A0A093HR29_STRCA Loading...

Testis-expressed sequence 10 protein

AlphaFold DB , UniProt , Accession A0A093HR29, Species STRCA (Struthio camelus australis), Gene n/a, Length 927 aa.

						>A0A093HR29_STRCA|A0A093HR29
MTKKRKHQEDFQKVKLKVGKKKPKLENATDTTFKTKAIQIPEQLKEDGMLSTQNRKLNIKDLLSQMHHYSAGVKQNALLGLKDLLSQYPFVIDAHLSSIISEVAAVFTDKDSGVRGAAVHLLQFLASKIRAEQIAPFFPLVSAHLSSAMTHISEGIQEDSLKVLDVLLERYPALLTDRSSILLKNFVELISHQQLSKRVKSREKLSWMLTVNPNRKVTSQQWRLNVLIRLKKFLQAVVDGSSELEDEGLQEQKDSPHSVRSPICISWKVHANNQQHIQLYENGGLRPKINSSFRLRSLASIMDSAEKGLSSAENLKSFIEIIIPLLIECWIEASPAQSAPILGNLLESDSQQLMQQVLSIIHLLWKLTKRHDETYKMELWLRMNYLVDFKHHFMRHFPYSLQETVKHKKKDSCKGNKYCMASSNNVDHLLLNLTLCDIMVSLASASTLQTDSGWLDMIRKFVTDTLQDGSRLNSKQVNRLLGVTWRLMQIQQNKVATEPLIKAVYTLYQQRNLLFPVRTLLLKFFSRVYQKEDLRAQRIRSRSKVLSRWLAGLPQQLALLGLRNPELSNQLIDIIHSAASRSNKELLQSLQATAARIYDPLDGTLVLLPAEAQRRLVQLVYFLPCLPASLLACLSRCCIMGRMSSELAATLIGILHMRSSFAGWKCQVQDNSVNDVDYFSFLFSTLIGFSREELTSLQGIRGKPHISQTQLSPVRLYLTDLDQFLHHWAVTEMICHSLSTIPSQSQCFDILQTGICKYLVGLVVIPDSTAGSVLCAINKLLDQACILNENLHKFLASCCYSLLYFLLTLDKEDAEHVQKRDLLWGSCISALALLPRLLRLMLQSLQVNRICQEELPVVAQLLRLLMQHGQLRSHMATNEFLVQQIIKDIMTLKSGEVQEQWLTDLHYCFNIYLASHSQGPGPISTVY
					

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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	34.3	Very low	53.4	Low	250 Å²	250	187.9 Å²	187.9	100%	1.232	87%	0.867	S	S	*	*				0	138.5	0	-79.6	-165.8	175.9	0	0	109.9
2	T	46.6	Very low	54.6	Low	139 Å²	139	183.3 Å²	183.3	85%	0.853	85%	0.846	S	S	*	*			trans	-55.7	142.6	-170.3	47.1	0	0	0	0	116.8
3	K	41.6	Very low	55.3	Low	216 Å²	216	184.4 Å²	184.4	94%	0.939	85%	0.847	S	S	*	*			trans	-131.8	126.9	153.8	-94.4	-177.1	177.6	175.8	0	111.3
4	K	45	Very low	56	Low	212 Å²	212	180.5 Å²	180.5	92%	0.922	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-63	146.4	-174.4	-74.3	173.4	169.5	177.2	0	113.1
5	R	48.1	Very low	56.5	Low	251 Å²	251	181.2 Å²	181.2	95%	0.947	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-63.4	135	172.6	-73.8	174.7	168.9	172.5	-4.7	111.3
6	K	56.5	Low	56.6	Low	208 Å²	208	179.1 Å²	179.1	90%	0.904	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-78.1	136.9	168.2	-108.2	-178.8	174.8	-177.2	0	109.6
7	H	55.1	Low	57.1	Low	172 Å²	172	178 Å²	178	80%	0.796	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-55.5	129.5	178.1	-164.4	-77.1	0	0	0	111.2
8	Q	63.6	Low	57.1	Low	156 Å²	156	176.8 Å²	176.8	73%	0.729	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-96	128.5	177.2	-147.4	163.6	-0.5	0	0	107
9	E	67.5	Low	57.8	Low	152 Å²	152	171.8 Å²	171.8	71%	0.71	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-72.5	134.5	179.2	-67.1	178.4	172	0	0	110.5	F11	E9-F11 VanDerWaalsContact C-N 3.29Å; E9-F11 PolarHBondContact O-N 3.32Å
10	D	63.1	Low	58.4	Low	145 Å²	145	171.7 Å²	171.7	78%	0.775	83%	0.832	S	S	*	*	S	Bend	trans	-72.2	-15.5	-171.1	-70.3	-31.7	0	0	0	114.4
11	F	66.1	Low	58.9	Low	166 Å²	166	173.3 Å²	173.3	73%	0.728	84%	0.835	S	S	*	*			trans	-130.9	110.9	179	-62.4	-80.6	0	0	0	111.7	E9	E9-F11 VanDerWaalsContact C-N 3.29Å; E9-F11 PolarHBondContact O-N 3.32Å
12	Q	68.1	Low	60.4	Low	133 Å²	133	169.7 Å²	169.7	62%	0.621	81%	0.812	S	S	*	*			trans	-108.4	101.4	177.1	-69.6	-175.1	5.5	0	0	111	V14	Q12-V14 PolarHBondContact O-N 3.34Å
13	K	62.9	Low	61.3	Low	197 Å²	197	167.5 Å²	167.5	86%	0.857	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69.4	116.4	172.4	-80.1	178.7	178.2	171.4	0	110.8	K15	K13-K15 PolarHBondContact O-N 2.91Å
14	V	65.3	Low	62.7	Low	130 Å²	130	164.5 Å²	164.5	79%	0.788	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.1	125.8	176.6	-178.3	0	0	0	0	110.3	Q12 L16	Q12-V14 PolarHBondContact O-N 3.34Å; V14-L16 PolarHBondContact O-N 3.25Å
15	K	63.3	Low	64.1	Low	191 Å²	191	160.5 Å²	160.5	83%	0.83	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-56.9	130.8	179	-71.9	-176.1	177.7	-179.5	0	111.5	K13 K17	K13-K15 PolarHBondContact O-N 2.91Å; K15-K17 PolarHBondContact O-N 3.07Å
16	L	59.3	Low	65	Low	147 Å²	147	155.8 Å²	155.8	77%	0.77	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-60.4	117.4	176.6	-76.8	156.4	0	0	0	110.6	V14	V14-L16 PolarHBondContact O-N 3.25Å
17	K	63.9	Low	66	Low	161 Å²	161	152.3 Å²	152.3	70%	0.7	76%	0.755	S	S	*	*			trans	-96.7	115.2	170.1	-69.6	-173.8	177.7	-177.6	0	109	K15 G19 K20	K15-K17 PolarHBondContact O-N 3.07Å; K17-G19 PolarHBondContact O-N 3.39Å; K17-K20 PolarHBondContact O-N 3.41Å
18	V	58.6	Low	67.1	Low	156 Å²	156	146.6 Å²	146.6	95%	0.945	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	132.9	-179.9	-172.3	0	0	0	0	109.8
19	G	70.6	Confident	67.8	Low	83 Å²	83	145.3 Å²	145.3	86%	0.856	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.9	-7.6	-178.6	0	0	0	0	0	116.3	K17	K17-G19 PolarHBondContact O-N 3.39Å
20	K	68.9	Low	68.2	Low	168 Å²	168	142.6 Å²	142.6	73%	0.73	73%	0.731	S	S	*	*	S	Bend	trans	-102.7	141.9	171.8	-68.4	-170.5	175.6	-169.6	0	110.9	K17 K22	K17-K20 PolarHBondContact O-N 3.41Å; K20-K22 PolarHBondContact O-N 3.25Å
21	K	68.2	Low	69	Low	207 Å²	207	141.3 Å²	141.3	90%	0.9	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-53.7	134.7	176.8	-79.4	-174.1	177.3	-179.3	0	109.8
22	K	65.9	Low	69.6	Low	174 Å²	174	138.8 Å²	138.8	76%	0.757	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-51.4	123.5	-179.6	-174.1	178.5	178	-178.9	0	109.3	K20	K20-K22 PolarHBondContact O-N 3.25Å
23	P	66.5	Low	70.2	Confident	93 Å²	93	140.4 Å²	140.4	60%	0.604	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-60.5	141.2	176.9	21.7	-29.2	0	0	0	109.8
24	K	71.1	Confident	70.8	Confident	153 Å²	153	141 Å²	141	67%	0.665	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-58.8	147.3	176.9	-66.7	-179.8	-177.9	174.5	0	109	A28 D30	K24-A28 HydrophobicContact CB-CB 4.18Å; K24-D30 IonicContact NZ-OD2 3.7Å
25	L	73.4	Confident	71.4	Confident	128 Å²	128	140.6 Å²	140.6	67%	0.67	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-57.6	145.1	178.6	-67.5	158.7	0	0	0	110	N27 A28	L25-N27 WeakPolarHBondContact CB-OD1 3.2Å; L25-N27 PolarHBondContact O-N 3.37Å; L25-A28 WeakPolarHBondContact O-CB 3.14Å; L25-A28 PolarHBondContact O-N 3.39Å
26	E	68	Low	72	Confident	152 Å²	152	141 Å²	141	71%	0.71	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-21	-175.8	-80.5	175.8	169.2	0	0	113.8
27	N	76.9	Confident	73	Confident	135 Å²	135	138.6 Å²	138.6	72%	0.722	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	3.8	175.4	64.2	-20.8	0	0	0	114.2	L25 T29	L25-N27 WeakPolarHBondContact CB-OD1 3.2Å; L25-N27 PolarHBondContact O-N 3.37Å; N27-T29 PolarHBondContact O-N 3.37Å
28	A	78	Confident	73.8	Confident	52 Å²	52	138.2 Å²	138.2	43%	0.43	74%	0.74	S	S	.	*			trans	-81	107.9	179.5	0	0	0	0	0	111	K24 L25 D30	K24-A28 HydrophobicContact CB-CB 4.18Å; L25-A28 WeakPolarHBondContact O-CB 3.14Å; L25-A28 PolarHBondContact O-N 3.39Å; A28-D30 PolarHBondContact O-N 3.38Å
29	T	78.2	Confident	74.5	Confident	128 Å²	128	139.7 Å²	139.7	79%	0.785	74%	0.737	S	S	*	*			trans	-68.1	121.3	171.9	-47.6	0	0	0	0	110	N27 T31	N27-T29 PolarHBondContact O-N 3.37Å; T29-T31 PolarHBondContact O-N 3.49Å
30	D	76.1	Confident	74.9	Confident	96 Å²	96	141.8 Å²	141.8	51%	0.513	73%	0.727	S	S	.	*			trans	-80.4	111.4	176.3	-157.7	-25.4	0	0	0	110.5	K24 A28 T32	K24-D30 IonicContact NZ-OD2 3.7Å; A28-D30 PolarHBondContact O-N 3.38Å; D30-T32 VanDerWaalsContact C-N 3.26Å; D30-T32 VanDerWaalsContact CG-OG1 3.26Å; D30-T32 PolarHBondContact O-N 3.49Å; D30-T32 WeakPolarHBondContact OD1-CB 3.38Å; D30-T32 PolarHBondContact OD1-N 3.09Å; D30-T32 PolarHBondContact OD1-OG1 3.49Å; D30-T32 PolarHBondContact OD2-OG1 2.61Å
31	T	79.9	Confident	74.8	Confident	117 Å²	117	139 Å²	139	72%	0.718	73%	0.726	S	S	*	*			trans	-85.6	4.4	178.7	56.6	0	0	0	0	113.1	T29 F33	T29-T31 PolarHBondContact O-N 3.49Å; T31-F33 PolarHBondContact O-N 3Å; T31-F33 VanDerWaalsContact O-N 3.09Å
32	T	77.7	Confident	74.6	Confident	113 Å²	113	136.1 Å²	136.1	69%	0.693	72%	0.716	S	S	*	*			trans	-82	87	177.3	59.7	0	0	0	0	111.4	D30	D30-T32 VanDerWaalsContact C-N 3.26Å; D30-T32 VanDerWaalsContact CG-OG1 3.26Å; D30-T32 PolarHBondContact O-N 3.49Å; D30-T32 WeakPolarHBondContact OD1-CB 3.38Å; D30-T32 PolarHBondContact OD1-N 3.09Å; D30-T32 PolarHBondContact OD1-OG1 3.49Å; D30-T32 PolarHBondContact OD2-OG1 2.61Å
33	F	81.2	Confident	74.4	Confident	168 Å²	168	136.1 Å²	136.1	74%	0.737	72%	0.719	S	S	*	*			trans	-100.4	146.3	166.2	66	-88.5	0	0	0	110.7	T31 T35	T31-F33 PolarHBondContact O-N 3Å; T31-F33 VanDerWaalsContact O-N 3.09Å; F33-T35 HydrophobicContact CD2-CG2 4.13Å; F33-T35 HydrophobicContact CE2-CG2 4.31Å
34	K	76.1	Confident	73.9	Confident	208 Å²	208	138.1 Å²	138.1	90%	0.904	72%	0.723	S	S	*	*			trans	-119.1	117.4	172.6	-70.9	-175.1	-179.7	-179.5	0	108.7
35	T	76.9	Confident	73.1	Confident	123 Å²	123	138.1 Å²	138.1	76%	0.755	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-94.7	126.8	171.5	39.3	0	0	0	0	109.8	F33	F33-T35 HydrophobicContact CD2-CG2 4.13Å; F33-T35 HydrophobicContact CE2-CG2 4.31Å
36	K	77.2	Confident	72	Confident	198 Å²	198	139.6 Å²	139.6	86%	0.861	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-102.2	131.6	168.2	-74	-174.1	176	-177.4	0	108.7
37	A	80.1	Confident	71	Confident	97 Å²	97	137.8 Å²	137.8	80%	0.802	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-68.4	134	173.4	0	0	0	0	0	110	Q39	A37-Q39 PolarHBondContact O-N 3.33Å
38	I	80	Confident	69.7	Low	154 Å²	154	135.5 Å²	135.5	79%	0.79	73%	0.73	S	S	*	*			trans	-76.2	111.7	173.7	-57.7	173.5	0	0	0	107.1	I40	I38-I40 HydrophobicContact CG2-CG1 4.1Å; I38-I40 PolarHBondContact O-N 3.33Å
39	Q	74.1	Confident	68.2	Low	187 Å²	187	141.3 Å²	141.3	87%	0.874	75%	0.751	S	S	*	*			trans	-80.8	105.2	168.9	-82.6	-172	-18.5	0	0	108.8	A37	A37-Q39 PolarHBondContact O-N 3.33Å
40	I	78.9	Confident	66.9	Low	127 Å²	127	139.3 Å²	139.3	65%	0.651	74%	0.735	S	S	*	*			trans	-81.7	125.2	170.6	-56	175	0	0	0	106.5	I38 E42	I38-I40 HydrophobicContact CG2-CG1 4.1Å; I38-I40 PolarHBondContact O-N 3.33Å; I40-E42 PolarHBondContact O-N 2.69Å
41	P	67	Low	65.5	Low	109 Å²	109	136.7 Å²	136.7	71%	0.708	72%	0.724	S	S	*	*			trans	-57.1	128.4	172.3	22.6	-30.1	0	0	0	108.4	Q43	P41-Q43 PolarHBondContact O-N 2.84Å
42	E	64.1	Low	63.9	Low	146 Å²	146	134.2 Å²	134.2	68%	0.682	71%	0.709	S	S	*	*			trans	-52.9	102.3	-174.8	-78.3	179.4	142	0	0	110.8	I40 L44 K45	I40-E42 PolarHBondContact O-N 2.69Å; E42-L44 PolarHBondContact O-N 3.26Å; E42-K45 WeakPolarHBondContact OE1-CE 3.32Å; E42-K45 IonicContact OE1-NZ 3.88Å; E42-K45 PolarHBondContact OE1-NZ 3.21Å
43	Q	60.5	Low	62.3	Low	175 Å²	175	130.7 Å²	130.7	82%	0.818	69%	0.685	S	S	*	*			trans	-74.5	106.4	164.5	-73.7	179.5	-37.7	0	0	106.3	P41 K45	P41-Q43 PolarHBondContact O-N 2.84Å; Q43-K45 PolarHBondContact O-N 3.39Å
44	L	57.4	Low	60.7	Low	134 Å²	134	130.7 Å²	130.7	70%	0.702	69%	0.692	S	S	*	*			trans	9.7	90.1	173.8	-64.2	167.8	0	0	0	114.4	E42	E42-L44 PolarHBondContact O-N 3.26Å
45	K	53.3	Low	59.7	Low	154 Å²	154	130.3 Å²	130.3	67%	0.67	69%	0.685	S	S	*	*			trans	-62.8	140.9	171.2	-76.9	176.3	174.9	163.5	0	110.1	E42 Q43 D47	E42-K45 WeakPolarHBondContact OE1-CE 3.32Å; E42-K45 IonicContact OE1-NZ 3.88Å; E42-K45 PolarHBondContact OE1-NZ 3.21Å; Q43-K45 PolarHBondContact O-N 3.39Å; K45-D47 PolarHBondContact O-N 2.98Å
46	E	50.1	Low	59	Low	158 Å²	158	130.7 Å²	130.7	74%	0.738	68%	0.676	S	S	*	*			trans	-68.8	91.3	167.8	-71	-173.1	149.3	0	0	109.4	G48 K56	E46-G48 PolarHBondContact O-N 3.23Å; E46-K56 IonicContact OE1-NZ 2.69Å; E46-K56 PolarHBondContact OE1-NZ 2.97Å
47	D	46.3	Very low	58.6	Low	114 Å²	114	123.2 Å²	123.2	61%	0.61	65%	0.646	S	S	*	*			trans	-85.2	103.9	174.2	-131.1	1.3	0	0	0	108.9	K45 M49	K45-D47 PolarHBondContact O-N 2.98Å; D47-M49 PolarHBondContact O-N 2.59Å
48	G	51.1	Low	58.6	Low	87 Å²	87	120.6 Å²	120.6	90%	0.897	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	11.6	-175.7	0	0	0	0	0	115.9	E46	E46-G48 PolarHBondContact O-N 3.23Å
49	M	47	Very low	58.9	Low	174 Å²	174	113.5 Å²	113.5	86%	0.857	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.4	-1.5	-171	-81.1	-86.5	-63.6	0	0	114.1	D47	D47-M49 PolarHBondContact O-N 2.59Å
50	L	49.6	Very low	59.4	Low	86 Å²	86	111.5 Å²	111.5	45%	0.45	57%	0.57	S	S	.	*	S	Bend	trans	-122.6	123.8	-178.7	-69.2	166.2	0	0	0	111.2	T52	L50-T52 PolarHBondContact O-N 2.94Å; L50-T52 PolarHBondContact O-OG1 2.83Å
51	S	47.8	Very low	59.8	Low	41 Å²	41	107.6 Å²	107.6	29%	0.287	55%	0.551	S	S	.	*			trans	-47.5	98.7	179	-72.8	0	0	0	0	112.2	L84 Y88	S51-L84 WeakPolarHBondContact O-CD1 3.35Å; S51-Y88 VanDerWaalsContact CB-CE2 3.46Å; S51-Y88 VanDerWaalsContact CB-CZ 3.47Å; S51-Y88 VanDerWaalsContact OG-CD1 3.26Å; S51-Y88 WeakPolarHBondContact OG-CD1 3.43Å; S51-Y88 WeakPolarHBondContact OG-CE1 3.45Å
52	T	44.8	Very low	60.9	Low	66 Å²	66	102.7 Å²	102.7	41%	0.405	52%	0.518	S	S	.	.			trans	-105.4	129.5	-175	26.4	0	0	0	0	110.2	L50 K56	L50-T52 PolarHBondContact O-N 2.94Å; L50-T52 PolarHBondContact O-OG1 2.83Å; T52-K56 HydrophobicContact CG2-CB 4.32Å
53	Q	44.5	Very low	62.2	Low	39 Å²	39	96.5 Å²	96.5	18%	0.182	49%	0.49	C	S	.	.			trans	-71.7	174.5	170.9	-131.8	-164.1	-21	0	0	110.8	R55 K56 G80 D83	Q53-R55 PolarHBondContact O-N 2.7Å; Q53-K56 PolarHBondContact O-N 2.91Å; Q53-G80 PolarHBondContact OE1-O 3.26Å; Q53-D83 PolarHBondContact NE2-OD2 3.19Å; Q53-D83 VanDerWaalsContact NE2-OD2 3.12Å
54	N	48.8	Very low	63.6	Low	167 Å²	167	91.6 Å²	91.6	89%	0.893	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-1	-178.8	-69.4	-16.9	0	0	0	117.3
55	R	54.1	Low	65.2	Low	201 Å²	201	87.6 Å²	87.6	76%	0.758	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	10.9	173.9	-75.9	-175.4	174.1	171.1	-0.9	114.9	Q53 L57	Q53-R55 PolarHBondContact O-N 2.7Å; R55-L57 VanDerWaalsContact C-N 3.3Å; R55-L57 PolarHBondContact O-N 3.05Å
56	K	62.1	Low	66.9	Low	131 Å²	131	80.4 Å²	80.4	57%	0.57	42%	0.421	S	S	*	.			trans	57.6	28.1	177.6	-56.5	-178.2	-179	175.8	0	116	E46 T52 Q53	E46-K56 IonicContact OE1-NZ 2.69Å; E46-K56 PolarHBondContact OE1-NZ 2.97Å; T52-K56 HydrophobicContact CG2-CB 4.32Å; Q53-K56 PolarHBondContact O-N 2.91Å
57	L	69.1	Low	68.7	Low	41 Å²	41	78.6 Å²	78.6	22%	0.215	41%	0.412	C	S	.	.			trans	-91.8	133.3	175.5	-66	173.3	0	0	0	110.9	R55 D61 L62	R55-L57 VanDerWaalsContact C-N 3.3Å; R55-L57 PolarHBondContact O-N 3.05Å; L57-D61 HydrophobicContact CB-CB 4.45Å; L57-D61 HydrophobicContact CD2-CB 4.05Å; L57-L62 HydrophobicContact CB-CD2 4.21Å; L57-L62 HydrophobicContact CB-CG 4.22Å; L57-L62 HydrophobicContact CD1-CD2 3.99Å
58	N	79.9	Confident	70.9	Confident	42 Å²	42	76.1 Å²	76.1	23%	0.225	40%	0.397	C	S	.	.			trans	-85.8	165	173.9	-170.5	5.4	0	0	0	110.6	K60 D61 L62	N58-K60 VanDerWaalsContact C-N 3.26Å; N58-K60 PolarHBondContact O-N 3.43Å; N58-D61 WeakPolarHBondContact CB-OD2 3.3Å; N58-D61 PolarHBondContact N-OD2 3.43Å; N58-D61 WeakPolarHBondContact O-CB 3.45Å; N58-D61 PolarHBondContact O-N 3.08Å; N58-L62 PolarHBondContact O-N 2.99Å
59	I	85.4	Confident	72.7	Confident	4 Å²	4	82 Å²	82	2%	0.021	39%	0.394	C	S	.	.	H	α-helix	trans	-55.2	-39.8	177.9	-171.8	163.6	0	0	0	112.4	D61 L62 L63 L81 L84 L85 V91 H95 I99	I59-D61 VanDerWaalsContact C-N 3.31Å; I59-D61 PolarHBondContact O-N 3.39Å; I59-L62 PolarHBondContact O-N 2.9Å; I59-L63 HydrophobicContact CG1-CD1 4.01Å; I59-L63 HydrophobicContact CG1-CG 4.23Å; I59-L63 WeakPolarHBondContact O-CB 3.42Å; I59-L63 VanDerWaalsContact O-CG 3.27Å; I59-L63 WeakPolarHBondContact O-CG 3.43Å; I59-L63 PolarHBondContact O-N 3.14Å; I59-L81 HydrophobicContact CD1-CD1 4.24Å; I59-L81 HydrophobicContact CG1-CD1 4.05Å; I59-L84 HydrophobicContact CB-CD2 4.05Å; I59-L85 HydrophobicContact CD1-CD2 4.47Å; I59-V91 HydrophobicContact CD1-CG1 3.47Å; I59-V91 VanDerWaalsContact CD1-CG1 3.47Å; I59-H95 HydrophobicContact CD1-CB 3.77Å; I59-I99 HydrophobicContact CD1-CD1 3.92Å; I59-I99 HydrophobicContact CD1-CG1 4.05Å
60	K	86.5	Confident	74.9	Confident	145 Å²	145	75.9 Å²	75.9	63%	0.63	37%	0.368	S	S	*	.	H	α-helix	trans	-63	-39.1	177.6	-68.5	-175.3	179.5	178.5	0	111.9	N58 S64	N58-K60 VanDerWaalsContact C-N 3.26Å; N58-K60 PolarHBondContact O-N 3.43Å; K60-S64 WeakPolarHBondContact O-CB 3.38Å; K60-S64 PolarHBondContact O-N 3.1Å
61	D	86.9	Confident	77	Confident	46 Å²	46	73.1 Å²	73.1	25%	0.246	36%	0.358	C	S	.	.	H	α-helix	trans	-67.3	-45.2	178.4	-52.7	-40.6	0	0	0	110.3	L57 N58 I59 S64 Q65	L57-D61 HydrophobicContact CB-CB 4.45Å; L57-D61 HydrophobicContact CD2-CB 4.05Å; N58-D61 WeakPolarHBondContact CB-OD2 3.3Å; N58-D61 PolarHBondContact N-OD2 3.43Å; N58-D61 WeakPolarHBondContact O-CB 3.45Å; N58-D61 PolarHBondContact O-N 3.08Å; I59-D61 VanDerWaalsContact C-N 3.31Å; I59-D61 PolarHBondContact O-N 3.39Å; D61-S64 PolarHBondContact O-N 3.25Å; D61-S64 PolarHBondContact O-OG 3.18Å; D61-Q65 VanDerWaalsContact O-CG 3.3Å; D61-Q65 WeakPolarHBondContact O-CG 3.45Å; D61-Q65 PolarHBondContact O-N 3.32Å
62	L	89.8	Confident	79.1	Confident	6 Å²	6	72.8 Å²	72.8	3%	0.031	36%	0.36	C	S	.	.	H	α-helix	trans	-61.6	-45.4	177.7	-68.3	170.6	0	0	0	111.9	L57 N58 I59 S64 Q65 M66 L81 L84	L57-L62 HydrophobicContact CB-CD2 4.21Å; L57-L62 HydrophobicContact CB-CG 4.22Å; L57-L62 HydrophobicContact CD1-CD2 3.99Å; N58-L62 PolarHBondContact O-N 2.99Å; I59-L62 PolarHBondContact O-N 2.9Å; L62-S64 VanDerWaalsContact C-N 3.34Å; L62-S64 PolarHBondContact O-N 3.37Å; L62-Q65 PolarHBondContact O-N 3.11Å; L62-M66 PolarHBondContact O-N 3.33Å; L62-L81 HydrophobicContact CD1-CB 4.48Å; L62-L84 HydrophobicContact CD1-CB 4.48Å; L62-L84 HydrophobicContact CD1-CD2 4Å
63	L	90.8	Very high	81.4	Confident	16 Å²	16	71.8 Å²	71.8	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-40.4	176.2	-67.2	174.9	0	0	0	111.4	I59 Q65 M66 L81 E102	I59-L63 HydrophobicContact CG1-CD1 4.01Å; I59-L63 HydrophobicContact CG1-CG 4.23Å; I59-L63 WeakPolarHBondContact O-CB 3.42Å; I59-L63 VanDerWaalsContact O-CG 3.27Å; I59-L63 WeakPolarHBondContact O-CG 3.43Å; I59-L63 PolarHBondContact O-N 3.14Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 3.26Å; L63-M66 HydrophobicContact CD2-SD 4.2Å; L63-M66 WeakPolarHBondContact O-CB 3.44Å; L63-M66 PolarHBondContact O-N 2.93Å; L63-L81 HydrophobicContact CD2-CD2 3.84Å; L63-E102 HydrophobicContact CB-CG 4.36Å; L63-E102 HydrophobicContact CD2-CB 3.92Å; L63-E102 HydrophobicContact CD2-CG 4Å
64	S	90.4	Very high	83.7	Confident	71 Å²	71	71.6 Å²	71.6	50%	0.497	35%	0.353	S	S	.	.	H	α-helix	trans	-65	-35.2	176.7	76.9	0	0	0	0	113	K60 D61 L62 M66 H67	K60-S64 WeakPolarHBondContact O-CB 3.38Å; K60-S64 PolarHBondContact O-N 3.1Å; D61-S64 PolarHBondContact O-N 3.25Å; D61-S64 PolarHBondContact O-OG 3.18Å; L62-S64 VanDerWaalsContact C-N 3.34Å; L62-S64 PolarHBondContact O-N 3.37Å; S64-M66 PolarHBondContact O-N 3.47Å; S64-H67 PolarHBondContact O-N 3.46Å
65	Q	90.8	Very high	85.8	Confident	51 Å²	51	67 Å²	67	24%	0.238	33%	0.326	C	S	.	.	H	α-helix	trans	-68.6	-18.2	179.7	-75.6	175.7	19.3	0	0	113.2	D61 L62 L63 H67 H68 V73 A77	D61-Q65 VanDerWaalsContact O-CG 3.3Å; D61-Q65 WeakPolarHBondContact O-CG 3.45Å; D61-Q65 PolarHBondContact O-N 3.32Å; L62-Q65 PolarHBondContact O-N 3.11Å; L63-Q65 VanDerWaalsContact C-N 3.33Å; L63-Q65 PolarHBondContact O-N 3.26Å; Q65-H67 PolarHBondContact O-N 3.27Å; Q65-H68 VanDerWaalsContact O-CB 3.23Å; Q65-H68 WeakPolarHBondContact O-CB 3.08Å; Q65-H68 PolarHBondContact O-N 3.05Å; Q65-H68 VanDerWaalsContact O-N 3.14Å; Q65-V73 HydrophobicContact CB-CG1 4.13Å; Q65-V73 HydrophobicContact CG-CG1 4.28Å; Q65-A77 HydrophobicContact CB-CB 3.69Å
66	M	89.3	Confident	87.6	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.015	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.9	174.3	-64	177.1	57.7	0	0	112.7	L62 L63 S64 K74 A77 L78 L81 E102 V103 V106	L62-M66 PolarHBondContact O-N 3.33Å; L63-M66 HydrophobicContact CD2-SD 4.2Å; L63-M66 WeakPolarHBondContact O-CB 3.44Å; L63-M66 PolarHBondContact O-N 2.93Å; S64-M66 PolarHBondContact O-N 3.47Å; M66-K74 VanDerWaalsContact O-CD 3.24Å; M66-K74 WeakPolarHBondContact O-CD 3.43Å; M66-K74 VanDerWaalsContact O-CE 3.3Å; M66-K74 WeakPolarHBondContact O-CE 3.26Å; M66-K74 WeakPolarHBondContact O-CG 3.27Å; M66-A77 HydrophobicContact CG-CB 4.15Å; M66-L78 HydrophobicContact CE-CD2 3.44Å; M66-L78 VanDerWaalsContact CE-CD2 3.44Å; M66-L78 HydrophobicContact CE-CG 4.21Å; M66-L78 HydrophobicContact SD-CD2 4.07Å; M66-L81 HydrophobicContact SD-CD2 4.4Å; M66-E102 HydrophobicContact CE-CB 4.01Å; M66-E102 WeakPolarHBondContact CE-O 3.39Å; M66-E102 HydrophobicContact SD-CB 4.11Å; M66-V103 HydrophobicContact CE-CG2 4.34Å; M66-V106 HydrophobicContact CB-CG2 4.46Å; M66-V106 HydrophobicContact CE-CB 4.37Å; M66-V106 HydrophobicContact CE-CG2 3.57Å
67	H	88.8	Confident	89.1	Confident	119 Å²	119	55.5 Å²	55.5	55%	0.551	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-4.5	174.7	-66.2	-67.5	0	0	0	114.2	S64 Q65 E102	S64-H67 PolarHBondContact O-N 3.46Å; Q65-H67 PolarHBondContact O-N 3.27Å; H67-E102 IonicContact CD2-OE2 3.3Å; H67-E102 IonicContact CE1-OE2 2.73Å; H67-E102 PolarHBondContact CE1-OE2 2.98Å; H67-E102 VanDerWaalsContact NE2-CD 3.28Å; H67-E102 IonicContact NE2-OE1 2.65Å; H67-E102 PolarHBondContact NE2-OE1 3.35Å; H67-E102 IonicContact NE2-OE2 2.59Å; H67-E102 PolarHBondContact NE2-OE2 3.25Å
68	H	90.8	Very high	90.3	Very high	63 Å²	63	53.7 Å²	53.7	29%	0.292	28%	0.276	S	S	.	.	S	Bend	trans	-67.7	140.5	-175	-171.6	-91.1	0	0	0	111.9	Q65 S70 V73 K74	Q65-H68 VanDerWaalsContact O-CB 3.23Å; Q65-H68 WeakPolarHBondContact O-CB 3.08Å; Q65-H68 PolarHBondContact O-N 3.05Å; Q65-H68 VanDerWaalsContact O-N 3.14Å; H68-S70 WeakPolarHBondContact ND1-CB 3.37Å; H68-S70 PolarHBondContact ND1-N 2.97Å; H68-S70 VanDerWaalsContact ND1-N 3.14Å; H68-S70 PolarHBondContact O-N 2.72Å; H68-S70 VanDerWaalsContact O-N 3.1Å; H68-V73 HydrophobicContact CB-CB 4.36Å; H68-V73 HydrophobicContact CB-CG1 3.95Å; H68-K74 WeakPolarHBondContact O-CE 2.7Å; H68-K74 WeakPolarHBondContact O-CG 3.23Å
69	Y	89.3	Confident	90.9	Very high	211 Å²	211	55 Å²	55	83%	0.827	28%	0.283	S	S	*	.	S	Bend	trans	-60.5	-26.4	-175.5	63.6	-90	0	0	0	114.7
70	S	94.2	Very high	91.2	Very high	45 Å²	45	55.3 Å²	55.3	32%	0.315	29%	0.287	S	S	.	.			trans	-81.3	120	178.9	175.8	0	0	0	0	112.5	H68 G72 V73 K74	H68-S70 WeakPolarHBondContact ND1-CB 3.37Å; H68-S70 PolarHBondContact ND1-N 2.97Å; H68-S70 VanDerWaalsContact ND1-N 3.14Å; H68-S70 PolarHBondContact O-N 2.72Å; H68-S70 VanDerWaalsContact O-N 3.1Å; S70-G72 VanDerWaalsContact C-N 3.31Å; S70-G72 PolarHBondContact O-N 3.29Å; S70-V73 PolarHBondContact O-N 3.28Å; S70-V73 VanDerWaalsContact O-N 3.11Å; S70-K74 PolarHBondContact O-N 2.65Å
71	A	92.1	Very high	91.4	Very high	28 Å²	28	48.4 Å²	48.4	23%	0.231	26%	0.257	C	S	.	.	H	α-helix	trans	-57.3	-40	177.7	0	0	0	0	0	113.1	V73 K74 Q75 D111 V114	A71-V73 VanDerWaalsContact C-N 3.3Å; A71-V73 PolarHBondContact O-N 3.29Å; A71-K74 PolarHBondContact O-N 3.3Å; A71-Q75 WeakPolarHBondContact O-CB 3.49Å; A71-Q75 PolarHBondContact O-N 3.12Å; A71-D111 HydrophobicContact CB-CB 3.69Å; A71-V114 HydrophobicContact CB-CG2 3.93Å; A71-V114 VanDerWaalsContact O-CG2 3.28Å; A71-V114 WeakPolarHBondContact O-CG2 3.37Å
72	G	92.6	Very high	91.7	Very high	33 Å²	33	49.4 Å²	49.4	34%	0.34	26%	0.259	S	S	.	.	H	α-helix	trans	-63.8	-34.4	178	0	0	0	0	0	113	S70 N76	S70-G72 VanDerWaalsContact C-N 3.31Å; S70-G72 PolarHBondContact O-N 3.29Å; G72-N76 WeakPolarHBondContact O-CB 3.41Å; G72-N76 VanDerWaalsContact O-CG 3.22Å; G72-N76 PolarHBondContact O-N 3.19Å; G72-N76 VanDerWaalsContact O-N 3.08Å; G72-N76 PolarHBondContact O-ND2 3.22Å
73	V	92.6	Very high	91.8	Very high	46 Å²	46	52.7 Å²	52.7	28%	0.279	28%	0.277	S	S	.	.	H	α-helix	trans	-68.7	-46.6	175	177.1	0	0	0	0	110.2	Q65 H68 S70 A71 Q75 N76 A77	Q65-V73 HydrophobicContact CB-CG1 4.13Å; Q65-V73 HydrophobicContact CG-CG1 4.28Å; H68-V73 HydrophobicContact CB-CB 4.36Å; H68-V73 HydrophobicContact CB-CG1 3.95Å; S70-V73 PolarHBondContact O-N 3.28Å; S70-V73 VanDerWaalsContact O-N 3.11Å; A71-V73 VanDerWaalsContact C-N 3.3Å; A71-V73 PolarHBondContact O-N 3.29Å; V73-Q75 PolarHBondContact O-N 3.14Å; V73-N76 PolarHBondContact O-N 3.42Å; V73-A77 WeakPolarHBondContact O-CB 3.34Å; V73-A77 PolarHBondContact O-N 2.99Å
74	K	93.8	Very high	91.7	Very high	34 Å²	34	52.1 Å²	52.1	15%	0.148	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-45.2	176.7	-61.1	-171.9	-177.4	-162.8	0	112.5	M66 H68 S70 A71 A77 L78 D109 V114	M66-K74 VanDerWaalsContact O-CD 3.24Å; M66-K74 WeakPolarHBondContact O-CD 3.43Å; M66-K74 VanDerWaalsContact O-CE 3.3Å; M66-K74 WeakPolarHBondContact O-CE 3.26Å; M66-K74 WeakPolarHBondContact O-CG 3.27Å; H68-K74 WeakPolarHBondContact O-CE 2.7Å; H68-K74 WeakPolarHBondContact O-CG 3.23Å; S70-K74 PolarHBondContact O-N 2.65Å; A71-K74 PolarHBondContact O-N 3.3Å; K74-A77 WeakPolarHBondContact O-CB 3.41Å; K74-A77 PolarHBondContact O-N 3.04Å; K74-L78 PolarHBondContact O-N 2.91Å; K74-D109 WeakPolarHBondContact CD-OD2 3.26Å; K74-D109 IonicContact NZ-OD2 3.99Å; K74-D109 PolarHBondContact NZ-OD2 3.43Å; K74-V114 HydrophobicContact CB-CG1 3.99Å; K74-V114 HydrophobicContact CB-CG2 3.95Å; K74-V114 HydrophobicContact CD-CG1 4.28Å
75	Q	93.4	Very high	91.7	Very high	71 Å²	71	48.8 Å²	48.8	33%	0.332	25%	0.25	S	S	.	.	H	α-helix	trans	-63.1	-44.6	179.5	-170.6	-178.1	6.7	0	0	111.4	A71 V73 A77 L78 L79 V114 A117	A71-Q75 WeakPolarHBondContact O-CB 3.49Å; A71-Q75 PolarHBondContact O-N 3.12Å; V73-Q75 PolarHBondContact O-N 3.14Å; Q75-A77 VanDerWaalsContact C-N 3.31Å; Q75-A77 PolarHBondContact O-N 3.37Å; Q75-L78 PolarHBondContact O-N 3.43Å; Q75-L79 HydrophobicContact CG-CD1 4.48Å; Q75-L79 WeakPolarHBondContact O-CG 3.43Å; Q75-L79 PolarHBondContact O-N 2.91Å; Q75-V114 HydrophobicContact CB-CG2 4.2Å; Q75-A117 HydrophobicContact CG-CB 3.97Å
76	N	91.5	Very high	91.7	Very high	91 Å²	91	49.1 Å²	49.1	49%	0.487	26%	0.259	S	S	.	.	H	α-helix	trans	-64.6	-35.5	175.6	-73.9	-33.8	0	0	0	112.2	G72 V73 L79 G80	G72-N76 WeakPolarHBondContact O-CB 3.41Å; G72-N76 VanDerWaalsContact O-CG 3.22Å; G72-N76 PolarHBondContact O-N 3.19Å; G72-N76 VanDerWaalsContact O-N 3.08Å; G72-N76 PolarHBondContact O-ND2 3.22Å; V73-N76 PolarHBondContact O-N 3.42Å; N76-L79 PolarHBondContact O-N 3.18Å; N76-G80 PolarHBondContact O-N 3.49Å
77	A	93.7	Very high	91.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-43.3	175.3	0	0	0	0	0	111.9	Q65 M66 V73 K74 Q75 G80 L81	Q65-A77 HydrophobicContact CB-CB 3.69Å; M66-A77 HydrophobicContact CG-CB 4.15Å; V73-A77 WeakPolarHBondContact O-CB 3.34Å; V73-A77 PolarHBondContact O-N 2.99Å; K74-A77 WeakPolarHBondContact O-CB 3.41Å; K74-A77 PolarHBondContact O-N 3.04Å; Q75-A77 VanDerWaalsContact C-N 3.31Å; Q75-A77 PolarHBondContact O-N 3.37Å; A77-G80 PolarHBondContact O-N 3.35Å; A77-L81 VanDerWaalsContact O-CB 3.28Å; A77-L81 WeakPolarHBondContact O-CB 3.38Å; A77-L81 PolarHBondContact O-N 3.03Å
78	L	94.2	Very high	91.6	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-43.1	175	-75.5	165.3	0	0	0	112.7	M66 K74 Q75 K82 V106 V114 A117 A118 L121	M66-L78 HydrophobicContact CE-CD2 3.44Å; M66-L78 VanDerWaalsContact CE-CD2 3.44Å; M66-L78 HydrophobicContact CE-CG 4.21Å; M66-L78 HydrophobicContact SD-CD2 4.07Å; K74-L78 PolarHBondContact O-N 2.91Å; Q75-L78 PolarHBondContact O-N 3.43Å; L78-K82 PolarHBondContact O-N 3.18Å; L78-K82 VanDerWaalsContact O-N 3.07Å; L78-V106 HydrophobicContact CD1-CG1 4.15Å; L78-V114 HydrophobicContact CD1-CG1 3.95Å; L78-V114 WeakPolarHBondContact CD1-O 3.3Å; L78-A117 HydrophobicContact CB-CB 4Å; L78-A117 HydrophobicContact CD1-CB 3.84Å; L78-A118 HydrophobicContact CD1-CB 4.14Å; L78-A118 HydrophobicContact CD2-CB 4.38Å; L78-L121 HydrophobicContact CD2-CD2 3.71Å
79	L	92.9	Very high	91.5	Very high	69 Å²	69	51.6 Å²	51.6	36%	0.361	27%	0.274	S	S	.	.	H	α-helix	trans	-67.6	-45.2	177.1	-67.7	174.4	0	0	0	111.5	Q75 N76 L81 K82 D83	Q75-L79 HydrophobicContact CG-CD1 4.48Å; Q75-L79 WeakPolarHBondContact O-CG 3.43Å; Q75-L79 PolarHBondContact O-N 2.91Å; N76-L79 PolarHBondContact O-N 3.18Å; L79-L81 VanDerWaalsContact C-N 3.31Å; L79-L81 PolarHBondContact O-N 3.45Å; L79-K82 WeakPolarHBondContact O-CB 3.28Å; L79-K82 PolarHBondContact O-N 3.07Å; L79-D83 PolarHBondContact O-N 3.42Å
80	G	90.2	Very high	91.3	Very high	11 Å²	11	47.8 Å²	47.8	11%	0.113	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-38.6	175.5	0	0	0	0	0	112.4	Q53 N76 A77 D83 L84	Q53-G80 PolarHBondContact OE1-O 3.26Å; N76-G80 PolarHBondContact O-N 3.49Å; A77-G80 PolarHBondContact O-N 3.35Å; G80-D83 PolarHBondContact O-N 2.85Å; G80-L84 WeakPolarHBondContact O-CB 3.37Å; G80-L84 PolarHBondContact O-N 3.06Å
81	L	92.5	Very high	91	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.2	-43.3	174.3	-176.7	58.9	0	0	0	111.2	I59 L62 L63 M66 A77 L79 D83 L84 L85 I99 L121	I59-L81 HydrophobicContact CD1-CD1 4.24Å; I59-L81 HydrophobicContact CG1-CD1 4.05Å; L62-L81 HydrophobicContact CD1-CB 4.48Å; L63-L81 HydrophobicContact CD2-CD2 3.84Å; M66-L81 HydrophobicContact SD-CD2 4.4Å; A77-L81 VanDerWaalsContact O-CB 3.28Å; A77-L81 WeakPolarHBondContact O-CB 3.38Å; A77-L81 PolarHBondContact O-N 3.03Å; L79-L81 VanDerWaalsContact C-N 3.31Å; L79-L81 PolarHBondContact O-N 3.45Å; L81-D83 VanDerWaalsContact C-N 3.35Å; L81-D83 PolarHBondContact O-N 3.46Å; L81-L84 PolarHBondContact O-N 3.33Å; L81-L85 HydrophobicContact CD1-CD1 3.97Å; L81-L85 HydrophobicContact CD1-CD2 4.44Å; L81-L85 HydrophobicContact CD1-CG 4.03Å; L81-L85 HydrophobicContact CG-CD1 3.98Å; L81-L85 HydrophobicContact CG-CG 4.42Å; L81-L85 WeakPolarHBondContact O-CB 3.19Å; L81-L85 WeakPolarHBondContact O-CG 3.45Å; L81-L85 PolarHBondContact O-N 3.24Å; L81-I99 HydrophobicContact CD2-CG2 4.49Å; L81-L121 HydrophobicContact CB-CD2 4.45Å; L81-L121 HydrophobicContact CD2-CD2 3.86Å; L81-L121 HydrophobicContact CG-CD2 4.26Å
82	K	92.4	Very high	90.9	Very high	68 Å²	68	45.5 Å²	45.5	30%	0.296	24%	0.243	S	C	.	.	H	α-helix	trans	-58.5	-46.5	175.2	-173.2	-176.9	171	-177.1	0	111.9	L78 L79 S86 L121 F124	L78-K82 PolarHBondContact O-N 3.18Å; L78-K82 VanDerWaalsContact O-N 3.07Å; L79-K82 WeakPolarHBondContact O-CB 3.28Å; L79-K82 PolarHBondContact O-N 3.07Å; K82-S86 WeakPolarHBondContact O-CB 3.34Å; K82-S86 PolarHBondContact O-N 2.9Å; K82-S86 PolarHBondContact O-OG 3.19Å; K82-L121 HydrophobicContact CB-CD1 3.81Å; K82-L121 HydrophobicContact CG-CD1 4.24Å; K82-F124 HydrophobicContact CD-CB 4.48Å; K82-F124 HydrophobicContact CG-CB 4.29Å; K82-F124 HydrophobicContact CG-CD1 4.17Å; K82-F124 HydrophobicContact CG-CG 4.06Å
83	D	90.9	Very high	90.6	Very high	75 Å²	75	48.9 Å²	48.9	40%	0.401	25%	0.253	S	S	.	.	H	α-helix	trans	-67.6	-42	-178.7	-67.6	-15.4	0	0	0	111.9	Q53 L79 G80 L81 L85 S86 Q87	Q53-D83 PolarHBondContact NE2-OD2 3.19Å; Q53-D83 VanDerWaalsContact NE2-OD2 3.12Å; L79-D83 PolarHBondContact O-N 3.42Å; G80-D83 PolarHBondContact O-N 2.85Å; L81-D83 VanDerWaalsContact C-N 3.35Å; L81-D83 PolarHBondContact O-N 3.46Å; D83-L85 PolarHBondContact O-N 2.83Å; D83-S86 WeakPolarHBondContact O-CB 3.28Å; D83-S86 PolarHBondContact O-N 3.44Å; D83-Q87 WeakPolarHBondContact O-CG 3.4Å; D83-Q87 PolarHBondContact O-N 3.22Å
84	L	89.6	Confident	90.4	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-48.8	175.9	-178.2	73	0	0	0	111.1	S51 I59 L62 G80 L81 S86 Q87 Y88	S51-L84 WeakPolarHBondContact O-CD1 3.35Å; I59-L84 HydrophobicContact CB-CD2 4.05Å; L62-L84 HydrophobicContact CD1-CB 4.48Å; L62-L84 HydrophobicContact CD1-CD2 4Å; G80-L84 WeakPolarHBondContact O-CB 3.37Å; G80-L84 PolarHBondContact O-N 3.06Å; L81-L84 PolarHBondContact O-N 3.33Å; L84-S86 PolarHBondContact O-N 3.02Å; L84-Q87 PolarHBondContact O-N 3.02Å; L84-Y88 HydrophobicContact CD1-CD2 4.03Å; L84-Y88 HydrophobicContact CD1-CE2 4.43Å; L84-Y88 PolarHBondContact O-N 3.46Å
85	L	90.8	Very high	90.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.4	-23.4	179.3	-62.3	176.9	0	0	0	112.7	I59 L81 D83 V91 I92 I99 F124 L125	I59-L85 HydrophobicContact CD1-CD2 4.47Å; L81-L85 HydrophobicContact CD1-CD1 3.97Å; L81-L85 HydrophobicContact CD1-CD2 4.44Å; L81-L85 HydrophobicContact CD1-CG 4.03Å; L81-L85 HydrophobicContact CG-CD1 3.98Å; L81-L85 HydrophobicContact CG-CG 4.42Å; L81-L85 WeakPolarHBondContact O-CB 3.19Å; L81-L85 WeakPolarHBondContact O-CG 3.45Å; L81-L85 PolarHBondContact O-N 3.24Å; D83-L85 PolarHBondContact O-N 2.83Å; L85-V91 HydrophobicContact CD2-CB 4Å; L85-V91 HydrophobicContact CD2-CG1 3.87Å; L85-I92 HydrophobicContact CB-CD1 4.41Å; L85-I92 HydrophobicContact CB-CG1 4.21Å; L85-I92 HydrophobicContact CD1-CG1 4.35Å; L85-I92 HydrophobicContact CD2-CG1 3.84Å; L85-I92 HydrophobicContact CG-CG1 4.34Å; L85-I99 HydrophobicContact CD1-CD1 4.15Å; L85-I99 HydrophobicContact CD1-CG2 4.45Å; L85-I99 HydrophobicContact CD2-CD1 4.02Å; L85-F124 HydrophobicContact CB-CE1 3.8Å; L85-F124 HydrophobicContact CB-CZ 4.4Å; L85-L125 HydrophobicContact CD1-CD2 3.7Å
86	S	90.9	Very high	90.1	Very high	59 Å²	59	49.1 Å²	49.1	41%	0.413	26%	0.264	S	S	.	.	H	α-helix	trans	-72.4	-37.5	172.6	-60.2	0	0	0	0	112	K82 D83 L84 F124	K82-S86 WeakPolarHBondContact O-CB 3.34Å; K82-S86 PolarHBondContact O-N 2.9Å; K82-S86 PolarHBondContact O-OG 3.19Å; D83-S86 WeakPolarHBondContact O-CB 3.28Å; D83-S86 PolarHBondContact O-N 3.44Å; L84-S86 PolarHBondContact O-N 3.02Å; S86-F124 VanDerWaalsContact OG-CE2 3.22Å; S86-F124 WeakPolarHBondContact OG-CE2 3.22Å; S86-F124 VanDerWaalsContact OG-CZ 3.24Å; S86-F124 WeakPolarHBondContact OG-CZ 3.41Å
87	Q	89.1	Confident	90.1	Very high	98 Å²	98	47.9 Å²	47.9	46%	0.458	26%	0.263	S	S	.	.	H	α-helix	trans	-77.6	-35.2	177.8	-67.3	173.2	23.1	0	0	112.1	D83 L84	D83-Q87 WeakPolarHBondContact O-CG 3.4Å; D83-Q87 PolarHBondContact O-N 3.22Å; L84-Q87 PolarHBondContact O-N 3.02Å
88	Y	86.6	Confident	90	Very high	70 Å²	70	50 Å²	50	28%	0.275	28%	0.277	S	S	.	.			trans	-130.3	77.7	-175.4	-54.9	-78.5	0	0	0	111.9	S51 L84 F90 V91	S51-Y88 VanDerWaalsContact CB-CE2 3.46Å; S51-Y88 VanDerWaalsContact CB-CZ 3.47Å; S51-Y88 VanDerWaalsContact OG-CD1 3.26Å; S51-Y88 WeakPolarHBondContact OG-CD1 3.43Å; S51-Y88 WeakPolarHBondContact OG-CE1 3.45Å; L84-Y88 HydrophobicContact CD1-CD2 4.03Å; L84-Y88 HydrophobicContact CD1-CE2 4.43Å; L84-Y88 PolarHBondContact O-N 3.46Å; Y88-F90 VanDerWaalsContact C-N 3.28Å; Y88-F90 AromaticContact CD1-CE1 3.83Å; Y88-F90 HydrophobicContact CD1-CE1 3.83Å; Y88-F90 HydrophobicContact CD1-CZ 4.27Å; Y88-F90 HydrophobicContact CG-CE1 4.25Å; Y88-F90 PolarHBondContact O-N 2.68Å; Y88-V91 WeakPolarHBondContact O-CB 3.3Å; Y88-V91 WeakPolarHBondContact O-CG2 3.24Å; Y88-V91 PolarHBondContact O-N 3.14Å
89	P	87.4	Confident	90	Very high	69 Å²	69	49.9 Å²	49.9	45%	0.448	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-29	-175.1	-26.3	35.9	0	0	0	115.1	V91 I92	P89-V91 PolarHBondContact O-N 3.04Å; P89-V91 VanDerWaalsContact O-N 3.14Å; P89-I92 VanDerWaalsContact O-CB 3.29Å; P89-I92 WeakPolarHBondContact O-CB 3.3Å; P89-I92 WeakPolarHBondContact O-CG1 3.28Å; P89-I92 PolarHBondContact O-N 3.19Å
90	F	86.6	Confident	90.1	Very high	131 Å²	131	46.8 Å²	46.8	58%	0.575	26%	0.26	S	S	*	.	H	α-helix	trans	-61.5	-22.3	179.1	67.7	-95.9	0	0	0	113.3	Y88 I92 D93 A94	Y88-F90 VanDerWaalsContact C-N 3.28Å; Y88-F90 AromaticContact CD1-CE1 3.83Å; Y88-F90 HydrophobicContact CD1-CE1 3.83Å; Y88-F90 HydrophobicContact CD1-CZ 4.27Å; Y88-F90 HydrophobicContact CG-CE1 4.25Å; Y88-F90 PolarHBondContact O-N 2.68Å; F90-I92 PolarHBondContact O-N 3.36Å; F90-D93 PolarHBondContact O-N 3.4Å; F90-A94 PolarHBondContact O-N 3.36Å
91	V	88.1	Confident	90.2	Very high	16 Å²	16	48.3 Å²	48.3	10%	0.097	27%	0.27	C	S	.	.	H	α-helix	trans	-65.8	-27.8	177.2	-179.6	0	0	0	0	110.9	I59 L85 Y88 P89 A94 H95	I59-V91 HydrophobicContact CD1-CG1 3.47Å; I59-V91 VanDerWaalsContact CD1-CG1 3.47Å; L85-V91 HydrophobicContact CD2-CB 4Å; L85-V91 HydrophobicContact CD2-CG1 3.87Å; Y88-V91 WeakPolarHBondContact O-CB 3.3Å; Y88-V91 WeakPolarHBondContact O-CG2 3.24Å; Y88-V91 PolarHBondContact O-N 3.14Å; P89-V91 PolarHBondContact O-N 3.04Å; P89-V91 VanDerWaalsContact O-N 3.14Å; V91-A94 PolarHBondContact O-N 3.04Å; V91-H95 PolarHBondContact O-N 3.38Å
92	I	88.6	Confident	90.2	Very high	9 Å²	9	50.5 Å²	50.5	5%	0.046	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-50	176.8	-60	173.2	0	0	0	109.7	L85 P89 F90 A94 H95 L96 K128 I129	L85-I92 HydrophobicContact CB-CD1 4.41Å; L85-I92 HydrophobicContact CB-CG1 4.21Å; L85-I92 HydrophobicContact CD1-CG1 4.35Å; L85-I92 HydrophobicContact CD2-CG1 3.84Å; L85-I92 HydrophobicContact CG-CG1 4.34Å; P89-I92 VanDerWaalsContact O-CB 3.29Å; P89-I92 WeakPolarHBondContact O-CB 3.3Å; P89-I92 WeakPolarHBondContact O-CG1 3.28Å; P89-I92 PolarHBondContact O-N 3.19Å; F90-I92 PolarHBondContact O-N 3.36Å; I92-A94 VanDerWaalsContact C-N 3.33Å; I92-A94 PolarHBondContact O-N 2.97Å; I92-H95 PolarHBondContact O-N 3.35Å; I92-L96 HydrophobicContact CG2-CD1 4.25Å; I92-L96 VanDerWaalsContact O-CA 3.23Å; I92-L96 WeakPolarHBondContact O-CA 3.5Å; I92-L96 VanDerWaalsContact O-CB 3.26Å; I92-L96 WeakPolarHBondContact O-CB 3.34Å; I92-L96 PolarHBondContact O-N 2.79Å; I92-K128 HydrophobicContact CD1-CB 4.03Å; I92-K128 HydrophobicContact CD1-CG 4.34Å; I92-I129 HydrophobicContact CG2-CD1 4.15Å; I92-I129 HydrophobicContact CG2-CG1 3.81Å
93	D	86.3	Confident	90.3	Very high	104 Å²	104	47.3 Å²	47.3	56%	0.556	27%	0.266	S	S	*	.	H	α-helix	trans	-65.9	-36.7	-178.4	-65.2	-48.5	0	0	0	111.8	F90 Q133	F90-D93 PolarHBondContact O-N 3.4Å; D93-Q133 PolarHBondContact OD1-NE2 3.18Å; D93-Q133 VanDerWaalsContact OD1-NE2 3.13Å
94	A	88.7	Confident	90.4	Very high	71 Å²	71	43.8 Å²	43.8	59%	0.587	25%	0.247	S	C	*	.	H	α-helix	trans	-70.6	-32.2	180	0	0	0	0	0	113.8	F90 V91 I92	F90-A94 PolarHBondContact O-N 3.36Å; V91-A94 PolarHBondContact O-N 3.04Å; I92-A94 VanDerWaalsContact C-N 3.33Å; I92-A94 PolarHBondContact O-N 2.97Å
95	H	90.4	Very high	90.6	Very high	67 Å²	67	45.3 Å²	45.3	31%	0.31	26%	0.26	S	S	.	.	H	α-helix	trans	-124.5	19.2	-171.8	-67.8	-68.8	0	0	0	114.1	I59 V91 I92 S97 S98 I99	I59-H95 HydrophobicContact CD1-CB 3.77Å; V91-H95 PolarHBondContact O-N 3.38Å; I92-H95 PolarHBondContact O-N 3.35Å; H95-S97 VanDerWaalsContact C-N 3.34Å; H95-S97 PolarHBondContact O-N 3.47Å; H95-S98 PolarHBondContact O-N 3.11Å; H95-S98 PolarHBondContact O-OG 3Å; H95-I99 HydrophobicContact CB-CD1 3.96Å; H95-I99 HydrophobicContact CB-CG1 4.25Å; H95-I99 VanDerWaalsContact O-CG1 3.3Å; H95-I99 WeakPolarHBondContact O-CG1 3.39Å; H95-I99 PolarHBondContact O-N 2.96Å
96	L	90.9	Very high	90.7	Very high	17 Å²	17	45.7 Å²	45.7	9%	0.089	26%	0.262	C	S	.	.	H	α-helix	trans	-52.3	-48	-172.4	-177.3	58.5	0	0	0	113.2	I92 S98 I99 I100 I129 Q133 F137	I92-L96 HydrophobicContact CG2-CD1 4.25Å; I92-L96 VanDerWaalsContact O-CA 3.23Å; I92-L96 WeakPolarHBondContact O-CA 3.5Å; I92-L96 VanDerWaalsContact O-CB 3.26Å; I92-L96 WeakPolarHBondContact O-CB 3.34Å; I92-L96 PolarHBondContact O-N 2.79Å; L96-S98 PolarHBondContact O-N 2.75Å; L96-I99 PolarHBondContact O-N 3.35Å; L96-I100 HydrophobicContact CD1-CD1 4.38Å; L96-I100 HydrophobicContact CD1-CG1 3.77Å; L96-I100 HydrophobicContact CG-CG1 4.39Å; L96-I100 WeakPolarHBondContact O-CB 3.29Å; L96-I100 WeakPolarHBondContact O-CG1 3.22Å; L96-I100 PolarHBondContact O-N 3.17Å; L96-I129 HydrophobicContact CD1-CD1 3.51Å; L96-I129 HydrophobicContact CD1-CG1 4.02Å; L96-I129 HydrophobicContact CD1-CG2 4.33Å; L96-I129 HydrophobicContact CD2-CG2 4.48Å; L96-Q133 HydrophobicContact CD2-CB 4.1Å; L96-F137 HydrophobicContact CD2-CD2 4.39Å; L96-F137 HydrophobicContact CD2-CE2 3.97Å; L96-F137 HydrophobicContact CG-CD2 4.35Å; L96-F137 HydrophobicContact CG-CE2 4.05Å
97	S	91.3	Very high	90.9	Very high	66 Å²	66	43.2 Å²	43.2	46%	0.462	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-48.9	-178.7	178.8	0	0	0	0	112.1	H95 S101 F137	H95-S97 VanDerWaalsContact C-N 3.34Å; H95-S97 PolarHBondContact O-N 3.47Å; S97-S101 WeakPolarHBondContact O-CB 3.44Å; S97-S101 PolarHBondContact O-N 3.24Å; S97-F137 VanDerWaalsContact CB-CE1 3.45Å; S97-F137 WeakPolarHBondContact OG-CE1 3.39Å
98	S	92	Very high	91.1	Very high	43 Å²	43	40.6 Å²	40.6	30%	0.301	24%	0.235	S	C	.	.	H	α-helix	trans	-66.5	-41.2	179	43.9	0	0	0	0	112.2	H95 L96 E102	H95-S98 PolarHBondContact O-N 3.11Å; H95-S98 PolarHBondContact O-OG 3Å; L96-S98 PolarHBondContact O-N 2.75Å; S98-E102 WeakPolarHBondContact O-CB 3.38Å; S98-E102 VanDerWaalsContact O-CG 3.28Å; S98-E102 WeakPolarHBondContact O-CG 3.5Å; S98-E102 PolarHBondContact O-N 3.23Å; S98-E102 VanDerWaalsContact O-N 3.11Å
99	I	93.9	Very high	91.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-50	179.1	-65.9	163.2	0	0	0	110.1	I59 L81 L85 H95 L96 S101 E102 V103 L125	I59-I99 HydrophobicContact CD1-CD1 3.92Å; I59-I99 HydrophobicContact CD1-CG1 4.05Å; L81-I99 HydrophobicContact CD2-CG2 4.49Å; L85-I99 HydrophobicContact CD1-CD1 4.15Å; L85-I99 HydrophobicContact CD1-CG2 4.45Å; L85-I99 HydrophobicContact CD2-CD1 4.02Å; H95-I99 HydrophobicContact CB-CD1 3.96Å; H95-I99 HydrophobicContact CB-CG1 4.25Å; H95-I99 VanDerWaalsContact O-CG1 3.3Å; H95-I99 WeakPolarHBondContact O-CG1 3.39Å; H95-I99 PolarHBondContact O-N 2.96Å; L96-I99 PolarHBondContact O-N 3.35Å; I99-S101 PolarHBondContact O-N 2.97Å; I99-E102 PolarHBondContact O-N 3.5Å; I99-V103 HydrophobicContact CG2-CG2 4.3Å; I99-V103 WeakPolarHBondContact O-CB 3.33Å; I99-V103 WeakPolarHBondContact O-CG2 3.42Å; I99-V103 PolarHBondContact O-N 3.47Å; I99-L125 HydrophobicContact CG2-CD1 3.7Å; I99-L125 HydrophobicContact CG2-CD2 4.18Å
100	I	93.7	Very high	91.7	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-39.7	-177.2	-66.3	-63.6	0	0	0	111.5	L96 A104 L125 I129 I134 F137 V141	L96-I100 HydrophobicContact CD1-CD1 4.38Å; L96-I100 HydrophobicContact CD1-CG1 3.77Å; L96-I100 HydrophobicContact CG-CG1 4.39Å; L96-I100 WeakPolarHBondContact O-CB 3.29Å; L96-I100 WeakPolarHBondContact O-CG1 3.22Å; L96-I100 PolarHBondContact O-N 3.17Å; I100-A104 WeakPolarHBondContact O-CB 3.24Å; I100-A104 PolarHBondContact O-N 3.23Å; I100-L125 HydrophobicContact CD1-CD1 4.42Å; I100-I129 HydrophobicContact CD1-CD1 4.17Å; I100-I134 HydrophobicContact CD1-CD1 4.09Å; I100-F137 HydrophobicContact CG2-CB 3.99Å; I100-V141 HydrophobicContact CG2-CG2 3.37Å
101	S	92.3	Very high	92.1	Very high	44 Å²	44	41 Å²	41	31%	0.308	24%	0.235	S	C	.	.	H	α-helix	trans	-60.7	-48.5	177.4	-173.6	0	0	0	0	111.9	S97 I99 A104 A105	S97-S101 WeakPolarHBondContact O-CB 3.44Å; S97-S101 PolarHBondContact O-N 3.24Å; I99-S101 PolarHBondContact O-N 2.97Å; S101-A104 PolarHBondContact O-N 3.42Å; S101-A105 PolarHBondContact O-N 3.08Å; S101-A105 VanDerWaalsContact O-N 3.12Å
102	E	93.6	Very high	92.3	Very high	45 Å²	45	44 Å²	44	21%	0.21	26%	0.256	C	S	.	.	H	α-helix	trans	-70.8	-40.7	-177.6	-65.9	-58.7	161.4	0	0	112.4	L63 M66 H67 S98 I99 A104 A105 V106	L63-E102 HydrophobicContact CB-CG 4.36Å; L63-E102 HydrophobicContact CD2-CB 3.92Å; L63-E102 HydrophobicContact CD2-CG 4Å; M66-E102 HydrophobicContact CE-CB 4.01Å; M66-E102 WeakPolarHBondContact CE-O 3.39Å; M66-E102 HydrophobicContact SD-CB 4.11Å; H67-E102 IonicContact CD2-OE2 3.3Å; H67-E102 IonicContact CE1-OE2 2.73Å; H67-E102 PolarHBondContact CE1-OE2 2.98Å; H67-E102 VanDerWaalsContact NE2-CD 3.28Å; H67-E102 IonicContact NE2-OE1 2.65Å; H67-E102 PolarHBondContact NE2-OE1 3.35Å; H67-E102 IonicContact NE2-OE2 2.59Å; H67-E102 PolarHBondContact NE2-OE2 3.25Å; S98-E102 WeakPolarHBondContact O-CB 3.38Å; S98-E102 VanDerWaalsContact O-CG 3.28Å; S98-E102 WeakPolarHBondContact O-CG 3.5Å; S98-E102 PolarHBondContact O-N 3.23Å; S98-E102 VanDerWaalsContact O-N 3.11Å; I99-E102 PolarHBondContact O-N 3.5Å; E102-A104 VanDerWaalsContact C-N 3.35Å; E102-A104 PolarHBondContact O-N 3.44Å; E102-A105 PolarHBondContact O-N 2.8Å; E102-V106 WeakPolarHBondContact O-CG2 3.21Å; E102-V106 PolarHBondContact O-N 3.46Å
103	V	93.9	Very high	92.5	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-40.8	176.7	173.9	0	0	0	0	111.3	M66 I99 V106 F107 L121 L125	M66-V103 HydrophobicContact CE-CG2 4.34Å; I99-V103 HydrophobicContact CG2-CG2 4.3Å; I99-V103 WeakPolarHBondContact O-CB 3.33Å; I99-V103 WeakPolarHBondContact O-CG2 3.42Å; I99-V103 PolarHBondContact O-N 3.47Å; V103-V106 PolarHBondContact O-N 2.95Å; V103-F107 HydrophobicContact CG1-CE1 4.1Å; V103-F107 WeakPolarHBondContact O-CD1 3.4Å; V103-F107 VanDerWaalsContact O-CE1 3.3Å; V103-F107 WeakPolarHBondContact O-CE1 3.32Å; V103-L121 HydrophobicContact CG2-CD2 3.51Å; V103-L121 HydrophobicContact CG2-CG 4.24Å; V103-L125 HydrophobicContact CG2-CD1 4.31Å
104	A	93.6	Very high	93	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-65.5	-37.7	178.1	0	0	0	0	0	112.7	I100 S101 E102 V106 F107 V141 H144	I100-A104 WeakPolarHBondContact O-CB 3.24Å; I100-A104 PolarHBondContact O-N 3.23Å; S101-A104 PolarHBondContact O-N 3.42Å; E102-A104 VanDerWaalsContact C-N 3.35Å; E102-A104 PolarHBondContact O-N 3.44Å; A104-V106 PolarHBondContact O-N 3.44Å; A104-F107 HydrophobicContact CB-CE2 4.1Å; A104-F107 HydrophobicContact CB-CZ 4.38Å; A104-F107 WeakPolarHBondContact O-CB 3.36Å; A104-F107 WeakPolarHBondContact O-CD2 3.26Å; A104-F107 VanDerWaalsContact O-CG 3.26Å; A104-F107 WeakPolarHBondContact O-CG 3.29Å; A104-F107 PolarHBondContact O-N 3.11Å; A104-V141 HydrophobicContact CB-CG2 4.46Å; A104-H144 HydrophobicContact CB-CB 4.12Å; A104-H144 WeakPolarHBondContact O-CB 3.23Å
105	A	93	Very high	93.3	Very high	35 Å²	35	37.1 Å²	37.1	29%	0.289	21%	0.214	S	C	.	.	H	α-helix	trans	-60.5	-30.1	178	0	0	0	0	0	113	S101 E102 F107 T108	S101-A105 PolarHBondContact O-N 3.08Å; S101-A105 VanDerWaalsContact O-N 3.12Å; E102-A105 PolarHBondContact O-N 2.8Å; A105-F107 VanDerWaalsContact C-N 3.31Å; A105-F107 PolarHBondContact O-N 3.17Å; A105-T108 PolarHBondContact O-OG1 2.9Å
106	V	94.3	Very high	93.5	Very high	8 Å²	8	35.1 Å²	35.1	5%	0.048	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-83.3	-4.5	-175.9	-178.8	0	0	0	0	113.1	M66 L78 E102 V103 A104 T108 D109 V114 A118	M66-V106 HydrophobicContact CB-CG2 4.46Å; M66-V106 HydrophobicContact CE-CB 4.37Å; M66-V106 HydrophobicContact CE-CG2 3.57Å; L78-V106 HydrophobicContact CD1-CG1 4.15Å; E102-V106 WeakPolarHBondContact O-CG2 3.21Å; E102-V106 PolarHBondContact O-N 3.46Å; V103-V106 PolarHBondContact O-N 2.95Å; A104-V106 PolarHBondContact O-N 3.44Å; V106-T108 PolarHBondContact O-N 3.08Å; V106-D109 HydrophobicContact CG1-CB 3.99Å; V106-D109 WeakPolarHBondContact O-CB 3.38Å; V106-D109 PolarHBondContact O-N 3.41Å; V106-D109 VanDerWaalsContact O-N 3.11Å; V106-V114 HydrophobicContact CG1-CG1 3.31Å; V106-A118 HydrophobicContact CB-CB 4.46Å; V106-A118 HydrophobicContact CG1-CB 4.15Å
107	F	94.4	Very high	93.7	Very high	8 Å²	8	34.7 Å²	34.7	4%	0.035	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-60.1	-26.9	174.7	-63.2	-13.6	0	0	0	113.3	V103 A104 A105 R115 L122 V141 H144 A148 V163	V103-F107 HydrophobicContact CG1-CE1 4.1Å; V103-F107 WeakPolarHBondContact O-CD1 3.4Å; V103-F107 VanDerWaalsContact O-CE1 3.3Å; V103-F107 WeakPolarHBondContact O-CE1 3.32Å; A104-F107 HydrophobicContact CB-CE2 4.1Å; A104-F107 HydrophobicContact CB-CZ 4.38Å; A104-F107 WeakPolarHBondContact O-CB 3.36Å; A104-F107 WeakPolarHBondContact O-CD2 3.26Å; A104-F107 VanDerWaalsContact O-CG 3.26Å; A104-F107 WeakPolarHBondContact O-CG 3.29Å; A104-F107 PolarHBondContact O-N 3.11Å; A105-F107 VanDerWaalsContact C-N 3.31Å; A105-F107 PolarHBondContact O-N 3.17Å; F107-R115 WeakPolarHBondContact O-CD 3.2Å; F107-L122 HydrophobicContact CE1-CD2 4.3Å; F107-L122 HydrophobicContact CZ-CD1 4.49Å; F107-L122 HydrophobicContact CZ-CD2 3.88Å; F107-V141 HydrophobicContact CE2-CG1 4.19Å; F107-H144 HydrophobicContact CD2-CB 4.02Å; F107-A148 HydrophobicContact CB-CB 4.41Å; F107-V163 HydrophobicContact CD1-CG2 4Å; F107-V163 HydrophobicContact CD2-CG1 3.94Å; F107-V163 HydrophobicContact CD2-CG2 4.47Å; F107-V163 HydrophobicContact CE1-CG1 4.27Å; F107-V163 HydrophobicContact CE1-CG2 4.17Å; F107-V163 HydrophobicContact CE2-CG1 3.56Å; F107-V163 HydrophobicContact CG-CG1 4.44Å; F107-V163 HydrophobicContact CG-CG2 4.17Å; F107-V163 HydrophobicContact CZ-CG1 3.75Å; F107-V163 HydrophobicContact CZ-CG2 4.49Å
108	T	94.3	Very high	93.9	Very high	42 Å²	42	31.6 Å²	31.6	26%	0.258	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-103.5	16.1	179.3	55.4	0	0	0	0	113.2	A105 V106 A148 I156	A105-T108 PolarHBondContact O-OG1 2.9Å; V106-T108 PolarHBondContact O-N 3.08Å; T108-A148 HydrophobicContact CG2-CB 3.79Å; T108-I156 HydrophobicContact CG2-CG2 4.45Å
109	D	94.8	Very high	94.1	Very high	22 Å²	22	30 Å²	30	12%	0.118	18%	0.177	C	C	.	.			trans	-61.9	147.1	178.3	-162.7	-78	0	0	0	111.5	K74 V106 D111 V114 R115	K74-D109 WeakPolarHBondContact CD-OD2 3.26Å; K74-D109 IonicContact NZ-OD2 3.99Å; K74-D109 PolarHBondContact NZ-OD2 3.43Å; V106-D109 HydrophobicContact CG1-CB 3.99Å; V106-D109 WeakPolarHBondContact O-CB 3.38Å; V106-D109 PolarHBondContact O-N 3.41Å; V106-D109 VanDerWaalsContact O-N 3.11Å; D109-D111 VanDerWaalsContact C-N 3.3Å; D109-D111 PolarHBondContact O-N 2.98Å; D109-D111 PolarHBondContact OD1-N 3.47Å; D109-V114 HydrophobicContact CB-CB 4.42Å; D109-V114 HydrophobicContact CB-CG1 4.01Å; D109-R115 HydrophobicContact CB-CG 4.2Å; D109-R115 VanDerWaalsContact O-CD 3.32Å; D109-R115 WeakPolarHBondContact O-CD 3.39Å; D109-R115 PolarHBondContact O-NH1 3.47Å
110	K	92	Very high	94.1	Very high	198 Å²	198	34.8 Å²	34.8	86%	0.861	20%	0.2	S	C	*	.	S	Bend	trans	-66.8	-34.1	-177.4	-63.2	179.7	-178.8	178.2	0	111.7	R115	K110-R115 PolarHBondContact O-NH1 3.49Å; K110-R115 VanDerWaalsContact O-NH1 3.08Å
111	D	94.4	Very high	94.2	Very high	60 Å²	60	34.7 Å²	34.7	32%	0.321	20%	0.199	S	C	.	.			trans	-87	131.7	-176.3	-173.7	-91.3	0	0	0	112.7	A71 D109 G113 V114 R115	A71-D111 HydrophobicContact CB-CB 3.69Å; D109-D111 VanDerWaalsContact C-N 3.3Å; D109-D111 PolarHBondContact O-N 2.98Å; D109-D111 PolarHBondContact OD1-N 3.47Å; D111-G113 VanDerWaalsContact OD1-CA 3.29Å; D111-G113 WeakPolarHBondContact OD1-CA 3.4Å; D111-G113 PolarHBondContact OD1-N 3.48Å; D111-V114 HydrophobicContact CB-CB 4.24Å; D111-V114 HydrophobicContact CB-CG2 3.91Å; D111-V114 PolarHBondContact OD1-N 3.24Å; D111-V114 VanDerWaalsContact OD1-N 3.08Å; D111-R115 WeakPolarHBondContact O-CG 3.43Å; D111-R115 PolarHBondContact O-N 3.24Å; D111-R115 PolarHBondContact O-NH1 2.98Å
112	S	92.3	Very high	94.3	Very high	78 Å²	78	32.9 Å²	32.9	55%	0.545	19%	0.186	S	C	.	.	H	α-helix	trans	-70	-31.2	-179	54.5	0	0	0	0	113.8	G116	S112-G116 PolarHBondContact O-N 3.12Å
113	G	93.3	Very high	94.4	Very high	24 Å²	24	35.4 Å²	35.4	25%	0.247	20%	0.198	C	C	.	.	H	α-helix	trans	-67.9	-39.8	178	0	0	0	0	0	111.7	D111 G116 A117	D111-G113 VanDerWaalsContact OD1-CA 3.29Å; D111-G113 WeakPolarHBondContact OD1-CA 3.4Å; D111-G113 PolarHBondContact OD1-N 3.48Å; G113-G116 PolarHBondContact O-N 3.44Å; G113-A117 PolarHBondContact O-N 3.13Å
114	V	95.4	Very high	94.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-49.1	174.2	178.8	0	0	0	0	111	A71 K74 Q75 L78 V106 D109 D111 G116 A117 A118	A71-V114 HydrophobicContact CB-CG2 3.93Å; A71-V114 VanDerWaalsContact O-CG2 3.28Å; A71-V114 WeakPolarHBondContact O-CG2 3.37Å; K74-V114 HydrophobicContact CB-CG1 3.99Å; K74-V114 HydrophobicContact CB-CG2 3.95Å; K74-V114 HydrophobicContact CD-CG1 4.28Å; Q75-V114 HydrophobicContact CB-CG2 4.2Å; L78-V114 HydrophobicContact CD1-CG1 3.95Å; L78-V114 WeakPolarHBondContact CD1-O 3.3Å; V106-V114 HydrophobicContact CG1-CG1 3.31Å; D109-V114 HydrophobicContact CB-CB 4.42Å; D109-V114 HydrophobicContact CB-CG1 4.01Å; D111-V114 HydrophobicContact CB-CB 4.24Å; D111-V114 HydrophobicContact CB-CG2 3.91Å; D111-V114 PolarHBondContact OD1-N 3.24Å; D111-V114 VanDerWaalsContact OD1-N 3.08Å; V114-G116 VanDerWaalsContact C-N 3.34Å; V114-G116 PolarHBondContact O-N 3.44Å; V114-A117 PolarHBondContact O-N 2.96Å; V114-A118 PolarHBondContact O-N 3.47Å
115	R	95.4	Very high	94.5	Very high	16 Å²	16	36.8 Å²	36.8	6%	0.06	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-42.6	175.8	-66.2	-167.2	-54.5	-86.5	0.7	112.4	F107 D109 K110 D111 A117 A118 V119 G155 D159	F107-R115 WeakPolarHBondContact O-CD 3.2Å; D109-R115 HydrophobicContact CB-CG 4.2Å; D109-R115 VanDerWaalsContact O-CD 3.32Å; D109-R115 WeakPolarHBondContact O-CD 3.39Å; D109-R115 PolarHBondContact O-NH1 3.47Å; K110-R115 PolarHBondContact O-NH1 3.49Å; K110-R115 VanDerWaalsContact O-NH1 3.08Å; D111-R115 WeakPolarHBondContact O-CG 3.43Å; D111-R115 PolarHBondContact O-N 3.24Å; D111-R115 PolarHBondContact O-NH1 2.98Å; R115-A117 PolarHBondContact O-N 3.05Å; R115-A118 WeakPolarHBondContact O-CB 3.33Å; R115-A118 PolarHBondContact O-N 3.32Å; R115-A118 VanDerWaalsContact O-N 3.17Å; R115-V119 WeakPolarHBondContact O-CG2 3.47Å; R115-V119 PolarHBondContact O-N 3.33Å; R115-G155 PolarHBondContact NH2-O 3.37Å; R115-D159 HydrophobicContact CB-CB 4.48Å; R115-D159 IonicContact CZ-OD2 2.84Å; R115-D159 VanDerWaalsContact CZ-OD2 3.24Å; R115-D159 IonicContact NE-OD2 2.74Å; R115-D159 PolarHBondContact NE-OD2 2.7Å; R115-D159 IonicContact NH2-OD2 2.71Å; R115-D159 PolarHBondContact NH2-OD2 3.48Å
116	G	94.6	Very high	94.5	Very high	25 Å²	25	35.2 Å²	35.2	26%	0.258	19%	0.19	S	C	.	.	H	α-helix	trans	-60	-42.9	175.8	0	0	0	0	0	112.9	S112 G113 V114 A118 V119 H120	S112-G116 PolarHBondContact O-N 3.12Å; G113-G116 PolarHBondContact O-N 3.44Å; V114-G116 VanDerWaalsContact C-N 3.34Å; V114-G116 PolarHBondContact O-N 3.44Å; G116-A118 VanDerWaalsContact C-N 3.34Å; G116-A118 PolarHBondContact O-N 3.14Å; G116-V119 PolarHBondContact O-N 3.47Å; G116-H120 PolarHBondContact O-N 3.39Å; G116-H120 VanDerWaalsContact O-N 3.14Å
117	A	95.1	Very high	94.4	Very high	7 Å²	7	37.5 Å²	37.5	6%	0.058	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-37.4	174.2	0	0	0	0	0	112.3	Q75 L78 G113 V114 R115 H120 L121	Q75-A117 HydrophobicContact CG-CB 3.97Å; L78-A117 HydrophobicContact CB-CB 4Å; L78-A117 HydrophobicContact CD1-CB 3.84Å; G113-A117 PolarHBondContact O-N 3.13Å; V114-A117 PolarHBondContact O-N 2.96Å; R115-A117 PolarHBondContact O-N 3.05Å; A117-H120 PolarHBondContact O-N 3.36Å; A117-L121 PolarHBondContact O-N 3.17Å
118	A	95.8	Very high	94.2	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-64.7	-41.5	176.3	0	0	0	0	0	112.1	L78 V106 V114 R115 G116 L121 L122	L78-A118 HydrophobicContact CD1-CB 4.14Å; L78-A118 HydrophobicContact CD2-CB 4.38Å; V106-A118 HydrophobicContact CB-CB 4.46Å; V106-A118 HydrophobicContact CG1-CB 4.15Å; V114-A118 PolarHBondContact O-N 3.47Å; R115-A118 WeakPolarHBondContact O-CB 3.33Å; R115-A118 PolarHBondContact O-N 3.32Å; R115-A118 VanDerWaalsContact O-N 3.17Å; G116-A118 VanDerWaalsContact C-N 3.34Å; G116-A118 PolarHBondContact O-N 3.14Å; A118-L121 PolarHBondContact O-N 2.99Å; A118-L122 WeakPolarHBondContact O-CB 3.45Å; A118-L122 PolarHBondContact O-N 2.85Å
119	V	95.4	Very high	94.1	Very high	9 Å²	9	41.2 Å²	41.2	6%	0.055	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-45.3	174.1	173.1	0	0	0	0	111.2	R115 G116 L121 L122 Q123 K162 V163 V166	R115-V119 WeakPolarHBondContact O-CG2 3.47Å; R115-V119 PolarHBondContact O-N 3.33Å; G116-V119 PolarHBondContact O-N 3.47Å; V119-L121 VanDerWaalsContact C-N 3.35Å; V119-L121 PolarHBondContact O-N 2.77Å; V119-L122 PolarHBondContact O-N 3.37Å; V119-Q123 WeakPolarHBondContact O-CG 3.45Å; V119-Q123 PolarHBondContact O-N 2.75Å; V119-K162 HydrophobicContact CG1-CB 4.1Å; V119-K162 HydrophobicContact CG2-CB 4.26Å; V119-V163 HydrophobicContact CG2-CG2 3.75Å; V119-V166 HydrophobicContact CG1-CG2 4.49Å
120	H	95	Very high	93.8	Very high	102 Å²	102	47.8 Å²	47.8	47%	0.472	24%	0.243	S	C	.	.	H	α-helix	trans	-64.4	-37.7	177.7	-70.4	160.3	0	0	0	113	G116 A117 F124	G116-H120 PolarHBondContact O-N 3.39Å; G116-H120 VanDerWaalsContact O-N 3.14Å; A117-H120 PolarHBondContact O-N 3.36Å; H120-F124 PolarHBondContact O-N 2.94Å
121	L	95	Very high	93.5	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-42.6	174.4	176.6	59.5	0	0	0	110.9	L78 L81 K82 V103 A117 A118 V119 Q123 F124 L125	L78-L121 HydrophobicContact CD2-CD2 3.71Å; L81-L121 HydrophobicContact CB-CD2 4.45Å; L81-L121 HydrophobicContact CD2-CD2 3.86Å; L81-L121 HydrophobicContact CG-CD2 4.26Å; K82-L121 HydrophobicContact CB-CD1 3.81Å; K82-L121 HydrophobicContact CG-CD1 4.24Å; V103-L121 HydrophobicContact CG2-CD2 3.51Å; V103-L121 HydrophobicContact CG2-CG 4.24Å; A117-L121 PolarHBondContact O-N 3.17Å; A118-L121 PolarHBondContact O-N 2.99Å; V119-L121 VanDerWaalsContact C-N 3.35Å; V119-L121 PolarHBondContact O-N 2.77Å; L121-Q123 VanDerWaalsContact C-N 3.34Å; L121-Q123 PolarHBondContact O-N 2.92Å; L121-F124 HydrophobicContact CD1-CD1 4.29Å; L121-F124 WeakPolarHBondContact O-CB 3.43Å; L121-F124 PolarHBondContact O-N 2.65Å; L121-L125 HydrophobicContact CD1-CD1 4.16Å; L121-L125 HydrophobicContact CD1-CG 4.03Å; L121-L125 HydrophobicContact CG-CD1 3.95Å; L121-L125 HydrophobicContact CG-CG 4.29Å; L121-L125 WeakPolarHBondContact O-CB 3.33Å; L121-L125 WeakPolarHBondContact O-CG 3.33Å; L121-L125 PolarHBondContact O-N 3.34Å
122	L	95.5	Very high	93.2	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-42.8	175.9	-177	67.9	0	0	0	111.8	F107 A118 V119 F124 L125 A126 V163 V166 L167	F107-L122 HydrophobicContact CE1-CD2 4.3Å; F107-L122 HydrophobicContact CZ-CD1 4.49Å; F107-L122 HydrophobicContact CZ-CD2 3.88Å; A118-L122 WeakPolarHBondContact O-CB 3.45Å; A118-L122 PolarHBondContact O-N 2.85Å; V119-L122 PolarHBondContact O-N 3.37Å; L122-F124 VanDerWaalsContact C-N 3.32Å; L122-F124 PolarHBondContact O-N 3.16Å; L122-L125 PolarHBondContact O-N 2.86Å; L122-A126 WeakPolarHBondContact O-CB 3.47Å; L122-A126 PolarHBondContact O-N 3.45Å; L122-V163 HydrophobicContact CD2-CG1 3.78Å; L122-V166 HydrophobicContact CD2-CB 4.21Å; L122-V166 HydrophobicContact CD2-CG1 4.16Å; L122-V166 HydrophobicContact CG-CG1 3.99Å; L122-L167 HydrophobicContact CD2-CD2 4.35Å
123	Q	95.2	Very high	92.9	Very high	98 Å²	98	42.2 Å²	42.2	46%	0.458	22%	0.216	S	C	.	.	H	α-helix	trans	-58.1	-44.6	174.3	-76.1	173	-11.5	0	0	112	V119 L121 S127 V166	V119-Q123 WeakPolarHBondContact O-CG 3.45Å; V119-Q123 PolarHBondContact O-N 2.75Å; L121-Q123 VanDerWaalsContact C-N 3.34Å; L121-Q123 PolarHBondContact O-N 2.92Å; Q123-S127 PolarHBondContact O-N 3.18Å; Q123-V166 HydrophobicContact CG-CB 4.39Å; Q123-V166 HydrophobicContact CG-CG1 4.06Å; Q123-V166 HydrophobicContact CG-CG2 3.36Å
124	F	95.2	Very high	92.7	Very high	31 Å²	31	41.2 Å²	41.2	14%	0.136	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-50.4	176.3	169.9	-96.3	0	0	0	111.5	K82 L85 S86 H120 L121 L122 A126 S127 K128	K82-F124 HydrophobicContact CD-CB 4.48Å; K82-F124 HydrophobicContact CG-CB 4.29Å; K82-F124 HydrophobicContact CG-CD1 4.17Å; K82-F124 HydrophobicContact CG-CG 4.06Å; L85-F124 HydrophobicContact CB-CE1 3.8Å; L85-F124 HydrophobicContact CB-CZ 4.4Å; S86-F124 VanDerWaalsContact OG-CE2 3.22Å; S86-F124 WeakPolarHBondContact OG-CE2 3.22Å; S86-F124 VanDerWaalsContact OG-CZ 3.24Å; S86-F124 WeakPolarHBondContact OG-CZ 3.41Å; H120-F124 PolarHBondContact O-N 2.94Å; L121-F124 HydrophobicContact CD1-CD1 4.29Å; L121-F124 WeakPolarHBondContact O-CB 3.43Å; L121-F124 PolarHBondContact O-N 2.65Å; L122-F124 VanDerWaalsContact C-N 3.32Å; L122-F124 PolarHBondContact O-N 3.16Å; F124-A126 PolarHBondContact O-N 3.44Å; F124-S127 WeakPolarHBondContact O-CB 3.48Å; F124-S127 PolarHBondContact O-N 2.83Å; F124-S127 VanDerWaalsContact O-N 3.16Å; F124-S127 PolarHBondContact O-OG 2.94Å; F124-K128 HydrophobicContact CZ-CG 4.4Å
125	L	94.1	Very high	92.3	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-59.7	-44.7	179.2	-72.3	174.9	0	0	0	111.8	L85 I99 I100 V103 L121 L122 S127 K128 I129	L85-L125 HydrophobicContact CD1-CD2 3.7Å; I99-L125 HydrophobicContact CG2-CD1 3.7Å; I99-L125 HydrophobicContact CG2-CD2 4.18Å; I100-L125 HydrophobicContact CD1-CD1 4.42Å; V103-L125 HydrophobicContact CG2-CD1 4.31Å; L121-L125 HydrophobicContact CD1-CD1 4.16Å; L121-L125 HydrophobicContact CD1-CG 4.03Å; L121-L125 HydrophobicContact CG-CD1 3.95Å; L121-L125 HydrophobicContact CG-CG 4.29Å; L121-L125 WeakPolarHBondContact O-CB 3.33Å; L121-L125 WeakPolarHBondContact O-CG 3.33Å; L121-L125 PolarHBondContact O-N 3.34Å; L122-L125 PolarHBondContact O-N 2.86Å; L125-S127 PolarHBondContact O-N 3.43Å; L125-K128 PolarHBondContact O-N 3.28Å; L125-I129 HydrophobicContact CB-CD1 3.91Å; L125-I129 HydrophobicContact CD2-CD1 4.29Å; L125-I129 WeakPolarHBondContact O-CG1 3.4Å; L125-I129 PolarHBondContact O-N 2.86Å
126	A	92.1	Very high	92	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.017	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-21.8	-179.4	0	0	0	0	0	113.3	L122 F124 K128 V166 R170 Y171	L122-A126 WeakPolarHBondContact O-CB 3.47Å; L122-A126 PolarHBondContact O-N 3.45Å; F124-A126 PolarHBondContact O-N 3.44Å; A126-K128 VanDerWaalsContact C-N 3.3Å; A126-V166 HydrophobicContact CB-CG1 4.04Å; A126-R170 HydrophobicContact CB-CB 3.95Å; A126-R170 HydrophobicContact CB-CG 3.75Å; A126-R170 VanDerWaalsContact O-CZ 3.29Å; A126-R170 PolarHBondContact O-NE 2.92Å; A126-R170 PolarHBondContact O-NH2 3.47Å; A126-Y171 WeakPolarHBondContact CA-OH 3.41Å; A126-Y171 HydrophobicContact CB-CE2 3.75Å; A126-Y171 PolarHBondContact O-OH 3.41Å
127	S	92.8	Very high	91.7	Very high	56 Å²	56	47.9 Å²	47.9	39%	0.392	24%	0.243	S	C	.	.	H	α-helix	trans	-73.6	-20.5	171.5	82	0	0	0	0	113.8	Q123 F124 L125	Q123-S127 PolarHBondContact O-N 3.18Å; F124-S127 WeakPolarHBondContact O-CB 3.48Å; F124-S127 PolarHBondContact O-N 2.83Å; F124-S127 VanDerWaalsContact O-N 3.16Å; F124-S127 PolarHBondContact O-OG 2.94Å; L125-S127 PolarHBondContact O-N 3.43Å
128	K	90.9	Very high	91.4	Very high	121 Å²	121	47.9 Å²	47.9	53%	0.526	24%	0.241	S	C	.	.	H	α-helix	trans	-109.5	-26	-173.1	-59.1	-59.8	-177.9	176.9	0	113.9	I92 F124 L125 A126	I92-K128 HydrophobicContact CD1-CB 4.03Å; I92-K128 HydrophobicContact CD1-CG 4.34Å; F124-K128 HydrophobicContact CZ-CG 4.4Å; L125-K128 PolarHBondContact O-N 3.28Å; A126-K128 VanDerWaalsContact C-N 3.3Å
129	I	91.8	Very high	91.1	Very high	7 Å²	7	50.3 Å²	50.3	4%	0.036	26%	0.257	C	S	.	.	S	Bend	trans	-98.9	128.6	-175.7	-58.4	158.1	0	0	0	110.2	I92 L96 I100 L125 Q133 I134 Y171	I92-I129 HydrophobicContact CG2-CD1 4.15Å; I92-I129 HydrophobicContact CG2-CG1 3.81Å; L96-I129 HydrophobicContact CD1-CD1 3.51Å; L96-I129 HydrophobicContact CD1-CG1 4.02Å; L96-I129 HydrophobicContact CD1-CG2 4.33Å; L96-I129 HydrophobicContact CD2-CG2 4.48Å; I100-I129 HydrophobicContact CD1-CD1 4.17Å; L125-I129 HydrophobicContact CB-CD1 3.91Å; L125-I129 HydrophobicContact CD2-CD1 4.29Å; L125-I129 WeakPolarHBondContact O-CG1 3.4Å; L125-I129 PolarHBondContact O-N 2.86Å; I129-Q133 HydrophobicContact CG2-CB 3.83Å; I129-I134 HydrophobicContact CG2-CB 3.93Å; I129-Y171 PolarHBondContact O-OH 3.18Å
130	R	88.3	Confident	90.9	Very high	161 Å²	161	53 Å²	53	61%	0.608	27%	0.271	S	S	*	.			trans	-76.9	158.1	175.6	-59	-176.3	-68.9	157.5	-1.2	111.8	E132 Q133 I134	R130-E132 WeakPolarHBondContact CB-OE2 3.48Å; R130-E132 PolarHBondContact O-N 3.01Å; R130-Q133 VanDerWaalsContact N-OE1 3.09Å; R130-Q133 PolarHBondContact O-N 3.21Å; R130-Q133 VanDerWaalsContact O-N 3.12Å; R130-I134 PolarHBondContact O-N 3.31Å
131	A	86.2	Confident	90.7	Very high	37 Å²	37	48.2 Å²	48.2	31%	0.306	25%	0.249	S	C	.	.	H	α-helix	trans	-57.8	-37.8	-177.7	0	0	0	0	0	112.2	Q133 I134 A135 Y171 L174	A131-Q133 VanDerWaalsContact C-N 3.28Å; A131-Q133 PolarHBondContact O-N 2.95Å; A131-I134 WeakPolarHBondContact O-CG2 3.37Å; A131-I134 PolarHBondContact O-N 3.45Å; A131-A135 WeakPolarHBondContact O-CB 3.41Å; A131-A135 PolarHBondContact O-N 3.28Å; A131-Y171 HydrophobicContact CB-CD1 4.07Å; A131-Y171 HydrophobicContact CB-CE1 4.43Å; A131-L174 HydrophobicContact CB-CD1 4.34Å
132	E	86.9	Confident	90.5	Very high	129 Å²	129	48.2 Å²	48.2	60%	0.603	25%	0.249	S	C	*	.	H	α-helix	trans	-67.7	-30	-178.3	-51.9	75.3	-157.9	0	0	112.3	R130	R130-E132 WeakPolarHBondContact CB-OE2 3.48Å; R130-E132 PolarHBondContact O-N 3.01Å
133	Q	86.6	Confident	90.3	Very high	53 Å²	53	50.4 Å²	50.4	25%	0.248	27%	0.268	C	S	.	.	H	α-helix	trans	-78.8	-37.4	-179	-66.5	175.5	-59.5	0	0	112.1	D93 L96 I129 R130 A131	D93-Q133 PolarHBondContact OD1-NE2 3.18Å; D93-Q133 VanDerWaalsContact OD1-NE2 3.13Å; L96-Q133 HydrophobicContact CD2-CB 4.1Å; I129-Q133 HydrophobicContact CG2-CB 3.83Å; R130-Q133 VanDerWaalsContact N-OE1 3.09Å; R130-Q133 PolarHBondContact O-N 3.21Å; R130-Q133 VanDerWaalsContact O-N 3.12Å; A131-Q133 VanDerWaalsContact C-N 3.28Å; A131-Q133 PolarHBondContact O-N 2.95Å
134	I	88.8	Confident	90.2	Very high	2 Å²	2	48 Å²	48	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-83.5	-21.8	179.3	-162.2	167.6	0	0	0	112.8	I100 I129 R130 A131 P136 F137 F138 Y171 L174	I100-I134 HydrophobicContact CD1-CD1 4.09Å; I129-I134 HydrophobicContact CG2-CB 3.93Å; R130-I134 PolarHBondContact O-N 3.31Å; A131-I134 WeakPolarHBondContact O-CG2 3.37Å; A131-I134 PolarHBondContact O-N 3.45Å; I134-P136 VanDerWaalsContact C-CD 3.41Å; I134-P136 VanDerWaalsContact C-N 3.35Å; I134-F137 CarbonylContact O-C 3.57Å; I134-F137 PolarHBondContact O-N 3.28Å; I134-F138 HydrophobicContact CG2-CD2 4.43Å; I134-F138 PolarHBondContact O-N 3.49Å; I134-Y171 HydrophobicContact CD1-CD2 4.43Å; I134-Y171 HydrophobicContact CD1-CE2 3.86Å; I134-Y171 HydrophobicContact CG2-CD1 3.84Å; I134-Y171 HydrophobicContact CG2-CD2 4.47Å; I134-Y171 HydrophobicContact CG2-CE1 3.65Å; I134-Y171 HydrophobicContact CG2-CE2 4.28Å; I134-Y171 HydrophobicContact CG2-CG 4.26Å; I134-L174 HydrophobicContact CG2-CD1 3.75Å
135	A	88.4	Confident	90.2	Very high	35 Å²	35	46.6 Å²	46.6	29%	0.289	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-44.4	-175.6	0	0	0	0	0	114.8	A131 F137 F138 P139 L174	A131-A135 WeakPolarHBondContact O-CB 3.41Å; A131-A135 PolarHBondContact O-N 3.28Å; A135-F137 PolarHBondContact O-N 2.95Å; A135-F138 WeakPolarHBondContact O-CB 3.44Å; A135-F138 PolarHBondContact O-N 3.43Å; A135-P139 WeakPolarHBondContact O-CD 3.28Å; A135-L174 HydrophobicContact CB-CD1 4.12Å; A135-L174 HydrophobicContact CB-CD2 3.77Å
136	P	88.9	Confident	90.1	Very high	91 Å²	91	47.1 Å²	47.1	59%	0.591	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-28.2	178.7	-22.1	34.7	0	0	0	114.1	I134	I134-P136 VanDerWaalsContact C-CD 3.41Å; I134-P136 VanDerWaalsContact C-N 3.35Å
137	F	88.4	Confident	90.1	Very high	56 Å²	56	50 Å²	50	25%	0.246	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-12.1	-178	-47.8	-68.4	0	0	0	112.6	L96 S97 I100 I134 A135 P139 L140 V141	L96-F137 HydrophobicContact CD2-CD2 4.39Å; L96-F137 HydrophobicContact CD2-CE2 3.97Å; L96-F137 HydrophobicContact CG-CD2 4.35Å; L96-F137 HydrophobicContact CG-CE2 4.05Å; S97-F137 VanDerWaalsContact CB-CE1 3.45Å; S97-F137 WeakPolarHBondContact OG-CE1 3.39Å; I100-F137 HydrophobicContact CG2-CB 3.99Å; I134-F137 CarbonylContact O-C 3.57Å; I134-F137 PolarHBondContact O-N 3.28Å; A135-F137 PolarHBondContact O-N 2.95Å; F137-P139 VanDerWaalsContact C-CD 3.46Å; F137-P139 VanDerWaalsContact C-N 3.3Å; F137-L140 WeakPolarHBondContact O-CB 3.39Å; F137-L140 PolarHBondContact O-N 3.38Å; F137-V141 PolarHBondContact O-N 3.25Å
138	F	89	Confident	90.1	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-56.4	-36.2	-179.7	-155.6	-87.2	0	0	0	113.8	I134 A135 L140 V141 S142 L167 Y171 L174 L175	I134-F138 HydrophobicContact CG2-CD2 4.43Å; I134-F138 PolarHBondContact O-N 3.49Å; A135-F138 WeakPolarHBondContact O-CB 3.44Å; A135-F138 PolarHBondContact O-N 3.43Å; F138-L140 VanDerWaalsContact C-N 3.27Å; F138-L140 PolarHBondContact O-N 3.14Å; F138-V141 PolarHBondContact O-N 3.35Å; F138-S142 VanDerWaalsContact O-CB 3.29Å; F138-S142 WeakPolarHBondContact O-CB 3.47Å; F138-S142 PolarHBondContact O-N 2.96Å; F138-L167 HydrophobicContact CE2-CD2 4.34Å; F138-L167 HydrophobicContact CZ-CD1 4.48Å; F138-Y171 HydrophobicContact CE2-CD2 4.28Å; F138-Y171 HydrophobicContact CE2-CG 4.23Å; F138-L174 HydrophobicContact CB-CD1 4.43Å; F138-L174 HydrophobicContact CD1-CB 3.76Å; F138-L174 WeakPolarHBondContact CD1-O 3.42Å; F138-L174 HydrophobicContact CD2-CB 3.77Å; F138-L174 HydrophobicContact CD2-CD1 3.76Å; F138-L174 HydrophobicContact CD2-CG 4.43Å; F138-L174 HydrophobicContact CE1-CB 3.82Å; F138-L174 WeakPolarHBondContact CE1-O 3.41Å; F138-L174 HydrophobicContact CE2-CB 3.8Å; F138-L174 HydrophobicContact CE2-CD1 4.26Å; F138-L174 HydrophobicContact CG-CB 3.74Å; F138-L174 HydrophobicContact CG-CD1 4.14Å; F138-L174 HydrophobicContact CZ-CB 3.82Å; F138-L175 HydrophobicContact CE1-CB 4.18Å; F138-L175 HydrophobicContact CE1-CD1 3.96Å; F138-L175 HydrophobicContact CZ-CB 3.9Å; F138-L175 HydrophobicContact CZ-CD1 3.81Å; F138-L175 HydrophobicContact CZ-CG 4.46Å
139	P	88.9	Confident	90.2	Very high	53 Å²	53	41.5 Å²	41.5	34%	0.344	23%	0.23	S	C	.	.	H	α-helix	trans	-47	-43.3	167.1	-39.7	43.6	0	0	0	116.3	A135 F137 A143 R178	A135-P139 WeakPolarHBondContact O-CD 3.28Å; F137-P139 VanDerWaalsContact C-CD 3.46Å; F137-P139 VanDerWaalsContact C-N 3.3Å; P139-A143 PolarHBondContact O-N 3.03Å; P139-R178 VanDerWaalsContact CA-CZ 3.45Å; P139-R178 VanDerWaalsContact CA-NH1 3.34Å; P139-R178 PolarHBondContact O-NH1 3.46Å
