-A632 HydrophobicContact CE-CB 3.78Å; V608-A632 HydrophobicContact CG1-CB 3.66Å; A632-L673 HydrophobicContact CB-CB 3.79Å; A632-L673 HydrophobicContact CB-CD2 4.01Å; A632-E674 CarbonylContact C-O 3.57Å; A632-E674 WeakPolarHBondContact CA-O 3.46Å; A632-E674 WeakPolarHBondContact CB-O 3.22Å
633	K	95.4	Very high	91.1	Very high	7 Å²	7	53.9 Å²	53.9	3%	0.03	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	163.7	176.8	72.3	172.5	-172.6	-165.9	0	112.6	E465 T594 F595 Y596 E674 L676	E465-K633 IonicContact OE1-NZ 2.79Å; E465-K633 PolarHBondContact OE1-NZ 2.83Å; E465-K633 IonicContact OE2-NZ 2.68Å; E465-K633 PolarHBondContact OE2-NZ 2.9Å; T594-K633 HydrophobicContact CG2-CB 4.08Å; T594-K633 HydrophobicContact CG2-CD 4.46Å; F595-K633 CarbonylContact O-C 3.57Å; F595-K633 WeakPolarHBondContact O-CA 3.43Å; Y596-K633 HydrophobicContact CD1-CB 3.67Å; Y596-K633 HydrophobicContact CE1-CB 3.78Å; Y596-K633 HydrophobicContact CE1-CD 4.39Å; K633-E674 WeakPolarHBondContact CE-OE2 3.37Å; K633-E674 HydrophobicContact CG-CB 4.37Å; K633-E674 PolarHBondContact N-O 2.83Å; K633-E674 IonicContact NZ-OE2 2.67Å; K633-E674 PolarHBondContact NZ-OE2 3.41Å; K633-E674 PolarHBondContact O-N 3.16Å; K633-L676 HydrophobicContact CB-CD1 3.93Å; K633-L676 HydrophobicContact CB-CG 4.36Å; K633-L676 HydrophobicContact CD-CD1 4Å; K633-L676 HydrophobicContact CD-CD2 3.81Å; K633-L676 HydrophobicContact CD-CG 4.25Å; K633-L676 HydrophobicContact CG-CD1 3.91Å; K633-L676 HydrophobicContact CG-CD2 3.92Å; K633-L676 HydrophobicContact CG-CG 3.96Å
634	K	95.1	Very high	91.7	Very high	57 Å²	57	45.7 Å²	45.7	25%	0.248	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	125.6	168.1	-172.6	169.6	-175.2	168.7	0	109.2	F595 L636 R671 L673	F595-K634 HydrophobicContact CB-CB 4.42Å; F595-K634 HydrophobicContact CD1-CB 4.34Å; F595-K634 PolarHBondContact N-O 3.08Å; F595-K634 PolarHBondContact O-N 3.17Å; K634-L636 HydrophobicContact CD-CD2 4.46Å; K634-L636 HydrophobicContact CG-CD2 4.27Å; K634-R671 PolarHBondContact NZ-O 3.47Å; K634-L673 HydrophobicContact CB-CG 4.19Å
635	V	93.6	Very high	92.3	Very high	69 Å²	69	44.8 Å²	44.8	42%	0.418	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	131.4	174.5	-178.5	0	0	0	0	108	Q592	Q592-V635 HydrophobicContact CG-CG1 4.07Å
636	L	93.1	Very high	92.9	Very high	12 Å²	12	49 Å²	49	6%	0.063	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.4	-179.3	-60.6	175.3	0	0	0	109.8	I593 F595 K634 L669	I593-L636 HydrophobicContact CB-CB 4.38Å; I593-L636 HydrophobicContact CG2-CB 4.06Å; I593-L636 HydrophobicContact CG2-CD1 4.3Å; I593-L636 PolarHBondContact O-N 2.91Å; F595-L636 HydrophobicContact CB-CD1 4.16Å; K634-L636 HydrophobicContact CD-CD2 4.46Å; K634-L636 HydrophobicContact CG-CD2 4.27Å; L636-L669 HydrophobicContact CD1-CD2 4.35Å; L636-L669 HydrophobicContact CD2-CD2 4.37Å
637	T	93.9	Very high	93.1	Very high	74 Å²	74	52.9 Å²	52.9	45%	0.454	27%	0.268	S	S	.	.			trans	-78.2	159.6	165.8	66.6	0	0	0	0	110.3	E639 Q640 Y641	T637-E639 PolarHBondContact O-N 2.91Å; T637-Q640 PolarHBondContact O-N 3.5Å; T637-Q640 VanDerWaalsContact O-N 3.14Å; T637-Q640 VanDerWaalsContact OG1-CG 3.26Å; T637-Q640 WeakPolarHBondContact OG1-CG 3.36Å; T637-Q640 PolarHBondContact OG1-N 3.08Å; T637-Y641 PolarHBondContact O-N 3.33Å
638	E	91.1	Very high	93.3	Very high	104 Å²	104	51.9 Å²	51.9	49%	0.486	26%	0.264	S	S	.	.	H	α-helix	trans	-57.5	-39.4	177.7	-166.8	65.2	-154.6	0	0	111.7	R586 I593 Y641 S642	R586-E638 IonicContact CZ-OE1 3.25Å; R586-E638 IonicContact CZ-OE2 2.61Å; R586-E638 IonicContact NH2-OE1 3.87Å; R586-E638 PolarHBondContact NH2-OE1 2.79Å; R586-E638 IonicContact NH2-OE2 2.67Å; R586-E638 PolarHBondContact NH2-OE2 3.19Å; I593-E638 WeakPolarHBondContact CD1-OE2 3.33Å; E638-Y641 PolarHBondContact O-N 2.92Å; E638-S642 WeakPolarHBondContact O-CB 3.42Å; E638-S642 PolarHBondContact O-N 3.35Å
639	E	92.3	Very high	93.3	Very high	165 Å²	165	53.8 Å²	53.8	77%	0.771	27%	0.274	S	S	*	.	H	α-helix	trans	-63.4	-44.1	175.4	-64.8	178.8	179.5	0	0	112.4	T637 Y641 S642 D643	T637-E639 PolarHBondContact O-N 2.91Å; E639-Y641 VanDerWaalsContact C-N 3.34Å; E639-Y641 PolarHBondContact O-N 3.16Å; E639-S642 PolarHBondContact O-N 3.44Å; E639-D643 PolarHBondContact O-N 3.48Å
640	Q	91.8	Very high	93.2	Very high	98 Å²	98	55 Å²	55	46%	0.458	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-40.1	177.9	-75.5	173.2	-23.5	0	0	111.9	T637 F644	T637-Q640 PolarHBondContact O-N 3.5Å; T637-Q640 VanDerWaalsContact O-N 3.14Å; T637-Q640 VanDerWaalsContact OG1-CG 3.26Å; T637-Q640 WeakPolarHBondContact OG1-CG 3.36Å; T637-Q640 PolarHBondContact OG1-N 3.08Å; Q640-F644 WeakPolarHBondContact O-CB 3.47Å; Q640-F644 PolarHBondContact O-N 2.9Å; Q640-F644 VanDerWaalsContact O-N 3.08Å
641	Y	93.1	Very high	92.9	Very high	12 Å²	12	55.3 Å²	55.3	5%	0.047	29%	0.292	C	S	.	.	H	α-helix	trans	-68.2	-44	176.8	175	-104.5	0	0	0	111.6	L569 I584 I593 T637 E638 E639 D643 F644 E645	L569-Y641 HydrophobicContact CB-CE2 3.99Å; L569-Y641 WeakPolarHBondContact CB-OH 3.31Å; L569-Y641 HydrophobicContact CD1-CD1 4.25Å; L569-Y641 HydrophobicContact CD1-CD2 4.28Å; L569-Y641 HydrophobicContact CD1-CE1 3.86Å; L569-Y641 HydrophobicContact CD1-CE2 3.89Å; L569-Y641 HydrophobicContact CD1-CG 4.46Å; I584-Y641 HydrophobicContact CD1-CD2 4.37Å; I584-Y641 HydrophobicContact CD1-CE2 4.26Å; I584-Y641 HydrophobicContact CG2-CD2 4.12Å; I584-Y641 HydrophobicContact CG2-CE2 4.1Å; I593-Y641 HydrophobicContact CD1-CD1 3.96Å; I593-Y641 HydrophobicContact CD1-CG 3.92Å; I593-Y641 HydrophobicContact CG2-CD2 4.5Å; T637-Y641 PolarHBondContact O-N 3.33Å; E638-Y641 PolarHBondContact O-N 2.92Å; E639-Y641 VanDerWaalsContact C-N 3.34Å; E639-Y641 PolarHBondContact O-N 3.16Å; Y641-D643 PolarHBondContact O-N 3.32Å; Y641-F644 WeakPolarHBondContact O-CB 3.2Å; Y641-F644 PolarHBondContact O-N 3.01Å; Y641-E645 WeakPolarHBondContact O-CB 3.39Å; Y641-E645 PolarHBondContact O-N 3.42Å
642	S	92.9	Very high	92.4	Very high	59 Å²	59	61.3 Å²	61.3	41%	0.413	32%	0.315	S	S	.	.	H	α-helix	trans	-62.4	-42	178.7	-175.7	0	0	0	0	112.6	E638 E639 E645 T646	E638-S642 WeakPolarHBondContact O-CB 3.42Å; E638-S642 PolarHBondContact O-N 3.35Å; E639-S642 PolarHBondContact O-N 3.44Å; S642-E645 PolarHBondContact O-N 2.97Å; S642-T646 WeakPolarHBondContact O-CB 3.19Å; S642-T646 PolarHBondContact O-N 3.42Å; S642-T646 PolarHBondContact O-OG1 3.36Å
643	D	93.2	Very high	92.1	Very high	83 Å²	83	68.3 Å²	68.3	44%	0.444	35%	0.351	S	S	.	.	H	α-helix	trans	-62.9	-45.5	173.7	174.7	65.7	0	0	0	111.6	E639 Y641 T646 R647	E639-D643 PolarHBondContact O-N 3.48Å; Y641-D643 PolarHBondContact O-N 3.32Å; D643-T646 PolarHBondContact O-N 3.17Å; D643-R647 WeakPolarHBondContact O-CG 3.42Å; D643-R647 PolarHBondContact O-N 2.97Å; D643-R647 IonicContact OD1-NE 3.58Å; D643-R647 IonicContact OD2-CZ 3.87Å; D643-R647 VanDerWaalsContact OD2-CZ 3.22Å; D643-R647 IonicContact OD2-NE 2.66Å; D643-R647 PolarHBondContact OD2-NE 3.37Å; D643-R647 IonicContact OD2-NH2 2.67Å; D643-R647 PolarHBondContact OD2-NH2 3.22Å
644	F	93.4	Very high	91.7	Very high	3 Å²	3	69 Å²	69	1%	0.013	36%	0.357	C	S	.	.	H	α-helix	trans	-59.1	-49.1	175.5	170.8	-95.4	0	0	0	111.9	F572 I584 Q640 Y641 T646 R647 Y648 V665 L669	F572-F644 HydrophobicContact CE1-CZ 4.05Å; F572-F644 AromaticContact CZ-CE1 3.98Å; F572-F644 HydrophobicContact CZ-CE1 3.98Å; F572-F644 AromaticContact CZ-CZ 3.58Å; F572-F644 HydrophobicContact CZ-CZ 3.58Å; I584-F644 HydrophobicContact CD1-CD1 4.21Å; I584-F644 HydrophobicContact CD1-CE1 3.96Å; Q640-F644 WeakPolarHBondContact O-CB 3.47Å; Q640-F644 PolarHBondContact O-N 2.9Å; Q640-F644 VanDerWaalsContact O-N 3.08Å; Y641-F644 WeakPolarHBondContact O-CB 3.2Å; Y641-F644 PolarHBondContact O-N 3.01Å; F644-T646 VanDerWaalsContact C-N 3.31Å; F644-T646 PolarHBondContact O-N 3.42Å; F644-R647 PolarHBondContact O-N 3.45Å; F644-Y648 HydrophobicContact CE1-CD2 4.45Å; F644-Y648 HydrophobicContact CE1-CG 4.16Å; F644-Y648 HydrophobicContact CE2-CD2 4.45Å; F644-Y648 AromaticContact CZ-CD2 3.8Å; F644-Y648 HydrophobicContact CZ-CD2 3.8Å; F644-Y648 HydrophobicContact CZ-CE2 4.48Å; F644-Y648 AromaticContact CZ-CG 3.94Å; F644-Y648 HydrophobicContact CZ-CG 3.94Å; F644-Y648 WeakPolarHBondContact O-CB 3.41Å; F644-Y648 PolarHBondContact O-N 3.44Å; F644-V665 HydrophobicContact CD2-CG1 3.97Å; F644-V665 HydrophobicContact CE2-CG1 3.61Å; F644-V665 HydrophobicContact CZ-CG1 4.4Å; F644-L669 HydrophobicContact CB-CD2 4.46Å; F644-L669 HydrophobicContact CD1-CD1 4.12Å; F644-L669 HydrophobicContact CD2-CD1 3.55Å; F644-L669 HydrophobicContact CD2-CD2 3.76Å; F644-L669 HydrophobicContact CD2-CG 3.52Å; F644-L669 HydrophobicContact CE1-CD1 3.85Å; F644-L669 HydrophobicContact CE2-CD1 3.22Å; F644-L669 HydrophobicContact CE2-CD2 4.27Å; F644-L669 HydrophobicContact CE2-CG 3.53Å; F644-L669 HydrophobicContact CG-CD1 4Å; F644-L669 HydrophobicContact CG-CD2 4.07Å; F644-L669 HydrophobicContact CG-CG 4.22Å; F644-L669 HydrophobicContact CZ-CD1 3.41Å; F644-L669 VanDerWaalsContact CZ-CD1 3.41Å; F644-L669 HydrophobicContact CZ-CG 4.24Å
645	E	92.6	Very high	91.3	Very high	80 Å²	80	74.5 Å²	74.5	37%	0.374	39%	0.387	S	S	.	.	H	α-helix	trans	-59.6	-42.9	-179.1	-179	174.5	-147.2	0	0	111.3	Y641 S642 Y648 N649	Y641-E645 WeakPolarHBondContact O-CB 3.39Å; Y641-E645 PolarHBondContact O-N 3.42Å; S642-E645 PolarHBondContact O-N 2.97Å; E645-Y648 PolarHBondContact O-N 3.44Å; E645-N649 WeakPolarHBondContact CG-ND2 3.23Å; E645-N649 VanDerWaalsContact O-CB 3.31Å; E645-N649 WeakPolarHBondContact O-CB 3.26Å; E645-N649 VanDerWaalsContact O-CG 3.3Å; E645-N649 PolarHBondContact O-N 2.95Å; E645-N649 PolarHBondContact O-ND2 3.11Å
646	T	92.8	Very high	90.9	Very high	92 Å²	92	75.6 Å²	75.6	56%	0.564	40%	0.395	S	S	*	.	H	α-helix	trans	-61.2	-48.9	176.8	-55.8	0	0	0	0	111.2	S642 D643 F644 Y648 A650	S642-T646 WeakPolarHBondContact O-CB 3.19Å; S642-T646 PolarHBondContact O-N 3.42Å; S642-T646 PolarHBondContact O-OG1 3.36Å; D643-T646 PolarHBondContact O-N 3.17Å; F644-T646 VanDerWaalsContact C-N 3.31Å; F644-T646 PolarHBondContact O-N 3.42Å; T646-Y648 PolarHBondContact O-N 3.44Å; T646-A650 WeakPolarHBondContact O-CB 3.47Å; T646-A650 PolarHBondContact O-N 3.13Å
647	R	92.6	Very high	90.5	Very high	92 Å²	92	81 Å²	81	35%	0.347	42%	0.423	S	S	.	.	H	α-helix	trans	-64.3	-39.3	177.3	-71.9	-172.6	-75.6	119.3	-3.5	112.3	D643 F644 A650 A651 V665 S668	D643-R647 WeakPolarHBondContact O-CG 3.42Å; D643-R647 PolarHBondContact O-N 2.97Å; D643-R647 IonicContact OD1-NE 3.58Å; D643-R647 IonicContact OD2-CZ 3.87Å; D643-R647 VanDerWaalsContact OD2-CZ 3.22Å; D643-R647 IonicContact OD2-NE 2.66Å; D643-R647 PolarHBondContact OD2-NE 3.37Å; D643-R647 IonicContact OD2-NH2 2.67Å; D643-R647 PolarHBondContact OD2-NH2 3.22Å; F644-R647 PolarHBondContact O-N 3.45Å; R647-A650 PolarHBondContact O-N 3.03Å; R647-A651 WeakPolarHBondContact O-CB 3.38Å; R647-A651 PolarHBondContact O-N 3.16Å; R647-V665 HydrophobicContact CB-CG1 4.13Å; R647-V665 HydrophobicContact CB-CG2 4.35Å; R647-S668 PolarHBondContact NH1-OG 3.47Å; R647-S668 VanDerWaalsContact NH1-OG 3.1Å
648	Y	91.4	Very high	90.1	Very high	21 Å²	21	84.7 Å²	84.7	8%	0.082	43%	0.429	C	S	.	.	H	α-helix	trans	-68.9	-43.2	-179	-174.8	-106.3	0	0	0	111.8	Q570 F572 F644 E645 T646 A651 R652 V662 V665	Q570-Y648 VanDerWaalsContact CD-CE1 3.42Å; Q570-Y648 HydrophobicContact CG-CE1 4.12Å; Q570-Y648 PolarHBondContact NE2-OH 2.86Å; Q570-Y648 VanDerWaalsContact NE2-OH 3.16Å; F572-Y648 AromaticContact CE1-CE2 3.84Å; F572-Y648 HydrophobicContact CE1-CE2 3.84Å; F644-Y648 HydrophobicContact CE1-CD2 4.45Å; F644-Y648 HydrophobicContact CE1-CG 4.16Å; F644-Y648 HydrophobicContact CE2-CD2 4.45Å; F644-Y648 AromaticContact CZ-CD2 3.8Å; F644-Y648 HydrophobicContact CZ-CD2 3.8Å; F644-Y648 HydrophobicContact CZ-CE2 4.48Å; F644-Y648 AromaticContact CZ-CG 3.94Å; F644-Y648 HydrophobicContact CZ-CG 3.94Å; F644-Y648 WeakPolarHBondContact O-CB 3.41Å; F644-Y648 PolarHBondContact O-N 3.44Å; E645-Y648 PolarHBondContact O-N 3.44Å; T646-Y648 PolarHBondContact O-N 3.44Å; Y648-A651 PolarHBondContact O-N 3.21Å; Y648-R652 HydrophobicContact CD1-CG 4.42Å; Y648-R652 HydrophobicContact CE1-CG 4.16Å; Y648-R652 WeakPolarHBondContact O-CG 3.49Å; Y648-R652 PolarHBondContact O-N 2.97Å; Y648-V662 HydrophobicContact CE2-CG1 3.81Å; Y648-V665 HydrophobicContact CD2-CG1 4.24Å
649	N	90.8	Very high	89.8	Confident	60 Å²	60	85.3 Å²	85.3	32%	0.321	44%	0.44	S	S	.	.	H	α-helix	trans	-65.4	-41	174.8	-73.9	-26.9	0	0	0	111.5	E645 A651 R652 L653	E645-N649 WeakPolarHBondContact CG-ND2 3.23Å; E645-N649 VanDerWaalsContact O-CB 3.31Å; E645-N649 WeakPolarHBondContact O-CB 3.26Å; E645-N649 VanDerWaalsContact O-CG 3.3Å; E645-N649 PolarHBondContact O-N 2.95Å; E645-N649 PolarHBondContact O-ND2 3.11Å; N649-A651 VanDerWaalsContact C-N 3.32Å; N649-A651 PolarHBondContact O-N 2.86Å; N649-R652 PolarHBondContact O-N 2.71Å; N649-L653 WeakPolarHBondContact O-CB 3.5Å; N649-L653 VanDerWaalsContact O-CG 3.29Å; N649-L653 WeakPolarHBondContact O-CG 3.43Å; N649-L653 PolarHBondContact O-N 3.11Å
650	A	90.3	Very high	89.5	Confident	65 Å²	65	80.5 Å²	80.5	54%	0.537	43%	0.428	S	S	.	.	H	α-helix	trans	-59.9	-40.9	172.8	0	0	0	0	0	112.3	T646 R647 S654	T646-A650 WeakPolarHBondContact O-CB 3.47Å; T646-A650 PolarHBondContact O-N 3.13Å; R647-A650 PolarHBondContact O-N 3.03Å; A650-S654 PolarHBondContact O-N 3.18Å
651	A	89.6	Confident	89.3	Confident	7 Å²	7	79.9 Å²	79.9	6%	0.058	42%	0.424	C	S	.	.	H	α-helix	trans	-66.8	-40.5	175.4	0	0	0	0	0	112.6	R647 Y648 N649 S654 K661 V662 V665	R647-A651 WeakPolarHBondContact O-CB 3.38Å; R647-A651 PolarHBondContact O-N 3.16Å; Y648-A651 PolarHBondContact O-N 3.21Å; N649-A651 VanDerWaalsContact C-N 3.32Å; N649-A651 PolarHBondContact O-N 2.86Å; A651-S654 VanDerWaalsContact O-CB 3.31Å; A651-S654 WeakPolarHBondContact O-CB 3.45Å; A651-S654 PolarHBondContact O-N 3.17Å; A651-K661 HydrophobicContact CB-CB 3.97Å; A651-V662 HydrophobicContact CB-CG2 3.95Å; A651-V665 HydrophobicContact CB-CG2 4.13Å
652	R	86.1	Confident	89	Confident	128 Å²	128	80.7 Å²	80.7	48%	0.483	43%	0.43	S	S	.	.	H	α-helix	trans	-67	-34.6	178	-77.7	180	68.8	-171.7	7.9	113.4	Y648 N649 S654 R658 V662	Y648-R652 HydrophobicContact CD1-CG 4.42Å; Y648-R652 HydrophobicContact CE1-CG 4.16Å; Y648-R652 WeakPolarHBondContact O-CG 3.49Å; Y648-R652 PolarHBondContact O-N 2.97Å; N649-R652 PolarHBondContact O-N 2.71Å; R652-S654 VanDerWaalsContact C-N 3.28Å; R652-R658 WeakPolarHBondContact O-CD 3.43Å; R652-V662 HydrophobicContact CG-CG2 4.03Å
653	L	88.6	Confident	88.7	Confident	147 Å²	147	80.6 Å²	80.6	77%	0.77	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.6	178.3	-66.8	170.4	0	0	0	113	N649 I655	N649-L653 WeakPolarHBondContact O-CB 3.5Å; N649-L653 VanDerWaalsContact O-CG 3.29Å; N649-L653 WeakPolarHBondContact O-CG 3.43Å; N649-L653 PolarHBondContact O-N 3.11Å; L653-I655 PolarHBondContact O-N 3.14Å
654	S	88.6	Confident	88.4	Confident	22 Å²	22	79.4 Å²	79.4	15%	0.154	43%	0.434	C	S	.	.			trans	-68.8	128.3	178.5	-174.5	0	0	0	0	111.9	A650 A651 R652 T656 R658 K661	A650-S654 PolarHBondContact O-N 3.18Å; A651-S654 VanDerWaalsContact O-CB 3.31Å; A651-S654 WeakPolarHBondContact O-CB 3.45Å; A651-S654 PolarHBondContact O-N 3.17Å; R652-S654 VanDerWaalsContact C-N 3.28Å; S654-T656 PolarHBondContact OG-O 2.9Å; S654-R658 WeakPolarHBondContact O-CB 3.18Å; S654-K661 WeakPolarHBondContact OG-CD 3.35Å; S654-K661 PolarHBondContact OG-NZ 2.78Å
655	I	85.1	Confident	88.3	Confident	171 Å²	171	80.2 Å²	80.2	88%	0.877	44%	0.439	S	S	*	.	S	Bend	trans	-77.8	-35	176.3	-57.4	167	0	0	0	111	L653	L653-I655 PolarHBondContact O-N 3.14Å
656	T	86.6	Confident	88.2	Confident	93 Å²	93	77.2 Å²	77.2	57%	0.571	43%	0.426	S	S	*	.	S	Bend	trans	-95.5	134.6	177.6	50.4	0	0	0	0	111.6	S654 R658 K661	S654-T656 PolarHBondContact OG-O 2.9Å; T656-R658 PolarHBondContact O-N 3.18Å; T656-R658 VanDerWaalsContact O-N 3.11Å; T656-K661 PolarHBondContact O-NZ 2.66Å
657	D	83.4	Confident	87.9	Confident	125 Å²	125	77.7 Å²	77.7	67%	0.668	42%	0.422	S	S	*	.	S	Bend	trans	47.4	38.9	176	-65.2	-22.9	0	0	0	115.1	V659 A660 K661	D657-V659 VanDerWaalsContact C-N 3.26Å; D657-V659 PolarHBondContact O-N 3.39Å; D657-A660 HydrophobicContact CB-CB 4.46Å; D657-A660 PolarHBondContact O-N 2.96Å; D657-K661 PolarHBondContact O-N 3.02Å
658	R	85.9	Confident	87.7	Confident	152 Å²	152	75.4 Å²	75.4	57%	0.574	42%	0.421	S	S	*	.	H	α-helix	trans	-49.9	-47.2	-178.9	-168.2	-175.5	78.4	-177.3	2.7	112.1	R652 S654 T656 K661 V662	R652-R658 WeakPolarHBondContact O-CD 3.43Å; S654-R658 WeakPolarHBondContact O-CB 3.18Å; T656-R658 PolarHBondContact O-N 3.18Å; T656-R658 VanDerWaalsContact O-N 3.11Å; R658-K661 PolarHBondContact O-N 2.98Å; R658-V662 HydrophobicContact CG-CG2 4.33Å; R658-V662 WeakPolarHBondContact O-CB 3.28Å; R658-V662 WeakPolarHBondContact O-CG2 3.43Å; R658-V662 PolarHBondContact O-N 3.5Å
659	V	84.1	Confident	87.6	Confident	117 Å²	117	75 Å²	75	71%	0.709	42%	0.419	S	S	*	.	H	α-helix	trans	-61.7	-47.9	-176	-178.6	0	0	0	0	111.2	D657 A663	D657-V659 VanDerWaalsContact C-N 3.26Å; D657-V659 PolarHBondContact O-N 3.39Å; V659-A663 WeakPolarHBondContact O-CB 3.39Å; V659-A663 PolarHBondContact O-N 2.78Å
660	A	86.3	Confident	87.6	Confident	63 Å²	63	72.9 Å²	72.9	52%	0.521	41%	0.408	S	S	.	.	H	α-helix	trans	-67.7	-42	-179.7	0	0	0	0	0	112.3	D657 A663 A664	D657-A660 HydrophobicContact CB-CB 4.46Å; D657-A660 PolarHBondContact O-N 2.96Å; A660-A663 PolarHBondContact O-N 2.84Å; A660-A664 PolarHBondContact O-N 3.42Å
661	K	88	Confident	87.5	Confident	86 Å²	86	77.2 Å²	77.2	37%	0.374	41%	0.41	S	S	.	.	H	α-helix	trans	-63.4	-43.6	177.5	-72	176.2	179.2	168.9	0	112	A651 S654 T656 D657 R658 A664 V665	A651-K661 HydrophobicContact CB-CB 3.97Å; S654-K661 WeakPolarHBondContact OG-CD 3.35Å; S654-K661 PolarHBondContact OG-NZ 2.78Å; T656-K661 PolarHBondContact O-NZ 2.66Å; D657-K661 PolarHBondContact O-N 3.02Å; R658-K661 PolarHBondContact O-N 2.98Å; K661-A664 PolarHBondContact O-N 3.04Å; K661-V665 WeakPolarHBondContact O-CG2 3.45Å; K661-V665 PolarHBondContact O-N 3.32Å; K661-V665 VanDerWaalsContact O-N 3.1Å
662	V	87	Confident	87.5	Confident	29 Å²	29	84 Å²	84	18%	0.176	44%	0.441	C	S	.	.	H	α-helix	trans	-64.1	-42.1	176.9	170.3	0	0	0	0	110.9	Y648 A651 R652 R658 V665 T666	Y648-V662 HydrophobicContact CE2-CG1 3.81Å; A651-V662 HydrophobicContact CB-CG2 3.95Å; R652-V662 HydrophobicContact CG-CG2 4.03Å; R658-V662 HydrophobicContact CG-CG2 4.33Å; R658-V662 WeakPolarHBondContact O-CB 3.28Å; R658-V662 WeakPolarHBondContact O-CG2 3.43Å; R658-V662 PolarHBondContact O-N 3.5Å; V662-V665 PolarHBondContact O-N 3Å; V662-T666 WeakPolarHBondContact O-CB 3.46Å; V662-T666 PolarHBondContact O-N 2.83Å; V662-T666 PolarHBondContact O-OG1 3.2Å
663	A	86.3	Confident	87.9	Confident	56 Å²	56	77.9 Å²	77.9	46%	0.463	42%	0.418	S	S	.	.	H	α-helix	trans	-60.4	-46.8	175.6	0	0	0	0	0	111.9	V659 A660 V665 T666 E667	V659-A663 WeakPolarHBondContact O-CB 3.39Å; V659-A663 PolarHBondContact O-N 2.78Å; A660-A663 PolarHBondContact O-N 2.84Å; A663-V665 PolarHBondContact O-N 2.86Å; A663-T666 PolarHBondContact O-N 2.9Å; A663-E667 WeakPolarHBondContact O-CB 3.28Å; A663-E667 PolarHBondContact O-N 3.32Å
664	A	88	Confident	88.1	Confident	58 Å²	58	73.5 Å²	73.5	48%	0.479	39%	0.393	S	S	.	.	H	α-helix	trans	-63.3	-40	-179.4	0	0	0	0	0	113	A660 K661 E667 S668	A660-A664 PolarHBondContact O-N 3.42Å; K661-A664 PolarHBondContact O-N 3.04Å; A664-E667 PolarHBondContact O-N 2.97Å; A664-S668 PolarHBondContact O-N 2.99Å
665	V	90.8	Very high	88.4	Confident	21 Å²	21	72.9 Å²	72.9	13%	0.127	39%	0.388	C	S	.	.	H	α-helix	trans	-66.9	-39.9	175.4	174.9	0	0	0	0	110.8	F644 R647 Y648 A651 K661 V662 A663 S668	F644-V665 HydrophobicContact CD2-CG1 3.97Å; F644-V665 HydrophobicContact CE2-CG1 3.61Å; F644-V665 HydrophobicContact CZ-CG1 4.4Å; R647-V665 HydrophobicContact CB-CG1 4.13Å; R647-V665 HydrophobicContact CB-CG2 4.35Å; Y648-V665 HydrophobicContact CD2-CG1 4.24Å; A651-V665 HydrophobicContact CB-CG2 4.13Å; K661-V665 WeakPolarHBondContact O-CG2 3.45Å; K661-V665 PolarHBondContact O-N 3.32Å; K661-V665 VanDerWaalsContact O-N 3.1Å; V662-V665 PolarHBondContact O-N 3Å; A663-V665 PolarHBondContact O-N 2.86Å; V665-S668 WeakPolarHBondContact O-CB 3.41Å; V665-S668 PolarHBondContact O-N 3.43Å; V665-S668 PolarHBondContact O-OG 2.65Å
666	T	89.2	Confident	88.8	Confident	16 Å²	16	65.2 Å²	65.2	10%	0.098	35%	0.349	C	S	.	.	H	α-helix	trans	-64.1	-43.7	177	-52.2	0	0	0	0	111.2	F572 V662 A663 S668 L669	F572-T666 HydrophobicContact CD1-CG2 3.75Å; F572-T666 HydrophobicContact CE1-CG2 3.92Å; F572-T666 HydrophobicContact CG-CG2 4.26Å; V662-T666 WeakPolarHBondContact O-CB 3.46Å; V662-T666 PolarHBondContact O-N 2.83Å; V662-T666 PolarHBondContact O-OG1 3.2Å; A663-T666 PolarHBondContact O-N 2.9Å; T666-S668 PolarHBondContact O-N 3.19Å; T666-S668 VanDerWaalsContact O-N 3.15Å; T666-L669 WeakPolarHBondContact O-CB 3.25Å; T666-L669 PolarHBondContact O-N 3.11Å
667	E	88	Confident	89.2	Confident	102 Å²	102	60.8 Å²	60.8	48%	0.477	32%	0.322	S	S	.	.	H	α-helix	trans	-60.4	-26	177.3	-164.7	-175.3	164.4	0	0	112.6	A663 A664 L669 E670	A663-E667 WeakPolarHBondContact O-CB 3.28Å; A663-E667 PolarHBondContact O-N 3.32Å; A664-E667 PolarHBondContact O-N 2.97Å; E667-L669 PolarHBondContact O-N 3.03Å; E667-E670 PolarHBondContact O-N 3.07Å; E667-E670 VanDerWaalsContact O-N 3.12Å
668	S	88.8	Confident	89.7	Confident	45 Å²	45	54.8 Å²	54.8	32%	0.315	29%	0.29	S	S	.	.	H	α-helix	trans	-65.2	-25.1	174.7	78.8	0	0	0	0	113.6	R647 A664 V665 T666	R647-S668 PolarHBondContact NH1-OG 3.47Å; R647-S668 VanDerWaalsContact NH1-OG 3.1Å; A664-S668 PolarHBondContact O-N 2.99Å; V665-S668 WeakPolarHBondContact O-CB 3.41Å; V665-S668 PolarHBondContact O-N 3.43Å; V665-S668 PolarHBondContact O-OG 2.65Å; T666-S668 PolarHBondContact O-N 3.19Å; T666-S668 VanDerWaalsContact O-N 3.15Å
669	L	89.1	Confident	90.1	Very high	11 Å²	11	47.6 Å²	47.6	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-80.7	-29.6	172.3	-67.7	178.4	0	0	0	112.2	F572 I584 F595 L636 F644 T666 E667 R671 L673	F572-L669 HydrophobicContact CE2-CD1 4.28Å; F572-L669 HydrophobicContact CZ-CD1 4.09Å; I584-L669 HydrophobicContact CD1-CD1 3.92Å; F595-L669 HydrophobicContact CD1-CB 4.28Å; F595-L669 HydrophobicContact CE1-CB 3.95Å; F595-L669 HydrophobicContact CZ-CB 4.34Å; L636-L669 HydrophobicContact CD1-CD2 4.35Å; L636-L669 HydrophobicContact CD2-CD2 4.37Å; F644-L669 HydrophobicContact CB-CD2 4.46Å; F644-L669 HydrophobicContact CD1-CD1 4.12Å; F644-L669 HydrophobicContact CD2-CD1 3.55Å; F644-L669 HydrophobicContact CD2-CD2 3.76Å; F644-L669 HydrophobicContact CD2-CG 3.52Å; F644-L669 HydrophobicContact CE1-CD1 3.85Å; F644-L669 HydrophobicContact CE2-CD1 3.22Å; F644-L669 HydrophobicContact CE2-CD2 4.27Å; F644-L669 HydrophobicContact CE2-CG 3.53Å; F644-L669 HydrophobicContact CG-CD1 4Å; F644-L669 HydrophobicContact CG-CD2 4.07Å; F644-L669 HydrophobicContact CG-CG 4.22Å; F644-L669 HydrophobicContact CZ-CD1 3.41Å; F644-L669 VanDerWaalsContact CZ-CD1 3.41Å; F644-L669 HydrophobicContact CZ-CG 4.24Å; T666-L669 WeakPolarHBondContact O-CB 3.25Å; T666-L669 PolarHBondContact O-N 3.11Å; E667-L669 PolarHBondContact O-N 3.03Å; L669-R671 PolarHBondContact O-N 3.44Å; L669-L673 WeakPolarHBondContact O-CD1 3.27Å
670	E	90.6	Very high	90.6	Very high	16 Å²	16	42 Å²	42	8%	0.075	23%	0.229	C	C	.	.	S	Bend	trans	-84.1	44.9	-172.2	-60.1	178.9	153.3	0	0	113	R580 F595 L597 I607 E667	R580-E670 IonicContact CZ-OE1 3.41Å; R580-E670 IonicContact CZ-OE2 2.71Å; R580-E670 VanDerWaalsContact CZ-OE2 3.25Å; R580-E670 IonicContact NE-OE1 3.97Å; R580-E670 PolarHBondContact NE-OE1 3.26Å; R580-E670 IonicContact NE-OE2 3.7Å; R580-E670 PolarHBondContact NE-OE2 3.26Å; R580-E670 IonicContact NH2-OE1 2.85Å; R580-E670 IonicContact NH2-OE2 3.88Å; R580-E670 PolarHBondContact NH2-OE2 2.88Å; F595-E670 HydrophobicContact CE1-CG 4.46Å; F595-E670 HydrophobicContact CZ-CG 4.41Å; L597-E670 HydrophobicContact CD2-CG 4.29Å; I607-E670 HydrophobicContact CG2-CB 4.21Å; I607-E670 WeakPolarHBondContact CG2-O 3.13Å; E667-E670 PolarHBondContact O-N 3.07Å; E667-E670 VanDerWaalsContact O-N 3.12Å
671	R	88.5	Confident	90.8	Very high	156 Å²	156	39 Å²	39	59%	0.589	20%	0.204	S	C	*	.	S	Bend	trans	-130.8	135.3	175.7	-63.7	-173.5	180	-172.8	-1.2	111.3	K634 L669 L673	K634-R671 PolarHBondContact NZ-O 3.47Å; L669-R671 PolarHBondContact O-N 3.44Å; R671-L673 PolarHBondContact O-N 3.47Å
672	E	88.7	Confident	90.9	Very high	150 Å²	150	36.5 Å²	36.5	70%	0.701	19%	0.193	S	C	*	.	S	Bend	trans	58.3	40.6	174.3	-57.2	-179.7	162.9	0	0	113.8	I607 Q609	I607-E672 PolarHBondContact O-N 3.11Å; I607-E672 VanDerWaalsContact O-N 3.14Å; Q609-E672 HydrophobicContact CG-CB 4.33Å; Q609-E672 PolarHBondContact NE2-O 3.11Å
673	L	93.7	Very high	91	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-69.5	143.3	177.5	-81.6	76	0	0	0	111.6	F595 L597 I607 V608 Q609 A632 K634 L669 R671 L675	F595-L673 HydrophobicContact CD1-CD2 4.17Å; F595-L673 HydrophobicContact CE1-CD2 4Å; L597-L673 HydrophobicContact CB-CD2 3.53Å; L597-L673 HydrophobicContact CD2-CD2 3.8Å; L597-L673 HydrophobicContact CG-CD2 4.33Å; I607-L673 HydrophobicContact CG2-CD1 3.74Å; I607-L673 HydrophobicContact CG2-CG 4.46Å; I607-L673 PolarHBondContact O-N 3.19Å; V608-L673 WeakPolarHBondContact CA-O 3.24Å; Q609-L673 WeakPolarHBondContact CG-O 3.45Å; Q609-L673 PolarHBondContact N-O 2.89Å; A632-L673 HydrophobicContact CB-CB 3.79Å; A632-L673 HydrophobicContact CB-CD2 4.01Å; K634-L673 HydrophobicContact CB-CG 4.19Å; L669-L673 WeakPolarHBondContact O-CD1 3.27Å; R671-L673 PolarHBondContact O-N 3.47Å; L673-L675 PolarHBondContact O-N 3.08Å
674	E	94	Very high	91.1	Very high	55 Å²	55	38 Å²	38	26%	0.257	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.2	172.8	-176.8	-178.8	-175	0	0	109.3	A632 K633 L676	A632-E674 CarbonylContact C-O 3.57Å; A632-E674 WeakPolarHBondContact CA-O 3.46Å; A632-E674 WeakPolarHBondContact CB-O 3.22Å; K633-E674 WeakPolarHBondContact CE-OE2 3.37Å; K633-E674 HydrophobicContact CG-CB 4.37Å; K633-E674 PolarHBondContact N-O 2.83Å; K633-E674 IonicContact NZ-OE2 2.67Å; K633-E674 PolarHBondContact NZ-OE2 3.41Å; K633-E674 PolarHBondContact O-N 3.16Å; E674-L676 PolarHBondContact O-N 3.34Å
675	L	94.6	Very high	91.3	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.042	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	121.6	175	176.8	62	0	0	0	110.1	V608 N611 W613 L614 V630 L673	V608-L675 HydrophobicContact CB-CB 4.37Å; V608-L675 HydrophobicContact CG1-CD1 4.49Å; N611-L675 HydrophobicContact CB-CD2 4.09Å; N611-L675 WeakPolarHBondContact ND2-CB 3.36Å; N611-L675 WeakPolarHBondContact ND2-CD2 3.2Å; W613-L675 HydrophobicContact CH2-CD2 3.94Å; W613-L675 HydrophobicContact CH2-CG 4.49Å; W613-L675 HydrophobicContact CZ2-CD2 3.37Å; W613-L675 HydrophobicContact CZ2-CG 4.05Å; L614-L675 HydrophobicContact CB-CD2 4.24Å; L614-L675 HydrophobicContact CD1-CD1 4.48Å; L614-L675 HydrophobicContact CD1-CD2 4.25Å; L614-L675 HydrophobicContact CD2-CD2 4.24Å; L614-L675 HydrophobicContact CG-CD2 4.48Å; V630-L675 HydrophobicContact CG1-CD1 3.34Å; L673-L675 PolarHBondContact O-N 3.08Å
676	L	93.6	Very high	91.3	Very high	10 Å²	10	36.2 Å²	36.2	5%	0.052	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-57.1	177.6	-67	-179.2	0	0	0	111.5	E465 A469 Y596 V631 K633 E674	E465-L676 HydrophobicContact CB-CD2 4.36Å; A469-L676 HydrophobicContact CB-CD1 3.56Å; Y596-L676 HydrophobicContact CD1-CD1 4.39Å; Y596-L676 HydrophobicContact CE1-CD1 4.19Å; V631-L676 WeakPolarHBondContact O-CB 3.4Å; V631-L676 PolarHBondContact O-N 3.35Å; K633-L676 HydrophobicContact CB-CD1 3.93Å; K633-L676 HydrophobicContact CB-CG 4.36Å; K633-L676 HydrophobicContact CD-CD1 4Å; K633-L676 HydrophobicContact CD-CD2 3.81Å; K633-L676 HydrophobicContact CD-CG 4.25Å; K633-L676 HydrophobicContact CG-CD1 3.91Å; K633-L676 HydrophobicContact CG-CD2 3.92Å; K633-L676 HydrophobicContact CG-CG 3.96Å; E674-L676 PolarHBondContact O-N 3.34Å
677	C	94.3	Very high	91.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	160.7	-176	70	0	0	0	0	112.8	I402 H403 L404 A466 V631	I402-C677 HydrophobicContact CD1-CB 4.04Å; I402-C677 HydrophobicContact CG1-CB 3.9Å; H403-C677 CarbonylContact O-C 3.06Å; H403-C677 VanDerWaalsContact O-CA 3.23Å; H403-C677 WeakPolarHBondContact O-CA 3.3Å; H403-C677 WeakPolarHBondContact O-CB 3.38Å; L404-C677 HydrophobicContact CD2-CB 3.64Å; A466-C677 HydrophobicContact CB-CB 4.01Å; V631-C677 PolarHBondContact N-O 3.09Å; V631-C677 PolarHBondContact O-N 2.91Å
678	L	95	Very high	91.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.9	165	173	71.8	0	0	0	107.4	I402 H403 W613 L614 E617 M621 T628 V630	I402-L678 CarbonylContact C-O 3.49Å; I402-L678 WeakPolarHBondContact CA-O 3.23Å; H403-L678 HydrophobicContact CB-CB 4.29Å; H403-L678 PolarHBondContact N-O 2.89Å; H403-L678 PolarHBondContact O-N 2.94Å; W613-L678 HydrophobicContact CH2-CB 4.15Å; W613-L678 HydrophobicContact CZ3-CB 3.94Å; W613-L678 HydrophobicContact CZ3-CD2 4.33Å; L614-L678 HydrophobicContact CD1-CB 4.4Å; L614-L678 HydrophobicContact CD1-CD1 4.24Å; E617-L678 HydrophobicContact CB-CD2 3.94Å; M621-L678 HydrophobicContact CE-CD2 3.77Å; M621-L678 HydrophobicContact CE-CG 4.05Å; M621-L678 HydrophobicContact SD-CD2 3.74Å; M621-L678 HydrophobicContact SD-CG 3.86Å; T628-L678 HydrophobicContact CG2-CD1 4.37Å; V630-L678 HydrophobicContact CG2-CD1 3.79Å
679	T	94.4	Very high	91.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	149.3	178.6	65.6	0	0	0	0	111.3	F399 K401 I402 L470 T628 L629	F399-T679 HydrophobicContact CE2-CG2 3.73Å; F399-T679 HydrophobicContact CZ-CG2 3.88Å; K401-T679 CarbonylContact O-C 3.56Å; K401-T679 WeakPolarHBondContact O-CA 3.32Å; I402-T679 HydrophobicContact CD1-CG2 4.44Å; I402-T679 HydrophobicContact CG1-CG2 4.28Å; L470-T679 HydrophobicContact CD1-CG2 4Å; L470-T679 HydrophobicContact CD2-CG2 4.04Å; T628-T679 CarbonylContact C-O 3.49Å; T628-T679 VanDerWaalsContact CA-O 3.25Å; T628-T679 WeakPolarHBondContact CA-O 3.48Å; L629-T679 WeakPolarHBondContact CB-OG1 3.46Å; L629-T679 PolarHBondContact N-O 2.89Å; L629-T679 PolarHBondContact O-N 3.49Å; L629-T679 PolarHBondContact O-OG1 3.02Å
680	G	92.8	Very high	92.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.2	176.1	0	0	0	0	0	110.8	K400 K401 R627	K400-G680 PolarHBondContact N-O 3.44Å; K401-G680 PolarHBondContact N-O 3.29Å; K401-G680 VanDerWaalsContact N-O 3.16Å; K401-G680 PolarHBondContact O-N 3.19Å; R627-G680 WeakPolarHBondContact O-CA 3.39Å
681	V	91.2	Very high	92.3	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.9	176	-178.1	0	0	0	0	109.3	M397 F399 A529 L530 R627	M397-V681 HydrophobicContact CB-CG1 4.03Å; F399-V681 HydrophobicContact CD2-CG2 4.21Å; A529-V681 HydrophobicContact CB-CG1 4.3Å; L530-V681 HydrophobicContact CD2-CG2 4.2Å; R627-V681 PolarHBondContact N-O 2.85Å; R627-V681 PolarHBondContact O-N 3.43Å
682	E	89.9	Confident	92.6	Very high	32 Å²	32	37.6 Å²	37.6	15%	0.15	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131	175.6	-172.2	179	-161	0	0	110.4	M397 V398 K400 L626 R684	M397-E682 WeakPolarHBondContact CA-O 3.44Å; V398-E682 PolarHBondContact N-O 2.91Å; V398-E682 PolarHBondContact O-N 3.45Å; K400-E682 WeakPolarHBondContact CE-OE2 3.4Å; K400-E682 HydrophobicContact CG-CB 3.54Å; K400-E682 IonicContact NZ-OE2 2.68Å; L626-E682 HydrophobicContact CD2-CB 3.74Å; L626-E682 HydrophobicContact CD2-CG 4.31Å; E682-R684 PolarHBondContact O-N 3.25Å
683	D	88.7	Confident	92.9	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.016	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	102.6	163.2	-179.4	-1.1	0	0	0	107.1	K388 T393 M397 R627 L685 I717	K388-D683 IonicContact NZ-OD2 3.56Å; K388-D683 PolarHBondContact NZ-OD2 3.36Å; T393-D683 WeakPolarHBondContact CB-OD1 3.4Å; T393-D683 PolarHBondContact OG1-OD1 2.97Å; M397-D683 HydrophobicContact CE-CB 3.94Å; M397-D683 HydrophobicContact SD-CB 3.58Å; M397-D683 VanDerWaalsContact SD-CB 3.58Å; R627-D683 IonicContact NH2-OD2 3.07Å; R627-D683 PolarHBondContact NH2-OD2 3.04Å; D683-L685 PolarHBondContact O-N 2.8Å; D683-I717 HydrophobicContact CB-CD1 3.91Å
684	R	89.1	Confident	92.9	Very high	114 Å²	114	34 Å²	34	43%	0.43	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	127.1	-165.5	-172.5	178.1	-178.6	175.6	2.3	111.2	T393 Q394 E396 E682	T393-R684 CarbonylContact C-O 3.44Å; T393-R684 VanDerWaalsContact CA-O 3.3Å; T393-R684 WeakPolarHBondContact CA-O 3.13Å; T393-R684 WeakPolarHBondContact CB-O 3.14Å; Q394-R684 PolarHBondContact N-O 2.98Å; Q394-R684 VanDerWaalsContact OE1-CD 3.28Å; E396-R684 HydrophobicContact CB-CB 4.39Å; E396-R684 WeakPolarHBondContact O-CB 3.42Å; E396-R684 PolarHBondContact O-N 2.86Å; E396-R684 VanDerWaalsContact OE2-CD 3.3Å; E396-R684 WeakPolarHBondContact OE2-CD 3.31Å; E396-R684 IonicContact OE2-CZ 3.71Å; E396-R684 IonicContact OE2-NH1 3.84Å; E396-R684 PolarHBondContact OE2-NH1 3.12Å; E682-R684 PolarHBondContact O-N 3.25Å
685	L	92	Very high	92.9	Very high	19 Å²	19	33.5 Å²	33.5	10%	0.099	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	152.6	173.9	-62.4	174.4	0	0	0	111.5	L392 T393 D683 V689 R690 I717 S720	L392-L685 CarbonylContact O-C 3.55Å; L392-L685 WeakPolarHBondContact O-CA 3.38Å; T393-L685 HydrophobicContact CG2-CD2 4.23Å; D683-L685 PolarHBondContact O-N 2.8Å; L685-V689 HydrophobicContact CB-CB 4.49Å; L685-R690 HydrophobicContact CD1-CG 4.15Å; L685-I717 HydrophobicContact CD2-CD1 4.41Å; L685-I717 HydrophobicContact CD2-CG2 4.18Å; L685-S720 WeakPolarHBondContact CD1-O 3.39Å
686	Q	91.6	Very high	92.9	Very high	23 Å²	23	33.1 Å²	33.1	11%	0.107	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-61.3	159.5	165.9	-65.1	-166.1	6.6	0	0	111.4	G390 T391 L392 Q394 N688 V689	G390-Q686 PolarHBondContact O-NE2 2.59Å; T391-Q686 PolarHBondContact O-NE2 2.85Å; T391-Q686 VanDerWaalsContact O-NE2 3.14Å; T391-Q686 PolarHBondContact O-OE1 3.37Å; L392-Q686 PolarHBondContact O-N 3.23Å; Q394-Q686 HydrophobicContact CG-CB 4.33Å; Q394-Q686 HydrophobicContact CG-CG 3.84Å; Q686-N688 PolarHBondContact O-N 3.02Å; Q686-V689 HydrophobicContact CB-CG2 3.65Å; Q686-V689 VanDerWaalsContact O-CG2 3.28Å; Q686-V689 WeakPolarHBondContact O-CG2 3.42Å; Q686-V689 PolarHBondContact O-N 3.46Å
687	E	90.4	Very high	92.8	Very high	109 Å²	109	38.3 Å²	38.3	51%	0.509	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	134.9	178.5	-65.5	-176.3	165.8	0	0	111.2	V689	E687-V689 PolarHBondContact O-N 3.18Å; E687-V689 VanDerWaalsContact O-N 3.09Å
688	N	93.1	Very high	92.8	Very high	101 Å²	101	42.4 Å²	42.4	54%	0.54	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	22.7	174.7	-58.6	-49.7	0	0	0	115.8	Q686 R690 P691 T692	Q686-N688 PolarHBondContact O-N 3.02Å; N688-R690 PolarHBondContact O-N 3.44Å; N688-P691 WeakPolarHBondContact O-CD 3.42Å; N688-T692 VanDerWaalsContact O-CB 3.27Å; N688-T692 WeakPolarHBondContact O-CB 3.43Å; N688-T692 PolarHBondContact O-N 2.96Å; N688-T692 VanDerWaalsContact O-N 3.15Å; N688-T692 PolarHBondContact O-OG1 2.83Å
689	V	94.8	Very high	92.7	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-46.5	174.7	168.3	0	0	0	0	111.8	L392 L685 Q686 E687 T692 L693 F851	L392-V689 HydrophobicContact CD2-CG1 3.75Å; L685-V689 HydrophobicContact CB-CB 4.49Å; Q686-V689 HydrophobicContact CB-CG2 3.65Å; Q686-V689 VanDerWaalsContact O-CG2 3.28Å; Q686-V689 WeakPolarHBondContact O-CG2 3.42Å; Q686-V689 PolarHBondContact O-N 3.46Å; E687-V689 PolarHBondContact O-N 3.18Å; E687-V689 VanDerWaalsContact O-N 3.09Å; V689-T692 WeakPolarHBondContact O-CB 3.2Å; V689-T692 PolarHBondContact O-N 3.23Å; V689-L693 HydrophobicContact CG1-CD1 3.84Å; V689-L693 HydrophobicContact CG1-CG 4.31Å; V689-L693 WeakPolarHBondContact O-CG 3.38Å; V689-L693 PolarHBondContact O-N 3.23Å; V689-F851 HydrophobicContact CG1-CD1 4.43Å; V689-F851 HydrophobicContact CG2-CB 4.41Å; V689-F851 HydrophobicContact CG2-CD1 4.01Å
690	R	93.2	Very high	92.6	Very high	95 Å²	95	44.3 Å²	44.3	36%	0.358	22%	0.218	S	C	.	.	H	α-helix	trans	-61.1	-53.6	-177.5	-48.9	174.5	176.9	158.7	3.3	112.3	L685 N688 T692 L693 E694 S720	L685-R690 HydrophobicContact CD1-CG 4.15Å; N688-R690 PolarHBondContact O-N 3.44Å; R690-T692 PolarHBondContact O-N 3.43Å; R690-L693 PolarHBondContact O-N 3.21Å; R690-E694 WeakPolarHBondContact O-CG 3.24Å; R690-E694 PolarHBondContact O-N 3.16Å; R690-E694 VanDerWaalsContact O-N 3.1Å; R690-S720 PolarHBondContact NE-O 3.2Å; R690-S720 PolarHBondContact NH2-O 3.36Å
691	P	94.7	Very high	92.6	Very high	61 Å²	61	44.6 Å²	44.6	40%	0.396	22%	0.219	S	C	.	.	H	α-helix	trans	-58.3	-36.7	175.3	-23.7	33.8	0	0	0	113.1	N688 E694 L695	N688-P691 WeakPolarHBondContact O-CD 3.42Å; P691-E694 PolarHBondContact O-N 2.85Å; P691-L695 WeakPolarHBondContact O-CB 3.38Å; P691-L695 VanDerWaalsContact O-CG 3.3Å; P691-L695 WeakPolarHBondContact O-CG 3.48Å; P691-L695 PolarHBondContact O-N 2.76Å
