A0A096MMB6_PAPAN Loading...

Phosphodiesterase

AlphaFold DB , UniProt , Accession A0A096MMB6, Species PAPAN (Papio anubis, Olive baboon), Gene PDE3B, Length 1,117 aa.

						>A0A096MMB6_PAPAN|A0A096MMB6|PDE3B
MRRDERDAKAMRSLQQPDGAGSPPESLRNGYVKSCVSPLRQDPPRGFFFHLCRFCNVELRPPPASLQQPRRGSPFCRARLSLGALAAFVLALLLGAEPESWAAGAAWLRTLLSVCSHSLSPLFSIACAFFFLTCFLTRTKRGPGPGRSGGSWWLLALPACCYLGDFLVWQWWSWPWGDGDAGSPATHTPPEAAAGRLLLVLSCVGLLLTLAHPLRLRHCLLVLLLASFVWWVSFTSLGSLPSALRPLLSGLVGGAGCLLALALDHFFQIREAPLHPRLSSGAEEKVPVIRPRRRSSCVSLGETAASYYGSCKIFRRPSLPCISREQMILWDWDLKQWYKPHYQNSGGGNGVDLSVLNEARNMVSDLLIDPSLPPQVISSLRSISSLMGAFSGSCRPKINPLTPFPGFYPCSEIEDPAEKGDRKLNKGLNRNSSPTPQLRRSSGTSGLLPVEQSSRWERNNGKRPHQEFGISSQGCYLNGPFNSNLLTIPKQRSSSVSLTHHVGLRRAGVLSSLSPVNSPNHGPVAAGSLTNRSPIEFPDTADFLNKPSIILQRSLGNAPNTPDFYQHLRNSDSNLCNNCGHQILKYVSTSESDSTDCCSGKSGEEENIFSKESFKLMETQQEEETEKKDSRKLFQEGDNWLTEEAQNEQQTNIEQEVSLDLILVEEYDSLIEKMSNWNFPIFELVEKMGEKSGRILSQVMYTLFQDTGLLEIFKIPTQQFMNYFRALENGYRDIPYHNRIHATDVLHAVWYLTTRPVPGLQQIHNGCGTGNETDSDGRINRGRIAYISSKSCSIPDESYGCLSSNIPALELMALYVAAAMHDYDHPGRTNAFLVATNAPQAVLYNDRSVLENHHAASAWNLYLSHPEYNFLLHLDHVEFKRFRFLVIEAILATDLKKHFDFLAEFNAKANDVNSNGIEWSNENDRLLVCQVCIKLADINGPAKVRDLHLKWTEGIVNEFYEQGDEEANLGLPISPFMDRSSPQLAKLQESFITHIVGPLCNSYDAAGLLPGQWIEAEEDNDTESGDDEDGEELDTDDEEMENNLNPKPPRRKSRRQIFCQLMHHLTENHKIWKEIIEEEEKCKADGNKLQVENSSLPQADEIQVIEEADEEEERQFE
					

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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	30.4	Very low	32.3	Very low	235 Å²	235	163.4 Å²	163.4	100%	1.158	79%	0.79	S	S	*	*				0	136.5	0	-74.1	172.8	170	0	0	107.2
2	R	29.1	Very low	32.1	Very low	220 Å²	220	167.6 Å²	167.6	83%	0.83	79%	0.791	S	S	*	*				52.3	128.9	74.7	-78.5	-169.8	-174.4	-178.5	4.6	111.8
3	R	29.6	Very low	32	Very low	211 Å²	211	162.2 Å²	162.2	80%	0.796	78%	0.783	S	S	*	*			cis	-159.4	177.5	-2.4	-148.5	179.1	-170	164.7	2.9	110
4	D	34.5	Very low	31.8	Very low	135 Å²	135	160.9 Å²	160.9	72%	0.722	78%	0.781	S	S	*	*			trans	-65.3	174.9	176.7	-43	-99.6	0	0	0	115.2
5	E	33.4	Very low	31.7	Very low	144 Å²	144	159.6 Å²	159.6	67%	0.673	77%	0.773	S	S	*	*			trans	112.6	113.3	146.4	-57.5	-154.9	163.1	0	0	121.8
6	R	31.6	Very low	31.4	Very low	181 Å²	181	159.1 Å²	159.1	68%	0.683	77%	0.769	S	S	*	*				79.9	126.9	120.4	-74.9	-163.3	-91.1	-153.3	-4.5	124.9
7	D	33.7	Very low	32.2	Very low	137 Å²	137	156 Å²	156	73%	0.733	76%	0.764	S	S	*	*				93.3	107.3	124	-66.4	-0.9	0	0	0	124.9
8	A	35.2	Very low	31.9	Very low	86 Å²	86	155.6 Å²	155.6	71%	0.711	77%	0.766	S	S	*	*				80.5	127.2	114.2	0	0	0	0	0	123.7
9	K	31.2	Very low	31.7	Very low	202 Å²	202	150.7 Å²	150.7	88%	0.878	76%	0.76	S	S	*	*				177.7	126.4	119.8	-96.2	157.7	-175.5	169.9	0	110.9
10	A	36.8	Very low	31.5	Very low	88 Å²	88	148.7 Å²	148.7	73%	0.727	77%	0.767	S	S	*	*				87.5	153.9	77.3	0	0	0	0	0	113.8
11	M	30.5	Very low	31.3	Very low	158 Å²	158	145.6 Å²	145.6	78%	0.778	77%	0.772	S	S	*	*			cis	-109	-134.7	-5.2	-57	177.5	-176.4	0	0	109.7
12	R	29.9	Very low	31.1	Very low	214 Å²	214	139.8 Å²	139.8	81%	0.808	76%	0.755	S	S	*	*			cis	-169.3	158.1	-9.5	-125.3	170.5	-163.3	-173.5	2.8	103.9
13	S	30.1	Very low	32	Very low	97 Å²	97	135 Å²	135	68%	0.678	75%	0.752	S	S	*	*			cis	-175.4	172.6	-15.8	42.8	0	0	0	0	106.4
14	L	29.2	Very low	32	Very low	144 Å²	144	131 Å²	131	75%	0.754	75%	0.754	S	S	*	*			cis	-155.9	-171	14.8	-155.8	67.6	0	0	0	110.8
15	Q	30.2	Very low	31.7	Very low	142 Å²	142	133.7 Å²	133.7	66%	0.664	76%	0.762	S	S	*	*			trans	-49.6	169.2	172.1	-68	165.2	-88.7	0	0	118.9
16	Q	27.8	Very low	31.4	Very low	152 Å²	152	132.2 Å²	132.2	71%	0.71	77%	0.768	S	S	*	*			cis	-172.5	172	-16.8	-109.3	178.3	-65.3	0	0	107.7
17	P	44.1	Very low	31.2	Very low	106 Å²	106	130.4 Å²	130.4	69%	0.688	77%	0.771	S	S	*	*			cis	-115.8	-159.4	-12.1	43.4	-29.8	0	0	0	110.1
18	D	27.3	Very low	30.8	Very low	148 Å²	148	133.9 Å²	133.9	79%	0.791	77%	0.773	S	S	*	*			cis	-139.6	-147.4	-4.5	-137.7	-32.7	0	0	0	108.7
19	G	27.9	Very low	30.3	Very low	63 Å²	63	137.1 Å²	137.1	65%	0.649	78%	0.779	S	S	*	*			cis	100.2	138.7	7.6	0	0	0	0	0	113.5
20	A	28.3	Very low	30.1	Very low	110 Å²	110	131.2 Å²	131.2	91%	0.909	78%	0.775	S	S	*	*			cis	-162.8	148.7	-12.4	0	0	0	0	0	109.2
21	G	26.1	Very low	29.5	Very low	85 Å²	85	138.6 Å²	138.6	88%	0.876	79%	0.786	S	S	*	*			trans	162.8	107.7	176	0	0	0	0	0	115.4
22	S	26.6	Very low	29.3	Very low	113 Å²	113	137.9 Å²	137.9	79%	0.79	79%	0.79	S	S	*	*			trans	-107.9	170.3	173.2	55.4	0	0	0	0	110.7
23	P	47.5	Very low	29.1	Very low	120 Å²	120	136.7 Å²	136.7	78%	0.779	79%	0.791	S	S	*	*			trans	-91.8	167.4	-160.5	37.3	-37	0	0	0	114.5
24	P	30.9	Very low	28.8	Very low	127 Å²	127	137.6 Å²	137.6	83%	0.825	80%	0.797	S	S	*	*			trans	-119.1	166.3	151.5	38.1	-28.2	0	0	0	113
25	E	27.8	Very low	28.7	Very low	190 Å²	190	136.2 Å²	136.2	89%	0.888	80%	0.798	S	S	*	*			trans	-101.6	163.1	-176.3	-56.9	173.6	109.7	0	0	113.7
26	S	27.6	Very low	28.5	Very low	114 Å²	114	136.1 Å²	136.1	80%	0.797	81%	0.807	S	S	*	*			trans	84.1	158.7	143.4	-150.4	0	0	0	0	121.5
27	L	25.9	Very low	28.5	Very low	143 Å²	143	133.9 Å²	133.9	75%	0.749	81%	0.808	S	S	*	*			trans	74	99.9	163.9	-74.9	160.8	0	0	0	122.3
28	R	26.2	Very low	27.7	Very low	210 Å²	210	134.7 Å²	134.7	79%	0.792	81%	0.813	S	S	*	*				69.9	121.4	130	-88.5	-177.3	167.8	179.5	-3.5	122.5
29	N	25.2	Very low	27.9	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	82%	0.819	S	S	*	*			trans	57.8	114.7	132.8	-60.4	13.6	0	0	0	120.6
30	G	25.9	Very low	27.8	Very low	78 Å²	78	144.2 Å²	144.2	80%	0.804	83%	0.831	S	S	*	*			trans	-165.6	114.8	160.2	0	0	0	0	0	113
31	Y	24.8	Very low	27.8	Very low	243 Å²	243	147.8 Å²	147.8	95%	0.953	83%	0.829	S	S	*	*			trans	-72.8	131.8	174.9	-98.4	-109.4	0	0	0	111.5
32	V	25.1	Very low	28.1	Very low	142 Å²	142	149 Å²	149	86%	0.861	82%	0.815	S	S	*	*			trans	-137.6	135.9	154.3	-175.6	0	0	0	0	110.1
33	K	25.7	Very low	28.4	Very low	190 Å²	190	148 Å²	148	83%	0.826	81%	0.806	S	S	*	*			trans	-61.9	138.8	-174.4	-60.1	164.7	178.2	176.6	0	112.8
34	S	25.3	Very low	27.9	Very low	116 Å²	116	148.7 Å²	148.7	81%	0.811	81%	0.81	S	S	*	*			trans	-81.3	137.4	153.4	52	0	0	0	0	109.7
35	C	25.6	Very low	28.5	Very low	115 Å²	115	150.4 Å²	150.4	78%	0.777	80%	0.8	S	S	*	*			trans	-107.8	124.9	170	-65.1	0	0	0	0	108.4
36	V	27.7	Very low	29.2	Very low	139 Å²	139	143.9 Å²	143.9	84%	0.842	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.3	126	179.1	178.4	0	0	0	0	109.5
37	S	26.8	Very low	29.7	Very low	106 Å²	106	146.1 Å²	146.1	74%	0.741	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-77	131.1	170.3	-62.1	0	0	0	0	109.6
38	P	28	Very low	30.3	Very low	122 Å²	122	146.4 Å²	146.4	79%	0.792	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-69.6	142.5	-175.8	27.5	-34.5	0	0	0	112.2
39	L	31	Very low	31.2	Very low	173 Å²	173	141.4 Å²	141.4	91%	0.906	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-64.6	136.7	170.1	-84.9	162.5	0	0	0	110.4
40	R	25.1	Very low	32	Very low	238 Å²	238	139.9 Å²	139.9	90%	0.898	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-81	120	-176.8	-165.4	-176.7	-164.7	-176.7	5.1	110
41	Q	28.4	Very low	32.6	Very low	186 Å²	186	140.1 Å²	140.1	87%	0.869	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-66	135.2	168.4	-72.4	178	-26.5	0	0	110.3
42	D	33.4	Very low	33.3	Very low	110 Å²	110	130.5 Å²	130.5	59%	0.588	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-81.5	138.2	172.5	-128.7	36	0	0	0	109.2	R45	D42-R45 IonicContact OD2-CZ 3.28Å; D42-R45 IonicContact OD2-NE 3.34Å; D42-R45 PolarHBondContact OD2-NE 3.17Å; D42-R45 IonicContact OD2-NH2 2.67Å; D42-R45 PolarHBondContact OD2-NH2 3.34Å
43	P	33	Very low	34	Very low	93 Å²	93	133.1 Å²	133.1	60%	0.604	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-72.9	156.4	-179.4	30.6	-35.3	0	0	0	112.1	R45	P43-R45 PolarHBondContact O-N 3.41Å
44	P	36.5	Very low	34.6	Very low	134 Å²	134	133.3 Å²	133.3	87%	0.87	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-60.4	124.9	-179.2	24.9	-34.4	0	0	0	111.5
45	R	43.2	Very low	35.1	Very low	162 Å²	162	130 Å²	130	61%	0.611	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-86.1	130	-179	-59.9	-175.5	-176.2	-168.5	3.2	110	D42 P43	D42-R45 IonicContact OD2-CZ 3.28Å; D42-R45 IonicContact OD2-NE 3.34Å; D42-R45 PolarHBondContact OD2-NE 3.17Å; D42-R45 IonicContact OD2-NH2 2.67Å; D42-R45 PolarHBondContact OD2-NH2 3.34Å; P43-R45 PolarHBondContact O-N 3.41Å
46	G	43.2	Very low	35.4	Very low	53 Å²	53	131.7 Å²	131.7	55%	0.546	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-77	163.8	-168.8	0	0	0	0	0	116	F48 F49	G46-F48 VanDerWaalsContact C-N 3.26Å; G46-F48 PolarHBondContact O-N 3.39Å; G46-F49 PolarHBondContact O-N 2.87Å
47	F	38.4	Very low	35.9	Very low	162 Å²	162	127.8 Å²	127.8	71%	0.711	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-35.8	-43.7	-178.2	-177	-103.3	0	0	0	116.2	F49 H50 L51	F47-F49 PolarHBondContact O-N 2.79Å; F47-F49 VanDerWaalsContact O-N 3.15Å; F47-H50 PolarHBondContact O-N 3.31Å; F47-L51 PolarHBondContact O-N 3.31Å
48	F	37.5	Very low	36.1	Very low	149 Å²	149	132.3 Å²	132.3	65%	0.654	66%	0.657	S	S	*	*	H	α-helix	trans	-55.1	-32.5	179.1	-89.1	-88.1	0	0	0	114.1	G46 H50 L51 C52	G46-F48 VanDerWaalsContact C-N 3.26Å; G46-F48 PolarHBondContact O-N 3.39Å; F48-H50 VanDerWaalsContact C-N 3.34Å; F48-H50 PolarHBondContact O-N 2.91Å; F48-L51 PolarHBondContact O-N 3.46Å; F48-C52 PolarHBondContact O-N 2.89Å; F48-C52 VanDerWaalsContact O-N 3.09Å; F48-C52 PolarHBondContact O-SG 2.91Å
49	F	44.8	Very low	36.3	Very low	104 Å²	104	129.9 Å²	129.9	46%	0.456	64%	0.637	S	S	.	*	H	α-helix	trans	-68.3	-34	179.2	-167.7	-100.7	0	0	0	112.2	G46 F47 R53	G46-F49 PolarHBondContact O-N 2.87Å; F47-F49 PolarHBondContact O-N 2.79Å; F47-F49 VanDerWaalsContact O-N 3.15Å; F49-R53 PolarHBondContact O-N 3.31Å
50	H	42.8	Very low	36.3	Very low	122 Å²	122	132.7 Å²	132.7	57%	0.565	64%	0.635	S	S	*	*	H	α-helix	trans	-72.9	-38	174.3	-73.9	-101.9	0	0	0	111.7	F47 F48 C52 R53 F54	F47-H50 PolarHBondContact O-N 3.31Å; F48-H50 VanDerWaalsContact C-N 3.34Å; F48-H50 PolarHBondContact O-N 2.91Å; H50-C52 PolarHBondContact O-N 3Å; H50-R53 WeakPolarHBondContact O-CB 3.36Å; H50-R53 PolarHBondContact O-N 3.17Å; H50-F54 PolarHBondContact O-N 2.84Å
51	L	38.7	Very low	36.7	Very low	83 Å²	83	126.4 Å²	126.4	44%	0.435	63%	0.625	S	S	.	*	H	α-helix	trans	-63.1	-41.4	177.3	-158.1	73.1	0	0	0	111.8	F47 F48 R53 F54	F47-L51 PolarHBondContact O-N 3.31Å; F48-L51 PolarHBondContact O-N 3.46Å; L51-R53 VanDerWaalsContact C-N 3.35Å; L51-R53 PolarHBondContact O-N 3.28Å; L51-F54 WeakPolarHBondContact O-CB 3.37Å; L51-F54 PolarHBondContact O-N 3.44Å
52	C	38.5	Very low	36.9	Very low	42 Å²	42	123.1 Å²	123.1	28%	0.284	62%	0.62	S	S	.	*	H	α-helix	trans	-66.1	-33.8	174.6	-66.9	0	0	0	0	113.2	F48 H50 F54 C55 L59	F48-C52 PolarHBondContact O-N 2.89Å; F48-C52 VanDerWaalsContact O-N 3.09Å; F48-C52 PolarHBondContact O-SG 2.91Å; H50-C52 PolarHBondContact O-N 3Å; C52-F54 VanDerWaalsContact C-N 3.29Å; C52-F54 PolarHBondContact O-N 3.03Å; C52-C55 PolarHBondContact O-N 3.49Å; C52-L59 HydrophobicContact CB-CD1 4.08Å
53	R	39.9	Very low	36.8	Very low	196 Å²	196	123.7 Å²	123.7	74%	0.74	63%	0.63	S	S	*	*	H	α-helix	trans	-63.7	-35.2	174.8	-171.5	174.8	179.1	176.3	-1.4	111.7	F49 H50 L51 C55 N56	F49-R53 PolarHBondContact O-N 3.31Å; H50-R53 WeakPolarHBondContact O-CB 3.36Å; H50-R53 PolarHBondContact O-N 3.17Å; L51-R53 VanDerWaalsContact C-N 3.35Å; L51-R53 PolarHBondContact O-N 3.28Å; R53-C55 PolarHBondContact O-N 2.88Å; R53-N56 PolarHBondContact O-N 3.37Å
54	F	37.8	Very low	36.7	Very low	194 Å²	194	124.5 Å²	124.5	85%	0.851	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-12.4	175.8	-128.5	-82.2	0	0	0	114.2	H50 L51 C52	H50-F54 PolarHBondContact O-N 2.84Å; L51-F54 WeakPolarHBondContact O-CB 3.37Å; L51-F54 PolarHBondContact O-N 3.44Å; C52-F54 VanDerWaalsContact C-N 3.29Å; C52-F54 PolarHBondContact O-N 3.03Å
55	C	37.5	Very low	36.4	Very low	46 Å²	46	123.4 Å²	123.4	31%	0.311	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.5	6.8	-178.8	-58.5	0	0	0	0	114.3	C52 R53 V57	C52-C55 PolarHBondContact O-N 3.49Å; R53-C55 PolarHBondContact O-N 2.88Å; C55-V57 HydrophobicContact CB-CG2 4.26Å
56	N	32.1	Very low	36.2	Very low	152 Å²	152	124 Å²	124	81%	0.813	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.8	59.7	-170.3	-80.6	-9.7	0	0	0	112.7	R53	R53-N56 PolarHBondContact O-N 3.37Å
57	V	36.6	Very low	35.7	Very low	57 Å²	57	130.5 Å²	130.5	35%	0.345	67%	0.67	S	S	.	*			trans	-124	103.4	172	-174.8	0	0	0	0	109.8	C55 L59	C55-V57 HydrophobicContact CB-CG2 4.26Å; V57-L59 HydrophobicContact CG1-CG 4.23Å; V57-L59 PolarHBondContact O-N 2.99Å; V57-L59 VanDerWaalsContact O-N 3.11Å
58	E	30.7	Very low	35.3	Very low	201 Å²	201	131.6 Å²	131.6	94%	0.939	68%	0.677	S	S	*	*			trans	-72.6	99.4	173.6	-73.9	-150.2	125.7	0	0	111.6	R60	E58-R60 PolarHBondContact O-N 3.45Å
59	L	33.7	Very low	35.1	Very low	71 Å²	71	130.7 Å²	130.7	37%	0.372	69%	0.687	S	S	.	*			trans	-88.9	89.2	174.1	-81.9	159.6	0	0	0	111.3	C52 V57 F267	C52-L59 HydrophobicContact CB-CD1 4.08Å; V57-L59 HydrophobicContact CG1-CG 4.23Å; V57-L59 PolarHBondContact O-N 2.99Å; V57-L59 VanDerWaalsContact O-N 3.11Å; L59-F267 HydrophobicContact CD2-CD1 3.97Å; L59-F267 HydrophobicContact CD2-CE1 3.5Å; L59-F267 VanDerWaalsContact CD2-CE1 3.5Å; L59-F267 HydrophobicContact CD2-CE2 4.21Å; L59-F267 HydrophobicContact CD2-CZ 3.63Å
60	R	30.3	Very low	34.4	Very low	232 Å²	232	137.4 Å²	137.4	88%	0.875	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-87.2	127.5	170.4	-152	173.9	-163.6	169.1	6.7	110.2	E58	E58-R60 PolarHBondContact O-N 3.45Å
61	P	33.4	Very low	34.2	Very low	106 Å²	106	143.9 Å²	143.9	69%	0.688	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-68.3	150.9	176.6	28.8	-34.7	0	0	0	111.2
62	P	33.1	Very low	34.5	Very low	116 Å²	116	143.9 Å²	143.9	75%	0.753	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-67	149.5	179.7	28.6	-35.3	0	0	0	111.8
63	P	30.8	Very low	34.4	Very low	123 Å²	123	145.4 Å²	145.4	80%	0.799	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-66.6	136.5	178.9	28.2	-34.7	0	0	0	111.3	S65	P63-S65 PolarHBondContact O-N 2.94Å
64	A	31.8	Very low	34.4	Very low	110 Å²	110	140.8 Å²	140.8	91%	0.909	76%	0.755	S	S	*	*			trans	-76.5	103.2	178.8	0	0	0	0	0	111.4
65	S	29.8	Very low	34.6	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	74%	0.744	S	S	*	*			trans	-100.5	129.1	167	54	0	0	0	0	110.8	P63 Q67	P63-S65 PolarHBondContact O-N 2.94Å; S65-Q67 PolarHBondContact O-N 3.23Å
66	L	38	Very low	34.5	Very low	174 Å²	174	140.3 Å²	140.3	91%	0.911	76%	0.757	S	S	*	*			trans	-77.8	105.6	169.9	-89.4	104.2	0	0	0	109.9
67	Q	32.8	Very low	35	Very low	190 Å²	190	142.8 Å²	142.8	89%	0.888	76%	0.755	S	S	*	*			trans	-150.7	154.9	158.4	-110.7	166.2	34.8	0	0	111.4	S65	S65-Q67 PolarHBondContact O-N 3.23Å
68	Q	31.5	Very low	35.3	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.864	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-76.8	151.1	-165.1	-71.1	175.5	-22.1	0	0	113.7	R70	Q68-R70 PolarHBondContact O-N 3.24Å
69	P	31.8	Very low	36.1	Very low	131 Å²	131	142.2 Å²	142.2	85%	0.851	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-75.6	120.7	-173.7	29.8	-35.1	0	0	0	112.9
70	R	30.1	Very low	36.6	Very low	244 Å²	244	145 Å²	145	92%	0.921	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-80.7	141.6	159.3	-80	-174.8	168.8	-179.1	-3	110.3	Q68	Q68-R70 PolarHBondContact O-N 3.24Å
71	R	39	Very low	37.4	Very low	258 Å²	258	137.4 Å²	137.4	97%	0.974	75%	0.748	S	S	*	*	S	Bend	trans	-63.8	141.1	-178.4	-75.7	176.3	167	170.5	-5.3	111.7
72	G	44.6	Very low	38.2	Very low	83 Å²	83	138.4 Å²	138.4	86%	0.856	75%	0.747	S	S	*	*			trans	110.2	76.9	162.2	0	0	0	0	0	115.2
73	S	37.8	Very low	38.9	Very low	75 Å²	75	134.9 Å²	134.9	52%	0.524	73%	0.731	S	S	.	*			trans	-131.1	152.7	165.7	80.2	0	0	0	0	110.8	F75	S73-F75 PolarHBondContact O-N 3.1Å; S73-F75 VanDerWaalsContact O-N 3.15Å
74	P	39.8	Very low	39.9	Very low	99 Å²	99	131.9 Å²	131.9	64%	0.643	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-17.3	-174.1	24.6	-34	0	0	0	114.1	C76 R77 A78	P74-C76 PolarHBondContact O-N 3.26Å; P74-C76 VanDerWaalsContact O-N 3.15Å; P74-R77 PolarHBondContact O-N 3.34Å; P74-A78 PolarHBondContact O-N 3.45Å
75	F	40.8	Very low	40.7	Very low	142 Å²	142	131.8 Å²	131.8	62%	0.623	70%	0.701	S	S	*	*	H	α-helix	trans	-58.3	-29.1	-176.6	-116.3	-90.5	0	0	0	114.5	S73 R79	S73-F75 PolarHBondContact O-N 3.1Å; S73-F75 VanDerWaalsContact O-N 3.15Å; F75-R79 PolarHBondContact O-N 3.25Å
76	C	36.8	Very low	41.7	Very low	87 Å²	87	129.4 Å²	129.4	59%	0.588	69%	0.687	S	S	*	*	H	α-helix	trans	-70.4	-32.5	175.3	-72	0	0	0	0	112.7	P74 L80	P74-C76 PolarHBondContact O-N 3.26Å; P74-C76 VanDerWaalsContact O-N 3.15Å; C76-L80 WeakPolarHBondContact O-CG 3.42Å; C76-L80 PolarHBondContact O-N 3.1Å; C76-L80 VanDerWaalsContact O-N 3.11Å
77	R	41.1	Very low	42.4	Very low	204 Å²	204	123.8 Å²	123.8	77%	0.77	67%	0.666	S	S	*	*	H	α-helix	trans	-69.7	-41.8	179.9	-61.1	-172.5	-172	179.1	3.7	111.2	P74 R79 L80 S81	P74-R77 PolarHBondContact O-N 3.34Å; R77-R79 PolarHBondContact O-N 3.32Å; R77-L80 PolarHBondContact O-N 3.11Å; R77-S81 PolarHBondContact O-N 2.95Å; R77-S81 PolarHBondContact O-OG 3.46Å
78	A	44.9	Very low	43.4	Very low	58 Å²	58	121.2 Å²	121.2	48%	0.479	65%	0.652	S	S	.	*	H	α-helix	trans	-63.3	-38.2	177.5	0	0	0	0	0	113.1	P74 S81 L82	P74-A78 PolarHBondContact O-N 3.45Å; A78-S81 WeakPolarHBondContact CA-OG 3.49Å; A78-S81 PolarHBondContact O-OG 2.99Å; A78-L82 WeakPolarHBondContact O-CB 3.45Å; A78-L82 PolarHBondContact O-N 3.15Å
79	R	45.6	Very low	44.5	Very low	189 Å²	189	115.8 Å²	115.8	71%	0.713	63%	0.632	S	S	*	*	H	α-helix	trans	-70.2	-37.2	174.9	-70.3	-175.4	178.8	179.8	0.3	112.3	F75 R77 G83	F75-R79 PolarHBondContact O-N 3.25Å; R77-R79 PolarHBondContact O-N 3.32Å; R79-G83 PolarHBondContact O-N 3.06Å
80	L	45.4	Very low	45.4	Very low	129 Å²	129	114.7 Å²	114.7	68%	0.675	62%	0.618	S	S	*	*	H	α-helix	trans	-68.2	-40.2	174.5	-76.2	166.6	0	0	0	112.4	C76 R77 G83 A84	C76-L80 WeakPolarHBondContact O-CG 3.42Å; C76-L80 PolarHBondContact O-N 3.1Å; C76-L80 VanDerWaalsContact O-N 3.11Å; R77-L80 PolarHBondContact O-N 3.11Å; L80-G83 PolarHBondContact O-N 2.88Å; L80-A84 VanDerWaalsContact O-CB 3.26Å; L80-A84 WeakPolarHBondContact O-CB 3.29Å; L80-A84 PolarHBondContact O-N 3.34Å
81	S	47.6	Very low	46.4	Very low	72 Å²	72	106 Å²	106	50%	0.503	60%	0.598	S	S	.	*	H	α-helix	trans	-68.2	-38.5	176.4	59	0	0	0	0	112.4	R77 A78 A84 L85	R77-S81 PolarHBondContact O-N 2.95Å; R77-S81 PolarHBondContact O-OG 3.46Å; A78-S81 WeakPolarHBondContact CA-OG 3.49Å; A78-S81 PolarHBondContact O-OG 2.99Å; S81-A84 PolarHBondContact O-N 2.85Å; S81-L85 WeakPolarHBondContact O-CB 3.49Å; S81-L85 PolarHBondContact O-N 2.83Å
82	L	49.2	Very low	46.9	Very low	128 Å²	128	99.2 Å²	99.2	67%	0.67	58%	0.581	S	S	*	*	H	α-helix	trans	-68.4	-39.6	175.9	-163.8	70.6	0	0	0	111.7	A78 L85 A86	A78-L82 WeakPolarHBondContact O-CB 3.45Å; A78-L82 PolarHBondContact O-N 3.15Å; L82-L85 PolarHBondContact O-N 3.45Å; L82-A86 WeakPolarHBondContact O-CB 3.36Å; L82-A86 PolarHBondContact O-N 3.33Å
83	G	48.7	Very low	47.1	Very low	41 Å²	41	100.1 Å²	100.1	42%	0.423	57%	0.566	S	S	.	*	H	α-helix	trans	-64.7	-40.9	172.6	0	0	0	0	0	113.1	R79 L80 A86 A87	R79-G83 PolarHBondContact O-N 3.06Å; L80-G83 PolarHBondContact O-N 2.88Å; G83-A86 PolarHBondContact O-N 2.91Å; G83-A87 WeakPolarHBondContact O-CB 3.32Å; G83-A87 PolarHBondContact O-N 3.41Å
84	A	51.8	Low	47.7	Very low	60 Å²	60	103.2 Å²	103.2	50%	0.496	58%	0.575	S	S	.	*	H	α-helix	trans	-65.9	-39	175.2	0	0	0	0	0	112.3	L80 S81 A87 F88	L80-A84 VanDerWaalsContact O-CB 3.26Å; L80-A84 WeakPolarHBondContact O-CB 3.29Å; L80-A84 PolarHBondContact O-N 3.34Å; S81-A84 PolarHBondContact O-N 2.85Å; A84-A87 PolarHBondContact O-N 2.86Å; A84-F88 VanDerWaalsContact O-CB 3.3Å; A84-F88 WeakPolarHBondContact O-CB 3.41Å; A84-F88 PolarHBondContact O-N 3.04Å
85	L	47.3	Very low	47.9	Very low	109 Å²	109	101.7 Å²	101.7	57%	0.571	58%	0.577	S	S	*	*	H	α-helix	trans	-68.3	-41.7	176.4	-167	152.8	0	0	0	111.2	S81 L82 F88 V89	S81-L85 WeakPolarHBondContact O-CB 3.49Å; S81-L85 PolarHBondContact O-N 2.83Å; L82-L85 PolarHBondContact O-N 3.45Å; L85-F88 PolarHBondContact O-N 3.34Å; L85-V89 HydrophobicContact CD2-CG2 4.27Å; L85-V89 WeakPolarHBondContact O-CG2 3.16Å; L85-V89 PolarHBondContact O-N 2.75Å
86	A	52	Low	48.1	Very low	59 Å²	59	98.6 Å²	98.6	49%	0.488	58%	0.578	S	S	.	*	H	α-helix	trans	-60.9	-43.3	172	0	0	0	0	0	112	L82 G83 V89 L90	L82-A86 WeakPolarHBondContact O-CB 3.36Å; L82-A86 PolarHBondContact O-N 3.33Å; G83-A86 PolarHBondContact O-N 2.91Å; A86-V89 PolarHBondContact O-N 3.29Å; A86-L90 WeakPolarHBondContact O-CB 3.21Å; A86-L90 PolarHBondContact O-N 3.33Å