140	L	90.4	Very high	90.1	Very high	64 Å²	64	43.9 Å²	43.9	34%	0.335	25%	0.245	S	C	.	.	H	α-helix	trans	-72.3	-47.9	-179.1	177.8	66.5	0	0	0	110.4	F137 F138 S142 A143 H144	F137-L140 WeakPolarHBondContact O-CB 3.39Å; F137-L140 PolarHBondContact O-N 3.38Å; F138-L140 VanDerWaalsContact C-N 3.27Å; F138-L140 PolarHBondContact O-N 3.14Å; L140-S142 VanDerWaalsContact C-N 3.31Å; L140-S142 PolarHBondContact O-N 3.39Å; L140-A143 PolarHBondContact O-N 2.92Å; L140-A143 VanDerWaalsContact O-N 3.14Å; L140-H144 PolarHBondContact O-CD2 2.72Å; L140-H144 PolarHBondContact O-N 3.26Å
141	V	91.9	Very high	90.3	Very high	3 Å²	3	39 Å²	39	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-44.9	178.3	-178.9	0	0	0	0	110.9	I100 A104 F107 F137 F138 A143 H144 L145 L167	I100-V141 HydrophobicContact CG2-CG2 3.37Å; A104-V141 HydrophobicContact CB-CG2 4.46Å; F107-V141 HydrophobicContact CE2-CG1 4.19Å; F137-V141 PolarHBondContact O-N 3.25Å; F138-V141 PolarHBondContact O-N 3.35Å; V141-A143 VanDerWaalsContact C-N 3.34Å; V141-A143 PolarHBondContact O-N 3.28Å; V141-H144 PolarHBondContact O-N 2.84Å; V141-L145 WeakPolarHBondContact O-CB 3.34Å; V141-L145 PolarHBondContact O-N 3.23Å; V141-L167 HydrophobicContact CG1-CD1 3.81Å; V141-L167 HydrophobicContact CG1-CD2 4.16Å
142	S	90.8	Very high	90.4	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-36	177.8	174.9	0	0	0	0	112.8	F138 L140 S146 R178	F138-S142 VanDerWaalsContact O-CB 3.29Å; F138-S142 WeakPolarHBondContact O-CB 3.47Å; F138-S142 PolarHBondContact O-N 2.96Å; L140-S142 VanDerWaalsContact C-N 3.31Å; L140-S142 PolarHBondContact O-N 3.39Å; S142-S146 WeakPolarHBondContact O-CB 3.4Å; S142-S146 PolarHBondContact O-N 3.26Å; S142-S146 PolarHBondContact O-OG 2.91Å; S142-R178 WeakPolarHBondContact OG-CD 3.49Å
143	A	90.6	Very high	90.5	Very high	51 Å²	51	41.8 Å²	41.8	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-69.4	-45.6	176.6	0	0	0	0	0	112	P139 L140 V141 L145 S146 S147	P139-A143 PolarHBondContact O-N 3.03Å; L140-A143 PolarHBondContact O-N 2.92Å; L140-A143 VanDerWaalsContact O-N 3.14Å; V141-A143 VanDerWaalsContact C-N 3.34Å; V141-A143 PolarHBondContact O-N 3.28Å; A143-L145 VanDerWaalsContact C-N 3.35Å; A143-L145 PolarHBondContact O-N 2.74Å; A143-S146 PolarHBondContact O-N 3.02Å; A143-S147 PolarHBondContact O-N 2.97Å
144	H	93.3	Very high	90.4	Very high	49 Å²	49	42.2 Å²	42.2	23%	0.227	25%	0.247	C	C	.	.	H	α-helix	trans	-62.8	-40.8	175	-80.8	-74.3	0	0	0	112.3	A104 F107 L140 V141 S147 A148	A104-H144 HydrophobicContact CB-CB 4.12Å; A104-H144 WeakPolarHBondContact O-CB 3.23Å; F107-H144 HydrophobicContact CD2-CB 4.02Å; L140-H144 PolarHBondContact O-CD2 2.72Å; L140-H144 PolarHBondContact O-N 3.26Å; V141-H144 PolarHBondContact O-N 2.84Å; H144-S147 PolarHBondContact O-N 3.21Å; H144-A148 WeakPolarHBondContact O-CB 3.42Å; H144-A148 PolarHBondContact O-N 3.2Å
145	L	94.1	Very high	90.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-47.7	172.9	173.8	61.1	0	0	0	111.4	V141 A143 S147 A148 M149 S160 V163 L164 L167 L175 L182	V141-L145 WeakPolarHBondContact O-CB 3.34Å; V141-L145 PolarHBondContact O-N 3.23Å; A143-L145 VanDerWaalsContact C-N 3.35Å; A143-L145 PolarHBondContact O-N 2.74Å; L145-S147 VanDerWaalsContact C-N 3.3Å; L145-S147 PolarHBondContact O-N 3.43Å; L145-A148 PolarHBondContact O-N 3.24Å; L145-A148 VanDerWaalsContact O-N 3.09Å; L145-M149 HydrophobicContact CD1-CG 4.03Å; L145-M149 HydrophobicContact CD1-SD 4.16Å; L145-M149 HydrophobicContact CG-CG 4.39Å; L145-M149 HydrophobicContact CG-SD 4.07Å; L145-M149 WeakPolarHBondContact O-CG 3.34Å; L145-M149 PolarHBondContact O-N 3.31Å; L145-S160 WeakPolarHBondContact CD1-O 3.48Å; L145-V163 HydrophobicContact CD1-CB 4.09Å; L145-V163 HydrophobicContact CD1-CG1 3.99Å; L145-L164 HydrophobicContact CD1-CB 4.21Å; L145-L164 HydrophobicContact CD2-CB 4.19Å; L145-L164 HydrophobicContact CD2-CD1 3.95Å; L145-L167 HydrophobicContact CD2-CD1 3.83Å; L145-L175 HydrophobicContact CD2-CD1 4.41Å; L145-L182 HydrophobicContact CD2-CD2 4.48Å
146	S	92.1	Very high	90.5	Very high	13 Å²	13	41.7 Å²	41.7	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-59	-43.3	178.7	-63.6	0	0	0	0	111.6	S142 A143 A148 M149 T150 N185	S142-S146 WeakPolarHBondContact O-CB 3.4Å; S142-S146 PolarHBondContact O-N 3.26Å; S142-S146 PolarHBondContact O-OG 2.91Å; A143-S146 PolarHBondContact O-N 3.02Å; S146-A148 VanDerWaalsContact C-N 3.32Å; S146-A148 PolarHBondContact O-N 3.3Å; S146-M149 PolarHBondContact O-N 3.18Å; S146-T150 PolarHBondContact O-N 3.33Å; S146-T150 VanDerWaalsContact O-N 3.17Å; S146-T150 PolarHBondContact O-OG1 3.02Å; S146-N185 WeakPolarHBondContact CA-ND2 3.33Å; S146-N185 WeakPolarHBondContact CB-ND2 3.4Å; S146-N185 PolarHBondContact OG-ND2 3.18Å
147	S	93.1	Very high	90.6	Very high	61 Å²	61	39.1 Å²	39.1	43%	0.427	23%	0.225	S	C	.	.	H	α-helix	trans	-64.2	-34.2	175.4	-177.5	0	0	0	0	113	A143 H144 L145 H151	A143-S147 PolarHBondContact O-N 2.97Å; H144-S147 PolarHBondContact O-N 3.21Å; L145-S147 VanDerWaalsContact C-N 3.3Å; L145-S147 PolarHBondContact O-N 3.43Å; S147-H151 WeakPolarHBondContact O-CB 3.41Å; S147-H151 PolarHBondContact O-N 3.03Å
148	A	93.6	Very high	90.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-73.7	-38.2	177.4	0	0	0	0	0	111.7	F107 T108 H144 L145 S146 T150 H151 I156	F107-A148 HydrophobicContact CB-CB 4.41Å; T108-A148 HydrophobicContact CG2-CB 3.79Å; H144-A148 WeakPolarHBondContact O-CB 3.42Å; H144-A148 PolarHBondContact O-N 3.2Å; L145-A148 PolarHBondContact O-N 3.24Å; L145-A148 VanDerWaalsContact O-N 3.09Å; S146-A148 VanDerWaalsContact C-N 3.32Å; S146-A148 PolarHBondContact O-N 3.3Å; A148-T150 VanDerWaalsContact C-N 3.33Å; A148-T150 PolarHBondContact O-N 3.35Å; A148-H151 VanDerWaalsContact O-CB 3.28Å; A148-H151 WeakPolarHBondContact O-CB 3.45Å; A148-H151 PolarHBondContact O-N 2.93Å; A148-I156 HydrophobicContact CB-CG2 4.13Å
149	M	91.4	Very high	90.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-33.7	176.6	-71.3	179.1	73.4	0	0	112.7	L145 S146 Q157 S160 L161 L164 L182 N185 F186 L189	L145-M149 HydrophobicContact CD1-CG 4.03Å; L145-M149 HydrophobicContact CD1-SD 4.16Å; L145-M149 HydrophobicContact CG-CG 4.39Å; L145-M149 HydrophobicContact CG-SD 4.07Å; L145-M149 WeakPolarHBondContact O-CG 3.34Å; L145-M149 PolarHBondContact O-N 3.31Å; S146-M149 PolarHBondContact O-N 3.18Å; M149-Q157 WeakPolarHBondContact O-CG 3.47Å; M149-S160 WeakPolarHBondContact CA-OG 3.2Å; M149-S160 VanDerWaalsContact CG-OG 3.3Å; M149-S160 WeakPolarHBondContact CG-OG 3.37Å; M149-L161 HydrophobicContact CE-CD2 4.36Å; M149-L164 HydrophobicContact CE-CD2 4.3Å; M149-L182 HydrophobicContact SD-CD2 4.14Å; M149-N185 HydrophobicContact CB-CB 4.21Å; M149-N185 HydrophobicContact CE-CB 3.96Å; M149-N185 HydrophobicContact SD-CB 4.33Å; M149-F186 HydrophobicContact CE-CD1 4.3Å; M149-F186 HydrophobicContact CE-CE1 4.32Å; M149-F186 HydrophobicContact CE-CG 4.49Å; M149-L189 HydrophobicContact CB-CD1 4.4Å; M149-L189 HydrophobicContact CE-CD1 3.61Å; M149-L189 WeakPolarHBondContact O-CD2 3.5Å
150	T	90.5	Very high	91.1	Very high	57 Å²	57	38.2 Å²	38.2	35%	0.35	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	12.8	179.3	58.9	0	0	0	0	113	S146 A148 N185 E188	S146-T150 PolarHBondContact O-N 3.33Å; S146-T150 VanDerWaalsContact O-N 3.17Å; S146-T150 PolarHBondContact O-OG1 3.02Å; A148-T150 VanDerWaalsContact C-N 3.33Å; A148-T150 PolarHBondContact O-N 3.35Å; T150-N185 HydrophobicContact CG2-CB 4.12Å; T150-N185 WeakPolarHBondContact CG2-OD1 3.38Å; T150-E188 VanDerWaalsContact CG2-OE2 3.29Å; T150-E188 WeakPolarHBondContact CG2-OE2 3.35Å
151	H	91.4	Very high	91.2	Very high	58 Å²	58	35.3 Å²	35.3	27%	0.269	20%	0.203	S	C	.	.			trans	-67.7	146	-176.4	-169.9	-94	0	0	0	111.8	S147 A148 S153 I156 Q157	S147-H151 WeakPolarHBondContact O-CB 3.41Å; S147-H151 PolarHBondContact O-N 3.03Å; A148-H151 VanDerWaalsContact O-CB 3.28Å; A148-H151 WeakPolarHBondContact O-CB 3.45Å; A148-H151 PolarHBondContact O-N 2.93Å; H151-S153 WeakPolarHBondContact ND1-CB 3.38Å; H151-S153 PolarHBondContact ND1-N 3.29Å; H151-S153 PolarHBondContact O-N 3.3Å; H151-I156 HydrophobicContact CB-CB 4.2Å; H151-I156 HydrophobicContact CB-CG2 3.76Å; H151-I156 WeakPolarHBondContact CE1-CD1 3.3Å; H151-I156 WeakPolarHBondContact ND1-CD1 3.41Å; H151-Q157 VanDerWaalsContact O-CG 3.28Å; H151-Q157 WeakPolarHBondContact O-CG 3.18Å; H151-Q157 PolarHBondContact O-NE2 3.2Å
152	I	88.8	Confident	91.3	Very high	168 Å²	168	39.4 Å²	39.4	86%	0.862	22%	0.22	S	C	*	.	S	Bend	trans	-63.4	-28.9	-176.9	-58.6	163.7	0	0	0	112.4
153	S	88.4	Confident	91.5	Very high	56 Å²	56	39.6 Å²	39.6	39%	0.392	22%	0.221	S	C	.	.	S	Bend	trans	-85.9	117.2	176.3	-177.4	0	0	0	0	111.8	H151 G155 I156 Q157	H151-S153 WeakPolarHBondContact ND1-CB 3.38Å; H151-S153 PolarHBondContact ND1-N 3.29Å; H151-S153 PolarHBondContact O-N 3.3Å; S153-G155 PolarHBondContact O-N 3.47Å; S153-I156 WeakPolarHBondContact O-CB 3.33Å; S153-I156 PolarHBondContact O-N 2.9Å; S153-Q157 PolarHBondContact O-N 3.43Å; S153-Q157 VanDerWaalsContact O-N 3.16Å
154	E	85.6	Confident	91.7	Very high	62 Å²	62	37.1 Å²	37.1	29%	0.29	20%	0.201	S	C	.	.	H	α-helix	trans	-56.6	-34.5	177.7	-63	175.5	-177.6	0	0	113.4	I156 Q157 E158 N212 N214	E154-I156 VanDerWaalsContact C-N 3.28Å; E154-I156 PolarHBondContact O-N 3.36Å; E154-Q157 WeakPolarHBondContact O-CB 3.38Å; E154-Q157 PolarHBondContact O-N 2.85Å; E154-E158 PolarHBondContact O-N 3.16Å; E154-N212 PolarHBondContact OE2-OD1 3.39Å; E154-N214 WeakPolarHBondContact OE2-CB 3.43Å; E154-N214 PolarHBondContact OE2-ND2 3.3Å
155	G	87.9	Confident	91.8	Very high	23 Å²	23	36.3 Å²	36.3	24%	0.237	20%	0.199	C	C	.	.	H	α-helix	trans	-66.2	-30.5	177.6	0	0	0	0	0	113.2	R115 S153 D159	R115-G155 PolarHBondContact NH2-O 3.37Å; S153-G155 PolarHBondContact O-N 3.47Å; G155-D159 PolarHBondContact O-N 3.29Å
156	I	92.1	Very high	91.8	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-75.2	-41	173.2	-67.9	170.5	0	0	0	109.7	T108 A148 H151 S153 E154 E158 D159 S160	T108-I156 HydrophobicContact CG2-CG2 4.45Å; A148-I156 HydrophobicContact CB-CG2 4.13Å; H151-I156 HydrophobicContact CB-CB 4.2Å; H151-I156 HydrophobicContact CB-CG2 3.76Å; H151-I156 WeakPolarHBondContact CE1-CD1 3.3Å; H151-I156 WeakPolarHBondContact ND1-CD1 3.41Å; S153-I156 WeakPolarHBondContact O-CB 3.33Å; S153-I156 PolarHBondContact O-N 2.9Å; E154-I156 VanDerWaalsContact C-N 3.28Å; E154-I156 PolarHBondContact O-N 3.36Å; I156-E158 VanDerWaalsContact C-N 3.33Å; I156-E158 PolarHBondContact O-N 3.38Å; I156-D159 PolarHBondContact O-N 3.03Å; I156-S160 WeakPolarHBondContact O-CB 3.43Å; I156-S160 PolarHBondContact O-N 3.15Å
157	Q	91.1	Very high	91.9	Very high	36 Å²	36	36 Å²	36	17%	0.168	20%	0.196	C	C	.	.	H	α-helix	trans	-57.7	-46.1	173.7	-60.3	-178.7	-6.3	0	0	111.1	M149 H151 S153 E154 S160 L161 L189 W222	M149-Q157 WeakPolarHBondContact O-CG 3.47Å; H151-Q157 VanDerWaalsContact O-CG 3.28Å; H151-Q157 WeakPolarHBondContact O-CG 3.18Å; H151-Q157 PolarHBondContact O-NE2 3.2Å; S153-Q157 PolarHBondContact O-N 3.43Å; S153-Q157 VanDerWaalsContact O-N 3.16Å; E154-Q157 WeakPolarHBondContact O-CB 3.38Å; E154-Q157 PolarHBondContact O-N 2.85Å; Q157-S160 WeakPolarHBondContact O-CB 3.28Å; Q157-S160 PolarHBondContact O-N 2.9Å; Q157-S160 PolarHBondContact O-OG 2.61Å; Q157-L161 PolarHBondContact O-N 3.45Å; Q157-L189 HydrophobicContact CB-CD2 4.19Å; Q157-L189 HydrophobicContact CG-CD2 4.32Å; Q157-W222 HydrophobicContact CB-CH2 4.19Å
158	E	89.2	Confident	91.8	Very high	80 Å²	80	33.9 Å²	33.9	37%	0.374	18%	0.18	S	C	.	.	H	α-helix	trans	-60.6	-46.8	178.5	-171.8	-177.6	175.3	0	0	112.4	E154 I156 S160 L161 W222	E154-E158 PolarHBondContact O-N 3.16Å; I156-E158 VanDerWaalsContact C-N 3.33Å; I156-E158 PolarHBondContact O-N 3.38Å; E158-S160 VanDerWaalsContact C-N 3.32Å; E158-S160 PolarHBondContact O-N 3.37Å; E158-L161 WeakPolarHBondContact O-CB 3.21Å; E158-L161 PolarHBondContact O-N 2.95Å; E158-W222 HydrophobicContact CB-CH2 4.39Å; E158-W222 HydrophobicContact CB-CZ3 3.96Å; E158-W222 HydrophobicContact CG-CZ3 4.18Å
159	D	91.8	Very high	91.8	Very high	16 Å²	16	41.4 Å²	41.4	9%	0.086	22%	0.215	C	C	.	.	H	α-helix	trans	-70.1	-29	178.9	-73.6	-34.9	0	0	0	112.6	R115 G155 I156 L161 K162 V163	R115-D159 HydrophobicContact CB-CB 4.48Å; R115-D159 IonicContact CZ-OD2 2.84Å; R115-D159 VanDerWaalsContact CZ-OD2 3.24Å; R115-D159 IonicContact NE-OD2 2.74Å; R115-D159 PolarHBondContact NE-OD2 2.7Å; R115-D159 IonicContact NH2-OD2 2.71Å; R115-D159 PolarHBondContact NH2-OD2 3.48Å; G155-D159 PolarHBondContact O-N 3.29Å; I156-D159 PolarHBondContact O-N 3.03Å; D159-L161 PolarHBondContact O-N 3.24Å; D159-K162 WeakPolarHBondContact O-CB 3.37Å; D159-K162 PolarHBondContact O-N 3.39Å; D159-K162 IonicContact OD1-NZ 3.69Å; D159-K162 PolarHBondContact OD1-NZ 3.46Å; D159-V163 PolarHBondContact O-N 3.17Å
160	S	93.9	Very high	91.8	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-31.1	174.5	81.8	0	0	0	0	112.3	L145 M149 I156 Q157 E158 K162 V163 L164	L145-S160 WeakPolarHBondContact CD1-O 3.48Å; M149-S160 WeakPolarHBondContact CA-OG 3.2Å; M149-S160 VanDerWaalsContact CG-OG 3.3Å; M149-S160 WeakPolarHBondContact CG-OG 3.37Å; I156-S160 WeakPolarHBondContact O-CB 3.43Å; I156-S160 PolarHBondContact O-N 3.15Å; Q157-S160 WeakPolarHBondContact O-CB 3.28Å; Q157-S160 PolarHBondContact O-N 2.9Å; Q157-S160 PolarHBondContact O-OG 2.61Å; E158-S160 VanDerWaalsContact C-N 3.32Å; E158-S160 PolarHBondContact O-N 3.37Å; S160-K162 PolarHBondContact O-N 2.71Å; S160-V163 WeakPolarHBondContact O-CB 3.44Å; S160-V163 PolarHBondContact O-N 3.25Å; S160-L164 PolarHBondContact O-N 3.09Å
161	L	92.9	Very high	91.9	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-66.7	-27.4	175.9	-65.3	-177.4	0	0	0	112.3	M149 Q157 E158 D159 L164 D165 L189 W222 V226 R229	M149-L161 HydrophobicContact CE-CD2 4.36Å; Q157-L161 PolarHBondContact O-N 3.45Å; E158-L161 WeakPolarHBondContact O-CB 3.21Å; E158-L161 PolarHBondContact O-N 2.95Å; D159-L161 PolarHBondContact O-N 3.24Å; L161-L164 HydrophobicContact CD2-CD2 4.24Å; L161-D165 PolarHBondContact O-N 2.82Å; L161-D165 VanDerWaalsContact O-N 3.08Å; L161-L189 HydrophobicContact CD2-CD1 3.93Å; L161-W222 HydrophobicContact CD1-CH2 4.33Å; L161-W222 HydrophobicContact CD1-CZ3 4.5Å; L161-V226 HydrophobicContact CD1-CG2 4.13Å; L161-R229 PolarHBondContact O-NE 2.91Å
162	K	94.4	Very high	91.8	Very high	89 Å²	89	44.1 Å²	44.1	39%	0.387	22%	0.223	S	C	.	.	H	α-helix	trans	-73.1	-39.7	173	-58.1	171.8	-174.1	157.8	0	111	V119 D159 S160 L164 D165 V166	V119-K162 HydrophobicContact CG1-CB 4.1Å; V119-K162 HydrophobicContact CG2-CB 4.26Å; D159-K162 WeakPolarHBondContact O-CB 3.37Å; D159-K162 PolarHBondContact O-N 3.39Å; D159-K162 IonicContact OD1-NZ 3.69Å; D159-K162 PolarHBondContact OD1-NZ 3.46Å; S160-K162 PolarHBondContact O-N 2.71Å; K162-L164 VanDerWaalsContact C-N 3.32Å; K162-D165 PolarHBondContact O-N 3.33Å; K162-V166 WeakPolarHBondContact O-CG2 3.36Å; K162-V166 PolarHBondContact O-N 3.25Å
163	V	94.8	Very high	91.7	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.024	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-46.8	171.9	175.3	0	0	0	0	110	F107 V119 L122 L145 D159 S160 D165 V166 L167	F107-V163 HydrophobicContact CD1-CG2 4Å; F107-V163 HydrophobicContact CD2-CG1 3.94Å; F107-V163 HydrophobicContact CD2-CG2 4.47Å; F107-V163 HydrophobicContact CE1-CG1 4.27Å; F107-V163 HydrophobicContact CE1-CG2 4.17Å; F107-V163 HydrophobicContact CE2-CG1 3.56Å; F107-V163 HydrophobicContact CG-CG1 4.44Å; F107-V163 HydrophobicContact CG-CG2 4.17Å; F107-V163 HydrophobicContact CZ-CG1 3.75Å; F107-V163 HydrophobicContact CZ-CG2 4.49Å; V119-V163 HydrophobicContact CG2-CG2 3.75Å; L122-V163 HydrophobicContact CD2-CG1 3.78Å; L145-V163 HydrophobicContact CD1-CB 4.09Å; L145-V163 HydrophobicContact CD1-CG1 3.99Å; D159-V163 PolarHBondContact O-N 3.17Å; S160-V163 WeakPolarHBondContact O-CB 3.44Å; S160-V163 PolarHBondContact O-N 3.25Å; V163-D165 VanDerWaalsContact C-N 3.34Å; V163-D165 PolarHBondContact O-N 2.94Å; V163-V166 WeakPolarHBondContact O-CB 3.34Å; V163-V166 PolarHBondContact O-N 3.03Å; V163-L167 HydrophobicContact CG1-CD1 4.42Å; V163-L167 PolarHBondContact O-N 3.12Å; V163-L167 VanDerWaalsContact O-N 3.15Å
164	L	94.4	Very high	91.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57.9	-42.4	176.8	175.3	66.8	0	0	0	112.7	L145 M149 S160 L161 K162 V166 L167 L168 L175 F186 R229	L145-L164 HydrophobicContact CD1-CB 4.21Å; L145-L164 HydrophobicContact CD2-CB 4.19Å; L145-L164 HydrophobicContact CD2-CD1 3.95Å; M149-L164 HydrophobicContact CE-CD2 4.3Å; S160-L164 PolarHBondContact O-N 3.09Å; L161-L164 HydrophobicContact CD2-CD2 4.24Å; K162-L164 VanDerWaalsContact C-N 3.32Å; L164-V166 VanDerWaalsContact C-N 3.31Å; L164-V166 PolarHBondContact O-N 2.88Å; L164-L167 PolarHBondContact O-N 3.45Å; L164-L168 HydrophobicContact CD1-CD1 4.03Å; L164-L168 HydrophobicContact CD1-CG 4.13Å; L164-L168 HydrophobicContact CD2-CD1 4.48Å; L164-L168 HydrophobicContact CG-CD1 3.89Å; L164-L168 HydrophobicContact CG-CG 4.42Å; L164-L168 WeakPolarHBondContact O-CB 3.29Å; L164-L168 WeakPolarHBondContact O-CG 3.29Å; L164-L168 PolarHBondContact O-N 3.08Å; L164-L175 HydrophobicContact CD1-CD2 3.74Å; L164-F186 HydrophobicContact CD2-CE1 3.97Å; L164-F186 HydrophobicContact CD2-CZ 3.59Å; L164-R229 HydrophobicContact CD2-CB 4.13Å
165	D	95.1	Very high	91.6	Very high	32 Å²	32	34.9 Å²	34.9	17%	0.171	18%	0.182	C	C	.	.	H	α-helix	trans	-58.3	-42.7	176.5	-78.4	-49.8	0	0	0	111.7	L161 K162 V163 L168 E169 R229 K232	L161-D165 PolarHBondContact O-N 2.82Å; L161-D165 VanDerWaalsContact O-N 3.08Å; K162-D165 PolarHBondContact O-N 3.33Å; V163-D165 VanDerWaalsContact C-N 3.34Å; V163-D165 PolarHBondContact O-N 2.94Å; D165-L168 PolarHBondContact O-N 2.88Å; D165-E169 WeakPolarHBondContact O-CB 3.45Å; D165-E169 PolarHBondContact O-N 3.34Å; D165-R229 IonicContact OD1-NE 2.77Å; D165-R229 PolarHBondContact OD1-NE 2.69Å; D165-R229 IonicContact OD2-CZ 3.19Å; D165-R229 IonicContact OD2-NE 3.24Å; D165-R229 PolarHBondContact OD2-NE 3.27Å; D165-R229 IonicContact OD2-NH2 2.68Å; D165-R229 PolarHBondContact OD2-NH2 3.44Å; D165-K232 IonicContact OD1-NZ 2.85Å; D165-K232 PolarHBondContact OD1-NZ 3.42Å; D165-K232 VanDerWaalsContact OD1-NZ 3.13Å
166	V	95.3	Very high	91.5	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.03	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-44.3	178.5	-178.1	0	0	0	0	111.2	V119 L122 Q123 A126 K162 V163 L164 E169 R170	V119-V166 HydrophobicContact CG1-CG2 4.49Å; L122-V166 HydrophobicContact CD2-CB 4.21Å; L122-V166 HydrophobicContact CD2-CG1 4.16Å; L122-V166 HydrophobicContact CG-CG1 3.99Å; Q123-V166 HydrophobicContact CG-CB 4.39Å; Q123-V166 HydrophobicContact CG-CG1 4.06Å; Q123-V166 HydrophobicContact CG-CG2 3.36Å; A126-V166 HydrophobicContact CB-CG1 4.04Å; K162-V166 WeakPolarHBondContact O-CG2 3.36Å; K162-V166 PolarHBondContact O-N 3.25Å; V163-V166 WeakPolarHBondContact O-CB 3.34Å; V163-V166 PolarHBondContact O-N 3.03Å; L164-V166 VanDerWaalsContact C-N 3.31Å; L164-V166 PolarHBondContact O-N 2.88Å; V166-E169 PolarHBondContact O-N 2.82Å; V166-R170 WeakPolarHBondContact O-CB 3.2Å; V166-R170 WeakPolarHBondContact O-CG 3.26Å; V166-R170 PolarHBondContact O-N 3.36Å; V166-R170 VanDerWaalsContact O-N 3.09Å
167	L	93.9	Very high	90.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-69.3	-38.7	179.8	-61.4	-176.8	0	0	0	112.1	L122 F138 V141 L145 V163 L164 E169 Y171 L175	L122-L167 HydrophobicContact CD2-CD2 4.35Å; F138-L167 HydrophobicContact CE2-CD2 4.34Å; F138-L167 HydrophobicContact CZ-CD1 4.48Å; V141-L167 HydrophobicContact CG1-CD1 3.81Å; V141-L167 HydrophobicContact CG1-CD2 4.16Å; L145-L167 HydrophobicContact CD2-CD1 3.83Å; V163-L167 HydrophobicContact CG1-CD1 4.42Å; V163-L167 PolarHBondContact O-N 3.12Å; V163-L167 VanDerWaalsContact O-N 3.15Å; L164-L167 PolarHBondContact O-N 3.45Å; L167-E169 VanDerWaalsContact C-N 3.33Å; L167-E169 PolarHBondContact O-N 3.37Å; L167-Y171 HydrophobicContact CD2-CD2 4.1Å; L167-Y171 CarbonylContact O-C 3.24Å; L167-Y171 VanDerWaalsContact O-C 3.24Å; L167-Y171 WeakPolarHBondContact O-CA 3.46Å; L167-Y171 PolarHBondContact O-N 2.71Å; L167-L175 HydrophobicContact CB-CD1 4.29Å; L167-L175 HydrophobicContact CB-CD2 4.41Å; L167-L175 HydrophobicContact CD1-CD1 4.23Å
168	L	91.8	Very high	89.7	Confident	17 Å²	17	43.2 Å²	43.2	9%	0.089	22%	0.217	C	C	.	.	H	α-helix	trans	-63.4	-38.5	175.4	-84	170.1	0	0	0	112.3	L164 D165 L175 K232 F233 A236	L164-L168 HydrophobicContact CD1-CD1 4.03Å; L164-L168 HydrophobicContact CD1-CG 4.13Å; L164-L168 HydrophobicContact CD2-CD1 4.48Å; L164-L168 HydrophobicContact CG-CD1 3.89Å; L164-L168 HydrophobicContact CG-CG 4.42Å; L164-L168 WeakPolarHBondContact O-CB 3.29Å; L164-L168 WeakPolarHBondContact O-CG 3.29Å; L164-L168 PolarHBondContact O-N 3.08Å; D165-L168 PolarHBondContact O-N 2.88Å; L168-L175 HydrophobicContact CB-CD2 4.48Å; L168-L175 HydrophobicContact CD2-CD2 3.52Å; L168-L175 HydrophobicContact CG-CD2 3.56Å; L168-K232 HydrophobicContact CD1-CB 4.08Å; L168-F233 HydrophobicContact CD1-CB 4.49Å; L168-F233 HydrophobicContact CD2-CB 4.21Å; L168-F233 HydrophobicContact CD2-CD2 4.07Å; L168-A236 HydrophobicContact CD2-CB 4.39Å
169	E	92.7	Very high	89.3	Confident	158 Å²	158	39.8 Å²	39.8	74%	0.738	20%	0.201	S	C	*	.	H	α-helix	trans	-73.1	-37.7	-179.8	-172.9	178	169.5	0	0	112.4	D165 V166 L167	D165-E169 WeakPolarHBondContact O-CB 3.45Å; D165-E169 PolarHBondContact O-N 3.34Å; V166-E169 PolarHBondContact O-N 2.82Å; L167-E169 VanDerWaalsContact C-N 3.33Å; L167-E169 PolarHBondContact O-N 3.37Å
170	R	92.8	Very high	88.8	Confident	113 Å²	113	40.9 Å²	40.9	43%	0.426	21%	0.21	S	C	.	.	H	α-helix	trans	-102.4	-29.4	-170.4	-58.7	-57	-58.6	-142.9	1.5	114.4	A126 V166	A126-R170 HydrophobicContact CB-CB 3.95Å; A126-R170 HydrophobicContact CB-CG 3.75Å; A126-R170 VanDerWaalsContact O-CZ 3.29Å; A126-R170 PolarHBondContact O-NE 2.92Å; A126-R170 PolarHBondContact O-NH2 3.47Å; V166-R170 WeakPolarHBondContact O-CB 3.2Å; V166-R170 WeakPolarHBondContact O-CG 3.26Å; V166-R170 PolarHBondContact O-N 3.36Å; V166-R170 VanDerWaalsContact O-N 3.09Å
171	Y	91.6	Very high	88.4	Confident	7 Å²	7	44.7 Å²	44.7	3%	0.027	23%	0.23	C	C	.	.			trans	-138.4	51.7	-172.9	-52.9	-61.4	0	0	0	113.2	A126 I129 A131 I134 F138 L167 A173 L174 L175	A126-Y171 WeakPolarHBondContact CA-OH 3.41Å; A126-Y171 HydrophobicContact CB-CE2 3.75Å; A126-Y171 PolarHBondContact O-OH 3.41Å; I129-Y171 PolarHBondContact O-OH 3.18Å; A131-Y171 HydrophobicContact CB-CD1 4.07Å; A131-Y171 HydrophobicContact CB-CE1 4.43Å; I134-Y171 HydrophobicContact CD1-CD2 4.43Å; I134-Y171 HydrophobicContact CD1-CE2 3.86Å; I134-Y171 HydrophobicContact CG2-CD1 3.84Å; I134-Y171 HydrophobicContact CG2-CD2 4.47Å; I134-Y171 HydrophobicContact CG2-CE1 3.65Å; I134-Y171 HydrophobicContact CG2-CE2 4.28Å; I134-Y171 HydrophobicContact CG2-CG 4.26Å; F138-Y171 HydrophobicContact CE2-CD2 4.28Å; F138-Y171 HydrophobicContact CE2-CG 4.23Å; L167-Y171 HydrophobicContact CD2-CD2 4.1Å; L167-Y171 CarbonylContact O-C 3.24Å; L167-Y171 VanDerWaalsContact O-C 3.24Å; L167-Y171 WeakPolarHBondContact O-CA 3.46Å; L167-Y171 PolarHBondContact O-N 2.71Å; Y171-A173 PolarHBondContact O-N 3.41Å; Y171-L174 HydrophobicContact CD1-CD1 4.39Å; Y171-L174 PolarHBondContact O-N 3Å; Y171-L175 PolarHBondContact O-N 3.49Å
172	P	89.1	Confident	88.1	Confident	52 Å²	52	44.6 Å²	44.6	34%	0.338	23%	0.229	S	C	.	.	H	α-helix	trans	-59.4	-44.3	-174.4	22.7	-33	0	0	0	113.1	L175 T176 A236	P172-L175 PolarHBondContact O-N 3.46Å; P172-T176 WeakPolarHBondContact O-CG2 3.33Å; P172-T176 PolarHBondContact O-N 3.43Å; P172-T176 PolarHBondContact O-OG1 3.03Å; P172-A236 HydrophobicContact CB-CB 4.02Å
173	A	85.9	Confident	87.9	Confident	63 Å²	63	40.6 Å²	40.6	52%	0.521	21%	0.212	S	C	.	.	H	α-helix	trans	-61.3	-47.8	-178.2	0	0	0	0	0	112.7	Y171 L175 T176 D177	Y171-A173 PolarHBondContact O-N 3.41Å; A173-L175 VanDerWaalsContact C-N 3.25Å; A173-L175 PolarHBondContact O-N 2.81Å; A173-T176 PolarHBondContact O-N 3.08Å; A173-T176 PolarHBondContact O-OG1 2.85Å; A173-D177 PolarHBondContact O-N 3.23Å
174	L	86.9	Confident	87.6	Confident	30 Å²	30	46.2 Å²	46.2	16%	0.157	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-32.4	178.7	-61.1	176.7	0	0	0	112.2	A131 I134 A135 F138 Y171	A131-L174 HydrophobicContact CB-CD1 4.34Å; I134-L174 HydrophobicContact CG2-CD1 3.75Å; A135-L174 HydrophobicContact CB-CD1 4.12Å; A135-L174 HydrophobicContact CB-CD2 3.77Å; F138-L174 HydrophobicContact CB-CD1 4.43Å; F138-L174 HydrophobicContact CD1-CB 3.76Å; F138-L174 WeakPolarHBondContact CD1-O 3.42Å; F138-L174 HydrophobicContact CD2-CB 3.77Å; F138-L174 HydrophobicContact CD2-CD1 3.76Å; F138-L174 HydrophobicContact CD2-CG 4.43Å; F138-L174 HydrophobicContact CE1-CB 3.82Å; F138-L174 WeakPolarHBondContact CE1-O 3.41Å; F138-L174 HydrophobicContact CE2-CB 3.8Å; F138-L174 HydrophobicContact CE2-CD1 4.26Å; F138-L174 HydrophobicContact CG-CB 3.74Å; F138-L174 HydrophobicContact CG-CD1 4.14Å; F138-L174 HydrophobicContact CZ-CB 3.82Å; Y171-L174 HydrophobicContact CD1-CD1 4.39Å; Y171-L174 PolarHBondContact O-N 3Å
175	L	86.9	Confident	87.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-72.7	-35.4	177.4	-163.6	72.2	0	0	0	112.3	F138 L145 L164 L167 L168 Y171 P172 A173 D177 L182 F233	F138-L175 HydrophobicContact CE1-CB 4.18Å; F138-L175 HydrophobicContact CE1-CD1 3.96Å; F138-L175 HydrophobicContact CZ-CB 3.9Å; F138-L175 HydrophobicContact CZ-CD1 3.81Å; F138-L175 HydrophobicContact CZ-CG 4.46Å; L145-L175 HydrophobicContact CD2-CD1 4.41Å; L164-L175 HydrophobicContact CD1-CD2 3.74Å; L167-L175 HydrophobicContact CB-CD1 4.29Å; L167-L175 HydrophobicContact CB-CD2 4.41Å; L167-L175 HydrophobicContact CD1-CD1 4.23Å; L168-L175 HydrophobicContact CB-CD2 4.48Å; L168-L175 HydrophobicContact CD2-CD2 3.52Å; L168-L175 HydrophobicContact CG-CD2 3.56Å; Y171-L175 PolarHBondContact O-N 3.49Å; P172-L175 PolarHBondContact O-N 3.46Å; A173-L175 VanDerWaalsContact C-N 3.25Å; A173-L175 PolarHBondContact O-N 2.81Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-D177 PolarHBondContact O-N 3.5Å; L175-L182 HydrophobicContact CD1-CD1 3.68Å; L175-L182 HydrophobicContact CG-CD1 3.79Å; L175-F233 HydrophobicContact CD2-CD2 4.07Å; L175-F233 HydrophobicContact CD2-CE2 4.23Å; L175-F233 HydrophobicContact CG-CD2 4.45Å; L175-F233 HydrophobicContact CG-CE2 4.11Å
176	T	84.3	Confident	87.2	Confident	23 Å²	23	45.2 Å²	45.2	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-73.2	-22	-179.5	51.2	0	0	0	0	113.9	P172 A173 R178 S179 A236 V237	P172-T176 WeakPolarHBondContact O-CG2 3.33Å; P172-T176 PolarHBondContact O-N 3.43Å; P172-T176 PolarHBondContact O-OG1 3.03Å; A173-T176 PolarHBondContact O-N 3.08Å; A173-T176 PolarHBondContact O-OG1 2.85Å; T176-R178 PolarHBondContact O-N 3.45Å; T176-R178 VanDerWaalsContact O-N 3.11Å; T176-S179 WeakPolarHBondContact O-CB 3.4Å; T176-S179 PolarHBondContact O-N 3.09Å; T176-A236 HydrophobicContact CG2-CB 3.89Å; T176-V237 HydrophobicContact CG2-CB 4.32Å; T176-V237 HydrophobicContact CG2-CG2 3.61Å
177	D	76.4	Confident	86.9	Confident	130 Å²	130	45.2 Å²	45.2	70%	0.695	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.4	176.7	-72.7	-16.2	0	0	0	113.2	A173 L175	A173-D177 PolarHBondContact O-N 3.23Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-D177 PolarHBondContact O-N 3.5Å
178	R	70.5	Confident	86.6	Confident	85 Å²	85	48.2 Å²	48.2	32%	0.321	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114	42.8	177.9	-66.7	-175.8	170.7	-163.8	-5.8	112.7	P139 S142 T176 S180	P139-R178 VanDerWaalsContact CA-CZ 3.45Å; P139-R178 VanDerWaalsContact CA-NH1 3.34Å; P139-R178 PolarHBondContact O-NH1 3.46Å; S142-R178 WeakPolarHBondContact OG-CD 3.49Å; T176-R178 PolarHBondContact O-N 3.45Å; T176-R178 VanDerWaalsContact O-N 3.11Å; R178-S180 VanDerWaalsContact C-N 3.34Å; R178-S180 PolarHBondContact O-N 2.89Å
179	S	79.9	Confident	86.4	Confident	7 Å²	7	47.6 Å²	47.6	5%	0.049	24%	0.242	C	C	.	.	H	α-helix	trans	-61.1	-37.5	-172.9	70.3	0	0	0	0	114.3	T176 I181 L182 L183 G308 L309	T176-S179 WeakPolarHBondContact O-CB 3.4Å; T176-S179 PolarHBondContact O-N 3.09Å; S179-I181 PolarHBondContact O-N 3.44Å; S179-L182 PolarHBondContact O-N 3.24Å; S179-L183 VanDerWaalsContact O-CB 3.29Å; S179-L183 WeakPolarHBondContact O-CB 3.31Å; S179-L183 WeakPolarHBondContact O-CD1 3.45Å; S179-L183 WeakPolarHBondContact O-CG 3.46Å; S179-L183 PolarHBondContact O-N 3.28Å; S179-G308 WeakPolarHBondContact OG-CA 3.33Å; S179-L309 PolarHBondContact OG-N 3.29Å
180	S	81.2	Confident	86	Confident	40 Å²	40	40.1 Å²	40.1	28%	0.28	21%	0.206	S	C	.	.	H	α-helix	trans	-59.4	-47.4	-174.4	52.5	0	0	0	0	112.8	R178 K184 E306	R178-S180 VanDerWaalsContact C-N 3.34Å; R178-S180 PolarHBondContact O-N 2.89Å; S180-K184 PolarHBondContact O-N 3.3Å; S180-E306 VanDerWaalsContact CB-OE2 3.28Å; S180-E306 WeakPolarHBondContact CB-OE2 3.38Å; S180-E306 PolarHBondContact OG-OE2 3.37Å
181	I	85.1	Confident	85.6	Confident	81 Å²	81	34.7 Å²	34.7	42%	0.415	19%	0.186	S	C	.	.	H	α-helix	trans	-66.5	-49.1	-178.6	-59.3	173.1	0	0	0	110.7	S179 L183 K184 N185	S179-I181 PolarHBondContact O-N 3.44Å; I181-L183 VanDerWaalsContact C-N 3.33Å; I181-L183 PolarHBondContact O-N 3.22Å; I181-K184 WeakPolarHBondContact O-CB 3.01Å; I181-K184 PolarHBondContact O-N 3.19Å; I181-N185 VanDerWaalsContact O-CG 3.26Å; I181-N185 PolarHBondContact O-N 3.46Å; I181-N185 PolarHBondContact O-OD1 3.11Å
182	L	88	Confident	84.9	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-37.2	-177.8	-69.1	175.5	0	0	0	112.1	L145 M149 L175 S179 K184 N185 F186 F233	L145-L182 HydrophobicContact CD2-CD2 4.48Å; M149-L182 HydrophobicContact SD-CD2 4.14Å; L175-L182 HydrophobicContact CD1-CD1 3.68Å; L175-L182 HydrophobicContact CG-CD1 3.79Å; S179-L182 PolarHBondContact O-N 3.24Å; L182-K184 VanDerWaalsContact C-N 3.33Å; L182-K184 PolarHBondContact O-N 3.32Å; L182-N185 WeakPolarHBondContact O-CB 3.17Å; L182-N185 PolarHBondContact O-N 2.79Å; L182-F186 WeakPolarHBondContact O-CD2 3.37Å; L182-F186 PolarHBondContact O-N 3.49Å; L182-F233 HydrophobicContact CB-CE2 4.34Å; L182-F233 HydrophobicContact CB-CZ 4.27Å; L182-F233 HydrophobicContact CD1-CD2 4.46Å; L182-F233 HydrophobicContact CD1-CE2 3.7Å; L182-F233 HydrophobicContact CD1-CZ 4.24Å
183	L	89.5	Confident	84	Confident	5 Å²	5	42.5 Å²	42.5	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-39.4	175.4	-70.5	165.4	0	0	0	112.1	S179 I181 F186 V187 L230 F233 L234 L309 F318	S179-L183 VanDerWaalsContact O-CB 3.29Å; S179-L183 WeakPolarHBondContact O-CB 3.31Å; S179-L183 WeakPolarHBondContact O-CD1 3.45Å; S179-L183 WeakPolarHBondContact O-CG 3.46Å; S179-L183 PolarHBondContact O-N 3.28Å; I181-L183 VanDerWaalsContact C-N 3.33Å; I181-L183 PolarHBondContact O-N 3.22Å; L183-F186 PolarHBondContact O-N 3.32Å; L183-V187 WeakPolarHBondContact O-CG2 3.32Å; L183-V187 PolarHBondContact O-N 3.06Å; L183-V187 VanDerWaalsContact O-N 3.1Å; L183-L230 HydrophobicContact CD2-CD1 3.9Å; L183-F233 HydrophobicContact CD2-CD1 3.98Å; L183-F233 HydrophobicContact CD2-CE1 3.85Å; L183-F233 HydrophobicContact CG-CE1 3.95Å; L183-L234 HydrophobicContact CD2-CD2 3.98Å; L183-L309 HydrophobicContact CD1-CD1 3.39Å; L183-L309 HydrophobicContact CD1-CD2 3.74Å; L183-L309 HydrophobicContact CD1-CG 3.43Å; L183-L309 VanDerWaalsContact CD1-CG 3.43Å; L183-L309 HydrophobicContact CD2-CD1 4.36Å; L183-L309 HydrophobicContact CG-CD1 4.49Å; L183-F318 HydrophobicContact CB-CD2 4.21Å; L183-F318 HydrophobicContact CB-CE2 3.75Å; L183-F318 HydrophobicContact CB-CZ 4.14Å; L183-F318 HydrophobicContact CD2-CE1 3.91Å; L183-F318 HydrophobicContact CD2-CE2 4.14Å; L183-F318 HydrophobicContact CD2-CZ 3.61Å; L183-F318 HydrophobicContact CG-CE2 4.39Å; L183-F318 HydrophobicContact CG-CZ 4.34Å
184	K	88.1	Confident	82.5	Confident	123 Å²	123	44.4 Å²	44.4	54%	0.535	22%	0.216	S	C	.	.	H	α-helix	trans	-61.7	-45.1	172.8	-169.9	-173.7	178.9	-160.2	0	111.2	S180 I181 L182 F186 V187 E188	S180-K184 PolarHBondContact O-N 3.3Å; I181-K184 WeakPolarHBondContact O-CB 3.01Å; I181-K184 PolarHBondContact O-N 3.19Å; L182-K184 VanDerWaalsContact C-N 3.33Å; L182-K184 PolarHBondContact O-N 3.32Å; K184-F186 VanDerWaalsContact C-N 3.29Å; K184-F186 PolarHBondContact O-N 3.46Å; K184-V187 WeakPolarHBondContact O-CB 3.45Å; K184-V187 PolarHBondContact O-N 3.21Å; K184-V187 VanDerWaalsContact O-N 3.09Å; K184-E188 WeakPolarHBondContact CE-OE1 3.39Å; K184-E188 IonicContact NZ-OE1 3.98Å; K184-E188 PolarHBondContact O-N 2.64Å
185	N	90.6	Very high	80.6	Confident	10 Å²	10	50.7 Å²	50.7	5%	0.053	25%	0.249	C	C	.	.	H	α-helix	trans	-59.7	-40.7	176.9	-57.9	-17.4	0	0	0	111.4	S146 M149 T150 I181 L182 V187 E188 L189	S146-N185 WeakPolarHBondContact CA-ND2 3.33Å; S146-N185 WeakPolarHBondContact CB-ND2 3.4Å; S146-N185 PolarHBondContact OG-ND2 3.18Å; M149-N185 HydrophobicContact CB-CB 4.21Å; M149-N185 HydrophobicContact CE-CB 3.96Å; M149-N185 HydrophobicContact SD-CB 4.33Å; T150-N185 HydrophobicContact CG2-CB 4.12Å; T150-N185 WeakPolarHBondContact CG2-OD1 3.38Å; I181-N185 VanDerWaalsContact O-CG 3.26Å; I181-N185 PolarHBondContact O-N 3.46Å; I181-N185 PolarHBondContact O-OD1 3.11Å; L182-N185 WeakPolarHBondContact O-CB 3.17Å; L182-N185 PolarHBondContact O-N 2.79Å; N185-V187 VanDerWaalsContact C-N 3.34Å; N185-V187 PolarHBondContact O-N 3.36Å; N185-E188 PolarHBondContact O-N 3.2Å; N185-L189 VanDerWaalsContact O-CG 3.31Å; N185-L189 WeakPolarHBondContact O-CG 3.34Å; N185-L189 PolarHBondContact O-N 3.09Å
186	F	91.3	Very high	78.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.2	-41	174.5	-80.3	-67.7	0	0	0	112.7	M149 L164 L182 L183 K184 L189 I190 V226 R229 L230 F233	M149-F186 HydrophobicContact CE-CD1 4.3Å; M149-F186 HydrophobicContact CE-CE1 4.32Å; M149-F186 HydrophobicContact CE-CG 4.49Å; L164-F186 HydrophobicContact CD2-CE1 3.97Å; L164-F186 HydrophobicContact CD2-CZ 3.59Å; L182-F186 WeakPolarHBondContact O-CD2 3.37Å; L182-F186 PolarHBondContact O-N 3.49Å; L183-F186 PolarHBondContact O-N 3.32Å; K184-F186 VanDerWaalsContact C-N 3.29Å; K184-F186 PolarHBondContact O-N 3.46Å; F186-L189 PolarHBondContact O-N 3.31Å; F186-I190 WeakPolarHBondContact O-CD1 3.49Å; F186-I190 VanDerWaalsContact O-CG1 3.24Å; F186-I190 WeakPolarHBondContact O-CG1 3.28Å; F186-I190 PolarHBondContact O-N 3.33Å; F186-V226 HydrophobicContact CD1-CG1 3.87Å; F186-V226 HydrophobicContact CE1-CG1 4.5Å; F186-R229 HydrophobicContact CE1-CB 3.96Å; F186-R229 HydrophobicContact CZ-CB 4.3Å; F186-L230 HydrophobicContact CB-CD1 4.05Å; F186-L230 HydrophobicContact CB-CD2 4.47Å; F186-L230 HydrophobicContact CD1-CB 3.86Å; F186-L230 HydrophobicContact CD1-CD1 4.39Å; F186-L230 HydrophobicContact CD2-CD1 3.71Å; F186-L230 HydrophobicContact CE1-CB 3.95Å; F186-L230 HydrophobicContact CE2-CD1 4.15Å; F186-L230 HydrophobicContact CG-CB 4.18Å; F186-L230 HydrophobicContact CG-CD1 3.83Å; F186-L230 HydrophobicContact CG-CG 4.46Å; F186-L230 HydrophobicContact CZ-CB 4.33Å; F186-F233 HydrophobicContact CE2-CB 3.9Å; F186-F233 HydrophobicContact CE2-CD1 4.15Å; F186-F233 HydrophobicContact CE2-CD2 4.4Å; F186-F233 AromaticContact CE2-CG 3.87Å; F186-F233 HydrophobicContact CE2-CG 3.87Å; F186-F233 HydrophobicContact CZ-CB 4.07Å; F186-F233 HydrophobicContact CZ-CG 4.49Å
187	V	89	Confident	76.4	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.03	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-43.8	175.9	173.5	0	0	0	0	110.9	L183 K184 N185 L189 I190 S191 W207 F318 I321 I322 L325	L183-V187 WeakPolarHBondContact O-CG2 3.32Å; L183-V187 PolarHBondContact O-N 3.06Å; L183-V187 VanDerWaalsContact O-N 3.1Å; K184-V187 WeakPolarHBondContact O-CB 3.45Å; K184-V187 PolarHBondContact O-N 3.21Å; K184-V187 VanDerWaalsContact O-N 3.09Å; N185-V187 VanDerWaalsContact C-N 3.34Å; N185-V187 PolarHBondContact O-N 3.36Å; V187-L189 VanDerWaalsContact C-N 3.31Å; V187-L189 PolarHBondContact O-N 3.25Å; V187-I190 PolarHBondContact O-N 3.39Å; V187-S191 PolarHBondContact O-N 3.11Å; V187-S191 PolarHBondContact O-OG 3.42Å; V187-W207 HydrophobicContact CG1-CD2 3.91Å; V187-W207 HydrophobicContact CG1-CE3 3.8Å; V187-W207 HydrophobicContact CG1-CH2 3.96Å; V187-W207 HydrophobicContact CG1-CZ2 4.11Å; V187-W207 HydrophobicContact CG1-CZ3 3.8Å; V187-F318 HydrophobicContact CG2-CE2 3.8Å; V187-I321 HydrophobicContact CG1-CG2 3.72Å; V187-I321 HydrophobicContact CG2-CG2 4.13Å; V187-I322 HydrophobicContact CG2-CD1 4.28Å; V187-L325 HydrophobicContact CG1-CD1 3.99Å
188	E	87.2	Confident	74.6	Confident	63 Å²	63	67.6 Å²	67.6	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-29.4	177.4	-69.4	177.1	-171.9	0	0	113.2	T150 K184 N185 S191 W207	T150-E188 VanDerWaalsContact CG2-OE2 3.29Å; T150-E188 WeakPolarHBondContact CG2-OE2 3.35Å; K184-E188 WeakPolarHBondContact CE-OE1 3.39Å; K184-E188 IonicContact NZ-OE1 3.98Å; K184-E188 PolarHBondContact O-N 2.64Å; N185-E188 PolarHBondContact O-N 3.2Å; E188-S191 CarbonylContact C-O 3.6Å; E188-S191 WeakPolarHBondContact CA-O 3.38Å; E188-W207 HydrophobicContact CG-CH2 4.08Å; E188-W207 HydrophobicContact CG-CZ3 4.07Å
189	L	86.9	Confident	72.9	Confident	5 Å²	5	69.7 Å²	69.7	3%	0.026	34%	0.341	C	S	.	.	H	α-helix	trans	-74.6	-26.4	174	-72.6	-180	0	0	0	113.4	M149 Q157 L161 N185 F186 V187 T210 W222 V226	M149-L189 HydrophobicContact CB-CD1 4.4Å; M149-L189 HydrophobicContact CE-CD1 3.61Å; M149-L189 WeakPolarHBondContact O-CD2 3.5Å; Q157-L189 HydrophobicContact CB-CD2 4.19Å; Q157-L189 HydrophobicContact CG-CD2 4.32Å; L161-L189 HydrophobicContact CD2-CD1 3.93Å; N185-L189 VanDerWaalsContact O-CG 3.31Å; N185-L189 WeakPolarHBondContact O-CG 3.34Å; N185-L189 PolarHBondContact O-N 3.09Å; F186-L189 PolarHBondContact O-N 3.31Å; V187-L189 VanDerWaalsContact C-N 3.31Å; V187-L189 PolarHBondContact O-N 3.25Å; L189-T210 PolarHBondContact O-OG1 3.2Å; L189-W222 HydrophobicContact CD2-CZ2 4.1Å; L189-W222 PolarHBondContact O-NE1 3.09Å; L189-V226 HydrophobicContact CB-CG1 3.95Å; L189-V226 HydrophobicContact CB-CG2 4.22Å; L189-V226 HydrophobicContact CD1-CG1 4.45Å
190	I	84.9	Confident	70.9	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-91.8	-26.1	179	-62.4	162	0	0	0	111.5	F186 V187 L209 T210 V226 L227 L230 I322	F186-I190 WeakPolarHBondContact O-CD1 3.49Å; F186-I190 VanDerWaalsContact O-CG1 3.24Å; F186-I190 WeakPolarHBondContact O-CG1 3.28Å; F186-I190 PolarHBondContact O-N 3.33Å; V187-I190 PolarHBondContact O-N 3.39Å; I190-L209 HydrophobicContact CG2-CD2 3.93Å; I190-T210 PolarHBondContact O-N 2.89Å; I190-T210 VanDerWaalsContact O-N 3.09Å; I190-T210 PolarHBondContact O-OG1 3.23Å; I190-V226 HydrophobicContact CD1-CG1 4.1Å; I190-V226 HydrophobicContact CG1-CB 4.32Å; I190-V226 HydrophobicContact CG1-CG1 3.68Å; I190-L227 HydrophobicContact CD1-CD2 3.61Å; I190-L227 HydrophobicContact CG1-CD2 4.4Å; I190-L230 HydrophobicContact CD1-CD2 4.11Å; I190-I322 HydrophobicContact CD1-CD1 4.17Å
191	S	84.6	Confident	68.6	Low	0 Å²	0	82.5 Å²	82.5	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	158.4	-171	65	0	0	0	0	113.7	V187 E188 M208 T210 L325	V187-S191 PolarHBondContact O-N 3.11Å; V187-S191 PolarHBondContact O-OG 3.42Å; E188-S191 CarbonylContact C-O 3.6Å; E188-S191 WeakPolarHBondContact CA-O 3.38Å; S191-M208 CarbonylContact C-O 3.54Å; S191-M208 WeakPolarHBondContact CA-O 3.24Å; S191-M208 WeakPolarHBondContact CB-O 3.36Å; S191-T210 WeakPolarHBondContact CA-OG1 3.46Å; S191-T210 PolarHBondContact N-OG1 3.04Å; S191-L325 WeakPolarHBondContact OG-CD1 3.13Å
192	H	77.3	Confident	66.3	Low	124 Å²	124	90.3 Å²	90.3	57%	0.574	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	143.2	167.7	-70.1	-37.1	0	0	0	111.4	Q194 M208 T210	H192-Q194 PolarHBondContact O-N 3.43Å; H192-M208 PolarHBondContact N-O 2.99Å; H192-M208 PolarHBondContact O-N 2.91Å; H192-M208 VanDerWaalsContact O-N 3.17Å; H192-T210 WeakPolarHBondContact CD2-CG2 3.36Å; H192-T210 WeakPolarHBondContact CE1-CG2 3.42Å; H192-T210 WeakPolarHBondContact NE2-CG2 3.11Å
193	Q	70.4	Confident	64	Low	99 Å²	99	100.1 Å²	100.1	46%	0.463	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	119.2	176.9	-169.8	178.7	29.2	0	0	110	W207	Q193-W207 HydrophobicContact CB-CE3 4.09Å; Q193-W207 HydrophobicContact CB-CH2 4.15Å; Q193-W207 HydrophobicContact CB-CZ2 4.5Å; Q193-W207 HydrophobicContact CB-CZ3 3.93Å
194	Q	54.5	Low	62	Low	102 Å²	102	108.9 Å²	108.9	48%	0.477	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	119.7	170.8	-69.9	-151.9	-16	0	0	110.9	H192 S196 S206 M208	H192-Q194 PolarHBondContact O-N 3.43Å; Q194-S196 PolarHBondContact O-N 3.09Å; Q194-S206 PolarHBondContact N-O 3.04Å; Q194-M208 HydrophobicContact CG-CG 4.47Å; Q194-M208 HydrophobicContact CG-SD 4.22Å; Q194-M208 PolarHBondContact NE2-SD 3.43Å
195	L	46.2	Very low	60.3	Low	162 Å²	162	108.9 Å²	108.9	85%	0.848	52%	0.517	S	S	*	.			trans	-78.3	91	160.9	-77.1	157.5	0	0	0	107.7	K197	L195-K197 PolarHBondContact O-N 3.15Å
196	S	42.4	Very low	58.8	Low	86 Å²	86	110.9 Å²	110.9	60%	0.601	53%	0.532	S	S	*	.			trans	-67	98.5	176.1	60.8	0	0	0	0	109.9	Q194 R198	Q194-S196 PolarHBondContact O-N 3.09Å; S196-R198 PolarHBondContact O-N 3.13Å
197	K	40.2	Very low	57.9	Low	204 Å²	204	112.5 Å²	112.5	89%	0.887	54%	0.538	S	S	*	.			trans	-73.7	57.3	162.9	-76	-175.9	177.4	176.7	0	109.9	L195	L195-K197 PolarHBondContact O-N 3.15Å
198	R	38.1	Very low	57.3	Low	218 Å²	218	116.8 Å²	116.8	82%	0.823	56%	0.559	S	S	*	*	S	Bend	trans	-167.9	124.3	163.2	-119.6	172	-176.3	-175.1	0.5	113.2	S196	S196-R198 PolarHBondContact O-N 3.13Å
199	V	34.7	Very low	57	Low	129 Å²	129	115.3 Å²	115.3	78%	0.782	55%	0.553	S	S	*	*			trans	85.5	116	158.2	-167.7	0	0	0	0	116.7	S201	V199-S201 PolarHBondContact O-N 2.86Å; V199-S201 VanDerWaalsContact O-N 3.15Å
200	K	38.9	Very low	56.5	Low	214 Å²	214	115.9 Å²	115.9	93%	0.93	56%	0.556	S	S	*	*			trans	-67.7	92.9	171.8	-66.2	173.3	174.8	178.6	0	110.4
201	S	33.1	Very low	55.6	Low	103 Å²	103	121.4 Å²	121.4	72%	0.72	59%	0.59	S	S	*	*	S	Bend	trans	-159.6	124.8	145.1	72.5	0	0	0	0	109.8	V199	V199-S201 PolarHBondContact O-N 2.86Å; V199-S201 VanDerWaalsContact O-N 3.15Å
202	R	37.1	Very low	54.5	Low	245 Å²	245	122.5 Å²	122.5	93%	0.925	60%	0.596	S	S	*	*			trans	41.7	103.8	175.6	-105.7	177.4	174.6	171	-1.3	116.5	K204	R202-K204 PolarHBondContact O-N 3.37Å
203	E	40	Very low	53.3	Low	205 Å²	205	121.4 Å²	121.4	96%	0.958	60%	0.6	S	S	*	*			trans	-39.3	95.9	168.2	-65.1	167.1	173.5	0	0	112.5
204	K	47.3	Very low	52.6	Low	190 Å²	190	120.5 Å²	120.5	83%	0.826	60%	0.598	S	S	*	*			trans	-124	105.6	165.9	-125.3	-177.1	-178.8	-173.3	0	106.6	R202 S206	R202-K204 PolarHBondContact O-N 3.37Å; K204-S206 PolarHBondContact O-N 3.1Å; K204-S206 VanDerWaalsContact O-N 3.14Å
205	L	52.7	Low	52.7	Low	122 Å²	122	127.7 Å²	127.7	64%	0.639	62%	0.621	S	S	*	*			trans	-59.4	112.7	170.5	-69.3	167.7	0	0	0	108.1
206	S	58.2	Low	53.7	Low	52 Å²	52	129 Å²	129	36%	0.364	62%	0.62	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.7	114.5	177.3	59.8	0	0	0	0	109.9	Q194 K204	Q194-S206 PolarHBondContact N-O 3.04Å; K204-S206 PolarHBondContact O-N 3.1Å; K204-S206 VanDerWaalsContact O-N 3.14Å
207	W	72.2	Confident	55.3	Low	35 Å²	35	126.7 Å²	126.7	13%	0.133	60%	0.602	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.9	140.1	171.3	-64.9	85.9	0	0	0	109.4	V187 E188 Q193 I321 L325	V187-W207 HydrophobicContact CG1-CD2 3.91Å; V187-W207 HydrophobicContact CG1-CE3 3.8Å; V187-W207 HydrophobicContact CG1-CH2 3.96Å; V187-W207 HydrophobicContact CG1-CZ2 4.11Å; V187-W207 HydrophobicContact CG1-CZ3 3.8Å; E188-W207 HydrophobicContact CG-CH2 4.08Å; E188-W207 HydrophobicContact CG-CZ3 4.07Å; Q193-W207 HydrophobicContact CB-CE3 4.09Å; Q193-W207 HydrophobicContact CB-CH2 4.15Å; Q193-W207 HydrophobicContact CB-CZ2 4.5Å; Q193-W207 HydrophobicContact CB-CZ3 3.93Å; W207-I321 HydrophobicContact CG-CG2 4.4Å; W207-L325 HydrophobicContact CB-CD1 4.15Å; W207-L325 HydrophobicContact CB-CD2 3.83Å; W207-L325 HydrophobicContact CB-CG 4.3Å
208	M	76.4	Confident	57.3	Low	95 Å²	95	120.4 Å²	120.4	47%	0.468	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.2	145.1	175.1	-75.4	-173.8	62.7	0	0	110.5	S191 H192 Q194 T210	S191-M208 CarbonylContact C-O 3.54Å; S191-M208 WeakPolarHBondContact CA-O 3.24Å; S191-M208 WeakPolarHBondContact CB-O 3.36Å; H192-M208 PolarHBondContact N-O 2.99Å; H192-M208 PolarHBondContact O-N 2.91Å; H192-M208 VanDerWaalsContact O-N 3.17Å; Q194-M208 HydrophobicContact CG-CG 4.47Å; Q194-M208 HydrophobicContact CG-SD 4.22Å; Q194-M208 PolarHBondContact NE2-SD 3.43Å; M208-T210 PolarHBondContact O-N 3.41Å
209	L	81.6	Confident	59.5	Low	31 Å²	31	111 Å²	111	16%	0.162	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	137.3	178.8	-66.5	-178.2	0	0	0	113.2	I190 V211 L325 E328 C329 E332	I190-L209 HydrophobicContact CG2-CD2 3.93Å; L209-V211 PolarHBondContact O-N 3.06Å; L209-L325 HydrophobicContact CD2-CD2 4.3Å; L209-E328 HydrophobicContact CD1-CB 3.66Å; L209-E328 HydrophobicContact CD2-CB 4.38Å; L209-E328 HydrophobicContact CG-CB 3.89Å; L209-E328 WeakPolarHBondContact CG-OE2 3.43Å; L209-C329 VanDerWaalsContact CD2-SG 3.52Å; L209-E332 WeakPolarHBondContact CD1-OE2 3.5Å
210	T	74.9	Confident	61.8	Low	17 Å²	17	107.8 Å²	107.8	10%	0.104	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-71.3	124.8	174.8	-15.2	0	0	0	0	110.2	L189 I190 S191 H192 M208	L189-T210 PolarHBondContact O-OG1 3.2Å; I190-T210 PolarHBondContact O-N 2.89Å; I190-T210 VanDerWaalsContact O-N 3.09Å; I190-T210 PolarHBondContact O-OG1 3.23Å; S191-T210 WeakPolarHBondContact CA-OG1 3.46Å; S191-T210 PolarHBondContact N-OG1 3.04Å; H192-T210 WeakPolarHBondContact CD2-CG2 3.36Å; H192-T210 WeakPolarHBondContact CE1-CG2 3.42Å; H192-T210 WeakPolarHBondContact NE2-CG2 3.11Å; M208-T210 PolarHBondContact O-N 3.41Å
211	V	65.8	Low	64	Low	116 Å²	116	100.9 Å²	100.9	70%	0.703	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-87.4	116.9	167.2	-178.5	0	0	0	0	107	L209 P213	L209-V211 PolarHBondContact O-N 3.06Å; V211-P213 VanDerWaalsContact O-CD 3.26Å; V211-P213 WeakPolarHBondContact O-CD 3.35Å
212	N	63.4	Low	66.6	Low	24 Å²	24	96.7 Å²	96.7	13%	0.128	46%	0.464	C	S	.	.			trans	-86.4	111.5	177.6	-170.8	-19.7	0	0	0	109.2	E154 N214 S219	E154-N212 PolarHBondContact OE2-OD1 3.39Å; N212-N214 VanDerWaalsContact C-N 3.29Å; N212-N214 PolarHBondContact O-N 3.44Å; N212-N214 WeakPolarHBondContact OD1-CB 3.44Å; N212-N214 PolarHBondContact OD1-N 3.41Å; N212-S219 PolarHBondContact N-OG 3.43Å; N212-S219 VanDerWaalsContact N-OG 3.09Å
213	P	50.5	Low	69.1	Low	101 Å²	101	85 Å²	85	66%	0.656	42%	0.42	S	S	*	.			trans	-82.7	-3.9	-178.6	33.3	-32.5	0	0	0	113.3	V211 R215	V211-P213 VanDerWaalsContact O-CD 3.26Å; V211-P213 WeakPolarHBondContact O-CD 3.35Å; P213-R215 PolarHBondContact O-N 2.86Å
214	N	55.5	Low	71.4	Confident	80 Å²	80	75.9 Å²	75.9	43%	0.428	38%	0.378	S	S	.	.			trans	-73.2	126.8	-173.9	-132.1	-23.5	0	0	0	111.3	E154 N212 K216	E154-N214 WeakPolarHBondContact OE2-CB 3.43Å; E154-N214 PolarHBondContact OE2-ND2 3.3Å; N212-N214 VanDerWaalsContact C-N 3.29Å; N212-N214 PolarHBondContact O-N 3.44Å; N212-N214 WeakPolarHBondContact OD1-CB 3.44Å; N212-N214 PolarHBondContact OD1-N 3.41Å; N214-K216 PolarHBondContact O-N 3.46Å
215	R	58.5	Low	73.5	Confident	253 Å²	253	69.6 Å²	69.6	96%	0.955	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-4.1	-168.2	-64.3	-176.8	179.7	-177	-0.2	115.8	P213	P213-R215 PolarHBondContact O-N 2.86Å
216	K	65.6	Low	75.3	Confident	189 Å²	189	63.8 Å²	63.8	82%	0.822	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-31.3	-172.2	-68.3	-173.9	-178.7	178.3	0	114.3	N214	N214-K216 PolarHBondContact O-N 3.46Å
217	V	76.6	Confident	77	Confident	37 Å²	37	61.3 Å²	61.3	22%	0.224	31%	0.305	C	S	.	.	S	Bend	trans	-142.1	138.8	-172	-176.7	0	0	0	0	108.4	Q221	V217-Q221 HydrophobicContact CG1-CB 3.31Å
218	T	82.9	Confident	78	Confident	72 Å²	72	62 Å²	62	44%	0.442	31%	0.311	S	S	.	.			trans	-71.4	156	177.3	66.2	0	0	0	0	111.3	Q220 Q221 W222	T218-Q220 PolarHBondContact O-N 3.23Å; T218-Q220 VanDerWaalsContact O-N 3.15Å; T218-Q221 PolarHBondContact O-N 3.18Å; T218-Q221 WeakPolarHBondContact OG1-CB 3.04Å; T218-Q221 WeakPolarHBondContact OG1-CG 3.45Å; T218-Q221 PolarHBondContact OG1-N 3.2Å; T218-Q221 VanDerWaalsContact OG1-N 3.17Å; T218-W222 PolarHBondContact O-N 2.92Å
219	S	83.1	Confident	78.8	Confident	22 Å²	22	59.3 Å²	59.3	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-53.7	-34	173.3	-56.2	0	0	0	0	112.7	N212 R223	N212-S219 PolarHBondContact N-OG 3.43Å; N212-S219 VanDerWaalsContact N-OG 3.09Å; S219-R223 WeakPolarHBondContact O-CG 3.21Å; S219-R223 PolarHBondContact O-N 3.46Å; S219-R223 VanDerWaalsContact O-N 3.15Å; S219-R223 PolarHBondContact O-NE 3.33Å
220	Q	83.8	Confident	79.5	Confident	60 Å²	60	57.8 Å²	57.8	28%	0.28	29%	0.288	S	S	.	.	H	α-helix	trans	-65.5	-47.9	173.7	-74.6	176.9	-13.6	0	0	112.9	T218 R223 L224 E332 L353	T218-Q220 PolarHBondContact O-N 3.23Å; T218-Q220 VanDerWaalsContact O-N 3.15Å; Q220-R223 PolarHBondContact O-N 2.97Å; Q220-L224 WeakPolarHBondContact O-CB 3.29Å; Q220-L224 PolarHBondContact O-N 2.85Å; Q220-E332 HydrophobicContact CG-CG 4.28Å; Q220-E332 WeakPolarHBondContact CG-OE1 3.4Å; Q220-E332 PolarHBondContact NE2-O 2.77Å; Q220-L353 HydrophobicContact CB-CD2 4.39Å; Q220-L353 HydrophobicContact CG-CD2 4.36Å
221	Q	85.1	Confident	80.4	Confident	69 Å²	69	60.2 Å²	60.2	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-68	-35.6	179.3	-74	171.5	-12.1	0	0	112.1	V217 T218 L224 N225 D349	V217-Q221 HydrophobicContact CG1-CB 3.31Å; T218-Q221 PolarHBondContact O-N 3.18Å; T218-Q221 WeakPolarHBondContact OG1-CB 3.04Å; T218-Q221 WeakPolarHBondContact OG1-CG 3.45Å; T218-Q221 PolarHBondContact OG1-N 3.2Å; T218-Q221 VanDerWaalsContact OG1-N 3.17Å; Q221-L224 PolarHBondContact O-N 3.02Å; Q221-N225 VanDerWaalsContact O-CG 3.29Å; Q221-N225 PolarHBondContact O-N 3.04Å; Q221-N225 PolarHBondContact O-ND2 3.36Å; Q221-D349 PolarHBondContact NE2-OD2 2.88Å
222	W	87.9	Confident	81.7	Confident	16 Å²	16	59.5 Å²	59.5	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-52.1	171.6	173.6	-103.9	0	0	0	111.3	Q157 E158 L161 L189 T218 L224 N225 V226	Q157-W222 HydrophobicContact CB-CH2 4.19Å; E158-W222 HydrophobicContact CB-CH2 4.39Å; E158-W222 HydrophobicContact CB-CZ3 3.96Å; E158-W222 HydrophobicContact CG-CZ3 4.18Å; L161-W222 HydrophobicContact CD1-CH2 4.33Å; L161-W222 HydrophobicContact CD1-CZ3 4.5Å; L189-W222 HydrophobicContact CD2-CZ2 4.1Å; L189-W222 PolarHBondContact O-NE1 3.09Å; T218-W222 PolarHBondContact O-N 2.92Å; W222-L224 VanDerWaalsContact C-N 3.33Å; W222-L224 PolarHBondContact O-N 3.25Å; W222-N225 WeakPolarHBondContact O-CB 3.34Å; W222-N225 PolarHBondContact O-N 3.31Å; W222-N225 VanDerWaalsContact O-N 3.11Å; W222-V226 HydrophobicContact CD2-CG2 4.37Å; W222-V226 HydrophobicContact CZ2-CG2 4.2Å; W222-V226 WeakPolarHBondContact O-CG2 3.24Å; W222-V226 PolarHBondContact O-N 3.1Å
223	R	89.1	Confident	83.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-38.8	179.2	-72.4	175.8	-61.3	120.7	9.1	111.9	S219 Q220 N225 V226 L227 C329 E332 L353	S219-R223 WeakPolarHBondContact O-CG 3.21Å; S219-R223 PolarHBondContact O-N 3.46Å; S219-R223 VanDerWaalsContact O-N 3.15Å; S219-R223 PolarHBondContact O-NE 3.33Å; Q220-R223 PolarHBondContact O-N 2.97Å; R223-N225 VanDerWaalsContact C-N 3.3Å; R223-N225 PolarHBondContact O-N 2.95Å; R223-V226 PolarHBondContact O-N 3.41Å; R223-L227 WeakPolarHBondContact O-CB 3.42Å; R223-L227 WeakPolarHBondContact O-CG 3.41Å; R223-L227 PolarHBondContact O-N 2.73Å; R223-C329 VanDerWaalsContact NH1-CA 3.26Å; R223-C329 PolarHBondContact NH1-SG 3.48Å; R223-E332 IonicContact CZ-OE1 2.67Å; R223-E332 IonicContact CZ-OE2 3.59Å; R223-E332 IonicContact NE-OE2 3.95Å; R223-E332 PolarHBondContact NE-OE2 3.16Å; R223-E332 IonicContact NH1-OE2 3.87Å; R223-E332 PolarHBondContact NH1-OE2 3.22Å; R223-E332 IonicContact NH2-OE1 3.56Å; R223-E332 PolarHBondContact NH2-OE1 3.43Å; R223-E332 IonicContact NH2-OE2 2.72Å; R223-E332 PolarHBondContact NH2-OE2 2.88Å; R223-L353 HydrophobicContact CB-CD1 4.46Å
224	L	89.3	Confident	85.1	Confident	13 Å²	13	53.6 Å²	53.6	7%	0.068	25%	0.247	C	C	.	.	H	α-helix	trans	-55.2	-47.7	172.1	177.3	60.2	0	0	0	110.9	Q220 Q221 W222 V226 L227 I228 Q352 L353 Q356	Q220-L224 WeakPolarHBondContact O-CB 3.29Å; Q220-L224 PolarHBondContact O-N 2.85Å; Q221-L224 PolarHBondContact O-N 3.02Å; W222-L224 VanDerWaalsContact C-N 3.33Å; W222-L224 PolarHBondContact O-N 3.25Å; L224-V226 VanDerWaalsContact C-N 3.35Å; L224-V226 PolarHBondContact O-N 2.97Å; L224-L227 PolarHBondContact O-N 3.09Å; L224-I228 HydrophobicContact CD1-CD1 3.93Å; L224-I228 HydrophobicContact CD1-CG1 4.13Å; L224-I228 HydrophobicContact CG-CD1 3.96Å; L224-I228 VanDerWaalsContact O-CG1 3.24Å; L224-I228 WeakPolarHBondContact O-CG1 3.43Å; L224-I228 PolarHBondContact O-N 3.17Å; L224-Q352 HydrophobicContact CD1-CB 4.01Å; L224-Q352 HydrophobicContact CD2-CB 4.1Å; L224-L353 HydrophobicContact CB-CD1 4.13Å; L224-L353 HydrophobicContact CD1-CB 4.44Å; L224-Q356 HydrophobicContact CD1-CG 3.77Å
225	N	89.9	Confident	86.8	Confident	57 Å²	57	52.9 Å²	52.9	31%	0.305	24%	0.241	S	C	.	.	H	α-helix	trans	-61.1	-40.2	178.6	-74.6	-26.7	0	0	0	113.1	Q221 W222 R223 R229	Q221-N225 VanDerWaalsContact O-CG 3.29Å; Q221-N225 PolarHBondContact O-N 3.04Å; Q221-N225 PolarHBondContact O-ND2 3.36Å; W222-N225 WeakPolarHBondContact O-CB 3.34Å; W222-N225 PolarHBondContact O-N 3.31Å; W222-N225 VanDerWaalsContact O-N 3.11Å; R223-N225 VanDerWaalsContact C-N 3.3Å; R223-N225 PolarHBondContact O-N 2.95Å; N225-R229 PolarHBondContact O-NH1 3.19Å
226	V	91.9	Very high	88.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.8	-46.5	177.7	-179.5	0	0	0	0	110.8	L161 F186 L189 I190 W222 R223 L224 I228 R229 L230	L161-V226 HydrophobicContact CD1-CG2 4.13Å; F186-V226 HydrophobicContact CD1-CG1 3.87Å; F186-V226 HydrophobicContact CE1-CG1 4.5Å; L189-V226 HydrophobicContact CB-CG1 3.95Å; L189-V226 HydrophobicContact CB-CG2 4.22Å; L189-V226 HydrophobicContact CD1-CG1 4.45Å; I190-V226 HydrophobicContact CD1-CG1 4.1Å; I190-V226 HydrophobicContact CG1-CB 4.32Å; I190-V226 HydrophobicContact CG1-CG1 3.68Å; W222-V226 HydrophobicContact CD2-CG2 4.37Å; W222-V226 HydrophobicContact CZ2-CG2 4.2Å; W222-V226 WeakPolarHBondContact O-CG2 3.24Å; W222-V226 PolarHBondContact O-N 3.1Å; R223-V226 PolarHBondContact O-N 3.41Å; L224-V226 VanDerWaalsContact C-N 3.35Å; L224-V226 PolarHBondContact O-N 2.97Å; V226-I228 PolarHBondContact O-N 3.49Å; V226-R229 PolarHBondContact O-N 3.41Å; V226-R229 VanDerWaalsContact O-N 3.1Å; V226-L230 PolarHBondContact O-N 3Å
227	L	93.1	Very high	89.4	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-35.3	-178.4	-67.9	176.3	0	0	0	112.8	I190 R223 L224 R229 L230 K231 L326 L353 Q356 V357 I360	I190-L227 HydrophobicContact CD1-CD2 3.61Å; I190-L227 HydrophobicContact CG1-CD2 4.4Å; R223-L227 WeakPolarHBondContact O-CB 3.42Å; R223-L227 WeakPolarHBondContact O-CG 3.41Å; R223-L227 PolarHBondContact O-N 2.73Å; L224-L227 PolarHBondContact O-N 3.09Å; L227-R229 VanDerWaalsContact C-N 3.25Å; L227-R229 PolarHBondContact O-N 3.2Å; L227-L230 HydrophobicContact CD2-CD2 4.29Å; L227-L230 PolarHBondContact O-N 3.5Å; L227-K231 WeakPolarHBondContact O-CB 3.46Å; L227-K231 PolarHBondContact O-N 3.28Å; L227-L326 HydrophobicContact CD1-CD2 4.35Å; L227-L326 HydrophobicContact CD2-CD2 3.58Å; L227-L353 HydrophobicContact CD1-CD1 3.68Å; L227-Q356 HydrophobicContact CB-CB 3.88Å; L227-Q356 HydrophobicContact CB-CG 4.46Å; L227-V357 HydrophobicContact CD1-CG2 4.21Å; L227-I360 HydrophobicContact CB-CD1 3.9Å; L227-I360 HydrophobicContact CD2-CD1 3.5Å; L227-I360 VanDerWaalsContact CD2-CD1 3.5Å; L227-I360 HydrophobicContact CG-CD1 4.23Å
228	I	93.2	Very high	89.8	Confident	49 Å²	49	31.8 Å²	31.8	25%	0.251	16%	0.158	S	C	.	.	H	α-helix	trans	-57	-42.7	172.2	-73.1	167.9	0	0	0	110.6	L224 V226 K232 Q356	L224-I228 HydrophobicContact CD1-CD1 3.93Å; L224-I228 HydrophobicContact CD1-CG1 4.13Å; L224-I228 HydrophobicContact CG-CD1 3.96Å; L224-I228 VanDerWaalsContact O-CG1 3.24Å; L224-I228 WeakPolarHBondContact O-CG1 3.43Å; L224-I228 PolarHBondContact O-N 3.17Å; V226-I228 PolarHBondContact O-N 3.49Å; I228-K232 WeakPolarHBondContact O-CG 3.35Å; I228-K232 PolarHBondContact O-N 3.19Å; I228-K232 VanDerWaalsContact O-N 3.08Å; I228-Q356 HydrophobicContact CG1-CG 3.76Å
229	R	93.9	Very high	89.8	Confident	39 Å²	39	32.4 Å²	32.4	15%	0.147	16%	0.159	C	C	.	.	H	α-helix	trans	-76.4	-38.3	-179	-71.1	170.3	178.6	86.3	-2.9	112.1	L161 L164 D165 F186 N225 V226 L227 K231 K232 F233	L161-R229 PolarHBondContact O-NE 2.91Å; L164-R229 HydrophobicContact CD2-CB 4.13Å; D165-R229 IonicContact OD1-NE 2.77Å; D165-R229 PolarHBondContact OD1-NE 2.69Å; D165-R229 IonicContact OD2-CZ 3.19Å; D165-R229 IonicContact OD2-NE 3.24Å; D165-R229 PolarHBondContact OD2-NE 3.27Å; D165-R229 IonicContact OD2-NH2 2.68Å; D165-R229 PolarHBondContact OD2-NH2 3.44Å; F186-R229 HydrophobicContact CE1-CB 3.96Å; F186-R229 HydrophobicContact CZ-CB 4.3Å; N225-R229 PolarHBondContact O-NH1 3.19Å; V226-R229 PolarHBondContact O-N 3.41Å; V226-R229 VanDerWaalsContact O-N 3.1Å; L227-R229 VanDerWaalsContact C-N 3.25Å; L227-R229 PolarHBondContact O-N 3.2Å; R229-K231 VanDerWaalsContact C-N 3.32Å; R229-K231 PolarHBondContact O-N 3.19Å; R229-K232 PolarHBondContact O-N 2.91Å; R229-F233 WeakPolarHBondContact O-CB 3.35Å; R229-F233 PolarHBondContact O-N 3.36Å
230	L	94.7	Very high	89.1	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.7	-43.5	171.5	177.2	57.5	0	0	0	111.1	L183 F186 I190 V226 L227 F233 L234 I322 I360	L183-L230 HydrophobicContact CD2-CD1 3.9Å; F186-L230 HydrophobicContact CB-CD1 4.05Å; F186-L230 HydrophobicContact CB-CD2 4.47Å; F186-L230 HydrophobicContact CD1-CB 3.86Å; F186-L230 HydrophobicContact CD1-CD1 4.39Å; F186-L230 HydrophobicContact CD2-CD1 3.71Å; F186-L230 HydrophobicContact CE1-CB 3.95Å; F186-L230 HydrophobicContact CE2-CD1 4.15Å; F186-L230 HydrophobicContact CG-CB 4.18Å; F186-L230 HydrophobicContact CG-CD1 3.83Å; F186-L230 HydrophobicContact CG-CG 4.46Å; F186-L230 HydrophobicContact CZ-CB 4.33Å; I190-L230 HydrophobicContact CD1-CD2 4.11Å; V226-L230 PolarHBondContact O-N 3Å; L227-L230 HydrophobicContact CD2-CD2 4.29Å; L227-L230 PolarHBondContact O-N 3.5Å; L230-F233 PolarHBondContact O-N 2.67Å; L230-L234 HydrophobicContact CD1-CD1 3.96Å; L230-L234 HydrophobicContact CD1-CG 4.05Å; L230-L234 HydrophobicContact CG-CD1 4Å; L230-L234 WeakPolarHBondContact O-CB 3.21Å; L230-L234 WeakPolarHBondContact O-CG 3.33Å; L230-L234 PolarHBondContact O-N 3.16Å; L230-I322 HydrophobicContact CD2-CD1 4.14Å; L230-I322 HydrophobicContact CD2-CG1 4.46Å; L230-I360 HydrophobicContact CB-CD1 4.38Å; L230-I360 HydrophobicContact CD2-CD1 4.03Å; L230-I360 HydrophobicContact CG-CD1 4.21Å
231	K	94.6	Very high	87.8	Confident	68 Å²	68	32.9 Å²	32.9	30%	0.296	18%	0.178	S	C	.	.	H	α-helix	trans	-58.1	-50.4	173.3	178.5	-160.4	163.9	-174.9	0	111.2	L227 R229 F233 L234 Q235 I360 L363	L227-K231 WeakPolarHBondContact O-CB 3.46Å; L227-K231 PolarHBondContact O-N 3.28Å; R229-K231 VanDerWaalsContact C-N 3.32Å; R229-K231 PolarHBondContact O-N 3.19Å; K231-F233 VanDerWaalsContact C-N 3.28Å; K231-F233 PolarHBondContact O-N 2.74Å; K231-L234 PolarHBondContact O-N 3.37Å; K231-Q235 WeakPolarHBondContact O-CB 3.48Å; K231-Q235 PolarHBondContact O-N 3.2Å; K231-I360 HydrophobicContact CB-CG1 4.03Å; K231-L363 HydrophobicContact CG-CD1 3.81Å; K231-L363 WeakPolarHBondContact O-CD1 3.39Å
232	K	93.6	Very high	86	Confident	101 Å²	101	31.3 Å²	31.3	44%	0.439	18%	0.175	S	C	.	.	H	α-helix	trans	-58.4	-42.3	177.9	-73.3	178.7	-176	179.4	0	111.5	D165 L168 I228 R229 Q235 A236	D165-K232 IonicContact OD1-NZ 2.85Å; D165-K232 PolarHBondContact OD1-NZ 3.42Å; D165-K232 VanDerWaalsContact OD1-NZ 3.13Å; L168-K232 HydrophobicContact CD1-CB 4.08Å; I228-K232 WeakPolarHBondContact O-CG 3.35Å; I228-K232 PolarHBondContact O-N 3.19Å; I228-K232 VanDerWaalsContact O-N 3.08Å; R229-K232 PolarHBondContact O-N 2.91Å; K232-Q235 PolarHBondContact O-N 3.17Å; K232-A236 PolarHBondContact O-N 2.89Å
233	F	93.1	Very high	83.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.5	-50.7	177.2	-179.3	-93.4	0	0	0	111.8	L168 L175 L182 L183 F186 R229 L230 K231 Q235 A236 V237	L168-F233 HydrophobicContact CD1-CB 4.49Å; L168-F233 HydrophobicContact CD2-CB 4.21Å; L168-F233 HydrophobicContact CD2-CD2 4.07Å; L175-F233 HydrophobicContact CD2-CD2 4.07Å; L175-F233 HydrophobicContact CD2-CE2 4.23Å; L175-F233 HydrophobicContact CG-CD2 4.45Å; L175-F233 HydrophobicContact CG-CE2 4.11Å; L182-F233 HydrophobicContact CB-CE2 4.34Å; L182-F233 HydrophobicContact CB-CZ 4.27Å; L182-F233 HydrophobicContact CD1-CD2 4.46Å; L182-F233 HydrophobicContact CD1-CE2 3.7Å; L182-F233 HydrophobicContact CD1-CZ 4.24Å; L183-F233 HydrophobicContact CD2-CD1 3.98Å; L183-F233 HydrophobicContact CD2-CE1 3.85Å; L183-F233 HydrophobicContact CG-CE1 3.95Å; F186-F233 HydrophobicContact CE2-CB 3.9Å; F186-F233 HydrophobicContact CE2-CD1 4.15Å; F186-F233 HydrophobicContact CE2-CD2 4.4Å; F186-F233 AromaticContact CE2-CG 3.87Å; F186-F233 HydrophobicContact CE2-CG 3.87Å; F186-F233 HydrophobicContact CZ-CB 4.07Å; F186-F233 HydrophobicContact CZ-CG 4.49Å; R229-F233 WeakPolarHBondContact O-CB 3.35Å; R229-F233 PolarHBondContact O-N 3.36Å; L230-F233 PolarHBondContact O-N 2.67Å; K231-F233 VanDerWaalsContact C-N 3.28Å; K231-F233 PolarHBondContact O-N 2.74Å; F233-Q235 VanDerWaalsContact C-N 3.3Å; F233-Q235 PolarHBondContact O-N 3.05Å; F233-A236 WeakPolarHBondContact O-CB 3.15Å; F233-A236 PolarHBondContact O-N 2.85Å; F233-A236 VanDerWaalsContact O-N 3.14Å; F233-V237 HydrophobicContact CD1-CG2 4.23Å; F233-V237 HydrophobicContact CE1-CG2 3.75Å; F233-V237 HydrophobicContact CZ-CG2 4.05Å; F233-V237 WeakPolarHBondContact O-CG2 3.48Å; F233-V237 PolarHBondContact O-N 3.39Å
234	L	92	Very high	81	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-35.5	177	-72	169	0	0	0	112.4	L183 L230 K231 V237 V238 L309 I360 L363 L364 L367	L183-L234 HydrophobicContact CD2-CD2 3.98Å; L230-L234 HydrophobicContact CD1-CD1 3.96Å; L230-L234 HydrophobicContact CD1-CG 4.05Å; L230-L234 HydrophobicContact CG-CD1 4Å; L230-L234 WeakPolarHBondContact O-CB 3.21Å; L230-L234 WeakPolarHBondContact O-CG 3.33Å; L230-L234 PolarHBondContact O-N 3.16Å; K231-L234 PolarHBondContact O-N 3.37Å; L234-V237 WeakPolarHBondContact O-CB 3.42Å; L234-V237 PolarHBondContact O-N 3.38Å; L234-V238 WeakPolarHBondContact O-CG2 3.49Å; L234-V238 PolarHBondContact O-N 3.02Å; L234-L309 HydrophobicContact CD2-CD1 3.75Å; L234-I360 HydrophobicContact CD1-CG2 3.74Å; L234-L363 HydrophobicContact CB-CB 4.29Å; L234-L363 HydrophobicContact CB-CD1 3.99Å; L234-L364 HydrophobicContact CD1-CD2 4.33Å; L234-L364 HydrophobicContact CD2-CD2 4.29Å; L234-L367 HydrophobicContact CD2-CD1 4.45Å
235	Q	91.9	Very high	78.4	Confident	65 Å²	65	53.2 Å²	53.2	30%	0.304	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-45	172.9	-175.5	69.1	62.3	0	0	110.8	K231 K232 F233 V237 V238 D239 L363	K231-Q235 WeakPolarHBondContact O-CB 3.48Å; K231-Q235 PolarHBondContact O-N 3.2Å; K232-Q235 PolarHBondContact O-N 3.17Å; F233-Q235 VanDerWaalsContact C-N 3.3Å; F233-Q235 PolarHBondContact O-N 3.05Å; Q235-V237 VanDerWaalsContact C-N 3.31Å; Q235-V237 PolarHBondContact O-N 3.15Å; Q235-V238 PolarHBondContact O-N 3.08Å; Q235-D239 PolarHBondContact NE2-OD1 2.97Å; Q235-D239 PolarHBondContact NE2-OD2 3.41Å; Q235-D239 WeakPolarHBondContact O-CB 3.43Å; Q235-D239 PolarHBondContact O-N 3.49Å; Q235-L363 HydrophobicContact CB-CD1 4.27Å
236	A	89.4	Confident	75.5	Confident	14 Å²	14	55.7 Å²	55.7	12%	0.116	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-38.4	174.5	0	0	0	0	0	112.3	L168 P172 T176 K232 F233 D239 G240	L168-A236 HydrophobicContact CD2-CB 4.39Å; P172-A236 HydrophobicContact CB-CB 4.02Å; T176-A236 HydrophobicContact CG2-CB 3.89Å; K232-A236 PolarHBondContact O-N 2.89Å; F233-A236 WeakPolarHBondContact O-CB 3.15Å; F233-A236 PolarHBondContact O-N 2.85Å; F233-A236 VanDerWaalsContact O-N 3.14Å; A236-D239 PolarHBondContact O-N 3.25Å; A236-G240 PolarHBondContact O-N 2.86Å
237	V	87.9	Confident	72.9	Confident	18 Å²	18	63.1 Å²	63.1	11%	0.109	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-42.6	174.2	176.3	0	0	0	0	111.1	T176 F233 L234 Q235 S241 L309 L367	T176-V237 HydrophobicContact CG2-CB 4.32Å; T176-V237 HydrophobicContact CG2-CG2 3.61Å; F233-V237 HydrophobicContact CD1-CG2 4.23Å; F233-V237 HydrophobicContact CE1-CG2 3.75Å; F233-V237 HydrophobicContact CZ-CG2 4.05Å; F233-V237 WeakPolarHBondContact O-CG2 3.48Å; F233-V237 PolarHBondContact O-N 3.39Å; L234-V237 WeakPolarHBondContact O-CB 3.42Å; L234-V237 PolarHBondContact O-N 3.38Å; Q235-V237 VanDerWaalsContact C-N 3.31Å; Q235-V237 PolarHBondContact O-N 3.15Å; V237-S241 VanDerWaalsContact O-CB 3.24Å; V237-S241 WeakPolarHBondContact O-CB 3.36Å; V237-S241 PolarHBondContact O-OG 2.83Å; V237-L309 HydrophobicContact CG1-CB 4.47Å; V237-L309 HydrophobicContact CG1-CD1 4.33Å; V237-L367 HydrophobicContact CG1-CD2 4.27Å
238	V	85.6	Confident	70.1	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.024	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-50.2	176.5	169.5	0	0	0	0	110.6	L234 Q235 S241 S242 L363 K366 L367	L234-V238 WeakPolarHBondContact O-CG2 3.49Å; L234-V238 PolarHBondContact O-N 3.02Å; Q235-V238 PolarHBondContact O-N 3.08Å; V238-S241 WeakPolarHBondContact O-CB 3.49Å; V238-S241 PolarHBondContact O-N 3.36Å; V238-S241 PolarHBondContact O-OG 2.91Å; V238-S242 WeakPolarHBondContact O-CB 3.44Å; V238-S242 PolarHBondContact O-N 2.85Å; V238-L363 HydrophobicContact CG2-CD2 4.13Å; V238-K366 HydrophobicContact CG1-CD 3.73Å; V238-K366 HydrophobicContact CG1-CG 4.18Å; V238-L367 HydrophobicContact CG2-CD1 4.37Å; V238-L367 HydrophobicContact CG2-CD2 3.6Å; V238-L367 HydrophobicContact CG2-CG 3.73Å
239	D	82.8	Confident	67.5	Low	86 Å²	86	62.5 Å²	62.5	46%	0.46	33%	0.333	S	S	.	.	H	α-helix	trans	-67.5	-44.9	-173.8	-65.3	-14.6	0	0	0	112	Q235 A236 S241 S242	Q235-D239 PolarHBondContact NE2-OD1 2.97Å; Q235-D239 PolarHBondContact NE2-OD2 3.41Å; Q235-D239 WeakPolarHBondContact O-CB 3.43Å; Q235-D239 PolarHBondContact O-N 3.49Å; A236-D239 PolarHBondContact O-N 3.25Å; D239-S241 PolarHBondContact O-N 3.35Å; D239-S242 PolarHBondContact O-N 3Å; D239-S242 VanDerWaalsContact O-N 3.08Å
240	G	67.4	Low	64.5	Low	63 Å²	63	66.6 Å²	66.6	65%	0.649	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.3	175.9	0	0	0	0	0	113.9	A236	A236-G240 PolarHBondContact O-N 2.86Å
241	S	56.9	Low	61.5	Low	28 Å²	28	72.3 Å²	72.3	20%	0.196	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-9	-179.2	91.5	0	0	0	0	113.4	V237 V238 D239 R370	V237-S241 VanDerWaalsContact O-CB 3.24Å; V237-S241 WeakPolarHBondContact O-CB 3.36Å; V237-S241 PolarHBondContact O-OG 2.83Å; V238-S241 WeakPolarHBondContact O-CB 3.49Å; V238-S241 PolarHBondContact O-N 3.36Å; V238-S241 PolarHBondContact O-OG 2.91Å; D239-S241 PolarHBondContact O-N 3.35Å; S241-R370 PolarHBondContact O-NE 2.87Å; S241-R370 PolarHBondContact O-NH2 3.19Å; S241-R370 PolarHBondContact OG-NH1 3.46Å
242	S	47.3	Very low	58.3	Low	37 Å²	37	74.7 Å²	74.7	26%	0.259	39%	0.392	S	S	.	.			trans	-117.9	61.9	-174.6	-175.7	0	0	0	0	110.9	V238 D239 L244	V238-S242 WeakPolarHBondContact O-CB 3.44Å; V238-S242 PolarHBondContact O-N 2.85Å; D239-S242 PolarHBondContact O-N 3Å; D239-S242 VanDerWaalsContact O-N 3.08Å; S242-L244 PolarHBondContact O-N 3.17Å; S242-L244 VanDerWaalsContact O-N 3.16Å; S242-L244 PolarHBondContact OG-O 3.41Å
243	E	34.9	Very low	55.1	Low	192 Å²	192	79 Å²	79	90%	0.897	41%	0.411	S	S	*	.	S	Bend	trans	-65.1	-6.2	162.5	-80.1	-159.8	151.8	0	0	112.7
244	L	37	Very low	52	Low	150 Å²	150	83.1 Å²	83.1	79%	0.785	43%	0.433	S	S	*	.	S	Bend	trans	-145.7	131.4	174.1	-65	167.6	0	0	0	109.9	S242	S242-L244 PolarHBondContact O-N 3.17Å; S242-L244 VanDerWaalsContact O-N 3.16Å; S242-L244 PolarHBondContact OG-O 3.41Å
245	E	35.4	Very low	48.7	Very low	147 Å²	147	86.4 Å²	86.4	69%	0.687	46%	0.456	S	S	*	.			trans	84.9	85.6	165.3	-50	-173	174.9	0	0	117.6
246	D	29.8	Very low	45.8	Very low	108 Å²	108	89.1 Å²	89.1	58%	0.578	48%	0.479	S	S	*	.			trans	-82.4	116.3	159.6	-160.1	26.7	0	0	0	109.8	G248 K366	D246-G248 VanDerWaalsContact C-N 3.29Å; D246-G248 PolarHBondContact O-N 2.93Å; D246-K366 IonicContact OD1-NZ 2.71Å; D246-K366 PolarHBondContact OD1-NZ 3.07Å
247	E	36.9	Very low	43	Very low	157 Å²	157	97 Å²	97	73%	0.734	51%	0.513	S	S	*	.			trans	-69	85.3	170	-78.6	-146.3	134.2	0	0	110.4	K369	E247-K369 IonicContact OE2-NZ 2.91Å; E247-K369 PolarHBondContact OE2-NZ 3.26Å
248	G	33.8	Very low	40	Very low	24 Å²	24	99.1 Å²	99.1	25%	0.247	53%	0.529	C	S	.	.	S	Bend	trans	-136.6	173.8	158.7	0	0	0	0	0	109.8	D246 Q250	D246-G248 VanDerWaalsContact C-N 3.29Å; D246-G248 PolarHBondContact O-N 2.93Å; G248-Q250 PolarHBondContact O-N 2.99Å
249	L	37.8	Very low	37.2	Very low	11 Å²	11	105 Å²	105	6%	0.058	56%	0.564	C	S	.	*	S	Bend	trans	-66.8	19.4	170.5	-70.4	160.2	0	0	0	113.2	N478 L481 L520	L249-N478 WeakPolarHBondContact CB-OD1 3.32Å; L249-N478 PolarHBondContact N-OD1 3.04Å; L249-L481 HydrophobicContact CD1-CB 3.44Å; L249-L481 VanDerWaalsContact CD1-CB 3.44Å; L249-L481 HydrophobicContact CD1-CD1 3.96Å; L249-L481 HydrophobicContact CD1-CG 4.36Å; L249-L520 HydrophobicContact CB-CD2 4.11Å