692	T	95.5	Very high	92.7	Very high	6 Å²	6	48.5 Å²	48.5	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-46	179.8	-59.9	0	0	0	0	111.4	N688 V689 R690 E694 L695 L696 F851 S852 I854 A855	N688-T692 VanDerWaalsContact O-CB 3.27Å; N688-T692 WeakPolarHBondContact O-CB 3.43Å; N688-T692 PolarHBondContact O-N 2.96Å; N688-T692 VanDerWaalsContact O-N 3.15Å; N688-T692 PolarHBondContact O-OG1 2.83Å; V689-T692 WeakPolarHBondContact O-CB 3.2Å; V689-T692 PolarHBondContact O-N 3.23Å; R690-T692 PolarHBondContact O-N 3.43Å; T692-E694 VanDerWaalsContact C-N 3.33Å; T692-E694 PolarHBondContact O-N 3.06Å; T692-L695 PolarHBondContact O-N 3.49Å; T692-L696 HydrophobicContact CG2-CD1 4.47Å; T692-L696 WeakPolarHBondContact O-CG 3.3Å; T692-L696 PolarHBondContact O-N 2.9Å; T692-F851 HydrophobicContact CG2-CD1 4.04Å; T692-F851 HydrophobicContact CG2-CE1 3.8Å; T692-S852 WeakPolarHBondContact OG1-CA 3.23Å; T692-I854 HydrophobicContact CG2-CG2 3.7Å; T692-A855 HydrophobicContact CG2-CB 3.85Å
693	L	95.1	Very high	93	Very high	6 Å²	6	47.4 Å²	47.4	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-64.1	-38.7	177.1	-70.6	175.4	0	0	0	112	V689 R690 L696 R697 V703 S721 L723 F851	V689-L693 HydrophobicContact CG1-CD1 3.84Å; V689-L693 HydrophobicContact CG1-CG 4.31Å; V689-L693 WeakPolarHBondContact O-CG 3.38Å; V689-L693 PolarHBondContact O-N 3.23Å; R690-L693 PolarHBondContact O-N 3.21Å; L693-L696 PolarHBondContact O-N 2.91Å; L693-R697 WeakPolarHBondContact O-CB 3.4Å; L693-R697 PolarHBondContact O-N 2.91Å; L693-V703 HydrophobicContact CD2-CB 4.35Å; L693-V703 HydrophobicContact CD2-CG1 3.82Å; L693-V703 HydrophobicContact CD2-CG2 4.14Å; L693-S721 WeakPolarHBondContact CD1-O 3.41Å; L693-L723 HydrophobicContact CD1-CB 4.31Å; L693-F851 HydrophobicContact CD2-CE1 3.96Å; L693-F851 HydrophobicContact CD2-CZ 3.89Å; L693-F851 HydrophobicContact CG-CE1 4.19Å
694	E	93.1	Very high	93.4	Very high	70 Å²	70	47.4 Å²	47.4	33%	0.327	23%	0.229	S	C	.	.	H	α-helix	trans	-63.7	-44.8	174.2	-69.7	-174.7	155.2	0	0	112.3	R690 P691 T692 L696 R697 N698	R690-E694 WeakPolarHBondContact O-CG 3.24Å; R690-E694 PolarHBondContact O-N 3.16Å; R690-E694 VanDerWaalsContact O-N 3.1Å; P691-E694 PolarHBondContact O-N 2.85Å; T692-E694 VanDerWaalsContact C-N 3.33Å; T692-E694 PolarHBondContact O-N 3.06Å; E694-L696 PolarHBondContact O-N 3.05Å; E694-R697 PolarHBondContact O-N 2.97Å; E694-N698 WeakPolarHBondContact O-CB 3.37Å; E694-N698 PolarHBondContact O-N 3Å; E694-N698 PolarHBondContact O-ND2 3.23Å
695	L	94.3	Very high	93.7	Very high	43 Å²	43	42 Å²	42	23%	0.225	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-45	175.7	-76	172.2	0	0	0	111.9	P691 T692 N698 A699 A855 V934 P937	P691-L695 WeakPolarHBondContact O-CB 3.38Å; P691-L695 VanDerWaalsContact O-CG 3.3Å; P691-L695 WeakPolarHBondContact O-CG 3.48Å; P691-L695 PolarHBondContact O-N 2.76Å; T692-L695 PolarHBondContact O-N 3.49Å; L695-N698 PolarHBondContact O-N 3.36Å; L695-A699 WeakPolarHBondContact O-CB 3.36Å; L695-A699 PolarHBondContact O-N 3.2Å; L695-A855 HydrophobicContact CD1-CB 4.37Å; L695-V934 HydrophobicContact CD1-CG1 4.32Å; L695-P937 HydrophobicContact CD2-CB 4.47Å; L695-P937 HydrophobicContact CD2-CG 4.16Å
696	L	94.6	Very high	93.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-43	177.3	-69	176.7	0	0	0	111.8	T692 L693 E694 N698 A699 G700 V701 V703 I854 L858	T692-L696 HydrophobicContact CG2-CD1 4.47Å; T692-L696 WeakPolarHBondContact O-CG 3.3Å; T692-L696 PolarHBondContact O-N 2.9Å; L693-L696 PolarHBondContact O-N 2.91Å; E694-L696 PolarHBondContact O-N 3.05Å; L696-N698 PolarHBondContact O-N 3.5Å; L696-A699 WeakPolarHBondContact O-CB 3.49Å; L696-A699 PolarHBondContact O-N 2.93Å; L696-G700 PolarHBondContact O-N 3.39Å; L696-V701 HydrophobicContact CB-CB 4.33Å; L696-V701 WeakPolarHBondContact O-CB 3.36Å; L696-V701 PolarHBondContact O-N 3.08Å; L696-V703 HydrophobicContact CB-CG2 4.22Å; L696-V703 HydrophobicContact CD1-CG2 4.22Å; L696-I854 HydrophobicContact CD1-CG2 4.12Å; L696-L858 HydrophobicContact CD2-CD1 3.9Å
697	R	92.3	Very high	93.8	Very high	120 Å²	120	40 Å²	40	45%	0.453	20%	0.199	S	C	.	.	H	α-helix	trans	-61.5	-45	176.5	-173.6	176.4	67.7	-165.1	-4.3	111.3	L693 E694 A699 G700	L693-R697 WeakPolarHBondContact O-CB 3.4Å; L693-R697 PolarHBondContact O-N 2.91Å; E694-R697 PolarHBondContact O-N 2.97Å; R697-A699 VanDerWaalsContact C-N 3.27Å; R697-A699 PolarHBondContact O-N 2.68Å; R697-G700 PolarHBondContact O-N 3.44Å
698	N	92.7	Very high	93.4	Very high	85 Å²	85	35.5 Å²	35.5	46%	0.455	18%	0.182	S	C	.	.	H	α-helix	trans	-66.6	-30	177.7	-65.7	-13.8	0	0	0	112	E694 L695 L696 G700 P937	E694-N698 WeakPolarHBondContact O-CB 3.37Å; E694-N698 PolarHBondContact O-N 3Å; E694-N698 PolarHBondContact O-ND2 3.23Å; L695-N698 PolarHBondContact O-N 3.36Å; L696-N698 PolarHBondContact O-N 3.5Å; N698-G700 PolarHBondContact O-N 2.93Å; N698-P937 HydrophobicContact CB-CB 4.39Å; N698-P937 HydrophobicContact CB-CG 3.64Å
699	A	93.2	Very high	92.8	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-7.6	171.2	0	0	0	0	0	114.1	L695 L696 R697 V701 L859 P937 Y940 K941	L695-A699 WeakPolarHBondContact O-CB 3.36Å; L695-A699 PolarHBondContact O-N 3.2Å; L696-A699 WeakPolarHBondContact O-CB 3.49Å; L696-A699 PolarHBondContact O-N 2.93Å; R697-A699 VanDerWaalsContact C-N 3.27Å; R697-A699 PolarHBondContact O-N 2.68Å; A699-V701 HydrophobicContact CB-CG2 4.27Å; A699-L859 HydrophobicContact CB-CD2 3.57Å; A699-P937 WeakPolarHBondContact CA-O 3.22Å; A699-P937 HydrophobicContact CB-CB 4.05Å; A699-Y940 HydrophobicContact CB-CD1 4.08Å; A699-Y940 HydrophobicContact CB-CG 4.34Å; A699-K941 PolarHBondContact O-N 3.43Å
700	G	91.6	Very high	92.1	Very high	40 Å²	40	34.6 Å²	34.6	41%	0.412	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	17	-175.9	0	0	0	0	0	113.7	L696 R697 N698	L696-G700 PolarHBondContact O-N 3.39Å; R697-G700 PolarHBondContact O-N 3.44Å; N698-G700 PolarHBondContact O-N 2.93Å
701	V	93.9	Very high	91.6	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.03	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-87.7	129.2	173.7	-177.9	0	0	0	0	108.9	V384 L696 A699 Y940	V384-V701 HydrophobicContact CB-CG1 4.11Å; V384-V701 HydrophobicContact CG2-CG1 3.5Å; L696-V701 HydrophobicContact CB-CB 4.33Å; L696-V701 WeakPolarHBondContact O-CB 3.36Å; L696-V701 PolarHBondContact O-N 3.08Å; A699-V701 HydrophobicContact CB-CG2 4.27Å; V701-Y940 HydrophobicContact CG2-CD1 4.12Å; V701-Y940 HydrophobicContact CG2-CE1 3.75Å
702	R	93.7	Very high	90.9	Very high	84 Å²	84	34 Å²	34	32%	0.317	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.4	176.8	-69.7	177.2	173.6	179.6	-15.4	109.6	S382 Y383 V384 T780	S382-R702 PolarHBondContact O-N 3.49Å; Y383-R702 CarbonylContact C-O 3.59Å; Y383-R702 VanDerWaalsContact CA-O 3.31Å; Y383-R702 WeakPolarHBondContact CA-O 3.41Å; Y383-R702 HydrophobicContact CD1-CB 3.68Å; Y383-R702 HydrophobicContact CE1-CB 3.74Å; Y383-R702 HydrophobicContact CE1-CG 4.27Å; Y383-R702 HydrophobicContact CG-CB 4.49Å; Y383-R702 PolarHBondContact OH-NH1 3.06Å; V384-R702 PolarHBondContact N-O 3.23Å; R702-T780 PolarHBondContact NH1-O 3.33Å; R702-T780 PolarHBondContact NH2-O 3.29Å
703	V	95.4	Very high	90.3	Very high	8 Å²	8	34.6 Å²	34.6	5%	0.048	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	125.4	-179.7	-172.8	0	0	0	0	109.8	V384 T386 L693 L696 L723	V384-V703 HydrophobicContact CB-CG2 4.37Å; V384-V703 HydrophobicContact CG1-CG1 4.46Å; V384-V703 CarbonylContact O-C 3.56Å; V384-V703 VanDerWaalsContact O-CA 3.27Å; V384-V703 WeakPolarHBondContact O-CA 3.19Å; T386-V703 HydrophobicContact CG2-CG1 3.95Å; L693-V703 HydrophobicContact CD2-CB 4.35Å; L693-V703 HydrophobicContact CD2-CG1 3.82Å; L693-V703 HydrophobicContact CD2-CG2 4.14Å; L696-V703 HydrophobicContact CB-CG2 4.22Å; L696-V703 HydrophobicContact CD1-CG2 4.22Å; V703-L723 HydrophobicContact CB-CD1 3.7Å; V703-L723 HydrophobicContact CG1-CD1 3.79Å
704	W	96.3	Very high	89.9	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.2	175.6	-72.9	23.1	0	0	0	108.7	Y383 V384 L385 T386 A779 T780 V785 V798 I802	Y383-W704 HydrophobicContact CE1-CZ2 4.38Å; Y383-W704 AromaticContact CE1-NE1 3.97Å; V384-W704 PolarHBondContact O-N 3.38Å; L385-W704 CarbonylContact C-O 3.58Å; L385-W704 WeakPolarHBondContact CA-O 3.12Å; L385-W704 HydrophobicContact CG-CB 4.5Å; T386-W704 PolarHBondContact N-O 3.13Å; W704-A779 HydrophobicContact CH2-CB 3.88Å; W704-A779 HydrophobicContact CZ2-CB 4.35Å; W704-A779 WeakPolarHBondContact CZ2-O 3.44Å; W704-T780 HydrophobicContact CH2-CG2 4.29Å; W704-T780 HydrophobicContact CZ2-CG2 4.17Å; W704-V785 CarbonylContact C-O 3.48Å; W704-V785 WeakPolarHBondContact CA-O 3.47Å; W704-V785 HydrophobicContact CD2-CB 3.65Å; W704-V785 HydrophobicContact CD2-CG1 4.29Å; W704-V785 HydrophobicContact CD2-CG2 3.93Å; W704-V785 VanDerWaalsContact CE2-CG2 3.46Å; W704-V785 HydrophobicContact CE3-CB 3.99Å; W704-V785 HydrophobicContact CE3-CG1 4.11Å; W704-V785 HydrophobicContact CE3-CG2 4.4Å; W704-V785 HydrophobicContact CG-CB 3.91Å; W704-V785 HydrophobicContact CG-CG2 4.42Å; W704-V785 HydrophobicContact CH2-CG2 4.13Å; W704-V785 HydrophobicContact CZ2-CB 4.23Å; W704-V785 HydrophobicContact CZ2-CG2 3.59Å; W704-V785 HydrophobicContact CZ3-CB 4.42Å; W704-V785 HydrophobicContact CZ3-CG1 4.29Å; W704-V785 HydrophobicContact CZ3-CG2 4.49Å; W704-V798 HydrophobicContact CE3-CG1 4.06Å; W704-V798 HydrophobicContact CZ3-CG1 3.98Å; W704-I802 HydrophobicContact CD2-CD1 3.99Å; W704-I802 HydrophobicContact CE3-CD1 3.5Å; W704-I802 HydrophobicContact CE3-CG1 4.47Å; W704-I802 HydrophobicContact CH2-CD1 3.92Å; W704-I802 HydrophobicContact CH2-CG1 4.09Å; W704-I802 HydrophobicContact CZ2-CD1 4.36Å; W704-I802 HydrophobicContact CZ3-CD1 3.47Å; W704-I802 VanDerWaalsContact CZ3-CD1 3.47Å; W704-I802 HydrophobicContact CZ3-CG1 3.96Å
705	M	95.9	Very high	89.6	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.5	175.6	-178.2	-169.7	-72.4	0	0	108.7	T386 K388 L392 I717 A718 L723 V785 V786 C787	T386-M705 WeakPolarHBondContact O-CA 3.24Å; K388-M705 HydrophobicContact CB-CG 4.39Å; K388-M705 HydrophobicContact CB-SD 4.23Å; K388-M705 HydrophobicContact CG-SD 4.24Å; L392-M705 HydrophobicContact CD1-CE 3.51Å; M705-I717 HydrophobicContact CE-CB 4.35Å; M705-I717 HydrophobicContact CE-CG2 3.71Å; M705-A718 HydrophobicContact CE-CB 4.28Å; M705-L723 HydrophobicContact CB-CD2 3.77Å; M705-L723 HydrophobicContact CE-CD2 3.87Å; M705-V785 PolarHBondContact N-O 3.3Å; M705-V786 HydrophobicContact CB-CG1 4.35Å; M705-V786 HydrophobicContact CB-CG2 4.3Å; M705-V786 HydrophobicContact CG-CG1 4.44Å; M705-V786 CarbonylContact O-C 3.56Å; M705-V786 WeakPolarHBondContact O-CA 3.36Å; M705-V786 HydrophobicContact SD-CG1 3.98Å; M705-C787 PolarHBondContact O-N 3.3Å
706	L	94.7	Very high	89.2	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113.7	175.9	-55	-176.2	0	0	0	108.2	L385 T386 C787 K795 V798 M822	L385-L706 HydrophobicContact CB-CD1 4.32Å; L385-L706 HydrophobicContact CD2-CD1 3.5Å; L385-L706 VanDerWaalsContact CD2-CD1 3.5Å; L385-L706 HydrophobicContact CD2-CG 4.19Å; T386-L706 PolarHBondContact O-N 3.47Å; L706-C787 HydrophobicContact CD2-CB 3.55Å; L706-C787 WeakPolarHBondContact CD2-SG 3.47Å; L706-K795 HydrophobicContact CB-CG 4.12Å; L706-K795 HydrophobicContact CD1-CB 4.33Å; L706-K795 WeakPolarHBondContact O-CE 3.43Å; L706-V798 HydrophobicContact CD1-CB 4.1Å; L706-V798 HydrophobicContact CD1-CG1 4.03Å; L706-V798 HydrophobicContact CD2-CG1 4.09Å; L706-M822 HydrophobicContact CB-SD 4.43Å; L706-M822 HydrophobicContact CD1-SD 3.83Å
707	T	90.6	Very high	89	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.006	16%	0.159	C	C	.	.			trans	-135.1	149.1	-174	-173.8	0	0	0	0	112.6	K388 D709 A714 C787 C788 R789 C790	K388-T707 HydrophobicContact CB-CG2 4.35Å; K388-T707 WeakPolarHBondContact CB-OG1 3.43Å; T707-D709 HydrophobicContact CG2-CB 4.06Å; T707-D709 PolarHBondContact OG1-N 3.36Å; T707-A714 HydrophobicContact CG2-CB 3.76Å; T707-C787 PolarHBondContact N-O 2.97Å; T707-C788 HydrophobicContact CG2-CB 4.48Å; T707-C788 CarbonylContact O-C 3.53Å; T707-C788 WeakPolarHBondContact O-CA 3.29Å; T707-R789 PolarHBondContact O-N 2.97Å; T707-C790 PolarHBondContact O-N 2.93Å
708	G	83.2	Confident	88.9	Confident	14 Å²	14	25 Å²	25	14%	0.144	14%	0.138	C	C	.	.	S	Bend	trans	-73	-13.4	168.9	0	0	0	0	0	113.1	R789	G708-R789 WeakPolarHBondContact O-CA 3.36Å
709	D	80.8	Confident	88.7	Confident	18 Å²	18	24.7 Å²	24.7	10%	0.096	13%	0.132	C	C	.	.	S	Bend	trans	-68.7	163.1	-173.8	-98.6	-2.9	0	0	0	114.9	K388 T707 T713 C788 R789	K388-D709 HydrophobicContact CD-CB 4.42Å; K388-D709 VanDerWaalsContact CD-OD2 3.26Å; K388-D709 WeakPolarHBondContact CD-OD2 3.43Å; K388-D709 WeakPolarHBondContact CE-OD2 3.16Å; K388-D709 IonicContact NZ-OD2 3.57Å; K388-D709 PolarHBondContact NZ-OD2 3.28Å; T707-D709 HydrophobicContact CG2-CB 4.06Å; T707-D709 PolarHBondContact OG1-N 3.36Å; D709-T713 HydrophobicContact CB-CG2 4.44Å; D709-T713 WeakPolarHBondContact OD2-CG2 3.35Å; D709-C788 WeakPolarHBondContact O-CB 3.43Å; D709-R789 PolarHBondContact O-N 3.12Å
710	K	79.3	Confident	88.4	Confident	66 Å²	66	24.9 Å²	24.9	29%	0.287	13%	0.133	S	C	.	.			trans	-60.8	153	172	-63.2	173.8	-173.5	165.2	0	111.2	E712 T713 A714	K710-E712 VanDerWaalsContact C-N 3.32Å; K710-E712 PolarHBondContact O-N 3.43Å; K710-T713 PolarHBondContact O-N 3.48Å; K710-A714 PolarHBondContact O-N 3.09Å
711	L	83.6	Confident	88.4	Confident	52 Å²	52	23 Å²	23	27%	0.272	11%	0.113	S	C	.	.	H	α-helix	trans	-59.3	-42.3	-175	-178.2	146.5	0	0	0	112.3	A714 C715 V732 V758	L711-A714 PolarHBondContact O-N 2.68Å; L711-C715 WeakPolarHBondContact O-CB 3.42Å; L711-C715 PolarHBondContact O-N 3.18Å; L711-C715 PolarHBondContact O-SG 2.85Å; L711-V732 HydrophobicContact CD1-CG1 3.7Å; L711-V732 HydrophobicContact CD2-CG1 4.18Å; L711-V732 HydrophobicContact CG-CG1 4.39Å; L711-V758 HydrophobicContact CD1-CG1 4.38Å; L711-V758 HydrophobicContact CG-CG1 4.3Å
712	E	80.2	Confident	88.2	Confident	90 Å²	90	24.8 Å²	24.8	42%	0.421	12%	0.122	S	C	.	.	H	α-helix	trans	-62.6	-48.4	-178.1	-58.9	90.5	159.7	0	0	110.9	K579 K710 C715 C716	K579-E712 IonicContact NZ-OE1 3.42Å; K579-E712 PolarHBondContact NZ-OE1 3.15Å; K710-E712 VanDerWaalsContact C-N 3.32Å; K710-E712 PolarHBondContact O-N 3.43Å; E712-C715 PolarHBondContact O-N 3.27Å; E712-C716 PolarHBondContact O-N 3.21Å; E712-C716 PolarHBondContact O-SG 3.43Å
713	T	81.4	Confident	88.1	Confident	19 Å²	19	21.4 Å²	21.4	12%	0.117	11%	0.11	C	C	.	.	H	α-helix	trans	-61.3	-47.8	176.9	-58.8	0	0	0	0	112.1	K388 D709 K710 C715 C716 I717	K388-T713 HydrophobicContact CD-CG2 4.19Å; D709-T713 HydrophobicContact CB-CG2 4.44Å; D709-T713 WeakPolarHBondContact OD2-CG2 3.35Å; K710-T713 PolarHBondContact O-N 3.48Å; T713-C715 VanDerWaalsContact C-N 3.29Å; T713-C715 PolarHBondContact O-N 3.33Å; T713-C716 WeakPolarHBondContact O-CB 3.11Å; T713-C716 PolarHBondContact O-N 3.05Å; T713-C716 VanDerWaalsContact O-N 3.14Å; T713-I717 PolarHBondContact O-N 2.93Å
714	A	87.4	Confident	87.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.7	-40.3	179.2	0	0	0	0	0	111.5	T707 K710 L711 A718 V786 C788	T707-A714 HydrophobicContact CG2-CB 3.76Å; K710-A714 PolarHBondContact O-N 3.09Å; L711-A714 PolarHBondContact O-N 2.68Å; A714-A718 VanDerWaalsContact O-CB 3.27Å; A714-A718 WeakPolarHBondContact O-CB 3.49Å; A714-A718 PolarHBondContact O-N 2.95Å; A714-V786 HydrophobicContact CB-CG1 3.92Å; A714-C788 HydrophobicContact CB-CB 4.09Å
715	C	87	Confident	87.1	Confident	15 Å²	15	22.2 Å²	22.2	10%	0.101	12%	0.119	C	C	.	.	H	α-helix	trans	-64.9	-40.7	174.9	-69.6	0	0	0	0	112.4	L711 E712 T713 A718 K719	L711-C715 WeakPolarHBondContact O-CB 3.42Å; L711-C715 PolarHBondContact O-N 3.18Å; L711-C715 PolarHBondContact O-SG 2.85Å; E712-C715 PolarHBondContact O-N 3.27Å; T713-C715 VanDerWaalsContact C-N 3.29Å; T713-C715 PolarHBondContact O-N 3.33Å; C715-A718 PolarHBondContact O-N 2.91Å; C715-K719 WeakPolarHBondContact O-CG 3.28Å; C715-K719 PolarHBondContact O-N 3.3Å; C715-K719 VanDerWaalsContact O-N 3.15Å
716	C	85.6	Confident	86.3	Confident	21 Å²	21	32.5 Å²	32.5	14%	0.142	16%	0.158	C	C	.	.	H	α-helix	trans	-62.1	-48.4	177.1	-66.6	0	0	0	0	111	E712 T713 A718 K719 S720	E712-C716 PolarHBondContact O-N 3.21Å; E712-C716 PolarHBondContact O-SG 3.43Å; T713-C716 WeakPolarHBondContact O-CB 3.11Å; T713-C716 PolarHBondContact O-N 3.05Å; T713-C716 VanDerWaalsContact O-N 3.14Å; C716-A718 PolarHBondContact O-N 2.94Å; C716-K719 PolarHBondContact O-N 2.72Å; C716-S720 WeakPolarHBondContact O-CB 3.34Å; C716-S720 PolarHBondContact O-N 3.39Å; C716-S720 PolarHBondContact O-OG 3.44Å
717	I	89.9	Confident	85.7	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-65.7	-39	177.6	-64.4	-53.4	0	0	0	112	K388 T393 D683 L685 M705 T713 K719 S720 S721	K388-I717 HydrophobicContact CD-CB 4.33Å; K388-I717 HydrophobicContact CD-CG1 3.83Å; K388-I717 HydrophobicContact CG-CB 3.99Å; K388-I717 HydrophobicContact CG-CG1 3.96Å; K388-I717 HydrophobicContact CG-CG2 3.79Å; T393-I717 HydrophobicContact CG2-CD1 3.69Å; T393-I717 HydrophobicContact CG2-CG1 4.05Å; T393-I717 HydrophobicContact CG2-CG2 4.29Å; D683-I717 HydrophobicContact CB-CD1 3.91Å; L685-I717 HydrophobicContact CD2-CD1 4.41Å; L685-I717 HydrophobicContact CD2-CG2 4.18Å; M705-I717 HydrophobicContact CE-CB 4.35Å; M705-I717 HydrophobicContact CE-CG2 3.71Å; T713-I717 PolarHBondContact O-N 2.93Å; I717-K719 PolarHBondContact O-N 2.92Å; I717-S720 WeakPolarHBondContact CA-OG 3.25Å; I717-S720 PolarHBondContact O-N 3.09Å; I717-S720 PolarHBondContact O-OG 3.14Å; I717-S721 WeakPolarHBondContact O-CB 3.43Å; I717-S721 PolarHBondContact O-N 3.47Å; I717-S721 PolarHBondContact O-OG 2.89Å
718	A	91.1	Very high	85.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-32	177.7	0	0	0	0	0	112.6	M705 A714 C715 C716 L723 I724 V786	M705-A718 HydrophobicContact CE-CB 4.28Å; A714-A718 VanDerWaalsContact O-CB 3.27Å; A714-A718 WeakPolarHBondContact O-CB 3.49Å; A714-A718 PolarHBondContact O-N 2.95Å; C715-A718 PolarHBondContact O-N 2.91Å; C716-A718 PolarHBondContact O-N 2.94Å; A718-L723 HydrophobicContact CB-CD2 4.46Å; A718-L723 PolarHBondContact O-N 2.98Å; A718-I724 HydrophobicContact CB-CD1 3.67Å; A718-I724 HydrophobicContact CB-CG1 4.05Å; A718-I724 PolarHBondContact O-N 2.99Å; A718-V786 HydrophobicContact CB-CG2 3.84Å
719	K	88.1	Confident	85.4	Confident	77 Å²	77	43.3 Å²	43.3	34%	0.335	22%	0.217	S	C	.	.	H	α-helix	trans	-78.6	-48.4	172.5	-69	175.1	-178.9	176.5	0	112.2	C715 C716 I717 S721 Q722	C715-K719 WeakPolarHBondContact O-CG 3.28Å; C715-K719 PolarHBondContact O-N 3.3Å; C715-K719 VanDerWaalsContact O-N 3.15Å; C716-K719 PolarHBondContact O-N 2.72Å; I717-K719 PolarHBondContact O-N 2.92Å; K719-S721 VanDerWaalsContact C-N 3.31Å; K719-S721 PolarHBondContact O-N 2.8Å; K719-Q722 PolarHBondContact O-N 3.23Å; K719-Q722 VanDerWaalsContact O-N 3.07Å
720	S	87.9	Confident	85.7	Confident	5 Å²	5	45 Å²	45	4%	0.035	23%	0.226	C	C	.	.	H	α-helix	trans	-65.6	-34.3	-176.5	75	0	0	0	0	112.3	L685 R690 C716 I717 Q722	L685-S720 WeakPolarHBondContact CD1-O 3.39Å; R690-S720 PolarHBondContact NE-O 3.2Å; R690-S720 PolarHBondContact NH2-O 3.36Å; C716-S720 WeakPolarHBondContact O-CB 3.34Å; C716-S720 PolarHBondContact O-N 3.39Å; C716-S720 PolarHBondContact O-OG 3.44Å; I717-S720 WeakPolarHBondContact CA-OG 3.25Å; I717-S720 PolarHBondContact O-N 3.09Å; I717-S720 PolarHBondContact O-OG 3.14Å; S720-Q722 VanDerWaalsContact C-N 3.26Å; S720-Q722 PolarHBondContact O-N 2.86Å
721	S	91	Very high	86.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-8.3	175.6	64.4	0	0	0	0	113.8	L693 I717 K719 L723	L693-S721 WeakPolarHBondContact CD1-O 3.41Å; I717-S721 WeakPolarHBondContact O-CB 3.43Å; I717-S721 PolarHBondContact O-N 3.47Å; I717-S721 PolarHBondContact O-OG 2.89Å; K719-S721 VanDerWaalsContact C-N 3.31Å; K719-S721 PolarHBondContact O-N 2.8Å; S721-L723 PolarHBondContact O-N 3.07Å; S721-L723 PolarHBondContact OG-N 3.36Å
722	Q	90.1	Very high	86.7	Confident	43 Å²	43	42.4 Å²	42.4	20%	0.201	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	22.2	-171.8	-59.2	178.9	-46.5	0	0	114.1	K719 S720 I724	K719-Q722 PolarHBondContact O-N 3.23Å; K719-Q722 VanDerWaalsContact O-N 3.07Å; S720-Q722 VanDerWaalsContact C-N 3.26Å; S720-Q722 PolarHBondContact O-N 2.86Å; Q722-I724 PolarHBondContact O-N 3.26Å
723	L	90.6	Very high	87.1	Confident	13 Å²	13	38.5 Å²	38.5	7%	0.068	20%	0.199	C	C	.	.	S	Bend	trans	-56	-39	164.4	178.9	63.8	0	0	0	110.3	L693 V703 M705 A718 S721 A784 V786	L693-L723 HydrophobicContact CD1-CB 4.31Å; V703-L723 HydrophobicContact CB-CD1 3.7Å; V703-L723 HydrophobicContact CG1-CD1 3.79Å; M705-L723 HydrophobicContact CB-CD2 3.77Å; M705-L723 HydrophobicContact CE-CD2 3.87Å; A718-L723 HydrophobicContact CB-CD2 4.46Å; A718-L723 PolarHBondContact O-N 2.98Å; S721-L723 PolarHBondContact O-N 3.07Å; S721-L723 PolarHBondContact OG-N 3.36Å; L723-A784 HydrophobicContact CD1-CB 4.48Å; L723-A784 HydrophobicContact CG-CB 4.3Å; L723-V786 HydrophobicContact CD2-CG2 4.24Å
724	I	89.3	Confident	87.3	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.041	23%	0.228	C	C	.	.	S	Bend	trans	-108	124.2	172	-54	179.2	0	0	0	107.3	A718 Q722 Q728 L730 A756 A784 V786	A718-I724 HydrophobicContact CB-CD1 3.67Å; A718-I724 HydrophobicContact CB-CG1 4.05Å; A718-I724 PolarHBondContact O-N 2.99Å; Q722-I724 PolarHBondContact O-N 3.26Å; I724-Q728 HydrophobicContact CG2-CB 4.05Å; I724-Q728 HydrophobicContact CG2-CG 4.31Å; I724-L730 HydrophobicContact CD1-CD1 3.41Å; I724-L730 VanDerWaalsContact CD1-CD1 3.41Å; I724-A756 HydrophobicContact CD1-CB 3.68Å; I724-A756 HydrophobicContact CG1-CB 3.84Å; I724-A756 HydrophobicContact CG2-CB 3.97Å; I724-A784 HydrophobicContact CG1-CB 4.4Å; I724-V786 HydrophobicContact CD1-CG2 4.25Å
725	G	82.6	Confident	87.3	Confident	21 Å²	21	50.2 Å²	50.2	22%	0.216	25%	0.252	C	S	.	.			trans	-63.5	151.3	-179.5	0	0	0	0	0	112.1	N727 Q728	G725-N727 PolarHBondContact O-N 3.18Å; G725-N727 VanDerWaalsContact O-N 3.15Å; G725-Q728 VanDerWaalsContact O-CB 3.28Å; G725-Q728 WeakPolarHBondContact O-CB 3.42Å; G725-Q728 PolarHBondContact O-N 2.69Å
726	R	79.2	Confident	87.3	Confident	216 Å²	216	49.7 Å²	49.7	82%	0.815	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-35.2	-178.4	-67.7	-177.8	177.8	178.5	-0.2	113.9
727	N	80.3	Confident	87.5	Confident	170 Å²	170	56.3 Å²	56.3	91%	0.909	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	5.3	-179.6	-64.5	-5.3	0	0	0	113	G725	G725-N727 PolarHBondContact O-N 3.18Å; G725-N727 VanDerWaalsContact O-N 3.15Å
728	Q	83.4	Confident	87.5	Confident	46 Å²	46	59 Å²	59	22%	0.215	29%	0.291	C	S	.	.	S	Bend	trans	-88.2	127.6	-176.1	-169.3	-179	-8.8	0	0	110	I724 G725 G754	I724-Q728 HydrophobicContact CG2-CB 4.05Å; I724-Q728 HydrophobicContact CG2-CG 4.31Å; G725-Q728 VanDerWaalsContact O-CB 3.28Å; G725-Q728 WeakPolarHBondContact O-CB 3.42Å; G725-Q728 PolarHBondContact O-N 2.69Å; Q728-G754 PolarHBondContact NE2-O 3.02Å
729	G	84.4	Confident	87.6	Confident	27 Å²	27	65.7 Å²	65.7	28%	0.278	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-64.8	138.5	178.3	0	0	0	0	0	112.1	H755 A756	G729-H755 VanDerWaalsContact CA-CD2 3.49Å; G729-H755 WeakPolarHBondContact CA-CD2 3.45Å; G729-H755 CarbonylContact O-C 3.53Å; G729-H755 WeakPolarHBondContact O-CA 3.28Å; G729-H755 WeakPolarHBondContact O-CB 3.15Å; G729-A756 PolarHBondContact O-N 3.48Å
730	L	88.4	Confident	87.8	Confident	53 Å²	53	66.4 Å²	66.4	28%	0.277	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126	175.3	-170.2	65.9	0	0	0	109.7	I724 V732 A756 V758	I724-L730 HydrophobicContact CD1-CD1 3.41Å; I724-L730 VanDerWaalsContact CD1-CD1 3.41Å; L730-V732 HydrophobicContact CD2-CG2 3.92Å; L730-V732 HydrophobicContact CG-CG2 4.01Å; L730-A756 HydrophobicContact CD1-CB 4.11Å; L730-V758 HydrophobicContact CD1-CG2 3.38Å; L730-V758 HydrophobicContact CD2-CG2 4.22Å; L730-V758 HydrophobicContact CG-CG2 3.93Å
731	H	91.6	Very high	87.9	Confident	10 Å²	10	68.6 Å²	68.6	5%	0.046	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	105.1	170.5	-174.2	56.3	0	0	0	110.3	E745 F749 H755 A756 V758	H731-E745 IonicContact CE1-OE2 3.68Å; H731-E745 IonicContact NE2-OE2 3.07Å; H731-F749 HydrophobicContact CB-CD2 3.91Å; H731-F749 HydrophobicContact CB-CE2 4.13Å; H731-F749 AromaticContact CD2-CD2 3.23Å; H731-F749 WeakPolarHBondContact CD2-CD2 3.33Å; H731-F749 AromaticContact CD2-CG 3.68Å; H731-F749 AromaticContact CG-CD2 3.77Å; H731-H755 HydrophobicContact CB-CB 4.32Å; H731-A756 PolarHBondContact N-O 3.38Å; H731-V758 PolarHBondContact O-N 3.23Å
732	V	91	Very high	87.9	Confident	54 Å²	54	68.6 Å²	68.6	33%	0.327	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	118.7	174.3	-174.3	0	0	0	0	108.8	L711 L730 V758	L711-V732 HydrophobicContact CD1-CG1 3.7Å; L711-V732 HydrophobicContact CD2-CG1 4.18Å; L711-V732 HydrophobicContact CG-CG1 4.39Å; L730-V732 HydrophobicContact CD2-CG2 3.92Å; L730-V732 HydrophobicContact CG-CG2 4.01Å; V732-V758 HydrophobicContact CB-CB 4.43Å; V732-V758 HydrophobicContact CG1-CB 4.38Å; V732-V758 HydrophobicContact CG1-CG1 4.42Å; V732-V758 HydrophobicContact CG2-CB 4.12Å; V732-V758 HydrophobicContact CG2-CG2 4.28Å
733	L	89.5	Confident	88	Confident	8 Å²	8	70.2 Å²	70.2	4%	0.042	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-66.9	134	171.7	-91.7	81.1	0	0	0	109.5	V736 E745 L757 V758 I759	L733-V736 HydrophobicContact CD2-CG2 4.39Å; L733-E745 HydrophobicContact CD2-CB 4.2Å; L733-E745 HydrophobicContact CG-CB 4.29Å; L733-L757 HydrophobicContact CD1-CD1 3.17Å; L733-L757 HydrophobicContact CD1-CG 4.35Å; L733-V758 PolarHBondContact N-O 2.85Å; L733-I759 HydrophobicContact CB-CG1 4.48Å; L733-I759 HydrophobicContact CD2-CD1 3.95Å; L733-I759 HydrophobicContact CD2-CG1 4.27Å
734	R	85.8	Confident	88	Confident	193 Å²	193	75.8 Å²	75.8	73%	0.728	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-66.4	164.5	169	-64.1	-177.9	176.1	-178.1	-1.8	110	V736 E745	R734-V736 WeakPolarHBondContact O-CG2 3.39Å; R734-V736 PolarHBondContact O-N 3.45Å; R734-E745 WeakPolarHBondContact CD-OE1 3.23Å
735	S	85.8	Confident	88.1	Confident	72 Å²	72	76.8 Å²	76.8	50%	0.503	38%	0.377	S	S	.	.			trans	-59.7	113	176.1	179.1	0	0	0	0	109.4
736	V	87.2	Confident	88.5	Confident	3 Å²	3	76 Å²	76	2%	0.018	37%	0.367	C	S	.	.			trans	-96.8	112.9	179.3	174.5	0	0	0	0	107.8	L733 R734 D741 A742 E745 S763 V766	L733-V736 HydrophobicContact CD2-CG2 4.39Å; R734-V736 WeakPolarHBondContact O-CG2 3.39Å; R734-V736 PolarHBondContact O-N 3.45Å; V736-D741 HydrophobicContact CG1-CB 4.14Å; V736-A742 HydrophobicContact CG1-CB 3.57Å; V736-E745 HydrophobicContact CG2-CB 4.45Å; V736-E745 HydrophobicContact CG2-CG 4.2Å; V736-S763 PolarHBondContact N-OG 3.24Å; V736-V766 HydrophobicContact CG1-CB 4.06Å; V736-V766 HydrophobicContact CG1-CG1 3.76Å
737	K	89.6	Confident	89.1	Confident	160 Å²	160	67.9 Å²	67.9	70%	0.696	34%	0.34	S	S	*	.			trans	-109.2	-31.8	176.6	-64.8	-175.5	179.1	-176.5	0	112.2
738	T	91.8	Very high	89.6	Confident	60 Å²	60	61.7 Å²	61.7	37%	0.368	31%	0.31	S	S	.	.	S	Bend	trans	-113.6	160.9	-176.5	72.2	0	0	0	0	112	T740 D741 A742	T738-T740 PolarHBondContact O-N 3.28Å; T738-T740 PolarHBondContact OG1-OG1 3.17Å; T738-D741 WeakPolarHBondContact CB-OD2 3.35Å; T738-D741 PolarHBondContact N-OD2 2.87Å; T738-D741 VanDerWaalsContact N-OD2 3.09Å; T738-D741 PolarHBondContact O-N 3.31Å; T738-D741 PolarHBondContact OG1-N 2.85Å; T738-D741 PolarHBondContact OG1-OD1 2.66Å; T738-D741 PolarHBondContact OG1-OD2 2.72Å; T738-A742 PolarHBondContact O-N 3.25Å; T738-A742 VanDerWaalsContact O-N 3.15Å
739	R	91.9	Very high	90	Very high	141 Å²	141	60.1 Å²	60.1	53%	0.532	30%	0.303	S	S	.	.	H	α-helix	trans	-57.6	-37.9	174.5	-177.4	179.9	177.6	168.8	2.1	112.4	A742 H743 Y770 Y771	R739-A742 PolarHBondContact O-N 2.84Å; R739-H743 PolarHBondContact O-N 3.07Å; R739-H743 VanDerWaalsContact O-N 3.12Å; R739-Y770 HydrophobicContact CB-CD1 4.36Å; R739-Y770 HydrophobicContact CB-CD2 4.06Å; R739-Y770 HydrophobicContact CB-CE2 4.3Å; R739-Y770 HydrophobicContact CB-CG 4.1Å; R739-Y770 HydrophobicContact CG-CD1 4.14Å; R739-Y770 HydrophobicContact CG-CD2 4.34Å; R739-Y770 HydrophobicContact CG-CG 3.91Å; R739-Y771 HydrophobicContact CG-CE2 3.6Å; R739-Y771 PolarHBondContact NE-OH 2.83Å; R739-Y771 WeakPolarHBondContact O-CE2 3.38Å
740	T	91.7	Very high	90.3	Very high	91 Å²	91	64.3 Å²	64.3	56%	0.558	31%	0.31	S	S	*	.	H	α-helix	trans	-67	-40.8	179.6	38.2	0	0	0	0	111.8	T738 A742 H743 Q744	T738-T740 PolarHBondContact O-N 3.28Å; T738-T740 PolarHBondContact OG1-OG1 3.17Å; T740-A742 VanDerWaalsContact C-N 3.32Å; T740-A742 PolarHBondContact O-N 2.81Å; T740-H743 PolarHBondContact O-N 3.48Å; T740-Q744 WeakPolarHBondContact O-CG 3.34Å; T740-Q744 PolarHBondContact O-N 3.36Å
741	D	91.4	Very high	90.3	Very high	52 Å²	52	72.1 Å²	72.1	28%	0.278	34%	0.336	S	S	.	.	H	α-helix	trans	-62.3	-44.4	176.6	-52.5	-28.1	0	0	0	110.2	V736 T738 H743 Q744 E745	V736-D741 HydrophobicContact CG1-CB 4.14Å; T738-D741 WeakPolarHBondContact CB-OD2 3.35Å; T738-D741 PolarHBondContact N-OD2 2.87Å; T738-D741 VanDerWaalsContact N-OD2 3.09Å; T738-D741 PolarHBondContact O-N 3.31Å; T738-D741 PolarHBondContact OG1-N 2.85Å; T738-D741 PolarHBondContact OG1-OD1 2.66Å; T738-D741 PolarHBondContact OG1-OD2 2.72Å; D741-H743 VanDerWaalsContact C-N 3.31Å; D741-H743 PolarHBondContact O-N 3.32Å; D741-Q744 PolarHBondContact O-N 3.24Å; D741-E745 PolarHBondContact O-N 3.43Å
742	A	90.3	Very high	90.1	Very high	0 Å²	0	75.9 Å²	75.9	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-57.5	-46.1	177.8	0	0	0	0	0	110.9	V736 T738 R739 T740 Q744 L746 V766 Y771	V736-A742 HydrophobicContact CG1-CB 3.57Å; T738-A742 PolarHBondContact O-N 3.25Å; T738-A742 VanDerWaalsContact O-N 3.15Å; R739-A742 PolarHBondContact O-N 2.84Å; T740-A742 VanDerWaalsContact C-N 3.32Å; T740-A742 PolarHBondContact O-N 2.81Å; A742-Q744 PolarHBondContact O-N 2.89Å; A742-L746 WeakPolarHBondContact O-CB 3.42Å; A742-L746 WeakPolarHBondContact O-CG 3.39Å; A742-L746 PolarHBondContact O-N 3.28Å; A742-V766 HydrophobicContact CB-CG1 4.48Å; A742-Y771 HydrophobicContact CB-CD2 3.92Å; A742-Y771 HydrophobicContact CB-CE2 4.16Å
743	H	92.1	Very high	89.5	Confident	76 Å²	76	81.6 Å²	81.6	35%	0.352	38%	0.375	S	S	.	.	H	α-helix	trans	-63.5	-42.6	179.4	-173.2	65.3	0	0	0	112.8	R739 T740 D741 N747 Y771	R739-H743 PolarHBondContact O-N 3.07Å; R739-H743 VanDerWaalsContact O-N 3.12Å; T740-H743 PolarHBondContact O-N 3.48Å; D741-H743 VanDerWaalsContact C-N 3.31Å; D741-H743 PolarHBondContact O-N 3.32Å; H743-N747 PolarHBondContact CD2-ND2 3.32Å; H743-N747 PolarHBondContact CE1-ND2 3.22Å; H743-N747 VanDerWaalsContact CE1-ND2 3.32Å; H743-N747 PolarHBondContact NE2-ND2 3.42Å; H743-N747 WeakPolarHBondContact O-CB 3.41Å; H743-N747 PolarHBondContact O-N 3.25Å; H743-N747 VanDerWaalsContact O-N 3.08Å; H743-N747 PolarHBondContact O-ND2 3.04Å; H743-Y771 HydrophobicContact CB-CE2 4.05Å; H743-Y771 AromaticContact ND1-CE1 3.83Å; H743-Y771 AromaticContact ND1-CZ 3.96Å
744	Q	91.5	Very high	89.2	Confident	130 Å²	130	83.7 Å²	83.7	61%	0.607	40%	0.399	S	S	*	.	H	α-helix	trans	-65.5	-45.5	179.4	-71	178.9	6.2	0	0	111.8	T740 D741 A742 N747 S748	T740-Q744 WeakPolarHBondContact O-CG 3.34Å; T740-Q744 PolarHBondContact O-N 3.36Å; D741-Q744 PolarHBondContact O-N 3.24Å; A742-Q744 PolarHBondContact O-N 2.89Å; Q744-N747 PolarHBondContact O-N 3.45Å; Q744-S748 WeakPolarHBondContact O-CB 3.43Å; Q744-S748 PolarHBondContact O-N 3.19Å
745	E	91.2	Very high	89.4	Confident	30 Å²	30	77.3 Å²	77.3	14%	0.14	38%	0.377	C	S	.	.	H	α-helix	trans	-67.4	-40.9	179.4	-71.9	-63	161	0	0	112	H731 L733 R734 V736 D741 N747 S748 F749	H731-E745 IonicContact CE1-OE2 3.68Å; H731-E745 IonicContact NE2-OE2 3.07Å; L733-E745 HydrophobicContact CD2-CB 4.2Å; L733-E745 HydrophobicContact CG-CB 4.29Å; R734-E745 WeakPolarHBondContact CD-OE1 3.23Å; V736-E745 HydrophobicContact CG2-CB 4.45Å; V736-E745 HydrophobicContact CG2-CG 4.2Å; D741-E745 PolarHBondContact O-N 3.43Å; E745-N747 VanDerWaalsContact C-N 3.34Å; E745-N747 PolarHBondContact O-N 3.47Å; E745-S748 WeakPolarHBondContact O-CB 3.36Å; E745-S748 PolarHBondContact O-N 2.89Å; E745-F749 PolarHBondContact O-N 3.16Å
746	L	91.4	Very high	89.7	Confident	3 Å²	3	73.9 Å²	73.9	2%	0.016	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-40.1	175.3	-69.4	172.5	0	0	0	112.2	A742 F749 R750 Y771 F775 L778	A742-L746 WeakPolarHBondContact O-CB 3.42Å; A742-L746 WeakPolarHBondContact O-CG 3.39Å; A742-L746 PolarHBondContact O-N 3.28Å; L746-F749 PolarHBondContact O-N 3.12Å; L746-R750 WeakPolarHBondContact O-CB 3.39Å; L746-R750 PolarHBondContact O-N 2.85Å; L746-Y771 HydrophobicContact CD1-CD2 4.3Å; L746-Y771 HydrophobicContact CD1-CG 3.94Å; L746-F775 HydrophobicContact CD2-CB 4.18Å; L746-F775 HydrophobicContact CD2-CD2 3.81Å; L746-L778 HydrophobicContact CB-CD1 4.28Å; L746-L778 HydrophobicContact CD2-CD1 4.19Å
747	N	91.2	Very high	90.1	Very high	47 Å²	47	73.8 Å²	73.8	25%	0.251	35%	0.353	S	S	.	.	H	α-helix	trans	-67.7	-36.8	175.3	-78.7	-25.9	0	0	0	112.5	H743 Q744 E745 R750	H743-N747 PolarHBondContact CD2-ND2 3.32Å; H743-N747 PolarHBondContact CE1-ND2 3.22Å; H743-N747 VanDerWaalsContact CE1-ND2 3.32Å; H743-N747 PolarHBondContact NE2-ND2 3.42Å; H743-N747 WeakPolarHBondContact O-CB 3.41Å; H743-N747 PolarHBondContact O-N 3.25Å; H743-N747 VanDerWaalsContact O-N 3.08Å; H743-N747 PolarHBondContact O-ND2 3.04Å; Q744-N747 PolarHBondContact O-N 3.45Å; E745-N747 VanDerWaalsContact C-N 3.34Å; E745-N747 PolarHBondContact O-N 3.47Å; N747-R750 PolarHBondContact O-N 3.01Å
748	S	90.6	Very high	90.3	Very high	40 Å²	40	66.2 Å²	66.2	28%	0.28	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-48.2	172.1	165	0	0	0	0	110.8	Q744 E745 R750 R751	Q744-S748 WeakPolarHBondContact O-CB 3.43Å; Q744-S748 PolarHBondContact O-N 3.19Å; E745-S748 WeakPolarHBondContact O-CB 3.36Å; E745-S748 PolarHBondContact O-N 2.89Å; S748-R750 PolarHBondContact O-N 2.83Å; S748-R751 PolarHBondContact O-N 3.06Å
749	F	91.4	Very high	90.4	Very high	13 Å²	13	63.3 Å²	63.3	6%	0.057	30%	0.302	C	S	.	.	H	α-helix	trans	-64.1	-39.3	178.8	-176	-129.3	0	0	0	112.4	H731 E745 L746 R751 K752 L757 L778	H731-F749 HydrophobicContact CB-CD2 3.91Å; H731-F749 HydrophobicContact CB-CE2 4.13Å; H731-F749 AromaticContact CD2-CD2 3.23Å; H731-F749 WeakPolarHBondContact CD2-CD2 3.33Å; H731-F749 AromaticContact CD2-CG 3.68Å; H731-F749 AromaticContact CG-CD2 3.77Å; E745-F749 PolarHBondContact O-N 3.16Å; L746-F749 PolarHBondContact O-N 3.12Å; F749-R751 PolarHBondContact O-N 3.3Å; F749-R751 VanDerWaalsContact O-N 3.11Å; F749-K752 PolarHBondContact O-N 3.47Å; F749-L757 HydrophobicContact CD1-CD1 4.06Å; F749-L757 HydrophobicContact CD2-CD1 4.18Å; F749-L757 HydrophobicContact CE1-CB 4.43Å; F749-L757 HydrophobicContact CE1-CD1 3.91Å; F749-L757 HydrophobicContact CE1-CD2 4.13Å; F749-L757 HydrophobicContact CE1-CG 4.4Å; F749-L757 HydrophobicContact CE2-CB 4.33Å; F749-L757 HydrophobicContact CE2-CD1 4.01Å; F749-L757 HydrophobicContact CG-CD1 4.21Å; F749-L757 HydrophobicContact CZ-CB 3.89Å; F749-L757 HydrophobicContact CZ-CD1 3.88Å; F749-L757 HydrophobicContact CZ-CD2 4.41Å; F749-L757 HydrophobicContact CZ-CG 4.3Å; F749-L778 HydrophobicContact CD1-CB 3.87Å; F749-L778 HydrophobicContact CD1-CD1 4.31Å; F749-L778 HydrophobicContact CE1-CB 3.91Å
750	R	90.8	Very high	90.4	Very high	115 Å²	115	57.6 Å²	57.6	43%	0.434	28%	0.284	S	S	.	.	H	α-helix	trans	-55.6	-30.7	177.2	-173.7	175.8	-69.2	170.8	0.5	113.2	L746 N747 S748 K752 L778	L746-R750 WeakPolarHBondContact O-CB 3.39Å; L746-R750 PolarHBondContact O-N 2.85Å; N747-R750 PolarHBondContact O-N 3.01Å; S748-R750 PolarHBondContact O-N 2.83Å; R750-K752 VanDerWaalsContact C-N 3.34Å; R750-L778 HydrophobicContact CB-CD1 4.34Å; R750-L778 HydrophobicContact CB-CD2 3.98Å; R750-L778 HydrophobicContact CG-CD2 4.05Å
751	R	88.9	Confident	90.3	Very high	216 Å²	216	53.3 Å²	53.3	82%	0.815	26%	0.258	S	S	*	.	H	α-helix	trans	-77.3	-18.7	177.4	-63.5	175.9	-172.3	-179.5	2.1	113.1	S748 F749	S748-R751 PolarHBondContact O-N 3.06Å; F749-R751 PolarHBondContact O-N 3.3Å; F749-R751 VanDerWaalsContact O-N 3.11Å
752	K	86.3	Confident	90.2	Very high	89 Å²	89	56.4 Å²	56.4	39%	0.387	27%	0.27	S	S	.	.			trans	-103	74	-174	-66.8	-177.3	179.1	178.2	0	111.4	F749 R750 H755	F749-K752 PolarHBondContact O-N 3.47Å; R750-K752 VanDerWaalsContact C-N 3.34Å; K752-H755 HydrophobicContact CB-CB 4.36Å
753	Q	79.1	Confident	90.3	Very high	174 Å²	174	56.4 Å²	56.4	81%	0.813	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	146.1	176.8	-64	-170.3	-2.2	0	0	111.7	H755	Q753-H755 PolarHBondContact O-N 2.66Å; Q753-H755 PolarHBondContact O-ND1 3.37Å
754	G	82.8	Confident	90.3	Very high	53 Å²	53	53 Å²	53	55%	0.546	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	-0.7	177	0	0	0	0	0	116.1	Q728	Q728-G754 PolarHBondContact NE2-O 3.02Å
755	H	90.9	Very high	90.3	Very high	58 Å²	58	52.3 Å²	52.3	27%	0.269	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-81	144.9	177	-69.3	56.6	0	0	0	111.1	G729 H731 K752 Q753 S782	G729-H755 VanDerWaalsContact CA-CD2 3.49Å; G729-H755 WeakPolarHBondContact CA-CD2 3.45Å; G729-H755 CarbonylContact O-C 3.53Å; G729-H755 WeakPolarHBondContact O-CA 3.28Å; G729-H755 WeakPolarHBondContact O-CB 3.15Å; H731-H755 HydrophobicContact CB-CB 4.32Å; K752-H755 HydrophobicContact CB-CB 4.36Å; Q753-H755 PolarHBondContact O-N 2.66Å; Q753-H755 PolarHBondContact O-ND1 3.37Å; H755-S782 PolarHBondContact O-OG 2.86Å; H755-S782 VanDerWaalsContact O-OG 3.11Å
756	A	92.4	Very high	90.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	145.1	170	0	0	0	0	0	110.4	I724 G729 L730 H731 A784	I724-A756 HydrophobicContact CD1-CB 3.68Å; I724-A756 HydrophobicContact CG1-CB 3.84Å; I724-A756 HydrophobicContact CG2-CB 3.97Å; G729-A756 PolarHBondContact O-N 3.48Å; L730-A756 HydrophobicContact CD1-CB 4.11Å; H731-A756 PolarHBondContact N-O 3.38Å; A756-A784 WeakPolarHBondContact CA-O 3.36Å; A756-A784 HydrophobicContact CB-CB 4.2Å