87	A	53.1	Low	48.5	Very low	57 Å²	57	102.8 Å²	102.8	47%	0.471	59%	0.589	S	S	.	*	H	α-helix	trans	-66.1	-36	175.9	0	0	0	0	0	112.9	G83 A84 L90 A91	G83-A87 WeakPolarHBondContact O-CB 3.32Å; G83-A87 PolarHBondContact O-N 3.41Å; A84-A87 PolarHBondContact O-N 2.86Å; A87-L90 PolarHBondContact O-N 2.84Å; A87-A91 WeakPolarHBondContact O-CB 3.43Å; A87-A91 PolarHBondContact O-N 3.32Å
88	F	53.1	Low	48.9	Very low	135 Å²	135	98.2 Å²	98.2	59%	0.592	59%	0.586	S	S	*	*	H	α-helix	trans	-67	-42.4	175.7	-175.3	-104.5	0	0	0	111.9	A84 L85 A91 L92	A84-F88 VanDerWaalsContact O-CB 3.3Å; A84-F88 WeakPolarHBondContact O-CB 3.41Å; A84-F88 PolarHBondContact O-N 3.04Å; L85-F88 PolarHBondContact O-N 3.34Å; F88-A91 PolarHBondContact O-N 3.33Å; F88-L92 HydrophobicContact CD1-CD1 3.9Å; F88-L92 HydrophobicContact CE1-CD1 3.59Å; F88-L92 HydrophobicContact CE1-CG 4.45Å; F88-L92 HydrophobicContact CZ-CD1 4.14Å; F88-L92 WeakPolarHBondContact O-CG 3.27Å; F88-L92 PolarHBondContact O-N 3.3Å
89	V	53.8	Low	49.1	Very low	72 Å²	72	104.1 Å²	104.1	44%	0.436	60%	0.603	S	S	.	*	H	α-helix	trans	-63.5	-41	171.9	172.1	0	0	0	0	111.1	L85 A86 L92 L93	L85-V89 HydrophobicContact CD2-CG2 4.27Å; L85-V89 WeakPolarHBondContact O-CG2 3.16Å; L85-V89 PolarHBondContact O-N 2.75Å; A86-V89 PolarHBondContact O-N 3.29Å; V89-L92 PolarHBondContact O-N 3.46Å; V89-L93 HydrophobicContact CG1-CD1 4.07Å; V89-L93 WeakPolarHBondContact O-CG 3.4Å; V89-L93 PolarHBondContact O-N 3.21Å
90	L	50.6	Low	49.5	Very low	107 Å²	107	99 Å²	99	56%	0.56	60%	0.596	S	S	*	*	H	α-helix	trans	-65.4	-38.8	176.5	-145.2	77	0	0	0	112.2	A86 A87 L93 L94	A86-L90 WeakPolarHBondContact O-CB 3.21Å; A86-L90 PolarHBondContact O-N 3.33Å; A87-L90 PolarHBondContact O-N 2.84Å; L90-L93 PolarHBondContact O-N 3.09Å; L90-L94 HydrophobicContact CD2-CD1 4.41Å; L90-L94 HydrophobicContact CG-CD1 4.18Å; L90-L94 WeakPolarHBondContact O-CB 3.37Å; L90-L94 VanDerWaalsContact O-CG 3.29Å; L90-L94 WeakPolarHBondContact O-CG 3.33Å; L90-L94 PolarHBondContact O-N 2.88Å
91	A	50.5	Low	49.7	Very low	61 Å²	61	102.5 Å²	102.5	50%	0.504	60%	0.601	S	S	.	*	H	α-helix	trans	-66.5	-39.8	175.8	0	0	0	0	0	112.3	A87 F88 L93 L94 G95	A87-A91 WeakPolarHBondContact O-CB 3.43Å; A87-A91 PolarHBondContact O-N 3.32Å; F88-A91 PolarHBondContact O-N 3.33Å; A91-L93 VanDerWaalsContact C-N 3.31Å; A91-L93 PolarHBondContact O-N 2.95Å; A91-L94 PolarHBondContact O-N 3.41Å; A91-G95 PolarHBondContact O-N 3.39Å
92	L	50.4	Low	49.8	Very low	116 Å²	116	102.7 Å²	102.7	61%	0.607	61%	0.607	S	S	*	*	H	α-helix	trans	-64	-34.2	173.2	-75.3	169.3	0	0	0	112.6	F88 V89	F88-L92 HydrophobicContact CD1-CD1 3.9Å; F88-L92 HydrophobicContact CE1-CD1 3.59Å; F88-L92 HydrophobicContact CE1-CG 4.45Å; F88-L92 HydrophobicContact CZ-CD1 4.14Å; F88-L92 WeakPolarHBondContact O-CG 3.27Å; F88-L92 PolarHBondContact O-N 3.3Å; V89-L92 PolarHBondContact O-N 3.46Å
93	L	49	Very low	49.9	Very low	103 Å²	103	99.2 Å²	99.2	54%	0.539	60%	0.597	S	S	.	*	H	α-helix	trans	-76.9	-24	176.4	-71.3	168.4	0	0	0	113.7	V89 L90 A91 L108	V89-L93 HydrophobicContact CG1-CD1 4.07Å; V89-L93 WeakPolarHBondContact O-CG 3.4Å; V89-L93 PolarHBondContact O-N 3.21Å; L90-L93 PolarHBondContact O-N 3.09Å; A91-L93 VanDerWaalsContact C-N 3.31Å; A91-L93 PolarHBondContact O-N 2.95Å; L93-L108 HydrophobicContact CD2-CD1 4.24Å
94	L	49.8	Very low	50.1	Low	140 Å²	140	99.2 Å²	99.2	73%	0.733	60%	0.597	S	S	*	*	H	α-helix	trans	-99.3	-6.4	-179.2	-68.7	169.5	0	0	0	113.8	L90 A91	L90-L94 HydrophobicContact CD2-CD1 4.41Å; L90-L94 HydrophobicContact CG-CD1 4.18Å; L90-L94 WeakPolarHBondContact O-CB 3.37Å; L90-L94 VanDerWaalsContact O-CG 3.29Å; L90-L94 WeakPolarHBondContact O-CG 3.33Å; L90-L94 PolarHBondContact O-N 2.88Å; A91-L94 PolarHBondContact O-N 3.41Å
95	G	45.4	Very low	50.3	Low	66 Å²	66	98.7 Å²	98.7	68%	0.68	59%	0.592	S	S	*	*	S	Bend	trans	-94.3	6.4	-176.6	0	0	0	0	0	116.1	A91	A91-G95 PolarHBondContact O-N 3.39Å
96	A	43.1	Very low	50.5	Low	77 Å²	77	96 Å²	96	64%	0.636	59%	0.585	S	S	*	*	S	Bend	trans	-94.1	127.9	-179.8	0	0	0	0	0	111.7
97	E	46.4	Very low	50.8	Low	176 Å²	176	101.3 Å²	101.3	82%	0.822	59%	0.593	S	S	*	*			trans	-66.8	153	178.4	-74.5	-165.1	135.3	0	0	112.9	E99	E97-E99 VanDerWaalsContact C-N 3.26Å; E97-E99 PolarHBondContact O-N 3.36Å
98	P	49.4	Very low	50.7	Low	108 Å²	108	102 Å²	102	70%	0.701	59%	0.588	S	S	*	*	S	Bend	trans	-83.4	40.9	-163.2	35.4	-38.7	0	0	0	115.4
99	E	48.4	Very low	51	Low	181 Å²	181	104.7 Å²	104.7	85%	0.846	60%	0.595	S	S	*	*	S	Bend	trans	-115.7	136	166.2	-67	-152.5	147.2	0	0	111.8	E97	E97-E99 VanDerWaalsContact C-N 3.26Å; E97-E99 PolarHBondContact O-N 3.36Å
100	S	54.4	Low	51.3	Low	81 Å²	81	105.6 Å²	105.6	57%	0.566	60%	0.6	S	S	*	*			trans	58.7	51.2	-176.3	-152.2	0	0	0	0	116.6	A102 A103 G104	S100-A102 PolarHBondContact O-N 3.36Å; S100-A103 PolarHBondContact O-N 3.37Å; S100-A103 VanDerWaalsContact OG-CB 3.27Å; S100-A103 WeakPolarHBondContact OG-CB 3.42Å; S100-A103 PolarHBondContact OG-N 3.03Å; S100-G104 PolarHBondContact O-N 3.48Å; S100-G104 VanDerWaalsContact O-N 3.15Å
101	W	49.7	Very low	51.6	Low	203 Å²	203	104 Å²	104	77%	0.769	59%	0.592	S	S	*	*	H	α-helix	trans	-52.4	-24.6	162.1	-82.8	40.3	0	0	0	113	A105	W101-A105 VanDerWaalsContact O-CB 3.25Å; W101-A105 WeakPolarHBondContact O-CB 3.36Å; W101-A105 PolarHBondContact O-N 3Å
102	A	49.2	Very low	52	Low	77 Å²	77	106.5 Å²	106.5	64%	0.636	60%	0.596	S	S	*	*	H	α-helix	trans	-65.2	-44.2	172.7	0	0	0	0	0	112.9	S100 A106	S100-A102 PolarHBondContact O-N 3.36Å; A102-A106 WeakPolarHBondContact O-CB 3.4Å; A102-A106 PolarHBondContact O-N 3.17Å
103	A	51.1	Low	52.5	Low	55 Å²	55	103.6 Å²	103.6	46%	0.455	59%	0.586	S	S	.	*	H	α-helix	trans	-68.4	-40.7	175.3	0	0	0	0	0	111.4	S100 A106 W107	S100-A103 PolarHBondContact O-N 3.37Å; S100-A103 VanDerWaalsContact OG-CB 3.27Å; S100-A103 WeakPolarHBondContact OG-CB 3.42Å; S100-A103 PolarHBondContact OG-N 3.03Å; A103-A106 PolarHBondContact O-N 2.89Å; A103-W107 WeakPolarHBondContact O-CB 3.48Å; A103-W107 PolarHBondContact O-N 3.44Å
104	G	53.1	Low	53.2	Low	41 Å²	41	100.7 Å²	100.7	42%	0.423	57%	0.572	S	S	.	*	H	α-helix	trans	-58.7	-48	173.6	0	0	0	0	0	112.6	S100 W107 L108	S100-G104 PolarHBondContact O-N 3.48Å; S100-G104 VanDerWaalsContact O-N 3.15Å; G104-W107 PolarHBondContact O-N 2.86Å; G104-L108 WeakPolarHBondContact O-CB 3.48Å; G104-L108 PolarHBondContact O-N 3.03Å
105	A	55.4	Low	53.6	Low	48 Å²	48	96.9 Å²	96.9	40%	0.397	56%	0.556	S	S	.	*	H	α-helix	trans	-67.8	-34.2	177.6	0	0	0	0	0	113.2	W101 R109	W101-A105 VanDerWaalsContact O-CB 3.25Å; W101-A105 WeakPolarHBondContact O-CB 3.36Å; W101-A105 PolarHBondContact O-N 3Å; A105-R109 WeakPolarHBondContact O-CB 3.34Å; A105-R109 VanDerWaalsContact O-CG 3.28Å; A105-R109 WeakPolarHBondContact O-CG 3.35Å; A105-R109 PolarHBondContact O-N 2.88Å
106	A	52.8	Low	54.6	Low	52 Å²	52	97 Å²	97	43%	0.43	55%	0.547	S	S	.	.	H	α-helix	trans	-64.7	-51	172.7	0	0	0	0	0	111	A102 A103 L108 R109 T110	A102-A106 WeakPolarHBondContact O-CB 3.4Å; A102-A106 PolarHBondContact O-N 3.17Å; A103-A106 PolarHBondContact O-N 2.89Å; A106-L108 VanDerWaalsContact C-N 3.33Å; A106-L108 PolarHBondContact O-N 3.46Å; A106-R109 PolarHBondContact O-N 3.43Å; A106-T110 PolarHBondContact O-N 3.07Å; A106-T110 PolarHBondContact O-OG1 2.88Å; A106-T110 VanDerWaalsContact O-OG1 3.1Å
107	W	57.8	Low	55.7	Low	171 Å²	171	99.4 Å²	99.4	65%	0.648	55%	0.545	S	S	*	.	H	α-helix	trans	-58.3	-43.8	176.4	-174.6	83.8	0	0	0	111.9	A103 G104 R109 T110 L111	A103-W107 WeakPolarHBondContact O-CB 3.48Å; A103-W107 PolarHBondContact O-N 3.44Å; G104-W107 PolarHBondContact O-N 2.86Å; W107-R109 PolarHBondContact O-N 3.01Å; W107-T110 PolarHBondContact O-N 2.98Å; W107-L111 HydrophobicContact CH2-CD1 4.39Å; W107-L111 HydrophobicContact CH2-CD2 3.99Å; W107-L111 HydrophobicContact CZ2-CD1 4.31Å; W107-L111 HydrophobicContact CZ3-CD2 3.96Å; W107-L111 VanDerWaalsContact O-CB 3.31Å; W107-L111 WeakPolarHBondContact O-CB 3.45Å; W107-L111 PolarHBondContact O-N 3.31Å
108	L	52	Low	56.9	Low	71 Å²	71	91.2 Å²	91.2	37%	0.372	51%	0.507	S	S	.	.	H	α-helix	trans	-64.4	-37.6	177.6	-155.3	81.4	0	0	0	112.4	L93 G104 A106 L112	L93-L108 HydrophobicContact CD2-CD1 4.24Å; G104-L108 WeakPolarHBondContact O-CB 3.48Å; G104-L108 PolarHBondContact O-N 3.03Å; A106-L108 VanDerWaalsContact C-N 3.33Å; A106-L108 PolarHBondContact O-N 3.46Å; L108-L112 HydrophobicContact CD2-CD1 4.47Å; L108-L112 HydrophobicContact CG-CD1 4.33Å; L108-L112 VanDerWaalsContact O-CB 3.29Å; L108-L112 WeakPolarHBondContact O-CB 3.42Å; L108-L112 WeakPolarHBondContact O-CD1 3.31Å; L108-L112 WeakPolarHBondContact O-CG 3.35Å; L108-L112 PolarHBondContact O-N 2.85Å
109	R	57.6	Low	58.2	Low	193 Å²	193	91.6 Å²	91.6	73%	0.728	50%	0.502	S	S	*	.	H	α-helix	trans	-67.1	-42.6	173.5	-77.7	175.6	-178.3	-179.5	2.1	112.1	A105 A106 W107 L111 L112 S113	A105-R109 WeakPolarHBondContact O-CB 3.34Å; A105-R109 VanDerWaalsContact O-CG 3.28Å; A105-R109 WeakPolarHBondContact O-CG 3.35Å; A105-R109 PolarHBondContact O-N 2.88Å; A106-R109 PolarHBondContact O-N 3.43Å; W107-R109 PolarHBondContact O-N 3.01Å; R109-L111 VanDerWaalsContact C-N 3.35Å; R109-L112 PolarHBondContact O-N 3.36Å; R109-S113 WeakPolarHBondContact O-CB 3.42Å; R109-S113 PolarHBondContact O-N 2.88Å
110	T	60.8	Low	59.7	Low	90 Å²	90	86.8 Å²	86.8	55%	0.552	49%	0.489	S	S	*	.	H	α-helix	trans	-63.6	-42.8	175.3	-53.8	0	0	0	0	110.8	A106 W107 S113 V114	A106-T110 PolarHBondContact O-N 3.07Å; A106-T110 PolarHBondContact O-OG1 2.88Å; A106-T110 VanDerWaalsContact O-OG1 3.1Å; W107-T110 PolarHBondContact O-N 2.98Å; T110-S113 PolarHBondContact O-N 3.39Å; T110-V114 WeakPolarHBondContact O-CB 3.26Å; T110-V114 WeakPolarHBondContact O-CG2 3.44Å; T110-V114 PolarHBondContact O-N 2.94Å
111	L	58.1	Low	60.9	Low	75 Å²	75	83.6 Å²	83.6	39%	0.393	47%	0.466	S	S	.	.	H	α-helix	trans	-60.9	-49.2	174.7	-166.7	79.6	0	0	0	111.4	W107 R109 S113 V114 C115	W107-L111 HydrophobicContact CH2-CD1 4.39Å; W107-L111 HydrophobicContact CH2-CD2 3.99Å; W107-L111 HydrophobicContact CZ2-CD1 4.31Å; W107-L111 HydrophobicContact CZ3-CD2 3.96Å; W107-L111 VanDerWaalsContact O-CB 3.31Å; W107-L111 WeakPolarHBondContact O-CB 3.45Å; W107-L111 PolarHBondContact O-N 3.31Å; R109-L111 VanDerWaalsContact C-N 3.35Å; L111-S113 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 2.99Å; L111-V114 PolarHBondContact O-N 3.46Å; L111-C115 VanDerWaalsContact O-CB 3.3Å; L111-C115 WeakPolarHBondContact O-CB 3.41Å; L111-C115 PolarHBondContact O-N 3.36Å; L111-C115 PolarHBondContact O-SG 3.39Å
112	L	57.8	Low	62.4	Low	112 Å²	112	75.2 Å²	75.2	59%	0.586	44%	0.436	S	S	*	.	H	α-helix	trans	-60.9	-39.6	176.6	-83.5	161.1	0	0	0	112.4	L108 R109 S116	L108-L112 HydrophobicContact CD2-CD1 4.47Å; L108-L112 HydrophobicContact CG-CD1 4.33Å; L108-L112 VanDerWaalsContact O-CB 3.29Å; L108-L112 WeakPolarHBondContact O-CB 3.42Å; L108-L112 WeakPolarHBondContact O-CD1 3.31Å; L108-L112 WeakPolarHBondContact O-CG 3.35Å; L108-L112 PolarHBondContact O-N 2.85Å; R109-L112 PolarHBondContact O-N 3.36Å; L112-S116 WeakPolarHBondContact O-CB 3.41Å; L112-S116 PolarHBondContact O-N 3.33Å; L112-S116 PolarHBondContact O-OG 3.42Å
113	S	61.7	Low	64.1	Low	55 Å²	55	77.8 Å²	77.8	39%	0.385	43%	0.434	S	S	.	.	H	α-helix	trans	-64.5	-52.5	175.2	174.6	0	0	0	0	111.3	R109 T110 L111 C115 S116 H117	R109-S113 WeakPolarHBondContact O-CB 3.42Å; R109-S113 PolarHBondContact O-N 2.88Å; T110-S113 PolarHBondContact O-N 3.39Å; L111-S113 VanDerWaalsContact C-N 3.34Å; L111-S113 PolarHBondContact O-N 2.99Å; S113-C115 VanDerWaalsContact C-N 3.28Å; S113-C115 PolarHBondContact O-N 2.91Å; S113-S116 WeakPolarHBondContact CA-OG 3.35Å; S113-S116 PolarHBondContact O-N 3.45Å; S113-S116 VanDerWaalsContact O-N 3.08Å; S113-S116 PolarHBondContact O-OG 3.1Å; S113-H117 PolarHBondContact O-CD2 2.92Å; S113-H117 PolarHBondContact O-N 3.29Å
114	V	63.2	Low	65.7	Low	43 Å²	43	78.2 Å²	78.2	26%	0.261	43%	0.433	S	S	.	.	H	α-helix	trans	-58	-41.2	176.2	170.5	0	0	0	0	111	T110 L111 S118 L240	T110-V114 WeakPolarHBondContact O-CB 3.26Å; T110-V114 WeakPolarHBondContact O-CG2 3.44Å; T110-V114 PolarHBondContact O-N 2.94Å; L111-V114 PolarHBondContact O-N 3.46Å; V114-S118 VanDerWaalsContact O-CB 3.28Å; V114-S118 WeakPolarHBondContact O-CB 3.25Å; V114-S118 PolarHBondContact O-N 2.83Å; V114-S118 PolarHBondContact O-OG 3.17Å; V114-L240 HydrophobicContact CG1-CD2 3.98Å
115	C	58.8	Low	67.2	Low	59 Å²	59	76.4 Å²	76.4	40%	0.399	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-47	173	-74.4	0	0	0	0	112.2	L111 S113 H117 S118 L119	L111-C115 VanDerWaalsContact O-CB 3.3Å; L111-C115 WeakPolarHBondContact O-CB 3.41Å; L111-C115 PolarHBondContact O-N 3.36Å; L111-C115 PolarHBondContact O-SG 3.39Å; S113-C115 VanDerWaalsContact C-N 3.28Å; S113-C115 PolarHBondContact O-N 2.91Å; C115-H117 PolarHBondContact O-N 3.03Å; C115-S118 CarbonylContact O-C 3.58Å; C115-S118 PolarHBondContact O-N 3Å; C115-S118 VanDerWaalsContact O-N 3.11Å; C115-L119 WeakPolarHBondContact O-CB 3.3Å; C115-L119 WeakPolarHBondContact O-CG 3.33Å; C115-L119 PolarHBondContact O-N 2.98Å
116	S	65.8	Low	68.7	Low	69 Å²	69	75.1 Å²	75.1	48%	0.483	40%	0.403	S	S	.	.	H	α-helix	trans	-61.5	-40.5	-179.3	66.4	0	0	0	0	112.9	L112 S113	L112-S116 WeakPolarHBondContact O-CB 3.41Å; L112-S116 PolarHBondContact O-N 3.33Å; L112-S116 PolarHBondContact O-OG 3.42Å; S113-S116 WeakPolarHBondContact CA-OG 3.35Å; S113-S116 PolarHBondContact O-N 3.45Å; S113-S116 VanDerWaalsContact O-N 3.08Å; S113-S116 PolarHBondContact O-OG 3.1Å
117	H	66	Low	70.3	Confident	127 Å²	127	74.4 Å²	74.4	59%	0.588	40%	0.395	S	S	*	.	H	α-helix	trans	-71.1	-28.7	173.8	-67	-62.8	0	0	0	113.4	S113 C115 P121	S113-H117 PolarHBondContact O-CD2 2.92Å; S113-H117 PolarHBondContact O-N 3.29Å; C115-H117 PolarHBondContact O-N 3.03Å; H117-P121 VanDerWaalsContact O-CD 3.27Å; H117-P121 WeakPolarHBondContact O-CD 3.34Å
118	S	71	Confident	71.7	Confident	5 Å²	5	67.5 Å²	67.5	4%	0.035	37%	0.374	C	S	.	.	H	α-helix	trans	-89.2	-21.5	-179.5	-48.2	0	0	0	0	114	V114 C115 P121 L122 S239	V114-S118 VanDerWaalsContact O-CB 3.28Å; V114-S118 WeakPolarHBondContact O-CB 3.25Å; V114-S118 PolarHBondContact O-N 2.83Å; V114-S118 PolarHBondContact O-OG 3.17Å; C115-S118 CarbonylContact O-C 3.58Å; C115-S118 PolarHBondContact O-N 3Å; C115-S118 VanDerWaalsContact O-N 3.11Å; S118-P121 WeakPolarHBondContact O-CD 3.42Å; S118-P121 WeakPolarHBondContact O-CG 3.28Å; S118-L122 WeakPolarHBondContact O-CB 3.31Å; S118-L122 WeakPolarHBondContact O-CG 3.35Å; S118-L122 PolarHBondContact O-N 2.99Å; S118-L122 VanDerWaalsContact O-N 3.12Å; S118-S239 PolarHBondContact OG-OG 3.07Å
119	L	77.2	Confident	73.4	Confident	115 Å²	115	64.3 Å²	64.3	60%	0.602	36%	0.357	S	S	*	.	H	α-helix	trans	-65.3	-41.7	-175.9	-89.9	163.4	0	0	0	112.7	C115 F123	C115-L119 WeakPolarHBondContact O-CB 3.3Å; C115-L119 WeakPolarHBondContact O-CG 3.33Å; C115-L119 PolarHBondContact O-N 2.98Å; L119-F123 WeakPolarHBondContact O-CB 3.48Å; L119-F123 PolarHBondContact O-N 3.49Å
120	S	80.3	Confident	74.9	Confident	81 Å²	81	57 Å²	57	57%	0.566	33%	0.331	S	S	*	.	H	α-helix	trans	-60.6	-57.1	177.1	-179.1	0	0	0	0	112.5	L122 F123 S124	S120-L122 PolarHBondContact O-N 3.07Å; S120-F123 WeakPolarHBondContact O-CB 3.39Å; S120-F123 PolarHBondContact O-N 3.04Å; S120-F123 VanDerWaalsContact O-N 3.15Å; S120-S124 PolarHBondContact O-N 3.09Å; S120-S124 PolarHBondContact O-OG 3.16Å
121	P	80.3	Confident	76.1	Confident	13 Å²	13	57.4 Å²	57.4	8%	0.084	33%	0.325	C	S	.	.	H	α-helix	trans	-64.4	-35.5	179	22.7	-32.7	0	0	0	113.7	H117 S118 F123 S124 I125 S236 L237	H117-P121 VanDerWaalsContact O-CD 3.27Å; H117-P121 WeakPolarHBondContact O-CD 3.34Å; S118-P121 WeakPolarHBondContact O-CD 3.42Å; S118-P121 WeakPolarHBondContact O-CG 3.28Å; P121-F123 VanDerWaalsContact C-N 3.34Å; P121-F123 PolarHBondContact O-N 3.33Å; P121-S124 PolarHBondContact O-N 3.4Å; P121-I125 WeakPolarHBondContact O-CD1 3.36Å; P121-I125 VanDerWaalsContact O-CG1 3.26Å; P121-I125 WeakPolarHBondContact O-CG1 3.22Å; P121-I125 PolarHBondContact O-N 3.29Å; P121-S236 WeakPolarHBondContact CB-OG 3.29Å; P121-L237 HydrophobicContact CB-CD2 4.15Å; P121-L237 HydrophobicContact CG-CD2 3.86Å
122	L	80.9	Confident	77.3	Confident	27 Å²	27	54.4 Å²	54.4	14%	0.141	31%	0.309	C	S	.	.	H	α-helix	trans	-62.7	-40.9	173.6	-71.1	173.2	0	0	0	111.6	S118 S120 I125 A126 L237 L248 V252	S118-L122 WeakPolarHBondContact O-CB 3.31Å; S118-L122 WeakPolarHBondContact O-CG 3.35Å; S118-L122 PolarHBondContact O-N 2.99Å; S118-L122 VanDerWaalsContact O-N 3.12Å; S120-L122 PolarHBondContact O-N 3.07Å; L122-I125 PolarHBondContact O-N 3.25Å; L122-A126 PolarHBondContact O-N 3Å; L122-L237 HydrophobicContact CD2-CD1 4.02Å; L122-L237 HydrophobicContact CD2-CD2 4.01Å; L122-L237 HydrophobicContact CG-CD2 3.97Å; L122-L248 HydrophobicContact CD2-CB 4.35Å; L122-V252 HydrophobicContact CB-CG1 4.35Å; L122-V252 HydrophobicContact CD2-CB 4.46Å; L122-V252 HydrophobicContact CD2-CG2 4.25Å; L122-V252 WeakPolarHBondContact O-CG1 3.18Å
123	F	83.8	Confident	78.6	Confident	132 Å²	132	49.2 Å²	49.2	58%	0.579	28%	0.282	S	S	*	.	H	α-helix	trans	-63	-43.7	173.8	-178.3	-101.3	0	0	0	112	L119 S120 P121 I125 A126 C127	L119-F123 WeakPolarHBondContact O-CB 3.48Å; L119-F123 PolarHBondContact O-N 3.49Å; S120-F123 WeakPolarHBondContact O-CB 3.39Å; S120-F123 PolarHBondContact O-N 3.04Å; S120-F123 VanDerWaalsContact O-N 3.15Å; P121-F123 VanDerWaalsContact C-N 3.34Å; P121-F123 PolarHBondContact O-N 3.33Å; F123-I125 VanDerWaalsContact C-N 3.33Å; F123-I125 PolarHBondContact O-N 3.33Å; F123-A126 WeakPolarHBondContact O-CB 3.48Å; F123-A126 PolarHBondContact O-N 3.24Å; F123-C127 PolarHBondContact O-N 3.13Å
124	S	84.8	Confident	79.6	Confident	63 Å²	63	48.2 Å²	48.2	44%	0.441	28%	0.275	S	S	.	.	H	α-helix	trans	-59.7	-40.4	174.5	-61.6	0	0	0	0	112.8	S120 P121 C127 A128	S120-S124 PolarHBondContact O-N 3.09Å; S120-S124 PolarHBondContact O-OG 3.16Å; P121-S124 PolarHBondContact O-N 3.4Å; S124-C127 PolarHBondContact O-N 3.03Å; S124-A128 WeakPolarHBondContact O-CB 3.41Å; S124-A128 PolarHBondContact O-N 3.48Å
125	I	85.6	Confident	80.4	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.015	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-44.2	174.6	-69.1	162.7	0	0	0	110.7	P121 L122 F123 C127 A128 F129 V229 L237	P121-I125 WeakPolarHBondContact O-CD1 3.36Å; P121-I125 VanDerWaalsContact O-CG1 3.26Å; P121-I125 WeakPolarHBondContact O-CG1 3.22Å; P121-I125 PolarHBondContact O-N 3.29Å; L122-I125 PolarHBondContact O-N 3.25Å; F123-I125 VanDerWaalsContact C-N 3.33Å; F123-I125 PolarHBondContact O-N 3.33Å; I125-C127 PolarHBondContact O-N 2.8Å; I125-A128 PolarHBondContact O-N 3.14Å; I125-F129 HydrophobicContact CG2-CD2 3.79Å; I125-F129 HydrophobicContact CG2-CE2 3.8Å; I125-F129 WeakPolarHBondContact O-CD2 3.29Å; I125-F129 PolarHBondContact O-N 3.49Å; I125-F129 VanDerWaalsContact O-N 3.14Å; I125-V229 HydrophobicContact CG1-CG1 4.45Å; I125-V229 HydrophobicContact CG2-CG1 4.49Å; I125-L237 HydrophobicContact CD1-CD1 4.32Å
126	A	87.4	Confident	81.3	Confident	22 Å²	22	48 Å²	48	18%	0.182	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-46.1	175.4	0	0	0	0	0	111.9	L122 F123 F130 V252	L122-A126 PolarHBondContact O-N 3Å; F123-A126 WeakPolarHBondContact O-CB 3.48Å; F123-A126 PolarHBondContact O-N 3.24Å; A126-F130 WeakPolarHBondContact O-CB 3.27Å; A126-F130 PolarHBondContact O-N 3.01Å; A126-V252 HydrophobicContact CB-CG1 3.71Å
127	C	86.1	Confident	81.7	Confident	37 Å²	37	45.4 Å²	45.4	25%	0.25	25%	0.246	C	C	.	.	H	α-helix	trans	-64.5	-42.1	178.1	-72.4	0	0	0	0	112.6	F123 S124 I125 F130 F131	F123-C127 PolarHBondContact O-N 3.13Å; S124-C127 PolarHBondContact O-N 3.03Å; I125-C127 PolarHBondContact O-N 2.8Å; C127-F130 WeakPolarHBondContact O-CB 3.29Å; C127-F130 PolarHBondContact O-N 3.45Å; C127-F131 HydrophobicContact CB-CE2 4.47Å; C127-F131 WeakPolarHBondContact O-CD2 3.32Å; C127-F131 PolarHBondContact O-N 3.13Å
128	A	86.4	Confident	81.9	Confident	26 Å²	26	46.3 Å²	46.3	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-48.7	178.8	0	0	0	0	0	111.8	S124 I125 L132 V229	S124-A128 WeakPolarHBondContact O-CB 3.41Å; S124-A128 PolarHBondContact O-N 3.48Å; I125-A128 PolarHBondContact O-N 3.14Å; A128-L132 VanDerWaalsContact O-CB 3.28Å; A128-L132 WeakPolarHBondContact O-CB 3.29Å; A128-L132 PolarHBondContact O-N 3.47Å; A128-V229 HydrophobicContact CB-CG2 3.72Å
129	F	87.7	Confident	81.4	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-69.6	-32.3	176.9	-75.9	-65	0	0	0	113	I125 L132 T133 L157 P158 C161 Y162 V229	I125-F129 HydrophobicContact CG2-CD2 3.79Å; I125-F129 HydrophobicContact CG2-CE2 3.8Å; I125-F129 WeakPolarHBondContact O-CD2 3.29Å; I125-F129 PolarHBondContact O-N 3.49Å; I125-F129 VanDerWaalsContact O-N 3.14Å; F129-L132 HydrophobicContact CD1-CD2 4.38Å; F129-T133 WeakPolarHBondContact O-CB 3.42Å; F129-T133 PolarHBondContact O-N 3.37Å; F129-T133 PolarHBondContact O-OG1 2.96Å; F129-L157 HydrophobicContact CD1-CD2 3.83Å; F129-L157 HydrophobicContact CE1-CD2 3.6Å; F129-P158 HydrophobicContact CD1-CB 4.4Å; F129-P158 HydrophobicContact CD1-CG 3.8Å; F129-P158 HydrophobicContact CE1-CB 4.22Å; F129-P158 HydrophobicContact CE1-CG 4.02Å; F129-P158 HydrophobicContact CE2-CB 4.35Å; F129-P158 HydrophobicContact CG-CG 4.08Å; F129-P158 HydrophobicContact CZ-CB 4.19Å; F129-P158 HydrophobicContact CZ-CG 4.45Å; F129-C161 HydrophobicContact CZ-CB 4.2Å; F129-Y162 HydrophobicContact CE2-CE2 4.12Å; F129-Y162 HydrophobicContact CZ-CE2 4.3Å; F129-V229 HydrophobicContact CD2-CG1 4.35Å; F129-V229 HydrophobicContact CE2-CG1 3.65Å; F129-V229 HydrophobicContact CZ-CG1 3.92Å