250	Q	32	Very low	34.7	Very low	126 Å²	126	107.6 Å²	107.6	59%	0.589	57%	0.568	S	S	*	*			trans	-77.3	136.4	172.7	-128.6	123	-10.1	0	0	109.1	G248	G248-Q250 PolarHBondContact O-N 2.99Å
251	E	31.1	Very low	32.6	Very low	119 Å²	119	108.8 Å²	108.8	56%	0.556	57%	0.566	S	S	*	*			trans	-57.6	150.2	165.6	-76.4	149.3	177.5	0	0	108.8	K253 K523	E251-K253 PolarHBondContact O-N 3.14Å; E251-K523 WeakPolarHBondContact OE1-CE 3.35Å; E251-K523 IonicContact OE1-NZ 2.85Å; E251-K523 PolarHBondContact OE1-NZ 2.87Å; E251-K523 IonicContact OE2-NZ 3.17Å; E251-K523 PolarHBondContact OE2-NZ 3.33Å
252	Q	27.6	Very low	31.4	Very low	118 Å²	118	112.6 Å²	112.6	55%	0.551	59%	0.59	S	S	*	*			trans	-40.9	98.9	143.4	-76.2	163.8	-23.8	0	0	107.3	D254	Q252-D254 VanDerWaalsContact C-N 3.27Å; Q252-D254 PolarHBondContact O-N 3.08Å; Q252-D254 VanDerWaalsContact O-N 3.08Å
253	K	27.3	Very low	30.8	Very low	193 Å²	193	118.4 Å²	118.4	84%	0.839	62%	0.617	S	S	*	*			trans	-66.8	104	155.7	-99.5	-174.7	170.8	-174.2	0	103.4	E251 S255	E251-K253 PolarHBondContact O-N 3.14Å; K253-S255 PolarHBondContact O-N 3.39Å; K253-S255 VanDerWaalsContact O-N 3.09Å
254	D	26.5	Very low	30.7	Very low	86 Å²	86	114.4 Å²	114.4	46%	0.46	61%	0.609	S	S	.	*			trans	-46.9	120.8	163.9	-69.4	-38.9	0	0	0	106.7	Q252 R260	Q252-D254 VanDerWaalsContact C-N 3.27Å; Q252-D254 PolarHBondContact O-N 3.08Å; Q252-D254 VanDerWaalsContact O-N 3.08Å; D254-R260 IonicContact OD1-NH1 3.43Å
255	S	24.1	Very low	30.9	Very low	68 Å²	68	110.2 Å²	110.2	48%	0.476	59%	0.587	S	S	.	*			trans	-56.6	150.6	166.6	59.6	0	0	0	0	107.9	K253 H257 S258	K253-S255 PolarHBondContact O-N 3.39Å; K253-S255 VanDerWaalsContact O-N 3.09Å; S255-H257 PolarHBondContact O-N 3.01Å; S255-S258 PolarHBondContact O-N 3.19Å; S255-S258 VanDerWaalsContact O-N 3.15Å
256	P	30.6	Very low	31	Very low	122 Å²	122	106 Å²	106	79%	0.792	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	9.3	179	25.6	-32.7	0	0	0	114.4
257	H	30.8	Very low	31.7	Very low	180 Å²	180	109 Å²	109	83%	0.833	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.1	7.4	177.6	-62.6	-45.2	0	0	0	115	S255	S255-H257 PolarHBondContact O-N 3.01Å
258	S	24.7	Very low	32	Very low	62 Å²	62	106.2 Å²	106.2	43%	0.434	56%	0.562	S	S	.	*			trans	-110.3	87	167.2	-173	0	0	0	0	109.4	S255 R260	S255-S258 PolarHBondContact O-N 3.19Å; S255-S258 VanDerWaalsContact O-N 3.15Å; S258-R260 PolarHBondContact O-N 3.29Å
259	V	27	Very low	32.3	Very low	127 Å²	127	107.8 Å²	107.8	77%	0.77	57%	0.567	S	S	*	*			trans	-66.7	90.5	167.1	-179.7	0	0	0	0	107	S261	V259-S261 PolarHBondContact O-N 3.14Å
260	R	30.4	Very low	32.8	Very low	141 Å²	141	109.3 Å²	109.3	53%	0.532	57%	0.573	S	S	.	*			trans	-65.7	83.8	152.3	-81.2	-179.9	167.3	168.6	-1.5	106.5	D254 S258 P262	D254-R260 IonicContact OD1-NH1 3.43Å; S258-R260 PolarHBondContact O-N 3.29Å; R260-P262 WeakPolarHBondContact O-CD 3.5Å
261	S	23.8	Very low	33.3	Very low	88 Å²	88	107.2 Å²	107.2	62%	0.615	58%	0.578	S	S	*	*			trans	-69.5	107.3	161.5	40.4	0	0	0	0	105.9	V259 I263	V259-S261 PolarHBondContact O-N 3.14Å; S261-I263 PolarHBondContact O-N 2.57Å
262	P	30	Very low	33.7	Very low	109 Å²	109	105.9 Å²	105.9	71%	0.708	57%	0.574	S	S	*	*			trans	-52.8	133.7	161.8	25.9	-32.8	0	0	0	106	R260 C264	R260-P262 WeakPolarHBondContact O-CD 3.5Å; P262-C264 PolarHBondContact O-N 3.39Å
263	I	35.7	Very low	34.5	Very low	158 Å²	158	107 Å²	107	81%	0.81	59%	0.585	S	S	*	*			trans	-60.9	98.9	170.5	-64.4	164.6	0	0	0	105.2	S261 I265	S261-I263 PolarHBondContact O-N 2.57Å; I263-I265 VanDerWaalsContact C-N 3.29Å; I263-I265 HydrophobicContact CG2-CG1 3.91Å; I263-I265 PolarHBondContact O-N 2.93Å
264	C	32	Very low	35.3	Very low	109 Å²	109	104.8 Å²	104.8	74%	0.736	58%	0.577	S	S	*	*			trans	-78	87.8	179.7	-177.1	0	0	0	0	106.6	P262 S266	P262-C264 PolarHBondContact O-N 3.39Å; C264-S266 PolarHBondContact O-N 2.95Å
265	I	41.2	Very low	35.9	Very low	62 Å²	62	106.7 Å²	106.7	32%	0.318	58%	0.583	S	S	.	*			trans	-69.1	103.2	172.7	-57.1	175.7	0	0	0	106.7	I263 W267 H270 I277	I263-I265 VanDerWaalsContact C-N 3.29Å; I263-I265 HydrophobicContact CG2-CG1 3.91Å; I263-I265 PolarHBondContact O-N 2.93Å; I265-W267 HydrophobicContact CG2-CD2 4.27Å; I265-W267 HydrophobicContact CG2-CZ2 4.5Å; I265-W267 PolarHBondContact O-N 2.96Å; I265-W267 VanDerWaalsContact O-N 3.14Å; I265-H270 VanDerWaalsContact CG2-CD2 3.47Å; I265-H270 WeakPolarHBondContact CG2-CD2 3.49Å; I265-I277 HydrophobicContact CD1-CD1 4.15Å; I265-I277 HydrophobicContact CG2-CD1 4.22Å
266	S	38.4	Very low	36.6	Very low	58 Å²	58	111.6 Å²	111.6	41%	0.406	60%	0.598	S	S	.	*			trans	-76	97.2	169.2	-177.5	0	0	0	0	108.2	C264 K268 V269	C264-S266 PolarHBondContact O-N 2.95Å; S266-K268 PolarHBondContact O-N 3.5Å; S266-V269 PolarHBondContact O-N 3.37Å
267	W	45.2	Very low	37.4	Very low	171 Å²	171	110 Å²	110	65%	0.648	58%	0.582	S	S	*	*	H	α-helix	trans	-56.1	-20.5	178.8	-66.9	100.2	0	0	0	113.5	I265 V269 H270 A271	I265-W267 HydrophobicContact CG2-CD2 4.27Å; I265-W267 HydrophobicContact CG2-CZ2 4.5Å; I265-W267 PolarHBondContact O-N 2.96Å; I265-W267 VanDerWaalsContact O-N 3.14Å; W267-V269 VanDerWaalsContact C-N 3.27Å; W267-V269 PolarHBondContact O-N 3.29Å; W267-H270 PolarHBondContact O-N 3.36Å; W267-A271 WeakPolarHBondContact O-CB 3.24Å; W267-A271 PolarHBondContact O-N 2.73Å
268	K	42.8	Very low	37.9	Very low	99 Å²	99	108.3 Å²	108.3	43%	0.43	58%	0.575	S	S	.	*	H	α-helix	trans	-59.6	-34.4	173.2	-72.9	-174.7	178.2	178	0	112.9	S266 E646	S266-K268 PolarHBondContact O-N 3.5Å; K268-E646 PolarHBondContact NZ-O 3.3Å
269	V	40.4	Very low	38.5	Very low	56 Å²	56	113.1 Å²	113.1	34%	0.339	59%	0.594	S	S	.	*	H	α-helix	trans	-80.6	-30.5	-179.3	-177	0	0	0	0	111.4	S266 W267 Q275	S266-V269 PolarHBondContact O-N 3.37Å; W267-V269 VanDerWaalsContact C-N 3.27Å; W267-V269 PolarHBondContact O-N 3.29Å; V269-Q275 HydrophobicContact CG1-CG 4.47Å
270	H	47.5	Very low	39.3	Very low	43 Å²	43	115.6 Å²	115.6	20%	0.199	59%	0.591	C	S	.	*	H	α-helix	trans	-85.3	-32.3	-179.7	-67	-66.3	0	0	0	113.8	I265 W267 N272 N273 Q275 I277	I265-H270 VanDerWaalsContact CG2-CD2 3.47Å; I265-H270 WeakPolarHBondContact CG2-CD2 3.49Å; W267-H270 PolarHBondContact O-N 3.36Å; H270-N272 PolarHBondContact O-N 3.34Å; H270-N273 PolarHBondContact O-N 2.99Å; H270-N273 VanDerWaalsContact O-N 3.12Å; H270-Q275 PolarHBondContact ND1-O 2.86Å; H270-I277 WeakPolarHBondContact CE1-CG1 3.43Å
271	A	43.3	Very low	39.6	Very low	82 Å²	82	118.1 Å²	118.1	68%	0.678	61%	0.609	S	S	*	*	H	α-helix	trans	-62.9	-27	176.7	0	0	0	0	0	112.8	W267 N273	W267-A271 WeakPolarHBondContact O-CB 3.24Å; W267-A271 PolarHBondContact O-N 2.73Å; A271-N273 VanDerWaalsContact C-N 3.34Å
272	N	39.4	Very low	40.1	Very low	91 Å²	91	121.5 Å²	121.5	49%	0.487	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.1	13	176.4	-74.9	-5.1	0	0	0	114	H270 Q274	H270-N272 PolarHBondContact O-N 3.34Å; N272-Q274 HydrophobicContact CB-CG 4.31Å; N272-Q274 PolarHBondContact O-N 3.5Å; N272-Q274 VanDerWaalsContact O-N 3.1Å
273	N	43.6	Very low	40.4	Very low	143 Å²	143	119.5 Å²	119.5	77%	0.765	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.2	20.5	-178.8	-78.8	-19.2	0	0	0	115.7	H270 A271	H270-N273 PolarHBondContact O-N 2.99Å; H270-N273 VanDerWaalsContact O-N 3.12Å; A271-N273 VanDerWaalsContact C-N 3.34Å
274	Q	44.4	Very low	40.4	Very low	145 Å²	145	115 Å²	115	68%	0.678	61%	0.611	S	S	*	*			trans	-83.2	-18.2	-174.8	-71.2	-178.1	-14.8	0	0	114.3	N272	N272-Q274 HydrophobicContact CB-CG 4.31Å; N272-Q274 PolarHBondContact O-N 3.5Å; N272-Q274 VanDerWaalsContact O-N 3.1Å
275	Q	38.9	Very low	40.6	Very low	127 Å²	127	118.6 Å²	118.6	59%	0.593	62%	0.622	S	S	*	*			trans	-146.8	140.9	175.1	-73.4	-170.4	-21.9	0	0	113	V269 H270	V269-Q275 HydrophobicContact CG1-CG 4.47Å; H270-Q275 PolarHBondContact ND1-O 2.86Å
276	H	39.6	Very low	40.1	Very low	170 Å²	170	125.5 Å²	125.5	79%	0.787	65%	0.645	S	S	*	*			trans	-93.8	139.2	170.9	-65.4	-44	0	0	0	111.6	Q278	H276-Q278 PolarHBondContact O-N 3.15Å
277	I	47.2	Very low	39.9	Very low	90 Å²	90	127.9 Å²	127.9	46%	0.462	66%	0.658	S	S	.	*			trans	-82.7	108.4	173	-57.4	174.1	0	0	0	108.2	I265 H270 L279	I265-I277 HydrophobicContact CD1-CD1 4.15Å; I265-I277 HydrophobicContact CG2-CD1 4.22Å; H270-I277 WeakPolarHBondContact CE1-CG1 3.43Å; I277-L279 HydrophobicContact CG2-CG 4.26Å
278	Q	41.2	Very low	39.2	Very low	144 Å²	144	129.2 Å²	129.2	67%	0.673	67%	0.669	S	S	*	*			trans	-87.5	106.6	169.6	-71.8	-175.8	-5.4	0	0	109.5	H276 Y280	H276-Q278 PolarHBondContact O-N 3.15Å; Q278-Y280 HydrophobicContact CB-CE2 4.45Å; Q278-Y280 PolarHBondContact OE1-OH 3.47Å
279	L	37.3	Very low	39	Very low	162 Å²	162	131.5 Å²	131.5	85%	0.848	68%	0.684	S	S	*	*			trans	-84.7	110.8	169.1	-75.2	162.9	0	0	0	108.4	I277	I277-L279 HydrophobicContact CG2-CG 4.26Å
280	Y	43	Very low	38.7	Very low	179 Å²	179	136.1 Å²	136.1	70%	0.702	71%	0.707	S	S	*	*			trans	-78.5	126.9	171.7	-71	-81.9	0	0	0	110.1	Q278 N282 G283	Q278-Y280 HydrophobicContact CB-CE2 4.45Å; Q278-Y280 PolarHBondContact OE1-OH 3.47Å; Y280-N282 PolarHBondContact O-N 3.26Å; Y280-G283 PolarHBondContact O-N 3.18Å; Y280-G283 VanDerWaalsContact O-N 3.16Å
281	E	36.2	Very low	38	Very low	195 Å²	195	137.8 Å²	137.8	91%	0.911	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-14	-177.9	-116	177.1	163	0	0	114.9
282	N	34.9	Very low	37.5	Very low	159 Å²	159	139.3 Å²	139.3	85%	0.85	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.8	16.9	-177.2	-68.3	-44.9	0	0	0	115.1	Y280 G284	Y280-N282 PolarHBondContact O-N 3.26Å; N282-G284 PolarHBondContact O-N 3.37Å
283	G	36.1	Very low	37	Very low	66 Å²	66	143.7 Å²	143.7	68%	0.68	74%	0.744	S	S	*	*			trans	-77.4	48.3	179.3	0	0	0	0	0	115.2	Y280	Y280-G283 PolarHBondContact O-N 3.18Å; Y280-G283 VanDerWaalsContact O-N 3.16Å
284	G	35.6	Very low	36.4	Very low	63 Å²	63	148 Å²	148	65%	0.649	75%	0.75	S	S	*	*			trans	-66	137.6	175.7	0	0	0	0	0	112.7	N282 R286	N282-G284 PolarHBondContact O-N 3.37Å; G284-R286 PolarHBondContact O-N 3.3Å
285	L	36.8	Very low	35.7	Very low	185 Å²	185	149.7 Å²	149.7	97%	0.969	76%	0.763	S	S	*	*	S	Bend	trans	-64.3	25.4	-179.8	-78	152.8	0	0	0	116.1
286	R	30.5	Very low	35.1	Very low	208 Å²	208	154.5 Å²	154.5	79%	0.785	78%	0.775	S	S	*	*	S	Bend	trans	-133.2	124.7	171.9	-72.1	-173.2	176.6	-172.8	-3.4	109.8	G284 K288	G284-R286 PolarHBondContact O-N 3.3Å; R286-K288 PolarHBondContact O-N 3.38Å
287	P	34.7	Very low	34.6	Very low	107 Å²	107	150.7 Å²	150.7	70%	0.695	77%	0.768	S	S	*	*			trans	-62.8	125.2	156.9	27.2	-28.9	0	0	0	107	I289	P287-I289 VanDerWaalsContact C-N 3.3Å; P287-I289 HydrophobicContact CG-CG1 4.39Å; P287-I289 PolarHBondContact O-N 3.11Å
288	K	30.3	Very low	34	Very low	200 Å²	200	154.5 Å²	154.5	87%	0.87	79%	0.788	S	S	*	*			trans	-65.3	96.9	164.5	-80	-177.9	178.4	176.1	0	106.8	R286 N290	R286-K288 PolarHBondContact O-N 3.38Å; K288-N290 PolarHBondContact O-N 3.03Å
289	I	38.5	Very low	33.6	Very low	146 Å²	146	151.4 Å²	151.4	75%	0.749	79%	0.787	S	S	*	*			trans	-75.5	63.7	169.7	-52.7	165	0	0	0	107.9	P287	P287-I289 VanDerWaalsContact C-N 3.3Å; P287-I289 HydrophobicContact CG-CG1 4.39Å; P287-I289 PolarHBondContact O-N 3.11Å
290	N	33	Very low	33.2	Very low	154 Å²	154	146.7 Å²	146.7	82%	0.824	77%	0.768	S	S	*	*			trans	-115.4	46.9	159.2	-77.1	2.2	0	0	0	108.1	K288 S292	K288-N290 PolarHBondContact O-N 3.03Å; N290-S292 PolarHBondContact O-N 3.07Å
291	S	34.6	Very low	32.8	Very low	78 Å²	78	145.6 Å²	145.6	55%	0.545	77%	0.772	S	S	.	*			trans	-68.2	118.1	160.1	167.3	0	0	0	0	107.5	F293	S291-F293 PolarHBondContact O-N 3.48Å; S291-F293 PolarHBondContact OG-N 3.35Å
292	S	31.6	Very low	32.7	Very low	114 Å²	114	144 Å²	144	80%	0.797	77%	0.767	S	S	*	*	S	Bend	trans	-69.2	2.2	173.1	42.3	0	0	0	0	113.5	N290	N290-S292 PolarHBondContact O-N 3.07Å
293	F	29.4	Very low	32.6	Very low	182 Å²	182	143.1 Å²	143.1	80%	0.798	76%	0.762	S	S	*	*			trans	-104	95	175.3	-75.9	-88.8	0	0	0	110.5	S291	S291-F293 PolarHBondContact O-N 3.48Å; S291-F293 PolarHBondContact OG-N 3.35Å
294	R	30.8	Very low	32.6	Very low	234 Å²	234	145.5 Å²	145.5	88%	0.883	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-97.5	125.1	158.7	-73.1	-174.1	-177	-178	0.9	108.5	R296	R294-R296 PolarHBondContact O-N 3.09Å
295	L	30.1	Very low	33	Very low	180 Å²	180	146.1 Å²	146.1	94%	0.942	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-58.9	122.2	165.2	-78.4	160.6	0	0	0	108	S297	L295-S297 PolarHBondContact O-N 3.43Å
296	R	26.7	Very low	33.8	Very low	229 Å²	229	143.7 Å²	143.7	86%	0.864	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-60.2	118.2	178.8	-80.8	-178.1	-124	-144.9	-1.2	109.5	R294	R294-R296 PolarHBondContact O-N 3.09Å
297	S	29.6	Very low	35.1	Very low	89 Å²	89	141.3 Å²	141.3	62%	0.622	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-72.1	141	162.4	177.1	0	0	0	0	109	L295 A299 S300	L295-S297 PolarHBondContact O-N 3.43Å; S297-A299 PolarHBondContact O-N 3.33Å; S297-S300 PolarHBondContact O-N 3.05Å
298	L	32.6	Very low	36.8	Very low	171 Å²	171	136.7 Å²	136.7	90%	0.895	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-1.9	-175.5	-133.5	92.1	0	0	0	114.6	S300	L298-S300 VanDerWaalsContact C-N 3.28Å; L298-S300 PolarHBondContact O-N 2.98Å
299	A	33.1	Very low	38.8	Very low	79 Å²	79	127.7 Å²	127.7	65%	0.653	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-7.3	176.2	0	0	0	0	0	114.3	S297 I301	S297-A299 PolarHBondContact O-N 3.33Å; A299-I301 PolarHBondContact O-N 2.93Å; A299-I301 VanDerWaalsContact O-N 3.08Å
300	S	28.5	Very low	40.4	Very low	62 Å²	62	124.4 Å²	124.4	43%	0.434	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	9.8	-171.7	90.6	0	0	0	0	116.1	S297 L298	S297-S300 PolarHBondContact O-N 3.05Å; L298-S300 VanDerWaalsContact C-N 3.28Å; L298-S300 PolarHBondContact O-N 2.98Å
301	I	34.8	Very low	42.7	Very low	157 Å²	157	118.3 Å²	118.3	81%	0.805	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-6.5	179	-60.2	179.1	0	0	0	111.8	A299	A299-I301 PolarHBondContact O-N 2.93Å; A299-I301 VanDerWaalsContact O-N 3.08Å
302	M	34.3	Very low	44.9	Very low	160 Å²	160	116.1 Å²	116.1	79%	0.788	63%	0.626	S	S	*	*	S	Bend	trans	-118	30.6	174.9	-67.7	-173.5	68.3	0	0	113.5	S304 A305	M302-S304 PolarHBondContact O-N 3.31Å; M302-A305 PolarHBondContact O-N 3.33Å
303	D	33.8	Very low	47.4	Very low	142 Å²	142	118 Å²	118	76%	0.759	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	52.6	-172	-142.8	15.5	0	0	0	113.9
304	S	35.8	Very low	50	Low	116 Å²	116	112.3 Å²	112.3	81%	0.811	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.2	16.5	150.7	63.3	0	0	0	0	111.4	M302 E306	M302-S304 PolarHBondContact O-N 3.31Å; S304-E306 PolarHBondContact O-N 3.34Å; S304-E306 VanDerWaalsContact O-N 3.09Å
305	A	43.7	Very low	52.8	Low	75 Å²	75	101.1 Å²	101.1	62%	0.62	56%	0.558	S	S	*	*			trans	-64.6	110.2	175.6	0	0	0	0	0	109.6	M302 K307	M302-A305 PolarHBondContact O-N 3.33Å; A305-K307 PolarHBondContact O-N 3.03Å
306	E	53.8	Low	55.5	Low	135 Å²	135	96.1 Å²	96.1	63%	0.631	53%	0.528	S	S	*	.			trans	-39.8	128.3	174.2	-63.7	175	159.8	0	0	110.6	S180 S304 G308	S180-E306 VanDerWaalsContact CB-OE2 3.28Å; S180-E306 WeakPolarHBondContact CB-OE2 3.38Å; S180-E306 PolarHBondContact OG-OE2 3.37Å; S304-E306 PolarHBondContact O-N 3.34Å; S304-E306 VanDerWaalsContact O-N 3.09Å; E306-G308 PolarHBondContact O-N 3.37Å
307	K	57	Low	58.4	Low	157 Å²	157	88.1 Å²	88.1	68%	0.683	51%	0.507	S	S	*	.			trans	-62.1	18.5	179.1	-70.8	179.7	177.2	175.5	0	114.5	A305 S310 S311	A305-K307 PolarHBondContact O-N 3.03Å; K307-S310 WeakPolarHBondContact O-CA 3.07Å; K307-S310 WeakPolarHBondContact O-CB 3.37Å; K307-S310 PolarHBondContact O-N 3.22Å; K307-S310 PolarHBondContact O-OG 2.64Å; K307-S311 PolarHBondContact O-N 3.43Å
308	G	70.6	Confident	61.3	Low	11 Å²	11	84.7 Å²	84.7	11%	0.113	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	46	-141.5	173.9	0	0	0	0	0	113.1	S179 E306 S310 N314	S179-G308 WeakPolarHBondContact OG-CA 3.33Å; E306-G308 PolarHBondContact O-N 3.37Å; G308-S310 PolarHBondContact O-N 2.87Å; G308-N314 WeakPolarHBondContact O-CB 3.44Å; G308-N314 PolarHBondContact O-ND2 3.15Å
309	L	72.8	Confident	64	Low	11 Å²	11	76.6 Å²	76.6	6%	0.058	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-78.3	4.1	170.6	-68.1	179.5	0	0	0	114	S179 L183 L234 V237 S311 L315 F318 L367	S179-L309 PolarHBondContact OG-N 3.29Å; L183-L309 HydrophobicContact CD1-CD1 3.39Å; L183-L309 HydrophobicContact CD1-CD2 3.74Å; L183-L309 HydrophobicContact CD1-CG 3.43Å; L183-L309 VanDerWaalsContact CD1-CG 3.43Å; L183-L309 HydrophobicContact CD2-CD1 4.36Å; L183-L309 HydrophobicContact CG-CD1 4.49Å; L234-L309 HydrophobicContact CD2-CD1 3.75Å; V237-L309 HydrophobicContact CG1-CB 4.47Å; V237-L309 HydrophobicContact CG1-CD1 4.33Å; L309-S311 VanDerWaalsContact C-N 3.3Å; L309-L315 HydrophobicContact CD2-CB 4.47Å; L309-L315 HydrophobicContact CD2-CD1 4Å; L309-F318 HydrophobicContact CD2-CB 4.11Å; L309-F318 HydrophobicContact CD2-CD1 4.16Å; L309-F318 HydrophobicContact CD2-CG 4.28Å; L309-L367 HydrophobicContact CD1-CD1 4.09Å
310	S	72.8	Confident	66.8	Low	76 Å²	76	77.4 Å²	77.4	53%	0.531	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-81.4	-9.9	176.5	77.2	0	0	0	0	113.4	K307 G308 H371	K307-S310 WeakPolarHBondContact O-CA 3.07Å; K307-S310 WeakPolarHBondContact O-CB 3.37Å; K307-S310 PolarHBondContact O-N 3.22Å; K307-S310 PolarHBondContact O-OG 2.64Å; G308-S310 PolarHBondContact O-N 2.87Å; S310-H371 PolarHBondContact O-CE1 3.41Å; S310-H371 VanDerWaalsContact O-CE1 3.29Å
311	S	80.6	Confident	69.7	Low	27 Å²	27	77.3 Å²	77.3	19%	0.189	42%	0.423	C	S	.	.	S	Bend	trans	-93.8	132.6	168.3	177.4	0	0	0	0	110.7	K307 L309 E313 N314 L315	K307-S311 PolarHBondContact O-N 3.43Å; L309-S311 VanDerWaalsContact C-N 3.3Å; S311-E313 PolarHBondContact O-N 3.07Å; S311-E313 PolarHBondContact OG-N 3.04Å; S311-N314 PolarHBondContact O-N 2.91Å; S311-L315 WeakPolarHBondContact O-CB 3.48Å; S311-L315 PolarHBondContact O-N 3.22Å
312	A	80.9	Confident	72.4	Confident	32 Å²	32	69.8 Å²	69.8	26%	0.264	39%	0.385	S	S	.	.	H	α-helix	trans	-60.3	-33	177.7	0	0	0	0	0	112.5	K316 M377	A312-K316 VanDerWaalsContact O-CB 3.26Å; A312-K316 WeakPolarHBondContact O-CB 3.41Å; A312-K316 PolarHBondContact O-N 3.13Å; A312-M377 HydrophobicContact CB-CE 4.18Å
313	E	83.3	Confident	75.2	Confident	154 Å²	154	62.4 Å²	62.4	72%	0.72	35%	0.348	S	S	*	.	H	α-helix	trans	-70.4	-45.3	178.3	-66	176.3	172.5	0	0	111.7	S311 L315 K316 S317	S311-E313 PolarHBondContact O-N 3.07Å; S311-E313 PolarHBondContact OG-N 3.04Å; E313-L315 PolarHBondContact O-N 2.91Å; E313-K316 WeakPolarHBondContact O-CB 3.47Å; E313-K316 PolarHBondContact O-N 3.35Å; E313-S317 PolarHBondContact O-N 2.99Å
314	N	85.1	Confident	78	Confident	61 Å²	61	58.1 Å²	58.1	33%	0.326	33%	0.328	S	S	.	.	H	α-helix	trans	-64	-43.1	176.9	-69.5	-7.3	0	0	0	110.8	G308 S311 K316 S317 F318	G308-N314 WeakPolarHBondContact O-CB 3.44Å; G308-N314 PolarHBondContact O-ND2 3.15Å; S311-N314 PolarHBondContact O-N 2.91Å; N314-K316 PolarHBondContact O-N 3.36Å; N314-S317 PolarHBondContact O-N 3.47Å; N314-S317 PolarHBondContact O-OG 3.11Å; N314-F318 WeakPolarHBondContact O-CB 3.29Å; N314-F318 PolarHBondContact O-N 3.36Å
315	L	88.1	Confident	80.6	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-45.2	175	178.5	61	0	0	0	111.4	L309 S311 E313 F318 I319 L364 L367 T368	L309-L315 HydrophobicContact CD2-CB 4.47Å; L309-L315 HydrophobicContact CD2-CD1 4Å; S311-L315 WeakPolarHBondContact O-CB 3.48Å; S311-L315 PolarHBondContact O-N 3.22Å; E313-L315 PolarHBondContact O-N 2.91Å; L315-F318 PolarHBondContact O-N 3.15Å; L315-I319 HydrophobicContact CD1-CD1 4.03Å; L315-I319 HydrophobicContact CD1-CG1 4.28Å; L315-I319 HydrophobicContact CG-CD1 3.88Å; L315-I319 WeakPolarHBondContact O-CB 3.48Å; L315-I319 VanDerWaalsContact O-CG1 3.24Å; L315-I319 WeakPolarHBondContact O-CG1 3.31Å; L315-I319 PolarHBondContact O-N 3.45Å; L315-L364 HydrophobicContact CD1-CD2 4.18Å; L315-L367 HydrophobicContact CD1-CB 4.26Å; L315-L367 HydrophobicContact CD1-CD1 4.26Å; L315-L367 HydrophobicContact CD2-CB 3.84Å; L315-T368 HydrophobicContact CD2-CG2 3.68Å; L315-T368 HydrophobicContact CG-CG2 4.34Å
316	K	87.9	Confident	82.9	Confident	75 Å²	75	49.1 Å²	49.1	33%	0.326	26%	0.261	S	S	.	.	H	α-helix	trans	-59.3	-47.8	175.7	-176.6	-178.1	174.4	-179.3	0	111.8	A312 E313 N314 F318 I319 E320 M377 W380	A312-K316 VanDerWaalsContact O-CB 3.26Å; A312-K316 WeakPolarHBondContact O-CB 3.41Å; A312-K316 PolarHBondContact O-N 3.13Å; E313-K316 WeakPolarHBondContact O-CB 3.47Å; E313-K316 PolarHBondContact O-N 3.35Å; N314-K316 PolarHBondContact O-N 3.36Å; K316-F318 VanDerWaalsContact C-N 3.28Å; K316-F318 PolarHBondContact O-N 2.99Å; K316-I319 PolarHBondContact O-N 3.37Å; K316-E320 WeakPolarHBondContact CE-OE1 3.38Å; K316-E320 WeakPolarHBondContact O-CG 3.29Å; K316-E320 PolarHBondContact O-N 2.91Å; K316-M377 HydrophobicContact CB-CE 4.31Å; K316-W380 HydrophobicContact CD-CD2 4.4Å; K316-W380 HydrophobicContact CD-CZ2 4.34Å; K316-W380 HydrophobicContact CG-CD2 4.35Å; K316-W380 HydrophobicContact CG-CE3 4.25Å; K316-W380 HydrophobicContact CG-CH2 3.69Å; K316-W380 HydrophobicContact CG-CZ2 3.75Å; K316-W380 HydrophobicContact CG-CZ3 3.94Å
317	S	87.4	Confident	84.7	Confident	60 Å²	60	43.3 Å²	43.3	42%	0.42	23%	0.233	S	C	.	.	H	α-helix	trans	-60.9	-37.8	178.3	74	0	0	0	0	112.3	E313 N314 I321	E313-S317 PolarHBondContact O-N 2.99Å; N314-S317 PolarHBondContact O-N 3.47Å; N314-S317 PolarHBondContact O-OG 3.11Å; S317-I321 WeakPolarHBondContact O-CG1 3.49Å; S317-I321 PolarHBondContact O-N 2.78Å
318	F	89.9	Confident	86.2	Confident	17 Å²	17	39.3 Å²	39.3	8%	0.075	22%	0.217	C	C	.	.	H	α-helix	trans	-69.3	-42.8	176.1	-177.1	-112.2	0	0	0	111.7	L183 V187 L309 N314 L315 K316 E320 I321 I322 L364	L183-F318 HydrophobicContact CB-CD2 4.21Å; L183-F318 HydrophobicContact CB-CE2 3.75Å; L183-F318 HydrophobicContact CB-CZ 4.14Å; L183-F318 HydrophobicContact CD2-CE1 3.91Å; L183-F318 HydrophobicContact CD2-CE2 4.14Å; L183-F318 HydrophobicContact CD2-CZ 3.61Å; L183-F318 HydrophobicContact CG-CE2 4.39Å; L183-F318 HydrophobicContact CG-CZ 4.34Å; V187-F318 HydrophobicContact CG2-CE2 3.8Å; L309-F318 HydrophobicContact CD2-CB 4.11Å; L309-F318 HydrophobicContact CD2-CD1 4.16Å; L309-F318 HydrophobicContact CD2-CG 4.28Å; N314-F318 WeakPolarHBondContact O-CB 3.29Å; N314-F318 PolarHBondContact O-N 3.36Å; L315-F318 PolarHBondContact O-N 3.15Å; K316-F318 VanDerWaalsContact C-N 3.28Å; K316-F318 PolarHBondContact O-N 2.99Å; F318-E320 VanDerWaalsContact C-N 3.31Å; F318-E320 PolarHBondContact O-N 3.23Å; F318-I321 PolarHBondContact O-N 3.42Å; F318-I321 VanDerWaalsContact O-N 3.12Å; F318-I322 HydrophobicContact CD1-CG2 4.12Å; F318-I322 HydrophobicContact CE1-CB 4.22Å; F318-I322 HydrophobicContact CE1-CG1 4.48Å; F318-I322 HydrophobicContact CE1-CG2 3.87Å; F318-I322 HydrophobicContact CE2-CB 4.38Å; F318-I322 HydrophobicContact CZ-CB 4.04Å; F318-I322 HydrophobicContact CZ-CG1 4.15Å; F318-I322 HydrophobicContact CZ-CG2 4.21Å; F318-I322 VanDerWaalsContact O-CG2 3.32Å; F318-I322 WeakPolarHBondContact O-CG2 3.49Å; F318-I322 PolarHBondContact O-N 3.49Å; F318-L364 HydrophobicContact CD1-CD2 3.94Å; F318-L364 HydrophobicContact CE1-CD2 3.94Å
319	I	90.8	Very high	87.1	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-58.3	-42.9	175.4	-73.2	170.4	0	0	0	111.3	L315 K316 I321 I322 I323 L364 T368 W380 L381 Y385	L315-I319 HydrophobicContact CD1-CD1 4.03Å; L315-I319 HydrophobicContact CD1-CG1 4.28Å; L315-I319 HydrophobicContact CG-CD1 3.88Å; L315-I319 WeakPolarHBondContact O-CB 3.48Å; L315-I319 VanDerWaalsContact O-CG1 3.24Å; L315-I319 WeakPolarHBondContact O-CG1 3.31Å; L315-I319 PolarHBondContact O-N 3.45Å; K316-I319 PolarHBondContact O-N 3.37Å; I319-I321 PolarHBondContact O-N 3.33Å; I319-I322 PolarHBondContact O-N 3.01Å; I319-I323 HydrophobicContact CG2-CD1 3.51Å; I319-I323 HydrophobicContact CG2-CG1 3.95Å; I319-I323 PolarHBondContact O-N 3.35Å; I319-I323 VanDerWaalsContact O-N 3.11Å; I319-L364 HydrophobicContact CG1-CB 4.4Å; I319-L364 HydrophobicContact CG1-CD1 4.36Å; I319-L364 HydrophobicContact CG1-CD2 4.41Å; I319-T368 HydrophobicContact CD1-CG2 3.78Å; I319-W380 HydrophobicContact CB-CH2 4.26Å; I319-W380 HydrophobicContact CB-CZ3 4.41Å; I319-W380 HydrophobicContact CG2-CH2 3.73Å; I319-W380 HydrophobicContact CG2-CZ3 3.84Å; I319-L381 HydrophobicContact CD1-CD2 4.41Å; I319-L381 HydrophobicContact CG2-CD2 3.87Å; I319-Y385 HydrophobicContact CG2-CE2 3.87Å; I319-Y385 PolarHBondContact O-OH 3.35Å
320	E	90.5	Very high	88	Confident	95 Å²	95	38.4 Å²	38.4	44%	0.444	21%	0.21	S	C	.	.	H	α-helix	trans	-58.4	-29.4	177.1	-75.8	176.7	175.7	0	0	113.1	K316 F318 P324 W380 Y385	K316-E320 WeakPolarHBondContact CE-OE1 3.38Å; K316-E320 WeakPolarHBondContact O-CG 3.29Å; K316-E320 PolarHBondContact O-N 2.91Å; F318-E320 VanDerWaalsContact C-N 3.31Å; F318-E320 PolarHBondContact O-N 3.23Å; E320-P324 WeakPolarHBondContact O-CD 3.32Å; E320-P324 WeakPolarHBondContact O-CG 3.5Å; E320-W380 HydrophobicContact CG-CH2 3.83Å; E320-W380 HydrophobicContact CG-CZ2 3.57Å; E320-W380 VanDerWaalsContact OE1-CZ2 3.31Å; E320-W380 WeakPolarHBondContact OE1-CZ2 3.28Å; E320-Y385 WeakPolarHBondContact CA-OH 3.48Å
321	I	90.1	Very high	88.7	Confident	60 Å²	60	38 Å²	38	31%	0.308	20%	0.201	S	C	.	.	H	α-helix	trans	-88.5	-49.2	178.3	-62.8	166.8	0	0	0	111.4	V187 W207 S317 F318 I319	V187-I321 HydrophobicContact CG1-CG2 3.72Å; V187-I321 HydrophobicContact CG2-CG2 4.13Å; W207-I321 HydrophobicContact CG-CG2 4.4Å; S317-I321 WeakPolarHBondContact O-CG1 3.49Å; S317-I321 PolarHBondContact O-N 2.78Å; F318-I321 PolarHBondContact O-N 3.42Å; F318-I321 VanDerWaalsContact O-N 3.12Å; I319-I321 PolarHBondContact O-N 3.33Å
322	I	92.3	Very high	89	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-80.6	-37	-167.7	-165.1	61.7	0	0	0	113.6	V187 I190 L230 F318 I319 L325 L326 L364	V187-I322 HydrophobicContact CG2-CD1 4.28Å; I190-I322 HydrophobicContact CD1-CD1 4.17Å; L230-I322 HydrophobicContact CD2-CD1 4.14Å; L230-I322 HydrophobicContact CD2-CG1 4.46Å; F318-I322 HydrophobicContact CD1-CG2 4.12Å; F318-I322 HydrophobicContact CE1-CB 4.22Å; F318-I322 HydrophobicContact CE1-CG1 4.48Å; F318-I322 HydrophobicContact CE1-CG2 3.87Å; F318-I322 HydrophobicContact CE2-CB 4.38Å; F318-I322 HydrophobicContact CZ-CB 4.04Å; F318-I322 HydrophobicContact CZ-CG1 4.15Å; F318-I322 HydrophobicContact CZ-CG2 4.21Å; F318-I322 VanDerWaalsContact O-CG2 3.32Å; F318-I322 WeakPolarHBondContact O-CG2 3.49Å; F318-I322 PolarHBondContact O-N 3.49Å; I319-I322 PolarHBondContact O-N 3.01Å; I322-L325 PolarHBondContact O-N 3.06Å; I322-L326 HydrophobicContact CG1-CD1 4.06Å; I322-L326 HydrophobicContact CG1-CG 4.12Å; I322-L326 VanDerWaalsContact O-CG 3.28Å; I322-L326 WeakPolarHBondContact O-CG 3.49Å; I322-L326 PolarHBondContact O-N 3.42Å; I322-L364 HydrophobicContact CG2-CD1 3.6Å
323	I	92.1	Very high	89.1	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-46.1	-176.8	-70.5	-170.6	0	0	0	112.4	I319 L325 L326 I327 L381 Y385 F389	I319-I323 HydrophobicContact CG2-CD1 3.51Å; I319-I323 HydrophobicContact CG2-CG1 3.95Å; I319-I323 PolarHBondContact O-N 3.35Å; I319-I323 VanDerWaalsContact O-N 3.11Å; I323-L325 VanDerWaalsContact C-N 3.3Å; I323-L325 PolarHBondContact O-N 3.43Å; I323-L326 WeakPolarHBondContact O-CB 3.49Å; I323-L326 PolarHBondContact O-N 3.41Å; I323-L326 VanDerWaalsContact O-N 3.13Å; I323-I327 HydrophobicContact CG2-CD1 3.81Å; I323-I327 HydrophobicContact CG2-CG1 4.32Å; I323-I327 WeakPolarHBondContact O-CG1 3.45Å; I323-I327 PolarHBondContact O-N 3.18Å; I323-L381 HydrophobicContact CD1-CD2 4.5Å; I323-Y385 HydrophobicContact CB-CD1 4.25Å; I323-Y385 HydrophobicContact CB-CE1 3.87Å; I323-Y385 HydrophobicContact CD1-CD2 4.1Å; I323-Y385 HydrophobicContact CD1-CE2 4.06Å; I323-Y385 HydrophobicContact CD1-CG 4.37Å; I323-Y385 HydrophobicContact CG2-CD1 3.44Å; I323-Y385 VanDerWaalsContact CG2-CD1 3.44Å; I323-Y385 HydrophobicContact CG2-CE1 3.56Å; I323-Y385 HydrophobicContact CG2-CG 4.01Å; I323-F389 HydrophobicContact CD1-CZ 4.47Å; I323-F389 HydrophobicContact CG2-CE1 3.99Å; I323-F389 HydrophobicContact CG2-CZ 4.15Å
324	P	92.3	Very high	89	Confident	53 Å²	53	33.3 Å²	33.3	34%	0.344	18%	0.175	S	C	.	.	H	α-helix	trans	-55.5	-43.9	175.3	-27.3	36.2	0	0	0	112.7	E320 L326 I327 E328	E320-P324 WeakPolarHBondContact O-CD 3.32Å; E320-P324 WeakPolarHBondContact O-CG 3.5Å; P324-L326 VanDerWaalsContact C-N 3.33Å; P324-L326 PolarHBondContact O-N 2.96Å; P324-I327 WeakPolarHBondContact O-CB 3.32Å; P324-I327 PolarHBondContact O-N 3.13Å; P324-E328 PolarHBondContact O-N 2.93Å
325	L	90.6	Very high	88.2	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-63.5	-37.8	177.1	-65.9	174.9	0	0	0	112.5	V187 S191 W207 L209 I322 I323 E328 C329	V187-L325 HydrophobicContact CG1-CD1 3.99Å; S191-L325 WeakPolarHBondContact OG-CD1 3.13Å; W207-L325 HydrophobicContact CB-CD1 4.15Å; W207-L325 HydrophobicContact CB-CD2 3.83Å; W207-L325 HydrophobicContact CB-CG 4.3Å; L209-L325 HydrophobicContact CD2-CD2 4.3Å; I322-L325 PolarHBondContact O-N 3.06Å; I323-L325 VanDerWaalsContact C-N 3.3Å; I323-L325 PolarHBondContact O-N 3.43Å; L325-E328 PolarHBondContact O-N 2.96Å; L325-C329 PolarHBondContact O-N 3.41Å; L325-C329 PolarHBondContact O-SG 3.15Å
326	L	93.1	Very high	86.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.7	-35.5	175.6	-67.5	174.9	0	0	0	112.1	L227 I322 I323 P324 C329 W330 V357 I360 I361	L227-L326 HydrophobicContact CD1-CD2 4.35Å; L227-L326 HydrophobicContact CD2-CD2 3.58Å; I322-L326 HydrophobicContact CG1-CD1 4.06Å; I322-L326 HydrophobicContact CG1-CG 4.12Å; I322-L326 VanDerWaalsContact O-CG 3.28Å; I322-L326 WeakPolarHBondContact O-CG 3.49Å; I322-L326 PolarHBondContact O-N 3.42Å; I323-L326 WeakPolarHBondContact O-CB 3.49Å; I323-L326 PolarHBondContact O-N 3.41Å; I323-L326 VanDerWaalsContact O-N 3.13Å; P324-L326 VanDerWaalsContact C-N 3.33Å; P324-L326 PolarHBondContact O-N 2.96Å; L326-C329 WeakPolarHBondContact O-CB 3.46Å; L326-C329 PolarHBondContact O-N 3.19Å; L326-W330 PolarHBondContact O-N 3.35Å; L326-V357 HydrophobicContact CB-CG1 4Å; L326-V357 HydrophobicContact CB-CG2 4.41Å; L326-V357 HydrophobicContact CD2-CG2 4.13Å; L326-I360 HydrophobicContact CD1-CB 4.12Å; L326-I360 HydrophobicContact CD1-CG2 3.63Å; L326-I360 HydrophobicContact CD2-CD1 4.12Å; L326-I361 HydrophobicContact CD1-CD1 4.45Å; L326-I361 HydrophobicContact CD1-CG1 3.79Å
327	I	91.1	Very high	85.1	Confident	12 Å²	12	41.2 Å²	41.2	6%	0.062	23%	0.228	C	C	.	.	H	α-helix	trans	-66	-44.9	173.4	-66.7	164.1	0	0	0	110	I323 P324 C329 W330 I331 D388 F389 H392 F393	I323-I327 HydrophobicContact CG2-CD1 3.81Å; I323-I327 HydrophobicContact CG2-CG1 4.32Å; I323-I327 WeakPolarHBondContact O-CG1 3.45Å; I323-I327 PolarHBondContact O-N 3.18Å; P324-I327 WeakPolarHBondContact O-CB 3.32Å; P324-I327 PolarHBondContact O-N 3.13Å; I327-C329 VanDerWaalsContact C-N 3.27Å; I327-C329 PolarHBondContact O-N 3.02Å; I327-W330 WeakPolarHBondContact O-CB 3.24Å; I327-W330 PolarHBondContact O-N 3.11Å; I327-W330 VanDerWaalsContact O-N 3.11Å; I327-I331 HydrophobicContact CG2-CD1 3.91Å; I327-I331 HydrophobicContact CG2-CG1 4.42Å; I327-I331 VanDerWaalsContact O-CG1 3.32Å; I327-I331 WeakPolarHBondContact O-CG1 3.46Å; I327-I331 PolarHBondContact O-N 3.44Å; I327-D388 HydrophobicContact CD1-CB 3.91Å; I327-F389 HydrophobicContact CD1-CD1 4.36Å; I327-F389 HydrophobicContact CD1-CE1 4.05Å; I327-F389 HydrophobicContact CG1-CE1 4.25Å; I327-H392 HydrophobicContact CG2-CB 4.49Å; I327-F393 HydrophobicContact CG1-CE1 4.45Å; I327-F393 HydrophobicContact CG1-CZ 4.08Å
328	E	89	Confident	82.9	Confident	74 Å²	74	43.5 Å²	43.5	35%	0.346	25%	0.245	S	C	.	.	H	α-helix	trans	-59.1	-41	173.6	-68.9	-176.3	178	0	0	111.3	L209 P324 L325 W330 I331 E332	L209-E328 HydrophobicContact CD1-CB 3.66Å; L209-E328 HydrophobicContact CD2-CB 4.38Å; L209-E328 HydrophobicContact CG-CB 3.89Å; L209-E328 WeakPolarHBondContact CG-OE2 3.43Å; P324-E328 PolarHBondContact O-N 2.93Å; L325-E328 PolarHBondContact O-N 2.96Å; E328-W330 VanDerWaalsContact C-N 3.28Å; E328-W330 PolarHBondContact O-N 3.23Å; E328-I331 PolarHBondContact O-N 3.38Å; E328-E332 PolarHBondContact O-N 2.9Å
329	C	89.4	Confident	80.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-38.1	175.8	-69.5	0	0	0	0	112.9	L209 R223 L325 L326 I327 A333 V357	L209-C329 VanDerWaalsContact CD2-SG 3.52Å; R223-C329 VanDerWaalsContact NH1-CA 3.26Å; R223-C329 PolarHBondContact NH1-SG 3.48Å; L325-C329 PolarHBondContact O-N 3.41Å; L325-C329 PolarHBondContact O-SG 3.15Å; L326-C329 WeakPolarHBondContact O-CB 3.46Å; L326-C329 PolarHBondContact O-N 3.19Å; I327-C329 VanDerWaalsContact C-N 3.27Å; I327-C329 PolarHBondContact O-N 3.02Å; C329-A333 WeakPolarHBondContact O-CB 3.5Å; C329-A333 PolarHBondContact O-N 2.77Å; C329-V357 HydrophobicContact CB-CG2 4.02Å
330	W	90.6	Very high	78.6	Confident	3 Å²	3	51.6 Å²	51.6	1%	0.011	30%	0.303	C	S	.	.	H	α-helix	trans	-67.2	-44.1	175	-178.5	-78.7	0	0	0	112.2	L326 I327 E328 E332 A333 S334 M354 V357 L358 H392 F393 Y399 L431	L326-W330 PolarHBondContact O-N 3.35Å; I327-W330 WeakPolarHBondContact O-CB 3.24Å; I327-W330 PolarHBondContact O-N 3.11Å; I327-W330 VanDerWaalsContact O-N 3.11Å; E328-W330 VanDerWaalsContact C-N 3.28Å; E328-W330 PolarHBondContact O-N 3.23Å; W330-E332 VanDerWaalsContact C-N 3.32Å; W330-E332 PolarHBondContact O-N 3.15Å; W330-A333 PolarHBondContact O-N 3.21Å; W330-A333 VanDerWaalsContact O-N 3.15Å; W330-S334 PolarHBondContact O-N 3.36Å; W330-M354 HydrophobicContact CD2-CB 4.48Å; W330-M354 HydrophobicContact CD2-CE 3.9Å; W330-M354 HydrophobicContact CD2-CG 4Å; W330-M354 HydrophobicContact CE3-CB 3.69Å; W330-M354 HydrophobicContact CE3-CE 4.12Å; W330-M354 HydrophobicContact CE3-CG 3.68Å; W330-M354 HydrophobicContact CH2-CB 4.14Å; W330-M354 HydrophobicContact CH2-CE 3.41Å; W330-M354 VanDerWaalsContact CH2-CE 3.41Å; W330-M354 HydrophobicContact CH2-CG 4.38Å; W330-M354 HydrophobicContact CZ2-CE 3.14Å; W330-M354 HydrophobicContact CZ3-CB 3.47Å; W330-M354 VanDerWaalsContact CZ3-CB 3.47Å; W330-M354 HydrophobicContact CZ3-CE 3.88Å; W330-M354 HydrophobicContact CZ3-CG 3.87Å; W330-V357 HydrophobicContact CE3-CB 4.36Å; W330-V357 HydrophobicContact CE3-CG1 4.04Å; W330-L358 HydrophobicContact CH2-CD1 4.03Å; W330-L358 HydrophobicContact CH2-CD2 4.4Å; W330-L358 HydrophobicContact CH2-CG 4.3Å; W330-L358 HydrophobicContact CZ3-CD1 3.85Å; W330-L358 HydrophobicContact CZ3-CD2 3.91Å; W330-L358 HydrophobicContact CZ3-CG 3.67Å; W330-H392 PolarHBondContact NE1-O 3.46Å; W330-F393 HydrophobicContact CB-CD1 4.45Å; W330-F393 HydrophobicContact CB-CE1 3.78Å; W330-F393 AromaticContact CD1-CD1 3.77Å; W330-F393 AromaticContact CD1-CE1 3.94Å; W330-F393 AromaticContact CD2-CD1 3.43Å; W330-F393 HydrophobicContact CD2-CD1 3.43Å; W330-F393 VanDerWaalsContact CD2-CD1 3.43Å; W330-F393 AromaticContact CD2-CE1 3.5Å; W330-F393 HydrophobicContact CD2-CE1 3.5Å; W330-F393 VanDerWaalsContact CD2-CE1 3.5Å; W330-F393 HydrophobicContact CD2-CG 4.48Å; W330-F393 AromaticContact CE2-CD1 3.37Å; W330-F393 AromaticContact CE2-CE1 3.97Å; W330-F393 AromaticContact CE3-CD1 3.97Å; W330-F393 HydrophobicContact CE3-CD1 3.97Å; W330-F393 AromaticContact CE3-CE1 3.87Å; W330-F393 HydrophobicContact CE3-CE1 3.87Å; W330-F393 AromaticContact CG-CD1 3.67Å; W330-F393 HydrophobicContact CG-CD1 3.67Å; W330-F393 AromaticContact CG-CE1 3.47Å; W330-F393 HydrophobicContact CG-CE1 3.47Å; W330-F393 VanDerWaalsContact CG-CE1 3.47Å; W330-F393 HydrophobicContact CH2-CD1 4.34Å; W330-F393 HydrophobicContact CZ2-CB 4.12Å; W330-F393 AromaticContact CZ2-CD1 3.84Å; W330-F393 HydrophobicContact CZ2-CD1 3.84Å; W330-F393 HydrophobicContact CZ2-CG 4.24Å; W330-F393 HydrophobicContact CZ3-CD1 4.4Å; W330-F393 AromaticContact NE1-CD1 3.59Å; W330-Y399 HydrophobicContact CH2-CE2 4.17Å; W330-Y399 HydrophobicContact CZ2-CE1 4.49Å; W330-Y399 AromaticContact CZ2-CE2 3.84Å; W330-Y399 HydrophobicContact CZ2-CE2 3.84Å; W330-Y399 AromaticContact CZ2-CZ 3.7Å; W330-L431 HydrophobicContact CH2-CD1 4.39Å; W330-L431 HydrophobicContact CZ3-CD1 4.24Å
331	I	87.8	Confident	76.6	Confident	67 Å²	67	54.7 Å²	54.7	34%	0.344	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-44.2	179.1	-65.9	164.1	0	0	0	110.1	I327 E328 A333 S334 H392	I327-I331 HydrophobicContact CG2-CD1 3.91Å; I327-I331 HydrophobicContact CG2-CG1 4.42Å; I327-I331 VanDerWaalsContact O-CG1 3.32Å; I327-I331 WeakPolarHBondContact O-CG1 3.46Å; I327-I331 PolarHBondContact O-N 3.44Å; E328-I331 PolarHBondContact O-N 3.38Å; I331-A333 VanDerWaalsContact C-N 3.27Å; I331-A333 PolarHBondContact O-N 2.73Å; I331-S334 PolarHBondContact O-N 3.36Å; I331-S334 PolarHBondContact O-OG 3.25Å; I331-H392 VanDerWaalsContact CD1-CE1 3.4Å; I331-H392 WeakPolarHBondContact CD1-CE1 3.34Å
332	E	86.1	Confident	74.8	Confident	74 Å²	74	56.2 Å²	56.2	35%	0.346	33%	0.33	S	S	.	.	H	α-helix	trans	-63.9	-31.7	177.1	-168.5	-177.4	150.7	0	0	112.8	L209 Q220 R223 E328 W330	L209-E332 WeakPolarHBondContact CD1-OE2 3.5Å; Q220-E332 HydrophobicContact CG-CG 4.28Å; Q220-E332 WeakPolarHBondContact CG-OE1 3.4Å; Q220-E332 PolarHBondContact NE2-O 2.77Å; R223-E332 IonicContact CZ-OE1 2.67Å; R223-E332 IonicContact CZ-OE2 3.59Å; R223-E332 IonicContact NE-OE2 3.95Å; R223-E332 PolarHBondContact NE-OE2 3.16Å; R223-E332 IonicContact NH1-OE2 3.87Å; R223-E332 PolarHBondContact NH1-OE2 3.22Å; R223-E332 IonicContact NH2-OE1 3.56Å; R223-E332 PolarHBondContact NH2-OE1 3.43Å; R223-E332 IonicContact NH2-OE2 2.72Å; R223-E332 PolarHBondContact NH2-OE2 2.88Å; E328-E332 PolarHBondContact O-N 2.9Å; W330-E332 VanDerWaalsContact C-N 3.32Å; W330-E332 PolarHBondContact O-N 3.15Å
333	A	84.6	Confident	73.2	Confident	3 Å²	3	56.7 Å²	56.7	3%	0.025	33%	0.334	C	S	.	.	H	α-helix	trans	-79.8	-21.4	178.3	0	0	0	0	0	113.4	C329 W330 I331 S350 L353 M354	C329-A333 WeakPolarHBondContact O-CB 3.5Å; C329-A333 PolarHBondContact O-N 2.77Å; W330-A333 PolarHBondContact O-N 3.21Å; W330-A333 VanDerWaalsContact O-N 3.15Å; I331-A333 VanDerWaalsContact C-N 3.27Å; I331-A333 PolarHBondContact O-N 2.73Å; A333-S350 VanDerWaalsContact O-CB 3.28Å; A333-S350 WeakPolarHBondContact O-CB 3.38Å; A333-S350 PolarHBondContact O-OG 2.95Å; A333-L353 HydrophobicContact CB-CB 4.47Å; A333-L353 HydrophobicContact CB-CD2 3.77Å; A333-L353 HydrophobicContact CB-CG 4.29Å; A333-M354 HydrophobicContact CB-CG 3.96Å; A333-M354 HydrophobicContact CB-SD 4.46Å
334	S	80.9	Confident	72.1	Confident	38 Å²	38	59.6 Å²	59.6	27%	0.266	35%	0.35	S	S	.	.	S	Bend	trans	-74.5	142.3	-174.4	71.4	0	0	0	0	111.9	W330 I331 A336	W330-S334 PolarHBondContact O-N 3.36Å; I331-S334 PolarHBondContact O-N 3.36Å; I331-S334 PolarHBondContact O-OG 3.25Å; S334-A336 PolarHBondContact O-N 2.9Å
335	P	67.9	Low	71.2	Confident	47 Å²	47	60.1 Å²	60.1	31%	0.305	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-59.4	139.2	-179.7	21.3	-30.3	0	0	0	111.2
336	A	57.3	Low	70.8	Confident	76 Å²	76	60.2 Å²	60.2	63%	0.628	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-54	141.6	-174.4	0	0	0	0	0	112.1	S334 S338	S334-A336 PolarHBondContact O-N 2.9Å; A336-S338 PolarHBondContact O-N 3.2Å
337	Q	53.1	Low	70.2	Confident	178 Å²	178	66.2 Å²	66.2	83%	0.832	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	3.4	-172.5	-60.4	176.1	1.9	0	0	115.2
338	S	41.5	Very low	69.8	Low	109 Å²	109	68 Å²	68	76%	0.762	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	3.5	-169.1	42.4	0	0	0	0	115.7	A336	A336-S338 PolarHBondContact O-N 3.2Å
339	A	41.9	Very low	69.4	Low	55 Å²	55	67.7 Å²	67.7	46%	0.455	39%	0.393	S	S	.	.			trans	-137.6	105	175.2	0	0	0	0	0	112.7	I341	A339-I341 PolarHBondContact O-N 3.23Å; A339-I341 VanDerWaalsContact O-N 3.14Å
340	P	47.6	Very low	69.2	Low	133 Å²	133	68.3 Å²	68.3	86%	0.864	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.2	-172.6	-18.6	29.9	0	0	0	115.8
341	I	49.1	Very low	68.9	Low	161 Å²	161	68.7 Å²	68.7	83%	0.826	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-17.6	-165.2	-54.2	171.8	0	0	0	112.3	A339	A339-I341 PolarHBondContact O-N 3.23Å; A339-I341 VanDerWaalsContact O-N 3.14Å
342	L	52.9	Low	68.9	Low	91 Å²	91	68.7 Å²	68.7	48%	0.476	40%	0.397	S	S	.	.	S	Bend	trans	-110.8	5.5	-175.4	-97.6	106.3	0	0	0	115.2	N344 L345	L342-N344 PolarHBondContact O-N 3.12Å; L342-L345 HydrophobicContact CD2-CD1 3.67Å; L342-L345 HydrophobicContact CG-CD1 4.03Å; L342-L345 PolarHBondContact O-N 3.43Å
343	G	59.1	Low	69.1	Low	10 Å²	10	65.2 Å²	65.2	10%	0.103	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.4	-169.4	0	0	0	0	0	116.7
344	N	67.3	Low	69.5	Low	66 Å²	66	65.1 Å²	65.1	35%	0.353	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-13	179.8	-62.1	14.9	0	0	0	113.1	L342 H396 P398 S400	L342-N344 PolarHBondContact O-N 3.12Å; N344-H396 PolarHBondContact ND2-O 3.44Å; N344-H396 WeakPolarHBondContact OD1-CA 3.26Å; N344-H396 WeakPolarHBondContact OD1-CB 3.31Å; N344-H396 PolarHBondContact OD1-O 2.95Å; N344-H396 VanDerWaalsContact OD1-O 3.05Å; N344-P398 PolarHBondContact ND2-O 3.43Å; N344-S400 PolarHBondContact O-N 3.09Å; N344-S400 VanDerWaalsContact O-O 3.12Å
345	L	74.8	Confident	70	Confident	64 Å²	64	64.1 Å²	64.1	34%	0.335	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.2	-178.4	-71.3	168.9	0	0	0	110.3	L342 S400 Q402	L342-L345 HydrophobicContact CD2-CD1 3.67Å; L342-L345 HydrophobicContact CG-CD1 4.03Å; L342-L345 PolarHBondContact O-N 3.43Å; L345-S400 WeakPolarHBondContact CA-O 3.31Å; L345-Q402 HydrophobicContact CB-CB 4.28Å
346	L	81.2	Confident	71.2	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	140.2	-177.3	-62.7	175	0	0	0	111.9	Q351 M354 Y399 S400 Q402 L431	L346-Q351 HydrophobicContact CB-CB 4.27Å; L346-Q351 HydrophobicContact CD1-CB 4.3Å; L346-Q351 HydrophobicContact CD1-CG 4.29Å; L346-M354 HydrophobicContact CD1-CE 3.94Å; L346-M354 HydrophobicContact CD1-SD 3.66Å; L346-M354 HydrophobicContact CD2-CE 4.1Å; L346-M354 HydrophobicContact CD2-SD 3.65Å; L346-M354 HydrophobicContact CG-SD 4.31Å; L346-Y399 HydrophobicContact CD1-CD1 3.74Å; L346-Y399 HydrophobicContact CD1-CG 3.96Å; L346-Y399 HydrophobicContact CD2-CD1 4.24Å; L346-Y399 HydrophobicContact CG-CD1 4.07Å; L346-S400 PolarHBondContact N-O 3.46Å; L346-Q402 PolarHBondContact O-N 3.29Å; L346-L431 HydrophobicContact CD1-CD2 3.72Å
347	E	81.6	Confident	73	Confident	126 Å²	126	59.3 Å²	59.3	59%	0.589	33%	0.332	S	S	*	.			trans	-68.6	154.6	163	-64.3	-175.3	178.9	0	0	110.7	D349 S350 Q351	E347-D349 VanDerWaalsContact C-N 3.34Å; E347-D349 PolarHBondContact O-N 3.29Å; E347-S350 PolarHBondContact O-N 3.28Å; E347-Q351 PolarHBondContact O-N 2.85Å
348	S	81.7	Confident	74.9	Confident	51 Å²	51	50.8 Å²	50.8	36%	0.357	29%	0.292	S	S	.	.	H	α-helix	trans	-56.6	-44.7	-177.2	176.4	0	0	0	0	112.7	Q351 Q352	S348-Q351 PolarHBondContact O-N 3.25Å; S348-Q352 WeakPolarHBondContact O-CG 3.46Å; S348-Q352 PolarHBondContact O-N 3.29Å; S348-Q352 VanDerWaalsContact O-N 3.09Å
349	D	80.3	Confident	77.4	Confident	67 Å²	67	46.1 Å²	46.1	36%	0.358	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-41.9	-177.3	-72.8	10.1	0	0	0	111.3	Q221 E347 Q352 L353	Q221-D349 PolarHBondContact NE2-OD2 2.88Å; E347-D349 VanDerWaalsContact C-N 3.34Å; E347-D349 PolarHBondContact O-N 3.29Å; D349-Q352 PolarHBondContact O-N 2.96Å; D349-L353 PolarHBondContact O-N 3.23Å
350	S	85.2	Confident	79.9	Confident	13 Å²	13	43.5 Å²	43.5	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-44.3	174.1	-65.9	0	0	0	0	112.1	A333 E347 Q352 L353 M354	A333-S350 VanDerWaalsContact O-CB 3.28Å; A333-S350 WeakPolarHBondContact O-CB 3.38Å; A333-S350 PolarHBondContact O-OG 2.95Å; E347-S350 PolarHBondContact O-N 3.28Å; S350-Q352 VanDerWaalsContact C-N 3.34Å; S350-Q352 PolarHBondContact O-N 2.94Å; S350-L353 PolarHBondContact O-N 2.95Å; S350-M354 WeakPolarHBondContact O-CB 3.35Å; S350-M354 WeakPolarHBondContact O-CG 3.41Å; S350-M354 PolarHBondContact O-N 3.09Å
351	Q	85.9	Confident	82	Confident	10 Å²	10	37.3 Å²	37.3	5%	0.047	20%	0.197	C	C	.	.	H	α-helix	trans	-61.9	-42.1	178	-167.6	-158.9	-6.6	0	0	111.6	L346 E347 S348 Q355 L431	L346-Q351 HydrophobicContact CB-CB 4.27Å; L346-Q351 HydrophobicContact CD1-CB 4.3Å; L346-Q351 HydrophobicContact CD1-CG 4.29Å; E347-Q351 PolarHBondContact O-N 2.85Å; S348-Q351 PolarHBondContact O-N 3.25Å; Q351-Q355 VanDerWaalsContact O-CB 3.31Å; Q351-Q355 WeakPolarHBondContact O-CB 3.31Å; Q351-Q355 PolarHBondContact O-N 2.91Å; Q351-L431 HydrophobicContact CG-CD2 4.16Å
352	Q	87.9	Confident	84	Confident	67 Å²	67	32.6 Å²	32.6	31%	0.313	17%	0.172	S	C	.	.	H	α-helix	trans	-64.1	-41.9	178	-72.5	-178.6	10.1	0	0	112	L224 S348 D349 S350 Q355 Q356	L224-Q352 HydrophobicContact CD1-CB 4.01Å; L224-Q352 HydrophobicContact CD2-CB 4.1Å; S348-Q352 WeakPolarHBondContact O-CG 3.46Å; S348-Q352 PolarHBondContact O-N 3.29Å; S348-Q352 VanDerWaalsContact O-N 3.09Å; D349-Q352 PolarHBondContact O-N 2.96Å; S350-Q352 VanDerWaalsContact C-N 3.34Å; S350-Q352 PolarHBondContact O-N 2.94Å; Q352-Q355 WeakPolarHBondContact O-CB 3.31Å; Q352-Q355 PolarHBondContact O-N 2.94Å; Q352-Q356 WeakPolarHBondContact O-CG 3.28Å; Q352-Q356 PolarHBondContact O-N 3.06Å
353	L	90.1	Very high	85.8	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-63.5	-49	177.2	-177	60.8	0	0	0	111.3	Q220 R223 L224 L227 A333 D349 S350 Q355 Q356 V357	Q220-L353 HydrophobicContact CB-CD2 4.39Å; Q220-L353 HydrophobicContact CG-CD2 4.36Å; R223-L353 HydrophobicContact CB-CD1 4.46Å; L224-L353 HydrophobicContact CB-CD1 4.13Å; L224-L353 HydrophobicContact CD1-CB 4.44Å; L227-L353 HydrophobicContact CD1-CD1 3.68Å; A333-L353 HydrophobicContact CB-CB 4.47Å; A333-L353 HydrophobicContact CB-CD2 3.77Å; A333-L353 HydrophobicContact CB-CG 4.29Å; D349-L353 PolarHBondContact O-N 3.23Å; S350-L353 PolarHBondContact O-N 2.95Å; L353-Q355 VanDerWaalsContact C-N 3.28Å; L353-Q355 PolarHBondContact O-N 3.12Å; L353-Q356 PolarHBondContact O-N 2.96Å; L353-Q356 VanDerWaalsContact O-N 3.13Å; L353-V357 PolarHBondContact O-N 3.23Å
354	M	91.6	Very high	87.3	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-58.1	-39.4	174.5	-70.4	168.5	81.8	0	0	111.9	W330 A333 L346 S350 V357 L358 Y399 L431	W330-M354 HydrophobicContact CD2-CB 4.48Å; W330-M354 HydrophobicContact CD2-CE 3.9Å; W330-M354 HydrophobicContact CD2-CG 4Å; W330-M354 HydrophobicContact CE3-CB 3.69Å; W330-M354 HydrophobicContact CE3-CE 4.12Å; W330-M354 HydrophobicContact CE3-CG 3.68Å; W330-M354 HydrophobicContact CH2-CB 4.14Å; W330-M354 HydrophobicContact CH2-CE 3.41Å; W330-M354 VanDerWaalsContact CH2-CE 3.41Å; W330-M354 HydrophobicContact CH2-CG 4.38Å; W330-M354 HydrophobicContact CZ2-CE 3.14Å; W330-M354 HydrophobicContact CZ3-CB 3.47Å; W330-M354 VanDerWaalsContact CZ3-CB 3.47Å; W330-M354 HydrophobicContact CZ3-CE 3.88Å; W330-M354 HydrophobicContact CZ3-CG 3.87Å; A333-M354 HydrophobicContact CB-CG 3.96Å; A333-M354 HydrophobicContact CB-SD 4.46Å; L346-M354 HydrophobicContact CD1-CE 3.94Å; L346-M354 HydrophobicContact CD1-SD 3.66Å; L346-M354 HydrophobicContact CD2-CE 4.1Å; L346-M354 HydrophobicContact CD2-SD 3.65Å; L346-M354 HydrophobicContact CG-SD 4.31Å; S350-M354 WeakPolarHBondContact O-CB 3.35Å; S350-M354 WeakPolarHBondContact O-CG 3.41Å; S350-M354 PolarHBondContact O-N 3.09Å; M354-V357 WeakPolarHBondContact O-CB 3.19Å; M354-V357 PolarHBondContact O-N 3Å; M354-L358 PolarHBondContact O-N 3.05Å; M354-L358 VanDerWaalsContact O-N 3.08Å; M354-Y399 HydrophobicContact CE-CD1 4.1Å; M354-Y399 HydrophobicContact CE-CE1 3.76Å; M354-L431 HydrophobicContact CB-CD1 3.81Å; M354-L431 HydrophobicContact CB-CD2 4.38Å
355	Q	92.1	Very high	88.3	Confident	16 Å²	16	25.6 Å²	25.6	8%	0.075	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-40.5	175.8	179.2	61.2	48.4	0	0	112.2	Q351 Q352 L353 S359 L430 L431	Q351-Q355 VanDerWaalsContact O-CB 3.31Å; Q351-Q355 WeakPolarHBondContact O-CB 3.31Å; Q351-Q355 PolarHBondContact O-N 2.91Å; Q352-Q355 WeakPolarHBondContact O-CB 3.31Å; Q352-Q355 PolarHBondContact O-N 2.94Å; L353-Q355 VanDerWaalsContact C-N 3.28Å; L353-Q355 PolarHBondContact O-N 3.12Å; Q355-S359 PolarHBondContact NE2-OG 3.11Å; Q355-S359 VanDerWaalsContact NE2-OG 3.07Å; Q355-S359 VanDerWaalsContact O-CB 3.29Å; Q355-S359 WeakPolarHBondContact O-CB 3.32Å; Q355-S359 PolarHBondContact O-N 2.93Å; Q355-S359 PolarHBondContact O-OG 3.32Å; Q355-L430 HydrophobicContact CG-CD2 4.07Å; Q355-L431 HydrophobicContact CB-CD1 4.15Å
356	Q	93	Very high	88.8	Confident	22 Å²	22	25.3 Å²	25.3	10%	0.103	13%	0.128	C	C	.	.	H	α-helix	trans	-67	-40.9	177	-61.2	-39.1	-60.5	0	0	111.3	L224 L227 I228 Q352 L353 L358 S359 I360	L224-Q356 HydrophobicContact CD1-CG 3.77Å; L227-Q356 HydrophobicContact CB-CB 3.88Å; L227-Q356 HydrophobicContact CB-CG 4.46Å; I228-Q356 HydrophobicContact CG1-CG 3.76Å; Q352-Q356 WeakPolarHBondContact O-CG 3.28Å; Q352-Q356 PolarHBondContact O-N 3.06Å; L353-Q356 PolarHBondContact O-N 2.96Å; L353-Q356 VanDerWaalsContact O-N 3.13Å; Q356-L358 PolarHBondContact O-N 3.48Å; Q356-S359 PolarHBondContact O-N 2.87Å; Q356-I360 VanDerWaalsContact O-CG1 3.31Å; Q356-I360 WeakPolarHBondContact O-CG1 3.36Å; Q356-I360 PolarHBondContact O-N 2.74Å
357	V	94.3	Very high	89	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-53.2	-55	174.2	162.9	0	0	0	0	110.8	L227 L326 C329 W330 L353 M354 S359 I360 I361 F393	L227-V357 HydrophobicContact CD1-CG2 4.21Å; L326-V357 HydrophobicContact CB-CG1 4Å; L326-V357 HydrophobicContact CB-CG2 4.41Å; L326-V357 HydrophobicContact CD2-CG2 4.13Å; C329-V357 HydrophobicContact CB-CG2 4.02Å; W330-V357 HydrophobicContact CE3-CB 4.36Å; W330-V357 HydrophobicContact CE3-CG1 4.04Å; L353-V357 PolarHBondContact O-N 3.23Å; M354-V357 WeakPolarHBondContact O-CB 3.19Å; M354-V357 PolarHBondContact O-N 3Å; V357-S359 VanDerWaalsContact C-N 3.35Å; V357-S359 PolarHBondContact O-N 2.82Å; V357-I360 PolarHBondContact O-N 2.84Å; V357-I361 HydrophobicContact CG1-CD1 3.98Å; V357-I361 WeakPolarHBondContact O-CG1 3.5Å; V357-I361 PolarHBondContact O-N 3.08Å; V357-F393 HydrophobicContact CG1-CZ 4.17Å
358	L	93.6	Very high	89	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.7	-37.4	179.2	-62.3	-178.5	0	0	0	112.4	W330 M354 Q356 I360 I361 H362 F393 L431 L435 I438	W330-L358 HydrophobicContact CH2-CD1 4.03Å; W330-L358 HydrophobicContact CH2-CD2 4.4Å; W330-L358 HydrophobicContact CH2-CG 4.3Å; W330-L358 HydrophobicContact CZ3-CD1 3.85Å; W330-L358 HydrophobicContact CZ3-CD2 3.91Å; W330-L358 HydrophobicContact CZ3-CG 3.67Å; M354-L358 PolarHBondContact O-N 3.05Å; M354-L358 VanDerWaalsContact O-N 3.08Å; Q356-L358 PolarHBondContact O-N 3.48Å; L358-I360 VanDerWaalsContact C-N 3.31Å; L358-I360 PolarHBondContact O-N 3.33Å; L358-I361 PolarHBondContact O-N 3.09Å; L358-H362 VanDerWaalsContact O-CB 3.27Å; L358-H362 WeakPolarHBondContact O-CB 3.27Å; L358-H362 PolarHBondContact O-N 2.78Å; L358-F393 HydrophobicContact CD2-CD2 3.98Å; L358-F393 HydrophobicContact CD2-CE2 3.95Å; L358-F393 HydrophobicContact CD2-CZ 4.47Å; L358-L431 HydrophobicContact CD1-CD1 3.66Å; L358-L431 HydrophobicContact CD1-CG 4.27Å; L358-L431 HydrophobicContact CG-CD1 4.43Å; L358-L435 HydrophobicContact CD1-CB 3.77Å; L358-L435 HydrophobicContact CD1-CD1 4.45Å; L358-L435 HydrophobicContact CD2-CD1 4.14Å; L358-I438 HydrophobicContact CB-CD1 3.98Å; L358-I438 HydrophobicContact CD2-CD1 3.97Å; L358-I438 WeakPolarHBondContact O-CD1 3.35Å
359	S	93.5	Very high	88.8	Confident	11 Å²	11	21.3 Å²	21.3	8%	0.077	10%	0.102	C	C	.	.	H	α-helix	trans	-62.2	-40.5	178.4	-57.5	0	0	0	0	111.6	Q355 Q356 V357 H362 L363	Q355-S359 PolarHBondContact NE2-OG 3.11Å; Q355-S359 VanDerWaalsContact NE2-OG 3.07Å; Q355-S359 VanDerWaalsContact O-CB 3.29Å; Q355-S359 WeakPolarHBondContact O-CB 3.32Å; Q355-S359 PolarHBondContact O-N 2.93Å; Q355-S359 PolarHBondContact O-OG 3.32Å; Q356-S359 PolarHBondContact O-N 2.87Å; V357-S359 VanDerWaalsContact C-N 3.35Å; V357-S359 PolarHBondContact O-N 2.82Å; S359-H362 PolarHBondContact O-N 3.08Å; S359-L363 VanDerWaalsContact O-CG 3.29Å; S359-L363 WeakPolarHBondContact O-CG 3.41Å; S359-L363 PolarHBondContact O-N 2.92Å
360	I	94.6	Very high	88.2	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67	-47.8	176.6	-68.7	162.3	0	0	0	110.3	L227 L230 K231 L234 L326 Q356 V357 L358 H362 L363 L364	L227-I360 HydrophobicContact CB-CD1 3.9Å; L227-I360 HydrophobicContact CD2-CD1 3.5Å; L227-I360 VanDerWaalsContact CD2-CD1 3.5Å; L227-I360 HydrophobicContact CG-CD1 4.23Å; L230-I360 HydrophobicContact CB-CD1 4.38Å; L230-I360 HydrophobicContact CD2-CD1 4.03Å; L230-I360 HydrophobicContact CG-CD1 4.21Å; K231-I360 HydrophobicContact CB-CG1 4.03Å; L234-I360 HydrophobicContact CD1-CG2 3.74Å; L326-I360 HydrophobicContact CD1-CB 4.12Å; L326-I360 HydrophobicContact CD1-CG2 3.63Å; L326-I360 HydrophobicContact CD2-CD1 4.12Å; Q356-I360 VanDerWaalsContact O-CG1 3.31Å; Q356-I360 WeakPolarHBondContact O-CG1 3.36Å; Q356-I360 PolarHBondContact O-N 2.74Å; V357-I360 PolarHBondContact O-N 2.84Å; L358-I360 VanDerWaalsContact C-N 3.31Å; L358-I360 PolarHBondContact O-N 3.33Å; I360-H362 VanDerWaalsContact C-N 3.27Å; I360-H362 PolarHBondContact O-N 2.9Å; I360-L363 PolarHBondContact O-N 2.95Å; I360-L363 VanDerWaalsContact O-N 3.15Å; I360-L364 HydrophobicContact CG2-CD1 4.03Å; I360-L364 HydrophobicContact CG2-CG 4.4Å; I360-L364 WeakPolarHBondContact O-CG 3.4Å; I360-L364 PolarHBondContact O-N 2.92Å
361	I	92.9	Very high	87.3	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-57.5	-43.2	176.7	-66.2	170.3	0	0	0	110.6	L326 V357 L358 L364 W365 F389 F393 I438	L326-I361 HydrophobicContact CD1-CD1 4.45Å; L326-I361 HydrophobicContact CD1-CG1 3.79Å; V357-I361 HydrophobicContact CG1-CD1 3.98Å; V357-I361 WeakPolarHBondContact O-CG1 3.5Å; V357-I361 PolarHBondContact O-N 3.08Å; L358-I361 PolarHBondContact O-N 3.09Å; I361-L364 PolarHBondContact O-N 2.85Å; I361-W365 PolarHBondContact O-N 3.43Å; I361-F389 HydrophobicContact CD1-CE1 4.27Å; I361-F389 HydrophobicContact CD1-CZ 4.1Å; I361-F389 HydrophobicContact CG2-CE2 4.33Å; I361-F389 HydrophobicContact CG2-CZ 4.13Å; I361-F393 HydrophobicContact CD1-CE2 3.76Å; I361-F393 HydrophobicContact CD1-CZ 3.86Å; I361-I438 HydrophobicContact CB-CD1 4.17Å; I361-I438 HydrophobicContact CG2-CD1 3.99Å; I361-I438 HydrophobicContact CG2-CG1 4.44Å; I361-I438 HydrophobicContact CG2-CG2 4.11Å
362	H	90.9	Very high	86.1	Confident	63 Å²	63	34.2 Å²	34.2	29%	0.292	16%	0.158	S	C	.	.	H	α-helix	trans	-63.3	-41.3	177.4	-176.4	80.4	0	0	0	112.6	L358 S359 I360 W365 K366 I438	L358-H362 VanDerWaalsContact O-CB 3.27Å; L358-H362 WeakPolarHBondContact O-CB 3.27Å; L358-H362 PolarHBondContact O-N 2.78Å; S359-H362 PolarHBondContact O-N 3.08Å; I360-H362 VanDerWaalsContact C-N 3.27Å; I360-H362 PolarHBondContact O-N 2.9Å; H362-W365 WeakPolarHBondContact O-CB 3.35Å; H362-W365 PolarHBondContact O-N 3.16Å; H362-K366 PolarHBondContact O-N 2.64Å; H362-I438 HydrophobicContact CB-CD1 4.19Å; H362-I438 HydrophobicContact CB-CG1 4.15Å
363	L	91.1	Very high	85.1	Confident	7 Å²	7	36.2 Å²	36.2	4%	0.037	17%	0.168	C	C	.	.	H	α-helix	trans	-65.8	-41.8	176.2	-72.9	169.6	0	0	0	112.1	K231 L234 Q235 V238 S359 I360 W365 K366 L367	K231-L363 HydrophobicContact CG-CD1 3.81Å; K231-L363 WeakPolarHBondContact O-CD1 3.39Å; L234-L363 HydrophobicContact CB-CB 4.29Å; L234-L363 HydrophobicContact CB-CD1 3.99Å; Q235-L363 HydrophobicContact CB-CD1 4.27Å; V238-L363 HydrophobicContact CG2-CD2 4.13Å; S359-L363 VanDerWaalsContact O-CG 3.29Å; S359-L363 WeakPolarHBondContact O-CG 3.41Å; S359-L363 PolarHBondContact O-N 2.92Å; I360-L363 PolarHBondContact O-N 2.95Å; I360-L363 VanDerWaalsContact O-N 3.15Å; L363-W365 VanDerWaalsContact C-N 3.26Å; L363-W365 PolarHBondContact O-N 2.78Å; L363-K366 PolarHBondContact O-N 2.91Å; L363-L367 WeakPolarHBondContact O-CG 3.43Å; L363-L367 PolarHBondContact O-N 3.24Å
364	L	90.6	Very high	84.2	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-58.8	-41.7	172.3	-66	171.4	0	0	0	110.6	L234 L315 F318 I319 I322 I360 I361 L367 T368	L234-L364 HydrophobicContact CD1-CD2 4.33Å; L234-L364 HydrophobicContact CD2-CD2 4.29Å; L315-L364 HydrophobicContact CD1-CD2 4.18Å; F318-L364 HydrophobicContact CD1-CD2 3.94Å; F318-L364 HydrophobicContact CE1-CD2 3.94Å; I319-L364 HydrophobicContact CG1-CB 4.4Å; I319-L364 HydrophobicContact CG1-CD1 4.36Å; I319-L364 HydrophobicContact CG1-CD2 4.41Å; I322-L364 HydrophobicContact CG2-CD1 3.6Å; I360-L364 HydrophobicContact CG2-CD1 4.03Å; I360-L364 HydrophobicContact CG2-CG 4.4Å; I360-L364 WeakPolarHBondContact O-CG 3.4Å; I360-L364 PolarHBondContact O-N 2.92Å; I361-L364 PolarHBondContact O-N 2.85Å; L364-L367 WeakPolarHBondContact O-CB 3.46Å; L364-L367 PolarHBondContact O-N 3.04Å; L364-T368 WeakPolarHBondContact O-CG2 3.43Å; L364-T368 PolarHBondContact O-N 3.2Å
365	W	86.9	Confident	83.5	Confident	11 Å²	11	44.8 Å²	44.8	4%	0.042	21%	0.205	C	C	.	.	H	α-helix	trans	-62.3	-43.2	174.9	-155	-91.6	0	0	0	112.9	I361 H362 L363 L367 T368 K369 E378 L381 S441 L442	I361-W365 PolarHBondContact O-N 3.43Å; H362-W365 WeakPolarHBondContact O-CB 3.35Å; H362-W365 PolarHBondContact O-N 3.16Å; L363-W365 VanDerWaalsContact C-N 3.26Å; L363-W365 PolarHBondContact O-N 2.78Å; W365-L367 VanDerWaalsContact C-N 3.26Å; W365-L367 PolarHBondContact O-N 2.92Å; W365-T368 WeakPolarHBondContact CA-OG1 3.37Å; W365-T368 PolarHBondContact O-N 3.13Å; W365-T368 VanDerWaalsContact O-N 3.07Å; W365-T368 PolarHBondContact O-OG1 2.97Å; W365-K369 PolarHBondContact O-N 2.98Å; W365-K369 VanDerWaalsContact O-N 3.16Å; W365-E378 HydrophobicContact CZ2-CB 4.34Å; W365-E378 HydrophobicContact CZ2-CG 3.94Å; W365-L381 HydrophobicContact CD2-CD1 4.29Å; W365-L381 HydrophobicContact CE3-CD1 3.57Å; W365-L381 HydrophobicContact CE3-CD2 4.45Å; W365-L381 HydrophobicContact CE3-CG 4.34Å; W365-L381 HydrophobicContact CH2-CB 3.3Å; W365-L381 HydrophobicContact CH2-CD1 3.35Å; W365-L381 HydrophobicContact CH2-CG 3.83Å; W365-L381 HydrophobicContact CZ2-CD1 4.13Å; W365-L381 HydrophobicContact CZ3-CB 3.31Å; W365-L381 HydrophobicContact CZ3-CD1 3.08Å; W365-L381 HydrophobicContact CZ3-CD2 3.85Å; W365-L381 HydrophobicContact CZ3-CG 3.51Å; W365-S441 PolarHBondContact NE1-OG 3.14Å; W365-L442 HydrophobicContact CH2-CD2 3.2Å; W365-L442 HydrophobicContact CH2-CG 4.08Å; W365-L442 HydrophobicContact CZ2-CD2 3.98Å; W365-L442 HydrophobicContact CZ3-CD2 3.62Å; W365-L442 HydrophobicContact CZ3-CG 4.41Å
366	K	85.8	Confident	82.9	Confident	58 Å²	58	50 Å²	50	25%	0.252	23%	0.227	S	C	.	.	H	α-helix	trans	-60.4	-38	176.3	-171.8	168.1	174.8	-178.5	0	111.3	V238 D246 H362 L363	V238-K366 HydrophobicContact CG1-CD 3.73Å; V238-K366 HydrophobicContact CG1-CG 4.18Å; D246-K366 IonicContact OD1-NZ 2.71Å; D246-K366 PolarHBondContact OD1-NZ 3.07Å; H362-K366 PolarHBondContact O-N 2.64Å; L363-K366 PolarHBondContact O-N 2.91Å
367	L	84.9	Confident	82.3	Confident	8 Å²	8	50 Å²	50	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-39.1	173.1	-68.2	171.8	0	0	0	112.1	L234 V237 V238 L309 L315 L363 L364 W365 K369 R370	L234-L367 HydrophobicContact CD2-CD1 4.45Å; V237-L367 HydrophobicContact CG1-CD2 4.27Å; V238-L367 HydrophobicContact CG2-CD1 4.37Å; V238-L367 HydrophobicContact CG2-CD2 3.6Å; V238-L367 HydrophobicContact CG2-CG 3.73Å; L309-L367 HydrophobicContact CD1-CD1 4.09Å; L315-L367 HydrophobicContact CD1-CB 4.26Å; L315-L367 HydrophobicContact CD1-CD1 4.26Å; L315-L367 HydrophobicContact CD2-CB 3.84Å; L363-L367 WeakPolarHBondContact O-CG 3.43Å; L363-L367 PolarHBondContact O-N 3.24Å; L364-L367 WeakPolarHBondContact O-CB 3.46Å; L364-L367 PolarHBondContact O-N 3.04Å; W365-L367 VanDerWaalsContact C-N 3.26Å; W365-L367 PolarHBondContact O-N 2.92Å; L367-K369 PolarHBondContact O-N 2.99Å; L367-R370 WeakPolarHBondContact O-CB 3.39Å; L367-R370 PolarHBondContact O-N 3.44Å
368	T	82.7	Confident	81.6	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-35.2	179.9	60.9	0	0	0	0	113.8	L315 I319 L364 W365 R370 H371 M377 L381	L315-T368 HydrophobicContact CD2-CG2 3.68Å; L315-T368 HydrophobicContact CG-CG2 4.34Å; I319-T368 HydrophobicContact CD1-CG2 3.78Å; L364-T368 WeakPolarHBondContact O-CG2 3.43Å; L364-T368 PolarHBondContact O-N 3.2Å; W365-T368 WeakPolarHBondContact CA-OG1 3.37Å; W365-T368 PolarHBondContact O-N 3.13Å; W365-T368 VanDerWaalsContact O-N 3.07Å; W365-T368 PolarHBondContact O-OG1 2.97Å; T368-R370 PolarHBondContact O-N 2.7Å; T368-H371 PolarHBondContact O-N 3.39Å; T368-M377 HydrophobicContact CG2-CG 3.66Å; T368-M377 HydrophobicContact CG2-SD 4.4Å; T368-L381 HydrophobicContact CG2-CD1 3.93Å
369	K	76.3	Confident	81.2	Confident	87 Å²	87	55.5 Å²	55.5	38%	0.378	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-12.8	177.2	-74.3	-177.8	167.9	-174.3	0	114.4	E247 W365 L367 T374	E247-K369 IonicContact OE2-NZ 2.91Å; E247-K369 PolarHBondContact OE2-NZ 3.26Å; W365-K369 PolarHBondContact O-N 2.98Å; W365-K369 VanDerWaalsContact O-N 3.16Å; L367-K369 PolarHBondContact O-N 2.99Å; K369-T374 HydrophobicContact CG-CG2 4.38Å; K369-T374 PolarHBondContact O-OG1 3.27Å; K369-T374 VanDerWaalsContact O-OG1 3.13Å
370	R	68.4	Low	81	Confident	141 Å²	141	57 Å²	57	53%	0.532	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.4	-177.2	-169.4	166.3	173.3	-118.9	1.3	113.3	S241 L367 T368	S241-R370 PolarHBondContact O-NE 2.87Å; S241-R370 PolarHBondContact O-NH2 3.19Å; S241-R370 PolarHBondContact OG-NH1 3.46Å; L367-R370 WeakPolarHBondContact O-CB 3.39Å; L367-R370 PolarHBondContact O-N 3.44Å; T368-R370 PolarHBondContact O-N 2.7Å
371	H	66.6	Low	80.6	Confident	40 Å²	40	57.1 Å²	57.1	19%	0.185	26%	0.26	C	S	.	.	S	Bend	trans	-90.9	144.5	-177.5	-65.3	-72.4	0	0	0	112.2	S310 T368 E373 T374	S310-H371 PolarHBondContact O-CE1 3.41Å; S310-H371 VanDerWaalsContact O-CE1 3.29Å; T368-H371 PolarHBondContact O-N 3.39Å; H371-E373 PolarHBondContact O-N 3.46Å; H371-T374 PolarHBondContact O-N 3.5Å; H371-T374 PolarHBondContact O-OG1 3.16Å
372	D	59.5	Low	80.4	Confident	179 Å²	179	58.8 Å²	58.8	96%	0.957	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-23.1	179	-69	-33.1	0	0	0	113.3
373	E	67.5	Low	80.2	Confident	110 Å²	110	63.7 Å²	63.7	51%	0.514	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	31.8	176.6	-55.4	-159.7	140.5	0	0	114.3	H371 Y375 K376 M377	H371-E373 PolarHBondContact O-N 3.46Å; E373-Y375 PolarHBondContact O-N 2.9Å; E373-K376 HydrophobicContact CB-CB 4.4Å; E373-K376 HydrophobicContact CB-CD 4.29Å; E373-K376 HydrophobicContact CG-CD 4.5Å; E373-K376 PolarHBondContact O-N 3.03Å; E373-K376 IonicContact OE1-NZ 2.54Å; E373-K376 PolarHBondContact OE1-NZ 2.7Å; E373-K376 WeakPolarHBondContact OE2-CD 3.49Å; E373-K376 IonicContact OE2-NZ 3.29Å; E373-M377 PolarHBondContact O-N 2.99Å
374	T	72.3	Confident	80.1	Confident	37 Å²	37	67.1 Å²	67.1	23%	0.227	31%	0.31	C	S	.	.	H	α-helix	trans	-45.8	-45.2	-176.6	-63.4	0	0	0	0	112.8	K369 H371 K376 M377 E378	K369-T374 HydrophobicContact CG-CG2 4.38Å; K369-T374 PolarHBondContact O-OG1 3.27Å; K369-T374 VanDerWaalsContact O-OG1 3.13Å; H371-T374 PolarHBondContact O-N 3.5Å; H371-T374 PolarHBondContact O-OG1 3.16Å; T374-K376 PolarHBondContact O-N 3.2Å; T374-M377 PolarHBondContact O-N 2.78Å; T374-E378 HydrophobicContact CG2-CG 4.17Å; T374-E378 WeakPolarHBondContact O-CG 3.23Å; T374-E378 PolarHBondContact O-N 3.26Å
375	Y	76.1	Confident	80.2	Confident	146 Å²	146	67.9 Å²	67.9	57%	0.573	31%	0.313	S	S	*	.	H	α-helix	trans	-61.7	-39.2	-179.2	-178.4	-104	0	0	0	113.8	E373 M377 L379	E373-Y375 PolarHBondContact O-N 2.9Å; Y375-M377 VanDerWaalsContact C-N 3.35Å; Y375-L379 HydrophobicContact CD1-CD1 3.89Å; Y375-L379 HydrophobicContact CE1-CD1 3.33Å; Y375-L379 HydrophobicContact CE1-CG 4.21Å; Y375-L379 HydrophobicContact CE2-CD1 4.37Å; Y375-L379 HydrophobicContact CE2-CG 4.46Å; Y375-L379 WeakPolarHBondContact O-CG 3.36Å; Y375-L379 PolarHBondContact O-N 2.82Å; Y375-L379 VanDerWaalsContact O-N 3.11Å
376	K	80.3	Confident	80.3	Confident	124 Å²	124	67.9 Å²	67.9	54%	0.539	31%	0.313	S	S	.	.	H	α-helix	trans	-68.1	-38.9	178.2	-67.6	-177.7	-174.2	169.2	0	111	E373 T374 W380	E373-K376 HydrophobicContact CB-CB 4.4Å; E373-K376 HydrophobicContact CB-CD 4.29Å; E373-K376 HydrophobicContact CG-CD 4.5Å; E373-K376 PolarHBondContact O-N 3.03Å; E373-K376 IonicContact OE1-NZ 2.54Å; E373-K376 PolarHBondContact OE1-NZ 2.7Å; E373-K376 WeakPolarHBondContact OE2-CD 3.49Å; E373-K376 IonicContact OE2-NZ 3.29Å; T374-K376 PolarHBondContact O-N 3.2Å; K376-W380 WeakPolarHBondContact O-CB 3.31Å; K376-W380 PolarHBondContact O-N 3.03Å
377	M	79.5	Confident	80.5	Confident	22 Å²	22	70.3 Å²	70.3	11%	0.108	33%	0.333	C	S	.	.	H	α-helix	trans	-69	-43	178.6	-167.6	61.5	77.1	0	0	111.7	A312 K316 T368 E373 T374 Y375 L379 W380 L381	A312-M377 HydrophobicContact CB-CE 4.18Å; K316-M377 HydrophobicContact CB-CE 4.31Å; T368-M377 HydrophobicContact CG2-CG 3.66Å; T368-M377 HydrophobicContact CG2-SD 4.4Å; E373-M377 PolarHBondContact O-N 2.99Å; T374-M377 PolarHBondContact O-N 2.78Å; Y375-M377 VanDerWaalsContact C-N 3.35Å; M377-L379 PolarHBondContact O-N 3.02Å; M377-W380 PolarHBondContact O-N 3.29Å; M377-W380 HydrophobicContact SD-CE3 3.6Å; M377-W380 HydrophobicContact SD-CZ3 4.09Å; M377-L381 HydrophobicContact CG-CD1 3.95Å; M377-L381 WeakPolarHBondContact O-CB 3.46Å; M377-L381 WeakPolarHBondContact O-CD1 3.29Å; M377-L381 WeakPolarHBondContact O-CG 3.48Å; M377-L381 PolarHBondContact O-N 3.36Å
378	E	80.4	Confident	80.7	Confident	45 Å²	45	72.8 Å²	72.8	21%	0.21	35%	0.346	C	S	.	.	H	α-helix	trans	-59.1	-44.3	174.5	-72.4	-174.6	164.6	0	0	111.8	W365 T374 R382	W365-E378 HydrophobicContact CZ2-CB 4.34Å; W365-E378 HydrophobicContact CZ2-CG 3.94Å; T374-E378 HydrophobicContact CG2-CG 4.17Å; T374-E378 WeakPolarHBondContact O-CG 3.23Å; T374-E378 PolarHBondContact O-N 3.26Å; E378-R382 WeakPolarHBondContact O-CB 3.35Å; E378-R382 PolarHBondContact O-N 2.97Å
379	L	83.8	Confident	81.2	Confident	71 Å²	71	72.9 Å²	72.9	37%	0.372	35%	0.346	S	S	.	.	H	α-helix	trans	-62.9	-47	175	-76.3	175.9	0	0	0	112.1	Y375 M377 L381 R382 M383	Y375-L379 HydrophobicContact CD1-CD1 3.89Å; Y375-L379 HydrophobicContact CE1-CD1 3.33Å; Y375-L379 HydrophobicContact CE1-CG 4.21Å; Y375-L379 HydrophobicContact CE2-CD1 4.37Å; Y375-L379 HydrophobicContact CE2-CG 4.46Å; Y375-L379 WeakPolarHBondContact O-CG 3.36Å; Y375-L379 PolarHBondContact O-N 2.82Å; Y375-L379 VanDerWaalsContact O-N 3.11Å; M377-L379 PolarHBondContact O-N 3.02Å; L379-L381 PolarHBondContact O-N 3.25Å; L379-R382 PolarHBondContact O-N 2.93Å; L379-M383 WeakPolarHBondContact O-CG 3.41Å; L379-M383 PolarHBondContact O-N 3.13Å
380	W	88.9	Confident	81.8	Confident	42 Å²	42	71.9 Å²	71.9	16%	0.159	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-46.6	179	172	79.3	0	0	0	111.5	K316 I319 E320 K376 M377 R382 M383 N384 Y385	K316-W380 HydrophobicContact CD-CD2 4.4Å; K316-W380 HydrophobicContact CD-CZ2 4.34Å; K316-W380 HydrophobicContact CG-CD2 4.35Å; K316-W380 HydrophobicContact CG-CE3 4.25Å; K316-W380 HydrophobicContact CG-CH2 3.69Å; K316-W380 HydrophobicContact CG-CZ2 3.75Å; K316-W380 HydrophobicContact CG-CZ3 3.94Å; I319-W380 HydrophobicContact CB-CH2 4.26Å; I319-W380 HydrophobicContact CB-CZ3 4.41Å; I319-W380 HydrophobicContact CG2-CH2 3.73Å; I319-W380 HydrophobicContact CG2-CZ3 3.84Å; E320-W380 HydrophobicContact CG-CH2 3.83Å; E320-W380 HydrophobicContact CG-CZ2 3.57Å; E320-W380 VanDerWaalsContact OE1-CZ2 3.31Å; E320-W380 WeakPolarHBondContact OE1-CZ2 3.28Å; K376-W380 WeakPolarHBondContact O-CB 3.31Å; K376-W380 PolarHBondContact O-N 3.03Å; M377-W380 PolarHBondContact O-N 3.29Å; M377-W380 HydrophobicContact SD-CE3 3.6Å; M377-W380 HydrophobicContact SD-CZ3 4.09Å; W380-R382 VanDerWaalsContact C-N 3.33Å; W380-R382 PolarHBondContact O-N 3.01Å; W380-M383 PolarHBondContact O-N 3.36Å; W380-N384 VanDerWaalsContact CE2-ND2 3.33Å; W380-N384 PolarHBondContact NE1-ND2 2.78Å; W380-N384 PolarHBondContact O-N 3.32Å; W380-N384 VanDerWaalsContact O-N 3.15Å; W380-N384 PolarHBondContact O-ND2 2.96Å; W380-Y385 AromaticContact CH2-CE2 3.91Å; W380-Y385 HydrophobicContact CH2-CE2 3.91Å; W380-Y385 HydrophobicContact CZ2-CE2 4.41Å; W380-Y385 HydrophobicContact CZ3-CE2 4.3Å
381	L	86.9	Confident	82.8	Confident	3 Å²	3	70.2 Å²	70.2	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-61.3	-43.1	177.5	-78.1	158	0	0	0	112.1	I319 I323 W365 T368 M377 L379 M383 N384 Y385 L442	I319-L381 HydrophobicContact CD1-CD2 4.41Å; I319-L381 HydrophobicContact CG2-CD2 3.87Å; I323-L381 HydrophobicContact CD1-CD2 4.5Å; W365-L381 HydrophobicContact CD2-CD1 4.29Å; W365-L381 HydrophobicContact CE3-CD1 3.57Å; W365-L381 HydrophobicContact CE3-CD2 4.45Å; W365-L381 HydrophobicContact CE3-CG 4.34Å; W365-L381 HydrophobicContact CH2-CB 3.3Å; W365-L381 HydrophobicContact CH2-CD1 3.35Å; W365-L381 HydrophobicContact CH2-CG 3.83Å; W365-L381 HydrophobicContact CZ2-CD1 4.13Å; W365-L381 HydrophobicContact CZ3-CB 3.31Å; W365-L381 HydrophobicContact CZ3-CD1 3.08Å; W365-L381 HydrophobicContact CZ3-CD2 3.85Å; W365-L381 HydrophobicContact CZ3-CG 3.51Å; T368-L381 HydrophobicContact CG2-CD1 3.93Å; M377-L381 HydrophobicContact CG-CD1 3.95Å; M377-L381 WeakPolarHBondContact O-CB 3.46Å; M377-L381 WeakPolarHBondContact O-CD1 3.29Å; M377-L381 WeakPolarHBondContact O-CG 3.48Å; M377-L381 PolarHBondContact O-N 3.36Å; L379-L381 PolarHBondContact O-N 3.25Å; L381-M383 PolarHBondContact O-N 3.21Å; L381-N384 PolarHBondContact O-N 3.41Å; L381-Y385 HydrophobicContact CD2-CD2 3.94Å; L381-Y385 HydrophobicContact CD2-CE2 3.99Å; L381-Y385 PolarHBondContact O-N 3.29Å; L381-L442 HydrophobicContact CB-CD2 4.47Å