757	L	94.7	Very high	90.3	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.2	-175.8	-178.6	65.2	0	0	0	110.5	L733 F749 F775 A779 A784 V785 V786	L733-L757 HydrophobicContact CD1-CD1 3.17Å; L733-L757 HydrophobicContact CD1-CG 4.35Å; F749-L757 HydrophobicContact CD1-CD1 4.06Å; F749-L757 HydrophobicContact CD2-CD1 4.18Å; F749-L757 HydrophobicContact CE1-CB 4.43Å; F749-L757 HydrophobicContact CE1-CD1 3.91Å; F749-L757 HydrophobicContact CE1-CD2 4.13Å; F749-L757 HydrophobicContact CE1-CG 4.4Å; F749-L757 HydrophobicContact CE2-CB 4.33Å; F749-L757 HydrophobicContact CE2-CD1 4.01Å; F749-L757 HydrophobicContact CG-CD1 4.21Å; F749-L757 HydrophobicContact CZ-CB 3.89Å; F749-L757 HydrophobicContact CZ-CD1 3.88Å; F749-L757 HydrophobicContact CZ-CD2 4.41Å; F749-L757 HydrophobicContact CZ-CG 4.3Å; L757-F775 HydrophobicContact CD2-CE2 4.04Å; L757-F775 HydrophobicContact CD2-CZ 4.43Å; L757-A779 HydrophobicContact CD2-CB 3.84Å; L757-A784 PolarHBondContact N-O 3.04Å; L757-V785 HydrophobicContact CB-CG1 4.32Å; L757-V785 HydrophobicContact CB-CG2 4.18Å; L757-V785 HydrophobicContact CD2-CG1 4.13Å; L757-V785 HydrophobicContact CD2-CG2 4.38Å; L757-V785 HydrophobicContact CG-CG1 4.39Å; L757-V785 CarbonylContact O-C 3.34Å; L757-V785 WeakPolarHBondContact O-CA 3.21Å; L757-V786 PolarHBondContact O-N 2.79Å
758	V	94.4	Very high	90.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.3	169.3	-175.6	0	0	0	0	109.2	L711 L730 H731 V732 L733 V786	L711-V758 HydrophobicContact CD1-CG1 4.38Å; L711-V758 HydrophobicContact CG-CG1 4.3Å; L730-V758 HydrophobicContact CD1-CG2 3.38Å; L730-V758 HydrophobicContact CD2-CG2 4.22Å; L730-V758 HydrophobicContact CG-CG2 3.93Å; H731-V758 PolarHBondContact O-N 3.23Å; V732-V758 HydrophobicContact CB-CB 4.43Å; V732-V758 HydrophobicContact CG1-CB 4.38Å; V732-V758 HydrophobicContact CG1-CG1 4.42Å; V732-V758 HydrophobicContact CG2-CB 4.12Å; V732-V758 HydrophobicContact CG2-CG2 4.28Å; L733-V758 PolarHBondContact N-O 2.85Å; V758-V786 VanDerWaalsContact CA-O 3.31Å; V758-V786 WeakPolarHBondContact CA-O 3.48Å; V758-V786 HydrophobicContact CG1-CB 4.5Å; V758-V786 HydrophobicContact CG2-CB 4.2Å
759	I	94.5	Very high	90.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	139.9	-177.8	-168.5	169.5	0	0	0	111	L733 L764 F775 V786 C787 C788	L733-I759 HydrophobicContact CB-CG1 4.48Å; L733-I759 HydrophobicContact CD2-CD1 3.95Å; L733-I759 HydrophobicContact CD2-CG1 4.27Å; I759-L764 HydrophobicContact CD1-CB 3.92Å; I759-L764 HydrophobicContact CD1-CD1 4.22Å; I759-L764 HydrophobicContact CG1-CB 4.17Å; I759-F775 HydrophobicContact CD1-CE2 3.63Å; I759-F775 HydrophobicContact CD1-CZ 3.91Å; I759-V786 PolarHBondContact N-O 3.47Å; I759-C787 HydrophobicContact CG2-CB 4.28Å; I759-C787 CarbonylContact O-C 3.53Å; I759-C787 VanDerWaalsContact O-CA 3.3Å; I759-C787 WeakPolarHBondContact O-CA 3.31Å; I759-C788 PolarHBondContact O-N 3.01Å; I759-C788 PolarHBondContact O-SG 2.86Å; I759-C788 VanDerWaalsContact O-SG 3.42Å
760	S	92.1	Very high	90.3	Very high	21 Å²	21	58.9 Å²	58.9	15%	0.147	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	152.6	172.1	66.2	0	0	0	0	111.8	E762 S763 L764 C788	S760-E762 VanDerWaalsContact C-N 3.3Å; S760-E762 PolarHBondContact O-N 2.85Å; S760-S763 PolarHBondContact O-N 3.04Å; S760-S763 VanDerWaalsContact O-N 3.1Å; S760-S763 WeakPolarHBondContact OG-CB 3.19Å; S760-S763 PolarHBondContact OG-N 2.77Å; S760-S763 PolarHBondContact OG-OG 3.05Å; S760-L764 WeakPolarHBondContact O-CB 3.44Å; S760-L764 PolarHBondContact O-N 3.45Å; S760-C788 CarbonylContact C-O 3.56Å; S760-C788 WeakPolarHBondContact CA-O 3.27Å
761	G	89.3	Confident	90.5	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-52.4	-44.2	177.6	0	0	0	0	0	113.6	L764 E765 C788	G761-L764 WeakPolarHBondContact O-CB 3.44Å; G761-L764 PolarHBondContact O-N 3.37Å; G761-E765 PolarHBondContact O-N 2.83Å; G761-C788 PolarHBondContact N-O 3.45Å
762	E	89.1	Confident	90.6	Very high	116 Å²	116	49.6 Å²	49.6	54%	0.542	24%	0.24	S	C	.	.	H	α-helix	trans	-59.6	-47.9	175.4	-65.7	172.1	-164.3	0	0	112.3	S760 L764 E765 V766	S760-E762 VanDerWaalsContact C-N 3.3Å; S760-E762 PolarHBondContact O-N 2.85Å; E762-L764 VanDerWaalsContact C-N 3.31Å; E762-L764 PolarHBondContact O-N 3.49Å; E762-E765 PolarHBondContact O-N 3.34Å; E762-V766 PolarHBondContact O-N 2.73Å
763	S	92.1	Very high	90.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.9	-35.4	-179.6	-54.7	0	0	0	0	111.4	V736 S760 V766 C767	V736-S763 PolarHBondContact N-OG 3.24Å; S760-S763 PolarHBondContact O-N 3.04Å; S760-S763 VanDerWaalsContact O-N 3.1Å; S760-S763 WeakPolarHBondContact OG-CB 3.19Å; S760-S763 PolarHBondContact OG-N 2.77Å; S760-S763 PolarHBondContact OG-OG 3.05Å; S763-V766 PolarHBondContact O-N 2.94Å; S763-C767 WeakPolarHBondContact O-CB 3.49Å; S763-C767 PolarHBondContact O-N 3.26Å; S763-C767 PolarHBondContact O-SG 3.4Å
764	L	91.9	Very high	91.5	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-44.4	175.7	174.4	65.7	0	0	0	110.9	I759 S760 G761 E762 C767 L768 F775 V798	I759-L764 HydrophobicContact CD1-CB 3.92Å; I759-L764 HydrophobicContact CD1-CD1 4.22Å; I759-L764 HydrophobicContact CG1-CB 4.17Å; S760-L764 WeakPolarHBondContact O-CB 3.44Å; S760-L764 PolarHBondContact O-N 3.45Å; G761-L764 WeakPolarHBondContact O-CB 3.44Å; G761-L764 PolarHBondContact O-N 3.37Å; E762-L764 VanDerWaalsContact C-N 3.31Å; E762-L764 PolarHBondContact O-N 3.49Å; L764-C767 PolarHBondContact O-N 2.74Å; L764-L768 HydrophobicContact CD1-CD1 3.83Å; L764-L768 HydrophobicContact CD1-CG 3.95Å; L764-L768 HydrophobicContact CD2-CD1 4.47Å; L764-L768 HydrophobicContact CG-CD1 3.8Å; L764-L768 HydrophobicContact CG-CG 4.29Å; L764-L768 WeakPolarHBondContact O-CB 3.47Å; L764-L768 WeakPolarHBondContact O-CG 3.36Å; L764-L768 PolarHBondContact O-N 3.19Å; L764-F775 HydrophobicContact CD1-CD1 4.32Å; L764-F775 HydrophobicContact CD1-CE1 3.35Å; L764-F775 HydrophobicContact CD1-CE2 4.47Å; L764-F775 HydrophobicContact CD1-CZ 3.44Å; L764-F775 VanDerWaalsContact CD1-CZ 3.44Å; L764-V798 HydrophobicContact CD2-CG2 3.7Å
765	E	90.7	Very high	92	Very high	115 Å²	115	42.2 Å²	42.2	54%	0.537	20%	0.2	S	C	.	.	H	α-helix	trans	-61.3	-46.1	179.3	-171.7	165.2	-175	0	0	111.9	G761 E762 C767 L768 Q769 Q794	G761-E765 PolarHBondContact O-N 2.83Å; E762-E765 PolarHBondContact O-N 3.34Å; E765-C767 PolarHBondContact O-N 2.83Å; E765-L768 PolarHBondContact O-N 3.39Å; E765-Q769 WeakPolarHBondContact O-CB 3.38Å; E765-Q769 PolarHBondContact O-N 2.88Å; E765-Q794 PolarHBondContact OE2-NE2 3.4Å
766	V	91.4	Very high	92.1	Very high	21 Å²	21	39.8 Å²	39.8	13%	0.127	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-42.4	176	-178.4	0	0	0	0	111.3	V736 A742 E762 S763 L768 Q769 Y770	V736-V766 HydrophobicContact CG1-CB 4.06Å; V736-V766 HydrophobicContact CG1-CG1 3.76Å; A742-V766 HydrophobicContact CB-CG1 4.48Å; E762-V766 PolarHBondContact O-N 2.73Å; S763-V766 PolarHBondContact O-N 2.94Å; V766-L768 PolarHBondContact O-N 2.9Å; V766-Q769 PolarHBondContact O-N 2.77Å; V766-Y770 HydrophobicContact CG1-CD2 3.82Å; V766-Y770 HydrophobicContact CG1-CE2 4Å; V766-Y770 WeakPolarHBondContact O-CD2 3.21Å; V766-Y770 PolarHBondContact O-N 2.86Å; V766-Y770 VanDerWaalsContact O-N 3.17Å
767	C	92.3	Very high	92.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-41.3	176.2	-69.7	0	0	0	0	112	S763 L764 E765 Y771 R772 F775	S763-C767 WeakPolarHBondContact O-CB 3.49Å; S763-C767 PolarHBondContact O-N 3.26Å; S763-C767 PolarHBondContact O-SG 3.4Å; L764-C767 PolarHBondContact O-N 2.74Å; E765-C767 PolarHBondContact O-N 2.83Å; C767-Y771 CarbonylContact O-C 3.59Å; C767-Y771 WeakPolarHBondContact O-CA 3.37Å; C767-Y771 PolarHBondContact O-N 3.43Å; C767-R772 PolarHBondContact O-N 3.43Å; C767-F775 HydrophobicContact CB-CB 4.46Å; C767-F775 HydrophobicContact CB-CD2 4.19Å; C767-F775 HydrophobicContact CB-CG 4.21Å
768	L	91.3	Very high	92	Very high	19 Å²	19	46.7 Å²	46.7	10%	0.099	22%	0.222	C	C	.	.	H	α-helix	trans	-72.7	-27	177.9	-70	175.1	0	0	0	113	L764 E765 V766 R772 F775 L801	L764-L768 HydrophobicContact CD1-CD1 3.83Å; L764-L768 HydrophobicContact CD1-CG 3.95Å; L764-L768 HydrophobicContact CD2-CD1 4.47Å; L764-L768 HydrophobicContact CG-CD1 3.8Å; L764-L768 HydrophobicContact CG-CG 4.29Å; L764-L768 WeakPolarHBondContact O-CB 3.47Å; L764-L768 WeakPolarHBondContact O-CG 3.36Å; L764-L768 PolarHBondContact O-N 3.19Å; E765-L768 PolarHBondContact O-N 3.39Å; V766-L768 PolarHBondContact O-N 2.9Å; L768-R772 HydrophobicContact CD2-CG 4.25Å; L768-R772 WeakPolarHBondContact O-CB 3.47Å; L768-F775 HydrophobicContact CD2-CD1 3.92Å; L768-F775 HydrophobicContact CD2-CE1 4.29Å; L768-L801 HydrophobicContact CD1-CD1 3.54Å; L768-L801 HydrophobicContact CD2-CD1 3.61Å; L768-L801 HydrophobicContact CG-CD1 4.22Å
769	Q	91	Very high	92	Very high	130 Å²	130	46.7 Å²	46.7	61%	0.607	22%	0.222	S	C	*	.	H	α-helix	trans	-72.4	-45.8	176.8	-172.9	179.4	10.8	0	0	111.7	E765 V766	E765-Q769 WeakPolarHBondContact O-CB 3.38Å; E765-Q769 PolarHBondContact O-N 2.88Å; V766-Q769 PolarHBondContact O-N 2.77Å
770	Y	91.6	Very high	91.9	Very high	102 Å²	102	47.4 Å²	47.4	40%	0.4	23%	0.226	S	C	.	.	H	α-helix	trans	-103.5	-31.7	-171.7	-61.5	-68.5	0	0	0	115	R739 V766	R739-Y770 HydrophobicContact CB-CD1 4.36Å; R739-Y770 HydrophobicContact CB-CD2 4.06Å; R739-Y770 HydrophobicContact CB-CE2 4.3Å; R739-Y770 HydrophobicContact CB-CG 4.1Å; R739-Y770 HydrophobicContact CG-CD1 4.14Å; R739-Y770 HydrophobicContact CG-CD2 4.34Å; R739-Y770 HydrophobicContact CG-CG 3.91Å; V766-Y770 HydrophobicContact CG1-CD2 3.82Å; V766-Y770 HydrophobicContact CG1-CE2 4Å; V766-Y770 WeakPolarHBondContact O-CD2 3.21Å; V766-Y770 PolarHBondContact O-N 2.86Å; V766-Y770 VanDerWaalsContact O-N 3.17Å
771	Y	92.9	Very high	91.8	Very high	31 Å²	31	49.8 Å²	49.8	12%	0.122	25%	0.247	C	C	.	.			trans	-132.6	31.7	-170.6	-65.9	-79.8	0	0	0	113.4	R739 A742 H743 L746 C767 E774 F775	R739-Y771 HydrophobicContact CG-CE2 3.6Å; R739-Y771 PolarHBondContact NE-OH 2.83Å; R739-Y771 WeakPolarHBondContact O-CE2 3.38Å; A742-Y771 HydrophobicContact CB-CD2 3.92Å; A742-Y771 HydrophobicContact CB-CE2 4.16Å; H743-Y771 HydrophobicContact CB-CE2 4.05Å; H743-Y771 AromaticContact ND1-CE1 3.83Å; H743-Y771 AromaticContact ND1-CZ 3.96Å; L746-Y771 HydrophobicContact CD1-CD2 4.3Å; L746-Y771 HydrophobicContact CD1-CG 3.94Å; C767-Y771 CarbonylContact O-C 3.59Å; C767-Y771 WeakPolarHBondContact O-CA 3.37Å; C767-Y771 PolarHBondContact O-N 3.43Å; Y771-E774 VanDerWaalsContact CD1-OE2 3.3Å; Y771-E774 WeakPolarHBondContact CD1-OE2 3.4Å; Y771-E774 PolarHBondContact O-N 2.88Å; Y771-F775 WeakPolarHBondContact O-CB 3.32Å; Y771-F775 PolarHBondContact O-N 2.88Å
772	R	92.5	Very high	91.9	Very high	104 Å²	104	50 Å²	50	39%	0.392	25%	0.248	S	C	.	.	H	α-helix	trans	-43.2	-54.6	-177.8	-176.1	173.3	171	164.8	-0.8	115.7	C767 L768 L776 L801	C767-R772 PolarHBondContact O-N 3.43Å; L768-R772 HydrophobicContact CD2-CG 4.25Å; L768-R772 WeakPolarHBondContact O-CB 3.47Å; R772-L776 HydrophobicContact CG-CD1 3.91Å; R772-L776 WeakPolarHBondContact O-CB 3.36Å; R772-L776 VanDerWaalsContact O-CG 3.25Å; R772-L776 WeakPolarHBondContact O-CG 3.1Å; R772-L776 PolarHBondContact O-N 2.94Å; R772-L776 VanDerWaalsContact O-N 3.09Å; R772-L801 HydrophobicContact CG-CD2 4.46Å
773	P	91.3	Very high	91.8	Very high	86 Å²	86	47.4 Å²	47.4	56%	0.558	24%	0.241	S	C	*	.	H	α-helix	trans	-67	-42.6	-175.7	26	-33.6	0	0	0	112.2	L776 E777	P773-L776 PolarHBondContact O-N 3.27Å; P773-E777 PolarHBondContact O-N 3.45Å
774	E	92.1	Very high	91.8	Very high	67 Å²	67	47.5 Å²	47.5	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-66.3	-42.2	-179.4	-63.8	176.8	-173.1	0	0	111.7	Y771 E777 L778	Y771-E774 VanDerWaalsContact CD1-OE2 3.3Å; Y771-E774 WeakPolarHBondContact CD1-OE2 3.4Å; Y771-E774 PolarHBondContact O-N 2.88Å; E774-E777 PolarHBondContact O-N 3.24Å; E774-L778 WeakPolarHBondContact O-CG 3.15Å; E774-L778 PolarHBondContact O-N 3.16Å; E774-L778 VanDerWaalsContact O-N 3.13Å
775	F	93.7	Very high	91.9	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.035	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-46.9	175.4	171.8	-103.1	0	0	0	111.4	L746 L757 I759 L764 C767 L768 Y771 E777 L778 A779	L746-F775 HydrophobicContact CD2-CB 4.18Å; L746-F775 HydrophobicContact CD2-CD2 3.81Å; L757-F775 HydrophobicContact CD2-CE2 4.04Å; L757-F775 HydrophobicContact CD2-CZ 4.43Å; I759-F775 HydrophobicContact CD1-CE2 3.63Å; I759-F775 HydrophobicContact CD1-CZ 3.91Å; L764-F775 HydrophobicContact CD1-CD1 4.32Å; L764-F775 HydrophobicContact CD1-CE1 3.35Å; L764-F775 HydrophobicContact CD1-CE2 4.47Å; L764-F775 HydrophobicContact CD1-CZ 3.44Å; L764-F775 VanDerWaalsContact CD1-CZ 3.44Å; C767-F775 HydrophobicContact CB-CB 4.46Å; C767-F775 HydrophobicContact CB-CD2 4.19Å; C767-F775 HydrophobicContact CB-CG 4.21Å; L768-F775 HydrophobicContact CD2-CD1 3.92Å; L768-F775 HydrophobicContact CD2-CE1 4.29Å; Y771-F775 WeakPolarHBondContact O-CB 3.32Å; Y771-F775 PolarHBondContact O-N 2.88Å; F775-E777 VanDerWaalsContact C-N 3.33Å; F775-E777 PolarHBondContact O-N 3.43Å; F775-L778 PolarHBondContact O-N 3.08Å; F775-A779 HydrophobicContact CE1-CB 4.24Å; F775-A779 HydrophobicContact CE2-CB 4.29Å; F775-A779 HydrophobicContact CZ-CB 4.06Å; F775-A779 VanDerWaalsContact O-CB 3.23Å; F775-A779 WeakPolarHBondContact O-CB 3.49Å; F775-A779 PolarHBondContact O-N 3.3Å
776	L	93.3	Very high	92.2	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-36.2	-178.9	-71.6	171.2	0	0	0	112.3	R772 P773 T780 L801 H805	R772-L776 HydrophobicContact CG-CD1 3.91Å; R772-L776 WeakPolarHBondContact O-CB 3.36Å; R772-L776 VanDerWaalsContact O-CG 3.25Å; R772-L776 WeakPolarHBondContact O-CG 3.1Å; R772-L776 PolarHBondContact O-N 2.94Å; R772-L776 VanDerWaalsContact O-N 3.09Å; P773-L776 PolarHBondContact O-N 3.27Å; L776-T780 VanDerWaalsContact O-CB 3.27Å; L776-T780 WeakPolarHBondContact O-CB 3.21Å; L776-T780 WeakPolarHBondContact O-CG2 3.46Å; L776-T780 PolarHBondContact O-N 2.88Å; L776-T780 PolarHBondContact O-OG1 2.91Å; L776-L801 HydrophobicContact CD1-CB 4.36Å; L776-L801 HydrophobicContact CD1-CD2 4.19Å; L776-L801 HydrophobicContact CD2-CB 4.07Å; L776-H805 HydrophobicContact CB-CB 4.48Å; L776-H805 HydrophobicContact CD1-CB 3.98Å
777	E	92.8	Very high	92.3	Very high	123 Å²	123	40.9 Å²	40.9	58%	0.575	21%	0.21	S	C	*	.	H	α-helix	trans	-62.1	-48.4	174.4	-173.6	177.9	-173.1	0	0	111.2	P773 E774 F775 T780 A781	P773-E777 PolarHBondContact O-N 3.45Å; E774-E777 PolarHBondContact O-N 3.24Å; F775-E777 VanDerWaalsContact C-N 3.33Å; F775-E777 PolarHBondContact O-N 3.43Å; E777-T780 PolarHBondContact O-OG1 3.21Å; E777-A781 WeakPolarHBondContact O-CB 3.38Å; E777-A781 PolarHBondContact O-N 3.4Å
778	L	92.3	Very high	92.2	Very high	25 Å²	25	40.9 Å²	40.9	13%	0.131	21%	0.21	C	C	.	.	H	α-helix	trans	-66.6	-46.7	178.4	-69.4	174.3	0	0	0	112.5	L746 F749 R750 E774 F775 T780 A781 S782	L746-L778 HydrophobicContact CB-CD1 4.28Å; L746-L778 HydrophobicContact CD2-CD1 4.19Å; F749-L778 HydrophobicContact CD1-CB 3.87Å; F749-L778 HydrophobicContact CD1-CD1 4.31Å; F749-L778 HydrophobicContact CE1-CB 3.91Å; R750-L778 HydrophobicContact CB-CD1 4.34Å; R750-L778 HydrophobicContact CB-CD2 3.98Å; R750-L778 HydrophobicContact CG-CD2 4.05Å; E774-L778 WeakPolarHBondContact O-CG 3.15Å; E774-L778 PolarHBondContact O-N 3.16Å; E774-L778 VanDerWaalsContact O-N 3.13Å; F775-L778 PolarHBondContact O-N 3.08Å; L778-T780 PolarHBondContact O-N 3.42Å; L778-A781 PolarHBondContact O-N 3.12Å; L778-S782 PolarHBondContact O-N 2.97Å; L778-S782 VanDerWaalsContact O-N 3.11Å
779	A	93.2	Very high	92	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-40.3	-179.1	0	0	0	0	0	111.5	W704 L757 F775 S782 V785	W704-A779 HydrophobicContact CH2-CB 3.88Å; W704-A779 HydrophobicContact CZ2-CB 4.35Å; W704-A779 WeakPolarHBondContact CZ2-O 3.44Å; L757-A779 HydrophobicContact CD2-CB 3.84Å; F775-A779 HydrophobicContact CE1-CB 4.24Å; F775-A779 HydrophobicContact CE2-CB 4.29Å; F775-A779 HydrophobicContact CZ-CB 4.06Å; F775-A779 VanDerWaalsContact O-CB 3.23Å; F775-A779 WeakPolarHBondContact O-CB 3.49Å; F775-A779 PolarHBondContact O-N 3.3Å; A779-S782 WeakPolarHBondContact O-CB 3.49Å; A779-S782 PolarHBondContact O-N 2.59Å; A779-V785 WeakPolarHBondContact O-CG2 2.93Å
780	T	92.2	Very high	91.7	Very high	15 Å²	15	40.5 Å²	40.5	9%	0.092	20%	0.202	C	C	.	.	H	α-helix	trans	-74.5	-24.6	175.5	62.7	0	0	0	0	112.7	R702 W704 L776 E777 L778 S782 T806	R702-T780 PolarHBondContact NH1-O 3.33Å; R702-T780 PolarHBondContact NH2-O 3.29Å; W704-T780 HydrophobicContact CH2-CG2 4.29Å; W704-T780 HydrophobicContact CZ2-CG2 4.17Å; L776-T780 VanDerWaalsContact O-CB 3.27Å; L776-T780 WeakPolarHBondContact O-CB 3.21Å; L776-T780 WeakPolarHBondContact O-CG2 3.46Å; L776-T780 PolarHBondContact O-N 2.88Å; L776-T780 PolarHBondContact O-OG1 2.91Å; E777-T780 PolarHBondContact O-OG1 3.21Å; L778-T780 PolarHBondContact O-N 3.42Å; T780-S782 VanDerWaalsContact C-N 3.25Å; T780-T806 HydrophobicContact CG2-CG2 3.79Å
781	A	90.4	Very high	91.3	Very high	71 Å²	71	37.6 Å²	37.6	59%	0.587	20%	0.197	S	C	*	.	H	α-helix	trans	-70.3	-25.1	169.7	0	0	0	0	0	112.4	E777 L778	E777-A781 WeakPolarHBondContact O-CB 3.38Å; E777-A781 PolarHBondContact O-N 3.4Å; L778-A781 PolarHBondContact O-N 3.12Å
782	S	91.1	Very high	90.8	Very high	5 Å²	5	36.9 Å²	36.9	4%	0.035	20%	0.196	C	C	.	.	S	Bend	trans	-61.3	139.2	178.5	-171	0	0	0	0	112.4	H755 L778 A779 T780 A784	H755-S782 PolarHBondContact O-OG 2.86Å; H755-S782 VanDerWaalsContact O-OG 3.11Å; L778-S782 PolarHBondContact O-N 2.97Å; L778-S782 VanDerWaalsContact O-N 3.11Å; A779-S782 WeakPolarHBondContact O-CB 3.49Å; A779-S782 PolarHBondContact O-N 2.59Å; T780-S782 VanDerWaalsContact C-N 3.25Å; S782-A784 PolarHBondContact OG-O 3.49Å
783	P	87.8	Confident	90.3	Very high	61 Å²	61	34.8 Å²	34.8	40%	0.396	20%	0.195	S	C	.	.	S	Bend	trans	-62.4	-36.9	173	23.3	-35.2	0	0	0	113.9
784	A	91.6	Very high	90.2	Very high	2 Å²	2	32 Å²	32	2%	0.017	18%	0.175	C	C	.	.			trans	-145.9	147.5	177.5	0	0	0	0	0	110	L723 I724 A756 L757 S782	L723-A784 HydrophobicContact CD1-CB 4.48Å; L723-A784 HydrophobicContact CG-CB 4.3Å; I724-A784 HydrophobicContact CG1-CB 4.4Å; A756-A784 WeakPolarHBondContact CA-O 3.36Å; A756-A784 HydrophobicContact CB-CB 4.2Å; L757-A784 PolarHBondContact N-O 3.04Å; S782-A784 PolarHBondContact OG-O 3.49Å
785	V	95.2	Very high	90.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	133	177.4	-177.1	0	0	0	0	108.7	W704 M705 L757 A779	W704-V785 CarbonylContact C-O 3.48Å; W704-V785 WeakPolarHBondContact CA-O 3.47Å; W704-V785 HydrophobicContact CD2-CB 3.65Å; W704-V785 HydrophobicContact CD2-CG1 4.29Å; W704-V785 HydrophobicContact CD2-CG2 3.93Å; W704-V785 VanDerWaalsContact CE2-CG2 3.46Å; W704-V785 HydrophobicContact CE3-CB 3.99Å; W704-V785 HydrophobicContact CE3-CG1 4.11Å; W704-V785 HydrophobicContact CE3-CG2 4.4Å; W704-V785 HydrophobicContact CG-CB 3.91Å; W704-V785 HydrophobicContact CG-CG2 4.42Å; W704-V785 HydrophobicContact CH2-CG2 4.13Å; W704-V785 HydrophobicContact CZ2-CB 4.23Å; W704-V785 HydrophobicContact CZ2-CG2 3.59Å; W704-V785 HydrophobicContact CZ3-CB 4.42Å; W704-V785 HydrophobicContact CZ3-CG1 4.29Å; W704-V785 HydrophobicContact CZ3-CG2 4.49Å; M705-V785 PolarHBondContact N-O 3.3Å; L757-V785 HydrophobicContact CB-CG1 4.32Å; L757-V785 HydrophobicContact CB-CG2 4.18Å; L757-V785 HydrophobicContact CD2-CG1 4.13Å; L757-V785 HydrophobicContact CD2-CG2 4.38Å; L757-V785 HydrophobicContact CG-CG1 4.39Å; L757-V785 CarbonylContact O-C 3.34Å; L757-V785 WeakPolarHBondContact O-CA 3.21Å; A779-V785 WeakPolarHBondContact O-CG2 2.93Å
786	V	95.8	Very high	89.9	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	116.4	175.2	-176.8	0	0	0	0	107.9	M705 A714 A718 L723 I724 L757 V758 I759	M705-V786 HydrophobicContact CB-CG1 4.35Å; M705-V786 HydrophobicContact CB-CG2 4.3Å; M705-V786 HydrophobicContact CG-CG1 4.44Å; M705-V786 CarbonylContact O-C 3.56Å; M705-V786 WeakPolarHBondContact O-CA 3.36Å; M705-V786 HydrophobicContact SD-CG1 3.98Å; A714-V786 HydrophobicContact CB-CG1 3.92Å; A718-V786 HydrophobicContact CB-CG2 3.84Å; L723-V786 HydrophobicContact CD2-CG2 4.24Å; I724-V786 HydrophobicContact CD1-CG2 4.25Å; L757-V786 PolarHBondContact O-N 2.79Å; V758-V786 VanDerWaalsContact CA-O 3.31Å; V758-V786 WeakPolarHBondContact CA-O 3.48Å; V758-V786 HydrophobicContact CG1-CB 4.5Å; V758-V786 HydrophobicContact CG2-CB 4.2Å; I759-V786 PolarHBondContact N-O 3.47Å
787	C	94.3	Very high	89.8	Confident	2 Å²	2	33 Å²	33	1%	0.014	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.3	171.6	-53.9	0	0	0	0	108.6	M705 L706 T707 I759 C790	M705-C787 PolarHBondContact O-N 3.3Å; L706-C787 HydrophobicContact CD2-CB 3.55Å; L706-C787 WeakPolarHBondContact CD2-SG 3.47Å; T707-C787 PolarHBondContact N-O 2.97Å; I759-C787 HydrophobicContact CG2-CB 4.28Å; I759-C787 CarbonylContact O-C 3.53Å; I759-C787 VanDerWaalsContact O-CA 3.3Å; I759-C787 WeakPolarHBondContact O-CA 3.31Å; C787-C790 WeakPolarHBondContact CB-SG 3.32Å
788	C	90.8	Very high	89.9	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	159.1	-179.6	58.6	0	0	0	0	111.4	T707 D709 A714 I759 S760 G761 C790	T707-C788 HydrophobicContact CG2-CB 4.48Å; T707-C788 CarbonylContact O-C 3.53Å; T707-C788 WeakPolarHBondContact O-CA 3.29Å; D709-C788 WeakPolarHBondContact O-CB 3.43Å; A714-C788 HydrophobicContact CB-CB 4.09Å; I759-C788 PolarHBondContact O-N 3.01Å; I759-C788 PolarHBondContact O-SG 2.86Å; I759-C788 VanDerWaalsContact O-SG 3.42Å; S760-C788 CarbonylContact C-O 3.56Å; S760-C788 WeakPolarHBondContact CA-O 3.27Å; G761-C788 PolarHBondContact N-O 3.45Å; C788-C790 PolarHBondContact O-N 3.21Å
789	R	86	Confident	90	Very high	136 Å²	136	26.3 Å²	26.3	51%	0.513	15%	0.15	S	C	.	.	S	Bend	trans	49.5	40.5	-172.9	-59.7	-170.2	176.9	-172.9	-0.6	113.3	T707 G708 D709	T707-R789 PolarHBondContact O-N 2.97Å; G708-R789 WeakPolarHBondContact O-CA 3.36Å; D709-R789 PolarHBondContact O-N 3.12Å
790	C	85.7	Confident	90	Very high	5 Å²	5	27.9 Å²	27.9	3%	0.034	16%	0.163	C	C	.	.			trans	-84.7	128.4	176.9	-67	0	0	0	0	110.9	T707 C787 C788 K795	T707-C790 PolarHBondContact O-N 2.93Å; C787-C790 WeakPolarHBondContact CB-SG 3.32Å; C788-C790 PolarHBondContact O-N 3.21Å; C790-K795 HydrophobicContact CB-CG 3.91Å
791	S	83.1	Confident	90	Very high	41 Å²	41	27.5 Å²	27.5	29%	0.287	16%	0.16	S	C	.	.			trans	-69.4	158.4	167.2	72.9	0	0	0	0	111.2	T793 Q794 K795	S791-T793 PolarHBondContact O-N 2.97Å; S791-T793 PolarHBondContact OG-OG1 2.9Å; S791-Q794 VanDerWaalsContact N-OE1 3.11Å; S791-Q794 PolarHBondContact O-N 2.92Å; S791-Q794 VanDerWaalsContact O-N 3.11Å; S791-Q794 WeakPolarHBondContact OG-CB 3.47Å; S791-Q794 VanDerWaalsContact OG-CG 3.28Å; S791-Q794 WeakPolarHBondContact OG-CG 3.47Å; S791-Q794 PolarHBondContact OG-N 3.25Å; S791-K795 WeakPolarHBondContact O-CG 3.37Å; S791-K795 PolarHBondContact O-N 2.96Å
792	P	81.8	Confident	90.2	Very high	16 Å²	16	24.2 Å²	24.2	10%	0.104	13%	0.132	C	C	.	.	H	α-helix	trans	-52.1	-39.5	174.1	-30.2	37.1	0	0	0	113.4	K795 A796 N818 S821	P792-K795 PolarHBondContact O-N 3.34Å; P792-A796 PolarHBondContact O-N 3.17Å; P792-N818 WeakPolarHBondContact CB-O 3.32Å; P792-N818 HydrophobicContact CG-CB 4.16Å; P792-S821 PolarHBondContact O-OG 2.75Å
793	T	82.8	Confident	90.3	Very high	61 Å²	61	25.5 Å²	25.5	37%	0.374	14%	0.138	S	C	.	.	H	α-helix	trans	-69.4	-40.5	179.4	52.6	0	0	0	0	111.9	S791 A796 Q797	S791-T793 PolarHBondContact O-N 2.97Å; S791-T793 PolarHBondContact OG-OG1 2.9Å; T793-A796 PolarHBondContact O-N 3.36Å; T793-Q797 WeakPolarHBondContact O-CB 3.45Å; T793-Q797 PolarHBondContact O-N 2.97Å
794	Q	88.1	Confident	90.5	Very high	27 Å²	27	30.4 Å²	30.4	13%	0.126	15%	0.153	C	C	.	.	H	α-helix	trans	-64	-40.4	174.3	-74.6	174.2	-18.7	0	0	111.6	E765 S791 A796 Q797 V798	E765-Q794 PolarHBondContact OE2-NE2 3.4Å; S791-Q794 VanDerWaalsContact N-OE1 3.11Å; S791-Q794 PolarHBondContact O-N 2.92Å; S791-Q794 VanDerWaalsContact O-N 3.11Å; S791-Q794 WeakPolarHBondContact OG-CB 3.47Å; S791-Q794 VanDerWaalsContact OG-CG 3.28Å; S791-Q794 WeakPolarHBondContact OG-CG 3.47Å; S791-Q794 PolarHBondContact OG-N 3.25Å; Q794-A796 PolarHBondContact O-N 3.36Å; Q794-Q797 WeakPolarHBondContact O-CB 3.41Å; Q794-Q797 PolarHBondContact O-N 3.45Å; Q794-Q797 VanDerWaalsContact O-N 3.16Å; Q794-V798 WeakPolarHBondContact O-CG2 3.37Å; Q794-V798 PolarHBondContact O-N 3.06Å
795	K	90.8	Very high	90.6	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-55.9	-50.1	175	-68.7	-178.8	172.9	-177.5	0	111	D387 L706 C790 S791 P792 Q797 V798 V799 D819 M822	D387-K795 IonicContact OD1-NZ 3.97Å; D387-K795 PolarHBondContact OD1-NZ 2.91Å; L706-K795 HydrophobicContact CB-CG 4.12Å; L706-K795 HydrophobicContact CD1-CB 4.33Å; L706-K795 WeakPolarHBondContact O-CE 3.43Å; C790-K795 HydrophobicContact CB-CG 3.91Å; S791-K795 WeakPolarHBondContact O-CG 3.37Å; S791-K795 PolarHBondContact O-N 2.96Å; P792-K795 PolarHBondContact O-N 3.34Å; K795-Q797 VanDerWaalsContact C-N 3.34Å; K795-Q797 PolarHBondContact O-N 3.01Å; K795-V798 PolarHBondContact O-N 3.27Å; K795-V799 WeakPolarHBondContact O-CG2 3.29Å; K795-V799 PolarHBondContact O-N 3.32Å; K795-D819 IonicContact NZ-OD1 3.67Å; K795-D819 PolarHBondContact NZ-OD1 3.34Å; K795-M822 HydrophobicContact CB-CB 4.02Å; K795-M822 HydrophobicContact CB-CG 4.23Å; K795-M822 HydrophobicContact CB-SD 4.25Å
796	A	90	Very high	90.4	Very high	10 Å²	10	36.2 Å²	36.2	8%	0.083	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-40.1	176.3	0	0	0	0	0	112.5	P792 T793 Q794 V798 V799 A800 Q825	P792-A796 PolarHBondContact O-N 3.17Å; T793-A796 PolarHBondContact O-N 3.36Å; Q794-A796 PolarHBondContact O-N 3.36Å; A796-V798 PolarHBondContact O-N 2.74Å; A796-V799 WeakPolarHBondContact O-CB 3.47Å; A796-V799 PolarHBondContact O-N 3.3Å; A796-A800 PolarHBondContact O-N 2.89Å; A796-Q825 HydrophobicContact CB-CB 4.08Å; A796-Q825 HydrophobicContact CB-CG 4.35Å; A796-Q825 WeakPolarHBondContact O-CG 3.44Å
797	Q	91.4	Very high	90.1	Very high	91 Å²	91	39.4 Å²	39.4	43%	0.425	22%	0.215	S	C	.	.	H	α-helix	trans	-61.5	-43.2	177.1	-171.2	-176.6	-1.1	0	0	112	T793 Q794 K795 V799 A800 L801	T793-Q797 WeakPolarHBondContact O-CB 3.45Å; T793-Q797 PolarHBondContact O-N 2.97Å; Q794-Q797 WeakPolarHBondContact O-CB 3.41Å; Q794-Q797 PolarHBondContact O-N 3.45Å; Q794-Q797 VanDerWaalsContact O-N 3.16Å; K795-Q797 VanDerWaalsContact C-N 3.34Å; K795-Q797 PolarHBondContact O-N 3.01Å; Q797-V799 VanDerWaalsContact C-N 3.33Å; Q797-V799 PolarHBondContact O-N 3.01Å; Q797-A800 PolarHBondContact O-N 3.39Å; Q797-L801 HydrophobicContact CG-CD1 3.95Å; Q797-L801 HydrophobicContact CG-CG 4.36Å; Q797-L801 WeakPolarHBondContact O-CB 3.5Å; Q797-L801 WeakPolarHBondContact O-CD1 3.24Å; Q797-L801 WeakPolarHBondContact O-CG 3.27Å; Q797-L801 PolarHBondContact O-N 3.41Å
798	V	93.6	Very high	90	Very high	8 Å²	8	43.8 Å²	43.8	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-44.7	176.1	172.7	0	0	0	0	111	L385 W704 L706 L764 Q794 K795 A796 A800 L801 I802	L385-V798 HydrophobicContact CD2-CG1 4.12Å; W704-V798 HydrophobicContact CE3-CG1 4.06Å; W704-V798 HydrophobicContact CZ3-CG1 3.98Å; L706-V798 HydrophobicContact CD1-CB 4.1Å; L706-V798 HydrophobicContact CD1-CG1 4.03Å; L706-V798 HydrophobicContact CD2-CG1 4.09Å; L764-V798 HydrophobicContact CD2-CG2 3.7Å; Q794-V798 WeakPolarHBondContact O-CG2 3.37Å; Q794-V798 PolarHBondContact O-N 3.06Å; K795-V798 PolarHBondContact O-N 3.27Å; A796-V798 PolarHBondContact O-N 2.74Å; V798-A800 PolarHBondContact O-N 2.72Å; V798-L801 WeakPolarHBondContact O-CB 3.27Å; V798-L801 PolarHBondContact O-N 2.97Å; V798-I802 HydrophobicContact CG1-CD1 4.05Å; V798-I802 WeakPolarHBondContact O-CG1 3.14Å; V798-I802 PolarHBondContact O-N 2.97Å
799	V	94.2	Very high	90.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.3	-50.1	175.4	177.8	0	0	0	0	111	L385 K795 A796 Q797 L801 I802 Q803 M822 Q825 A826	L385-V799 HydrophobicContact CD1-CG2 4.04Å; L385-V799 HydrophobicContact CD2-CG2 3.75Å; L385-V799 HydrophobicContact CG-CG2 4.34Å; K795-V799 WeakPolarHBondContact O-CG2 3.29Å; K795-V799 PolarHBondContact O-N 3.32Å; A796-V799 WeakPolarHBondContact O-CB 3.47Å; A796-V799 PolarHBondContact O-N 3.3Å; Q797-V799 VanDerWaalsContact C-N 3.33Å; Q797-V799 PolarHBondContact O-N 3.01Å; V799-L801 VanDerWaalsContact C-N 3.29Å; V799-L801 PolarHBondContact O-N 3.42Å; V799-I802 PolarHBondContact O-N 3.32Å; V799-Q803 WeakPolarHBondContact O-CG 3.43Å; V799-Q803 PolarHBondContact O-N 3.48Å; V799-Q803 VanDerWaalsContact O-N 3.07Å; V799-M822 HydrophobicContact CG2-CG 3.55Å; V799-Q825 HydrophobicContact CB-CG 4.19Å; V799-Q825 HydrophobicContact CG1-CB 4.45Å; V799-Q825 HydrophobicContact CG1-CG 4.17Å; V799-A826 HydrophobicContact CG1-CB 4.01Å
800	A	92.9	Very high	90.5	Very high	33 Å²	33	39.7 Å²	39.7	27%	0.273	22%	0.218	S	C	.	.	H	α-helix	trans	-62	-36.5	179.8	0	0	0	0	0	112.6	A796 Q797 V798 K804 Q825	A796-A800 PolarHBondContact O-N 2.89Å; Q797-A800 PolarHBondContact O-N 3.39Å; V798-A800 PolarHBondContact O-N 2.72Å; A800-K804 WeakPolarHBondContact O-CB 3.44Å; A800-K804 PolarHBondContact O-N 3.35Å; A800-Q825 HydrophobicContact CB-CG 4.13Å
801	L	93.9	Very high	91.1	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.037	22%	0.217	C	C	.	.	H	α-helix	trans	-65.9	-45.2	177.9	-72.8	165.4	0	0	0	112	L768 R772 L776 Q797 V798 V799 K804 H805	L768-L801 HydrophobicContact CD1-CD1 3.54Å; L768-L801 HydrophobicContact CD2-CD1 3.61Å; L768-L801 HydrophobicContact CG-CD1 4.22Å; R772-L801 HydrophobicContact CG-CD2 4.46Å; L776-L801 HydrophobicContact CD1-CB 4.36Å; L776-L801 HydrophobicContact CD1-CD2 4.19Å; L776-L801 HydrophobicContact CD2-CB 4.07Å; Q797-L801 HydrophobicContact CG-CD1 3.95Å; Q797-L801 HydrophobicContact CG-CG 4.36Å; Q797-L801 WeakPolarHBondContact O-CB 3.5Å; Q797-L801 WeakPolarHBondContact O-CD1 3.24Å; Q797-L801 WeakPolarHBondContact O-CG 3.27Å; Q797-L801 PolarHBondContact O-N 3.41Å; V798-L801 WeakPolarHBondContact O-CB 3.27Å; V798-L801 PolarHBondContact O-N 2.97Å; V799-L801 VanDerWaalsContact C-N 3.29Å; V799-L801 PolarHBondContact O-N 3.42Å; L801-K804 PolarHBondContact O-N 3.33Å; L801-H805 VanDerWaalsContact O-CB 3.27Å; L801-H805 WeakPolarHBondContact O-CB 3.06Å; L801-H805 PolarHBondContact O-N 2.92Å
802	I	94.1	Very high	91.7	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-63	-45.2	177.5	-64.9	170.1	0	0	0	110.3	Y383 L385 W704 V798 V799 K804 H805 T806 T810	Y383-I802 HydrophobicContact CD1-CG2 4.19Å; Y383-I802 HydrophobicContact CD2-CG2 3.64Å; Y383-I802 HydrophobicContact CE1-CG2 4.35Å; Y383-I802 HydrophobicContact CE2-CG2 3.79Å; Y383-I802 HydrophobicContact CG-CG2 3.86Å; L385-I802 HydrophobicContact CD2-CD1 3.85Å; W704-I802 HydrophobicContact CD2-CD1 3.99Å; W704-I802 HydrophobicContact CE3-CD1 3.5Å; W704-I802 HydrophobicContact CE3-CG1 4.47Å; W704-I802 HydrophobicContact CH2-CD1 3.92Å; W704-I802 HydrophobicContact CH2-CG1 4.09Å; W704-I802 HydrophobicContact CZ2-CD1 4.36Å; W704-I802 HydrophobicContact CZ3-CD1 3.47Å; W704-I802 VanDerWaalsContact CZ3-CD1 3.47Å; W704-I802 HydrophobicContact CZ3-CG1 3.96Å; V798-I802 HydrophobicContact CG1-CD1 4.05Å; V798-I802 WeakPolarHBondContact O-CG1 3.14Å; V798-I802 PolarHBondContact O-N 2.97Å; V799-I802 PolarHBondContact O-N 3.32Å; I802-K804 PolarHBondContact O-N 3.43Å; I802-H805 PolarHBondContact O-N 3.42Å; I802-T806 HydrophobicContact CG2-CG2 4.31Å; I802-T806 WeakPolarHBondContact O-CB 3.35Å; I802-T806 PolarHBondContact O-N 3.39Å; I802-T806 PolarHBondContact O-OG1 2.92Å; I802-T810 HydrophobicContact CB-CG2 4.32Å; I802-T810 HydrophobicContact CG2-CG2 3.87Å
803	Q	93.1	Very high	92.3	Very high	32 Å²	32	36.8 Å²	36.8	15%	0.15	20%	0.198	C	C	.	.	H	α-helix	trans	-56.6	-50.4	176.7	-71.9	167.8	-11.9	0	0	111.1	V799 G807 T810 Q825 D827	V799-Q803 WeakPolarHBondContact O-CG 3.43Å; V799-Q803 PolarHBondContact O-N 3.48Å; V799-Q803 VanDerWaalsContact O-N 3.07Å; Q803-G807 VanDerWaalsContact O-CA 3.29Å; Q803-G807 WeakPolarHBondContact O-CA 3.26Å; Q803-G807 PolarHBondContact O-N 3.18Å; Q803-T810 HydrophobicContact CG-CG2 3.73Å; Q803-T810 WeakPolarHBondContact CG-OG1 3.33Å; Q803-T810 PolarHBondContact NE2-OG1 2.95Å; Q803-Q825 PolarHBondContact NE2-O 3.12Å; Q803-D827 PolarHBondContact NE2-OD2 3.47Å
804	K	91.9	Very high	92.8	Very high	165 Å²	165	33.9 Å²	33.9	72%	0.717	18%	0.18	S	C	*	.	H	α-helix	trans	-68.9	-39.5	-177	-171.9	176.6	-179	177.3	0	113	A800 L801 I802	A800-K804 WeakPolarHBondContact O-CB 3.44Å; A800-K804 PolarHBondContact O-N 3.35Å; L801-K804 PolarHBondContact O-N 3.33Å; I802-K804 PolarHBondContact O-N 3.43Å
805	H	92.6	Very high	92.8	Very high	86 Å²	86	32.7 Å²	32.7	40%	0.398	18%	0.175	S	C	.	.	H	α-helix	trans	-79.4	-41.8	-175.8	-176.3	81.2	0	0	0	112.6	L776 L801 I802	L776-H805 HydrophobicContact CB-CB 4.48Å; L776-H805 HydrophobicContact CD1-CB 3.98Å; L801-H805 VanDerWaalsContact O-CB 3.27Å; L801-H805 WeakPolarHBondContact O-CB 3.06Å; L801-H805 PolarHBondContact O-N 2.92Å; I802-H805 PolarHBondContact O-N 3.42Å
806	T	91.4	Very high	92.3	Very high	38 Å²	38	32.6 Å²	32.6	23%	0.233	17%	0.174	C	C	.	.	H	α-helix	trans	-93.9	-22	-175.1	69.3	0	0	0	0	113.6	Y383 T780 I802 K808	Y383-T806 HydrophobicContact CE2-CG2 4.05Å; T780-T806 HydrophobicContact CG2-CG2 3.79Å; I802-T806 HydrophobicContact CG2-CG2 4.31Å; I802-T806 WeakPolarHBondContact O-CB 3.35Å; I802-T806 PolarHBondContact O-N 3.39Å; I802-T806 PolarHBondContact O-OG1 2.92Å; T806-K808 PolarHBondContact O-N 3.04Å; T806-K808 VanDerWaalsContact O-N 3.14Å; T806-K808 WeakPolarHBondContact OG1-CB 3.26Å; T806-K808 PolarHBondContact OG1-N 3.22Å
807	G	89.8	Confident	91.5	Very high	66 Å²	66	32.3 Å²	32.3	68%	0.68	17%	0.173	S	C	*	.			trans	64	8.4	-169.8	0	0	0	0	0	114.1	Q803	Q803-G807 VanDerWaalsContact O-CA 3.29Å; Q803-G807 WeakPolarHBondContact O-CA 3.26Å; Q803-G807 PolarHBondContact O-N 3.18Å
808	K	91.5	Very high	90.9	Very high	94 Å²	94	28.3 Å²	28.3	41%	0.409	15%	0.154	S	C	.	.			trans	-92.2	156.9	-178.8	-65.9	-179.1	176.9	176.7	0	111.2	Y383 T806	Y383-K808 HydrophobicContact CD2-CB 4.2Å; Y383-K808 HydrophobicContact CE2-CB 4.16Å; Y383-K808 HydrophobicContact CE2-CD 3.92Å; T806-K808 PolarHBondContact O-N 3.04Å; T806-K808 VanDerWaalsContact O-N 3.14Å; T806-K808 WeakPolarHBondContact OG1-CB 3.26Å; T806-K808 PolarHBondContact OG1-N 3.22Å
809	R	93.3	Very high	90.6	Very high	51 Å²	51	27.9 Å²	27.9	19%	0.192	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	138.6	179.1	-63.4	-58.4	-169	-156.9	-6.4	112.5	L291 E377 R380 I381 S382 Y383 D827	L291-R809 VanDerWaalsContact CA-NH2 3.3Å; L291-R809 VanDerWaalsContact CD1-NH2 3.28Å; E377-R809 WeakPolarHBondContact OE2-CD 3.23Å; E377-R809 IonicContact OE2-CZ 2.82Å; E377-R809 IonicContact OE2-NE 3.85Å; E377-R809 PolarHBondContact OE2-NE 3.08Å; E377-R809 IonicContact OE2-NH2 2.76Å; R380-R809 HydrophobicContact CB-CG 4.38Å; I381-R809 HydrophobicContact CD1-CB 4.1Å; S382-R809 PolarHBondContact N-O 3.49Å; Y383-R809 PolarHBondContact N-O 2.91Å; R809-D827 WeakPolarHBondContact CA-OD2 3.15Å; R809-D827 VanDerWaalsContact CD-CG 3.44Å; R809-D827 WeakPolarHBondContact CD-OD1 3.46Å; R809-D827 IonicContact CZ-OD1 3.56Å; R809-D827 IonicContact NE-OD1 3.94Å; R809-D827 IonicContact NH1-OD1 3.89Å; R809-D827 PolarHBondContact NH1-OD1 3.39Å
810	T	95.6	Very high	90.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.3	-175.1	54.6	0	0	0	0	110.5	Y383 L385 I802 Q803 D827 A828	Y383-T810 CarbonylContact O-C 3.57Å; Y383-T810 WeakPolarHBondContact O-CA 3.24Å; L385-T810 HydrophobicContact CD1-CG2 4.24Å; I802-T810 HydrophobicContact CB-CG2 4.32Å; I802-T810 HydrophobicContact CG2-CG2 3.87Å; Q803-T810 HydrophobicContact CG-CG2 3.73Å; Q803-T810 WeakPolarHBondContact CG-OG1 3.33Å; Q803-T810 PolarHBondContact NE2-OG1 2.95Å; T810-D827 PolarHBondContact N-OD2 2.86Å; T810-D827 WeakPolarHBondContact O-CB 3.33Å; T810-D827 PolarHBondContact O-N 3.4Å; T810-D827 PolarHBondContact OG1-N 3.03Å; T810-D827 PolarHBondContact OG1-OD2 3Å; T810-A828 PolarHBondContact O-N 3.23Å; T810-A828 VanDerWaalsContact O-N 3.16Å
811	C	96.3	Very high	89.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.9	170.2	-177.7	0	0	0	0	108.2	I381 Y383 V384 L385 A828	I381-C811 HydrophobicContact CB-CB 4.38Å; I381-C811 HydrophobicContact CD1-CB 3.95Å; I381-C811 HydrophobicContact CG1-CB 4.01Å; I381-C811 HydrophobicContact CG2-CB 3.48Å; I381-C811 VanDerWaalsContact CG2-CB 3.48Å; Y383-C811 PolarHBondContact O-N 3.38Å; V384-C811 CarbonylContact C-O 3.55Å; V384-C811 WeakPolarHBondContact CA-O 3.43Å; V384-C811 HydrophobicContact CG2-CB 4.11Å; L385-C811 PolarHBondContact N-O 3.13Å; C811-A828 CarbonylContact C-O 3.49Å; C811-A828 VanDerWaalsContact CA-O 3.22Å; C811-A828 WeakPolarHBondContact CA-O 3.4Å
812	A	96.1	Very high	89.6	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.2	173.4	0	0	0	0	0	110.6	L385 M822 I823 A826 A828 V830	L385-A812 CarbonylContact O-C 3.47Å; L385-A812 VanDerWaalsContact O-CA 3.27Å; L385-A812 WeakPolarHBondContact O-CA 3.33Å; A812-M822 HydrophobicContact CB-CE 4.21Å; A812-M822 HydrophobicContact CB-CG 3.78Å; A812-M822 WeakPolarHBondContact CB-O 3.49Å; A812-M822 HydrophobicContact CB-SD 4.32Å; A812-I823 HydrophobicContact CB-CG1 4.41Å; A812-A826 HydrophobicContact CB-CB 3.44Å; A812-A826 VanDerWaalsContact CB-CB 3.44Å; A812-A828 PolarHBondContact N-O 3.26Å; A812-V830 PolarHBondContact O-N 3.47Å