130	F	88.9	Confident	80.5	Confident	38 Å²	38	47.9 Å²	47.9	17%	0.167	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-55.5	171.6	173	-93.2	0	0	0	111.9	A126 C127 L132 T133 C134 L259 A260 L263	A126-F130 WeakPolarHBondContact O-CB 3.27Å; A126-F130 PolarHBondContact O-N 3.01Å; C127-F130 WeakPolarHBondContact O-CB 3.29Å; C127-F130 PolarHBondContact O-N 3.45Å; F130-L132 PolarHBondContact O-N 3.28Å; F130-T133 WeakPolarHBondContact O-CB 3.38Å; F130-T133 PolarHBondContact O-N 3.24Å; F130-C134 PolarHBondContact O-N 3.38Å; F130-C134 PolarHBondContact O-SG 2.99Å; F130-L259 HydrophobicContact CD2-CB 4.16Å; F130-L259 HydrophobicContact CD2-CD2 4.12Å; F130-L259 HydrophobicContact CD2-CG 4.1Å; F130-L259 HydrophobicContact CE2-CB 4.43Å; F130-L259 HydrophobicContact CE2-CD2 4.16Å; F130-L259 HydrophobicContact CE2-CG 3.97Å; F130-A260 HydrophobicContact CD2-CB 3.7Å; F130-A260 HydrophobicContact CE2-CB 4Å; F130-A260 HydrophobicContact CG-CB 4.38Å; F130-L263 HydrophobicContact CE2-CD1 3.71Å; F130-L263 HydrophobicContact CZ-CD1 3.75Å
131	F	85.8	Confident	79.2	Confident	100 Å²	100	49.3 Å²	49.3	44%	0.439	24%	0.244	S	C	.	.	H	α-helix	trans	-65.9	-38.7	-179.2	-74	-62.8	0	0	0	112.5	C127 T133 C134 F135	C127-F131 HydrophobicContact CB-CE2 4.47Å; C127-F131 WeakPolarHBondContact O-CD2 3.32Å; C127-F131 PolarHBondContact O-N 3.13Å; F131-T133 VanDerWaalsContact C-N 3.3Å; F131-T133 PolarHBondContact O-N 3.44Å; F131-C134 PolarHBondContact O-N 3.5Å; F131-F135 WeakPolarHBondContact O-CB 3.28Å; F131-F135 PolarHBondContact O-N 3.43Å
132	L	84.3	Confident	77.7	Confident	11 Å²	11	51.2 Å²	51.2	6%	0.058	27%	0.265	C	S	.	.	H	α-helix	trans	-58.9	-41.5	172.5	177.8	58.4	0	0	0	111.9	A128 F129 F130 F135 L136 L157 V222 L225	A128-L132 VanDerWaalsContact O-CB 3.28Å; A128-L132 WeakPolarHBondContact O-CB 3.29Å; A128-L132 PolarHBondContact O-N 3.47Å; F129-L132 HydrophobicContact CD1-CD2 4.38Å; F130-L132 PolarHBondContact O-N 3.28Å; L132-F135 PolarHBondContact O-N 3.25Å; L132-L136 HydrophobicContact CD1-CD1 3.77Å; L132-L136 HydrophobicContact CD1-CG 4.02Å; L132-L136 HydrophobicContact CG-CD1 3.96Å; L132-L136 WeakPolarHBondContact O-CB 3.24Å; L132-L136 WeakPolarHBondContact O-CG 3.21Å; L132-L136 PolarHBondContact O-N 2.86Å; L132-L157 HydrophobicContact CD2-CD2 3.69Å; L132-V222 HydrophobicContact CD1-CG2 4.32Å; L132-L225 HydrophobicContact CB-CD2 4.06Å; L132-L225 HydrophobicContact CD1-CD2 3.98Å; L132-L225 HydrophobicContact CD2-CD2 4.09Å; L132-L225 HydrophobicContact CG-CD2 4.25Å
133	T	85.4	Confident	75.7	Confident	3 Å²	3	57 Å²	57	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-65.1	-46.2	177.6	-56.9	0	0	0	0	110.9	F129 F130 F131 F135 L136 T137 L154 C257 A260 L261	F129-T133 WeakPolarHBondContact O-CB 3.42Å; F129-T133 PolarHBondContact O-N 3.37Å; F129-T133 PolarHBondContact O-OG1 2.96Å; F130-T133 WeakPolarHBondContact O-CB 3.38Å; F130-T133 PolarHBondContact O-N 3.24Å; F131-T133 VanDerWaalsContact C-N 3.3Å; F131-T133 PolarHBondContact O-N 3.44Å; T133-F135 VanDerWaalsContact C-N 3.31Å; T133-F135 PolarHBondContact O-N 2.87Å; T133-L136 PolarHBondContact O-N 2.94Å; T133-T137 WeakPolarHBondContact O-CG2 3.37Å; T133-T137 PolarHBondContact O-N 3.41Å; T133-T137 PolarHBondContact O-OG1 3.34Å; T133-L154 HydrophobicContact CG2-CB 4.47Å; T133-L154 HydrophobicContact CG2-CD1 4.02Å; T133-C257 WeakPolarHBondContact OG1-CA 3.49Å; T133-C257 PolarHBondContact OG1-SG 3.19Å; T133-A260 HydrophobicContact CG2-CB 3.59Å; T133-L261 HydrophobicContact CG2-CD2 4.13Å; T133-L261 HydrophobicContact CG2-CG 3.98Å
134	C	82.4	Confident	73.5	Confident	35 Å²	35	53.5 Å²	53.5	24%	0.236	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-34.6	175.4	-68	0	0	0	0	113.4	F130 F131 T137 R138	F130-C134 PolarHBondContact O-N 3.38Å; F130-C134 PolarHBondContact O-SG 2.99Å; F131-C134 PolarHBondContact O-N 3.5Å; C134-T137 PolarHBondContact O-OG1 3.32Å; C134-R138 WeakPolarHBondContact O-CB 3.44Å; C134-R138 VanDerWaalsContact O-CG 3.31Å; C134-R138 WeakPolarHBondContact O-CG 3.18Å; C134-R138 PolarHBondContact O-N 2.93Å
135	F	80.5	Confident	71.4	Confident	87 Å²	87	57.3 Å²	57.3	38%	0.382	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-51.6	173.9	178.8	-101	0	0	0	110.9	F131 L132 T133 T137 R138 T139 L221	F131-F135 WeakPolarHBondContact O-CB 3.28Å; F131-F135 PolarHBondContact O-N 3.43Å; L132-F135 PolarHBondContact O-N 3.25Å; T133-F135 VanDerWaalsContact C-N 3.31Å; T133-F135 PolarHBondContact O-N 2.87Å; F135-T137 PolarHBondContact O-N 2.82Å; F135-R138 PolarHBondContact O-N 3.01Å; F135-T139 HydrophobicContact CE1-CG2 4.24Å; F135-T139 HydrophobicContact CZ-CG2 4.26Å; F135-T139 WeakPolarHBondContact O-CG2 3.45Å; F135-T139 PolarHBondContact O-N 3.45Å; F135-T139 VanDerWaalsContact O-N 3.09Å; F135-L221 HydrophobicContact CE1-CD2 4.19Å
136	L	77.3	Confident	69.4	Low	10 Å²	10	60.6 Å²	60.6	5%	0.052	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-35.9	-178.4	-68.3	172.9	0	0	0	112.6	L132 T133 T139 L154 V222	L132-L136 HydrophobicContact CD1-CD1 3.77Å; L132-L136 HydrophobicContact CD1-CG 4.02Å; L132-L136 HydrophobicContact CG-CD1 3.96Å; L132-L136 WeakPolarHBondContact O-CB 3.24Å; L132-L136 WeakPolarHBondContact O-CG 3.21Å; L132-L136 PolarHBondContact O-N 2.86Å; T133-L136 PolarHBondContact O-N 2.94Å; L136-T139 PolarHBondContact O-OG1 3.32Å; L136-L154 HydrophobicContact CB-CD1 4.33Å; L136-L154 HydrophobicContact CB-CD2 4Å; L136-L154 HydrophobicContact CD1-CD2 3.59Å; L136-L154 HydrophobicContact CG-CD2 4.44Å; L136-V222 HydrophobicContact CD1-CG2 4.31Å; L136-V222 HydrophobicContact CD2-CG2 4.09Å
137	T	74	Confident	67.3	Low	15 Å²	15	70.4 Å²	70.4	9%	0.092	40%	0.396	C	S	.	.	H	α-helix	trans	-67.9	-38.6	172.7	57.6	0	0	0	0	112.8	T133 C134 F135 K140 L154 L261	T133-T137 WeakPolarHBondContact O-CG2 3.37Å; T133-T137 PolarHBondContact O-N 3.41Å; T133-T137 PolarHBondContact O-OG1 3.34Å; C134-T137 PolarHBondContact O-OG1 3.32Å; F135-T137 PolarHBondContact O-N 2.82Å; T137-K140 WeakPolarHBondContact O-CB 3.25Å; T137-K140 PolarHBondContact O-N 2.96Å; T137-L154 HydrophobicContact CG2-CD1 3.91Å; T137-L261 HydrophobicContact CG2-CD2 3.94Å
138	R	69.4	Low	65.4	Low	146 Å²	146	74.6 Å²	74.6	55%	0.551	43%	0.426	S	S	*	.	H	α-helix	trans	-59.5	-45.4	173.9	-80.4	178.7	175.9	-172.5	0.3	112	C134 F135 K140 R141	C134-R138 WeakPolarHBondContact O-CB 3.44Å; C134-R138 VanDerWaalsContact O-CG 3.31Å; C134-R138 WeakPolarHBondContact O-CG 3.18Å; C134-R138 PolarHBondContact O-N 2.93Å; F135-R138 PolarHBondContact O-N 3.01Å; R138-K140 PolarHBondContact O-N 3.35Å; R138-R141 PolarHBondContact O-N 3.45Å
139	T	61.4	Low	63.8	Low	65 Å²	65	76.2 Å²	76.2	40%	0.399	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-11.1	-179.9	62.7	0	0	0	0	115.1	F135 L136	F135-T139 HydrophobicContact CE1-CG2 4.24Å; F135-T139 HydrophobicContact CZ-CG2 4.26Å; F135-T139 WeakPolarHBondContact O-CG2 3.45Å; F135-T139 PolarHBondContact O-N 3.45Å; F135-T139 VanDerWaalsContact O-N 3.09Å; L136-T139 PolarHBondContact O-OG1 3.32Å
140	K	57.9	Low	62.4	Low	87 Å²	87	77.7 Å²	77.7	38%	0.378	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-7.7	-175.7	-169.4	176.2	162.4	-170.2	0	114.2	T137 R138 G142 G150 S151	T137-K140 WeakPolarHBondContact O-CB 3.25Å; T137-K140 PolarHBondContact O-N 2.96Å; R138-K140 PolarHBondContact O-N 3.35Å; K140-G142 PolarHBondContact O-N 2.94Å; K140-G150 PolarHBondContact NZ-O 2.96Å; K140-S151 PolarHBondContact NZ-OG 3.45Å
141	R	53.9	Low	61.5	Low	112 Å²	112	77.1 Å²	77.1	42%	0.423	46%	0.462	S	S	.	.			trans	-78.2	63.4	178.7	-61.3	-166.5	-173.7	-173	-1.6	112.3	R138 D264 E271	R138-R141 PolarHBondContact O-N 3.45Å; R141-D264 IonicContact NH2-OD1 3.58Å; R141-D264 PolarHBondContact NH2-OD1 3.35Å; R141-E271 WeakPolarHBondContact CD-OE1 3.35Å; R141-E271 IonicContact CZ-OE1 3.22Å; R141-E271 IonicContact NE-OE1 3.64Å; R141-E271 VanDerWaalsContact NH1-CD 3.29Å; R141-E271 IonicContact NH1-OE1 3.37Å; R141-E271 PolarHBondContact NH1-OE1 2.99Å; R141-E271 IonicContact NH1-OE2 3.77Å
142	G	47.7	Very low	60.8	Low	52 Å²	52	81 Å²	81	54%	0.536	47%	0.474	S	S	.	.			trans	-88.1	151.9	164.7	0	0	0	0	0	111.5	K140 G144	K140-G142 PolarHBondContact O-N 2.94Å; G142-G144 PolarHBondContact O-N 2.98Å
143	P	38.9	Very low	60.5	Low	149 Å²	149	83.1 Å²	83.1	97%	0.968	48%	0.481	S	S	*	.	S	Bend	trans	-73	93.7	-178.1	29.7	-34.8	0	0	0	111.3
144	G	37.8	Very low	60.2	Low	59 Å²	59	83.2 Å²	83.2	61%	0.608	48%	0.482	S	S	*	.			trans	-156	118.1	178.6	0	0	0	0	0	112.7	G142 G146	G142-G144 PolarHBondContact O-N 2.98Å; G144-G146 PolarHBondContact O-N 2.84Å
145	P	40	Very low	60.2	Low	143 Å²	143	83.7 Å²	83.7	93%	0.929	48%	0.482	S	S	*	.	S	Bend	trans	-75.1	110.2	-177.9	29	-33.3	0	0	0	111.8
146	G	45	Very low	60.2	Low	72 Å²	72	81.4 Å²	81.4	74%	0.742	48%	0.478	S	S	*	.			trans	107.7	81.2	157.9	0	0	0	0	0	117.6	G144	G144-G146 PolarHBondContact O-N 2.84Å
147	R	42.3	Very low	60.4	Low	228 Å²	228	81.1 Å²	81.1	86%	0.86	48%	0.477	S	S	*	.			trans	-154.7	61.7	155.9	-121	174.4	-172.1	-161.3	1.8	114.6	G149 G150	R147-G149 PolarHBondContact O-N 3.38Å; R147-G149 VanDerWaalsContact O-N 3.16Å; R147-G150 PolarHBondContact O-N 3.47Å
148	S	46.6	Very low	60.9	Low	124 Å²	124	80.4 Å²	80.4	87%	0.867	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.5	-178.1	-174	0	0	0	0	114.9	G150	S148-G150 PolarHBondContact O-N 3.3Å
149	G	52	Low	61.5	Low	61 Å²	61	76.1 Å²	76.1	63%	0.629	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-17.7	-176.9	0	0	0	0	0	116.6	R147 S151	R147-G149 PolarHBondContact O-N 3.38Å; R147-G149 VanDerWaalsContact O-N 3.16Å; G149-S151 PolarHBondContact O-N 2.91Å; G149-S151 VanDerWaalsContact O-N 3.1Å
150	G	59.8	Low	62.3	Low	34 Å²	34	74.1 Å²	74.1	35%	0.351	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	26.5	-159.3	0	0	0	0	0	118.2	K140 R147 S148 W153	K140-G150 PolarHBondContact NZ-O 2.96Å; R147-G150 PolarHBondContact O-N 3.47Å; S148-G150 PolarHBondContact O-N 3.3Å; G150-W153 PolarHBondContact O-NE1 3.44Å
151	S	69.4	Low	63.4	Low	27 Å²	27	70 Å²	70	19%	0.189	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-11.7	-179.3	-57.1	0	0	0	0	114	K140 G149 W153 L154	K140-S151 PolarHBondContact NZ-OG 3.45Å; G149-S151 PolarHBondContact O-N 2.91Å; G149-S151 VanDerWaalsContact O-N 3.1Å; S151-W153 VanDerWaalsContact C-N 3.27Å; S151-W153 PolarHBondContact O-N 2.85Å; S151-L154 WeakPolarHBondContact O-CB 3.48Å; S151-L154 WeakPolarHBondContact O-CG 3.08Å; S151-L154 PolarHBondContact O-N 2.87Å
152	W	71.1	Confident	64.6	Low	182 Å²	182	65.1 Å²	65.1	69%	0.689	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-69	-20.9	-177.5	-72.2	82.6	0	0	0	114.1	L154 L155	W152-L154 PolarHBondContact O-N 2.91Å; W152-L155 HydrophobicContact CE3-CD1 3.68Å; W152-L155 HydrophobicContact CZ3-CD1 4.02Å; W152-L155 WeakPolarHBondContact O-CB 3.34Å; W152-L155 PolarHBondContact O-N 3.42Å
153	W	78.1	Confident	65.9	Low	54 Å²	54	66.4 Å²	66.4	21%	0.205	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-62.9	-21	176	69.5	-92.4	0	0	0	113.2	G150 S151 L155 A156 L208 A211 L214	G150-W153 PolarHBondContact O-NE1 3.44Å; S151-W153 VanDerWaalsContact C-N 3.27Å; S151-W153 PolarHBondContact O-N 2.85Å; W153-L155 PolarHBondContact O-N 2.86Å; W153-A156 WeakPolarHBondContact O-CB 3.45Å; W153-A156 PolarHBondContact O-N 3.43Å; W153-L208 HydrophobicContact CH2-CD2 4.47Å; W153-L208 HydrophobicContact CZ3-CD2 4.43Å; W153-A211 HydrophobicContact CB-CB 4.45Å; W153-A211 HydrophobicContact CD2-CB 3.89Å; W153-A211 HydrophobicContact CE3-CB 3.88Å; W153-A211 HydrophobicContact CG-CB 4.15Å; W153-A211 HydrophobicContact CZ3-CB 4.42Å; W153-L214 HydrophobicContact CH2-CD1 4.29Å
154	L	79.6	Confident	67.4	Low	5 Å²	5	59.3 Å²	59.3	3%	0.026	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-62.2	-22.6	173.4	-62.9	173.4	0	0	0	112.3	T133 L136 T137 S151 W152 A156 L157 P158	T133-L154 HydrophobicContact CG2-CB 4.47Å; T133-L154 HydrophobicContact CG2-CD1 4.02Å; L136-L154 HydrophobicContact CB-CD1 4.33Å; L136-L154 HydrophobicContact CB-CD2 4Å; L136-L154 HydrophobicContact CD1-CD2 3.59Å; L136-L154 HydrophobicContact CG-CD2 4.44Å; T137-L154 HydrophobicContact CG2-CD1 3.91Å; S151-L154 WeakPolarHBondContact O-CB 3.48Å; S151-L154 WeakPolarHBondContact O-CG 3.08Å; S151-L154 PolarHBondContact O-N 2.87Å; W152-L154 PolarHBondContact O-N 2.91Å; L154-A156 VanDerWaalsContact C-N 3.33Å; L154-L157 PolarHBondContact O-N 3.08Å; L154-P158 VanDerWaalsContact O-CD 3.24Å; L154-P158 WeakPolarHBondContact O-CD 3.35Å
155	L	81.9	Confident	69.1	Low	46 Å²	46	57.2 Å²	57.2	24%	0.241	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-74.1	-22.3	172.4	-59.2	-178	0	0	0	113.3	W152 W153 C257 L258 L261	W152-L155 HydrophobicContact CE3-CD1 3.68Å; W152-L155 HydrophobicContact CZ3-CD1 4.02Å; W152-L155 WeakPolarHBondContact O-CB 3.34Å; W152-L155 PolarHBondContact O-N 3.42Å; W153-L155 PolarHBondContact O-N 2.86Å; L155-C257 HydrophobicContact CD2-CB 3.61Å; L155-L258 HydrophobicContact CD1-CD2 3.75Å; L155-L258 HydrophobicContact CD1-CG 4.45Å; L155-L258 HydrophobicContact CD2-CD2 3.82Å; L155-L258 HydrophobicContact CD2-CG 3.75Å; L155-L258 HydrophobicContact CG-CD2 4.46Å; L155-L261 HydrophobicContact CD2-CD1 3.89Å; L155-L261 HydrophobicContact CG-CD1 4.03Å
156	A	80.9	Confident	70.4	Confident	38 Å²	38	55 Å²	55	31%	0.314	32%	0.32	S	S	.	.	H	α-helix	trans	-79.4	-21.3	174.6	0	0	0	0	0	112.1	W153 L154 A159 C160 L207	W153-A156 WeakPolarHBondContact O-CB 3.45Å; W153-A156 PolarHBondContact O-N 3.43Å; L154-A156 VanDerWaalsContact C-N 3.33Å; A156-A159 WeakPolarHBondContact O-CB 3.45Å; A156-A159 PolarHBondContact O-N 3.11Å; A156-A159 VanDerWaalsContact O-N 3.13Å; A156-C160 PolarHBondContact O-N 2.8Å; A156-C160 PolarHBondContact O-SG 2.82Å; A156-L207 HydrophobicContact CB-CD1 4.21Å; A156-L207 HydrophobicContact CB-CD2 4.36Å
157	L	81.6	Confident	71.5	Confident	4 Å²	4	55 Å²	55	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-63.3	-47.2	-176	179.7	137.3	0	0	0	113.1	F129 L132 L154 A159 C160 C161 L207 V222	F129-L157 HydrophobicContact CD1-CD2 3.83Å; F129-L157 HydrophobicContact CE1-CD2 3.6Å; L132-L157 HydrophobicContact CD2-CD2 3.69Å; L154-L157 PolarHBondContact O-N 3.08Å; L157-A159 VanDerWaalsContact C-N 3.27Å; L157-A159 PolarHBondContact O-N 3.41Å; L157-C160 PolarHBondContact O-N 3.33Å; L157-C161 PolarHBondContact O-N 2.63Å; L157-C161 PolarHBondContact O-SG 2.82Å; L157-L207 HydrophobicContact CB-CD2 3.95Å; L157-V222 HydrophobicContact CD1-CG1 3.83Å
158	P	83.9	Confident	72.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-35.5	170.3	-24.2	33.1	0	0	0	113.6	F129 L154 C161 Y162 C257	F129-P158 HydrophobicContact CD1-CB 4.4Å; F129-P158 HydrophobicContact CD1-CG 3.8Å; F129-P158 HydrophobicContact CE1-CB 4.22Å; F129-P158 HydrophobicContact CE1-CG 4.02Å; F129-P158 HydrophobicContact CE2-CB 4.35Å; F129-P158 HydrophobicContact CG-CG 4.08Å; F129-P158 HydrophobicContact CZ-CB 4.19Å; F129-P158 HydrophobicContact CZ-CG 4.45Å; L154-P158 VanDerWaalsContact O-CD 3.24Å; L154-P158 WeakPolarHBondContact O-CD 3.35Å; P158-C161 PolarHBondContact O-N 3.04Å; P158-Y162 WeakPolarHBondContact O-CD2 3.26Å; P158-C257 WeakPolarHBondContact CG-SG 3.29Å
159	A	81.6	Confident	73.6	Confident	57 Å²	57	45 Å²	45	47%	0.471	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-45.7	177.1	0	0	0	0	0	111.3	A156 L157 C161 Y162 L163	A156-A159 WeakPolarHBondContact O-CB 3.45Å; A156-A159 PolarHBondContact O-N 3.11Å; A156-A159 VanDerWaalsContact O-N 3.13Å; L157-A159 VanDerWaalsContact C-N 3.27Å; L157-A159 PolarHBondContact O-N 3.41Å; A159-C161 VanDerWaalsContact C-N 3.29Å; A159-C161 PolarHBondContact O-N 3.38Å; A159-Y162 PolarHBondContact O-N 3Å; A159-Y162 VanDerWaalsContact O-N 3.13Å; A159-L163 WeakPolarHBondContact O-CB 3.41Å; A159-L163 PolarHBondContact O-N 3.14Å
160	C	79.1	Confident	74	Confident	22 Å²	22	46.1 Å²	46.1	15%	0.149	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-33.8	175.5	-70.2	0	0	0	0	112.9	A156 L157 Y162 C203 V204 L207	A156-C160 PolarHBondContact O-N 2.8Å; A156-C160 PolarHBondContact O-SG 2.82Å; L157-C160 PolarHBondContact O-N 3.33Å; C160-Y162 PolarHBondContact O-N 2.79Å; C160-C203 HydrophobicContact CB-CB 4.47Å; C160-V204 HydrophobicContact CB-CG2 4.22Å; C160-L207 HydrophobicContact CB-CD2 4.19Å
161	C	80.3	Confident	74	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.014	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-19.4	175	-69.3	0	0	0	0	114.4	F129 L157 P158 A159 V200	F129-C161 HydrophobicContact CZ-CB 4.2Å; L157-C161 PolarHBondContact O-N 2.63Å; L157-C161 PolarHBondContact O-SG 2.82Å; P158-C161 PolarHBondContact O-N 3.04Å; A159-C161 VanDerWaalsContact C-N 3.29Å; A159-C161 PolarHBondContact O-N 3.38Å; C161-V200 VanDerWaalsContact O-CG1 3.25Å; C161-V200 WeakPolarHBondContact O-CG1 3.34Å
162	Y	78.4	Confident	73.5	Confident	9 Å²	9	62.8 Å²	62.8	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-126.8	-5.7	-178	-59	-65.5	0	0	0	114.4	F129 P158 A159 C160 G164 D165 F166 S233 S249	F129-Y162 HydrophobicContact CE2-CE2 4.12Å; F129-Y162 HydrophobicContact CZ-CE2 4.3Å; P158-Y162 WeakPolarHBondContact O-CD2 3.26Å; A159-Y162 PolarHBondContact O-N 3Å; A159-Y162 VanDerWaalsContact O-N 3.13Å; C160-Y162 PolarHBondContact O-N 2.79Å; Y162-G164 PolarHBondContact O-N 3.27Å; Y162-D165 PolarHBondContact O-N 3.29Å; Y162-F166 PolarHBondContact O-N 2.96Å; Y162-S233 WeakPolarHBondContact OH-CB 3.44Å; Y162-S249 VanDerWaalsContact CD1-OG 3.29Å; Y162-S249 WeakPolarHBondContact CD1-OG 3.47Å; Y162-S249 VanDerWaalsContact CD2-OG 3.28Å; Y162-S249 WeakPolarHBondContact CD2-OG 3.28Å; Y162-S249 VanDerWaalsContact CE1-OG 3.29Å; Y162-S249 WeakPolarHBondContact CE1-OG 3.48Å; Y162-S249 VanDerWaalsContact CE2-OG 3.29Å; Y162-S249 WeakPolarHBondContact CE2-OG 3.37Å; Y162-S249 VanDerWaalsContact CG-OG 3.3Å; Y162-S249 VanDerWaalsContact CZ-CB 3.47Å; Y162-S249 VanDerWaalsContact CZ-OG 3.3Å
163	L	76.3	Confident	72.6	Confident	78 Å²	78	57.3 Å²	57.3	41%	0.408	28%	0.276	S	S	.	.	H	α-helix	trans	-60.1	-34.7	175	-177.5	62.1	0	0	0	112	A159 F166 L167	A159-L163 WeakPolarHBondContact O-CB 3.41Å; A159-L163 PolarHBondContact O-N 3.14Å; L163-F166 PolarHBondContact O-N 3.42Å; L163-L167 HydrophobicContact CD1-CD1 4.49Å; L163-L167 HydrophobicContact CD1-CG 4.34Å; L163-L167 HydrophobicContact CG-CD1 4.06Å; L163-L167 HydrophobicContact CG-CG 4.36Å; L163-L167 WeakPolarHBondContact O-CG 3.48Å; L163-L167 PolarHBondContact O-N 3.39Å
164	G	70.6	Confident	71.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-42.4	177.8	0	0	0	0	0	113.3	Y162 L167 V168	Y162-G164 PolarHBondContact O-N 3.27Å; G164-L167 PolarHBondContact O-N 3.33Å; G164-V168 WeakPolarHBondContact O-CB 3.36Å; G164-V168 VanDerWaalsContact O-CG2 3.32Å; G164-V168 WeakPolarHBondContact O-CG2 3.34Å; G164-V168 PolarHBondContact O-N 2.88Å
165	D	72.5	Confident	69.3	Low	15 Å²	15	68.6 Å²	68.6	8%	0.08	33%	0.332	C	S	.	.	H	α-helix	trans	-66.9	-36	173.8	-85.7	-58.4	0	0	0	112.7	Y162 W169 R196 W230 P246	Y162-D165 PolarHBondContact O-N 3.29Å; D165-W169 VanDerWaalsContact O-CB 3.29Å; D165-W169 WeakPolarHBondContact O-CB 3.29Å; D165-W169 PolarHBondContact O-N 3.41Å; D165-R196 WeakPolarHBondContact OD1-CD 3.35Å; D165-R196 IonicContact OD1-CZ 3.82Å; D165-R196 IonicContact OD1-NH1 2.84Å; D165-R196 PolarHBondContact OD1-NH1 2.83Å; D165-W230 PolarHBondContact OD2-NE1 3.12Å; D165-P246 HydrophobicContact CB-CB 4.15Å; D165-P246 HydrophobicContact CB-CG 4.43Å
166	F	68.5	Low	67.4	Low	97 Å²	97	78.6 Å²	78.6	43%	0.425	37%	0.367	S	S	.	.	H	α-helix	trans	-64.3	-45.6	175.8	-174.9	-90.9	0	0	0	111.5	Y162 L163 W169 Q170	Y162-F166 PolarHBondContact O-N 2.96Å; L163-F166 PolarHBondContact O-N 3.42Å; F166-W169 HydrophobicContact CE2-CE3 4.5Å; F166-W169 HydrophobicContact CE2-CZ3 4.49Å; F166-W169 PolarHBondContact O-N 2.92Å; F166-Q170 WeakPolarHBondContact O-CB 3.48Å; F166-Q170 PolarHBondContact O-N 2.89Å
167	L	68	Low	65.3	Low	71 Å²	71	80.2 Å²	80.2	37%	0.372	39%	0.387	S	S	.	.	H	α-helix	trans	-64.9	-42.2	177	-69.2	171.4	0	0	0	112	L163 G164 Q170 W171	L163-L167 HydrophobicContact CD1-CD1 4.49Å; L163-L167 HydrophobicContact CD1-CG 4.34Å; L163-L167 HydrophobicContact CG-CD1 4.06Å; L163-L167 HydrophobicContact CG-CG 4.36Å; L163-L167 WeakPolarHBondContact O-CG 3.48Å; L163-L167 PolarHBondContact O-N 3.39Å; G164-L167 PolarHBondContact O-N 3.33Å; L167-Q170 PolarHBondContact O-N 2.96Å; L167-W171 WeakPolarHBondContact O-CB 3.22Å; L167-W171 PolarHBondContact O-N 3.21Å