382	R	88.1	Confident	83.8	Confident	38 Å²	38	70.7 Å²	70.7	14%	0.143	34%	0.342	C	S	.	.	H	α-helix	trans	-59.9	-45.6	176.3	-173.8	-172	166.9	83.1	5.3	111.7	E378 L379 W380 N384 L386 L442 D451	E378-R382 WeakPolarHBondContact O-CB 3.35Å; E378-R382 PolarHBondContact O-N 2.97Å; L379-R382 PolarHBondContact O-N 2.93Å; W380-R382 VanDerWaalsContact C-N 3.33Å; W380-R382 PolarHBondContact O-N 3.01Å; R382-N384 VanDerWaalsContact C-N 3.31Å; R382-N384 PolarHBondContact O-N 3.39Å; R382-L386 HydrophobicContact CG-CB 4.23Å; R382-L386 HydrophobicContact CG-CD2 3.85Å; R382-L386 WeakPolarHBondContact O-CB 3.41Å; R382-L386 PolarHBondContact O-N 3.23Å; R382-L442 HydrophobicContact CB-CD2 4.26Å; R382-L442 WeakPolarHBondContact CD-O 3.13Å; R382-L442 PolarHBondContact NH1-O 3.32Å; R382-D451 IonicContact CZ-OD1 3.99Å; R382-D451 IonicContact CZ-OD2 2.78Å; R382-D451 IonicContact NH1-OD1 3.2Å; R382-D451 IonicContact NH1-OD2 3.43Å; R382-D451 PolarHBondContact NH1-OD2 2.74Å; R382-D451 IonicContact NH2-OD1 2.71Å; R382-D451 PolarHBondContact NH2-OD1 2.74Å; R382-D451 VanDerWaalsContact NH2-OD1 3.1Å; R382-D451 IonicContact NH2-OD2 3.44Å; R382-D451 PolarHBondContact NH2-OD2 3.34Å
383	M	87.6	Confident	85.3	Confident	165 Å²	165	62.2 Å²	62.2	81%	0.813	30%	0.297	S	S	*	.	H	α-helix	trans	-65.8	-32.4	-178.6	-69.3	-159.5	84.2	0	0	113	L379 W380 L381	L379-M383 WeakPolarHBondContact O-CG 3.41Å; L379-M383 PolarHBondContact O-N 3.13Å; W380-M383 PolarHBondContact O-N 3.36Å; L381-M383 PolarHBondContact O-N 3.21Å
384	N	88.8	Confident	86.4	Confident	80 Å²	80	57.3 Å²	57.3	43%	0.428	27%	0.274	S	S	.	.	H	α-helix	trans	-91.1	-34	-175.5	-69.2	-72.2	0	0	0	114.4	W380 L381 R382	W380-N384 VanDerWaalsContact CE2-ND2 3.33Å; W380-N384 PolarHBondContact NE1-ND2 2.78Å; W380-N384 PolarHBondContact O-N 3.32Å; W380-N384 VanDerWaalsContact O-N 3.15Å; W380-N384 PolarHBondContact O-ND2 2.96Å; L381-N384 PolarHBondContact O-N 3.41Å; R382-N384 VanDerWaalsContact C-N 3.31Å; R382-N384 PolarHBondContact O-N 3.39Å
385	Y	91.8	Very high	87	Confident	18 Å²	18	62.4 Å²	62.4	7%	0.071	29%	0.289	C	S	.	.	H	α-helix	trans	-122.1	-12.5	-166.8	-56.6	-68.7	0	0	0	115.5	I319 E320 I323 W380 L381 V387 D388 F389	I319-Y385 HydrophobicContact CG2-CE2 3.87Å; I319-Y385 PolarHBondContact O-OH 3.35Å; E320-Y385 WeakPolarHBondContact CA-OH 3.48Å; I323-Y385 HydrophobicContact CB-CD1 4.25Å; I323-Y385 HydrophobicContact CB-CE1 3.87Å; I323-Y385 HydrophobicContact CD1-CD2 4.1Å; I323-Y385 HydrophobicContact CD1-CE2 4.06Å; I323-Y385 HydrophobicContact CD1-CG 4.37Å; I323-Y385 HydrophobicContact CG2-CD1 3.44Å; I323-Y385 VanDerWaalsContact CG2-CD1 3.44Å; I323-Y385 HydrophobicContact CG2-CE1 3.56Å; I323-Y385 HydrophobicContact CG2-CG 4.01Å; W380-Y385 AromaticContact CH2-CE2 3.91Å; W380-Y385 HydrophobicContact CH2-CE2 3.91Å; W380-Y385 HydrophobicContact CZ2-CE2 4.41Å; W380-Y385 HydrophobicContact CZ3-CE2 4.3Å; L381-Y385 HydrophobicContact CD2-CD2 3.94Å; L381-Y385 HydrophobicContact CD2-CE2 3.99Å; L381-Y385 PolarHBondContact O-N 3.29Å; Y385-V387 VanDerWaalsContact C-N 3.3Å; Y385-V387 PolarHBondContact O-N 3.29Å; Y385-D388 PolarHBondContact O-N 2.9Å; Y385-F389 WeakPolarHBondContact O-CD1 3.49Å; Y385-F389 WeakPolarHBondContact O-CG 3.36Å; Y385-F389 PolarHBondContact O-N 3.41Å
386	L	90.5	Very high	87.4	Confident	11 Å²	11	57.9 Å²	57.9	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-62.1	-38.2	-176	179.1	66.3	0	0	0	112.6	R382 F389 K390 M439 L442	R382-L386 HydrophobicContact CG-CB 4.23Å; R382-L386 HydrophobicContact CG-CD2 3.85Å; R382-L386 WeakPolarHBondContact O-CB 3.41Å; R382-L386 PolarHBondContact O-N 3.23Å; L386-F389 PolarHBondContact O-N 2.66Å; L386-K390 HydrophobicContact CD1-CG 4.37Å; L386-K390 HydrophobicContact CG-CD 4.26Å; L386-K390 HydrophobicContact CG-CG 4.49Å; L386-K390 WeakPolarHBondContact O-CB 3.42Å; L386-K390 VanDerWaalsContact O-CG 3.31Å; L386-K390 WeakPolarHBondContact O-CG 3.36Å; L386-K390 PolarHBondContact O-N 2.91Å; L386-M439 HydrophobicContact CD1-CE 4.1Å; L386-L442 HydrophobicContact CD1-CB 4.32Å; L386-L442 HydrophobicContact CD1-CD1 4.17Å
387	V	89.9	Confident	87.7	Confident	108 Å²	108	52.7 Å²	52.7	66%	0.655	25%	0.251	S	S	*	.	H	α-helix	trans	-63.4	-46.9	-179.9	178.5	0	0	0	0	110.1	Y385 K390 H391	Y385-V387 VanDerWaalsContact C-N 3.3Å; Y385-V387 PolarHBondContact O-N 3.29Å; V387-K390 PolarHBondContact O-N 3.04Å; V387-H391 PolarHBondContact O-N 3.15Å
388	D	89	Confident	88.1	Confident	60 Å²	60	54 Å²	54	32%	0.321	26%	0.261	S	S	.	.	H	α-helix	trans	-64.5	-42.2	178.3	-59.2	-35.5	0	0	0	111.4	I327 Y385 K390 H391 H392	I327-D388 HydrophobicContact CD1-CB 3.91Å; Y385-D388 PolarHBondContact O-N 2.9Å; D388-K390 VanDerWaalsContact C-N 3.35Å; D388-K390 PolarHBondContact O-N 2.93Å; D388-H391 PolarHBondContact O-N 3.4Å; D388-H392 WeakPolarHBondContact O-CB 3.46Å; D388-H392 PolarHBondContact O-CD2 3.4Å; D388-H392 VanDerWaalsContact O-CD2 3.25Å; D388-H392 PolarHBondContact O-N 3.39Å
389	F	92.6	Very high	88.4	Confident	3 Å²	3	52.4 Å²	52.4	1%	0.013	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-38.5	177	-68.5	-1.5	0	0	0	112.2	I323 I327 I361 Y385 L386 F393 M394 I438 M439 L442	I323-F389 HydrophobicContact CD1-CZ 4.47Å; I323-F389 HydrophobicContact CG2-CE1 3.99Å; I323-F389 HydrophobicContact CG2-CZ 4.15Å; I327-F389 HydrophobicContact CD1-CD1 4.36Å; I327-F389 HydrophobicContact CD1-CE1 4.05Å; I327-F389 HydrophobicContact CG1-CE1 4.25Å; I361-F389 HydrophobicContact CD1-CE1 4.27Å; I361-F389 HydrophobicContact CD1-CZ 4.1Å; I361-F389 HydrophobicContact CG2-CE2 4.33Å; I361-F389 HydrophobicContact CG2-CZ 4.13Å; Y385-F389 WeakPolarHBondContact O-CD1 3.49Å; Y385-F389 WeakPolarHBondContact O-CG 3.36Å; Y385-F389 PolarHBondContact O-N 3.41Å; L386-F389 PolarHBondContact O-N 2.66Å; F389-F393 HydrophobicContact CB-CD2 3.97Å; F389-F393 HydrophobicContact CB-CE2 4.49Å; F389-F393 AromaticContact CD1-CD2 3.69Å; F389-F393 HydrophobicContact CD1-CD2 3.69Å; F389-F393 AromaticContact CD1-CE2 3.31Å; F389-F393 HydrophobicContact CD1-CE2 3.31Å; F389-F393 AromaticContact CD1-CZ 3.98Å; F389-F393 HydrophobicContact CD1-CZ 3.98Å; F389-F393 HydrophobicContact CD2-CD2 4.44Å; F389-F393 HydrophobicContact CD2-CE2 4.4Å; F389-F393 HydrophobicContact CE1-CD2 4.28Å; F389-F393 AromaticContact CE1-CE2 3.48Å; F389-F393 HydrophobicContact CE1-CE2 3.48Å; F389-F393 VanDerWaalsContact CE1-CE2 3.48Å; F389-F393 HydrophobicContact CE1-CZ 4.01Å; F389-F393 AromaticContact CG-CD2 3.79Å; F389-F393 HydrophobicContact CG-CD2 3.79Å; F389-F393 AromaticContact CG-CE2 3.83Å; F389-F393 HydrophobicContact CG-CE2 3.83Å; F389-F393 HydrophobicContact CZ-CE2 4.11Å; F389-F393 WeakPolarHBondContact O-CA 3.37Å; F389-F393 VanDerWaalsContact O-CB 3.31Å; F389-F393 WeakPolarHBondContact O-CB 3.08Å; F389-F393 PolarHBondContact O-N 3.07Å; F389-M394 PolarHBondContact O-N 3.17Å; F389-M394 VanDerWaalsContact O-N 3.13Å; F389-I438 HydrophobicContact CD2-CG2 4.42Å; F389-I438 HydrophobicContact CE2-CG2 4.16Å; F389-M439 HydrophobicContact CB-SD 3.93Å; F389-M439 HydrophobicContact CD2-SD 4.49Å; F389-L442 HydrophobicContact CD2-CD1 3.68Å; F389-L442 HydrophobicContact CE2-CD1 4.05Å
390	K	89.2	Confident	88.4	Confident	66 Å²	66	52.2 Å²	52.2	29%	0.287	26%	0.257	S	S	.	.	H	α-helix	trans	-62.5	-44.5	173.1	-75.4	177.9	-176.5	-174.1	0	111.1	L386 V387 D388 M439 D451	L386-K390 HydrophobicContact CD1-CG 4.37Å; L386-K390 HydrophobicContact CG-CD 4.26Å; L386-K390 HydrophobicContact CG-CG 4.49Å; L386-K390 WeakPolarHBondContact O-CB 3.42Å; L386-K390 VanDerWaalsContact O-CG 3.31Å; L386-K390 WeakPolarHBondContact O-CG 3.36Å; L386-K390 PolarHBondContact O-N 2.91Å; V387-K390 PolarHBondContact O-N 3.04Å; D388-K390 VanDerWaalsContact C-N 3.35Å; D388-K390 PolarHBondContact O-N 2.93Å; K390-M439 HydrophobicContact CG-CE 4.34Å; K390-D451 IonicContact NZ-OD1 2.72Å; K390-D451 PolarHBondContact NZ-OD1 2.71Å
391	H	88.9	Confident	87.8	Confident	106 Å²	106	52.6 Å²	52.6	49%	0.491	26%	0.263	S	S	.	.	H	α-helix	trans	-73.4	-40	-176	-171.8	71.7	0	0	0	113.4	V387 D388 R395	V387-H391 PolarHBondContact O-N 3.15Å; D388-H391 PolarHBondContact O-N 3.4Å; H391-R395 WeakPolarHBondContact O-CB 3.48Å
392	H	88.8	Confident	87	Confident	51 Å²	51	56.2 Å²	56.2	24%	0.236	28%	0.279	C	S	.	.	H	α-helix	trans	-98.1	-43.5	-173.8	-63.9	-65.1	0	0	0	113.6	I327 W330 I331 D388	I327-H392 HydrophobicContact CG2-CB 4.49Å; W330-H392 PolarHBondContact NE1-O 3.46Å; I331-H392 VanDerWaalsContact CD1-CE1 3.4Å; I331-H392 WeakPolarHBondContact CD1-CE1 3.34Å; D388-H392 WeakPolarHBondContact O-CB 3.46Å; D388-H392 PolarHBondContact O-CD2 3.4Å; D388-H392 VanDerWaalsContact O-CD2 3.25Å; D388-H392 PolarHBondContact O-N 3.39Å
393	F	91	Very high	85.4	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-39.1	-173.3	-56.7	-16.7	0	0	0	112.8	I327 W330 V357 L358 I361 F389 Y399 L435	I327-F393 HydrophobicContact CG1-CE1 4.45Å; I327-F393 HydrophobicContact CG1-CZ 4.08Å; W330-F393 HydrophobicContact CB-CD1 4.45Å; W330-F393 HydrophobicContact CB-CE1 3.78Å; W330-F393 AromaticContact CD1-CD1 3.77Å; W330-F393 AromaticContact CD1-CE1 3.94Å; W330-F393 AromaticContact CD2-CD1 3.43Å; W330-F393 HydrophobicContact CD2-CD1 3.43Å; W330-F393 VanDerWaalsContact CD2-CD1 3.43Å; W330-F393 AromaticContact CD2-CE1 3.5Å; W330-F393 HydrophobicContact CD2-CE1 3.5Å; W330-F393 VanDerWaalsContact CD2-CE1 3.5Å; W330-F393 HydrophobicContact CD2-CG 4.48Å; W330-F393 AromaticContact CE2-CD1 3.37Å; W330-F393 AromaticContact CE2-CE1 3.97Å; W330-F393 AromaticContact CE3-CD1 3.97Å; W330-F393 HydrophobicContact CE3-CD1 3.97Å; W330-F393 AromaticContact CE3-CE1 3.87Å; W330-F393 HydrophobicContact CE3-CE1 3.87Å; W330-F393 AromaticContact CG-CD1 3.67Å; W330-F393 HydrophobicContact CG-CD1 3.67Å; W330-F393 AromaticContact CG-CE1 3.47Å; W330-F393 HydrophobicContact CG-CE1 3.47Å; W330-F393 VanDerWaalsContact CG-CE1 3.47Å; W330-F393 HydrophobicContact CH2-CD1 4.34Å; W330-F393 HydrophobicContact CZ2-CB 4.12Å; W330-F393 AromaticContact CZ2-CD1 3.84Å; W330-F393 HydrophobicContact CZ2-CD1 3.84Å; W330-F393 HydrophobicContact CZ2-CG 4.24Å; W330-F393 HydrophobicContact CZ3-CD1 4.4Å; W330-F393 AromaticContact NE1-CD1 3.59Å; V357-F393 HydrophobicContact CG1-CZ 4.17Å; L358-F393 HydrophobicContact CD2-CD2 3.98Å; L358-F393 HydrophobicContact CD2-CE2 3.95Å; L358-F393 HydrophobicContact CD2-CZ 4.47Å; I361-F393 HydrophobicContact CD1-CE2 3.76Å; I361-F393 HydrophobicContact CD1-CZ 3.86Å; F389-F393 HydrophobicContact CB-CD2 3.97Å; F389-F393 HydrophobicContact CB-CE2 4.49Å; F389-F393 AromaticContact CD1-CD2 3.69Å; F389-F393 HydrophobicContact CD1-CD2 3.69Å; F389-F393 AromaticContact CD1-CE2 3.31Å; F389-F393 HydrophobicContact CD1-CE2 3.31Å; F389-F393 AromaticContact CD1-CZ 3.98Å; F389-F393 HydrophobicContact CD1-CZ 3.98Å; F389-F393 HydrophobicContact CD2-CD2 4.44Å; F389-F393 HydrophobicContact CD2-CE2 4.4Å; F389-F393 HydrophobicContact CE1-CD2 4.28Å; F389-F393 AromaticContact CE1-CE2 3.48Å; F389-F393 HydrophobicContact CE1-CE2 3.48Å; F389-F393 VanDerWaalsContact CE1-CE2 3.48Å; F389-F393 HydrophobicContact CE1-CZ 4.01Å; F389-F393 AromaticContact CG-CD2 3.79Å; F389-F393 HydrophobicContact CG-CD2 3.79Å; F389-F393 AromaticContact CG-CE2 3.83Å; F389-F393 HydrophobicContact CG-CE2 3.83Å; F389-F393 HydrophobicContact CZ-CE2 4.11Å; F389-F393 WeakPolarHBondContact O-CA 3.37Å; F389-F393 VanDerWaalsContact O-CB 3.31Å; F389-F393 WeakPolarHBondContact O-CB 3.08Å; F389-F393 PolarHBondContact O-N 3.07Å; F393-Y399 WeakPolarHBondContact O-CE2 3.32Å; F393-Y399 PolarHBondContact O-OH 2.81Å; F393-L435 HydrophobicContact CB-CD1 3.67Å; F393-L435 HydrophobicContact CB-CD2 4.24Å; F393-L435 HydrophobicContact CD2-CD1 4.11Å; F393-L435 HydrophobicContact CG-CD1 4.3Å
394	M	89.6	Confident	83.3	Confident	8 Å²	8	60 Å²	60	4%	0.039	31%	0.305	C	S	.	.	S	Bend	trans	-87.2	-10.2	-175.9	-69	-60.3	-64.5	0	0	114.8	F389 H396 F397 L435 M439 W454 M457 I458	F389-M394 PolarHBondContact O-N 3.17Å; F389-M394 VanDerWaalsContact O-N 3.13Å; M394-H396 PolarHBondContact O-N 2.68Å; M394-F397 HydrophobicContact CE-CB 4.14Å; M394-F397 HydrophobicContact CE-CD1 3.76Å; M394-F397 HydrophobicContact CE-CE1 4.39Å; M394-F397 HydrophobicContact CE-CG 3.97Å; M394-F397 PolarHBondContact O-N 3.02Å; M394-F397 HydrophobicContact SD-CB 4.24Å; M394-F397 HydrophobicContact SD-CG 4.22Å; M394-L435 HydrophobicContact SD-CD1 4.46Å; M394-L435 HydrophobicContact SD-CD2 4Å; M394-L435 HydrophobicContact SD-CG 4.08Å; M394-M439 HydrophobicContact CG-CE 3.69Å; M394-M439 HydrophobicContact CG-CG 4.24Å; M394-M439 HydrophobicContact CG-SD 4.07Å; M394-M439 HydrophobicContact SD-CE 4.36Å; M394-M439 HydrophobicContact SD-CG 3.85Å; M394-M439 HydrophobicContact SD-SD 4.46Å; M394-W454 HydrophobicContact CE-CB 4.25Å; M394-M457 HydrophobicContact CE-CE 4.3Å; M394-I458 HydrophobicContact CE-CD1 4.25Å; M394-I458 HydrophobicContact CE-CG1 3.96Å
395	R	85	Confident	80.9	Confident	143 Å²	143	62 Å²	62	54%	0.54	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-39.2	-173.7	-178.3	175.6	177.1	168.1	-0.2	114.4	H391	H391-R395 WeakPolarHBondContact O-CB 3.48Å
396	H	84.1	Confident	78.3	Confident	51 Å²	51	70 Å²	70	24%	0.236	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	20.5	-178.6	-56.3	123.4	0	0	0	112	N344 M394 P398 Y399	N344-H396 PolarHBondContact ND2-O 3.44Å; N344-H396 WeakPolarHBondContact OD1-CA 3.26Å; N344-H396 WeakPolarHBondContact OD1-CB 3.31Å; N344-H396 PolarHBondContact OD1-O 2.95Å; N344-H396 VanDerWaalsContact OD1-O 3.05Å; M394-H396 PolarHBondContact O-N 2.68Å; H396-P398 CarbonylContact O-C 3.41Å; H396-Y399 HydrophobicContact CB-CD1 4.45Å; H396-Y399 HydrophobicContact CB-CE1 3.7Å
397	F	87.4	Confident	75.7	Confident	16 Å²	16	78.2 Å²	78.2	7%	0.07	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-74.7	137.5	178.4	177.5	-93.3	0	0	0	110.8	M394 Y399 N432 L435 C436 I458 F461	M394-F397 HydrophobicContact CE-CB 4.14Å; M394-F397 HydrophobicContact CE-CD1 3.76Å; M394-F397 HydrophobicContact CE-CE1 4.39Å; M394-F397 HydrophobicContact CE-CG 3.97Å; M394-F397 PolarHBondContact O-N 3.02Å; M394-F397 HydrophobicContact SD-CB 4.24Å; M394-F397 HydrophobicContact SD-CG 4.22Å; F397-Y399 HydrophobicContact CB-CE2 4.44Å; F397-N432 HydrophobicContact CE2-CB 3.88Å; F397-L435 HydrophobicContact CD2-CD2 3.72Å; F397-L435 HydrophobicContact CE2-CD2 4.36Å; F397-L435 HydrophobicContact CG-CD2 4.46Å; F397-C436 VanDerWaalsContact CZ-SG 3.58Å; F397-I458 HydrophobicContact CE1-CG1 4.31Å; F397-F461 HydrophobicContact CE1-CB 3.82Å; F397-F461 HydrophobicContact CE1-CD1 4.41Å; F397-F461 HydrophobicContact CE1-CG 4.05Å; F397-F461 HydrophobicContact CZ-CB 3.93Å; F397-F461 AromaticContact CZ-CD1 3.66Å; F397-F461 HydrophobicContact CZ-CD1 3.66Å; F397-F461 HydrophobicContact CZ-CD2 4.26Å; F397-F461 HydrophobicContact CZ-CE1 4.24Å; F397-F461 AromaticContact CZ-CG 3.66Å; F397-F461 HydrophobicContact CZ-CG 3.66Å
398	P	87.9	Confident	72.9	Confident	50 Å²	50	82.8 Å²	82.8	33%	0.325	40%	0.404	S	S	.	.	S	Bend	cis	-84.3	145.4	-0.6	33	-34.3	0	0	0	113.9	N344 H396 F461	N344-P398 PolarHBondContact ND2-O 3.43Å; H396-P398 CarbonylContact O-C 3.41Å; P398-F461 HydrophobicContact CB-CD2 3.64Å; P398-F461 HydrophobicContact CB-CE2 3.85Å; P398-F461 HydrophobicContact CB-CG 4.47Å; P398-F461 HydrophobicContact CG-CD2 4.03Å
399	Y	87.2	Confident	70.3	Confident	10 Å²	10	89.8 Å²	89.8	4%	0.039	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-83.4	144.3	179.3	-62.5	-82.6	0	0	0	111.9	W330 L346 M354 F393 H396 F397 L431 N432 L435	W330-Y399 HydrophobicContact CH2-CE2 4.17Å; W330-Y399 HydrophobicContact CZ2-CE1 4.49Å; W330-Y399 AromaticContact CZ2-CE2 3.84Å; W330-Y399 HydrophobicContact CZ2-CE2 3.84Å; W330-Y399 AromaticContact CZ2-CZ 3.7Å; L346-Y399 HydrophobicContact CD1-CD1 3.74Å; L346-Y399 HydrophobicContact CD1-CG 3.96Å; L346-Y399 HydrophobicContact CD2-CD1 4.24Å; L346-Y399 HydrophobicContact CG-CD1 4.07Å; M354-Y399 HydrophobicContact CE-CD1 4.1Å; M354-Y399 HydrophobicContact CE-CE1 3.76Å; F393-Y399 WeakPolarHBondContact O-CE2 3.32Å; F393-Y399 PolarHBondContact O-OH 2.81Å; H396-Y399 HydrophobicContact CB-CD1 4.45Å; H396-Y399 HydrophobicContact CB-CE1 3.7Å; F397-Y399 HydrophobicContact CB-CE2 4.44Å; Y399-L431 HydrophobicContact CD2-CD2 4.14Å; Y399-L431 HydrophobicContact CG-CD2 4.09Å; Y399-N432 PolarHBondContact N-OD1 3.44Å; Y399-N432 PolarHBondContact O-ND2 3.33Å; Y399-L435 HydrophobicContact CE2-CD2 4.04Å
400	S	82.4	Confident	67.5	Low	67 Å²	67	99.1 Å²	99.1	47%	0.469	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150.9	178.9	-61.7	0	0	0	0	110.9	N344 L345 L346	N344-S400 PolarHBondContact O-N 3.09Å; N344-S400 VanDerWaalsContact O-O 3.12Å; L345-S400 WeakPolarHBondContact CA-O 3.31Å; L346-S400 PolarHBondContact N-O 3.46Å
401	L	77	Confident	64.7	Low	51 Å²	51	103.7 Å²	103.7	27%	0.267	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	137.2	177.7	-167	103.7	0	0	0	110.7	E403	L401-E403 PolarHBondContact O-N 3.39Å
402	Q	70.1	Confident	61.7	Low	78 Å²	78	103.9 Å²	103.9	36%	0.364	51%	0.512	S	S	.	.			trans	-78	109.8	169.6	-165.6	174.4	11.5	0	0	110.6	L345 L346 T404	L345-Q402 HydrophobicContact CB-CB 4.28Å; L346-Q402 PolarHBondContact O-N 3.29Å; Q402-T404 PolarHBondContact O-N 3.43Å
403	E	54.4	Low	58.7	Low	169 Å²	169	106.7 Å²	106.7	79%	0.79	54%	0.536	S	S	*	.			trans	-74.8	106.2	170.1	-70.9	-174.3	174.1	0	0	109.7	L401 V405	L401-E403 PolarHBondContact O-N 3.39Å; E403-V405 PolarHBondContact O-N 3.45Å
404	T	44	Very low	55.8	Low	115 Å²	115	116.2 Å²	116.2	71%	0.706	58%	0.578	S	S	*	*			trans	-72.8	102	173.4	48.5	0	0	0	0	109.7	Q402 K406	Q402-T404 PolarHBondContact O-N 3.43Å; T404-K406 PolarHBondContact O-N 2.96Å
405	V	38.8	Very low	52.7	Low	122 Å²	122	119.3 Å²	119.3	74%	0.739	61%	0.612	S	S	*	*			trans	-63.8	100.2	163.8	-179.9	0	0	0	0	106.9	E403 H407	E403-V405 PolarHBondContact O-N 3.45Å; V405-H407 PolarHBondContact O-N 2.82Å
406	K	35.4	Very low	49.8	Very low	184 Å²	184	120.1 Å²	120.1	80%	0.8	63%	0.627	S	S	*	*			trans	-57.7	107.9	171.8	-68.9	-174.9	179.8	-178.7	0	108.2	T404 K408	T404-K406 PolarHBondContact O-N 2.96Å; K406-K408 PolarHBondContact O-N 3.25Å
407	H	36	Very low	47.2	Very low	185 Å²	185	127.2 Å²	127.2	86%	0.856	66%	0.657	S	S	*	*			trans	-56.9	107.8	168.2	-87.3	-76.6	0	0	0	108.7	V405 K409	V405-H407 PolarHBondContact O-N 2.82Å; H407-K409 PolarHBondContact O-N 3.21Å; H407-K409 VanDerWaalsContact O-N 3.11Å
408	K	32.5	Very low	44.2	Very low	204 Å²	204	136.9 Å²	136.9	89%	0.887	69%	0.694	S	S	*	*			trans	-60.7	111.1	169.7	-84.4	-179	172.4	176.2	0	108.5	K406 K410	K406-K408 PolarHBondContact O-N 3.25Å; K408-K410 PolarHBondContact O-N 3.44Å
409	K	34.3	Very low	41	Very low	207 Å²	207	141 Å²	141	90%	0.9	72%	0.723	S	S	*	*			trans	-60.6	125.9	150.3	-99.3	-179.3	173.8	179.4	0	107.4	H407 D411	H407-K409 PolarHBondContact O-N 3.21Å; H407-K409 VanDerWaalsContact O-N 3.11Å; K409-D411 PolarHBondContact O-N 3.17Å
410	K	33.8	Very low	37.9	Very low	198 Å²	198	149 Å²	149	86%	0.861	76%	0.763	S	S	*	*			trans	-65	110.8	177.5	177	-177.7	-178.7	-179.7	0	108.6	K408	K408-K410 PolarHBondContact O-N 3.44Å
411	D	29.1	Very low	35.1	Very low	163 Å²	163	150.5 Å²	150.5	87%	0.872	78%	0.779	S	S	*	*			trans	-147.5	140.1	153.3	-84.3	-40.5	0	0	0	109.6	K409	K409-D411 PolarHBondContact O-N 3.17Å
412	S	26.9	Very low	32.6	Very low	109 Å²	109	153.3 Å²	153.3	76%	0.762	80%	0.803	S	S	*	*			trans	-86.3	139.7	-159.2	60.7	0	0	0	0	114.7
413	C	26.1	Very low	30.5	Very low	110 Å²	110	155 Å²	155	74%	0.743	82%	0.824	S	S	*	*			trans	73.3	117.2	139.9	-80.6	0	0	0	0	122.7
414	K	29.1	Very low	29.5	Very low	201 Å²	201	153.3 Å²	153.3	87%	0.874	82%	0.82	S	S	*	*			trans	95.7	104.4	133.9	-68.7	179.5	-176.8	-178	0	119.7
415	G	25	Very low	29.1	Very low	72 Å²	72	156.2 Å²	156.2	74%	0.742	83%	0.831	S	S	*	*				97	88.5	123.9	0	0	0	0	0	118.3
416	N	23.1	Very low	29.8	Very low	160 Å²	160	152.4 Å²	152.4	86%	0.856	81%	0.808	S	S	*	*				-176.6	129	119.4	-107.5	-6.9	0	0	0	111.9	Y418	N416-Y418 PolarHBondContact O-N 3.34Å
417	K	30.8	Very low	31.3	Very low	201 Å²	201	145.4 Å²	145.4	87%	0.874	78%	0.78	S	S	*	*			trans	-76.5	100.1	172.2	-81.1	175.7	173.7	174.5	0	109.2
418	Y	23.2	Very low	33.1	Very low	218 Å²	218	141.8 Å²	141.8	86%	0.855	76%	0.763	S	S	*	*			trans	-145.9	90.4	150.1	-86.2	-78.8	0	0	0	107.6	N416 M420	N416-Y418 PolarHBondContact O-N 3.34Å; Y418-M420 PolarHBondContact O-N 2.98Å
419	C	21.5	Very low	35.6	Very low	138 Å²	138	133.7 Å²	133.7	93%	0.932	73%	0.729	S	S	*	*			trans	-77.7	96.2	165.9	-98.6	0	0	0	0	108.1	A421	C419-A421 PolarHBondContact O-N 3.04Å
420	M	21.9	Very low	38.1	Very low	178 Å²	178	126.1 Å²	126.1	88%	0.877	70%	0.698	S	S	*	*			trans	-55.1	127.1	154.9	-85.8	-90.5	-161.3	0	0	108.5	Y418 S422	Y418-M420 PolarHBondContact O-N 2.98Å; M420-S422 PolarHBondContact O-N 3.29Å; M420-S422 VanDerWaalsContact O-N 3.16Å
421	A	23.9	Very low	40.8	Very low	98 Å²	98	116.8 Å²	116.8	81%	0.81	66%	0.657	S	S	*	*			trans	-58.9	113	177.1	0	0	0	0	0	110.7	C419 S423	C419-A421 PolarHBondContact O-N 3.04Å; A421-S423 PolarHBondContact O-N 2.64Å
422	S	25.3	Very low	43.7	Very low	110 Å²	110	109.2 Å²	109.2	77%	0.769	62%	0.617	S	S	*	*			trans	-76.6	111.2	166.9	57.2	0	0	0	0	109.3	M420 N424	M420-S422 PolarHBondContact O-N 3.29Å; M420-S422 VanDerWaalsContact O-N 3.16Å; S422-N424 PolarHBondContact O-N 3.37Å
423	S	26.3	Very low	46.7	Very low	113 Å²	113	104.1 Å²	104.1	79%	0.79	58%	0.581	S	S	*	*			trans	-77.4	64.6	-175.1	60.1	0	0	0	0	114.2	A421	A421-S423 PolarHBondContact O-N 2.64Å
424	N	32.3	Very low	49.8	Very low	134 Å²	134	99 Å²	99	72%	0.717	55%	0.547	S	S	*	.			trans	-118	68	171.5	-75.9	-1.2	0	0	0	111	S422 V426	S422-N424 PolarHBondContact O-N 3.37Å; N424-V426 VanDerWaalsContact C-N 3.25Å; N424-V426 PolarHBondContact O-N 3.32Å
425	N	35.6	Very low	52.8	Low	175 Å²	175	89.4 Å²	89.4	94%	0.936	51%	0.505	S	S	*	.			trans	-78.8	73.6	167	-90.5	-16.2	0	0	0	109.5	D427	N425-D427 PolarHBondContact O-N 3.2Å
426	V	52.8	Low	56	Low	42 Å²	42	86 Å²	86	26%	0.255	47%	0.47	S	S	.	.			trans	-80.4	116.4	166.6	-179.2	0	0	0	0	107.2	N424 H428	N424-V426 VanDerWaalsContact C-N 3.25Å; N424-V426 PolarHBondContact O-N 3.32Å; V426-H428 PolarHBondContact O-CD2 3.32Å; V426-H428 PolarHBondContact O-N 3.44Å
427	D	68.1	Low	59.1	Low	38 Å²	38	80 Å²	80	20%	0.203	44%	0.438	C	S	.	.			trans	-65.7	98.7	173.5	-175.5	-21.3	0	0	0	108.9	N425 L429 L430 Q476	N425-D427 PolarHBondContact O-N 3.2Å; D427-L429 PolarHBondContact O-N 3.11Å; D427-L429 VanDerWaalsContact O-N 3.12Å; D427-L429 PolarHBondContact OD1-N 3.31Å; D427-L429 VanDerWaalsContact OD1-N 3.16Å; D427-L430 HydrophobicContact CB-CB 3.94Å; D427-L430 VanDerWaalsContact O-CB 3.31Å; D427-L430 WeakPolarHBondContact O-CB 3.4Å; D427-L430 PolarHBondContact O-N 3.33Å; D427-L430 VanDerWaalsContact O-N 3.09Å; D427-L430 PolarHBondContact OD1-N 2.84Å; D427-Q476 PolarHBondContact OD1-NE2 3.3Å; D427-Q476 WeakPolarHBondContact OD2-CG 3.49Å; D427-Q476 PolarHBondContact OD2-NE2 2.99Å
428	H	72.8	Confident	61.9	Low	108 Å²	108	70.5 Å²	70.5	50%	0.5	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.4	-175	-58.3	-68.6	0	0	0	113.6	V426	V426-H428 PolarHBondContact O-CD2 3.32Å; V426-H428 PolarHBondContact O-N 3.44Å
429	L	85.1	Confident	65.2	Low	34 Å²	34	60.1 Å²	60.1	18%	0.178	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-17.7	179.8	-76.1	162.2	0	0	0	113	D427 L431 N432 L433 F461 T465 L472	D427-L429 PolarHBondContact O-N 3.11Å; D427-L429 VanDerWaalsContact O-N 3.12Å; D427-L429 PolarHBondContact OD1-N 3.31Å; D427-L429 VanDerWaalsContact OD1-N 3.16Å; L429-L431 VanDerWaalsContact C-N 3.29Å; L429-L431 PolarHBondContact O-N 3.29Å; L429-N432 PolarHBondContact O-N 3.02Å; L429-L433 HydrophobicContact CB-CD1 4.15Å; L429-L433 HydrophobicContact CB-CG 4.41Å; L429-L433 VanDerWaalsContact O-CG 3.29Å; L429-L433 WeakPolarHBondContact O-CG 3.42Å; L429-L433 PolarHBondContact O-N 2.73Å; L429-F461 HydrophobicContact CD2-CE2 4.43Å; L429-F461 HydrophobicContact CD2-CZ 3.92Å; L429-T465 HydrophobicContact CD1-CG2 4.28Å; L429-T465 HydrophobicContact CD2-CG2 4.01Å; L429-L472 HydrophobicContact CD1-CD2 3.61Å
430	L	88.2	Confident	68.3	Low	48 Å²	48	53.6 Å²	53.6	25%	0.251	31%	0.312	S	S	.	.	H	α-helix	trans	-55.7	-42.5	-170.6	-173.6	67	0	0	0	112.9	Q355 D427 L433 T434	Q355-L430 HydrophobicContact CG-CD2 4.07Å; D427-L430 HydrophobicContact CB-CB 3.94Å; D427-L430 VanDerWaalsContact O-CB 3.31Å; D427-L430 WeakPolarHBondContact O-CB 3.4Å; D427-L430 PolarHBondContact O-N 3.33Å; D427-L430 VanDerWaalsContact O-N 3.09Å; D427-L430 PolarHBondContact OD1-N 2.84Å; L430-L433 PolarHBondContact O-N 3Å; L430-T434 WeakPolarHBondContact O-CG2 3.33Å; L430-T434 PolarHBondContact O-N 3.49Å; L430-T434 PolarHBondContact O-OG1 2.91Å; L430-T434 VanDerWaalsContact O-OG1 3.05Å
431	L	89.1	Confident	71.4	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-61.3	-54.4	-179.1	-176	74.4	0	0	0	111.1	W330 L346 Q351 M354 Q355 L358 Y399 L429 L433 T434 L435	W330-L431 HydrophobicContact CH2-CD1 4.39Å; W330-L431 HydrophobicContact CZ3-CD1 4.24Å; L346-L431 HydrophobicContact CD1-CD2 3.72Å; Q351-L431 HydrophobicContact CG-CD2 4.16Å; M354-L431 HydrophobicContact CB-CD1 3.81Å; M354-L431 HydrophobicContact CB-CD2 4.38Å; Q355-L431 HydrophobicContact CB-CD1 4.15Å; L358-L431 HydrophobicContact CD1-CD1 3.66Å; L358-L431 HydrophobicContact CD1-CG 4.27Å; L358-L431 HydrophobicContact CG-CD1 4.43Å; Y399-L431 HydrophobicContact CD2-CD2 4.14Å; Y399-L431 HydrophobicContact CG-CD2 4.09Å; L429-L431 VanDerWaalsContact C-N 3.29Å; L429-L431 PolarHBondContact O-N 3.29Å; L431-L433 VanDerWaalsContact C-N 3.31Å; L431-L433 PolarHBondContact O-N 3.36Å; L431-T434 PolarHBondContact O-N 3.25Å; L431-T434 PolarHBondContact O-OG1 3.23Å; L431-L435 PolarHBondContact O-N 3.26Å
432	N	90.9	Very high	74.3	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.027	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-41.9	179.4	-68.1	-35.3	0	0	0	111.2	F397 Y399 L429 L435 C436 F461	F397-N432 HydrophobicContact CE2-CB 3.88Å; Y399-N432 PolarHBondContact N-OD1 3.44Å; Y399-N432 PolarHBondContact O-ND2 3.33Å; L429-N432 PolarHBondContact O-N 3.02Å; N432-L435 PolarHBondContact O-N 3.11Å; N432-C436 PolarHBondContact O-N 3.38Å; N432-C436 PolarHBondContact O-SG 2.92Å; N432-F461 HydrophobicContact CB-CE1 3.91Å; N432-F461 HydrophobicContact CB-CE2 4.19Å; N432-F461 HydrophobicContact CB-CZ 3.51Å
433	L	90.3	Very high	77.2	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-45.2	177.8	-65.6	177.7	0	0	0	112.3	L429 L430 L431 L435 C436 D437 F461 Q476 R479 L480	L429-L433 HydrophobicContact CB-CD1 4.15Å; L429-L433 HydrophobicContact CB-CG 4.41Å; L429-L433 VanDerWaalsContact O-CG 3.29Å; L429-L433 WeakPolarHBondContact O-CG 3.42Å; L429-L433 PolarHBondContact O-N 2.73Å; L430-L433 PolarHBondContact O-N 3Å; L431-L433 VanDerWaalsContact C-N 3.31Å; L431-L433 PolarHBondContact O-N 3.36Å; L433-L435 VanDerWaalsContact C-N 3.27Å; L433-L435 PolarHBondContact O-N 3.07Å; L433-C436 WeakPolarHBondContact O-CB 3.49Å; L433-C436 PolarHBondContact O-N 3.43Å; L433-D437 PolarHBondContact O-N 3.15Å; L433-F461 HydrophobicContact CD2-CE1 4.32Å; L433-Q476 HydrophobicContact CD1-CB 4.27Å; L433-Q476 HydrophobicContact CD1-CG 4.34Å; L433-R479 HydrophobicContact CD1-CB 4.28Å; L433-L480 HydrophobicContact CD1-CG 4.42Å; L433-L480 HydrophobicContact CD2-CD1 4.5Å; L433-L480 HydrophobicContact CD2-CD2 3.34Å; L433-L480 HydrophobicContact CD2-CG 3.53Å
434	T	90.1	Very high	80	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.018	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-37.2	175.3	46.5	0	0	0	0	112.3	L430 L431 D437 I438	L430-T434 WeakPolarHBondContact O-CG2 3.33Å; L430-T434 PolarHBondContact O-N 3.49Å; L430-T434 PolarHBondContact O-OG1 2.91Å; L430-T434 VanDerWaalsContact O-OG1 3.05Å; L431-T434 PolarHBondContact O-N 3.25Å; L431-T434 PolarHBondContact O-OG1 3.23Å; T434-D437 PolarHBondContact O-N 2.7Å; T434-I438 WeakPolarHBondContact O-CD1 3.41Å; T434-I438 VanDerWaalsContact O-CG1 3.32Å; T434-I438 WeakPolarHBondContact O-CG1 3.4Å; T434-I438 PolarHBondContact O-N 3.46Å; T434-I438 VanDerWaalsContact O-N 3.09Å
435	L	92.5	Very high	82.1	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.9	-44.1	175.9	-176.5	54.4	0	0	0	111	L358 F393 M394 F397 Y399 L431 N432 L433 D437 I438 M439	L358-L435 HydrophobicContact CD1-CB 3.77Å; L358-L435 HydrophobicContact CD1-CD1 4.45Å; L358-L435 HydrophobicContact CD2-CD1 4.14Å; F393-L435 HydrophobicContact CB-CD1 3.67Å; F393-L435 HydrophobicContact CB-CD2 4.24Å; F393-L435 HydrophobicContact CD2-CD1 4.11Å; F393-L435 HydrophobicContact CG-CD1 4.3Å; M394-L435 HydrophobicContact SD-CD1 4.46Å; M394-L435 HydrophobicContact SD-CD2 4Å; M394-L435 HydrophobicContact SD-CG 4.08Å; F397-L435 HydrophobicContact CD2-CD2 3.72Å; F397-L435 HydrophobicContact CE2-CD2 4.36Å; F397-L435 HydrophobicContact CG-CD2 4.46Å; Y399-L435 HydrophobicContact CE2-CD2 4.04Å; L431-L435 PolarHBondContact O-N 3.26Å; N432-L435 PolarHBondContact O-N 3.11Å; L433-L435 VanDerWaalsContact C-N 3.27Å; L433-L435 PolarHBondContact O-N 3.07Å; L435-D437 PolarHBondContact O-N 3.28Å; L435-I438 PolarHBondContact O-N 2.77Å; L435-M439 HydrophobicContact CD1-CG 3.74Å; L435-M439 HydrophobicContact CD1-SD 4.43Å; L435-M439 HydrophobicContact CG-CG 4.2Å; L435-M439 VanDerWaalsContact O-CB 3.31Å; L435-M439 WeakPolarHBondContact O-CB 3.47Å; L435-M439 WeakPolarHBondContact O-CG 3.32Å; L435-M439 PolarHBondContact O-N 2.8Å
436	C	92.1	Very high	84.1	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.3	-46.4	174.3	-65.6	0	0	0	0	111.9	F397 N432 L433 I438 M439 V440 I458 V483	F397-C436 VanDerWaalsContact CZ-SG 3.58Å; N432-C436 PolarHBondContact O-N 3.38Å; N432-C436 PolarHBondContact O-SG 2.92Å; L433-C436 WeakPolarHBondContact O-CB 3.49Å; L433-C436 PolarHBondContact O-N 3.43Å; C436-I438 PolarHBondContact O-N 2.83Å; C436-M439 PolarHBondContact O-N 3.05Å; C436-V440 VanDerWaalsContact O-CB 3.3Å; C436-V440 WeakPolarHBondContact O-CB 3.01Å; C436-V440 WeakPolarHBondContact O-CG2 3.43Å; C436-V440 PolarHBondContact O-N 3.48Å; C436-I458 HydrophobicContact CB-CG2 4.06Å; C436-V483 HydrophobicContact CB-CG1 3.93Å; C436-V483 HydrophobicContact CB-CG2 3.8Å
437	D	88.4	Confident	85.4	Confident	35 Å²	35	24.3 Å²	24.3	19%	0.187	15%	0.147	C	C	.	.	H	α-helix	trans	-58.4	-47.3	178.9	-77.4	-36.9	0	0	0	111.7	L433 T434 L435 S441 V483	L433-D437 PolarHBondContact O-N 3.15Å; T434-D437 PolarHBondContact O-N 2.7Å; L435-D437 PolarHBondContact O-N 3.28Å; D437-S441 WeakPolarHBondContact O-CB 3.44Å; D437-S441 PolarHBondContact O-N 2.97Å; D437-S441 VanDerWaalsContact O-N 3.11Å; D437-V483 WeakPolarHBondContact OD1-CG2 3.38Å
438	I	90	Very high	85.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64	-52.2	178.2	-65.9	163.1	0	0	0	110.5	L358 I361 H362 F389 T434 L435 C436 V440 S441 L442	L358-I438 HydrophobicContact CB-CD1 3.98Å; L358-I438 HydrophobicContact CD2-CD1 3.97Å; L358-I438 WeakPolarHBondContact O-CD1 3.35Å; I361-I438 HydrophobicContact CB-CD1 4.17Å; I361-I438 HydrophobicContact CG2-CD1 3.99Å; I361-I438 HydrophobicContact CG2-CG1 4.44Å; I361-I438 HydrophobicContact CG2-CG2 4.11Å; H362-I438 HydrophobicContact CB-CD1 4.19Å; H362-I438 HydrophobicContact CB-CG1 4.15Å; F389-I438 HydrophobicContact CD2-CG2 4.42Å; F389-I438 HydrophobicContact CE2-CG2 4.16Å; T434-I438 WeakPolarHBondContact O-CD1 3.41Å; T434-I438 VanDerWaalsContact O-CG1 3.32Å; T434-I438 WeakPolarHBondContact O-CG1 3.4Å; T434-I438 PolarHBondContact O-N 3.46Å; T434-I438 VanDerWaalsContact O-N 3.09Å; L435-I438 PolarHBondContact O-N 2.77Å; C436-I438 PolarHBondContact O-N 2.83Å; I438-V440 PolarHBondContact O-N 2.97Å; I438-S441 WeakPolarHBondContact O-CB 3.15Å; I438-S441 PolarHBondContact O-N 2.95Å; I438-S441 PolarHBondContact O-OG 3.16Å; I438-L442 HydrophobicContact CG2-CD1 4.37Å; I438-L442 PolarHBondContact O-N 2.79Å
439	M	91.2	Very high	86.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-45.4	-175.3	-70.5	-62	-57.7	0	0	111.7	L386 F389 K390 M394 L435 C436 S441 L442 W454 I458	L386-M439 HydrophobicContact CD1-CE 4.1Å; F389-M439 HydrophobicContact CB-SD 3.93Å; F389-M439 HydrophobicContact CD2-SD 4.49Å; K390-M439 HydrophobicContact CG-CE 4.34Å; M394-M439 HydrophobicContact CG-CE 3.69Å; M394-M439 HydrophobicContact CG-CG 4.24Å; M394-M439 HydrophobicContact CG-SD 4.07Å; M394-M439 HydrophobicContact SD-CE 4.36Å; M394-M439 HydrophobicContact SD-CG 3.85Å; M394-M439 HydrophobicContact SD-SD 4.46Å; L435-M439 HydrophobicContact CD1-CG 3.74Å; L435-M439 HydrophobicContact CD1-SD 4.43Å; L435-M439 HydrophobicContact CG-CG 4.2Å; L435-M439 VanDerWaalsContact O-CB 3.31Å; L435-M439 WeakPolarHBondContact O-CB 3.47Å; L435-M439 WeakPolarHBondContact O-CG 3.32Å; L435-M439 PolarHBondContact O-N 2.8Å; C436-M439 PolarHBondContact O-N 3.05Å; M439-S441 VanDerWaalsContact C-N 3.29Å; M439-S441 PolarHBondContact O-N 3.31Å; M439-L442 WeakPolarHBondContact O-CB 3.24Å; M439-L442 PolarHBondContact O-N 3.33Å; M439-W454 HydrophobicContact CB-CE3 4.19Å; M439-W454 HydrophobicContact CB-CH2 4.4Å; M439-W454 HydrophobicContact CB-CZ3 3.69Å; M439-W454 HydrophobicContact CE-CD2 3.96Å; M439-W454 HydrophobicContact CE-CE3 3.8Å; M439-W454 HydrophobicContact CE-CH2 4.32Å; M439-W454 HydrophobicContact CE-CZ2 4.46Å; M439-W454 HydrophobicContact CE-CZ3 4.01Å; M439-W454 WeakPolarHBondContact O-CH2 3.36Å; M439-W454 WeakPolarHBondContact O-CZ3 3.37Å; M439-I458 HydrophobicContact CB-CD1 3.74Å
440	V	88.6	Confident	85.8	Confident	2 Å²	2	32 Å²	32	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-70	-27.4	-179.7	-176.4	0	0	0	0	111.4	C436 I438 L442 A443 L455 I458 V483 R486 L487 I490	C436-V440 VanDerWaalsContact O-CB 3.3Å; C436-V440 WeakPolarHBondContact O-CB 3.01Å; C436-V440 WeakPolarHBondContact O-CG2 3.43Å; C436-V440 PolarHBondContact O-N 3.48Å; I438-V440 PolarHBondContact O-N 2.97Å; V440-L442 VanDerWaalsContact C-N 3.28Å; V440-L442 PolarHBondContact O-N 3.04Å; V440-A443 PolarHBondContact O-N 3.47Å; V440-L455 HydrophobicContact CG2-CD2 4.49Å; V440-I458 HydrophobicContact CG2-CD1 3.87Å; V440-I458 HydrophobicContact CG2-CG2 3.96Å; V440-V483 HydrophobicContact CG2-CG1 4.15Å; V440-R486 HydrophobicContact CB-CG 4.4Å; V440-R486 HydrophobicContact CG1-CB 3.78Å; V440-R486 HydrophobicContact CG1-CG 3.35Å; V440-L487 HydrophobicContact CG1-CD2 3.98Å; V440-L487 HydrophobicContact CG1-CG 4.18Å; V440-L487 HydrophobicContact CG2-CD2 3.87Å; V440-L487 HydrophobicContact CG2-CG 4.28Å; V440-I490 HydrophobicContact CG1-CD1 3.59Å; V440-I490 WeakPolarHBondContact O-CD1 3.34Å
441	S	85.9	Confident	85.6	Confident	16 Å²	16	29.8 Å²	29.8	11%	0.112	18%	0.178	C	C	.	.	H	α-helix	trans	-64.4	-30.8	172.7	78.1	0	0	0	0	113.3	W365 D437 I438 M439 A443	W365-S441 PolarHBondContact NE1-OG 3.14Å; D437-S441 WeakPolarHBondContact O-CB 3.44Å; D437-S441 PolarHBondContact O-N 2.97Å; D437-S441 VanDerWaalsContact O-N 3.11Å; I438-S441 WeakPolarHBondContact O-CB 3.15Å; I438-S441 PolarHBondContact O-N 2.95Å; I438-S441 PolarHBondContact O-OG 3.16Å; M439-S441 VanDerWaalsContact C-N 3.29Å; M439-S441 PolarHBondContact O-N 3.31Å; S441-A443 VanDerWaalsContact C-N 3.27Å; S441-A443 PolarHBondContact O-N 3.14Å
442	L	85.8	Confident	85.2	Confident	8 Å²	8	32.3 Å²	32.3	4%	0.042	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-11.1	178.1	-70.2	163.9	0	0	0	113.6	W365 L381 R382 L386 F389 I438 M439 V440	W365-L442 HydrophobicContact CH2-CD2 3.2Å; W365-L442 HydrophobicContact CH2-CG 4.08Å; W365-L442 HydrophobicContact CZ2-CD2 3.98Å; W365-L442 HydrophobicContact CZ3-CD2 3.62Å; W365-L442 HydrophobicContact CZ3-CG 4.41Å; L381-L442 HydrophobicContact CB-CD2 4.47Å; R382-L442 HydrophobicContact CB-CD2 4.26Å; R382-L442 WeakPolarHBondContact CD-O 3.13Å; R382-L442 PolarHBondContact NH1-O 3.32Å; L386-L442 HydrophobicContact CD1-CB 4.32Å; L386-L442 HydrophobicContact CD1-CD1 4.17Å; F389-L442 HydrophobicContact CD2-CD1 3.68Å; F389-L442 HydrophobicContact CE2-CD1 4.05Å; I438-L442 HydrophobicContact CG2-CD1 4.37Å; I438-L442 PolarHBondContact O-N 2.79Å; M439-L442 WeakPolarHBondContact O-CB 3.24Å; M439-L442 PolarHBondContact O-N 3.33Å; V440-L442 VanDerWaalsContact C-N 3.28Å; V440-L442 PolarHBondContact O-N 3.04Å
443	A	85.9	Confident	84.9	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.008	22%	0.219	C	C	.	.			trans	-100.1	148.3	178.6	0	0	0	0	0	112.2	V440 S441 W454 L455 R486 I490	V440-A443 PolarHBondContact O-N 3.47Å; S441-A443 VanDerWaalsContact C-N 3.27Å; S441-A443 PolarHBondContact O-N 3.14Å; A443-W454 HydrophobicContact CB-CH2 3.71Å; A443-W454 HydrophobicContact CB-CZ2 4.05Å; A443-L455 HydrophobicContact CB-CD1 4.38Å; A443-L455 HydrophobicContact CB-CD2 4.16Å; A443-R486 PolarHBondContact O-NH2 3.27Å; A443-I490 HydrophobicContact CB-CD1 3.87Å
444	S	83.5	Confident	84.8	Confident	33 Å²	33	35 Å²	35	23%	0.231	22%	0.221	C	C	.	.			trans	-136.9	169.8	176.9	75.2	0	0	0	0	110.6	S446 T447 L448	S444-S446 PolarHBondContact O-N 2.99Å; S444-S446 PolarHBondContact OG-N 3.05Å; S444-S446 PolarHBondContact OG-OG 3.05Å; S444-T447 PolarHBondContact N-OG1 3.18Å; S444-T447 PolarHBondContact O-N 2.98Å; S444-T447 VanDerWaalsContact O-N 3.15Å; S444-T447 PolarHBondContact O-OG1 3.27Å; S444-L448 PolarHBondContact O-N 3.36Å
445	A	78.1	Confident	84.8	Confident	59 Å²	59	34.9 Å²	34.9	49%	0.488	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-27	178.2	0	0	0	0	0	113
446	S	77.8	Confident	84.6	Confident	98 Å²	98	38.3 Å²	38.3	69%	0.685	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-23.7	178.3	55.3	0	0	0	0	113.3	S444	S444-S446 PolarHBondContact O-N 2.99Å; S444-S446 PolarHBondContact OG-N 3.05Å; S444-S446 PolarHBondContact OG-OG 3.05Å
447	T	79.2	Confident	84.5	Confident	20 Å²	20	42.3 Å²	42.3	12%	0.123	26%	0.258	C	S	.	.	S	Bend	trans	-99.8	6.4	-177.1	68.9	0	0	0	0	113.8	S444 Q449 T450 D451	S444-T447 PolarHBondContact N-OG1 3.18Å; S444-T447 PolarHBondContact O-N 2.98Å; S444-T447 VanDerWaalsContact O-N 3.15Å; S444-T447 PolarHBondContact O-OG1 3.27Å; T447-Q449 VanDerWaalsContact C-N 3.29Å; T447-Q449 PolarHBondContact O-N 2.95Å; T447-Q449 VanDerWaalsContact O-N 3.17Å; T447-T450 PolarHBondContact O-N 3.23Å; T447-T450 PolarHBondContact O-OG1 3.39Å; T447-D451 WeakPolarHBondContact CB-OD2 3.42Å; T447-D451 PolarHBondContact O-N 3.36Å; T447-D451 PolarHBondContact OG1-OD2 2.95Å
448	L	77.9	Confident	84.6	Confident	55 Å²	55	40.7 Å²	40.7	29%	0.288	25%	0.249	S	C	.	.	H	α-helix	trans	-54.8	-39.6	-172.3	178.3	62.6	0	0	0	113.9	S444 D451 S452 L455 I490 Q491	S444-L448 PolarHBondContact O-N 3.36Å; L448-D451 PolarHBondContact O-N 2.97Å; L448-S452 PolarHBondContact O-N 3.42Å; L448-L455 HydrophobicContact CD1-CD1 4.12Å; L448-I490 HydrophobicContact CD1-CG2 4.18Å; L448-Q491 HydrophobicContact CD1-CG 3.66Å
449	Q	77.4	Confident	84.7	Confident	183 Å²	183	43 Å²	43	86%	0.855	26%	0.258	S	S	*	.	H	α-helix	trans	-68.5	-39.1	-177.2	-68.7	-157.9	-6	0	0	112.8	T447 D451 S452	T447-Q449 VanDerWaalsContact C-N 3.29Å; T447-Q449 PolarHBondContact O-N 2.95Å; T447-Q449 VanDerWaalsContact O-N 3.17Å; Q449-D451 VanDerWaalsContact C-N 3.3Å; Q449-D451 PolarHBondContact O-N 3.34Å; Q449-S452 PolarHBondContact O-OG 3.16Å
450	T	78.8	Confident	84.6	Confident	104 Å²	104	49.7 Å²	49.7	64%	0.638	29%	0.287	S	S	*	.	H	α-helix	trans	-78.7	-16.3	-178.3	54	0	0	0	0	113.1	T447	T447-T450 PolarHBondContact O-N 3.23Å; T447-T450 PolarHBondContact O-OG1 3.39Å
451	D	83.8	Confident	84.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-109.8	0.4	-174.7	-71.7	-31.8	0	0	0	114.8	R382 K390 T447 L448 Q449 G453 W454 L455	R382-D451 IonicContact CZ-OD1 3.99Å; R382-D451 IonicContact CZ-OD2 2.78Å; R382-D451 IonicContact NH1-OD1 3.2Å; R382-D451 IonicContact NH1-OD2 3.43Å; R382-D451 PolarHBondContact NH1-OD2 2.74Å; R382-D451 IonicContact NH2-OD1 2.71Å; R382-D451 PolarHBondContact NH2-OD1 2.74Å; R382-D451 VanDerWaalsContact NH2-OD1 3.1Å; R382-D451 IonicContact NH2-OD2 3.44Å; R382-D451 PolarHBondContact NH2-OD2 3.34Å; K390-D451 IonicContact NZ-OD1 2.72Å; K390-D451 PolarHBondContact NZ-OD1 2.71Å; T447-D451 WeakPolarHBondContact CB-OD2 3.42Å; T447-D451 PolarHBondContact O-N 3.36Å; T447-D451 PolarHBondContact OG1-OD2 2.95Å; L448-D451 PolarHBondContact O-N 2.97Å; Q449-D451 VanDerWaalsContact C-N 3.3Å; Q449-D451 PolarHBondContact O-N 3.34Å; D451-G453 VanDerWaalsContact C-N 3.33Å; D451-G453 PolarHBondContact O-N 3.47Å; D451-W454 HydrophobicContact CB-CZ2 3.6Å; D451-W454 VanDerWaalsContact CB-NE1 3.31Å; D451-W454 VanDerWaalsContact CG-CZ2 3.48Å; D451-W454 PolarHBondContact O-N 2.9Å; D451-W454 PolarHBondContact O-NE1 3.44Å; D451-W454 PolarHBondContact OD1-NE1 3.04Å; D451-L455 HydrophobicContact CB-CD1 3.63Å; D451-L455 HydrophobicContact CB-CG 4.11Å; D451-L455 WeakPolarHBondContact O-CB 3.35Å; D451-L455 VanDerWaalsContact O-CG 3.3Å; D451-L455 WeakPolarHBondContact O-CG 3.32Å; D451-L455 PolarHBondContact O-N 3.33Å; D451-L455 VanDerWaalsContact O-N 3.12Å
452	S	81.8	Confident	85	Confident	56 Å²	56	49.9 Å²	49.9	39%	0.392	29%	0.286	S	S	.	.	H	α-helix	trans	-49.2	-48.3	-175.2	53.1	0	0	0	0	113.5	L448 Q449 W454 L455 D456	L448-S452 PolarHBondContact O-N 3.42Å; Q449-S452 PolarHBondContact O-OG 3.16Å; S452-W454 PolarHBondContact O-N 3.38Å; S452-L455 PolarHBondContact O-N 3.41Å; S452-D456 WeakPolarHBondContact O-CB 3.39Å; S452-D456 VanDerWaalsContact O-CG 3.27Å; S452-D456 PolarHBondContact O-N 2.95Å
453	G	85.1	Confident	85.2	Confident	49 Å²	49	50.3 Å²	50.3	51%	0.505	29%	0.289	S	S	.	.	H	α-helix	trans	-57	-49.2	-174.5	0	0	0	0	0	114.8	D451 M457	D451-G453 VanDerWaalsContact C-N 3.33Å; D451-G453 PolarHBondContact O-N 3.47Å; G453-M457 PolarHBondContact O-N 2.88Å
454	W	87.4	Confident	85.4	Confident	14 Å²	14	53.3 Å²	53.3	5%	0.053	30%	0.304	C	S	.	.	H	α-helix	trans	-84.2	-26.1	-179.2	65.4	-90.8	0	0	0	113	M394 M439 A443 D451 S452 D456 M457 I458	M394-W454 HydrophobicContact CE-CB 4.25Å; M439-W454 HydrophobicContact CB-CE3 4.19Å; M439-W454 HydrophobicContact CB-CH2 4.4Å; M439-W454 HydrophobicContact CB-CZ3 3.69Å; M439-W454 HydrophobicContact CE-CD2 3.96Å; M439-W454 HydrophobicContact CE-CE3 3.8Å; M439-W454 HydrophobicContact CE-CH2 4.32Å; M439-W454 HydrophobicContact CE-CZ2 4.46Å; M439-W454 HydrophobicContact CE-CZ3 4.01Å; M439-W454 WeakPolarHBondContact O-CH2 3.36Å; M439-W454 WeakPolarHBondContact O-CZ3 3.37Å; A443-W454 HydrophobicContact CB-CH2 3.71Å; A443-W454 HydrophobicContact CB-CZ2 4.05Å; D451-W454 HydrophobicContact CB-CZ2 3.6Å; D451-W454 VanDerWaalsContact CB-NE1 3.31Å; D451-W454 VanDerWaalsContact CG-CZ2 3.48Å; D451-W454 PolarHBondContact O-N 2.9Å; D451-W454 PolarHBondContact O-NE1 3.44Å; D451-W454 PolarHBondContact OD1-NE1 3.04Å; S452-W454 PolarHBondContact O-N 3.38Å; W454-D456 VanDerWaalsContact C-N 3.32Å; W454-M457 HydrophobicContact CB-CE 3.7Å; W454-M457 PolarHBondContact O-N 3.49Å; W454-I458 HydrophobicContact CE3-CD1 3.61Å; W454-I458 HydrophobicContact CZ3-CD1 3.67Å; W454-I458 WeakPolarHBondContact O-CG1 3.47Å; W454-I458 PolarHBondContact O-N 2.87Å; W454-I458 VanDerWaalsContact O-N 3.12Å
455	L	89.1	Confident	85.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.6	-36	171	-74.1	172.5	0	0	0	111.7	V440 A443 L448 D451 S452 I458 R459 L487	V440-L455 HydrophobicContact CG2-CD2 4.49Å; A443-L455 HydrophobicContact CB-CD1 4.38Å; A443-L455 HydrophobicContact CB-CD2 4.16Å; L448-L455 HydrophobicContact CD1-CD1 4.12Å; D451-L455 HydrophobicContact CB-CD1 3.63Å; D451-L455 HydrophobicContact CB-CG 4.11Å; D451-L455 WeakPolarHBondContact O-CB 3.35Å; D451-L455 VanDerWaalsContact O-CG 3.3Å; D451-L455 WeakPolarHBondContact O-CG 3.32Å; D451-L455 PolarHBondContact O-N 3.33Å; D451-L455 VanDerWaalsContact O-N 3.12Å; S452-L455 PolarHBondContact O-N 3.41Å; L455-I458 PolarHBondContact O-N 3.43Å; L455-R459 WeakPolarHBondContact O-CB 3.32Å; L455-R459 PolarHBondContact O-N 2.92Å; L455-L487 HydrophobicContact CD2-CD2 3.97Å
456	D	88.1	Confident	86.1	Confident	71 Å²	71	49.6 Å²	49.6	38%	0.38	27%	0.274	S	S	.	.	H	α-helix	trans	-71.2	-34.4	176.3	-71.2	-27.2	0	0	0	111.8	S452 W454 R459 K460	S452-D456 WeakPolarHBondContact O-CB 3.39Å; S452-D456 VanDerWaalsContact O-CG 3.27Å; S452-D456 PolarHBondContact O-N 2.95Å; W454-D456 VanDerWaalsContact C-N 3.32Å; D456-R459 PolarHBondContact O-N 3.02Å; D456-R459 IonicContact OD1-CZ 2.8Å; D456-R459 IonicContact OD1-NE 3.64Å; D456-R459 IonicContact OD1-NH1 3.6Å; D456-R459 PolarHBondContact OD1-NH1 3.48Å; D456-R459 IonicContact OD1-NH2 3.52Å; D456-R459 PolarHBondContact OD1-NH2 3.33Å; D456-K460 WeakPolarHBondContact O-CB 3.43Å; D456-K460 PolarHBondContact O-N 2.92Å
457	M	90.6	Very high	86.4	Confident	85 Å²	85	49 Å²	49	42%	0.419	26%	0.261	S	S	.	.	H	α-helix	trans	-60	-46.4	170	-69.6	-170.3	-76.5	0	0	111.8	M394 G453 W454 K460 F461	M394-M457 HydrophobicContact CE-CE 4.3Å; G453-M457 PolarHBondContact O-N 2.88Å; W454-M457 HydrophobicContact CB-CE 3.7Å; W454-M457 PolarHBondContact O-N 3.49Å; M457-K460 PolarHBondContact O-N 2.71Å; M457-F461 WeakPolarHBondContact O-CB 3.35Å; M457-F461 PolarHBondContact O-N 2.89Å
458	I	91.6	Very high	86.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-43	176.1	-65.4	174.2	0	0	0	110.6	M394 F397 C436 M439 V440 W454 L455 K460 F461 V462 V483 L487	M394-I458 HydrophobicContact CE-CD1 4.25Å; M394-I458 HydrophobicContact CE-CG1 3.96Å; F397-I458 HydrophobicContact CE1-CG1 4.31Å; C436-I458 HydrophobicContact CB-CG2 4.06Å; M439-I458 HydrophobicContact CB-CD1 3.74Å; V440-I458 HydrophobicContact CG2-CD1 3.87Å; V440-I458 HydrophobicContact CG2-CG2 3.96Å; W454-I458 HydrophobicContact CE3-CD1 3.61Å; W454-I458 HydrophobicContact CZ3-CD1 3.67Å; W454-I458 WeakPolarHBondContact O-CG1 3.47Å; W454-I458 PolarHBondContact O-N 2.87Å; W454-I458 VanDerWaalsContact O-N 3.12Å; L455-I458 PolarHBondContact O-N 3.43Å; I458-K460 VanDerWaalsContact C-N 3.33Å; I458-K460 PolarHBondContact O-N 3.29Å; I458-F461 PolarHBondContact O-N 3.13Å; I458-V462 HydrophobicContact CG2-CG2 4.19Å; I458-V462 WeakPolarHBondContact O-CB 3.47Å; I458-V462 VanDerWaalsContact O-CG2 3.31Å; I458-V462 WeakPolarHBondContact O-CG2 3.22Å; I458-V462 PolarHBondContact O-N 3.49Å; I458-V483 HydrophobicContact CG2-CG1 4.04Å; I458-L487 HydrophobicContact CG2-CD1 4.22Å
459	R	90.5	Very high	85.4	Confident	48 Å²	48	53.3 Å²	53.3	18%	0.181	29%	0.294	C	S	.	.	H	α-helix	trans	-59.4	-45.8	177.9	-166.6	-166.2	-59.8	147	16.6	111	L455 D456 V462 T463 Q491 L500	L455-R459 WeakPolarHBondContact O-CB 3.32Å; L455-R459 PolarHBondContact O-N 2.92Å; D456-R459 PolarHBondContact O-N 3.02Å; D456-R459 IonicContact OD1-CZ 2.8Å; D456-R459 IonicContact OD1-NE 3.64Å; D456-R459 IonicContact OD1-NH1 3.6Å; D456-R459 PolarHBondContact OD1-NH1 3.48Å; D456-R459 IonicContact OD1-NH2 3.52Å; D456-R459 PolarHBondContact OD1-NH2 3.33Å; R459-V462 PolarHBondContact O-N 3.21Å; R459-T463 VanDerWaalsContact O-CB 3.28Å; R459-T463 WeakPolarHBondContact O-CB 3.41Å; R459-T463 PolarHBondContact O-N 3.13Å; R459-T463 PolarHBondContact O-OG1 3.2Å; R459-Q491 VanDerWaalsContact CZ-OE1 3.23Å; R459-L500 HydrophobicContact CG-CD1 4.18Å; R459-L500 HydrophobicContact CG-CD2 3.78Å; R459-L500 HydrophobicContact CG-CG 4Å
460	K	90.8	Very high	84.9	Confident	141 Å²	141	47.2 Å²	47.2	61%	0.613	27%	0.271	S	S	*	.	H	α-helix	trans	-60.3	-51.8	177.3	-176.2	175.9	178.7	-175.6	0	110.7	D456 M457 I458 V462 T463 D464	D456-K460 WeakPolarHBondContact O-CB 3.43Å; D456-K460 PolarHBondContact O-N 2.92Å; M457-K460 PolarHBondContact O-N 2.71Å; I458-K460 VanDerWaalsContact C-N 3.33Å; I458-K460 PolarHBondContact O-N 3.29Å; K460-V462 PolarHBondContact O-N 3.15Å; K460-T463 PolarHBondContact O-N 3.1Å; K460-T463 VanDerWaalsContact O-N 3.16Å; K460-D464 WeakPolarHBondContact CG-OD2 3.47Å; K460-D464 WeakPolarHBondContact O-CB 3.33Å; K460-D464 PolarHBondContact O-N 3.27Å
461	F	91.4	Very high	84.4	Confident	23 Å²	23	53.7 Å²	53.7	10%	0.101	28%	0.284	C	S	.	.	H	α-helix	trans	-55	-48.4	177.2	171.5	-101.7	0	0	0	113.1	F397 P398 L429 N432 L433 M457 I458 T463 D464 T465	F397-F461 HydrophobicContact CE1-CB 3.82Å; F397-F461 HydrophobicContact CE1-CD1 4.41Å; F397-F461 HydrophobicContact CE1-CG 4.05Å; F397-F461 HydrophobicContact CZ-CB 3.93Å; F397-F461 AromaticContact CZ-CD1 3.66Å; F397-F461 HydrophobicContact CZ-CD1 3.66Å; F397-F461 HydrophobicContact CZ-CD2 4.26Å; F397-F461 HydrophobicContact CZ-CE1 4.24Å; F397-F461 AromaticContact CZ-CG 3.66Å; F397-F461 HydrophobicContact CZ-CG 3.66Å; P398-F461 HydrophobicContact CB-CD2 3.64Å; P398-F461 HydrophobicContact CB-CE2 3.85Å; P398-F461 HydrophobicContact CB-CG 4.47Å; P398-F461 HydrophobicContact CG-CD2 4.03Å; L429-F461 HydrophobicContact CD2-CE2 4.43Å; L429-F461 HydrophobicContact CD2-CZ 3.92Å; N432-F461 HydrophobicContact CB-CE1 3.91Å; N432-F461 HydrophobicContact CB-CE2 4.19Å; N432-F461 HydrophobicContact CB-CZ 3.51Å; L433-F461 HydrophobicContact CD2-CE1 4.32Å; M457-F461 WeakPolarHBondContact O-CB 3.35Å; M457-F461 PolarHBondContact O-N 2.89Å; I458-F461 PolarHBondContact O-N 3.13Å; F461-T463 PolarHBondContact O-N 2.63Å; F461-D464 PolarHBondContact O-N 2.95Å; F461-T465 VanDerWaalsContact O-CB 3.29Å; F461-T465 WeakPolarHBondContact O-CB 3.4Å; F461-T465 PolarHBondContact O-N 3.25Å; F461-T465 PolarHBondContact O-OG1 2.85Å
462	V	90.7	Very high	84.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-41.2	179.1	171.4	0	0	0	0	111.3	I458 R459 K460 L466 L480 V483 T484 L500	I458-V462 HydrophobicContact CG2-CG2 4.19Å; I458-V462 WeakPolarHBondContact O-CB 3.47Å; I458-V462 VanDerWaalsContact O-CG2 3.31Å; I458-V462 WeakPolarHBondContact O-CG2 3.22Å; I458-V462 PolarHBondContact O-N 3.49Å; R459-V462 PolarHBondContact O-N 3.21Å; K460-V462 PolarHBondContact O-N 3.15Å; V462-L466 HydrophobicContact CG1-CD1 3.86Å; V462-L466 HydrophobicContact CG1-CG 4.49Å; V462-L466 WeakPolarHBondContact O-CB 3.5Å; V462-L466 VanDerWaalsContact O-CG 3.23Å; V462-L466 WeakPolarHBondContact O-CG 3.47Å; V462-L466 PolarHBondContact O-N 3.01Å; V462-L480 HydrophobicContact CG1-CD2 4.24Å; V462-L480 HydrophobicContact CG2-CD2 4.29Å; V462-V483 HydrophobicContact CG2-CG1 3.85Å; V462-T484 VanDerWaalsContact CG1-OG1 3.28Å; V462-T484 WeakPolarHBondContact CG1-OG1 3.31Å; V462-L500 HydrophobicContact CG1-CD2 4.31Å
463	T	90.4	Very high	84.3	Confident	17 Å²	17	54.6 Å²	54.6	10%	0.104	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-48.8	178.8	-57.9	0	0	0	0	110.9	R459 K460 F461 L466 Q467 A503	R459-T463 VanDerWaalsContact O-CB 3.28Å; R459-T463 WeakPolarHBondContact O-CB 3.41Å; R459-T463 PolarHBondContact O-N 3.13Å; R459-T463 PolarHBondContact O-OG1 3.2Å; K460-T463 PolarHBondContact O-N 3.1Å; K460-T463 VanDerWaalsContact O-N 3.16Å; F461-T463 PolarHBondContact O-N 2.63Å; T463-L466 PolarHBondContact O-N 3Å; T463-Q467 VanDerWaalsContact CG2-NE2 3.34Å; T463-Q467 WeakPolarHBondContact O-CB 3.35Å; T463-Q467 VanDerWaalsContact O-CG 3.25Å; T463-Q467 WeakPolarHBondContact O-CG 3.2Å; T463-Q467 PolarHBondContact O-N 3.36Å; T463-Q467 VanDerWaalsContact O-N 3.11Å; T463-A503 HydrophobicContact CG2-CB 4.08Å
464	D	89.8	Confident	84.4	Confident	63 Å²	63	54.5 Å²	54.5	34%	0.337	28%	0.276	S	S	.	.	H	α-helix	trans	-64.1	-46.9	-179.8	-63	-10.4	0	0	0	109.9	K460 F461 L466 Q467 D468	K460-D464 WeakPolarHBondContact CG-OD2 3.47Å; K460-D464 WeakPolarHBondContact O-CB 3.33Å; K460-D464 PolarHBondContact O-N 3.27Å; F461-D464 PolarHBondContact O-N 2.95Å; D464-L466 VanDerWaalsContact C-N 3.33Å; D464-L466 PolarHBondContact O-N 3.12Å; D464-Q467 CarbonylContact O-C 3.38Å; D464-Q467 PolarHBondContact O-N 2.93Å; D464-D468 WeakPolarHBondContact O-CB 3.37Å; D464-D468 VanDerWaalsContact O-CG 3.23Å; D464-D468 PolarHBondContact O-N 2.94Å
465	T	88.1	Confident	84.3	Confident	13 Å²	13	61.4 Å²	61.4	8%	0.08	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-38.3	179	-54.2	0	0	0	0	113	L429 F461 Q467 L472 L480	L429-T465 HydrophobicContact CD1-CG2 4.28Å; L429-T465 HydrophobicContact CD2-CG2 4.01Å; F461-T465 VanDerWaalsContact O-CB 3.29Å; F461-T465 WeakPolarHBondContact O-CB 3.4Å; F461-T465 PolarHBondContact O-N 3.25Å; F461-T465 PolarHBondContact O-OG1 2.85Å; T465-Q467 VanDerWaalsContact C-N 3.34Å; T465-L472 HydrophobicContact CG2-CD2 4.31Å; T465-L480 HydrophobicContact CG2-CD1 3.98Å; T465-L480 HydrophobicContact CG2-CD2 4.36Å
466	L	86.9	Confident	84.2	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-73.2	-26.6	176.8	-73.1	170.8	0	0	0	112.5	V462 T463 D464 L480 A503 V504 L507	V462-L466 HydrophobicContact CG1-CD1 3.86Å; V462-L466 HydrophobicContact CG1-CG 4.49Å; V462-L466 WeakPolarHBondContact O-CB 3.5Å; V462-L466 VanDerWaalsContact O-CG 3.23Å; V462-L466 WeakPolarHBondContact O-CG 3.47Å; V462-L466 PolarHBondContact O-N 3.01Å; T463-L466 PolarHBondContact O-N 3Å; D464-L466 VanDerWaalsContact C-N 3.33Å; D464-L466 PolarHBondContact O-N 3.12Å; L466-L480 HydrophobicContact CD2-CB 4.3Å; L466-L480 HydrophobicContact CD2-CD1 4.13Å; L466-A503 HydrophobicContact CB-CB 3.98Å; L466-A503 HydrophobicContact CD1-CB 4.21Å; L466-V504 HydrophobicContact CD1-CG2 3.78Å; L466-L507 HydrophobicContact CD2-CD2 3.76Å
467	Q	85.6	Confident	84.2	Confident	86 Å²	86	59.1 Å²	59.1	40%	0.402	29%	0.293	S	S	.	.	H	α-helix	trans	-87.5	-29.7	179.8	-72.7	179	17.7	0	0	113.2	T463 D464 T465 G469 A503	T463-Q467 VanDerWaalsContact CG2-NE2 3.34Å; T463-Q467 WeakPolarHBondContact O-CB 3.35Å; T463-Q467 VanDerWaalsContact O-CG 3.25Å; T463-Q467 WeakPolarHBondContact O-CG 3.2Å; T463-Q467 PolarHBondContact O-N 3.36Å; T463-Q467 VanDerWaalsContact O-N 3.11Å; D464-Q467 CarbonylContact O-C 3.38Å; D464-Q467 PolarHBondContact O-N 2.93Å; T465-Q467 VanDerWaalsContact C-N 3.34Å; Q467-G469 PolarHBondContact O-N 3.07Å; Q467-A503 HydrophobicContact CG-CB 4.06Å
468	D	75.6	Confident	84.1	Confident	123 Å²	123	56.8 Å²	56.8	66%	0.658	28%	0.282	S	S	*	.	S	Bend	trans	-65.3	4.3	-171	-86.1	-11.7	0	0	0	115.5	D464 S470	D464-D468 WeakPolarHBondContact O-CB 3.37Å; D464-D468 VanDerWaalsContact O-CG 3.23Å; D464-D468 PolarHBondContact O-N 2.94Å; D468-S470 PolarHBondContact O-N 3.02Å
469	G	60.5	Low	83.9	Confident	43 Å²	43	61 Å²	61	44%	0.443	30%	0.298	S	S	.	.			trans	65.3	3.5	168.2	0	0	0	0	0	115.4	Q467	Q467-G469 PolarHBondContact O-N 3.07Å
470	S	65.4	Low	83.9	Confident	54 Å²	54	58.7 Å²	58.7	38%	0.378	29%	0.289	S	S	.	.			trans	-60.8	142.8	175.1	66.1	0	0	0	0	110	D468 L472	D468-S470 PolarHBondContact O-N 3.02Å; S470-L472 PolarHBondContact O-N 3.36Å
471	R	69.3	Low	83.8	Confident	241 Å²	241	52 Å²	52	91%	0.909	26%	0.26	S	S	*	.			trans	-71.1	81.7	176.5	-71.2	-172.1	-178.3	-176.9	2.1	109.5
472	L	80.6	Confident	83.7	Confident	15 Å²	15	52.2 Å²	52.2	8%	0.079	27%	0.27	C	S	.	.			trans	-66.1	135.7	175.4	-61.3	170.5	0	0	0	110.1	L429 T465 S470 V477 L480 L507	L429-L472 HydrophobicContact CD1-CD2 3.61Å; T465-L472 HydrophobicContact CG2-CD2 4.31Å; S470-L472 PolarHBondContact O-N 3.36Å; L472-V477 HydrophobicContact CB-CG2 3.54Å; L472-V477 HydrophobicContact CD1-CG2 4.13Å; L472-V477 HydrophobicContact CG-CG2 4.5Å; L472-L480 HydrophobicContact CD1-CD1 3.77Å; L472-L480 HydrophobicContact CD2-CD1 4.37Å; L472-L507 HydrophobicContact CD1-CD2 4.36Å
473	N	83.7	Confident	83.6	Confident	59 Å²	59	52.3 Å²	52.3	32%	0.316	27%	0.27	S	S	.	.			trans	-76.7	163.7	173.4	74.8	42.8	0	0	0	110.9	K475 Q476 V477	N473-K475 VanDerWaalsContact C-N 3.27Å; N473-K475 PolarHBondContact O-N 2.89Å; N473-K475 WeakPolarHBondContact OD1-CA 3.15Å; N473-K475 WeakPolarHBondContact OD1-CB 3.34Å; N473-K475 PolarHBondContact OD1-N 3.47Å; N473-Q476 VanDerWaalsContact CG-CD 3.46Å; N473-Q476 PolarHBondContact ND2-NE2 3.09Å; N473-Q476 PolarHBondContact ND2-OE1 2.97Å; N473-Q476 PolarHBondContact O-N 2.99Å; N473-Q476 WeakPolarHBondContact OD1-CB 3.49Å; N473-Q476 VanDerWaalsContact OD1-CG 3.31Å; N473-Q476 WeakPolarHBondContact OD1-CG 3.24Å; N473-Q476 PolarHBondContact OD1-N 2.95Å; N473-V477 WeakPolarHBondContact O-CG2 3.42Å; N473-V477 PolarHBondContact O-N 2.98Å
474	S	85.4	Confident	83.6	Confident	48 Å²	48	51.5 Å²	51.5	34%	0.336	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-32.5	-177.1	57.6	0	0	0	0	113.9	N478 L520	S474-N478 WeakPolarHBondContact O-CB 3.47Å; S474-N478 PolarHBondContact O-N 3.42Å; S474-L520 WeakPolarHBondContact O-CD1 3.41Å
475	K	85.8	Confident	83.5	Confident	159 Å²	159	51.1 Å²	51.1	69%	0.691	26%	0.259	S	S	*	.	H	α-helix	trans	-71	-43.7	178.7	-64.7	-176.2	179.2	-179.2	0	111.6	N473 N478 R479	N473-K475 VanDerWaalsContact C-N 3.27Å; N473-K475 PolarHBondContact O-N 2.89Å; N473-K475 WeakPolarHBondContact OD1-CA 3.15Å; N473-K475 WeakPolarHBondContact OD1-CB 3.34Å; N473-K475 PolarHBondContact OD1-N 3.47Å; K475-N478 PolarHBondContact O-N 2.89Å; K475-R479 PolarHBondContact O-N 3.47Å; K475-R479 VanDerWaalsContact O-N 3.13Å
476	Q	87.1	Confident	83.4	Confident	22 Å²	22	54 Å²	54	10%	0.103	27%	0.268	C	S	.	.	H	α-helix	trans	-61.4	-47.7	175.5	-72.2	165.9	-20.8	0	0	110.6	D427 L433 N473 N478 R479 L480	D427-Q476 PolarHBondContact OD1-NE2 3.3Å; D427-Q476 WeakPolarHBondContact OD2-CG 3.49Å; D427-Q476 PolarHBondContact OD2-NE2 2.99Å; L433-Q476 HydrophobicContact CD1-CB 4.27Å; L433-Q476 HydrophobicContact CD1-CG 4.34Å; N473-Q476 VanDerWaalsContact CG-CD 3.46Å; N473-Q476 PolarHBondContact ND2-NE2 3.09Å; N473-Q476 PolarHBondContact ND2-OE1 2.97Å; N473-Q476 PolarHBondContact O-N 2.99Å; N473-Q476 WeakPolarHBondContact OD1-CB 3.49Å; N473-Q476 VanDerWaalsContact OD1-CG 3.31Å; N473-Q476 WeakPolarHBondContact OD1-CG 3.24Å; N473-Q476 PolarHBondContact OD1-N 2.95Å; Q476-N478 PolarHBondContact O-N 3.45Å; Q476-R479 PolarHBondContact O-N 3.21Å; Q476-L480 WeakPolarHBondContact O-CB 3.17Å; Q476-L480 WeakPolarHBondContact O-CG 3.47Å; Q476-L480 PolarHBondContact O-N 3.43Å
477	V	87.9	Confident	83.4	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-45.2	177.2	175.5	0	0	0	0	111	L472 N473 R479 L480 L481 L507 V517 L521	L472-V477 HydrophobicContact CB-CG2 3.54Å; L472-V477 HydrophobicContact CD1-CG2 4.13Å; L472-V477 HydrophobicContact CG-CG2 4.5Å; N473-V477 WeakPolarHBondContact O-CG2 3.42Å; N473-V477 PolarHBondContact O-N 2.98Å; V477-R479 VanDerWaalsContact C-N 3.32Å; V477-R479 PolarHBondContact O-N 3.46Å; V477-L480 PolarHBondContact O-N 2.54Å; V477-L481 HydrophobicContact CG1-CD1 3.66Å; V477-L481 HydrophobicContact CG1-CG 4.01Å; V477-L481 WeakPolarHBondContact O-CB 3.48Å; V477-L481 VanDerWaalsContact O-CG 3.22Å; V477-L481 WeakPolarHBondContact O-CG 3.3Å; V477-L481 PolarHBondContact O-N 3.39Å; V477-L507 HydrophobicContact CG2-CD2 4.46Å; V477-V517 HydrophobicContact CG1-CG1 4.29Å; V477-V517 HydrophobicContact CG2-CG1 4.04Å; V477-V517 HydrophobicContact CG2-CG2 4.35Å; V477-L521 HydrophobicContact CG1-CD2 4.39Å
478	N	88.6	Confident	83.4	Confident	36 Å²	36	51 Å²	51	19%	0.193	25%	0.254	C	S	.	.	H	α-helix	trans	-57.6	-44.4	178.6	-173.9	42.8	0	0	0	112.2	L249 S474 K475 Q476 L481 G482 L520	L249-N478 WeakPolarHBondContact CB-OD1 3.32Å; L249-N478 PolarHBondContact N-OD1 3.04Å; S474-N478 WeakPolarHBondContact O-CB 3.47Å; S474-N478 PolarHBondContact O-N 3.42Å; K475-N478 PolarHBondContact O-N 2.89Å; Q476-N478 PolarHBondContact O-N 3.45Å; N478-L481 PolarHBondContact O-N 3.27Å; N478-G482 PolarHBondContact O-N 3.23Å; N478-L520 HydrophobicContact CB-CD1 4.03Å; N478-L520 HydrophobicContact CB-CD2 4.45Å
479	R	87.5	Confident	83.8	Confident	88 Å²	88	47.6 Å²	47.6	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-65.9	-47.2	176.3	-70.1	-174	-179.7	-155.9	-2	112.4	L433 K475 Q476 V477 L481 G482 V483	L433-R479 HydrophobicContact CD1-CB 4.28Å; K475-R479 PolarHBondContact O-N 3.47Å; K475-R479 VanDerWaalsContact O-N 3.13Å; Q476-R479 PolarHBondContact O-N 3.21Å; V477-R479 VanDerWaalsContact C-N 3.32Å; V477-R479 PolarHBondContact O-N 3.46Å; R479-L481 VanDerWaalsContact C-N 3.29Å; R479-L481 PolarHBondContact O-N 3.22Å; R479-G482 WeakPolarHBondContact O-CA 3.5Å; R479-G482 PolarHBondContact O-N 3.35Å; R479-V483 WeakPolarHBondContact O-CG2 3.47Å; R479-V483 PolarHBondContact O-N 2.67Å
480	L	89.7	Confident	84.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-55.8	-43.9	175.8	-81.3	166.3	0	0	0	112.1	L433 V462 T465 L466 L472 Q476 V477 G482 V483 T484	L433-L480 HydrophobicContact CD1-CG 4.42Å; L433-L480 HydrophobicContact CD2-CD1 4.5Å; L433-L480 HydrophobicContact CD2-CD2 3.34Å; L433-L480 HydrophobicContact CD2-CG 3.53Å; V462-L480 HydrophobicContact CG1-CD2 4.24Å; V462-L480 HydrophobicContact CG2-CD2 4.29Å; T465-L480 HydrophobicContact CG2-CD1 3.98Å; T465-L480 HydrophobicContact CG2-CD2 4.36Å; L466-L480 HydrophobicContact CD2-CB 4.3Å; L466-L480 HydrophobicContact CD2-CD1 4.13Å; L472-L480 HydrophobicContact CD1-CD1 3.77Å; L472-L480 HydrophobicContact CD2-CD1 4.37Å; Q476-L480 WeakPolarHBondContact O-CB 3.17Å; Q476-L480 WeakPolarHBondContact O-CG 3.47Å; Q476-L480 PolarHBondContact O-N 3.43Å; V477-L480 PolarHBondContact O-N 2.54Å; L480-G482 VanDerWaalsContact C-N 3.33Å; L480-V483 PolarHBondContact O-N 2.94Å; L480-T484 WeakPolarHBondContact O-CB 3.03Å; L480-T484 PolarHBondContact O-N 3.42Å; L480-T484 PolarHBondContact O-OG1 3.18Å
481	L	90.3	Very high	85.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.5	-34.2	176.7	-66.3	175.3	0	0	0	111.8	L249 V477 N478 R479 W485 V504 L520 L521 F524	L249-L481 HydrophobicContact CD1-CB 3.44Å; L249-L481 VanDerWaalsContact CD1-CB 3.44Å; L249-L481 HydrophobicContact CD1-CD1 3.96Å; L249-L481 HydrophobicContact CD1-CG 4.36Å; V477-L481 HydrophobicContact CG1-CD1 3.66Å; V477-L481 HydrophobicContact CG1-CG 4.01Å; V477-L481 WeakPolarHBondContact O-CB 3.48Å; V477-L481 VanDerWaalsContact O-CG 3.22Å; V477-L481 WeakPolarHBondContact O-CG 3.3Å; V477-L481 PolarHBondContact O-N 3.39Å; N478-L481 PolarHBondContact O-N 3.27Å; R479-L481 VanDerWaalsContact C-N 3.29Å; R479-L481 PolarHBondContact O-N 3.22Å; L481-W485 WeakPolarHBondContact O-CB 3.2Å; L481-W485 PolarHBondContact O-N 3.41Å; L481-V504 HydrophobicContact CD2-CG1 3.8Å; L481-V504 HydrophobicContact CD2-CG2 3.86Å; L481-L520 HydrophobicContact CD1-CB 4.1Å; L481-L521 HydrophobicContact CD1-CD2 4.09Å; L481-L521 HydrophobicContact CD2-CD2 4.05Å; L481-F524 HydrophobicContact CB-CD2 3.95Å; L481-F524 HydrophobicContact CB-CE2 4.45Å; L481-F524 HydrophobicContact CD1-CB 4.09Å; L481-F524 HydrophobicContact CD2-CB 4.24Å; L481-F524 HydrophobicContact CD2-CD1 4.19Å; L481-F524 HydrophobicContact CD2-CD2 3.89Å; L481-F524 HydrophobicContact CD2-CE2 4.26Å; L481-F524 HydrophobicContact CD2-CG 3.85Å; L481-F524 HydrophobicContact CG-CD2 4.38Å
482	G	87.8	Confident	85.5	Confident	29 Å²	29	36 Å²	36	30%	0.299	17%	0.173	S	C	.	.	H	α-helix	trans	-60.8	-50.5	171.1	0	0	0	0	0	112.9	N478 R479 L480 W485 R486	N478-G482 PolarHBondContact O-N 3.23Å; R479-G482 WeakPolarHBondContact O-CA 3.5Å; R479-G482 PolarHBondContact O-N 3.35Å; L480-G482 VanDerWaalsContact C-N 3.33Å; G482-W485 WeakPolarHBondContact O-CB 3.21Å; G482-W485 PolarHBondContact O-N 3.47Å; G482-R486 PolarHBondContact O-N 2.91Å
483	V	89.4	Confident	85.2	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-59.4	-48.8	174.4	178.7	0	0	0	0	110.5	C436 D437 V440 I458 V462 R479 L480 W485 R486 L487	C436-V483 HydrophobicContact CB-CG1 3.93Å; C436-V483 HydrophobicContact CB-CG2 3.8Å; D437-V483 WeakPolarHBondContact OD1-CG2 3.38Å; V440-V483 HydrophobicContact CG2-CG1 4.15Å; I458-V483 HydrophobicContact CG2-CG1 4.04Å; V462-V483 HydrophobicContact CG2-CG1 3.85Å; R479-V483 WeakPolarHBondContact O-CG2 3.47Å; R479-V483 PolarHBondContact O-N 2.67Å; L480-V483 PolarHBondContact O-N 2.94Å; V483-W485 VanDerWaalsContact C-N 3.32Å; V483-W485 PolarHBondContact O-N 2.76Å; V483-R486 PolarHBondContact O-N 3.48Å; V483-L487 HydrophobicContact CG1-CD1 4.08Å; V483-L487 HydrophobicContact CG1-CG 4.35Å; V483-L487 WeakPolarHBondContact O-CG 3.43Å; V483-L487 PolarHBondContact O-N 3.35Å
484	T	90	Very high	84.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.7	-46.6	179.1	-57.5	0	0	0	0	111	V462 L480 R486 L487 M488 L500 V504 F524	V462-T484 VanDerWaalsContact CG1-OG1 3.28Å; V462-T484 WeakPolarHBondContact CG1-OG1 3.31Å; L480-T484 WeakPolarHBondContact O-CB 3.03Å; L480-T484 PolarHBondContact O-N 3.42Å; L480-T484 PolarHBondContact O-OG1 3.18Å; T484-R486 PolarHBondContact O-N 2.93Å; T484-L487 PolarHBondContact O-N 3.11Å; T484-M488 HydrophobicContact CG2-SD 4.2Å; T484-M488 VanDerWaalsContact O-CG 3.29Å; T484-M488 WeakPolarHBondContact O-CG 3.31Å; T484-M488 PolarHBondContact O-N 3.18Å; T484-L500 HydrophobicContact CG2-CB 3.99Å; T484-L500 HydrophobicContact CG2-CD1 4.4Å; T484-L500 HydrophobicContact CG2-CD2 4.29Å; T484-L500 HydrophobicContact CG2-CG 4.46Å; T484-V504 HydrophobicContact CG2-CG2 4.24Å; T484-F524 HydrophobicContact CG2-CE2 4.29Å; T484-F524 HydrophobicContact CG2-CZ 3.84Å
485	W	88.6	Confident	84.4	Confident	55 Å²	55	43.7 Å²	43.7	21%	0.208	21%	0.211	C	C	.	.	H	α-helix	trans	-57.8	-50	176.6	177.5	-112.5	0	0	0	111.1	L481 G482 V483 M488 Q489 F524 R527 V528 K531	L481-W485 WeakPolarHBondContact O-CB 3.2Å; L481-W485 PolarHBondContact O-N 3.41Å; G482-W485 WeakPolarHBondContact O-CB 3.21Å; G482-W485 PolarHBondContact O-N 3.47Å; V483-W485 VanDerWaalsContact C-N 3.32Å; V483-W485 PolarHBondContact O-N 2.76Å; W485-M488 WeakPolarHBondContact O-CB 3.48Å; W485-M488 PolarHBondContact O-N 3.27Å; W485-Q489 WeakPolarHBondContact O-CG 3.48Å; W485-Q489 PolarHBondContact O-N 2.96Å; W485-F524 HydrophobicContact CB-CE2 4.12Å; W485-F524 HydrophobicContact CE3-CE2 4.37Å; W485-R527 HydrophobicContact CH2-CB 4.14Å; W485-R527 HydrophobicContact CZ3-CB 4.23Å; W485-V528 HydrophobicContact CE3-CG2 4.05Å; W485-V528 HydrophobicContact CZ3-CB 4.42Å; W485-V528 HydrophobicContact CZ3-CG2 3.74Å; W485-K531 HydrophobicContact CH2-CB 4Å; W485-K531 HydrophobicContact CH2-CD 3.39Å; W485-K531 HydrophobicContact CH2-CG 4.35Å; W485-K531 HydrophobicContact CZ2-CD 3.64Å; W485-K531 HydrophobicContact CZ3-CD 4.28Å
486	R	86.1	Confident	84	Confident	74 Å²	74	36.5 Å²	36.5	28%	0.279	18%	0.181	S	C	.	.	H	α-helix	trans	-63.5	-42	-179.8	-174.5	66.5	-178.8	-175	-7.2	112.1	V440 A443 G482 V483 T484 M488 Q489 I490	V440-R486 HydrophobicContact CB-CG 4.4Å; V440-R486 HydrophobicContact CG1-CB 3.78Å; V440-R486 HydrophobicContact CG1-CG 3.35Å; A443-R486 PolarHBondContact O-NH2 3.27Å; G482-R486 PolarHBondContact O-N 2.91Å; V483-R486 PolarHBondContact O-N 3.48Å; T484-R486 PolarHBondContact O-N 2.93Å; R486-M488 VanDerWaalsContact C-N 3.3Å; R486-M488 PolarHBondContact O-N 3.08Å; R486-Q489 WeakPolarHBondContact O-CB 3.48Å; R486-Q489 PolarHBondContact O-N 2.98Å; R486-I490 HydrophobicContact CG-CD1 3.99Å; R486-I490 WeakPolarHBondContact O-CG1 3.44Å; R486-I490 PolarHBondContact O-N 3.4Å; R486-I490 VanDerWaalsContact O-N 3.1Å
487	L	86.5	Confident	83.9	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-56.4	-44.4	172.9	-73.7	173.4	0	0	0	111.5	V440 L455 I458 V483 T484 Q489 I490 Q491 L500	V440-L487 HydrophobicContact CG1-CD2 3.98Å; V440-L487 HydrophobicContact CG1-CG 4.18Å; V440-L487 HydrophobicContact CG2-CD2 3.87Å; V440-L487 HydrophobicContact CG2-CG 4.28Å; L455-L487 HydrophobicContact CD2-CD2 3.97Å; I458-L487 HydrophobicContact CG2-CD1 4.22Å; V483-L487 HydrophobicContact CG1-CD1 4.08Å; V483-L487 HydrophobicContact CG1-CG 4.35Å; V483-L487 WeakPolarHBondContact O-CG 3.43Å; V483-L487 PolarHBondContact O-N 3.35Å; T484-L487 PolarHBondContact O-N 3.11Å; L487-Q489 VanDerWaalsContact C-N 3.27Å; L487-Q489 PolarHBondContact O-N 3.4Å; L487-I490 PolarHBondContact O-N 3.01Å; L487-Q491 WeakPolarHBondContact O-CB 3.5Å; L487-Q491 PolarHBondContact O-N 3.25Å; L487-L500 HydrophobicContact CB-CD1 4.03Å; L487-L500 HydrophobicContact CD1-CD1 4.35Å
488	M	85.8	Confident	83.8	Confident	23 Å²	23	38.4 Å²	38.4	11%	0.113	19%	0.192	C	C	.	.	H	α-helix	trans	-65.2	-27.5	175.9	-67.3	172	64.1	0	0	113.2	T484 W485 R486 T497 L500 I501 F524 V528	T484-M488 HydrophobicContact CG2-SD 4.2Å; T484-M488 VanDerWaalsContact O-CG 3.29Å; T484-M488 WeakPolarHBondContact O-CG 3.31Å; T484-M488 PolarHBondContact O-N 3.18Å; W485-M488 WeakPolarHBondContact O-CB 3.48Å; W485-M488 PolarHBondContact O-N 3.27Å; R486-M488 VanDerWaalsContact C-N 3.3Å; R486-M488 PolarHBondContact O-N 3.08Å; M488-T497 HydrophobicContact CB-CG2 4.2Å; M488-T497 HydrophobicContact CG-CG2 4.04Å; M488-L500 HydrophobicContact CG-CD1 4.18Å; M488-I501 HydrophobicContact CE-CD1 3.77Å; M488-I501 HydrophobicContact CE-CG1 3.76Å; M488-I501 HydrophobicContact SD-CG1 4.18Å; M488-F524 HydrophobicContact SD-CZ 3.89Å; M488-V528 HydrophobicContact CE-CG1 3.89Å; M488-V528 HydrophobicContact CE-CG2 3.94Å; M488-V528 HydrophobicContact SD-CG2 4.48Å