813	V	95.8	Very high	89.5	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.2	-177.7	-163.7	0	0	0	0	109.3	V384 L385 T386 D387 T391 M822 V830 I832 F851 I854	V384-V813 HydrophobicContact CG1-CG2 4Å; L385-V813 PolarHBondContact O-N 3.47Å; T386-V813 WeakPolarHBondContact CA-O 3.43Å; D387-V813 PolarHBondContact N-O 2.95Å; T391-V813 HydrophobicContact CG2-CB 4.37Å; T391-V813 HydrophobicContact CG2-CG1 3.91Å; V813-M822 WeakPolarHBondContact O-CE 3.49Å; V813-V830 VanDerWaalsContact CA-O 3.29Å; V813-V830 WeakPolarHBondContact CA-O 3.35Å; V813-V830 HydrophobicContact CG1-CB 4.37Å; V813-V830 HydrophobicContact CG1-CG1 4.33Å; V813-V830 HydrophobicContact CG2-CB 4.32Å; V813-I832 HydrophobicContact CG1-CD1 3.85Å; V813-I832 HydrophobicContact CG1-CG1 4Å; V813-F851 HydrophobicContact CG1-CD2 4.17Å; V813-F851 HydrophobicContact CG1-CE2 4.38Å; V813-I854 HydrophobicContact CG2-CD1 3.29Å
814	G	92.6	Very high	89.3	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	163.4	178.9	0	0	0	0	0	111.5	T391 D819 V830 G831 I832 A840	T391-G814 VanDerWaalsContact OG1-CA 3.32Å; T391-G814 WeakPolarHBondContact OG1-CA 3.37Å; G814-D819 VanDerWaalsContact CA-OD2 3.25Å; G814-D819 WeakPolarHBondContact CA-OD2 3.43Å; G814-V830 PolarHBondContact N-O 2.98Å; G814-G831 CarbonylContact O-C 3.51Å; G814-G831 VanDerWaalsContact O-CA 3.3Å; G814-G831 WeakPolarHBondContact O-CA 3.32Å; G814-I832 PolarHBondContact O-N 3.02Å; G814-A840 WeakPolarHBondContact O-CB 3.37Å
815	D	88	Confident	89.2	Confident	2 Å²	2	20.6 Å²	20.6	1%	0.011	12%	0.115	C	C	.	.	S	Bend	trans	-119.4	-27.9	179.9	73.1	-50.6	0	0	0	113	G390 T391 I832 A840	G390-D815 WeakPolarHBondContact CA-OD2 3.22Å; T391-D815 PolarHBondContact OG1-N 3.46Å; T391-D815 PolarHBondContact OG1-OD1 3.46Å; D815-I832 HydrophobicContact CB-CB 3.95Å; D815-I832 HydrophobicContact CB-CG2 4.45Å; D815-A840 WeakPolarHBondContact O-CB 3.4Å
816	G	80.4	Confident	89.3	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	-92.7	165.1	-177.8	0	0	0	0	0	116.3	N818 D819 A840	G816-N818 WeakPolarHBondContact CA-OD1 3.43Å; G816-N818 PolarHBondContact O-N 3.26Å; G816-N818 PolarHBondContact O-OD1 3.14Å; G816-D819 PolarHBondContact O-N 3.48Å; G816-D819 VanDerWaalsContact O-N 3.16Å; G816-A840 WeakPolarHBondContact O-CB 3.23Å
817	G	72.5	Confident	89.4	Confident	5 Å²	5	15.7 Å²	15.7	5%	0.052	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-57.3	-31.1	173.1	0	0	0	0	0	114	Q189 D819 V820	Q189-G817 CarbonylContact O-C 3.51Å; G817-D819 PolarHBondContact O-N 2.93Å; G817-V820 WeakPolarHBondContact O-CB 3.42Å; G817-V820 WeakPolarHBondContact O-CG2 3.48Å; G817-V820 PolarHBondContact O-N 3.35Å
818	N	79.5	Confident	89.7	Confident	6 Å²	6	12.5 Å²	12.5	3%	0.032	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	-61.8	-22.8	176.2	64.3	-16.1	0	0	0	114	Q189 G192 P792 G816	Q189-N818 PolarHBondContact O-N 2.97Å; G192-N818 WeakPolarHBondContact CA-ND2 3.39Å; P792-N818 WeakPolarHBondContact CB-O 3.32Å; P792-N818 HydrophobicContact CG-CB 4.16Å; G816-N818 WeakPolarHBondContact CA-OD1 3.43Å; G816-N818 PolarHBondContact O-N 3.26Å; G816-N818 PolarHBondContact O-OD1 3.14Å
819	D	86.4	Confident	89.8	Confident	0 Å²	0	8 Å²	8	0%	0	4%	0.038	C	C	.	.	G	3₁₀ helix	trans	-96.8	-9.2	-177.9	-65.1	-37.8	0	0	0	113.3	D387 K795 G814 G816 G817 S821 M822 I823	D387-D819 WeakPolarHBondContact CB-OD2 3.33Å; K795-D819 IonicContact NZ-OD1 3.67Å; K795-D819 PolarHBondContact NZ-OD1 3.34Å; G814-D819 VanDerWaalsContact CA-OD2 3.25Å; G814-D819 WeakPolarHBondContact CA-OD2 3.43Å; G816-D819 PolarHBondContact O-N 3.48Å; G816-D819 VanDerWaalsContact O-N 3.16Å; G817-D819 PolarHBondContact O-N 2.93Å; D819-S821 VanDerWaalsContact C-N 3.25Å; D819-S821 PolarHBondContact O-N 2.92Å; D819-M822 HydrophobicContact CB-CE 4.14Å; D819-M822 WeakPolarHBondContact O-CB 3.38Å; D819-M822 PolarHBondContact O-N 3.5Å; D819-I823 HydrophobicContact CB-CD1 4.11Å; D819-I823 HydrophobicContact CB-CG1 4.47Å; D819-I823 WeakPolarHBondContact O-CB 3.37Å; D819-I823 VanDerWaalsContact O-CG1 3.3Å; D819-I823 WeakPolarHBondContact O-CG1 3.34Å; D819-I823 PolarHBondContact O-N 3.06Å
820	V	84.2	Confident	89.9	Confident	9 Å²	9	5.6 Å²	5.6	6%	0.055	3%	0.029	C	C	.	.	H	α-helix	trans	-55.3	-42.8	-177	169.3	0	0	0	0	111.3	G817 I823 Q824 A843	G817-V820 WeakPolarHBondContact O-CB 3.42Å; G817-V820 WeakPolarHBondContact O-CG2 3.48Å; G817-V820 PolarHBondContact O-N 3.35Å; V820-I823 PolarHBondContact O-N 3.28Å; V820-Q824 HydrophobicContact CG1-CG 4.35Å; V820-Q824 WeakPolarHBondContact O-CB 3.27Å; V820-Q824 VanDerWaalsContact O-CG 3.24Å; V820-Q824 WeakPolarHBondContact O-CG 3.38Å; V820-Q824 PolarHBondContact O-N 3.11Å; V820-A843 HydrophobicContact CB-CB 4.35Å; V820-A843 HydrophobicContact CG1-CB 3.69Å; V820-A843 HydrophobicContact CG2-CB 3.99Å
821	S	86.3	Confident	89.8	Confident	1 Å²	1	5.6 Å²	5.6	1%	0.007	3%	0.029	C	C	.	.	H	α-helix	trans	-62.8	-43.8	177.3	57.2	0	0	0	0	112.2	S283 P792 D819 Q825	S283-S821 WeakPolarHBondContact OG-CB 3.36Å; P792-S821 PolarHBondContact O-OG 2.75Å; D819-S821 VanDerWaalsContact C-N 3.25Å; D819-S821 PolarHBondContact O-N 2.92Å; S821-Q825 VanDerWaalsContact O-CB 3.23Å; S821-Q825 WeakPolarHBondContact O-CB 3.48Å; S821-Q825 PolarHBondContact O-N 3.22Å
822	M	91.3	Very high	89.5	Confident	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-63.1	-46.5	176.1	-173.1	-174	55.4	0	0	111.5	L385 L706 K795 V799 A812 V813 D819 Q825 A826	L385-M822 HydrophobicContact CB-SD 4.12Å; L706-M822 HydrophobicContact CB-SD 4.43Å; L706-M822 HydrophobicContact CD1-SD 3.83Å; K795-M822 HydrophobicContact CB-CB 4.02Å; K795-M822 HydrophobicContact CB-CG 4.23Å; K795-M822 HydrophobicContact CB-SD 4.25Å; V799-M822 HydrophobicContact CG2-CG 3.55Å; A812-M822 HydrophobicContact CB-CE 4.21Å; A812-M822 HydrophobicContact CB-CG 3.78Å; A812-M822 WeakPolarHBondContact CB-O 3.49Å; A812-M822 HydrophobicContact CB-SD 4.32Å; V813-M822 WeakPolarHBondContact O-CE 3.49Å; D819-M822 HydrophobicContact CB-CE 4.14Å; D819-M822 WeakPolarHBondContact O-CB 3.38Å; D819-M822 PolarHBondContact O-N 3.5Å; M822-Q825 PolarHBondContact O-N 3.13Å; M822-A826 PolarHBondContact O-N 2.76Å
823	I	91.4	Very high	88.8	Confident	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-61.6	-45	179	-72	172.4	0	0	0	111.2	K288 A812 D819 V820 A840	K288-I823 PolarHBondContact NZ-O 3.27Å; A812-I823 HydrophobicContact CB-CG1 4.41Å; D819-I823 HydrophobicContact CB-CD1 4.11Å; D819-I823 HydrophobicContact CB-CG1 4.47Å; D819-I823 WeakPolarHBondContact O-CB 3.37Å; D819-I823 VanDerWaalsContact O-CG1 3.3Å; D819-I823 WeakPolarHBondContact O-CG1 3.34Å; D819-I823 PolarHBondContact O-N 3.06Å; V820-I823 PolarHBondContact O-N 3.28Å; I823-A840 HydrophobicContact CD1-CB 3.75Å
824	Q	88.3	Confident	87.5	Confident	24 Å²	24	10.2 Å²	10.2	11%	0.112	6%	0.057	C	C	.	.	H	α-helix	trans	-68.8	-37.2	178.2	-72.5	-179.7	3.9	0	0	112	S283 R286 K288 V820	S283-Q824 VanDerWaalsContact C-OE1 3.25Å; S283-Q824 PolarHBondContact O-OE1 3.01Å; R286-Q824 PolarHBondContact NE-O 3.39Å; K288-Q824 VanDerWaalsContact CE-O 3.26Å; K288-Q824 WeakPolarHBondContact CE-O 3.27Å; V820-Q824 HydrophobicContact CG1-CG 4.35Å; V820-Q824 WeakPolarHBondContact O-CB 3.27Å; V820-Q824 VanDerWaalsContact O-CG 3.24Å; V820-Q824 WeakPolarHBondContact O-CG 3.38Å; V820-Q824 PolarHBondContact O-N 3.11Å
825	Q	91	Very high	86	Confident	51 Å²	51	21.3 Å²	21.3	24%	0.238	10%	0.099	C	C	.	.	H	α-helix	trans	-74.3	-22	-180	-172.9	55.5	35.3	0	0	113.9	R286 A796 V799 A800 Q803 S821 M822	R286-Q825 PolarHBondContact NH1-O 2.9Å; R286-Q825 VanDerWaalsContact NH2-C 3.29Å; R286-Q825 PolarHBondContact NH2-O 3.32Å; A796-Q825 HydrophobicContact CB-CB 4.08Å; A796-Q825 HydrophobicContact CB-CG 4.35Å; A796-Q825 WeakPolarHBondContact O-CG 3.44Å; V799-Q825 HydrophobicContact CB-CG 4.19Å; V799-Q825 HydrophobicContact CG1-CB 4.45Å; V799-Q825 HydrophobicContact CG1-CG 4.17Å; A800-Q825 HydrophobicContact CB-CG 4.13Å; Q803-Q825 PolarHBondContact NE2-O 3.12Å; S821-Q825 VanDerWaalsContact O-CB 3.23Å; S821-Q825 WeakPolarHBondContact O-CB 3.48Å; S821-Q825 PolarHBondContact O-N 3.22Å; M822-Q825 PolarHBondContact O-N 3.13Å
826	A	93.6	Very high	84.5	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.103	C	C	.	.	S	Bend	trans	-72.6	157.1	176	0	0	0	0	0	113.3	R286 K288 V799 A812 M822 A828	R286-A826 PolarHBondContact NH2-O 2.83Å; K288-A826 VanDerWaalsContact CE-O 3.26Å; K288-A826 WeakPolarHBondContact CE-O 3.45Å; K288-A826 PolarHBondContact NZ-O 3.35Å; V799-A826 HydrophobicContact CG1-CB 4.01Å; A812-A826 HydrophobicContact CB-CB 3.44Å; A812-A826 VanDerWaalsContact CB-CB 3.44Å; M822-A826 PolarHBondContact O-N 2.76Å; A826-A828 VanDerWaalsContact C-N 3.29Å; A826-A828 WeakPolarHBondContact CB-O 3.31Å; A826-A828 PolarHBondContact O-N 2.97Å
827	D	94.3	Very high	83.8	Confident	20 Å²	20	22.7 Å²	22.7	11%	0.107	11%	0.108	C	C	.	.	S	Bend	trans	-66.3	-35.6	176.1	-57.6	-83	0	0	0	111.3	K288 I374 Q803 R809 T810	K288-D827 WeakPolarHBondContact CD-O 3.3Å; I374-D827 WeakPolarHBondContact CD1-O 3.36Å; Q803-D827 PolarHBondContact NE2-OD2 3.47Å; R809-D827 WeakPolarHBondContact CA-OD2 3.15Å; R809-D827 VanDerWaalsContact CD-CG 3.44Å; R809-D827 WeakPolarHBondContact CD-OD1 3.46Å; R809-D827 IonicContact CZ-OD1 3.56Å; R809-D827 IonicContact NE-OD1 3.94Å; R809-D827 IonicContact NH1-OD1 3.89Å; R809-D827 PolarHBondContact NH1-OD1 3.39Å; T810-D827 PolarHBondContact N-OD2 2.86Å; T810-D827 WeakPolarHBondContact O-CB 3.33Å; T810-D827 PolarHBondContact O-N 3.4Å; T810-D827 PolarHBondContact OG1-N 3.03Å; T810-D827 PolarHBondContact OG1-OD2 3Å
828	A	94.6	Very high	83.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127.2	167.1	0	0	0	0	0	109.8	I374 L378 I381 T810 C811 A812 A826 F846	I374-A828 HydrophobicContact CD1-CB 4.31Å; L378-A828 HydrophobicContact CD2-CB 4.03Å; I381-A828 HydrophobicContact CD1-CB 4.03Å; T810-A828 PolarHBondContact O-N 3.23Å; T810-A828 VanDerWaalsContact O-N 3.16Å; C811-A828 CarbonylContact C-O 3.49Å; C811-A828 VanDerWaalsContact CA-O 3.22Å; C811-A828 WeakPolarHBondContact CA-O 3.4Å; A812-A828 PolarHBondContact N-O 3.26Å; A826-A828 VanDerWaalsContact C-N 3.29Å; A826-A828 WeakPolarHBondContact CB-O 3.31Å; A826-A828 PolarHBondContact O-N 2.97Å; A828-F846 HydrophobicContact CB-CE2 4.42Å
829	G	94.6	Very high	83.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.5	176.2	0	0	0	0	0	110.7	D845 F846	G829-D845 PolarHBondContact N-OD2 2.76Å; G829-D845 WeakPolarHBondContact O-CA 3.46Å; G829-D845 WeakPolarHBondContact O-CB 3.25Å; G829-D845 PolarHBondContact O-N 2.84Å; G829-F846 PolarHBondContact O-N 3.48Å
830	V	95.3	Very high	83.1	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	116	177.8	-178.1	0	0	0	0	108.2	A812 V813 G814 F846 I848 L857	A812-V830 PolarHBondContact O-N 3.47Å; V813-V830 VanDerWaalsContact CA-O 3.29Å; V813-V830 WeakPolarHBondContact CA-O 3.35Å; V813-V830 HydrophobicContact CG1-CB 4.37Å; V813-V830 HydrophobicContact CG1-CG1 4.33Å; V813-V830 HydrophobicContact CG2-CB 4.32Å; G814-V830 PolarHBondContact N-O 2.98Å; V830-F846 CarbonylContact C-O 3.15Å; V830-F846 WeakPolarHBondContact CA-O 3.46Å; V830-F846 HydrophobicContact CG2-CB 4.31Å; V830-I848 HydrophobicContact CG1-CD1 3.55Å; V830-I848 HydrophobicContact CG1-CG1 3.7Å; V830-I848 HydrophobicContact CG1-CG2 4.41Å; V830-L857 HydrophobicContact CG2-CD2 4.5Å
831	G	93.4	Very high	83	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	140.4	172.7	0	0	0	0	0	111.1	G814 F846 S847 I848	G814-G831 CarbonylContact O-C 3.51Å; G814-G831 VanDerWaalsContact O-CA 3.3Å; G814-G831 WeakPolarHBondContact O-CA 3.32Å; G831-F846 PolarHBondContact N-O 3.42Å; G831-S847 VanDerWaalsContact O-CA 3.23Å; G831-S847 WeakPolarHBondContact O-CA 3.37Å; G831-I848 PolarHBondContact O-N 2.95Å
832	I	91	Very high	82.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140	170.7	-58.8	-174.3	0	0	0	109.3	T391 V813 G814 D815 G834 I848 F851	T391-I832 HydrophobicContact CG2-CD1 3.81Å; V813-I832 HydrophobicContact CG1-CD1 3.85Å; V813-I832 HydrophobicContact CG1-CG1 4Å; G814-I832 PolarHBondContact O-N 3.02Å; D815-I832 HydrophobicContact CB-CB 3.95Å; D815-I832 HydrophobicContact CB-CG2 4.45Å; I832-G834 PolarHBondContact O-N 3.26Å; I832-G834 VanDerWaalsContact O-N 3.16Å; I832-I848 VanDerWaalsContact CA-O 3.3Å; I832-I848 WeakPolarHBondContact CA-O 3.26Å; I832-I848 HydrophobicContact CG1-CD1 4.45Å; I832-I848 HydrophobicContact CG1-CG1 4.02Å; I832-F851 HydrophobicContact CD1-CB 3.97Å; I832-F851 HydrophobicContact CD1-CD2 4.27Å
833	E	80.9	Confident	82	Confident	72 Å²	72	37.1 Å²	37.1	34%	0.336	17%	0.173	S	C	.	.			trans	-80.9	88.3	172.1	-68.7	-173.4	-174.4	0	0	110	S841 S847 I848	E833-S841 PolarHBondContact OE1-OG 2.88Å; E833-S847 PolarHBondContact OE1-OG 3.26Å; E833-I848 PolarHBondContact N-O 3.36Å
834	G	68.6	Low	81.8	Confident	23 Å²	23	37.2 Å²	37.2	24%	0.237	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-89	170.3	179.9	0	0	0	0	0	114.2	I832 E836	I832-G834 PolarHBondContact O-N 3.26Å; I832-G834 VanDerWaalsContact O-N 3.16Å; G834-E836 PolarHBondContact O-N 2.97Å
835	R	59.8	Low	81.9	Confident	234 Å²	234	36.9 Å²	36.9	88%	0.883	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.9	171.4	-68.5	-177.2	175.5	176.6	-1.2	112.8
836	E	57.3	Low	82	Confident	19 Å²	19	34.4 Å²	34.4	9%	0.089	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-24.1	-176.5	-86	-166.8	-157.7	0	0	113	R166 D188 Q189 T389 N395 G834	R166-E836 PolarHBondContact NH2-O 3.47Å; D188-E836 WeakPolarHBondContact OD2-CG 3.41Å; Q189-E836 VanDerWaalsContact CD-O 3.23Å; Q189-E836 PolarHBondContact NE2-O 3.34Å; T389-E836 WeakPolarHBondContact CG2-OE1 3.2Å; N395-E836 PolarHBondContact ND2-OE1 3.46Å; G834-E836 PolarHBondContact O-N 2.97Å
837	G	64.6	Low	82	Confident	11 Å²	11	34.4 Å²	34.4	11%	0.113	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	149.4	-179.7	172.7	0	0	0	0	0	112.2
838	R	70.6	Confident	81.9	Confident	172 Å²	172	33.5 Å²	33.5	65%	0.649	16%	0.157	S	C	*	.	S	Bend	trans	-101.4	9.9	178.2	-67	-177.4	174.5	170.7	-2.1	113.4	S841 L842	R838-S841 WeakPolarHBondContact O-CB 3.27Å; R838-S841 PolarHBondContact O-N 3.25Å; R838-L842 HydrophobicContact CB-CD1 4.21Å; R838-L842 HydrophobicContact CB-CG 4.32Å; R838-L842 WeakPolarHBondContact O-CB 3.35Å; R838-L842 WeakPolarHBondContact O-CG 3.38Å; R838-L842 PolarHBondContact O-N 3.32Å
839	Q	73.8	Confident	81.7	Confident	47 Å²	47	35.6 Å²	35.6	22%	0.22	17%	0.171	C	C	.	.	H	α-helix	trans	-66.2	-49.6	-170.5	-68.1	-171.4	-15.5	0	0	112.8	N257 S841 L842 A843	N257-Q839 PolarHBondContact OD1-NE2 3.46Å; Q839-S841 VanDerWaalsContact C-N 3.34Å; Q839-S841 PolarHBondContact O-N 3.39Å; Q839-L842 PolarHBondContact O-N 3Å; Q839-A843 WeakPolarHBondContact O-CB 3.1Å; Q839-A843 PolarHBondContact O-N 2.72Å
840	A	80	Confident	81.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62	-43.4	176.6	0	0	0	0	0	111.8	G814 D815 G816 I823 A843 G844	G814-A840 WeakPolarHBondContact O-CB 3.37Å; D815-A840 WeakPolarHBondContact O-CB 3.4Å; G816-A840 WeakPolarHBondContact O-CB 3.23Å; I823-A840 HydrophobicContact CD1-CB 3.75Å; A840-A843 PolarHBondContact O-N 3Å; A840-G844 PolarHBondContact O-N 3.19Å
841	S	83.2	Confident	81.5	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-50.8	-63.3	170.3	178.3	0	0	0	0	109.3	R370 E833 R838 Q839 A843 G844 S847	R370-S841 VanDerWaalsContact CZ-C 3.43Å; R370-S841 VanDerWaalsContact CZ-OG 3.31Å; R370-S841 PolarHBondContact NH1-O 2.87Å; R370-S841 PolarHBondContact NH1-OG 3.42Å; R370-S841 PolarHBondContact NH2-OG 3.39Å; E833-S841 PolarHBondContact OE1-OG 2.88Å; R838-S841 WeakPolarHBondContact O-CB 3.27Å; R838-S841 PolarHBondContact O-N 3.25Å; Q839-S841 VanDerWaalsContact C-N 3.34Å; Q839-S841 PolarHBondContact O-N 3.39Å; S841-A843 PolarHBondContact O-N 2.66Å; S841-G844 PolarHBondContact O-N 2.91Å; S841-S847 VanDerWaalsContact OG-CB 3.28Å; S841-S847 WeakPolarHBondContact OG-CB 3.47Å; S841-S847 PolarHBondContact OG-OG 2.88Å
842	L	78.8	Confident	81.6	Confident	72 Å²	72	39.3 Å²	39.3	38%	0.377	19%	0.19	S	C	.	.	H	α-helix	trans	-55.9	-32	-175.2	-69.2	169.4	0	0	0	114.5	R125 R838 Q839	R125-L842 PolarHBondContact NH1-O 3.08Å; R838-L842 HydrophobicContact CB-CD1 4.21Å; R838-L842 HydrophobicContact CB-CG 4.32Å; R838-L842 WeakPolarHBondContact O-CB 3.35Å; R838-L842 WeakPolarHBondContact O-CG 3.38Å; R838-L842 PolarHBondContact O-N 3.32Å; Q839-L842 PolarHBondContact O-N 3Å
843	A	77.5	Confident	81.7	Confident	33 Å²	33	40.5 Å²	40.5	27%	0.273	20%	0.196	S	C	.	.	H	α-helix	trans	-84.6	-22.7	177.3	0	0	0	0	0	114.4	V820 Q839 A840 S841	V820-A843 HydrophobicContact CB-CB 4.35Å; V820-A843 HydrophobicContact CG1-CB 3.69Å; V820-A843 HydrophobicContact CG2-CB 3.99Å; Q839-A843 WeakPolarHBondContact O-CB 3.1Å; Q839-A843 PolarHBondContact O-N 2.72Å; A840-A843 PolarHBondContact O-N 3Å; S841-A843 PolarHBondContact O-N 2.66Å
844	G	86.5	Confident	82.4	Confident	3 Å²	3	37.1 Å²	37.1	3%	0.031	18%	0.18	C	C	.	.	S	Bend	trans	-69.4	152	178.8	0	0	0	0	0	113.7	R370 A840 S841 F846	R370-G844 WeakPolarHBondContact CB-O 3.45Å; R370-G844 WeakPolarHBondContact CD-O 3.34Å; A840-G844 PolarHBondContact O-N 3.19Å; S841-G844 PolarHBondContact O-N 2.91Å; G844-F846 VanDerWaalsContact C-N 3.33Å
845	D	90.8	Very high	83.6	Confident	16 Å²	16	36.2 Å²	36.2	9%	0.086	17%	0.17	C	C	.	.	S	Bend	trans	-71.6	-34.9	172.3	-60.8	-59.6	0	0	0	111.3	K288 R370 S371 I374 G829	K288-D845 VanDerWaalsContact CD-OD2 3.3Å; K288-D845 WeakPolarHBondContact CD-OD2 3.41Å; K288-D845 WeakPolarHBondContact CE-OD2 3.37Å; K288-D845 IonicContact NZ-OD1 3.25Å; K288-D845 IonicContact NZ-OD2 3.54Å; K288-D845 PolarHBondContact NZ-OD2 2.82Å; R370-D845 WeakPolarHBondContact CA-O 3.29Å; R370-D845 PolarHBondContact N-O 3.35Å; S371-D845 WeakPolarHBondContact CB-OD1 3.18Å; S371-D845 PolarHBondContact N-O 3.31Å; I374-D845 HydrophobicContact CD1-CB 3.78Å; I374-D845 VanDerWaalsContact CD1-CG 3.5Å; I374-D845 WeakPolarHBondContact CD1-OD2 3.24Å; G829-D845 PolarHBondContact N-OD2 2.76Å; G829-D845 WeakPolarHBondContact O-CA 3.46Å; G829-D845 WeakPolarHBondContact O-CB 3.25Å; G829-D845 PolarHBondContact O-N 2.84Å
846	F	93.2	Very high	85.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	146.1	175.5	-55	-85.9	0	0	0	108.3	M358 V368 V369 I374 L378 A828 G829 V830 G831 G844 L857	M358-F846 HydrophobicContact SD-CE1 4.03Å; V368-F846 CarbonylContact O-C 3.52Å; V369-F846 HydrophobicContact CB-CD1 4.37Å; V369-F846 HydrophobicContact CG1-CD1 3.95Å; V369-F846 HydrophobicContact CG1-CE1 3.71Å; V369-F846 HydrophobicContact CG2-CD1 3.98Å; V369-F846 HydrophobicContact CG2-CE1 4.2Å; I374-F846 HydrophobicContact CD1-CE2 3.94Å; I374-F846 HydrophobicContact CG1-CE2 4.05Å; I374-F846 HydrophobicContact CG1-CZ 4.14Å; L378-F846 HydrophobicContact CD1-CD1 4.22Å; L378-F846 HydrophobicContact CD1-CD2 4.49Å; L378-F846 HydrophobicContact CD1-CE1 3.64Å; L378-F846 HydrophobicContact CD1-CE2 3.95Å; L378-F846 HydrophobicContact CD1-CZ 3.49Å; L378-F846 VanDerWaalsContact CD1-CZ 3.49Å; L378-F846 HydrophobicContact CD2-CD2 4.1Å; L378-F846 HydrophobicContact CD2-CE2 3.72Å; L378-F846 HydrophobicContact CD2-CZ 4.13Å; L378-F846 HydrophobicContact CG-CE1 4.46Å; L378-F846 HydrophobicContact CG-CE2 3.92Å; L378-F846 HydrophobicContact CG-CZ 3.82Å; A828-F846 HydrophobicContact CB-CE2 4.42Å; G829-F846 PolarHBondContact O-N 3.48Å; V830-F846 CarbonylContact C-O 3.15Å; V830-F846 WeakPolarHBondContact CA-O 3.46Å; V830-F846 HydrophobicContact CG2-CB 4.31Å; G831-F846 PolarHBondContact N-O 3.42Å; G844-F846 VanDerWaalsContact C-N 3.33Å; F846-L857 HydrophobicContact CB-CD2 4.26Å; F846-L857 HydrophobicContact CG-CD2 4.37Å
847	S	92.6	Very high	87.1	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.1	169.3	169.3	0	0	0	0	110.8	T367 V368 G831 E833 S841	T367-S847 CarbonylContact C-O 3.58Å; T367-S847 WeakPolarHBondContact CA-O 3.47Å; T367-S847 WeakPolarHBondContact CG2-O 3.43Å; V368-S847 PolarHBondContact N-O 2.84Å; V368-S847 PolarHBondContact O-N 2.65Å; G831-S847 VanDerWaalsContact O-CA 3.23Å; G831-S847 WeakPolarHBondContact O-CA 3.37Å; E833-S847 PolarHBondContact OE1-OG 3.26Å; S841-S847 VanDerWaalsContact OG-CB 3.28Å; S841-S847 WeakPolarHBondContact OG-CB 3.47Å; S841-S847 PolarHBondContact OG-OG 2.88Å
848	I	93.5	Very high	88.5	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	146.4	177.6	61.2	-178.5	0	0	0	108.6	T367 V830 G831 I832 E833 Q850 H853 I854 L857	T367-I848 HydrophobicContact CG2-CG2 4.06Å; V830-I848 HydrophobicContact CG1-CD1 3.55Å; V830-I848 HydrophobicContact CG1-CG1 3.7Å; V830-I848 HydrophobicContact CG1-CG2 4.41Å; G831-I848 PolarHBondContact O-N 2.95Å; I832-I848 VanDerWaalsContact CA-O 3.3Å; I832-I848 WeakPolarHBondContact CA-O 3.26Å; I832-I848 HydrophobicContact CG1-CD1 4.45Å; I832-I848 HydrophobicContact CG1-CG1 4.02Å; E833-I848 PolarHBondContact N-O 3.36Å; I848-Q850 VanDerWaalsContact C-N 3.35Å; I848-Q850 VanDerWaalsContact CD1-O 3.24Å; I848-Q850 WeakPolarHBondContact CD1-O 3.29Å; I848-Q850 WeakPolarHBondContact CG1-O 3.16Å; I848-H853 HydrophobicContact CB-CB 4.16Å; I848-H853 HydrophobicContact CD1-CB 4.3Å; I848-H853 HydrophobicContact CG2-CB 4.31Å; I848-I854 HydrophobicContact CD1-CB 4.15Å; I848-L857 HydrophobicContact CG2-CD2 4.26Å
849	P	90.5	Very high	89.6	Confident	44 Å²	44	19.1 Å²	19.1	29%	0.286	10%	0.104	S	C	.	.	S	Bend	trans	-75.4	-23.5	179.6	29.2	-37	0	0	0	113.6	Q365 H853	Q365-P849 WeakPolarHBondContact O-CG 3.41Å; P849-H853 WeakPolarHBondContact CG-ND1 3.21Å
850	Q	91.8	Very high	90.6	Very high	63 Å²	63	17.5 Å²	17.5	29%	0.294	10%	0.096	S	C	.	.	S	Bend	trans	-143.1	152.1	-175.5	-65.4	-175	-8.8	0	0	110.8	I848 S852 H853	I848-Q850 VanDerWaalsContact C-N 3.35Å; I848-Q850 VanDerWaalsContact CD1-O 3.24Å; I848-Q850 WeakPolarHBondContact CD1-O 3.29Å; I848-Q850 WeakPolarHBondContact CG1-O 3.16Å; Q850-S852 VanDerWaalsContact C-N 3.31Å; Q850-S852 PolarHBondContact O-N 2.61Å; Q850-S852 PolarHBondContact OE1-OG 2.85Å; Q850-H853 WeakPolarHBondContact O-CB 3.45Å; Q850-H853 PolarHBondContact O-N 3.42Å
851	F	94.2	Very high	91.3	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-36.5	178.5	-177.2	-95.8	0	0	0	113.1	T391 L392 V689 T692 L693 V813 I832 H853 I854	T391-F851 HydrophobicContact CG2-CD2 3.96Å; T391-F851 HydrophobicContact CG2-CE2 4.44Å; T391-F851 WeakPolarHBondContact O-CB 3.48Å; L392-F851 HydrophobicContact CD2-CD1 4.03Å; L392-F851 HydrophobicContact CD2-CD2 4.05Å; L392-F851 HydrophobicContact CD2-CE1 3.78Å; L392-F851 HydrophobicContact CD2-CE2 3.8Å; L392-F851 HydrophobicContact CD2-CG 4.16Å; L392-F851 HydrophobicContact CD2-CZ 3.67Å; V689-F851 HydrophobicContact CG1-CD1 4.43Å; V689-F851 HydrophobicContact CG2-CB 4.41Å; V689-F851 HydrophobicContact CG2-CD1 4.01Å; T692-F851 HydrophobicContact CG2-CD1 4.04Å; T692-F851 HydrophobicContact CG2-CE1 3.8Å; L693-F851 HydrophobicContact CD2-CE1 3.96Å; L693-F851 HydrophobicContact CD2-CZ 3.89Å; L693-F851 HydrophobicContact CG-CE1 4.19Å; V813-F851 HydrophobicContact CG1-CD2 4.17Å; V813-F851 HydrophobicContact CG1-CE2 4.38Å; I832-F851 HydrophobicContact CD1-CB 3.97Å; I832-F851 HydrophobicContact CD1-CD2 4.27Å; F851-H853 PolarHBondContact O-N 3.4Å; F851-I854 HydrophobicContact CE1-CG2 4.36Å; F851-I854 HydrophobicContact CE2-CG2 4.48Å; F851-I854 HydrophobicContact CZ-CG2 4.3Å; F851-I854 WeakPolarHBondContact O-CB 3.31Å; F851-I854 WeakPolarHBondContact O-CG2 3.24Å; F851-I854 PolarHBondContact O-N 3.46Å
852	S	93.5	Very high	91.9	Very high	16 Å²	16	17.7 Å²	17.7	11%	0.112	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.4	-177	67.3	0	0	0	0	114.2	T692 Q850 I854	T692-S852 WeakPolarHBondContact OG1-CA 3.23Å; Q850-S852 VanDerWaalsContact C-N 3.31Å; Q850-S852 PolarHBondContact O-N 2.61Å; Q850-S852 PolarHBondContact OE1-OG 2.85Å; S852-I854 PolarHBondContact O-N 3.36Å
853	H	94.9	Very high	92.5	Very high	26 Å²	26	14.9 Å²	14.9	12%	0.12	8%	0.082	C	C	.	.	H	α-helix	trans	-68	-20	-179.8	-71.4	173.7	0	0	0	113.8	I364 I848 P849 Q850 F851 A855 K856 L857	I364-H853 HydrophobicContact CG2-CB 3.4Å; I364-H853 VanDerWaalsContact CG2-CB 3.4Å; I364-H853 WeakPolarHBondContact CG2-ND1 3.3Å; I848-H853 HydrophobicContact CB-CB 4.16Å; I848-H853 HydrophobicContact CD1-CB 4.3Å; I848-H853 HydrophobicContact CG2-CB 4.31Å; P849-H853 WeakPolarHBondContact CG-ND1 3.21Å; Q850-H853 WeakPolarHBondContact O-CB 3.45Å; Q850-H853 PolarHBondContact O-N 3.42Å; F851-H853 PolarHBondContact O-N 3.4Å; H853-A855 VanDerWaalsContact C-N 3.31Å; H853-A855 PolarHBondContact O-N 3.03Å; H853-K856 PolarHBondContact O-N 3Å; H853-L857 WeakPolarHBondContact O-CB 3.3Å; H853-L857 PolarHBondContact O-N 3.07Å
854	I	95.1	Very high	93.3	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62.2	-36.8	-179.6	-162.8	169.1	0	0	0	112.8	V384 T692 L696 V813 I848 F851 S852 K856 L857 L858	V384-I854 HydrophobicContact CG1-CD1 4.26Å; T692-I854 HydrophobicContact CG2-CG2 3.7Å; L696-I854 HydrophobicContact CD1-CG2 4.12Å; V813-I854 HydrophobicContact CG2-CD1 3.29Å; I848-I854 HydrophobicContact CD1-CB 4.15Å; F851-I854 HydrophobicContact CE1-CG2 4.36Å; F851-I854 HydrophobicContact CE2-CG2 4.48Å; F851-I854 HydrophobicContact CZ-CG2 4.3Å; F851-I854 WeakPolarHBondContact O-CB 3.31Å; F851-I854 WeakPolarHBondContact O-CG2 3.24Å; F851-I854 PolarHBondContact O-N 3.46Å; S852-I854 PolarHBondContact O-N 3.36Å; I854-K856 PolarHBondContact O-N 3.01Å; I854-L857 PolarHBondContact O-N 2.85Å; I854-L858 HydrophobicContact CG1-CD1 4.07Å; I854-L858 HydrophobicContact CG1-CG 4.28Å; I854-L858 WeakPolarHBondContact O-CG 3.35Å; I854-L858 PolarHBondContact O-N 3.37Å
855	A	94.5	Very high	93.7	Very high	4 Å²	4	14.2 Å²	14.2	3%	0.033	7%	0.071	C	C	.	.	H	α-helix	trans	-63.5	-45	179.4	0	0	0	0	0	110.7	T692 L695 H853 L859	T692-A855 HydrophobicContact CG2-CB 3.85Å; L695-A855 HydrophobicContact CD1-CB 4.37Å; H853-A855 VanDerWaalsContact C-N 3.31Å; H853-A855 PolarHBondContact O-N 3.03Å; A855-L859 HydrophobicContact CB-CD1 4.47Å; A855-L859 WeakPolarHBondContact O-CB 3.35Å; A855-L859 WeakPolarHBondContact O-CG 3.18Å; A855-L859 PolarHBondContact O-N 2.64Å
856	K	93.6	Very high	93.8	Very high	72 Å²	72	13.5 Å²	13.5	31%	0.313	7%	0.068	S	C	.	.	H	α-helix	trans	-65.4	-42.9	176.2	-67.3	178.2	-178	172.6	0	111.4	N363 I364 H853 I854 L858 I860 H861	N363-K856 HydrophobicContact CB-CD 4.34Å; N363-K856 PolarHBondContact O-NZ 3.35Å; I364-K856 HydrophobicContact CD1-CB 3.69Å; I364-K856 HydrophobicContact CG1-CB 4.24Å; I364-K856 HydrophobicContact CG1-CD 4.25Å; H853-K856 PolarHBondContact O-N 3Å; I854-K856 PolarHBondContact O-N 3.01Å; K856-L858 VanDerWaalsContact C-N 3.35Å; K856-L858 PolarHBondContact O-N 2.87Å; K856-I860 HydrophobicContact CB-CD1 4.2Å; K856-I860 HydrophobicContact CG-CD1 4.3Å; K856-I860 VanDerWaalsContact O-CB 3.31Å; K856-I860 WeakPolarHBondContact O-CB 3.34Å; K856-I860 PolarHBondContact O-N 3.46Å; K856-H861 PolarHBondContact O-N 3.35Å
857	L	95.2	Very high	93.8	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	8%	0.08	C	C	.	.	I	π-helix	trans	-57.5	-45.4	178.7	-177	63.4	0	0	0	111.9	M358 L378 V830 F846 I848 H853 I854 H861 G862	M358-L857 HydrophobicContact CG-CD1 4.46Å; M358-L857 HydrophobicContact SD-CD1 4.29Å; L378-L857 HydrophobicContact CD1-CD1 3.92Å; L378-L857 HydrophobicContact CD1-CD2 4.45Å; L378-L857 HydrophobicContact CD1-CG 3.96Å; V830-L857 HydrophobicContact CG2-CD2 4.5Å; F846-L857 HydrophobicContact CB-CD2 4.26Å; F846-L857 HydrophobicContact CG-CD2 4.37Å; I848-L857 HydrophobicContact CG2-CD2 4.26Å; H853-L857 WeakPolarHBondContact O-CB 3.3Å; H853-L857 PolarHBondContact O-N 3.07Å; I854-L857 PolarHBondContact O-N 2.85Å; L857-H861 HydrophobicContact CD1-CB 4.49Å; L857-H861 WeakPolarHBondContact O-CB 3.48Å; L857-H861 PolarHBondContact O-N 3.38Å; L857-G862 PolarHBondContact O-N 3.33Å
858	L	95.2	Very high	93.8	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	8%	0.082	C	C	.	.	I	π-helix	trans	-76.6	-54.8	179.3	-63.6	178	0	0	0	112.4	L378 I381 V384 L696 I854 K856 I860 G862 R863 Y940	L378-L858 HydrophobicContact CB-CD2 4.05Å; L378-L858 HydrophobicContact CD2-CD2 3.74Å; L378-L858 HydrophobicContact CG-CD2 4.48Å; L378-L858 WeakPolarHBondContact O-CD2 3.47Å; I381-L858 HydrophobicContact CB-CD2 4.25Å; I381-L858 HydrophobicContact CG1-CD2 3.88Å; V384-L858 HydrophobicContact CG2-CD1 4.16Å; L696-L858 HydrophobicContact CD2-CD1 3.9Å; I854-L858 HydrophobicContact CG1-CD1 4.07Å; I854-L858 HydrophobicContact CG1-CG 4.28Å; I854-L858 WeakPolarHBondContact O-CG 3.35Å; I854-L858 PolarHBondContact O-N 3.37Å; K856-L858 VanDerWaalsContact C-N 3.35Å; K856-L858 PolarHBondContact O-N 2.87Å; L858-I860 PolarHBondContact O-N 2.75Å; L858-G862 WeakPolarHBondContact O-CA 3.39Å; L858-G862 PolarHBondContact O-N 2.87Å; L858-R863 PolarHBondContact O-N 3.29Å; L858-Y940 HydrophobicContact CB-CE2 4.4Å; L858-Y940 WeakPolarHBondContact O-CE2 3.4Å
859	L	94.2	Very high	93.8	Very high	4 Å²	4	16.9 Å²	16.9	2%	0.021	8%	0.082	C	C	.	.	I	π-helix	trans	-69.4	-34.8	-169.6	-61	178.2	0	0	0	113	A699 A855 R863 P937 Y940	A699-L859 HydrophobicContact CB-CD2 3.57Å; A855-L859 HydrophobicContact CB-CD1 4.47Å; A855-L859 WeakPolarHBondContact O-CB 3.35Å; A855-L859 WeakPolarHBondContact O-CG 3.18Å; A855-L859 PolarHBondContact O-N 2.64Å; L859-R863 WeakPolarHBondContact O-CB 3.49Å; L859-P937 HydrophobicContact CD1-CB 4.15Å; L859-Y940 HydrophobicContact CD2-CD1 4.38Å; L859-Y940 HydrophobicContact CD2-CD2 3.83Å; L859-Y940 HydrophobicContact CD2-CG 3.69Å
860	I	93.9	Very high	93.9	Very high	12 Å²	12	14.9 Å²	14.9	6%	0.062	7%	0.069	C	C	.	.	I	π-helix	trans	-98.2	-66.3	-177.8	-56	169.3	0	0	0	109.9	K856 L858 R864 A933 V934	K856-I860 HydrophobicContact CB-CD1 4.2Å; K856-I860 HydrophobicContact CG-CD1 4.3Å; K856-I860 VanDerWaalsContact O-CB 3.31Å; K856-I860 WeakPolarHBondContact O-CB 3.34Å; K856-I860 PolarHBondContact O-N 3.46Å; L858-I860 PolarHBondContact O-N 2.75Å; I860-R864 WeakPolarHBondContact O-CB 3.32Å; I860-R864 VanDerWaalsContact O-CG 3.31Å; I860-R864 WeakPolarHBondContact O-CG 3.48Å; I860-R864 PolarHBondContact O-N 3.22Å; I860-A933 HydrophobicContact CG1-CB 4.21Å; I860-V934 HydrophobicContact CD1-CG2 3.89Å; I860-V934 HydrophobicContact CG1-CG2 4.24Å
861	H	95.1	Very high	93.9	Very high	5 Å²	5	13.3 Å²	13.3	2%	0.023	7%	0.067	C	C	.	.	I	π-helix	trans	-73.1	-40.9	-170.7	-69.8	-66.4	0	0	0	112.8	M358 D361 K856 L857 R864 S865	M358-H861 HydrophobicContact CE-CB 3.61Å; M358-H861 HydrophobicContact CG-CB 3.83Å; M358-H861 HydrophobicContact SD-CB 4.46Å; D361-H861 IonicContact OD2-CD2 2.87Å; D361-H861 IonicContact OD2-CE1 3.22Å; D361-H861 PolarHBondContact OD2-CE1 3.02Å; D361-H861 VanDerWaalsContact OD2-CE1 3.25Å; D361-H861 IonicContact OD2-NE2 2.72Å; D361-H861 PolarHBondContact OD2-NE2 3Å; K856-H861 PolarHBondContact O-N 3.35Å; L857-H861 HydrophobicContact CD1-CB 4.49Å; L857-H861 WeakPolarHBondContact O-CB 3.48Å; L857-H861 PolarHBondContact O-N 3.38Å; H861-R864 PolarHBondContact O-N 2.81Å; H861-S865 VanDerWaalsContact O-CB 3.31Å; H861-S865 WeakPolarHBondContact O-CB 3.36Å; H861-S865 PolarHBondContact O-N 3.45Å; H861-S865 PolarHBondContact O-OG 2.97Å
862	G	94.6	Very high	93.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.068	C	C	.	.	I	π-helix	trans	-61.6	-45.7	174.5	0	0	0	0	0	112.3	G379 L857 L858 S865 Y866	G379-G862 VanDerWaalsContact CA-O 3.27Å; G379-G862 WeakPolarHBondContact CA-O 3.39Å; G379-G862 PolarHBondContact N-O 3.36Å; L857-G862 PolarHBondContact O-N 3.33Å; L858-G862 WeakPolarHBondContact O-CA 3.39Å; L858-G862 PolarHBondContact O-N 2.87Å; G862-S865 PolarHBondContact O-N 2.98Å; G862-Y866 PolarHBondContact O-N 3.11Å
863	R	93.3	Very high	93.8	Very high	13 Å²	13	12.6 Å²	12.6	5%	0.049	6%	0.062	C	C	.	.	H	α-helix	trans	-56.4	-53.3	174	175.3	179	-170.1	103.3	-1.5	112.1	L858 L859 Y866 K867 D927 L939 L943	L858-R863 PolarHBondContact O-N 3.29Å; L859-R863 WeakPolarHBondContact O-CB 3.49Å; R863-Y866 PolarHBondContact O-N 3.09Å; R863-K867 HydrophobicContact CG-CG 4.42Å; R863-K867 WeakPolarHBondContact O-CB 3.42Å; R863-K867 WeakPolarHBondContact O-CG 3.42Å; R863-K867 PolarHBondContact O-N 3.38Å; R863-D927 IonicContact CZ-OD2 2.72Å; R863-D927 IonicContact NE-OD1 3.99Å; R863-D927 PolarHBondContact NE-OD1 3.45Å; R863-D927 IonicContact NE-OD2 2.71Å; R863-D927 PolarHBondContact NE-OD2 3.08Å; R863-D927 IonicContact NH2-OD2 3.32Å; R863-D927 PolarHBondContact NH2-OD2 2.91Å; R863-L939 VanDerWaalsContact NH1-C 3.31Å; R863-L939 PolarHBondContact NH1-O 3.48Å; R863-L943 HydrophobicContact CB-CD1 3.71Å; R863-L943 HydrophobicContact CG-CD1 3.71Å; R863-L943 HydrophobicContact CG-CD2 4.17Å
864	R	93.4	Very high	93.6	Very high	18 Å²	18	12.5 Å²	12.5	7%	0.068	6%	0.062	C	C	.	.	H	α-helix	trans	-58.2	-50	-179.2	-77	175	177	162.1	3.4	110.5	I860 H861 Y866 K867 R868 S930	I860-R864 WeakPolarHBondContact O-CB 3.32Å; I860-R864 VanDerWaalsContact O-CG 3.31Å; I860-R864 WeakPolarHBondContact O-CG 3.48Å; I860-R864 PolarHBondContact O-N 3.22Å; H861-R864 PolarHBondContact O-N 2.81Å; R864-Y866 PolarHBondContact O-N 2.9Å; R864-K867 PolarHBondContact O-N 3.29Å; R864-R868 VanDerWaalsContact O-CB 3.24Å; R864-R868 WeakPolarHBondContact O-CB 3.12Å; R864-R868 VanDerWaalsContact O-CD 3.25Å; R864-R868 WeakPolarHBondContact O-CD 3.47Å; R864-R868 WeakPolarHBondContact O-CG 3.41Å; R864-R868 PolarHBondContact O-N 3.5Å; R864-S930 PolarHBondContact NH2-OG 3.35Å
865	S	94.4	Very high	93.4	Very high	3 Å²	3	12.8 Å²	12.8	2%	0.021	6%	0.063	C	C	.	.	H	α-helix	trans	-56.2	-50.5	179.8	-56.2	0	0	0	0	111.5	M358 P375 H861 G862 S869	M358-S865 WeakPolarHBondContact CE-OG 3.49Å; P375-S865 WeakPolarHBondContact O-CB 3.43Å; H861-S865 VanDerWaalsContact O-CB 3.31Å; H861-S865 WeakPolarHBondContact O-CB 3.36Å; H861-S865 PolarHBondContact O-N 3.45Å; H861-S865 PolarHBondContact O-OG 2.97Å; G862-S865 PolarHBondContact O-N 2.98Å; S865-S869 VanDerWaalsContact O-CB 3.31Å; S865-S869 WeakPolarHBondContact O-CB 3.4Å; S865-S869 PolarHBondContact O-N 3.01Å; S865-S869 PolarHBondContact O-OG 3.27Å
866	Y	94.1	Very high	93.3	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.008	6%	0.061	C	C	.	.	H	α-helix	trans	-63.6	-46.1	179	177.4	-112.6	0	0	0	113	L292 R380 G862 R863 R864 A870 L943 S948	L292-Y866 HydrophobicContact CD1-CD2 3.88Å; L292-Y866 HydrophobicContact CD1-CE2 3.94Å; R380-Y866 HydrophobicContact CG-CD2 4.07Å; R380-Y866 HydrophobicContact CG-CE2 4.28Å; R380-Y866 HydrophobicContact CG-CG 4.33Å; R380-Y866 PolarHBondContact NH1-OH 2.97Å; G862-Y866 PolarHBondContact O-N 3.11Å; R863-Y866 PolarHBondContact O-N 3.09Å; R864-Y866 PolarHBondContact O-N 2.9Å; Y866-A870 VanDerWaalsContact O-CB 3.31Å; Y866-A870 WeakPolarHBondContact O-CB 3.13Å; Y866-A870 PolarHBondContact O-N 2.79Å; Y866-L943 HydrophobicContact CD1-CB 4.48Å; Y866-L943 HydrophobicContact CD1-CD2 3.91Å; Y866-L943 HydrophobicContact CE1-CD2 4.45Å; Y866-S948 WeakPolarHBondContact CE1-OG 3.3Å
867	K	91.8	Very high	93.3	Very high	62 Å²	62	9.4 Å²	9.4	27%	0.27	5%	0.048	S	C	.	.	H	α-helix	trans	-65	-43.7	-178.4	-77.7	-69.6	-173.2	-172.2	0	112.2	R863 R864 A870 A871 L943 S948	R863-K867 HydrophobicContact CG-CG 4.42Å; R863-K867 WeakPolarHBondContact O-CB 3.42Å; R863-K867 WeakPolarHBondContact O-CG 3.42Å; R863-K867 PolarHBondContact O-N 3.38Å; R864-K867 PolarHBondContact O-N 3.29Å; K867-A870 PolarHBondContact O-N 3.46Å; K867-A871 PolarHBondContact O-N 3.16Å; K867-L943 HydrophobicContact CD-CD2 4.19Å; K867-L943 VanDerWaalsContact CE-CD2 3.45Å; K867-L943 HydrophobicContact CG-CD2 3.98Å; K867-S948 WeakPolarHBondContact CD-OG 3.49Å; K867-S948 WeakPolarHBondContact CE-OG 3.48Å; K867-S948 PolarHBondContact NZ-OG 3.33Å
868	R	93.2	Very high	93.2	Very high	8 Å²	8	9.4 Å²	9.4	3%	0.03	5%	0.048	C	C	.	.	H	α-helix	trans	-68.9	-46.3	179.8	-67.2	162.7	169.5	-173.9	-7.3	111.5	Y354 R864 A870 A871 L872 V923 L924 D925	Y354-R868 HydrophobicContact CE1-CB 3.97Å; Y354-R868 WeakPolarHBondContact OH-CB 3.21Å; R864-R868 VanDerWaalsContact O-CB 3.24Å; R864-R868 WeakPolarHBondContact O-CB 3.12Å; R864-R868 VanDerWaalsContact O-CD 3.25Å; R864-R868 WeakPolarHBondContact O-CD 3.47Å; R864-R868 WeakPolarHBondContact O-CG 3.41Å; R864-R868 PolarHBondContact O-N 3.5Å; R868-A870 VanDerWaalsContact C-N 3.31Å; R868-A870 PolarHBondContact O-N 2.91Å; R868-A871 PolarHBondContact O-N 3.49Å; R868-L872 VanDerWaalsContact O-CB 3.24Å; R868-L872 WeakPolarHBondContact O-CB 3.47Å; R868-L872 PolarHBondContact O-N 3.41Å; R868-V923 WeakPolarHBondContact CD-O 3.34Å; R868-V923 PolarHBondContact NE-O 3.5Å; R868-V923 VanDerWaalsContact NE-O 3.14Å; R868-V923 PolarHBondContact NH1-O 2.9Å; R868-L924 PolarHBondContact NH2-O 3.47Å; R868-L924 VanDerWaalsContact NH2-O 3.08Å; R868-D925 PolarHBondContact NE-O 3.5Å; R868-D925 PolarHBondContact NH2-O 3.32Å
869	S	93.9	Very high	93	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-56.9	-43.5	173.3	-73.7	0	0	0	0	112	Y354 E376 S865 S873	Y354-S869 WeakPolarHBondContact CE2-OG 3.44Å; Y354-S869 PolarHBondContact OH-N 3.18Å; E376-S869 WeakPolarHBondContact OE2-CB 3.42Å; E376-S869 PolarHBondContact OE2-OG 3Å; S865-S869 VanDerWaalsContact O-CB 3.31Å; S865-S869 WeakPolarHBondContact O-CB 3.4Å; S865-S869 PolarHBondContact O-N 3.01Å; S865-S869 PolarHBondContact O-OG 3.27Å; S869-S873 WeakPolarHBondContact O-CB 3.23Å; S869-S873 PolarHBondContact O-N 3.44Å; S869-S873 PolarHBondContact O-OG 3.37Å