168	V	67	Low	63.4	Low	31 Å²	31	88.4 Å²	88.4	19%	0.188	43%	0.431	C	S	.	.	H	α-helix	trans	-66.8	-37.3	176.2	171.1	0	0	0	0	111.7	G164 W171 W172 R196 L199	G164-V168 WeakPolarHBondContact O-CB 3.36Å; G164-V168 VanDerWaalsContact O-CG2 3.32Å; G164-V168 WeakPolarHBondContact O-CG2 3.34Å; G164-V168 PolarHBondContact O-N 2.88Å; V168-W171 PolarHBondContact O-N 3.05Å; V168-W172 WeakPolarHBondContact O-CB 3.32Å; V168-W172 PolarHBondContact O-N 3.2Å; V168-R196 HydrophobicContact CB-CG 4.35Å; V168-R196 HydrophobicContact CG1-CG 4.08Å; V168-R196 HydrophobicContact CG2-CG 4.22Å; V168-L199 HydrophobicContact CG2-CD1 4.46Å
169	W	64.2	Low	61.3	Low	112 Å²	112	92 Å²	92	42%	0.424	47%	0.468	S	S	.	.	H	α-helix	trans	-64.3	-43.9	172.2	179.5	68.8	0	0	0	111.6	D165 F166 W171 W172 S173 A243	D165-W169 VanDerWaalsContact O-CB 3.29Å; D165-W169 WeakPolarHBondContact O-CB 3.29Å; D165-W169 PolarHBondContact O-N 3.41Å; F166-W169 HydrophobicContact CE2-CE3 4.5Å; F166-W169 HydrophobicContact CE2-CZ3 4.49Å; F166-W169 PolarHBondContact O-N 2.92Å; W169-W171 VanDerWaalsContact C-N 3.33Å; W169-W171 PolarHBondContact O-N 2.58Å; W169-W172 PolarHBondContact O-N 2.9Å; W169-S173 WeakPolarHBondContact O-CB 3.3Å; W169-S173 PolarHBondContact O-N 3.1Å; W169-S173 PolarHBondContact O-OG 2.76Å; W169-A243 HydrophobicContact CD2-CB 4.33Å; W169-A243 HydrophobicContact CH2-CB 4.17Å; W169-A243 HydrophobicContact CZ2-CB 3.66Å
170	Q	60.4	Low	59.1	Low	84 Å²	84	97.8 Å²	97.8	39%	0.393	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-40.6	177.6	-167.2	171.3	9.9	0	0	111.7	F166 L167 S173 W174	F166-Q170 WeakPolarHBondContact O-CB 3.48Å; F166-Q170 PolarHBondContact O-N 2.89Å; L167-Q170 PolarHBondContact O-N 2.96Å; Q170-S173 WeakPolarHBondContact CA-OG 3.28Å; Q170-S173 PolarHBondContact O-N 2.89Å; Q170-S173 PolarHBondContact O-OG 2.97Å; Q170-W174 PolarHBondContact O-N 2.88Å
171	W	60.7	Low	57.4	Low	218 Å²	218	101.6 Å²	101.6	83%	0.826	52%	0.524	S	S	*	.	H	α-helix	trans	-63.7	-43.1	175.4	-151.4	-50.9	0	0	0	112.2	L167 V168 W169 S173 W174	L167-W171 WeakPolarHBondContact O-CB 3.22Å; L167-W171 PolarHBondContact O-N 3.21Å; V168-W171 PolarHBondContact O-N 3.05Å; W169-W171 VanDerWaalsContact C-N 3.33Å; W169-W171 PolarHBondContact O-N 2.58Å; W171-S173 VanDerWaalsContact C-N 3.29Å; W171-S173 PolarHBondContact O-N 3.17Å; W171-W174 PolarHBondContact O-N 3.44Å
172	W	59.4	Low	55.6	Low	193 Å²	193	105.3 Å²	105.3	73%	0.731	56%	0.563	S	S	*	*	H	α-helix	trans	-72.8	-21.7	177.5	-151.4	-69.4	0	0	0	113.1	V168 W169 W174	V168-W172 WeakPolarHBondContact O-CB 3.32Å; V168-W172 PolarHBondContact O-N 3.2Å; W169-W172 PolarHBondContact O-N 2.9Å; W172-W174 VanDerWaalsContact C-N 3.33Å
173	S	52.4	Low	53.3	Low	67 Å²	67	109.8 Å²	109.8	47%	0.469	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.2	-2.9	175.9	72.2	0	0	0	0	114.4	W169 Q170 W171	W169-S173 WeakPolarHBondContact O-CB 3.3Å; W169-S173 PolarHBondContact O-N 3.1Å; W169-S173 PolarHBondContact O-OG 2.76Å; Q170-S173 WeakPolarHBondContact CA-OG 3.28Å; Q170-S173 PolarHBondContact O-N 2.89Å; Q170-S173 PolarHBondContact O-OG 2.97Å; W171-S173 VanDerWaalsContact C-N 3.29Å; W171-S173 PolarHBondContact O-N 3.17Å
174	W	45.2	Very low	51.5	Low	189 Å²	189	111.7 Å²	111.7	72%	0.716	61%	0.612	S	S	*	*	S	Bend	trans	-79	122.4	180	-148.6	-65.3	0	0	0	110.5	Q170 W171 W172 W176	Q170-W174 PolarHBondContact O-N 2.88Å; W171-W174 PolarHBondContact O-N 3.44Å; W172-W174 VanDerWaalsContact C-N 3.33Å; W174-W176 PolarHBondContact O-N 3.32Å
175	P	43.2	Very low	49.8	Very low	107 Å²	107	116 Å²	116	70%	0.695	65%	0.648	S	S	*	*			trans	-73.5	111.6	-178.2	28.4	-33.6	0	0	0	111.2
176	W	41.4	Very low	48.3	Very low	257 Å²	257	121 Å²	121	97%	0.973	68%	0.68	S	S	*	*			trans	-90.4	144.2	148	-98.6	14.7	0	0	0	108.9	W174	W174-W176 PolarHBondContact O-N 3.32Å
177	G	37	Very low	47	Very low	72 Å²	72	125 Å²	125	74%	0.742	70%	0.699	S	S	*	*			trans	-79.2	156	-151	0	0	0	0	0	117.1
178	D	42.1	Very low	46.1	Very low	175 Å²	175	126.8 Å²	126.8	94%	0.936	71%	0.713	S	S	*	*			trans	20	112.7	158.9	-57	-20.1	0	0	0	118.8
179	G	38.3	Very low	45.4	Very low	76 Å²	76	128.5 Å²	128.5	78%	0.784	73%	0.725	S	S	*	*			trans	-171.9	60	177.6	0	0	0	0	0	115.6
180	D	35.6	Very low	44.9	Very low	178 Å²	178	128.4 Å²	128.4	95%	0.952	74%	0.739	S	S	*	*			trans	58.9	155.6	168.3	-91.4	-42.5	0	0	0	120.1
181	A	44.4	Very low	44.5	Very low	103 Å²	103	132.1 Å²	132.1	85%	0.851	76%	0.756	S	S	*	*			trans	-107.1	124.4	-178.3	0	0	0	0	0	111.5
182	G	41.1	Very low	44.5	Very low	79 Å²	79	123 Å²	123	81%	0.814	73%	0.728	S	S	*	*			trans	-170.5	6.1	-173.8	0	0	0	0	0	122.1
183	S	30	Very low	44.7	Very low	103 Å²	103	115.3 Å²	115.3	72%	0.72	71%	0.705	S	S	*	*			trans	-170.1	147.8	165.5	48.7	0	0	0	0	114.8	A185	S183-A185 PolarHBondContact O-N 3.21Å
184	P	38.7	Very low	45.4	Very low	118 Å²	118	114.7 Å²	114.7	77%	0.766	70%	0.704	S	S	*	*			trans	-84.2	92.5	166.4	33.1	-30.8	0	0	0	110.3	T186	P184-T186 VanDerWaalsContact C-N 3.31Å; P184-T186 PolarHBondContact O-N 3.32Å
185	A	35.6	Very low	46.6	Very low	92 Å²	92	107.6 Å²	107.6	76%	0.76	69%	0.689	S	S	*	*			trans	-74.3	73.2	-177.4	0	0	0	0	0	113.5	S183 H187	S183-A185 PolarHBondContact O-N 3.21Å; A185-H187 VanDerWaalsContact C-N 3.27Å; A185-H187 PolarHBondContact O-N 3.26Å
186	T	40.5	Very low	48	Very low	120 Å²	120	104.5 Å²	104.5	74%	0.736	66%	0.664	S	S	*	*			trans	-79.2	58.9	176.7	54.1	0	0	0	0	113.6	P184	P184-T186 VanDerWaalsContact C-N 3.31Å; P184-T186 PolarHBondContact O-N 3.32Å
187	H	41.6	Very low	49.6	Very low	180 Å²	180	94.7 Å²	94.7	83%	0.833	63%	0.63	S	S	*	*			trans	-155.4	117.9	160.9	-79.8	-60.3	0	0	0	111.1	A185	A185-H187 VanDerWaalsContact C-N 3.27Å; A185-H187 PolarHBondContact O-N 3.26Å
188	T	49.9	Very low	51.5	Low	109 Å²	109	97.1 Å²	97.1	67%	0.669	63%	0.625	S	S	*	*			trans	-83.5	129.3	165	49.1	0	0	0	0	109.6
189	P	51.6	Low	53.1	Low	66 Å²	66	92.1 Å²	92.1	43%	0.429	60%	0.598	S	S	.	*			trans	-66.5	147.1	-179	27	-34.3	0	0	0	111.8	E191 A192	P189-E191 VanDerWaalsContact C-N 3.26Å; P189-E191 PolarHBondContact O-N 2.91Å; P189-A192 HydrophobicContact CG-CB 4.27Å; P189-A192 WeakPolarHBondContact O-CB 3.36Å; P189-A192 PolarHBondContact O-N 3.43Å; P189-A192 VanDerWaalsContact O-N 3.1Å
190	P	53.1	Low	55.1	Low	111 Å²	111	88.5 Å²	88.5	72%	0.721	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-30.1	-174.9	24.8	-34.1	0	0	0	113.3	A192 A193 A194	P190-A192 PolarHBondContact O-N 3Å; P190-A193 WeakPolarHBondContact O-CB 3.38Å; P190-A193 PolarHBondContact O-N 2.89Å; P190-A194 PolarHBondContact O-N 2.89Å
191	E	53.1	Low	57.2	Low	162 Å²	162	81.9 Å²	81.9	76%	0.757	53%	0.525	S	S	*	.	H	α-helix	trans	-56.7	-35.8	175	-60.8	176	169.9	0	0	112.2	P189 A193 A194 G195	P189-E191 VanDerWaalsContact C-N 3.26Å; P189-E191 PolarHBondContact O-N 2.91Å; E191-A193 PolarHBondContact O-N 3.31Å; E191-A194 PolarHBondContact O-N 2.89Å; E191-G195 PolarHBondContact O-N 3.49Å; E191-G195 VanDerWaalsContact O-N 3.1Å
192	A	60.1	Low	58.9	Low	27 Å²	27	80.8 Å²	80.8	22%	0.223	51%	0.511	C	S	.	.	H	α-helix	trans	-70.4	-18.9	177.2	0	0	0	0	0	113.2	P189 P190 R196	P189-A192 HydrophobicContact CG-CB 4.27Å; P189-A192 WeakPolarHBondContact O-CB 3.36Å; P189-A192 PolarHBondContact O-N 3.43Å; P189-A192 VanDerWaalsContact O-N 3.1Å; P190-A192 PolarHBondContact O-N 3Å; A192-R196 WeakPolarHBondContact O-CD 3.38Å; A192-R196 WeakPolarHBondContact O-CG 3.27Å; A192-R196 PolarHBondContact O-N 3.35Å; A192-R196 PolarHBondContact O-NE 3.38Å
193	A	63	Low	60.6	Low	31 Å²	31	78.4 Å²	78.4	26%	0.256	48%	0.482	S	S	.	.	H	α-helix	trans	-79.5	-40.8	172.8	0	0	0	0	0	111.6	P190 E191 R196 L197	P190-A193 WeakPolarHBondContact O-CB 3.38Å; P190-A193 PolarHBondContact O-N 2.89Å; E191-A193 PolarHBondContact O-N 3.31Å; A193-R196 PolarHBondContact O-N 2.87Å; A193-L197 PolarHBondContact O-N 3.4Å; A193-L197 VanDerWaalsContact O-N 3.09Å
194	A	67.9	Low	63	Low	54 Å²	54	73.5 Å²	73.5	45%	0.446	45%	0.447	S	S	.	.	H	α-helix	trans	-61.8	-43.7	174.4	0	0	0	0	0	111.7	P190 E191 R196 L197 L198	P190-A194 PolarHBondContact O-N 2.89Å; E191-A194 PolarHBondContact O-N 2.89Å; A194-R196 VanDerWaalsContact C-N 3.35Å; A194-R196 PolarHBondContact O-N 2.75Å; A194-L197 PolarHBondContact O-N 3.47Å; A194-L198 WeakPolarHBondContact O-CG 3.35Å; A194-L198 PolarHBondContact O-N 3.26Å
195	G	70.3	Confident	64.9	Low	39 Å²	39	68.8 Å²	68.8	40%	0.402	42%	0.421	S	S	.	.	H	α-helix	trans	-59.6	-40	175.3	0	0	0	0	0	113.7	E191 L199	E191-G195 PolarHBondContact O-N 3.49Å; E191-G195 VanDerWaalsContact O-N 3.1Å; G195-L199 WeakPolarHBondContact O-CB 3.4Å; G195-L199 PolarHBondContact O-N 3.05Å; G195-L199 VanDerWaalsContact O-N 3.11Å
196	R	71.7	Confident	67	Low	43 Å²	43	69.3 Å²	69.3	16%	0.162	41%	0.41	C	S	.	.	H	α-helix	trans	-63.9	-47.5	175	-71	158.8	-171.8	-103.9	0.5	112	D165 V168 A192 A193 A194 L198 L199 V200 W230	D165-R196 WeakPolarHBondContact OD1-CD 3.35Å; D165-R196 IonicContact OD1-CZ 3.82Å; D165-R196 IonicContact OD1-NH1 2.84Å; D165-R196 PolarHBondContact OD1-NH1 2.83Å; V168-R196 HydrophobicContact CB-CG 4.35Å; V168-R196 HydrophobicContact CG1-CG 4.08Å; V168-R196 HydrophobicContact CG2-CG 4.22Å; A192-R196 WeakPolarHBondContact O-CD 3.38Å; A192-R196 WeakPolarHBondContact O-CG 3.27Å; A192-R196 PolarHBondContact O-N 3.35Å; A192-R196 PolarHBondContact O-NE 3.38Å; A193-R196 PolarHBondContact O-N 2.87Å; A194-R196 VanDerWaalsContact C-N 3.35Å; A194-R196 PolarHBondContact O-N 2.75Å; R196-L198 PolarHBondContact O-N 2.91Å; R196-L199 PolarHBondContact O-N 2.97Å; R196-V200 WeakPolarHBondContact O-CB 3.22Å; R196-V200 WeakPolarHBondContact O-CG2 3.36Å; R196-V200 PolarHBondContact O-N 3.25Å; R196-W230 HydrophobicContact CB-CH2 4.36Å; R196-W230 HydrophobicContact CB-CZ2 3.87Å
197	L	76.8	Confident	68.7	Low	51 Å²	51	65.1 Å²	65.1	27%	0.267	38%	0.383	S	S	.	.	H	α-helix	trans	-59.9	-44.9	179.4	177.1	57.8	0	0	0	111.5	A193 A194 L199 V200 L201 W230	A193-L197 PolarHBondContact O-N 3.4Å; A193-L197 VanDerWaalsContact O-N 3.09Å; A194-L197 PolarHBondContact O-N 3.47Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 3.06Å; L197-V200 PolarHBondContact O-N 3.42Å; L197-L201 HydrophobicContact CD1-CD1 3.75Å; L197-L201 HydrophobicContact CD1-CG 3.97Å; L197-L201 HydrophobicContact CG-CD1 3.93Å; L197-L201 WeakPolarHBondContact O-CB 3.24Å; L197-L201 VanDerWaalsContact O-CG 3.31Å; L197-L201 WeakPolarHBondContact O-CG 3.14Å; L197-L201 PolarHBondContact O-N 2.99Å; L197-W230 HydrophobicContact CB-CE3 4.3Å; L197-W230 HydrophobicContact CB-CH2 3.98Å; L197-W230 HydrophobicContact CB-CZ3 3.8Å; L197-W230 HydrophobicContact CD1-CD2 4.26Å; L197-W230 HydrophobicContact CD1-CE3 3.71Å; L197-W230 HydrophobicContact CD1-CZ3 4.05Å; L197-W230 HydrophobicContact CD2-CZ3 4.39Å; L197-W230 HydrophobicContact CG-CE3 4.44Å; L197-W230 HydrophobicContact CG-CZ3 4.29Å
198	L	76.7	Confident	70.2	Confident	122 Å²	122	56.9 Å²	56.9	64%	0.639	35%	0.345	S	S	*	.	H	α-helix	trans	-61.7	-40.3	176.5	-71.4	170.8	0	0	0	112.3	A194 R196 L201 S202	A194-L198 WeakPolarHBondContact O-CG 3.35Å; A194-L198 PolarHBondContact O-N 3.26Å; R196-L198 PolarHBondContact O-N 2.91Å; L198-L201 PolarHBondContact O-N 3.11Å; L198-S202 WeakPolarHBondContact O-CB 3.3Å; L198-S202 PolarHBondContact O-N 2.97Å
199	L	75.9	Confident	71.1	Confident	70 Å²	70	56.8 Å²	56.8	37%	0.366	34%	0.344	S	S	.	.	H	α-helix	trans	-70.9	-40	179.2	-157.7	151.2	0	0	0	111.6	V168 G195 R196 L197 S202 C203	V168-L199 HydrophobicContact CG2-CD1 4.46Å; G195-L199 WeakPolarHBondContact O-CB 3.4Å; G195-L199 PolarHBondContact O-N 3.05Å; G195-L199 VanDerWaalsContact O-N 3.11Å; R196-L199 PolarHBondContact O-N 2.97Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 3.06Å; L199-S202 WeakPolarHBondContact O-CB 3.21Å; L199-S202 PolarHBondContact O-N 3.02Å; L199-C203 PolarHBondContact O-N 3.24Å; L199-C203 PolarHBondContact O-SG 2.87Å; L199-C203 VanDerWaalsContact O-SG 3.36Å
200	V	78.8	Confident	71.9	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-60.1	-47.8	171	164.7	0	0	0	0	111.6	C161 R196 L197 S202 C203 V204 W230	C161-V200 VanDerWaalsContact O-CG1 3.25Å; C161-V200 WeakPolarHBondContact O-CG1 3.34Å; R196-V200 WeakPolarHBondContact O-CB 3.22Å; R196-V200 WeakPolarHBondContact O-CG2 3.36Å; R196-V200 PolarHBondContact O-N 3.25Å; L197-V200 PolarHBondContact O-N 3.42Å; V200-S202 VanDerWaalsContact C-N 3.31Å; V200-S202 PolarHBondContact O-N 3.46Å; V200-C203 WeakPolarHBondContact O-CB 3.33Å; V200-C203 PolarHBondContact O-N 3.49Å; V200-V204 WeakPolarHBondContact O-CG2 3.08Å; V200-V204 PolarHBondContact O-N 3.5Å; V200-W230 HydrophobicContact CG1-CG 4.45Å
201	L	80.4	Confident	72.4	Confident	40 Å²	40	56.7 Å²	56.7	21%	0.209	34%	0.338	C	S	.	.	H	α-helix	trans	-67.8	-31.3	178.7	-69.6	172.5	0	0	0	112.6	L197 L198 G205 L223 S227	L197-L201 HydrophobicContact CD1-CD1 3.75Å; L197-L201 HydrophobicContact CD1-CG 3.97Å; L197-L201 HydrophobicContact CG-CD1 3.93Å; L197-L201 WeakPolarHBondContact O-CB 3.24Å; L197-L201 VanDerWaalsContact O-CG 3.31Å; L197-L201 WeakPolarHBondContact O-CG 3.14Å; L197-L201 PolarHBondContact O-N 2.99Å; L198-L201 PolarHBondContact O-N 3.11Å; L201-G205 PolarHBondContact O-N 2.92Å; L201-L223 HydrophobicContact CD2-CB 4.45Å; L201-L223 HydrophobicContact CD2-CD2 3.88Å; L201-S227 WeakPolarHBondContact CD2-OG 3.49Å
202	S	79.6	Confident	72.8	Confident	80 Å²	80	53.2 Å²	53.2	56%	0.559	32%	0.322	S	S	*	.	H	α-helix	trans	-62.6	-45.9	169.2	-171.1	0	0	0	0	111.4	L198 L199 V200 V204 G205 L206	L198-S202 WeakPolarHBondContact O-CB 3.3Å; L198-S202 PolarHBondContact O-N 2.97Å; L199-S202 WeakPolarHBondContact O-CB 3.21Å; L199-S202 PolarHBondContact O-N 3.02Å; V200-S202 VanDerWaalsContact C-N 3.31Å; V200-S202 PolarHBondContact O-N 3.46Å; S202-V204 PolarHBondContact O-N 3Å; S202-G205 PolarHBondContact O-N 3.15Å; S202-L206 VanDerWaalsContact O-CB 3.26Å; S202-L206 WeakPolarHBondContact O-CB 3.26Å; S202-L206 PolarHBondContact O-N 2.97Å
203	C	78.3	Confident	72.7	Confident	28 Å²	28	57.8 Å²	57.8	19%	0.189	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-42.6	175.4	-68	0	0	0	0	113.1	C160 L199 V200 L207	C160-C203 HydrophobicContact CB-CB 4.47Å; L199-C203 PolarHBondContact O-N 3.24Å; L199-C203 PolarHBondContact O-SG 2.87Å; L199-C203 VanDerWaalsContact O-SG 3.36Å; V200-C203 WeakPolarHBondContact O-CB 3.33Å; V200-C203 PolarHBondContact O-N 3.49Å; C203-L207 WeakPolarHBondContact O-CB 3.48Å; C203-L207 PolarHBondContact O-N 3.15Å
204	V	79.8	Confident	72.6	Confident	0 Å²	0	58 Å²	58	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-69.7	-40.8	177.8	176	0	0	0	0	111.3	C160 V200 S202 L207 L208 V222 L223 A226	C160-V204 HydrophobicContact CB-CG2 4.22Å; V200-V204 WeakPolarHBondContact O-CG2 3.08Å; V200-V204 PolarHBondContact O-N 3.5Å; S202-V204 PolarHBondContact O-N 3Å; V204-L207 PolarHBondContact O-N 3.34Å; V204-L208 HydrophobicContact CG1-CD1 4.2Å; V204-L208 WeakPolarHBondContact O-CG 3.36Å; V204-L208 PolarHBondContact O-N 3.05Å; V204-V222 HydrophobicContact CG1-CG1 4.49Å; V204-L223 HydrophobicContact CB-CD2 4.12Å; V204-L223 HydrophobicContact CG1-CD2 3.82Å; V204-A226 HydrophobicContact CG1-CB 4.36Å
205	G	78.3	Confident	72.5	Confident	20 Å²	20	65.5 Å²	65.5	21%	0.206	36%	0.363	C	S	.	.	H	α-helix	trans	-62.3	-43.7	174.3	0	0	0	0	0	112.4	L201 S202 L208 T209	L201-G205 PolarHBondContact O-N 2.92Å; S202-G205 PolarHBondContact O-N 3.15Å; G205-L208 PolarHBondContact O-N 3.44Å; G205-T209 WeakPolarHBondContact O-CG2 3.45Å; G205-T209 PolarHBondContact O-N 2.86Å; G205-T209 PolarHBondContact O-OG1 2.92Å
206	L	78.8	Confident	72.4	Confident	103 Å²	103	70.1 Å²	70.1	54%	0.539	38%	0.377	S	S	.	.	H	α-helix	trans	-62.9	-43.9	175.4	-174.1	64.8	0	0	0	111.6	S202 L208 T209 L210	S202-L206 VanDerWaalsContact O-CB 3.26Å; S202-L206 WeakPolarHBondContact O-CB 3.26Å; S202-L206 PolarHBondContact O-N 2.97Å; L206-L208 VanDerWaalsContact C-N 3.33Å; L206-L208 PolarHBondContact O-N 3.09Å; L206-T209 PolarHBondContact O-N 3.38Å; L206-T209 PolarHBondContact O-OG1 3.3Å; L206-L210 HydrophobicContact CD1-CD1 3.55Å; L206-L210 HydrophobicContact CG-CD1 4.05Å; L206-L210 WeakPolarHBondContact O-CD1 3.41Å; L206-L210 PolarHBondContact O-N 3.34Å
207	L	76.2	Confident	72.3	Confident	31 Å²	31	78.5 Å²	78.5	16%	0.162	41%	0.409	C	S	.	.	H	α-helix	trans	-57.8	-45.5	173.5	-179.2	70.2	0	0	0	111.3	A156 L157 C160 C203 V204 A211	A156-L207 HydrophobicContact CB-CD1 4.21Å; A156-L207 HydrophobicContact CB-CD2 4.36Å; L157-L207 HydrophobicContact CB-CD2 3.95Å; C160-L207 HydrophobicContact CB-CD2 4.19Å; C203-L207 WeakPolarHBondContact O-CB 3.48Å; C203-L207 PolarHBondContact O-N 3.15Å; V204-L207 PolarHBondContact O-N 3.34Å; L207-A211 WeakPolarHBondContact O-CB 3.48Å; L207-A211 PolarHBondContact O-N 3.47Å
208	L	73.7	Confident	72.1	Confident	7 Å²	7	78.8 Å²	78.8	4%	0.037	41%	0.409	C	S	.	.	H	α-helix	trans	-61.4	-48.2	178	-73	166.5	0	0	0	111.4	W153 V204 G205 L206 L210 A211 H212 L214 C219 V222 L223	W153-L208 HydrophobicContact CH2-CD2 4.47Å; W153-L208 HydrophobicContact CZ3-CD2 4.43Å; V204-L208 HydrophobicContact CG1-CD1 4.2Å; V204-L208 WeakPolarHBondContact O-CG 3.36Å; V204-L208 PolarHBondContact O-N 3.05Å; G205-L208 PolarHBondContact O-N 3.44Å; L206-L208 VanDerWaalsContact C-N 3.33Å; L206-L208 PolarHBondContact O-N 3.09Å; L208-L210 PolarHBondContact O-N 3.31Å; L208-A211 PolarHBondContact O-N 2.98Å; L208-H212 PolarHBondContact O-N 3.19Å; L208-L214 HydrophobicContact CD2-CD1 3.97Å; L208-C219 HydrophobicContact CD1-CB 4.44Å; L208-V222 HydrophobicContact CD1-CB 4.32Å; L208-V222 HydrophobicContact CD1-CG1 4.08Å; L208-V222 HydrophobicContact CD2-CG1 4.3Å; L208-L223 HydrophobicContact CD1-CD2 4.43Å; L208-L223 HydrophobicContact CD1-CG 4.18Å
209	T	70.3	Confident	72	Confident	107 Å²	107	74.3 Å²	74.3	66%	0.656	39%	0.388	S	S	*	.	H	α-helix	trans	-64.2	-36.4	-179.8	58	0	0	0	0	114	G205 L206	G205-T209 WeakPolarHBondContact O-CG2 3.45Å; G205-T209 PolarHBondContact O-N 2.86Å; G205-T209 PolarHBondContact O-OG1 2.92Å; L206-T209 PolarHBondContact O-N 3.38Å; L206-T209 PolarHBondContact O-OG1 3.3Å
210	L	67	Low	72	Confident	140 Å²	140	75.4 Å²	75.4	73%	0.733	39%	0.393	S	S	*	.	H	α-helix	trans	-78.8	-36	175.5	-91	81	0	0	0	113.2	L206 L208	L206-L210 HydrophobicContact CD1-CD1 3.55Å; L206-L210 HydrophobicContact CG-CD1 4.05Å; L206-L210 WeakPolarHBondContact O-CD1 3.41Å; L206-L210 PolarHBondContact O-N 3.34Å; L208-L210 PolarHBondContact O-N 3.31Å
211	A	63	Low	72	Confident	35 Å²	35	79.6 Å²	79.6	29%	0.289	42%	0.415	S	S	.	.	H	α-helix	trans	-81.9	-35.8	-172.6	0	0	0	0	0	113.4	W153 L207 L208	W153-A211 HydrophobicContact CB-CB 4.45Å; W153-A211 HydrophobicContact CD2-CB 3.89Å; W153-A211 HydrophobicContact CE3-CB 3.88Å; W153-A211 HydrophobicContact CG-CB 4.15Å; W153-A211 HydrophobicContact CZ3-CB 4.42Å; L207-A211 WeakPolarHBondContact O-CB 3.48Å; L207-A211 PolarHBondContact O-N 3.47Å; L208-A211 PolarHBondContact O-N 2.98Å
212	H	61.7	Low	72	Confident	89 Å²	89	77.7 Å²	77.7	41%	0.412	41%	0.405	S	S	.	.			trans	-164.1	137.5	-179.2	-148.1	-81.6	0	0	0	114.8	L208 L214	L208-H212 PolarHBondContact O-N 3.19Å; H212-L214 HydrophobicContact CB-CD1 4.43Å; H212-L214 HydrophobicContact CB-CG 4.12Å; H212-L214 PolarHBondContact O-N 3.41Å
213	P	59.1	Low	72	Confident	123 Å²	123	76 Å²	76	80%	0.799	39%	0.39	S	S	*	.			trans	-71.1	79.8	159.9	31.5	-33.7	0	0	0	109.6
214	L	60.4	Low	72.2	Confident	37 Å²	37	80.6 Å²	80.6	19%	0.194	41%	0.412	C	S	.	.			trans	-76.2	145.6	169.2	-81.7	160.9	0	0	0	109.7	W153 L208 H212 L216 C219	W153-L214 HydrophobicContact CH2-CD1 4.29Å; L208-L214 HydrophobicContact CD2-CD1 3.97Å; H212-L214 HydrophobicContact CB-CD1 4.43Å; H212-L214 HydrophobicContact CB-CG 4.12Å; H212-L214 PolarHBondContact O-N 3.41Å; L214-L216 PolarHBondContact O-N 2.92Å; L214-C219 VanDerWaalsContact CB-SG 3.58Å
215	R	67	Low	72.3	Confident	211 Å²	211	83.3 Å²	83.3	80%	0.796	43%	0.426	S	S	*	.			trans	-59	129.2	174.4	-70.4	-178.7	177.6	-178	-0.9	109	R217 H218	R215-R217 PolarHBondContact O-N 2.94Å; R215-H218 WeakPolarHBondContact O-CB 3.18Å; R215-H218 PolarHBondContact O-N 3.32Å; R215-H218 PolarHBondContact O-ND1 3.37Å
216	L	67.3	Low	72.5	Confident	135 Å²	135	82.6 Å²	82.6	71%	0.707	42%	0.418	S	S	*	.	H	α-helix	trans	-41.3	-42.7	-169.4	-160.8	107.9	0	0	0	115.3	L214 H218 C219 L220	L214-L216 PolarHBondContact O-N 2.92Å; L216-H218 VanDerWaalsContact C-N 3.26Å; L216-H218 PolarHBondContact O-N 2.96Å; L216-C219 WeakPolarHBondContact O-CB 3.39Å; L216-C219 PolarHBondContact O-N 3.36Å; L216-C219 VanDerWaalsContact O-N 3.13Å; L216-L220 HydrophobicContact CD2-CD1 4.09Å; L216-L220 PolarHBondContact O-N 3.46Å; L216-L220 VanDerWaalsContact O-N 3.12Å
217	R	69.1	Low	72.6	Confident	220 Å²	220	79.1 Å²	79.1	83%	0.83	40%	0.402	S	S	*	.	H	α-helix	trans	-54.3	-35.7	176.6	-65.3	-174.6	179.9	-179.4	-0.6	113.7	R215 L221	R215-R217 PolarHBondContact O-N 2.94Å; R217-L221 PolarHBondContact O-N 2.97Å