489	Q	82.8	Confident	83.9	Confident	52 Å²	52	39.2 Å²	39.2	24%	0.243	20%	0.199	C	C	.	.	H	α-helix	trans	-72	-40.4	174.9	-51.3	-161	-25.3	0	0	112.2	W485 R486 L487 Q492 K531	W485-Q489 WeakPolarHBondContact O-CG 3.48Å; W485-Q489 PolarHBondContact O-N 2.96Å; R486-Q489 WeakPolarHBondContact O-CB 3.48Å; R486-Q489 PolarHBondContact O-N 2.98Å; L487-Q489 VanDerWaalsContact C-N 3.27Å; L487-Q489 PolarHBondContact O-N 3.4Å; Q489-Q492 WeakPolarHBondContact O-CG 3.45Å; Q489-K531 VanDerWaalsContact CG-NZ 3.35Å
490	I	81.8	Confident	84	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-74.3	-50.7	-178.8	-64.1	161.5	0	0	0	109.8	V440 A443 L448 R486 L487 Q492	V440-I490 HydrophobicContact CG1-CD1 3.59Å; V440-I490 WeakPolarHBondContact O-CD1 3.34Å; A443-I490 HydrophobicContact CB-CD1 3.87Å; L448-I490 HydrophobicContact CD1-CG2 4.18Å; R486-I490 HydrophobicContact CG-CD1 3.99Å; R486-I490 WeakPolarHBondContact O-CG1 3.44Å; R486-I490 PolarHBondContact O-N 3.4Å; R486-I490 VanDerWaalsContact O-N 3.1Å; L487-I490 PolarHBondContact O-N 3.01Å; I490-Q492 PolarHBondContact O-N 2.98Å
491	Q	76.7	Confident	84	Confident	5 Å²	5	35.1 Å²	35.1	2%	0.023	18%	0.184	C	C	.	.			trans	-94	75.9	-173.5	-58.3	-178.6	-30.6	0	0	109.7	L448 R459 L487 N493 A496 T497	L448-Q491 HydrophobicContact CD1-CG 3.66Å; R459-Q491 VanDerWaalsContact CZ-OE1 3.23Å; L487-Q491 WeakPolarHBondContact O-CB 3.5Å; L487-Q491 PolarHBondContact O-N 3.25Å; Q491-N493 PolarHBondContact O-N 3.04Å; Q491-A496 HydrophobicContact CB-CB 3.95Å; Q491-T497 WeakPolarHBondContact O-CG2 3.38Å
492	Q	72.4	Confident	84	Confident	84 Å²	84	41 Å²	41	39%	0.393	21%	0.209	S	C	.	.			trans	-72.2	15	-176.7	-56.9	-174.8	9.2	0	0	114.8	Q489 I490 R540	Q489-Q492 WeakPolarHBondContact O-CG 3.45Å; I490-Q492 PolarHBondContact O-N 2.98Å; Q492-R540 PolarHBondContact O-NH1 3.01Å
493	N	75.7	Confident	84.1	Confident	94 Å²	94	39.6 Å²	39.6	50%	0.503	20%	0.195	S	C	.	.			trans	-95.4	130.9	178.8	-175.2	-7.7	0	0	0	110.4	Q491 V495 A496 T497	Q491-N493 PolarHBondContact O-N 3.04Å; N493-V495 PolarHBondContact O-N 3.35Å; N493-V495 VanDerWaalsContact O-N 3.17Å; N493-V495 PolarHBondContact OD1-N 3.16Å; N493-V495 VanDerWaalsContact OD1-N 3.13Å; N493-A496 PolarHBondContact O-N 2.9Å; N493-T497 PolarHBondContact O-N 3.43Å; N493-T497 VanDerWaalsContact O-N 3.17Å; N493-T497 PolarHBondContact O-OG1 2.91Å
494	K	74.1	Confident	84.2	Confident	80 Å²	80	39.6 Å²	39.6	35%	0.348	19%	0.194	S	C	.	.	H	α-helix	trans	-52	-37	177.2	-172.8	-178.3	-169.8	174.5	0	113.6	A496 T497 E498 S541	K494-A496 PolarHBondContact O-N 2.85Å; K494-T497 WeakPolarHBondContact CA-OG1 3.42Å; K494-T497 PolarHBondContact O-N 3.07Å; K494-T497 PolarHBondContact O-OG1 3.27Å; K494-E498 WeakPolarHBondContact O-CB 3.46Å; K494-E498 PolarHBondContact O-N 3.5Å; K494-S541 VanDerWaalsContact CD-OG 3.3Å; K494-S541 WeakPolarHBondContact CD-OG 3.1Å; K494-S541 WeakPolarHBondContact CE-OG 3.11Å; K494-S541 PolarHBondContact NZ-OG 2.74Å
495	V	78	Confident	84.3	Confident	111 Å²	111	41.1 Å²	41.1	67%	0.673	20%	0.2	S	C	*	.	H	α-helix	trans	-62.3	-33.8	-178.7	-178.2	0	0	0	0	111.6	N493 P499	N493-V495 PolarHBondContact O-N 3.35Å; N493-V495 VanDerWaalsContact O-N 3.17Å; N493-V495 PolarHBondContact OD1-N 3.16Å; N493-V495 VanDerWaalsContact OD1-N 3.13Å; V495-P499 WeakPolarHBondContact O-CD 3.38Å; V495-P499 WeakPolarHBondContact O-CG 3.34Å
496	A	77.9	Confident	84.3	Confident	7 Å²	7	40.9 Å²	40.9	6%	0.058	21%	0.205	C	C	.	.	H	α-helix	trans	-86.2	-34.7	179.3	0	0	0	0	0	112.8	Q491 N493 K494	Q491-A496 HydrophobicContact CB-CB 3.95Å; N493-A496 PolarHBondContact O-N 2.9Å; K494-A496 PolarHBondContact O-N 2.85Å
497	T	83.7	Confident	84.4	Confident	23 Å²	23	37.6 Å²	37.6	14%	0.141	19%	0.193	C	C	.	.	H	α-helix	trans	-83.9	-34.3	-174.9	58.3	0	0	0	0	113.8	M488 Q491 N493 K494 L500 I501	M488-T497 HydrophobicContact CB-CG2 4.2Å; M488-T497 HydrophobicContact CG-CG2 4.04Å; Q491-T497 WeakPolarHBondContact O-CG2 3.38Å; N493-T497 PolarHBondContact O-N 3.43Å; N493-T497 VanDerWaalsContact O-N 3.17Å; N493-T497 PolarHBondContact O-OG1 2.91Å; K494-T497 WeakPolarHBondContact CA-OG1 3.42Å; K494-T497 PolarHBondContact O-N 3.07Å; K494-T497 PolarHBondContact O-OG1 3.27Å; T497-L500 WeakPolarHBondContact O-CB 3.23Å; T497-L500 PolarHBondContact O-N 3.3Å; T497-I501 WeakPolarHBondContact O-CG1 3.39Å; T497-I501 PolarHBondContact O-N 2.84Å
498	E	87.4	Confident	84.5	Confident	40 Å²	40	37.8 Å²	37.8	19%	0.187	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-43.1	-177.9	-167.2	77.2	175.7	0	0	112.9	K494 L500 I501 K502 S543 K544 V545	K494-E498 WeakPolarHBondContact O-CB 3.46Å; K494-E498 PolarHBondContact O-N 3.5Å; E498-L500 VanDerWaalsContact C-N 3.31Å; E498-L500 PolarHBondContact O-N 3.21Å; E498-I501 PolarHBondContact O-N 3.29Å; E498-K502 VanDerWaalsContact O-CB 3.31Å; E498-K502 WeakPolarHBondContact O-CB 3.45Å; E498-K502 PolarHBondContact O-N 2.9Å; E498-S543 VanDerWaalsContact CD-OG 3.3Å; E498-S543 PolarHBondContact OE1-OG 3.47Å; E498-S543 WeakPolarHBondContact OE2-CA 3.32Å; E498-S543 VanDerWaalsContact OE2-CB 3.25Å; E498-S543 WeakPolarHBondContact OE2-CB 3.42Å; E498-S543 PolarHBondContact OE2-OG 3.07Å; E498-K544 PolarHBondContact OE1-N 3.36Å; E498-K544 VanDerWaalsContact OE1-N 3.13Å; E498-V545 PolarHBondContact OE1-N 3.07Å
499	P	89.3	Confident	84.6	Confident	53 Å²	53	41.8 Å²	41.8	34%	0.344	21%	0.212	S	C	.	.	H	α-helix	trans	-61.6	-37.1	175.4	-23.5	35.1	0	0	0	113.2	V495 K502 A503	V495-P499 WeakPolarHBondContact O-CD 3.38Å; V495-P499 WeakPolarHBondContact O-CG 3.34Å; P499-K502 PolarHBondContact O-N 2.88Å; P499-A503 PolarHBondContact O-N 3.12Å
500	L	89.3	Confident	84.8	Confident	1 Å²	1	42 Å²	42	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-66.6	-48.1	177.6	-72.8	174.5	0	0	0	111.5	R459 V462 T484 L487 M488 T497 E498 K502 A503 V504	R459-L500 HydrophobicContact CG-CD1 4.18Å; R459-L500 HydrophobicContact CG-CD2 3.78Å; R459-L500 HydrophobicContact CG-CG 4Å; V462-L500 HydrophobicContact CG1-CD2 4.31Å; T484-L500 HydrophobicContact CG2-CB 3.99Å; T484-L500 HydrophobicContact CG2-CD1 4.4Å; T484-L500 HydrophobicContact CG2-CD2 4.29Å; T484-L500 HydrophobicContact CG2-CG 4.46Å; L487-L500 HydrophobicContact CB-CD1 4.03Å; L487-L500 HydrophobicContact CD1-CD1 4.35Å; M488-L500 HydrophobicContact CG-CD1 4.18Å; T497-L500 WeakPolarHBondContact O-CB 3.23Å; T497-L500 PolarHBondContact O-N 3.3Å; E498-L500 VanDerWaalsContact C-N 3.31Å; E498-L500 PolarHBondContact O-N 3.21Å; L500-K502 VanDerWaalsContact C-N 3.27Å; L500-K502 PolarHBondContact O-N 2.85Å; L500-A503 PolarHBondContact O-N 2.83Å; L500-V504 WeakPolarHBondContact O-CG2 3.26Å; L500-V504 PolarHBondContact O-N 3.07Å; L500-V504 VanDerWaalsContact O-N 3.09Å
501	I	89.8	Confident	84.5	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-61	-41	176	-62.6	170.5	0	0	0	109.9	M488 T497 E498 V504 Y505 F525 V528 V545	M488-I501 HydrophobicContact CE-CD1 3.77Å; M488-I501 HydrophobicContact CE-CG1 3.76Å; M488-I501 HydrophobicContact SD-CG1 4.18Å; T497-I501 WeakPolarHBondContact O-CG1 3.39Å; T497-I501 PolarHBondContact O-N 2.84Å; E498-I501 PolarHBondContact O-N 3.29Å; I501-V504 PolarHBondContact O-N 3.02Å; I501-Y505 WeakPolarHBondContact O-CB 3.39Å; I501-Y505 PolarHBondContact O-N 3.18Å; I501-F525 HydrophobicContact CG2-CE1 3.99Å; I501-V528 HydrophobicContact CD1-CG1 4.45Å; I501-V545 HydrophobicContact CG2-CB 3.93Å; I501-V545 HydrophobicContact CG2-CG1 3.86Å
502	K	90.9	Very high	84.4	Confident	123 Å²	123	60.2 Å²	60.2	54%	0.535	29%	0.293	S	S	.	.	H	α-helix	trans	-60.2	-44.2	175.5	-172.3	-179.5	175.9	-173.7	0	111.9	E498 P499 L500 Y505 T506 V545	E498-K502 VanDerWaalsContact O-CB 3.31Å; E498-K502 WeakPolarHBondContact O-CB 3.45Å; E498-K502 PolarHBondContact O-N 2.9Å; P499-K502 PolarHBondContact O-N 2.88Å; L500-K502 VanDerWaalsContact C-N 3.27Å; L500-K502 PolarHBondContact O-N 2.85Å; K502-Y505 WeakPolarHBondContact O-CB 3.34Å; K502-Y505 PolarHBondContact O-N 3.07Å; K502-T506 PolarHBondContact O-N 2.7Å; K502-T506 PolarHBondContact O-OG1 3.5Å; K502-T506 VanDerWaalsContact O-OG1 3.05Å; K502-V545 HydrophobicContact CB-CG2 4.12Å; K502-V545 HydrophobicContact CG-CG2 4.45Å
503	A	90.3	Very high	84.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-45.5	178.5	0	0	0	0	0	112.2	T463 L466 Q467 P499 L500 Y505 T506 L507	T463-A503 HydrophobicContact CG2-CB 4.08Å; L466-A503 HydrophobicContact CB-CB 3.98Å; L466-A503 HydrophobicContact CD1-CB 4.21Å; Q467-A503 HydrophobicContact CG-CB 4.06Å; P499-A503 PolarHBondContact O-N 3.12Å; L500-A503 PolarHBondContact O-N 2.83Å; A503-Y505 VanDerWaalsContact C-N 3.26Å; A503-Y505 PolarHBondContact O-N 3.44Å; A503-T506 PolarHBondContact O-N 2.91Å; A503-L507 PolarHBondContact O-N 3.34Å; A503-L507 VanDerWaalsContact O-N 3.15Å
504	V	91.4	Very high	85.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-37.3	174.5	-179.8	0	0	0	0	111.2	L466 L481 T484 L500 I501 L507 Y508 L521 F524 F525	L466-V504 HydrophobicContact CD1-CG2 3.78Å; L481-V504 HydrophobicContact CD2-CG1 3.8Å; L481-V504 HydrophobicContact CD2-CG2 3.86Å; T484-V504 HydrophobicContact CG2-CG2 4.24Å; L500-V504 WeakPolarHBondContact O-CG2 3.26Å; L500-V504 PolarHBondContact O-N 3.07Å; L500-V504 VanDerWaalsContact O-N 3.09Å; I501-V504 PolarHBondContact O-N 3.02Å; V504-L507 PolarHBondContact O-N 3Å; V504-Y508 PolarHBondContact O-N 2.8Å; V504-L521 HydrophobicContact CG1-CD2 3.63Å; V504-F524 HydrophobicContact CB-CE1 4.27Å; V504-F524 HydrophobicContact CG1-CD1 3.82Å; V504-F524 HydrophobicContact CG1-CE1 3.98Å; V504-F524 HydrophobicContact CG2-CE1 4Å; V504-F524 HydrophobicContact CG2-CZ 4.34Å; V504-F525 HydrophobicContact CB-CZ 4.11Å; V504-F525 HydrophobicContact CG1-CE1 4.45Å; V504-F525 HydrophobicContact CG1-CE2 3.81Å; V504-F525 HydrophobicContact CG1-CZ 3.69Å
505	Y	90.8	Very high	85.7	Confident	32 Å²	32	58.4 Å²	58.4	13%	0.125	29%	0.286	C	S	.	.	H	α-helix	trans	-68.7	-39.7	177.8	-177.2	-109.8	0	0	0	112.5	I501 K502 A503 L507 Y508 Q509 F525 V545 W549	I501-Y505 WeakPolarHBondContact O-CB 3.39Å; I501-Y505 PolarHBondContact O-N 3.18Å; K502-Y505 WeakPolarHBondContact O-CB 3.34Å; K502-Y505 PolarHBondContact O-N 3.07Å; A503-Y505 VanDerWaalsContact C-N 3.26Å; A503-Y505 PolarHBondContact O-N 3.44Å; Y505-L507 VanDerWaalsContact C-N 3.29Å; Y505-L507 PolarHBondContact O-N 3.2Å; Y505-Y508 HydrophobicContact CD2-CD1 4.31Å; Y505-Y508 HydrophobicContact CE2-CD1 4.29Å; Y505-Y508 WeakPolarHBondContact O-CB 3.33Å; Y505-Y508 PolarHBondContact O-N 2.59Å; Y505-Y508 VanDerWaalsContact O-N 3.14Å; Y505-Q509 HydrophobicContact CD1-CG 4.32Å; Y505-Q509 HydrophobicContact CE1-CG 3.95Å; Y505-Q509 HydrophobicContact CE2-CG 4.25Å; Y505-Q509 VanDerWaalsContact CZ-NE2 3.34Å; Y505-Q509 WeakPolarHBondContact O-CG 3.48Å; Y505-Q509 PolarHBondContact O-N 2.73Å; Y505-Q509 PolarHBondContact OH-NE2 3.37Å; Y505-Q509 VanDerWaalsContact OH-NE2 3.09Å; Y505-F525 HydrophobicContact CD2-CZ 4.29Å; Y505-V545 VanDerWaalsContact CB-CG1 3.44Å; Y505-V545 HydrophobicContact CD1-CG1 3.82Å; Y505-V545 HydrophobicContact CD2-CG1 4.21Å; Y505-V545 HydrophobicContact CG-CG1 3.56Å; Y505-W549 HydrophobicContact CD2-CB 3.92Å; Y505-W549 HydrophobicContact CD2-CG 4.33Å; Y505-W549 HydrophobicContact CE2-CB 3.7Å; Y505-W549 AromaticContact CE2-CD1 3.96Å; Y505-W549 HydrophobicContact CE2-CG 4.25Å
506	T	89.6	Confident	86.1	Confident	51 Å²	51	56.4 Å²	56.4	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-57.7	-43.7	172.7	-56.1	0	0	0	0	111.1	K502 A503 Q509	K502-T506 PolarHBondContact O-N 2.7Å; K502-T506 PolarHBondContact O-OG1 3.5Å; K502-T506 VanDerWaalsContact O-OG1 3.05Å; A503-T506 PolarHBondContact O-N 2.91Å; T506-Q509 PolarHBondContact O-N 3.5Å
507	L	88.6	Confident	86.5	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-44.6	174.6	-178	61.7	0	0	0	111.3	L466 L472 V477 A503 V504 Y505 Q509 Q510 L513 L521	L466-L507 HydrophobicContact CD2-CD2 3.76Å; L472-L507 HydrophobicContact CD1-CD2 4.36Å; V477-L507 HydrophobicContact CG2-CD2 4.46Å; A503-L507 PolarHBondContact O-N 3.34Å; A503-L507 VanDerWaalsContact O-N 3.15Å; V504-L507 PolarHBondContact O-N 3Å; Y505-L507 VanDerWaalsContact C-N 3.29Å; Y505-L507 PolarHBondContact O-N 3.2Å; L507-Q509 VanDerWaalsContact C-N 3.28Å; L507-Q509 PolarHBondContact O-N 3.2Å; L507-Q510 WeakPolarHBondContact O-CB 3.49Å; L507-Q510 WeakPolarHBondContact O-CG 3.46Å; L507-Q510 PolarHBondContact O-N 3.01Å; L507-L513 HydrophobicContact CD1-CD2 4.26Å; L507-L513 WeakPolarHBondContact O-CD1 3.31Å; L507-L521 HydrophobicContact CD2-CD1 4.36Å; L507-L521 HydrophobicContact CD2-CD2 4.07Å; L507-L521 HydrophobicContact CG-CD1 4.13Å
508	Y	88.9	Confident	86.7	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-32.3	178.2	177.9	-104.3	0	0	0	114.4	V504 Y505 Q510 R518 L521 L522 F525 W549 Q556	V504-Y508 PolarHBondContact O-N 2.8Å; Y505-Y508 HydrophobicContact CD2-CD1 4.31Å; Y505-Y508 HydrophobicContact CE2-CD1 4.29Å; Y505-Y508 WeakPolarHBondContact O-CB 3.33Å; Y505-Y508 PolarHBondContact O-N 2.59Å; Y505-Y508 VanDerWaalsContact O-N 3.14Å; Y508-Q510 PolarHBondContact O-N 2.96Å; Y508-R518 HydrophobicContact CE2-CG 4.2Å; Y508-R518 PolarHBondContact O-NH1 3.15Å; Y508-R518 PolarHBondContact OH-NH2 3.41Å; Y508-R518 VanDerWaalsContact OH-NH2 3.15Å; Y508-L521 HydrophobicContact CD2-CB 4.06Å; Y508-L521 HydrophobicContact CD2-CD1 4.36Å; Y508-L522 HydrophobicContact CE2-CD2 3.73Å; Y508-L522 HydrophobicContact CE2-CG 4.1Å; Y508-F525 HydrophobicContact CG-CE2 4.32Å; Y508-W549 AromaticContact CD1-CD1 3.7Å; Y508-W549 AromaticContact CD1-NE1 3.92Å; Y508-W549 AromaticContact CE1-CD1 3.49Å; Y508-W549 VanDerWaalsContact CE1-CD1 3.49Å; Y508-W549 AromaticContact CE1-NE1 3.48Å; Y508-W549 AromaticContact CZ-NE1 3.64Å; Y508-Q556 PolarHBondContact OH-OE1 3.4Å
509	Q	87.8	Confident	86.8	Confident	106 Å²	106	56.2 Å²	56.2	50%	0.495	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-10.8	-179.7	-72.9	-173.3	-46.8	0	0	114	Y505 T506 L507 R511	Y505-Q509 HydrophobicContact CD1-CG 4.32Å; Y505-Q509 HydrophobicContact CE1-CG 3.95Å; Y505-Q509 HydrophobicContact CE2-CG 4.25Å; Y505-Q509 VanDerWaalsContact CZ-NE2 3.34Å; Y505-Q509 WeakPolarHBondContact O-CG 3.48Å; Y505-Q509 PolarHBondContact O-N 2.73Å; Y505-Q509 PolarHBondContact OH-NE2 3.37Å; Y505-Q509 VanDerWaalsContact OH-NE2 3.09Å; T506-Q509 PolarHBondContact O-N 3.5Å; L507-Q509 VanDerWaalsContact C-N 3.28Å; L507-Q509 PolarHBondContact O-N 3.2Å; Q509-R511 PolarHBondContact O-N 2.59Å
510	Q	86	Confident	86.7	Confident	57 Å²	57	54.8 Å²	54.8	27%	0.266	26%	0.26	S	S	.	.			trans	-64.9	135.2	177.8	-63.9	179.4	1.5	0	0	111.3	L507 Y508 L513	L507-Q510 WeakPolarHBondContact O-CB 3.49Å; L507-Q510 WeakPolarHBondContact O-CG 3.46Å; L507-Q510 PolarHBondContact O-N 3.01Å; Y508-Q510 PolarHBondContact O-N 2.96Å; Q510-L513 HydrophobicContact CB-CD2 4.08Å; Q510-L513 HydrophobicContact CB-CG 4.06Å
511	R	74.9	Confident	86.8	Confident	243 Å²	243	54.7 Å²	54.7	92%	0.917	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-33.3	-173.4	-67.9	-173.6	177.3	-172.9	-0.4	113.8	Q509	Q509-R511 PolarHBondContact O-N 2.59Å
512	N	76.3	Confident	86.8	Confident	149 Å²	149	54.8 Å²	54.8	80%	0.797	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	47.5	-170.9	-65.1	-21.9	0	0	0	112.6
513	L	82.9	Confident	86.7	Confident	34 Å²	34	50.7 Å²	50.7	18%	0.178	24%	0.242	C	C	.	.			trans	-80.6	138.2	175.8	-67.3	173.6	0	0	0	111.1	L507 Q510 V517 R518 L521	L507-L513 HydrophobicContact CD1-CD2 4.26Å; L507-L513 WeakPolarHBondContact O-CD1 3.31Å; Q510-L513 HydrophobicContact CB-CD2 4.08Å; Q510-L513 HydrophobicContact CB-CG 4.06Å; L513-V517 HydrophobicContact CD2-CG1 4.09Å; L513-R518 HydrophobicContact CB-CB 4.49Å; L513-L521 HydrophobicContact CD1-CD1 3.96Å
514	L	83.7	Confident	86.7	Confident	116 Å²	116	50.7 Å²	50.7	61%	0.607	24%	0.242	S	C	*	.			trans	-61.6	140.9	168.2	-63.5	173	0	0	0	109.8	V517 R518	L514-V517 HydrophobicContact CB-CG2 4.24Å; L514-V517 WeakPolarHBondContact O-CB 3.37Å; L514-V517 PolarHBondContact O-N 2.92Å; L514-R518 PolarHBondContact O-N 3.18Å
515	F	82.8	Confident	86.6	Confident	70 Å²	70	50.7 Å²	50.7	31%	0.307	24%	0.242	S	C	.	.	H	α-helix	trans	-51.3	-44.4	-178.7	173.6	-84	0	0	0	114.2	V517 R518 T519 N564 E566 L567	F515-V517 VanDerWaalsContact C-N 3.3Å; F515-V517 PolarHBondContact O-N 3.48Å; F515-R518 PolarHBondContact O-N 2.85Å; F515-T519 PolarHBondContact O-N 3.21Å; F515-T519 PolarHBondContact O-OG1 3.47Å; F515-N564 WeakPolarHBondContact CD2-ND2 3.37Å; F515-N564 WeakPolarHBondContact CE2-ND2 3.34Å; F515-N564 WeakPolarHBondContact CE2-OD1 3.33Å; F515-E566 HydrophobicContact CE2-CB 4.38Å; F515-E566 HydrophobicContact CZ-CB 4.05Å; F515-E566 VanDerWaalsContact CZ-OE2 3.23Å; F515-E566 WeakPolarHBondContact CZ-OE2 3.32Å; F515-L567 HydrophobicContact CD2-CD1 3.78Å; F515-L567 HydrophobicContact CD2-CD2 4.14Å; F515-L567 HydrophobicContact CD2-CG 3.85Å; F515-L567 HydrophobicContact CE2-CD1 3.91Å; F515-L567 HydrophobicContact CE2-CD2 3.79Å; F515-L567 HydrophobicContact CE2-CG 3.45Å; F515-L567 VanDerWaalsContact CE2-CG 3.45Å; F515-L567 HydrophobicContact CZ-CD2 4.33Å; F515-L567 HydrophobicContact CZ-CG 4.34Å
516	P	85.4	Confident	86.5	Confident	69 Å²	69	50.3 Å²	50.3	45%	0.448	24%	0.244	S	C	.	.	H	α-helix	trans	-62.4	-35.8	176.7	-24.3	35.4	0	0	0	113.3	L520	P516-L520 VanDerWaalsContact O-CG 3.32Å; P516-L520 WeakPolarHBondContact O-CG 3.41Å; P516-L520 PolarHBondContact O-N 3.37Å
517	V	87.1	Confident	86.3	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.024	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-46	177.1	173.7	0	0	0	0	110	V477 L513 L514 F515 T519 L520 L521	V477-V517 HydrophobicContact CG1-CG1 4.29Å; V477-V517 HydrophobicContact CG2-CG1 4.04Å; V477-V517 HydrophobicContact CG2-CG2 4.35Å; L513-V517 HydrophobicContact CD2-CG1 4.09Å; L514-V517 HydrophobicContact CB-CG2 4.24Å; L514-V517 WeakPolarHBondContact O-CB 3.37Å; L514-V517 PolarHBondContact O-N 2.92Å; F515-V517 VanDerWaalsContact C-N 3.3Å; F515-V517 PolarHBondContact O-N 3.48Å; V517-T519 VanDerWaalsContact C-N 3.3Å; V517-T519 PolarHBondContact O-N 3.07Å; V517-L520 PolarHBondContact O-N 3.23Å; V517-L521 HydrophobicContact CG1-CD1 4.06Å; V517-L521 WeakPolarHBondContact O-CG 3.23Å; V517-L521 PolarHBondContact O-N 3.14Å
518	R	88	Confident	86.1	Confident	48 Å²	48	51.6 Å²	51.6	18%	0.181	24%	0.243	C	C	.	.	H	α-helix	trans	-61.4	-40.6	178.3	-165.2	166.3	-173.6	87.2	4.4	112	Y508 L513 L514 F515 L521 L522	Y508-R518 HydrophobicContact CE2-CG 4.2Å; Y508-R518 PolarHBondContact O-NH1 3.15Å; Y508-R518 PolarHBondContact OH-NH2 3.41Å; Y508-R518 VanDerWaalsContact OH-NH2 3.15Å; L513-R518 HydrophobicContact CB-CB 4.49Å; L514-R518 PolarHBondContact O-N 3.18Å; F515-R518 PolarHBondContact O-N 2.85Å; R518-L521 PolarHBondContact O-N 2.99Å; R518-L522 WeakPolarHBondContact O-CG 2.93Å; R518-L522 PolarHBondContact O-N 2.92Å
519	T	88.1	Confident	85.8	Confident	15 Å²	15	52.3 Å²	52.3	9%	0.092	25%	0.246	C	C	.	.	H	α-helix	trans	-61.5	-46.4	175	-59.7	0	0	0	0	111.9	F515 V517 L521 L522 K523	F515-T519 PolarHBondContact O-N 3.21Å; F515-T519 PolarHBondContact O-OG1 3.47Å; V517-T519 VanDerWaalsContact C-N 3.3Å; V517-T519 PolarHBondContact O-N 3.07Å; T519-L521 VanDerWaalsContact C-N 3.32Å; T519-L521 PolarHBondContact O-N 2.92Å; T519-L522 PolarHBondContact O-N 3.31Å; T519-K523 HydrophobicContact CG2-CD 4.11Å; T519-K523 WeakPolarHBondContact O-CB 3.39Å; T519-K523 WeakPolarHBondContact O-CG 3.29Å; T519-K523 PolarHBondContact O-N 2.91Å
520	L	88.1	Confident	85.4	Confident	22 Å²	22	51.3 Å²	51.3	12%	0.115	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-40.6	177.1	-74.2	168.6	0	0	0	112.2	L249 S474 N478 L481 P516 V517 K523 F524	L249-L520 HydrophobicContact CB-CD2 4.11Å; S474-L520 WeakPolarHBondContact O-CD1 3.41Å; N478-L520 HydrophobicContact CB-CD1 4.03Å; N478-L520 HydrophobicContact CB-CD2 4.45Å; L481-L520 HydrophobicContact CD1-CB 4.1Å; P516-L520 VanDerWaalsContact O-CG 3.32Å; P516-L520 WeakPolarHBondContact O-CG 3.41Å; P516-L520 PolarHBondContact O-N 3.37Å; V517-L520 PolarHBondContact O-N 3.23Å; L520-K523 PolarHBondContact O-N 3.23Å; L520-F524 WeakPolarHBondContact O-CB 3.48Å; L520-F524 PolarHBondContact O-N 3Å
521	L	91	Very high	84.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-44.5	177.5	-65.5	169.1	0	0	0	111.8	V477 L481 V504 L507 Y508 L513 V517 R518 T519 K523 F524 F525	V477-L521 HydrophobicContact CG1-CD2 4.39Å; L481-L521 HydrophobicContact CD1-CD2 4.09Å; L481-L521 HydrophobicContact CD2-CD2 4.05Å; V504-L521 HydrophobicContact CG1-CD2 3.63Å; L507-L521 HydrophobicContact CD2-CD1 4.36Å; L507-L521 HydrophobicContact CD2-CD2 4.07Å; L507-L521 HydrophobicContact CG-CD1 4.13Å; Y508-L521 HydrophobicContact CD2-CB 4.06Å; Y508-L521 HydrophobicContact CD2-CD1 4.36Å; L513-L521 HydrophobicContact CD1-CD1 3.96Å; V517-L521 HydrophobicContact CG1-CD1 4.06Å; V517-L521 WeakPolarHBondContact O-CG 3.23Å; V517-L521 PolarHBondContact O-N 3.14Å; R518-L521 PolarHBondContact O-N 2.99Å; T519-L521 VanDerWaalsContact C-N 3.32Å; T519-L521 PolarHBondContact O-N 2.92Å; L521-K523 VanDerWaalsContact C-N 3.35Å; L521-K523 PolarHBondContact O-N 3.26Å; L521-F524 WeakPolarHBondContact O-CB 3.37Å; L521-F524 PolarHBondContact O-N 3.48Å; L521-F525 WeakPolarHBondContact O-CD2 3.45Å; L521-F525 PolarHBondContact O-N 3.36Å
522	L	90.1	Very high	84.5	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-45.5	174.7	-73.4	175.1	0	0	0	111.5	Y508 R518 T519 F524 F525 S526 W549 L567 L571 I574	Y508-L522 HydrophobicContact CE2-CD2 3.73Å; Y508-L522 HydrophobicContact CE2-CG 4.1Å; R518-L522 WeakPolarHBondContact O-CG 2.93Å; R518-L522 PolarHBondContact O-N 2.92Å; T519-L522 PolarHBondContact O-N 3.31Å; L522-F524 VanDerWaalsContact C-N 3.33Å; L522-F524 PolarHBondContact O-N 3.43Å; L522-F525 PolarHBondContact O-N 3.43Å; L522-S526 WeakPolarHBondContact O-CB 3.28Å; L522-S526 PolarHBondContact O-N 3.5Å; L522-W549 HydrophobicContact CD2-CZ2 3.78Å; L522-L567 HydrophobicContact CD1-CD2 4.14Å; L522-L571 HydrophobicContact CD1-CD2 4.19Å; L522-L571 HydrophobicContact CD2-CD2 3.92Å; L522-I574 HydrophobicContact CB-CD1 4.26Å; L522-I574 HydrophobicContact CD2-CD1 4.38Å
523	K	89	Confident	83.5	Confident	37 Å²	37	38.3 Å²	38.3	16%	0.161	19%	0.187	C	C	.	.	H	α-helix	trans	-61.1	-41.5	176.2	-74.5	178.3	177.1	-173.7	0	112	E251 T519 L520 L521 S526 R527	E251-K523 WeakPolarHBondContact OE1-CE 3.35Å; E251-K523 IonicContact OE1-NZ 2.85Å; E251-K523 PolarHBondContact OE1-NZ 2.87Å; E251-K523 IonicContact OE2-NZ 3.17Å; E251-K523 PolarHBondContact OE2-NZ 3.33Å; T519-K523 HydrophobicContact CG2-CD 4.11Å; T519-K523 WeakPolarHBondContact O-CB 3.39Å; T519-K523 WeakPolarHBondContact O-CG 3.29Å; T519-K523 PolarHBondContact O-N 2.91Å; L520-K523 PolarHBondContact O-N 3.23Å; L521-K523 VanDerWaalsContact C-N 3.35Å; L521-K523 PolarHBondContact O-N 3.26Å; K523-S526 PolarHBondContact O-N 3.34Å; K523-R527 WeakPolarHBondContact O-CG 3.39Å; K523-R527 PolarHBondContact O-N 3.48Å
524	F	90.6	Very high	82.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-51.9	175.3	175.8	-91.6	0	0	0	111.5	L481 T484 W485 M488 V504 L520 L521 L522 S526 R527 V528	L481-F524 HydrophobicContact CB-CD2 3.95Å; L481-F524 HydrophobicContact CB-CE2 4.45Å; L481-F524 HydrophobicContact CD1-CB 4.09Å; L481-F524 HydrophobicContact CD2-CB 4.24Å; L481-F524 HydrophobicContact CD2-CD1 4.19Å; L481-F524 HydrophobicContact CD2-CD2 3.89Å; L481-F524 HydrophobicContact CD2-CE2 4.26Å; L481-F524 HydrophobicContact CD2-CG 3.85Å; L481-F524 HydrophobicContact CG-CD2 4.38Å; T484-F524 HydrophobicContact CG2-CE2 4.29Å; T484-F524 HydrophobicContact CG2-CZ 3.84Å; W485-F524 HydrophobicContact CB-CE2 4.12Å; W485-F524 HydrophobicContact CE3-CE2 4.37Å; M488-F524 HydrophobicContact SD-CZ 3.89Å; V504-F524 HydrophobicContact CB-CE1 4.27Å; V504-F524 HydrophobicContact CG1-CD1 3.82Å; V504-F524 HydrophobicContact CG1-CE1 3.98Å; V504-F524 HydrophobicContact CG2-CE1 4Å; V504-F524 HydrophobicContact CG2-CZ 4.34Å; L520-F524 WeakPolarHBondContact O-CB 3.48Å; L520-F524 PolarHBondContact O-N 3Å; L521-F524 WeakPolarHBondContact O-CB 3.37Å; L521-F524 PolarHBondContact O-N 3.48Å; L522-F524 VanDerWaalsContact C-N 3.33Å; L522-F524 PolarHBondContact O-N 3.43Å; F524-S526 PolarHBondContact O-N 3.06Å; F524-R527 PolarHBondContact O-N 3.12Å; F524-V528 HydrophobicContact CD1-CG2 4.09Å; F524-V528 HydrophobicContact CE1-CG2 3.71Å; F524-V528 HydrophobicContact CE2-CG2 4.32Å; F524-V528 HydrophobicContact CZ-CG2 3.84Å; F524-V528 WeakPolarHBondContact O-CG2 3.38Å; F524-V528 PolarHBondContact O-N 3.44Å
525	F	89.9	Confident	80.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-39.1	179.1	-76.6	-65.1	0	0	0	113	I501 V504 Y505 Y508 L521 L522 V528 Y529 L546 W549	I501-F525 HydrophobicContact CG2-CE1 3.99Å; V504-F525 HydrophobicContact CB-CZ 4.11Å; V504-F525 HydrophobicContact CG1-CE1 4.45Å; V504-F525 HydrophobicContact CG1-CE2 3.81Å; V504-F525 HydrophobicContact CG1-CZ 3.69Å; Y505-F525 HydrophobicContact CD2-CZ 4.29Å; Y508-F525 HydrophobicContact CG-CE2 4.32Å; L521-F525 WeakPolarHBondContact O-CD2 3.45Å; L521-F525 PolarHBondContact O-N 3.36Å; L522-F525 PolarHBondContact O-N 3.43Å; F525-V528 PolarHBondContact O-N 3Å; F525-Y529 WeakPolarHBondContact O-CB 3.31Å; F525-Y529 PolarHBondContact O-N 3.47Å; F525-L546 HydrophobicContact CB-CD1 4.47Å; F525-L546 HydrophobicContact CD1-CD1 3.85Å; F525-W549 HydrophobicContact CB-CD2 3.91Å; F525-W549 HydrophobicContact CB-CE3 3.83Å; F525-W549 HydrophobicContact CB-CH2 3.33Å; F525-W549 HydrophobicContact CB-CZ2 3.41Å; F525-W549 VanDerWaalsContact CB-CZ2 3.41Å; F525-W549 HydrophobicContact CB-CZ3 3.55Å; F525-W549 HydrophobicContact CD1-CD2 4.32Å; F525-W549 HydrophobicContact CD1-CE3 4.44Å; F525-W549 HydrophobicContact CD2-CD2 4.25Å; F525-W549 AromaticContact CD2-CE2 3.85Å; F525-W549 HydrophobicContact CD2-CG 4.47Å; F525-W549 HydrophobicContact CD2-CZ2 4.23Å; F525-W549 AromaticContact CD2-NE1 3.79Å; F525-W549 AromaticContact CG-CD2 3.93Å; F525-W549 HydrophobicContact CG-CD2 3.93Å; F525-W549 AromaticContact CG-CE2 3.84Å; F525-W549 HydrophobicContact CG-CE3 4.21Å; F525-W549 HydrophobicContact CG-CG 4.41Å; F525-W549 HydrophobicContact CG-CH2 4.35Å; F525-W549 HydrophobicContact CG-CZ2 4.08Å; F525-W549 HydrophobicContact CG-CZ3 4.41Å
526	S	87.5	Confident	79.1	Confident	23 Å²	23	44.4 Å²	44.4	16%	0.161	22%	0.223	C	C	.	.	H	α-helix	trans	-57	-48.6	172.5	177.5	0	0	0	0	111.5	L522 K523 F524 V528 Y529 Q530	L522-S526 WeakPolarHBondContact O-CB 3.28Å; L522-S526 PolarHBondContact O-N 3.5Å; K523-S526 PolarHBondContact O-N 3.34Å; F524-S526 PolarHBondContact O-N 3.06Å; S526-V528 PolarHBondContact O-N 3.39Å; S526-Y529 PolarHBondContact O-N 3.36Å; S526-Q530 VanDerWaalsContact O-CG 3.29Å; S526-Q530 WeakPolarHBondContact O-CG 3.47Å; S526-Q530 PolarHBondContact O-N 2.88Å
527	R	85.4	Confident	77.2	Confident	80 Å²	80	50.7 Å²	50.7	30%	0.302	25%	0.246	S	C	.	.	H	α-helix	trans	-63.7	-40.2	177.3	-72.7	-177.1	-173.6	-167	3.4	112.5	W485 K523 F524 Q530 K531	W485-R527 HydrophobicContact CH2-CB 4.14Å; W485-R527 HydrophobicContact CZ3-CB 4.23Å; K523-R527 WeakPolarHBondContact O-CG 3.39Å; K523-R527 PolarHBondContact O-N 3.48Å; F524-R527 PolarHBondContact O-N 3.12Å; R527-Q530 PolarHBondContact O-N 2.99Å; R527-K531 WeakPolarHBondContact O-CB 3.37Å; R527-K531 PolarHBondContact O-N 3.14Å; R527-K531 VanDerWaalsContact O-N 3.15Å
528	V	84.8	Confident	75.2	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.024	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-48.6	174.4	173.5	0	0	0	0	110.3	W485 M488 I501 F524 F525 S526 K531 E532 L546	W485-V528 HydrophobicContact CE3-CG2 4.05Å; W485-V528 HydrophobicContact CZ3-CB 4.42Å; W485-V528 HydrophobicContact CZ3-CG2 3.74Å; M488-V528 HydrophobicContact CE-CG1 3.89Å; M488-V528 HydrophobicContact CE-CG2 3.94Å; M488-V528 HydrophobicContact SD-CG2 4.48Å; I501-V528 HydrophobicContact CD1-CG1 4.45Å; F524-V528 HydrophobicContact CD1-CG2 4.09Å; F524-V528 HydrophobicContact CE1-CG2 3.71Å; F524-V528 HydrophobicContact CE2-CG2 4.32Å; F524-V528 HydrophobicContact CZ-CG2 3.84Å; F524-V528 WeakPolarHBondContact O-CG2 3.38Å; F524-V528 PolarHBondContact O-N 3.44Å; F525-V528 PolarHBondContact O-N 3Å; S526-V528 PolarHBondContact O-N 3.39Å; V528-K531 PolarHBondContact O-N 2.9Å; V528-E532 PolarHBondContact O-N 2.86Å; V528-E532 VanDerWaalsContact O-N 3.13Å; V528-L546 HydrophobicContact CG1-CD1 4.47Å; V528-L546 HydrophobicContact CG1-CD2 4.23Å
529	Y	82.5	Confident	73.1	Confident	18 Å²	18	66.3 Å²	66.3	7%	0.071	32%	0.317	C	S	.	.	H	α-helix	trans	-61.2	-45.4	178.3	178.2	-114.8	0	0	0	112.8	F525 S526 K531 E532 L546 L550 A578 R581	F525-Y529 WeakPolarHBondContact O-CB 3.31Å; F525-Y529 PolarHBondContact O-N 3.47Å; S526-Y529 PolarHBondContact O-N 3.36Å; Y529-K531 VanDerWaalsContact C-N 3.28Å; Y529-K531 PolarHBondContact O-N 3.44Å; Y529-E532 PolarHBondContact O-N 3.35Å; Y529-L546 HydrophobicContact CD2-CD2 4.15Å; Y529-L550 HydrophobicContact CD2-CD1 3.72Å; Y529-L550 HydrophobicContact CE2-CD1 3.71Å; Y529-L550 HydrophobicContact CG-CD1 4.33Å; Y529-A578 HydrophobicContact CE1-CB 3.76Å; Y529-A578 WeakPolarHBondContact OH-CA 3.35Å; Y529-R581 WeakPolarHBondContact OH-CD 3.45Å
530	Q	79.1	Confident	71	Confident	85 Å²	85	72.8 Å²	72.8	40%	0.397	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-37	178.6	-73.1	175.5	0.4	0	0	112.6	S526 R527	S526-Q530 VanDerWaalsContact O-CG 3.29Å; S526-Q530 WeakPolarHBondContact O-CG 3.47Å; S526-Q530 PolarHBondContact O-N 2.88Å; R527-Q530 PolarHBondContact O-N 2.99Å
531	K	73.9	Confident	69.4	Low	46 Å²	46	75 Å²	75	20%	0.2	36%	0.357	C	S	.	.	H	α-helix	trans	-79.7	-30.8	-177.1	-172.8	173.6	-179.6	176.6	0	114.2	W485 Q489 R527 V528 Y529 D533 R535	W485-K531 HydrophobicContact CH2-CB 4Å; W485-K531 HydrophobicContact CH2-CD 3.39Å; W485-K531 HydrophobicContact CH2-CG 4.35Å; W485-K531 HydrophobicContact CZ2-CD 3.64Å; W485-K531 HydrophobicContact CZ3-CD 4.28Å; Q489-K531 VanDerWaalsContact CG-NZ 3.35Å; R527-K531 WeakPolarHBondContact O-CB 3.37Å; R527-K531 PolarHBondContact O-N 3.14Å; R527-K531 VanDerWaalsContact O-N 3.15Å; V528-K531 PolarHBondContact O-N 2.9Å; Y529-K531 VanDerWaalsContact C-N 3.28Å; Y529-K531 PolarHBondContact O-N 3.44Å; K531-D533 PolarHBondContact O-N 3.23Å; K531-R535 VanDerWaalsContact CE-NH2 3.26Å
532	E	68.7	Low	68.1	Low	71 Å²	71	81.4 Å²	81.4	33%	0.332	38%	0.381	S	S	.	.	H	α-helix	trans	-60	-32.1	174.7	-78.8	-168.6	167.7	0	0	111.7	V528 Y529 L546	V528-E532 PolarHBondContact O-N 2.86Å; V528-E532 VanDerWaalsContact O-N 3.13Å; Y529-E532 PolarHBondContact O-N 3.35Å; E532-L546 WeakPolarHBondContact OE2-CD2 3.19Å
533	D	54.9	Low	67.4	Low	60 Å²	60	81.4 Å²	81.4	32%	0.321	38%	0.381	S	S	.	.	H	α-helix	trans	-83.1	-35.7	-172.1	-152.3	24.5	0	0	0	114.2	K531 R535 A536 R581	K531-D533 PolarHBondContact O-N 3.23Å; D533-R535 PolarHBondContact O-N 2.81Å; D533-A536 WeakPolarHBondContact O-CB 3.22Å; D533-A536 PolarHBondContact O-N 3.44Å; D533-R581 WeakPolarHBondContact OD2-CD 3.37Å; D533-R581 IonicContact OD2-CZ 2.7Å; D533-R581 IonicContact OD2-NE 2.68Å; D533-R581 IonicContact OD2-NH1 3.73Å; D533-R581 PolarHBondContact OD2-NH1 3.2Å
534	L	56.8	Low	67.1	Low	157 Å²	157	87.5 Å²	87.5	82%	0.822	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.3	173.4	-75.2	165.5	0	0	0	113
535	R	53.7	Low	66.9	Low	125 Å²	125	88.4 Å²	88.4	47%	0.472	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	2.3	-178.6	-61.9	175.3	175.4	-171.8	-7.8	112.7	K531 D533 Q537 R538	K531-R535 VanDerWaalsContact CE-NH2 3.26Å; D533-R535 PolarHBondContact O-N 2.81Å; R535-Q537 PolarHBondContact O-N 2.81Å; R535-R538 PolarHBondContact O-N 3.31Å
536	A	46.1	Very low	66.8	Low	65 Å²	65	88.6 Å²	88.6	54%	0.537	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	20.4	-169.3	0	0	0	0	0	116.1	D533 R538	D533-A536 WeakPolarHBondContact O-CB 3.22Å; D533-A536 PolarHBondContact O-N 3.44Å; A536-R538 VanDerWaalsContact C-N 3.27Å
537	Q	46.8	Very low	66.7	Low	202 Å²	202	88 Å²	88	94%	0.944	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.9	157.3	-80.5	-178.8	-15	0	0	112.6	R535	R535-Q537 PolarHBondContact O-N 2.81Å
538	R	44.1	Very low	66.9	Low	194 Å²	194	92.2 Å²	92.2	73%	0.732	43%	0.426	S	S	*	.	S	Bend	trans	-120.2	114.6	167.3	-69.8	-176.4	-170.5	174.1	4.7	109.3	R535 A536 R540	R535-R538 PolarHBondContact O-N 3.31Å; A536-R538 VanDerWaalsContact C-N 3.27Å; R538-R540 VanDerWaalsContact C-N 3.29Å; R538-R540 PolarHBondContact O-N 3.47Å
539	I	44.8	Very low	67.2	Low	185 Å²	185	92.1 Å²	92.1	95%	0.949	43%	0.425	S	S	*	.			trans	-51.5	90	171.7	-58.3	160.8	0	0	0	108.5
540	R	43.9	Very low	67.6	Low	152 Å²	152	91.3 Å²	91.3	57%	0.574	42%	0.422	S	S	*	.			trans	-117.1	114.3	173.4	-148	-178.7	-79.3	-171.8	1.5	105.9	Q492 R538 R542	Q492-R540 PolarHBondContact O-NH1 3.01Å; R538-R540 VanDerWaalsContact C-N 3.29Å; R538-R540 PolarHBondContact O-N 3.47Å; R540-R542 PolarHBondContact O-N 2.76Å
541	S	53.2	Low	68.1	Low	68 Å²	68	88.5 Å²	88.5	48%	0.476	41%	0.413	S	S	.	.			trans	-43	119.4	-172.5	57.5	0	0	0	0	112.9	K494	K494-S541 VanDerWaalsContact CD-OG 3.3Å; K494-S541 WeakPolarHBondContact CD-OG 3.1Å; K494-S541 WeakPolarHBondContact CE-OG 3.11Å; K494-S541 PolarHBondContact NZ-OG 2.74Å
542	R	63.5	Low	69	Low	134 Å²	134	87.6 Å²	87.6	51%	0.506	42%	0.417	S	S	.	.			trans	-52.1	141.9	175.8	-66.5	178.6	175.7	174.1	-2.7	110.8	R540 K544	R540-R542 PolarHBondContact O-N 2.76Å; R542-K544 PolarHBondContact O-N 2.98Å
543	S	75.8	Confident	70.1	Confident	4 Å²	4	84.2 Å²	84.2	3%	0.028	40%	0.401	C	S	.	.			trans	-60.7	130.5	173.7	175.1	0	0	0	0	109.9	E498 V545 L546 S547	E498-S543 VanDerWaalsContact CD-OG 3.3Å; E498-S543 PolarHBondContact OE1-OG 3.47Å; E498-S543 WeakPolarHBondContact OE2-CA 3.32Å; E498-S543 VanDerWaalsContact OE2-CB 3.25Å; E498-S543 WeakPolarHBondContact OE2-CB 3.42Å; E498-S543 PolarHBondContact OE2-OG 3.07Å; S543-V545 VanDerWaalsContact C-N 3.28Å; S543-V545 PolarHBondContact O-N 3.22Å; S543-V545 PolarHBondContact OG-N 3.37Å; S543-L546 PolarHBondContact O-N 2.85Å; S543-L546 PolarHBondContact OG-N 3.25Å; S543-S547 PolarHBondContact O-N 3.42Å; S543-S547 PolarHBondContact O-OG 2.95Å
544	K	83.3	Confident	72	Confident	164 Å²	164	81.3 Å²	81.3	71%	0.713	39%	0.386	S	S	*	.	H	α-helix	trans	-68.6	-34.9	179.9	-70.4	-175.8	177.2	-177.3	0	110.7	E498 R542 R548	E498-K544 PolarHBondContact OE1-N 3.36Å; E498-K544 VanDerWaalsContact OE1-N 3.13Å; R542-K544 PolarHBondContact O-N 2.98Å; K544-R548 WeakPolarHBondContact O-CB 3.28Å; K544-R548 PolarHBondContact O-N 3.2Å; K544-R548 VanDerWaalsContact O-N 3.11Å
545	V	87	Confident	73.7	Confident	20 Å²	20	77 Å²	77	12%	0.121	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-44.4	177.7	180	0	0	0	0	110.9	E498 I501 K502 Y505 S543 R548 W549	E498-V545 PolarHBondContact OE1-N 3.07Å; I501-V545 HydrophobicContact CG2-CB 3.93Å; I501-V545 HydrophobicContact CG2-CG1 3.86Å; K502-V545 HydrophobicContact CB-CG2 4.12Å; K502-V545 HydrophobicContact CG-CG2 4.45Å; Y505-V545 VanDerWaalsContact CB-CG1 3.44Å; Y505-V545 HydrophobicContact CD1-CG1 3.82Å; Y505-V545 HydrophobicContact CD2-CG1 4.21Å; Y505-V545 HydrophobicContact CG-CG1 3.56Å; S543-V545 VanDerWaalsContact C-N 3.28Å; S543-V545 PolarHBondContact O-N 3.22Å; S543-V545 PolarHBondContact OG-N 3.37Å; V545-R548 PolarHBondContact O-N 3.48Å; V545-W549 WeakPolarHBondContact O-CB 3.31Å; V545-W549 PolarHBondContact O-N 3.46Å
546	L	86.6	Confident	75.4	Confident	3 Å²	3	73.4 Å²	73.4	2%	0.016	35%	0.35	C	S	.	.	H	α-helix	trans	-64.2	-43.3	-179.8	-172	68.7	0	0	0	111.8	F525 V528 Y529 E532 S543 W549 L550	F525-L546 HydrophobicContact CB-CD1 4.47Å; F525-L546 HydrophobicContact CD1-CD1 3.85Å; V528-L546 HydrophobicContact CG1-CD1 4.47Å; V528-L546 HydrophobicContact CG1-CD2 4.23Å; Y529-L546 HydrophobicContact CD2-CD2 4.15Å; E532-L546 WeakPolarHBondContact OE2-CD2 3.19Å; S543-L546 PolarHBondContact O-N 2.85Å; S543-L546 PolarHBondContact OG-N 3.25Å; L546-W549 HydrophobicContact CD1-CE3 3.83Å; L546-W549 HydrophobicContact CD1-CZ3 4.18Å; L546-W549 PolarHBondContact O-N 3.23Å; L546-L550 WeakPolarHBondContact O-CG 3.49Å; L546-L550 PolarHBondContact O-N 3.45Å
547	S	86.4	Confident	77.5	Confident	10 Å²	10	70.3 Å²	70.3	7%	0.07	32%	0.324	C	S	.	.	H	α-helix	trans	-63.8	-41.6	176.8	-49.2	0	0	0	0	112	S543 W549 L550 A551 E585	S543-S547 PolarHBondContact O-N 3.42Å; S543-S547 PolarHBondContact O-OG 2.95Å; S547-W549 PolarHBondContact O-N 3.28Å; S547-L550 PolarHBondContact O-N 3.03Å; S547-A551 WeakPolarHBondContact O-CB 3.45Å; S547-A551 PolarHBondContact O-N 3.36Å; S547-E585 WeakPolarHBondContact CB-OE1 3.49Å; S547-E585 WeakPolarHBondContact CB-OE2 3.33Å
548	R	88.8	Confident	79.5	Confident	169 Å²	169	61.9 Å²	61.9	64%	0.638	29%	0.289	S	S	*	.	H	α-helix	trans	-62.7	-39.7	174.4	-176.1	173.6	-177.3	156.9	1.2	112.8	K544 V545 A551 G552	K544-R548 WeakPolarHBondContact O-CB 3.28Å; K544-R548 PolarHBondContact O-N 3.2Å; K544-R548 VanDerWaalsContact O-N 3.11Å; V545-R548 PolarHBondContact O-N 3.48Å; R548-A551 PolarHBondContact O-N 3.22Å; R548-G552 PolarHBondContact O-N 2.89Å
549	W	91.8	Very high	81.6	Confident	2 Å²	2	58 Å²	58	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-48.3	175.1	169.4	78.4	0	0	0	111	Y505 Y508 L522 F525 V545 L546 S547 A551 G552 L553 I574	Y505-W549 HydrophobicContact CD2-CB 3.92Å; Y505-W549 HydrophobicContact CD2-CG 4.33Å; Y505-W549 HydrophobicContact CE2-CB 3.7Å; Y505-W549 AromaticContact CE2-CD1 3.96Å; Y505-W549 HydrophobicContact CE2-CG 4.25Å; Y508-W549 AromaticContact CD1-CD1 3.7Å; Y508-W549 AromaticContact CD1-NE1 3.92Å; Y508-W549 AromaticContact CE1-CD1 3.49Å; Y508-W549 VanDerWaalsContact CE1-CD1 3.49Å; Y508-W549 AromaticContact CE1-NE1 3.48Å; Y508-W549 AromaticContact CZ-NE1 3.64Å; L522-W549 HydrophobicContact CD2-CZ2 3.78Å; F525-W549 HydrophobicContact CB-CD2 3.91Å; F525-W549 HydrophobicContact CB-CE3 3.83Å; F525-W549 HydrophobicContact CB-CH2 3.33Å; F525-W549 HydrophobicContact CB-CZ2 3.41Å; F525-W549 VanDerWaalsContact CB-CZ2 3.41Å; F525-W549 HydrophobicContact CB-CZ3 3.55Å; F525-W549 HydrophobicContact CD1-CD2 4.32Å; F525-W549 HydrophobicContact CD1-CE3 4.44Å; F525-W549 HydrophobicContact CD2-CD2 4.25Å; F525-W549 AromaticContact CD2-CE2 3.85Å; F525-W549 HydrophobicContact CD2-CG 4.47Å; F525-W549 HydrophobicContact CD2-CZ2 4.23Å; F525-W549 AromaticContact CD2-NE1 3.79Å; F525-W549 AromaticContact CG-CD2 3.93Å; F525-W549 HydrophobicContact CG-CD2 3.93Å; F525-W549 AromaticContact CG-CE2 3.84Å; F525-W549 HydrophobicContact CG-CE3 4.21Å; F525-W549 HydrophobicContact CG-CG 4.41Å; F525-W549 HydrophobicContact CG-CH2 4.35Å; F525-W549 HydrophobicContact CG-CZ2 4.08Å; F525-W549 HydrophobicContact CG-CZ3 4.41Å; V545-W549 WeakPolarHBondContact O-CB 3.31Å; V545-W549 PolarHBondContact O-N 3.46Å; L546-W549 HydrophobicContact CD1-CE3 3.83Å; L546-W549 HydrophobicContact CD1-CZ3 4.18Å; L546-W549 PolarHBondContact O-N 3.23Å; S547-W549 PolarHBondContact O-N 3.28Å; W549-A551 VanDerWaalsContact C-N 3.35Å; W549-A551 PolarHBondContact O-N 3.49Å; W549-G552 PolarHBondContact O-N 3.43Å; W549-L553 HydrophobicContact CD2-CD2 4.41Å; W549-L553 HydrophobicContact CH2-CD1 4.04Å; W549-L553 HydrophobicContact CZ2-CD1 4.11Å; W549-L553 HydrophobicContact CZ2-CD2 3.98Å; W549-L553 HydrophobicContact CZ3-CD1 4.29Å; W549-L553 WeakPolarHBondContact O-CG 3.37Å; W549-I574 HydrophobicContact CH2-CD1 4.21Å; W549-I574 HydrophobicContact CH2-CG2 3.67Å; W549-I574 HydrophobicContact CZ2-CD1 4.39Å; W549-I574 HydrophobicContact CZ3-CG2 4.19Å
550	L	90.3	Very high	83.5	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-58	-45.4	175.9	-74.9	172.9	0	0	0	111.8	Y529 L546 S547 G552 L553 I574 A578 N583 L586	Y529-L550 HydrophobicContact CD2-CD1 3.72Å; Y529-L550 HydrophobicContact CE2-CD1 3.71Å; Y529-L550 HydrophobicContact CG-CD1 4.33Å; L546-L550 WeakPolarHBondContact O-CG 3.49Å; L546-L550 PolarHBondContact O-N 3.45Å; S547-L550 PolarHBondContact O-N 3.03Å; L550-G552 PolarHBondContact O-N 3.34Å; L550-L553 HydrophobicContact CD2-CD1 3.94Å; L550-L553 PolarHBondContact O-N 3.46Å; L550-L553 VanDerWaalsContact O-N 3.12Å; L550-I574 HydrophobicContact CD2-CG2 4.14Å; L550-A578 HydrophobicContact CD2-CB 4.2Å; L550-N583 WeakPolarHBondContact CD1-ND2 3.36Å; L550-L586 HydrophobicContact CB-CB 4.41Å; L550-L586 HydrophobicContact CB-CD1 4.02Å; L550-L586 HydrophobicContact CD2-CD1 4.08Å
551	A	90.5	Very high	85	Confident	26 Å²	26	44.4 Å²	44.4	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-22.9	177	0	0	0	0	0	113	S547 R548 W549 E585 S589	S547-A551 WeakPolarHBondContact O-CB 3.45Å; S547-A551 PolarHBondContact O-N 3.36Å; R548-A551 PolarHBondContact O-N 3.22Å; W549-A551 VanDerWaalsContact C-N 3.35Å; W549-A551 PolarHBondContact O-N 3.49Å; A551-E585 HydrophobicContact CB-CB 4.33Å; A551-S589 WeakPolarHBondContact O-CB 3.27Å; A551-S589 PolarHBondContact O-OG 2.96Å
552	G	91.5	Very high	86.2	Confident	27 Å²	27	45.4 Å²	45.4	28%	0.278	22%	0.224	S	C	.	.	H	α-helix	trans	-80.8	-17.2	176.3	0	0	0	0	0	115	R548 W549 L550 Q556	R548-G552 PolarHBondContact O-N 2.89Å; W549-G552 PolarHBondContact O-N 3.43Å; L550-G552 PolarHBondContact O-N 3.34Å; G552-Q556 WeakPolarHBondContact O-CG 3.42Å; G552-Q556 PolarHBondContact O-N 2.92Å; G552-Q556 VanDerWaalsContact O-N 3.16Å
553	L	92.9	Very high	87.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-68	-43.8	-171	-54.7	178.8	0	0	0	114	W549 L550 Q555 Q556 L557 L571 I574 I575	W549-L553 HydrophobicContact CD2-CD2 4.41Å; W549-L553 HydrophobicContact CH2-CD1 4.04Å; W549-L553 HydrophobicContact CZ2-CD1 4.11Å; W549-L553 HydrophobicContact CZ2-CD2 3.98Å; W549-L553 HydrophobicContact CZ3-CD1 4.29Å; W549-L553 WeakPolarHBondContact O-CG 3.37Å; L550-L553 HydrophobicContact CD2-CD1 3.94Å; L550-L553 PolarHBondContact O-N 3.46Å; L550-L553 VanDerWaalsContact O-N 3.12Å; L553-Q555 VanDerWaalsContact C-N 3.32Å; L553-Q555 PolarHBondContact O-N 2.98Å; L553-Q556 WeakPolarHBondContact O-CB 3.25Å; L553-Q556 PolarHBondContact O-N 3.21Å; L553-Q556 VanDerWaalsContact O-N 3.12Å; L553-L557 PolarHBondContact O-N 3Å; L553-L571 HydrophobicContact CD2-CD2 3.82Å; L553-I574 HydrophobicContact CD1-CB 4.28Å; L553-I574 HydrophobicContact CD1-CG2 3.51Å; L553-I575 HydrophobicContact CB-CD1 3.97Å; L553-I575 HydrophobicContact CB-CG1 3.82Å; L553-I575 HydrophobicContact CD1-CG1 4.36Å
554	P	93.9	Very high	87.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-41.7	179	-26.2	36.6	0	0	0	112.9	Q556 L557 A558 I575 L590	P554-Q556 PolarHBondContact O-N 2.83Å; P554-L557 PolarHBondContact O-N 3.38Å; P554-A558 PolarHBondContact O-N 3.48Å; P554-I575 HydrophobicContact CG-CD1 4.48Å; P554-L590 HydrophobicContact CB-CB 4.46Å; P554-L590 HydrophobicContact CB-CD1 4.09Å; P554-L590 HydrophobicContact CG-CB 4.13Å; P554-L590 HydrophobicContact CG-CD1 4.26Å
555	Q	91.9	Very high	87.4	Confident	65 Å²	65	46.1 Å²	46.1	30%	0.304	23%	0.231	S	C	.	.	H	α-helix	trans	-66.6	-36.1	176.1	-177.8	61.7	41	0	0	112.1	L553 L559	L553-Q555 VanDerWaalsContact C-N 3.32Å; L553-Q555 PolarHBondContact O-N 2.98Å; Q555-L559 HydrophobicContact CG-CD1 4.37Å; Q555-L559 VanDerWaalsContact O-CG 3.3Å; Q555-L559 WeakPolarHBondContact O-CG 3.36Å; Q555-L559 PolarHBondContact O-N 2.87Å
556	Q	90.1	Very high	87.3	Confident	50 Å²	50	51 Å²	51	23%	0.234	25%	0.253	C	S	.	.	H	α-helix	trans	-66.5	-41.3	174	-74.6	178.8	-12.6	0	0	111.9	Y508 G552 L553 P554 L559 L560 L571	Y508-Q556 PolarHBondContact OH-OE1 3.4Å; G552-Q556 WeakPolarHBondContact O-CG 3.42Å; G552-Q556 PolarHBondContact O-N 2.92Å; G552-Q556 VanDerWaalsContact O-N 3.16Å; L553-Q556 WeakPolarHBondContact O-CB 3.25Å; L553-Q556 PolarHBondContact O-N 3.21Å; L553-Q556 VanDerWaalsContact O-N 3.12Å; P554-Q556 PolarHBondContact O-N 2.83Å; Q556-L559 PolarHBondContact O-N 3.19Å; Q556-L560 WeakPolarHBondContact O-CB 3.27Å; Q556-L560 WeakPolarHBondContact O-CD1 3.3Å; Q556-L560 VanDerWaalsContact O-CG 3.32Å; Q556-L560 WeakPolarHBondContact O-CG 3.3Å; Q556-L560 PolarHBondContact O-N 3.12Å; Q556-L571 HydrophobicContact CB-CD1 4.34Å
557	L	90.9	Very high	87.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.4	-47.8	176.9	178.2	63.7	0	0	0	111.3	L553 P554 L559 L560 G561 L571 I572 I575 T604 L616	L553-L557 PolarHBondContact O-N 3Å; P554-L557 PolarHBondContact O-N 3.38Å; L557-L559 VanDerWaalsContact C-N 3.28Å; L557-L559 PolarHBondContact O-N 3.33Å; L557-L560 PolarHBondContact O-N 3.44Å; L557-G561 PolarHBondContact O-N 3.02Å; L557-L571 HydrophobicContact CD1-CB 4.45Å; L557-I572 HydrophobicContact CD1-CD1 4.19Å; L557-I572 HydrophobicContact CD1-CG1 3.88Å; L557-I572 HydrophobicContact CD2-CG1 3.76Å; L557-I572 HydrophobicContact CG-CG1 4.5Å; L557-I575 HydrophobicContact CB-CD1 4.3Å; L557-I575 HydrophobicContact CD2-CD1 3.88Å; L557-T604 HydrophobicContact CD1-CG2 3.99Å; L557-T604 HydrophobicContact CG-CG2 4.06Å; L557-L616 HydrophobicContact CD2-CD2 4.08Å
558	A	88.8	Confident	87.4	Confident	25 Å²	25	50.9 Å²	50.9	21%	0.207	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-33.6	177.9	0	0	0	0	0	113.4	P554 T593 R596 I597	P554-A558 PolarHBondContact O-N 3.48Å; A558-T593 HydrophobicContact CB-CG2 3.54Å; A558-R596 HydrophobicContact CB-CB 4.34Å; A558-I597 HydrophobicContact CB-CG1 4.09Å
559	L	87.3	Confident	87.4	Confident	114 Å²	114	45.1 Å²	45.1	60%	0.597	23%	0.233	S	C	*	.	H	α-helix	trans	-81.1	-27.4	177.9	-69.4	172.6	0	0	0	113.6	Q555 Q556 L557	Q555-L559 HydrophobicContact CG-CD1 4.37Å; Q555-L559 VanDerWaalsContact O-CG 3.3Å; Q555-L559 WeakPolarHBondContact O-CG 3.36Å; Q555-L559 PolarHBondContact O-N 2.87Å; Q556-L559 PolarHBondContact O-N 3.19Å; L557-L559 VanDerWaalsContact C-N 3.28Å; L557-L559 PolarHBondContact O-N 3.33Å
560	L	84.4	Confident	87.2	Confident	44 Å²	44	47.2 Å²	47.2	23%	0.23	24%	0.243	C	C	.	.	H	α-helix	trans	-80.3	-48.8	-178.5	-80.5	163.4	0	0	0	111.7	Q556 L557 L562 R563 L571	Q556-L560 WeakPolarHBondContact O-CB 3.27Å; Q556-L560 WeakPolarHBondContact O-CD1 3.3Å; Q556-L560 VanDerWaalsContact O-CG 3.32Å; Q556-L560 WeakPolarHBondContact O-CG 3.3Å; Q556-L560 PolarHBondContact O-N 3.12Å; L557-L560 PolarHBondContact O-N 3.44Å; L560-L562 PolarHBondContact O-N 2.94Å; L560-R563 VanDerWaalsContact O-CB 3.23Å; L560-R563 WeakPolarHBondContact O-CB 3.36Å; L560-R563 WeakPolarHBondContact O-CG 3.33Å; L560-R563 PolarHBondContact O-N 3.49Å; L560-L571 HydrophobicContact CD1-CD1 3.52Å
561	G	76.9	Confident	87.2	Confident	6 Å²	6	47.2 Å²	47.2	6%	0.062	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	46.6	-126.4	-178.7	0	0	0	0	0	112.7	L557 S568 L608	L557-G561 PolarHBondContact O-N 3.02Å; G561-S568 PolarHBondContact O-OG 3.39Å; G561-L608 WeakPolarHBondContact O-CD2 3.35Å
562	L	77.4	Confident	87.2	Confident	90 Å²	90	46 Å²	46	47%	0.471	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-77.6	-9.1	177.1	-90.3	171.4	0	0	0	115.6	L560 N564 L607 L608	L560-L562 PolarHBondContact O-N 2.94Å; L562-N564 PolarHBondContact O-N 3.31Å; L562-N564 VanDerWaalsContact O-N 3.14Å; L562-L607 HydrophobicContact CD1-CB 3.7Å; L562-L607 HydrophobicContact CD1-CD2 4.02Å; L562-L607 HydrophobicContact CD1-CG 4.36Å; L562-L607 VanDerWaalsContact CD1-O 3.24Å; L562-L607 WeakPolarHBondContact CD1-O 3.31Å; L562-L607 WeakPolarHBondContact CD2-O 3.34Å; L562-L607 HydrophobicContact CG-CB 3.78Å; L562-L607 WeakPolarHBondContact CG-O 3.43Å; L562-L608 HydrophobicContact CD2-CD2 4.45Å
563	R	82.4	Confident	87.1	Confident	223 Å²	223	48 Å²	48	84%	0.842	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-61.6	-27.7	-176.2	-63.1	179.3	176	-174.6	-0.2	112.1	L560	L560-R563 VanDerWaalsContact O-CB 3.23Å; L560-R563 WeakPolarHBondContact O-CB 3.36Å; L560-R563 WeakPolarHBondContact O-CG 3.33Å; L560-R563 PolarHBondContact O-N 3.49Å
564	N	82.3	Confident	86.9	Confident	43 Å²	43	48.6 Å²	48.6	23%	0.23	24%	0.24	C	C	.	.			trans	-152.2	90.8	172.3	-163.1	-48.6	0	0	0	110.7	F515 L562 E566 L567 S568	F515-N564 WeakPolarHBondContact CD2-ND2 3.37Å; F515-N564 WeakPolarHBondContact CE2-ND2 3.34Å; F515-N564 WeakPolarHBondContact CE2-OD1 3.33Å; L562-N564 PolarHBondContact O-N 3.31Å; L562-N564 VanDerWaalsContact O-N 3.14Å; N564-E566 VanDerWaalsContact C-N 3.28Å; N564-E566 PolarHBondContact O-N 3.05Å; N564-L567 HydrophobicContact CB-CB 4.28Å; N564-L567 HydrophobicContact CB-CD1 4.23Å; N564-L567 HydrophobicContact CB-CG 4.47Å; N564-L567 PolarHBondContact O-N 3.46Å; N564-L567 PolarHBondContact OD1-N 2.95Å; N564-S568 PolarHBondContact O-N 2.83Å; N564-S568 PolarHBondContact O-OG 3.19Å
565	P	83.4	Confident	86.8	Confident	51 Å²	51	48.6 Å²	48.6	33%	0.331	24%	0.24	S	C	.	.	H	α-helix	trans	-65.2	-31.6	-173.2	26.3	-34.1	0	0	0	112.6	S568 N569 L608	P565-S568 PolarHBondContact O-N 3.34Å; P565-N569 PolarHBondContact O-N 3.45Å; P565-N569 PolarHBondContact O-ND2 3.11Å; P565-L608 HydrophobicContact CB-CD2 4.45Å
566	E	84.9	Confident	86.7	Confident	122 Å²	122	47.7 Å²	47.7	57%	0.57	24%	0.236	S	C	*	.	H	α-helix	trans	-64.7	-45.6	177.4	-65.3	-178.4	-176.5	0	0	112	F515 N564 N569 Q570	F515-E566 HydrophobicContact CE2-CB 4.38Å; F515-E566 HydrophobicContact CZ-CB 4.05Å; F515-E566 VanDerWaalsContact CZ-OE2 3.23Å; F515-E566 WeakPolarHBondContact CZ-OE2 3.32Å; N564-E566 VanDerWaalsContact C-N 3.28Å; N564-E566 PolarHBondContact O-N 3.05Å; E566-N569 PolarHBondContact O-N 3.39Å; E566-Q570 WeakPolarHBondContact O-CG 3.29Å; E566-Q570 PolarHBondContact O-N 3.01Å; E566-Q570 VanDerWaalsContact O-N 3.16Å
567	L	85.8	Confident	86.5	Confident	11 Å²	11	46.7 Å²	46.7	6%	0.058	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-40.4	174.4	-72	174.7	0	0	0	111.7	F515 L522 N564 N569 Q570 L571	F515-L567 HydrophobicContact CD2-CD1 3.78Å; F515-L567 HydrophobicContact CD2-CD2 4.14Å; F515-L567 HydrophobicContact CD2-CG 3.85Å; F515-L567 HydrophobicContact CE2-CD1 3.91Å; F515-L567 HydrophobicContact CE2-CD2 3.79Å; F515-L567 HydrophobicContact CE2-CG 3.45Å; F515-L567 VanDerWaalsContact CE2-CG 3.45Å; F515-L567 HydrophobicContact CZ-CD2 4.33Å; F515-L567 HydrophobicContact CZ-CG 4.34Å; L522-L567 HydrophobicContact CD1-CD2 4.14Å; N564-L567 HydrophobicContact CB-CB 4.28Å; N564-L567 HydrophobicContact CB-CD1 4.23Å; N564-L567 HydrophobicContact CB-CG 4.47Å; N564-L567 PolarHBondContact O-N 3.46Å; N564-L567 PolarHBondContact OD1-N 2.95Å; L567-N569 VanDerWaalsContact C-N 3.29Å; L567-N569 PolarHBondContact O-N 3.38Å; L567-Q570 PolarHBondContact O-N 3.46Å; L567-L571 VanDerWaalsContact O-CG 3.32Å; L567-L571 WeakPolarHBondContact O-CG 3.18Å; L567-L571 PolarHBondContact O-N 3.01Å
568	S	89.3	Confident	86.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.5	-42.8	177.5	-65.1	0	0	0	0	111.1	G561 N564 P565 L571 I572	G561-S568 PolarHBondContact O-OG 3.39Å; N564-S568 PolarHBondContact O-N 2.83Å; N564-S568 PolarHBondContact O-OG 3.19Å; P565-S568 PolarHBondContact O-N 3.34Å; S568-L571 PolarHBondContact O-N 3.42Å; S568-I572 WeakPolarHBondContact O-CD1 3.39Å; S568-I572 WeakPolarHBondContact O-CG1 3.2Å; S568-I572 PolarHBondContact O-N 3.11Å
569	N	88.5	Confident	86.1	Confident	47 Å²	47	45.5 Å²	45.5	25%	0.251	23%	0.225	S	C	.	.	H	α-helix	trans	-62	-46.1	174.5	-78.7	-26.7	0	0	0	112.9	P565 E566 L567 L571 I572 D573 A612	P565-N569 PolarHBondContact O-N 3.45Å; P565-N569 PolarHBondContact O-ND2 3.11Å; E566-N569 PolarHBondContact O-N 3.39Å; L567-N569 VanDerWaalsContact C-N 3.29Å; L567-N569 PolarHBondContact O-N 3.38Å; N569-L571 VanDerWaalsContact C-N 3.29Å; N569-L571 PolarHBondContact O-N 3.49Å; N569-I572 PolarHBondContact O-N 3.2Å; N569-D573 PolarHBondContact O-N 3.48Å; N569-A612 WeakPolarHBondContact OD1-CB 3.45Å
570	Q	87.5	Confident	85.9	Confident	46 Å²	46	43 Å²	43	22%	0.215	22%	0.216	C	C	.	.	H	α-helix	trans	-61.1	-38.8	176.7	-70.2	177.7	16.3	0	0	112.2	E566 L567 D573 I574	E566-Q570 WeakPolarHBondContact O-CG 3.29Å; E566-Q570 PolarHBondContact O-N 3.01Å; E566-Q570 VanDerWaalsContact O-N 3.16Å; L567-Q570 PolarHBondContact O-N 3.46Å; Q570-D573 PolarHBondContact O-N 3.06Å; Q570-I574 WeakPolarHBondContact O-CG1 3.5Å; Q570-I574 PolarHBondContact O-N 3.1Å
571	L	91	Very high	85.8	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-66	-43.9	175.8	-70.6	177.8	0	0	0	111.5	L522 L553 Q556 L557 L560 L567 S568 N569 D573 I574 I575	L522-L571 HydrophobicContact CD1-CD2 4.19Å; L522-L571 HydrophobicContact CD2-CD2 3.92Å; L553-L571 HydrophobicContact CD2-CD2 3.82Å; Q556-L571 HydrophobicContact CB-CD1 4.34Å; L557-L571 HydrophobicContact CD1-CB 4.45Å; L560-L571 HydrophobicContact CD1-CD1 3.52Å; L567-L571 VanDerWaalsContact O-CG 3.32Å; L567-L571 WeakPolarHBondContact O-CG 3.18Å; L567-L571 PolarHBondContact O-N 3.01Å; S568-L571 PolarHBondContact O-N 3.42Å; N569-L571 VanDerWaalsContact C-N 3.29Å; N569-L571 PolarHBondContact O-N 3.49Å; L571-D573 VanDerWaalsContact C-N 3.25Å; L571-D573 PolarHBondContact O-N 3.19Å; L571-I574 PolarHBondContact O-N 3.02Å; L571-I575 WeakPolarHBondContact O-CB 3.41Å; L571-I575 WeakPolarHBondContact O-CD1 3.33Å; L571-I575 WeakPolarHBondContact O-CG1 3.47Å; L571-I575 PolarHBondContact O-N 3.39Å
572	I	91.1	Very high	86	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.7	-40.9	176.6	-70.2	163.2	0	0	0	110.5	L557 S568 N569 I575 H576 L608 A612 R615 L616	L557-I572 HydrophobicContact CD1-CD1 4.19Å; L557-I572 HydrophobicContact CD1-CG1 3.88Å; L557-I572 HydrophobicContact CD2-CG1 3.76Å; L557-I572 HydrophobicContact CG-CG1 4.5Å; S568-I572 WeakPolarHBondContact O-CD1 3.39Å; S568-I572 WeakPolarHBondContact O-CG1 3.2Å; S568-I572 PolarHBondContact O-N 3.11Å; N569-I572 PolarHBondContact O-N 3.2Å; I572-I575 PolarHBondContact O-N 3.33Å; I572-H576 VanDerWaalsContact O-CB 3.22Å; I572-H576 WeakPolarHBondContact O-CB 3.5Å; I572-H576 PolarHBondContact O-N 2.94Å; I572-L608 HydrophobicContact CD1-CD1 3.67Å; I572-A612 HydrophobicContact CD1-CB 4.02Å; I572-R615 HydrophobicContact CG2-CB 3.45Å; I572-R615 VanDerWaalsContact CG2-CB 3.45Å; I572-R615 HydrophobicContact CG2-CG 4.38Å; I572-L616 HydrophobicContact CD1-CD1 4.23Å; I572-L616 HydrophobicContact CD1-CD2 3.99Å; I572-L616 HydrophobicContact CD1-CG 3.97Å; I572-L616 HydrophobicContact CG1-CD2 3.96Å; I572-L616 HydrophobicContact CG1-CG 4.43Å
573	D	89	Confident	86.3	Confident	68 Å²	68	43.6 Å²	43.6	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-65.1	-42.5	179.2	-72.3	-15.8	0	0	0	113.5	N569 Q570 L571 S577 R615	N569-D573 PolarHBondContact O-N 3.48Å; Q570-D573 PolarHBondContact O-N 3.06Å; L571-D573 VanDerWaalsContact C-N 3.25Å; L571-D573 PolarHBondContact O-N 3.19Å; D573-S577 WeakPolarHBondContact O-CB 3.36Å; D573-S577 PolarHBondContact O-N 2.87Å; D573-R615 WeakPolarHBondContact OD1-CD 3.25Å; D573-R615 IonicContact OD1-CZ 2.74Å; D573-R615 VanDerWaalsContact OD1-CZ 3.29Å; D573-R615 IonicContact OD1-NE 3.84Å; D573-R615 IonicContact OD1-NH1 2.81Å; D573-R615 PolarHBondContact OD1-NH1 3.31Å; D573-R615 IonicContact OD2-NH1 3.02Å; D573-R615 PolarHBondContact OD2-NH1 2.64Å
574	I	89.1	Confident	86.5	Confident	13 Å²	13	40.6 Å²	40.6	7%	0.067	21%	0.212	C	C	.	.	H	α-helix	trans	-66.6	-44.9	176.5	-63.6	166.9	0	0	0	109.9	L522 W549 L550 L553 Q570 L571 S577 A578	L522-I574 HydrophobicContact CB-CD1 4.26Å; L522-I574 HydrophobicContact CD2-CD1 4.38Å; W549-I574 HydrophobicContact CH2-CD1 4.21Å; W549-I574 HydrophobicContact CH2-CG2 3.67Å; W549-I574 HydrophobicContact CZ2-CD1 4.39Å; W549-I574 HydrophobicContact CZ3-CG2 4.19Å; L550-I574 HydrophobicContact CD2-CG2 4.14Å; L553-I574 HydrophobicContact CD1-CB 4.28Å; L553-I574 HydrophobicContact CD1-CG2 3.51Å; Q570-I574 WeakPolarHBondContact O-CG1 3.5Å; Q570-I574 PolarHBondContact O-N 3.1Å; L571-I574 PolarHBondContact O-N 3.02Å; I574-S577 PolarHBondContact O-N 3.34Å; I574-A578 WeakPolarHBondContact O-CB 3.45Å; I574-A578 PolarHBondContact O-N 3.35Å
575	I	91.1	Very high	86.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-45.7	178.4	-67.9	164.5	0	0	0	110.1	L553 P554 L557 L571 I572 A578 A579 L586 L590 L619	L553-I575 HydrophobicContact CB-CD1 3.97Å; L553-I575 HydrophobicContact CB-CG1 3.82Å; L553-I575 HydrophobicContact CD1-CG1 4.36Å; P554-I575 HydrophobicContact CG-CD1 4.48Å; L557-I575 HydrophobicContact CB-CD1 4.3Å; L557-I575 HydrophobicContact CD2-CD1 3.88Å; L571-I575 WeakPolarHBondContact O-CB 3.41Å; L571-I575 WeakPolarHBondContact O-CD1 3.33Å; L571-I575 WeakPolarHBondContact O-CG1 3.47Å; L571-I575 PolarHBondContact O-N 3.39Å; I572-I575 PolarHBondContact O-N 3.33Å; I575-A578 PolarHBondContact O-N 3.43Å; I575-A579 WeakPolarHBondContact O-CB 3.42Å; I575-A579 PolarHBondContact O-N 3.45Å; I575-L586 HydrophobicContact CG1-CD1 4.46Å; I575-L586 HydrophobicContact CG2-CD2 4.33Å; I575-L590 HydrophobicContact CG2-CD1 4.35Å; I575-L619 HydrophobicContact CG2-CD1 3.86Å; I575-L619 HydrophobicContact CG2-CD2 4.02Å
576	H	89.2	Confident	87.1	Confident	47 Å²	47	40.3 Å²	40.3	22%	0.218	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-46.5	178.9	-168.9	-74.9	0	0	0	111.6	I572 A578 A579 S580 L619 F622	I572-H576 VanDerWaalsContact O-CB 3.22Å; I572-H576 WeakPolarHBondContact O-CB 3.5Å; I572-H576 PolarHBondContact O-N 2.94Å; H576-A578 PolarHBondContact O-N 2.92Å; H576-A579 PolarHBondContact O-N 2.97Å; H576-S580 WeakPolarHBondContact O-CB 3.04Å; H576-S580 PolarHBondContact O-N 2.91Å; H576-S580 PolarHBondContact O-OG 3.1Å; H576-L619 HydrophobicContact CB-CD2 3.95Å; H576-F622 AromaticContact NE2-CE2 3.81Å
577	S	86.4	Confident	87.4	Confident	29 Å²	29	35.6 Å²	35.6	20%	0.203	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-31.8	175.3	179.6	0	0	0	0	112.8	D573 I574 S580 R581	D573-S577 WeakPolarHBondContact O-CB 3.36Å; D573-S577 PolarHBondContact O-N 2.87Å; I574-S577 PolarHBondContact O-N 3.34Å; S577-S580 PolarHBondContact O-OG 3.39Å; S577-S580 VanDerWaalsContact O-OG 3.11Å; S577-R581 WeakPolarHBondContact O-CD 3.49Å; S577-R581 VanDerWaalsContact O-CG 3.27Å; S577-R581 WeakPolarHBondContact O-CG 3.4Å; S577-R581 PolarHBondContact O-NE 2.96Å
578	A	85.8	Confident	87.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-82.1	-34.7	178.7	0	0	0	0	0	112.7	Y529 L550 I574 I575 H576 R581 N583 L586	Y529-A578 HydrophobicContact CE1-CB 3.76Å; Y529-A578 WeakPolarHBondContact OH-CA 3.35Å; L550-A578 HydrophobicContact CD2-CB 4.2Å; I574-A578 WeakPolarHBondContact O-CB 3.45Å; I574-A578 PolarHBondContact O-N 3.35Å; I575-A578 PolarHBondContact O-N 3.43Å; H576-A578 PolarHBondContact O-N 2.92Å; A578-R581 PolarHBondContact O-N 3.15Å; A578-N583 PolarHBondContact O-N 3.14Å; A578-L586 HydrophobicContact CB-CD1 3.66Å; A578-L586 HydrophobicContact CB-CD2 4.02Å; A578-L586 HydrophobicContact CB-CG 4.37Å
579	A	85.9	Confident	87.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-42.3	175.4	0	0	0	0	0	111	I575 H576 R581 S582 L586 L587 L619 F622	I575-A579 WeakPolarHBondContact O-CB 3.42Å; I575-A579 PolarHBondContact O-N 3.45Å; H576-A579 PolarHBondContact O-N 2.97Å; A579-R581 PolarHBondContact O-N 2.91Å; A579-R581 VanDerWaalsContact O-N 3.08Å; A579-S582 PolarHBondContact O-N 2.93Å; A579-L586 HydrophobicContact CB-CD2 4.14Å; A579-L587 HydrophobicContact CB-CD2 4.03Å; A579-L619 HydrophobicContact CB-CD2 3.98Å; A579-F622 HydrophobicContact CB-CB 3.77Å; A579-F622 HydrophobicContact CB-CD2 3.8Å; A579-F622 HydrophobicContact CB-CG 3.81Å
580	S	83.4	Confident	88	Confident	60 Å²	60	40.3 Å²	40.3	42%	0.42	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.8	175.5	75.6	0	0	0	0	114	H576 S577	H576-S580 WeakPolarHBondContact O-CB 3.04Å; H576-S580 PolarHBondContact O-N 2.91Å; H576-S580 PolarHBondContact O-OG 3.1Å; S577-S580 PolarHBondContact O-OG 3.39Å; S577-S580 VanDerWaalsContact O-OG 3.11Å
581	R	80.6	Confident	88.2	Confident	75 Å²	75	40 Å²	40	28%	0.283	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	11.2	177	-63.8	167.3	-175.8	-144.5	9.7	112.7	Y529 D533 S577 A578 A579 N583	Y529-R581 WeakPolarHBondContact OH-CD 3.45Å; D533-R581 WeakPolarHBondContact OD2-CD 3.37Å; D533-R581 IonicContact OD2-CZ 2.7Å; D533-R581 IonicContact OD2-NE 2.68Å; D533-R581 IonicContact OD2-NH1 3.73Å; D533-R581 PolarHBondContact OD2-NH1 3.2Å; S577-R581 WeakPolarHBondContact O-CD 3.49Å; S577-R581 VanDerWaalsContact O-CG 3.27Å; S577-R581 WeakPolarHBondContact O-CG 3.4Å; S577-R581 PolarHBondContact O-NE 2.96Å; A578-R581 PolarHBondContact O-N 3.15Å; A579-R581 PolarHBondContact O-N 2.91Å; A579-R581 VanDerWaalsContact O-N 3.08Å; R581-N583 VanDerWaalsContact C-N 3.33Å; R581-N583 PolarHBondContact O-N 3.29Å
582	S	81.9	Confident	88.3	Confident	74 Å²	74	44 Å²	44	52%	0.517	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	40.9	176.7	-56.1	0	0	0	0	114.1	A579 K584	A579-S582 PolarHBondContact O-N 2.93Å; S582-K584 PolarHBondContact O-N 3.18Å; S582-K584 VanDerWaalsContact O-N 3.17Å
583	N	84	Confident	88.3	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	24%	0.239	C	C	.	.			trans	-68.7	111.3	175.8	-173.9	-51.2	0	0	0	111.4	L550 A578 R581 E585 L586 L587	L550-N583 WeakPolarHBondContact CD1-ND2 3.36Å; A578-N583 PolarHBondContact O-N 3.14Å; R581-N583 VanDerWaalsContact C-N 3.33Å; R581-N583 PolarHBondContact O-N 3.29Å; N583-E585 PolarHBondContact O-N 3.13Å; N583-E585 PolarHBondContact OD1-N 3.31Å; N583-L586 HydrophobicContact CB-CB 4.17Å; N583-L586 PolarHBondContact O-N 3.21Å; N583-L586 PolarHBondContact OD1-N 3.5Å; N583-L587 WeakPolarHBondContact O-CB 3.2Å; N583-L587 VanDerWaalsContact O-CG 3.26Å; N583-L587 WeakPolarHBondContact O-CG 3.4Å; N583-L587 PolarHBondContact O-N 3.15Å
584	K	86	Confident	88.5	Confident	161 Å²	161	41 Å²	41	70%	0.7	22%	0.223	S	C	*	.	H	α-helix	trans	-56.5	-47.6	-174.6	-63.1	-173.1	178.2	-173.8	0	114.6	S582 L587 Q588	S582-K584 PolarHBondContact O-N 3.18Å; S582-K584 VanDerWaalsContact O-N 3.17Å; K584-L587 PolarHBondContact O-N 3.32Å; K584-Q588 VanDerWaalsContact O-CG 3.31Å; K584-Q588 WeakPolarHBondContact O-CG 3.3Å; K584-Q588 PolarHBondContact O-N 3.23Å
585	E	87.9	Confident	88.5	Confident	88 Å²	88	43 Å²	43	41%	0.411	24%	0.241	S	C	.	.	H	α-helix	trans	-68.7	-39.5	-175.9	-67.7	-179.6	-147.1	0	0	111.7	S547 A551 N583 S589	S547-E585 WeakPolarHBondContact CB-OE1 3.49Å; S547-E585 WeakPolarHBondContact CB-OE2 3.33Å; A551-E585 HydrophobicContact CB-CB 4.33Å; N583-E585 PolarHBondContact O-N 3.13Å; N583-E585 PolarHBondContact OD1-N 3.31Å; E585-S589 PolarHBondContact O-N 2.71Å; E585-S589 VanDerWaalsContact O-N 3.12Å
586	L	91.5	Very high	88.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-44.1	175.1	178.9	132.4	0	0	0	111.5	L550 I575 A578 A579 N583 Q588 S589 L590	L550-L586 HydrophobicContact CB-CB 4.41Å; L550-L586 HydrophobicContact CB-CD1 4.02Å; L550-L586 HydrophobicContact CD2-CD1 4.08Å; I575-L586 HydrophobicContact CG1-CD1 4.46Å; I575-L586 HydrophobicContact CG2-CD2 4.33Å; A578-L586 HydrophobicContact CB-CD1 3.66Å; A578-L586 HydrophobicContact CB-CD2 4.02Å; A578-L586 HydrophobicContact CB-CG 4.37Å; A579-L586 HydrophobicContact CB-CD2 4.14Å; N583-L586 HydrophobicContact CB-CB 4.17Å; N583-L586 PolarHBondContact O-N 3.21Å; N583-L586 PolarHBondContact OD1-N 3.5Å; L586-Q588 PolarHBondContact O-N 2.97Å; L586-S589 PolarHBondContact O-N 2.95Å; L586-L590 WeakPolarHBondContact O-CB 3.17Å; L586-L590 PolarHBondContact O-N 3.46Å
587	L	90.1	Very high	88.7	Confident	23 Å²	23	48.2 Å²	48.2	12%	0.12	26%	0.259	C	S	.	.	H	α-helix	trans	-64.5	-38.3	178.9	-70.2	-179.7	0	0	0	112.5	A579 N583 K584 L590 Q591 F622 P624	A579-L587 HydrophobicContact CB-CD2 4.03Å; N583-L587 WeakPolarHBondContact O-CB 3.2Å; N583-L587 VanDerWaalsContact O-CG 3.26Å; N583-L587 WeakPolarHBondContact O-CG 3.4Å; N583-L587 PolarHBondContact O-N 3.15Å; K584-L587 PolarHBondContact O-N 3.32Å; L587-L590 PolarHBondContact O-N 3.07Å; L587-Q591 WeakPolarHBondContact O-CB 3.45Å; L587-Q591 PolarHBondContact O-N 3.2Å; L587-F622 HydrophobicContact CD2-CB 4.1Å; L587-F622 WeakPolarHBondContact CD2-O 2.97Å; L587-P624 HydrophobicContact CB-CG 3.91Å
588	Q	91.3	Very high	89	Confident	134 Å²	134	46.9 Å²	46.9	63%	0.626	25%	0.25	S	C	*	.	H	α-helix	trans	-63.3	-43.3	173.5	-74.8	174	-6	0	0	112	K584 L586 Q591 A592	K584-Q588 VanDerWaalsContact O-CG 3.31Å; K584-Q588 WeakPolarHBondContact O-CG 3.3Å; K584-Q588 PolarHBondContact O-N 3.23Å; L586-Q588 PolarHBondContact O-N 2.97Å; Q588-Q591 WeakPolarHBondContact O-CB 3.43Å; Q588-Q591 PolarHBondContact O-N 2.72Å; Q588-A592 PolarHBondContact O-N 3.38Å; Q588-A592 VanDerWaalsContact O-N 3.08Å
589	S	92.6	Very high	89.3	Confident	22 Å²	22	49.4 Å²	49.4	15%	0.154	26%	0.263	C	S	.	.	H	α-helix	trans	-66.5	-40.3	175.7	179.6	0	0	0	0	112.6	A551 E585 L586 Q591 A592 T593	A551-S589 WeakPolarHBondContact O-CB 3.27Å; A551-S589 PolarHBondContact O-OG 2.96Å; E585-S589 PolarHBondContact O-N 2.71Å; E585-S589 VanDerWaalsContact O-N 3.12Å; L586-S589 PolarHBondContact O-N 2.95Å; S589-Q591 VanDerWaalsContact C-N 3.32Å; S589-Q591 PolarHBondContact O-N 3.24Å; S589-A592 PolarHBondContact O-N 3.19Å; S589-T593 WeakPolarHBondContact O-CB 3.4Å; S589-T593 PolarHBondContact O-N 3.39Å; S589-T593 PolarHBondContact O-OG1 3Å
590	L	92.4	Very high	89.3	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-42.7	175.5	-173.9	64.8	0	0	0	110.7	P554 I575 L586 L587 T593 A594 I597 L623	P554-L590 HydrophobicContact CB-CB 4.46Å; P554-L590 HydrophobicContact CB-CD1 4.09Å; P554-L590 HydrophobicContact CG-CB 4.13Å; P554-L590 HydrophobicContact CG-CD1 4.26Å; I575-L590 HydrophobicContact CG2-CD1 4.35Å; L586-L590 WeakPolarHBondContact O-CB 3.17Å; L586-L590 PolarHBondContact O-N 3.46Å; L587-L590 PolarHBondContact O-N 3.07Å; L590-T593 PolarHBondContact O-N 3.4Å; L590-A594 WeakPolarHBondContact O-CB 3.26Å; L590-A594 PolarHBondContact O-N 3.46Å; L590-I597 HydrophobicContact CD1-CD1 3.96Å; L590-L623 HydrophobicContact CB-CD2 4.46Å; L590-L623 HydrophobicContact CD2-CD2 4.03Å; L590-L623 HydrophobicContact CG-CD2 3.79Å
591	Q	91.9	Very high	89.5	Confident	38 Å²	38	52.4 Å²	52.4	18%	0.178	27%	0.274	C	S	.	.	H	α-helix	trans	-58.4	-47.8	174	-172.6	65.7	45	0	0	112.1	L587 Q588 S589 T593 A594 C625	L587-Q591 WeakPolarHBondContact O-CB 3.45Å; L587-Q591 PolarHBondContact O-N 3.2Å; Q588-Q591 WeakPolarHBondContact O-CB 3.43Å; Q588-Q591 PolarHBondContact O-N 2.72Å; S589-Q591 VanDerWaalsContact C-N 3.32Å; S589-Q591 PolarHBondContact O-N 3.24Å; Q591-T593 PolarHBondContact O-N 3.02Å; Q591-A594 PolarHBondContact O-N 2.9Å; Q591-C625 VanDerWaalsContact CD-O 3.26Å; Q591-C625 PolarHBondContact NE2-O 2.93Å; Q591-C625 PolarHBondContact NE2-SG 3.36Å; Q591-C625 VanDerWaalsContact OE1-N 3.13Å; Q591-C625 PolarHBondContact OE1-O 3.16Å
592	A	92.4	Very high	89.8	Confident	86 Å²	86	55.1 Å²	55.1	71%	0.711	29%	0.294	S	S	*	.	H	α-helix	trans	-64.8	-29.2	-180	0	0	0	0	0	112.8	Q588 S589	Q588-A592 PolarHBondContact O-N 3.38Å; Q588-A592 VanDerWaalsContact O-N 3.08Å; S589-A592 PolarHBondContact O-N 3.19Å
593	T	92.8	Very high	90	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-96.1	-11.2	-177.4	-41.6	0	0	0	0	112.8	A558 S589 L590 Q591 A595 R596 I597	A558-T593 HydrophobicContact CB-CG2 3.54Å; S589-T593 WeakPolarHBondContact O-CB 3.4Å; S589-T593 PolarHBondContact O-N 3.39Å; S589-T593 PolarHBondContact O-OG1 3Å; L590-T593 PolarHBondContact O-N 3.4Å; Q591-T593 PolarHBondContact O-N 3.02Å; T593-A595 VanDerWaalsContact C-N 3.32Å; T593-A595 PolarHBondContact O-N 3.14Å; T593-R596 PolarHBondContact O-N 3.29Å; T593-I597 HydrophobicContact CG2-CD1 4Å; T593-I597 HydrophobicContact CG2-CG1 4.03Å; T593-I597 PolarHBondContact O-N 3.48Å; T593-I597 VanDerWaalsContact O-N 3.12Å
594	A	91.9	Very high	90.3	Very high	2 Å²	2	51.5 Å²	51.5	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-54.3	-44.2	-172.5	0	0	0	0	0	112.8	L590 Q591 R596 I597 Y598 L623 L630	L590-A594 WeakPolarHBondContact O-CB 3.26Å; L590-A594 PolarHBondContact O-N 3.46Å; Q591-A594 PolarHBondContact O-N 2.9Å; A594-R596 PolarHBondContact O-N 2.94Å; A594-I597 PolarHBondContact O-N 3.46Å; A594-I597 VanDerWaalsContact O-N 3.12Å; A594-Y598 HydrophobicContact CB-CD2 4.21Å; A594-Y598 HydrophobicContact CB-CE2 4.4Å; A594-Y598 WeakPolarHBondContact O-CD2 3.33Å; A594-Y598 PolarHBondContact O-N 3.35Å; A594-L623 HydrophobicContact CB-CD1 4.4Å; A594-L623 HydrophobicContact CB-CD2 4.23Å; A594-L630 HydrophobicContact CB-CD1 4.16Å; A594-L630 HydrophobicContact CB-CD2 3.91Å
595	A	89.9	Confident	90.5	Very high	55 Å²	55	43.9 Å²	43.9	46%	0.455	24%	0.236	S	C	.	.	H	α-helix	trans	-59.3	-30.3	179.7	0	0	0	0	0	113.6	T593 D599	T593-A595 VanDerWaalsContact C-N 3.32Å; T593-A595 PolarHBondContact O-N 3.14Å; A595-D599 PolarHBondContact O-N 2.82Å
596	R	91.2	Very high	90.5	Very high	156 Å²	156	40.8 Å²	40.8	59%	0.589	22%	0.223	S	C	*	.	H	α-helix	trans	-83.6	-35.3	175.7	-66.4	-179.4	176.5	164.3	-6.2	112.5	A558 T593 A594 G603	A558-R596 HydrophobicContact CB-CB 4.34Å; T593-R596 PolarHBondContact O-N 3.29Å; A594-R596 PolarHBondContact O-N 2.94Å; R596-G603 WeakPolarHBondContact O-CA 3.46Å