870	A	92.5	Very high	92.9	Very high	2 Å²	2	9.7 Å²	9.7	2%	0.017	5%	0.05	C	C	.	.	H	α-helix	trans	-65.4	-43.6	-179.9	0	0	0	0	0	112.3	Y866 K867 R868 Q874 L949	Y866-A870 VanDerWaalsContact O-CB 3.31Å; Y866-A870 WeakPolarHBondContact O-CB 3.13Å; Y866-A870 PolarHBondContact O-N 2.79Å; K867-A870 PolarHBondContact O-N 3.46Å; R868-A870 VanDerWaalsContact C-N 3.31Å; R868-A870 PolarHBondContact O-N 2.91Å; A870-Q874 WeakPolarHBondContact O-CG 3.28Å; A870-Q874 PolarHBondContact O-N 3.21Å; A870-Q874 VanDerWaalsContact O-N 3.12Å; A870-L949 HydrophobicContact CB-CB 4.19Å
871	A	91.3	Very high	92.9	Very high	31 Å²	31	9.5 Å²	9.5	26%	0.256	5%	0.049	S	C	.	.	H	α-helix	trans	-64.5	-48.6	176.7	0	0	0	0	0	111.6	K867 R868 S873 Q874 F875	K867-A871 PolarHBondContact O-N 3.16Å; R868-A871 PolarHBondContact O-N 3.49Å; A871-S873 VanDerWaalsContact C-N 3.33Å; A871-S873 PolarHBondContact O-N 3.18Å; A871-Q874 PolarHBondContact O-N 3.23Å; A871-F875 WeakPolarHBondContact O-CD2 3.14Å; A871-F875 PolarHBondContact O-N 3.44Å
872	L	92.7	Very high	92.9	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.005	5%	0.048	C	C	.	.	H	α-helix	trans	-55.1	-47.2	175.6	-178.4	64.5	0	0	0	111.6	N346 L347 R868 Q874 F875 V876 V919 V923	N346-L872 HydrophobicContact CB-CD1 4.39Å; N346-L872 HydrophobicContact CB-CD2 4.18Å; N346-L872 HydrophobicContact CB-CG 4.4Å; N346-L872 WeakPolarHBondContact O-CD2 3.4Å; L347-L872 HydrophobicContact CD2-CD2 4.21Å; R868-L872 VanDerWaalsContact O-CB 3.24Å; R868-L872 WeakPolarHBondContact O-CB 3.47Å; R868-L872 PolarHBondContact O-N 3.41Å; L872-Q874 PolarHBondContact O-N 2.99Å; L872-F875 PolarHBondContact O-N 3.23Å; L872-V876 HydrophobicContact CD1-CG2 4.32Å; L872-V876 VanDerWaalsContact O-CG2 3.31Å; L872-V876 WeakPolarHBondContact O-CG2 3.49Å; L872-V876 PolarHBondContact O-N 3.38Å; L872-V919 HydrophobicContact CD1-CG1 3.74Å; L872-V919 VanDerWaalsContact CD1-O 3.23Å; L872-V919 WeakPolarHBondContact CD1-O 3.35Å; L872-V923 HydrophobicContact CD2-CG2 3.93Å
873	S	92.4	Very high	92.8	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-60.1	-45.9	178.9	-55.5	0	0	0	0	112.3	I296 L347 S869 A871 F875 V876 I877	I296-S873 WeakPolarHBondContact CD1-OG 3.37Å; L347-S873 VanDerWaalsContact CD2-OG 3.24Å; L347-S873 WeakPolarHBondContact CD2-OG 3.41Å; S869-S873 WeakPolarHBondContact O-CB 3.23Å; S869-S873 PolarHBondContact O-N 3.44Å; S869-S873 PolarHBondContact O-OG 3.37Å; A871-S873 VanDerWaalsContact C-N 3.33Å; A871-S873 PolarHBondContact O-N 3.18Å; S873-F875 VanDerWaalsContact C-N 3.35Å; S873-V876 PolarHBondContact O-N 3.08Å; S873-I877 WeakPolarHBondContact O-CB 3.38Å; S873-I877 VanDerWaalsContact O-CG1 3.27Å; S873-I877 WeakPolarHBondContact O-CG1 3.48Å; S873-I877 PolarHBondContact O-N 3.38Å
874	Q	91.4	Very high	92.8	Very high	24 Å²	24	9.3 Å²	9.3	11%	0.112	5%	0.049	C	C	.	.	H	α-helix	trans	-62.9	-43.2	179.5	-75.8	173.2	-5.6	0	0	111.6	A870 A871 L872 I877 H878 S948 L949 T953 W957	A870-Q874 WeakPolarHBondContact O-CG 3.28Å; A870-Q874 PolarHBondContact O-N 3.21Å; A870-Q874 VanDerWaalsContact O-N 3.12Å; A871-Q874 PolarHBondContact O-N 3.23Å; L872-Q874 PolarHBondContact O-N 2.99Å; Q874-I877 PolarHBondContact O-N 2.98Å; Q874-H878 VanDerWaalsContact O-CB 3.22Å; Q874-H878 WeakPolarHBondContact O-CB 3.33Å; Q874-H878 PolarHBondContact O-N 2.71Å; Q874-S948 PolarHBondContact NE2-O 3.32Å; Q874-L949 HydrophobicContact CG-CD1 3.98Å; Q874-T953 PolarHBondContact NE2-OG1 3.46Å; Q874-W957 HydrophobicContact CB-CD2 4.49Å; Q874-W957 HydrophobicContact CB-CG 4.36Å
875	F	91.7	Very high	92.9	Very high	6 Å²	6	9.3 Å²	9.3	3%	0.026	5%	0.051	C	C	.	.	H	α-helix	trans	-64.6	-44.5	178.4	-98.8	-74.1	0	0	0	113.1	A871 L872 S873 I877 H878 R879 V919 L922 W957 V999 T1002	A871-F875 WeakPolarHBondContact O-CD2 3.14Å; A871-F875 PolarHBondContact O-N 3.44Å; L872-F875 PolarHBondContact O-N 3.23Å; S873-F875 VanDerWaalsContact C-N 3.35Å; F875-I877 VanDerWaalsContact C-N 3.34Å; F875-I877 PolarHBondContact O-N 3.22Å; F875-H878 WeakPolarHBondContact O-CB 3.36Å; F875-H878 PolarHBondContact O-N 2.96Å; F875-R879 WeakPolarHBondContact O-CB 3.33Å; F875-R879 PolarHBondContact O-N 2.97Å; F875-V919 HydrophobicContact CB-CG1 4.1Å; F875-L922 HydrophobicContact CB-CD1 4.02Å; F875-L922 HydrophobicContact CD2-CD1 3.41Å; F875-L922 VanDerWaalsContact CD2-CD1 3.41Å; F875-L922 HydrophobicContact CE2-CD1 4.05Å; F875-L922 HydrophobicContact CG-CD1 3.75Å; F875-W957 HydrophobicContact CD2-CH2 4.28Å; F875-W957 AromaticContact CE1-CH2 3.99Å; F875-W957 HydrophobicContact CE1-CH2 3.99Å; F875-W957 HydrophobicContact CE1-CZ3 4.26Å; F875-W957 AromaticContact CE2-CH2 3.66Å; F875-W957 HydrophobicContact CE2-CH2 3.66Å; F875-W957 HydrophobicContact CE2-CZ2 4.06Å; F875-W957 AromaticContact CZ-CH2 3.49Å; F875-W957 HydrophobicContact CZ-CH2 3.49Å; F875-W957 VanDerWaalsContact CZ-CH2 3.49Å; F875-W957 HydrophobicContact CZ-CZ2 4.33Å; F875-W957 HydrophobicContact CZ-CZ3 4.2Å; F875-V999 HydrophobicContact CD1-CG2 4.33Å; F875-V999 HydrophobicContact CE1-CG2 4.18Å; F875-T1002 HydrophobicContact CE2-CG2 3.87Å; F875-T1002 WeakPolarHBondContact CE2-OG1 3.34Å; F875-T1002 HydrophobicContact CZ-CG2 3.42Å; F875-T1002 VanDerWaalsContact CZ-CG2 3.42Å; F875-T1002 WeakPolarHBondContact CZ-OG1 3.27Å
876	V	92.5	Very high	92.8	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-64.3	-42.3	178.1	176.6	0	0	0	0	110.6	P340 L343 N346 L872 S873 R879 G880 V919	P340-V876 HydrophobicContact CB-CG1 3.9Å; P340-V876 HydrophobicContact CG-CG1 3.6Å; P340-V876 WeakPolarHBondContact CG-O 3.45Å; L343-V876 HydrophobicContact CB-CG1 3.86Å; L343-V876 HydrophobicContact CD1-CB 3.94Å; L343-V876 HydrophobicContact CD1-CG1 4.02Å; N346-V876 HydrophobicContact CB-CG2 4.36Å; N346-V876 WeakPolarHBondContact ND2-CG2 3.28Å; L872-V876 HydrophobicContact CD1-CG2 4.32Å; L872-V876 VanDerWaalsContact O-CG2 3.31Å; L872-V876 WeakPolarHBondContact O-CG2 3.49Å; L872-V876 PolarHBondContact O-N 3.38Å; S873-V876 PolarHBondContact O-N 3.08Å; V876-R879 WeakPolarHBondContact O-CB 3.29Å; V876-R879 PolarHBondContact O-N 3.35Å; V876-G880 PolarHBondContact O-N 3.39Å; V876-V919 HydrophobicContact CG2-CG1 3.66Å
877	I	92.2	Very high	92.8	Very high	5 Å²	5	9.6 Å²	9.6	3%	0.026	5%	0.052	C	C	.	.	H	α-helix	trans	-62.8	-44.2	175.3	-70.4	168.3	0	0	0	111.4	L303 L343 S873 Q874 F875 R879 G880 L881 F954	L303-I877 HydrophobicContact CD1-CG2 4Å; L343-I877 HydrophobicContact CD1-CG1 4.44Å; L343-I877 HydrophobicContact CD2-CD1 4.32Å; L343-I877 HydrophobicContact CD2-CG1 4.1Å; S873-I877 WeakPolarHBondContact O-CB 3.38Å; S873-I877 VanDerWaalsContact O-CG1 3.27Å; S873-I877 WeakPolarHBondContact O-CG1 3.48Å; S873-I877 PolarHBondContact O-N 3.38Å; Q874-I877 PolarHBondContact O-N 2.98Å; F875-I877 VanDerWaalsContact C-N 3.34Å; F875-I877 PolarHBondContact O-N 3.22Å; I877-R879 VanDerWaalsContact C-N 3.29Å; I877-R879 PolarHBondContact O-N 3.37Å; I877-G880 PolarHBondContact O-N 3.04Å; I877-L881 HydrophobicContact CG2-CD1 3.59Å; I877-L881 HydrophobicContact CG2-CG 4.38Å; I877-L881 WeakPolarHBondContact O-CG 3.5Å; I877-L881 PolarHBondContact O-N 2.84Å; I877-F954 HydrophobicContact CG2-CE2 4.06Å
878	H	92.4	Very high	92.8	Very high	1 Å²	1	7.3 Å²	7.3	1%	0.005	5%	0.045	C	C	.	.	H	α-helix	trans	-55	-44.7	177.1	170	68.8	0	0	0	112.1	Q874 F875 G880 L881 I882 W957 S961 Q964	Q874-H878 VanDerWaalsContact O-CB 3.22Å; Q874-H878 WeakPolarHBondContact O-CB 3.33Å; Q874-H878 PolarHBondContact O-N 2.71Å; F875-H878 WeakPolarHBondContact O-CB 3.36Å; F875-H878 PolarHBondContact O-N 2.96Å; H878-G880 PolarHBondContact O-N 3.09Å; H878-L881 WeakPolarHBondContact O-CB 3.28Å; H878-L881 PolarHBondContact O-N 3.47Å; H878-I882 WeakPolarHBondContact CE1-CD1 3.44Å; H878-I882 WeakPolarHBondContact NE2-CD1 3.43Å; H878-I882 PolarHBondContact O-N 3.49Å; H878-W957 HydrophobicContact CB-CE3 3.97Å; H878-W957 HydrophobicContact CB-CZ3 4.36Å; H878-W957 AromaticContact CG-CE3 3.8Å; H878-W957 AromaticContact CG-CZ3 3.95Å; H878-W957 AromaticContact ND1-CE3 3.77Å; H878-S961 WeakPolarHBondContact CA-OG 3.38Å; H878-S961 PolarHBondContact ND1-OG 3.29Å; H878-S961 PolarHBondContact O-OG 3.38Å; H878-S961 VanDerWaalsContact O-OG 3.11Å; H878-Q964 PolarHBondContact CE1-OE1 2.64Å; H878-Q964 PolarHBondContact NE2-OE1 3.31Å
879	R	92.2	Very high	92.8	Very high	6 Å²	6	8.8 Å²	8.8	2%	0.023	6%	0.055	C	C	.	.	H	α-helix	trans	-57.3	-45.9	176.4	-168.6	-171.4	67	173.7	6.8	112.7	S342 F875 V876 I877 Y910 S911 T915	S342-R879 PolarHBondContact OG-NH2 3.29Å; F875-R879 WeakPolarHBondContact O-CB 3.33Å; F875-R879 PolarHBondContact O-N 2.97Å; V876-R879 WeakPolarHBondContact O-CB 3.29Å; V876-R879 PolarHBondContact O-N 3.35Å; I877-R879 VanDerWaalsContact C-N 3.29Å; I877-R879 PolarHBondContact O-N 3.37Å; R879-Y910 HydrophobicContact CG-CE1 3.4Å; R879-Y910 VanDerWaalsContact CG-CE1 3.4Å; R879-Y910 HydrophobicContact CG-CE2 4.38Å; R879-Y910 WeakPolarHBondContact CG-OH 3.29Å; R879-Y910 PolarHBondContact O-OH 3.39Å; R879-Y910 VanDerWaalsContact O-OH 3.11Å; R879-S911 PolarHBondContact NH1-O 2.86Å; R879-S911 PolarHBondContact NH2-O 3.49Å; R879-T915 WeakPolarHBondContact CD-OG1 3.43Å; R879-T915 PolarHBondContact NH1-OG1 2.89Å
880	G	92.1	Very high	92.7	Very high	5 Å²	5	9.4 Å²	9.4	5%	0.052	6%	0.057	C	C	.	.	H	α-helix	trans	-65.5	-43.3	176.2	0	0	0	0	0	112.7	Y337 V876 I877 H878 I882 I883 T884	Y337-G880 VanDerWaalsContact O-CA 3.3Å; Y337-G880 WeakPolarHBondContact O-CA 3.21Å; V876-G880 PolarHBondContact O-N 3.39Å; I877-G880 PolarHBondContact O-N 3.04Å; H878-G880 PolarHBondContact O-N 3.09Å; G880-I882 PolarHBondContact O-N 3.01Å; G880-I883 PolarHBondContact O-N 3.43Å; G880-T884 PolarHBondContact O-N 3.33Å; G880-T884 VanDerWaalsContact O-N 3.11Å; G880-T884 PolarHBondContact O-OG1 2.99Å
881	L	94	Very high	92.6	Very high	8 Å²	8	9.3 Å²	9.3	4%	0.042	6%	0.056	C	C	.	.	H	α-helix	trans	-62.7	-38.6	178.8	-78.9	158.8	0	0	0	113.5	L303 I338 I877 H878 T884 T885 V958 S961	L303-L881 HydrophobicContact CD2-CD2 4.07Å; I338-L881 HydrophobicContact CD1-CD2 3.51Å; I338-L881 HydrophobicContact CG1-CD2 3.36Å; I338-L881 HydrophobicContact CG1-CG 3.87Å; I877-L881 HydrophobicContact CG2-CD1 3.59Å; I877-L881 HydrophobicContact CG2-CG 4.38Å; I877-L881 WeakPolarHBondContact O-CG 3.5Å; I877-L881 PolarHBondContact O-N 2.84Å; H878-L881 WeakPolarHBondContact O-CB 3.28Å; H878-L881 PolarHBondContact O-N 3.47Å; L881-T884 PolarHBondContact O-N 3.44Å; L881-T885 WeakPolarHBondContact O-CB 3.42Å; L881-T885 PolarHBondContact O-N 3.42Å; L881-T885 PolarHBondContact O-OG1 3.29Å; L881-V958 HydrophobicContact CD1-CB 4.43Å; L881-V958 HydrophobicContact CD1-CG2 3.74Å; L881-V958 HydrophobicContact CD2-CG1 4.5Å; L881-V958 HydrophobicContact CD2-CG2 4.39Å; L881-S961 VanDerWaalsContact CB-CB 3.42Å; L881-S961 WeakPolarHBondContact CB-OG 3.46Å
882	I	94.5	Very high	92.6	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-60.8	-53.9	177.2	-74.4	169.6	0	0	0	109.5	H878 G880 T884 T885 L886 Q964 L991 E995	H878-I882 WeakPolarHBondContact CE1-CD1 3.44Å; H878-I882 WeakPolarHBondContact NE2-CD1 3.43Å; H878-I882 PolarHBondContact O-N 3.49Å; G880-I882 PolarHBondContact O-N 3.01Å; I882-T884 VanDerWaalsContact C-N 3.3Å; I882-T884 PolarHBondContact O-N 3.49Å; I882-T885 WeakPolarHBondContact O-CA 3.45Å; I882-T885 WeakPolarHBondContact O-CB 3.26Å; I882-T885 PolarHBondContact O-N 2.91Å; I882-L886 HydrophobicContact CG2-CD1 3.36Å; I882-L886 WeakPolarHBondContact O-CD1 3.22Å; I882-L886 PolarHBondContact O-N 2.59Å; I882-Q964 HydrophobicContact CD1-CB 4.32Å; I882-L991 HydrophobicContact CB-CD1 4.38Å; I882-L991 HydrophobicContact CG2-CD1 3.32Å; I882-E995 WeakPolarHBondContact CD1-OE1 3.35Å
883	I	93	Very high	92.4	Very high	9 Å²	9	13.9 Å²	13.9	5%	0.046	9%	0.087	C	C	.	.	H	α-helix	trans	-56.1	-44.7	178.9	-74.2	-165.1	0	0	0	112	G880 T885 L886 Q887 M907 Y910 L991	G880-I883 PolarHBondContact O-N 3.43Å; I883-T885 VanDerWaalsContact C-N 3.27Å; I883-T885 PolarHBondContact O-N 2.68Å; I883-L886 PolarHBondContact O-N 3.38Å; I883-Q887 WeakPolarHBondContact O-CB 3.18Å; I883-Q887 PolarHBondContact O-N 3.4Å; I883-M907 HydrophobicContact CD1-CE 4.34Å; I883-M907 HydrophobicContact CD1-SD 4.05Å; I883-M907 HydrophobicContact CG2-CE 4.14Å; I883-M907 HydrophobicContact CG2-SD 4.37Å; I883-Y910 HydrophobicContact CD1-CD1 3.19Å; I883-Y910 HydrophobicContact CD1-CD2 4.21Å; I883-Y910 HydrophobicContact CD1-CE1 3.05Å; I883-Y910 HydrophobicContact CD1-CE2 4.16Å; I883-Y910 HydrophobicContact CD1-CG 3.76Å; I883-Y910 HydrophobicContact CG1-CD1 4.31Å; I883-Y910 HydrophobicContact CG1-CE1 3.7Å; I883-L991 HydrophobicContact CD1-CD2 4.17Å; I883-L991 HydrophobicContact CG1-CD2 3.85Å
884	T	93.5	Very high	92.1	Very high	5 Å²	5	16.4 Å²	16.4	3%	0.031	10%	0.098	C	C	.	.	H	α-helix	trans	-63	-35.8	177.9	-63.3	0	0	0	0	112.2	L310 F335 I338 G880 L881 I882 Q887 A888	L310-T884 HydrophobicContact CD2-CG2 4.29Å; F335-T884 HydrophobicContact CB-CG2 3.88Å; F335-T884 HydrophobicContact CD1-CG2 3.85Å; F335-T884 HydrophobicContact CG-CG2 4.16Å; I338-T884 WeakPolarHBondContact CA-OG1 3.18Å; I338-T884 HydrophobicContact CB-CG2 4.11Å; I338-T884 WeakPolarHBondContact CB-OG1 3.06Å; I338-T884 HydrophobicContact CD1-CG2 4.38Å; I338-T884 HydrophobicContact CG1-CG2 4.36Å; I338-T884 PolarHBondContact N-OG1 3.09Å; G880-T884 PolarHBondContact O-N 3.33Å; G880-T884 VanDerWaalsContact O-N 3.11Å; G880-T884 PolarHBondContact O-OG1 2.99Å; L881-T884 PolarHBondContact O-N 3.44Å; I882-T884 VanDerWaalsContact C-N 3.3Å; I882-T884 PolarHBondContact O-N 3.49Å; T884-Q887 PolarHBondContact O-N 2.97Å; T884-A888 VanDerWaalsContact O-CB 3.32Å; T884-A888 WeakPolarHBondContact O-CB 3.13Å; T884-A888 PolarHBondContact O-N 3.37Å
885	T	94.6	Very high	91.8	Very high	18 Å²	18	25.6 Å²	25.6	11%	0.11	13%	0.133	C	C	.	.	H	α-helix	trans	-66.6	-46.6	175	-55.1	0	0	0	0	111.2	L881 I882 I883 Q887 A888 V889 I962	L881-T885 WeakPolarHBondContact O-CB 3.42Å; L881-T885 PolarHBondContact O-N 3.42Å; L881-T885 PolarHBondContact O-OG1 3.29Å; I882-T885 WeakPolarHBondContact O-CA 3.45Å; I882-T885 WeakPolarHBondContact O-CB 3.26Å; I882-T885 PolarHBondContact O-N 2.91Å; I883-T885 VanDerWaalsContact C-N 3.27Å; I883-T885 PolarHBondContact O-N 2.68Å; T885-Q887 VanDerWaalsContact C-N 3.28Å; T885-Q887 PolarHBondContact O-N 2.89Å; T885-A888 PolarHBondContact O-N 3.36Å; T885-V889 HydrophobicContact CG2-CG2 4.44Å; T885-V889 WeakPolarHBondContact O-CG2 3.43Å; T885-V889 PolarHBondContact O-N 3.42Å; T885-I962 HydrophobicContact CG2-CG2 4.42Å
886	L	93.4	Very high	91.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-55.8	-47.6	175	-83.8	82	0	0	0	110.3	I882 I883 A888 V889 F890 L901 Y902 I968 M969	I882-L886 HydrophobicContact CG2-CD1 3.36Å; I882-L886 WeakPolarHBondContact O-CD1 3.22Å; I882-L886 PolarHBondContact O-N 2.59Å; I883-L886 PolarHBondContact O-N 3.38Å; L886-A888 PolarHBondContact O-N 3.37Å; L886-V889 PolarHBondContact O-N 3.46Å; L886-F890 VanDerWaalsContact O-CB 3.27Å; L886-F890 WeakPolarHBondContact O-CB 3.28Å; L886-F890 PolarHBondContact O-N 2.93Å; L886-L901 HydrophobicContact CB-CD2 4.11Å; L886-L901 HydrophobicContact CD2-CD2 4.45Å; L886-Y902 HydrophobicContact CD2-CE2 4.12Å; L886-Y902 VanDerWaalsContact CD2-OH 3.29Å; L886-Y902 WeakPolarHBondContact CD2-OH 3.28Å; L886-I968 HydrophobicContact CD2-CB 4.49Å; L886-I968 HydrophobicContact CD2-CG2 3.88Å; L886-I968 HydrophobicContact CG-CG2 4.5Å; L886-M969 HydrophobicContact CB-CE 3.96Å; L886-M969 HydrophobicContact CD2-CE 4.3Å; L886-M969 HydrophobicContact CG-CB 4.26Å; L886-M969 HydrophobicContact CG-CE 4.29Å
887	Q	93.3	Very high	91.3	Very high	11 Å²	11	28.2 Å²	28.2	5%	0.051	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-40.8	178.9	-178.2	61	57.4	0	0	112.2	L334 F335 I883 T884 T885 S891 V899 L901	L334-Q887 HydrophobicContact CB-CG 4.18Å; L334-Q887 HydrophobicContact CD2-CG 4.38Å; F335-Q887 HydrophobicContact CD1-CG 4.33Å; F335-Q887 HydrophobicContact CE1-CG 4.1Å; I883-Q887 WeakPolarHBondContact O-CB 3.18Å; I883-Q887 PolarHBondContact O-N 3.4Å; T884-Q887 PolarHBondContact O-N 2.97Å; T885-Q887 VanDerWaalsContact C-N 3.28Å; T885-Q887 PolarHBondContact O-N 2.89Å; Q887-S891 PolarHBondContact NE2-OG 3.37Å; Q887-S891 WeakPolarHBondContact O-CB 3.45Å; Q887-S891 PolarHBondContact O-N 3.27Å; Q887-S891 PolarHBondContact O-OG 3.01Å; Q887-V899 PolarHBondContact NE2-O 3.16Å; Q887-L901 VanDerWaalsContact OE1-CB 3.32Å
888	A	93.1	Very high	91.1	Very high	13 Å²	13	28.3 Å²	28.3	11%	0.107	15%	0.151	C	C	.	.	H	α-helix	trans	-66.6	-45	179	0	0	0	0	0	111.8	L310 M314 F335 T884 T885 L886 S891 A892	L310-A888 HydrophobicContact CD2-CB 4.18Å; M314-A888 HydrophobicContact CE-CB 3.87Å; M314-A888 WeakPolarHBondContact CE-O 3.27Å; F335-A888 HydrophobicContact CE1-CB 3.79Å; F335-A888 HydrophobicContact CZ-CB 4.14Å; T884-A888 VanDerWaalsContact O-CB 3.32Å; T884-A888 WeakPolarHBondContact O-CB 3.13Å; T884-A888 PolarHBondContact O-N 3.37Å; T885-A888 PolarHBondContact O-N 3.36Å; L886-A888 PolarHBondContact O-N 3.37Å; A888-S891 PolarHBondContact O-N 3.3Å; A888-A892 WeakPolarHBondContact O-CB 3.45Å; A888-A892 PolarHBondContact O-N 2.85Å
889	V	92.6	Very high	90.9	Very high	39 Å²	39	31.7 Å²	31.7	24%	0.236	17%	0.171	C	C	.	.	H	α-helix	trans	-64.5	-44.2	176.7	176.4	0	0	0	0	110.5	T885 L886 A892 V893 M969	T885-V889 HydrophobicContact CG2-CG2 4.44Å; T885-V889 WeakPolarHBondContact O-CG2 3.43Å; T885-V889 PolarHBondContact O-N 3.42Å; L886-V889 PolarHBondContact O-N 3.46Å; V889-A892 PolarHBondContact O-N 3.43Å; V889-V893 HydrophobicContact CG1-CG2 4.48Å; V889-V893 WeakPolarHBondContact O-CG2 3.31Å; V889-V893 PolarHBondContact O-N 3.05Å; V889-M969 HydrophobicContact CB-CB 4.16Å; V889-M969 HydrophobicContact CB-CG 3.78Å; V889-M969 HydrophobicContact CG1-CB 4.02Å; V889-M969 HydrophobicContact CG1-CG 3.51Å
890	F	91.1	Very high	90.7	Very high	13 Å²	13	32.1 Å²	32.1	6%	0.057	18%	0.176	C	C	.	.	H	α-helix	trans	-56.8	-53.9	174.1	177.3	-99.4	0	0	0	111.4	L886 A892 V893 F894 L901 M969 F980	L886-F890 VanDerWaalsContact O-CB 3.27Å; L886-F890 WeakPolarHBondContact O-CB 3.28Å; L886-F890 PolarHBondContact O-N 2.93Å; F890-A892 VanDerWaalsContact C-N 3.28Å; F890-A892 PolarHBondContact O-N 2.99Å; F890-V893 PolarHBondContact O-N 3.48Å; F890-F894 HydrophobicContact CD1-CD2 4.41Å; F890-F894 AromaticContact CD2-CD2 3.32Å; F890-F894 HydrophobicContact CD2-CD2 3.32Å; F890-F894 AromaticContact CD2-CE2 3.37Å; F890-F894 HydrophobicContact CD2-CE2 3.37Å; F890-F894 HydrophobicContact CD2-CG 4.46Å; F890-F894 HydrophobicContact CE1-CD2 4.36Å; F890-F894 AromaticContact CE2-CD2 3.26Å; F890-F894 HydrophobicContact CE2-CD2 3.26Å; F890-F894 AromaticContact CE2-CE2 3.29Å; F890-F894 HydrophobicContact CE2-CE2 3.29Å; F890-F894 HydrophobicContact CE2-CG 4.09Å; F890-F894 HydrophobicContact CE2-CZ 4.14Å; F890-F894 AromaticContact CG-CD2 3.93Å; F890-F894 HydrophobicContact CG-CD2 3.93Å; F890-F894 HydrophobicContact CG-CE2 4.36Å; F890-F894 AromaticContact CZ-CD2 3.81Å; F890-F894 HydrophobicContact CZ-CD2 3.81Å; F890-F894 HydrophobicContact CZ-CE2 4.23Å; F890-F894 HydrophobicContact CZ-CG 4.26Å; F890-F894 VanDerWaalsContact O-CD2 3.26Å; F890-F894 WeakPolarHBondContact O-CD2 2.94Å; F890-F894 PolarHBondContact O-N 3.42Å; F890-L901 HydrophobicContact CD1-CB 4.19Å; F890-L901 HydrophobicContact CD1-CD1 4.45Å; F890-L901 HydrophobicContact CD2-CD1 3.66Å; F890-L901 HydrophobicContact CE2-CD1 3.85Å; F890-L901 HydrophobicContact CG-CB 4.34Å; F890-L901 HydrophobicContact CG-CD1 3.99Å; F890-L901 HydrophobicContact CZ-CD1 4.34Å; F890-M969 HydrophobicContact CB-CE 3.9Å; F890-M969 HydrophobicContact CB-SD 4.11Å; F890-M969 HydrophobicContact CD2-CE 4.47Å; F890-M969 HydrophobicContact CD2-SD 4.34Å; F890-F980 HydrophobicContact CE2-CE2 4.17Å; F890-F980 HydrophobicContact CE2-CZ 4.14Å; F890-F980 HydrophobicContact CZ-CZ 4.27Å
891	S	91.2	Very high	90.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.2	-39.1	178.1	-75.5	0	0	0	0	112.5	Q887 A888 L896 S897	Q887-S891 PolarHBondContact NE2-OG 3.37Å; Q887-S891 WeakPolarHBondContact O-CB 3.45Å; Q887-S891 PolarHBondContact O-N 3.27Å; Q887-S891 PolarHBondContact O-OG 3.01Å; A888-S891 PolarHBondContact O-N 3.3Å; S891-L896 WeakPolarHBondContact O-CA 3.41Å; S891-L896 PolarHBondContact O-N 3.02Å; S891-S897 WeakPolarHBondContact CB-O 3.34Å; S891-S897 PolarHBondContact OG-O 3.31Å
892	A	90.5	Very high	90.3	Very high	53 Å²	53	32.6 Å²	32.6	44%	0.438	18%	0.177	S	C	.	.	H	α-helix	trans	-64.6	-42.2	178.1	0	0	0	0	0	112.9	M314 A888 V889 F890	M314-A892 HydrophobicContact CE-CB 4.28Å; A888-A892 WeakPolarHBondContact O-CB 3.45Å; A888-A892 PolarHBondContact O-N 2.85Å; V889-A892 PolarHBondContact O-N 3.43Å; F890-A892 VanDerWaalsContact C-N 3.28Å; F890-A892 PolarHBondContact O-N 2.99Å
893	V	87.9	Confident	89.8	Confident	76 Å²	76	36.4 Å²	36.4	46%	0.461	20%	0.195	S	C	.	.	H	α-helix	trans	-74.1	-39.5	-179.1	174.4	0	0	0	0	111.6	V889 F890 Y895 L973	V889-V893 HydrophobicContact CG1-CG2 4.48Å; V889-V893 WeakPolarHBondContact O-CG2 3.31Å; V889-V893 PolarHBondContact O-N 3.05Å; F890-V893 PolarHBondContact O-N 3.48Å; V893-Y895 VanDerWaalsContact C-N 3.28Å; V893-Y895 PolarHBondContact O-N 3.23Å; V893-L973 HydrophobicContact CB-CD1 4.19Å; V893-L973 HydrophobicContact CG1-CD1 4.03Å; V893-L973 HydrophobicContact CG2-CD1 3.92Å
894	F	86.3	Confident	89.4	Confident	52 Å²	52	36.2 Å²	36.2	23%	0.228	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	61	-179.7	-69.2	-80.6	0	0	0	112.3	F890 L896 S897 L973 F980	F890-F894 HydrophobicContact CD1-CD2 4.41Å; F890-F894 AromaticContact CD2-CD2 3.32Å; F890-F894 HydrophobicContact CD2-CD2 3.32Å; F890-F894 AromaticContact CD2-CE2 3.37Å; F890-F894 HydrophobicContact CD2-CE2 3.37Å; F890-F894 HydrophobicContact CD2-CG 4.46Å; F890-F894 HydrophobicContact CE1-CD2 4.36Å; F890-F894 AromaticContact CE2-CD2 3.26Å; F890-F894 HydrophobicContact CE2-CD2 3.26Å; F890-F894 AromaticContact CE2-CE2 3.29Å; F890-F894 HydrophobicContact CE2-CE2 3.29Å; F890-F894 HydrophobicContact CE2-CG 4.09Å; F890-F894 HydrophobicContact CE2-CZ 4.14Å; F890-F894 AromaticContact CG-CD2 3.93Å; F890-F894 HydrophobicContact CG-CD2 3.93Å; F890-F894 HydrophobicContact CG-CE2 4.36Å; F890-F894 AromaticContact CZ-CD2 3.81Å; F890-F894 HydrophobicContact CZ-CD2 3.81Å; F890-F894 HydrophobicContact CZ-CE2 4.23Å; F890-F894 HydrophobicContact CZ-CG 4.26Å; F890-F894 VanDerWaalsContact O-CD2 3.26Å; F890-F894 WeakPolarHBondContact O-CD2 2.94Å; F890-F894 PolarHBondContact O-N 3.42Å; F894-L896 PolarHBondContact O-N 3.38Å; F894-L896 VanDerWaalsContact O-N 3.09Å; F894-S897 WeakPolarHBondContact O-CB 3.4Å; F894-S897 PolarHBondContact O-N 3.43Å; F894-S897 PolarHBondContact O-OG 3Å; F894-L973 HydrophobicContact CE2-CD2 3.79Å; F894-L973 HydrophobicContact CZ-CD2 3.84Å; F894-F980 HydrophobicContact CD1-CE2 4.22Å; F894-F980 HydrophobicContact CD1-CZ 4.46Å; F894-F980 AromaticContact CE1-CD2 3.89Å; F894-F980 HydrophobicContact CE1-CD2 3.89Å; F894-F980 AromaticContact CE1-CE2 3.32Å; F894-F980 HydrophobicContact CE1-CE2 3.32Å; F894-F980 AromaticContact CE1-CZ 3.95Å; F894-F980 HydrophobicContact CE1-CZ 3.95Å; F894-F980 AromaticContact CE2-CE2 3.93Å; F894-F980 HydrophobicContact CE2-CE2 3.93Å; F894-F980 AromaticContact CZ-CD2 3.8Å; F894-F980 HydrophobicContact CZ-CD2 3.8Å; F894-F980 AromaticContact CZ-CE2 3.18Å; F894-F980 HydrophobicContact CZ-CE2 3.18Å; F894-F980 HydrophobicContact CZ-CZ 4.11Å
895	Y	86.4	Confident	89	Confident	218 Å²	218	41.6 Å²	41.6	86%	0.855	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	36.2	172.3	-57.2	-80.6	0	0	0	114.6	V893 S897	V893-Y895 VanDerWaalsContact C-N 3.28Å; V893-Y895 PolarHBondContact O-N 3.23Å; Y895-S897 PolarHBondContact O-N 2.93Å
896	L	88.3	Confident	88.6	Confident	27 Å²	27	40.9 Å²	40.9	14%	0.141	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	40.8	-179.8	-59.1	162.9	0	0	0	111.7	M314 L317 K318 F331 S891 F894	M314-L896 HydrophobicContact SD-CD2 3.74Å; L317-L896 VanDerWaalsContact C-CD1 3.41Å; L317-L896 HydrophobicContact CB-CD1 3.7Å; L317-L896 HydrophobicContact CB-CD2 4.27Å; L317-L896 WeakPolarHBondContact O-CD1 3.35Å; K318-L896 HydrophobicContact CB-CB 4.02Å; K318-L896 HydrophobicContact CB-CD1 4.03Å; K318-L896 HydrophobicContact CD-CB 4.35Å; K318-L896 WeakPolarHBondContact CD-O 3.09Å; K318-L896 HydrophobicContact CG-CB 4.2Å; K318-L896 PolarHBondContact NZ-O 3Å; F331-L896 WeakPolarHBondContact CZ-O 3.22Å; S891-L896 WeakPolarHBondContact O-CA 3.41Å; S891-L896 PolarHBondContact O-N 3.02Å; F894-L896 PolarHBondContact O-N 3.38Å; F894-L896 VanDerWaalsContact O-N 3.09Å
897	S	85.9	Confident	88.3	Confident	33 Å²	33	41.6 Å²	41.6	23%	0.231	22%	0.217	C	C	.	.			trans	-77.7	141.9	175.1	66.5	0	0	0	0	111.4	S891 F894 Y895 V899	S891-S897 WeakPolarHBondContact CB-O 3.34Å; S891-S897 PolarHBondContact OG-O 3.31Å; F894-S897 WeakPolarHBondContact O-CB 3.4Å; F894-S897 PolarHBondContact O-N 3.43Å; F894-S897 PolarHBondContact O-OG 3Å; Y895-S897 PolarHBondContact O-N 2.93Å; S897-V899 VanDerWaalsContact C-N 3.32Å; S897-V899 PolarHBondContact O-N 2.89Å
898	S	87.1	Confident	87.9	Confident	7 Å²	7	43 Å²	43	5%	0.049	23%	0.226	C	C	.	.			trans	-98.5	48.8	178.9	60.7	0	0	0	0	111.1	R330	R330-S898 PolarHBondContact NE-OG 3.32Å; R330-S898 PolarHBondContact NH2-O 3.11Å; R330-S898 PolarHBondContact NH2-OG 3.1Å
899	V	87.6	Confident	87.6	Confident	72 Å²	72	42.5 Å²	42.5	44%	0.436	22%	0.222	S	C	.	.			trans	-102.1	132.9	176.5	-179.4	0	0	0	0	108.8	Q887 S897	Q887-V899 PolarHBondContact NE2-O 3.16Å; S897-V899 VanDerWaalsContact C-N 3.32Å; S897-V899 PolarHBondContact O-N 2.89Å
900	A	88.4	Confident	87.4	Confident	15 Å²	15	41 Å²	41	12%	0.124	21%	0.212	C	C	.	.			trans	-73.6	128.2	175.8	0	0	0	0	0	110.4	I94 L334 Q903	I94-A900 HydrophobicContact CG2-CB 3.86Å; L334-A900 HydrophobicContact CD2-CB 3.69Å; A900-Q903 HydrophobicContact CB-CG 3.83Å; A900-Q903 PolarHBondContact O-NE2 3.06Å; A900-Q903 VanDerWaalsContact O-NE2 3.08Å
901	L	88.9	Confident	87	Confident	12 Å²	12	41.9 Å²	41.9	6%	0.063	22%	0.221	C	C	.	.	S	Bend	trans	-64	-46.4	178	173.4	70.5	0	0	0	111.7	L886 Q887 F890 M969	L886-L901 HydrophobicContact CB-CD2 4.11Å; L886-L901 HydrophobicContact CD2-CD2 4.45Å; Q887-L901 VanDerWaalsContact OE1-CB 3.32Å; F890-L901 HydrophobicContact CD1-CB 4.19Å; F890-L901 HydrophobicContact CD1-CD1 4.45Å; F890-L901 HydrophobicContact CD2-CD1 3.66Å; F890-L901 HydrophobicContact CE2-CD1 3.85Å; F890-L901 HydrophobicContact CG-CB 4.34Å; F890-L901 HydrophobicContact CG-CD1 3.99Å; F890-L901 HydrophobicContact CZ-CD1 4.34Å; L901-M969 HydrophobicContact CD1-CE 3.94Å; L901-M969 HydrophobicContact CD2-CE 3.21Å; L901-M969 HydrophobicContact CG-CE 4.2Å
902	Y	88.8	Confident	86.7	Confident	11 Å²	11	44.8 Å²	44.8	4%	0.043	24%	0.238	C	C	.	.	S	Bend	trans	-114	133.8	177.1	-54	-49.2	0	0	0	109.2	L886 M907 V984 S987 F988 L991	L886-Y902 HydrophobicContact CD2-CE2 4.12Å; L886-Y902 VanDerWaalsContact CD2-OH 3.29Å; L886-Y902 WeakPolarHBondContact CD2-OH 3.28Å; Y902-M907 HydrophobicContact CD2-SD 4.25Å; Y902-M907 HydrophobicContact CG-SD 4.45Å; Y902-M907 VanDerWaalsContact O-CG 3.26Å; Y902-M907 WeakPolarHBondContact O-CG 3.22Å; Y902-V984 HydrophobicContact CD1-CG1 4.04Å; Y902-V984 HydrophobicContact CE1-CG1 4.19Å; Y902-S987 VanDerWaalsContact OH-CB 3.27Å; Y902-S987 WeakPolarHBondContact OH-CB 3.41Å; Y902-S987 PolarHBondContact OH-OG 3.23Å; Y902-F988 HydrophobicContact CD1-CB 4.46Å; Y902-F988 AromaticContact CD1-CD2 3.92Å; Y902-F988 HydrophobicContact CD1-CD2 3.92Å; Y902-F988 HydrophobicContact CD2-CD2 4.17Å; Y902-F988 HydrophobicContact CE1-CB 3.79Å; Y902-F988 AromaticContact CE1-CD2 3.85Å; Y902-F988 HydrophobicContact CE1-CD2 3.85Å; Y902-F988 HydrophobicContact CE1-CG 4.28Å; Y902-F988 HydrophobicContact CE2-CD2 4.09Å; Y902-F988 HydrophobicContact CG-CD2 4.1Å; Y902-F988 AromaticContact CZ-CD2 3.94Å; Y902-F988 PolarHBondContact OH-N 3.38Å; Y902-L991 HydrophobicContact CE2-CD2 4.08Å
903	Q	83.3	Confident	86.5	Confident	81 Å²	81	46.1 Å²	46.1	38%	0.379	24%	0.238	S	C	.	.			trans	-134.8	160.1	-176.3	-62.2	-173.6	12.4	0	0	111.7	A900 F905 L906	A900-Q903 HydrophobicContact CB-CG 3.83Å; A900-Q903 PolarHBondContact O-NE2 3.06Å; A900-Q903 VanDerWaalsContact O-NE2 3.08Å; Q903-F905 PolarHBondContact O-N 3.31Å; Q903-L906 PolarHBondContact O-N 3.45Å
904	G	85.1	Confident	86.6	Confident	4 Å²	4	43.1 Å²	43.1	4%	0.041	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	-127.6	172.9	0	0	0	0	0	113.7	L906 M907 V908	G904-L906 VanDerWaalsContact C-N 3.3Å; G904-L906 PolarHBondContact O-N 2.65Å; G904-M907 PolarHBondContact O-N 2.81Å; G904-V908 PolarHBondContact O-N 3.38Å
905	F	85.5	Confident	86.9	Confident	119 Å²	119	40.8 Å²	40.8	52%	0.522	21%	0.208	S	C	.	.	H	α-helix	trans	-65.1	-27.7	-173.7	-72.9	-73.5	0	0	0	114.2	Q903 G909 Y1031	Q903-F905 PolarHBondContact O-N 3.31Å; F905-G909 WeakPolarHBondContact O-CA 3.31Å; F905-G909 PolarHBondContact O-N 3.28Å; F905-Y1031 HydrophobicContact CB-CE2 4.39Å; F905-Y1031 HydrophobicContact CD2-CE2 4.41Å
906	L	86.8	Confident	87	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-64.1	-44.6	177.8	-65.7	177.6	0	0	0	111.6	Q903 G904 Y910 V984 F988 Y1031 F1032	Q903-L906 PolarHBondContact O-N 3.45Å; G904-L906 VanDerWaalsContact C-N 3.3Å; G904-L906 PolarHBondContact O-N 2.65Å; L906-Y910 WeakPolarHBondContact O-CB 3.25Å; L906-Y910 PolarHBondContact O-N 3.42Å; L906-V984 HydrophobicContact CD1-CG1 3.82Å; L906-F988 HydrophobicContact CB-CE2 4.17Å; L906-F988 HydrophobicContact CB-CZ 4.08Å; L906-F988 HydrophobicContact CD2-CD1 4.13Å; L906-F988 HydrophobicContact CD2-CE1 3.84Å; L906-F988 HydrophobicContact CD2-CZ 4.22Å; L906-F988 WeakPolarHBondContact O-CZ 3.26Å; L906-Y1031 HydrophobicContact CD1-CD1 3.71Å; L906-Y1031 HydrophobicContact CD1-CE1 4.35Å; L906-Y1031 HydrophobicContact CD1-CG 4.14Å; L906-Y1031 HydrophobicContact CG-CD1 4.03Å; L906-Y1031 HydrophobicContact CG-CE1 4.42Å; L906-Y1031 HydrophobicContact CG-CG 4.19Å; L906-F1032 HydrophobicContact CD2-CE2 3.73Å; L906-F1032 HydrophobicContact CD2-CZ 3.58Å
907	M	85.6	Confident	87.1	Confident	15 Å²	15	34.4 Å²	34.4	7%	0.074	19%	0.185	C	C	.	.	H	α-helix	trans	-69.5	-42.6	178.6	-79.7	-60.7	-71.8	0	0	112.4	Y337 I883 Y902 G904 S911	Y337-M907 HydrophobicContact CD1-CE 3.4Å; Y337-M907 HydrophobicContact CD2-CE 3.71Å; Y337-M907 HydrophobicContact CE1-CE 3.34Å; Y337-M907 HydrophobicContact CE2-CE 3.65Å; Y337-M907 HydrophobicContact CG-CE 3.58Å; Y337-M907 VanDerWaalsContact CZ-CE 3.47Å; I883-M907 HydrophobicContact CD1-CE 4.34Å; I883-M907 HydrophobicContact CD1-SD 4.05Å; I883-M907 HydrophobicContact CG2-CE 4.14Å; I883-M907 HydrophobicContact CG2-SD 4.37Å; Y902-M907 HydrophobicContact CD2-SD 4.25Å; Y902-M907 HydrophobicContact CG-SD 4.45Å; Y902-M907 VanDerWaalsContact O-CG 3.26Å; Y902-M907 WeakPolarHBondContact O-CG 3.22Å; G904-M907 PolarHBondContact O-N 2.81Å; M907-S911 PolarHBondContact O-N 2.9Å; M907-S911 PolarHBondContact O-OG 3.3Å
908	V	85	Confident	87.4	Confident	40 Å²	40	32.9 Å²	32.9	24%	0.242	17%	0.174	C	C	.	.	H	α-helix	trans	-61.9	-53.2	176	176.9	0	0	0	0	109.4	Y98 T99 G904 Y910 S911 T912	Y98-V908 HydrophobicContact CE2-CG2 4.4Å; T99-V908 HydrophobicContact CG2-CG2 3.92Å; G904-V908 PolarHBondContact O-N 3.38Å; V908-Y910 PolarHBondContact O-N 3.09Å; V908-S911 PolarHBondContact O-N 2.69Å; V908-S911 VanDerWaalsContact O-N 3.09Å; V908-S911 PolarHBondContact O-OG 3.03Å; V908-T912 PolarHBondContact O-N 2.9Å; V908-T912 PolarHBondContact O-OG1 3.48Å
909	G	87.6	Confident	87.6	Confident	4 Å²	4	32.7 Å²	32.7	4%	0.041	17%	0.172	C	C	.	.	H	α-helix	trans	-58.8	-40.1	-179.3	0	0	0	0	0	113.6	F905 S911 L913 Y914	F905-G909 WeakPolarHBondContact O-CA 3.31Å; F905-G909 PolarHBondContact O-N 3.28Å; G909-S911 VanDerWaalsContact C-N 3.34Å; G909-S911 PolarHBondContact O-N 3.44Å; G909-L913 CarbonylContact O-C 3.46Å; G909-L913 WeakPolarHBondContact O-CA 3.44Å; G909-L913 WeakPolarHBondContact O-CB 3.15Å; G909-L913 PolarHBondContact O-N 3.26Å; G909-Y914 VanDerWaalsContact C-CD2 3.41Å; G909-Y914 WeakPolarHBondContact O-CD2 3.39Å; G909-Y914 PolarHBondContact O-N 2.84Å
910	Y	88.9	Confident	87.8	Confident	6 Å²	6	31.3 Å²	31.3	2%	0.024	16%	0.161	C	C	.	.	I	π-helix	trans	-57.1	-48.1	173.6	176.8	-99	0	0	0	111.9	R879 I883 L906 V908 T915 F988 L991 I992 E995	R879-Y910 HydrophobicContact CG-CE1 3.4Å; R879-Y910 VanDerWaalsContact CG-CE1 3.4Å; R879-Y910 HydrophobicContact CG-CE2 4.38Å; R879-Y910 WeakPolarHBondContact CG-OH 3.29Å; R879-Y910 PolarHBondContact O-OH 3.39Å; R879-Y910 VanDerWaalsContact O-OH 3.11Å; I883-Y910 HydrophobicContact CD1-CD1 3.19Å; I883-Y910 HydrophobicContact CD1-CD2 4.21Å; I883-Y910 HydrophobicContact CD1-CE1 3.05Å; I883-Y910 HydrophobicContact CD1-CE2 4.16Å; I883-Y910 HydrophobicContact CD1-CG 3.76Å; I883-Y910 HydrophobicContact CG1-CD1 4.31Å; I883-Y910 HydrophobicContact CG1-CE1 3.7Å; L906-Y910 WeakPolarHBondContact O-CB 3.25Å; L906-Y910 PolarHBondContact O-N 3.42Å; V908-Y910 PolarHBondContact O-N 3.09Å; Y910-T915 HydrophobicContact CD2-CG2 3.92Å; Y910-T915 HydrophobicContact CE2-CG2 3.72Å; Y910-T915 PolarHBondContact O-OG1 3.12Å; Y910-F988 HydrophobicContact CD2-CE2 4.4Å; Y910-L991 HydrophobicContact CD2-CD2 4.06Å; Y910-L991 HydrophobicContact CD2-CG 4.45Å; Y910-L991 HydrophobicContact CE2-CD1 4.21Å; Y910-L991 HydrophobicContact CE2-CD2 3.65Å; Y910-L991 HydrophobicContact CE2-CG 3.74Å; Y910-I992 HydrophobicContact CD2-CD1 3.54Å; Y910-I992 HydrophobicContact CE2-CD1 4.03Å; Y910-E995 HydrophobicContact CE2-CG 4.42Å; Y910-E995 PolarHBondContact OH-OE1 3.01Å
911	S	82.1	Confident	88	Confident	33 Å²	33	31 Å²	31	23%	0.231	16%	0.158	C	C	.	.	I	π-helix	trans	-75.8	-31.9	-173.5	71	0	0	0	0	113.8	R879 M907 V908 G909	R879-S911 PolarHBondContact NH1-O 2.86Å; R879-S911 PolarHBondContact NH2-O 3.49Å; M907-S911 PolarHBondContact O-N 2.9Å; M907-S911 PolarHBondContact O-OG 3.3Å; V908-S911 PolarHBondContact O-N 2.69Å; V908-S911 VanDerWaalsContact O-N 3.09Å; V908-S911 PolarHBondContact O-OG 3.03Å; G909-S911 VanDerWaalsContact C-N 3.34Å; G909-S911 PolarHBondContact O-N 3.44Å
912	T	84.1	Confident	88.1	Confident	60 Å²	60	30.7 Å²	30.7	37%	0.368	16%	0.156	S	C	.	.	I	π-helix	trans	-110.5	-32.4	-171	59.6	0	0	0	0	115	V908 M916	V908-T912 PolarHBondContact O-N 2.9Å; V908-T912 PolarHBondContact O-OG1 3.48Å; T912-M916 WeakPolarHBondContact O-CB 3.34Å
913	L	86.8	Confident	88.3	Confident	82 Å²	82	30.3 Å²	30.3	43%	0.429	16%	0.155	S	C	.	.	I	π-helix	trans	-110.9	-63.6	-171.8	-66.6	173.3	0	0	0	111.7	G909 T915	G909-L913 CarbonylContact O-C 3.46Å; G909-L913 WeakPolarHBondContact O-CA 3.44Å; G909-L913 WeakPolarHBondContact O-CB 3.15Å; G909-L913 PolarHBondContact O-N 3.26Å; L913-T915 VanDerWaalsContact C-N 3.32Å; L913-T915 PolarHBondContact O-N 3.39Å
914	Y	91.4	Very high	88.7	Confident	13 Å²	13	27.8 Å²	27.8	5%	0.051	14%	0.144	C	C	.	.	I	π-helix	trans	-73	-19.1	-164.2	-51.3	-40.3	0	0	0	115.1	G909 F988 I992 S1017 Y1021 S1024	G909-Y914 VanDerWaalsContact C-CD2 3.41Å; G909-Y914 WeakPolarHBondContact O-CD2 3.39Å; G909-Y914 PolarHBondContact O-N 2.84Å; Y914-F988 HydrophobicContact CD2-CE1 4.05Å; Y914-F988 HydrophobicContact CD2-CZ 4.01Å; Y914-F988 AromaticContact CE2-CE1 3.91Å; Y914-F988 HydrophobicContact CE2-CE1 3.91Å; Y914-F988 HydrophobicContact CE2-CZ 4.05Å; Y914-I992 HydrophobicContact CD2-CD1 4.09Å; Y914-I992 HydrophobicContact CG-CD1 4.28Å; Y914-S1017 PolarHBondContact O-OG 2.89Å; Y914-Y1021 HydrophobicContact CD1-CD2 4.26Å; Y914-Y1021 HydrophobicContact CD2-CD2 4.17Å; Y914-Y1021 HydrophobicContact CE1-CD2 4.34Å; Y914-Y1021 HydrophobicContact CE2-CD2 4.24Å; Y914-Y1021 HydrophobicContact CG-CD2 4.2Å; Y914-S1024 WeakPolarHBondContact OH-CB 3.23Å; Y914-S1024 PolarHBondContact OH-OG 3.17Å
915	T	90.9	Very high	88.9	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.012	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-5.5	-179.3	65.5	0	0	0	0	113.2	R879 Y910 L913 V919 I992 E995	R879-T915 WeakPolarHBondContact CD-OG1 3.43Å; R879-T915 PolarHBondContact NH1-OG1 2.89Å; Y910-T915 HydrophobicContact CD2-CG2 3.92Å; Y910-T915 HydrophobicContact CE2-CG2 3.72Å; Y910-T915 PolarHBondContact O-OG1 3.12Å; L913-T915 VanDerWaalsContact C-N 3.32Å; L913-T915 PolarHBondContact O-N 3.39Å; T915-V919 WeakPolarHBondContact O-CB 3.43Å; T915-V919 WeakPolarHBondContact O-CG2 3.45Å; T915-V919 PolarHBondContact O-N 3.3Å; T915-I992 HydrophobicContact CG2-CD1 4.02Å; T915-E995 HydrophobicContact CG2-CB 4.27Å; T915-E995 HydrophobicContact CG2-CG 4.48Å
916	M	88.9	Confident	89	Confident	38 Å²	38	25.9 Å²	25.9	19%	0.187	14%	0.136	C	C	.	.	H	α-helix	trans	-71.6	-53	-173.3	-170.6	-78.5	-88.7	0	0	111.5	T912 V919 F920	T912-M916 WeakPolarHBondContact O-CB 3.34Å; M916-V919 PolarHBondContact O-N 2.9Å; M916-F920 VanDerWaalsContact O-CB 3.23Å; M916-F920 WeakPolarHBondContact O-CB 3.44Å; M916-F920 PolarHBondContact O-N 3.02Å; M916-F920 HydrophobicContact SD-CB 4Å