218	H	72.8	Confident	72.8	Confident	57 Å²	57	83.4 Å²	83.4	26%	0.264	42%	0.42	S	S	.	.	H	α-helix	trans	-76.2	-37.8	178.2	-59	82.7	0	0	0	111.9	R215 L216 L220 L221 V222	R215-H218 WeakPolarHBondContact O-CB 3.18Å; R215-H218 PolarHBondContact O-N 3.32Å; R215-H218 PolarHBondContact O-ND1 3.37Å; L216-H218 VanDerWaalsContact C-N 3.26Å; L216-H218 PolarHBondContact O-N 2.96Å; H218-L220 VanDerWaalsContact C-N 3.31Å; H218-L220 PolarHBondContact O-N 3.46Å; H218-L221 PolarHBondContact O-N 3.07Å; H218-V222 VanDerWaalsContact O-CG2 3.32Å; H218-V222 WeakPolarHBondContact O-CG2 3.24Å; H218-V222 PolarHBondContact O-N 2.96Å
219	C	73.8	Confident	73.3	Confident	28 Å²	28	83.5 Å²	83.5	19%	0.189	42%	0.421	C	S	.	.	H	α-helix	trans	-60.7	-43.2	175.5	-57.2	0	0	0	0	111	L208 L214 L216 V222 L223	L208-C219 HydrophobicContact CD1-CB 4.44Å; L214-C219 VanDerWaalsContact CB-SG 3.58Å; L216-C219 WeakPolarHBondContact O-CB 3.39Å; L216-C219 PolarHBondContact O-N 3.36Å; L216-C219 VanDerWaalsContact O-N 3.13Å; C219-V222 PolarHBondContact O-N 3.14Å; C219-L223 WeakPolarHBondContact O-CB 3.35Å; C219-L223 VanDerWaalsContact O-CG 3.31Å; C219-L223 WeakPolarHBondContact O-CG 3.24Å; C219-L223 PolarHBondContact O-N 3.34Å
220	L	76.8	Confident	73.9	Confident	93 Å²	93	78.9 Å²	78.9	49%	0.487	39%	0.391	S	S	.	.	H	α-helix	trans	-60.4	-46.3	174.7	-67.6	170.6	0	0	0	111.9	L216 H218 V222 L223 L224	L216-L220 HydrophobicContact CD2-CD1 4.09Å; L216-L220 PolarHBondContact O-N 3.46Å; L216-L220 VanDerWaalsContact O-N 3.12Å; H218-L220 VanDerWaalsContact C-N 3.31Å; H218-L220 PolarHBondContact O-N 3.46Å; L220-V222 PolarHBondContact O-N 3.16Å; L220-L223 PolarHBondContact O-N 3.16Å; L220-L224 WeakPolarHBondContact O-CB 3.41Å; L220-L224 WeakPolarHBondContact O-CG 3.41Å; L220-L224 PolarHBondContact O-N 3.43Å
221	L	79.1	Confident	74.5	Confident	87 Å²	87	79.4 Å²	79.4	46%	0.455	38%	0.384	S	S	.	.	H	α-helix	trans	-63.5	-39	178.2	-174.5	141.7	0	0	0	112.7	F135 R217 H218 L225	F135-L221 HydrophobicContact CE1-CD2 4.19Å; R217-L221 PolarHBondContact O-N 2.97Å; H218-L221 PolarHBondContact O-N 3.07Å; L221-L225 WeakPolarHBondContact O-CB 3.47Å; L221-L225 PolarHBondContact O-N 3Å
222	V	80.4	Confident	75.2	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-65.4	-42	174.3	174.8	0	0	0	0	111.4	L132 L136 L157 V204 L208 H218 C219 L220 A226	L132-V222 HydrophobicContact CD1-CG2 4.32Å; L136-V222 HydrophobicContact CD1-CG2 4.31Å; L136-V222 HydrophobicContact CD2-CG2 4.09Å; L157-V222 HydrophobicContact CD1-CG1 3.83Å; V204-V222 HydrophobicContact CG1-CG1 4.49Å; L208-V222 HydrophobicContact CD1-CB 4.32Å; L208-V222 HydrophobicContact CD1-CG1 4.08Å; L208-V222 HydrophobicContact CD2-CG1 4.3Å; H218-V222 VanDerWaalsContact O-CG2 3.32Å; H218-V222 WeakPolarHBondContact O-CG2 3.24Å; H218-V222 PolarHBondContact O-N 2.96Å; C219-V222 PolarHBondContact O-N 3.14Å; L220-V222 PolarHBondContact O-N 3.16Å; V222-A226 VanDerWaalsContact O-CB 3.24Å; V222-A226 WeakPolarHBondContact O-CB 3.48Å; V222-A226 PolarHBondContact O-N 2.66Å
223	L	79.9	Confident	76	Confident	45 Å²	45	75.5 Å²	75.5	24%	0.236	36%	0.363	C	S	.	.	H	α-helix	trans	-67.5	-40.8	178.5	-73.2	165.9	0	0	0	112.3	L201 V204 L208 C219 L220 A226 S227	L201-L223 HydrophobicContact CD2-CB 4.45Å; L201-L223 HydrophobicContact CD2-CD2 3.88Å; V204-L223 HydrophobicContact CB-CD2 4.12Å; V204-L223 HydrophobicContact CG1-CD2 3.82Å; L208-L223 HydrophobicContact CD1-CD2 4.43Å; L208-L223 HydrophobicContact CD1-CG 4.18Å; C219-L223 WeakPolarHBondContact O-CB 3.35Å; C219-L223 VanDerWaalsContact O-CG 3.31Å; C219-L223 WeakPolarHBondContact O-CG 3.24Å; C219-L223 PolarHBondContact O-N 3.34Å; L220-L223 PolarHBondContact O-N 3.16Å; L223-A226 PolarHBondContact O-N 2.98Å; L223-S227 WeakPolarHBondContact O-CB 3.31Å; L223-S227 PolarHBondContact O-N 2.87Å; L223-S227 PolarHBondContact O-OG 3.41Å
224	L	81.5	Confident	76.7	Confident	125 Å²	125	72.9 Å²	72.9	65%	0.654	34%	0.339	S	S	*	.	H	α-helix	trans	-63.6	-45.9	175.4	-73.1	170.5	0	0	0	111.3	L220 S227 F228	L220-L224 WeakPolarHBondContact O-CB 3.41Å; L220-L224 WeakPolarHBondContact O-CG 3.41Å; L220-L224 PolarHBondContact O-N 3.43Å; L224-S227 WeakPolarHBondContact O-CB 3.48Å; L224-S227 PolarHBondContact O-N 2.81Å; L224-F228 PolarHBondContact O-N 3.04Å
225	L	82.2	Confident	77.3	Confident	56 Å²	56	74.7 Å²	74.7	29%	0.293	35%	0.351	S	S	.	.	H	α-helix	trans	-66.6	-37.9	176.8	-173.1	63.1	0	0	0	112	L132 L221 F228 V229	L132-L225 HydrophobicContact CB-CD2 4.06Å; L132-L225 HydrophobicContact CD1-CD2 3.98Å; L132-L225 HydrophobicContact CD2-CD2 4.09Å; L132-L225 HydrophobicContact CG-CD2 4.25Å; L221-L225 WeakPolarHBondContact O-CB 3.47Å; L221-L225 PolarHBondContact O-N 3Å; L225-F228 PolarHBondContact O-N 3.45Å; L225-V229 HydrophobicContact CD1-CG2 4.11Å; L225-V229 HydrophobicContact CG-CG2 4.26Å; L225-V229 WeakPolarHBondContact O-CB 3.42Å; L225-V229 VanDerWaalsContact O-CG2 3.29Å; L225-V229 WeakPolarHBondContact O-CG2 3.4Å; L225-V229 PolarHBondContact O-N 3.26Å
226	A	82.3	Confident	77.6	Confident	5 Å²	5	66.7 Å²	66.7	4%	0.041	33%	0.328	C	S	.	.	H	α-helix	trans	-62.1	-43.1	173.7	0	0	0	0	0	111.7	V204 V222 L223 F228 W230	V204-A226 HydrophobicContact CG1-CB 4.36Å; V222-A226 VanDerWaalsContact O-CB 3.24Å; V222-A226 WeakPolarHBondContact O-CB 3.48Å; V222-A226 PolarHBondContact O-N 2.66Å; L223-A226 PolarHBondContact O-N 2.98Å; A226-F228 PolarHBondContact O-N 2.94Å; A226-W230 WeakPolarHBondContact O-CB 3.4Å; A226-W230 PolarHBondContact O-N 3.24Å
227	S	80.9	Confident	77.9	Confident	30 Å²	30	60.2 Å²	60.2	21%	0.21	29%	0.294	C	S	.	.	H	α-helix	trans	-58	-47.7	174.5	-54.8	0	0	0	0	111.3	L201 L223 L224 W231	L201-S227 WeakPolarHBondContact CD2-OG 3.49Å; L223-S227 WeakPolarHBondContact O-CB 3.31Å; L223-S227 PolarHBondContact O-N 2.87Å; L223-S227 PolarHBondContact O-OG 3.41Å; L224-S227 WeakPolarHBondContact O-CB 3.48Å; L224-S227 PolarHBondContact O-N 2.81Å; S227-W231 WeakPolarHBondContact O-CB 3.35Å; S227-W231 PolarHBondContact O-N 3.23Å
228	F	81.4	Confident	77.8	Confident	121 Å²	121	51.8 Å²	51.8	53%	0.531	28%	0.275	S	S	.	.	H	α-helix	trans	-66.8	-48	-179	-177.5	-103.1	0	0	0	112.4	L224 L225 A226 W230 W231 V232	L224-F228 PolarHBondContact O-N 3.04Å; L225-F228 PolarHBondContact O-N 3.45Å; A226-F228 PolarHBondContact O-N 2.94Å; F228-W230 VanDerWaalsContact C-N 3.31Å; F228-W230 PolarHBondContact O-N 3.13Å; F228-W231 HydrophobicContact CD2-CE3 4.5Å; F228-W231 PolarHBondContact O-N 2.81Å; F228-V232 HydrophobicContact CD1-CG2 4.32Å; F228-V232 HydrophobicContact CD2-CG2 4.43Å; F228-V232 HydrophobicContact CE1-CG2 3.94Å; F228-V232 HydrophobicContact CE2-CG2 4.06Å; F228-V232 HydrophobicContact CZ-CG2 3.8Å; F228-V232 WeakPolarHBondContact O-CB 3.38Å; F228-V232 WeakPolarHBondContact O-CG2 3.17Å; F228-V232 PolarHBondContact O-N 2.93Å
229	V	82.4	Confident	77.5	Confident	10 Å²	10	51.4 Å²	51.4	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-65.4	-35.3	178.4	173.7	0	0	0	0	111.4	I125 A128 F129 L225 S233	I125-V229 HydrophobicContact CG1-CG1 4.45Å; I125-V229 HydrophobicContact CG2-CG1 4.49Å; A128-V229 HydrophobicContact CB-CG2 3.72Å; F129-V229 HydrophobicContact CD2-CG1 4.35Å; F129-V229 HydrophobicContact CE2-CG1 3.65Å; F129-V229 HydrophobicContact CZ-CG1 3.92Å; L225-V229 HydrophobicContact CD1-CG2 4.11Å; L225-V229 HydrophobicContact CG-CG2 4.26Å; L225-V229 WeakPolarHBondContact O-CB 3.42Å; L225-V229 VanDerWaalsContact O-CG2 3.29Å; L225-V229 WeakPolarHBondContact O-CG2 3.4Å; L225-V229 PolarHBondContact O-N 3.26Å; V229-S233 WeakPolarHBondContact O-CB 3.21Å; V229-S233 PolarHBondContact O-N 3.31Å
230	W	83.6	Confident	77.3	Confident	9 Å²	9	51.2 Å²	51.2	3%	0.034	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-49.8	171.3	178.2	85.5	0	0	0	111.7	D165 R196 L197 V200 A226 F228 V232 S233 F234	D165-W230 PolarHBondContact OD2-NE1 3.12Å; R196-W230 HydrophobicContact CB-CH2 4.36Å; R196-W230 HydrophobicContact CB-CZ2 3.87Å; L197-W230 HydrophobicContact CB-CE3 4.3Å; L197-W230 HydrophobicContact CB-CH2 3.98Å; L197-W230 HydrophobicContact CB-CZ3 3.8Å; L197-W230 HydrophobicContact CD1-CD2 4.26Å; L197-W230 HydrophobicContact CD1-CE3 3.71Å; L197-W230 HydrophobicContact CD1-CZ3 4.05Å; L197-W230 HydrophobicContact CD2-CZ3 4.39Å; L197-W230 HydrophobicContact CG-CE3 4.44Å; L197-W230 HydrophobicContact CG-CZ3 4.29Å; V200-W230 HydrophobicContact CG1-CG 4.45Å; A226-W230 WeakPolarHBondContact O-CB 3.4Å; A226-W230 PolarHBondContact O-N 3.24Å; F228-W230 VanDerWaalsContact C-N 3.31Å; F228-W230 PolarHBondContact O-N 3.13Å; W230-V232 PolarHBondContact O-N 3.46Å; W230-S233 CarbonylContact O-C 3.25Å; W230-S233 WeakPolarHBondContact O-CB 3.46Å; W230-S233 PolarHBondContact O-N 3.12Å; W230-S233 VanDerWaalsContact O-N 3.14Å; W230-F234 HydrophobicContact CH2-CD2 4.38Å; W230-F234 HydrophobicContact CH2-CG 4.37Å; W230-F234 HydrophobicContact CZ2-CD2 4.01Å; W230-F234 HydrophobicContact CZ2-CG 4.33Å; W230-F234 WeakPolarHBondContact O-CB 3.47Å; W230-F234 PolarHBondContact O-N 3.15Å
231	W	79.1	Confident	77	Confident	151 Å²	151	50.5 Å²	50.5	57%	0.572	28%	0.277	S	S	*	.	H	α-helix	trans	-63.3	-43.5	-178.9	179.8	70.5	0	0	0	112.5	S227 F228 F234 T235	S227-W231 WeakPolarHBondContact O-CB 3.35Å; S227-W231 PolarHBondContact O-N 3.23Å; F228-W231 HydrophobicContact CD2-CE3 4.5Å; F228-W231 PolarHBondContact O-N 2.81Å; W231-F234 PolarHBondContact O-N 2.95Å; W231-T235 WeakPolarHBondContact O-CB 3.41Å; W231-T235 WeakPolarHBondContact O-CG2 3.42Å; W231-T235 PolarHBondContact O-N 2.86Å; W231-T235 PolarHBondContact O-OG1 3.31Å
232	V	77.6	Confident	76.4	Confident	39 Å²	39	50.3 Å²	50.3	24%	0.236	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-44.9	171.9	170.8	0	0	0	0	110.4	F228 W230 F234 T235 S236	F228-V232 HydrophobicContact CD1-CG2 4.32Å; F228-V232 HydrophobicContact CD2-CG2 4.43Å; F228-V232 HydrophobicContact CE1-CG2 3.94Å; F228-V232 HydrophobicContact CE2-CG2 4.06Å; F228-V232 HydrophobicContact CZ-CG2 3.8Å; F228-V232 WeakPolarHBondContact O-CB 3.38Å; F228-V232 WeakPolarHBondContact O-CG2 3.17Å; F228-V232 PolarHBondContact O-N 2.93Å; W230-V232 PolarHBondContact O-N 3.46Å; V232-F234 PolarHBondContact O-N 3.29Å; V232-T235 PolarHBondContact O-OG1 3.38Å; V232-S236 WeakPolarHBondContact O-CB 3.35Å; V232-S236 PolarHBondContact O-N 3.48Å; V232-S236 PolarHBondContact O-OG 3.11Å
233	S	79.2	Confident	75.6	Confident	4 Å²	4	52 Å²	52	3%	0.028	30%	0.297	C	S	.	.	H	α-helix	trans	-63.7	-39.5	177	-175	0	0	0	0	113.1	Y162 V229 W230 L237 S249	Y162-S233 WeakPolarHBondContact OH-CB 3.44Å; V229-S233 WeakPolarHBondContact O-CB 3.21Å; V229-S233 PolarHBondContact O-N 3.31Å; W230-S233 CarbonylContact O-C 3.25Å; W230-S233 WeakPolarHBondContact O-CB 3.46Å; W230-S233 PolarHBondContact O-N 3.12Å; W230-S233 VanDerWaalsContact O-N 3.14Å; S233-L237 VanDerWaalsContact O-CB 3.27Å; S233-L237 WeakPolarHBondContact O-CB 3.28Å; S233-L237 VanDerWaalsContact O-CG 3.32Å; S233-L237 WeakPolarHBondContact O-CG 3.5Å; S233-L237 PolarHBondContact O-N 3.33Å; S233-L237 WeakPolarHBondContact OG-CD1 3.34Å; S233-S249 VanDerWaalsContact OG-CB 3.24Å; S233-S249 WeakPolarHBondContact OG-CB 3.34Å
234	F	73.9	Confident	75.1	Confident	67 Å²	67	53.7 Å²	53.7	29%	0.294	31%	0.306	S	S	.	.	H	α-helix	trans	-68.5	-41.3	-178.5	-177.5	-93.2	0	0	0	111.8	W230 W231 V232	W230-F234 HydrophobicContact CH2-CD2 4.38Å; W230-F234 HydrophobicContact CH2-CG 4.37Å; W230-F234 HydrophobicContact CZ2-CD2 4.01Å; W230-F234 HydrophobicContact CZ2-CG 4.33Å; W230-F234 WeakPolarHBondContact O-CB 3.47Å; W230-F234 PolarHBondContact O-N 3.15Å; W231-F234 PolarHBondContact O-N 2.95Å; V232-F234 PolarHBondContact O-N 3.29Å
235	T	73.3	Confident	74.9	Confident	75 Å²	75	50.8 Å²	50.8	46%	0.46	29%	0.286	S	S	.	.	H	α-helix	trans	-78.1	-50.3	179.8	52	0	0	0	0	112.6	W231 V232 G238	W231-T235 WeakPolarHBondContact O-CB 3.41Å; W231-T235 WeakPolarHBondContact O-CG2 3.42Å; W231-T235 PolarHBondContact O-N 2.86Å; W231-T235 PolarHBondContact O-OG1 3.31Å; V232-T235 PolarHBondContact O-OG1 3.38Å; T235-G238 PolarHBondContact O-N 3.27Å
236	S	73.3	Confident	74.6	Confident	43 Å²	43	49 Å²	49	30%	0.301	28%	0.278	S	S	.	.	H	α-helix	trans	-76.2	-28.7	-172.2	66.1	0	0	0	0	114.6	P121 V232 G238	P121-S236 WeakPolarHBondContact CB-OG 3.29Å; V232-S236 WeakPolarHBondContact O-CB 3.35Å; V232-S236 PolarHBondContact O-N 3.48Å; V232-S236 PolarHBondContact O-OG 3.11Å; S236-G238 PolarHBondContact O-N 2.94Å; S236-G238 VanDerWaalsContact O-N 3.16Å
237	L	73.3	Confident	74.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-82.2	20.5	175	-55.8	-176.5	0	0	0	112.6	P121 L122 I125 S233 S239 L240 R245	P121-L237 HydrophobicContact CB-CD2 4.15Å; P121-L237 HydrophobicContact CG-CD2 3.86Å; L122-L237 HydrophobicContact CD2-CD1 4.02Å; L122-L237 HydrophobicContact CD2-CD2 4.01Å; L122-L237 HydrophobicContact CG-CD2 3.97Å; I125-L237 HydrophobicContact CD1-CD1 4.32Å; S233-L237 VanDerWaalsContact O-CB 3.27Å; S233-L237 WeakPolarHBondContact O-CB 3.28Å; S233-L237 VanDerWaalsContact O-CG 3.32Å; S233-L237 WeakPolarHBondContact O-CG 3.5Å; S233-L237 PolarHBondContact O-N 3.33Å; S233-L237 WeakPolarHBondContact OG-CD1 3.34Å; L237-S239 PolarHBondContact O-N 3.5Å; L237-S239 VanDerWaalsContact O-N 3.09Å; L237-L240 HydrophobicContact CB-CD1 4.29Å; L237-L240 HydrophobicContact CD2-CD1 4.21Å; L237-L240 PolarHBondContact O-N 3.36Å; L237-R245 HydrophobicContact CB-CB 4.5Å; L237-R245 HydrophobicContact CB-CG 4.05Å; L237-R245 WeakPolarHBondContact O-CD 3.47Å; L237-R245 PolarHBondContact O-NE 3.19Å
238	G	66	Low	74.3	Confident	42 Å²	42	54.7 Å²	54.7	43%	0.433	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-55	-23.6	178.6	0	0	0	0	0	115.2	T235 S236 R245	T235-G238 PolarHBondContact O-N 3.27Å; S236-G238 PolarHBondContact O-N 2.94Å; S236-G238 VanDerWaalsContact O-N 3.16Å; G238-R245 PolarHBondContact O-NH2 3.21Å
239	S	66.9	Low	74.4	Confident	49 Å²	49	49 Å²	49	34%	0.343	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-73.7	-22.1	175.8	51.9	0	0	0	0	114.9	S118 L237	S118-S239 PolarHBondContact OG-OG 3.07Å; L237-S239 PolarHBondContact O-N 3.5Å; L237-S239 VanDerWaalsContact O-N 3.09Å
240	L	69.1	Low	74.4	Confident	24 Å²	24	49.1 Å²	49.1	13%	0.126	28%	0.283	C	S	.	.	S	Bend	trans	-91.8	152.5	-175.2	-71.5	168.8	0	0	0	111.9	V114 L237 S242 R245 L248	V114-L240 HydrophobicContact CG1-CD2 3.98Å; L237-L240 HydrophobicContact CB-CD1 4.29Å; L237-L240 HydrophobicContact CD2-CD1 4.21Å; L237-L240 PolarHBondContact O-N 3.36Å; L240-S242 PolarHBondContact O-N 2.89Å; L240-R245 HydrophobicContact CB-CG 3.97Å; L240-R245 VanDerWaalsContact O-CZ 3.29Å; L240-R245 PolarHBondContact O-NE 3.4Å; L240-R245 PolarHBondContact O-NH2 3.31Å; L240-L248 HydrophobicContact CD1-CD1 3.85Å; L240-L248 HydrophobicContact CD2-CD1 4.38Å
241	P	72	Confident	74.5	Confident	79 Å²	79	54 Å²	54	51%	0.513	31%	0.31	S	S	.	.			trans	-54.7	136.3	169.7	-25.6	35.4	0	0	0	111.5	A243 L244 R245	P241-A243 VanDerWaalsContact C-N 3.28Å; P241-A243 PolarHBondContact O-N 3.17Å; P241-A243 VanDerWaalsContact O-N 3.17Å; P241-L244 HydrophobicContact CB-CD1 4.31Å; P241-L244 HydrophobicContact CB-CG 4.45Å; P241-L244 HydrophobicContact CG-CD1 4.11Å; P241-L244 PolarHBondContact O-N 3.02Å; P241-R245 PolarHBondContact O-N 3.42Å
242	S	65	Low	74.9	Confident	82 Å²	82	48.7 Å²	48.7	57%	0.573	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-39.7	-171.7	49.5	0	0	0	0	113.8	L240 L244 P246	L240-S242 PolarHBondContact O-N 2.89Å; S242-L244 VanDerWaalsContact C-N 3.32Å; S242-L244 PolarHBondContact O-N 2.95Å; S242-P246 WeakPolarHBondContact O-CD 3.47Å
243	A	65.1	Low	75.3	Confident	37 Å²	37	46.8 Å²	46.8	31%	0.306	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-24.8	177.3	0	0	0	0	0	114.3	W169 P241	W169-A243 HydrophobicContact CD2-CB 4.33Å; W169-A243 HydrophobicContact CH2-CB 4.17Å; W169-A243 HydrophobicContact CZ2-CB 3.66Å; P241-A243 VanDerWaalsContact C-N 3.28Å; P241-A243 PolarHBondContact O-N 3.17Å; P241-A243 VanDerWaalsContact O-N 3.17Å
244	L	69.4	Low	75.7	Confident	80 Å²	80	47.3 Å²	47.3	42%	0.419	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-20.8	-178.9	-67.7	178.3	0	0	0	113.3	P241 S242 L247 L248	P241-L244 HydrophobicContact CB-CD1 4.31Å; P241-L244 HydrophobicContact CB-CG 4.45Å; P241-L244 HydrophobicContact CG-CD1 4.11Å; P241-L244 PolarHBondContact O-N 3.02Å; S242-L244 VanDerWaalsContact C-N 3.32Å; S242-L244 PolarHBondContact O-N 2.95Å; L244-L247 HydrophobicContact CD2-CD2 4.32Å; L244-L247 PolarHBondContact O-N 3.47Å; L244-L248 HydrophobicContact CB-CD1 4.19Å; L244-L248 WeakPolarHBondContact O-CB 3.41Å; L244-L248 WeakPolarHBondContact O-CG 3.48Å; L244-L248 PolarHBondContact O-N 3.26Å
245	R	76.4	Confident	76.3	Confident	64 Å²	64	46.7 Å²	46.7	24%	0.242	30%	0.296	C	S	.	.	H	α-helix	trans	-55.3	-59.6	179.5	-63.2	177.1	-162	-171.5	-0.4	113	L237 G238 L240 P241 L247 L248 S249	L237-R245 HydrophobicContact CB-CB 4.5Å; L237-R245 HydrophobicContact CB-CG 4.05Å; L237-R245 WeakPolarHBondContact O-CD 3.47Å; L237-R245 PolarHBondContact O-NE 3.19Å; G238-R245 PolarHBondContact O-NH2 3.21Å; L240-R245 HydrophobicContact CB-CG 3.97Å; L240-R245 VanDerWaalsContact O-CZ 3.29Å; L240-R245 PolarHBondContact O-NE 3.4Å; L240-R245 PolarHBondContact O-NH2 3.31Å; P241-R245 PolarHBondContact O-N 3.42Å; R245-L247 VanDerWaalsContact C-N 3.28Å; R245-L247 PolarHBondContact O-N 3.19Å; R245-L248 PolarHBondContact O-N 2.91Å; R245-S249 PolarHBondContact O-N 3.32Å; R245-S249 PolarHBondContact O-OG 3.26Å; R245-S249 VanDerWaalsContact O-OG 3.07Å
246	P	76.4	Confident	77	Confident	19 Å²	19	43.3 Å²	43.3	12%	0.123	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-29.6	-176.9	27.3	-35.6	0	0	0	112.9	D165 S242 S249 G250	D165-P246 HydrophobicContact CB-CB 4.15Å; D165-P246 HydrophobicContact CB-CG 4.43Å; S242-P246 WeakPolarHBondContact O-CD 3.47Å; P246-S249 WeakPolarHBondContact CA-OG 3.47Å; P246-S249 PolarHBondContact O-OG 3.21Å; P246-G250 PolarHBondContact O-N 2.86Å
247	L	78.4	Confident	77.7	Confident	99 Å²	99	41.3 Å²	41.3	52%	0.518	26%	0.261	S	S	.	.	H	α-helix	trans	-67.7	-48	176.8	-176.3	67.5	0	0	0	111.1	L244 R245 L251	L244-L247 HydrophobicContact CD2-CD2 4.32Å; L244-L247 PolarHBondContact O-N 3.47Å; R245-L247 VanDerWaalsContact C-N 3.28Å; R245-L247 PolarHBondContact O-N 3.19Å; L247-L251 HydrophobicContact CD1-CD1 4.23Å; L247-L251 HydrophobicContact CG-CD1 4.08Å; L247-L251 WeakPolarHBondContact O-CB 3.38Å; L247-L251 VanDerWaalsContact O-CG 3.22Å; L247-L251 WeakPolarHBondContact O-CG 3.48Å; L247-L251 PolarHBondContact O-N 2.97Å
248	L	79.2	Confident	78.3	Confident	55 Å²	55	45.7 Å²	45.7	29%	0.288	28%	0.284	S	S	.	.	H	α-helix	trans	-70.8	-42.2	-179	-72.3	167.5	0	0	0	112	L122 L240 L244 R245 L251 V252	L122-L248 HydrophobicContact CD2-CB 4.35Å; L240-L248 HydrophobicContact CD1-CD1 3.85Å; L240-L248 HydrophobicContact CD2-CD1 4.38Å; L244-L248 HydrophobicContact CB-CD1 4.19Å; L244-L248 WeakPolarHBondContact O-CB 3.41Å; L244-L248 WeakPolarHBondContact O-CG 3.48Å; L244-L248 PolarHBondContact O-N 3.26Å; R245-L248 PolarHBondContact O-N 2.91Å; L248-L251 PolarHBondContact O-N 2.88Å; L248-V252 VanDerWaalsContact O-CB 3.3Å; L248-V252 WeakPolarHBondContact O-CB 3.32Å; L248-V252 VanDerWaalsContact O-CG2 3.24Å; L248-V252 WeakPolarHBondContact O-CG2 3.36Å; L248-V252 PolarHBondContact O-N 3.43Å
249	S	82.8	Confident	79.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-40.7	176.1	61.4	0	0	0	0	112.2	Y162 S233 R245 P246 G253	Y162-S249 VanDerWaalsContact CD1-OG 3.29Å; Y162-S249 WeakPolarHBondContact CD1-OG 3.47Å; Y162-S249 VanDerWaalsContact CD2-OG 3.28Å; Y162-S249 WeakPolarHBondContact CD2-OG 3.28Å; Y162-S249 VanDerWaalsContact CE1-OG 3.29Å; Y162-S249 WeakPolarHBondContact CE1-OG 3.48Å; Y162-S249 VanDerWaalsContact CE2-OG 3.29Å; Y162-S249 WeakPolarHBondContact CE2-OG 3.37Å; Y162-S249 VanDerWaalsContact CG-OG 3.3Å; Y162-S249 VanDerWaalsContact CZ-CB 3.47Å; Y162-S249 VanDerWaalsContact CZ-OG 3.3Å; S233-S249 VanDerWaalsContact OG-CB 3.24Å; S233-S249 WeakPolarHBondContact OG-CB 3.34Å; R245-S249 PolarHBondContact O-N 3.32Å; R245-S249 PolarHBondContact O-OG 3.26Å; R245-S249 VanDerWaalsContact O-OG 3.07Å; P246-S249 WeakPolarHBondContact CA-OG 3.47Å; P246-S249 PolarHBondContact O-OG 3.21Å; S249-G253 PolarHBondContact O-N 3.46Å
250	G	82.7	Confident	80.2	Confident	14 Å²	14	46.3 Å²	46.3	14%	0.144	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-45.9	175.1	0	0	0	0	0	113.4	P246 G254	P246-G250 PolarHBondContact O-N 2.86Å; G250-G254 PolarHBondContact O-N 3.09Å
251	L	84.3	Confident	80.8	Confident	112 Å²	112	46.5 Å²	46.5	59%	0.586	28%	0.275	S	S	*	.	H	α-helix	trans	-63.9	-42.5	177	-74.9	170.7	0	0	0	112.3	L247 L248 G254 A255	L247-L251 HydrophobicContact CD1-CD1 4.23Å; L247-L251 HydrophobicContact CG-CD1 4.08Å; L247-L251 WeakPolarHBondContact O-CB 3.38Å; L247-L251 VanDerWaalsContact O-CG 3.22Å; L247-L251 WeakPolarHBondContact O-CG 3.48Å; L247-L251 PolarHBondContact O-N 2.97Å; L248-L251 PolarHBondContact O-N 2.88Å; L251-G254 PolarHBondContact O-N 3.4Å; L251-A255 PolarHBondContact O-N 2.82Å