597	I	91.9	Very high	90.3	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-40	179.5	-68.2	171.8	0	0	0	110.5	A558 L590 T593 A594 G603 T604 L605 L616	A558-I597 HydrophobicContact CB-CG1 4.09Å; L590-I597 HydrophobicContact CD1-CD1 3.96Å; T593-I597 HydrophobicContact CG2-CD1 4Å; T593-I597 HydrophobicContact CG2-CG1 4.03Å; T593-I597 PolarHBondContact O-N 3.48Å; T593-I597 VanDerWaalsContact O-N 3.12Å; A594-I597 PolarHBondContact O-N 3.46Å; A594-I597 VanDerWaalsContact O-N 3.12Å; I597-G603 CarbonylContact O-C 3.6Å; I597-G603 WeakPolarHBondContact O-CA 3.45Å; I597-T604 PolarHBondContact O-N 2.95Å; I597-L605 PolarHBondContact O-N 3.1Å; I597-L616 HydrophobicContact CG2-CD2 4.18Å
598	Y	93.3	Very high	90.2	Very high	1 Å²	1	43 Å²	43	0%	0.004	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	21.6	-177	-58.3	-71.2	0	0	0	113.1	A594 L605 L616 V620 L623 L630 C633 L634 C637	A594-Y598 HydrophobicContact CB-CD2 4.21Å; A594-Y598 HydrophobicContact CB-CE2 4.4Å; A594-Y598 WeakPolarHBondContact O-CD2 3.33Å; A594-Y598 PolarHBondContact O-N 3.35Å; Y598-L605 HydrophobicContact CD1-CB 4.05Å; Y598-L605 HydrophobicContact CD1-CD2 3.78Å; Y598-L605 HydrophobicContact CD1-CG 4.41Å; Y598-L605 HydrophobicContact CE1-CD2 4.29Å; Y598-L616 HydrophobicContact CE1-CB 4.46Å; Y598-L616 PolarHBondContact OH-O 3.15Å; Y598-V620 HydrophobicContact CE1-CG2 3.79Å; Y598-V620 HydrophobicContact CE2-CG2 4.2Å; Y598-V620 WeakPolarHBondContact OH-CG2 3.41Å; Y598-L623 HydrophobicContact CE2-CD1 4.39Å; Y598-L630 HydrophobicContact CD2-CD1 3.86Å; Y598-L630 HydrophobicContact CG-CD1 4.28Å; Y598-C633 WeakPolarHBondContact O-CB 3.32Å; Y598-L634 HydrophobicContact CD1-CD2 3.73Å; Y598-L634 HydrophobicContact CE1-CD2 4.38Å; Y598-L634 HydrophobicContact CG-CD2 3.84Å; Y598-C637 PolarHBondContact O-SG 2.87Å
599	D	91.7	Very high	90.1	Very high	53 Å²	53	39.9 Å²	39.9	28%	0.283	23%	0.226	S	C	.	.			trans	-61.8	131.7	172.5	-176	-86.6	0	0	0	110	A595 L601 D602 G603	A595-D599 PolarHBondContact O-N 2.82Å; D599-L601 VanDerWaalsContact C-N 3.26Å; D599-L601 PolarHBondContact O-N 2.73Å; D599-L601 PolarHBondContact OD1-N 2.91Å; D599-D602 PolarHBondContact OD1-N 3.49Å; D599-G603 WeakPolarHBondContact O-CA 3.29Å; D599-G603 PolarHBondContact O-N 3.03Å
600	P	87.6	Confident	89.8	Confident	7 Å²	7	41.7 Å²	41.7	5%	0.045	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-18.2	-173.4	27.8	-35	0	0	0	114.1	R636 M640	P600-R636 HydrophobicContact CB-CB 3.64Å; P600-R636 HydrophobicContact CG-CB 3.98Å; P600-M640 HydrophobicContact CB-SD 3.87Å; P600-M640 VanDerWaalsContact O-SD 3.36Å
601	L	86.6	Confident	89.4	Confident	116 Å²	116	45.8 Å²	45.8	61%	0.607	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-53.9	-179	-59.3	179.7	0	0	0	111.1	D599 M640	D599-L601 VanDerWaalsContact C-N 3.26Å; D599-L601 PolarHBondContact O-N 2.73Å; D599-L601 PolarHBondContact OD1-N 2.91Å; L601-M640 HydrophobicContact CD2-CE 3.66Å; L601-M640 HydrophobicContact CD2-SD 4.19Å
602	D	86.3	Confident	89.2	Confident	131 Å²	131	44 Å²	44	70%	0.701	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	7.9	-170.7	-71.9	-38.1	0	0	0	113.3	D599 L607	D599-D602 PolarHBondContact OD1-N 3.49Å; D602-L607 WeakPolarHBondContact O-CD1 3.47Å
603	G	87.8	Confident	89.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.223	C	C	.	.			trans	-69	148.8	-175.5	0	0	0	0	0	113.5	R596 I597 D599 L605 V606 L607	R596-G603 WeakPolarHBondContact O-CA 3.46Å; I597-G603 CarbonylContact O-C 3.6Å; I597-G603 WeakPolarHBondContact O-CA 3.45Å; D599-G603 WeakPolarHBondContact O-CA 3.29Å; D599-G603 PolarHBondContact O-N 3.03Å; G603-L605 PolarHBondContact O-N 3.23Å; G603-V606 PolarHBondContact O-N 3.39Å; G603-V606 VanDerWaalsContact O-N 3.07Å; G603-L607 VanDerWaalsContact O-CG 3.31Å; G603-L607 WeakPolarHBondContact O-CG 3.4Å; G603-L607 PolarHBondContact O-N 2.88Å; G603-L607 VanDerWaalsContact O-N 3.12Å
604	T	89.7	Confident	89.1	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	24%	0.241	C	C	.	.	H	α-helix	trans	-56.2	-33.3	175.6	-51	0	0	0	0	112.5	L557 I597 L608 L616	L557-T604 HydrophobicContact CD1-CG2 3.99Å; L557-T604 HydrophobicContact CG-CG2 4.06Å; I597-T604 PolarHBondContact O-N 2.95Å; T604-L608 HydrophobicContact CG2-CD1 3.43Å; T604-L608 VanDerWaalsContact CG2-CD1 3.43Å; T604-L608 HydrophobicContact CG2-CG 3.9Å; T604-L608 WeakPolarHBondContact O-CB 3.45Å; T604-L608 WeakPolarHBondContact O-CG 3.13Å; T604-L608 PolarHBondContact O-N 3.4Å; T604-L608 VanDerWaalsContact O-N 3.15Å; T604-L616 HydrophobicContact CG2-CD1 4.18Å
605	L	90	Very high	88.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-60.1	-47.4	175.2	178.3	68.5	0	0	0	111.8	I597 Y598 G603 Q613 L616 V617 C637	I597-L605 PolarHBondContact O-N 3.1Å; Y598-L605 HydrophobicContact CD1-CB 4.05Å; Y598-L605 HydrophobicContact CD1-CD2 3.78Å; Y598-L605 HydrophobicContact CD1-CG 4.41Å; Y598-L605 HydrophobicContact CE1-CD2 4.29Å; G603-L605 PolarHBondContact O-N 3.23Å; L605-Q613 HydrophobicContact CD1-CB 4.06Å; L605-Q613 HydrophobicContact CD1-CG 4.33Å; L605-Q613 VanDerWaalsContact O-CG 3.28Å; L605-Q613 WeakPolarHBondContact O-CG 3.48Å; L605-Q613 PolarHBondContact O-NE2 3.31Å; L605-L616 HydrophobicContact CB-CD1 4.27Å; L605-L616 HydrophobicContact CD1-CB 3.75Å; L605-L616 HydrophobicContact CD1-CD1 4.21Å; L605-V617 HydrophobicContact CD1-CG2 4.04Å; L605-C637 HydrophobicContact CD2-CB 4.23Å
606	V	87.8	Confident	89	Confident	24 Å²	24	46 Å²	46	15%	0.145	23%	0.231	C	C	.	.	H	α-helix	trans	-73.5	-32.3	-175.5	169.4	0	0	0	0	111.6	G603 R642	G603-V606 PolarHBondContact O-N 3.39Å; G603-V606 VanDerWaalsContact O-N 3.07Å; V606-R642 HydrophobicContact CG1-CB 3.78Å; V606-R642 HydrophobicContact CG1-CG 3.76Å; V606-R642 HydrophobicContact CG2-CB 4.42Å
607	L	87.9	Confident	89.1	Confident	64 Å²	64	38.7 Å²	38.7	34%	0.335	20%	0.203	S	C	.	.	H	α-helix	trans	-82.8	-31.8	-174.3	-64.9	178.1	0	0	0	113.5	L562 D602 G603	L562-L607 HydrophobicContact CD1-CB 3.7Å; L562-L607 HydrophobicContact CD1-CD2 4.02Å; L562-L607 HydrophobicContact CD1-CG 4.36Å; L562-L607 VanDerWaalsContact CD1-O 3.24Å; L562-L607 WeakPolarHBondContact CD1-O 3.31Å; L562-L607 WeakPolarHBondContact CD2-O 3.34Å; L562-L607 HydrophobicContact CG-CB 3.78Å; L562-L607 WeakPolarHBondContact CG-O 3.43Å; D602-L607 WeakPolarHBondContact O-CD1 3.47Å; G603-L607 VanDerWaalsContact O-CG 3.31Å; G603-L607 WeakPolarHBondContact O-CG 3.4Å; G603-L607 PolarHBondContact O-N 2.88Å; G603-L607 VanDerWaalsContact O-N 3.12Å
608	L	88.3	Confident	89	Confident	4 Å²	4	42 Å²	42	2%	0.021	22%	0.218	C	C	.	.	S	Bend	trans	-83.8	159.8	-174.9	-70.4	-178.5	0	0	0	114.2	G561 L562 P565 I572 T604 A612 Q613 L616	G561-L608 WeakPolarHBondContact O-CD2 3.35Å; L562-L608 HydrophobicContact CD2-CD2 4.45Å; P565-L608 HydrophobicContact CB-CD2 4.45Å; I572-L608 HydrophobicContact CD1-CD1 3.67Å; T604-L608 HydrophobicContact CG2-CD1 3.43Å; T604-L608 VanDerWaalsContact CG2-CD1 3.43Å; T604-L608 HydrophobicContact CG2-CG 3.9Å; T604-L608 WeakPolarHBondContact O-CB 3.45Å; T604-L608 WeakPolarHBondContact O-CG 3.13Å; T604-L608 PolarHBondContact O-N 3.4Å; T604-L608 VanDerWaalsContact O-N 3.15Å; L608-A612 HydrophobicContact CB-CB 3.72Å; L608-A612 HydrophobicContact CD1-CB 3.92Å; L608-A612 HydrophobicContact CG-CB 4.44Å; L608-Q613 VanDerWaalsContact O-CG 3.31Å; L608-Q613 WeakPolarHBondContact O-CG 3.35Å; L608-Q613 PolarHBondContact O-NE2 3.22Å; L608-Q613 VanDerWaalsContact O-NE2 3.14Å; L608-L616 HydrophobicContact CD1-CD1 4.26Å
609	P	88.6	Confident	88.9	Confident	70 Å²	70	42 Å²	42	46%	0.455	22%	0.218	S	C	.	.			trans	-64.4	161	177.6	-20.8	32.7	0	0	0	114.4	E611 A612 Q613	P609-E611 VanDerWaalsContact C-N 3.3Å; P609-E611 PolarHBondContact O-N 2.92Å; P609-E611 VanDerWaalsContact O-N 3.07Å; P609-A612 WeakPolarHBondContact O-CA 3.42Å; P609-A612 WeakPolarHBondContact O-CB 3.44Å; P609-A612 PolarHBondContact O-N 3.18Å; P609-Q613 WeakPolarHBondContact O-CG 3.49Å; P609-Q613 PolarHBondContact O-N 3.39Å
610	A	85.9	Confident	88.8	Confident	60 Å²	60	39.4 Å²	39.4	50%	0.496	21%	0.205	S	C	.	.	H	α-helix	trans	-50.5	-37.7	-173.3	0	0	0	0	0	115.8	Q613 R614	A610-Q613 WeakPolarHBondContact O-CB 3.38Å; A610-Q613 PolarHBondContact O-N 3.37Å; A610-R614 PolarHBondContact O-N 3.36Å
611	E	84.4	Confident	88.9	Confident	86 Å²	86	43.3 Å²	43.3	40%	0.402	22%	0.219	S	C	.	.	H	α-helix	trans	-66.3	-40.5	178.1	-174.1	59.4	-154.5	0	0	112.1	P609 R614 R615	P609-E611 VanDerWaalsContact C-N 3.3Å; P609-E611 PolarHBondContact O-N 2.92Å; P609-E611 VanDerWaalsContact O-N 3.07Å; E611-R614 PolarHBondContact O-N 3.29Å; E611-R614 IonicContact OE1-NH1 3.48Å; E611-R614 IonicContact OE2-CZ 3.13Å; E611-R614 IonicContact OE2-NH1 2.67Å; E611-R614 PolarHBondContact OE2-NH1 2.89Å; E611-R614 IonicContact OE2-NH2 3.67Å; E611-R615 PolarHBondContact O-N 3.33Å; E611-R615 IonicContact OE1-CZ 3.84Å; E611-R615 IonicContact OE1-NE 3.94Å; E611-R615 IonicContact OE1-NH2 3.12Å; E611-R615 PolarHBondContact OE1-NH2 3.07Å
612	A	88.2	Confident	89	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-41.5	175	0	0	0	0	0	110.7	N569 I572 L608 P609 R614 R615 L616	N569-A612 WeakPolarHBondContact OD1-CB 3.45Å; I572-A612 HydrophobicContact CD1-CB 4.02Å; L608-A612 HydrophobicContact CB-CB 3.72Å; L608-A612 HydrophobicContact CD1-CB 3.92Å; L608-A612 HydrophobicContact CG-CB 4.44Å; P609-A612 WeakPolarHBondContact O-CA 3.42Å; P609-A612 WeakPolarHBondContact O-CB 3.44Å; P609-A612 PolarHBondContact O-N 3.18Å; A612-R614 VanDerWaalsContact C-N 3.28Å; A612-R614 PolarHBondContact O-N 3.04Å; A612-R615 PolarHBondContact O-N 2.97Å; A612-L616 WeakPolarHBondContact O-CG 3.43Å; A612-L616 PolarHBondContact O-N 2.86Å
613	Q	91.2	Very high	89.1	Confident	16 Å²	16	33.1 Å²	33.1	8%	0.075	16%	0.164	C	C	.	.	H	α-helix	trans	-56.5	-43.6	176.4	-64.7	-175.6	-20.7	0	0	111.3	L605 L608 P609 A610 R615 L616 V617 R642 L647	L605-Q613 HydrophobicContact CD1-CB 4.06Å; L605-Q613 HydrophobicContact CD1-CG 4.33Å; L605-Q613 VanDerWaalsContact O-CG 3.28Å; L605-Q613 WeakPolarHBondContact O-CG 3.48Å; L605-Q613 PolarHBondContact O-NE2 3.31Å; L608-Q613 VanDerWaalsContact O-CG 3.31Å; L608-Q613 WeakPolarHBondContact O-CG 3.35Å; L608-Q613 PolarHBondContact O-NE2 3.22Å; L608-Q613 VanDerWaalsContact O-NE2 3.14Å; P609-Q613 WeakPolarHBondContact O-CG 3.49Å; P609-Q613 PolarHBondContact O-N 3.39Å; A610-Q613 WeakPolarHBondContact O-CB 3.38Å; A610-Q613 PolarHBondContact O-N 3.37Å; Q613-R615 PolarHBondContact O-N 2.94Å; Q613-L616 PolarHBondContact O-N 3.22Å; Q613-V617 WeakPolarHBondContact O-CG2 3.39Å; Q613-V617 PolarHBondContact O-N 2.96Å; Q613-R642 PolarHBondContact NE2-O 2.91Å; Q613-L647 HydrophobicContact CB-CD1 3.74Å
614	R	90.7	Very high	89	Confident	105 Å²	105	36.1 Å²	36.1	40%	0.396	18%	0.183	S	C	.	.	H	α-helix	trans	-56.4	-48.4	176.9	-169.3	-174.7	-65.6	136	2.6	112.3	A610 E611 A612 V617 Q618 L647	A610-R614 PolarHBondContact O-N 3.36Å; E611-R614 PolarHBondContact O-N 3.29Å; E611-R614 IonicContact OE1-NH1 3.48Å; E611-R614 IonicContact OE2-CZ 3.13Å; E611-R614 IonicContact OE2-NH1 2.67Å; E611-R614 PolarHBondContact OE2-NH1 2.89Å; E611-R614 IonicContact OE2-NH2 3.67Å; A612-R614 VanDerWaalsContact C-N 3.28Å; A612-R614 PolarHBondContact O-N 3.04Å; R614-V617 PolarHBondContact O-N 2.99Å; R614-Q618 VanDerWaalsContact O-CG 3.32Å; R614-Q618 WeakPolarHBondContact O-CG 3.34Å; R614-Q618 PolarHBondContact O-N 3.37Å; R614-L647 HydrophobicContact CB-CD2 3.79Å; R614-L647 HydrophobicContact CG-CD2 3.95Å
615	R	88.4	Confident	88.9	Confident	68 Å²	68	38.9 Å²	38.9	26%	0.257	20%	0.202	S	C	.	.	H	α-helix	trans	-68.1	-36.8	179.8	-67	-177.6	-172.8	163	4.2	111.9	I572 D573 E611 A612 Q613 Q618 L619	I572-R615 HydrophobicContact CG2-CB 3.45Å; I572-R615 VanDerWaalsContact CG2-CB 3.45Å; I572-R615 HydrophobicContact CG2-CG 4.38Å; D573-R615 WeakPolarHBondContact OD1-CD 3.25Å; D573-R615 IonicContact OD1-CZ 2.74Å; D573-R615 VanDerWaalsContact OD1-CZ 3.29Å; D573-R615 IonicContact OD1-NE 3.84Å; D573-R615 IonicContact OD1-NH1 2.81Å; D573-R615 PolarHBondContact OD1-NH1 3.31Å; D573-R615 IonicContact OD2-NH1 3.02Å; D573-R615 PolarHBondContact OD2-NH1 2.64Å; E611-R615 PolarHBondContact O-N 3.33Å; E611-R615 IonicContact OE1-CZ 3.84Å; E611-R615 IonicContact OE1-NE 3.94Å; E611-R615 IonicContact OE1-NH2 3.12Å; E611-R615 PolarHBondContact OE1-NH2 3.07Å; A612-R615 PolarHBondContact O-N 2.97Å; Q613-R615 PolarHBondContact O-N 2.94Å; R615-Q618 WeakPolarHBondContact O-CB 3.39Å; R615-Q618 PolarHBondContact O-N 3.15Å; R615-L619 WeakPolarHBondContact O-CG 3.27Å; R615-L619 PolarHBondContact O-N 2.9Å
616	L	91.6	Very high	88.9	Confident	1 Å²	1	39 Å²	39	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-44.9	173.5	-70.4	174.7	0	0	0	111.6	L557 I572 I597 Y598 T604 L605 L608 A612 Q613 Q618 L619	L557-L616 HydrophobicContact CD2-CD2 4.08Å; I572-L616 HydrophobicContact CD1-CD1 4.23Å; I572-L616 HydrophobicContact CD1-CD2 3.99Å; I572-L616 HydrophobicContact CD1-CG 3.97Å; I572-L616 HydrophobicContact CG1-CD2 3.96Å; I572-L616 HydrophobicContact CG1-CG 4.43Å; I597-L616 HydrophobicContact CG2-CD2 4.18Å; Y598-L616 HydrophobicContact CE1-CB 4.46Å; Y598-L616 PolarHBondContact OH-O 3.15Å; T604-L616 HydrophobicContact CG2-CD1 4.18Å; L605-L616 HydrophobicContact CB-CD1 4.27Å; L605-L616 HydrophobicContact CD1-CB 3.75Å; L605-L616 HydrophobicContact CD1-CD1 4.21Å; L608-L616 HydrophobicContact CD1-CD1 4.26Å; A612-L616 WeakPolarHBondContact O-CG 3.43Å; A612-L616 PolarHBondContact O-N 2.86Å; Q613-L616 PolarHBondContact O-N 3.22Å; L616-Q618 VanDerWaalsContact C-N 3.27Å; L616-Q618 PolarHBondContact O-N 3.02Å; L616-L619 HydrophobicContact CD2-CD1 4.08Å; L616-L619 WeakPolarHBondContact O-CB 3.28Å; L616-L619 PolarHBondContact O-N 3.14Å
617	V	92.5	Very high	89	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-57.8	-42.5	173.7	168.2	0	0	0	0	111	L605 Q613 R614 L619 V620 M643 T650 L651 I654	L605-V617 HydrophobicContact CD1-CG2 4.04Å; Q613-V617 WeakPolarHBondContact O-CG2 3.39Å; Q613-V617 PolarHBondContact O-N 2.96Å; R614-V617 PolarHBondContact O-N 2.99Å; V617-L619 VanDerWaalsContact C-N 3.31Å; V617-L619 PolarHBondContact O-N 3.28Å; V617-V620 WeakPolarHBondContact O-CB 3.33Å; V617-V620 WeakPolarHBondContact O-CG2 3.35Å; V617-V620 PolarHBondContact O-N 3.41Å; V617-M643 HydrophobicContact CG2-SD 3.75Å; V617-T650 HydrophobicContact CG1-CG2 4.05Å; V617-L651 HydrophobicContact CG1-CB 3.8Å; V617-L651 HydrophobicContact CG1-CD1 4.19Å; V617-I654 HydrophobicContact CG1-CD1 3.94Å; V617-I654 WeakPolarHBondContact O-CD1 3.42Å
618	Q	90.8	Very high	89.1	Confident	70 Å²	70	39.7 Å²	39.7	33%	0.327	22%	0.216	S	C	.	.	H	α-helix	trans	-63.4	-33	175.4	-70.8	169.6	-13.1	0	0	113.1	R614 R615 L616 V620 Y621	R614-Q618 VanDerWaalsContact O-CG 3.32Å; R614-Q618 WeakPolarHBondContact O-CG 3.34Å; R614-Q618 PolarHBondContact O-N 3.37Å; R615-Q618 WeakPolarHBondContact O-CB 3.39Å; R615-Q618 PolarHBondContact O-N 3.15Å; L616-Q618 VanDerWaalsContact C-N 3.27Å; L616-Q618 PolarHBondContact O-N 3.02Å; Q618-V620 PolarHBondContact O-N 3.21Å; Q618-Y621 VanDerWaalsContact O-CB 3.3Å; Q618-Y621 WeakPolarHBondContact O-CB 3.36Å; Q618-Y621 PolarHBondContact O-N 2.92Å; Q618-Y621 VanDerWaalsContact O-N 3.15Å
619	L	90.6	Very high	89.2	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-25.5	177.2	-76	177.4	0	0	0	113.5	I575 H576 A579 R615 L616 V617 Y621 F622	I575-L619 HydrophobicContact CG2-CD1 3.86Å; I575-L619 HydrophobicContact CG2-CD2 4.02Å; H576-L619 HydrophobicContact CB-CD2 3.95Å; A579-L619 HydrophobicContact CB-CD2 3.98Å; R615-L619 WeakPolarHBondContact O-CG 3.27Å; R615-L619 PolarHBondContact O-N 2.9Å; L616-L619 HydrophobicContact CD2-CD1 4.08Å; L616-L619 WeakPolarHBondContact O-CB 3.28Å; L616-L619 PolarHBondContact O-N 3.14Å; V617-L619 VanDerWaalsContact C-N 3.31Å; V617-L619 PolarHBondContact O-N 3.28Å; L619-Y621 PolarHBondContact O-N 3.2Å; L619-F622 HydrophobicContact CD2-CD2 4.26Å; L619-F622 PolarHBondContact O-N 2.94Å
620	V	91	Very high	89.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-57.5	-33.8	175.9	-179.8	0	0	0	0	110.9	Y598 V617 Q618 F622 L623 L626 L634 L651 I654 L655	Y598-V620 HydrophobicContact CE1-CG2 3.79Å; Y598-V620 HydrophobicContact CE2-CG2 4.2Å; Y598-V620 WeakPolarHBondContact OH-CG2 3.41Å; V617-V620 WeakPolarHBondContact O-CB 3.33Å; V617-V620 WeakPolarHBondContact O-CG2 3.35Å; V617-V620 PolarHBondContact O-N 3.41Å; Q618-V620 PolarHBondContact O-N 3.21Å; V620-F622 PolarHBondContact O-N 3.11Å; V620-L623 HydrophobicContact CG1-CD1 4.41Å; V620-L623 PolarHBondContact O-N 3.37Å; V620-L626 HydrophobicContact CG1-CD2 3.94Å; V620-L634 HydrophobicContact CG1-CD1 4.2Å; V620-L634 HydrophobicContact CG2-CD2 4.42Å; V620-L651 HydrophobicContact CB-CD1 4.17Å; V620-L651 HydrophobicContact CG1-CD1 4.11Å; V620-L651 HydrophobicContact CG2-CD1 3.89Å; V620-I654 HydrophobicContact CB-CG2 4.44Å; V620-I654 HydrophobicContact CG1-CG2 4.43Å; V620-L655 HydrophobicContact CG1-CD2 4.2Å
621	Y	88.8	Confident	89.7	Confident	88 Å²	88	37.5 Å²	37.5	35%	0.345	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-61.1	-29.7	176.7	-179.7	-98.8	0	0	0	113.2	Q618 L619 I654 R658	Q618-Y621 VanDerWaalsContact O-CB 3.3Å; Q618-Y621 WeakPolarHBondContact O-CB 3.36Å; Q618-Y621 PolarHBondContact O-N 2.92Å; Q618-Y621 VanDerWaalsContact O-N 3.15Å; L619-Y621 PolarHBondContact O-N 3.2Å; Y621-I654 HydrophobicContact CD2-CG2 4.29Å; Y621-R658 HydrophobicContact CD2-CG 4.1Å; Y621-R658 HydrophobicContact CE2-CG 4.46Å; Y621-R658 PolarHBondContact O-NH1 2.87Å
622	F	87.8	Confident	90	Very high	33 Å²	33	35.7 Å²	35.7	15%	0.145	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-91.7	-8.2	-176.9	-60.3	-67.1	0	0	0	113.8	H576 A579 L587 L619 V620	H576-F622 AromaticContact NE2-CE2 3.81Å; A579-F622 HydrophobicContact CB-CB 3.77Å; A579-F622 HydrophobicContact CB-CD2 3.8Å; A579-F622 HydrophobicContact CB-CG 3.81Å; L587-F622 HydrophobicContact CD2-CB 4.1Å; L587-F622 WeakPolarHBondContact CD2-O 2.97Å; L619-F622 HydrophobicContact CD2-CD2 4.26Å; L619-F622 PolarHBondContact O-N 2.94Å; V620-F622 PolarHBondContact O-N 3.11Å
623	L	88.4	Confident	90.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.			trans	-59.3	136.6	-179.3	-76.5	171.3	0	0	0	110.9	L590 A594 Y598 V620 L626 L630 R658	L590-L623 HydrophobicContact CB-CD2 4.46Å; L590-L623 HydrophobicContact CD2-CD2 4.03Å; L590-L623 HydrophobicContact CG-CD2 3.79Å; A594-L623 HydrophobicContact CB-CD1 4.4Å; A594-L623 HydrophobicContact CB-CD2 4.23Å; Y598-L623 HydrophobicContact CE2-CD1 4.39Å; V620-L623 HydrophobicContact CG1-CD1 4.41Å; V620-L623 PolarHBondContact O-N 3.37Å; L623-L626 HydrophobicContact CB-CD2 4.21Å; L623-L626 HydrophobicContact CD1-CD2 3.72Å; L623-L630 HydrophobicContact CD1-CD2 3.82Å; L623-R658 PolarHBondContact O-NH1 2.86Å; L623-R658 PolarHBondContact O-NH2 3.26Å
624	P	86.2	Confident	90.4	Very high	63 Å²	63	35.8 Å²	35.8	41%	0.409	20%	0.2	S	C	.	.	S	Bend	trans	-60.7	-44.4	176.2	-27.3	34.8	0	0	0	113.7	L587	L587-P624 HydrophobicContact CB-CG 3.91Å
625	C	87.4	Confident	90.5	Very high	60 Å²	60	31 Å²	31	41%	0.405	18%	0.182	S	C	.	.			trans	-140.2	151.8	-179.8	62.6	0	0	0	0	112.2	Q591 P627	Q591-C625 VanDerWaalsContact CD-O 3.26Å; Q591-C625 PolarHBondContact NE2-O 2.93Å; Q591-C625 PolarHBondContact NE2-SG 3.36Å; Q591-C625 VanDerWaalsContact OE1-N 3.13Å; Q591-C625 PolarHBondContact OE1-O 3.16Å; C625-P627 WeakPolarHBondContact O-CD 3.42Å
626	L	89.5	Confident	90.6	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	19%	0.189	C	C	.	.			trans	-120.9	85	-177.7	-70	168.9	0	0	0	109.2	V620 L623 L630 L655 R658 V673	V620-L626 HydrophobicContact CG1-CD2 3.94Å; L623-L626 HydrophobicContact CB-CD2 4.21Å; L623-L626 HydrophobicContact CD1-CD2 3.72Å; L626-L630 HydrophobicContact CD2-CD2 3.89Å; L626-L655 HydrophobicContact CD1-CD2 3.7Å; L626-R658 HydrophobicContact CD1-CB 4.49Å; L626-V673 HydrophobicContact CB-CG2 3.96Å; L626-V673 HydrophobicContact CD1-CG2 3.38Å; L626-V673 HydrophobicContact CG-CG2 4.26Å
627	P	90.3	Very high	90.6	Very high	50 Å²	50	32.8 Å²	32.8	33%	0.325	19%	0.189	S	C	.	.			trans	-69.5	154.6	-178.2	28.8	-34.7	0	0	0	111.7	C625 S629 L630 L631	C625-P627 WeakPolarHBondContact O-CD 3.42Å; P627-S629 PolarHBondContact O-N 2.96Å; P627-S629 VanDerWaalsContact O-N 3.12Å; P627-L630 HydrophobicContact CG-CB 3.89Å; P627-L630 WeakPolarHBondContact O-CB 3.5Å; P627-L630 PolarHBondContact O-N 3.12Å; P627-L631 PolarHBondContact O-N 2.87Å
628	A	90.2	Very high	90.5	Very high	51 Å²	51	32.8 Å²	32.8	42%	0.421	19%	0.189	S	C	.	.	H	α-helix	trans	-51.2	-37.3	179	0	0	0	0	0	113.9	L631 A632 D677	A628-L631 PolarHBondContact O-N 2.62Å; A628-A632 WeakPolarHBondContact O-CB 3.47Å; A628-A632 PolarHBondContact O-N 3.48Å; A628-D677 WeakPolarHBondContact CB-OD1 3.46Å
629	S	90.8	Very high	90.4	Very high	81 Å²	81	30.8 Å²	30.8	57%	0.566	18%	0.181	S	C	*	.	H	α-helix	trans	-64.3	-40	177.3	55.8	0	0	0	0	112.8	P627 A632 C633	P627-S629 PolarHBondContact O-N 2.96Å; P627-S629 VanDerWaalsContact O-N 3.12Å; S629-A632 PolarHBondContact O-N 2.91Å; S629-C633 PolarHBondContact O-N 3.32Å; S629-C633 PolarHBondContact O-SG 3.1Å; S629-C633 VanDerWaalsContact O-SG 3.4Å
630	L	92.3	Very high	90	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-70.3	-41.4	176.7	178.3	61.3	0	0	0	110.8	A594 Y598 L623 L626 P627 A632 C633 L634	A594-L630 HydrophobicContact CB-CD1 4.16Å; A594-L630 HydrophobicContact CB-CD2 3.91Å; Y598-L630 HydrophobicContact CD2-CD1 3.86Å; Y598-L630 HydrophobicContact CG-CD1 4.28Å; L623-L630 HydrophobicContact CD1-CD2 3.82Å; L626-L630 HydrophobicContact CD2-CD2 3.89Å; P627-L630 HydrophobicContact CG-CB 3.89Å; P627-L630 WeakPolarHBondContact O-CB 3.5Å; P627-L630 PolarHBondContact O-N 3.12Å; L630-A632 VanDerWaalsContact C-N 3.3Å; L630-A632 PolarHBondContact O-N 2.93Å; L630-C633 WeakPolarHBondContact O-CB 3.49Å; L630-C633 PolarHBondContact O-N 2.99Å; L630-C633 VanDerWaalsContact O-N 3.15Å; L630-L634 HydrophobicContact CD1-CG 4.45Å; L630-L634 HydrophobicContact CG-CD1 4.24Å; L630-L634 HydrophobicContact CG-CG 4.47Å; L630-L634 WeakPolarHBondContact O-CG 3.37Å; L630-L634 PolarHBondContact O-N 3.14Å
631	L	92.6	Very high	89.4	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-39.1	175.3	-70.5	169	0	0	0	111.6	P627 A628 C633 L634 S635 L655 V673 D677 F681	P627-L631 PolarHBondContact O-N 2.87Å; A628-L631 PolarHBondContact O-N 2.62Å; L631-C633 VanDerWaalsContact C-N 3.34Å; L631-C633 PolarHBondContact O-N 2.93Å; L631-L634 HydrophobicContact CD2-CD1 4.43Å; L631-L634 PolarHBondContact O-N 3.4Å; L631-S635 WeakPolarHBondContact O-CB 3.41Å; L631-S635 PolarHBondContact O-N 3.28Å; L631-L655 HydrophobicContact CD2-CD1 4.01Å; L631-L655 HydrophobicContact CD2-CD2 3.77Å; L631-V673 HydrophobicContact CD1-CG1 4.08Å; L631-D677 HydrophobicContact CD1-CB 3.7Å; L631-F681 HydrophobicContact CB-CB 4.34Å; L631-F681 HydrophobicContact CB-CD2 4.33Å; L631-F681 HydrophobicContact CD2-CD2 4.31Å; L631-F681 HydrophobicContact CD2-CG 4.44Å; L631-F681 WeakPolarHBondContact O-CD2 3.45Å
632	A	91.7	Very high	89.1	Confident	47 Å²	47	40.6 Å²	40.6	39%	0.388	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-39.4	173.4	0	0	0	0	0	112.4	A628 S629 L630 R636	A628-A632 WeakPolarHBondContact O-CB 3.47Å; A628-A632 PolarHBondContact O-N 3.48Å; S629-A632 PolarHBondContact O-N 2.91Å; L630-A632 VanDerWaalsContact C-N 3.3Å; L630-A632 PolarHBondContact O-N 2.93Å; A632-R636 PolarHBondContact O-N 3.09Å; A632-R636 VanDerWaalsContact O-N 3.14Å
633	C	92.5	Very high	89.1	Confident	19 Å²	19	39.3 Å²	39.3	13%	0.128	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-46	173.2	-66.9	0	0	0	0	111.9	Y598 S629 L630 L631 S635 R636 C637	Y598-C633 WeakPolarHBondContact O-CB 3.32Å; S629-C633 PolarHBondContact O-N 3.32Å; S629-C633 PolarHBondContact O-SG 3.1Å; S629-C633 VanDerWaalsContact O-SG 3.4Å; L630-C633 WeakPolarHBondContact O-CB 3.49Å; L630-C633 PolarHBondContact O-N 2.99Å; L630-C633 VanDerWaalsContact O-N 3.15Å; L631-C633 VanDerWaalsContact C-N 3.34Å; L631-C633 PolarHBondContact O-N 2.93Å; C633-S635 VanDerWaalsContact C-N 3.31Å; C633-S635 PolarHBondContact O-N 3.04Å; C633-R636 PolarHBondContact O-N 3.41Å; C633-C637 PolarHBondContact O-N 3.4Å; C633-C637 PolarHBondContact O-SG 3.4Å
634	L	93.4	Very high	89.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-39.4	177.3	-70.7	174.6	0	0	0	112.3	Y598 V620 L630 L631 C637 C638 L651 F681	Y598-L634 HydrophobicContact CD1-CD2 3.73Å; Y598-L634 HydrophobicContact CE1-CD2 4.38Å; Y598-L634 HydrophobicContact CG-CD2 3.84Å; V620-L634 HydrophobicContact CG1-CD1 4.2Å; V620-L634 HydrophobicContact CG2-CD2 4.42Å; L630-L634 HydrophobicContact CD1-CG 4.45Å; L630-L634 HydrophobicContact CG-CD1 4.24Å; L630-L634 HydrophobicContact CG-CG 4.47Å; L630-L634 WeakPolarHBondContact O-CG 3.37Å; L630-L634 PolarHBondContact O-N 3.14Å; L631-L634 HydrophobicContact CD2-CD1 4.43Å; L631-L634 PolarHBondContact O-N 3.4Å; L634-C637 WeakPolarHBondContact O-CB 3.39Å; L634-C637 PolarHBondContact O-N 2.68Å; L634-C638 PolarHBondContact O-N 3.39Å; L634-C638 PolarHBondContact O-SG 3.15Å; L634-L651 HydrophobicContact CB-CD2 4.21Å; L634-L651 HydrophobicContact CD1-CD1 4.48Å; L634-L651 HydrophobicContact CD2-CD1 4.32Å; L634-L651 HydrophobicContact CD2-CD2 4.02Å; L634-F681 HydrophobicContact CB-CE2 4.08Å
635	S	93.4	Very high	89.4	Confident	4 Å²	4	40.8 Å²	40.8	3%	0.028	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-46.6	175.1	-179.8	0	0	0	0	110.5	L631 C633 C637 C638 I639 T685	L631-S635 WeakPolarHBondContact O-CB 3.41Å; L631-S635 PolarHBondContact O-N 3.28Å; C633-S635 VanDerWaalsContact C-N 3.31Å; C633-S635 PolarHBondContact O-N 3.04Å; S635-C637 VanDerWaalsContact C-N 3.33Å; S635-C637 PolarHBondContact O-N 3.48Å; S635-C638 WeakPolarHBondContact O-CB 3.31Å; S635-C638 PolarHBondContact O-N 3.05Å; S635-C638 VanDerWaalsContact O-N 3.13Å; S635-I639 VanDerWaalsContact O-CG1 3.27Å; S635-I639 WeakPolarHBondContact O-CG1 3.26Å; S635-I639 PolarHBondContact O-N 2.92Å; S635-I639 VanDerWaalsContact O-N 3.14Å; S635-T685 WeakPolarHBondContact CB-OG1 3.43Å; S635-T685 PolarHBondContact OG-N 3.42Å; S635-T685 PolarHBondContact OG-OG1 3.41Å
636	R	91.2	Very high	89.4	Confident	107 Å²	107	44.1 Å²	44.1	40%	0.404	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-39.2	174.4	-74.5	-165	-90.4	-160.2	-1.9	112.7	P600 A632 C633 C638 I639 M640	P600-R636 HydrophobicContact CB-CB 3.64Å; P600-R636 HydrophobicContact CG-CB 3.98Å; A632-R636 PolarHBondContact O-N 3.09Å; A632-R636 VanDerWaalsContact O-N 3.14Å; C633-R636 PolarHBondContact O-N 3.41Å; R636-C638 VanDerWaalsContact C-N 3.31Å; R636-C638 PolarHBondContact O-N 3.01Å; R636-I639 PolarHBondContact O-N 3.21Å; R636-I639 VanDerWaalsContact O-N 3.1Å; R636-M640 WeakPolarHBondContact O-CG 3.47Å; R636-M640 PolarHBondContact O-N 3.4Å
637	C	91.3	Very high	89.5	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.007	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-37.1	173.9	-68.8	0	0	0	0	112.8	Y598 L605 C633 L634 S635 I639	Y598-C637 PolarHBondContact O-SG 2.87Å; L605-C637 HydrophobicContact CD2-CB 4.23Å; C633-C637 PolarHBondContact O-N 3.4Å; C633-C637 PolarHBondContact O-SG 3.4Å; L634-C637 WeakPolarHBondContact O-CB 3.39Å; L634-C637 PolarHBondContact O-N 2.68Å; S635-C637 VanDerWaalsContact C-N 3.33Å; S635-C637 PolarHBondContact O-N 3.48Å; C637-I639 VanDerWaalsContact C-N 3.32Å
638	C	91.3	Very high	89.5	Confident	1 Å²	1	42 Å²	42	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-66.6	-33.6	173.6	-70.4	0	0	0	0	112.5	L634 S635 R636 M643 A648 T685 H726	L634-C638 PolarHBondContact O-N 3.39Å; L634-C638 PolarHBondContact O-SG 3.15Å; S635-C638 WeakPolarHBondContact O-CB 3.31Å; S635-C638 PolarHBondContact O-N 3.05Å; S635-C638 VanDerWaalsContact O-N 3.13Å; R636-C638 VanDerWaalsContact C-N 3.31Å; R636-C638 PolarHBondContact O-N 3.01Å; C638-M643 HydrophobicContact CB-CE 4.47Å; C638-A648 HydrophobicContact CB-CB 4.32Å; C638-T685 HydrophobicContact CB-CG2 3.77Å; C638-H726 PolarHBondContact O-NE2 3.26Å
639	I	88.1	Confident	89.5	Confident	28 Å²	28	40.1 Å²	40.1	14%	0.144	22%	0.223	C	C	.	.	H	α-helix	trans	-82	-42.6	-172.3	-67.9	168	0	0	0	112.4	S635 R636 C637 G641 G688	S635-I639 VanDerWaalsContact O-CG1 3.27Å; S635-I639 WeakPolarHBondContact O-CG1 3.26Å; S635-I639 PolarHBondContact O-N 2.92Å; S635-I639 VanDerWaalsContact O-N 3.14Å; R636-I639 PolarHBondContact O-N 3.21Å; R636-I639 VanDerWaalsContact O-N 3.1Å; C637-I639 VanDerWaalsContact C-N 3.32Å; I639-G641 PolarHBondContact O-N 3.32Å; I639-G688 WeakPolarHBondContact CG2-O 3.38Å
640	M	81.6	Confident	89.5	Confident	78 Å²	78	38.6 Å²	38.6	38%	0.384	21%	0.21	S	C	.	.	S	Bend	trans	-68.2	2.5	-168.4	-73.7	-176.5	74.5	0	0	116.2	P600 L601 R636 R642	P600-M640 HydrophobicContact CB-SD 3.87Å; P600-M640 VanDerWaalsContact O-SD 3.36Å; L601-M640 HydrophobicContact CD2-CE 3.66Å; L601-M640 HydrophobicContact CD2-SD 4.19Å; R636-M640 WeakPolarHBondContact O-CG 3.47Å; R636-M640 PolarHBondContact O-N 3.4Å; M640-R642 HydrophobicContact CB-CG 4.3Å; M640-R642 PolarHBondContact O-N 2.94Å
641	G	78.9	Confident	89.5	Confident	49 Å²	49	38.5 Å²	38.5	51%	0.505	21%	0.209	S	C	.	.	S	Bend	trans	67.3	6.2	178.5	0	0	0	0	0	115.6	I639 M643	I639-G641 PolarHBondContact O-N 3.32Å; G641-M643 VanDerWaalsContact C-N 3.33Å
642	R	82.9	Confident	89.4	Confident	168 Å²	168	38.2 Å²	38.2	63%	0.634	21%	0.208	S	C	*	.	S	Bend	trans	-80.1	-15.6	178.7	-63.2	-69.5	-172.3	179.4	-0.5	113.8	V606 Q613 M640	V606-R642 HydrophobicContact CG1-CB 3.78Å; V606-R642 HydrophobicContact CG1-CG 3.76Å; V606-R642 HydrophobicContact CG2-CB 4.42Å; Q613-R642 PolarHBondContact NE2-O 2.91Å; M640-R642 HydrophobicContact CB-CG 4.3Å; M640-R642 PolarHBondContact O-N 2.94Å
643	M	87.8	Confident	89.3	Confident	5 Å²	5	37 Å²	37	3%	0.025	20%	0.2	C	C	.	.	S	Bend	trans	-117.7	141.2	174.3	175.2	175.9	60.9	0	0	107.4	V617 C638 G641 L647 A648 L651 H726	V617-M643 HydrophobicContact CG2-SD 3.75Å; C638-M643 HydrophobicContact CB-CE 4.47Å; G641-M643 VanDerWaalsContact C-N 3.33Å; M643-L647 HydrophobicContact CG-CB 3.35Å; M643-L647 HydrophobicContact CG-CD1 3.92Å; M643-L647 HydrophobicContact CG-CG 4.29Å; M643-L647 HydrophobicContact SD-CB 3.65Å; M643-A648 HydrophobicContact CE-CB 3.77Å; M643-L651 HydrophobicContact CE-CD2 4.22Å; M643-H726 PolarHBondContact O-CE1 3.18Å
644	S	90.4	Very high	89.1	Confident	53 Å²	53	37.1 Å²	37.1	37%	0.371	20%	0.199	S	C	.	.			trans	-63.7	153	178.9	68.5	0	0	0	0	112.2	E646 L647 A648	S644-E646 PolarHBondContact O-N 3.47Å; S644-L647 PolarHBondContact O-N 3.23Å; S644-L647 WeakPolarHBondContact OG-CG 3.31Å; S644-L647 PolarHBondContact OG-N 3.46Å; S644-A648 PolarHBondContact O-N 2.93Å
645	S	88.8	Confident	88.9	Confident	41 Å²	41	37.1 Å²	37.1	29%	0.287	20%	0.199	S	C	.	.	H	α-helix	trans	-56.4	-33.7	175.3	57	0	0	0	0	112.4	A648 A649 H726	S645-A648 PolarHBondContact O-N 2.97Å; S645-A649 WeakPolarHBondContact O-CB 3.22Å; S645-A649 PolarHBondContact O-N 3.4Å; S645-H726 PolarHBondContact N-CE1 3.33Å; S645-H726 PolarHBondContact N-ND1 3.26Å
646	E	89	Confident	88.7	Confident	131 Å²	131	38 Å²	38	61%	0.612	20%	0.203	S	C	*	.	H	α-helix	trans	-63.6	-43.1	175.1	-67	-172	166.8	0	0	113.1	K268 S644 A649 T650	K268-E646 PolarHBondContact NZ-O 3.3Å; S644-E646 PolarHBondContact O-N 3.47Å; E646-A649 PolarHBondContact O-N 2.91Å; E646-T650 PolarHBondContact O-N 3.49Å; E646-T650 PolarHBondContact O-OG1 2.91Å
647	L	90.8	Very high	88.2	Confident	11 Å²	11	37 Å²	37	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-71.2	-38.6	178.7	-73.8	176.6	0	0	0	111.3	Q613 R614 M643 S644 A649 T650 L651	Q613-L647 HydrophobicContact CB-CD1 3.74Å; R614-L647 HydrophobicContact CB-CD2 3.79Å; R614-L647 HydrophobicContact CG-CD2 3.95Å; M643-L647 HydrophobicContact CG-CB 3.35Å; M643-L647 HydrophobicContact CG-CD1 3.92Å; M643-L647 HydrophobicContact CG-CG 4.29Å; M643-L647 HydrophobicContact SD-CB 3.65Å; S644-L647 PolarHBondContact O-N 3.23Å; S644-L647 WeakPolarHBondContact OG-CG 3.31Å; S644-L647 PolarHBondContact OG-N 3.46Å; L647-A649 VanDerWaalsContact C-N 3.3Å; L647-A649 PolarHBondContact O-N 3.31Å; L647-T650 PolarHBondContact O-N 3.48Å; L647-L651 PolarHBondContact O-N 3.09Å
648	A	91.3	Very high	87.8	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-44.2	170.5	0	0	0	0	0	111.1	C638 M643 S644 S645 T650 L651 I652 V730	C638-A648 HydrophobicContact CB-CB 4.32Å; M643-A648 HydrophobicContact CE-CB 3.77Å; S644-A648 PolarHBondContact O-N 2.93Å; S645-A648 PolarHBondContact O-N 2.97Å; A648-T650 PolarHBondContact O-N 2.92Å; A648-L651 WeakPolarHBondContact O-CB 3.43Å; A648-L651 PolarHBondContact O-N 2.86Å; A648-I652 VanDerWaalsContact O-CG1 3.32Å; A648-I652 WeakPolarHBondContact O-CG1 3.27Å; A648-I652 PolarHBondContact O-N 3.09Å; A648-V730 HydrophobicContact CB-CG2 3.71Å
649	A	89.8	Confident	87.5	Confident	11 Å²	11	37.8 Å²	37.8	9%	0.091	21%	0.207	C	C	.	.	H	α-helix	trans	-63.8	-39.3	176	0	0	0	0	0	112.6	S645 E646 L647 I652 G653 M733	S645-A649 WeakPolarHBondContact O-CB 3.22Å; S645-A649 PolarHBondContact O-N 3.4Å; E646-A649 PolarHBondContact O-N 2.91Å; L647-A649 VanDerWaalsContact C-N 3.3Å; L647-A649 PolarHBondContact O-N 3.31Å; A649-I652 PolarHBondContact O-N 3.34Å; A649-G653 PolarHBondContact O-N 3.46Å; A649-M733 HydrophobicContact CB-CB 4.15Å; A649-M733 HydrophobicContact CB-CG 3.84Å; A649-M733 HydrophobicContact CB-SD 4.16Å
650	T	90.4	Very high	87.2	Confident	49 Å²	49	38.5 Å²	38.5	30%	0.301	22%	0.215	S	C	.	.	H	α-helix	trans	-63	-41.7	173.1	-61.4	0	0	0	0	111.8	V617 E646 L647 A648 G653 I654	V617-T650 HydrophobicContact CG1-CG2 4.05Å; E646-T650 PolarHBondContact O-N 3.49Å; E646-T650 PolarHBondContact O-OG1 2.91Å; L647-T650 PolarHBondContact O-N 3.48Å; A648-T650 PolarHBondContact O-N 2.92Å; T650-G653 PolarHBondContact O-N 3.03Å; T650-I654 HydrophobicContact CG2-CD1 4.06Å; T650-I654 WeakPolarHBondContact O-CG1 3.29Å; T650-I654 PolarHBondContact O-N 3.39Å
651	L	92.5	Very high	87.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.1	-46.3	177.1	-179.3	62.8	0	0	0	111.7	V617 V620 L634 M643 L647 A648 G653 I654 L655	V617-L651 HydrophobicContact CG1-CB 3.8Å; V617-L651 HydrophobicContact CG1-CD1 4.19Å; V620-L651 HydrophobicContact CB-CD1 4.17Å; V620-L651 HydrophobicContact CG1-CD1 4.11Å; V620-L651 HydrophobicContact CG2-CD1 3.89Å; L634-L651 HydrophobicContact CB-CD2 4.21Å; L634-L651 HydrophobicContact CD1-CD1 4.48Å; L634-L651 HydrophobicContact CD2-CD1 4.32Å; L634-L651 HydrophobicContact CD2-CD2 4.02Å; M643-L651 HydrophobicContact CE-CD2 4.22Å; L647-L651 PolarHBondContact O-N 3.09Å; A648-L651 WeakPolarHBondContact O-CB 3.43Å; A648-L651 PolarHBondContact O-N 2.86Å; L651-G653 VanDerWaalsContact C-N 3.31Å; L651-G653 PolarHBondContact O-N 2.81Å; L651-I654 PolarHBondContact O-N 3.05Å; L651-L655 HydrophobicContact CG-CD1 4.4Å; L651-L655 WeakPolarHBondContact O-CG 3.25Å; L651-L655 PolarHBondContact O-N 3.35Å
652	I	91.2	Very high	86.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-44.1	175.5	-66.9	162.5	0	0	0	110.2	A648 A649 I654 L655 H656 F681 L682 V730 M733 I734	A648-I652 VanDerWaalsContact O-CG1 3.32Å; A648-I652 WeakPolarHBondContact O-CG1 3.27Å; A648-I652 PolarHBondContact O-N 3.09Å; A649-I652 PolarHBondContact O-N 3.34Å; I652-I654 PolarHBondContact O-N 2.88Å; I652-L655 PolarHBondContact O-N 2.79Å; I652-H656 WeakPolarHBondContact O-CB 3.33Å; I652-H656 PolarHBondContact O-N 2.88Å; I652-F681 HydrophobicContact CG1-CE1 4.09Å; I652-F681 HydrophobicContact CG1-CZ 4.24Å; I652-L682 HydrophobicContact CG2-CD2 4.21Å; I652-V730 HydrophobicContact CD1-CG1 3.92Å; I652-M733 HydrophobicContact CB-CG 4.15Å; I652-M733 HydrophobicContact CD1-CB 4.39Å; I652-M733 HydrophobicContact CD1-CG 4.31Å; I652-M733 HydrophobicContact CG2-CG 4Å; I652-I734 HydrophobicContact CD1-CG1 3.94Å
653	G	88.6	Confident	85.7	Confident	21 Å²	21	31.2 Å²	31.2	22%	0.216	20%	0.198	C	C	.	.	H	α-helix	trans	-58.8	-45.4	174.3	0	0	0	0	0	112.9	A649 T650 L651 L655 H656 M657	A649-G653 PolarHBondContact O-N 3.46Å; T650-G653 PolarHBondContact O-N 3.03Å; L651-G653 VanDerWaalsContact C-N 3.31Å; L651-G653 PolarHBondContact O-N 2.81Å; G653-L655 VanDerWaalsContact C-N 3.35Å; G653-L655 PolarHBondContact O-N 3.43Å; G653-H656 PolarHBondContact O-N 3.31Å; G653-M657 VanDerWaalsContact O-CG 3.26Å; G653-M657 WeakPolarHBondContact O-CG 3.29Å; G653-M657 PolarHBondContact O-N 2.78Å
654	I	88.4	Confident	84.2	Confident	21 Å²	21	40.6 Å²	40.6	11%	0.108	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-44.6	176.2	-72.4	167.9	0	0	0	111.1	V617 V620 Y621 T650 L651 I652 M657 R658	V617-I654 HydrophobicContact CG1-CD1 3.94Å; V617-I654 WeakPolarHBondContact O-CD1 3.42Å; V620-I654 HydrophobicContact CB-CG2 4.44Å; V620-I654 HydrophobicContact CG1-CG2 4.43Å; Y621-I654 HydrophobicContact CD2-CG2 4.29Å; T650-I654 HydrophobicContact CG2-CD1 4.06Å; T650-I654 WeakPolarHBondContact O-CG1 3.29Å; T650-I654 PolarHBondContact O-N 3.39Å; L651-I654 PolarHBondContact O-N 3.05Å; I652-I654 PolarHBondContact O-N 2.88Å; I654-M657 PolarHBondContact O-N 3.27Å; I654-R658 WeakPolarHBondContact O-CB 3.48Å; I654-R658 VanDerWaalsContact O-CG 3.28Å; I654-R658 WeakPolarHBondContact O-CG 3.39Å; I654-R658 PolarHBondContact O-N 2.96Å; I654-R658 VanDerWaalsContact O-N 3.08Å
655	L	89.9	Confident	82.1	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-65.9	-39.3	178.3	-68.3	175.2	0	0	0	111.9	V620 L626 L631 L651 I652 G653 R658 S659 Y678 F681	V620-L655 HydrophobicContact CG1-CD2 4.2Å; L626-L655 HydrophobicContact CD1-CD2 3.7Å; L631-L655 HydrophobicContact CD2-CD1 4.01Å; L631-L655 HydrophobicContact CD2-CD2 3.77Å; L651-L655 HydrophobicContact CG-CD1 4.4Å; L651-L655 WeakPolarHBondContact O-CG 3.25Å; L651-L655 PolarHBondContact O-N 3.35Å; I652-L655 PolarHBondContact O-N 2.79Å; G653-L655 VanDerWaalsContact C-N 3.35Å; G653-L655 PolarHBondContact O-N 3.43Å; L655-R658 CarbonylContact O-C 3.44Å; L655-R658 PolarHBondContact O-N 3.46Å; L655-S659 PolarHBondContact O-N 2.9Å; L655-Y678 HydrophobicContact CB-CE2 4.37Å; L655-F681 HydrophobicContact CD1-CD1 3.84Å; L655-F681 HydrophobicContact CD1-CD2 4.13Å; L655-F681 HydrophobicContact CD1-CE1 3.4Å; L655-F681 VanDerWaalsContact CD1-CE1 3.4Å; L655-F681 HydrophobicContact CD1-CE2 3.7Å; L655-F681 HydrophobicContact CD1-CG 4.2Å; L655-F681 HydrophobicContact CD1-CZ 3.33Å
656	H	87.9	Confident	79.9	Confident	23 Å²	23	50.2 Å²	50.2	11%	0.106	27%	0.273	C	S	.	.	H	α-helix	trans	-60.2	-46.7	173.2	-175.3	62.2	0	0	0	111.2	I652 G653 R658 S659 Y678 T740	I652-H656 WeakPolarHBondContact O-CB 3.33Å; I652-H656 PolarHBondContact O-N 2.88Å; G653-H656 PolarHBondContact O-N 3.31Å; H656-R658 PolarHBondContact O-N 3.39Å; H656-S659 WeakPolarHBondContact O-CB 3.47Å; H656-S659 PolarHBondContact O-N 3.44Å; H656-S659 PolarHBondContact O-OG 3.22Å; H656-Y678 WeakPolarHBondContact CB-OH 3.22Å; H656-Y678 AromaticContact ND1-CZ 3.85Å; H656-Y678 PolarHBondContact ND1-OH 2.93Å; H656-T740 PolarHBondContact CE1-OG1 3.19Å; H656-T740 PolarHBondContact NE2-OG1 3.14Å; H656-T740 VanDerWaalsContact NE2-OG1 3.09Å
657	M	82.1	Confident	77.6	Confident	84 Å²	84	53.4 Å²	53.4	41%	0.414	29%	0.288	S	S	.	.	H	α-helix	trans	-62.9	-23.7	176.8	-66.9	-56.1	-66.6	0	0	113.7	G653 I654 A662 W664	G653-M657 VanDerWaalsContact O-CG 3.26Å; G653-M657 WeakPolarHBondContact O-CG 3.29Å; G653-M657 PolarHBondContact O-N 2.78Å; I654-M657 PolarHBondContact O-N 3.27Å; M657-A662 HydrophobicContact SD-CB 4.44Å; M657-W664 HydrophobicContact CE-CB 4.32Å; M657-W664 HydrophobicContact CE-CD2 4.2Å; M657-W664 HydrophobicContact CE-CE3 3.37Å; M657-W664 HydrophobicContact CE-CZ3 4Å
658	R	82.6	Confident	75.3	Confident	16 Å²	16	58.9 Å²	58.9	6%	0.06	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-2.7	178.1	-71.5	-73.3	-58.4	-133.3	-15.9	113.4	Y621 L623 L626 I654 L655 H656 S672 V673	Y621-R658 HydrophobicContact CD2-CG 4.1Å; Y621-R658 HydrophobicContact CE2-CG 4.46Å; Y621-R658 PolarHBondContact O-NH1 2.87Å; L623-R658 PolarHBondContact O-NH1 2.86Å; L623-R658 PolarHBondContact O-NH2 3.26Å; L626-R658 HydrophobicContact CD1-CB 4.49Å; I654-R658 WeakPolarHBondContact O-CB 3.48Å; I654-R658 VanDerWaalsContact O-CG 3.28Å; I654-R658 WeakPolarHBondContact O-CG 3.39Å; I654-R658 PolarHBondContact O-N 2.96Å; I654-R658 VanDerWaalsContact O-N 3.08Å; L655-R658 CarbonylContact O-C 3.44Å; L655-R658 PolarHBondContact O-N 3.46Å; H656-R658 PolarHBondContact O-N 3.39Å; R658-S672 VanDerWaalsContact CZ-OG 3.23Å; R658-S672 PolarHBondContact NE-OG 2.85Å; R658-S672 PolarHBondContact NH2-OG 3.22Å; R658-V673 HydrophobicContact CB-CG2 4.13Å
659	S	85.4	Confident	73.5	Confident	4 Å²	4	62.6 Å²	62.6	3%	0.028	34%	0.339	C	S	.	.	S	Bend	trans	-87.7	164.7	175.5	78.4	0	0	0	0	111.4	L655 H656 F661 A662	L655-S659 PolarHBondContact O-N 2.9Å; H656-S659 WeakPolarHBondContact O-CB 3.47Å; H656-S659 PolarHBondContact O-N 3.44Å; H656-S659 PolarHBondContact O-OG 3.22Å; S659-F661 PolarHBondContact O-N 3Å; S659-F661 PolarHBondContact OG-N 2.99Å; S659-A662 PolarHBondContact O-N 3.32Å
660	S	81.4	Confident	71.7	Confident	43 Å²	43	69.6 Å²	69.6	30%	0.301	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.9	174.8	64.5	0	0	0	0	113.8	D675	S660-D675 WeakPolarHBondContact CB-OD1 3.2Å; S660-D675 VanDerWaalsContact OG-CG 3.32Å; S660-D675 PolarHBondContact OG-OD1 3.23Å; S660-D675 PolarHBondContact OG-OD2 3.48Å
661	F	78.9	Confident	70.1	Confident	42 Å²	42	72.9 Å²	72.9	18%	0.184	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-4	-173.7	-53.2	-68.9	0	0	0	114	S659 G663 D675 Y678 F679 I741	S659-F661 PolarHBondContact O-N 3Å; S659-F661 PolarHBondContact OG-N 2.99Å; F661-G663 PolarHBondContact O-N 3.4Å; F661-D675 HydrophobicContact CE2-CB 4.1Å; F661-D675 HydrophobicContact CZ-CB 4.1Å; F661-Y678 HydrophobicContact CD2-CD1 4Å; F661-Y678 HydrophobicContact CD2-CE1 4.06Å; F661-Y678 HydrophobicContact CE2-CD1 4.11Å; F661-F679 AromaticContact CE2-CE2 3.73Å; F661-F679 HydrophobicContact CE2-CE2 3.73Å; F661-F679 HydrophobicContact CE2-CZ 4.12Å; F661-F679 AromaticContact CZ-CE2 3.69Å; F661-F679 HydrophobicContact CZ-CE2 3.69Å; F661-F679 HydrophobicContact CZ-CZ 4.11Å; F661-I741 HydrophobicContact CB-CG1 4.2Å; F661-I741 HydrophobicContact CD1-CG2 3.86Å; F661-I741 HydrophobicContact CD2-CD1 4.43Å; F661-I741 HydrophobicContact CE1-CG2 4.2Å; F661-I741 HydrophobicContact CG-CD1 4.43Å; F661-I741 HydrophobicContact CG-CG1 4.24Å; F661-I741 HydrophobicContact CG-CG2 4.36Å
662	A	73.1	Confident	68.8	Low	15 Å²	15	74 Å²	74	12%	0.124	40%	0.398	C	S	.	.			trans	-66.6	127.2	175.3	0	0	0	0	0	110.4	M657 S659 W664	M657-A662 HydrophobicContact SD-CB 4.44Å; S659-A662 PolarHBondContact O-N 3.32Å; A662-W664 PolarHBondContact O-N 2.88Å
663	G	58.4	Low	68.3	Low	85 Å²	85	74.1 Å²	74.1	88%	0.876	40%	0.399	S	S	*	.	S	Bend	trans	-62.4	-7	177.4	0	0	0	0	0	115	F661	F661-G663 PolarHBondContact O-N 3.4Å
664	W	56.8	Low	68.2	Low	201 Å²	201	77.4 Å²	77.4	76%	0.761	41%	0.412	S	S	*	.			trans	-97.8	108.7	175.7	-94.8	-8.1	0	0	0	112.2	M657 A662 C666	M657-W664 HydrophobicContact CE-CB 4.32Å; M657-W664 HydrophobicContact CE-CD2 4.2Å; M657-W664 HydrophobicContact CE-CE3 3.37Å; M657-W664 HydrophobicContact CE-CZ3 4Å; A662-W664 PolarHBondContact O-N 2.88Å; W664-C666 PolarHBondContact O-N 3.48Å; W664-C666 VanDerWaalsContact O-N 3.07Å
665	K	46.2	Very low	68.1	Low	210 Å²	210	79.4 Å²	79.4	91%	0.913	42%	0.423	S	S	*	.			trans	-76.6	85.9	165.7	-65.2	-174.9	-179.5	-178.8	0	109.8	Q667	K665-Q667 PolarHBondContact O-N 2.76Å
666	C	42.3	Very low	68.1	Low	86 Å²	86	84.2 Å²	84.2	58%	0.581	45%	0.452	S	S	*	.			trans	-77.5	115.9	168.1	-166.1	0	0	0	0	109.2	W664 V668	W664-C666 PolarHBondContact O-N 3.48Å; W664-C666 VanDerWaalsContact O-N 3.07Å; C666-V668 PolarHBondContact O-N 2.83Å
667	Q	41.4	Very low	68.3	Low	198 Å²	198	85 Å²	85	93%	0.925	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	7.4	-173.7	-74.6	179.8	-22.6	0	0	115.8	K665	K665-Q667 PolarHBondContact O-N 2.76Å
668	V	43.3	Very low	68.7	Low	126 Å²	126	81.1 Å²	81.1	76%	0.764	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	-8	-164.3	-171.1	0	0	0	0	115	C666	C666-V668 PolarHBondContact O-N 2.83Å
669	Q	52.4	Low	69.1	Low	78 Å²	78	82 Å²	82	36%	0.364	44%	0.442	S	S	.	.	S	Bend	trans	-133.6	113.6	174.8	-75.7	177.7	-10.8	0	0	110
670	D	52.3	Low	69.5	Low	159 Å²	159	85 Å²	85	85%	0.85	46%	0.463	S	S	*	.			trans	-51.1	138.7	169.1	-70.6	-39.8	0	0	0	109.8	S672	D670-S672 PolarHBondContact O-N 3.09Å
671	N	57.1	Low	70.1	Confident	118 Å²	118	83.1 Å²	83.1	63%	0.631	45%	0.45	S	S	*	.			trans	-47.9	104.5	179.8	-69.1	-11	0	0	0	110.7
672	S	64.2	Low	70.8	Confident	22 Å²	22	81.2 Å²	81.2	15%	0.154	44%	0.442	C	S	.	.			trans	-86.9	-17.7	-168.3	66.8	0	0	0	0	114.7	R658 D670	R658-S672 VanDerWaalsContact CZ-OG 3.23Å; R658-S672 PolarHBondContact NE-OG 2.85Å; R658-S672 PolarHBondContact NH2-OG 3.22Å; D670-S672 PolarHBondContact O-N 3.09Å
673	V	81.2	Confident	71.8	Confident	3 Å²	3	82 Å²	82	2%	0.018	44%	0.442	C	S	.	.	S	Bend	trans	-107.4	125.4	179.3	-172.1	0	0	0	0	107.4	L626 L631 R658	L626-V673 HydrophobicContact CB-CG2 3.96Å; L626-V673 HydrophobicContact CD1-CG2 3.38Å; L626-V673 HydrophobicContact CG-CG2 4.26Å; L631-V673 HydrophobicContact CD1-CG1 4.08Å; R658-V673 HydrophobicContact CB-CG2 4.13Å
674	N	86.2	Confident	73.5	Confident	91 Å²	91	80.2 Å²	80.2	49%	0.487	42%	0.416	S	S	.	.			trans	-69.8	136.4	171.3	-177.6	0.3	0	0	0	109.7	V676 D677 Y678	N674-V676 PolarHBondContact O-N 3.37Å; N674-V676 PolarHBondContact OD1-N 3.38Å; N674-D677 HydrophobicContact CB-CB 4.28Å; N674-D677 WeakPolarHBondContact CB-OD2 3.43Å; N674-D677 PolarHBondContact O-N 3.36Å; N674-Y678 PolarHBondContact O-N 3.46Å
675	D	87.6	Confident	75.2	Confident	63 Å²	63	70.7 Å²	70.7	34%	0.337	38%	0.38	S	S	.	.	H	α-helix	trans	-55.3	-39.7	-177.8	-60.7	-18.1	0	0	0	112	S660 F661 D677 Y678 F679	S660-D675 WeakPolarHBondContact CB-OD1 3.2Å; S660-D675 VanDerWaalsContact OG-CG 3.32Å; S660-D675 PolarHBondContact OG-OD1 3.23Å; S660-D675 PolarHBondContact OG-OD2 3.48Å; F661-D675 HydrophobicContact CE2-CB 4.1Å; F661-D675 HydrophobicContact CZ-CB 4.1Å; D675-D677 VanDerWaalsContact C-N 3.35Å; D675-D677 PolarHBondContact O-N 2.97Å; D675-Y678 WeakPolarHBondContact O-CB 3.37Å; D675-Y678 PolarHBondContact O-N 3.03Å; D675-F679 WeakPolarHBondContact O-CD2 3.41Å; D675-F679 PolarHBondContact O-N 3.46Å
676	V	89.4	Confident	77.5	Confident	102 Å²	102	60.8 Å²	60.8	62%	0.618	34%	0.337	S	S	*	.	H	α-helix	trans	-61.2	-44.6	177.2	-179.4	0	0	0	0	111.3	N674 Y678 S680	N674-V676 PolarHBondContact O-N 3.37Å; N674-V676 PolarHBondContact OD1-N 3.38Å; V676-Y678 VanDerWaalsContact C-N 3.34Å; V676-S680 VanDerWaalsContact O-CB 3.26Å; V676-S680 WeakPolarHBondContact O-CB 3.38Å; V676-S680 PolarHBondContact O-N 3.22Å
677	D	90.9	Very high	80	Confident	40 Å²	40	57.2 Å²	57.2	21%	0.214	31%	0.312	C	S	.	.	H	α-helix	trans	-71.5	-33.2	-179.1	-64.5	-35.1	0	0	0	111.2	A628 L631 N674 D675 S680 F681	A628-D677 WeakPolarHBondContact CB-OD1 3.46Å; L631-D677 HydrophobicContact CD1-CB 3.7Å; N674-D677 HydrophobicContact CB-CB 4.28Å; N674-D677 WeakPolarHBondContact CB-OD2 3.43Å; N674-D677 PolarHBondContact O-N 3.36Å; D675-D677 VanDerWaalsContact C-N 3.35Å; D675-D677 PolarHBondContact O-N 2.97Å; D677-S680 PolarHBondContact O-N 3.5Å; D677-F681 WeakPolarHBondContact O-CB 3.41Å; D677-F681 PolarHBondContact O-N 2.89Å
678	Y	91.3	Very high	82.3	Confident	1 Å²	1	47.9 Å²	47.9	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-64.2	-50.6	173.6	179.6	-111.1	0	0	0	112	L655 H656 F661 N674 D675 V676 S680 F681 L682	L655-Y678 HydrophobicContact CB-CE2 4.37Å; H656-Y678 WeakPolarHBondContact CB-OH 3.22Å; H656-Y678 AromaticContact ND1-CZ 3.85Å; H656-Y678 PolarHBondContact ND1-OH 2.93Å; F661-Y678 HydrophobicContact CD2-CD1 4Å; F661-Y678 HydrophobicContact CD2-CE1 4.06Å; F661-Y678 HydrophobicContact CE2-CD1 4.11Å; N674-Y678 PolarHBondContact O-N 3.46Å; D675-Y678 WeakPolarHBondContact O-CB 3.37Å; D675-Y678 PolarHBondContact O-N 3.03Å; V676-Y678 VanDerWaalsContact C-N 3.34Å; Y678-S680 VanDerWaalsContact C-N 3.31Å; Y678-S680 PolarHBondContact O-N 3.2Å; Y678-F681 WeakPolarHBondContact O-CB 3.39Å; Y678-F681 PolarHBondContact O-N 3.4Å; Y678-L682 HydrophobicContact CD1-CD1 4.14Å; Y678-L682 HydrophobicContact CE1-CD1 3.5Å; Y678-L682 HydrophobicContact CE1-CG 4.28Å; Y678-L682 HydrophobicContact CE2-CD1 4.27Å; Y678-L682 HydrophobicContact CE2-CD2 4.39Å; Y678-L682 HydrophobicContact CE2-CG 4.27Å; Y678-L682 WeakPolarHBondContact O-CG 3.26Å; Y678-L682 PolarHBondContact O-N 3.04Å
679	F	91.6	Very high	84.6	Confident	34 Å²	34	42.9 Å²	42.9	15%	0.149	24%	0.237	C	C	.	.	H	α-helix	trans	-63.8	-37.4	175.6	-78.5	-68.5	0	0	0	111.9	F661 D675 F681 L682 F683 L738 I741 I750	F661-F679 AromaticContact CE2-CE2 3.73Å; F661-F679 HydrophobicContact CE2-CE2 3.73Å; F661-F679 HydrophobicContact CE2-CZ 4.12Å; F661-F679 AromaticContact CZ-CE2 3.69Å; F661-F679 HydrophobicContact CZ-CE2 3.69Å; F661-F679 HydrophobicContact CZ-CZ 4.11Å; D675-F679 WeakPolarHBondContact O-CD2 3.41Å; D675-F679 PolarHBondContact O-N 3.46Å; F679-F681 VanDerWaalsContact C-N 3.34Å; F679-F681 PolarHBondContact O-N 2.98Å; F679-L682 PolarHBondContact O-N 3.24Å; F679-F683 WeakPolarHBondContact O-CB 3.44Å; F679-F683 PolarHBondContact O-N 3.31Å; F679-L738 HydrophobicContact CD1-CD2 4.19Å; F679-L738 HydrophobicContact CE1-CD2 3.93Å; F679-I741 HydrophobicContact CE1-CD1 3.75Å; F679-I741 HydrophobicContact CZ-CD1 3.73Å; F679-I750 HydrophobicContact CB-CG2 4.44Å; F679-I750 HydrophobicContact CD1-CG2 4.44Å; F679-I750 HydrophobicContact CD2-CD1 4.38Å; F679-I750 HydrophobicContact CE2-CD1 4.19Å; F679-I750 HydrophobicContact CG-CG2 4.38Å; F679-I750 HydrophobicContact CZ-CD1 4.35Å
680	S	92.6	Very high	86.3	Confident	67 Å²	67	40.5 Å²	40.5	47%	0.469	23%	0.229	S	C	.	.	H	α-helix	trans	-60.5	-42.7	173.9	-174.1	0	0	0	0	112	V676 D677 Y678 S684	V676-S680 VanDerWaalsContact O-CB 3.26Å; V676-S680 WeakPolarHBondContact O-CB 3.38Å; V676-S680 PolarHBondContact O-N 3.22Å; D677-S680 PolarHBondContact O-N 3.5Å; Y678-S680 VanDerWaalsContact C-N 3.31Å; Y678-S680 PolarHBondContact O-N 3.2Å; S680-S684 VanDerWaalsContact O-CB 3.29Å; S680-S684 WeakPolarHBondContact O-CB 3.17Å; S680-S684 PolarHBondContact O-N 3.21Å; S680-S684 PolarHBondContact O-OG 2.93Å
681	F	94.4	Very high	88	Confident	5 Å²	5	41.3 Å²	41.3	2%	0.022	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-50.4	174	168.2	-93	0	0	0	112.1	L631 L634 I652 L655 D677 Y678 F679 F683 S684 T685	L631-F681 HydrophobicContact CB-CB 4.34Å; L631-F681 HydrophobicContact CB-CD2 4.33Å; L631-F681 HydrophobicContact CD2-CD2 4.31Å; L631-F681 HydrophobicContact CD2-CG 4.44Å; L631-F681 WeakPolarHBondContact O-CD2 3.45Å; L634-F681 HydrophobicContact CB-CE2 4.08Å; I652-F681 HydrophobicContact CG1-CE1 4.09Å; I652-F681 HydrophobicContact CG1-CZ 4.24Å; L655-F681 HydrophobicContact CD1-CD1 3.84Å; L655-F681 HydrophobicContact CD1-CD2 4.13Å; L655-F681 HydrophobicContact CD1-CE1 3.4Å; L655-F681 VanDerWaalsContact CD1-CE1 3.4Å; L655-F681 HydrophobicContact CD1-CE2 3.7Å; L655-F681 HydrophobicContact CD1-CG 4.2Å; L655-F681 HydrophobicContact CD1-CZ 3.33Å; D677-F681 WeakPolarHBondContact O-CB 3.41Å; D677-F681 PolarHBondContact O-N 2.89Å; Y678-F681 WeakPolarHBondContact O-CB 3.39Å; Y678-F681 PolarHBondContact O-N 3.4Å; F679-F681 VanDerWaalsContact C-N 3.34Å; F679-F681 PolarHBondContact O-N 2.98Å; F681-F683 VanDerWaalsContact C-N 3.35Å; F681-F683 PolarHBondContact O-N 3.32Å; F681-S684 PolarHBondContact O-N 3.43Å; F681-T685 WeakPolarHBondContact O-CB 3.35Å; F681-T685 PolarHBondContact O-N 3.34Å; F681-T685 PolarHBondContact O-OG1 3.37Å
682	L	93.8	Very high	89.4	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-44.7	179.7	-69.1	-177.2	0	0	0	111.3	I652 Y678 F679 T685 L686 I734 L738	I652-L682 HydrophobicContact CG2-CD2 4.21Å; Y678-L682 HydrophobicContact CD1-CD1 4.14Å; Y678-L682 HydrophobicContact CE1-CD1 3.5Å; Y678-L682 HydrophobicContact CE1-CG 4.28Å; Y678-L682 HydrophobicContact CE2-CD1 4.27Å; Y678-L682 HydrophobicContact CE2-CD2 4.39Å; Y678-L682 HydrophobicContact CE2-CG 4.27Å; Y678-L682 WeakPolarHBondContact O-CG 3.26Å; Y678-L682 PolarHBondContact O-N 3.04Å; F679-L682 PolarHBondContact O-N 3.24Å; L682-T685 PolarHBondContact O-N 2.93Å; L682-L686 VanDerWaalsContact O-CB 3.24Å; L682-L686 WeakPolarHBondContact O-CB 3.21Å; L682-L686 PolarHBondContact O-N 3.11Å; L682-I734 HydrophobicContact CB-CG2 4.24Å; L682-I734 HydrophobicContact CD2-CG1 4.35Å; L682-I734 HydrophobicContact CD2-CG2 4.28Å; L682-L738 HydrophobicContact CD1-CD2 3.5Å; L682-L738 VanDerWaalsContact CD1-CD2 3.5Å; L682-L738 HydrophobicContact CD1-CG 4.01Å
683	F	93.9	Very high	90.5	Very high	31 Å²	31	45.5 Å²	45.5	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-64.5	-45.6	179.3	-175.4	-103.2	0	0	0	112.2	F679 F681 T685 L686 I687 L751 G754 I755 Y758	F679-F683 WeakPolarHBondContact O-CB 3.44Å; F679-F683 PolarHBondContact O-N 3.31Å; F681-F683 VanDerWaalsContact C-N 3.35Å; F681-F683 PolarHBondContact O-N 3.32Å; F683-T685 VanDerWaalsContact C-N 3.29Å; F683-T685 PolarHBondContact O-N 2.95Å; F683-L686 PolarHBondContact O-N 2.89Å; F683-I687 HydrophobicContact CD1-CD1 3.78Å; F683-I687 HydrophobicContact CE1-CD1 3.21Å; F683-I687 HydrophobicContact CE1-CG1 4.27Å; F683-I687 HydrophobicContact CE2-CD1 4.26Å; F683-I687 HydrophobicContact CZ-CD1 3.5Å; F683-I687 VanDerWaalsContact CZ-CD1 3.5Å; F683-I687 HydrophobicContact CZ-CG1 4.25Å; F683-I687 WeakPolarHBondContact O-CG1 3.41Å; F683-I687 PolarHBondContact O-N 3.5Å; F683-L751 HydrophobicContact CD2-CD1 3.82Å; F683-L751 HydrophobicContact CE2-CD1 4.08Å; F683-G754 WeakPolarHBondContact CZ-O 3.39Å; F683-I755 HydrophobicContact CE2-CG1 4.06Å; F683-Y758 AromaticContact CE1-CD2 3.54Å; F683-Y758 HydrophobicContact CE1-CD2 3.54Å; F683-Y758 HydrophobicContact CE1-CE2 4.23Å; F683-Y758 HydrophobicContact CE1-CG 4.34Å; F683-Y758 HydrophobicContact CZ-CD2 4.03Å
684	S	93.7	Very high	90.9	Very high	48 Å²	48	46 Å²	46	34%	0.336	24%	0.236	S	C	.	.	H	α-helix	trans	-61.9	-39.8	177.4	-57.9	0	0	0	0	111.5	S680 F681 G688	S680-S684 VanDerWaalsContact O-CB 3.29Å; S680-S684 WeakPolarHBondContact O-CB 3.17Å; S680-S684 PolarHBondContact O-N 3.21Å; S680-S684 PolarHBondContact O-OG 2.93Å; F681-S684 PolarHBondContact O-N 3.43Å; S684-G688 PolarHBondContact O-N 3.32Å
685	T	94.2	Very high	91.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-73	-32.6	178.8	-46.5	0	0	0	0	112.2	S635 C638 F681 L682 F683 G688 V730 I734	S635-T685 WeakPolarHBondContact CB-OG1 3.43Å; S635-T685 PolarHBondContact OG-N 3.42Å; S635-T685 PolarHBondContact OG-OG1 3.41Å; C638-T685 HydrophobicContact CB-CG2 3.77Å; F681-T685 WeakPolarHBondContact O-CB 3.35Å; F681-T685 PolarHBondContact O-N 3.34Å; F681-T685 PolarHBondContact O-OG1 3.37Å; L682-T685 PolarHBondContact O-N 2.93Å; F683-T685 VanDerWaalsContact C-N 3.29Å; F683-T685 PolarHBondContact O-N 2.95Å; T685-G688 PolarHBondContact O-N 3.45Å; T685-V730 HydrophobicContact CG2-CG1 3.64Å; T685-I734 HydrophobicContact CG2-CD1 3.8Å
686	L	94.4	Very high	91.1	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-69.3	-33.7	176.1	179.6	67.6	0	0	0	112.8	L682 F683 G688 H727 T731 I734 L751 A776	L682-L686 VanDerWaalsContact O-CB 3.24Å; L682-L686 WeakPolarHBondContact O-CB 3.21Å; L682-L686 PolarHBondContact O-N 3.11Å; F683-L686 PolarHBondContact O-N 2.89Å; L686-G688 VanDerWaalsContact C-N 3.3Å; L686-H727 PolarHBondContact O-NE2 3.49Å; L686-H727 VanDerWaalsContact O-NE2 3.09Å; L686-T731 HydrophobicContact CD1-CG2 3.68Å; L686-I734 HydrophobicContact CB-CD1 4.09Å; L686-I734 HydrophobicContact CB-CG2 4.35Å; L686-I734 HydrophobicContact CD1-CG2 4.37Å; L686-L751 HydrophobicContact CD2-CD1 3.7Å; L686-A776 HydrophobicContact CD1-CB 4.07Å; L686-A776 HydrophobicContact CD2-CB 3.95Å
687	I	93.4	Very high	91	Very high	12 Å²	12	42.2 Å²	42.2	6%	0.062	22%	0.221	C	C	.	.	H	α-helix	trans	-68.8	-35.9	175.5	-71.6	172.6	0	0	0	110.2	F683 F689 L694 H727 L759 T769	F683-I687 HydrophobicContact CD1-CD1 3.78Å; F683-I687 HydrophobicContact CE1-CD1 3.21Å; F683-I687 HydrophobicContact CE1-CG1 4.27Å; F683-I687 HydrophobicContact CE2-CD1 4.26Å; F683-I687 HydrophobicContact CZ-CD1 3.5Å; F683-I687 VanDerWaalsContact CZ-CD1 3.5Å; F683-I687 HydrophobicContact CZ-CG1 4.25Å; F683-I687 WeakPolarHBondContact O-CG1 3.41Å; F683-I687 PolarHBondContact O-N 3.5Å; I687-F689 HydrophobicContact CG2-CB 4.32Å; I687-F689 WeakPolarHBondContact CG2-O 3.31Å; I687-F689 PolarHBondContact O-N 3.27Å; I687-L694 HydrophobicContact CG2-CD1 3.81Å; I687-H727 PolarHBondContact O-CE1 3.44Å; I687-H727 VanDerWaalsContact O-CE1 3.31Å; I687-L759 HydrophobicContact CD1-CD2 4.4Å; I687-L759 HydrophobicContact CG1-CD1 4.41Å; I687-T769 HydrophobicContact CG2-CG2 4.06Å; I687-T769 WeakPolarHBondContact O-CB 3.47Å; I687-T769 WeakPolarHBondContact O-CG2 3.46Å; I687-T769 PolarHBondContact O-OG1 3.38Å
688	G	90.6	Very high	90.9	Very high	2 Å²	2	43.2 Å²	43.2	2%	0.021	23%	0.225	C	C	.	.			trans	72.9	6.2	179.2	0	0	0	0	0	115	I639 S684 T685 L686 H727	I639-G688 WeakPolarHBondContact CG2-O 3.38Å; S684-G688 PolarHBondContact O-N 3.32Å; T685-G688 PolarHBondContact O-N 3.45Å; L686-G688 VanDerWaalsContact C-N 3.3Å; G688-H727 VanDerWaalsContact CA-CE1 3.48Å; G688-H727 WeakPolarHBondContact CA-CE1 3.42Å; G688-H727 WeakPolarHBondContact CA-NE2 3.27Å
689	F	90.3	Very high	90.4	Very high	20 Å²	20	46.1 Å²	46.1	9%	0.088	26%	0.255	C	S	.	.	S	Bend	trans	-141.4	139.7	178.5	-74.6	-98.1	0	0	0	109.3	I687 E693 L694 L697 T719 P766 T769	I687-F689 HydrophobicContact CG2-CB 4.32Å; I687-F689 WeakPolarHBondContact CG2-O 3.31Å; I687-F689 PolarHBondContact O-N 3.27Å; F689-E693 HydrophobicContact CB-CB 4.49Å; F689-E693 HydrophobicContact CD1-CB 4.08Å; F689-L694 HydrophobicContact CB-CD1 4.49Å; F689-L694 HydrophobicContact CB-CD2 3.8Å; F689-L694 HydrophobicContact CB-CG 3.81Å; F689-L694 HydrophobicContact CG-CD2 4.32Å; F689-L697 HydrophobicContact CD1-CD1 4.42Å; F689-L697 HydrophobicContact CE1-CD1 4.43Å; F689-T719 HydrophobicContact CE2-CG2 4.22Å; F689-T719 HydrophobicContact CZ-CG2 3.85Å; F689-P766 HydrophobicContact CD1-CG 4.22Å; F689-P766 HydrophobicContact CD2-CB 3.96Å; F689-P766 HydrophobicContact CD2-CG 3.57Å; F689-P766 HydrophobicContact CE1-CG 4.07Å; F689-P766 HydrophobicContact CE2-CB 3.37Å; F689-P766 HydrophobicContact CE2-CG 3.41Å; F689-P766 VanDerWaalsContact CE2-CG 3.41Å; F689-P766 HydrophobicContact CG-CG 3.99Å; F689-P766 HydrophobicContact CZ-CB 3.74Å; F689-P766 HydrophobicContact CZ-CG 3.67Å; F689-T769 WeakPolarHBondContact CD2-OG1 3.36Å
690	S	89	Confident	89.8	Confident	28 Å²	28	46.8 Å²	46.8	20%	0.196	26%	0.26	C	S	.	.			trans	-70	160.2	172.9	68.9	0	0	0	0	111.1	E692 E693 L694	S690-E692 PolarHBondContact O-N 3.47Å; S690-E693 VanDerWaalsContact CB-OE2 3.29Å; S690-E693 WeakPolarHBondContact CB-OE2 3.49Å; S690-E693 PolarHBondContact N-OE2 2.83Å; S690-E693 PolarHBondContact O-N 3.13Å; S690-E693 WeakPolarHBondContact OG-CB 3.4Å; S690-E693 VanDerWaalsContact OG-CG 3.23Å; S690-E693 WeakPolarHBondContact OG-CG 3.5Å; S690-E693 PolarHBondContact OG-N 3.3Å; S690-E693 PolarHBondContact OG-OE2 3.27Å; S690-L694 PolarHBondContact O-N 3.35Å
691	R	87.3	Confident	88.2	Confident	177 Å²	177	54.9 Å²	54.9	67%	0.668	28%	0.28	S	S	*	.	H	α-helix	trans	-57.4	-39.8	176	-178	179.8	-68.9	177.5	0.2	112	L694 T695	R691-L694 PolarHBondContact O-N 3.26Å; R691-T695 WeakPolarHBondContact O-CG2 3.32Å; R691-T695 PolarHBondContact O-N 3.5Å; R691-T695 PolarHBondContact O-OG1 3.32Å; R691-T695 VanDerWaalsContact O-OG1 3.09Å
692	E	86.5	Confident	86.4	Confident	145 Å²	145	58.5 Å²	58.5	68%	0.678	32%	0.319	S	S	*	.	H	α-helix	trans	-66.9	-39.5	-179.9	-67	168.7	-164.7	0	0	111.6	S690 T695 S696	S690-E692 PolarHBondContact O-N 3.47Å; E692-T695 WeakPolarHBondContact CA-OG1 3.32Å; E692-T695 PolarHBondContact O-OG1 3.49Å; E692-S696 WeakPolarHBondContact O-CB 3.48Å; E692-S696 PolarHBondContact O-N 3.27Å
693	E	88.4	Confident	84.5	Confident	82 Å²	82	65.1 Å²	65.1	38%	0.383	35%	0.347	S	S	.	.	H	α-helix	trans	-66	-48.2	174.5	-71.3	159.6	151.4	0	0	110.6	F689 S690 T695 S696 L697	F689-E693 HydrophobicContact CB-CB 4.49Å; F689-E693 HydrophobicContact CD1-CB 4.08Å; S690-E693 VanDerWaalsContact CB-OE2 3.29Å; S690-E693 WeakPolarHBondContact CB-OE2 3.49Å; S690-E693 PolarHBondContact N-OE2 2.83Å; S690-E693 PolarHBondContact O-N 3.13Å; S690-E693 WeakPolarHBondContact OG-CB 3.4Å; S690-E693 VanDerWaalsContact OG-CG 3.23Å; S690-E693 WeakPolarHBondContact OG-CG 3.5Å; S690-E693 PolarHBondContact OG-N 3.3Å; S690-E693 PolarHBondContact OG-OE2 3.27Å; E693-T695 VanDerWaalsContact C-N 3.33Å; E693-T695 PolarHBondContact O-N 3.15Å; E693-S696 PolarHBondContact O-N 3.46Å; E693-S696 VanDerWaalsContact O-N 3.13Å; E693-S696 PolarHBondContact O-OG 2.95Å; E693-L697 WeakPolarHBondContact O-CG 3.33Å; E693-L697 PolarHBondContact O-N 3.24Å
694	L	89.4	Confident	82.8	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-60.9	-38.6	179.1	-72.1	178.7	0	0	0	113.2	I687 F689 S690 R691 L697 Q698 L759 L762 P766	I687-L694 HydrophobicContact CG2-CD1 3.81Å; F689-L694 HydrophobicContact CB-CD1 4.49Å; F689-L694 HydrophobicContact CB-CD2 3.8Å; F689-L694 HydrophobicContact CB-CG 3.81Å; F689-L694 HydrophobicContact CG-CD2 4.32Å; S690-L694 PolarHBondContact O-N 3.35Å; R691-L694 PolarHBondContact O-N 3.26Å; L694-L697 HydrophobicContact CD2-CD1 4.47Å; L694-L697 PolarHBondContact O-N 3.02Å; L694-Q698 WeakPolarHBondContact O-CG 3.32Å; L694-Q698 PolarHBondContact O-N 2.98Å; L694-Q698 PolarHBondContact O-NE2 3.49Å; L694-L759 HydrophobicContact CD1-CD2 4.23Å; L694-L762 HydrophobicContact CB-CD1 4.37Å; L694-L762 HydrophobicContact CD1-CD1 4.21Å; L694-P766 HydrophobicContact CD2-CG 4.23Å
695	T	89.4	Confident	81.7	Confident	89 Å²	89	71.6 Å²	71.6	55%	0.546	38%	0.383	S	S	.	.	H	α-helix	trans	-69.3	-38.7	175.1	52.5	0	0	0	0	111.6	R691 E692 E693 L697 Q698	R691-T695 WeakPolarHBondContact O-CG2 3.32Å; R691-T695 PolarHBondContact O-N 3.5Å; R691-T695 PolarHBondContact O-OG1 3.32Å; R691-T695 VanDerWaalsContact O-OG1 3.09Å; E692-T695 WeakPolarHBondContact CA-OG1 3.32Å; E692-T695 PolarHBondContact O-OG1 3.49Å; E693-T695 VanDerWaalsContact C-N 3.33Å; E693-T695 PolarHBondContact O-N 3.15Å; T695-L697 VanDerWaalsContact C-N 3.3Å; T695-L697 PolarHBondContact O-N 2.92Å; T695-Q698 PolarHBondContact O-N 2.69Å
696	S	88.3	Confident	81.2	Confident	75 Å²	75	73 Å²	73	52%	0.524	39%	0.39	S	S	.	.	H	α-helix	trans	-62.3	-37.7	175.6	78.8	0	0	0	0	112.3	E692 E693 Q698 G699	E692-S696 WeakPolarHBondContact O-CB 3.48Å; E692-S696 PolarHBondContact O-N 3.27Å; E693-S696 PolarHBondContact O-N 3.46Å; E693-S696 VanDerWaalsContact O-N 3.13Å; E693-S696 PolarHBondContact O-OG 2.95Å; S696-Q698 VanDerWaalsContact C-N 3.27Å; S696-Q698 PolarHBondContact O-N 3.31Å; S696-G699 PolarHBondContact O-N 3Å
697	L	88.1	Confident	80.6	Confident	12 Å²	12	73.6 Å²	73.6	6%	0.063	39%	0.394	C	S	.	.	H	α-helix	trans	-64.5	-29	178.4	-70.1	178.5	0	0	0	112.7	F689 E693 L694 T695 G699 I700 Y717 V764 P766	F689-L697 HydrophobicContact CD1-CD1 4.42Å; F689-L697 HydrophobicContact CE1-CD1 4.43Å; E693-L697 WeakPolarHBondContact O-CG 3.33Å; E693-L697 PolarHBondContact O-N 3.24Å; L694-L697 HydrophobicContact CD2-CD1 4.47Å; L694-L697 PolarHBondContact O-N 3.02Å; T695-L697 VanDerWaalsContact C-N 3.3Å; T695-L697 PolarHBondContact O-N 2.92Å; L697-G699 PolarHBondContact O-N 2.93Å; L697-I700 HydrophobicContact CD2-CD1 3.59Å; L697-I700 PolarHBondContact O-N 2.89Å; L697-Y717 HydrophobicContact CD1-CD1 4.47Å; L697-Y717 HydrophobicContact CD1-CG 4.43Å; L697-Y717 HydrophobicContact CD2-CD1 4.47Å; L697-Y717 HydrophobicContact CD2-CD2 3.86Å; L697-Y717 HydrophobicContact CD2-CE2 4Å; L697-Y717 HydrophobicContact CD2-CG 4.1Å; L697-V764 HydrophobicContact CB-CG1 4.43Å; L697-P766 HydrophobicContact CD1-CG 3.81Å
698	Q	89.2	Confident	80.1	Confident	61 Å²	61	78.5 Å²	78.5	29%	0.285	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.8	178.1	-54.9	-46.1	-59.5	0	0	112.9	L694 T695 S696 L762 V764	L694-Q698 WeakPolarHBondContact O-CG 3.32Å; L694-Q698 PolarHBondContact O-N 2.98Å; L694-Q698 PolarHBondContact O-NE2 3.49Å; T695-Q698 PolarHBondContact O-N 2.69Å; S696-Q698 VanDerWaalsContact C-N 3.27Å; S696-Q698 PolarHBondContact O-N 3.31Å; Q698-L762 HydrophobicContact CG-CD2 4.12Å; Q698-V764 PolarHBondContact NE2-O 2.79Å
699	G	80.4	Confident	79.7	Confident	62 Å²	62	79 Å²	79	64%	0.639	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-8.7	-179.8	0	0	0	0	0	114.8	S696 L697 R701	S696-G699 PolarHBondContact O-N 3Å; L697-G699 PolarHBondContact O-N 2.93Å; G699-R701 PolarHBondContact O-N 3.33Å
700	I	77.4	Confident	79.1	Confident	49 Å²	49	84 Å²	84	25%	0.251	44%	0.443	S	S	.	.			trans	-78	118.3	-174.2	-56.4	178.2	0	0	0	110	L697 K703 I706	L697-I700 HydrophobicContact CD2-CD1 3.59Å; L697-I700 PolarHBondContact O-N 2.89Å; I700-K703 HydrophobicContact CG2-CD 4.31Å; I700-I706 HydrophobicContact CB-CD1 4.16Å; I700-I706 HydrophobicContact CG2-CD1 3.71Å
701	R	59.5	Low	78.6	Confident	237 Å²	237	84 Å²	84	89%	0.894	44%	0.441	S	S	*	.			trans	-113.5	126.7	170.1	-63.8	-167.8	-170.4	-142.2	4	110.4	G699	G699-R701 PolarHBondContact O-N 3.33Å
702	G	56.8	Low	78.4	Confident	81 Å²	81	76 Å²	76	84%	0.835	41%	0.413	S	S	*	.	S	Bend	trans	69.3	63.9	162.2	0	0	0	0	0	117.6
703	K	54.9	Low	78.3	Confident	140 Å²	140	73.5 Å²	73.5	61%	0.609	41%	0.409	S	S	*	.			trans	-132.6	157.9	173.9	-76.8	-171.6	179.4	-176.7	0	111.3	I700 H705 I706	I700-K703 HydrophobicContact CG2-CD 4.31Å; K703-H705 PolarHBondContact O-N 2.8Å; K703-I706 PolarHBondContact O-N 3.33Å
704	P	57.5	Low	78.3	Confident	116 Å²	116	69.9 Å²	69.9	75%	0.753	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-11.1	-175.1	25.9	-35.9	0	0	0	115.4
705	H	71.6	Confident	78.3	Confident	99 Å²	99	74.3 Å²	74.3	46%	0.458	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	11.5	-176.9	-57.1	-72.5	0	0	0	114.3	K703 Y717 L718	K703-H705 PolarHBondContact O-N 2.8Å; H705-Y717 HydrophobicContact CB-CE2 4.4Å; H705-L718 WeakPolarHBondContact O-CG 3.36Å; H705-L718 PolarHBondContact O-N 3.17Å
706	I	82.2	Confident	78.3	Confident	29 Å²	29	70.1 Å²	70.1	15%	0.149	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117.5	177.5	-61.2	175.5	0	0	0	109.4	I700 K703 R715 L716	I700-I706 HydrophobicContact CB-CD1 4.16Å; I700-I706 HydrophobicContact CG2-CD1 3.71Å; K703-I706 PolarHBondContact O-N 3.33Å; I706-R715 HydrophobicContact CG2-CB 4.05Å; I706-L716 CarbonylContact C-O 3.58Å; I706-L716 VanDerWaalsContact CA-O 3.26Å; I706-L716 WeakPolarHBondContact CA-O 3.42Å
707	S	82.1	Confident	78.4	Confident	15 Å²	15	69.5 Å²	69.5	11%	0.105	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.2	166.8	-179.2	0	0	0	0	109.1	L716	S707-L716 PolarHBondContact N-O 2.98Å; S707-L716 PolarHBondContact O-N 3.3Å
708	Q	84.1	Confident	78.4	Confident	115 Å²	115	70.6 Å²	70.6	54%	0.537	38%	0.375	S	S	.	.			trans	-136	145.9	-178.3	63.3	179.2	4.2	0	0	109.9	R715 Y804	Q708-R715 HydrophobicContact CB-CG 4.11Å; Q708-Y804 WeakPolarHBondContact O-CE1 3.26Å
709	T	81.8	Confident	78.3	Confident	13 Å²	13	68 Å²	68	8%	0.08	36%	0.363	C	S	.	.			trans	-133.3	148.1	173.7	163.9	0	0	0	0	107.7	L711 Y800 Y804 E854	T709-L711 PolarHBondContact O-N 2.82Å; T709-L711 PolarHBondContact OG1-N 3.2Å; T709-L711 VanDerWaalsContact OG1-N 3.12Å; T709-Y800 HydrophobicContact CG2-CD1 3.98Å; T709-Y800 HydrophobicContact CG2-CE1 3.58Å; T709-Y800 WeakPolarHBondContact OG1-CE1 3.33Å; T709-Y804 HydrophobicContact CG2-CD1 4.26Å; T709-Y804 HydrophobicContact CG2-CG 4.29Å; T709-E854 WeakPolarHBondContact CA-OE1 3.43Å; T709-E854 PolarHBondContact OG1-OE2 3.41Å
710	Q	78.2	Confident	78.7	Confident	125 Å²	125	70.4 Å²	70.4	58%	0.584	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.2	176.2	-59.8	-169.5	10.2	0	0	113.2	E854	Q710-E854 PolarHBondContact N-OE1 3.21Å
711	L	77.4	Confident	79.1	Confident	28 Å²	28	69.9 Å²	69.9	15%	0.147	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-9	-175.1	-64.5	170.6	0	0	0	113.5	T709 Y800 L845 V858	T709-L711 PolarHBondContact O-N 2.82Å; T709-L711 PolarHBondContact OG1-N 3.2Å; T709-L711 VanDerWaalsContact OG1-N 3.12Å; L711-Y800 HydrophobicContact CB-CD1 4.39Å; L711-Y800 HydrophobicContact CB-CE1 3.54Å; L711-Y800 HydrophobicContact CD1-CE1 4.48Å; L711-Y800 VanDerWaalsContact CD1-OH 3.22Å; L711-Y800 WeakPolarHBondContact CD1-OH 3.13Å; L711-L845 HydrophobicContact CD1-CD2 4.45Å; L711-V858 HydrophobicContact CD1-CG2 3.79Å
712	S	83.2	Confident	80.4	Confident	10 Å²	10	65.1 Å²	65.1	7%	0.07	35%	0.351	C	S	.	.			trans	-129.6	140.6	173.8	166.4	0	0	0	0	112.1	V714 S797 S801	S712-V714 PolarHBondContact O-N 3.1Å; S712-V714 PolarHBondContact OG-N 3.26Å; S712-V714 VanDerWaalsContact OG-N 3.16Å; S712-S797 WeakPolarHBondContact OG-CB 3.29Å; S712-S797 PolarHBondContact OG-O 3.2Å; S712-S797 VanDerWaalsContact OG-O 3.07Å; S712-S801 VanDerWaalsContact CB-OG 3.25Å; S712-S801 WeakPolarHBondContact CB-OG 3.27Å; S712-S801 PolarHBondContact OG-OG 3.46Å
713	P	83.9	Confident	82	Confident	92 Å²	92	64.6 Å²	64.6	60%	0.597	33%	0.326	S	S	*	.	S	Bend	trans	-70.6	-15.7	175.3	30	-35.4	0	0	0	113.4