917	F	91.3	Very high	88.9	Confident	74 Å²	74	26.8 Å²	26.8	33%	0.325	14%	0.141	S	C	.	.	H	α-helix	trans	-60.9	-46.8	-175.5	-62	-79.6	0	0	0	113.5	F920 S921 A1013 F1016 L1020	F917-F920 PolarHBondContact O-N 3.36Å; F917-S921 WeakPolarHBondContact O-CB 3.49Å; F917-S921 PolarHBondContact O-N 2.92Å; F917-A1013 HydrophobicContact CB-CB 4.1Å; F917-F1016 AromaticContact CD2-CD1 3.94Å; F917-F1016 HydrophobicContact CD2-CD1 3.94Å; F917-F1016 AromaticContact CD2-CE1 3.99Å; F917-F1016 HydrophobicContact CD2-CE1 3.99Å; F917-F1016 HydrophobicContact CE2-CD1 4.1Å; F917-F1016 AromaticContact CE2-CE1 3.65Å; F917-F1016 HydrophobicContact CE2-CE1 3.65Å; F917-F1016 HydrophobicContact CG-CD1 4.3Å; F917-F1016 AromaticContact CZ-CE1 3.97Å; F917-F1016 HydrophobicContact CZ-CE1 3.97Å; F917-L1020 HydrophobicContact CE2-CD1 4.34Å
918	P	91.6	Very high	89	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-63.4	-45.2	178.6	-23.9	36.4	0	0	0	112.3	S921 L996 V999 E1014 S1017	P918-S921 WeakPolarHBondContact O-CB 3.08Å; P918-S921 PolarHBondContact O-N 3.4Å; P918-S921 PolarHBondContact O-OG 2.9Å; P918-L996 HydrophobicContact CB-CD2 4.14Å; P918-L996 HydrophobicContact CG-CD2 3.53Å; P918-V999 HydrophobicContact CB-CG1 4.18Å; P918-V999 HydrophobicContact CB-CG2 4.44Å; P918-E1014 HydrophobicContact CB-CG 4.11Å; P918-E1014 HydrophobicContact CG-CG 4.48Å; P918-S1017 WeakPolarHBondContact CD-OG 3.29Å; P918-S1017 VanDerWaalsContact CG-CB 3.49Å
919	V	91.3	Very high	89.3	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-42.4	179	172.6	0	0	0	0	110.9	L872 F875 V876 T915 M916 S921 L922 V999	L872-V919 HydrophobicContact CD1-CG1 3.74Å; L872-V919 VanDerWaalsContact CD1-O 3.23Å; L872-V919 WeakPolarHBondContact CD1-O 3.35Å; F875-V919 HydrophobicContact CB-CG1 4.1Å; V876-V919 HydrophobicContact CG2-CG1 3.66Å; T915-V919 WeakPolarHBondContact O-CB 3.43Å; T915-V919 WeakPolarHBondContact O-CG2 3.45Å; T915-V919 PolarHBondContact O-N 3.3Å; M916-V919 PolarHBondContact O-N 2.9Å; V919-S921 VanDerWaalsContact C-N 3.26Å; V919-S921 PolarHBondContact O-N 2.81Å; V919-L922 VanDerWaalsContact O-CB 3.27Å; V919-L922 WeakPolarHBondContact O-CB 3.5Å; V919-L922 VanDerWaalsContact O-CG 3.27Å; V919-L922 WeakPolarHBondContact O-CG 3.49Å; V919-L922 PolarHBondContact O-N 3.4Å; V919-V999 HydrophobicContact CG2-CG2 3.99Å
920	F	92	Very high	89.3	Confident	44 Å²	44	30.6 Å²	30.6	19%	0.193	17%	0.165	C	C	.	.	H	α-helix	trans	-65.7	-30.1	176	-171.8	-108.1	0	0	0	112.2	M349 M916 F917 L922 V923	M349-F920 HydrophobicContact CB-CD2 4.48Å; M349-F920 HydrophobicContact CB-CE2 3.47Å; M349-F920 VanDerWaalsContact CB-CE2 3.47Å; M349-F920 HydrophobicContact CB-CZ 3.72Å; M349-F920 HydrophobicContact CE-CE1 4.37Å; M349-F920 HydrophobicContact CE-CE2 4.45Å; M349-F920 HydrophobicContact CE-CZ 4.16Å; M916-F920 VanDerWaalsContact O-CB 3.23Å; M916-F920 WeakPolarHBondContact O-CB 3.44Å; M916-F920 PolarHBondContact O-N 3.02Å; M916-F920 HydrophobicContact SD-CB 4Å; F917-F920 PolarHBondContact O-N 3.36Å; F920-L922 PolarHBondContact O-N 3.3Å; F920-V923 HydrophobicContact CD2-CG2 4.04Å; F920-V923 HydrophobicContact CE2-CG2 3.89Å; F920-V923 HydrophobicContact CZ-CG2 4.32Å; F920-V923 WeakPolarHBondContact O-CB 3.09Å; F920-V923 WeakPolarHBondContact O-CG2 3.3Å; F920-V923 PolarHBondContact O-N 2.95Å
921	S	92.6	Very high	89.4	Confident	8 Å²	8	37.6 Å²	37.6	6%	0.056	20%	0.198	C	C	.	.	H	α-helix	trans	-61.2	-18.4	177	86.7	0	0	0	0	113.8	F917 P918 V919 V923 L924	F917-S921 WeakPolarHBondContact O-CB 3.49Å; F917-S921 PolarHBondContact O-N 2.92Å; P918-S921 WeakPolarHBondContact O-CB 3.08Å; P918-S921 PolarHBondContact O-N 3.4Å; P918-S921 PolarHBondContact O-OG 2.9Å; V919-S921 VanDerWaalsContact C-N 3.26Å; V919-S921 PolarHBondContact O-N 2.81Å; S921-V923 PolarHBondContact O-N 2.96Å; S921-V923 VanDerWaalsContact O-N 3.11Å; S921-L924 WeakPolarHBondContact O-CB 3.47Å; S921-L924 PolarHBondContact O-N 3.48Å
922	L	91	Very high	89.8	Confident	6 Å²	6	38.3 Å²	38.3	3%	0.031	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-59.6	-19.6	172.2	-64	176.2	0	0	0	113.4	F875 V919 F920 L924 D925 V999 V1003	F875-L922 HydrophobicContact CB-CD1 4.02Å; F875-L922 HydrophobicContact CD2-CD1 3.41Å; F875-L922 VanDerWaalsContact CD2-CD1 3.41Å; F875-L922 HydrophobicContact CE2-CD1 4.05Å; F875-L922 HydrophobicContact CG-CD1 3.75Å; V919-L922 VanDerWaalsContact O-CB 3.27Å; V919-L922 WeakPolarHBondContact O-CB 3.5Å; V919-L922 VanDerWaalsContact O-CG 3.27Å; V919-L922 WeakPolarHBondContact O-CG 3.49Å; V919-L922 PolarHBondContact O-N 3.4Å; F920-L922 PolarHBondContact O-N 3.3Å; L922-L924 PolarHBondContact O-N 3.34Å; L922-D925 WeakPolarHBondContact O-CB 3.32Å; L922-D925 PolarHBondContact O-N 3Å; L922-D925 VanDerWaalsContact O-N 3.11Å; L922-V999 HydrophobicContact CD2-CG1 4.36Å; L922-V1003 HydrophobicContact CD2-CG2 3.97Å
923	V	92.4	Very high	90	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-59.7	-19.9	170.3	172.4	0	0	0	0	111.6	F353 Y354 R868 L872 F920 S921	F353-V923 HydrophobicContact CB-CG1 3.91Å; F353-V923 HydrophobicContact CD1-CG1 3.15Å; F353-V923 HydrophobicContact CE1-CG1 3.8Å; F353-V923 HydrophobicContact CG-CG1 3.66Å; Y354-V923 HydrophobicContact CD1-CG1 4.15Å; Y354-V923 HydrophobicContact CE1-CB 4.25Å; Y354-V923 HydrophobicContact CE1-CG1 3.46Å; Y354-V923 VanDerWaalsContact CE1-CG1 3.46Å; R868-V923 WeakPolarHBondContact CD-O 3.34Å; R868-V923 PolarHBondContact NE-O 3.5Å; R868-V923 VanDerWaalsContact NE-O 3.14Å; R868-V923 PolarHBondContact NH1-O 2.9Å; L872-V923 HydrophobicContact CD2-CG2 3.93Å; F920-V923 HydrophobicContact CD2-CG2 4.04Å; F920-V923 HydrophobicContact CE2-CG2 3.89Å; F920-V923 HydrophobicContact CZ-CG2 4.32Å; F920-V923 WeakPolarHBondContact O-CB 3.09Å; F920-V923 WeakPolarHBondContact O-CG2 3.3Å; F920-V923 PolarHBondContact O-N 2.95Å; S921-V923 PolarHBondContact O-N 2.96Å; S921-V923 VanDerWaalsContact O-N 3.11Å
924	L	91.1	Very high	90.2	Very high	28 Å²	28	34.1 Å²	34.1	15%	0.147	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-92.1	-17.1	177	-58.6	175.6	0	0	0	113.7	F353 R868 S921 L922 L1009 M1010	F353-L924 HydrophobicContact CE1-CD2 3.76Å; F353-L924 HydrophobicContact CE2-CD2 4.08Å; F353-L924 HydrophobicContact CZ-CD2 3.3Å; R868-L924 PolarHBondContact NH2-O 3.47Å; R868-L924 VanDerWaalsContact NH2-O 3.08Å; S921-L924 WeakPolarHBondContact O-CB 3.47Å; S921-L924 PolarHBondContact O-N 3.48Å; L922-L924 PolarHBondContact O-N 3.34Å; L924-L1009 HydrophobicContact CD1-CB 3.69Å; L924-L1009 HydrophobicContact CD1-CD1 4Å; L924-L1009 HydrophobicContact CD1-CG 4.47Å; L924-M1010 HydrophobicContact CB-CG 4.25Å; L924-M1010 HydrophobicContact CB-SD 4.14Å; L924-M1010 HydrophobicContact CD1-CG 4.16Å
925	D	89.9	Confident	90.2	Very high	23 Å²	23	37.9 Å²	37.9	12%	0.123	20%	0.204	C	C	.	.			trans	-61.2	144	-173.1	-171.1	44.3	0	0	0	111.7	R868 L922 R1004 T1005 M1010	R868-D925 PolarHBondContact NE-O 3.5Å; R868-D925 PolarHBondContact NH2-O 3.32Å; L922-D925 WeakPolarHBondContact O-CB 3.32Å; L922-D925 PolarHBondContact O-N 3Å; L922-D925 VanDerWaalsContact O-N 3.11Å; D925-R1004 PolarHBondContact OD1-N 2.91Å; D925-R1004 VanDerWaalsContact OD1-N 3.08Å; D925-T1005 PolarHBondContact OD1-N 3.17Å; D925-T1005 VanDerWaalsContact OD1-N 3.16Å; D925-T1005 PolarHBondContact OD1-OG1 3.05Å; D925-M1010 HydrophobicContact CB-CE 4.44Å
926	Q	87.1	Confident	90.3	Very high	60 Å²	60	42.7 Å²	42.7	28%	0.28	22%	0.223	S	C	.	.			trans	-124.6	125.6	179.7	-62.3	-175.3	27.5	0	0	109.4	T1005	Q926-T1005 HydrophobicContact CB-CG2 4.44Å; Q926-T1005 PolarHBondContact N-OG1 3.21Å; Q926-T1005 WeakPolarHBondContact O-CG2 3.23Å; Q926-T1005 PolarHBondContact O-OG1 3.22Å
927	D	85.4	Confident	90.4	Very high	21 Å²	21	41.4 Å²	41.4	11%	0.112	22%	0.217	C	C	.	.	S	Bend	trans	-80.3	-34	177.5	68.4	-39.8	0	0	0	112.9	R863	R863-D927 IonicContact CZ-OD2 2.72Å; R863-D927 IonicContact NE-OD1 3.99Å; R863-D927 PolarHBondContact NE-OD1 3.45Å; R863-D927 IonicContact NE-OD2 2.71Å; R863-D927 PolarHBondContact NE-OD2 3.08Å; R863-D927 IonicContact NH2-OD2 3.32Å; R863-D927 PolarHBondContact NH2-OD2 2.91Å
928	I	88.3	Confident	90.4	Very high	18 Å²	18	44.7 Å²	44.7	9%	0.092	23%	0.233	C	C	.	.	S	Bend	trans	-143.5	156.9	175.9	60.6	175.1	0	0	0	110.6	A933 L939 Y1072	I928-A933 HydrophobicContact CD1-CB 3.64Å; I928-A933 HydrophobicContact CG1-CB 4.27Å; I928-L939 HydrophobicContact CD1-CD1 3.92Å; I928-Y1072 HydrophobicContact CG2-CD2 4.05Å; I928-Y1072 HydrophobicContact CG2-CG 4.18Å
929	T	89.9	Confident	90.4	Very high	79 Å²	79	45.2 Å²	45.2	49%	0.485	24%	0.236	S	C	.	.			trans	-72.3	159.9	174.2	64.5	0	0	0	0	111.2	E931 T932 A933	T929-E931 VanDerWaalsContact C-N 3.3Å; T929-E931 PolarHBondContact O-N 3.4Å; T929-T932 PolarHBondContact O-N 3.01Å; T929-T932 PolarHBondContact OG1-N 3.24Å; T929-T932 PolarHBondContact OG1-OG1 3.4Å; T929-A933 PolarHBondContact O-N 2.87Å; T929-A933 VanDerWaalsContact O-N 3.17Å
930	S	89.4	Confident	90.4	Very high	42 Å²	42	45.5 Å²	45.5	29%	0.294	24%	0.237	S	C	.	.	H	α-helix	trans	-60.1	-39.8	179.7	-56	0	0	0	0	112.2	R864 A933 V934	R864-S930 PolarHBondContact NH2-OG 3.35Å; S930-A933 PolarHBondContact O-N 2.88Å; S930-V934 PolarHBondContact O-N 3.04Å
931	E	89.7	Confident	90.2	Very high	154 Å²	154	49.1 Å²	49.1	72%	0.72	25%	0.253	S	S	*	.	H	α-helix	trans	-66.8	-44.6	-179.1	-65.8	174.6	-174.2	0	0	111.8	T929 A933 V934 T935	T929-E931 VanDerWaalsContact C-N 3.3Å; T929-E931 PolarHBondContact O-N 3.4Å; E931-A933 VanDerWaalsContact C-N 3.28Å; E931-A933 PolarHBondContact O-N 2.85Å; E931-V934 PolarHBondContact O-N 3.32Å; E931-T935 WeakPolarHBondContact O-CB 3.22Å; E931-T935 PolarHBondContact O-N 2.99Å; E931-T935 PolarHBondContact O-OG1 3.18Å
932	T	90.3	Very high	89.9	Confident	47 Å²	47	51 Å²	51	29%	0.288	26%	0.262	S	S	.	.	H	α-helix	trans	-63.5	-35.7	176.8	-53.3	0	0	0	0	111.5	T929 V934 T935 Y936	T929-T932 PolarHBondContact O-N 3.01Å; T929-T932 PolarHBondContact OG1-N 3.24Å; T929-T932 PolarHBondContact OG1-OG1 3.4Å; T932-V934 VanDerWaalsContact C-N 3.34Å; T932-V934 PolarHBondContact O-N 3.01Å; T932-T935 PolarHBondContact O-N 3.24Å; T932-Y936 HydrophobicContact CG2-CD2 3.85Å; T932-Y936 HydrophobicContact CG2-CE2 4.43Å; T932-Y936 PolarHBondContact O-N 3.36Å
933	A	89.7	Confident	89.7	Confident	6 Å²	6	50.9 Å²	50.9	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-64.9	-35.9	178.1	0	0	0	0	0	113.1	I860 I928 T929 S930 E931	I860-A933 HydrophobicContact CG1-CB 4.21Å; I928-A933 HydrophobicContact CD1-CB 3.64Å; I928-A933 HydrophobicContact CG1-CB 4.27Å; T929-A933 PolarHBondContact O-N 2.87Å; T929-A933 VanDerWaalsContact O-N 3.17Å; S930-A933 PolarHBondContact O-N 2.88Å; E931-A933 VanDerWaalsContact C-N 3.28Å; E931-A933 PolarHBondContact O-N 2.85Å
934	V	90.8	Very high	89.1	Confident	48 Å²	48	52.9 Å²	52.9	29%	0.291	28%	0.276	S	S	.	.	H	α-helix	trans	-81.3	-37.2	177.5	177.8	0	0	0	0	111.4	L695 I860 S930 E931 T932	L695-V934 HydrophobicContact CD1-CG1 4.32Å; I860-V934 HydrophobicContact CD1-CG2 3.89Å; I860-V934 HydrophobicContact CG1-CG2 4.24Å; S930-V934 PolarHBondContact O-N 3.04Å; E931-V934 PolarHBondContact O-N 3.32Å; T932-V934 VanDerWaalsContact C-N 3.34Å; T932-V934 PolarHBondContact O-N 3.01Å
935	T	91.4	Very high	88.7	Confident	92 Å²	92	56.3 Å²	56.3	56%	0.564	29%	0.289	S	S	*	.	H	α-helix	trans	-67.5	-38.1	178.8	-52.3	0	0	0	0	111.8	E931 T932 P937	E931-T935 WeakPolarHBondContact O-CB 3.22Å; E931-T935 PolarHBondContact O-N 2.99Å; E931-T935 PolarHBondContact O-OG1 3.18Å; T932-T935 PolarHBondContact O-N 3.24Å; T935-P937 VanDerWaalsContact C-CD 3.43Å; T935-P937 VanDerWaalsContact O-CD 3.24Å; T935-P937 WeakPolarHBondContact O-CD 3.41Å
936	Y	91.8	Very high	88.2	Confident	104 Å²	104	55.8 Å²	55.8	41%	0.408	29%	0.289	S	S	.	.			trans	-119	71.5	-179.7	-58.7	-76.8	0	0	0	111.6	T932 E938 L939 L1075	T932-Y936 HydrophobicContact CG2-CD2 3.85Å; T932-Y936 HydrophobicContact CG2-CE2 4.43Å; T932-Y936 PolarHBondContact O-N 3.36Å; Y936-E938 PolarHBondContact O-N 3.47Å; Y936-E938 VanDerWaalsContact O-N 3.14Å; Y936-L939 WeakPolarHBondContact O-CB 3.38Å; Y936-L939 WeakPolarHBondContact O-CG 3.3Å; Y936-L939 PolarHBondContact O-N 3.37Å; Y936-L1075 HydrophobicContact CD1-CD1 4.29Å; Y936-L1075 HydrophobicContact CD1-CD2 4.22Å; Y936-L1075 HydrophobicContact CD2-CD1 4.27Å; Y936-L1075 HydrophobicContact CE1-CD2 4.16Å; Y936-L1075 HydrophobicContact CG-CD1 3.97Å
937	P	92.1	Very high	87.9	Confident	10 Å²	10	60.3 Å²	60.3	7%	0.065	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-24	-176.2	25.9	-35.1	0	0	0	112.9	L695 N698 A699 L859 T935 L939 Y940	L695-P937 HydrophobicContact CD2-CB 4.47Å; L695-P937 HydrophobicContact CD2-CG 4.16Å; N698-P937 HydrophobicContact CB-CB 4.39Å; N698-P937 HydrophobicContact CB-CG 3.64Å; A699-P937 WeakPolarHBondContact CA-O 3.22Å; A699-P937 HydrophobicContact CB-CB 4.05Å; L859-P937 HydrophobicContact CD1-CB 4.15Å; T935-P937 VanDerWaalsContact C-CD 3.43Å; T935-P937 VanDerWaalsContact O-CD 3.24Å; T935-P937 WeakPolarHBondContact O-CD 3.41Å; P937-L939 PolarHBondContact O-N 2.94Å; P937-Y940 WeakPolarHBondContact O-CB 3.24Å; P937-Y940 PolarHBondContact O-N 2.96Å
938	E	90.8	Very high	87.8	Confident	144 Å²	144	60.1 Å²	60.1	67%	0.673	30%	0.304	S	S	*	.	H	α-helix	trans	-55.2	-26.5	176.7	-60.6	-174.8	177.1	0	0	113.5	Y936 Y940 K941	Y936-E938 PolarHBondContact O-N 3.47Å; Y936-E938 VanDerWaalsContact O-N 3.14Å; E938-Y940 PolarHBondContact O-N 3.35Å; E938-Y940 VanDerWaalsContact O-N 3.16Å; E938-K941 WeakPolarHBondContact O-CB 3.41Å; E938-K941 PolarHBondContact O-N 3.27Å
939	L	90.8	Very high	87.6	Confident	12 Å²	12	59.7 Å²	59.7	6%	0.063	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-23.8	175.6	-67.3	178.1	0	0	0	112.6	R863 I928 Y936 P937 L1075	R863-L939 VanDerWaalsContact NH1-C 3.31Å; R863-L939 PolarHBondContact NH1-O 3.48Å; I928-L939 HydrophobicContact CD1-CD1 3.92Å; Y936-L939 WeakPolarHBondContact O-CB 3.38Å; Y936-L939 WeakPolarHBondContact O-CG 3.3Å; Y936-L939 PolarHBondContact O-N 3.37Å; P937-L939 PolarHBondContact O-N 2.94Å; L939-L1075 HydrophobicContact CD1-CD1 3.97Å; L939-L1075 HydrophobicContact CD2-CD1 3.85Å; L939-L1075 HydrophobicContact CG-CD1 4.1Å
940	Y	92.3	Very high	87.6	Confident	7 Å²	7	57.6 Å²	57.6	3%	0.027	29%	0.291	C	S	.	.	H	α-helix	trans	-70.5	-34	175.7	-176.2	-89.1	0	0	0	111.9	L378 R380 I381 A699 V701 L858 L859 P937 E938 D942 L943	L378-Y940 PolarHBondContact O-OH 3.38Å; R380-Y940 PolarHBondContact N-OH 2.9Å; I381-Y940 PolarHBondContact N-OH 2.91Å; I381-Y940 VanDerWaalsContact N-OH 3.08Å; I381-Y940 WeakPolarHBondContact O-CE1 3.3Å; I381-Y940 PolarHBondContact O-OH 3.09Å; A699-Y940 HydrophobicContact CB-CD1 4.08Å; A699-Y940 HydrophobicContact CB-CG 4.34Å; V701-Y940 HydrophobicContact CG2-CD1 4.12Å; V701-Y940 HydrophobicContact CG2-CE1 3.75Å; L858-Y940 HydrophobicContact CB-CE2 4.4Å; L858-Y940 WeakPolarHBondContact O-CE2 3.4Å; L859-Y940 HydrophobicContact CD2-CD1 4.38Å; L859-Y940 HydrophobicContact CD2-CD2 3.83Å; L859-Y940 HydrophobicContact CD2-CG 3.69Å; P937-Y940 WeakPolarHBondContact O-CB 3.24Å; P937-Y940 PolarHBondContact O-N 2.96Å; E938-Y940 PolarHBondContact O-N 3.35Å; E938-Y940 VanDerWaalsContact O-N 3.16Å; Y940-D942 PolarHBondContact O-N 3.49Å; Y940-D942 VanDerWaalsContact O-N 3.11Å; Y940-L943 HydrophobicContact CD2-CD1 3.57Å; Y940-L943 HydrophobicContact CE2-CD1 4.05Å; Y940-L943 HydrophobicContact CG-CD1 4.1Å; Y940-L943 VanDerWaalsContact O-CB 3.26Å; Y940-L943 WeakPolarHBondContact O-CB 3.47Å; Y940-L943 PolarHBondContact O-N 3.32Å
941	K	88.4	Confident	87.5	Confident	120 Å²	120	61.9 Å²	61.9	52%	0.522	30%	0.301	S	S	.	.	H	α-helix	trans	-56	-33.2	178	-167.7	178.6	-178.7	174.4	0	112.5	A699 E938 L943 S944	A699-K941 PolarHBondContact O-N 3.43Å; E938-K941 WeakPolarHBondContact O-CB 3.41Å; E938-K941 PolarHBondContact O-N 3.27Å; K941-L943 VanDerWaalsContact C-N 3.29Å; K941-L943 PolarHBondContact O-N 3.47Å; K941-S944 PolarHBondContact O-N 2.94Å; K941-S944 PolarHBondContact O-OG 3.35Å
942	D	85.3	Confident	87.5	Confident	49 Å²	49	62 Å²	62	26%	0.262	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-23.4	177.9	-85	-18.9	0	0	0	113.9	Y940 K945	Y940-D942 PolarHBondContact O-N 3.49Å; Y940-D942 VanDerWaalsContact O-N 3.11Å; D942-K945 IonicContact OD1-NZ 2.74Å; D942-K945 PolarHBondContact OD1-NZ 2.91Å
943	L	86.5	Confident	87.5	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.01	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-70.5	-36.2	176.6	-58	161.3	0	0	0	111.2	G379 R380 R863 Y866 K867 Y940 K941 K945 G946	G379-L943 WeakPolarHBondContact O-CB 3.49Å; R380-L943 WeakPolarHBondContact CD-O 3.08Å; R380-L943 VanDerWaalsContact CZ-O 3.29Å; R380-L943 PolarHBondContact NE-O 2.93Å; R380-L943 PolarHBondContact NH1-O 3.21Å; R863-L943 HydrophobicContact CB-CD1 3.71Å; R863-L943 HydrophobicContact CG-CD1 3.71Å; R863-L943 HydrophobicContact CG-CD2 4.17Å; Y866-L943 HydrophobicContact CD1-CB 4.48Å; Y866-L943 HydrophobicContact CD1-CD2 3.91Å; Y866-L943 HydrophobicContact CE1-CD2 4.45Å; K867-L943 HydrophobicContact CD-CD2 4.19Å; K867-L943 VanDerWaalsContact CE-CD2 3.45Å; K867-L943 HydrophobicContact CG-CD2 3.98Å; Y940-L943 HydrophobicContact CD2-CD1 3.57Å; Y940-L943 HydrophobicContact CE2-CD1 4.05Å; Y940-L943 HydrophobicContact CG-CD1 4.1Å; Y940-L943 VanDerWaalsContact O-CB 3.26Å; Y940-L943 WeakPolarHBondContact O-CB 3.47Å; Y940-L943 PolarHBondContact O-N 3.32Å; K941-L943 VanDerWaalsContact C-N 3.29Å; K941-L943 PolarHBondContact O-N 3.47Å; L943-K945 PolarHBondContact O-N 2.87Å; L943-G946 PolarHBondContact O-N 3.27Å
944	S	80.3	Confident	87.5	Confident	45 Å²	45	61.5 Å²	61.5	32%	0.315	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-57.4	-24.5	-179.6	72.4	0	0	0	0	113.6	K941 G946	K941-S944 PolarHBondContact O-N 2.94Å; K941-S944 PolarHBondContact O-OG 3.35Å; S944-G946 PolarHBondContact O-N 3.11Å
945	K	81.8	Confident	87.6	Confident	99 Å²	99	64.7 Å²	64.7	43%	0.43	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-80.5	1.1	-172.7	-65.1	176.9	-173.5	152.3	0	115.9	D942 L943 R947	D942-K945 IonicContact OD1-NZ 2.74Å; D942-K945 PolarHBondContact OD1-NZ 2.91Å; L943-K945 PolarHBondContact O-N 2.87Å; K945-R947 VanDerWaalsContact C-N 3.27Å; K945-R947 HydrophobicContact CB-CG 4Å; K945-R947 PolarHBondContact O-N 2.89Å
946	G	80.2	Confident	87.6	Confident	12 Å²	12	63.4 Å²	63.4	12%	0.124	29%	0.294	C	S	.	.			trans	83.2	-7.3	179.5	0	0	0	0	0	116	R380 L943 S944 S948 L949	R380-G946 VanDerWaalsContact NH2-CA 3.35Å; L943-G946 PolarHBondContact O-N 3.27Å; S944-G946 PolarHBondContact O-N 3.11Å; G946-S948 VanDerWaalsContact C-N 3.29Å; G946-S948 PolarHBondContact O-N 3.05Å; G946-S948 VanDerWaalsContact O-N 3.11Å; G946-L949 CarbonylContact O-C 3.6Å; G946-L949 PolarHBondContact O-N 3.27Å
947	R	81.1	Confident	87.6	Confident	156 Å²	156	60.2 Å²	60.2	59%	0.589	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-67.8	-23.2	-158.1	-67.9	177.8	176	179.7	-5	115.2	K945	K945-R947 VanDerWaalsContact C-N 3.27Å; K945-R947 HydrophobicContact CB-CG 4Å; K945-R947 PolarHBondContact O-N 2.89Å
948	S	82.9	Confident	87.6	Confident	17 Å²	17	60.9 Å²	60.9	12%	0.119	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-69.4	-37.1	-179.3	-52.2	0	0	0	0	112.3	Y866 K867 Q874 G946	Y866-S948 WeakPolarHBondContact CE1-OG 3.3Å; K867-S948 WeakPolarHBondContact CD-OG 3.49Å; K867-S948 WeakPolarHBondContact CE-OG 3.48Å; K867-S948 PolarHBondContact NZ-OG 3.33Å; Q874-S948 PolarHBondContact NE2-O 3.32Å; G946-S948 VanDerWaalsContact C-N 3.29Å; G946-S948 PolarHBondContact O-N 3.05Å; G946-S948 VanDerWaalsContact O-N 3.11Å
949	L	84.8	Confident	87.8	Confident	9 Å²	9	59.8 Å²	59.8	5%	0.047	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-126.8	67.8	-178.9	-168.3	72.5	0	0	0	109.7	L292 E295 I296 L299 A870 Q874 G946	L292-L949 HydrophobicContact CG-CD2 4.02Å; E295-L949 HydrophobicContact CB-CD2 4.2Å; I296-L949 HydrophobicContact CD1-CD2 4.43Å; I296-L949 HydrophobicContact CG1-CD2 3.75Å; L299-L949 HydrophobicContact CD1-CD1 4.12Å; L299-L949 HydrophobicContact CD1-CG 4.22Å; A870-L949 HydrophobicContact CB-CB 4.19Å; Q874-L949 HydrophobicContact CG-CD1 3.98Å; G946-L949 CarbonylContact O-C 3.6Å; G946-L949 PolarHBondContact O-N 3.27Å
950	S	88.7	Confident	87.9	Confident	35 Å²	35	60.8 Å²	60.8	25%	0.245	29%	0.288	C	S	.	.			trans	-105.5	161.1	178.4	68.4	0	0	0	0	111.8	K952 T953 F954	S950-K952 PolarHBondContact O-N 3.01Å; S950-T953 PolarHBondContact N-OG1 2.78Å; S950-T953 PolarHBondContact O-N 3.29Å; S950-T953 VanDerWaalsContact O-N 3.16Å; S950-T953 PolarHBondContact O-OG1 2.94Å; S950-T953 PolarHBondContact OG-N 2.92Å; S950-T953 PolarHBondContact OG-OG1 3.44Å; S950-F954 WeakPolarHBondContact O-CB 3.33Å; S950-F954 PolarHBondContact O-N 3.47Å
951	Y	88.4	Confident	88	Confident	131 Å²	131	60.4 Å²	60.4	51%	0.514	29%	0.287	S	S	.	.	H	α-helix	trans	-53.8	-37.9	170.4	-73.3	-72.5	0	0	0	112.2	L299 V302 F954 F955	L299-Y951 HydrophobicContact CD2-CD1 3.74Å; L299-Y951 HydrophobicContact CD2-CE1 3.67Å; V302-Y951 HydrophobicContact CG2-CE1 4.11Å; Y951-F954 WeakPolarHBondContact O-CB 3.44Å; Y951-F954 PolarHBondContact O-N 3.24Å; Y951-F955 HydrophobicContact CD1-CE2 4.47Å; Y951-F955 WeakPolarHBondContact O-CD2 3.28Å; Y951-F955 PolarHBondContact O-N 3.03Å
952	K	90.1	Very high	88.3	Confident	157 Å²	157	58.9 Å²	58.9	68%	0.683	28%	0.284	S	S	*	.	H	α-helix	trans	-60.8	-50.3	176.9	-178.6	176.7	-178.3	171.7	0	112	S950 F954 F955 I956	S950-K952 PolarHBondContact O-N 3.01Å; K952-F954 VanDerWaalsContact C-N 3.3Å; K952-F954 PolarHBondContact O-N 3.01Å; K952-F955 PolarHBondContact O-N 2.92Å; K952-I956 HydrophobicContact CG-CD1 4.29Å; K952-I956 WeakPolarHBondContact O-CG1 3.43Å; K952-I956 PolarHBondContact O-N 2.99Å
953	T	89.1	Confident	88.8	Confident	35 Å²	35	60.6 Å²	60.6	22%	0.215	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-37.8	178.3	43.8	0	0	0	0	111.3	Q874 S950 I956 W957	Q874-T953 PolarHBondContact NE2-OG1 3.46Å; S950-T953 PolarHBondContact N-OG1 2.78Å; S950-T953 PolarHBondContact O-N 3.29Å; S950-T953 VanDerWaalsContact O-N 3.16Å; S950-T953 PolarHBondContact O-OG1 2.94Å; S950-T953 PolarHBondContact OG-N 2.92Å; S950-T953 PolarHBondContact OG-OG1 3.44Å; T953-I956 PolarHBondContact O-N 2.96Å; T953-W957 PolarHBondContact O-N 3.22Å; T953-W957 VanDerWaalsContact O-N 3.11Å
954	F	90.5	Very high	89.2	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-60.4	-50.4	176	168.9	-98.8	0	0	0	112.1	L299 V302 L303 I877 S950 Y951 K952 I956 W957 V958	L299-F954 HydrophobicContact CB-CD2 4.47Å; L299-F954 HydrophobicContact CB-CE2 4.34Å; L299-F954 HydrophobicContact CD1-CB 4.43Å; L299-F954 HydrophobicContact CD1-CD2 4Å; L299-F954 HydrophobicContact CD1-CG 4.37Å; L299-F954 HydrophobicContact CD2-CB 4.07Å; L299-F954 HydrophobicContact CD2-CD1 4.03Å; L299-F954 HydrophobicContact CD2-CD2 4Å; L299-F954 HydrophobicContact CD2-CE1 4.47Å; L299-F954 HydrophobicContact CD2-CE2 4.44Å; L299-F954 HydrophobicContact CD2-CG 3.76Å; L299-F954 HydrophobicContact CG-CD2 4.39Å; V302-F954 HydrophobicContact CG1-CE1 4.36Å; L303-F954 HydrophobicContact CD1-CE2 4.25Å; L303-F954 HydrophobicContact CD1-CZ 4.42Å; L303-F954 HydrophobicContact CD2-CE2 4.07Å; L303-F954 HydrophobicContact CD2-CZ 3.58Å; L303-F954 HydrophobicContact CG-CE2 4.14Å; L303-F954 HydrophobicContact CG-CZ 3.81Å; I877-F954 HydrophobicContact CG2-CE2 4.06Å; S950-F954 WeakPolarHBondContact O-CB 3.33Å; S950-F954 PolarHBondContact O-N 3.47Å; Y951-F954 WeakPolarHBondContact O-CB 3.44Å; Y951-F954 PolarHBondContact O-N 3.24Å; K952-F954 VanDerWaalsContact C-N 3.3Å; K952-F954 PolarHBondContact O-N 3.01Å; F954-I956 VanDerWaalsContact C-N 3.3Å; F954-I956 PolarHBondContact O-N 3.38Å; F954-W957 WeakPolarHBondContact O-CB 3.49Å; F954-W957 PolarHBondContact O-N 3.28Å; F954-W957 VanDerWaalsContact O-N 3.09Å; F954-V958 HydrophobicContact CD1-CG2 4.28Å; F954-V958 HydrophobicContact CD2-CG2 4.49Å; F954-V958 HydrophobicContact CE1-CG2 3.89Å; F954-V958 HydrophobicContact CE2-CG2 4.14Å; F954-V958 HydrophobicContact CZ-CG2 3.82Å; F954-V958 WeakPolarHBondContact O-CG2 3.33Å; F954-V958 PolarHBondContact O-N 3.19Å
955	F	92.3	Very high	89.9	Confident	115 Å²	115	58.3 Å²	58.3	50%	0.504	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-31.6	178.6	-76.3	-64.2	0	0	0	113.5	Y951 K952 V958 L959	Y951-F955 HydrophobicContact CD1-CE2 4.47Å; Y951-F955 WeakPolarHBondContact O-CD2 3.28Å; Y951-F955 PolarHBondContact O-N 3.03Å; K952-F955 PolarHBondContact O-N 2.92Å; F955-V958 PolarHBondContact O-N 2.83Å; F955-L959 PolarHBondContact O-N 2.75Å
956	I	91.3	Very high	90.5	Very high	64 Å²	64	54.5 Å²	54.5	33%	0.328	26%	0.26	S	S	.	.	H	α-helix	trans	-60.8	-47.1	171.2	-69.6	166.2	0	0	0	110.1	K952 T953 F954 L959 I960	K952-I956 HydrophobicContact CG-CD1 4.29Å; K952-I956 WeakPolarHBondContact O-CG1 3.43Å; K952-I956 PolarHBondContact O-N 2.99Å; T953-I956 PolarHBondContact O-N 2.96Å; F954-I956 VanDerWaalsContact C-N 3.3Å; F954-I956 PolarHBondContact O-N 3.38Å; I956-L959 PolarHBondContact O-N 2.95Å; I956-I960 HydrophobicContact CG2-CD1 3.94Å; I956-I960 VanDerWaalsContact O-CG1 3.28Å; I956-I960 WeakPolarHBondContact O-CG1 3.48Å; I956-I960 PolarHBondContact O-N 3.27Å
957	W	91.7	Very high	91.2	Very high	37 Å²	37	55.3 Å²	55.3	14%	0.14	26%	0.262	C	S	.	.	H	α-helix	trans	-64.6	-37.9	176.8	-81.3	110.1	0	0	0	113	Q874 F875 H878 T953 F954 L959 I960 S961 T1002	Q874-W957 HydrophobicContact CB-CD2 4.49Å; Q874-W957 HydrophobicContact CB-CG 4.36Å; F875-W957 HydrophobicContact CD2-CH2 4.28Å; F875-W957 AromaticContact CE1-CH2 3.99Å; F875-W957 HydrophobicContact CE1-CH2 3.99Å; F875-W957 HydrophobicContact CE1-CZ3 4.26Å; F875-W957 AromaticContact CE2-CH2 3.66Å; F875-W957 HydrophobicContact CE2-CH2 3.66Å; F875-W957 HydrophobicContact CE2-CZ2 4.06Å; F875-W957 AromaticContact CZ-CH2 3.49Å; F875-W957 HydrophobicContact CZ-CH2 3.49Å; F875-W957 VanDerWaalsContact CZ-CH2 3.49Å; F875-W957 HydrophobicContact CZ-CZ2 4.33Å; F875-W957 HydrophobicContact CZ-CZ3 4.2Å; H878-W957 HydrophobicContact CB-CE3 3.97Å; H878-W957 HydrophobicContact CB-CZ3 4.36Å; H878-W957 AromaticContact CG-CE3 3.8Å; H878-W957 AromaticContact CG-CZ3 3.95Å; H878-W957 AromaticContact ND1-CE3 3.77Å; T953-W957 PolarHBondContact O-N 3.22Å; T953-W957 VanDerWaalsContact O-N 3.11Å; F954-W957 WeakPolarHBondContact O-CB 3.49Å; F954-W957 PolarHBondContact O-N 3.28Å; F954-W957 VanDerWaalsContact O-N 3.09Å; W957-L959 VanDerWaalsContact C-N 3.34Å; W957-L959 PolarHBondContact O-N 3.02Å; W957-I960 HydrophobicContact CE3-CD1 4.34Å; W957-I960 PolarHBondContact O-N 2.78Å; W957-S961 PolarHBondContact O-N 3.11Å; W957-S961 PolarHBondContact O-OG 3.1Å; W957-T1002 HydrophobicContact CH2-CG2 4.26Å
958	V	92.8	Very high	91.8	Very high	24 Å²	24	47.9 Å²	47.9	15%	0.145	23%	0.234	C	C	.	.	H	α-helix	trans	-58.9	-45.7	172.7	171.3	0	0	0	0	111	L881 F954 F955 I960 S961 I962	L881-V958 HydrophobicContact CD1-CB 4.43Å; L881-V958 HydrophobicContact CD1-CG2 3.74Å; L881-V958 HydrophobicContact CD2-CG1 4.5Å; L881-V958 HydrophobicContact CD2-CG2 4.39Å; F954-V958 HydrophobicContact CD1-CG2 4.28Å; F954-V958 HydrophobicContact CD2-CG2 4.49Å; F954-V958 HydrophobicContact CE1-CG2 3.89Å; F954-V958 HydrophobicContact CE2-CG2 4.14Å; F954-V958 HydrophobicContact CZ-CG2 3.82Å; F954-V958 WeakPolarHBondContact O-CG2 3.33Å; F954-V958 PolarHBondContact O-N 3.19Å; F955-V958 PolarHBondContact O-N 2.83Å; V958-I960 VanDerWaalsContact C-N 3.34Å; V958-I960 PolarHBondContact O-N 3.36Å; V958-S961 WeakPolarHBondContact O-CB 2.99Å; V958-S961 PolarHBondContact O-N 3.28Å; V958-I962 HydrophobicContact CG1-CD1 3.79Å; V958-I962 HydrophobicContact CG1-CG1 4.46Å; V958-I962 WeakPolarHBondContact O-CG1 3.2Å; V958-I962 PolarHBondContact O-N 3.17Å
959	L	93.9	Very high	92.3	Very high	122 Å²	122	47 Å²	47	64%	0.639	23%	0.229	S	C	*	.	H	α-helix	trans	-63.5	-40.6	177.9	-176.1	65.5	0	0	0	111.9	F955 I956 W957 I962 Y963	F955-L959 PolarHBondContact O-N 2.75Å; I956-L959 PolarHBondContact O-N 2.95Å; W957-L959 VanDerWaalsContact C-N 3.34Å; W957-L959 PolarHBondContact O-N 3.02Å; L959-I962 PolarHBondContact O-N 3.42Å; L959-Y963 WeakPolarHBondContact O-CB 3.46Å; L959-Y963 PolarHBondContact O-N 3.29Å
960	I	93.4	Very high	92.5	Very high	32 Å²	32	53.6 Å²	53.6	16%	0.164	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-46.6	175	-66.9	168	0	0	0	110.3	I956 W957 V958 I962 Y963 Q964 M998 L1057	I956-I960 HydrophobicContact CG2-CD1 3.94Å; I956-I960 VanDerWaalsContact O-CG1 3.28Å; I956-I960 WeakPolarHBondContact O-CG1 3.48Å; I956-I960 PolarHBondContact O-N 3.27Å; W957-I960 HydrophobicContact CE3-CD1 4.34Å; W957-I960 PolarHBondContact O-N 2.78Å; V958-I960 VanDerWaalsContact C-N 3.34Å; V958-I960 PolarHBondContact O-N 3.36Å; I960-I962 PolarHBondContact O-N 3.42Å; I960-Y963 PolarHBondContact O-N 3.17Å; I960-Q964 HydrophobicContact CG2-CG 4.45Å; I960-Q964 WeakPolarHBondContact O-CG 3.48Å; I960-Q964 PolarHBondContact O-N 3.08Å; I960-M998 HydrophobicContact CG2-CE 4.23Å; I960-L1057 HydrophobicContact CG1-CD2 4.06Å; I960-L1057 HydrophobicContact CG2-CD1 3.61Å; I960-L1057 HydrophobicContact CG2-CD2 4.17Å
961	S	94.9	Very high	92.6	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-43.9	176.6	-65.9	0	0	0	0	112.8	H878 L881 W957 V958 Y963 G965	H878-S961 WeakPolarHBondContact CA-OG 3.38Å; H878-S961 PolarHBondContact ND1-OG 3.29Å; H878-S961 PolarHBondContact O-OG 3.38Å; H878-S961 VanDerWaalsContact O-OG 3.11Å; L881-S961 VanDerWaalsContact CB-CB 3.42Å; L881-S961 WeakPolarHBondContact CB-OG 3.46Å; W957-S961 PolarHBondContact O-N 3.11Å; W957-S961 PolarHBondContact O-OG 3.1Å; V958-S961 WeakPolarHBondContact O-CB 2.99Å; V958-S961 PolarHBondContact O-N 3.28Å; S961-Y963 VanDerWaalsContact C-N 3.34Å; S961-G965 PolarHBondContact O-N 3.23Å
962	I	94.8	Very high	92.6	Very high	88 Å²	88	46.6 Å²	46.6	45%	0.451	23%	0.226	S	C	.	.	H	α-helix	trans	-64.3	-43.1	179.5	-69.7	167.9	0	0	0	110.2	T885 V958 L959 I960 G966	T885-I962 HydrophobicContact CG2-CG2 4.42Å; V958-I962 HydrophobicContact CG1-CD1 3.79Å; V958-I962 HydrophobicContact CG1-CG1 4.46Å; V958-I962 WeakPolarHBondContact O-CG1 3.2Å; V958-I962 PolarHBondContact O-N 3.17Å; L959-I962 PolarHBondContact O-N 3.42Å; I960-I962 PolarHBondContact O-N 3.42Å; I962-G966 PolarHBondContact O-N 3.19Å
963	Y	95.6	Very high	92.4	Very high	84 Å²	84	40.8 Å²	40.8	33%	0.329	20%	0.203	S	C	.	.	H	α-helix	trans	-60.8	-54.6	176.9	171.5	-103.8	0	0	0	111.5	L959 I960 S961 G965 G966 V967 V1052 P1056 L1057	L959-Y963 WeakPolarHBondContact O-CB 3.46Å; L959-Y963 PolarHBondContact O-N 3.29Å; I960-Y963 PolarHBondContact O-N 3.17Å; S961-Y963 VanDerWaalsContact C-N 3.34Å; Y963-G965 PolarHBondContact O-N 3.1Å; Y963-G966 PolarHBondContact O-N 3.29Å; Y963-V967 HydrophobicContact CD2-CG2 4.11Å; Y963-V967 HydrophobicContact CE1-CG2 4.33Å; Y963-V967 HydrophobicContact CE2-CG2 3.68Å; Y963-V967 WeakPolarHBondContact O-CB 3.49Å; Y963-V967 VanDerWaalsContact O-CG2 3.3Å; Y963-V967 WeakPolarHBondContact O-CG2 3.18Å; Y963-V967 PolarHBondContact O-N 3.36Å; Y963-V1052 PolarHBondContact OH-O 2.71Å; Y963-P1056 WeakPolarHBondContact OH-CG 3.27Å; Y963-L1057 HydrophobicContact CD1-CD1 4.4Å; Y963-L1057 HydrophobicContact CD1-CD2 4.27Å; Y963-L1057 HydrophobicContact CD1-CG 4.35Å; Y963-L1057 HydrophobicContact CE1-CG 4.36Å
964	Q	95	Very high	92.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-44.4	-177.7	-68.7	-173.2	-62.3	0	0	111.5	H878 I882 I960 G966 V967 I968 M998 S1053 L1057	H878-Q964 PolarHBondContact CE1-OE1 2.64Å; H878-Q964 PolarHBondContact NE2-OE1 3.31Å; I882-Q964 HydrophobicContact CD1-CB 4.32Å; I960-Q964 HydrophobicContact CG2-CG 4.45Å; I960-Q964 WeakPolarHBondContact O-CG 3.48Å; I960-Q964 PolarHBondContact O-N 3.08Å; Q964-G966 VanDerWaalsContact C-N 3.34Å; Q964-G966 PolarHBondContact O-N 2.94Å; Q964-V967 PolarHBondContact O-N 3.48Å; Q964-I968 WeakPolarHBondContact O-CB 3.45Å; Q964-I968 WeakPolarHBondContact O-CD1 3.26Å; Q964-I968 WeakPolarHBondContact O-CG1 3.29Å; Q964-I968 PolarHBondContact O-N 3.48Å; Q964-M998 VanDerWaalsContact NE2-CG 3.35Å; Q964-M998 PolarHBondContact NE2-SD 3.18Å; Q964-S1053 WeakPolarHBondContact CG-OG 3.11Å; Q964-S1053 PolarHBondContact NE2-O 3.2Å; Q964-L1057 VanDerWaalsContact CD-CD1 3.43Å; Q964-L1057 HydrophobicContact CG-CD1 3.67Å; Q964-L1057 VanDerWaalsContact NE2-CD1 3.3Å
965	G	94.8	Very high	91.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-38.5	178.5	0	0	0	0	0	113.4	S961 Y963 M969	S961-G965 PolarHBondContact O-N 3.23Å; Y963-G965 PolarHBondContact O-N 3.1Å; G965-M969 WeakPolarHBondContact O-CB 3.1Å; G965-M969 PolarHBondContact O-N 3.36Å; G965-M969 VanDerWaalsContact O-N 3.13Å
966	G	93.9	Very high	90.8	Very high	18 Å²	18	41.7 Å²	41.7	19%	0.186	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-47.4	173.6	0	0	0	0	0	112.4	I962 Y963 Q964 M969 Y970	I962-G966 PolarHBondContact O-N 3.19Å; Y963-G966 PolarHBondContact O-N 3.29Å; Q964-G966 VanDerWaalsContact C-N 3.34Å; Q964-G966 PolarHBondContact O-N 2.94Å; G966-M969 PolarHBondContact O-N 3.02Å; G966-Y970 WeakPolarHBondContact O-CB 3.37Å; G966-Y970 PolarHBondContact O-N 3.29Å
967	V	94.6	Very high	89.5	Confident	29 Å²	29	44.3 Å²	44.3	18%	0.176	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-44.5	177.8	168.9	0	0	0	0	111.5	Y963 Q964 G971 V1052	Y963-V967 HydrophobicContact CD2-CG2 4.11Å; Y963-V967 HydrophobicContact CE1-CG2 4.33Å; Y963-V967 HydrophobicContact CE2-CG2 3.68Å; Y963-V967 WeakPolarHBondContact O-CB 3.49Å; Y963-V967 VanDerWaalsContact O-CG2 3.3Å; Y963-V967 WeakPolarHBondContact O-CG2 3.18Å; Y963-V967 PolarHBondContact O-N 3.36Å; Q964-V967 PolarHBondContact O-N 3.48Å; V967-G971 WeakPolarHBondContact O-CA 3.23Å; V967-G971 PolarHBondContact O-N 3.43Å; V967-V1052 HydrophobicContact CG1-CB 4.21Å; V967-V1052 HydrophobicContact CG1-CG1 3.84Å
968	I	94.4	Very high	88	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-48.9	-179.9	-66.8	162.5	0	0	0	110.6	L886 Q964 A972 A990 L991 T994 I1049	L886-I968 HydrophobicContact CD2-CB 4.49Å; L886-I968 HydrophobicContact CD2-CG2 3.88Å; L886-I968 HydrophobicContact CG-CG2 4.5Å; Q964-I968 WeakPolarHBondContact O-CB 3.45Å; Q964-I968 WeakPolarHBondContact O-CD1 3.26Å; Q964-I968 WeakPolarHBondContact O-CG1 3.29Å; Q964-I968 PolarHBondContact O-N 3.48Å; I968-A972 VanDerWaalsContact O-CB 3.22Å; I968-A972 WeakPolarHBondContact O-CB 3.38Å; I968-A972 PolarHBondContact O-N 2.92Å; I968-A990 HydrophobicContact CG2-CB 4.17Å; I968-L991 HydrophobicContact CD1-CD1 4.46Å; I968-T994 HydrophobicContact CD1-CG2 4.26Å; I968-I1049 HydrophobicContact CB-CG2 4.25Å; I968-I1049 HydrophobicContact CG1-CG2 4.06Å; I968-I1049 HydrophobicContact CG2-CG2 4.36Å
969	M	92.4	Very high	86.7	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-71.9	-49	-177.4	-178.9	54	64.3	0	0	112.4	L886 V889 F890 L901 G965 G966 G971 A972 L973 I983	L886-M969 HydrophobicContact CB-CE 3.96Å; L886-M969 HydrophobicContact CD2-CE 4.3Å; L886-M969 HydrophobicContact CG-CB 4.26Å; L886-M969 HydrophobicContact CG-CE 4.29Å; V889-M969 HydrophobicContact CB-CB 4.16Å; V889-M969 HydrophobicContact CB-CG 3.78Å; V889-M969 HydrophobicContact CG1-CB 4.02Å; V889-M969 HydrophobicContact CG1-CG 3.51Å; F890-M969 HydrophobicContact CB-CE 3.9Å; F890-M969 HydrophobicContact CB-SD 4.11Å; F890-M969 HydrophobicContact CD2-CE 4.47Å; F890-M969 HydrophobicContact CD2-SD 4.34Å; L901-M969 HydrophobicContact CD1-CE 3.94Å; L901-M969 HydrophobicContact CD2-CE 3.21Å; L901-M969 HydrophobicContact CG-CE 4.2Å; G965-M969 WeakPolarHBondContact O-CB 3.1Å; G965-M969 PolarHBondContact O-N 3.36Å; G965-M969 VanDerWaalsContact O-N 3.13Å; G966-M969 PolarHBondContact O-N 3.02Å; M969-G971 VanDerWaalsContact C-N 3.35Å; M969-G971 PolarHBondContact O-N 2.93Å; M969-A972 PolarHBondContact O-N 3.35Å; M969-L973 HydrophobicContact CG-CD1 4.18Å; M969-L973 WeakPolarHBondContact O-CG 3.27Å; M969-L973 PolarHBondContact O-N 3.46Å; M969-L973 HydrophobicContact SD-CD1 4.22Å; M969-L973 HydrophobicContact SD-CG 4.3Å; M969-I983 HydrophobicContact SD-CD1 4.37Å
970	Y	90.5	Very high	85.4	Confident	147 Å²	147	54 Å²	54	58%	0.576	27%	0.273	S	S	*	.	H	α-helix	trans	-66.6	-38.8	-179.2	-171.4	-113	0	0	0	111.8	G966 L973 I974	G966-Y970 WeakPolarHBondContact O-CB 3.37Å; G966-Y970 PolarHBondContact O-N 3.29Å; Y970-L973 PolarHBondContact O-N 3.45Å; Y970-I974 HydrophobicContact CD1-CD1 3.65Å; Y970-I974 HydrophobicContact CD1-CG1 4.47Å; Y970-I974 HydrophobicContact CE1-CD1 3.14Å; Y970-I974 HydrophobicContact CE1-CG1 4.18Å; Y970-I974 HydrophobicContact CE2-CD1 4.18Å; Y970-I974 HydrophobicContact CE2-CG1 4.46Å; Y970-I974 HydrophobicContact CG-CD1 4.37Å; Y970-I974 VanDerWaalsContact CZ-CD1 3.44Å; Y970-I974 WeakPolarHBondContact O-CG1 3.27Å; Y970-I974 PolarHBondContact O-N 3.09Å
971	G	89.7	Confident	84.3	Confident	17 Å²	17	59.5 Å²	59.5	18%	0.175	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-42.8	172.8	0	0	0	0	0	112.4	V967 M969 L973 I974 L975	V967-G971 WeakPolarHBondContact O-CA 3.23Å; V967-G971 PolarHBondContact O-N 3.43Å; M969-G971 VanDerWaalsContact C-N 3.35Å; M969-G971 PolarHBondContact O-N 2.93Å; G971-L973 VanDerWaalsContact C-N 3.3Å; G971-L973 PolarHBondContact O-N 3.34Å; G971-I974 PolarHBondContact O-N 3.38Å; G971-L975 VanDerWaalsContact O-CB 3.29Å; G971-L975 WeakPolarHBondContact O-CB 3.29Å; G971-L975 VanDerWaalsContact O-CG 3.29Å; G971-L975 WeakPolarHBondContact O-CG 3.43Å; G971-L975 PolarHBondContact O-N 3.37Å
972	A	87.9	Confident	83.6	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-62.2	-36.6	174.8	0	0	0	0	0	112.5	I968 M969 I983 I1049	I968-A972 VanDerWaalsContact O-CB 3.22Å; I968-A972 WeakPolarHBondContact O-CB 3.38Å; I968-A972 PolarHBondContact O-N 2.92Å; M969-A972 PolarHBondContact O-N 3.35Å; A972-I983 HydrophobicContact CB-CG1 4.31Å; A972-I1049 HydrophobicContact CB-CD1 4.33Å