252	V	87.6	Confident	81.1	Confident	38 Å²	38	44.5 Å²	44.5	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-73.5	-36.9	-178.8	173.1	0	0	0	0	111.7	L122 A126 L248 A255 G256	L122-V252 HydrophobicContact CB-CG1 4.35Å; L122-V252 HydrophobicContact CD2-CB 4.46Å; L122-V252 HydrophobicContact CD2-CG2 4.25Å; L122-V252 WeakPolarHBondContact O-CG1 3.18Å; A126-V252 HydrophobicContact CB-CG1 3.71Å; L248-V252 VanDerWaalsContact O-CB 3.3Å; L248-V252 WeakPolarHBondContact O-CB 3.32Å; L248-V252 VanDerWaalsContact O-CG2 3.24Å; L248-V252 WeakPolarHBondContact O-CG2 3.36Å; L248-V252 PolarHBondContact O-N 3.43Å; V252-A255 PolarHBondContact O-N 3.31Å; V252-G256 PolarHBondContact O-N 3.42Å
253	G	87.1	Confident	81.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-44.2	168.9	0	0	0	0	0	112.6	S249 A255 G256 C257	S249-G253 PolarHBondContact O-N 3.46Å; G253-A255 VanDerWaalsContact C-N 3.31Å; G253-A255 PolarHBondContact O-N 2.97Å; G253-G256 WeakPolarHBondContact O-CA 3.43Å; G253-G256 PolarHBondContact O-N 3.25Å; G253-G256 VanDerWaalsContact O-N 3.09Å; G253-C257 PolarHBondContact O-N 3.19Å; G253-C257 PolarHBondContact O-SG 3.05Å
254	G	86.8	Confident	82.2	Confident	15 Å²	15	44.9 Å²	44.9	16%	0.155	26%	0.255	C	S	.	.	H	α-helix	trans	-59.6	-37.8	173.5	0	0	0	0	0	113.2	G250 L251 C257 L258	G250-G254 PolarHBondContact O-N 3.09Å; L251-G254 PolarHBondContact O-N 3.4Å; G254-C257 PolarHBondContact O-N 2.78Å; G254-L258 WeakPolarHBondContact O-CB 3.48Å; G254-L258 WeakPolarHBondContact O-CG 3.45Å; G254-L258 PolarHBondContact O-N 3.22Å
255	A	87.3	Confident	82	Confident	54 Å²	54	47.9 Å²	47.9	45%	0.446	27%	0.267	S	S	.	.	H	α-helix	trans	-65.4	-38.1	172.7	0	0	0	0	0	112.5	L251 V252 G253 L258 L259	L251-A255 PolarHBondContact O-N 2.82Å; V252-A255 PolarHBondContact O-N 3.31Å; G253-A255 VanDerWaalsContact C-N 3.31Å; G253-A255 PolarHBondContact O-N 2.97Å; A255-L258 PolarHBondContact O-N 3.15Å; A255-L259 WeakPolarHBondContact O-CB 3.44Å; A255-L259 PolarHBondContact O-N 3.49Å
256	G	88.4	Confident	81.1	Confident	3 Å²	3	52.6 Å²	52.6	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-47.3	171.6	0	0	0	0	0	112.7	V252 G253 L259 A260	V252-G256 PolarHBondContact O-N 3.42Å; G253-G256 WeakPolarHBondContact O-CA 3.43Å; G253-G256 PolarHBondContact O-N 3.25Å; G253-G256 VanDerWaalsContact O-N 3.09Å; G256-L259 PolarHBondContact O-N 3.09Å; G256-A260 PolarHBondContact O-N 3.34Å
257	C	88.3	Confident	80.1	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.007	31%	0.305	C	S	.	.	H	α-helix	trans	-62.7	-43.4	174.8	-62.9	0	0	0	0	112.6	T133 L155 P158 G253 G254 L259 A260 L261	T133-C257 WeakPolarHBondContact OG1-CA 3.49Å; T133-C257 PolarHBondContact OG1-SG 3.19Å; L155-C257 HydrophobicContact CD2-CB 3.61Å; P158-C257 WeakPolarHBondContact CG-SG 3.29Å; G253-C257 PolarHBondContact O-N 3.19Å; G253-C257 PolarHBondContact O-SG 3.05Å; G254-C257 PolarHBondContact O-N 2.78Å; C257-L259 VanDerWaalsContact C-N 3.33Å; C257-L259 PolarHBondContact O-N 3.34Å; C257-A260 PolarHBondContact O-N 3.49Å; C257-L261 WeakPolarHBondContact O-CG 3.43Å; C257-L261 PolarHBondContact O-N 3.23Å
258	L	86.1	Confident	78.4	Confident	93 Å²	93	59.7 Å²	59.7	49%	0.487	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-39.7	176	-79.5	170.8	0	0	0	112	L155 G254 A255 A262	L155-L258 HydrophobicContact CD1-CD2 3.75Å; L155-L258 HydrophobicContact CD1-CG 4.45Å; L155-L258 HydrophobicContact CD2-CD2 3.82Å; L155-L258 HydrophobicContact CD2-CG 3.75Å; L155-L258 HydrophobicContact CG-CD2 4.46Å; G254-L258 WeakPolarHBondContact O-CB 3.48Å; G254-L258 WeakPolarHBondContact O-CG 3.45Å; G254-L258 PolarHBondContact O-N 3.22Å; A255-L258 PolarHBondContact O-N 3.15Å; L258-A262 WeakPolarHBondContact O-CB 3.43Å; L258-A262 PolarHBondContact O-N 3.43Å
259	L	86.3	Confident	76.7	Confident	100 Å²	100	61.5 Å²	61.5	52%	0.524	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-43.7	176.8	-176.1	63.8	0	0	0	111.3	F130 A255 G256 C257 A262 L263	F130-L259 HydrophobicContact CD2-CB 4.16Å; F130-L259 HydrophobicContact CD2-CD2 4.12Å; F130-L259 HydrophobicContact CD2-CG 4.1Å; F130-L259 HydrophobicContact CE2-CB 4.43Å; F130-L259 HydrophobicContact CE2-CD2 4.16Å; F130-L259 HydrophobicContact CE2-CG 3.97Å; A255-L259 WeakPolarHBondContact O-CB 3.44Å; A255-L259 PolarHBondContact O-N 3.49Å; G256-L259 PolarHBondContact O-N 3.09Å; C257-L259 VanDerWaalsContact C-N 3.33Å; C257-L259 PolarHBondContact O-N 3.34Å; L259-A262 PolarHBondContact O-N 3.48Å; L259-L263 WeakPolarHBondContact O-CG 3.36Å; L259-L263 PolarHBondContact O-N 3.17Å
260	A	85.6	Confident	74.2	Confident	3 Å²	3	72 Å²	72	3%	0.025	37%	0.365	C	S	.	.	H	α-helix	trans	-62.2	-47.6	176	0	0	0	0	0	112.5	F130 T133 G256 C257 A262 L263 D264	F130-A260 HydrophobicContact CD2-CB 3.7Å; F130-A260 HydrophobicContact CE2-CB 4Å; F130-A260 HydrophobicContact CG-CB 4.38Å; T133-A260 HydrophobicContact CG2-CB 3.59Å; G256-A260 PolarHBondContact O-N 3.34Å; C257-A260 PolarHBondContact O-N 3.49Å; A260-A262 VanDerWaalsContact C-N 3.34Å; A260-A262 PolarHBondContact O-N 3.28Å; A260-L263 PolarHBondContact O-N 2.91Å; A260-D264 PolarHBondContact O-N 2.84Å
261	L	81.9	Confident	71.8	Confident	29 Å²	29	76.9 Å²	76.9	15%	0.152	38%	0.384	C	S	.	.	H	α-helix	trans	-65.7	-35	176.7	-69	175.3	0	0	0	112.4	T133 T137 L155 C257 H265	T133-L261 HydrophobicContact CG2-CD2 4.13Å; T133-L261 HydrophobicContact CG2-CG 3.98Å; T137-L261 HydrophobicContact CG2-CD2 3.94Å; L155-L261 HydrophobicContact CD2-CD1 3.89Å; L155-L261 HydrophobicContact CG-CD1 4.03Å; C257-L261 WeakPolarHBondContact O-CG 3.43Å; C257-L261 PolarHBondContact O-N 3.23Å; L261-H265 WeakPolarHBondContact O-CB 3.08Å; L261-H265 PolarHBondContact O-N 2.82Å; L261-H265 VanDerWaalsContact O-N 3.11Å
262	A	78.6	Confident	69.2	Low	37 Å²	37	75.3 Å²	75.3	31%	0.306	39%	0.387	S	S	.	.	H	α-helix	trans	-66.8	-40.1	174.3	0	0	0	0	0	111.7	L258 L259 A260 H265 F266	L258-A262 WeakPolarHBondContact O-CB 3.43Å; L258-A262 PolarHBondContact O-N 3.43Å; L259-A262 PolarHBondContact O-N 3.48Å; A260-A262 VanDerWaalsContact C-N 3.34Å; A260-A262 PolarHBondContact O-N 3.28Å; A262-H265 PolarHBondContact O-N 3.48Å; A262-F266 HydrophobicContact CB-CD2 4.44Å; A262-F266 WeakPolarHBondContact O-CB 3.45Å; A262-F266 VanDerWaalsContact O-CD2 3.28Å; A262-F266 WeakPolarHBondContact O-CD2 3.38Å; A262-F266 PolarHBondContact O-N 3.45Å
263	L	79.4	Confident	66.4	Low	67 Å²	67	78.1 Å²	78.1	35%	0.351	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-45.2	175.6	-70.6	-179.8	0	0	0	112	F130 L259 A260 H265 F266 F267	F130-L263 HydrophobicContact CE2-CD1 3.71Å; F130-L263 HydrophobicContact CZ-CD1 3.75Å; L259-L263 WeakPolarHBondContact O-CG 3.36Å; L259-L263 PolarHBondContact O-N 3.17Å; A260-L263 PolarHBondContact O-N 2.91Å; L263-H265 PolarHBondContact O-N 3.28Å; L263-F266 PolarHBondContact O-N 3.18Å; L263-F267 HydrophobicContact CD2-CD2 3.82Å; L263-F267 HydrophobicContact CD2-CE2 3.66Å; L263-F267 WeakPolarHBondContact O-CA 3.31Å; L263-F267 WeakPolarHBondContact O-CB 3.45Å; L263-F267 PolarHBondContact O-N 2.7Å
264	D	72.8	Confident	63.7	Low	60 Å²	60	85.9 Å²	85.9	32%	0.321	45%	0.447	S	S	.	.	H	α-helix	trans	-63.5	-24.8	176.1	-169	51.8	0	0	0	112.4	R141 A260	R141-D264 IonicContact NH2-OD1 3.58Å; R141-D264 PolarHBondContact NH2-OD1 3.35Å; A260-D264 PolarHBondContact O-N 2.84Å
265	H	65.4	Low	61	Low	143 Å²	143	93.6 Å²	93.6	66%	0.662	48%	0.478	S	S	*	.	H	α-helix	trans	-86.3	-41	175.7	-167.2	66.2	0	0	0	114.2	L261 A262 L263	L261-H265 WeakPolarHBondContact O-CB 3.08Å; L261-H265 PolarHBondContact O-N 2.82Å; L261-H265 VanDerWaalsContact O-N 3.11Å; A262-H265 PolarHBondContact O-N 3.48Å; L263-H265 PolarHBondContact O-N 3.28Å
266	F	57.9	Low	58.3	Low	163 Å²	163	96.6 Å²	96.6	72%	0.715	49%	0.494	S	S	*	.	H	α-helix	trans	-78.1	-41.2	178.7	-84.4	-68	0	0	0	112.5	A262 L263 Q268	A262-F266 HydrophobicContact CB-CD2 4.44Å; A262-F266 WeakPolarHBondContact O-CB 3.45Å; A262-F266 VanDerWaalsContact O-CD2 3.28Å; A262-F266 WeakPolarHBondContact O-CD2 3.38Å; A262-F266 PolarHBondContact O-N 3.45Å; L263-F266 PolarHBondContact O-N 3.18Å; F266-Q268 PolarHBondContact O-N 3.29Å
267	F	56.5	Low	55.4	Low	102 Å²	102	108.1 Å²	108.1	45%	0.447	54%	0.536	S	S	.	.	S	Bend	trans	-96.6	81.6	170.5	-60.2	-82.7	0	0	0	108	L59 L263 I269	L59-F267 HydrophobicContact CD2-CD1 3.97Å; L59-F267 HydrophobicContact CD2-CE1 3.5Å; L59-F267 VanDerWaalsContact CD2-CE1 3.5Å; L59-F267 HydrophobicContact CD2-CE2 4.21Å; L59-F267 HydrophobicContact CD2-CZ 3.63Å; L263-F267 HydrophobicContact CD2-CD2 3.82Å; L263-F267 HydrophobicContact CD2-CE2 3.66Å; L263-F267 WeakPolarHBondContact O-CA 3.31Å; L263-F267 WeakPolarHBondContact O-CB 3.45Å; L263-F267 PolarHBondContact O-N 2.7Å; F267-I269 PolarHBondContact O-N 2.91Å
268	Q	42.4	Very low	52.5	Low	165 Å²	165	116.3 Å²	116.3	77%	0.771	58%	0.579	S	S	*	*			trans	-59	95.5	159	-73.6	-170.5	-2.6	0	0	107.8	F266 R270	F266-Q268 PolarHBondContact O-N 3.29Å; Q268-R270 VanDerWaalsContact C-N 3.26Å; Q268-R270 PolarHBondContact O-N 3.4Å
269	I	42	Very low	49.6	Very low	92 Å²	92	116.3 Å²	116.3	47%	0.472	59%	0.587	S	S	.	*			trans	-63.2	95.4	170.4	-61.9	173.2	0	0	0	105.6	F267 E271	F267-I269 PolarHBondContact O-N 2.91Å; I269-E271 VanDerWaalsContact C-N 3.31Å; I269-E271 PolarHBondContact O-N 3.29Å
270	R	30.6	Very low	46.9	Very low	220 Å²	220	117 Å²	117	83%	0.83	60%	0.6	S	S	*	*			trans	-70.7	91.2	-179.8	-175.5	179.8	-177.7	-178.4	1	108.4	Q268	Q268-R270 VanDerWaalsContact C-N 3.26Å; Q268-R270 PolarHBondContact O-N 3.4Å
271	E	33.7	Very low	44.2	Very low	118 Å²	118	120.8 Å²	120.8	55%	0.551	64%	0.639	S	S	*	*			trans	-50.4	141.4	160.7	-73	165.6	173.6	0	0	109.1	R141 I269	R141-E271 WeakPolarHBondContact CD-OE1 3.35Å; R141-E271 IonicContact CZ-OE1 3.22Å; R141-E271 IonicContact NE-OE1 3.64Å; R141-E271 VanDerWaalsContact NH1-CD 3.29Å; R141-E271 IonicContact NH1-OE1 3.37Å; R141-E271 PolarHBondContact NH1-OE1 2.99Å; R141-E271 IonicContact NH1-OE2 3.77Å; I269-E271 VanDerWaalsContact C-N 3.31Å; I269-E271 PolarHBondContact O-N 3.29Å
272	A	29.1	Very low	41.6	Very low	79 Å²	79	124.4 Å²	124.4	65%	0.653	67%	0.673	S	S	*	*			trans	-61.9	145.3	173.8	0	0	0	0	0	109.2	L274	A272-L274 PolarHBondContact O-N 2.96Å
273	P	28.7	Very low	39.5	Very low	96 Å²	96	130.6 Å²	130.6	62%	0.623	70%	0.696	S	S	*	*			trans	-71.4	101.8	-171.3	-15.8	30.9	0	0	0	111.9	H275	P273-H275 PolarHBondContact O-N 2.94Å
274	L	30	Very low	36.9	Very low	163 Å²	163	136.8 Å²	136.8	85%	0.853	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-67.6	122.1	156	-85.4	82.6	0	0	0	108	A272 P276	A272-L274 PolarHBondContact O-N 2.96Å; L274-P276 WeakPolarHBondContact O-CD 3.4Å
275	H	29.5	Very low	34.8	Very low	177 Å²	177	141.7 Å²	141.7	82%	0.819	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-77.6	121.4	174.6	-90.3	-96.8	0	0	0	110.8	P273	P273-H275 PolarHBondContact O-N 2.94Å
276	P	31.9	Very low	33.1	Very low	118 Å²	118	140.3 Å²	140.3	77%	0.766	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-76.9	140.1	166	31.7	-32.6	0	0	0	110.4	L274	L274-P276 WeakPolarHBondContact O-CD 3.4Å
277	R	26.6	Very low	31.7	Very low	244 Å²	244	138.2 Å²	138.2	92%	0.921	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-63.7	132.8	165.2	-72.1	-177.6	175.6	-174.1	-0.7	109.9
278	L	28.4	Very low	30.4	Very low	173 Å²	173	139.1 Å²	139.1	91%	0.906	76%	0.759	S	S	*	*			trans	-160.7	165.2	150.3	-111.9	159.6	0	0	0	110.6
279	S	25	Very low	29.7	Very low	94 Å²	94	138.2 Å²	138.2	66%	0.657	76%	0.758	S	S	*	*			trans	-101.1	157.2	-156.2	53.2	0	0	0	0	115.5
280	S	29.4	Very low	29.5	Very low	115 Å²	115	144.9 Å²	144.9	80%	0.804	78%	0.777	S	S	*	*			trans	59	115.5	151.8	61	0	0	0	0	120.2
281	G	28.6	Very low	29.6	Very low	82 Å²	82	139.6 Å²	139.6	85%	0.845	77%	0.772	S	S	*	*				107.3	69.2	116.8	0	0	0	0	0	119.7
282	A	26.7	Very low	29.2	Very low	104 Å²	104	145.4 Å²	145.4	86%	0.86	79%	0.788	S	S	*	*			trans	-159.9	138.8	147.6	0	0	0	0	0	110.9
283	E	34.7	Very low	29.3	Very low	167 Å²	167	153.5 Å²	153.5	78%	0.78	80%	0.802	S	S	*	*			trans	-84.5	137.7	163.1	-71	-172.7	97.2	0	0	109.9	K285	E283-K285 IonicContact OE1-NZ 3.5Å
284	E	25.1	Very low	29.2	Very low	197 Å²	197	160.9 Å²	160.9	92%	0.921	82%	0.818	S	S	*	*			trans	-146.3	143.9	153.3	-161.5	165.3	-145.2	0	0	111.3
285	K	27.7	Very low	29.1	Very low	163 Å²	163	158.8 Å²	158.8	71%	0.709	82%	0.817	S	S	*	*			trans	-108.6	115.6	-167.5	-73.4	169.5	-179.4	158.3	0	112.5	E283	E283-K285 IonicContact OE1-NZ 3.5Å
286	V	30.7	Very low	28.9	Very low	114 Å²	114	156.2 Å²	156.2	69%	0.691	82%	0.818	S	S	*	*			trans	49.5	126.6	133	-177.1	0	0	0	0	118.9	V288	V286-V288 HydrophobicContact CG1-CG2 3.76Å
287	P	29.2	Very low	28.6	Very low	119 Å²	119	155.7 Å²	155.7	77%	0.773	82%	0.816	S	S	*	*			trans	-123.8	116.5	131.9	34	-26.6	0	0	0	112.8
288	V	29	Very low	28.5	Very low	121 Å²	121	151 Å²	151	73%	0.733	81%	0.814	S	S	*	*			trans	-77.7	125.4	171.1	171.2	0	0	0	0	110	V286	V286-V288 HydrophobicContact CG1-CG2 3.76Å
289	I	27.9	Very low	28.4	Very low	147 Å²	147	147.4 Å²	147.4	75%	0.754	80%	0.804	S	S	*	*			trans	-125	105.5	173.2	-56.5	-179.7	0	0	0	110.2
290	R	37.1	Very low	28.6	Very low	232 Å²	232	149.9 Å²	149.9	88%	0.875	81%	0.809	S	S	*	*			trans	-96.6	127.9	158.4	-70	174.1	170.3	160.1	-3.9	106.9
291	P	32.9	Very low	28.4	Very low	109 Å²	109	147.9 Å²	147.9	71%	0.708	81%	0.806	S	S	*	*				-149.8	-177.1	92.9	44.2	-28.4	0	0	0	111.9
292	R	25.8	Very low	28.4	Very low	240 Å²	240	151.5 Å²	151.5	91%	0.906	80%	0.801	S	S	*	*			cis	-152.3	155.6	-5	-139.7	166.5	-177.2	152	1.1	108.1
293	R	29.5	Very low	28.4	Very low	248 Å²	248	153.3 Å²	153.3	94%	0.936	80%	0.801	S	S	*	*			trans	-87.1	138.2	162.3	-79.3	-171.8	175	-169.9	0.2	110.9
294	R	27	Very low	28.2	Very low	252 Å²	252	149.7 Å²	149.7	95%	0.951	80%	0.8	S	S	*	*			trans	-135.8	128.3	148.2	-90.2	-165.1	171.8	-150.6	-1.9	108.5
295	S	27.8	Very low	28.3	Very low	119 Å²	119	145.1 Å²	145.1	83%	0.832	80%	0.796	S	S	*	*			trans	-112.4	138.6	173.8	49.5	0	0	0	0	109.3
296	S	26.6	Very low	28.3	Very low	122 Å²	122	142.1 Å²	142.1	85%	0.853	80%	0.796	S	S	*	*			trans	-144.9	95.1	166.9	54.5	0	0	0	0	109.5
297	C	25	Very low	28	Very low	108 Å²	108	146.4 Å²	146.4	73%	0.73	80%	0.801	S	S	*	*			trans	-93.4	138.1	159.4	49.7	0	0	0	0	108.5
298	V	25.3	Very low	28	Very low	144 Å²	144	151.8 Å²	151.8	87%	0.873	81%	0.807	S	S	*	*			trans	-135.3	136.3	165.8	178.3	0	0	0	0	106.2
299	S	25.2	Very low	27.8	Very low	98 Å²	98	149.7 Å²	149.7	69%	0.685	81%	0.811	S	S	*	*			trans	-137.2	146.1	-173.2	-59.8	0	0	0	0	111.9
300	L	30.4	Very low	27.7	Very low	147 Å²	147	148.1 Å²	148.1	77%	0.77	81%	0.812	S	S	*	*			trans	67.5	167.6	151.3	-98.5	74.5	0	0	0	121.3	E302	L300-E302 WeakPolarHBondContact CD2-OE1 3.46Å
301	G	24.5	Very low	27.3	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	81%	0.812	S	S	*	*			trans	119.2	82.2	-173	0	0	0	0	0	111
302	E	28.8	Very low	27	Very low	158 Å²	158	146.4 Å²	146.4	74%	0.738	82%	0.815	S	S	*	*			cis	74.9	110.8	20.5	-165.8	-174.5	-104.2	0	0	116.1	L300	L300-E302 WeakPolarHBondContact CD2-OE1 3.46Å
303	T	27.2	Very low	27.1	Very low	142 Å²	142	142.9 Å²	142.9	87%	0.871	81%	0.812	S	S	*	*			trans	-167.1	148.9	148.1	39.6	0	0	0	0	109.2
304	A	30.2	Very low	27.1	Very low	91 Å²	91	140 Å²	140	75%	0.752	81%	0.807	S	S	*	*			cis	-168.3	162.5	-23.9	0	0	0	0	0	110.9
305	A	27.3	Very low	27.2	Very low	101 Å²	101	138.8 Å²	138.8	84%	0.835	80%	0.802	S	S	*	*			trans	77.9	133.6	169.6	0	0	0	0	0	118.6
306	S	26.4	Very low	27.2	Very low	100 Å²	100	143.7 Å²	143.7	70%	0.699	80%	0.803	S	S	*	*			cis	-161.3	170.2	-9.8	52	0	0	0	0	113.4
307	Y	26	Very low	27.2	Very low	204 Å²	204	144.1 Å²	144.1	80%	0.8	80%	0.803	S	S	*	*			trans	90	96.3	171.6	-76.1	-86.8	0	0	0	120.9
308	Y	27.8	Very low	27.3	Very low	232 Å²	232	143.8 Å²	143.8	91%	0.91	80%	0.801	S	S	*	*			trans	55.5	122.2	138.2	-89	-96	0	0	0	122.6
309	G	26	Very low	27.6	Very low	78 Å²	78	142.8 Å²	142.8	80%	0.804	79%	0.79	S	S	*	*			trans	139.2	95.4	165.6	0	0	0	0	0	112.2
310	S	26.1	Very low	27.8	Very low	113 Å²	113	142.5 Å²	142.5	79%	0.79	79%	0.786	S	S	*	*			trans	-120.3	98.8	-170.1	-170	0	0	0	0	113.7
311	C	26.9	Very low	28	Very low	127 Å²	127	138.3 Å²	138.3	86%	0.858	77%	0.768	S	S	*	*			trans	-83.1	134.1	167.5	-59.7	0	0	0	0	110.5
312	K	28.4	Very low	28.6	Very low	178 Å²	178	139.7 Å²	139.7	77%	0.774	76%	0.758	S	S	*	*			trans	-104.2	114.8	175.8	-74.8	-178.3	179.1	173.8	0	111.3	F314	K312-F314 PolarHBondContact O-N 3.3Å
313	I	28	Very low	28.8	Very low	166 Å²	166	134.1 Å²	134.1	85%	0.851	74%	0.736	S	S	*	*			trans	-73.7	119.7	174.5	-61.6	169.9	0	0	0	109.9
314	F	29	Very low	29.3	Very low	189 Å²	189	136.4 Å²	136.4	83%	0.829	73%	0.729	S	S	*	*			trans	-104.3	162.7	165.2	-92.8	-89.7	0	0	0	111.4	K312	K312-F314 PolarHBondContact O-N 3.3Å
315	R	27.8	Very low	29.6	Very low	225 Å²	225	138.6 Å²	138.6	85%	0.849	72%	0.724	S	S	*	*			trans	-106.7	136.1	-177.5	-68.7	177.5	172.7	169.7	-1.9	111.1
316	R	28.6	Very low	30.2	Very low	223 Å²	223	138.6 Å²	138.6	84%	0.842	71%	0.706	S	S	*	*			trans	29.3	125.2	158.1	-65.4	-170.2	-179.8	-152.9	-2.1	117.4
317	P	27.2	Very low	30.8	Very low	131 Å²	131	138 Å²	138	85%	0.851	69%	0.694	S	S	*	*				-105.4	-158.9	100.1	31.9	-36.2	0	0	0	112.3
318	S	27	Very low	31.4	Very low	100 Å²	100	133.4 Å²	133.4	70%	0.699	68%	0.682	S	S	*	*			trans	-127.8	149.8	-162.3	49.9	0	0	0	0	113
319	L	30.1	Very low	31.6	Very low	123 Å²	123	127.3 Å²	127.3	64%	0.644	66%	0.664	S	S	*	*			trans	67.7	132.9	163.4	-63.2	160.3	0	0	0	117.9
320	P	29.8	Very low	32.1	Very low	92 Å²	92	131.8 Å²	131.8	60%	0.597	66%	0.657	S	S	*	*			trans	-95.3	92	144.8	34.7	-25	0	0	0	109.2	K896	P320-K896 HydrophobicContact CG-CG 4.24Å
321	C	34.4	Very low	32.5	Very low	59 Å²	59	130.5 Å²	130.5	40%	0.399	64%	0.641	S	S	.	*			trans	-144.5	118.2	161.4	57.8	0	0	0	0	106.7	S323	C321-S323 PolarHBondContact O-N 3.34Å
322	I	38.5	Very low	32.7	Very low	102 Å²	102	133.5 Å²	133.5	52%	0.523	64%	0.635	S	S	.	*			trans	-67.1	107.1	-169.5	-61.3	174.1	0	0	0	108.9
323	S	32.1	Very low	33	Very low	41 Å²	41	128.8 Å²	128.8	29%	0.287	62%	0.618	S	S	.	*			trans	-87.4	151	178.6	99.3	0	0	0	0	111.1	C321 E325 Q326 M327	C321-S323 PolarHBondContact O-N 3.34Å; S323-E325 VanDerWaalsContact CB-OE2 3.28Å; S323-E325 WeakPolarHBondContact CB-OE2 3.43Å; S323-E325 PolarHBondContact O-N 3.11Å; S323-E325 PolarHBondContact OG-N 3.36Å; S323-E325 PolarHBondContact OG-OE2 3.29Å; S323-Q326 PolarHBondContact O-N 3.18Å; S323-Q326 VanDerWaalsContact O-N 3.08Å; S323-Q326 PolarHBondContact OG-N 2.96Å; S323-M327 PolarHBondContact O-N 3.2Å; S323-M327 VanDerWaalsContact O-N 3.14Å
324	R	37.8	Very low	33.4	Very low	189 Å²	189	126.1 Å²	126.1	71%	0.713	61%	0.605	S	S	*	*	H	α-helix	trans	-62.5	-29.7	-179.6	-176.7	175.7	171.4	-174.8	-2.3	112.4	M327 I328	R324-M327 PolarHBondContact O-N 3.02Å; R324-I328 HydrophobicContact CG-CD1 4.25Å; R324-I328 WeakPolarHBondContact O-CG1 3.48Å; R324-I328 PolarHBondContact O-N 3.35Å; R324-I328 VanDerWaalsContact O-N 3.14Å
325	E	37	Very low	33.6	Very low	137 Å²	137	123.2 Å²	123.2	64%	0.64	59%	0.592	S	S	*	*	H	α-helix	trans	-67.9	-36.7	174.5	-55.6	76.2	-159.8	0	0	112	S323 I328 L329	S323-E325 VanDerWaalsContact CB-OE2 3.28Å; S323-E325 WeakPolarHBondContact CB-OE2 3.43Å; S323-E325 PolarHBondContact O-N 3.11Å; S323-E325 PolarHBondContact OG-N 3.36Å; S323-E325 PolarHBondContact OG-OE2 3.29Å; E325-I328 PolarHBondContact O-N 2.79Å; E325-L329 WeakPolarHBondContact O-CB 3.3Å; E325-L329 PolarHBondContact O-N 3.39Å
326	Q	39.9	Very low	33.8	Very low	102 Å²	102	118.5 Å²	118.5	48%	0.477	58%	0.579	S	S	.	*	H	α-helix	trans	-66.6	-43	173	-71.1	-176.6	-37.3	0	0	110.9	S323 I328 L329 W330	S323-Q326 PolarHBondContact O-N 3.18Å; S323-Q326 VanDerWaalsContact O-N 3.08Å; S323-Q326 PolarHBondContact OG-N 2.96Å; Q326-I328 VanDerWaalsContact C-N 3.27Å; Q326-I328 PolarHBondContact O-N 2.89Å; Q326-L329 PolarHBondContact O-N 2.77Å; Q326-W330 WeakPolarHBondContact O-CB 3.5Å; Q326-W330 PolarHBondContact O-N 3.19Å
327	M	38.3	Very low	33.9	Very low	88 Å²	88	118.1 Å²	118.1	43%	0.433	58%	0.578	S	S	.	*	H	α-helix	trans	-57.5	-38.3	176.3	-168.4	178.4	70.3	0	0	112.7	S323 R324 D331 K986	S323-M327 PolarHBondContact O-N 3.2Å; S323-M327 VanDerWaalsContact O-N 3.14Å; R324-M327 PolarHBondContact O-N 3.02Å; M327-D331 PolarHBondContact O-N 3.26Å; M327-D331 VanDerWaalsContact O-N 3.1Å; M327-K986 PolarHBondContact SD-NZ 3.25Å
328	I	37.9	Very low	33.9	Very low	106 Å²	106	121.9 Å²	121.9	54%	0.544	58%	0.577	S	S	.	*	H	α-helix	trans	-74.9	-36.1	178	-66.1	167.9	0	0	0	112	R324 E325 Q326	R324-I328 HydrophobicContact CG-CD1 4.25Å; R324-I328 WeakPolarHBondContact O-CG1 3.48Å; R324-I328 PolarHBondContact O-N 3.35Å; R324-I328 VanDerWaalsContact O-N 3.14Å; E325-I328 PolarHBondContact O-N 2.79Å; Q326-I328 VanDerWaalsContact C-N 3.27Å; Q326-I328 PolarHBondContact O-N 2.89Å