714	V	88.2	Confident	83.7	Confident	6 Å²	6	58 Å²	58	4%	0.036	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-92.2	121.1	-177.6	177	0	0	0	0	110.4	S712 L716 I765 F794 S801	S712-V714 PolarHBondContact O-N 3.1Å; S712-V714 PolarHBondContact OG-N 3.26Å; S712-V714 VanDerWaalsContact OG-N 3.16Å; V714-L716 HydrophobicContact CG1-CD2 4.33Å; V714-I765 HydrophobicContact CG1-CB 4.18Å; V714-I765 HydrophobicContact CG1-CD1 4.06Å; V714-I765 HydrophobicContact CG1-CG1 4.2Å; V714-F794 HydrophobicContact CG2-CE2 4.46Å; V714-S801 WeakPolarHBondContact O-CB 3.43Å; V714-S801 PolarHBondContact O-OG 2.91Å
715	R	89.8	Confident	85.3	Confident	107 Å²	107	55 Å²	55	40%	0.404	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	137.6	171.7	-59.1	-179.2	-174.9	155.3	1	109.9	I706 Q708 V763 V764 I765	I706-R715 HydrophobicContact CG2-CB 4.05Å; Q708-R715 HydrophobicContact CB-CG 4.11Å; R715-V763 HydrophobicContact CG-CG1 4.43Å; R715-V763 PolarHBondContact N-O 2.84Å; R715-V764 HydrophobicContact CB-CG2 4.32Å; R715-V764 CarbonylContact O-C 3.38Å; R715-V764 WeakPolarHBondContact O-CA 3.47Å; R715-I765 PolarHBondContact O-N 2.91Å
716	L	89.1	Confident	86.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.8	-176.6	-65.6	178.1	0	0	0	111.6	I706 S707 V714 L718 I765 A770 S801 L802 F805	I706-L716 CarbonylContact C-O 3.58Å; I706-L716 VanDerWaalsContact CA-O 3.26Å; I706-L716 WeakPolarHBondContact CA-O 3.42Å; S707-L716 PolarHBondContact N-O 2.98Å; S707-L716 PolarHBondContact O-N 3.3Å; V714-L716 HydrophobicContact CG1-CD2 4.33Å; L716-L718 HydrophobicContact CB-CD2 4.45Å; L716-I765 CarbonylContact C-O 3.57Å; L716-I765 VanDerWaalsContact CA-O 3.27Å; L716-I765 WeakPolarHBondContact CA-O 3.33Å; L716-A770 HydrophobicContact CD2-CB 4.13Å; L716-S801 VanDerWaalsContact CD1-C 3.44Å; L716-S801 VanDerWaalsContact CD1-O 3.29Å; L716-S801 WeakPolarHBondContact CD1-O 3.47Å; L716-L802 HydrophobicContact CD1-CB 4.43Å; L716-L802 HydrophobicContact CD1-CD2 3.66Å; L716-L802 HydrophobicContact CD1-CG 3.99Å; L716-L802 HydrophobicContact CD2-CD2 4.28Å; L716-F805 HydrophobicContact CD1-CB 4.02Å
717	Y	90.1	Very high	86.7	Confident	62 Å²	62	50.8 Å²	50.8	24%	0.243	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	122.5	164.4	175.4	-94.8	0	0	0	108.9	L697 H705 T719 I765 P766 D767	L697-Y717 HydrophobicContact CD1-CD1 4.47Å; L697-Y717 HydrophobicContact CD1-CG 4.43Å; L697-Y717 HydrophobicContact CD2-CD1 4.47Å; L697-Y717 HydrophobicContact CD2-CD2 3.86Å; L697-Y717 HydrophobicContact CD2-CE2 4Å; L697-Y717 HydrophobicContact CD2-CG 4.1Å; H705-Y717 HydrophobicContact CB-CE2 4.4Å; Y717-T719 HydrophobicContact CD1-CG2 4.29Å; Y717-T719 HydrophobicContact CE1-CG2 4.34Å; Y717-T719 PolarHBondContact O-N 3.36Å; Y717-I765 PolarHBondContact N-O 2.69Å; Y717-P766 HydrophobicContact CD1-CB 4.36Å; Y717-P766 CarbonylContact O-C 3.59Å; Y717-P766 WeakPolarHBondContact O-CA 3.3Å; Y717-D767 PolarHBondContact O-N 3.43Å
718	L	88.2	Confident	87.2	Confident	36 Å²	36	50.8 Å²	50.8	19%	0.188	25%	0.253	C	S	.	.			trans	-83.8	115.6	-174.8	-56.4	-177.8	0	0	0	110.4	H705 L716 D767 F805	H705-L718 WeakPolarHBondContact O-CG 3.36Å; H705-L718 PolarHBondContact O-N 3.17Å; L716-L718 HydrophobicContact CB-CD2 4.45Å; L718-D767 WeakPolarHBondContact CA-OD2 3.43Å; L718-F805 HydrophobicContact CD1-CD2 4.21Å; L718-F805 HydrophobicContact CD1-CE2 3.59Å; L718-F805 HydrophobicContact CD1-CZ 4.3Å; L718-F805 HydrophobicContact CD2-CD1 4.27Å; L718-F805 HydrophobicContact CD2-CD2 3.58Å; L718-F805 HydrophobicContact CD2-CE1 4.04Å; L718-F805 HydrophobicContact CD2-CE2 3.31Å; L718-F805 HydrophobicContact CD2-CG 4.05Å; L718-F805 HydrophobicContact CD2-CZ 3.56Å; L718-F805 HydrophobicContact CG-CE2 4.07Å; L718-F805 HydrophobicContact CG-CZ 4.48Å
719	T	88.6	Confident	87.6	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.037	24%	0.24	C	C	.	.			trans	-82.4	147.8	174.9	53.9	0	0	0	0	112.3	F689 Y717 P766 D767 K819	F689-T719 HydrophobicContact CE2-CG2 4.22Å; F689-T719 HydrophobicContact CZ-CG2 3.85Å; Y717-T719 HydrophobicContact CD1-CG2 4.29Å; Y717-T719 HydrophobicContact CE1-CG2 4.34Å; Y717-T719 PolarHBondContact O-N 3.36Å; T719-P766 HydrophobicContact CG2-CB 4.17Å; T719-D767 WeakPolarHBondContact CB-OD1 3.5Å; T719-D767 WeakPolarHBondContact CG2-OD1 3.49Å; T719-D767 PolarHBondContact N-OD1 3.48Å; T719-D767 PolarHBondContact N-OD2 3.38Å; T719-D767 PolarHBondContact OG1-OD1 3.4Å; T719-K819 PolarHBondContact O-NZ 3.08Å
720	D	87.7	Confident	88.1	Confident	113 Å²	113	46.4 Å²	46.4	60%	0.604	24%	0.238	S	C	*	.			trans	-61.1	151.6	174	-61.5	-31.7	0	0	0	110.8	D722 Q723 F724	D720-D722 PolarHBondContact O-N 3.01Å; D720-Q723 HydrophobicContact CB-CB 4.44Å; D720-Q723 PolarHBondContact O-N 3.34Å; D720-F724 WeakPolarHBondContact O-CB 3.28Å; D720-F724 PolarHBondContact O-N 3.07Å
721	L	86.6	Confident	88.8	Confident	38 Å²	38	40.5 Å²	40.5	20%	0.199	21%	0.21	C	C	.	.	H	α-helix	trans	-57.4	-45.8	-175.1	-179.1	63.4	0	0	0	112.5	Q723 F724 L725 E815 K819	L721-Q723 PolarHBondContact O-N 3.34Å; L721-F724 WeakPolarHBondContact O-CB 3.31Å; L721-F724 PolarHBondContact O-N 3.28Å; L721-L725 HydrophobicContact CD1-CD1 3.94Å; L721-L725 HydrophobicContact CD1-CD2 4.45Å; L721-L725 HydrophobicContact CD1-CG 3.93Å; L721-L725 HydrophobicContact CD2-CD1 4.46Å; L721-L725 HydrophobicContact CG-CD1 3.88Å; L721-L725 HydrophobicContact CG-CG 4.26Å; L721-L725 WeakPolarHBondContact O-CB 3.28Å; L721-L725 WeakPolarHBondContact O-CG 3.46Å; L721-L725 PolarHBondContact O-N 2.88Å; L721-E815 WeakPolarHBondContact CD1-O 3.36Å; L721-E815 HydrophobicContact CD2-CB 4.01Å; L721-E815 HydrophobicContact CD2-CG 4.34Å; L721-E815 WeakPolarHBondContact CD2-O 3.48Å; L721-K819 HydrophobicContact CD1-CB 4.2Å
722	D	87.3	Confident	89.5	Confident	137 Å²	137	43.1 Å²	43.1	73%	0.733	22%	0.221	S	C	*	.	H	α-helix	trans	-63	-42.6	179.7	-72	-26.6	0	0	0	112	D720 H726	D720-D722 PolarHBondContact O-N 3.01Å; D722-H726 VanDerWaalsContact O-CB 3.24Å; D722-H726 WeakPolarHBondContact O-CB 3.38Å; D722-H726 PolarHBondContact O-N 3.41Å
723	Q	89.2	Confident	89.7	Confident	69 Å²	69	44.7 Å²	44.7	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-64.4	-42.6	176.2	-173	-177.9	10.6	0	0	110.8	D720 L721 H727	D720-Q723 HydrophobicContact CB-CB 4.44Å; D720-Q723 PolarHBondContact O-N 3.34Å; L721-Q723 PolarHBondContact O-N 3.34Å; Q723-H727 VanDerWaalsContact O-CB 3.3Å; Q723-H727 WeakPolarHBondContact O-CB 3.24Å; Q723-H727 PolarHBondContact O-N 3.5Å
724	F	90.9	Very high	90.2	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-62.1	-52.3	177.7	179	-90.1	0	0	0	111.6	D720 L721 H726 H727 W728 K819 L822 L823	D720-F724 WeakPolarHBondContact O-CB 3.28Å; D720-F724 PolarHBondContact O-N 3.07Å; L721-F724 WeakPolarHBondContact O-CB 3.31Å; L721-F724 PolarHBondContact O-N 3.28Å; F724-H726 PolarHBondContact O-N 3.29Å; F724-H727 PolarHBondContact O-N 3.12Å; F724-W728 HydrophobicContact CE1-CB 4.49Å; F724-W728 HydrophobicContact CE1-CE3 4.29Å; F724-W728 HydrophobicContact CE2-CE3 4.4Å; F724-W728 HydrophobicContact CZ-CD2 4.44Å; F724-W728 AromaticContact CZ-CE3 3.75Å; F724-W728 HydrophobicContact CZ-CE3 3.75Å; F724-W728 HydrophobicContact CZ-CZ3 4.16Å; F724-W728 VanDerWaalsContact O-CB 3.3Å; F724-W728 WeakPolarHBondContact O-CB 3.33Å; F724-W728 PolarHBondContact O-N 3.19Å; F724-K819 HydrophobicContact CD1-CB 4.23Å; F724-K819 HydrophobicContact CD1-CD 4.35Å; F724-K819 HydrophobicContact CD1-CG 3.86Å; F724-K819 HydrophobicContact CD2-CD 4.27Å; F724-K819 HydrophobicContact CD2-CG 4.17Å; F724-K819 HydrophobicContact CE1-CB 4.23Å; F724-K819 HydrophobicContact CE1-CG 3.84Å; F724-K819 HydrophobicContact CE2-CG 4.14Å; F724-K819 HydrophobicContact CG-CD 4.12Å; F724-K819 HydrophobicContact CG-CG 4.06Å; F724-K819 HydrophobicContact CZ-CG 3.99Å; F724-L822 HydrophobicContact CE1-CB 4.39Å; F724-L822 HydrophobicContact CE1-CD1 4.02Å; F724-L823 HydrophobicContact CE2-CD1 4.07Å; F724-L823 HydrophobicContact CE2-CD2 3.83Å; F724-L823 HydrophobicContact CE2-CG 3.97Å; F724-L823 HydrophobicContact CZ-CD1 4.19Å; F724-L823 HydrophobicContact CZ-CD2 3.84Å; F724-L823 HydrophobicContact CZ-CG 3.72Å
725	L	90.6	Very high	90.3	Very high	54 Å²	54	40 Å²	40	28%	0.283	20%	0.198	S	C	.	.	H	α-helix	trans	-64.1	-40.7	-178.1	-70.3	176.3	0	0	0	111.9	L721 W728 A729 L822	L721-L725 HydrophobicContact CD1-CD1 3.94Å; L721-L725 HydrophobicContact CD1-CD2 4.45Å; L721-L725 HydrophobicContact CD1-CG 3.93Å; L721-L725 HydrophobicContact CD2-CD1 4.46Å; L721-L725 HydrophobicContact CG-CD1 3.88Å; L721-L725 HydrophobicContact CG-CG 4.26Å; L721-L725 WeakPolarHBondContact O-CB 3.28Å; L721-L725 WeakPolarHBondContact O-CG 3.46Å; L721-L725 PolarHBondContact O-N 2.88Å; L725-W728 PolarHBondContact O-N 2.96Å; L725-A729 WeakPolarHBondContact O-CB 3.34Å; L725-A729 PolarHBondContact O-N 3.01Å; L725-L822 HydrophobicContact CD2-CD1 4.1Å
726	H	91.8	Very high	90.2	Very high	26 Å²	26	39.1 Å²	39.1	12%	0.12	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-49.7	174.9	178	73.7	0	0	0	111.4	C638 M643 S645 D722 F724 W728 A729 V730	C638-H726 PolarHBondContact O-NE2 3.26Å; M643-H726 PolarHBondContact O-CE1 3.18Å; S645-H726 PolarHBondContact N-CE1 3.33Å; S645-H726 PolarHBondContact N-ND1 3.26Å; D722-H726 VanDerWaalsContact O-CB 3.24Å; D722-H726 WeakPolarHBondContact O-CB 3.38Å; D722-H726 PolarHBondContact O-N 3.41Å; F724-H726 PolarHBondContact O-N 3.29Å; H726-W728 VanDerWaalsContact C-N 3.33Å; H726-W728 PolarHBondContact O-N 2.66Å; H726-A729 PolarHBondContact O-N 2.7Å; H726-V730 WeakPolarHBondContact O-CG2 3.3Å; H726-V730 PolarHBondContact O-N 3.3Å; H726-V730 VanDerWaalsContact O-N 3.11Å
727	H	92.8	Very high	90.1	Very high	13 Å²	13	39.2 Å²	39.2	6%	0.06	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-37.1	178.5	-175.9	-163.2	0	0	0	112	L686 I687 G688 Q723 F724 V730 T731 S768	L686-H727 PolarHBondContact O-NE2 3.49Å; L686-H727 VanDerWaalsContact O-NE2 3.09Å; I687-H727 PolarHBondContact O-CE1 3.44Å; I687-H727 VanDerWaalsContact O-CE1 3.31Å; G688-H727 VanDerWaalsContact CA-CE1 3.48Å; G688-H727 WeakPolarHBondContact CA-CE1 3.42Å; G688-H727 WeakPolarHBondContact CA-NE2 3.27Å; Q723-H727 VanDerWaalsContact O-CB 3.3Å; Q723-H727 WeakPolarHBondContact O-CB 3.24Å; Q723-H727 PolarHBondContact O-N 3.5Å; F724-H727 PolarHBondContact O-N 3.12Å; H727-V730 PolarHBondContact O-N 3.47Å; H727-T731 WeakPolarHBondContact O-CB 3.42Å; H727-T731 PolarHBondContact O-N 3.24Å; H727-T731 PolarHBondContact O-OG1 3.12Å; H727-S768 WeakPolarHBondContact ND1-CB 3.41Å; H727-S768 PolarHBondContact ND1-OG 3.04Å; H727-S768 VanDerWaalsContact ND1-OG 3.09Å
728	W	92.9	Very high	90.1	Very high	15 Å²	15	36.6 Å²	36.6	6%	0.057	19%	0.189	C	C	.	.	H	α-helix	trans	-60.4	-49.7	175.4	-169.8	-91.5	0	0	0	112	F724 L725 H726 V730 T731 E732 C775 L822 L823 S826	F724-W728 HydrophobicContact CE1-CB 4.49Å; F724-W728 HydrophobicContact CE1-CE3 4.29Å; F724-W728 HydrophobicContact CE2-CE3 4.4Å; F724-W728 HydrophobicContact CZ-CD2 4.44Å; F724-W728 AromaticContact CZ-CE3 3.75Å; F724-W728 HydrophobicContact CZ-CE3 3.75Å; F724-W728 HydrophobicContact CZ-CZ3 4.16Å; F724-W728 VanDerWaalsContact O-CB 3.3Å; F724-W728 WeakPolarHBondContact O-CB 3.33Å; F724-W728 PolarHBondContact O-N 3.19Å; L725-W728 PolarHBondContact O-N 2.96Å; H726-W728 VanDerWaalsContact C-N 3.33Å; H726-W728 PolarHBondContact O-N 2.66Å; W728-V730 VanDerWaalsContact C-N 3.31Å; W728-V730 PolarHBondContact O-N 2.98Å; W728-T731 VanDerWaalsContact O-CB 3.31Å; W728-T731 WeakPolarHBondContact O-CB 3.5Å; W728-T731 PolarHBondContact O-N 3.23Å; W728-T731 VanDerWaalsContact O-N 3.09Å; W728-E732 PolarHBondContact NE1-OE1 2.99Å; W728-E732 PolarHBondContact O-N 3.13Å; W728-C775 HydrophobicContact CH2-CB 4.15Å; W728-L822 HydrophobicContact CD2-CB 4.38Å; W728-L822 HydrophobicContact CD2-CD1 4.21Å; W728-L822 HydrophobicContact CG-CD1 4.01Å; W728-L822 HydrophobicContact CH2-CB 4.27Å; W728-L822 HydrophobicContact CZ2-CB 3.95Å; W728-L822 HydrophobicContact CZ2-CD2 4.22Å; W728-L823 HydrophobicContact CZ3-CD2 4.34Å; W728-S826 WeakPolarHBondContact CH2-OG 3.38Å
729	A	91.3	Very high	90	Very high	34 Å²	34	36.8 Å²	36.8	28%	0.281	19%	0.193	S	C	.	.	H	α-helix	trans	-61.2	-39.1	178	0	0	0	0	0	112.3	L725 H726 E732 M733	L725-A729 WeakPolarHBondContact O-CB 3.34Å; L725-A729 PolarHBondContact O-N 3.01Å; H726-A729 PolarHBondContact O-N 2.7Å; A729-E732 PolarHBondContact O-N 2.83Å; A729-M733 PolarHBondContact O-N 2.81Å
730	V	92.4	Very high	89.8	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.018	21%	0.21	C	C	.	.	H	α-helix	trans	-64.4	-41.8	173.7	171.8	0	0	0	0	111.2	A648 I652 T685 H726 H727 W728 E732 M733 I734	A648-V730 HydrophobicContact CB-CG2 3.71Å; I652-V730 HydrophobicContact CD1-CG1 3.92Å; T685-V730 HydrophobicContact CG2-CG1 3.64Å; H726-V730 WeakPolarHBondContact O-CG2 3.3Å; H726-V730 PolarHBondContact O-N 3.3Å; H726-V730 VanDerWaalsContact O-N 3.11Å; H727-V730 PolarHBondContact O-N 3.47Å; W728-V730 VanDerWaalsContact C-N 3.31Å; W728-V730 PolarHBondContact O-N 2.98Å; V730-E732 PolarHBondContact O-N 3.35Å; V730-M733 WeakPolarHBondContact O-CB 3.26Å; V730-M733 PolarHBondContact O-N 2.71Å; V730-I734 HydrophobicContact CG1-CD1 3.98Å; V730-I734 WeakPolarHBondContact O-CG1 3.21Å; V730-I734 PolarHBondContact O-N 2.75Å
731	T	93.1	Very high	89.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.1	-44.7	177.5	-64.6	0	0	0	0	111.7	L686 H727 W728 M733 I734 C735 S772	L686-T731 HydrophobicContact CD1-CG2 3.68Å; H727-T731 WeakPolarHBondContact O-CB 3.42Å; H727-T731 PolarHBondContact O-N 3.24Å; H727-T731 PolarHBondContact O-OG1 3.12Å; W728-T731 VanDerWaalsContact O-CB 3.31Å; W728-T731 WeakPolarHBondContact O-CB 3.5Å; W728-T731 PolarHBondContact O-N 3.23Å; W728-T731 VanDerWaalsContact O-N 3.09Å; T731-M733 VanDerWaalsContact C-N 3.26Å; T731-M733 PolarHBondContact O-N 3.16Å; T731-I734 PolarHBondContact O-N 3.39Å; T731-I734 VanDerWaalsContact O-N 3.13Å; T731-C735 PolarHBondContact O-N 3.35Å; T731-C735 PolarHBondContact O-SG 2.68Å; T731-S772 WeakPolarHBondContact OG1-CB 3.36Å; T731-S772 PolarHBondContact OG1-OG 3.47Å
732	E	91.1	Very high	89.4	Confident	84 Å²	84	37.9 Å²	37.9	39%	0.393	21%	0.208	S	C	.	.	H	α-helix	trans	-59.3	-39	177.9	-69.8	-169.7	147.5	0	0	112.5	W728 A729 V730 C735 H736	W728-E732 PolarHBondContact NE1-OE1 2.99Å; W728-E732 PolarHBondContact O-N 3.13Å; A729-E732 PolarHBondContact O-N 2.83Å; V730-E732 PolarHBondContact O-N 3.35Å; E732-C735 PolarHBondContact O-N 3.12Å; E732-H736 PolarHBondContact O-N 3.18Å
733	M	89.1	Confident	89.3	Confident	42 Å²	42	33.3 Å²	33.3	21%	0.207	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-41.5	175.4	-172	66.6	-141.3	0	0	112	A649 I652 A729 V730 T731 H736 S737	A649-M733 HydrophobicContact CB-CB 4.15Å; A649-M733 HydrophobicContact CB-CG 3.84Å; A649-M733 HydrophobicContact CB-SD 4.16Å; I652-M733 HydrophobicContact CB-CG 4.15Å; I652-M733 HydrophobicContact CD1-CB 4.39Å; I652-M733 HydrophobicContact CD1-CG 4.31Å; I652-M733 HydrophobicContact CG2-CG 4Å; A729-M733 PolarHBondContact O-N 2.81Å; V730-M733 WeakPolarHBondContact O-CB 3.26Å; V730-M733 PolarHBondContact O-N 2.71Å; T731-M733 VanDerWaalsContact C-N 3.26Å; T731-M733 PolarHBondContact O-N 3.16Å; M733-H736 WeakPolarHBondContact O-CB 3.3Å; M733-H736 PolarHBondContact O-N 3.12Å; M733-S737 PolarHBondContact O-N 3.49Å; M733-S737 PolarHBondContact O-OG 2.85Å
734	I	92.5	Very high	89	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-47	176	-66.7	167.7	0	0	0	110.4	I652 L682 T685 L686 V730 T731 H736 S737 L738	I652-I734 HydrophobicContact CD1-CG1 3.94Å; L682-I734 HydrophobicContact CB-CG2 4.24Å; L682-I734 HydrophobicContact CD2-CG1 4.35Å; L682-I734 HydrophobicContact CD2-CG2 4.28Å; T685-I734 HydrophobicContact CG2-CD1 3.8Å; L686-I734 HydrophobicContact CB-CD1 4.09Å; L686-I734 HydrophobicContact CB-CG2 4.35Å; L686-I734 HydrophobicContact CD1-CG2 4.37Å; V730-I734 HydrophobicContact CG1-CD1 3.98Å; V730-I734 WeakPolarHBondContact O-CG1 3.21Å; V730-I734 PolarHBondContact O-N 2.75Å; T731-I734 PolarHBondContact O-N 3.39Å; T731-I734 VanDerWaalsContact O-N 3.13Å; I734-H736 VanDerWaalsContact C-N 3.27Å; I734-H736 PolarHBondContact O-N 3.36Å; I734-S737 CarbonylContact O-C 3.48Å; I734-S737 PolarHBondContact O-N 3.09Å; I734-S737 VanDerWaalsContact O-N 3.16Å; I734-L738 HydrophobicContact CG2-CD1 3.74Å; I734-L738 HydrophobicContact CG2-CG 4.23Å; I734-L738 WeakPolarHBondContact O-CG 3.36Å; I734-L738 PolarHBondContact O-N 3.05Å
735	C	90.6	Very high	88.7	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-58.7	-41.4	176.9	-65.2	0	0	0	0	111.4	T731 E732 L738 S739 A776 K779	T731-C735 PolarHBondContact O-N 3.35Å; T731-C735 PolarHBondContact O-SG 2.68Å; E732-C735 PolarHBondContact O-N 3.12Å; C735-L738 PolarHBondContact O-N 2.68Å; C735-S739 WeakPolarHBondContact O-CB 3.29Å; C735-S739 PolarHBondContact O-N 3.47Å; C735-S739 PolarHBondContact O-OG 2.9Å; C735-A776 VanDerWaalsContact SG-CA 3.51Å; C735-K779 HydrophobicContact CB-CB 4.29Å; C735-K779 HydrophobicContact CB-CD 3.63Å
736	H	88.6	Confident	88.5	Confident	87 Å²	87	38.6 Å²	38.6	40%	0.403	22%	0.215	S	C	.	.	H	α-helix	trans	-61.1	-49.5	174.1	-176.4	66.6	0	0	0	111.5	E732 M733 I734 L738 S739 T740	E732-H736 PolarHBondContact O-N 3.18Å; M733-H736 WeakPolarHBondContact O-CB 3.3Å; M733-H736 PolarHBondContact O-N 3.12Å; I734-H736 VanDerWaalsContact C-N 3.27Å; I734-H736 PolarHBondContact O-N 3.36Å; H736-L738 VanDerWaalsContact C-N 3.29Å; H736-L738 PolarHBondContact O-N 3.27Å; H736-S739 PolarHBondContact O-N 3.35Å; H736-S739 VanDerWaalsContact O-N 3.14Å; H736-S739 PolarHBondContact O-OG 3.27Å; H736-T740 WeakPolarHBondContact O-CG2 3.23Å; H736-T740 PolarHBondContact O-N 3.16Å
737	S	87.8	Confident	88.3	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.014	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-27.8	177.2	-67.9	0	0	0	0	114.6	M733 I734 T740	M733-S737 PolarHBondContact O-N 3.49Å; M733-S737 PolarHBondContact O-OG 2.85Å; I734-S737 CarbonylContact O-C 3.48Å; I734-S737 PolarHBondContact O-N 3.09Å; I734-S737 VanDerWaalsContact O-N 3.16Å; S737-T740 PolarHBondContact O-OG1 3.3Å
738	L	88.9	Confident	88.1	Confident	8 Å²	8	37 Å²	37	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-78.3	-35.3	173.6	-70.6	170.7	0	0	0	111.2	F679 L682 I734 C735 H736 T740 I741 L780	F679-L738 HydrophobicContact CD1-CD2 4.19Å; F679-L738 HydrophobicContact CE1-CD2 3.93Å; L682-L738 HydrophobicContact CD1-CD2 3.5Å; L682-L738 VanDerWaalsContact CD1-CD2 3.5Å; L682-L738 HydrophobicContact CD1-CG 4.01Å; I734-L738 HydrophobicContact CG2-CD1 3.74Å; I734-L738 HydrophobicContact CG2-CG 4.23Å; I734-L738 WeakPolarHBondContact O-CG 3.36Å; I734-L738 PolarHBondContact O-N 3.05Å; C735-L738 PolarHBondContact O-N 2.68Å; H736-L738 VanDerWaalsContact C-N 3.29Å; H736-L738 PolarHBondContact O-N 3.27Å; L738-T740 VanDerWaalsContact C-N 3.32Å; L738-T740 PolarHBondContact O-N 3.13Å; L738-I741 HydrophobicContact CD2-CD1 4.17Å; L738-I741 WeakPolarHBondContact O-CB 3.35Å; L738-I741 PolarHBondContact O-N 3.4Å; L738-L780 HydrophobicContact CB-CD1 3.88Å; L738-L780 HydrophobicContact CB-CD2 3.6Å; L738-L780 HydrophobicContact CB-CG 4.35Å; L738-L780 HydrophobicContact CD1-CD1 3.75Å; L738-L780 HydrophobicContact CG-CD1 4.43Å
739	S	86.6	Confident	87.9	Confident	40 Å²	40	39.8 Å²	39.8	28%	0.28	22%	0.224	S	C	.	.	H	α-helix	trans	-69.9	-25.7	179.6	71.3	0	0	0	0	113.8	C735 H736 I741 Q744	C735-S739 WeakPolarHBondContact O-CB 3.29Å; C735-S739 PolarHBondContact O-N 3.47Å; C735-S739 PolarHBondContact O-OG 2.9Å; H736-S739 PolarHBondContact O-N 3.35Å; H736-S739 VanDerWaalsContact O-N 3.14Å; H736-S739 PolarHBondContact O-OG 3.27Å; S739-I741 PolarHBondContact O-N 2.89Å; S739-Q744 PolarHBondContact O-NE2 3.18Å
740	T	85	Confident	87.8	Confident	62 Å²	62	42.1 Å²	42.1	38%	0.38	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-11.1	176.3	54.9	0	0	0	0	113.2	H656 H736 S737 L738	H656-T740 PolarHBondContact CE1-OG1 3.19Å; H656-T740 PolarHBondContact NE2-OG1 3.14Å; H656-T740 VanDerWaalsContact NE2-OG1 3.09Å; H736-T740 WeakPolarHBondContact O-CG2 3.23Å; H736-T740 PolarHBondContact O-N 3.16Å; S737-T740 PolarHBondContact O-OG1 3.3Å; L738-T740 VanDerWaalsContact C-N 3.32Å; L738-T740 PolarHBondContact O-N 3.13Å
741	I	84.6	Confident	87.8	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	23%	0.233	C	C	.	.	S	Bend	trans	-74.7	127.7	178.5	-58.9	177.8	0	0	0	108.9	F661 F679 L738 S739 S743	F661-I741 HydrophobicContact CB-CG1 4.2Å; F661-I741 HydrophobicContact CD1-CG2 3.86Å; F661-I741 HydrophobicContact CD2-CD1 4.43Å; F661-I741 HydrophobicContact CE1-CG2 4.2Å; F661-I741 HydrophobicContact CG-CD1 4.43Å; F661-I741 HydrophobicContact CG-CG1 4.24Å; F661-I741 HydrophobicContact CG-CG2 4.36Å; F679-I741 HydrophobicContact CE1-CD1 3.75Å; F679-I741 HydrophobicContact CZ-CD1 3.73Å; L738-I741 HydrophobicContact CD2-CD1 4.17Å; L738-I741 WeakPolarHBondContact O-CB 3.35Å; L738-I741 PolarHBondContact O-N 3.4Å; S739-I741 PolarHBondContact O-N 2.89Å; I741-S743 PolarHBondContact O-N 3.4Å
742	P	80.7	Confident	87.7	Confident	116 Å²	116	43.4 Å²	43.4	75%	0.753	24%	0.237	S	C	*	.	S	Bend	trans	-65.5	-32.3	-172.1	23.1	-33.3	0	0	0	114	Q744	P742-Q744 PolarHBondContact O-N 3.22Å
743	S	84.4	Confident	87.7	Confident	41 Å²	41	43.6 Å²	43.6	29%	0.287	24%	0.244	S	C	.	.			trans	-91.7	70.1	178.5	50.6	0	0	0	0	112.1	I741 S745 Q746 C747	I741-S743 PolarHBondContact O-N 3.4Å; S743-S745 VanDerWaalsContact C-N 3.34Å; S743-S745 PolarHBondContact O-N 3.03Å; S743-Q746 PolarHBondContact O-N 2.95Å; S743-C747 WeakPolarHBondContact O-CB 3.5Å; S743-C747 PolarHBondContact O-N 3.19Å
744	Q	82.8	Confident	87.8	Confident	70 Å²	70	42 Å²	42	33%	0.327	24%	0.239	S	C	.	.	H	α-helix	trans	-58.6	-38.9	-175.1	-68.6	-172.2	-12.1	0	0	113.8	S739 P742 C747 F748	S739-Q744 PolarHBondContact O-NE2 3.18Å; P742-Q744 PolarHBondContact O-N 3.22Å; Q744-C747 WeakPolarHBondContact O-CB 3.49Å; Q744-C747 PolarHBondContact O-N 3.12Å; Q744-F748 WeakPolarHBondContact O-CB 3.47Å; Q744-F748 PolarHBondContact O-N 2.9Å
745	S	84.8	Confident	87.8	Confident	48 Å²	48	42.1 Å²	42.1	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-63.5	-43.5	178.2	56.5	0	0	0	0	113.3	S743 F748 D749	S743-S745 VanDerWaalsContact C-N 3.34Å; S743-S745 PolarHBondContact O-N 3.03Å; S745-F748 WeakPolarHBondContact O-CB 3.25Å; S745-F748 PolarHBondContact O-N 3.49Å; S745-D749 PolarHBondContact O-N 2.9Å
746	Q	86.1	Confident	87.8	Confident	118 Å²	118	43.6 Å²	43.6	55%	0.551	25%	0.249	S	C	*	.	H	α-helix	trans	-69.3	-39.4	177.3	-67	178.5	-12.9	0	0	111.7	S743 F748 D749 I750	S743-Q746 PolarHBondContact O-N 2.95Å; Q746-F748 VanDerWaalsContact C-N 3.29Å; Q746-F748 PolarHBondContact O-N 3.29Å; Q746-D749 PolarHBondContact O-N 3.45Å; Q746-I750 VanDerWaalsContact O-CG1 3.29Å; Q746-I750 WeakPolarHBondContact O-CG1 3.44Å; Q746-I750 PolarHBondContact O-N 3.29Å
747	C	87.8	Confident	88	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.027	26%	0.261	C	S	.	.	H	α-helix	trans	-58	-45.1	173.6	-175.8	0	0	0	0	110.8	S743 Q744 I750 L751	S743-C747 WeakPolarHBondContact O-CB 3.5Å; S743-C747 PolarHBondContact O-N 3.19Å; Q744-C747 WeakPolarHBondContact O-CB 3.49Å; Q744-C747 PolarHBondContact O-N 3.12Å; C747-I750 PolarHBondContact O-N 3.44Å; C747-L751 PolarHBondContact O-N 3.42Å
748	F	88.9	Confident	88.1	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	28%	0.278	C	S	.	.	H	α-helix	trans	-61.4	-45.6	175	-175.8	-93.7	0	0	0	112.2	Q744 S745 Q746 I750 L751 Q752 I777 L780 L781 C785 L787	Q744-F748 WeakPolarHBondContact O-CB 3.47Å; Q744-F748 PolarHBondContact O-N 2.9Å; S745-F748 WeakPolarHBondContact O-CB 3.25Å; S745-F748 PolarHBondContact O-N 3.49Å; Q746-F748 VanDerWaalsContact C-N 3.29Å; Q746-F748 PolarHBondContact O-N 3.29Å; F748-I750 VanDerWaalsContact C-N 3.34Å; F748-I750 PolarHBondContact O-N 2.97Å; F748-L751 PolarHBondContact O-N 2.9Å; F748-Q752 HydrophobicContact CE1-CB 4.43Å; F748-Q752 VanDerWaalsContact O-CB 3.29Å; F748-Q752 WeakPolarHBondContact O-CB 3.48Å; F748-Q752 PolarHBondContact O-N 3.23Å; F748-I777 HydrophobicContact CE2-CG1 4.49Å; F748-I777 HydrophobicContact CE2-CG2 4.21Å; F748-L780 HydrophobicContact CD2-CB 4.36Å; F748-L781 HydrophobicContact CE1-CD1 4.46Å; F748-L781 HydrophobicContact CE2-CD1 3.88Å; F748-L781 HydrophobicContact CZ-CD1 3.83Å; F748-C785 HydrophobicContact CD1-CB 3.77Å; F748-C785 HydrophobicContact CE1-CB 4.09Å; F748-C785 HydrophobicContact CG-CB 4.07Å; F748-L787 HydrophobicContact CE1-CD1 4.16Å; F748-L787 HydrophobicContact CE1-CG 4.24Å; F748-L787 HydrophobicContact CZ-CD1 3.73Å; F748-L787 HydrophobicContact CZ-CG 3.84Å
749	D	88.8	Confident	88.3	Confident	73 Å²	73	50.5 Å²	50.5	39%	0.39	28%	0.276	S	S	.	.	H	α-helix	trans	-61.7	-39.8	178.5	-74.9	-26.1	0	0	0	112.7	S745 Q746 T753	S745-D749 PolarHBondContact O-N 2.9Å; Q746-D749 PolarHBondContact O-N 3.45Å; D749-T753 VanDerWaalsContact O-CB 3.3Å; D749-T753 WeakPolarHBondContact O-CB 3.27Å; D749-T753 PolarHBondContact O-N 3.22Å; D749-T753 PolarHBondContact O-OG1 3.36Å
750	I	89.7	Confident	88.4	Confident	84 Å²	84	50.9 Å²	50.9	43%	0.431	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-48.2	175.2	-67.6	165	0	0	0	110.1	F679 Q746 C747 F748 T753 G754	F679-I750 HydrophobicContact CB-CG2 4.44Å; F679-I750 HydrophobicContact CD1-CG2 4.44Å; F679-I750 HydrophobicContact CD2-CD1 4.38Å; F679-I750 HydrophobicContact CE2-CD1 4.19Å; F679-I750 HydrophobicContact CG-CG2 4.38Å; F679-I750 HydrophobicContact CZ-CD1 4.35Å; Q746-I750 VanDerWaalsContact O-CG1 3.29Å; Q746-I750 WeakPolarHBondContact O-CG1 3.44Å; Q746-I750 PolarHBondContact O-N 3.29Å; C747-I750 PolarHBondContact O-N 3.44Å; F748-I750 VanDerWaalsContact C-N 3.34Å; F748-I750 PolarHBondContact O-N 2.97Å; I750-T753 PolarHBondContact O-N 3.35Å; I750-G754 PolarHBondContact O-N 3.13Å
751	L	91	Very high	88.5	Confident	12 Å²	12	51.4 Å²	51.4	6%	0.063	30%	0.295	C	S	.	.	H	α-helix	trans	-61.4	-48.8	178.7	178.2	62.4	0	0	0	111.3	F683 L686 C747 F748 T753 G754 I755 A776 L780	F683-L751 HydrophobicContact CD2-CD1 3.82Å; F683-L751 HydrophobicContact CE2-CD1 4.08Å; L686-L751 HydrophobicContact CD2-CD1 3.7Å; C747-L751 PolarHBondContact O-N 3.42Å; F748-L751 PolarHBondContact O-N 2.9Å; L751-T753 VanDerWaalsContact C-N 3.31Å; L751-T753 PolarHBondContact O-N 3.4Å; L751-G754 PolarHBondContact O-N 3.29Å; L751-G754 VanDerWaalsContact O-N 3.15Å; L751-I755 HydrophobicContact CD1-CD1 4.1Å; L751-I755 HydrophobicContact CD1-CG1 4.37Å; L751-I755 HydrophobicContact CG-CD1 3.9Å; L751-I755 WeakPolarHBondContact O-CG1 3.37Å; L751-I755 PolarHBondContact O-N 2.61Å; L751-A776 HydrophobicContact CD2-CB 4.22Å; L751-L780 HydrophobicContact CD2-CD1 3.64Å
752	Q	91.8	Very high	88.7	Confident	17 Å²	17	53.1 Å²	53.1	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-55.9	-45.7	176.2	165.3	164.3	-82.5	0	0	111.5	F748 G754 I755 C756 I786 L787 N788 L791	F748-Q752 HydrophobicContact CE1-CB 4.43Å; F748-Q752 VanDerWaalsContact O-CB 3.29Å; F748-Q752 WeakPolarHBondContact O-CB 3.48Å; F748-Q752 PolarHBondContact O-N 3.23Å; Q752-G754 VanDerWaalsContact C-N 3.33Å; Q752-G754 PolarHBondContact O-N 3.03Å; Q752-I755 PolarHBondContact O-N 3.02Å; Q752-C756 WeakPolarHBondContact O-CB 3.21Å; Q752-C756 PolarHBondContact O-N 2.79Å; Q752-C756 PolarHBondContact O-SG 3.39Å; Q752-I786 PolarHBondContact NE2-O 2.78Å; Q752-L787 VanDerWaalsContact OE1-CA 3.26Å; Q752-N788 HydrophobicContact CG-CB 4.16Å; Q752-L791 HydrophobicContact CB-CD2 4.1Å; Q752-L791 HydrophobicContact CG-CD2 3.86Å; Q752-L791 VanDerWaalsContact OE1-CD2 3.25Å
753	T	91.9	Very high	89.1	Confident	88 Å²	88	50.8 Å²	50.8	54%	0.54	29%	0.287	S	S	.	.	H	α-helix	trans	-63.1	-41	178.4	-58.7	0	0	0	0	111.1	D749 I750 L751 K757	D749-T753 VanDerWaalsContact O-CB 3.3Å; D749-T753 WeakPolarHBondContact O-CB 3.27Å; D749-T753 PolarHBondContact O-N 3.22Å; D749-T753 PolarHBondContact O-OG1 3.36Å; I750-T753 PolarHBondContact O-N 3.35Å; L751-T753 VanDerWaalsContact C-N 3.31Å; L751-T753 PolarHBondContact O-N 3.4Å; T753-K757 VanDerWaalsContact O-CB 3.24Å; T753-K757 WeakPolarHBondContact O-CB 3.47Å; T753-K757 PolarHBondContact O-N 3.45Å
754	G	90.3	Very high	89.4	Confident	10 Å²	10	49 Å²	49	10%	0.103	27%	0.274	C	S	.	.	H	α-helix	trans	-59.9	-50.5	173.7	0	0	0	0	0	112.5	F683 I750 L751 Q752 C756 K757 Y758	F683-G754 WeakPolarHBondContact CZ-O 3.39Å; I750-G754 PolarHBondContact O-N 3.13Å; L751-G754 PolarHBondContact O-N 3.29Å; L751-G754 VanDerWaalsContact O-N 3.15Å; Q752-G754 VanDerWaalsContact C-N 3.33Å; Q752-G754 PolarHBondContact O-N 3.03Å; G754-C756 PolarHBondContact O-N 3.07Å; G754-K757 PolarHBondContact O-N 2.91Å; G754-Y758 VanDerWaalsContact O-CD2 3.22Å; G754-Y758 WeakPolarHBondContact O-CD2 3.47Å; G754-Y758 PolarHBondContact O-N 2.95Å
755	I	92.4	Very high	89.9	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-47.9	179.4	-64.5	163.4	0	0	0	110.5	F683 L751 Q752 K757 Y758 L759 V760 V773 I777 L791 F794	F683-I755 HydrophobicContact CE2-CG1 4.06Å; L751-I755 HydrophobicContact CD1-CD1 4.1Å; L751-I755 HydrophobicContact CD1-CG1 4.37Å; L751-I755 HydrophobicContact CG-CD1 3.9Å; L751-I755 WeakPolarHBondContact O-CG1 3.37Å; L751-I755 PolarHBondContact O-N 2.61Å; Q752-I755 PolarHBondContact O-N 3.02Å; I755-K757 VanDerWaalsContact C-N 3.29Å; I755-K757 PolarHBondContact O-N 3.31Å; I755-Y758 PolarHBondContact O-N 3.33Å; I755-L759 HydrophobicContact CG2-CB 4.29Å; I755-L759 HydrophobicContact CG2-CD1 4.27Å; I755-L759 WeakPolarHBondContact O-CB 3.31Å; I755-L759 PolarHBondContact O-N 3.36Å; I755-V760 PolarHBondContact O-N 3.07Å; I755-V773 HydrophobicContact CD1-CG1 3.74Å; I755-V773 HydrophobicContact CG1-CG1 4.37Å; I755-V773 HydrophobicContact CG2-CG1 4.45Å; I755-I777 HydrophobicContact CD1-CD1 4.06Å; I755-I777 HydrophobicContact CD1-CG1 4.44Å; I755-L791 HydrophobicContact CB-CD1 4.19Å; I755-L791 HydrophobicContact CD1-CD1 4.41Å; I755-L791 HydrophobicContact CG2-CD1 3.54Å; I755-F794 HydrophobicContact CG2-CD1 4.06Å; I755-F794 HydrophobicContact CG2-CE1 3.88Å
756	C	91.9	Very high	90.3	Very high	32 Å²	32	43.4 Å²	43.4	22%	0.216	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-39.8	179.5	-68.9	0	0	0	0	112.3	Q752 G754	Q752-C756 WeakPolarHBondContact O-CB 3.21Å; Q752-C756 PolarHBondContact O-N 2.79Å; Q752-C756 PolarHBondContact O-SG 3.39Å; G754-C756 PolarHBondContact O-N 3.07Å
757	K	91.5	Very high	90.5	Very high	147 Å²	147	37.8 Å²	37.8	64%	0.639	22%	0.216	S	C	*	.	H	α-helix	trans	-74.8	-38	-177.6	-174	175.6	-179.7	-178.4	0	113.2	T753 G754 I755	T753-K757 VanDerWaalsContact O-CB 3.24Å; T753-K757 WeakPolarHBondContact O-CB 3.47Å; T753-K757 PolarHBondContact O-N 3.45Å; G754-K757 PolarHBondContact O-N 2.91Å; I755-K757 VanDerWaalsContact C-N 3.29Å; I755-K757 PolarHBondContact O-N 3.31Å
758	Y	90.6	Very high	90.7	Very high	94 Å²	94	37.6 Å²	37.6	37%	0.369	22%	0.215	S	C	.	.	H	α-helix	trans	-110.2	-23.1	-168	-61.3	-63.1	0	0	0	115	F683 G754 I755 L762	F683-Y758 AromaticContact CE1-CD2 3.54Å; F683-Y758 HydrophobicContact CE1-CD2 3.54Å; F683-Y758 HydrophobicContact CE1-CE2 4.23Å; F683-Y758 HydrophobicContact CE1-CG 4.34Å; F683-Y758 HydrophobicContact CZ-CD2 4.03Å; G754-Y758 VanDerWaalsContact O-CD2 3.22Å; G754-Y758 WeakPolarHBondContact O-CD2 3.47Å; G754-Y758 PolarHBondContact O-N 2.95Å; I755-Y758 PolarHBondContact O-N 3.33Å; Y758-L762 WeakPolarHBondContact O-CD1 3.41Å
759	L	91.9	Very high	91	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-36.7	-174.2	-61.1	-179.4	0	0	0	114.3	I687 L694 I755 G761 L762 T769 V773 F794	I687-L759 HydrophobicContact CD1-CD2 4.4Å; I687-L759 HydrophobicContact CG1-CD1 4.41Å; L694-L759 HydrophobicContact CD1-CD2 4.23Å; I755-L759 HydrophobicContact CG2-CB 4.29Å; I755-L759 HydrophobicContact CG2-CD1 4.27Å; I755-L759 WeakPolarHBondContact O-CB 3.31Å; I755-L759 PolarHBondContact O-N 3.36Å; L759-G761 PolarHBondContact O-N 3.42Å; L759-G761 VanDerWaalsContact O-N 3.11Å; L759-L762 HydrophobicContact CD2-CD1 3.99Å; L759-L762 WeakPolarHBondContact O-CB 3.18Å; L759-L762 PolarHBondContact O-N 3.27Å; L759-T769 HydrophobicContact CD1-CG2 4.36Å; L759-V773 HydrophobicContact CD1-CG2 3.84Å; L759-F794 HydrophobicContact CB-CE1 4.38Å; L759-F794 HydrophobicContact CB-CE2 4.45Å; L759-F794 HydrophobicContact CB-CZ 3.87Å
760	V	89.8	Confident	91.2	Very high	48 Å²	48	34.2 Å²	34.2	29%	0.291	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.8	-173.4	174	0	0	0	0	113.4	I755 F794	I755-V760 PolarHBondContact O-N 3.07Å; V760-F794 HydrophobicContact CB-CD2 4.38Å; V760-F794 HydrophobicContact CG1-CB 4.49Å; V760-F794 HydrophobicContact CG2-CB 3.81Å; V760-F794 HydrophobicContact CG2-CD1 4.19Å; V760-F794 HydrophobicContact CG2-CD2 4.03Å; V760-F794 HydrophobicContact CG2-CG 3.74Å
761	G	86.4	Confident	91.3	Very high	74 Å²	74	30.2 Å²	30.2	76%	0.763	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-1.9	176.4	0	0	0	0	0	115.5	L759	L759-G761 PolarHBondContact O-N 3.42Å; L759-G761 VanDerWaalsContact O-N 3.11Å
762	L	90.1	Very high	91.5	Very high	36 Å²	36	29.7 Å²	29.7	19%	0.188	17%	0.174	C	C	.	.			trans	-90.8	141.7	-178.1	-57.9	179.5	0	0	0	111.1	L694 Q698 Y758 L759 I765	L694-L762 HydrophobicContact CB-CD1 4.37Å; L694-L762 HydrophobicContact CD1-CD1 4.21Å; Q698-L762 HydrophobicContact CG-CD2 4.12Å; Y758-L762 WeakPolarHBondContact O-CD1 3.41Å; L759-L762 HydrophobicContact CD2-CD1 3.99Å; L759-L762 WeakPolarHBondContact O-CB 3.18Å; L759-L762 PolarHBondContact O-N 3.27Å; L762-I765 HydrophobicContact CB-CD1 4.46Å; L762-I765 HydrophobicContact CB-CG1 4.22Å
763	V	88.8	Confident	91.6	Very high	67 Å²	67	29 Å²	29	41%	0.406	17%	0.172	S	C	.	.	S	Bend	trans	-91.7	-40.5	178.4	179.3	0	0	0	0	110.7	R715	R715-V763 HydrophobicContact CG-CG1 4.43Å; R715-V763 PolarHBondContact N-O 2.84Å
764	V	90.6	Very high	91.6	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.018	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.8	178.9	-175.6	0	0	0	0	109.4	L697 Q698 R715	L697-V764 HydrophobicContact CB-CG1 4.43Å; Q698-V764 PolarHBondContact NE2-O 2.79Å; R715-V764 HydrophobicContact CB-CG2 4.32Å; R715-V764 CarbonylContact O-C 3.38Å; R715-V764 WeakPolarHBondContact O-CA 3.47Å
765	I	92.6	Very high	91.7	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.4	-178.2	-58.3	-174.8	0	0	0	109.4	V714 R715 L716 Y717 L762 D767 T769 A770 F794	V714-I765 HydrophobicContact CG1-CB 4.18Å; V714-I765 HydrophobicContact CG1-CD1 4.06Å; V714-I765 HydrophobicContact CG1-CG1 4.2Å; R715-I765 PolarHBondContact O-N 2.91Å; L716-I765 CarbonylContact C-O 3.57Å; L716-I765 VanDerWaalsContact CA-O 3.27Å; L716-I765 WeakPolarHBondContact CA-O 3.33Å; Y717-I765 PolarHBondContact N-O 2.69Å; L762-I765 HydrophobicContact CB-CD1 4.46Å; L762-I765 HydrophobicContact CB-CG1 4.22Å; I765-D767 PolarHBondContact O-N 2.64Å; I765-T769 HydrophobicContact CG2-CG2 4.29Å; I765-A770 HydrophobicContact CG2-CB 4.22Å; I765-F794 HydrophobicContact CD1-CE2 3.33Å; I765-F794 HydrophobicContact CD1-CZ 3.49Å; I765-F794 VanDerWaalsContact CD1-CZ 3.49Å
766	P	93.3	Very high	91.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	137.1	173.2	-22.6	34.2	0	0	0	111.8	F689 L694 L697 Y717 T719 S768 T769 A770	F689-P766 HydrophobicContact CD1-CG 4.22Å; F689-P766 HydrophobicContact CD2-CB 3.96Å; F689-P766 HydrophobicContact CD2-CG 3.57Å; F689-P766 HydrophobicContact CE1-CG 4.07Å; F689-P766 HydrophobicContact CE2-CB 3.37Å; F689-P766 HydrophobicContact CE2-CG 3.41Å; F689-P766 VanDerWaalsContact CE2-CG 3.41Å; F689-P766 HydrophobicContact CG-CG 3.99Å; F689-P766 HydrophobicContact CZ-CB 3.74Å; F689-P766 HydrophobicContact CZ-CG 3.67Å; L694-P766 HydrophobicContact CD2-CG 4.23Å; L697-P766 HydrophobicContact CD1-CG 3.81Å; Y717-P766 HydrophobicContact CD1-CB 4.36Å; Y717-P766 CarbonylContact O-C 3.59Å; Y717-P766 WeakPolarHBondContact O-CA 3.3Å; T719-P766 HydrophobicContact CG2-CB 4.17Å; P766-S768 VanDerWaalsContact C-N 3.26Å; P766-S768 PolarHBondContact O-N 3.35Å; P766-T769 WeakPolarHBondContact O-CB 3.42Å; P766-T769 PolarHBondContact O-N 2.84Å; P766-A770 PolarHBondContact O-N 3.47Å
767	D	91.3	Very high	91.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-57.9	-36.8	176.8	56.7	-1.7	0	0	0	113.1	Y717 L718 T719 I765 T769 A770 G771 L802 K819	Y717-D767 PolarHBondContact O-N 3.43Å; L718-D767 WeakPolarHBondContact CA-OD2 3.43Å; T719-D767 WeakPolarHBondContact CB-OD1 3.5Å; T719-D767 WeakPolarHBondContact CG2-OD1 3.49Å; T719-D767 PolarHBondContact N-OD1 3.48Å; T719-D767 PolarHBondContact N-OD2 3.38Å; T719-D767 PolarHBondContact OG1-OD1 3.4Å; I765-D767 PolarHBondContact O-N 2.64Å; D767-T769 VanDerWaalsContact C-N 3.34Å; D767-T769 PolarHBondContact O-N 3.35Å; D767-A770 PolarHBondContact O-N 2.99Å; D767-G771 PolarHBondContact O-N 3.45Å; D767-L802 HydrophobicContact CB-CD2 4.14Å; D767-K819 IonicContact OD1-NZ 2.78Å; D767-K819 WeakPolarHBondContact OD2-CE 3.36Å; D767-K819 IonicContact OD2-NZ 3.49Å; D767-K819 PolarHBondContact OD2-NZ 3.19Å
768	S	91.9	Very high	91.4	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.007	11%	0.109	C	C	.	.	H	α-helix	trans	-60.6	-43	171.9	69.1	0	0	0	0	111.6	H727 P766 S772	H727-S768 WeakPolarHBondContact ND1-CB 3.41Å; H727-S768 PolarHBondContact ND1-OG 3.04Å; H727-S768 VanDerWaalsContact ND1-OG 3.09Å; P766-S768 VanDerWaalsContact C-N 3.26Å; P766-S768 PolarHBondContact O-N 3.35Å; S768-S772 VanDerWaalsContact O-CB 3.29Å; S768-S772 WeakPolarHBondContact O-CB 3.43Å; S768-S772 PolarHBondContact O-N 3.17Å; S768-S772 PolarHBondContact O-OG 3.32Å
769	T	94.3	Very high	91.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-68.3	-44.5	180	-54.4	0	0	0	0	111.1	I687 F689 L759 I765 P766 D767 S772 V773	I687-T769 HydrophobicContact CG2-CG2 4.06Å; I687-T769 WeakPolarHBondContact O-CB 3.47Å; I687-T769 WeakPolarHBondContact O-CG2 3.46Å; I687-T769 PolarHBondContact O-OG1 3.38Å; F689-T769 WeakPolarHBondContact CD2-OG1 3.36Å; L759-T769 HydrophobicContact CD1-CG2 4.36Å; I765-T769 HydrophobicContact CG2-CG2 4.29Å; P766-T769 WeakPolarHBondContact O-CB 3.42Å; P766-T769 PolarHBondContact O-N 2.84Å; D767-T769 VanDerWaalsContact C-N 3.34Å; D767-T769 PolarHBondContact O-N 3.35Å; T769-S772 PolarHBondContact O-N 2.97Å; T769-V773 WeakPolarHBondContact O-CB 3.45Å; T769-V773 VanDerWaalsContact O-CG2 3.3Å; T769-V773 WeakPolarHBondContact O-CG2 3.21Å; T769-V773 PolarHBondContact O-N 2.99Å
770	A	93.2	Very high	90.8	Very high	2 Å²	2	18 Å²	18	2%	0.017	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-44.7	177	0	0	0	0	0	111.4	L716 I765 P766 D767 L774 C798 L802	L716-A770 HydrophobicContact CD2-CB 4.13Å; I765-A770 HydrophobicContact CG2-CB 4.22Å; P766-A770 PolarHBondContact O-N 3.47Å; D767-A770 PolarHBondContact O-N 2.99Å; A770-L774 WeakPolarHBondContact O-CG 3.34Å; A770-L774 PolarHBondContact O-N 3.14Å; A770-L774 VanDerWaalsContact O-N 3.14Å; A770-C798 HydrophobicContact CB-CB 4.42Å; A770-L802 HydrophobicContact CB-CD1 3.96Å; A770-L802 HydrophobicContact CB-CD2 4.35Å; A770-L802 HydrophobicContact CB-CG 4.32Å
771	G	92.7	Very high	90.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.7	-45.4	174.2	0	0	0	0	0	112.9	D767 V773 L774 C775	D767-G771 PolarHBondContact O-N 3.45Å; G771-V773 PolarHBondContact O-N 3.37Å; G771-L774 PolarHBondContact O-N 2.87Å; G771-C775 WeakPolarHBondContact O-CB 3.25Å; G771-C775 PolarHBondContact O-N 3.08Å
772	S	93.3	Very high	90.2	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.007	9%	0.093	C	C	.	.	H	α-helix	trans	-63.7	-40.5	179.4	-68.3	0	0	0	0	113.1	T731 S768 T769 C775 A776	T731-S772 WeakPolarHBondContact OG1-CB 3.36Å; T731-S772 PolarHBondContact OG1-OG 3.47Å; S768-S772 VanDerWaalsContact O-CB 3.29Å; S768-S772 WeakPolarHBondContact O-CB 3.43Å; S768-S772 PolarHBondContact O-N 3.17Å; S768-S772 PolarHBondContact O-OG 3.32Å; T769-S772 PolarHBondContact O-N 2.97Å; S772-C775 PolarHBondContact O-N 3.36Å; S772-A776 WeakPolarHBondContact O-CB 3.36Å; S772-A776 PolarHBondContact O-N 3.02Å
773	V	93.9	Very high	89.2	Confident	4 Å²	4	25.6 Å²	25.6	2%	0.024	13%	0.129	C	C	.	.	H	α-helix	trans	-63.9	-44.9	175.6	168.8	0	0	0	0	111.1	I755 L759 T769 G771 A776 I777 L795	I755-V773 HydrophobicContact CD1-CG1 3.74Å; I755-V773 HydrophobicContact CG1-CG1 4.37Å; I755-V773 HydrophobicContact CG2-CG1 4.45Å; L759-V773 HydrophobicContact CD1-CG2 3.84Å; T769-V773 WeakPolarHBondContact O-CB 3.45Å; T769-V773 VanDerWaalsContact O-CG2 3.3Å; T769-V773 WeakPolarHBondContact O-CG2 3.21Å; T769-V773 PolarHBondContact O-N 2.99Å; G771-V773 PolarHBondContact O-N 3.37Å; V773-A776 PolarHBondContact O-N 3.42Å; V773-I777 HydrophobicContact CG1-CD1 3.84Å; V773-I777 WeakPolarHBondContact O-CG1 3.47Å; V773-I777 PolarHBondContact O-N 2.83Å; V773-L795 HydrophobicContact CG1-CD2 3.9Å
774	L	92.1	Very high	88.3	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-45.8	175.4	-73.4	170.2	0	0	0	111.4	A770 G771 A776 I777 N778 L795 C799 L802 A830	A770-L774 WeakPolarHBondContact O-CG 3.34Å; A770-L774 PolarHBondContact O-N 3.14Å; A770-L774 VanDerWaalsContact O-N 3.14Å; G771-L774 PolarHBondContact O-N 2.87Å; L774-A776 VanDerWaalsContact C-N 3.34Å; L774-A776 PolarHBondContact O-N 2.99Å; L774-I777 PolarHBondContact O-N 3.34Å; L774-N778 WeakPolarHBondContact O-CB 3.27Å; L774-N778 PolarHBondContact O-N 3.45Å; L774-N778 PolarHBondContact O-ND2 3.15Å; L774-N778 PolarHBondContact O-OD1 3.25Å; L774-L795 HydrophobicContact CD2-CB 4.26Å; L774-L795 HydrophobicContact CD2-CD2 3.97Å; L774-C799 VanDerWaalsContact CD2-SG 3.51Å; L774-L802 HydrophobicContact CD1-CD1 3.52Å; L774-A830 HydrophobicContact CD2-CB 4.06Å
775	C	92.3	Very high	87.8	Confident	6 Å²	6	26.5 Å²	26.5	4%	0.041	14%	0.142	C	C	.	.	H	α-helix	trans	-60.1	-43	176.5	-178.9	0	0	0	0	112	W728 G771 S772 N778 K779	W728-C775 HydrophobicContact CH2-CB 4.15Å; G771-C775 WeakPolarHBondContact O-CB 3.25Å; G771-C775 PolarHBondContact O-N 3.08Å; S772-C775 PolarHBondContact O-N 3.36Å; C775-N778 PolarHBondContact O-N 3.24Å; C775-K779 WeakPolarHBondContact O-CG 3.49Å; C775-K779 PolarHBondContact O-N 2.86Å; C775-K779 VanDerWaalsContact O-N 3.12Å
776	A	90.9	Very high	87.2	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66	-44	-179.8	0	0	0	0	0	112.1	L686 C735 L751 S772 V773 L774 K779 L780	L686-A776 HydrophobicContact CD1-CB 4.07Å; L686-A776 HydrophobicContact CD2-CB 3.95Å; C735-A776 VanDerWaalsContact SG-CA 3.51Å; L751-A776 HydrophobicContact CD2-CB 4.22Å; S772-A776 WeakPolarHBondContact O-CB 3.36Å; S772-A776 PolarHBondContact O-N 3.02Å; V773-A776 PolarHBondContact O-N 3.42Å; L774-A776 VanDerWaalsContact C-N 3.34Å; L774-A776 PolarHBondContact O-N 2.99Å; A776-K779 PolarHBondContact O-N 3.4Å; A776-L780 WeakPolarHBondContact O-CB 3.37Å; A776-L780 VanDerWaalsContact O-CG 3.29Å; A776-L780 WeakPolarHBondContact O-CG 3.42Å; A776-L780 PolarHBondContact O-N 3.48Å; A776-L780 VanDerWaalsContact O-N 3.08Å
777	I	90.3	Very high	86.7	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-45.1	176.5	-70.6	169.2	0	0	0	110.4	F748 I755 V773 L774 K779 L780 L781 L791 L795 L834	F748-I777 HydrophobicContact CE2-CG1 4.49Å; F748-I777 HydrophobicContact CE2-CG2 4.21Å; I755-I777 HydrophobicContact CD1-CD1 4.06Å; I755-I777 HydrophobicContact CD1-CG1 4.44Å; V773-I777 HydrophobicContact CG1-CD1 3.84Å; V773-I777 WeakPolarHBondContact O-CG1 3.47Å; V773-I777 PolarHBondContact O-N 2.83Å; L774-I777 PolarHBondContact O-N 3.34Å; I777-K779 VanDerWaalsContact C-N 3.28Å; I777-K779 PolarHBondContact O-N 3.01Å; I777-L780 PolarHBondContact O-N 2.96Å; I777-L781 VanDerWaalsContact O-CB 3.28Å; I777-L781 WeakPolarHBondContact O-CB 3.41Å; I777-L781 PolarHBondContact O-N 3.2Å; I777-L791 HydrophobicContact CD1-CD1 4.18Å; I777-L791 HydrophobicContact CD1-CD2 4.14Å; I777-L791 HydrophobicContact CD1-CG 4.47Å; I777-L795 HydrophobicContact CD1-CD1 3.46Å; I777-L795 VanDerWaalsContact CD1-CD1 3.46Å; I777-L795 HydrophobicContact CD1-CD2 3.48Å; I777-L795 VanDerWaalsContact CD1-CD2 3.48Å; I777-L795 HydrophobicContact CD1-CG 3.99Å; I777-L795 HydrophobicContact CG2-CD1 4.14Å; I777-L834 HydrophobicContact CG2-CD1 4.28Å
778	N	88.5	Confident	86.5	Confident	26 Å²	26	36.8 Å²	36.8	14%	0.139	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-36.4	179.3	-69.3	-14.4	0	0	0	113.2	L774 C775 S826 A830	L774-N778 WeakPolarHBondContact O-CB 3.27Å; L774-N778 PolarHBondContact O-N 3.45Å; L774-N778 PolarHBondContact O-ND2 3.15Å; L774-N778 PolarHBondContact O-OD1 3.25Å; C775-N778 PolarHBondContact O-N 3.24Å; N778-S826 PolarHBondContact ND2-O 3.33Å; N778-A830 PolarHBondContact ND2-N 3.48Å; N778-A830 WeakPolarHBondContact OD1-CA 3.49Å; N778-A830 VanDerWaalsContact OD1-CB 3.23Å; N778-A830 WeakPolarHBondContact OD1-CB 3.43Å
779	K	86.8	Confident	86.2	Confident	103 Å²	103	41.1 Å²	41.1	45%	0.448	22%	0.216	S	C	.	.	H	α-helix	trans	-82.3	-23.2	-178.4	-73.5	-175.5	176.9	179.3	0	113.7	C735 C775 A776 I777	C735-K779 HydrophobicContact CB-CB 4.29Å; C735-K779 HydrophobicContact CB-CD 3.63Å; C775-K779 WeakPolarHBondContact O-CG 3.49Å; C775-K779 PolarHBondContact O-N 2.86Å; C775-K779 VanDerWaalsContact O-N 3.12Å; A776-K779 PolarHBondContact O-N 3.4Å; I777-K779 VanDerWaalsContact C-N 3.28Å; I777-K779 PolarHBondContact O-N 3.01Å
780	L	84.9	Confident	85.9	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-104.1	-11.1	-175.3	-64.5	170.8	0	0	0	114	L738 F748 L751 A776 I777 D782	L738-L780 HydrophobicContact CB-CD1 3.88Å; L738-L780 HydrophobicContact CB-CD2 3.6Å; L738-L780 HydrophobicContact CB-CG 4.35Å; L738-L780 HydrophobicContact CD1-CD1 3.75Å; L738-L780 HydrophobicContact CG-CD1 4.43Å; F748-L780 HydrophobicContact CD2-CB 4.36Å; L751-L780 HydrophobicContact CD2-CD1 3.64Å; A776-L780 WeakPolarHBondContact O-CB 3.37Å; A776-L780 VanDerWaalsContact O-CG 3.29Å; A776-L780 WeakPolarHBondContact O-CG 3.42Å; A776-L780 PolarHBondContact O-N 3.48Å; A776-L780 VanDerWaalsContact O-N 3.08Å; I777-L780 PolarHBondContact O-N 2.96Å; L780-D782 PolarHBondContact O-N 3.26Å
781	L	84.3	Confident	85.7	Confident	37 Å²	37	45.3 Å²	45.3	19%	0.194	24%	0.238	C	C	.	.			trans	-72.4	117.5	-179.5	-169.1	77.6	0	0	0	111.2	F748 I777 C785 L787 L833 L834	F748-L781 HydrophobicContact CE1-CD1 4.46Å; F748-L781 HydrophobicContact CE2-CD1 3.88Å; F748-L781 HydrophobicContact CZ-CD1 3.83Å; I777-L781 VanDerWaalsContact O-CB 3.28Å; I777-L781 WeakPolarHBondContact O-CB 3.41Å; I777-L781 PolarHBondContact O-N 3.2Å; L781-C785 HydrophobicContact CD1-CB 3.82Å; L781-L787 HydrophobicContact CD1-CD1 3.35Å; L781-L833 HydrophobicContact CB-CD2 3.89Å; L781-L833 HydrophobicContact CD2-CD2 3.55Å; L781-L833 HydrophobicContact CD2-CG 3.74Å; L781-L833 HydrophobicContact CG-CD2 4.34Å; L781-L834 HydrophobicContact CD2-CD2 3.44Å; L781-L834 VanDerWaalsContact CD2-CD2 3.44Å; L781-L834 HydrophobicContact CD2-CG 3.97Å
782	D	78.3	Confident	85.6	Confident	80 Å²	80	46 Å²	46	43%	0.428	24%	0.241	S	C	.	.			trans	-111.9	164	169.3	-172.3	21.3	0	0	0	110.6	L780 A784 C785	L780-D782 PolarHBondContact O-N 3.26Å; D782-A784 PolarHBondContact O-N 2.97Å; D782-C785 WeakPolarHBondContact O-CB 3.43Å; D782-C785 PolarHBondContact O-N 3.08Å
783	Q	69.6	Low	85.4	Confident	200 Å²	200	51.5 Å²	51.5	94%	0.935	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-22.1	-179.1	-65.5	-175.8	-4.2	0	0	113.4
784	A	69.7	Low	85.3	Confident	70 Å²	70	51.9 Å²	51.9	58%	0.579	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-8.1	178.4	0	0	0	0	0	114.9	D782	D782-A784 PolarHBondContact O-N 2.97Å
785	C	79.2	Confident	85.2	Confident	19 Å²	19	51.9 Å²	51.9	13%	0.128	27%	0.266	C	S	.	.			trans	-87.7	136.4	-174.2	-63.5	0	0	0	0	112.3	F748 L781 D782	F748-C785 HydrophobicContact CD1-CB 3.77Å; F748-C785 HydrophobicContact CE1-CB 4.09Å; F748-C785 HydrophobicContact CG-CB 4.07Å; L781-C785 HydrophobicContact CD1-CB 3.82Å; D782-C785 WeakPolarHBondContact O-CB 3.43Å; D782-C785 PolarHBondContact O-N 3.08Å
786	I	81.1	Confident	85.1	Confident	136 Å²	136	51.8 Å²	51.8	70%	0.697	27%	0.266	S	S	*	.			trans	-110.8	118.2	177.1	-59.7	170.4	0	0	0	109.6	Q752	Q752-I786 PolarHBondContact NE2-O 2.78Å
787	L	83.1	Confident	85.1	Confident	16 Å²	16	52.7 Å²	52.7	8%	0.084	27%	0.272	C	S	.	.			trans	-78	134.8	175.7	-87.2	84.2	0	0	0	112.2	F748 Q752 L781 L791 H792 L795 L834	F748-L787 HydrophobicContact CE1-CD1 4.16Å; F748-L787 HydrophobicContact CE1-CG 4.24Å; F748-L787 HydrophobicContact CZ-CD1 3.73Å; F748-L787 HydrophobicContact CZ-CG 3.84Å; Q752-L787 VanDerWaalsContact OE1-CA 3.26Å; L781-L787 HydrophobicContact CD1-CD1 3.35Å; L787-L791 HydrophobicContact CD2-CD2 4.32Å; L787-L791 HydrophobicContact CG-CD2 4.36Å; L787-H792 WeakPolarHBondContact CB-CE1 3.24Å; L787-H792 WeakPolarHBondContact CB-ND1 3.32Å; L787-H792 PolarHBondContact O-CE1 3.38Å; L787-H792 VanDerWaalsContact O-CE1 3.3Å; L787-L795 HydrophobicContact CD2-CD1 4.14Å; L787-L834 HydrophobicContact CD1-CD2 3.74Å; L787-L834 HydrophobicContact CD2-CD1 3.76Å; L787-L834 HydrophobicContact CD2-CD2 4.09Å
788	N	86.2	Confident	85.2	Confident	65 Å²	65	52.8 Å²	52.8	35%	0.348	27%	0.273	S	S	.	.			trans	-65.6	139.8	169.7	-172.3	-30.4	0	0	0	110.5	Q752 N790 L791 H792	Q752-N788 HydrophobicContact CG-CB 4.16Å; N788-N790 VanDerWaalsContact C-N 3.26Å; N788-N790 PolarHBondContact O-N 3.3Å; N788-N790 PolarHBondContact OD1-N 3.3Å; N788-L791 HydrophobicContact CB-CB 4.22Å; N788-L791 WeakPolarHBondContact O-CB 3.36Å; N788-L791 PolarHBondContact O-N 2.96Å; N788-H792 PolarHBondContact O-N 3.24Å; N788-H792 PolarHBondContact O-ND1 3.33Å
789	E	86.4	Confident	85.3	Confident	93 Å²	93	51.5 Å²	51.5	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-56.7	-37.5	176.5	-73	-64.6	150.8	0	0	112.9	L791 H792 K793 R836	E789-L791 VanDerWaalsContact C-N 3.32Å; E789-L791 PolarHBondContact O-N 2.92Å; E789-H792 PolarHBondContact O-N 3.26Å; E789-K793 PolarHBondContact O-N 3Å; E789-K793 VanDerWaalsContact O-N 3.17Å; E789-R836 IonicContact OE1-NH1 3.02Å
790	N	87.6	Confident	85.4	Confident	90 Å²	90	46.7 Å²	46.7	48%	0.481	25%	0.245	S	C	.	.	H	α-helix	trans	-66.4	-36.9	176.3	-69.6	-21.5	0	0	0	111.8	N788 F794	N788-N790 VanDerWaalsContact C-N 3.26Å; N788-N790 PolarHBondContact O-N 3.3Å; N788-N790 PolarHBondContact OD1-N 3.3Å; N790-F794 WeakPolarHBondContact O-CB 3.4Å; N790-F794 PolarHBondContact O-N 3.27Å; N790-F794 VanDerWaalsContact O-N 3.1Å
791	L	89.4	Confident	85.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.5	-43.9	175.6	-176.9	63.6	0	0	0	110.6	Q752 I755 I777 L787 N788 E789 K793 F794 L795	Q752-L791 HydrophobicContact CB-CD2 4.1Å; Q752-L791 HydrophobicContact CG-CD2 3.86Å; Q752-L791 VanDerWaalsContact OE1-CD2 3.25Å; I755-L791 HydrophobicContact CB-CD1 4.19Å; I755-L791 HydrophobicContact CD1-CD1 4.41Å; I755-L791 HydrophobicContact CG2-CD1 3.54Å; I777-L791 HydrophobicContact CD1-CD1 4.18Å; I777-L791 HydrophobicContact CD1-CD2 4.14Å; I777-L791 HydrophobicContact CD1-CG 4.47Å; L787-L791 HydrophobicContact CD2-CD2 4.32Å; L787-L791 HydrophobicContact CG-CD2 4.36Å; N788-L791 HydrophobicContact CB-CB 4.22Å; N788-L791 WeakPolarHBondContact O-CB 3.36Å; N788-L791 PolarHBondContact O-N 2.96Å; E789-L791 VanDerWaalsContact C-N 3.32Å; E789-L791 PolarHBondContact O-N 2.92Å; L791-K793 PolarHBondContact O-N 2.82Å; L791-F794 HydrophobicContact CD1-CD1 4.27Å; L791-F794 WeakPolarHBondContact O-CB 3.3Å; L791-F794 PolarHBondContact O-N 3.4Å; L791-L795 HydrophobicContact CD1-CD1 4.39Å; L791-L795 HydrophobicContact CD1-CD2 4.12Å; L791-L795 HydrophobicContact CD1-CG 4.02Å; L791-L795 HydrophobicContact CG-CD1 4.08Å; L791-L795 HydrophobicContact CG-CG 4.12Å; L791-L795 VanDerWaalsContact O-CG 3.3Å; L791-L795 WeakPolarHBondContact O-CG 3.2Å; L791-L795 PolarHBondContact O-N 3.26Å
792	H	89.1	Confident	86	Confident	13 Å²	13	44.9 Å²	44.9	6%	0.06	24%	0.236	C	C	.	.	H	α-helix	trans	-55.6	-47.8	176.8	-76.2	102.1	0	0	0	112.8	L787 N788 E789 F794 L795 A796 L840	L787-H792 WeakPolarHBondContact CB-CE1 3.24Å; L787-H792 WeakPolarHBondContact CB-ND1 3.32Å; L787-H792 PolarHBondContact O-CE1 3.38Å; L787-H792 VanDerWaalsContact O-CE1 3.3Å; N788-H792 PolarHBondContact O-N 3.24Å; N788-H792 PolarHBondContact O-ND1 3.33Å; E789-H792 PolarHBondContact O-N 3.26Å; H792-F794 VanDerWaalsContact C-N 3.33Å; H792-F794 PolarHBondContact O-N 3.27Å; H792-L795 PolarHBondContact O-N 3.09Å; H792-A796 WeakPolarHBondContact O-CB 3.43Å; H792-A796 PolarHBondContact O-N 2.97Å; H792-L840 HydrophobicContact CB-CD1 3.63Å
793	K	89.1	Confident	86.5	Confident	118 Å²	118	41 Å²	41	51%	0.513	22%	0.215	S	C	.	.	H	α-helix	trans	-63.3	-41.6	178.4	-69.6	177.4	-177.5	177.1	0	111.8	E789 L791 A796 S797	E789-K793 PolarHBondContact O-N 3Å; E789-K793 VanDerWaalsContact O-N 3.17Å; L791-K793 PolarHBondContact O-N 2.82Å; K793-A796 PolarHBondContact O-N 3.49Å; K793-S797 WeakPolarHBondContact O-CB 3.39Å; K793-S797 PolarHBondContact O-N 3.43Å; K793-S797 PolarHBondContact O-OG 2.89Å
794	F	91.7	Very high	87.4	Confident	12 Å²	12	33 Å²	33	5%	0.053	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-49.4	177	175.7	-104.8	0	0	0	112.1	V714 I755 L759 V760 I765 N790 L791 H792 A796 S797 C798	V714-F794 HydrophobicContact CG2-CE2 4.46Å; I755-F794 HydrophobicContact CG2-CD1 4.06Å; I755-F794 HydrophobicContact CG2-CE1 3.88Å; L759-F794 HydrophobicContact CB-CE1 4.38Å; L759-F794 HydrophobicContact CB-CE2 4.45Å; L759-F794 HydrophobicContact CB-CZ 3.87Å; V760-F794 HydrophobicContact CB-CD2 4.38Å; V760-F794 HydrophobicContact CG1-CB 4.49Å; V760-F794 HydrophobicContact CG2-CB 3.81Å; V760-F794 HydrophobicContact CG2-CD1 4.19Å; V760-F794 HydrophobicContact CG2-CD2 4.03Å; V760-F794 HydrophobicContact CG2-CG 3.74Å; I765-F794 HydrophobicContact CD1-CE2 3.33Å; I765-F794 HydrophobicContact CD1-CZ 3.49Å; I765-F794 VanDerWaalsContact CD1-CZ 3.49Å; N790-F794 WeakPolarHBondContact O-CB 3.4Å; N790-F794 PolarHBondContact O-N 3.27Å; N790-F794 VanDerWaalsContact O-N 3.1Å; L791-F794 HydrophobicContact CD1-CD1 4.27Å; L791-F794 WeakPolarHBondContact O-CB 3.3Å; L791-F794 PolarHBondContact O-N 3.4Å; H792-F794 VanDerWaalsContact C-N 3.33Å; H792-F794 PolarHBondContact O-N 3.27Å; F794-A796 VanDerWaalsContact C-N 3.31Å; F794-A796 PolarHBondContact O-N 3.42Å; F794-S797 WeakPolarHBondContact O-CB 3.15Å; F794-S797 PolarHBondContact O-N 3.44Å; F794-C798 PolarHBondContact O-N 3.36Å; F794-C798 PolarHBondContact O-SG 3.13Å; F794-C798 VanDerWaalsContact O-SG 3.39Å
795	L	91.9	Very high	88.2	Confident	1 Å²	1	30 Å²	30	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-62.8	-38	177.1	-63.4	-177.7	0	0	0	112	V773 L774 I777 L787 L791 H792 S797 C798 C799 L834 L837	V773-L795 HydrophobicContact CG1-CD2 3.9Å; L774-L795 HydrophobicContact CD2-CB 4.26Å; L774-L795 HydrophobicContact CD2-CD2 3.97Å; I777-L795 HydrophobicContact CD1-CD1 3.46Å; I777-L795 VanDerWaalsContact CD1-CD1 3.46Å; I777-L795 HydrophobicContact CD1-CD2 3.48Å; I777-L795 VanDerWaalsContact CD1-CD2 3.48Å; I777-L795 HydrophobicContact CD1-CG 3.99Å; I777-L795 HydrophobicContact CG2-CD1 4.14Å; L787-L795 HydrophobicContact CD2-CD1 4.14Å; L791-L795 HydrophobicContact CD1-CD1 4.39Å; L791-L795 HydrophobicContact CD1-CD2 4.12Å; L791-L795 HydrophobicContact CD1-CG 4.02Å; L791-L795 HydrophobicContact CG-CD1 4.08Å; L791-L795 HydrophobicContact CG-CG 4.12Å; L791-L795 VanDerWaalsContact O-CG 3.3Å; L791-L795 WeakPolarHBondContact O-CG 3.2Å; L791-L795 PolarHBondContact O-N 3.26Å; H792-L795 PolarHBondContact O-N 3.09Å; L795-S797 VanDerWaalsContact C-N 3.31Å; L795-S797 PolarHBondContact O-N 3.12Å; L795-C798 PolarHBondContact O-N 2.85Å; L795-C799 WeakPolarHBondContact O-CB 3.39Å; L795-C799 PolarHBondContact O-N 3.34Å; L795-C799 PolarHBondContact O-SG 2.92Å; L795-C799 VanDerWaalsContact O-SG 3.42Å; L795-L834 HydrophobicContact CD1-CD1 4.47Å; L795-L837 HydrophobicContact CB-CD1 3.5Å; L795-L837 VanDerWaalsContact CB-CD1 3.5Å
796	A	90.2	Very high	88.5	Confident	4 Å²	4	29.2 Å²	29.2	3%	0.033	15%	0.145	C	C	.	.	H	α-helix	trans	-62.5	-42.7	176.9	0	0	0	0	0	110.8	H792 K793 F794 C799 Y800 L837 L840 M841	H792-A796 WeakPolarHBondContact O-CB 3.43Å; H792-A796 PolarHBondContact O-N 2.97Å; K793-A796 PolarHBondContact O-N 3.49Å; F794-A796 VanDerWaalsContact C-N 3.31Å; F794-A796 PolarHBondContact O-N 3.42Å; A796-C799 PolarHBondContact O-N 3.48Å; A796-Y800 PolarHBondContact O-N 3.28Å; A796-L837 HydrophobicContact CB-CD1 3.92Å; A796-L837 VanDerWaalsContact N-CD1 3.27Å; A796-L840 HydrophobicContact CB-CB 4Å; A796-M841 HydrophobicContact CB-CB 4.35Å
797	S	90.5	Very high	88.7	Confident	19 Å²	19	23.6 Å²	23.6	13%	0.133	12%	0.116	C	C	.	.	H	α-helix	trans	-63.4	-43.7	175.9	-54.5	0	0	0	0	111.5	S712 K793 F794 L795 S801	S712-S797 WeakPolarHBondContact OG-CB 3.29Å; S712-S797 PolarHBondContact OG-O 3.2Å; S712-S797 VanDerWaalsContact OG-O 3.07Å; K793-S797 WeakPolarHBondContact O-CB 3.39Å; K793-S797 PolarHBondContact O-N 3.43Å; K793-S797 PolarHBondContact O-OG 2.89Å; F794-S797 WeakPolarHBondContact O-CB 3.15Å; F794-S797 PolarHBondContact O-N 3.44Å; L795-S797 VanDerWaalsContact C-N 3.31Å; L795-S797 PolarHBondContact O-N 3.12Å; S797-S801 WeakPolarHBondContact O-CB 3.43Å; S797-S801 PolarHBondContact O-N 3.27Å; S797-S801 PolarHBondContact O-OG 2.94Å
798	C	91.9	Very high	88.6	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.014	13%	0.13	C	C	.	.	H	α-helix	trans	-64.1	-46.9	175.6	-70.6	0	0	0	0	112.5	A770 F794 L795 Y800 S801 L802	A770-C798 HydrophobicContact CB-CB 4.42Å; F794-C798 PolarHBondContact O-N 3.36Å; F794-C798 PolarHBondContact O-SG 3.13Å; F794-C798 VanDerWaalsContact O-SG 3.39Å; L795-C798 PolarHBondContact O-N 2.85Å; C798-Y800 VanDerWaalsContact C-N 3.34Å; C798-Y800 PolarHBondContact O-N 3.16Å; C798-S801 PolarHBondContact O-N 3.48Å; C798-L802 WeakPolarHBondContact O-CB 3.27Å; C798-L802 VanDerWaalsContact O-CG 3.25Å; C798-L802 WeakPolarHBondContact O-CG 3.11Å; C798-L802 PolarHBondContact O-N 3.3Å
799	C	90.9	Very high	88.1	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.4	-47.4	177.3	-79.6	0	0	0	0	111.1	L774 L795 A796 L802 L803 M841	L774-C799 VanDerWaalsContact CD2-SG 3.51Å; L795-C799 WeakPolarHBondContact O-CB 3.39Å; L795-C799 PolarHBondContact O-N 3.34Å; L795-C799 PolarHBondContact O-SG 2.92Å; L795-C799 VanDerWaalsContact O-SG 3.42Å; A796-C799 PolarHBondContact O-N 3.48Å; C799-L802 PolarHBondContact O-N 3.03Å; C799-L803 WeakPolarHBondContact O-CB 3.4Å; C799-L803 WeakPolarHBondContact O-CD1 3.47Å; C799-L803 WeakPolarHBondContact O-CG 3.36Å; C799-L803 PolarHBondContact O-N 2.92Å; C799-M841 HydrophobicContact CB-SD 4.13Å
800	Y	89.4	Confident	87.1	Confident	1 Å²	1	25.9 Å²	25.9	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-65.7	-48.4	179.1	179.1	-102.5	0	0	0	112	T709 L711 A796 C798 L802 L803 Y804 L845 L861	T709-Y800 HydrophobicContact CG2-CD1 3.98Å; T709-Y800 HydrophobicContact CG2-CE1 3.58Å; T709-Y800 WeakPolarHBondContact OG1-CE1 3.33Å; L711-Y800 HydrophobicContact CB-CD1 4.39Å; L711-Y800 HydrophobicContact CB-CE1 3.54Å; L711-Y800 HydrophobicContact CD1-CE1 4.48Å; L711-Y800 VanDerWaalsContact CD1-OH 3.22Å; L711-Y800 WeakPolarHBondContact CD1-OH 3.13Å; A796-Y800 PolarHBondContact O-N 3.28Å; C798-Y800 VanDerWaalsContact C-N 3.34Å; C798-Y800 PolarHBondContact O-N 3.16Å; Y800-L802 VanDerWaalsContact C-N 3.27Å; Y800-L802 PolarHBondContact O-N 2.86Å; Y800-L803 PolarHBondContact O-N 3.19Å; Y800-Y804 VanDerWaalsContact O-CB 3.27Å; Y800-Y804 WeakPolarHBondContact O-CB 3.46Å; Y800-Y804 PolarHBondContact O-N 3.19Å; Y800-L845 HydrophobicContact CD2-CD2 3.58Å; Y800-L845 HydrophobicContact CE2-CD2 3.18Å; Y800-L845 HydrophobicContact CG-CD2 4.49Å; Y800-L861 HydrophobicContact CD2-CD2 3.89Å; Y800-L861 HydrophobicContact CE2-CD2 3.82Å
801	S	90	Very high	85.8	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-59.5	-38.3	178.8	-61.1	0	0	0	0	112.2	S712 V714 L716 S797 C798 F805	S712-S801 VanDerWaalsContact CB-OG 3.25Å; S712-S801 WeakPolarHBondContact CB-OG 3.27Å; S712-S801 PolarHBondContact OG-OG 3.46Å; V714-S801 WeakPolarHBondContact O-CB 3.43Å; V714-S801 PolarHBondContact O-OG 2.91Å; L716-S801 VanDerWaalsContact CD1-C 3.44Å; L716-S801 VanDerWaalsContact CD1-O 3.29Å; L716-S801 WeakPolarHBondContact CD1-O 3.47Å; S797-S801 WeakPolarHBondContact O-CB 3.43Å; S797-S801 PolarHBondContact O-N 3.27Å; S797-S801 PolarHBondContact O-OG 2.94Å; C798-S801 PolarHBondContact O-N 3.48Å; S801-F805 WeakPolarHBondContact O-CB 3.2Å; S801-F805 PolarHBondContact O-N 3.17Å
802	L	90.4	Very high	83.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68	-48.1	175.9	-73.7	168	0	0	0	111.4	L716 D767 A770 L774 C798 C799 Y800 Y804 F805 L806 L823	L716-L802 HydrophobicContact CD1-CB 4.43Å; L716-L802 HydrophobicContact CD1-CD2 3.66Å; L716-L802 HydrophobicContact CD1-CG 3.99Å; L716-L802 HydrophobicContact CD2-CD2 4.28Å; D767-L802 HydrophobicContact CB-CD2 4.14Å; A770-L802 HydrophobicContact CB-CD1 3.96Å; A770-L802 HydrophobicContact CB-CD2 4.35Å; A770-L802 HydrophobicContact CB-CG 4.32Å; L774-L802 HydrophobicContact CD1-CD1 3.52Å; C798-L802 WeakPolarHBondContact O-CB 3.27Å; C798-L802 VanDerWaalsContact O-CG 3.25Å; C798-L802 WeakPolarHBondContact O-CG 3.11Å; C798-L802 PolarHBondContact O-N 3.3Å; C799-L802 PolarHBondContact O-N 3.03Å; Y800-L802 VanDerWaalsContact C-N 3.27Å; Y800-L802 PolarHBondContact O-N 2.86Å; L802-Y804 VanDerWaalsContact C-N 3.32Å; L802-Y804 PolarHBondContact O-N 3.11Å; L802-F805 WeakPolarHBondContact O-CB 3.3Å; L802-F805 PolarHBondContact O-N 3.14Å; L802-L806 VanDerWaalsContact O-CG 3.27Å; L802-L806 WeakPolarHBondContact O-CG 3.23Å; L802-L806 PolarHBondContact O-N 3.35Å; L802-L823 HydrophobicContact CD2-CD1 4.11Å; L802-L823 HydrophobicContact CD2-CD2 4.09Å
803	L	89.3	Confident	82.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-38.7	178.8	-69.7	167.3	0	0	0	111.8	C799 Y800 L806 L807 W824 C827 L831 M841 L861	C799-L803 WeakPolarHBondContact O-CB 3.4Å; C799-L803 WeakPolarHBondContact O-CD1 3.47Å; C799-L803 WeakPolarHBondContact O-CG 3.36Å; C799-L803 PolarHBondContact O-N 2.92Å; Y800-L803 PolarHBondContact O-N 3.19Å; L803-L806 PolarHBondContact O-N 3.31Å; L803-L807 VanDerWaalsContact O-CG 3.25Å; L803-L807 WeakPolarHBondContact O-CG 3.45Å; L803-L807 PolarHBondContact O-N 3.13Å; L803-L807 VanDerWaalsContact O-N 3.12Å; L803-W824 HydrophobicContact CD2-CD2 4.25Å; L803-W824 HydrophobicContact CD2-CE3 3.45Å; L803-W824 VanDerWaalsContact CD2-CE3 3.45Å; L803-W824 HydrophobicContact CD2-CH2 4.2Å; L803-W824 HydrophobicContact CD2-CZ3 3.43Å; L803-W824 VanDerWaalsContact CD2-CZ3 3.43Å; L803-C827 HydrophobicContact CD1-CB 4.23Å; L803-C827 HydrophobicContact CD2-CB 3.88Å; L803-C827 HydrophobicContact CG-CB 4.01Å; L803-L831 HydrophobicContact CD1-CD1 4.04Å; L803-M841 HydrophobicContact CD1-SD 4.13Å; L803-L861 HydrophobicContact CB-CD1 3.84Å; L803-L861 HydrophobicContact CB-CD2 4.48Å; L803-L861 HydrophobicContact CD1-CD1 4.04Å; L803-L861 HydrophobicContact CD2-CD1 4.43Å; L803-L861 HydrophobicContact CG-CD1 4.32Å
804	Y	88.3	Confident	81	Confident	31 Å²	31	40.2 Å²	40.2	12%	0.122	21%	0.214	C	C	.	.	H	α-helix	trans	-60.4	-48.7	172.6	177.7	-92.6	0	0	0	111.3	Q708 T709 Y800 L802 L806 L807 T808 E854 V857	Q708-Y804 WeakPolarHBondContact O-CE1 3.26Å; T709-Y804 HydrophobicContact CG2-CD1 4.26Å; T709-Y804 HydrophobicContact CG2-CG 4.29Å; Y800-Y804 VanDerWaalsContact O-CB 3.27Å; Y800-Y804 WeakPolarHBondContact O-CB 3.46Å; Y800-Y804 PolarHBondContact O-N 3.19Å; L802-Y804 VanDerWaalsContact C-N 3.32Å; L802-Y804 PolarHBondContact O-N 3.11Å; Y804-L806 PolarHBondContact O-N 2.86Å; Y804-L807 PolarHBondContact O-N 3.45Å; Y804-T808 HydrophobicContact CD1-CG2 4.41Å; Y804-T808 HydrophobicContact CE1-CG2 4Å; Y804-T808 HydrophobicContact CE2-CG2 4.17Å; Y804-T808 WeakPolarHBondContact O-CG2 3.31Å; Y804-T808 PolarHBondContact O-N 3.4Å; Y804-T808 VanDerWaalsContact O-N 3.1Å; Y804-T808 PolarHBondContact O-OG1 2.99Å; Y804-E854 HydrophobicContact CE2-CB 4.26Å; Y804-E854 HydrophobicContact CE2-CG 3.96Å; Y804-V857 HydrophobicContact CD2-CB 4.36Å; Y804-V857 HydrophobicContact CD2-CG1 3.7Å; Y804-V857 HydrophobicContact CE2-CB 4.22Å; Y804-V857 HydrophobicContact CE2-CG1 3.98Å; Y804-V857 HydrophobicContact CE2-CG2 4.42Å
805	F	86.8	Confident	79.4	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-55.7	-49	173.9	164.7	-115.7	0	0	0	111.5	L716 L718 S801 L802 L807 T808 L809 L823	L716-F805 HydrophobicContact CD1-CB 4.02Å; L718-F805 HydrophobicContact CD1-CD2 4.21Å; L718-F805 HydrophobicContact CD1-CE2 3.59Å; L718-F805 HydrophobicContact CD1-CZ 4.3Å; L718-F805 HydrophobicContact CD2-CD1 4.27Å; L718-F805 HydrophobicContact CD2-CD2 3.58Å; L718-F805 HydrophobicContact CD2-CE1 4.04Å; L718-F805 HydrophobicContact CD2-CE2 3.31Å; L718-F805 HydrophobicContact CD2-CG 4.05Å; L718-F805 HydrophobicContact CD2-CZ 3.56Å; L718-F805 HydrophobicContact CG-CE2 4.07Å; L718-F805 HydrophobicContact CG-CZ 4.48Å; S801-F805 WeakPolarHBondContact O-CB 3.2Å; S801-F805 PolarHBondContact O-N 3.17Å; L802-F805 WeakPolarHBondContact O-CB 3.3Å; L802-F805 PolarHBondContact O-N 3.14Å; F805-L807 PolarHBondContact O-N 3.42Å; F805-T808 WeakPolarHBondContact CA-OG1 3.23Å; F805-T808 PolarHBondContact O-N 2.93Å; F805-T808 VanDerWaalsContact O-N 3.13Å; F805-T808 PolarHBondContact O-OG1 3.31Å; F805-L809 HydrophobicContact CD1-CD1 4.44Å; F805-L809 HydrophobicContact CD2-CD2 4.36Å; F805-L809 HydrophobicContact CD2-CG 4.24Å; F805-L809 HydrophobicContact CE1-CD1 3.9Å; F805-L809 HydrophobicContact CE2-CD1 4.03Å; F805-L809 HydrophobicContact CE2-CD2 3.48Å; F805-L809 VanDerWaalsContact CE2-CD2 3.48Å; F805-L809 HydrophobicContact CE2-CG 3.76Å; F805-L809 HydrophobicContact CZ-CD1 3.67Å; F805-L809 HydrophobicContact CZ-CD2 3.69Å; F805-L809 HydrophobicContact CZ-CG 3.92Å; F805-L809 WeakPolarHBondContact O-CG 3.45Å; F805-L809 PolarHBondContact O-N 3.38Å; F805-L823 HydrophobicContact CE1-CD1 4.43Å
806	L	85.9	Confident	78.3	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-62.7	-28	-178	-67.7	-177.8	0	0	0	114.3	L802 L803 Y804 L809 R820 L823 W824	L802-L806 VanDerWaalsContact O-CG 3.27Å; L802-L806 WeakPolarHBondContact O-CG 3.23Å; L802-L806 PolarHBondContact O-N 3.35Å; L803-L806 PolarHBondContact O-N 3.31Å; Y804-L806 PolarHBondContact O-N 2.86Å; L806-L809 HydrophobicContact CD2-CD1 3.97Å; L806-R820 HydrophobicContact CD1-CG 4.45Å; L806-R820 HydrophobicContact CD2-CB 3.91Å; L806-R820 HydrophobicContact CD2-CG 4.03Å; L806-L823 HydrophobicContact CD1-CB 3.88Å; L806-L823 HydrophobicContact CD2-CB 4.28Å; L806-L823 HydrophobicContact CD2-CD1 4.19Å; L806-L823 HydrophobicContact CG-CB 4.49Å; L806-W824 HydrophobicContact CD1-CB 3.91Å; L806-W824 HydrophobicContact CD1-CE3 4.16Å
807	L	84.6	Confident	77.5	Confident	19 Å²	19	51.6 Å²	51.6	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-88.6	-17.3	179.4	-66.3	174.2	0	0	0	113.5	L803 Y804 F805 W824 V857 Q860 L861 L864	L803-L807 VanDerWaalsContact O-CG 3.25Å; L803-L807 WeakPolarHBondContact O-CG 3.45Å; L803-L807 PolarHBondContact O-N 3.13Å; L803-L807 VanDerWaalsContact O-N 3.12Å; Y804-L807 PolarHBondContact O-N 3.45Å; F805-L807 PolarHBondContact O-N 3.42Å; L807-W824 HydrophobicContact CD2-CZ3 4.46Å; L807-V857 HydrophobicContact CB-CG1 3.8Å; L807-V857 HydrophobicContact CD1-CG1 4.2Å; L807-Q860 HydrophobicContact CD2-CG 4.3Å; L807-L861 HydrophobicContact CD1-CB 3.6Å; L807-L861 HydrophobicContact CD1-CD1 3.87Å; L807-L861 HydrophobicContact CD1-CG 4.3Å; L807-L864 HydrophobicContact CD2-CD1 3.51Å
808	T	80.6	Confident	76.9	Confident	61 Å²	61	56 Å²	56	37%	0.374	29%	0.29	S	S	.	.	H	α-helix	trans	-96.3	-3.1	177.3	48.8	0	0	0	0	113.1	Y804 F805 V857	Y804-T808 HydrophobicContact CD1-CG2 4.41Å; Y804-T808 HydrophobicContact CE1-CG2 4Å; Y804-T808 HydrophobicContact CE2-CG2 4.17Å; Y804-T808 WeakPolarHBondContact O-CG2 3.31Å; Y804-T808 PolarHBondContact O-N 3.4Å; Y804-T808 VanDerWaalsContact O-N 3.1Å; Y804-T808 PolarHBondContact O-OG1 2.99Å; F805-T808 WeakPolarHBondContact CA-OG1 3.23Å; F805-T808 PolarHBondContact O-N 2.93Å; F805-T808 VanDerWaalsContact O-N 3.13Å; F805-T808 PolarHBondContact O-OG1 3.31Å; T808-V857 HydrophobicContact CG2-CG1 4.17Å; T808-V857 HydrophobicContact CG2-CG2 3.88Å
809	L	76.8	Confident	76.5	Confident	32 Å²	32	56.1 Å²	56.1	17%	0.168	29%	0.291	C	S	.	.	S	Bend	trans	-70.1	135.5	171.5	-76.6	167	0	0	0	111.6	F805 L806 K811 H816	F805-L809 HydrophobicContact CD1-CD1 4.44Å; F805-L809 HydrophobicContact CD2-CD2 4.36Å; F805-L809 HydrophobicContact CD2-CG 4.24Å; F805-L809 HydrophobicContact CE1-CD1 3.9Å; F805-L809 HydrophobicContact CE2-CD1 4.03Å; F805-L809 HydrophobicContact CE2-CD2 3.48Å; F805-L809 VanDerWaalsContact CE2-CD2 3.48Å; F805-L809 HydrophobicContact CE2-CG 3.76Å; F805-L809 HydrophobicContact CZ-CD1 3.67Å; F805-L809 HydrophobicContact CZ-CD2 3.69Å; F805-L809 HydrophobicContact CZ-CG 3.92Å; F805-L809 WeakPolarHBondContact O-CG 3.45Å; F805-L809 PolarHBondContact O-N 3.38Å; L806-L809 HydrophobicContact CD2-CD1 3.97Å; L809-K811 PolarHBondContact O-N 2.7Å; L809-H816 HydrophobicContact CD1-CB 4.2Å; L809-H816 HydrophobicContact CD2-CB 4.29Å
810	D	64.6	Low	76.2	Confident	128 Å²	128	60.6 Å²	60.6	68%	0.684	31%	0.307	S	S	*	.			trans	-62.1	129.1	172.5	-81.9	-34	0	0	0	110.3	E812	D810-E812 PolarHBondContact O-N 2.92Å; D810-E812 VanDerWaalsContact O-N 3.11Å
811	K	59.4	Low	76	Confident	169 Å²	169	65.6 Å²	65.6	74%	0.735	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.3	-173.5	-68.1	-179.6	-177.9	171.8	0	113.9	L809	L809-K811 PolarHBondContact O-N 2.7Å