973	L	85.9	Confident	83.1	Confident	35 Å²	35	56.8 Å²	56.8	18%	0.183	29%	0.287	C	S	.	.	H	α-helix	trans	-72	-40.2	177	-71.8	167.1	0	0	0	113.3	V893 F894 M969 Y970 G971 I983	V893-L973 HydrophobicContact CB-CD1 4.19Å; V893-L973 HydrophobicContact CG1-CD1 4.03Å; V893-L973 HydrophobicContact CG2-CD1 3.92Å; F894-L973 HydrophobicContact CE2-CD2 3.79Å; F894-L973 HydrophobicContact CZ-CD2 3.84Å; M969-L973 HydrophobicContact CG-CD1 4.18Å; M969-L973 WeakPolarHBondContact O-CG 3.27Å; M969-L973 PolarHBondContact O-N 3.46Å; M969-L973 HydrophobicContact SD-CD1 4.22Å; M969-L973 HydrophobicContact SD-CG 4.3Å; Y970-L973 PolarHBondContact O-N 3.45Å; G971-L973 VanDerWaalsContact C-N 3.3Å; G971-L973 PolarHBondContact O-N 3.34Å; L973-I983 HydrophobicContact CD2-CD1 3.52Å; L973-I983 HydrophobicContact CG-CD1 4.13Å
974	I	85.2	Confident	82.7	Confident	94 Å²	94	54.5 Å²	54.5	48%	0.482	28%	0.282	S	S	.	.	H	α-helix	trans	-71	-44.8	178.9	-74	177.5	0	0	0	111.4	Y970 G971 F976	Y970-I974 HydrophobicContact CD1-CD1 3.65Å; Y970-I974 HydrophobicContact CD1-CG1 4.47Å; Y970-I974 HydrophobicContact CE1-CD1 3.14Å; Y970-I974 HydrophobicContact CE1-CG1 4.18Å; Y970-I974 HydrophobicContact CE2-CD1 4.18Å; Y970-I974 HydrophobicContact CE2-CG1 4.46Å; Y970-I974 HydrophobicContact CG-CD1 4.37Å; Y970-I974 VanDerWaalsContact CZ-CD1 3.44Å; Y970-I974 WeakPolarHBondContact O-CG1 3.27Å; Y970-I974 PolarHBondContact O-N 3.09Å; G971-I974 PolarHBondContact O-N 3.38Å; I974-F976 PolarHBondContact O-N 3.32Å
975	L	82.6	Confident	82.3	Confident	51 Å²	51	54.6 Å²	54.6	27%	0.267	28%	0.283	S	S	.	.	S	Bend	trans	-75	-6.1	-172.9	-67.6	170.4	0	0	0	112.8	G971 L1048 I1049	G971-L975 VanDerWaalsContact O-CB 3.29Å; G971-L975 WeakPolarHBondContact O-CB 3.29Å; G971-L975 VanDerWaalsContact O-CG 3.29Å; G971-L975 WeakPolarHBondContact O-CG 3.43Å; G971-L975 PolarHBondContact O-N 3.37Å; L975-L1048 HydrophobicContact CD1-CD2 3.96Å; L975-L1048 HydrophobicContact CD2-CD2 4.24Å; L975-I1049 HydrophobicContact CD1-CD1 4.01Å; L975-I1049 HydrophobicContact CD1-CG1 3.7Å
976	F	72	Confident	82	Confident	32 Å²	32	54.6 Å²	54.6	14%	0.14	28%	0.283	C	S	.	.			trans	-143.7	94.2	179.7	-68.8	-89.8	0	0	0	111.8	I974 I986 F1036 K1045	I974-F976 PolarHBondContact O-N 3.32Å; F976-I986 HydrophobicContact CD1-CD1 4.03Å; F976-I986 HydrophobicContact CD2-CD1 3.59Å; F976-I986 HydrophobicContact CE1-CD1 3.63Å; F976-I986 HydrophobicContact CE2-CB 4.35Å; F976-I986 HydrophobicContact CE2-CD1 3.15Å; F976-I986 HydrophobicContact CE2-CG1 3.74Å; F976-I986 HydrophobicContact CE2-CG2 3.94Å; F976-I986 HydrophobicContact CG-CD1 3.96Å; F976-I986 HydrophobicContact CZ-CD1 3.1Å; F976-I986 HydrophobicContact CZ-CG1 3.69Å; F976-F1036 HydrophobicContact CE1-CE2 4.2Å; F976-F1036 AromaticContact CE1-CZ 3.74Å; F976-F1036 HydrophobicContact CE1-CZ 3.74Å; F976-F1036 AromaticContact CZ-CZ 3.94Å; F976-F1036 HydrophobicContact CZ-CZ 3.94Å; F976-K1045 HydrophobicContact CD1-CD 4.35Å; F976-K1045 HydrophobicContact CD2-CD 4.08Å; F976-K1045 HydrophobicContact CE1-CD 3.55Å; F976-K1045 HydrophobicContact CE2-CB 3.73Å; F976-K1045 HydrophobicContact CE2-CD 3.19Å; F976-K1045 HydrophobicContact CE2-CG 4Å; F976-K1045 HydrophobicContact CZ-CB 3.97Å; F976-K1045 HydrophobicContact CZ-CD 2.93Å; F976-K1045 HydrophobicContact CZ-CG 4.03Å
977	V	62.8	Low	81.9	Confident	120 Å²	120	53.8 Å²	53.8	73%	0.727	27%	0.274	S	S	*	.	S	Bend	trans	-91.9	-21.5	177	-178.6	0	0	0	0	111.9
978	D	61.1	Low	81.8	Confident	154 Å²	154	52.4 Å²	52.4	82%	0.824	27%	0.266	S	S	*	.	S	Bend	trans	-105.2	-17.9	-163	-57	-47.1	0	0	0	115.8
979	E	64.6	Low	81.7	Confident	110 Å²	110	52.5 Å²	52.5	51%	0.514	27%	0.267	S	S	.	.			trans	-139.4	93.9	-179.4	-70.7	-179.6	166.2	0	0	113.2	I981 H982	E979-I981 VanDerWaalsContact C-N 3.27Å; E979-I981 PolarHBondContact O-N 3.39Å; E979-H982 PolarHBondContact O-N 3Å; E979-H982 IonicContact OE2-CD2 3.98Å; E979-H982 PolarHBondContact OE2-CD2 3.45Å; E979-H982 VanDerWaalsContact OE2-CD2 3.26Å; E979-H982 IonicContact OE2-NE2 3.5Å
980	F	67.4	Low	81.8	Confident	123 Å²	123	52.5 Å²	52.5	54%	0.539	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-63.8	-26.3	-177	-179.8	-110	0	0	0	114.2	F890 F894 H982 I983	F890-F980 HydrophobicContact CE2-CE2 4.17Å; F890-F980 HydrophobicContact CE2-CZ 4.14Å; F890-F980 HydrophobicContact CZ-CZ 4.27Å; F894-F980 HydrophobicContact CD1-CE2 4.22Å; F894-F980 HydrophobicContact CD1-CZ 4.46Å; F894-F980 AromaticContact CE1-CD2 3.89Å; F894-F980 HydrophobicContact CE1-CD2 3.89Å; F894-F980 AromaticContact CE1-CE2 3.32Å; F894-F980 HydrophobicContact CE1-CE2 3.32Å; F894-F980 AromaticContact CE1-CZ 3.95Å; F894-F980 HydrophobicContact CE1-CZ 3.95Å; F894-F980 AromaticContact CE2-CE2 3.93Å; F894-F980 HydrophobicContact CE2-CE2 3.93Å; F894-F980 AromaticContact CZ-CD2 3.8Å; F894-F980 HydrophobicContact CZ-CD2 3.8Å; F894-F980 AromaticContact CZ-CE2 3.18Å; F894-F980 HydrophobicContact CZ-CE2 3.18Å; F894-F980 HydrophobicContact CZ-CZ 4.11Å; F980-H982 PolarHBondContact O-N 3.37Å; F980-I983 HydrophobicContact CD2-CG2 4.28Å; F980-I983 HydrophobicContact CE2-CG2 4.1Å; F980-I983 WeakPolarHBondContact O-CG2 3.3Å; F980-I983 PolarHBondContact O-N 3.47Å
981	I	69.3	Low	82	Confident	147 Å²	147	45.5 Å²	45.5	75%	0.754	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-63.6	-32	-175.3	-61	172.5	0	0	0	111.3	E979	E979-I981 VanDerWaalsContact C-N 3.27Å; E979-I981 PolarHBondContact O-N 3.39Å
982	H	80.3	Confident	82.3	Confident	21 Å²	21	44.7 Å²	44.7	10%	0.097	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-86	-9.3	-175.2	-60.1	-58	0	0	0	114.5	E979 F980 V984 A985 I986 D1033 F1036	E979-H982 PolarHBondContact O-N 3Å; E979-H982 IonicContact OE2-CD2 3.98Å; E979-H982 PolarHBondContact OE2-CD2 3.45Å; E979-H982 VanDerWaalsContact OE2-CD2 3.26Å; E979-H982 IonicContact OE2-NE2 3.5Å; F980-H982 PolarHBondContact O-N 3.37Å; H982-V984 PolarHBondContact O-N 3.38Å; H982-V984 VanDerWaalsContact O-N 3.1Å; H982-A985 WeakPolarHBondContact O-CB 3.48Å; H982-A985 PolarHBondContact O-N 3.18Å; H982-I986 HydrophobicContact CB-CD1 4.12Å; H982-I986 WeakPolarHBondContact O-CD1 3.24Å; H982-I986 PolarHBondContact O-N 3.01Å; H982-D1033 IonicContact CE1-OD2 3.69Å; H982-D1033 PolarHBondContact CE1-OD2 3.45Å; H982-F1036 HydrophobicContact CB-CD1 4.05Å; H982-F1036 HydrophobicContact CB-CE1 3.65Å; H982-F1036 HydrophobicContact CB-CZ 3.96Å; H982-F1036 AromaticContact CG-CD1 3.82Å; H982-F1036 AromaticContact CG-CE1 3.9Å; H982-F1036 AromaticContact ND1-CD1 3.66Å; H982-F1036 AromaticContact ND1-CG 3.81Å
983	I	85	Confident	82.6	Confident	10 Å²	10	47.5 Å²	47.5	5%	0.051	24%	0.244	C	C	.	.	H	α-helix	trans	-54.4	-36.8	-177.6	-165	175	0	0	0	112.4	M969 A972 L973 F980 S987	M969-I983 HydrophobicContact SD-CD1 4.37Å; A972-I983 HydrophobicContact CB-CG1 4.31Å; L973-I983 HydrophobicContact CD2-CD1 3.52Å; L973-I983 HydrophobicContact CG-CD1 4.13Å; F980-I983 HydrophobicContact CD2-CG2 4.28Å; F980-I983 HydrophobicContact CE2-CG2 4.1Å; F980-I983 WeakPolarHBondContact O-CG2 3.3Å; F980-I983 PolarHBondContact O-N 3.47Å; I983-S987 VanDerWaalsContact O-CB 3.23Å; I983-S987 WeakPolarHBondContact O-CB 3.43Å; I983-S987 PolarHBondContact O-N 3.04Å; I983-S987 PolarHBondContact O-OG 2.98Å
984	V	87	Confident	83	Confident	35 Å²	35	45.8 Å²	45.8	21%	0.212	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-45.2	178.2	174.3	0	0	0	0	110.4	Y902 L906 H982 S987 F988	Y902-V984 HydrophobicContact CD1-CG1 4.04Å; Y902-V984 HydrophobicContact CE1-CG1 4.19Å; L906-V984 HydrophobicContact CD1-CG1 3.82Å; H982-V984 PolarHBondContact O-N 3.38Å; H982-V984 VanDerWaalsContact O-N 3.1Å; V984-S987 PolarHBondContact O-OG 3.04Å; V984-F988 WeakPolarHBondContact O-CB 3.17Å; V984-F988 PolarHBondContact O-N 3.26Å
985	A	86.8	Confident	83.4	Confident	3 Å²	3	41.5 Å²	41.5	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-48.3	-178.8	0	0	0	0	0	112.2	H982 S989 F1032 F1042	H982-A985 WeakPolarHBondContact O-CB 3.48Å; H982-A985 PolarHBondContact O-N 3.18Å; A985-S989 VanDerWaalsContact O-CB 3.29Å; A985-S989 WeakPolarHBondContact O-CB 3.48Å; A985-S989 PolarHBondContact O-N 3.3Å; A985-S989 PolarHBondContact O-OG 2.98Å; A985-F1032 HydrophobicContact CB-CD1 3.73Å; A985-F1032 HydrophobicContact CB-CE1 4.19Å; A985-F1042 HydrophobicContact CB-CE2 4.45Å
986	I	88.8	Confident	83.9	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69	-51.3	-177.6	-62.3	136.6	0	0	0	111.1	F976 H982 F988 S989 A990 F1036 F1042 V1046 I1049	F976-I986 HydrophobicContact CD1-CD1 4.03Å; F976-I986 HydrophobicContact CD2-CD1 3.59Å; F976-I986 HydrophobicContact CE1-CD1 3.63Å; F976-I986 HydrophobicContact CE2-CB 4.35Å; F976-I986 HydrophobicContact CE2-CD1 3.15Å; F976-I986 HydrophobicContact CE2-CG1 3.74Å; F976-I986 HydrophobicContact CE2-CG2 3.94Å; F976-I986 HydrophobicContact CG-CD1 3.96Å; F976-I986 HydrophobicContact CZ-CD1 3.1Å; F976-I986 HydrophobicContact CZ-CG1 3.69Å; H982-I986 HydrophobicContact CB-CD1 4.12Å; H982-I986 WeakPolarHBondContact O-CD1 3.24Å; H982-I986 PolarHBondContact O-N 3.01Å; I986-F988 VanDerWaalsContact C-N 3.32Å; I986-F988 PolarHBondContact O-N 3.15Å; I986-S989 PolarHBondContact O-N 3.45Å; I986-A990 WeakPolarHBondContact O-CB 3.26Å; I986-A990 PolarHBondContact O-N 3.35Å; I986-F1036 HydrophobicContact CD1-CE1 4Å; I986-F1036 HydrophobicContact CD1-CZ 3.94Å; I986-F1036 HydrophobicContact CG1-CE1 3.97Å; I986-F1036 HydrophobicContact CG1-CZ 4.2Å; I986-F1042 HydrophobicContact CG1-CD2 4.11Å; I986-F1042 HydrophobicContact CG1-CE2 4.42Å; I986-V1046 HydrophobicContact CB-CG2 4.47Å; I986-V1046 HydrophobicContact CG2-CG2 4.02Å; I986-I1049 HydrophobicContact CG2-CD1 3.8Å
987	S	91.8	Very high	84.9	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.1	-38.7	-176.6	62.5	0	0	0	0	111.5	Y902 I983 V984 L991	Y902-S987 VanDerWaalsContact OH-CB 3.27Å; Y902-S987 WeakPolarHBondContact OH-CB 3.41Å; Y902-S987 PolarHBondContact OH-OG 3.23Å; I983-S987 VanDerWaalsContact O-CB 3.23Å; I983-S987 WeakPolarHBondContact O-CB 3.43Å; I983-S987 PolarHBondContact O-N 3.04Å; I983-S987 PolarHBondContact O-OG 2.98Å; V984-S987 PolarHBondContact O-OG 3.04Å; S987-L991 VanDerWaalsContact O-CB 3.23Å; S987-L991 WeakPolarHBondContact O-CB 3.06Å; S987-L991 PolarHBondContact O-N 2.85Å
988	F	92.4	Very high	86.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-70	-39.7	177	-164.9	-104.5	0	0	0	111.9	Y902 L906 Y910 Y914 V984 I986 L991 I992 Y1021 F1032	Y902-F988 HydrophobicContact CD1-CB 4.46Å; Y902-F988 AromaticContact CD1-CD2 3.92Å; Y902-F988 HydrophobicContact CD1-CD2 3.92Å; Y902-F988 HydrophobicContact CD2-CD2 4.17Å; Y902-F988 HydrophobicContact CE1-CB 3.79Å; Y902-F988 AromaticContact CE1-CD2 3.85Å; Y902-F988 HydrophobicContact CE1-CD2 3.85Å; Y902-F988 HydrophobicContact CE1-CG 4.28Å; Y902-F988 HydrophobicContact CE2-CD2 4.09Å; Y902-F988 HydrophobicContact CG-CD2 4.1Å; Y902-F988 AromaticContact CZ-CD2 3.94Å; Y902-F988 PolarHBondContact OH-N 3.38Å; L906-F988 HydrophobicContact CB-CE2 4.17Å; L906-F988 HydrophobicContact CB-CZ 4.08Å; L906-F988 HydrophobicContact CD2-CD1 4.13Å; L906-F988 HydrophobicContact CD2-CE1 3.84Å; L906-F988 HydrophobicContact CD2-CZ 4.22Å; L906-F988 WeakPolarHBondContact O-CZ 3.26Å; Y910-F988 HydrophobicContact CD2-CE2 4.4Å; Y914-F988 HydrophobicContact CD2-CE1 4.05Å; Y914-F988 HydrophobicContact CD2-CZ 4.01Å; Y914-F988 AromaticContact CE2-CE1 3.91Å; Y914-F988 HydrophobicContact CE2-CE1 3.91Å; Y914-F988 HydrophobicContact CE2-CZ 4.05Å; V984-F988 WeakPolarHBondContact O-CB 3.17Å; V984-F988 PolarHBondContact O-N 3.26Å; I986-F988 VanDerWaalsContact C-N 3.32Å; I986-F988 PolarHBondContact O-N 3.15Å; F988-L991 HydrophobicContact CD2-CD2 4.38Å; F988-L991 WeakPolarHBondContact O-CB 3.45Å; F988-L991 PolarHBondContact O-N 3.47Å; F988-I992 HydrophobicContact CD1-CG1 4.37Å; F988-I992 HydrophobicContact CE1-CD1 4.47Å; F988-I992 HydrophobicContact CE1-CG1 4.15Å; F988-I992 HydrophobicContact CZ-CD1 4.39Å; F988-I992 WeakPolarHBondContact O-CG1 3.28Å; F988-I992 PolarHBondContact O-N 3.45Å; F988-Y1021 AromaticContact CD1-CE2 3.82Å; F988-Y1021 HydrophobicContact CD1-CE2 3.82Å; F988-Y1021 AromaticContact CE1-CE2 3.76Å; F988-Y1021 HydrophobicContact CE1-CE2 3.76Å; F988-F1032 HydrophobicContact CD1-CZ 4.07Å
989	S	92.5	Very high	87.6	Confident	3 Å²	3	28.7 Å²	28.7	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-63.6	-46.1	175.1	-57	0	0	0	0	112.1	A985 I986 L991 I992 M993 Y1021 F1042	A985-S989 VanDerWaalsContact O-CB 3.29Å; A985-S989 WeakPolarHBondContact O-CB 3.48Å; A985-S989 PolarHBondContact O-N 3.3Å; A985-S989 PolarHBondContact O-OG 2.98Å; I986-S989 PolarHBondContact O-N 3.45Å; S989-L991 VanDerWaalsContact C-N 3.3Å; S989-L991 PolarHBondContact O-N 2.91Å; S989-I992 PolarHBondContact O-N 2.98Å; S989-M993 WeakPolarHBondContact O-CB 3.06Å; S989-M993 WeakPolarHBondContact O-CG 3.36Å; S989-M993 PolarHBondContact O-N 3.45Å; S989-Y1021 WeakPolarHBondContact CA-OH 3.27Å; S989-Y1021 WeakPolarHBondContact CB-OH 3.45Å; S989-Y1021 PolarHBondContact N-OH 3.39Å; S989-Y1021 PolarHBondContact OG-OH 3.1Å; S989-F1042 VanDerWaalsContact OG-CZ 3.25Å; S989-F1042 WeakPolarHBondContact OG-CZ 3.16Å
990	A	93.9	Very high	88.9	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.7	-36.2	176.1	0	0	0	0	0	111.8	I968 I986 T994 V1046 I1049	I968-A990 HydrophobicContact CG2-CB 4.17Å; I986-A990 WeakPolarHBondContact O-CB 3.26Å; I986-A990 PolarHBondContact O-N 3.35Å; A990-T994 WeakPolarHBondContact O-CB 3.33Å; A990-T994 PolarHBondContact O-N 3.09Å; A990-T994 PolarHBondContact O-OG1 3.29Å; A990-V1046 HydrophobicContact CB-CG1 4.4Å; A990-I1049 HydrophobicContact CB-CB 4.23Å; A990-I1049 HydrophobicContact CB-CG2 3.79Å
991	L	95.1	Very high	89.9	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62	-51.8	174.2	173.2	63.9	0	0	0	111.9	I882 I883 Y902 Y910 I968 S987 F988 S989 T994 E995	I882-L991 HydrophobicContact CB-CD1 4.38Å; I882-L991 HydrophobicContact CG2-CD1 3.32Å; I883-L991 HydrophobicContact CD1-CD2 4.17Å; I883-L991 HydrophobicContact CG1-CD2 3.85Å; Y902-L991 HydrophobicContact CE2-CD2 4.08Å; Y910-L991 HydrophobicContact CD2-CD2 4.06Å; Y910-L991 HydrophobicContact CD2-CG 4.45Å; Y910-L991 HydrophobicContact CE2-CD1 4.21Å; Y910-L991 HydrophobicContact CE2-CD2 3.65Å; Y910-L991 HydrophobicContact CE2-CG 3.74Å; I968-L991 HydrophobicContact CD1-CD1 4.46Å; S987-L991 VanDerWaalsContact O-CB 3.23Å; S987-L991 WeakPolarHBondContact O-CB 3.06Å; S987-L991 PolarHBondContact O-N 2.85Å; F988-L991 HydrophobicContact CD2-CD2 4.38Å; F988-L991 WeakPolarHBondContact O-CB 3.45Å; F988-L991 PolarHBondContact O-N 3.47Å; S989-L991 VanDerWaalsContact C-N 3.3Å; S989-L991 PolarHBondContact O-N 2.91Å; L991-T994 PolarHBondContact O-N 2.98Å; L991-E995 HydrophobicContact CD1-CG 4.37Å; L991-E995 WeakPolarHBondContact O-CG 3.11Å; L991-E995 PolarHBondContact O-N 3.01Å
992	I	95	Very high	90.6	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61	-48	179	-64.5	-58.6	0	0	0	110.7	Y910 Y914 T915 F988 S989 T994 E995 L996 Y1021	Y910-I992 HydrophobicContact CD2-CD1 3.54Å; Y910-I992 HydrophobicContact CE2-CD1 4.03Å; Y914-I992 HydrophobicContact CD2-CD1 4.09Å; Y914-I992 HydrophobicContact CG-CD1 4.28Å; T915-I992 HydrophobicContact CG2-CD1 4.02Å; F988-I992 HydrophobicContact CD1-CG1 4.37Å; F988-I992 HydrophobicContact CE1-CD1 4.47Å; F988-I992 HydrophobicContact CE1-CG1 4.15Å; F988-I992 HydrophobicContact CZ-CD1 4.39Å; F988-I992 WeakPolarHBondContact O-CG1 3.28Å; F988-I992 PolarHBondContact O-N 3.45Å; S989-I992 PolarHBondContact O-N 2.98Å; I992-T994 VanDerWaalsContact C-N 3.34Å; I992-T994 PolarHBondContact O-N 3.42Å; I992-E995 PolarHBondContact O-N 3.29Å; I992-L996 HydrophobicContact CG2-CD1 4.04Å; I992-L996 HydrophobicContact CG2-CG 4.34Å; I992-L996 WeakPolarHBondContact O-CG 3.42Å; I992-L996 PolarHBondContact O-N 3.42Å; I992-Y1021 HydrophobicContact CB-CD1 4.29Å; I992-Y1021 HydrophobicContact CB-CE1 4.25Å; I992-Y1021 HydrophobicContact CB-CG 4.47Å; I992-Y1021 HydrophobicContact CG1-CD2 4.11Å; I992-Y1021 HydrophobicContact CG1-CE1 4.47Å; I992-Y1021 HydrophobicContact CG1-CE2 4.01Å; I992-Y1021 HydrophobicContact CG1-CG 4.43Å; I992-Y1021 HydrophobicContact CG2-CD1 3.88Å; I992-Y1021 HydrophobicContact CG2-CD2 4.41Å; I992-Y1021 HydrophobicContact CG2-CE1 4.35Å; I992-Y1021 HydrophobicContact CG2-CG 3.91Å
993	M	94.4	Very high	90.9	Very high	59 Å²	59	15.2 Å²	15.2	29%	0.291	9%	0.086	S	C	.	.	H	α-helix	trans	-63	-39.8	179.4	-71.7	-58.4	-56.3	0	0	112.5	S989 L996 I997 L1018 T1050	S989-M993 WeakPolarHBondContact O-CB 3.06Å; S989-M993 WeakPolarHBondContact O-CG 3.36Å; S989-M993 PolarHBondContact O-N 3.45Å; M993-L996 PolarHBondContact O-N 3.29Å; M993-I997 HydrophobicContact CE-CD1 4.38Å; M993-I997 WeakPolarHBondContact O-CB 3.29Å; M993-I997 VanDerWaalsContact O-CG1 3.26Å; M993-I997 WeakPolarHBondContact O-CG1 3.29Å; M993-I997 PolarHBondContact O-N 3.5Å; M993-L1018 HydrophobicContact SD-CD1 3.66Å; M993-T1050 HydrophobicContact CB-CG2 3.72Å
994	T	94.2	Very high	90.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59.8	-48.4	175.1	-65	0	0	0	0	110.6	I968 A990 L991 I992 I997 M998 S1053	I968-T994 HydrophobicContact CD1-CG2 4.26Å; A990-T994 WeakPolarHBondContact O-CB 3.33Å; A990-T994 PolarHBondContact O-N 3.09Å; A990-T994 PolarHBondContact O-OG1 3.29Å; L991-T994 PolarHBondContact O-N 2.98Å; I992-T994 VanDerWaalsContact C-N 3.34Å; I992-T994 PolarHBondContact O-N 3.42Å; T994-I997 PolarHBondContact O-N 2.95Å; T994-M998 HydrophobicContact CG2-CG 4.21Å; T994-M998 VanDerWaalsContact O-CB 3.29Å; T994-M998 WeakPolarHBondContact O-CB 3.35Å; T994-M998 WeakPolarHBondContact O-CG 3.35Å; T994-M998 PolarHBondContact O-N 2.95Å; T994-S1053 VanDerWaalsContact CG2-OG 3.28Å; T994-S1053 WeakPolarHBondContact CG2-OG 3.4Å
995	E	93.5	Very high	90.9	Very high	3 Å²	3	22 Å²	22	1%	0.014	11%	0.114	C	C	.	.	H	α-helix	trans	-61.9	-45.9	179.6	-73.2	-72.3	170.7	0	0	112.2	I882 Y910 T915 L991 I992 I997 M998 V999	I882-E995 WeakPolarHBondContact CD1-OE1 3.35Å; Y910-E995 HydrophobicContact CE2-CG 4.42Å; Y910-E995 PolarHBondContact OH-OE1 3.01Å; T915-E995 HydrophobicContact CG2-CB 4.27Å; T915-E995 HydrophobicContact CG2-CG 4.48Å; L991-E995 HydrophobicContact CD1-CG 4.37Å; L991-E995 WeakPolarHBondContact O-CG 3.11Å; L991-E995 PolarHBondContact O-N 3.01Å; I992-E995 PolarHBondContact O-N 3.29Å; E995-I997 PolarHBondContact O-N 3.13Å; E995-M998 PolarHBondContact O-N 3.38Å; E995-V999 WeakPolarHBondContact O-CG2 3.46Å; E995-V999 PolarHBondContact O-N 3.38Å
996	L	93.4	Very high	91	Very high	13 Å²	13	28.3 Å²	28.3	7%	0.068	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-46.2	178.1	-66.4	-180	0	0	0	111.6	P918 I992 M993 M998 V999 A1000 L1018	P918-L996 HydrophobicContact CB-CD2 4.14Å; P918-L996 HydrophobicContact CG-CD2 3.53Å; I992-L996 HydrophobicContact CG2-CD1 4.04Å; I992-L996 HydrophobicContact CG2-CG 4.34Å; I992-L996 WeakPolarHBondContact O-CG 3.42Å; I992-L996 PolarHBondContact O-N 3.42Å; M993-L996 PolarHBondContact O-N 3.29Å; L996-M998 VanDerWaalsContact C-N 3.35Å; L996-M998 PolarHBondContact O-N 3.49Å; L996-V999 PolarHBondContact O-N 2.85Å; L996-A1000 PolarHBondContact O-N 2.87Å; L996-L1018 HydrophobicContact CD1-CB 4.12Å; L996-L1018 HydrophobicContact CD1-CD1 4.09Å
997	I	93.1	Very high	91.1	Very high	61 Å²	61	32.4 Å²	32.4	31%	0.313	16%	0.156	S	C	.	.	H	α-helix	trans	-65.3	-39.9	177.4	-68.5	168.5	0	0	0	110.6	M993 T994 E995 V999 A1000 L1001 T1050 C1054	M993-I997 HydrophobicContact CE-CD1 4.38Å; M993-I997 WeakPolarHBondContact O-CB 3.29Å; M993-I997 VanDerWaalsContact O-CG1 3.26Å; M993-I997 WeakPolarHBondContact O-CG1 3.29Å; M993-I997 PolarHBondContact O-N 3.5Å; T994-I997 PolarHBondContact O-N 2.95Å; E995-I997 PolarHBondContact O-N 3.13Å; I997-V999 VanDerWaalsContact C-N 3.34Å; I997-V999 PolarHBondContact O-N 3.28Å; I997-A1000 WeakPolarHBondContact O-CB 3.49Å; I997-A1000 PolarHBondContact O-N 3.45Å; I997-L1001 HydrophobicContact CG2-CD1 3.79Å; I997-L1001 HydrophobicContact CG2-CG 4Å; I997-L1001 WeakPolarHBondContact O-CB 3.39Å; I997-L1001 WeakPolarHBondContact O-CG 3.32Å; I997-L1001 PolarHBondContact O-N 3.35Å; I997-T1050 HydrophobicContact CD1-CG2 3.83Å; I997-C1054 HydrophobicContact CG2-CB 4.13Å
998	M	91.2	Very high	91.1	Very high	12 Å²	12	42.6 Å²	42.6	6%	0.059	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-38.7	178.4	-77.1	-62.4	-70	0	0	112.3	I960 Q964 T994 E995 L996 T1002 L1057	I960-M998 HydrophobicContact CG2-CE 4.23Å; Q964-M998 VanDerWaalsContact NE2-CG 3.35Å; Q964-M998 PolarHBondContact NE2-SD 3.18Å; T994-M998 HydrophobicContact CG2-CG 4.21Å; T994-M998 VanDerWaalsContact O-CB 3.29Å; T994-M998 WeakPolarHBondContact O-CB 3.35Å; T994-M998 WeakPolarHBondContact O-CG 3.35Å; T994-M998 PolarHBondContact O-N 2.95Å; E995-M998 PolarHBondContact O-N 3.38Å; L996-M998 VanDerWaalsContact C-N 3.35Å; L996-M998 PolarHBondContact O-N 3.49Å; M998-T1002 WeakPolarHBondContact O-CG2 3.47Å; M998-T1002 PolarHBondContact O-N 2.92Å; M998-T1002 PolarHBondContact O-OG1 3.04Å; M998-L1057 HydrophobicContact CE-CD1 3.96Å; M998-L1057 HydrophobicContact SD-CD1 4.09Å
999	V	91.1	Very high	91.1	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-60.6	-54.7	170.4	174.5	0	0	0	0	109.5	F875 P918 V919 L922 E995 L996 I997 L1001 T1002 V1003	F875-V999 HydrophobicContact CD1-CG2 4.33Å; F875-V999 HydrophobicContact CE1-CG2 4.18Å; P918-V999 HydrophobicContact CB-CG1 4.18Å; P918-V999 HydrophobicContact CB-CG2 4.44Å; V919-V999 HydrophobicContact CG2-CG2 3.99Å; L922-V999 HydrophobicContact CD2-CG1 4.36Å; E995-V999 WeakPolarHBondContact O-CG2 3.46Å; E995-V999 PolarHBondContact O-N 3.38Å; L996-V999 PolarHBondContact O-N 2.85Å; I997-V999 VanDerWaalsContact C-N 3.34Å; I997-V999 PolarHBondContact O-N 3.28Å; V999-L1001 VanDerWaalsContact C-N 3.26Å; V999-L1001 PolarHBondContact O-N 2.9Å; V999-L1001 VanDerWaalsContact O-N 3.16Å; V999-T1002 PolarHBondContact O-N 3.11Å; V999-T1002 PolarHBondContact O-OG1 3.43Å; V999-V1003 HydrophobicContact CG1-CG2 4.32Å; V999-V1003 WeakPolarHBondContact O-CG2 3.49Å; V999-V1003 PolarHBondContact O-N 2.65Å; V999-V1003 VanDerWaalsContact O-N 3.12Å
1000	A	90.6	Very high	91.1	Very high	25 Å²	25	47.1 Å²	47.1	21%	0.207	22%	0.218	C	C	.	.	H	α-helix	trans	-53.8	-40.1	179.5	0	0	0	0	0	113.4	L996 I997 T1002 W1006 E1014	L996-A1000 PolarHBondContact O-N 2.87Å; I997-A1000 WeakPolarHBondContact O-CB 3.49Å; I997-A1000 PolarHBondContact O-N 3.45Å; A1000-T1002 VanDerWaalsContact C-N 3.3Å; A1000-T1002 PolarHBondContact O-N 3.34Å; A1000-W1006 HydrophobicContact CB-CH2 3.73Å; A1000-W1006 HydrophobicContact CB-CZ2 3.99Å; A1000-W1006 WeakPolarHBondContact O-CZ2 3.22Å; A1000-E1014 VanDerWaalsContact CA-OE1 3.29Å; A1000-E1014 WeakPolarHBondContact CA-OE1 3.3Å; A1000-E1014 WeakPolarHBondContact CB-OE1 3.37Å; A1000-E1014 PolarHBondContact N-OE1 3.44Å
1001	L	87.8	Confident	91.1	Very high	54 Å²	54	50 Å²	50	28%	0.283	24%	0.235	S	C	.	.	H	α-helix	trans	-72.9	-19.2	178.9	-70.5	-179.4	0	0	0	113.5	I997 V999 Y1058 K1061	I997-L1001 HydrophobicContact CG2-CD1 3.79Å; I997-L1001 HydrophobicContact CG2-CG 4Å; I997-L1001 WeakPolarHBondContact O-CB 3.39Å; I997-L1001 WeakPolarHBondContact O-CG 3.32Å; I997-L1001 PolarHBondContact O-N 3.35Å; V999-L1001 VanDerWaalsContact C-N 3.26Å; V999-L1001 PolarHBondContact O-N 2.9Å; V999-L1001 VanDerWaalsContact O-N 3.16Å; L1001-Y1058 HydrophobicContact CD1-CD2 4.29Å; L1001-Y1058 HydrophobicContact CD2-CD2 3.62Å; L1001-Y1058 HydrophobicContact CD2-CE2 3.94Å; L1001-Y1058 HydrophobicContact CD2-CG 4.46Å; L1001-Y1058 HydrophobicContact CG-CD2 4.45Å; L1001-K1061 PolarHBondContact O-NZ 3Å
1002	T	84.9	Confident	91	Very high	27 Å²	27	55.1 Å²	55.1	17%	0.166	26%	0.262	C	S	.	.	H	α-helix	trans	-96.8	-28.8	-178.1	55.4	0	0	0	0	115.5	F875 W957 M998 V999 A1000 R1004	F875-T1002 HydrophobicContact CE2-CG2 3.87Å; F875-T1002 WeakPolarHBondContact CE2-OG1 3.34Å; F875-T1002 HydrophobicContact CZ-CG2 3.42Å; F875-T1002 VanDerWaalsContact CZ-CG2 3.42Å; F875-T1002 WeakPolarHBondContact CZ-OG1 3.27Å; W957-T1002 HydrophobicContact CH2-CG2 4.26Å; M998-T1002 WeakPolarHBondContact O-CG2 3.47Å; M998-T1002 PolarHBondContact O-N 2.92Å; M998-T1002 PolarHBondContact O-OG1 3.04Å; V999-T1002 PolarHBondContact O-N 3.11Å; V999-T1002 PolarHBondContact O-OG1 3.43Å; A1000-T1002 VanDerWaalsContact C-N 3.3Å; A1000-T1002 PolarHBondContact O-N 3.34Å; T1002-R1004 PolarHBondContact O-N 2.97Å
1003	V	87.3	Confident	91	Very high	13 Å²	13	55.8 Å²	55.8	8%	0.079	27%	0.268	C	S	.	.			trans	-52	135.6	172.3	174.4	0	0	0	0	110.3	L922 V999 T1005 W1006 M1010	L922-V1003 HydrophobicContact CD2-CG2 3.97Å; V999-V1003 HydrophobicContact CG1-CG2 4.32Å; V999-V1003 WeakPolarHBondContact O-CG2 3.49Å; V999-V1003 PolarHBondContact O-N 2.65Å; V999-V1003 VanDerWaalsContact O-N 3.12Å; V1003-T1005 WeakPolarHBondContact CG1-O 3.47Å; V1003-W1006 HydrophobicContact CG1-CD2 4.23Å; V1003-W1006 HydrophobicContact CG1-CG 4.4Å; V1003-M1010 HydrophobicContact CB-CE 4.05Å; V1003-M1010 HydrophobicContact CG1-CE 3.5Å; V1003-M1010 VanDerWaalsContact CG1-CE 3.5Å; V1003-M1010 HydrophobicContact CG1-SD 4.23Å; V1003-M1010 HydrophobicContact CG2-CE 3.3Å
1004	R	84.1	Confident	91	Very high	127 Å²	127	54.5 Å²	54.5	48%	0.479	26%	0.261	S	S	.	.	S	Bend	trans	-98.1	-42.8	178.5	-63.9	178.2	-178.1	-175.6	0.6	111.1	D925 T1002 Y1072	D925-R1004 PolarHBondContact OD1-N 2.91Å; D925-R1004 VanDerWaalsContact OD1-N 3.08Å; T1002-R1004 PolarHBondContact O-N 2.97Å; R1004-Y1072 VanDerWaalsContact CZ-OH 3.31Å; R1004-Y1072 PolarHBondContact NH1-OH 3.01Å; R1004-Y1072 VanDerWaalsContact NH1-OH 3.1Å
1005	T	86.5	Confident	91	Very high	61 Å²	61	59.4 Å²	59.4	37%	0.374	29%	0.287	S	S	.	.	S	Bend	trans	-122	119.5	-180	54.4	0	0	0	0	109.6	D925 Q926 V1003 H1007	D925-T1005 PolarHBondContact OD1-N 3.17Å; D925-T1005 VanDerWaalsContact OD1-N 3.16Å; D925-T1005 PolarHBondContact OD1-OG1 3.05Å; Q926-T1005 HydrophobicContact CB-CG2 4.44Å; Q926-T1005 PolarHBondContact N-OG1 3.21Å; Q926-T1005 WeakPolarHBondContact O-CG2 3.23Å; Q926-T1005 PolarHBondContact O-OG1 3.22Å; V1003-T1005 WeakPolarHBondContact CG1-O 3.47Å; T1005-H1007 PolarHBondContact O-N 2.99Å
1006	W	89.8	Confident	91.1	Very high	134 Å²	134	64.1 Å²	64.1	51%	0.508	31%	0.307	S	S	.	.			trans	-78.1	114.8	179	-75.2	94.2	0	0	0	111.1	A1000 V1003 V1011 E1014	A1000-W1006 HydrophobicContact CB-CH2 3.73Å; A1000-W1006 HydrophobicContact CB-CZ2 3.99Å; A1000-W1006 WeakPolarHBondContact O-CZ2 3.22Å; V1003-W1006 HydrophobicContact CG1-CD2 4.23Å; V1003-W1006 HydrophobicContact CG1-CG 4.4Å; W1006-V1011 HydrophobicContact CE3-CG2 3.51Å; W1006-V1011 HydrophobicContact CZ3-CG2 3.94Å; W1006-E1014 WeakPolarHBondContact CH2-OE2 3.4Å
1007	H	89.8	Confident	91.2	Very high	87 Å²	87	63.5 Å²	63.5	40%	0.403	30%	0.304	S	S	.	.			trans	-97.8	147	168.3	-169.7	-92.2	0	0	0	110	T1005 L1009 M1010 V1011	T1005-H1007 PolarHBondContact O-N 2.99Å; H1007-L1009 PolarHBondContact ND1-N 3.26Å; H1007-L1009 PolarHBondContact O-N 3.04Å; H1007-M1010 HydrophobicContact CB-CG 3.98Å; H1007-M1010 HydrophobicContact CB-SD 3.83Å; H1007-M1010 WeakPolarHBondContact O-CB 3.35Å; H1007-M1010 PolarHBondContact O-N 3.1Å; H1007-V1011 PolarHBondContact O-N 3.43Å
1008	R	91.8	Very high	91.2	Very high	214 Å²	214	63 Å²	63	81%	0.808	30%	0.302	S	S	*	.	H	α-helix	trans	-54.5	-40.4	-178.2	-66.9	-178.2	180	170.2	-0.2	112.8	M1010 V1011 L1012	R1008-M1010 VanDerWaalsContact C-N 3.28Å; R1008-M1010 PolarHBondContact O-N 2.88Å; R1008-V1011 PolarHBondContact O-N 3.41Å; R1008-L1012 WeakPolarHBondContact O-CG 3.2Å; R1008-L1012 PolarHBondContact O-N 3.44Å
1009	L	92.3	Very high	91.4	Very high	98 Å²	98	64.5 Å²	64.5	51%	0.513	32%	0.316	S	S	.	.	H	α-helix	trans	-64.8	-28.4	177	-64	174.9	0	0	0	113.6	L924 H1007 L1012 A1013	L924-L1009 HydrophobicContact CD1-CB 3.69Å; L924-L1009 HydrophobicContact CD1-CD1 4Å; L924-L1009 HydrophobicContact CD1-CG 4.47Å; H1007-L1009 PolarHBondContact ND1-N 3.26Å; H1007-L1009 PolarHBondContact O-N 3.04Å; L1009-L1012 HydrophobicContact CD2-CD1 4.48Å; L1009-A1013 VanDerWaalsContact O-CB 3.28Å; L1009-A1013 WeakPolarHBondContact O-CB 3.29Å; L1009-A1013 PolarHBondContact O-N 3.48Å
1010	M	93	Very high	91.5	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-72.8	-43.5	177.9	-59.7	172.1	74.7	0	0	110.5	L924 D925 V1003 H1007 R1008 L1012 A1013 E1014	L924-M1010 HydrophobicContact CB-CG 4.25Å; L924-M1010 HydrophobicContact CB-SD 4.14Å; L924-M1010 HydrophobicContact CD1-CG 4.16Å; D925-M1010 HydrophobicContact CB-CE 4.44Å; V1003-M1010 HydrophobicContact CB-CE 4.05Å; V1003-M1010 HydrophobicContact CG1-CE 3.5Å; V1003-M1010 VanDerWaalsContact CG1-CE 3.5Å; V1003-M1010 HydrophobicContact CG1-SD 4.23Å; V1003-M1010 HydrophobicContact CG2-CE 3.3Å; H1007-M1010 HydrophobicContact CB-CG 3.98Å; H1007-M1010 HydrophobicContact CB-SD 3.83Å; H1007-M1010 WeakPolarHBondContact O-CB 3.35Å; H1007-M1010 PolarHBondContact O-N 3.1Å; R1008-M1010 VanDerWaalsContact C-N 3.28Å; R1008-M1010 PolarHBondContact O-N 2.88Å; M1010-L1012 VanDerWaalsContact C-N 3.34Å; M1010-L1012 PolarHBondContact O-N 3.35Å; M1010-A1013 WeakPolarHBondContact O-CB 3.11Å; M1010-A1013 PolarHBondContact O-N 3.28Å; M1010-E1014 PolarHBondContact O-N 2.98Å
1011	V	93.5	Very high	91.6	Very high	59 Å²	59	65.6 Å²	65.6	36%	0.358	32%	0.318	S	S	.	.	H	α-helix	trans	-59.5	-46.8	173.3	-177.7	0	0	0	0	110.4	W1006 H1007 R1008 A1013 E1014 L1015	W1006-V1011 HydrophobicContact CE3-CG2 3.51Å; W1006-V1011 HydrophobicContact CZ3-CG2 3.94Å; H1007-V1011 PolarHBondContact O-N 3.43Å; R1008-V1011 PolarHBondContact O-N 3.41Å; V1011-A1013 VanDerWaalsContact C-N 3.32Å; V1011-A1013 PolarHBondContact O-N 3.48Å; V1011-E1014 PolarHBondContact O-N 3.27Å; V1011-L1015 HydrophobicContact CG1-CD1 4.03Å; V1011-L1015 HydrophobicContact CG1-CG 4.44Å; V1011-L1015 WeakPolarHBondContact O-CG 3.28Å; V1011-L1015 PolarHBondContact O-N 2.62Å
1012	L	94.6	Very high	91.7	Very high	108 Å²	108	67.8 Å²	67.8	57%	0.565	33%	0.329	S	S	*	.	H	α-helix	trans	-61.7	-39.4	176.6	-71.5	172.5	0	0	0	112.1	R1008 L1009 M1010 F1016	R1008-L1012 WeakPolarHBondContact O-CG 3.2Å; R1008-L1012 PolarHBondContact O-N 3.44Å; L1009-L1012 HydrophobicContact CD2-CD1 4.48Å; M1010-L1012 VanDerWaalsContact C-N 3.34Å; M1010-L1012 PolarHBondContact O-N 3.35Å; L1012-F1016 WeakPolarHBondContact O-CB 3.35Å; L1012-F1016 PolarHBondContact O-N 3.28Å
1013	A	94.2	Very high	92	Very high	15 Å²	15	71.2 Å²	71.2	12%	0.124	35%	0.346	C	S	.	.	H	α-helix	trans	-64	-42.8	177	0	0	0	0	0	112.2	F917 L1009 M1010 V1011 S1017	F917-A1013 HydrophobicContact CB-CB 4.1Å; L1009-A1013 VanDerWaalsContact O-CB 3.28Å; L1009-A1013 WeakPolarHBondContact O-CB 3.29Å; L1009-A1013 PolarHBondContact O-N 3.48Å; M1010-A1013 WeakPolarHBondContact O-CB 3.11Å; M1010-A1013 PolarHBondContact O-N 3.28Å; V1011-A1013 VanDerWaalsContact C-N 3.32Å; V1011-A1013 PolarHBondContact O-N 3.48Å; A1013-S1017 WeakPolarHBondContact O-CB 3.44Å; A1013-S1017 PolarHBondContact O-N 3.38Å
1014	E	93.8	Very high	92.1	Very high	32 Å²	32	71 Å²	71	15%	0.15	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-49.6	175	-77	-173.9	-173.2	0	0	112.1	P918 A1000 W1006 M1010 V1011 F1016 S1017 L1018	P918-E1014 HydrophobicContact CB-CG 4.11Å; P918-E1014 HydrophobicContact CG-CG 4.48Å; A1000-E1014 VanDerWaalsContact CA-OE1 3.29Å; A1000-E1014 WeakPolarHBondContact CA-OE1 3.3Å; A1000-E1014 WeakPolarHBondContact CB-OE1 3.37Å; A1000-E1014 PolarHBondContact N-OE1 3.44Å; W1006-E1014 WeakPolarHBondContact CH2-OE2 3.4Å; M1010-E1014 PolarHBondContact O-N 2.98Å; V1011-E1014 PolarHBondContact O-N 3.27Å; E1014-F1016 VanDerWaalsContact C-N 3.34Å; E1014-F1016 PolarHBondContact O-N 3.5Å; E1014-S1017 PolarHBondContact O-N 3.49Å; E1014-L1018 WeakPolarHBondContact O-CB 3.49Å; E1014-L1018 PolarHBondContact O-N 3.4Å
1015	L	94.8	Very high	92.3	Very high	103 Å²	103	65.6 Å²	65.6	54%	0.539	33%	0.325	S	S	.	.	H	α-helix	trans	-63.3	-40.4	179.2	-68.6	176.4	0	0	0	112.1	V1011 L1018 A1019	V1011-L1015 HydrophobicContact CG1-CD1 4.03Å; V1011-L1015 HydrophobicContact CG1-CG 4.44Å; V1011-L1015 WeakPolarHBondContact O-CG 3.28Å; V1011-L1015 PolarHBondContact O-N 2.62Å; L1015-L1018 PolarHBondContact O-N 3.01Å; L1015-A1019 WeakPolarHBondContact O-CB 3.41Å; L1015-A1019 PolarHBondContact O-N 3.22Å
1016	F	95.1	Very high	92.2	Very high	101 Å²	101	64.3 Å²	64.3	44%	0.443	32%	0.321	S	S	.	.	H	α-helix	trans	-64.3	-42.9	177.1	-178.5	-111	0	0	0	111.6	F917 L1012 E1014 A1019 L1020	F917-F1016 AromaticContact CD2-CD1 3.94Å; F917-F1016 HydrophobicContact CD2-CD1 3.94Å; F917-F1016 AromaticContact CD2-CE1 3.99Å; F917-F1016 HydrophobicContact CD2-CE1 3.99Å; F917-F1016 HydrophobicContact CE2-CD1 4.1Å; F917-F1016 AromaticContact CE2-CE1 3.65Å; F917-F1016 HydrophobicContact CE2-CE1 3.65Å; F917-F1016 HydrophobicContact CG-CD1 4.3Å; F917-F1016 AromaticContact CZ-CE1 3.97Å; F917-F1016 HydrophobicContact CZ-CE1 3.97Å; L1012-F1016 WeakPolarHBondContact O-CB 3.35Å; L1012-F1016 PolarHBondContact O-N 3.28Å; E1014-F1016 VanDerWaalsContact C-N 3.34Å; E1014-F1016 PolarHBondContact O-N 3.5Å; F1016-A1019 PolarHBondContact O-N 3.08Å; F1016-L1020 HydrophobicContact CD1-CD1 3.9Å; F1016-L1020 HydrophobicContact CD1-CG 4.41Å; F1016-L1020 HydrophobicContact CE1-CD1 3.41Å; F1016-L1020 VanDerWaalsContact CE1-CD1 3.41Å; F1016-L1020 HydrophobicContact CE1-CG 4.07Å; F1016-L1020 HydrophobicContact CE2-CD1 4.46Å; F1016-L1020 HydrophobicContact CE2-CD2 4.42Å; F1016-L1020 HydrophobicContact CE2-CG 4.27Å; F1016-L1020 HydrophobicContact CZ-CD1 3.73Å; F1016-L1020 HydrophobicContact CZ-CD2 4.16Å; F1016-L1020 HydrophobicContact CZ-CG 3.99Å; F1016-L1020 WeakPolarHBondContact O-CB 3.37Å; F1016-L1020 WeakPolarHBondContact O-CG 3.17Å; F1016-L1020 PolarHBondContact O-N 3.27Å
1017	S	95.1	Very high	92.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-42.1	176.7	-138.4	0	0	0	0	112.2	Y914 P918 A1013 E1014 L1020 Y1021	Y914-S1017 PolarHBondContact O-OG 2.89Å; P918-S1017 WeakPolarHBondContact CD-OG 3.29Å; P918-S1017 VanDerWaalsContact CG-CB 3.49Å; A1013-S1017 WeakPolarHBondContact O-CB 3.44Å; A1013-S1017 PolarHBondContact O-N 3.38Å; E1014-S1017 PolarHBondContact O-N 3.49Å; S1017-L1020 PolarHBondContact O-N 2.84Å; S1017-Y1021 PolarHBondContact O-N 3.3Å
1018	L	94.3	Very high	91.9	Very high	52 Å²	52	60.2 Å²	60.2	27%	0.272	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-45.5	175.1	-177.6	63.4	0	0	0	111.3	M993 L996 E1014 L1015 Y1021 L1022	M993-L1018 HydrophobicContact SD-CD1 3.66Å; L996-L1018 HydrophobicContact CD1-CB 4.12Å; L996-L1018 HydrophobicContact CD1-CD1 4.09Å; E1014-L1018 WeakPolarHBondContact O-CB 3.49Å; E1014-L1018 PolarHBondContact O-N 3.4Å; L1015-L1018 PolarHBondContact O-N 3.01Å; L1018-Y1021 PolarHBondContact O-N 3.32Å; L1018-L1022 HydrophobicContact CG-CD1 4.14Å; L1018-L1022 WeakPolarHBondContact O-CG 3.47Å; L1018-L1022 PolarHBondContact O-N 2.93Å
1019	A	94.4	Very high	91.5	Very high	43 Å²	43	56 Å²	56	36%	0.355	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-45	177.7	0	0	0	0	0	112	L1015 F1016 Y1021 L1022 I1023	L1015-A1019 WeakPolarHBondContact O-CB 3.41Å; L1015-A1019 PolarHBondContact O-N 3.22Å; F1016-A1019 PolarHBondContact O-N 3.08Å; A1019-Y1021 VanDerWaalsContact C-N 3.26Å; A1019-Y1021 PolarHBondContact O-N 3.07Å; A1019-L1022 PolarHBondContact O-N 3.39Å; A1019-I1023 VanDerWaalsContact O-CG1 3.27Å; A1019-I1023 WeakPolarHBondContact O-CG1 3.38Å; A1019-I1023 PolarHBondContact O-N 3.23Å
1020	L	93.5	Very high	90.9	Very high	45 Å²	45	59.9 Å²	59.9	24%	0.236	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-40.2	174.7	-77.3	-179.3	0	0	0	112	F917 F1016 S1017 S1024	F917-L1020 HydrophobicContact CE2-CD1 4.34Å; F1016-L1020 HydrophobicContact CD1-CD1 3.9Å; F1016-L1020 HydrophobicContact CD1-CG 4.41Å; F1016-L1020 HydrophobicContact CE1-CD1 3.41Å; F1016-L1020 VanDerWaalsContact CE1-CD1 3.41Å; F1016-L1020 HydrophobicContact CE1-CG 4.07Å; F1016-L1020 HydrophobicContact CE2-CD1 4.46Å; F1016-L1020 HydrophobicContact CE2-CD2 4.42Å; F1016-L1020 HydrophobicContact CE2-CG 4.27Å; F1016-L1020 HydrophobicContact CZ-CD1 3.73Å; F1016-L1020 HydrophobicContact CZ-CD2 4.16Å; F1016-L1020 HydrophobicContact CZ-CG 3.99Å; F1016-L1020 WeakPolarHBondContact O-CB 3.37Å; F1016-L1020 WeakPolarHBondContact O-CG 3.17Å; F1016-L1020 PolarHBondContact O-N 3.27Å; S1017-L1020 PolarHBondContact O-N 2.84Å; L1020-S1024 PolarHBondContact O-N 3.02Å