329	L	33.1	Very low	33.9	Very low	104 Å²	104	124.6 Å²	124.6	55%	0.545	58%	0.576	S	S	.	*	H	α-helix	trans	-69.5	-37.1	174.6	-166.1	69	0	0	0	111.6	E325 Q326 W332 D333	E325-L329 WeakPolarHBondContact O-CB 3.3Å; E325-L329 PolarHBondContact O-N 3.39Å; Q326-L329 PolarHBondContact O-N 2.77Å; L329-W332 VanDerWaalsContact O-CB 3.27Å; L329-W332 WeakPolarHBondContact O-CB 3.38Å; L329-W332 PolarHBondContact O-N 3.07Å; L329-D333 PolarHBondContact O-N 3.36Å
330	W	36.9	Very low	33.8	Very low	173 Å²	173	124 Å²	124	66%	0.655	58%	0.58	S	S	*	*	H	α-helix	trans	-74.5	-30.7	-179.8	-77.6	50.4	0	0	0	112.9	Q326 W332 D333 L334	Q326-W330 WeakPolarHBondContact O-CB 3.5Å; Q326-W330 PolarHBondContact O-N 3.19Å; W330-W332 PolarHBondContact O-N 3.25Å; W330-D333 PolarHBondContact O-N 3.45Å; W330-L334 WeakPolarHBondContact O-CB 3.39Å; W330-L334 PolarHBondContact O-N 2.75Å
331	D	33.7	Very low	33.9	Very low	86 Å²	86	128 Å²	128	46%	0.46	59%	0.59	S	S	.	*	H	α-helix	trans	-63.3	-24.5	169.2	-179.3	57.8	0	0	0	112.4	M327 K335	M327-D331 PolarHBondContact O-N 3.26Å; M327-D331 VanDerWaalsContact O-N 3.1Å; D331-K335 WeakPolarHBondContact O-CG 3.38Å; D331-K335 IonicContact OD1-NZ 3.47Å; D331-K335 PolarHBondContact OD1-NZ 2.75Å; D331-K335 IonicContact OD2-NZ 3.64Å; D331-K335 PolarHBondContact OD2-NZ 2.87Å
332	W	30.7	Very low	33.5	Very low	190 Å²	190	136.1 Å²	136.1	72%	0.72	61%	0.614	S	S	*	*	H	α-helix	trans	-75.6	-38.2	173.6	-146.2	-13.4	0	0	0	112.1	L329 W330	L329-W332 VanDerWaalsContact O-CB 3.27Å; L329-W332 WeakPolarHBondContact O-CB 3.38Å; L329-W332 PolarHBondContact O-N 3.07Å; W330-W332 PolarHBondContact O-N 3.25Å
333	D	35.2	Very low	33.1	Very low	79 Å²	79	140.4 Å²	140.4	42%	0.422	63%	0.632	S	S	.	*	H	α-helix	trans	-75.2	-37.3	174.7	-81	-24.2	0	0	0	112.8	L329 W330 K335 Q336 W337	L329-D333 PolarHBondContact O-N 3.36Å; W330-D333 PolarHBondContact O-N 3.45Å; D333-K335 PolarHBondContact O-N 2.94Å; D333-Q336 WeakPolarHBondContact O-CA 3.47Å; D333-Q336 WeakPolarHBondContact O-CB 3.38Å; D333-Q336 PolarHBondContact O-N 2.76Å; D333-W337 PolarHBondContact O-N 2.77Å; D333-W337 VanDerWaalsContact O-N 3.16Å
334	L	36.5	Very low	33	Very low	109 Å²	109	146.1 Å²	146.1	57%	0.571	66%	0.659	S	S	*	*	H	α-helix	trans	-61.9	-33.8	-179.4	-147.5	76	0	0	0	111.8	W330 Q336 W337 Y338	W330-L334 WeakPolarHBondContact O-CB 3.39Å; W330-L334 PolarHBondContact O-N 2.75Å; L334-Q336 PolarHBondContact O-N 3.3Å; L334-W337 PolarHBondContact O-N 3.45Å; L334-Y338 PolarHBondContact O-N 2.76Å
335	K	33.5	Very low	32.6	Very low	128 Å²	128	142.8 Å²	142.8	56%	0.557	67%	0.665	S	S	*	*	H	α-helix	trans	-67.4	-10.9	171.9	-73.6	176.6	173.3	84.2	0	114.2	D331 D333	D331-K335 WeakPolarHBondContact O-CG 3.38Å; D331-K335 IonicContact OD1-NZ 3.47Å; D331-K335 PolarHBondContact OD1-NZ 2.75Å; D331-K335 IonicContact OD2-NZ 3.64Å; D331-K335 PolarHBondContact OD2-NZ 2.87Å; D333-K335 PolarHBondContact O-N 2.94Å
336	Q	31.5	Very low	32.3	Very low	126 Å²	126	140.2 Å²	140.2	59%	0.589	68%	0.675	S	S	*	*	H	α-helix	trans	-93	-39.9	168	-55.7	-168.4	50.8	0	0	112	D333 L334 Y338	D333-Q336 WeakPolarHBondContact O-CA 3.47Å; D333-Q336 WeakPolarHBondContact O-CB 3.38Å; D333-Q336 PolarHBondContact O-N 2.76Å; L334-Q336 PolarHBondContact O-N 3.3Å; Q336-Y338 VanDerWaalsContact C-N 3.33Å; Q336-Y338 PolarHBondContact O-N 3.29Å
337	W	30.6	Very low	31.8	Very low	216 Å²	216	139.4 Å²	139.4	82%	0.818	69%	0.694	S	S	*	*	H	α-helix	trans	-65.8	-28.5	-178.3	-81	89.9	0	0	0	114.4	D333 L334 K339	D333-W337 PolarHBondContact O-N 2.77Å; D333-W337 VanDerWaalsContact O-N 3.16Å; L334-W337 PolarHBondContact O-N 3.45Å; W337-K339 VanDerWaalsContact C-N 3.3Å; W337-K339 PolarHBondContact O-N 3.19Å
338	Y	27.8	Very low	31.3	Very low	210 Å²	210	138.5 Å²	138.5	82%	0.824	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	16.2	-176.3	-125.1	-88.1	0	0	0	115.7	L334 Q336 P340	L334-Y338 PolarHBondContact O-N 2.76Å; Q336-Y338 VanDerWaalsContact C-N 3.33Å; Q336-Y338 PolarHBondContact O-N 3.29Å; Y338-P340 WeakPolarHBondContact O-CD 3.37Å
339	K	26.4	Very low	31.3	Very low	156 Å²	156	141.8 Å²	141.8	68%	0.678	73%	0.726	S	S	*	*			trans	-106.8	106	175.5	-76.1	-170.1	177.1	-178.4	0	112.6	W337 H341	W337-K339 VanDerWaalsContact C-N 3.3Å; W337-K339 PolarHBondContact O-N 3.19Å; K339-H341 PolarHBondContact O-N 3.46Å
340	P	28.3	Very low	31.7	Very low	112 Å²	112	140.4 Å²	140.4	73%	0.727	74%	0.737	S	S	*	*	S	Bend	trans	-64.3	130.8	161.4	28.2	-32.4	0	0	0	108.8	Y338	Y338-P340 WeakPolarHBondContact O-CD 3.37Å
341	H	31.1	Very low	32.6	Very low	174 Å²	174	137.9 Å²	137.9	81%	0.806	74%	0.74	S	S	*	*	S	Bend	trans	75	82.2	-168.6	-45.1	81.1	0	0	0	115.1	K339	K339-H341 PolarHBondContact O-N 3.46Å
342	Y	27.4	Very low	33.9	Very low	230 Å²	230	138.2 Å²	138.2	90%	0.902	74%	0.742	S	S	*	*				-173.1	144.7	111.9	-112.1	-86.7	0	0	0	109.5
343	Q	30.2	Very low	35.6	Very low	192 Å²	192	134 Å²	134	90%	0.897	73%	0.733	S	S	*	*			trans	-92.4	113.4	178.5	-84.2	-171.6	-41.7	0	0	112.7
344	N	29.3	Very low	37.3	Very low	161 Å²	161	133.7 Å²	133.7	86%	0.861	74%	0.737	S	S	*	*			trans	19.5	122.4	156.7	-66.8	7.4	0	0	0	121.2
345	S	29.9	Very low	39.1	Very low	120 Å²	120	132.3 Å²	132.3	84%	0.839	73%	0.733	S	S	*	*				-140.5	141.9	126.1	65.3	0	0	0	0	108.3
346	G	29.4	Very low	41.2	Very low	82 Å²	82	127.9 Å²	127.9	85%	0.845	72%	0.715	S	S	*	*			cis	-160.4	177.7	-10	0	0	0	0	0	108.4
347	G	29.2	Very low	43.3	Very low	85 Å²	85	125.5 Å²	125.5	88%	0.876	71%	0.706	S	S	*	*			cis	-174.3	-158.7	5.4	0	0	0	0	0	110.3
348	G	29.2	Very low	45.7	Very low	70 Å²	70	121.1 Å²	121.1	72%	0.722	70%	0.695	S	S	*	*	S	Bend	cis	-167.1	121.5	0.4	0	0	0	0	0	112.9
349	N	37.3	Very low	48.3	Very low	175 Å²	175	112.8 Å²	112.8	94%	0.936	67%	0.669	S	S	*	*	S	Bend	trans	-159.4	21.8	148.9	-117	-2.1	0	0	0	111.8
350	G	42	Very low	50.8	Low	74 Å²	74	109.3 Å²	109.3	76%	0.763	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-85.7	136.3	170.5	0	0	0	0	0	110
351	V	55.8	Low	53.4	Low	121 Å²	121	108.7 Å²	108.7	73%	0.733	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-74.1	128.9	168.7	177.6	0	0	0	0	107.9	L353 L356	V351-L353 PolarHBondContact O-N 3.09Å; V351-L356 HydrophobicContact CG1-CD1 4.42Å
352	D	59.8	Low	55.9	Low	93 Å²	93	105.9 Å²	105.9	50%	0.497	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-62.4	119.8	178.1	-169.8	-28.5	0	0	0	110.5	S354 V355 L356	D352-S354 VanDerWaalsContact C-N 3.26Å; D352-S354 PolarHBondContact O-N 2.7Å; D352-S354 WeakPolarHBondContact OD1-CB 3.45Å; D352-S354 PolarHBondContact OD1-N 3.48Å; D352-S354 PolarHBondContact OD1-OG 2.88Å; D352-S354 PolarHBondContact OD2-OG 3.17Å; D352-V355 HydrophobicContact CB-CB 4.22Å; D352-V355 HydrophobicContact CB-CG2 3.96Å; D352-V355 PolarHBondContact O-N 3.34Å; D352-L356 WeakPolarHBondContact O-CB 2.97Å; D352-L356 PolarHBondContact O-N 2.87Å
353	L	68.1	Low	58.7	Low	101 Å²	101	95.8 Å²	95.8	53%	0.529	59%	0.593	S	S	.	*	H	α-helix	trans	-72.2	-20.9	-176	-161	68.7	0	0	0	112.3	V351 L356 N357	V351-L353 PolarHBondContact O-N 3.09Å; L353-L356 HydrophobicContact CD1-CD2 4.16Å; L353-N357 WeakPolarHBondContact O-CB 3.44Å; L353-N357 PolarHBondContact O-N 3.44Å; L353-N357 VanDerWaalsContact O-N 3.16Å; L353-N357 PolarHBondContact O-ND2 3.28Å
354	S	69.9	Low	61.4	Low	72 Å²	72	88.8 Å²	88.8	50%	0.503	57%	0.566	S	S	.	*	H	α-helix	trans	-69.6	-52.9	172.5	69	0	0	0	0	110.5	D352 L356 N357 E358	D352-S354 VanDerWaalsContact C-N 3.26Å; D352-S354 PolarHBondContact O-N 2.7Å; D352-S354 WeakPolarHBondContact OD1-CB 3.45Å; D352-S354 PolarHBondContact OD1-N 3.48Å; D352-S354 PolarHBondContact OD1-OG 2.88Å; D352-S354 PolarHBondContact OD2-OG 3.17Å; S354-L356 VanDerWaalsContact C-N 3.29Å; S354-L356 PolarHBondContact O-N 2.91Å; S354-N357 PolarHBondContact O-N 3.11Å; S354-E358 PolarHBondContact O-N 2.68Å
355	V	73.9	Confident	64.1	Low	80 Å²	80	86.1 Å²	86.1	49%	0.485	55%	0.552	S	S	.	*	H	α-helix	trans	-59.9	-38.1	175.8	-178.3	0	0	0	0	111.4	D352 N357 E358 A359	D352-V355 HydrophobicContact CB-CB 4.22Å; D352-V355 HydrophobicContact CB-CG2 3.96Å; D352-V355 PolarHBondContact O-N 3.34Å; V355-N357 VanDerWaalsContact C-N 3.34Å; V355-N357 PolarHBondContact O-N 3.04Å; V355-E358 PolarHBondContact O-N 2.7Å; V355-A359 WeakPolarHBondContact O-CB 3.18Å; V355-A359 PolarHBondContact O-N 3.48Å
356	L	78	Confident	66.7	Low	36 Å²	36	84.3 Å²	84.3	19%	0.188	53%	0.532	C	S	.	.	H	α-helix	trans	-65.2	-36.2	175.6	-166	72.9	0	0	0	112.4	V351 D352 L353 S354 R360 M387 F390	V351-L356 HydrophobicContact CG1-CD1 4.42Å; D352-L356 WeakPolarHBondContact O-CB 2.97Å; D352-L356 PolarHBondContact O-N 2.87Å; L353-L356 HydrophobicContact CD1-CD2 4.16Å; S354-L356 VanDerWaalsContact C-N 3.29Å; S354-L356 PolarHBondContact O-N 2.91Å; L356-R360 WeakPolarHBondContact O-CB 3.39Å; L356-R360 PolarHBondContact O-N 3.08Å; L356-R360 VanDerWaalsContact O-N 3.14Å; L356-M387 HydrophobicContact CD1-CE 3.92Å; L356-M387 HydrophobicContact CD1-CG 4.35Å; L356-M387 HydrophobicContact CG-CE 4.34Å; L356-M387 WeakPolarHBondContact O-CE 3.44Å; L356-F390 HydrophobicContact CD2-CB 4.46Å
357	N	74.8	Confident	69.2	Low	75 Å²	75	82.8 Å²	82.8	40%	0.401	50%	0.504	S	S	.	.	H	α-helix	trans	-75.3	-38.8	174.8	-81.9	-27.2	0	0	0	112.5	L353 S354 V355 R360 N361	L353-N357 WeakPolarHBondContact O-CB 3.44Å; L353-N357 PolarHBondContact O-N 3.44Å; L353-N357 VanDerWaalsContact O-N 3.16Å; L353-N357 PolarHBondContact O-ND2 3.28Å; S354-N357 PolarHBondContact O-N 3.11Å; V355-N357 VanDerWaalsContact C-N 3.34Å; V355-N357 PolarHBondContact O-N 3.04Å; N357-R360 WeakPolarHBondContact O-CB 3.18Å; N357-R360 PolarHBondContact O-N 3.02Å; N357-R360 VanDerWaalsContact O-N 3.14Å; N357-N361 PolarHBondContact O-N 3.45Å
358	E	82.8	Confident	71.8	Confident	124 Å²	124	85 Å²	85	58%	0.579	49%	0.494	S	S	*	.	H	α-helix	trans	-60.5	-50.3	174.8	-175.5	176.5	-163	0	0	110.9	S354 V355 R360 N361 M362	S354-E358 PolarHBondContact O-N 2.68Å; V355-E358 PolarHBondContact O-N 2.7Å; E358-R360 PolarHBondContact O-N 2.63Å; E358-N361 WeakPolarHBondContact O-CB 3.41Å; E358-N361 PolarHBondContact O-N 3.17Å; E358-N361 VanDerWaalsContact O-N 3.11Å; E358-M362 WeakPolarHBondContact O-CG 3.32Å; E358-M362 PolarHBondContact O-N 2.98Å
359	A	80.4	Confident	74.4	Confident	35 Å²	35	84.7 Å²	84.7	29%	0.289	48%	0.477	S	S	.	.	H	α-helix	trans	-60.1	-31.5	174	0	0	0	0	0	112.5	V355 V363 M387	V355-A359 WeakPolarHBondContact O-CB 3.18Å; V355-A359 PolarHBondContact O-N 3.48Å; A359-V363 WeakPolarHBondContact O-CB 3.45Å; A359-V363 VanDerWaalsContact O-CG2 3.28Å; A359-V363 WeakPolarHBondContact O-CG2 3.39Å; A359-V363 PolarHBondContact O-N 3.24Å; A359-M387 HydrophobicContact CB-CE 3.7Å
360	R	80.3	Confident	76	Confident	84 Å²	84	82.7 Å²	82.7	32%	0.317	47%	0.473	S	S	.	.	H	α-helix	trans	-71	-36.6	176.5	-169.9	176.5	-171.6	164.4	3.4	112	L356 N357 E358 S364 M387	L356-R360 WeakPolarHBondContact O-CB 3.39Å; L356-R360 PolarHBondContact O-N 3.08Å; L356-R360 VanDerWaalsContact O-N 3.14Å; N357-R360 WeakPolarHBondContact O-CB 3.18Å; N357-R360 PolarHBondContact O-N 3.02Å; N357-R360 VanDerWaalsContact O-N 3.14Å; E358-R360 PolarHBondContact O-N 2.63Å; R360-S364 WeakPolarHBondContact O-CB 3.46Å; R360-S364 PolarHBondContact O-N 2.75Å; R360-S364 PolarHBondContact O-OG 3.24Å; R360-M387 HydrophobicContact CB-CE 3.95Å
361	N	82	Confident	77.9	Confident	99 Å²	99	83.6 Å²	83.6	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-66	-50.7	172.7	-65.7	-15.2	0	0	0	109.7	N357 E358 V363 S364 D365	N357-N361 PolarHBondContact O-N 3.45Å; E358-N361 WeakPolarHBondContact O-CB 3.41Å; E358-N361 PolarHBondContact O-N 3.17Å; E358-N361 VanDerWaalsContact O-N 3.11Å; N361-V363 VanDerWaalsContact C-N 3.33Å; N361-V363 PolarHBondContact O-N 2.78Å; N361-S364 CarbonylContact O-C 3.54Å; N361-S364 WeakPolarHBondContact O-CA 3.41Å; N361-S364 WeakPolarHBondContact O-CB 3.35Å; N361-S364 PolarHBondContact O-N 2.74Å; N361-D365 PolarHBondContact O-N 2.88Å
362	M	84.6	Confident	79.3	Confident	115 Å²	115	79.7 Å²	79.7	57%	0.567	44%	0.442	S	S	*	.	H	α-helix	trans	-54.1	-44.4	175.6	-66.8	176.8	69.5	0	0	113.3	E358 S364 D365 L366	E358-M362 WeakPolarHBondContact O-CG 3.32Å; E358-M362 PolarHBondContact O-N 2.98Å; M362-S364 VanDerWaalsContact C-N 3.29Å; M362-S364 PolarHBondContact O-N 3.46Å; M362-D365 PolarHBondContact O-N 3.09Å; M362-L366 WeakPolarHBondContact O-CB 3.41Å; M362-L366 VanDerWaalsContact O-CG 3.27Å; M362-L366 WeakPolarHBondContact O-CG 3.31Å; M362-L366 PolarHBondContact O-N 3.13Å
363	V	86.3	Confident	80.6	Confident	17 Å²	17	78.6 Å²	78.6	10%	0.103	44%	0.44	C	S	.	.	H	α-helix	trans	-67.9	-29.7	176.5	169.4	0	0	0	0	111.8	A359 N361 L367 L380 I383	A359-V363 WeakPolarHBondContact O-CB 3.45Å; A359-V363 VanDerWaalsContact O-CG2 3.28Å; A359-V363 WeakPolarHBondContact O-CG2 3.39Å; A359-V363 PolarHBondContact O-N 3.24Å; N361-V363 VanDerWaalsContact C-N 3.33Å; N361-V363 PolarHBondContact O-N 2.78Å; V363-L367 HydrophobicContact CG1-CD1 4.13Å; V363-L367 WeakPolarHBondContact O-CB 3.15Å; V363-L367 WeakPolarHBondContact O-CD1 3.32Å; V363-L367 WeakPolarHBondContact O-CG 3.36Å; V363-L367 PolarHBondContact O-N 3.16Å; V363-L367 VanDerWaalsContact O-N 3.11Å; V363-L380 HydrophobicContact CG1-CB 4.4Å; V363-L380 HydrophobicContact CG1-CD2 4.37Å; V363-L380 WeakPolarHBondContact CG1-O 3.38Å; V363-L380 HydrophobicContact CG2-CD2 4.48Å; V363-I383 HydrophobicContact CG2-CG2 4.37Å
364	S	85.9	Confident	81.1	Confident	45 Å²	45	78.9 Å²	78.9	32%	0.315	45%	0.448	S	S	.	.	H	α-helix	trans	-74.2	-42.3	175.5	-56.8	0	0	0	0	111.7	R360 N361 M362 L367 I368	R360-S364 WeakPolarHBondContact O-CB 3.46Å; R360-S364 PolarHBondContact O-N 2.75Å; R360-S364 PolarHBondContact O-OG 3.24Å; N361-S364 CarbonylContact O-C 3.54Å; N361-S364 WeakPolarHBondContact O-CA 3.41Å; N361-S364 WeakPolarHBondContact O-CB 3.35Å; N361-S364 PolarHBondContact O-N 2.74Å; M362-S364 VanDerWaalsContact C-N 3.29Å; M362-S364 PolarHBondContact O-N 3.46Å; S364-L367 CarbonylContact O-C 3.56Å; S364-L367 WeakPolarHBondContact O-CA 3.26Å; S364-L367 WeakPolarHBondContact O-CB 3.39Å; S364-L367 PolarHBondContact O-N 3.5Å; S364-L367 VanDerWaalsContact O-N 3.11Å; S364-I368 WeakPolarHBondContact O-CG1 3.29Å; S364-I368 PolarHBondContact O-N 2.84Å; S364-I368 VanDerWaalsContact O-N 3.16Å
365	D	85.6	Confident	81.5	Confident	106 Å²	106	83.1 Å²	83.1	57%	0.567	46%	0.46	S	S	*	.	H	α-helix	trans	-65	-41.5	176.4	-63.4	-31.2	0	0	0	111.3	N361 M362 L367 I368	N361-D365 PolarHBondContact O-N 2.88Å; M362-D365 PolarHBondContact O-N 3.09Å; D365-L367 VanDerWaalsContact C-N 3.3Å; D365-L367 PolarHBondContact O-N 3.26Å; D365-I368 WeakPolarHBondContact O-CB 3.4Å; D365-I368 PolarHBondContact O-N 3.33Å; D365-I368 VanDerWaalsContact O-N 3.1Å
366	L	84.9	Confident	82	Confident	82 Å²	82	82.2 Å²	82.2	43%	0.429	46%	0.455	S	S	.	.	H	α-helix	trans	-62.5	-35.3	170.8	-72	169.6	0	0	0	112.3	M362 I368 D369 L372 L380	M362-L366 WeakPolarHBondContact O-CB 3.41Å; M362-L366 VanDerWaalsContact O-CG 3.27Å; M362-L366 WeakPolarHBondContact O-CG 3.31Å; M362-L366 PolarHBondContact O-N 3.13Å; L366-I368 PolarHBondContact O-N 3.47Å; L366-D369 PolarHBondContact O-N 3.43Å; L366-L372 WeakPolarHBondContact O-CD1 3.29Å; L366-L380 HydrophobicContact CB-CD1 4Å
367	L	83.1	Confident	82.2	Confident	50 Å²	50	82.6 Å²	82.6	26%	0.262	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-7.9	175.2	-79.6	169.3	0	0	0	114	V363 S364 D365 I377 L380 R381	V363-L367 HydrophobicContact CG1-CD1 4.13Å; V363-L367 WeakPolarHBondContact O-CB 3.15Å; V363-L367 WeakPolarHBondContact O-CD1 3.32Å; V363-L367 WeakPolarHBondContact O-CG 3.36Å; V363-L367 PolarHBondContact O-N 3.16Å; V363-L367 VanDerWaalsContact O-N 3.11Å; S364-L367 CarbonylContact O-C 3.56Å; S364-L367 WeakPolarHBondContact O-CA 3.26Å; S364-L367 WeakPolarHBondContact O-CB 3.39Å; S364-L367 PolarHBondContact O-N 3.5Å; S364-L367 VanDerWaalsContact O-N 3.11Å; D365-L367 VanDerWaalsContact C-N 3.3Å; D365-L367 PolarHBondContact O-N 3.26Å; L367-I377 HydrophobicContact CD2-CB 4.49Å; L367-I377 HydrophobicContact CD2-CG2 3.9Å; L367-L380 HydrophobicContact CD1-CB 4.28Å; L367-L380 HydrophobicContact CD2-CB 3.72Å; L367-L380 HydrophobicContact CD2-CD1 4.46Å; L367-L380 HydrophobicContact CG-CB 3.88Å; L367-R381 HydrophobicContact CD2-CB 4.49Å
368	I	83.4	Confident	82.6	Confident	130 Å²	130	82.4 Å²	82.4	67%	0.667	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-18.9	174.5	-70.5	163.6	0	0	0	111.6	S364 D365 L366 P370	S364-I368 WeakPolarHBondContact O-CG1 3.29Å; S364-I368 PolarHBondContact O-N 2.84Å; S364-I368 VanDerWaalsContact O-N 3.16Å; D365-I368 WeakPolarHBondContact O-CB 3.4Å; D365-I368 PolarHBondContact O-N 3.33Å; D365-I368 VanDerWaalsContact O-N 3.1Å; L366-I368 PolarHBondContact O-N 3.47Å; I368-P370 VanDerWaalsContact O-CD 3.3Å; I368-P370 WeakPolarHBondContact O-CD 3.43Å
369	D	83.6	Confident	82.7	Confident	65 Å²	65	79.7 Å²	79.7	35%	0.348	46%	0.456	S	S	.	.			trans	-68.7	114.8	176.7	-175.7	-12.6	0	0	0	111.8	L366 S371 L372	L366-D369 PolarHBondContact O-N 3.43Å; D369-S371 VanDerWaalsContact CG-OG 3.23Å; D369-S371 PolarHBondContact O-N 2.86Å; D369-S371 VanDerWaalsContact OD1-CB 3.25Å; D369-S371 WeakPolarHBondContact OD1-CB 3.41Å; D369-S371 PolarHBondContact OD1-N 3.08Å; D369-S371 PolarHBondContact OD1-OG 3.41Å; D369-S371 PolarHBondContact OD2-OG 2.85Å; D369-L372 HydrophobicContact CB-CG 4.24Å
370	P	71.3	Confident	83	Confident	132 Å²	132	79.1 Å²	79.1	86%	0.857	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-4.8	-178.5	33.6	-37.1	0	0	0	113.9	I368	I368-P370 VanDerWaalsContact O-CD 3.3Å; I368-P370 WeakPolarHBondContact O-CD 3.43Å
371	S	81	Confident	83.2	Confident	93 Å²	93	82.7 Å²	82.7	65%	0.65	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-11	-178.6	75.3	0	0	0	0	114.3	D369	D369-S371 VanDerWaalsContact CG-OG 3.23Å; D369-S371 PolarHBondContact O-N 2.86Å; D369-S371 VanDerWaalsContact OD1-CB 3.25Å; D369-S371 WeakPolarHBondContact OD1-CB 3.41Å; D369-S371 PolarHBondContact OD1-N 3.08Å; D369-S371 PolarHBondContact OD1-OG 3.41Å; D369-S371 PolarHBondContact OD2-OG 2.85Å
372	L	85.6	Confident	83.2	Confident	40 Å²	40	81.6 Å²	81.6	21%	0.209	46%	0.461	C	S	.	.	S	Bend	trans	-71.8	141.7	-173.8	-69.2	-174.8	0	0	0	113.9	L366 D369 V376 I377 L380	L366-L372 WeakPolarHBondContact O-CD1 3.29Å; D369-L372 HydrophobicContact CB-CG 4.24Å; L372-V376 HydrophobicContact CD1-CG1 4.4Å; L372-I377 HydrophobicContact CB-CD1 4.11Å; L372-I377 HydrophobicContact CB-CG1 3.79Å; L372-I377 WeakPolarHBondContact O-CD1 3.49Å; L372-L380 HydrophobicContact CD1-CD1 3.82Å
373	P	86.3	Confident	83.1	Confident	69 Å²	69	79.9 Å²	79.9	45%	0.448	45%	0.454	S	S	.	.			trans	-62	144.8	173.4	-22.2	32.8	0	0	0	112.5	Q375 V376 I377	P373-Q375 PolarHBondContact O-N 3.46Å; P373-Q375 VanDerWaalsContact O-N 3.09Å; P373-V376 HydrophobicContact CB-CG2 4.18Å; P373-V376 HydrophobicContact CG-CG2 4.2Å; P373-V376 WeakPolarHBondContact O-CA 3.3Å; P373-V376 WeakPolarHBondContact O-CB 3.23Å; P373-V376 PolarHBondContact O-N 3.5Å; P373-I377 PolarHBondContact O-N 3.32Å; P373-I377 VanDerWaalsContact O-N 3.07Å
374	P	78.7	Confident	82.9	Confident	108 Å²	108	80.3 Å²	80.3	70%	0.701	46%	0.457	S	S	*	.	H	α-helix	trans	-61.6	-26.7	-175.3	23.3	-34	0	0	0	113.8	S378	P374-S378 WeakPolarHBondContact O-CB 3.44Å; P374-S378 PolarHBondContact O-N 3.26Å
375	Q	79.4	Confident	82.6	Confident	160 Å²	160	82.4 Å²	82.4	75%	0.748	47%	0.472	S	S	*	.	H	α-helix	trans	-69.3	-32.9	174.3	-65.3	173.6	-7.1	0	0	112.5	P373 S379	P373-Q375 PolarHBondContact O-N 3.46Å; P373-Q375 VanDerWaalsContact O-N 3.09Å; Q375-S379 PolarHBondContact O-N 3.04Å; Q375-S379 PolarHBondContact O-OG 3.16Å
376	V	83.3	Confident	82.1	Confident	62 Å²	62	82.8 Å²	82.8	38%	0.376	47%	0.473	S	S	.	.	H	α-helix	trans	-75.1	-45.3	175.1	-178.3	0	0	0	0	109.7	L372 P373 S378 S379 L380	L372-V376 HydrophobicContact CD1-CG1 4.4Å; P373-V376 HydrophobicContact CB-CG2 4.18Å; P373-V376 HydrophobicContact CG-CG2 4.2Å; P373-V376 WeakPolarHBondContact O-CA 3.3Å; P373-V376 WeakPolarHBondContact O-CB 3.23Å; P373-V376 PolarHBondContact O-N 3.5Å; V376-S378 VanDerWaalsContact C-N 3.29Å; V376-S378 PolarHBondContact O-N 3.41Å; V376-S379 WeakPolarHBondContact O-CB 3.49Å; V376-S379 PolarHBondContact O-N 3.26Å; V376-S379 VanDerWaalsContact O-N 3.1Å; V376-L380 HydrophobicContact CG1-CD1 3.97Å; V376-L380 HydrophobicContact CG1-CG 4.3Å; V376-L380 WeakPolarHBondContact O-CG 3.28Å; V376-L380 PolarHBondContact O-N 3.28Å
377	I	83.3	Confident	81.5	Confident	43 Å²	43	80.1 Å²	80.1	22%	0.221	46%	0.459	C	S	.	.	H	α-helix	trans	-57.4	-42.3	174.5	-63.2	173.3	0	0	0	111.1	L367 L372 P373 R381	L367-I377 HydrophobicContact CD2-CB 4.49Å; L367-I377 HydrophobicContact CD2-CG2 3.9Å; L372-I377 HydrophobicContact CB-CD1 4.11Å; L372-I377 HydrophobicContact CB-CG1 3.79Å; L372-I377 WeakPolarHBondContact O-CD1 3.49Å; P373-I377 PolarHBondContact O-N 3.32Å; P373-I377 VanDerWaalsContact O-N 3.07Å; I377-R381 VanDerWaalsContact O-CB 3.28Å; I377-R381 WeakPolarHBondContact O-CB 3.48Å; I377-R381 PolarHBondContact O-N 3.07Å