812	E	51.1	Low	75.9	Confident	185 Å²	185	68.1 Å²	68.1	86%	0.864	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-12.9	-173.5	-60.7	-169.7	167.7	0	0	113.6	D810 A814	D810-E812 PolarHBondContact O-N 2.92Å; D810-E812 VanDerWaalsContact O-N 3.11Å; E812-A814 PolarHBondContact O-N 3.18Å
813	D	59.3	Low	76	Confident	82 Å²	82	68.1 Å²	68.1	44%	0.439	35%	0.347	S	S	.	.			trans	-85.3	102.6	-179	-74.9	-27	0	0	0	112.3	E815 H816	D813-E815 PolarHBondContact O-N 3.14Å; D813-E815 VanDerWaalsContact O-N 3.17Å; D813-H816 HydrophobicContact CB-CB 4.42Å; D813-H816 PolarHBondContact O-N 2.97Å; D813-H816 VanDerWaalsContact O-N 3.07Å; D813-H816 IonicContact OD2-CD2 2.94Å
814	A	57	Low	76	Confident	86 Å²	86	70.2 Å²	70.2	71%	0.711	36%	0.355	S	S	*	.	H	α-helix	trans	-56.9	-29.3	178.4	0	0	0	0	0	113.7	E812 H816 V817	E812-A814 PolarHBondContact O-N 3.18Å; A814-H816 VanDerWaalsContact C-N 3.28Å; A814-H816 PolarHBondContact O-N 2.96Å; A814-V817 PolarHBondContact O-N 3.03Å
815	E	59.2	Low	76	Confident	130 Å²	130	70.2 Å²	70.2	61%	0.607	36%	0.364	S	S	*	.	H	α-helix	trans	-64	-31.2	177.3	-67.5	-173.8	177.9	0	0	112.6	L721 D813	L721-E815 WeakPolarHBondContact CD1-O 3.36Å; L721-E815 HydrophobicContact CD2-CB 4.01Å; L721-E815 HydrophobicContact CD2-CG 4.34Å; L721-E815 WeakPolarHBondContact CD2-O 3.48Å; D813-E815 PolarHBondContact O-N 3.14Å; D813-E815 VanDerWaalsContact O-N 3.17Å
816	H	67.1	Low	76.2	Confident	55 Å²	55	70.6 Å²	70.6	26%	0.255	37%	0.368	S	S	.	.	H	α-helix	trans	-86.2	-12.2	-175.6	-71.1	-41.8	0	0	0	114	L809 D813 A814 R820	L809-H816 HydrophobicContact CD1-CB 4.2Å; L809-H816 HydrophobicContact CD2-CB 4.29Å; D813-H816 HydrophobicContact CB-CB 4.42Å; D813-H816 PolarHBondContact O-N 2.97Å; D813-H816 VanDerWaalsContact O-N 3.07Å; D813-H816 IonicContact OD2-CD2 2.94Å; A814-H816 VanDerWaalsContact C-N 3.28Å; A814-H816 PolarHBondContact O-N 2.96Å; H816-R820 WeakPolarHBondContact O-CB 3.13Å; H816-R820 PolarHBondContact O-N 3.25Å
817	V	74.3	Confident	76.5	Confident	71 Å²	71	70.4 Å²	70.4	43%	0.43	37%	0.367	S	S	.	.	H	α-helix	trans	-67.2	-47.4	-178.2	-179.5	0	0	0	0	111.9	A814 K819 R820 D821	A814-V817 PolarHBondContact O-N 3.03Å; V817-K819 PolarHBondContact O-N 3.3Å; V817-R820 WeakPolarHBondContact O-CB 3.47Å; V817-R820 PolarHBondContact O-N 3.09Å; V817-D821 PolarHBondContact O-N 2.99Å
818	Q	78	Confident	76.7	Confident	113 Å²	113	69.6 Å²	69.6	53%	0.528	36%	0.363	S	S	.	.	H	α-helix	trans	-64	-43.1	-180	-68	-175.7	-1.8	0	0	112.1	R820 D821 L822	Q818-R820 VanDerWaalsContact C-N 3.3Å; Q818-R820 PolarHBondContact O-N 2.95Å; Q818-D821 PolarHBondContact O-N 3.31Å; Q818-L822 WeakPolarHBondContact O-CG 3.49Å; Q818-L822 PolarHBondContact O-N 3.11Å
819	K	83.7	Confident	77.2	Confident	4 Å²	4	69.2 Å²	69.2	2%	0.017	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-39.4	175.7	-175.9	172	-177	-179.7	0	111.5	T719 L721 F724 D767 V817 L823	T719-K819 PolarHBondContact O-NZ 3.08Å; L721-K819 HydrophobicContact CD1-CB 4.2Å; F724-K819 HydrophobicContact CD1-CB 4.23Å; F724-K819 HydrophobicContact CD1-CD 4.35Å; F724-K819 HydrophobicContact CD1-CG 3.86Å; F724-K819 HydrophobicContact CD2-CD 4.27Å; F724-K819 HydrophobicContact CD2-CG 4.17Å; F724-K819 HydrophobicContact CE1-CB 4.23Å; F724-K819 HydrophobicContact CE1-CG 3.84Å; F724-K819 HydrophobicContact CE2-CG 4.14Å; F724-K819 HydrophobicContact CG-CD 4.12Å; F724-K819 HydrophobicContact CG-CG 4.06Å; F724-K819 HydrophobicContact CZ-CG 3.99Å; D767-K819 IonicContact OD1-NZ 2.78Å; D767-K819 WeakPolarHBondContact OD2-CE 3.36Å; D767-K819 IonicContact OD2-NZ 3.49Å; D767-K819 PolarHBondContact OD2-NZ 3.19Å; V817-K819 PolarHBondContact O-N 3.3Å; K819-L823 HydrophobicContact CG-CD1 3.9Å; K819-L823 WeakPolarHBondContact O-CB 3.41Å; K819-L823 WeakPolarHBondContact O-CG 3.5Å; K819-L823 PolarHBondContact O-N 3.11Å; K819-L823 VanDerWaalsContact O-N 3.11Å
820	R	84.2	Confident	77.7	Confident	94 Å²	94	67.7 Å²	67.7	36%	0.355	35%	0.354	S	S	.	.	H	α-helix	trans	-62.9	-47	177.5	175	176.1	170.7	-162.8	-5.7	112.4	L806 H816 V817 Q818 L822 W824	L806-R820 HydrophobicContact CD1-CG 4.45Å; L806-R820 HydrophobicContact CD2-CB 3.91Å; L806-R820 HydrophobicContact CD2-CG 4.03Å; H816-R820 WeakPolarHBondContact O-CB 3.13Å; H816-R820 PolarHBondContact O-N 3.25Å; V817-R820 WeakPolarHBondContact O-CB 3.47Å; V817-R820 PolarHBondContact O-N 3.09Å; Q818-R820 VanDerWaalsContact C-N 3.3Å; Q818-R820 PolarHBondContact O-N 2.95Å; R820-L822 PolarHBondContact O-N 3.04Å; R820-W824 WeakPolarHBondContact O-CB 3.35Å; R820-W824 PolarHBondContact O-N 2.91Å
821	D	85.5	Confident	78.9	Confident	105 Å²	105	61.6 Å²	61.6	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-63	-42.8	-178.1	-69.8	-21	0	0	0	112.1	V817 Q818 G825	V817-D821 PolarHBondContact O-N 2.99Å; Q818-D821 PolarHBondContact O-N 3.31Å; D821-G825 PolarHBondContact O-N 3.38Å
822	L	88.6	Confident	80.2	Confident	56 Å²	56	54.7 Å²	54.7	29%	0.293	30%	0.296	S	S	.	.	H	α-helix	trans	-66.8	-46.2	179.7	-67.8	174.4	0	0	0	112.8	F724 L725 W728 Q818 R820 S826	F724-L822 HydrophobicContact CE1-CB 4.39Å; F724-L822 HydrophobicContact CE1-CD1 4.02Å; L725-L822 HydrophobicContact CD2-CD1 4.1Å; W728-L822 HydrophobicContact CD2-CB 4.38Å; W728-L822 HydrophobicContact CD2-CD1 4.21Å; W728-L822 HydrophobicContact CG-CD1 4.01Å; W728-L822 HydrophobicContact CH2-CB 4.27Å; W728-L822 HydrophobicContact CZ2-CB 3.95Å; W728-L822 HydrophobicContact CZ2-CD2 4.22Å; Q818-L822 WeakPolarHBondContact O-CG 3.49Å; Q818-L822 PolarHBondContact O-N 3.11Å; R820-L822 PolarHBondContact O-N 3.04Å; L822-S826 PolarHBondContact O-N 3.4Å; L822-S826 VanDerWaalsContact O-N 3.13Å; L822-S826 PolarHBondContact O-OG 2.97Å
823	L	91	Very high	81.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-42.7	178.3	-71.8	176.3	0	0	0	111.7	F724 W728 L802 F805 L806 K819 S826 C827	F724-L823 HydrophobicContact CE2-CD1 4.07Å; F724-L823 HydrophobicContact CE2-CD2 3.83Å; F724-L823 HydrophobicContact CE2-CG 3.97Å; F724-L823 HydrophobicContact CZ-CD1 4.19Å; F724-L823 HydrophobicContact CZ-CD2 3.84Å; F724-L823 HydrophobicContact CZ-CG 3.72Å; W728-L823 HydrophobicContact CZ3-CD2 4.34Å; L802-L823 HydrophobicContact CD2-CD1 4.11Å; L802-L823 HydrophobicContact CD2-CD2 4.09Å; F805-L823 HydrophobicContact CE1-CD1 4.43Å; L806-L823 HydrophobicContact CD1-CB 3.88Å; L806-L823 HydrophobicContact CD2-CB 4.28Å; L806-L823 HydrophobicContact CD2-CD1 4.19Å; L806-L823 HydrophobicContact CG-CB 4.49Å; K819-L823 HydrophobicContact CG-CD1 3.9Å; K819-L823 WeakPolarHBondContact O-CB 3.41Å; K819-L823 WeakPolarHBondContact O-CG 3.5Å; K819-L823 PolarHBondContact O-N 3.11Å; K819-L823 VanDerWaalsContact O-N 3.11Å; L823-S826 PolarHBondContact O-N 3.46Å; L823-C827 PolarHBondContact O-N 3.15Å; L823-C827 PolarHBondContact O-SG 3.18Å
824	W	90.3	Very high	83	Confident	45 Å²	45	46.6 Å²	46.6	17%	0.17	26%	0.258	C	S	.	.	H	α-helix	trans	-60.1	-50.6	176.2	-177.2	-91.7	0	0	0	110.6	L803 L806 L807 R820 S826 C827 I828 L864	L803-W824 HydrophobicContact CD2-CD2 4.25Å; L803-W824 HydrophobicContact CD2-CE3 3.45Å; L803-W824 VanDerWaalsContact CD2-CE3 3.45Å; L803-W824 HydrophobicContact CD2-CH2 4.2Å; L803-W824 HydrophobicContact CD2-CZ3 3.43Å; L803-W824 VanDerWaalsContact CD2-CZ3 3.43Å; L806-W824 HydrophobicContact CD1-CB 3.91Å; L806-W824 HydrophobicContact CD1-CE3 4.16Å; L807-W824 HydrophobicContact CD2-CZ3 4.46Å; R820-W824 WeakPolarHBondContact O-CB 3.35Å; R820-W824 PolarHBondContact O-N 2.91Å; W824-S826 VanDerWaalsContact C-N 3.28Å; W824-S826 PolarHBondContact O-N 3.44Å; W824-C827 PolarHBondContact O-N 3.48Å; W824-I828 HydrophobicContact CD2-CG1 4.28Å; W824-I828 HydrophobicContact CG-CG1 4.34Å; W824-I828 HydrophobicContact CZ2-CD1 3.93Å; W824-I828 HydrophobicContact CZ2-CG1 4.23Å; W824-I828 WeakPolarHBondContact O-CG1 3.37Å; W824-I828 PolarHBondContact O-N 2.96Å; W824-L864 HydrophobicContact CH2-CB 3.77Å; W824-L864 HydrophobicContact CH2-CD1 3.75Å; W824-L864 HydrophobicContact CH2-CG 4.35Å; W824-L864 HydrophobicContact CZ2-CB 4.13Å; W824-L864 HydrophobicContact CZ2-CD1 4.5Å; W824-L864 HydrophobicContact CZ3-CD1 4.31Å
825	G	88.5	Confident	84.1	Confident	31 Å²	31	45.7 Å²	45.7	32%	0.32	25%	0.245	S	C	.	.	H	α-helix	trans	-56	-41.2	177.8	0	0	0	0	0	112.9	D821 S829	D821-G825 PolarHBondContact O-N 3.38Å; G825-S829 VanDerWaalsContact O-CB 3.24Å; G825-S829 WeakPolarHBondContact O-CB 3.43Å; G825-S829 PolarHBondContact O-N 2.87Å; G825-S829 PolarHBondContact O-OG 2.79Å
826	S	90.5	Very high	85.3	Confident	13 Å²	13	47.1 Å²	47.1	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-72.1	-37.9	178	-66.9	0	0	0	0	113.7	W728 N778 L822 L823 W824 A830	W728-S826 WeakPolarHBondContact CH2-OG 3.38Å; N778-S826 PolarHBondContact ND2-O 3.33Å; L822-S826 PolarHBondContact O-N 3.4Å; L822-S826 VanDerWaalsContact O-N 3.13Å; L822-S826 PolarHBondContact O-OG 2.97Å; L823-S826 PolarHBondContact O-N 3.46Å; W824-S826 VanDerWaalsContact C-N 3.28Å; W824-S826 PolarHBondContact O-N 3.44Å; S826-A830 WeakPolarHBondContact O-CB 3.45Å; S826-A830 PolarHBondContact O-N 3.25Å
827	C	91.5	Very high	86.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-47.6	175.2	-67.2	0	0	0	0	111.2	L803 L823 W824 A830 L831	L803-C827 HydrophobicContact CD1-CB 4.23Å; L803-C827 HydrophobicContact CD2-CB 3.88Å; L803-C827 HydrophobicContact CG-CB 4.01Å; L823-C827 PolarHBondContact O-N 3.15Å; L823-C827 PolarHBondContact O-SG 3.18Å; W824-C827 PolarHBondContact O-N 3.48Å; C827-A830 PolarHBondContact O-N 3.01Å; C827-L831 VanDerWaalsContact O-CG 3.28Å; C827-L831 WeakPolarHBondContact O-CG 3.46Å; C827-L831 PolarHBondContact O-N 3.27Å
828	I	90.5	Very high	86.9	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-42.1	-180	-62.9	-62.1	0	0	0	111.2	W824 A830 L831 A832 L865 H868 L871	W824-I828 HydrophobicContact CD2-CG1 4.28Å; W824-I828 HydrophobicContact CG-CG1 4.34Å; W824-I828 HydrophobicContact CZ2-CD1 3.93Å; W824-I828 HydrophobicContact CZ2-CG1 4.23Å; W824-I828 WeakPolarHBondContact O-CG1 3.37Å; W824-I828 PolarHBondContact O-N 2.96Å; I828-A830 VanDerWaalsContact C-N 3.3Å; I828-A830 PolarHBondContact O-N 2.82Å; I828-L831 PolarHBondContact O-N 2.57Å; I828-A832 WeakPolarHBondContact O-CB 3.45Å; I828-A832 PolarHBondContact O-N 3.08Å; I828-L865 HydrophobicContact CD1-CD2 3.74Å; I828-H868 VanDerWaalsContact CG2-CE1 3.43Å; I828-H868 WeakPolarHBondContact CG2-CE1 3.46Å; I828-L871 HydrophobicContact CD1-CD1 3.77Å; I828-L871 HydrophobicContact CG2-CD1 4.25Å; I828-L871 HydrophobicContact CG2-CG 4.32Å
829	S	89.1	Confident	87.3	Confident	53 Å²	53	42.1 Å²	42.1	37%	0.371	21%	0.211	S	C	.	.	H	α-helix	trans	-60	-40.8	175	-60.3	0	0	0	0	111.6	G825 A832 L833	G825-S829 VanDerWaalsContact O-CB 3.24Å; G825-S829 WeakPolarHBondContact O-CB 3.43Å; G825-S829 PolarHBondContact O-N 2.87Å; G825-S829 PolarHBondContact O-OG 2.79Å; S829-A832 PolarHBondContact O-N 3.27Å; S829-L833 VanDerWaalsContact O-CB 3.23Å; S829-L833 WeakPolarHBondContact O-CB 3.43Å; S829-L833 PolarHBondContact O-N 3.47Å
830	A	88.3	Confident	87.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.6	-43.8	176.8	0	0	0	0	0	112.3	L774 N778 S826 C827 I828 A832 L833 L834 L837	L774-A830 HydrophobicContact CD2-CB 4.06Å; N778-A830 PolarHBondContact ND2-N 3.48Å; N778-A830 WeakPolarHBondContact OD1-CA 3.49Å; N778-A830 VanDerWaalsContact OD1-CB 3.23Å; N778-A830 WeakPolarHBondContact OD1-CB 3.43Å; S826-A830 WeakPolarHBondContact O-CB 3.45Å; S826-A830 PolarHBondContact O-N 3.25Å; C827-A830 PolarHBondContact O-N 3.01Å; I828-A830 VanDerWaalsContact C-N 3.3Å; I828-A830 PolarHBondContact O-N 2.82Å; A830-A832 VanDerWaalsContact C-N 3.3Å; A830-A832 PolarHBondContact O-N 3.12Å; A830-L833 PolarHBondContact O-N 3.49Å; A830-L834 WeakPolarHBondContact O-CB 3.16Å; A830-L834 PolarHBondContact O-N 3.41Å; A830-L837 HydrophobicContact CB-CD2 3.82Å
831	L	89.2	Confident	87.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-31.7	178.3	-68.1	172.6	0	0	0	112.7	L803 C827 I828 L837 L838 M841 L865 L871	L803-L831 HydrophobicContact CD1-CD1 4.04Å; C827-L831 VanDerWaalsContact O-CG 3.28Å; C827-L831 WeakPolarHBondContact O-CG 3.46Å; C827-L831 PolarHBondContact O-N 3.27Å; I828-L831 PolarHBondContact O-N 2.57Å; L831-L837 HydrophobicContact CD2-CD2 4.19Å; L831-L837 HydrophobicContact CD2-CG 4.15Å; L831-L838 HydrophobicContact CD1-CD1 4.44Å; L831-L838 HydrophobicContact CD2-CB 4.1Å; L831-L838 HydrophobicContact CD2-CD1 4.04Å; L831-M841 HydrophobicContact CD1-CE 3.91Å; L831-M841 HydrophobicContact CD1-SD 4.13Å; L831-M841 HydrophobicContact CD2-CE 4.09Å; L831-M841 HydrophobicContact CD2-SD 3.89Å; L831-L865 HydrophobicContact CD1-CD2 3.98Å; L831-L871 HydrophobicContact CB-CD1 4.42Å; L831-L871 HydrophobicContact CB-CD2 3.7Å
832	A	86.8	Confident	87.5	Confident	23 Å²	23	34.3 Å²	34.3	19%	0.19	18%	0.177	C	C	.	.	H	α-helix	trans	-76.4	-40.2	175.6	0	0	0	0	0	111.9	I828 S829 A830 Q870 L871 H874	I828-A832 WeakPolarHBondContact O-CB 3.45Å; I828-A832 PolarHBondContact O-N 3.08Å; S829-A832 PolarHBondContact O-N 3.27Å; A830-A832 VanDerWaalsContact C-N 3.3Å; A830-A832 PolarHBondContact O-N 3.12Å; A832-Q870 HydrophobicContact CB-CB 4.31Å; A832-L871 HydrophobicContact CB-CD2 3.83Å; A832-H874 PolarHBondContact O-NE2 3.11Å; A832-H874 VanDerWaalsContact O-NE2 3.13Å
833	L	85.3	Confident	87.3	Confident	82 Å²	82	35.2 Å²	35.2	43%	0.429	18%	0.179	S	C	.	.	H	α-helix	trans	-75.6	-31.5	-176.8	-166.1	71.3	0	0	0	112.7	L781 S829 A830 P835	L781-L833 HydrophobicContact CB-CD2 3.89Å; L781-L833 HydrophobicContact CD2-CD2 3.55Å; L781-L833 HydrophobicContact CD2-CG 3.74Å; L781-L833 HydrophobicContact CG-CD2 4.34Å; S829-L833 VanDerWaalsContact O-CB 3.23Å; S829-L833 WeakPolarHBondContact O-CB 3.43Å; S829-L833 PolarHBondContact O-N 3.47Å; A830-L833 PolarHBondContact O-N 3.49Å; L833-P835 WeakPolarHBondContact O-CD 3.48Å
834	L	84.6	Confident	86.7	Confident	15 Å²	15	37.2 Å²	37.2	8%	0.079	19%	0.193	C	C	.	.			trans	-118.4	92.2	-175.8	-67.2	168	0	0	0	111.3	I777 L781 L787 L795 A830 R836 L837	I777-L834 HydrophobicContact CG2-CD1 4.28Å; L781-L834 HydrophobicContact CD2-CD2 3.44Å; L781-L834 VanDerWaalsContact CD2-CD2 3.44Å; L781-L834 HydrophobicContact CD2-CG 3.97Å; L787-L834 HydrophobicContact CD1-CD2 3.74Å; L787-L834 HydrophobicContact CD2-CD1 3.76Å; L787-L834 HydrophobicContact CD2-CD2 4.09Å; L795-L834 HydrophobicContact CD1-CD1 4.47Å; A830-L834 WeakPolarHBondContact O-CB 3.16Å; A830-L834 PolarHBondContact O-N 3.41Å; L834-R836 VanDerWaalsContact C-N 3.25Å; L834-R836 PolarHBondContact O-N 3.46Å; L834-R836 VanDerWaalsContact O-N 3.15Å; L834-L837 HydrophobicContact CB-CB 3.69Å; L834-L837 HydrophobicContact CB-CD2 4.37Å; L834-L837 HydrophobicContact CD1-CD2 4.34Å; L834-L837 WeakPolarHBondContact O-CB 3.43Å; L834-L837 PolarHBondContact O-N 2.79Å
835	P	80.8	Confident	85.9	Confident	67 Å²	67	35 Å²	35	44%	0.435	19%	0.185	S	C	.	.	H	α-helix	trans	-60.3	-32.7	-175.8	-23.1	31.8	0	0	0	113.9	L833 L837 R839 H874	L833-P835 WeakPolarHBondContact O-CD 3.48Å; P835-L837 VanDerWaalsContact C-N 3.31Å; P835-R839 PolarHBondContact O-N 3.47Å; P835-H874 VanDerWaalsContact CG-CE1 3.46Å; P835-H874 WeakPolarHBondContact CG-CE1 3.39Å
836	R	84.6	Confident	84.9	Confident	160 Å²	160	37.7 Å²	37.7	60%	0.604	19%	0.189	S	C	*	.	H	α-helix	trans	-68.2	-30.4	176	-70.8	-170.3	177.2	-166.3	1.8	112.4	E789 L834 R839 L840	E789-R836 IonicContact OE1-NH1 3.02Å; L834-R836 VanDerWaalsContact C-N 3.25Å; L834-R836 PolarHBondContact O-N 3.46Å; L834-R836 VanDerWaalsContact O-N 3.15Å; R836-R839 PolarHBondContact O-N 3.21Å; R836-L840 WeakPolarHBondContact O-CG 3.46Å; R836-L840 PolarHBondContact O-N 3.4Å
837	L	87.1	Confident	83.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-47.7	178.3	-173.1	70.3	0	0	0	110.7	L795 A796 A830 L831 L834 P835 R839 L840 M841	L795-L837 HydrophobicContact CB-CD1 3.5Å; L795-L837 VanDerWaalsContact CB-CD1 3.5Å; A796-L837 HydrophobicContact CB-CD1 3.92Å; A796-L837 VanDerWaalsContact N-CD1 3.27Å; A830-L837 HydrophobicContact CB-CD2 3.82Å; L831-L837 HydrophobicContact CD2-CD2 4.19Å; L831-L837 HydrophobicContact CD2-CG 4.15Å; L834-L837 HydrophobicContact CB-CB 3.69Å; L834-L837 HydrophobicContact CB-CD2 4.37Å; L834-L837 HydrophobicContact CD1-CD2 4.34Å; L834-L837 WeakPolarHBondContact O-CB 3.43Å; L834-L837 PolarHBondContact O-N 2.79Å; P835-L837 VanDerWaalsContact C-N 3.31Å; L837-R839 VanDerWaalsContact C-N 3.32Å; L837-R839 PolarHBondContact O-N 3.44Å; L837-L840 PolarHBondContact O-N 3.1Å; L837-M841 WeakPolarHBondContact O-CB 3.44Å; L837-M841 PolarHBondContact O-N 3.2Å
838	L	86.3	Confident	81.8	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59	-44.9	176.1	179.9	66.6	0	0	0	111.3	L831 L840 M841 L842 H874 M875	L831-L838 HydrophobicContact CD1-CD1 4.44Å; L831-L838 HydrophobicContact CD2-CB 4.1Å; L831-L838 HydrophobicContact CD2-CD1 4.04Å; L838-L840 PolarHBondContact O-N 3.03Å; L838-M841 HydrophobicContact CD1-CE 4.06Å; L838-M841 PolarHBondContact O-N 3.49Å; L838-L842 HydrophobicContact CD1-CD1 4.33Å; L838-L842 HydrophobicContact CD1-CG 4.3Å; L838-L842 HydrophobicContact CG-CD1 4.06Å; L838-L842 HydrophobicContact CG-CG 4.42Å; L838-L842 WeakPolarHBondContact O-CB 3.22Å; L838-L842 VanDerWaalsContact O-CG 3.27Å; L838-L842 WeakPolarHBondContact O-CG 3.29Å; L838-L842 PolarHBondContact O-N 3.4Å; L838-H874 HydrophobicContact CD2-CB 3.56Å; L838-M875 HydrophobicContact CD1-SD 4.05Å; L838-M875 HydrophobicContact CD2-CG 4.2Å; L838-M875 HydrophobicContact CD2-SD 3.83Å; L838-M875 HydrophobicContact CG-SD 4.35Å
839	R	86.9	Confident	80	Confident	134 Å²	134	54.8 Å²	54.8	51%	0.506	26%	0.263	S	S	.	.	H	α-helix	trans	-60.2	-46.7	177.8	-176.7	174.2	179	176.4	3.5	112.4	P835 R836 L837 L842 Q843 N878 L881	P835-R839 PolarHBondContact O-N 3.47Å; R836-R839 PolarHBondContact O-N 3.21Å; L837-R839 VanDerWaalsContact C-N 3.32Å; L837-R839 PolarHBondContact O-N 3.44Å; R839-L842 PolarHBondContact O-N 2.97Å; R839-Q843 VanDerWaalsContact O-CG 3.3Å; R839-Q843 WeakPolarHBondContact O-CG 3.39Å; R839-Q843 PolarHBondContact O-N 2.75Å; R839-N878 WeakPolarHBondContact CB-OD1 3.32Å; R839-N878 WeakPolarHBondContact CG-OD1 3.47Å; R839-L881 HydrophobicContact CG-CD1 3.86Å
840	L	86.1	Confident	78.2	Confident	40 Å²	40	58.4 Å²	58.4	21%	0.209	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-39.5	178.3	-72.4	170.7	0	0	0	111.9	H792 A796 R836 L837 L838 Q843 S844	H792-L840 HydrophobicContact CB-CD1 3.63Å; A796-L840 HydrophobicContact CB-CB 4Å; R836-L840 WeakPolarHBondContact O-CG 3.46Å; R836-L840 PolarHBondContact O-N 3.4Å; L837-L840 PolarHBondContact O-N 3.1Å; L838-L840 PolarHBondContact O-N 3.03Å; L840-Q843 PolarHBondContact O-N 3.47Å; L840-S844 PolarHBondContact O-N 3.48Å
841	M	86.9	Confident	76.8	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-48.4	174.3	-167.6	-173.3	76.1	0	0	110.7	A796 C799 L803 L831 L837 L838 Q843 S844 L845 L865	A796-M841 HydrophobicContact CB-CB 4.35Å; C799-M841 HydrophobicContact CB-SD 4.13Å; L803-M841 HydrophobicContact CD1-SD 4.13Å; L831-M841 HydrophobicContact CD1-CE 3.91Å; L831-M841 HydrophobicContact CD1-SD 4.13Å; L831-M841 HydrophobicContact CD2-CE 4.09Å; L831-M841 HydrophobicContact CD2-SD 3.89Å; L837-M841 WeakPolarHBondContact O-CB 3.44Å; L837-M841 PolarHBondContact O-N 3.2Å; L838-M841 HydrophobicContact CD1-CE 4.06Å; L838-M841 PolarHBondContact O-N 3.49Å; M841-Q843 VanDerWaalsContact C-N 3.3Å; M841-Q843 PolarHBondContact O-N 3.43Å; M841-S844 PolarHBondContact O-N 2.93Å; M841-S844 VanDerWaalsContact O-N 3.08Å; M841-S844 PolarHBondContact O-OG 3.22Å; M841-L845 WeakPolarHBondContact O-CG 3.43Å; M841-L845 PolarHBondContact O-N 2.91Å; M841-L865 HydrophobicContact CE-CD1 3.68Å
842	L	84.5	Confident	75.8	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-37.3	176.3	-69	173.9	0	0	0	112.2	L838 R839 S844 L845 L862 M875 N878 V882 I885	L838-L842 HydrophobicContact CD1-CD1 4.33Å; L838-L842 HydrophobicContact CD1-CG 4.3Å; L838-L842 HydrophobicContact CG-CD1 4.06Å; L838-L842 HydrophobicContact CG-CG 4.42Å; L838-L842 WeakPolarHBondContact O-CB 3.22Å; L838-L842 VanDerWaalsContact O-CG 3.27Å; L838-L842 WeakPolarHBondContact O-CG 3.29Å; L838-L842 PolarHBondContact O-N 3.4Å; R839-L842 PolarHBondContact O-N 2.97Å; L842-S844 VanDerWaalsContact C-N 3.31Å; L842-S844 PolarHBondContact O-N 3.36Å; L842-L845 HydrophobicContact CD2-CD1 3.98Å; L842-L845 WeakPolarHBondContact O-CB 3.4Å; L842-L845 PolarHBondContact O-N 3.07Å; L842-L845 VanDerWaalsContact O-N 3.13Å; L842-L862 HydrophobicContact CD2-CD2 3.91Å; L842-M875 HydrophobicContact CD1-SD 4.3Å; L842-N878 HydrophobicContact CD1-CB 3.91Å; L842-V882 HydrophobicContact CD1-CG2 3.95Å; L842-I885 HydrophobicContact CB-CD1 4.13Å; L842-I885 HydrophobicContact CD2-CD1 4.31Å; L842-I885 VanDerWaalsContact O-CD1 3.27Å; L842-I885 WeakPolarHBondContact O-CD1 3.46Å
843	Q	84.6	Confident	75	Confident	74 Å²	74	72.3 Å²	72.3	35%	0.346	34%	0.339	S	S	.	.	H	α-helix	trans	-63.6	-35.7	174.3	-75.7	174	-17.5	0	0	112.4	R839 L840 M841 L845 Q846 L881	R839-Q843 VanDerWaalsContact O-CG 3.3Å; R839-Q843 WeakPolarHBondContact O-CG 3.39Å; R839-Q843 PolarHBondContact O-N 2.75Å; L840-Q843 PolarHBondContact O-N 3.47Å; M841-Q843 VanDerWaalsContact C-N 3.3Å; M841-Q843 PolarHBondContact O-N 3.43Å; Q843-L845 PolarHBondContact O-N 2.9Å; Q843-Q846 WeakPolarHBondContact O-CB 3.33Å; Q843-Q846 WeakPolarHBondContact O-CG 3.42Å; Q843-Q846 PolarHBondContact O-N 3.48Å; Q843-L881 HydrophobicContact CG-CD1 4.27Å
844	S	77.7	Confident	74.6	Confident	42 Å²	42	69.2 Å²	69.2	29%	0.294	32%	0.323	S	S	.	.	H	α-helix	trans	-68.4	-19.6	174.1	68.7	0	0	0	0	113.9	L840 M841 L842 Q846	L840-S844 PolarHBondContact O-N 3.48Å; M841-S844 PolarHBondContact O-N 2.93Å; M841-S844 VanDerWaalsContact O-N 3.08Å; M841-S844 PolarHBondContact O-OG 3.22Å; L842-S844 VanDerWaalsContact C-N 3.31Å; L842-S844 PolarHBondContact O-N 3.36Å; S844-Q846 VanDerWaalsContact C-N 3.31Å
845	L	73.5	Confident	74.4	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-7.4	174.5	-59	176.8	0	0	0	113.5	L711 Y800 M841 L842 Q843 V847 V858 L862 I885	L711-L845 HydrophobicContact CD1-CD2 4.45Å; Y800-L845 HydrophobicContact CD2-CD2 3.58Å; Y800-L845 HydrophobicContact CE2-CD2 3.18Å; Y800-L845 HydrophobicContact CG-CD2 4.49Å; M841-L845 WeakPolarHBondContact O-CG 3.43Å; M841-L845 PolarHBondContact O-N 2.91Å; L842-L845 HydrophobicContact CD2-CD1 3.98Å; L842-L845 WeakPolarHBondContact O-CB 3.4Å; L842-L845 PolarHBondContact O-N 3.07Å; L842-L845 VanDerWaalsContact O-N 3.13Å; Q843-L845 PolarHBondContact O-N 2.9Å; L845-V847 VanDerWaalsContact O-CG2 3.31Å; L845-V847 WeakPolarHBondContact O-CG2 2.95Å; L845-V847 PolarHBondContact O-N 3.01Å; L845-V858 HydrophobicContact CD2-CG1 4.33Å; L845-L862 HydrophobicContact CD1-CD2 4.2Å; L845-I885 HydrophobicContact CB-CD1 4.23Å; L845-I885 HydrophobicContact CB-CG2 4.48Å
846	Q	68.1	Low	74.5	Confident	86 Å²	86	67.4 Å²	67.4	40%	0.402	31%	0.312	S	S	.	.	S	Bend	trans	-61.4	113.3	179.1	-71.9	-175.1	-18.9	0	0	109.4	Q843 S844 N848 I885	Q843-Q846 WeakPolarHBondContact O-CB 3.33Å; Q843-Q846 WeakPolarHBondContact O-CG 3.42Å; Q843-Q846 PolarHBondContact O-N 3.48Å; S844-Q846 VanDerWaalsContact C-N 3.31Å; Q846-N848 PolarHBondContact O-N 3.42Å; Q846-I885 HydrophobicContact CG-CG1 4.28Å
847	V	58.5	Low	74.4	Confident	25 Å²	25	60.9 Å²	60.9	15%	0.152	29%	0.289	C	S	.	.			trans	-76.3	117.2	-159	-170.4	0	0	0	0	110.8	L845 L855 D888 I889 L892	L845-V847 VanDerWaalsContact O-CG2 3.31Å; L845-V847 WeakPolarHBondContact O-CG2 2.95Å; L845-V847 PolarHBondContact O-N 3.01Å; V847-L855 HydrophobicContact CG1-CD2 4.29Å; V847-D888 HydrophobicContact CB-CB 4.42Å; V847-D888 HydrophobicContact CG2-CB 4.4Å; V847-I889 HydrophobicContact CG2-CG1 4.27Å; V847-L892 HydrophobicContact CB-CD1 3.83Å; V847-L892 HydrophobicContact CG1-CD1 3.23Å
848	N	59	Low	74.2	Confident	123 Å²	123	61 Å²	61	66%	0.658	29%	0.291	S	S	*	.			trans	-87.1	153.2	159.7	-82.1	-34	0	0	0	109.6	Q846 I850	Q846-N848 PolarHBondContact O-N 3.42Å; N848-I850 PolarHBondContact O-N 2.97Å
849	R	51.7	Low	74	Confident	226 Å²	226	61.1 Å²	61.1	85%	0.853	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	2.8	-174.2	-68.5	-176.1	177.2	-171	-1.2	117	L892	R849-L892 HydrophobicContact CG-CD2 4.43Å
850	I	51.2	Low	73.9	Confident	130 Å²	130	58.1 Å²	58.1	67%	0.667	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-13.1	-165	-52.5	172.2	0	0	0	112.4	N848	N848-I850 PolarHBondContact O-N 2.97Å
851	C	59.2	Low	73.9	Confident	13 Å²	13	56.3 Å²	56.3	9%	0.088	27%	0.273	C	S	.	.			trans	-111.1	36.7	-169.2	-55.4	0	0	0	0	115.9	E853 E854	C851-E853 PolarHBondContact O-N 3.29Å; C851-E854 PolarHBondContact O-N 3.39Å
852	Q	67.4	Low	73.8	Confident	118 Å²	118	56.3 Å²	56.3	55%	0.551	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-59.6	-31.4	-176	-76.3	-172.3	-17.6	0	0	114.1	L855	Q852-L855 HydrophobicContact CB-CD1 4.47Å; Q852-L855 HydrophobicContact CG-CD1 4.45Å
853	E	70.3	Confident	73.9	Confident	183 Å²	183	60.2 Å²	60.2	86%	0.855	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-72.9	-25.6	-179.2	-63.4	179.5	178	0	0	113.2	C851	C851-E853 PolarHBondContact O-N 3.29Å
854	E	77.4	Confident	73.9	Confident	17 Å²	17	59.1 Å²	59.1	8%	0.079	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-91.4	-8.2	-178.3	-62.7	-175.3	-168	0	0	112.9	T709 Q710 Y804 C851 P856 V857 V858	T709-E854 WeakPolarHBondContact CA-OE1 3.43Å; T709-E854 PolarHBondContact OG1-OE2 3.41Å; Q710-E854 PolarHBondContact N-OE1 3.21Å; Y804-E854 HydrophobicContact CE2-CB 4.26Å; Y804-E854 HydrophobicContact CE2-CG 3.96Å; C851-E854 PolarHBondContact O-N 3.39Å; E854-P856 VanDerWaalsContact C-CD 3.48Å; E854-V857 PolarHBondContact O-N 3.13Å; E854-V857 VanDerWaalsContact O-N 3.14Å; E854-V858 WeakPolarHBondContact O-CG2 3.38Å; E854-V858 PolarHBondContact O-N 3.33Å
855	L	80.3	Confident	74.3	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-55.3	-42.2	-177.9	-71.3	172.2	0	0	0	114.5	V847 Q852 V857 V858 A859 I889 K893 W901	V847-L855 HydrophobicContact CG1-CD2 4.29Å; Q852-L855 HydrophobicContact CB-CD1 4.47Å; Q852-L855 HydrophobicContact CG-CD1 4.45Å; L855-V857 VanDerWaalsContact C-N 3.3Å; L855-V857 PolarHBondContact O-N 3.13Å; L855-V858 PolarHBondContact O-N 3.04Å; L855-A859 WeakPolarHBondContact O-CB 3.33Å; L855-A859 PolarHBondContact O-N 3.17Å; L855-I889 HydrophobicContact CD2-CG1 3.99Å; L855-I889 HydrophobicContact CD2-CG2 4.4Å; L855-K893 HydrophobicContact CD1-CG 3.93Å; L855-W901 HydrophobicContact CB-CH2 4.17Å
856	P	82.3	Confident	74.8	Confident	40 Å²	40	57.7 Å²	57.7	26%	0.26	27%	0.273	S	S	.	.	H	α-helix	trans	-62.3	-37.8	178.1	-22.4	34.2	0	0	0	112.6	E854 A859 Q860 W901	E854-P856 VanDerWaalsContact C-CD 3.48Å; P856-A859 PolarHBondContact O-N 3.22Å; P856-Q860 WeakPolarHBondContact O-CB 3.46Å; P856-Q860 PolarHBondContact O-N 3.43Å; P856-W901 HydrophobicContact CB-CD2 4.19Å; P856-W901 HydrophobicContact CB-CG 4.41Å; P856-W901 HydrophobicContact CB-CZ2 4.44Å; P856-W901 HydrophobicContact CG-CZ2 3.97Å
857	V	82.6	Confident	75.5	Confident	23 Å²	23	58.9 Å²	58.9	14%	0.139	28%	0.279	C	S	.	.	H	α-helix	trans	-69.8	-42.7	178.9	-176.5	0	0	0	0	110.4	Y804 L807 T808 E854 L855 Q860 L861	Y804-V857 HydrophobicContact CD2-CB 4.36Å; Y804-V857 HydrophobicContact CD2-CG1 3.7Å; Y804-V857 HydrophobicContact CE2-CB 4.22Å; Y804-V857 HydrophobicContact CE2-CG1 3.98Å; Y804-V857 HydrophobicContact CE2-CG2 4.42Å; L807-V857 HydrophobicContact CB-CG1 3.8Å; L807-V857 HydrophobicContact CD1-CG1 4.2Å; T808-V857 HydrophobicContact CG2-CG1 4.17Å; T808-V857 HydrophobicContact CG2-CG2 3.88Å; E854-V857 PolarHBondContact O-N 3.13Å; E854-V857 VanDerWaalsContact O-N 3.14Å; L855-V857 VanDerWaalsContact C-N 3.3Å; L855-V857 PolarHBondContact O-N 3.13Å; V857-Q860 PolarHBondContact O-N 3.17Å; V857-L861 WeakPolarHBondContact O-CB 3.47Å; V857-L861 PolarHBondContact O-N 2.91Å
858	V	83.4	Confident	76.8	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.024	29%	0.285	C	S	.	.	H	α-helix	trans	-63	-42.5	175.4	176.2	0	0	0	0	111.3	L711 L845 E854 L855 L861 L862 I889	L711-V858 HydrophobicContact CD1-CG2 3.79Å; L845-V858 HydrophobicContact CD2-CG1 4.33Å; E854-V858 WeakPolarHBondContact O-CG2 3.38Å; E854-V858 PolarHBondContact O-N 3.33Å; L855-V858 PolarHBondContact O-N 3.04Å; V858-L861 WeakPolarHBondContact O-CB 3.3Å; V858-L861 PolarHBondContact O-N 3.33Å; V858-L862 HydrophobicContact CG1-CD1 4.26Å; V858-L862 WeakPolarHBondContact O-CG 3.4Å; V858-L862 PolarHBondContact O-N 3.38Å; V858-I889 HydrophobicContact CG1-CD1 4.13Å
859	A	82.3	Confident	77.8	Confident	2 Å²	2	57.6 Å²	57.6	2%	0.017	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-44.5	176.1	0	0	0	0	0	112.1	L855 P856 L861 L862 R863 W901 L905	L855-A859 WeakPolarHBondContact O-CB 3.33Å; L855-A859 PolarHBondContact O-N 3.17Å; P856-A859 PolarHBondContact O-N 3.22Å; A859-L861 VanDerWaalsContact C-N 3.34Å; A859-L861 PolarHBondContact O-N 2.92Å; A859-L862 PolarHBondContact O-N 2.86Å; A859-R863 WeakPolarHBondContact O-CB 3.39Å; A859-R863 PolarHBondContact O-N 2.95Å; A859-W901 HydrophobicContact CB-CD2 4.49Å; A859-W901 HydrophobicContact CB-CE3 3.35Å; A859-W901 HydrophobicContact CB-CZ3 3.52Å; A859-L905 HydrophobicContact CB-CB 4.49Å; A859-L905 HydrophobicContact CB-CD2 3.81Å
860	Q	85.4	Confident	79.2	Confident	71 Å²	71	52.4 Å²	52.4	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-63.1	-40.1	175.1	-174.9	175.5	-19.9	0	0	111.8	L807 P856 V857 R863 L864	L807-Q860 HydrophobicContact CD2-CG 4.3Å; P856-Q860 WeakPolarHBondContact O-CB 3.46Å; P856-Q860 PolarHBondContact O-N 3.43Å; V857-Q860 PolarHBondContact O-N 3.17Å; Q860-R863 PolarHBondContact O-N 3.45Å; Q860-L864 HydrophobicContact CG-CD1 4.25Å; Q860-L864 WeakPolarHBondContact O-CG 3.3Å; Q860-L864 PolarHBondContact O-N 2.83Å
861	L	86.1	Confident	80.7	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-51.2	175.4	179.7	60.8	0	0	0	111.6	Y800 L803 L807 V857 V858 A859 R863 L864 L865	Y800-L861 HydrophobicContact CD2-CD2 3.89Å; Y800-L861 HydrophobicContact CE2-CD2 3.82Å; L803-L861 HydrophobicContact CB-CD1 3.84Å; L803-L861 HydrophobicContact CB-CD2 4.48Å; L803-L861 HydrophobicContact CD1-CD1 4.04Å; L803-L861 HydrophobicContact CD2-CD1 4.43Å; L803-L861 HydrophobicContact CG-CD1 4.32Å; L807-L861 HydrophobicContact CD1-CB 3.6Å; L807-L861 HydrophobicContact CD1-CD1 3.87Å; L807-L861 HydrophobicContact CD1-CG 4.3Å; V857-L861 WeakPolarHBondContact O-CB 3.47Å; V857-L861 PolarHBondContact O-N 2.91Å; V858-L861 WeakPolarHBondContact O-CB 3.3Å; V858-L861 PolarHBondContact O-N 3.33Å; A859-L861 VanDerWaalsContact C-N 3.34Å; A859-L861 PolarHBondContact O-N 2.92Å; L861-R863 VanDerWaalsContact C-N 3.31Å; L861-R863 PolarHBondContact O-N 2.73Å; L861-L864 PolarHBondContact O-N 3.17Å; L861-L864 VanDerWaalsContact O-N 3.15Å; L861-L865 HydrophobicContact CD1-CD1 4.07Å; L861-L865 HydrophobicContact CD1-CG 4.1Å; L861-L865 HydrophobicContact CG-CD1 3.92Å; L861-L865 HydrophobicContact CG-CG 4.36Å; L861-L865 WeakPolarHBondContact O-CG 3.36Å; L861-L865 PolarHBondContact O-N 3.28Å
862	L	84.7	Confident	81.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-43.7	178.9	-73.1	172.4	0	0	0	111.4	L842 L845 V858 A859 L864 L865 M866 I885 I886 I889 L905	L842-L862 HydrophobicContact CD2-CD2 3.91Å; L845-L862 HydrophobicContact CD1-CD2 4.2Å; V858-L862 HydrophobicContact CG1-CD1 4.26Å; V858-L862 WeakPolarHBondContact O-CG 3.4Å; V858-L862 PolarHBondContact O-N 3.38Å; A859-L862 PolarHBondContact O-N 2.86Å; L862-L864 PolarHBondContact O-N 3.37Å; L862-L865 PolarHBondContact O-N 2.96Å; L862-M866 WeakPolarHBondContact O-CB 3.49Å; L862-M866 WeakPolarHBondContact O-CG 3.33Å; L862-M866 PolarHBondContact O-N 2.67Å; L862-I885 HydrophobicContact CD1-CG2 3.83Å; L862-I886 HydrophobicContact CD1-CG1 4.35Å; L862-I889 HydrophobicContact CD1-CD1 3.88Å; L862-L905 HydrophobicContact CB-CD1 4.09Å
863	R	85.7	Confident	82.3	Confident	83 Å²	83	48.5 Å²	48.5	31%	0.313	25%	0.25	S	C	.	.	H	α-helix	trans	-55.9	-48.6	174.4	174	177	171.4	-175.5	6.3	111.9	A859 Q860 L861 M866 Q867 D904 C908	A859-R863 WeakPolarHBondContact O-CB 3.39Å; A859-R863 PolarHBondContact O-N 2.95Å; Q860-R863 PolarHBondContact O-N 3.45Å; L861-R863 VanDerWaalsContact C-N 3.31Å; L861-R863 PolarHBondContact O-N 2.73Å; R863-M866 PolarHBondContact O-N 3.35Å; R863-Q867 VanDerWaalsContact O-CG 3.26Å; R863-Q867 WeakPolarHBondContact O-CG 3.26Å; R863-Q867 PolarHBondContact O-N 3.29Å; R863-Q867 VanDerWaalsContact O-N 3.14Å; R863-D904 IonicContact CZ-OD2 2.59Å; R863-D904 IonicContact NH1-OD2 3.56Å; R863-D904 PolarHBondContact NH1-OD2 3.46Å; R863-D904 IonicContact NH2-OD2 3.9Å; R863-C908 HydrophobicContact CG-CB 4.16Å
864	L	85.7	Confident	82.9	Confident	51 Å²	51	41.7 Å²	41.7	27%	0.267	22%	0.218	S	C	.	.	H	α-helix	trans	-66.9	-40.4	-179	-70.4	169.9	0	0	0	112.4	L807 W824 Q860 L861 L862 Q867 H868	L807-L864 HydrophobicContact CD2-CD1 3.51Å; W824-L864 HydrophobicContact CH2-CB 3.77Å; W824-L864 HydrophobicContact CH2-CD1 3.75Å; W824-L864 HydrophobicContact CH2-CG 4.35Å; W824-L864 HydrophobicContact CZ2-CB 4.13Å; W824-L864 HydrophobicContact CZ2-CD1 4.5Å; W824-L864 HydrophobicContact CZ3-CD1 4.31Å; Q860-L864 HydrophobicContact CG-CD1 4.25Å; Q860-L864 WeakPolarHBondContact O-CG 3.3Å; Q860-L864 PolarHBondContact O-N 2.83Å; L861-L864 PolarHBondContact O-N 3.17Å; L861-L864 VanDerWaalsContact O-N 3.15Å; L862-L864 PolarHBondContact O-N 3.37Å; L864-Q867 PolarHBondContact O-N 3.23Å; L864-H868 PolarHBondContact O-N 3Å
865	L	85.1	Confident	83.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-39.9	177.2	-66.9	173.7	0	0	0	111.9	I828 L831 M841 L861 L862 Q867 H868 L871 M875	I828-L865 HydrophobicContact CD1-CD2 3.74Å; L831-L865 HydrophobicContact CD1-CD2 3.98Å; M841-L865 HydrophobicContact CE-CD1 3.68Å; L861-L865 HydrophobicContact CD1-CD1 4.07Å; L861-L865 HydrophobicContact CD1-CG 4.1Å; L861-L865 HydrophobicContact CG-CD1 3.92Å; L861-L865 HydrophobicContact CG-CG 4.36Å; L861-L865 WeakPolarHBondContact O-CG 3.36Å; L861-L865 PolarHBondContact O-N 3.28Å; L862-L865 PolarHBondContact O-N 2.96Å; L865-Q867 VanDerWaalsContact C-N 3.35Å; L865-H868 PolarHBondContact O-N 3.36Å; L865-L871 HydrophobicContact CB-CD1 4.44Å; L865-L871 HydrophobicContact CD2-CD1 3.51Å; L865-M875 HydrophobicContact CB-CE 4.1Å; L865-M875 HydrophobicContact CB-SD 4.44Å
866	M	84.5	Confident	83.1	Confident	11 Å²	11	42 Å²	42	5%	0.054	22%	0.224	C	C	.	.	H	α-helix	trans	-69.4	-30.8	178.5	-70.4	177.1	62.3	0	0	113.4	L862 R863 M875 V882 I886 F909 Y912	L862-M866 WeakPolarHBondContact O-CB 3.49Å; L862-M866 WeakPolarHBondContact O-CG 3.33Å; L862-M866 PolarHBondContact O-N 2.67Å; R863-M866 PolarHBondContact O-N 3.35Å; M866-M875 HydrophobicContact CG-CE 3.49Å; M866-M875 VanDerWaalsContact CG-CE 3.49Å; M866-V882 HydrophobicContact SD-CG1 4.22Å; M866-I886 HydrophobicContact SD-CD1 4.46Å; M866-F909 HydrophobicContact CE-CB 4.31Å; M866-F909 HydrophobicContact CE-CD2 3.92Å; M866-Y912 HydrophobicContact CB-CD2 4.24Å; M866-Y912 HydrophobicContact CE-CD1 3.45Å; M866-Y912 VanDerWaalsContact CE-CD1 3.45Å; M866-Y912 HydrophobicContact CE-CD2 3.78Å; M866-Y912 HydrophobicContact CE-CE1 4.22Å; M866-Y912 HydrophobicContact CE-CE2 4.49Å; M866-Y912 HydrophobicContact CE-CG 3.19Å
867	Q	83.5	Confident	83.1	Confident	111 Å²	111	45.7 Å²	45.7	52%	0.519	25%	0.246	S	C	.	.	H	α-helix	trans	-81.4	-17.3	177.7	-70.7	178.5	-10.3	0	0	112.8	R863 L864 L865 G869 C908	R863-Q867 VanDerWaalsContact O-CG 3.26Å; R863-Q867 WeakPolarHBondContact O-CG 3.26Å; R863-Q867 PolarHBondContact O-N 3.29Å; R863-Q867 VanDerWaalsContact O-N 3.14Å; L864-Q867 PolarHBondContact O-N 3.23Å; L865-Q867 VanDerWaalsContact C-N 3.35Å; Q867-G869 PolarHBondContact O-N 3.31Å; Q867-C908 PolarHBondContact NE2-SG 3.31Å
868	H	84.6	Confident	83.1	Confident	59 Å²	59	45.4 Å²	45.4	27%	0.273	24%	0.244	S	C	.	.			trans	-78.3	117.4	-176.4	-156.7	-78.8	0	0	0	111.9	I828 L864 L865 Q870 L871 R872	I828-H868 VanDerWaalsContact CG2-CE1 3.43Å; I828-H868 WeakPolarHBondContact CG2-CE1 3.46Å; L864-H868 PolarHBondContact O-N 3Å; L865-H868 PolarHBondContact O-N 3.36Å; H868-Q870 VanDerWaalsContact C-N 3.33Å; H868-Q870 PolarHBondContact O-N 3.43Å; H868-L871 HydrophobicContact CB-CD1 4.44Å; H868-L871 PolarHBondContact O-N 3.37Å; H868-R872 PolarHBondContact O-N 2.93Å
869	G	80.7	Confident	83.1	Confident	62 Å²	62	48.6 Å²	48.6	64%	0.639	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-56.2	-39.7	-171.8	0	0	0	0	0	115.1	Q867 L871 R872	Q867-G869 PolarHBondContact O-N 3.31Å; G869-L871 VanDerWaalsContact C-N 3.28Å; G869-L871 PolarHBondContact O-N 3.08Å; G869-R872 WeakPolarHBondContact O-CB 3.3Å; G869-R872 PolarHBondContact O-N 2.93Å
870	Q	80.4	Confident	83	Confident	118 Å²	118	55.8 Å²	55.8	55%	0.551	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-67.6	-23.1	-179.6	-68.4	179	-20.3	0	0	114.1	A832 H868	A832-Q870 HydrophobicContact CB-CB 4.31Å; H868-Q870 VanDerWaalsContact C-N 3.33Å; H868-Q870 PolarHBondContact O-N 3.43Å
871	L	83.7	Confident	82.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-96.9	-9	-177.5	-63.9	179.7	0	0	0	112.8	I828 L831 A832 L865 H868 G869 S873 H874 M875	I828-L871 HydrophobicContact CD1-CD1 3.77Å; I828-L871 HydrophobicContact CG2-CD1 4.25Å; I828-L871 HydrophobicContact CG2-CG 4.32Å; L831-L871 HydrophobicContact CB-CD1 4.42Å; L831-L871 HydrophobicContact CB-CD2 3.7Å; A832-L871 HydrophobicContact CB-CD2 3.83Å; L865-L871 HydrophobicContact CB-CD1 4.44Å; L865-L871 HydrophobicContact CD2-CD1 3.51Å; H868-L871 HydrophobicContact CB-CD1 4.44Å; H868-L871 PolarHBondContact O-N 3.37Å; G869-L871 VanDerWaalsContact C-N 3.28Å; G869-L871 PolarHBondContact O-N 3.08Å; L871-S873 VanDerWaalsContact C-N 3.33Å; L871-S873 PolarHBondContact O-N 3.35Å; L871-H874 PolarHBondContact O-N 3.33Å; L871-H874 VanDerWaalsContact O-N 3.1Å; L871-M875 HydrophobicContact CB-CG 4.2Å; L871-M875 WeakPolarHBondContact O-CB 3.47Å; L871-M875 VanDerWaalsContact O-CG 3.27Å; L871-M875 WeakPolarHBondContact O-CG 3.29Å; L871-M875 PolarHBondContact O-N 3.38Å
872	R	80.5	Confident	82.7	Confident	108 Å²	108	53.5 Å²	53.5	41%	0.408	28%	0.28	S	S	.	.	H	α-helix	trans	-55.8	-43.8	-172.4	-172.2	174.9	175.7	-175.7	-4.2	113.1	H868 G869 A876 Y912 S915	H868-R872 PolarHBondContact O-N 2.93Å; G869-R872 WeakPolarHBondContact O-CB 3.3Å; G869-R872 PolarHBondContact O-N 2.93Å; R872-A876 WeakPolarHBondContact O-CB 3.35Å; R872-A876 PolarHBondContact O-N 2.65Å; R872-Y912 HydrophobicContact CG-CE2 4.43Å; R872-S915 PolarHBondContact NH2-O 3Å; R872-S915 PolarHBondContact NH2-OG 2.94Å
873	S	78.5	Confident	82.6	Confident	70 Å²	70	55.9 Å²	55.9	49%	0.49	29%	0.291	S	S	.	.	H	α-helix	trans	-65.5	-43	177.5	55.5	0	0	0	0	112.5	L871 A876 T877	L871-S873 VanDerWaalsContact C-N 3.33Å; L871-S873 PolarHBondContact O-N 3.35Å; S873-A876 WeakPolarHBondContact O-CB 3.38Å; S873-A876 PolarHBondContact O-N 3.08Å; S873-T877 PolarHBondContact O-N 3.33Å; S873-T877 VanDerWaalsContact O-N 3.11Å; S873-T877 PolarHBondContact O-OG1 3.06Å; S873-T877 VanDerWaalsContact O-OG1 3.08Å
874	H	82.6	Confident	82.4	Confident	40 Å²	40	55.1 Å²	55.1	19%	0.185	29%	0.291	C	S	.	.	H	α-helix	trans	-72.6	-33.8	179.9	-63.5	-56.5	0	0	0	112.8	A832 P835 L838 L871 A876 N878	A832-H874 PolarHBondContact O-NE2 3.11Å; A832-H874 VanDerWaalsContact O-NE2 3.13Å; P835-H874 VanDerWaalsContact CG-CE1 3.46Å; P835-H874 WeakPolarHBondContact CG-CE1 3.39Å; L838-H874 HydrophobicContact CD2-CB 3.56Å; L871-H874 PolarHBondContact O-N 3.33Å; L871-H874 VanDerWaalsContact O-N 3.1Å; H874-A876 VanDerWaalsContact C-N 3.32Å; H874-N878 PolarHBondContact O-N 3.06Å; H874-N878 PolarHBondContact O-ND2 3.2Å
875	M	82.1	Confident	82.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-36.6	171.3	-69.1	-67.3	-78.6	0	0	110.8	L838 L842 L865 M866 L871 N878 E879 V882 Y912	L838-M875 HydrophobicContact CD1-SD 4.05Å; L838-M875 HydrophobicContact CD2-CG 4.2Å; L838-M875 HydrophobicContact CD2-SD 3.83Å; L838-M875 HydrophobicContact CG-SD 4.35Å; L842-M875 HydrophobicContact CD1-SD 4.3Å; L865-M875 HydrophobicContact CB-CE 4.1Å; L865-M875 HydrophobicContact CB-SD 4.44Å; M866-M875 HydrophobicContact CG-CE 3.49Å; M866-M875 VanDerWaalsContact CG-CE 3.49Å; L871-M875 HydrophobicContact CB-CG 4.2Å; L871-M875 WeakPolarHBondContact O-CB 3.47Å; L871-M875 VanDerWaalsContact O-CG 3.27Å; L871-M875 WeakPolarHBondContact O-CG 3.29Å; L871-M875 PolarHBondContact O-N 3.38Å; M875-N878 CarbonylContact O-C 3.53Å; M875-N878 PolarHBondContact O-N 2.77Å; M875-N878 VanDerWaalsContact O-N 3.17Å; M875-E879 PolarHBondContact O-N 3.15Å; M875-V882 HydrophobicContact CE-CG2 3.96Å; M875-Y912 HydrophobicContact CB-CE2 4.29Å; M875-Y912 VanDerWaalsContact CB-OH 3.3Å; M875-Y912 WeakPolarHBondContact CB-OH 3.15Å; M875-Y912 PolarHBondContact O-OH 3.18Å
876	A	80.4	Confident	81.9	Confident	28 Å²	28	53 Å²	53	23%	0.231	28%	0.28	C	S	.	.	H	α-helix	trans	-66.7	-41.8	177.2	0	0	0	0	0	111.3	R872 S873 H874 N878 E879 Y912	R872-A876 WeakPolarHBondContact O-CB 3.35Å; R872-A876 PolarHBondContact O-N 2.65Å; S873-A876 WeakPolarHBondContact O-CB 3.38Å; S873-A876 PolarHBondContact O-N 3.08Å; H874-A876 VanDerWaalsContact C-N 3.32Å; A876-N878 PolarHBondContact O-N 2.76Å; A876-N878 VanDerWaalsContact O-N 3.14Å; A876-E879 VanDerWaalsContact O-CB 3.31Å; A876-E879 WeakPolarHBondContact O-CB 3.48Å; A876-E879 PolarHBondContact O-N 3.01Å; A876-E879 VanDerWaalsContact O-N 3.11Å; A876-Y912 WeakPolarHBondContact CA-OH 3.3Å; A876-Y912 PolarHBondContact N-OH 2.99Å
877	T	82.9	Confident	81.7	Confident	118 Å²	118	58.2 Å²	58.2	72%	0.724	30%	0.302	S	S	*	.	H	α-helix	trans	-61.7	-22.8	174.2	-51.9	0	0	0	0	113.1	S873	S873-T877 PolarHBondContact O-N 3.33Å; S873-T877 VanDerWaalsContact O-N 3.11Å; S873-T877 PolarHBondContact O-OG1 3.06Å; S873-T877 VanDerWaalsContact O-OG1 3.08Å
878	N	82.9	Confident	81.4	Confident	16 Å²	16	54.7 Å²	54.7	9%	0.086	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	21.4	178.1	-66.8	-76.5	0	0	0	113.1	R839 L842 H874 M875 A876 F880 L881 V882	R839-N878 WeakPolarHBondContact CB-OD1 3.32Å; R839-N878 WeakPolarHBondContact CG-OD1 3.47Å; L842-N878 HydrophobicContact CD1-CB 3.91Å; H874-N878 PolarHBondContact O-N 3.06Å; H874-N878 PolarHBondContact O-ND2 3.2Å; M875-N878 CarbonylContact O-C 3.53Å; M875-N878 PolarHBondContact O-N 2.77Å; M875-N878 VanDerWaalsContact O-N 3.17Å; A876-N878 PolarHBondContact O-N 2.76Å; A876-N878 VanDerWaalsContact O-N 3.14Å; N878-F880 VanDerWaalsContact C-N 3.3Å; N878-F880 PolarHBondContact O-N 3.3Å; N878-L881 PolarHBondContact O-N 3.3Å; N878-V882 PolarHBondContact O-N 3.45Å; N878-V882 VanDerWaalsContact O-N 3.09Å
879	E	81.8	Confident	81	Confident	72 Å²	72	51.9 Å²	51.9	34%	0.336	27%	0.274	S	S	.	.	H	α-helix	trans	-51.6	-45	-173.7	-175.9	-177.2	170.2	0	0	113.1	M875 A876 L881 V882 Q883 L913	M875-E879 PolarHBondContact O-N 3.15Å; A876-E879 VanDerWaalsContact O-CB 3.31Å; A876-E879 WeakPolarHBondContact O-CB 3.48Å; A876-E879 PolarHBondContact O-N 3.01Å; A876-E879 VanDerWaalsContact O-N 3.11Å; E879-L881 VanDerWaalsContact C-N 3.34Å; E879-L881 PolarHBondContact O-N 3.29Å; E879-V882 PolarHBondContact O-N 3.44Å; E879-Q883 HydrophobicContact CG-CG 4.31Å; E879-Q883 WeakPolarHBondContact O-CB 3.38Å; E879-Q883 VanDerWaalsContact O-CG 3.3Å; E879-Q883 WeakPolarHBondContact O-CG 3.46Å; E879-Q883 PolarHBondContact O-N 3.09Å; E879-Q883 PolarHBondContact OE1-NE2 3.16Å; E879-L913 VanDerWaalsContact OE1-CD2 3.26Å; E879-L913 WeakPolarHBondContact OE1-CD2 3.29Å
880	F	81.8	Confident	80.7	Confident	152 Å²	152	52.1 Å²	52.1	67%	0.667	26%	0.259	S	S	*	.	H	α-helix	trans	-60.9	-40	179.1	-178	-93.5	0	0	0	113	N878 Q884	N878-F880 VanDerWaalsContact C-N 3.3Å; N878-F880 PolarHBondContact O-N 3.3Å; F880-Q884 WeakPolarHBondContact O-CB 3.28Å; F880-Q884 PolarHBondContact O-N 3.23Å
881	L	82.6	Confident	80.5	Confident	23 Å²	23	50.9 Å²	50.9	12%	0.12	26%	0.26	C	S	.	.	H	α-helix	trans	-68	-42.3	177.5	-70.1	172.7	0	0	0	110.9	R839 Q843 N878 E879 Q884 I885	R839-L881 HydrophobicContact CG-CD1 3.86Å; Q843-L881 HydrophobicContact CG-CD1 4.27Å; N878-L881 PolarHBondContact O-N 3.3Å; E879-L881 VanDerWaalsContact C-N 3.34Å; E879-L881 PolarHBondContact O-N 3.29Å; L881-Q884 PolarHBondContact O-N 2.97Å; L881-I885 WeakPolarHBondContact O-CD1 3.28Å; L881-I885 WeakPolarHBondContact O-CG1 3.45Å; L881-I885 PolarHBondContact O-N 3.29Å
882	V	82.4	Confident	79.8	Confident	2 Å²	2	53 Å²	53	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-43.7	176.8	177.8	0	0	0	0	110.7	L842 M866 M875 N878 E879 Q884 I885 I886	L842-V882 HydrophobicContact CD1-CG2 3.95Å; M866-V882 HydrophobicContact SD-CG1 4.22Å; M875-V882 HydrophobicContact CE-CG2 3.96Å; N878-V882 PolarHBondContact O-N 3.45Å; N878-V882 VanDerWaalsContact O-N 3.09Å; E879-V882 PolarHBondContact O-N 3.44Å; V882-Q884 VanDerWaalsContact C-N 3.34Å; V882-Q884 PolarHBondContact O-N 2.99Å; V882-I885 PolarHBondContact O-N 2.88Å; V882-I886 HydrophobicContact CG1-CD1 3.79Å; V882-I886 VanDerWaalsContact O-CG1 3.31Å; V882-I886 WeakPolarHBondContact O-CG1 3.42Å; V882-I886 PolarHBondContact O-N 2.98Å
883	Q	81.8	Confident	79.1	Confident	50 Å²	50	51 Å²	51	23%	0.234	27%	0.265	C	S	.	.	H	α-helix	trans	-58.4	-44.4	174.2	-78.2	-175.5	10.8	0	0	112.2	E879 K887 F909	E879-Q883 HydrophobicContact CG-CG 4.31Å; E879-Q883 WeakPolarHBondContact O-CB 3.38Å; E879-Q883 VanDerWaalsContact O-CG 3.3Å; E879-Q883 WeakPolarHBondContact O-CG 3.46Å; E879-Q883 PolarHBondContact O-N 3.09Å; E879-Q883 PolarHBondContact OE1-NE2 3.16Å; Q883-K887 WeakPolarHBondContact O-CB 3.47Å; Q883-K887 VanDerWaalsContact O-CG 3.28Å; Q883-K887 WeakPolarHBondContact O-CG 3.46Å; Q883-K887 PolarHBondContact O-N 3.39Å; Q883-F909 HydrophobicContact CG-CE2 4.08Å; Q883-F909 HydrophobicContact CG-CZ 3.73Å
884	Q	82.6	Confident	78	Confident	66 Å²	66	52.9 Å²	52.9	31%	0.308	28%	0.278	S	S	.	.	H	α-helix	trans	-63.6	-47.7	178.8	-173.3	61.3	33.6	0	0	111.2	F880 L881 V882 I886 K887 D888	F880-Q884 WeakPolarHBondContact O-CB 3.28Å; F880-Q884 PolarHBondContact O-N 3.23Å; L881-Q884 PolarHBondContact O-N 2.97Å; V882-Q884 VanDerWaalsContact C-N 3.34Å; V882-Q884 PolarHBondContact O-N 2.99Å; Q884-I886 VanDerWaalsContact C-N 3.34Å; Q884-I886 PolarHBondContact O-N 3.43Å; Q884-K887 PolarHBondContact O-N 3.12Å; Q884-D888 PolarHBondContact NE2-OD1 2.91Å; Q884-D888 PolarHBondContact O-N 3.41Å
885	I	80.6	Confident	76.7	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-43.5	179.5	-63.4	157.8	0	0	0	110.9	L842 L845 Q846 L862 L881 V882 D888 I889	L842-I885 HydrophobicContact CB-CD1 4.13Å; L842-I885 HydrophobicContact CD2-CD1 4.31Å; L842-I885 VanDerWaalsContact O-CD1 3.27Å; L842-I885 WeakPolarHBondContact O-CD1 3.46Å; L845-I885 HydrophobicContact CB-CD1 4.23Å; L845-I885 HydrophobicContact CB-CG2 4.48Å; Q846-I885 HydrophobicContact CG-CG1 4.28Å; L862-I885 HydrophobicContact CD1-CG2 3.83Å; L881-I885 WeakPolarHBondContact O-CD1 3.28Å; L881-I885 WeakPolarHBondContact O-CG1 3.45Å; L881-I885 PolarHBondContact O-N 3.29Å; V882-I885 PolarHBondContact O-N 2.88Å; I885-D888 PolarHBondContact O-N 3.35Å; I885-I889 HydrophobicContact CG2-CD1 3.94Å; I885-I889 HydrophobicContact CG2-CG1 4.47Å; I885-I889 VanDerWaalsContact O-CG1 3.26Å; I885-I889 WeakPolarHBondContact O-CG1 3.22Å; I885-I889 PolarHBondContact O-N 3.48Å
886	I	79.3	Confident	75	Confident	8 Å²	8	63.5 Å²	63.5	4%	0.041	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-41.7	178.6	-67.3	170	0	0	0	110.7	L862 M866 V882 Q884 D888 I889 M890 L905 F909	L862-I886 HydrophobicContact CD1-CG1 4.35Å; M866-I886 HydrophobicContact SD-CD1 4.46Å; V882-I886 HydrophobicContact CG1-CD1 3.79Å; V882-I886 VanDerWaalsContact O-CG1 3.31Å; V882-I886 WeakPolarHBondContact O-CG1 3.42Å; V882-I886 PolarHBondContact O-N 2.98Å; Q884-I886 VanDerWaalsContact C-N 3.34Å; Q884-I886 PolarHBondContact O-N 3.43Å; I886-D888 VanDerWaalsContact C-N 3.33Å; I886-D888 PolarHBondContact O-N 3.01Å; I886-I889 PolarHBondContact O-N 2.92Å; I886-M890 HydrophobicContact CG2-CG 4.35Å; I886-M890 WeakPolarHBondContact O-CB 3.44Å; I886-M890 WeakPolarHBondContact O-CG 3.26Å; I886-M890 PolarHBondContact O-N 3.48Å; I886-L905 HydrophobicContact CG1-CD2 4.46Å; I886-F909 HydrophobicContact CD1-CB 4.1Å; I886-F909 HydrophobicContact CD1-CD2 3.22Å; I886-F909 HydrophobicContact CD1-CE2 3.8Å; I886-F909 HydrophobicContact CD1-CG 3.72Å
887	K	79.6	Confident	73.8	Confident	120 Å²	120	67.8 Å²	67.8	52%	0.522	37%	0.366	S	S	.	.	H	α-helix	trans	-60.1	-42.9	173.3	-75	173.4	-177.6	175.7	0	111.6	Q883 Q884 M890 T891	Q883-K887 WeakPolarHBondContact O-CB 3.47Å; Q883-K887 VanDerWaalsContact O-CG 3.28Å; Q883-K887 WeakPolarHBondContact O-CG 3.46Å; Q883-K887 PolarHBondContact O-N 3.39Å; Q884-K887 PolarHBondContact O-N 3.12Å; K887-M890 PolarHBondContact O-N 3.29Å; K887-T891 VanDerWaalsContact O-CG2 3.31Å; K887-T891 WeakPolarHBondContact O-CG2 3.39Å; K887-T891 PolarHBondContact O-N 2.84Å; K887-T891 PolarHBondContact O-OG1 2.89Å
888	D	77.5	Confident	72.6	Confident	37 Å²	37	69.6 Å²	69.6	20%	0.198	37%	0.366	C	S	.	.	H	α-helix	trans	-63.5	-42.8	178	-63	-20.4	0	0	0	111	V847 Q884 I885 I886 M890 T891 L892	V847-D888 HydrophobicContact CB-CB 4.42Å; V847-D888 HydrophobicContact CG2-CB 4.4Å; Q884-D888 PolarHBondContact NE2-OD1 2.91Å; Q884-D888 PolarHBondContact O-N 3.41Å; I885-D888 PolarHBondContact O-N 3.35Å; I886-D888 VanDerWaalsContact C-N 3.33Å; I886-D888 PolarHBondContact O-N 3.01Å; D888-M890 PolarHBondContact O-N 3.28Å; D888-T891 PolarHBondContact O-N 2.91Å; D888-T891 PolarHBondContact O-OG1 3.17Å; D888-L892 WeakPolarHBondContact O-CB 3.31Å; D888-L892 WeakPolarHBondContact O-CD1 3.29Å; D888-L892 VanDerWaalsContact O-CG 3.26Å; D888-L892 WeakPolarHBondContact O-CG 3.42Å; D888-L892 PolarHBondContact O-N 3.36Å; D888-L892 VanDerWaalsContact O-N 3.15Å
889	I	76.9	Confident	72.1	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-60.6	-44.6	174.1	-66.6	167	0	0	0	111.2	V847 L855 V858 L862 I885 I886 L892 K893 W901 L905	V847-I889 HydrophobicContact CG2-CG1 4.27Å; L855-I889 HydrophobicContact CD2-CG1 3.99Å; L855-I889 HydrophobicContact CD2-CG2 4.4Å; V858-I889 HydrophobicContact CG1-CD1 4.13Å; L862-I889 HydrophobicContact CD1-CD1 3.88Å; I885-I889 HydrophobicContact CG2-CD1 3.94Å; I885-I889 HydrophobicContact CG2-CG1 4.47Å; I885-I889 VanDerWaalsContact O-CG1 3.26Å; I885-I889 WeakPolarHBondContact O-CG1 3.22Å; I885-I889 PolarHBondContact O-N 3.48Å; I886-I889 PolarHBondContact O-N 2.92Å; I889-L892 PolarHBondContact O-N 3.35Å; I889-K893 PolarHBondContact O-N 3.48Å; I889-W901 HydrophobicContact CG2-CH2 4.48Å; I889-W901 HydrophobicContact CG2-CZ3 4.17Å; I889-L905 HydrophobicContact CD1-CD2 4.43Å; I889-L905 HydrophobicContact CG2-CD2 4.5Å
890	M	74.3	Confident	71.8	Confident	66 Å²	66	76.2 Å²	76.2	33%	0.325	40%	0.396	S	S	.	.	H	α-helix	trans	-67.3	-35.6	-179	-67.8	-64	-72.2	0	0	112.7	I886 K887 D888 L902	I886-M890 HydrophobicContact CG2-CG 4.35Å; I886-M890 WeakPolarHBondContact O-CB 3.44Å; I886-M890 WeakPolarHBondContact O-CG 3.26Å; I886-M890 PolarHBondContact O-N 3.48Å; K887-M890 PolarHBondContact O-N 3.29Å; D888-M890 PolarHBondContact O-N 3.28Å; M890-L902 HydrophobicContact CE-CD2 3.67Å; M890-L902 HydrophobicContact CE-CG 4.48Å; M890-L902 HydrophobicContact SD-CD1 4.02Å; M890-L902 HydrophobicContact SD-CD2 3.5Å; M890-L902 VanDerWaalsContact SD-CD2 3.5Å; M890-L902 HydrophobicContact SD-CG 3.65Å
891	T	75.4	Confident	71.6	Confident	93 Å²	93	71.4 Å²	71.4	57%	0.571	37%	0.374	S	S	*	.	H	α-helix	trans	-72.7	-36.4	178.6	55.5	0	0	0	0	112.7	K887 D888 S894	K887-T891 VanDerWaalsContact O-CG2 3.31Å; K887-T891 WeakPolarHBondContact O-CG2 3.39Å; K887-T891 PolarHBondContact O-N 2.84Å; K887-T891 PolarHBondContact O-OG1 2.89Å; D888-T891 PolarHBondContact O-N 2.91Å; D888-T891 PolarHBondContact O-OG1 3.17Å; T891-S894 PolarHBondContact O-OG 3.06Å
892	L	70.1	Confident	71.4	Confident	45 Å²	45	71 Å²	71	24%	0.236	37%	0.372	C	S	.	.	H	α-helix	trans	-75.8	-19.5	-176.4	-72.3	166.9	0	0	0	114.9	V847 R849 D888 I889	V847-L892 HydrophobicContact CB-CD1 3.83Å; V847-L892 HydrophobicContact CG1-CD1 3.23Å; R849-L892 HydrophobicContact CG-CD2 4.43Å; D888-L892 WeakPolarHBondContact O-CB 3.31Å; D888-L892 WeakPolarHBondContact O-CD1 3.29Å; D888-L892 VanDerWaalsContact O-CG 3.26Å; D888-L892 WeakPolarHBondContact O-CG 3.42Å; D888-L892 PolarHBondContact O-N 3.36Å; D888-L892 VanDerWaalsContact O-N 3.15Å; I889-L892 PolarHBondContact O-N 3.35Å
893	K	64.6	Low	71.2	Confident	66 Å²	66	74.3 Å²	74.3	29%	0.287	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	17.4	-176.7	-102.6	-94.7	177.6	171.8	0	114.2	L855 I889 G895 E899 W901 L902	L855-K893 HydrophobicContact CD1-CG 3.93Å; I889-K893 PolarHBondContact O-N 3.48Å; K893-G895 PolarHBondContact O-N 3.31Å; K893-E899 IonicContact NZ-OE1 3.1Å; K893-E899 PolarHBondContact NZ-OE1 3.15Å; K893-E899 IonicContact NZ-OE2 3.46Å; K893-E899 PolarHBondContact NZ-OE2 2.99Å; K893-W901 HydrophobicContact CD-CH2 4.4Å; K893-W901 HydrophobicContact CD-CZ2 4.1Å; K893-W901 HydrophobicContact CG-CH2 4.27Å; K893-W901 HydrophobicContact CG-CZ2 4.45Å; K893-L902 HydrophobicContact CB-CD1 4.01Å
894	S	55.5	Low	71	Confident	109 Å²	109	74.2 Å²	74.2	76%	0.762	39%	0.393	S	S	*	.			trans	-67.9	53.8	-177.8	51.6	0	0	0	0	115.1	T891	T891-S894 PolarHBondContact O-OG 3.06Å
895	G	56.4	Low	71	Confident	54 Å²	54	71.1 Å²	71.1	56%	0.557	38%	0.378	S	S	*	.	S	Bend	trans	-111.3	163.5	171.3	0	0	0	0	0	112.8	K893 V897	K893-G895 PolarHBondContact O-N 3.31Å; G895-V897 PolarHBondContact O-N 2.98Å
896	E	44.6	Very low	70.9	Confident	209 Å²	209	75.4 Å²	75.4	98%	0.977	40%	0.398	S	S	*	.	S	Bend	trans	-63.6	-1.1	-161.7	-66.1	-178.5	154.7	0	0	117.8
897	V	55.1	Low	71	Confident	118 Å²	118	82.2 Å²	82.2	72%	0.715	42%	0.424	S	S	*	.			trans	-122.2	107.1	177.5	-175.3	0	0	0	0	110.1	G895 E899	G895-V897 PolarHBondContact O-N 2.98Å; V897-E899 PolarHBondContact O-N 3.19Å; V897-E899 VanDerWaalsContact O-N 3.15Å
898	Q	59.7	Low	71	Confident	156 Å²	156	77 Å²	77	73%	0.729	40%	0.403	S	S	*	.			trans	-69.6	106.8	172.1	-96.5	-175.8	-17.5	0	0	110.1
899	E	72.1	Confident	71.1	Confident	74 Å²	74	76.3 Å²	76.3	35%	0.346	40%	0.398	S	S	.	.			trans	-72.3	141.3	175.3	-66.9	171.4	-174.9	0	0	110.9	K893 V897 W901 L902	K893-E899 IonicContact NZ-OE1 3.1Å; K893-E899 PolarHBondContact NZ-OE1 3.15Å; K893-E899 IonicContact NZ-OE2 3.46Å; K893-E899 PolarHBondContact NZ-OE2 2.99Å; V897-E899 PolarHBondContact O-N 3.19Å; V897-E899 VanDerWaalsContact O-N 3.15Å; E899-W901 VanDerWaalsContact C-N 3.27Å; E899-W901 HydrophobicContact CB-CG 4.48Å; E899-W901 PolarHBondContact O-N 3.23Å; E899-W901 WeakPolarHBondContact OE2-CZ2 3.03Å; E899-W901 PolarHBondContact OE2-NE1 3.33Å; E899-L902 WeakPolarHBondContact O-CB 3.19Å; E899-L902 PolarHBondContact O-N 3.47Å
900	Q	74.5	Confident	71.2	Confident	153 Å²	153	79.8 Å²	79.8	72%	0.715	42%	0.417	S	S	*	.	H	α-helix	trans	-56.7	-35.9	-172.6	-171.8	175.8	-4.2	0	0	113.6	L902 T903 D904	Q900-L902 VanDerWaalsContact C-N 3.28Å; Q900-L902 PolarHBondContact O-N 2.97Å; Q900-T903 WeakPolarHBondContact O-CB 3.44Å; Q900-T903 PolarHBondContact O-N 2.81Å; Q900-D904 PolarHBondContact O-N 3.39Å
901	W	78.1	Confident	71.4	Confident	51 Å²	51	80.5 Å²	80.5	19%	0.193	42%	0.421	C	S	.	.	H	α-helix	trans	-66	-28.1	179.3	61.3	-96.4	0	0	0	113.5	L855 P856 A859 I889 K893 E899 L905	L855-W901 HydrophobicContact CB-CH2 4.17Å; P856-W901 HydrophobicContact CB-CD2 4.19Å; P856-W901 HydrophobicContact CB-CG 4.41Å; P856-W901 HydrophobicContact CB-CZ2 4.44Å; P856-W901 HydrophobicContact CG-CZ2 3.97Å; A859-W901 HydrophobicContact CB-CD2 4.49Å; A859-W901 HydrophobicContact CB-CE3 3.35Å; A859-W901 HydrophobicContact CB-CZ3 3.52Å; I889-W901 HydrophobicContact CG2-CH2 4.48Å; I889-W901 HydrophobicContact CG2-CZ3 4.17Å; K893-W901 HydrophobicContact CD-CH2 4.4Å; K893-W901 HydrophobicContact CD-CZ2 4.1Å; K893-W901 HydrophobicContact CG-CH2 4.27Å; K893-W901 HydrophobicContact CG-CZ2 4.45Å; E899-W901 VanDerWaalsContact C-N 3.27Å; E899-W901 HydrophobicContact CB-CG 4.48Å; E899-W901 PolarHBondContact O-N 3.23Å; E899-W901 WeakPolarHBondContact OE2-CZ2 3.03Å; E899-W901 PolarHBondContact OE2-NE1 3.33Å; W901-L905 WeakPolarHBondContact O-CB 3.5Å; W901-L905 PolarHBondContact O-N 3.06Å
902	L	78	Confident	71.4	Confident	15 Å²	15	76.6 Å²	76.6	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-75.1	-37.2	178.7	-171.3	139.3	0	0	0	110.4	M890 K893 E899 Q900 H906	M890-L902 HydrophobicContact CE-CD2 3.67Å; M890-L902 HydrophobicContact CE-CG 4.48Å; M890-L902 HydrophobicContact SD-CD1 4.02Å; M890-L902 HydrophobicContact SD-CD2 3.5Å; M890-L902 VanDerWaalsContact SD-CD2 3.5Å; M890-L902 HydrophobicContact SD-CG 3.65Å; K893-L902 HydrophobicContact CB-CD1 4.01Å; E899-L902 WeakPolarHBondContact O-CB 3.19Å; E899-L902 PolarHBondContact O-N 3.47Å; Q900-L902 VanDerWaalsContact C-N 3.28Å; Q900-L902 PolarHBondContact O-N 2.97Å; L902-H906 WeakPolarHBondContact O-CB 3.46Å; L902-H906 PolarHBondContact O-N 3.43Å; L902-H906 VanDerWaalsContact O-N 3.09Å
903	T	77.8	Confident	71.4	Confident	70 Å²	70	76.8 Å²	76.8	43%	0.429	40%	0.397	S	S	.	.	H	α-helix	trans	-65.1	-43.9	171.7	-41.2	0	0	0	0	111.2	Q900 H906 Y907	Q900-T903 WeakPolarHBondContact O-CB 3.44Å; Q900-T903 PolarHBondContact O-N 2.81Å; T903-H906 PolarHBondContact O-N 3Å; T903-Y907 WeakPolarHBondContact O-CB 3.36Å; T903-Y907 PolarHBondContact O-N 3.35Å
904	D	78.9	Confident	71.5	Confident	48 Å²	48	76.7 Å²	76.7	26%	0.257	41%	0.408	S	S	.	.	H	α-helix	trans	-63	-42.2	176.8	-80.3	-1.1	0	0	0	112.6	R863 Q900 Y907 C908	R863-D904 IonicContact CZ-OD2 2.59Å; R863-D904 IonicContact NH1-OD2 3.56Å; R863-D904 PolarHBondContact NH1-OD2 3.46Å; R863-D904 IonicContact NH2-OD2 3.9Å; Q900-D904 PolarHBondContact O-N 3.39Å; D904-Y907 PolarHBondContact O-N 2.89Å; D904-C908 WeakPolarHBondContact O-CB 3.43Å; D904-C908 PolarHBondContact O-N 2.94Å; D904-C908 PolarHBondContact O-SG 2.96Å
905	L	81.5	Confident	71.8	Confident	2 Å²	2	73.9 Å²	73.9	1%	0.01	39%	0.389	C	S	.	.	H	α-helix	trans	-61.8	-47.2	175.6	177.4	65.7	0	0	0	110.7	A859 L862 I886 I889 W901 Y907 C908 F909	A859-L905 HydrophobicContact CB-CB 4.49Å; A859-L905 HydrophobicContact CB-CD2 3.81Å; L862-L905 HydrophobicContact CB-CD1 4.09Å; I886-L905 HydrophobicContact CG1-CD2 4.46Å; I889-L905 HydrophobicContact CD1-CD2 4.43Å; I889-L905 HydrophobicContact CG2-CD2 4.5Å; W901-L905 WeakPolarHBondContact O-CB 3.5Å; W901-L905 PolarHBondContact O-N 3.06Å; L905-Y907 PolarHBondContact O-N 3.47Å; L905-C908 PolarHBondContact O-N 3.3Å; L905-F909 VanDerWaalsContact O-CB 3.27Å; L905-F909 WeakPolarHBondContact O-CB 3.46Å; L905-F909 PolarHBondContact O-N 2.92Å
906	H	79.4	Confident	71.8	Confident	89 Å²	89	75 Å²	75	41%	0.412	38%	0.379	S	S	.	.	H	α-helix	trans	-62.6	-42	179	-169.4	-104.5	0	0	0	111.8	L902 T903 F909 N910	L902-H906 WeakPolarHBondContact O-CB 3.46Å; L902-H906 PolarHBondContact O-N 3.43Å; L902-H906 VanDerWaalsContact O-N 3.09Å; T903-H906 PolarHBondContact O-N 3Å; H906-F909 PolarHBondContact O-N 3.21Å; H906-N910 PolarHBondContact CE1-ND2 3.41Å; H906-N910 PolarHBondContact ND1-ND2 3.3Å; H906-N910 VanDerWaalsContact O-CG 3.25Å; H906-N910 PolarHBondContact O-N 2.95Å; H906-N910 PolarHBondContact O-ND2 3.27Å; H906-N910 VanDerWaalsContact O-ND2 3.08Å
907	Y	81.1	Confident	71.9	Confident	151 Å²	151	69.2 Å²	69.2	59%	0.592	36%	0.362	S	S	*	.	H	α-helix	trans	-62.3	-48	174.7	178.7	-106.1	0	0	0	112.3	T903 D904 L905 F909 N910 I911	T903-Y907 WeakPolarHBondContact O-CB 3.36Å; T903-Y907 PolarHBondContact O-N 3.35Å; D904-Y907 PolarHBondContact O-N 2.89Å; L905-Y907 PolarHBondContact O-N 3.47Å; Y907-F909 VanDerWaalsContact C-N 3.29Å; Y907-F909 PolarHBondContact O-N 3.42Å; Y907-N910 PolarHBondContact O-N 3.33Å; Y907-I911 HydrophobicContact CD1-CD1 3.79Å; Y907-I911 HydrophobicContact CD2-CD1 4.46Å; Y907-I911 HydrophobicContact CE1-CD1 3.22Å; Y907-I911 HydrophobicContact CE1-CG1 4.39Å; Y907-I911 HydrophobicContact CE2-CD1 3.97Å; Y907-I911 HydrophobicContact CE2-CG1 4.46Å; Y907-I911 HydrophobicContact CG-CD1 4.38Å; Y907-I911 PolarHBondContact O-N 2.87Å
908	C	79.8	Confident	71.4	Confident	11 Å²	11	73 Å²	73	7%	0.074	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-36.9	178.1	-67.3	0	0	0	0	112	R863 Q867 D904 L905 Y912	R863-C908 HydrophobicContact CG-CB 4.16Å; Q867-C908 PolarHBondContact NE2-SG 3.31Å; D904-C908 WeakPolarHBondContact O-CB 3.43Å; D904-C908 PolarHBondContact O-N 2.94Å; D904-C908 PolarHBondContact O-SG 2.96Å; L905-C908 PolarHBondContact O-N 3.3Å; C908-Y912 VanDerWaalsContact O-CB 3.29Å; C908-Y912 WeakPolarHBondContact O-CB 3.24Å; C908-Y912 PolarHBondContact O-N 2.96Å
909	F	80.1	Confident	70	Confident	23 Å²	23	68.8 Å²	68.8	10%	0.101	37%	0.37	C	S	.	.	H	α-helix	trans	-65	-43.7	175.5	178.6	-105.2	0	0	0	112.3	M866 Q883 I886 L905 H906 Y907 Y912 L913	M866-F909 HydrophobicContact CE-CB 4.31Å; M866-F909 HydrophobicContact CE-CD2 3.92Å; Q883-F909 HydrophobicContact CG-CE2 4.08Å; Q883-F909 HydrophobicContact CG-CZ 3.73Å; I886-F909 HydrophobicContact CD1-CB 4.1Å; I886-F909 HydrophobicContact CD1-CD2 3.22Å; I886-F909 HydrophobicContact CD1-CE2 3.8Å; I886-F909 HydrophobicContact CD1-CG 3.72Å; L905-F909 VanDerWaalsContact O-CB 3.27Å; L905-F909 WeakPolarHBondContact O-CB 3.46Å; L905-F909 PolarHBondContact O-N 2.92Å; H906-F909 PolarHBondContact O-N 3.21Å; Y907-F909 VanDerWaalsContact C-N 3.29Å; Y907-F909 PolarHBondContact O-N 3.42Å; F909-Y912 WeakPolarHBondContact O-CB 3.48Å; F909-Y912 PolarHBondContact O-N 3.38Å; F909-L913 HydrophobicContact CD1-CD1 4.03Å; F909-L913 HydrophobicContact CE1-CD1 3.33Å; F909-L913 HydrophobicContact CE1-CG 4.06Å; F909-L913 HydrophobicContact CE2-CD1 4.28Å; F909-L913 HydrophobicContact CE2-CD2 4.32Å; F909-L913 HydrophobicContact CE2-CG 4.17Å; F909-L913 HydrophobicContact CZ-CD1 3.44Å; F909-L913 VanDerWaalsContact CZ-CD1 3.44Å; F909-L913 HydrophobicContact CZ-CD2 4.04Å; F909-L913 HydrophobicContact CZ-CG 3.81Å; F909-L913 WeakPolarHBondContact O-CG 3.47Å; F909-L913 PolarHBondContact O-N 3.04Å
910	N	79.1	Confident	68.6	Low	72 Å²	72	72 Å²	72	39%	0.385	40%	0.397	S	S	.	.	H	α-helix	trans	-66.1	-39.8	177	-69.8	-31.8	0	0	0	112.7	H906 Y907 Y912 L913 A914	H906-N910 PolarHBondContact CE1-ND2 3.41Å; H906-N910 PolarHBondContact ND1-ND2 3.3Å; H906-N910 VanDerWaalsContact O-CG 3.25Å; H906-N910 PolarHBondContact O-N 2.95Å; H906-N910 PolarHBondContact O-ND2 3.27Å; H906-N910 VanDerWaalsContact O-ND2 3.08Å; Y907-N910 PolarHBondContact O-N 3.33Å; N910-Y912 VanDerWaalsContact C-N 3.33Å; N910-L913 PolarHBondContact O-N 3.33Å; N910-A914 VanDerWaalsContact O-CB 3.31Å; N910-A914 WeakPolarHBondContact O-CB 3.37Å; N910-A914 PolarHBondContact O-N 2.91Å
911	I	77.5	Confident	66.4	Low	81 Å²	81	68.1 Å²	68.1	42%	0.415	40%	0.399	S	S	.	.	H	α-helix	trans	-61.9	-44.4	172.4	-71.5	173.1	0	0	0	110.8	Y907 L913 A914 S915	Y907-I911 HydrophobicContact CD1-CD1 3.79Å; Y907-I911 HydrophobicContact CD2-CD1 4.46Å; Y907-I911 HydrophobicContact CE1-CD1 3.22Å; Y907-I911 HydrophobicContact CE1-CG1 4.39Å; Y907-I911 HydrophobicContact CE2-CD1 3.97Å; Y907-I911 HydrophobicContact CE2-CG1 4.46Å; Y907-I911 HydrophobicContact CG-CD1 4.38Å; Y907-I911 PolarHBondContact O-N 2.87Å; I911-L913 PolarHBondContact O-N 3.07Å; I911-A914 PolarHBondContact O-N 3.43Å; I911-S915 WeakPolarHBondContact O-CB 3.39Å; I911-S915 PolarHBondContact O-N 3.27Å; I911-S915 PolarHBondContact O-OG 3.5Å
912	Y	75.3	Confident	64.5	Low	11 Å²	11	71.4 Å²	71.4	4%	0.043	43%	0.427	C	S	.	.	H	α-helix	trans	-60.6	-45.6	179.7	174.2	-93.8	0	0	0	111.6	M866 R872 M875 A876 C908 F909 N910 S915 H916	M866-Y912 HydrophobicContact CB-CD2 4.24Å; M866-Y912 HydrophobicContact CE-CD1 3.45Å; M866-Y912 VanDerWaalsContact CE-CD1 3.45Å; M866-Y912 HydrophobicContact CE-CD2 3.78Å; M866-Y912 HydrophobicContact CE-CE1 4.22Å; M866-Y912 HydrophobicContact CE-CE2 4.49Å; M866-Y912 HydrophobicContact CE-CG 3.19Å; R872-Y912 HydrophobicContact CG-CE2 4.43Å; M875-Y912 HydrophobicContact CB-CE2 4.29Å; M875-Y912 VanDerWaalsContact CB-OH 3.3Å; M875-Y912 WeakPolarHBondContact CB-OH 3.15Å; M875-Y912 PolarHBondContact O-OH 3.18Å; A876-Y912 WeakPolarHBondContact CA-OH 3.3Å; A876-Y912 PolarHBondContact N-OH 2.99Å; C908-Y912 VanDerWaalsContact O-CB 3.29Å; C908-Y912 WeakPolarHBondContact O-CB 3.24Å; C908-Y912 PolarHBondContact O-N 2.96Å; F909-Y912 WeakPolarHBondContact O-CB 3.48Å; F909-Y912 PolarHBondContact O-N 3.38Å; N910-Y912 VanDerWaalsContact C-N 3.33Å; Y912-S915 PolarHBondContact O-N 3.38Å; Y912-S915 PolarHBondContact O-OG 3.2Å; Y912-H916 AromaticContact CD2-CE1 3.93Å; Y912-H916 AromaticContact CE2-CE1 3.51Å; Y912-H916 AromaticContact CZ-CE1 3.63Å; Y912-H916 PolarHBondContact O-ND1 2.93Å
913	L	70.7	Confident	63.1	Low	50 Å²	50	78.5 Å²	78.5	26%	0.262	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-46.3	173.8	-71.5	179.2	0	0	0	112.2	E879 F909 N910 I911 S915 H916 S917	E879-L913 VanDerWaalsContact OE1-CD2 3.26Å; E879-L913 WeakPolarHBondContact OE1-CD2 3.29Å; F909-L913 HydrophobicContact CD1-CD1 4.03Å; F909-L913 HydrophobicContact CE1-CD1 3.33Å; F909-L913 HydrophobicContact CE1-CG 4.06Å; F909-L913 HydrophobicContact CE2-CD1 4.28Å; F909-L913 HydrophobicContact CE2-CD2 4.32Å; F909-L913 HydrophobicContact CE2-CG 4.17Å; F909-L913 HydrophobicContact CZ-CD1 3.44Å; F909-L913 VanDerWaalsContact CZ-CD1 3.44Å; F909-L913 HydrophobicContact CZ-CD2 4.04Å; F909-L913 HydrophobicContact CZ-CG 3.81Å; F909-L913 WeakPolarHBondContact O-CG 3.47Å; F909-L913 PolarHBondContact O-N 3.04Å; N910-L913 PolarHBondContact O-N 3.33Å; I911-L913 PolarHBondContact O-N 3.07Å; L913-S915 PolarHBondContact O-N 3.45Å; L913-H916 PolarHBondContact O-N 3.02Å; L913-H916 VanDerWaalsContact O-N 3.07Å; L913-S917 PolarHBondContact O-N 2.72Å
914	A	66.7	Low	60.7	Low	63 Å²	63	80.4 Å²	80.4	52%	0.521	48%	0.479	S	S	.	.	H	α-helix	trans	-62.7	-30.4	179.4	0	0	0	0	0	112.9	N910 I911 H916 S917	N910-A914 VanDerWaalsContact O-CB 3.31Å; N910-A914 WeakPolarHBondContact O-CB 3.37Å; N910-A914 PolarHBondContact O-N 2.91Å; I911-A914 PolarHBondContact O-N 3.43Å; A914-H916 VanDerWaalsContact C-N 3.25Å; A914-H916 PolarHBondContact O-N 3.24Å; A914-S917 PolarHBondContact O-OG 3.49Å
915	S	61.1	Low	58.5	Low	51 Å²	51	84.3 Å²	84.3	36%	0.357	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-8.6	177.3	80.1	0	0	0	0	114.3	R872 I911 Y912 L913	R872-S915 PolarHBondContact NH2-O 3Å; R872-S915 PolarHBondContact NH2-OG 2.94Å; I911-S915 WeakPolarHBondContact O-CB 3.39Å; I911-S915 PolarHBondContact O-N 3.27Å; I911-S915 PolarHBondContact O-OG 3.5Å; Y912-S915 PolarHBondContact O-N 3.38Å; Y912-S915 PolarHBondContact O-OG 3.2Å; L913-S915 PolarHBondContact O-N 3.45Å
916	H	56.1	Low	56.2	Low	76 Å²	76	90.1 Å²	90.1	35%	0.352	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-13.4	176.8	-71.5	81.8	0	0	0	113	Y912 L913 A914 Q918	Y912-H916 AromaticContact CD2-CE1 3.93Å; Y912-H916 AromaticContact CE2-CE1 3.51Å; Y912-H916 AromaticContact CZ-CE1 3.63Å; Y912-H916 PolarHBondContact O-ND1 2.93Å; L913-H916 PolarHBondContact O-N 3.02Å; L913-H916 VanDerWaalsContact O-N 3.07Å; A914-H916 VanDerWaalsContact C-N 3.25Å; A914-H916 PolarHBondContact O-N 3.24Å; H916-Q918 VanDerWaalsContact C-N 3.33Å; H916-Q918 PolarHBondContact O-N 3.27Å
917	S	46.7	Very low	53.9	Low	88 Å²	88	100 Å²	100	62%	0.615	58%	0.576	S	S	*	*			trans	-88.7	43.8	-176.1	67.8	0	0	0	0	114.6	L913 A914	L913-S917 PolarHBondContact O-N 2.72Å; A914-S917 PolarHBondContact O-OG 3.49Å
918	Q	44.3	Very low	52.5	Low	198 Å²	198	97.5 Å²	97.5	93%	0.925	58%	0.575	S	S	*	*			trans	-136.9	87.4	164.6	-76.2	-161.2	-3.7	0	0	111.9	H916	H916-Q918 VanDerWaalsContact C-N 3.33Å; H916-Q918 PolarHBondContact O-N 3.27Å
919	G	30.8	Very low	51.1	Low	67 Å²	67	102.1 Å²	102.1	69%	0.691	60%	0.602	S	S	*	*	S	Bend	trans	-143.4	139.3	156.7	0	0	0	0	0	107.8
920	P	42.4	Very low	49.5	Very low	141 Å²	141	106.4 Å²	106.4	92%	0.916	63%	0.63	S	S	*	*			trans	-84	133.3	-158.9	31.9	-33.1	0	0	0	114.2
921	G	29	Very low	47.7	Very low	72 Å²	72	108.5 Å²	108.5	74%	0.742	64%	0.644	S	S	*	*			trans	107.2	161	143.8	0	0	0	0	0	117.3
922	P	38.6	Very low	45.8	Very low	120 Å²	120	110.2 Å²	110.2	78%	0.779	66%	0.658	S	S	*	*			cis	-110.8	163.8	-12.4	35.3	-21	0	0	0	112.5	S924	P922-S924 PolarHBondContact O-N 2.58Å
923	I	48.1	Very low	43.9	Very low	164 Å²	164	116.8 Å²	116.8	84%	0.841	70%	0.699	S	S	*	*			trans	-53	118.8	163.5	-64.6	159.9	0	0	0	108.5
924	S	27.4	Very low	42	Very low	111 Å²	111	121.6 Å²	121.6	78%	0.776	73%	0.73	S	S	*	*			trans	-141.2	126.2	147.9	68.1	0	0	0	0	109.1	P922	P922-S924 PolarHBondContact O-N 2.58Å
925	T	32.5	Very low	40.1	Very low	129 Å²	129	126.1 Å²	126.1	79%	0.791	75%	0.747	S	S	*	*			trans	-60	138.7	-172.8	38.3	0	0	0	0	113.8
926	V	32.5	Very low	38.3	Very low	124 Å²	124	132.3 Å²	132.3	75%	0.752	78%	0.779	S	S	*	*			trans	-65.5	137.2	160	170.3	0	0	0	0	110
927	Y	31.3	Very low	36.7	Very low	298 Å²	298	137.5 Å²	137.5	100%	1.169	82%	0.818	S	S	*	*				-123.7	0	112.3	-98.4	-74.9	0	0	0	109

Retrieved 927 of 927 residues in 305.1 ms (Link to these results)

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