1021	Y	92.8	Very high	90.3	Very high	5 Å²	5	63.1 Å²	63.1	2%	0.02	33%	0.332	C	S	.	.	H	α-helix	trans	-68.4	-44.2	177	-177.1	-118	0	0	0	112.3	Y914 F988 S989 I992 S1017 L1018 A1019 I1023 S1024 L1025	Y914-Y1021 HydrophobicContact CD1-CD2 4.26Å; Y914-Y1021 HydrophobicContact CD2-CD2 4.17Å; Y914-Y1021 HydrophobicContact CE1-CD2 4.34Å; Y914-Y1021 HydrophobicContact CE2-CD2 4.24Å; Y914-Y1021 HydrophobicContact CG-CD2 4.2Å; F988-Y1021 AromaticContact CD1-CE2 3.82Å; F988-Y1021 HydrophobicContact CD1-CE2 3.82Å; F988-Y1021 AromaticContact CE1-CE2 3.76Å; F988-Y1021 HydrophobicContact CE1-CE2 3.76Å; S989-Y1021 WeakPolarHBondContact CA-OH 3.27Å; S989-Y1021 WeakPolarHBondContact CB-OH 3.45Å; S989-Y1021 PolarHBondContact N-OH 3.39Å; S989-Y1021 PolarHBondContact OG-OH 3.1Å; I992-Y1021 HydrophobicContact CB-CD1 4.29Å; I992-Y1021 HydrophobicContact CB-CE1 4.25Å; I992-Y1021 HydrophobicContact CB-CG 4.47Å; I992-Y1021 HydrophobicContact CG1-CD2 4.11Å; I992-Y1021 HydrophobicContact CG1-CE1 4.47Å; I992-Y1021 HydrophobicContact CG1-CE2 4.01Å; I992-Y1021 HydrophobicContact CG1-CG 4.43Å; I992-Y1021 HydrophobicContact CG2-CD1 3.88Å; I992-Y1021 HydrophobicContact CG2-CD2 4.41Å; I992-Y1021 HydrophobicContact CG2-CE1 4.35Å; I992-Y1021 HydrophobicContact CG2-CG 3.91Å; S1017-Y1021 PolarHBondContact O-N 3.3Å; L1018-Y1021 PolarHBondContact O-N 3.32Å; A1019-Y1021 VanDerWaalsContact C-N 3.26Å; A1019-Y1021 PolarHBondContact O-N 3.07Å; Y1021-I1023 VanDerWaalsContact C-N 3.3Å; Y1021-I1023 PolarHBondContact O-N 2.94Å; Y1021-S1024 WeakPolarHBondContact CD2-OG 3.43Å; Y1021-S1024 WeakPolarHBondContact O-CA 3.3Å; Y1021-S1024 WeakPolarHBondContact O-CB 3.35Å; Y1021-S1024 PolarHBondContact O-N 3.42Å; Y1021-S1024 PolarHBondContact O-OG 2.92Å; Y1021-L1025 HydrophobicContact CD1-CD1 4.42Å; Y1021-L1025 HydrophobicContact CE1-CD1 3.95Å; Y1021-L1025 HydrophobicContact CE1-CD2 4.41Å; Y1021-L1025 HydrophobicContact CE1-CG 4.22Å; Y1021-L1025 HydrophobicContact CE2-CD2 4.32Å; Y1021-L1025 HydrophobicContact CE2-CG 4.43Å; Y1021-L1025 PolarHBondContact O-N 3.43Å
1022	L	90.9	Very high	89.8	Confident	99 Å²	99	60.4 Å²	60.4	52%	0.518	32%	0.316	S	S	.	.	H	α-helix	trans	-60.8	-38.9	176.1	-67.9	168.2	0	0	0	112	L1018 A1019 S1024 L1025 A1026	L1018-L1022 HydrophobicContact CG-CD1 4.14Å; L1018-L1022 WeakPolarHBondContact O-CG 3.47Å; L1018-L1022 PolarHBondContact O-N 2.93Å; A1019-L1022 PolarHBondContact O-N 3.39Å; L1022-S1024 VanDerWaalsContact C-N 3.32Å; L1022-L1025 HydrophobicContact CD2-CD1 4.37Å; L1022-L1025 PolarHBondContact O-N 3.13Å; L1022-A1026 PolarHBondContact O-N 3.45Å
1023	I	90.9	Very high	89.3	Confident	100 Å²	100	58.8 Å²	58.8	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-40.7	172.6	-67.1	163.8	0	0	0	110.4	A1019 Y1021 L1025 A1026 V1027	A1019-I1023 VanDerWaalsContact O-CG1 3.27Å; A1019-I1023 WeakPolarHBondContact O-CG1 3.38Å; A1019-I1023 PolarHBondContact O-N 3.23Å; Y1021-I1023 VanDerWaalsContact C-N 3.3Å; Y1021-I1023 PolarHBondContact O-N 2.94Å; I1023-L1025 VanDerWaalsContact C-N 3.31Å; I1023-L1025 PolarHBondContact O-N 3.4Å; I1023-A1026 WeakPolarHBondContact O-CA 3.49Å; I1023-A1026 WeakPolarHBondContact O-CB 3.38Å; I1023-A1026 PolarHBondContact O-N 3.39Å; I1023-V1027 HydrophobicContact CG2-CG2 3.98Å; I1023-V1027 WeakPolarHBondContact O-CG2 3.36Å; I1023-V1027 PolarHBondContact O-N 2.98Å
1024	S	89.8	Confident	88.7	Confident	9 Å²	9	63.9 Å²	63.9	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-63.8	-35.5	179.1	79.7	0	0	0	0	113.2	Y914 L1020 Y1021 L1022 A1026 V1027 L1028	Y914-S1024 WeakPolarHBondContact OH-CB 3.23Å; Y914-S1024 PolarHBondContact OH-OG 3.17Å; L1020-S1024 PolarHBondContact O-N 3.02Å; Y1021-S1024 WeakPolarHBondContact CD2-OG 3.43Å; Y1021-S1024 WeakPolarHBondContact O-CA 3.3Å; Y1021-S1024 WeakPolarHBondContact O-CB 3.35Å; Y1021-S1024 PolarHBondContact O-N 3.42Å; Y1021-S1024 PolarHBondContact O-OG 2.92Å; L1022-S1024 VanDerWaalsContact C-N 3.32Å; S1024-A1026 PolarHBondContact O-N 2.84Å; S1024-V1027 PolarHBondContact O-N 2.88Å; S1024-L1028 VanDerWaalsContact O-CB 3.3Å; S1024-L1028 WeakPolarHBondContact O-CB 3.47Å; S1024-L1028 PolarHBondContact O-N 2.89Å
1025	L	87.1	Confident	88.2	Confident	13 Å²	13	70.1 Å²	70.1	7%	0.068	35%	0.353	C	S	.	.	H	α-helix	trans	-61.2	-30.3	172.6	-68.6	175.8	0	0	0	111.8	Y1021 L1022 I1023 F1032 I1037	Y1021-L1025 HydrophobicContact CD1-CD1 4.42Å; Y1021-L1025 HydrophobicContact CE1-CD1 3.95Å; Y1021-L1025 HydrophobicContact CE1-CD2 4.41Å; Y1021-L1025 HydrophobicContact CE1-CG 4.22Å; Y1021-L1025 HydrophobicContact CE2-CD2 4.32Å; Y1021-L1025 HydrophobicContact CE2-CG 4.43Å; Y1021-L1025 PolarHBondContact O-N 3.43Å; L1022-L1025 HydrophobicContact CD2-CD1 4.37Å; L1022-L1025 PolarHBondContact O-N 3.13Å; I1023-L1025 VanDerWaalsContact C-N 3.31Å; I1023-L1025 PolarHBondContact O-N 3.4Å; L1025-F1032 HydrophobicContact CD2-CD1 3.59Å; L1025-F1032 HydrophobicContact CD2-CD2 3.98Å; L1025-F1032 HydrophobicContact CD2-CE1 3.57Å; L1025-F1032 HydrophobicContact CD2-CE2 3.97Å; L1025-F1032 HydrophobicContact CD2-CG 3.8Å; L1025-F1032 HydrophobicContact CD2-CZ 3.77Å; L1025-I1037 HydrophobicContact CB-CD1 4.07Å; L1025-I1037 HydrophobicContact CD2-CD1 4.25Å; L1025-I1037 WeakPolarHBondContact O-CD1 3.17Å
1026	A	85.5	Confident	87.6	Confident	34 Å²	34	66.4 Å²	66.4	28%	0.281	33%	0.332	S	S	.	.	H	α-helix	trans	-87.7	-25.9	178.6	0	0	0	0	0	115.1	L1022 I1023 S1024 H1029 W1034	L1022-A1026 PolarHBondContact O-N 3.45Å; I1023-A1026 WeakPolarHBondContact O-CA 3.49Å; I1023-A1026 WeakPolarHBondContact O-CB 3.38Å; I1023-A1026 PolarHBondContact O-N 3.39Å; S1024-A1026 PolarHBondContact O-N 2.84Å; A1026-H1029 PolarHBondContact O-CE1 3.36Å; A1026-H1029 PolarHBondContact O-NE2 2.95Å; A1026-W1034 HydrophobicContact CB-CE3 4.38Å; A1026-W1034 HydrophobicContact CB-CH2 3.9Å; A1026-W1034 HydrophobicContact CB-CZ3 3.39Å
1027	V	87.6	Confident	87.1	Confident	97 Å²	97	62.4 Å²	62.4	59%	0.588	32%	0.316	S	S	*	.	H	α-helix	trans	-94.6	-37.3	-175.5	174.5	0	0	0	0	111.8	I1023 S1024 H1029	I1023-V1027 HydrophobicContact CG2-CG2 3.98Å; I1023-V1027 WeakPolarHBondContact O-CG2 3.36Å; I1023-V1027 PolarHBondContact O-N 2.98Å; S1024-V1027 PolarHBondContact O-N 2.88Å; V1027-H1029 VanDerWaalsContact C-N 3.32Å; V1027-H1029 PolarHBondContact O-N 3.26Å; V1027-H1029 PolarHBondContact O-ND1 2.94Å
1028	L	85.9	Confident	86.6	Confident	38 Å²	38	71.7 Å²	71.7	20%	0.199	35%	0.351	C	S	.	.			trans	-87.2	62.8	-172.4	-67.2	175.4	0	0	0	112.7	S1024 E1030 Y1031 F1032	S1024-L1028 VanDerWaalsContact O-CB 3.3Å; S1024-L1028 WeakPolarHBondContact O-CB 3.47Å; S1024-L1028 PolarHBondContact O-N 2.89Å; L1028-E1030 PolarHBondContact O-N 3.42Å; L1028-E1030 VanDerWaalsContact O-N 3.15Å; L1028-Y1031 HydrophobicContact CB-CD2 4.1Å; L1028-Y1031 HydrophobicContact CD2-CD2 4.28Å; L1028-Y1031 HydrophobicContact CD2-CE2 4.49Å; L1028-Y1031 PolarHBondContact O-N 3.41Å; L1028-F1032 HydrophobicContact CB-CD2 4.02Å; L1028-F1032 HydrophobicContact CB-CE2 4.29Å; L1028-F1032 HydrophobicContact CD1-CE2 4.41Å; L1028-F1032 PolarHBondContact O-N 3.2Å
1029	H	82	Confident	86.3	Confident	124 Å²	124	70.8 Å²	70.8	57%	0.574	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.2	-179.7	-61	84	0	0	0	113.9	A1026 V1027 Y1031	A1026-H1029 PolarHBondContact O-CE1 3.36Å; A1026-H1029 PolarHBondContact O-NE2 2.95Å; V1027-H1029 VanDerWaalsContact C-N 3.32Å; V1027-H1029 PolarHBondContact O-N 3.26Å; V1027-H1029 PolarHBondContact O-ND1 2.94Å; H1029-Y1031 VanDerWaalsContact C-N 3.26Å; H1029-Y1031 PolarHBondContact O-N 3.45Å
1030	E	79.8	Confident	86	Confident	181 Å²	181	77.2 Å²	77.2	85%	0.846	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-22.3	174.3	-67.8	-173.9	171.1	0	0	113.2	L1028	L1028-E1030 PolarHBondContact O-N 3.42Å; L1028-E1030 VanDerWaalsContact O-N 3.15Å
1031	Y	80.6	Confident	85.6	Confident	67 Å²	67	78.6 Å²	78.6	26%	0.263	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-29.5	-175.5	-65.5	-78.2	0	0	0	113.1	F905 L906 L1028 H1029	F905-Y1031 HydrophobicContact CB-CE2 4.39Å; F905-Y1031 HydrophobicContact CD2-CE2 4.41Å; L906-Y1031 HydrophobicContact CD1-CD1 3.71Å; L906-Y1031 HydrophobicContact CD1-CE1 4.35Å; L906-Y1031 HydrophobicContact CD1-CG 4.14Å; L906-Y1031 HydrophobicContact CG-CD1 4.03Å; L906-Y1031 HydrophobicContact CG-CE1 4.42Å; L906-Y1031 HydrophobicContact CG-CG 4.19Å; L1028-Y1031 HydrophobicContact CB-CD2 4.1Å; L1028-Y1031 HydrophobicContact CD2-CD2 4.28Å; L1028-Y1031 HydrophobicContact CD2-CE2 4.49Å; L1028-Y1031 PolarHBondContact O-N 3.41Å; H1029-Y1031 VanDerWaalsContact C-N 3.26Å; H1029-Y1031 PolarHBondContact O-N 3.45Å
1032	F	83.7	Confident	85.4	Confident	3 Å²	3	78.9 Å²	78.9	1%	0.013	37%	0.374	C	S	.	.	S	Bend	trans	-124.2	130.3	-178.3	-54.8	-78	0	0	0	111	L906 A985 F988 L1025 L1028 I1037	L906-F1032 HydrophobicContact CD2-CE2 3.73Å; L906-F1032 HydrophobicContact CD2-CZ 3.58Å; A985-F1032 HydrophobicContact CB-CD1 3.73Å; A985-F1032 HydrophobicContact CB-CE1 4.19Å; F988-F1032 HydrophobicContact CD1-CZ 4.07Å; L1025-F1032 HydrophobicContact CD2-CD1 3.59Å; L1025-F1032 HydrophobicContact CD2-CD2 3.98Å; L1025-F1032 HydrophobicContact CD2-CE1 3.57Å; L1025-F1032 HydrophobicContact CD2-CE2 3.97Å; L1025-F1032 HydrophobicContact CD2-CG 3.8Å; L1025-F1032 HydrophobicContact CD2-CZ 3.77Å; L1028-F1032 HydrophobicContact CB-CD2 4.02Å; L1028-F1032 HydrophobicContact CB-CE2 4.29Å; L1028-F1032 HydrophobicContact CD1-CE2 4.41Å; L1028-F1032 PolarHBondContact O-N 3.2Å; F1032-I1037 HydrophobicContact CB-CD1 3.51Å; F1032-I1037 HydrophobicContact CB-CG1 4.42Å; F1032-I1037 HydrophobicContact CG-CD1 4.32Å
1033	D	83.3	Confident	85.3	Confident	74 Å²	74	78.8 Å²	78.8	40%	0.396	37%	0.373	S	S	.	.			trans	-80.2	118.6	173.3	-173	-12.6	0	0	0	110.2	H982 E1035 F1036 I1037	H982-D1033 IonicContact CE1-OD2 3.69Å; H982-D1033 PolarHBondContact CE1-OD2 3.45Å; D1033-E1035 PolarHBondContact O-N 3.35Å; D1033-E1035 PolarHBondContact OD1-N 3.27Å; D1033-F1036 HydrophobicContact CB-CB 4.01Å; D1033-F1036 PolarHBondContact O-N 2.85Å; D1033-I1037 VanDerWaalsContact O-CG1 3.3Å; D1033-I1037 WeakPolarHBondContact O-CG1 3.23Å; D1033-I1037 PolarHBondContact O-N 3.31Å; D1033-I1037 VanDerWaalsContact O-N 3.12Å
1034	W	80.9	Confident	85.3	Confident	122 Å²	122	79 Å²	79	46%	0.462	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-38.5	-174.9	-177.2	-102.4	0	0	0	112.8	A1026	A1026-W1034 HydrophobicContact CB-CE3 4.38Å; A1026-W1034 HydrophobicContact CB-CH2 3.9Å; A1026-W1034 HydrophobicContact CB-CZ3 3.39Å
1035	E	83.3	Confident	85.3	Confident	163 Å²	163	79.7 Å²	79.7	76%	0.762	37%	0.37	S	S	*	.	H	α-helix	trans	-69.6	-38.5	179.9	-65.9	-170.1	173.3	0	0	110.9	D1033	D1033-E1035 PolarHBondContact O-N 3.35Å; D1033-E1035 PolarHBondContact OD1-N 3.27Å
1036	F	83.1	Confident	85.5	Confident	24 Å²	24	79.7 Å²	79.7	11%	0.105	37%	0.37	C	S	.	.	H	α-helix	trans	-69.3	-39.2	179.6	-178.8	-108.8	0	0	0	113	F976 H982 I986 D1033 W1038 S1039 F1042	F976-F1036 HydrophobicContact CE1-CE2 4.2Å; F976-F1036 AromaticContact CE1-CZ 3.74Å; F976-F1036 HydrophobicContact CE1-CZ 3.74Å; F976-F1036 AromaticContact CZ-CZ 3.94Å; F976-F1036 HydrophobicContact CZ-CZ 3.94Å; H982-F1036 HydrophobicContact CB-CD1 4.05Å; H982-F1036 HydrophobicContact CB-CE1 3.65Å; H982-F1036 HydrophobicContact CB-CZ 3.96Å; H982-F1036 AromaticContact CG-CD1 3.82Å; H982-F1036 AromaticContact CG-CE1 3.9Å; H982-F1036 AromaticContact ND1-CD1 3.66Å; H982-F1036 AromaticContact ND1-CG 3.81Å; I986-F1036 HydrophobicContact CD1-CE1 4Å; I986-F1036 HydrophobicContact CD1-CZ 3.94Å; I986-F1036 HydrophobicContact CG1-CE1 3.97Å; I986-F1036 HydrophobicContact CG1-CZ 4.2Å; D1033-F1036 HydrophobicContact CB-CB 4.01Å; D1033-F1036 PolarHBondContact O-N 2.85Å; F1036-W1038 VanDerWaalsContact C-N 3.27Å; F1036-W1038 PolarHBondContact O-N 2.93Å; F1036-S1039 VanDerWaalsContact O-CB 3.24Å; F1036-S1039 WeakPolarHBondContact O-CB 3.37Å; F1036-S1039 PolarHBondContact O-N 3Å; F1036-S1039 PolarHBondContact O-OG 3.37Å; F1036-F1042 HydrophobicContact CD1-CB 4.47Å; F1036-F1042 HydrophobicContact CD1-CD2 4.09Å; F1036-F1042 HydrophobicContact CE1-CB 4.15Å; F1036-F1042 AromaticContact CE1-CD2 3.63Å; F1036-F1042 HydrophobicContact CE1-CD2 3.63Å; F1036-F1042 HydrophobicContact CE1-CG 4.33Å; F1036-F1042 HydrophobicContact CZ-CB 4.26Å; F1036-F1042 HydrophobicContact CZ-CD2 4.38Å; F1036-F1042 VanDerWaalsContact O-CB 3.31Å; F1036-F1042 WeakPolarHBondContact O-CB 3.05Å
1037	I	85.1	Confident	85.8	Confident	18 Å²	18	81.5 Å²	81.5	9%	0.092	38%	0.381	C	S	.	.	H	α-helix	trans	-60.2	-36.9	-179.6	-68.9	160.8	0	0	0	112	L1025 F1032 D1033 S1039 F1042	L1025-I1037 HydrophobicContact CB-CD1 4.07Å; L1025-I1037 HydrophobicContact CD2-CD1 4.25Å; L1025-I1037 WeakPolarHBondContact O-CD1 3.17Å; F1032-I1037 HydrophobicContact CB-CD1 3.51Å; F1032-I1037 HydrophobicContact CB-CG1 4.42Å; F1032-I1037 HydrophobicContact CG-CD1 4.32Å; D1033-I1037 VanDerWaalsContact O-CG1 3.3Å; D1033-I1037 WeakPolarHBondContact O-CG1 3.23Å; D1033-I1037 PolarHBondContact O-N 3.31Å; D1033-I1037 VanDerWaalsContact O-N 3.12Å; I1037-S1039 VanDerWaalsContact C-N 3.25Å; I1037-S1039 PolarHBondContact O-N 3.08Å; I1037-F1042 HydrophobicContact CG2-CD1 4.31Å; I1037-F1042 HydrophobicContact CG2-CE1 4.04Å; I1037-F1042 VanDerWaalsContact O-CD1 3.22Å; I1037-F1042 WeakPolarHBondContact O-CD1 3.39Å
1038	W	84.6	Confident	86.1	Confident	195 Å²	195	79.6 Å²	79.6	74%	0.739	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.8	179.3	-92	80.8	0	0	0	113.9	F1036	F1036-W1038 VanDerWaalsContact C-N 3.27Å; F1036-W1038 PolarHBondContact O-N 2.93Å
1039	S	87.7	Confident	86.5	Confident	32 Å²	32	78 Å²	78	22%	0.224	36%	0.358	C	S	.	.	S	Bend	trans	-69	145.3	176.4	75.5	0	0	0	0	111.7	F1036 I1037 D1041 F1042 L1043	F1036-S1039 VanDerWaalsContact O-CB 3.24Å; F1036-S1039 WeakPolarHBondContact O-CB 3.37Å; F1036-S1039 PolarHBondContact O-N 3Å; F1036-S1039 PolarHBondContact O-OG 3.37Å; I1037-S1039 VanDerWaalsContact C-N 3.25Å; I1037-S1039 PolarHBondContact O-N 3.08Å; S1039-D1041 PolarHBondContact O-N 3.4Å; S1039-F1042 PolarHBondContact O-N 3.47Å; S1039-F1042 PolarHBondContact OG-N 3.28Å; S1039-F1042 VanDerWaalsContact OG-N 3.08Å; S1039-L1043 PolarHBondContact O-N 3.45Å
1040	Y	87.3	Confident	87.1	Confident	179 Å²	179	72.5 Å²	72.5	70%	0.702	33%	0.334	S	S	*	.	H	α-helix	trans	-59.6	-31.1	170.4	-179.1	-98.5	0	0	0	111.7	L1043 W1044	Y1040-L1043 PolarHBondContact O-N 3.17Å; Y1040-W1044 HydrophobicContact CE1-CB 4.19Å; Y1040-W1044 HydrophobicContact CE1-CG 4.45Å; Y1040-W1044 PolarHBondContact O-N 2.65Å
1041	D	85.3	Confident	87.7	Confident	73 Å²	73	68.6 Å²	68.6	39%	0.39	32%	0.318	S	S	.	.	H	α-helix	trans	-61.2	-45.5	177.9	-99.6	34	0	0	0	112.6	S1039 K1045	S1039-D1041 PolarHBondContact O-N 3.4Å; D1041-K1045 VanDerWaalsContact O-CB 3.27Å; D1041-K1045 WeakPolarHBondContact O-CB 3.3Å; D1041-K1045 VanDerWaalsContact O-CD 3.26Å; D1041-K1045 WeakPolarHBondContact O-CD 3.4Å; D1041-K1045 WeakPolarHBondContact O-CG 3.35Å; D1041-K1045 PolarHBondContact O-N 2.96Å; D1041-K1045 VanDerWaalsContact OD2-CE 3.29Å; D1041-K1045 WeakPolarHBondContact OD2-CE 3.39Å; D1041-K1045 IonicContact OD2-NZ 3.26Å; D1041-K1045 PolarHBondContact OD2-NZ 3.04Å
1042	F	88.4	Confident	88.4	Confident	11 Å²	11	68.5 Å²	68.5	5%	0.048	32%	0.324	C	S	.	.	H	α-helix	trans	-61.3	-50.3	175.3	174.3	-99.4	0	0	0	111.4	A985 I986 S989 F1036 I1037 S1039 K1045 V1046	A985-F1042 HydrophobicContact CB-CE2 4.45Å; I986-F1042 HydrophobicContact CG1-CD2 4.11Å; I986-F1042 HydrophobicContact CG1-CE2 4.42Å; S989-F1042 VanDerWaalsContact OG-CZ 3.25Å; S989-F1042 WeakPolarHBondContact OG-CZ 3.16Å; F1036-F1042 HydrophobicContact CD1-CB 4.47Å; F1036-F1042 HydrophobicContact CD1-CD2 4.09Å; F1036-F1042 HydrophobicContact CE1-CB 4.15Å; F1036-F1042 AromaticContact CE1-CD2 3.63Å; F1036-F1042 HydrophobicContact CE1-CD2 3.63Å; F1036-F1042 HydrophobicContact CE1-CG 4.33Å; F1036-F1042 HydrophobicContact CZ-CB 4.26Å; F1036-F1042 HydrophobicContact CZ-CD2 4.38Å; F1036-F1042 VanDerWaalsContact O-CB 3.31Å; F1036-F1042 WeakPolarHBondContact O-CB 3.05Å; I1037-F1042 HydrophobicContact CG2-CD1 4.31Å; I1037-F1042 HydrophobicContact CG2-CE1 4.04Å; I1037-F1042 VanDerWaalsContact O-CD1 3.22Å; I1037-F1042 WeakPolarHBondContact O-CD1 3.39Å; S1039-F1042 PolarHBondContact O-N 3.47Å; S1039-F1042 PolarHBondContact OG-N 3.28Å; S1039-F1042 VanDerWaalsContact OG-N 3.08Å; F1042-K1045 PolarHBondContact O-N 3.15Å; F1042-V1046 HydrophobicContact CD2-CG2 4.06Å; F1042-V1046 HydrophobicContact CE1-CG2 4.38Å; F1042-V1046 HydrophobicContact CE2-CG2 3.83Å; F1042-V1046 HydrophobicContact CG-CG2 4.47Å; F1042-V1046 HydrophobicContact CZ-CG2 4.01Å; F1042-V1046 WeakPolarHBondContact O-CB 3.43Å; F1042-V1046 VanDerWaalsContact O-CG2 3.28Å; F1042-V1046 WeakPolarHBondContact O-CG2 3.39Å; F1042-V1046 PolarHBondContact O-N 3.5Å
1043	L	89.1	Confident	88.8	Confident	97 Å²	97	68.4 Å²	68.4	51%	0.508	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-47.8	-175.1	-72.6	171.3	0	0	0	113.1	S1039 Y1040 S1047	S1039-L1043 PolarHBondContact O-N 3.45Å; Y1040-L1043 PolarHBondContact O-N 3.17Å; L1043-S1047 VanDerWaalsContact O-CB 3.26Å; L1043-S1047 WeakPolarHBondContact O-CB 3.48Å; L1043-S1047 PolarHBondContact O-N 3.24Å; L1043-S1047 PolarHBondContact O-OG 3.48Å
1044	W	90.9	Very high	89.2	Confident	104 Å²	104	65.2 Å²	65.2	39%	0.394	31%	0.307	S	S	.	.	H	α-helix	trans	-70.6	-39.6	-177.4	108.7	-102.1	0	0	0	111.4	Y1040 S1047 L1048	Y1040-W1044 HydrophobicContact CE1-CB 4.19Å; Y1040-W1044 HydrophobicContact CE1-CG 4.45Å; Y1040-W1044 PolarHBondContact O-N 2.65Å; W1044-S1047 PolarHBondContact O-N 3.21Å; W1044-L1048 HydrophobicContact CE3-CB 3.89Å; W1044-L1048 HydrophobicContact CE3-CD2 4.38Å; W1044-L1048 HydrophobicContact CH2-CB 4.41Å; W1044-L1048 HydrophobicContact CH2-CD2 3.37Å; W1044-L1048 HydrophobicContact CH2-CG 4.38Å; W1044-L1048 HydrophobicContact CZ2-CD2 4.44Å; W1044-L1048 HydrophobicContact CZ3-CB 3.63Å; W1044-L1048 HydrophobicContact CZ3-CD1 4.2Å; W1044-L1048 HydrophobicContact CZ3-CD2 3.35Å; W1044-L1048 HydrophobicContact CZ3-CG 3.88Å; W1044-L1048 WeakPolarHBondContact O-CB 3.32Å; W1044-L1048 PolarHBondContact O-N 2.94Å
1045	K	90	Very high	89.7	Confident	25 Å²	25	63.3 Å²	63.3	11%	0.109	31%	0.306	C	S	.	.	H	α-helix	trans	-69.1	-43.4	-178.2	-65.1	171.6	-167.6	173.1	0	111.2	F976 D1041 F1042 S1047 L1048 I1049	F976-K1045 HydrophobicContact CD1-CD 4.35Å; F976-K1045 HydrophobicContact CD2-CD 4.08Å; F976-K1045 HydrophobicContact CE1-CD 3.55Å; F976-K1045 HydrophobicContact CE2-CB 3.73Å; F976-K1045 HydrophobicContact CE2-CD 3.19Å; F976-K1045 HydrophobicContact CE2-CG 4Å; F976-K1045 HydrophobicContact CZ-CB 3.97Å; F976-K1045 HydrophobicContact CZ-CD 2.93Å; F976-K1045 HydrophobicContact CZ-CG 4.03Å; D1041-K1045 VanDerWaalsContact O-CB 3.27Å; D1041-K1045 WeakPolarHBondContact O-CB 3.3Å; D1041-K1045 VanDerWaalsContact O-CD 3.26Å; D1041-K1045 WeakPolarHBondContact O-CD 3.4Å; D1041-K1045 WeakPolarHBondContact O-CG 3.35Å; D1041-K1045 PolarHBondContact O-N 2.96Å; D1041-K1045 VanDerWaalsContact OD2-CE 3.29Å; D1041-K1045 WeakPolarHBondContact OD2-CE 3.39Å; D1041-K1045 IonicContact OD2-NZ 3.26Å; D1041-K1045 PolarHBondContact OD2-NZ 3.04Å; F1042-K1045 PolarHBondContact O-N 3.15Å; K1045-S1047 VanDerWaalsContact C-N 3.34Å; K1045-S1047 PolarHBondContact O-N 3.28Å; K1045-L1048 PolarHBondContact O-N 3.5Å; K1045-I1049 VanDerWaalsContact O-CG1 3.28Å; K1045-I1049 WeakPolarHBondContact O-CG1 3.5Å; K1045-I1049 PolarHBondContact O-N 3.24Å; K1045-I1049 VanDerWaalsContact O-N 3.09Å
1046	V	91.8	Very high	90	Very high	12 Å²	12	57.7 Å²	57.7	7%	0.073	28%	0.283	C	S	.	.	H	α-helix	trans	-59.3	-47.3	171.4	172.6	0	0	0	0	110.1	I986 A990 F1042 L1048 I1049 T1050	I986-V1046 HydrophobicContact CB-CG2 4.47Å; I986-V1046 HydrophobicContact CG2-CG2 4.02Å; A990-V1046 HydrophobicContact CB-CG1 4.4Å; F1042-V1046 HydrophobicContact CD2-CG2 4.06Å; F1042-V1046 HydrophobicContact CE1-CG2 4.38Å; F1042-V1046 HydrophobicContact CE2-CG2 3.83Å; F1042-V1046 HydrophobicContact CG-CG2 4.47Å; F1042-V1046 HydrophobicContact CZ-CG2 4.01Å; F1042-V1046 WeakPolarHBondContact O-CB 3.43Å; F1042-V1046 VanDerWaalsContact O-CG2 3.28Å; F1042-V1046 WeakPolarHBondContact O-CG2 3.39Å; F1042-V1046 PolarHBondContact O-N 3.5Å; V1046-L1048 PolarHBondContact O-N 3.29Å; V1046-I1049 PolarHBondContact O-N 2.97Å; V1046-T1050 WeakPolarHBondContact O-CB 3.43Å; V1046-T1050 PolarHBondContact O-N 2.97Å; V1046-T1050 PolarHBondContact O-OG1 2.96Å
1047	S	92.5	Very high	90.3	Very high	73 Å²	73	58 Å²	58	51%	0.51	29%	0.286	S	S	.	.	H	α-helix	trans	-60.6	-43.4	-179.8	-61.9	0	0	0	0	112.9	L1043 W1044 K1045 T1050 L1051	L1043-S1047 VanDerWaalsContact O-CB 3.26Å; L1043-S1047 WeakPolarHBondContact O-CB 3.48Å; L1043-S1047 PolarHBondContact O-N 3.24Å; L1043-S1047 PolarHBondContact O-OG 3.48Å; W1044-S1047 PolarHBondContact O-N 3.21Å; K1045-S1047 VanDerWaalsContact C-N 3.34Å; K1045-S1047 PolarHBondContact O-N 3.28Å; S1047-T1050 PolarHBondContact O-N 3.5Å; S1047-L1051 WeakPolarHBondContact O-CB 3.06Å; S1047-L1051 PolarHBondContact O-N 3.07Å
1048	L	93.8	Very high	90.4	Very high	56 Å²	56	62.4 Å²	62.4	29%	0.293	30%	0.302	S	S	.	.	H	α-helix	trans	-62.1	-50.2	177.7	177.5	66.9	0	0	0	111.4	L975 W1044 K1045 V1046 T1050 L1051 V1052	L975-L1048 HydrophobicContact CD1-CD2 3.96Å; L975-L1048 HydrophobicContact CD2-CD2 4.24Å; W1044-L1048 HydrophobicContact CE3-CB 3.89Å; W1044-L1048 HydrophobicContact CE3-CD2 4.38Å; W1044-L1048 HydrophobicContact CH2-CB 4.41Å; W1044-L1048 HydrophobicContact CH2-CD2 3.37Å; W1044-L1048 HydrophobicContact CH2-CG 4.38Å; W1044-L1048 HydrophobicContact CZ2-CD2 4.44Å; W1044-L1048 HydrophobicContact CZ3-CB 3.63Å; W1044-L1048 HydrophobicContact CZ3-CD1 4.2Å; W1044-L1048 HydrophobicContact CZ3-CD2 3.35Å; W1044-L1048 HydrophobicContact CZ3-CG 3.88Å; W1044-L1048 WeakPolarHBondContact O-CB 3.32Å; W1044-L1048 PolarHBondContact O-N 2.94Å; K1045-L1048 PolarHBondContact O-N 3.5Å; V1046-L1048 PolarHBondContact O-N 3.29Å; L1048-T1050 VanDerWaalsContact C-N 3.28Å; L1048-T1050 PolarHBondContact O-N 2.91Å; L1048-L1051 PolarHBondContact O-N 3.46Å; L1048-V1052 HydrophobicContact CD1-CG2 4.14Å; L1048-V1052 WeakPolarHBondContact O-CG2 3.26Å; L1048-V1052 PolarHBondContact O-N 2.94Å
1049	I	93.7	Very high	90.6	Very high	4 Å²	4	57 Å²	57	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-58.7	-45	179.9	-66.6	168.3	0	0	0	110	I968 A972 L975 I986 A990 K1045 V1046 L1051 V1052 S1053	I968-I1049 HydrophobicContact CB-CG2 4.25Å; I968-I1049 HydrophobicContact CG1-CG2 4.06Å; I968-I1049 HydrophobicContact CG2-CG2 4.36Å; A972-I1049 HydrophobicContact CB-CD1 4.33Å; L975-I1049 HydrophobicContact CD1-CD1 4.01Å; L975-I1049 HydrophobicContact CD1-CG1 3.7Å; I986-I1049 HydrophobicContact CG2-CD1 3.8Å; A990-I1049 HydrophobicContact CB-CB 4.23Å; A990-I1049 HydrophobicContact CB-CG2 3.79Å; K1045-I1049 VanDerWaalsContact O-CG1 3.28Å; K1045-I1049 WeakPolarHBondContact O-CG1 3.5Å; K1045-I1049 PolarHBondContact O-N 3.24Å; K1045-I1049 VanDerWaalsContact O-N 3.09Å; V1046-I1049 PolarHBondContact O-N 2.97Å; I1049-L1051 PolarHBondContact O-N 2.94Å; I1049-V1052 PolarHBondContact O-N 2.95Å; I1049-S1053 VanDerWaalsContact O-CB 3.29Å; I1049-S1053 WeakPolarHBondContact O-CB 3.45Å; I1049-S1053 PolarHBondContact O-N 3.03Å
1050	T	93.6	Very high	90.5	Very high	9 Å²	9	60.8 Å²	60.8	6%	0.055	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-41.8	180	-40.7	0	0	0	0	111.5	M993 I997 V1046 S1047 L1048 S1053 C1054	M993-T1050 HydrophobicContact CB-CG2 3.72Å; I997-T1050 HydrophobicContact CD1-CG2 3.83Å; V1046-T1050 WeakPolarHBondContact O-CB 3.43Å; V1046-T1050 PolarHBondContact O-N 2.97Å; V1046-T1050 PolarHBondContact O-OG1 2.96Å; S1047-T1050 PolarHBondContact O-N 3.5Å; L1048-T1050 VanDerWaalsContact C-N 3.28Å; L1048-T1050 PolarHBondContact O-N 2.91Å; T1050-S1053 PolarHBondContact O-N 3.32Å; T1050-C1054 PolarHBondContact O-N 3.4Å; T1050-C1054 VanDerWaalsContact O-N 3.08Å
1051	L	93.6	Very high	90.4	Very high	99 Å²	99	56.7 Å²	56.7	52%	0.518	29%	0.289	S	S	.	.	H	α-helix	trans	-62.8	-47.7	178	-176.7	69.4	0	0	0	111.5	S1047 L1048 I1049 S1053 C1054 L1055	S1047-L1051 WeakPolarHBondContact O-CB 3.06Å; S1047-L1051 PolarHBondContact O-N 3.07Å; L1048-L1051 PolarHBondContact O-N 3.46Å; I1049-L1051 PolarHBondContact O-N 2.94Å; L1051-S1053 VanDerWaalsContact C-N 3.29Å; L1051-S1053 PolarHBondContact O-N 3.41Å; L1051-C1054 PolarHBondContact O-N 3.2Å; L1051-L1055 HydrophobicContact CD1-CB 4.25Å; L1051-L1055 HydrophobicContact CD1-CD2 4.3Å; L1051-L1055 HydrophobicContact CG-CD2 4.45Å; L1051-L1055 WeakPolarHBondContact O-CB 3.38Å; L1051-L1055 PolarHBondContact O-N 3.47Å
1052	V	94.1	Very high	90.4	Very high	66 Å²	66	58.5 Å²	58.5	40%	0.4	29%	0.294	S	S	.	.	H	α-helix	trans	-65.8	-34.9	179.5	178.6	0	0	0	0	111.2	Y963 V967 L1048 I1049 P1056	Y963-V1052 PolarHBondContact OH-O 2.71Å; V967-V1052 HydrophobicContact CG1-CB 4.21Å; V967-V1052 HydrophobicContact CG1-CG1 3.84Å; L1048-V1052 HydrophobicContact CD1-CG2 4.14Å; L1048-V1052 WeakPolarHBondContact O-CG2 3.26Å; L1048-V1052 PolarHBondContact O-N 2.94Å; I1049-V1052 PolarHBondContact O-N 2.95Å; V1052-P1056 WeakPolarHBondContact O-CD 3.42Å
1053	S	93.4	Very high	90.3	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66	-41.2	176.5	-177.8	0	0	0	0	113.1	Q964 T994 I1049 T1050 L1051	Q964-S1053 WeakPolarHBondContact CG-OG 3.11Å; Q964-S1053 PolarHBondContact NE2-O 3.2Å; T994-S1053 VanDerWaalsContact CG2-OG 3.28Å; T994-S1053 WeakPolarHBondContact CG2-OG 3.4Å; I1049-S1053 VanDerWaalsContact O-CB 3.29Å; I1049-S1053 WeakPolarHBondContact O-CB 3.45Å; I1049-S1053 PolarHBondContact O-N 3.03Å; T1050-S1053 PolarHBondContact O-N 3.32Å; L1051-S1053 VanDerWaalsContact C-N 3.29Å; L1051-S1053 PolarHBondContact O-N 3.41Å
1054	C	92.1	Very high	90	Very high	7 Å²	7	65.1 Å²	65.1	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-97.2	-38.1	-171.9	-69.2	0	0	0	0	114.8	I997 T1050 L1051 L1057 Y1058	I997-C1054 HydrophobicContact CG2-CB 4.13Å; T1050-C1054 PolarHBondContact O-N 3.4Å; T1050-C1054 VanDerWaalsContact O-N 3.08Å; L1051-C1054 PolarHBondContact O-N 3.2Å; C1054-L1057 PolarHBondContact O-N 2.85Å; C1054-Y1058 PolarHBondContact O-N 3.23Å; C1054-Y1058 VanDerWaalsContact O-N 3.13Å
1055	L	90.2	Very high	89.5	Confident	82 Å²	82	66.1 Å²	66.1	43%	0.429	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-45.1	-168.3	-178.4	69.3	0	0	0	113.6	L1051 L1057 Y1058 I1059	L1051-L1055 HydrophobicContact CD1-CB 4.25Å; L1051-L1055 HydrophobicContact CD1-CD2 4.3Å; L1051-L1055 HydrophobicContact CG-CD2 4.45Å; L1051-L1055 WeakPolarHBondContact O-CB 3.38Å; L1051-L1055 PolarHBondContact O-N 3.47Å; L1055-L1057 VanDerWaalsContact C-N 3.3Å; L1055-L1057 PolarHBondContact O-N 3.29Å; L1055-Y1058 WeakPolarHBondContact O-CB 3.48Å; L1055-Y1058 PolarHBondContact O-N 2.92Å; L1055-I1059 HydrophobicContact CD1-CD1 4.44Å; L1055-I1059 HydrophobicContact CG-CD1 4.1Å; L1055-I1059 WeakPolarHBondContact O-CG1 3.23Å; L1055-I1059 PolarHBondContact O-N 2.94Å
1056	P	89.9	Confident	89.2	Confident	45 Å²	45	72.5 Å²	72.5	29%	0.292	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-36.9	179.8	-26.8	40.2	0	0	0	112.8	Y963 V1052 I1059 I1060	Y963-P1056 WeakPolarHBondContact OH-CG 3.27Å; V1052-P1056 WeakPolarHBondContact O-CD 3.42Å; P1056-I1059 PolarHBondContact O-N 2.94Å; P1056-I1060 VanDerWaalsContact O-CG1 3.28Å; P1056-I1060 WeakPolarHBondContact O-CG1 3.34Å; P1056-I1060 PolarHBondContact O-N 3.22Å
1057	L	89	Confident	88.8	Confident	30 Å²	30	77 Å²	77	16%	0.157	38%	0.384	C	S	.	.	H	α-helix	trans	-66.8	-39.3	177.7	-61.2	174.4	0	0	0	111.7	I960 Y963 Q964 M998 C1054 L1055 I1060 K1061	I960-L1057 HydrophobicContact CG1-CD2 4.06Å; I960-L1057 HydrophobicContact CG2-CD1 3.61Å; I960-L1057 HydrophobicContact CG2-CD2 4.17Å; Y963-L1057 HydrophobicContact CD1-CD1 4.4Å; Y963-L1057 HydrophobicContact CD1-CD2 4.27Å; Y963-L1057 HydrophobicContact CD1-CG 4.35Å; Y963-L1057 HydrophobicContact CE1-CG 4.36Å; Q964-L1057 VanDerWaalsContact CD-CD1 3.43Å; Q964-L1057 HydrophobicContact CG-CD1 3.67Å; Q964-L1057 VanDerWaalsContact NE2-CD1 3.3Å; M998-L1057 HydrophobicContact CE-CD1 3.96Å; M998-L1057 HydrophobicContact SD-CD1 4.09Å; C1054-L1057 PolarHBondContact O-N 2.85Å; L1055-L1057 VanDerWaalsContact C-N 3.3Å; L1055-L1057 PolarHBondContact O-N 3.29Å; L1057-I1060 PolarHBondContact O-N 3.19Å; L1057-K1061 WeakPolarHBondContact O-CB 3.49Å; L1057-K1061 PolarHBondContact O-N 3.14Å
1058	Y	87.9	Confident	88.2	Confident	112 Å²	112	76.8 Å²	76.8	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-60.8	-47.3	173.5	178.3	-104.5	0	0	0	111.7	L1001 C1054 L1055 I1060 K1061 F1062	L1001-Y1058 HydrophobicContact CD1-CD2 4.29Å; L1001-Y1058 HydrophobicContact CD2-CD2 3.62Å; L1001-Y1058 HydrophobicContact CD2-CE2 3.94Å; L1001-Y1058 HydrophobicContact CD2-CG 4.46Å; L1001-Y1058 HydrophobicContact CG-CD2 4.45Å; C1054-Y1058 PolarHBondContact O-N 3.23Å; C1054-Y1058 VanDerWaalsContact O-N 3.13Å; L1055-Y1058 WeakPolarHBondContact O-CB 3.48Å; L1055-Y1058 PolarHBondContact O-N 2.92Å; Y1058-I1060 PolarHBondContact O-N 3.28Å; Y1058-K1061 PolarHBondContact O-N 3.27Å; Y1058-F1062 WeakPolarHBondContact O-CB 3.3Å; Y1058-F1062 PolarHBondContact O-N 3.48Å
1059	I	88.4	Confident	87.4	Confident	82 Å²	82	76.4 Å²	76.4	42%	0.421	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-47.7	178.3	-65.9	167.3	0	0	0	110.5	L1055 P1056 K1061 F1062 L1063	L1055-I1059 HydrophobicContact CD1-CD1 4.44Å; L1055-I1059 HydrophobicContact CG-CD1 4.1Å; L1055-I1059 WeakPolarHBondContact O-CG1 3.23Å; L1055-I1059 PolarHBondContact O-N 2.94Å; P1056-I1059 PolarHBondContact O-N 2.94Å; I1059-K1061 VanDerWaalsContact C-N 3.32Å; I1059-K1061 PolarHBondContact O-N 3.32Å; I1059-F1062 PolarHBondContact O-N 3.33Å; I1059-L1063 HydrophobicContact CG2-CD1 3.9Å; I1059-L1063 HydrophobicContact CG2-CG 4.33Å; I1059-L1063 WeakPolarHBondContact O-CB 3.19Å; I1059-L1063 VanDerWaalsContact O-CG 3.31Å; I1059-L1063 WeakPolarHBondContact O-CG 3.49Å; I1059-L1063 PolarHBondContact O-N 3.24Å
1060	I	86.3	Confident	86.4	Confident	110 Å²	110	78.6 Å²	78.6	56%	0.564	40%	0.398	S	S	*	.	H	α-helix	trans	-59.2	-44.7	177.7	-69.4	165.9	0	0	0	110.9	P1056 L1057 Y1058 L1063 R1064	P1056-I1060 VanDerWaalsContact O-CG1 3.28Å; P1056-I1060 WeakPolarHBondContact O-CG1 3.34Å; P1056-I1060 PolarHBondContact O-N 3.22Å; L1057-I1060 PolarHBondContact O-N 3.19Å; Y1058-I1060 PolarHBondContact O-N 3.28Å; I1060-L1063 PolarHBondContact O-N 3.36Å; I1060-R1064 WeakPolarHBondContact O-CB 3.31Å; I1060-R1064 PolarHBondContact O-N 3.2Å
1061	K	84.3	Confident	85.4	Confident	93 Å²	93	81.1 Å²	81.1	40%	0.404	42%	0.416	S	S	.	.	H	α-helix	trans	-63.3	-44.3	178.6	-176.2	-179.4	176.6	-176.8	0	111.6	L1001 L1057 Y1058 I1059 R1064 K1065	L1001-K1061 PolarHBondContact O-NZ 3Å; L1057-K1061 WeakPolarHBondContact O-CB 3.49Å; L1057-K1061 PolarHBondContact O-N 3.14Å; Y1058-K1061 PolarHBondContact O-N 3.27Å; I1059-K1061 VanDerWaalsContact C-N 3.32Å; I1059-K1061 PolarHBondContact O-N 3.32Å; K1061-R1064 PolarHBondContact O-N 3.24Å; K1061-K1065 WeakPolarHBondContact O-CB 3.48Å; K1061-K1065 PolarHBondContact O-N 3.29Å
1062	F	85.4	Confident	84.3	Confident	112 Å²	112	78.8 Å²	78.8	49%	0.491	40%	0.401	S	S	.	.	H	α-helix	trans	-61.1	-49	177.4	178.8	-97.7	0	0	0	111.4	Y1058 I1059 R1064 K1065 K1066	Y1058-F1062 WeakPolarHBondContact O-CB 3.3Å; Y1058-F1062 PolarHBondContact O-N 3.48Å; I1059-F1062 PolarHBondContact O-N 3.33Å; F1062-R1064 VanDerWaalsContact C-N 3.35Å; F1062-R1064 PolarHBondContact O-N 3.01Å; F1062-K1065 PolarHBondContact O-N 2.93Å; F1062-K1066 PolarHBondContact O-N 3.09Å
1063	L	86.2	Confident	83.1	Confident	91 Å²	91	77.8 Å²	77.8	48%	0.476	39%	0.393	S	S	.	.	H	α-helix	trans	-59.3	-44.4	176.4	-71.2	173.6	0	0	0	111.7	I1059 I1060 K1065 K1066 C1067	I1059-L1063 HydrophobicContact CG2-CD1 3.9Å; I1059-L1063 HydrophobicContact CG2-CG 4.33Å; I1059-L1063 WeakPolarHBondContact O-CB 3.19Å; I1059-L1063 VanDerWaalsContact O-CG 3.31Å; I1059-L1063 WeakPolarHBondContact O-CG 3.49Å; I1059-L1063 PolarHBondContact O-N 3.24Å; I1060-L1063 PolarHBondContact O-N 3.36Å; L1063-K1065 VanDerWaalsContact C-N 3.34Å; L1063-K1065 PolarHBondContact O-N 2.82Å; L1063-K1066 PolarHBondContact O-N 2.91Å; L1063-C1067 WeakPolarHBondContact O-CB 3.42Å; L1063-C1067 PolarHBondContact O-N 2.99Å; L1063-C1067 PolarHBondContact O-SG 2.85Å; L1063-C1067 VanDerWaalsContact O-SG 3.38Å
1064	R	82.8	Confident	82.1	Confident	156 Å²	156	84.9 Å²	84.9	59%	0.589	42%	0.423	S	S	*	.	H	α-helix	trans	-62.8	-40.3	178	-173.3	178	-179.7	-173.1	-0.4	112.5	I1060 K1061 F1062 K1066 S1068	I1060-R1064 WeakPolarHBondContact O-CB 3.31Å; I1060-R1064 PolarHBondContact O-N 3.2Å; K1061-R1064 PolarHBondContact O-N 3.24Å; F1062-R1064 VanDerWaalsContact C-N 3.35Å; F1062-R1064 PolarHBondContact O-N 3.01Å; R1064-K1066 VanDerWaalsContact C-N 3.3Å; R1064-S1068 CarbonylContact O-C 3.58Å; R1064-S1068 PolarHBondContact O-N 3.4Å; R1064-S1068 PolarHBondContact O-OG 3.23Å
1065	K	80.2	Confident	80.7	Confident	124 Å²	124	88.2 Å²	88.2	54%	0.539	44%	0.44	S	S	.	.	H	α-helix	trans	-64	-37.5	177.1	-168.5	-179	179.1	-174.1	0	111.1	K1061 F1062 L1063 L1073	K1061-K1065 WeakPolarHBondContact O-CB 3.48Å; K1061-K1065 PolarHBondContact O-N 3.29Å; F1062-K1065 PolarHBondContact O-N 2.93Å; L1063-K1065 VanDerWaalsContact C-N 3.34Å; L1063-K1065 PolarHBondContact O-N 2.82Å; K1065-L1073 HydrophobicContact CG-CD1 4.36Å
1066	K	83.5	Confident	78.9	Confident	159 Å²	159	90.8 Å²	90.8	69%	0.691	47%	0.466	S	S	*	.	H	α-helix	trans	-75.9	-44.4	179.1	-167	170.7	-177.8	177.8	0	113	F1062 L1063 R1064	F1062-K1066 PolarHBondContact O-N 3.09Å; L1063-K1066 PolarHBondContact O-N 2.91Å; R1064-K1066 VanDerWaalsContact C-N 3.3Å
1067	C	84.3	Confident	78.3	Confident	107 Å²	107	93.1 Å²	93.1	72%	0.723	47%	0.474	S	S	*	.	H	α-helix	trans	-82.9	-25.2	-176	-61.3	0	0	0	0	113.9	L1063	L1063-C1067 WeakPolarHBondContact O-CB 3.42Å; L1063-C1067 PolarHBondContact O-N 2.99Å; L1063-C1067 PolarHBondContact O-SG 2.85Å; L1063-C1067 VanDerWaalsContact O-SG 3.38Å
1068	S	79.1	Confident	77.7	Confident	68 Å²	68	96.4 Å²	96.4	48%	0.476	49%	0.491	S	S	.	.	S	Bend	trans	-144.6	69.5	-177.4	59.4	0	0	0	0	112	R1064	R1064-S1068 CarbonylContact O-C 3.58Å; R1064-S1068 PolarHBondContact O-N 3.4Å; R1064-S1068 PolarHBondContact O-OG 3.23Å
1069	P	78.1	Confident	77.2	Confident	49 Å²	49	95.6 Å²	95.6	32%	0.318	49%	0.494	S	S	.	.			trans	-63.4	136.3	-176.3	24.2	-32.3	0	0	0	111.3	L1073 K1074	P1069-L1073 HydrophobicContact CB-CB 4.27Å; P1069-K1074 HydrophobicContact CB-CG 4.44Å; P1069-K1074 HydrophobicContact CG-CG 4.21Å; P1069-K1074 WeakPolarHBondContact O-CE 3.44Å
1070	P	72	Confident	76.5	Confident	50 Å²	50	96.4 Å²	96.4	33%	0.325	50%	0.498	S	S	.	.			trans	-54.1	151.9	170.6	-26	33.4	0	0	0	112.9	Y1072 L1073 K1074	P1070-Y1072 HydrophobicContact CB-CD1 3.6Å; P1070-Y1072 HydrophobicContact CB-CE1 3.22Å; P1070-Y1072 HydrophobicContact CG-CE1 3.85Å; P1070-Y1072 PolarHBondContact O-N 3.35Å; P1070-Y1072 VanDerWaalsContact O-N 3.08Å; P1070-L1073 HydrophobicContact CB-CD1 4.39Å; P1070-L1073 HydrophobicContact CG-CD1 3.89Å; P1070-L1073 WeakPolarHBondContact O-CB 3.13Å; P1070-L1073 PolarHBondContact O-N 3.5Å; P1070-K1074 PolarHBondContact O-N 2.99Å
1071	S	72.1	Confident	75.9	Confident	62 Å²	62	95.5 Å²	95.5	43%	0.434	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-51.2	-38.6	-176.9	-42.5	0	0	0	0	113.8	K1074	S1071-K1074 WeakPolarHBondContact O-CB 2.94Å; S1071-K1074 PolarHBondContact O-N 3.04Å
1072	Y	70.9	Confident	75.4	Confident	50 Å²	50	95.7 Å²	95.7	20%	0.196	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-71.7	-29.6	179.5	68.7	-91	0	0	0	113.6	I928 R1004 P1070 K1074 L1075	I928-Y1072 HydrophobicContact CG2-CD2 4.05Å; I928-Y1072 HydrophobicContact CG2-CG 4.18Å; R1004-Y1072 VanDerWaalsContact CZ-OH 3.31Å; R1004-Y1072 PolarHBondContact NH1-OH 3.01Å; R1004-Y1072 VanDerWaalsContact NH1-OH 3.1Å; P1070-Y1072 HydrophobicContact CB-CD1 3.6Å; P1070-Y1072 HydrophobicContact CB-CE1 3.22Å; P1070-Y1072 HydrophobicContact CG-CE1 3.85Å; P1070-Y1072 PolarHBondContact O-N 3.35Å; P1070-Y1072 VanDerWaalsContact O-N 3.08Å; Y1072-K1074 PolarHBondContact O-N 2.8Å; Y1072-L1075 PolarHBondContact O-N 3.17Å
1073	L	69.5	Low	74.6	Confident	45 Å²	45	94.5 Å²	94.5	24%	0.236	50%	0.5	C	S	.	.	G	3₁₀ helix	trans	-76.9	-9.1	175.7	-89.9	155.5	0	0	0	112.6	K1065 P1069 P1070 S1076	K1065-L1073 HydrophobicContact CG-CD1 4.36Å; P1069-L1073 HydrophobicContact CB-CB 4.27Å; P1070-L1073 HydrophobicContact CB-CD1 4.39Å; P1070-L1073 HydrophobicContact CG-CD1 3.89Å; P1070-L1073 WeakPolarHBondContact O-CB 3.13Å; P1070-L1073 PolarHBondContact O-N 3.5Å; L1073-S1076 PolarHBondContact O-OG 3.28Å
1074	K	72.1	Confident	73.8	Confident	148 Å²	148	94.8 Å²	94.8	64%	0.643	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-86.5	-11.9	171.4	-59.4	-177.7	179.2	-174.5	0	112.5	P1069 P1070 S1071 Y1072	P1069-K1074 HydrophobicContact CB-CG 4.44Å; P1069-K1074 HydrophobicContact CG-CG 4.21Å; P1069-K1074 WeakPolarHBondContact O-CE 3.44Å; P1070-K1074 PolarHBondContact O-N 2.99Å; S1071-K1074 WeakPolarHBondContact O-CB 2.94Å; S1071-K1074 PolarHBondContact O-N 3.04Å; Y1072-K1074 PolarHBondContact O-N 2.8Å
1075	L	63	Low	73	Confident	77 Å²	77	89.7 Å²	89.7	40%	0.403	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-20.3	-178.8	-63.8	170.7	0	0	0	112.4	Y936 L939 Y1072	Y936-L1075 HydrophobicContact CD1-CD1 4.29Å; Y936-L1075 HydrophobicContact CD1-CD2 4.22Å; Y936-L1075 HydrophobicContact CD2-CD1 4.27Å; Y936-L1075 HydrophobicContact CE1-CD2 4.16Å; Y936-L1075 HydrophobicContact CG-CD1 3.97Å; L939-L1075 HydrophobicContact CD1-CD1 3.97Å; L939-L1075 HydrophobicContact CD2-CD1 3.85Å; L939-L1075 HydrophobicContact CG-CD1 4.1Å; Y1072-L1075 PolarHBondContact O-N 3.17Å
1076	S	51.3	Low	72.3	Confident	137 Å²	137	86.5 Å²	86.5	96%	0.958	49%	0.491	S	S	*	.			trans	-88.9	0	167.9	62.6	0	0	0	0	110.4	L1073	L1073-S1076 PolarHBondContact O-OG 3.28Å

Retrieved 1,076 of 1,076 residues in 1545.7 ms (Link to these results)

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