378	S	82.8	Confident	80.7	Confident	72 Å²	72	78.9 Å²	78.9	50%	0.503	46%	0.459	S	S	.	.	H	α-helix	trans	-59.1	-48.9	174	-170.8	0	0	0	0	111.6	P374 V376 R381 S382	P374-S378 WeakPolarHBondContact O-CB 3.44Å; P374-S378 PolarHBondContact O-N 3.26Å; V376-S378 VanDerWaalsContact C-N 3.29Å; V376-S378 PolarHBondContact O-N 3.41Å; S378-R381 PolarHBondContact O-N 3.23Å; S378-S382 PolarHBondContact O-N 3.41Å; S378-S382 PolarHBondContact O-OG 2.86Å
379	S	85.1	Confident	79.7	Confident	67 Å²	67	76.2 Å²	76.2	47%	0.469	46%	0.456	S	S	.	.	H	α-helix	trans	-61.4	-48.4	179.9	-56.6	0	0	0	0	112.2	Q375 V376 R381 S382 I383	Q375-S379 PolarHBondContact O-N 3.04Å; Q375-S379 PolarHBondContact O-OG 3.16Å; V376-S379 WeakPolarHBondContact O-CB 3.49Å; V376-S379 PolarHBondContact O-N 3.26Å; V376-S379 VanDerWaalsContact O-N 3.1Å; S379-R381 VanDerWaalsContact C-N 3.33Å; S379-R381 PolarHBondContact O-N 3.45Å; S379-S382 WeakPolarHBondContact O-CB 3.1Å; S379-S382 PolarHBondContact O-N 2.79Å; S379-I383 WeakPolarHBondContact O-CG1 3.2Å; S379-I383 PolarHBondContact O-N 2.77Å
380	L	87.4	Confident	78.4	Confident	23 Å²	23	80.3 Å²	80.3	12%	0.12	47%	0.471	C	S	.	.	H	α-helix	trans	-61.8	-38.7	177.7	-72.2	173.7	0	0	0	112.2	V363 L366 L367 L372 V376 I383 S384	V363-L380 HydrophobicContact CG1-CB 4.4Å; V363-L380 HydrophobicContact CG1-CD2 4.37Å; V363-L380 WeakPolarHBondContact CG1-O 3.38Å; V363-L380 HydrophobicContact CG2-CD2 4.48Å; L366-L380 HydrophobicContact CB-CD1 4Å; L367-L380 HydrophobicContact CD1-CB 4.28Å; L367-L380 HydrophobicContact CD2-CB 3.72Å; L367-L380 HydrophobicContact CD2-CD1 4.46Å; L367-L380 HydrophobicContact CG-CB 3.88Å; L372-L380 HydrophobicContact CD1-CD1 3.82Å; V376-L380 HydrophobicContact CG1-CD1 3.97Å; V376-L380 HydrophobicContact CG1-CG 4.3Å; V376-L380 WeakPolarHBondContact O-CG 3.28Å; V376-L380 PolarHBondContact O-N 3.28Å; L380-I383 PolarHBondContact O-N 3.49Å; L380-S384 WeakPolarHBondContact O-CB 3.41Å; L380-S384 PolarHBondContact O-N 2.95Å
381	R	83.8	Confident	77.6	Confident	159 Å²	159	76.9 Å²	76.9	60%	0.6	45%	0.45	S	S	*	.	H	α-helix	trans	-67.5	-38	176.1	-167.6	175.7	-63.6	158.8	2.5	112.2	L367 I377 S378 S379 S385	L367-R381 HydrophobicContact CD2-CB 4.49Å; I377-R381 VanDerWaalsContact O-CB 3.28Å; I377-R381 WeakPolarHBondContact O-CB 3.48Å; I377-R381 PolarHBondContact O-N 3.07Å; S378-R381 PolarHBondContact O-N 3.23Å; S379-R381 VanDerWaalsContact C-N 3.33Å; S379-R381 PolarHBondContact O-N 3.45Å; R381-S385 WeakPolarHBondContact O-CB 3.49Å; R381-S385 PolarHBondContact O-N 3.43Å
382	S	81.8	Confident	75.9	Confident	76 Å²	76	75.5 Å²	75.5	53%	0.531	45%	0.451	S	S	.	.	H	α-helix	trans	-64	-41.2	171.6	-64.6	0	0	0	0	112.2	S378 S379 S385 L386	S378-S382 PolarHBondContact O-N 3.41Å; S378-S382 PolarHBondContact O-OG 2.86Å; S379-S382 WeakPolarHBondContact O-CB 3.1Å; S379-S382 PolarHBondContact O-N 2.79Å; S382-S385 PolarHBondContact O-N 3.45Å; S382-L386 WeakPolarHBondContact O-CB 3.06Å; S382-L386 PolarHBondContact O-N 3.08Å
383	I	82.5	Confident	73.8	Confident	79 Å²	79	78.8 Å²	78.8	41%	0.405	48%	0.477	S	S	.	.	H	α-helix	trans	-62.8	-48.5	175.5	-68.9	162.7	0	0	0	110.7	V363 S379 L380 S385 L386 M387	V363-I383 HydrophobicContact CG2-CG2 4.37Å; S379-I383 WeakPolarHBondContact O-CG1 3.2Å; S379-I383 PolarHBondContact O-N 2.77Å; L380-I383 PolarHBondContact O-N 3.49Å; I383-S385 VanDerWaalsContact C-N 3.3Å; I383-S385 PolarHBondContact O-N 3.03Å; I383-L386 WeakPolarHBondContact O-CB 3.47Å; I383-L386 PolarHBondContact O-N 2.6Å; I383-L386 VanDerWaalsContact O-N 3.09Å; I383-M387 HydrophobicContact CG2-CG 4.45Å; I383-M387 HydrophobicContact CG2-SD 3.82Å; I383-M387 WeakPolarHBondContact O-CG 3.47Å; I383-M387 PolarHBondContact O-N 3.49Å
384	S	82.3	Confident	71.5	Confident	25 Å²	25	80.9 Å²	80.9	18%	0.175	49%	0.492	C	S	.	.	H	α-helix	trans	-58.2	-40.6	176.1	-173.1	0	0	0	0	112.4	L380 G388	L380-S384 WeakPolarHBondContact O-CB 3.41Å; L380-S384 PolarHBondContact O-N 2.95Å; S384-G388 PolarHBondContact O-N 2.84Å
385	S	78.6	Confident	69.3	Low	90 Å²	90	86.6 Å²	86.6	63%	0.629	50%	0.5	S	S	*	.	H	α-helix	trans	-66.2	-36.9	174.7	-168.1	0	0	0	0	113.1	R381 S382 I383 G388 A389	R381-S385 WeakPolarHBondContact O-CB 3.49Å; R381-S385 PolarHBondContact O-N 3.43Å; S382-S385 PolarHBondContact O-N 3.45Å; I383-S385 VanDerWaalsContact C-N 3.3Å; I383-S385 PolarHBondContact O-N 3.03Å; S385-G388 PolarHBondContact O-N 3.11Å; S385-A389 PolarHBondContact O-N 3.39Å
386	L	76	Confident	66.9	Low	113 Å²	113	84.7 Å²	84.7	59%	0.592	50%	0.501	S	S	*	.	H	α-helix	trans	-68.5	-44.8	177.5	-174.5	66.8	0	0	0	111.1	S382 I383 G388 A389 F390	S382-L386 WeakPolarHBondContact O-CB 3.06Å; S382-L386 PolarHBondContact O-N 3.08Å; I383-L386 WeakPolarHBondContact O-CB 3.47Å; I383-L386 PolarHBondContact O-N 2.6Å; I383-L386 VanDerWaalsContact O-N 3.09Å; L386-G388 VanDerWaalsContact C-N 3.27Å; L386-G388 PolarHBondContact O-N 3.34Å; L386-A389 WeakPolarHBondContact O-CB 3.4Å; L386-A389 PolarHBondContact O-N 2.96Å; L386-F390 HydrophobicContact CD1-CE2 4.49Å; L386-F390 HydrophobicContact CG-CE2 4.36Å; L386-F390 WeakPolarHBondContact O-CD2 3.07Å
387	M	72.5	Confident	64.3	Low	26 Å²	26	91.6 Å²	91.6	13%	0.128	53%	0.526	C	S	.	.	H	α-helix	trans	-62.2	-34.8	174.9	-65.7	170.2	73	0	0	112	L356 A359 R360 I383 A389 F390	L356-M387 HydrophobicContact CD1-CE 3.92Å; L356-M387 HydrophobicContact CD1-CG 4.35Å; L356-M387 HydrophobicContact CG-CE 4.34Å; L356-M387 WeakPolarHBondContact O-CE 3.44Å; A359-M387 HydrophobicContact CB-CE 3.7Å; R360-M387 HydrophobicContact CB-CE 3.95Å; I383-M387 HydrophobicContact CG2-CG 4.45Å; I383-M387 HydrophobicContact CG2-SD 3.82Å; I383-M387 WeakPolarHBondContact O-CG 3.47Å; I383-M387 PolarHBondContact O-N 3.49Å; M387-A389 VanDerWaalsContact C-N 3.29Å; M387-A389 PolarHBondContact O-N 3.17Å; M387-F390 PolarHBondContact O-N 3.05Å
388	G	65.1	Low	61.7	Low	25 Å²	25	97.3 Å²	97.3	26%	0.258	56%	0.555	S	S	.	*	H	α-helix	trans	-60.1	-34.3	174.8	0	0	0	0	0	114	S384 S385 L386 F390 S391	S384-G388 PolarHBondContact O-N 2.84Å; S385-G388 PolarHBondContact O-N 3.11Å; L386-G388 VanDerWaalsContact C-N 3.27Å; L386-G388 PolarHBondContact O-N 3.34Å; G388-F390 PolarHBondContact O-N 3.44Å; G388-S391 PolarHBondContact O-N 3.02Å
389	A	63.5	Low	59	Low	73 Å²	73	100.9 Å²	100.9	60%	0.603	57%	0.569	S	S	*	*	H	α-helix	trans	-66.6	-36.1	-176.9	0	0	0	0	0	113.3	S385 L386 M387 S391	S385-A389 PolarHBondContact O-N 3.39Å; L386-A389 WeakPolarHBondContact O-CB 3.4Å; L386-A389 PolarHBondContact O-N 2.96Å; M387-A389 VanDerWaalsContact C-N 3.29Å; M387-A389 PolarHBondContact O-N 3.17Å; A389-S391 VanDerWaalsContact C-N 3.26Å; A389-S391 PolarHBondContact O-N 3.11Å
390	F	55.2	Low	56.5	Low	151 Å²	151	103 Å²	103	66%	0.662	58%	0.581	S	S	*	*	H	α-helix	trans	-69.3	-21.6	-179.6	-69.6	-79.7	0	0	0	113.7	L356 L386 M387 G388 G392	L356-F390 HydrophobicContact CD2-CB 4.46Å; L386-F390 HydrophobicContact CD1-CE2 4.49Å; L386-F390 HydrophobicContact CG-CE2 4.36Å; L386-F390 WeakPolarHBondContact O-CD2 3.07Å; M387-F390 PolarHBondContact O-N 3.05Å; G388-F390 PolarHBondContact O-N 3.44Å; F390-G392 VanDerWaalsContact C-N 3.31Å; F390-G392 PolarHBondContact O-N 3.26Å
391	S	54.6	Low	53.8	Low	60 Å²	60	107.6 Å²	107.6	42%	0.42	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	-7.6	-177.2	-170.3	0	0	0	0	114.3	G388 A389	G388-S391 PolarHBondContact O-N 3.02Å; A389-S391 VanDerWaalsContact C-N 3.26Å; A389-S391 PolarHBondContact O-N 3.11Å
392	G	45.5	Very low	51.1	Low	65 Å²	65	105.8 Å²	105.8	67%	0.67	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-18.1	-172.4	0	0	0	0	0	116.1	F390	F390-G392 VanDerWaalsContact C-N 3.31Å; F390-G392 PolarHBondContact O-N 3.26Å
393	S	41.9	Very low	48.6	Very low	108 Å²	108	108 Å²	108	76%	0.755	62%	0.624	S	S	*	*	S	Bend	trans	-85.8	-12	-166.7	-162.3	0	0	0	0	115.4
394	C	39.1	Very low	46	Very low	113 Å²	113	113.3 Å²	113.3	76%	0.764	65%	0.645	S	S	*	*			trans	-125.7	79	-170.7	-63.1	0	0	0	0	111.7
395	R	31.9	Very low	43.5	Very low	229 Å²	229	118.3 Å²	118.3	86%	0.864	68%	0.677	S	S	*	*			trans	-141.6	108.2	163.5	-76.6	-165.4	176.7	-149.8	-1	110.8	K397	R395-K397 PolarHBondContact O-N 2.95Å
396	P	29.1	Very low	41.2	Very low	120 Å²	120	117.1 Å²	117.1	78%	0.779	68%	0.678	S	S	*	*			trans	-66.7	130.3	167.5	28.2	-32.5	0	0	0	109.5	I398	P396-I398 PolarHBondContact O-N 2.92Å
397	K	28.5	Very low	38.8	Very low	207 Å²	207	122 Å²	122	90%	0.9	70%	0.695	S	S	*	*			trans	-79	103.9	166.6	-83.2	-175.2	175.4	179.5	0	108.5	R395 N399	R395-K397 PolarHBondContact O-N 2.95Å; K397-N399 PolarHBondContact O-N 2.68Å
398	I	28.8	Very low	36.6	Very low	162 Å²	162	131.3 Å²	131.3	83%	0.831	73%	0.731	S	S	*	*			trans	-62.2	126.9	168.2	-60.9	170.3	0	0	0	108.2	P396	P396-I398 PolarHBondContact O-N 2.92Å
399	N	26.2	Very low	34.9	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	76%	0.755	S	S	*	*			trans	-129.1	119.3	172.1	-161.8	33.2	0	0	0	108.1	K397 L401	K397-N399 PolarHBondContact O-N 2.68Å; N399-L401 PolarHBondContact O-N 2.99Å
400	P	33.3	Very low	33	Very low	111 Å²	111	138.3 Å²	138.3	72%	0.721	77%	0.767	S	S	*	*			trans	-87.9	96.5	-164.9	32.5	-34.2	0	0	0	112.3
401	L	29.1	Very low	31.8	Very low	120 Å²	120	136.3 Å²	136.3	63%	0.628	77%	0.771	S	S	*	*			trans	-161.4	35.6	170.6	-120.4	172.4	0	0	0	118.1	N399	N399-L401 PolarHBondContact O-N 2.99Å
402	T	27.3	Very low	30.4	Very low	122 Å²	122	142.8 Å²	142.8	75%	0.748	80%	0.795	S	S	*	*			trans	-140.6	108	169.4	47.6	0	0	0	0	112.3
403	P	29.8	Very low	29.6	Very low	122 Å²	122	147.5 Å²	147.5	79%	0.792	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-79.6	141.6	161.6	33	-31.2	0	0	0	110.1
404	F	27.7	Very low	28.9	Very low	190 Å²	190	151.6 Å²	151.6	83%	0.833	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-91.1	135.9	166.9	-74.1	-94.2	0	0	0	109.3
405	P	30	Very low	28.2	Very low	131 Å²	131	153.9 Å²	153.9	85%	0.851	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-65.1	130	161.5	-15	30.1	0	0	0	109.1
406	G	30.3	Very low	28.7	Very low	64 Å²	64	148.7 Å²	148.7	66%	0.66	81%	0.811	S	S	*	*			trans	-107.8	142.5	175.8	0	0	0	0	0	111.2
407	F	25.6	Very low	28.6	Very low	216 Å²	216	147.5 Å²	147.5	95%	0.947	81%	0.812	S	S	*	*			trans	-71.3	127.4	162	-74.3	-90.9	0	0	0	109.2
408	Y	27	Very low	28.7	Very low	222 Å²	222	147 Å²	147	87%	0.871	81%	0.812	S	S	*	*			trans	-109.3	122.4	164.2	-99	-86.1	0	0	0	108.8
409	P	27.8	Very low	28.8	Very low	117 Å²	117	149 Å²	149	76%	0.76	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-64.9	135	152.8	-12.1	28.4	0	0	0	108.3
410	C	25.2	Very low	28.8	Very low	128 Å²	128	146 Å²	146	87%	0.865	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-74.2	145.7	173	-158.7	0	0	0	0	110
411	S	28.3	Very low	28.6	Very low	108 Å²	108	145.8 Å²	145.8	76%	0.755	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-82.2	132	-175.6	52.9	0	0	0	0	112.6
412	E	26.3	Very low	28.6	Very low	196 Å²	196	151 Å²	151	92%	0.916	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-66.1	162.9	157.2	-67.8	-169.4	133.9	0	0	111
413	I	29.3	Very low	28.6	Very low	165 Å²	165	152.4 Å²	152.4	85%	0.846	82%	0.819	S	S	*	*			trans	-107.7	131.6	-168.3	-164.7	154.6	0	0	0	111.3
414	E	26	Very low	28.5	Very low	194 Å²	194	152.9 Å²	152.9	91%	0.907	81%	0.814	S	S	*	*			trans	-114.8	135.8	168.8	-82.2	-166	136.6	0	0	110.5
415	D	24.8	Very low	28.6	Very low	160 Å²	160	149.4 Å²	149.4	86%	0.856	80%	0.804	S	S	*	*			trans	-108.2	145	-175.6	-154.3	31.2	0	0	0	110.1
416	P	42.6	Very low	28.6	Very low	120 Å²	120	152.4 Å²	152.4	78%	0.779	80%	0.804	S	S	*	*			trans	-102.8	133.3	-151.8	36.5	-34.6	0	0	0	117.1
417	A	27.5	Very low	28.5	Very low	96 Å²	96	152.9 Å²	152.9	79%	0.793	81%	0.809	S	S	*	*			trans	-157.9	150.5	161.2	0	0	0	0	0	110.1
418	E	29.8	Very low	28.8	Very low	195 Å²	195	151.2 Å²	151.2	91%	0.911	81%	0.809	S	S	*	*			cis	-150.7	179.9	-8.8	-137.4	-167.5	153	0	0	110.6
419	K	30.5	Very low	28.8	Very low	205 Å²	205	147.1 Å²	147.1	89%	0.891	80%	0.802	S	S	*	*			trans	-88.6	130.6	-176.6	-71.5	173.3	-179.3	164.9	0	114
420	G	27.4	Very low	28.9	Very low	85 Å²	85	151.5 Å²	151.5	88%	0.876	80%	0.804	S	S	*	*			trans	-106.8	105.4	162.4	0	0	0	0	0	112.4
421	D	27.4	Very low	29	Very low	106 Å²	106	151.6 Å²	151.6	57%	0.567	80%	0.796	S	S	*	*			trans	-96.4	126.3	-167.6	-168.1	34.5	0	0	0	113.7	K423	D421-K423 WeakPolarHBondContact OD2-CE 3.4Å; D421-K423 IonicContact OD2-NZ 2.72Å; D421-K423 PolarHBondContact OD2-NZ 3.36Å
422	R	30.3	Very low	28.9	Very low	230 Å²	230	151.9 Å²	151.9	87%	0.868	80%	0.798	S	S	*	*			trans	178.8	121.2	140.7	-91.4	141.7	-155.9	-143.4	3.8	111.3
423	K	28.2	Very low	29.7	Very low	150 Å²	150	147.8 Å²	147.8	65%	0.652	79%	0.79	S	S	*	*				77	133.3	61.8	-68.6	175.9	-178.7	150.8	0	112.3	D421	D421-K423 WeakPolarHBondContact OD2-CE 3.4Å; D421-K423 IonicContact OD2-NZ 2.72Å; D421-K423 PolarHBondContact OD2-NZ 3.36Å
424	L	26.4	Very low	30.4	Very low	133 Å²	133	145.6 Å²	145.6	70%	0.696	79%	0.787	S	S	*	*			cis	-166.1	163.9	7.3	-155.1	67.1	0	0	0	112.8
425	N	30.8	Very low	31.1	Very low	117 Å²	117	142.4 Å²	142.4	63%	0.626	78%	0.781	S	S	*	*			trans	69.5	149	157.1	-69.2	-31.9	0	0	0	118.8
426	K	28.7	Very low	31.9	Very low	193 Å²	193	139.9 Å²	139.9	84%	0.839	77%	0.773	S	S	*	*			cis	-159.6	142.6	-10.5	-121	166.5	-174.2	179	0	109.5
427	G	28.4	Very low	31.2	Very low	75 Å²	75	142.4 Å²	142.4	77%	0.773	78%	0.775	S	S	*	*			trans	-150	7.7	-173.6	0	0	0	0	0	119.3
428	L	31.3	Very low	31.4	Very low	180 Å²	180	144.5 Å²	144.5	94%	0.942	77%	0.772	S	S	*	*			trans	63	-177.9	-179.8	-125.3	72.2	0	0	0	116.3
429	N	28.4	Very low	31.5	Very low	136 Å²	136	145.8 Å²	145.8	73%	0.727	77%	0.768	S	S	*	*			trans	-153.7	138.1	-147.8	-168.8	13.6	0	0	0	114.5
430	R	30.3	Very low	31.5	Very low	210 Å²	210	147.3 Å²	147.3	79%	0.792	77%	0.768	S	S	*	*			trans	65.7	140	150.9	-100.2	-179.6	173.7	-178.4	-2.9	123
431	N	26.4	Very low	31.4	Very low	130 Å²	130	148.5 Å²	148.5	70%	0.695	76%	0.764	S	S	*	*			trans	93.7	132.3	142.4	-66	-3.6	0	0	0	122
432	S	25.7	Very low	31.6	Very low	114 Å²	114	149.7 Å²	149.7	80%	0.797	78%	0.78	S	S	*	*			trans	64.9	125.5	149.2	50.9	0	0	0	0	121.5
433	S	44.4	Very low	31.4	Very low	109 Å²	109	142 Å²	142	76%	0.762	77%	0.773	S	S	*	*			trans	-59.3	153.1	151	55.1	0	0	0	0	111.7
434	P	44.3	Very low	31.4	Very low	119 Å²	119	141.3 Å²	141.3	77%	0.773	78%	0.781	S	S	*	*				-155.9	-172.7	82.5	41.8	-21.3	0	0	0	117.4
435	T	39.7	Very low	31.4	Very low	128 Å²	128	140.8 Å²	140.8	79%	0.785	79%	0.788	S	S	*	*			trans	-49.8	165.6	164.6	-2	0	0	0	0	114.8
436	P	41.1	Very low	31.2	Very low	106 Å²	106	138.3 Å²	138.3	69%	0.688	79%	0.791	S	S	*	*				-164	178.9	82.5	42.9	-20.4	0	0	0	120.7
437	Q	29.2	Very low	31.2	Very low	173 Å²	173	137 Å²	137	81%	0.808	79%	0.792	S	S	*	*			trans	79.3	165.3	157.7	-56.2	-159.9	53	0	0	121
438	L	31.4	Very low	31.1	Very low	140 Å²	140	140.6 Å²	140.6	73%	0.733	79%	0.793	S	S	*	*				174	148.5	-58	-102.1	170.5	0	0	0	112.3
439	R	32.2	Very low	32	Very low	222 Å²	222	136.6 Å²	136.6	84%	0.838	78%	0.777	S	S	*	*			trans	81.1	155.9	146.5	-91.9	177.2	179.4	157.1	0.3	123.9
440	R	29.5	Very low	32.1	Very low	237 Å²	237	135.9 Å²	135.9	89%	0.894	78%	0.778	S	S	*	*			trans	83	146.1	165.1	-65.8	-169.9	-173.8	-156.1	2.1	117.5
441	S	25.5	Very low	32.2	Very low	111 Å²	111	132.9 Å²	132.9	78%	0.776	77%	0.773	S	S	*	*			cis	-166.8	164.7	-17.7	45.7	0	0	0	0	111.5
442	S	31.2	Very low	32.6	Very low	130 Å²	130	134.3 Å²	134.3	91%	0.909	78%	0.775	S	S	*	*			trans	-102.7	155	-173.8	-42.4	0	0	0	0	115.2
443	G	26.6	Very low	32.9	Very low	70 Å²	70	133.1 Å²	133.1	72%	0.722	77%	0.767	S	S	*	*			trans	113.3	152.8	167.1	0	0	0	0	0	115.1
444	T	28.3	Very low	32.4	Very low	134 Å²	134	132.8 Å²	132.8	82%	0.822	76%	0.764	S	S	*	*			cis	-162.5	158.4	-2.1	-41.1	0	0	0	0	110.8
445	S	26.6	Very low	31.5	Very low	122 Å²	122	137.4 Å²	137.4	85%	0.853	77%	0.767	S	S	*	*			trans	74.2	146.9	162	-53	0	0	0	0	119.3
446	G	25.3	Very low	30.9	Very low	65 Å²	65	141 Å²	141	67%	0.67	77%	0.766	S	S	*	*			cis	155.2	150.7	-14.4	0	0	0	0	0	116
447	L	30.1	Very low	30.2	Very low	166 Å²	166	141.3 Å²	141.3	87%	0.869	76%	0.758	S	S	*	*			trans	75.3	152.3	166.6	-43.8	177.1	0	0	0	117.3
448	L	26.5	Very low	30.1	Very low	150 Å²	150	141.3 Å²	141.3	79%	0.785	75%	0.751	S	S	*	*			cis	-176.3	-177.2	-19.9	-101.2	-175.1	0	0	0	107.2
449	P	48.6	Very low	29.8	Very low	96 Å²	96	140.5 Å²	140.5	62%	0.623	75%	0.747	S	S	*	*			cis	-133.5	179.9	-34.5	39.4	-23.1	0	0	0	114.5
450	V	32.1	Very low	29.5	Very low	121 Å²	121	137.2 Å²	137.2	73%	0.733	75%	0.746	S	S	*	*			trans	59.1	135.7	143.4	161.2	0	0	0	0	119.4
451	E	31.2	Very low	29.4	Very low	148 Å²	148	129.1 Å²	129.1	69%	0.692	74%	0.736	S	S	*	*			cis	-167.4	-171.5	-5.5	-107.6	175.9	-147	0	0	106.4
452	Q	36.3	Very low	29.4	Very low	159 Å²	159	134 Å²	134	74%	0.743	74%	0.744	S	S	*	*			cis	-164.3	177.5	-4	-124.5	-167.4	76.1	0	0	105.1
453	S	31.3	Very low	29.5	Very low	90 Å²	90	139 Å²	139	63%	0.629	74%	0.742	S	S	*	*			cis	-160.4	175.8	-23.9	85.8	0	0	0	0	105.4
454	S	32.8	Very low	30.7	Very low	101 Å²	101	140 Å²	140	71%	0.706	74%	0.736	S	S	*	*			cis	-144.6	-132.5	-8.4	29.6	0	0	0	0	105.7
455	R	26.8	Very low	30.5	Very low	217 Å²	217	141 Å²	141	82%	0.819	73%	0.731	S	S	*	*			cis	-161.1	115	-6.7	-164.1	163.8	-175.5	176.2	1.9	106.8
456	W	26.4	Very low	30.6	Very low	202 Å²	202	141.3 Å²	141.3	77%	0.765	72%	0.72	S	S	*	*				46.5	132.6	109.3	-71.7	45.8	0	0	0	116.4
457	E	26.2	Very low	30.5	Very low	114 Å²	114	144.8 Å²	144.8	53%	0.533	72%	0.718	S	S	.	*			cis	-170.6	-177.8	3.9	-112.7	-168.9	149.3	0	0	108.4
458	R	27.1	Very low	30.4	Very low	172 Å²	172	144.9 Å²	144.9	65%	0.649	71%	0.712	S	S	*	*			cis	-163.1	157.2	6.9	-135.6	174.2	-155.3	156.8	27.3	113.7
459	N	26.2	Very low	30.5	Very low	124 Å²	124	140.9 Å²	140.9	66%	0.663	71%	0.707	S	S	*	*			trans	51.8	143.5	142.2	-77.2	2.8	0	0	0	126.6
460	N	26.1	Very low	29.5	Very low	153 Å²	153	143.8 Å²	143.8	82%	0.818	72%	0.715	S	S	*	*			trans	68.4	151.9	152.9	-56.7	-18.9	0	0	0	118.9
461	G	25.9	Very low	29.4	Very low	66 Å²	66	142.3 Å²	142.3	68%	0.68	71%	0.711	S	S	*	*			cis	125.1	118.3	-12.6	0	0	0	0	0	115.6
462	K	26.7	Very low	29.3	Very low	215 Å²	215	139.4 Å²	139.4	94%	0.935	71%	0.707	S	S	*	*			trans	162.9	137.1	152.3	-97.8	172.8	-176.5	-174.2	0	115.4
463	R	32.5	Very low	29	Very low	233 Å²	233	139.8 Å²	139.8	88%	0.879	71%	0.708	S	S	*	*			trans	-83.3	-172.9	144.4	-79.5	-172.6	179.7	177.9	0.4	108.3
464	P	51.4	Low	28.9	Very low	92 Å²	92	138.7 Å²	138.7	60%	0.597	71%	0.711	S	S	*	*			cis	-136.9	-158.6	-0.8	14.8	15.6	0	0	0	114.1
465	H	25.7	Very low	28.6	Very low	154 Å²	154	138.4 Å²	138.4	71%	0.713	71%	0.708	S	S	*	*			trans	84.5	152.9	153.5	-59.3	-60.4	0	0	0	119.2
466	Q	26.9	Very low	28.7	Very low	130 Å²	130	137.8 Å²	137.8	61%	0.607	71%	0.707	S	S	*	*			cis	-171.7	149.8	-24.1	175.3	158.2	-18.2	0	0	110.5
467	E	24.6	Very low	28.9	Very low	138 Å²	138	135.3 Å²	135.3	65%	0.645	71%	0.708	S	S	*	*			trans	73.7	163.7	152.9	-90.7	166.2	-152.1	0	0	124.9
468	F	27.6	Very low	29.2	Very low	168 Å²	168	136.7 Å²	136.7	74%	0.737	72%	0.719	S	S	*	*			trans	5.8	137.9	167.9	-59.5	-72.3	0	0	0	120.3	I470	F468-I470 HydrophobicContact CD1-CD1 4.39Å
469	G	28.4	Very low	29.2	Very low	65 Å²	65	131.9 Å²	131.9	67%	0.67	72%	0.723	S	S	*	*			cis	130	178	4.5	0	0	0	0	0	111.8
470	I	28.4	Very low	29.9	Very low	157 Å²	157	131.6 Å²	131.6	81%	0.805	73%	0.728	S	S	*	*			trans	66.1	133.2	158.3	-65.3	169.4	0	0	0	115.9	F468	F468-I470 HydrophobicContact CD1-CD1 4.39Å
471	S	28.6	Very low	30	Very low	91 Å²	91	134.1 Å²	134.1	64%	0.636	73%	0.732	S	S	*	*			cis	-173.9	150.7	-7.6	173.4	0	0	0	0	110.3
472	S	28.8	Very low	30.2	Very low	87 Å²	87	137 Å²	137	61%	0.608	73%	0.732	S	S	*	*			trans	50.4	178	145.6	67.8	0	0	0	0	120.4
473	Q	30.8	Very low	30.4	Very low	167 Å²	167	132.5 Å²	132.5	78%	0.78	73%	0.728	S	S	*	*			cis	-109.6	159.1	-22.4	-105.4	94.5	-6	0	0	107.1
474	G	28.2	Very low	30.5	Very low	67 Å²	67	127.7 Å²	127.7	69%	0.691	72%	0.719	S	S	*	*				82.2	135.8	63.1	0	0	0	0	0	111.1
475	C	27.6	Very low	29.3	Very low	94 Å²	94	131.4 Å²	131.4	64%	0.635	73%	0.733	S	S	*	*			cis	-164.7	145.2	11.9	-88.8	0	0	0	0	112.9
476	Y	28.3	Very low	29.8	Very low	205 Å²	205	131 Å²	131	80%	0.804	74%	0.736	S	S	*	*			trans	58.5	149.3	153	-47.3	-48.3	0	0	0	120.1
477	L	31.8	Very low	29.9	Very low	149 Å²	149	131.3 Å²	131.3	78%	0.78	75%	0.746	S	S	*	*			cis	-126.3	148.5	4.9	-78	83.8	0	0	0	113
478	N	31.6	Very low	30.7	Very low	143 Å²	143	131.9 Å²	131.9	77%	0.765	75%	0.752	S	S	*	*			trans	19.6	135.9	137.7	-43.3	-10.5	0	0	0	119.3
479	G	28.2	Very low	30.8	Very low	71 Å²	71	129.8 Å²	129.8	73%	0.732	76%	0.755	S	S	*	*			cis	102.4	139.8	12.8	0	0	0	0	0	111.9
480	P	39.4	Very low	31.1	Very low	118 Å²	118	136 Å²	136	77%	0.766	76%	0.764	S	S	*	*			cis	-128.8	170.2	33.9	28.1	-6.3	0	0	0	118
481	F	27.9	Very low	31	Very low	206 Å²	206	138.1 Å²	138.1	90%	0.904	77%	0.77	S	S	*	*			trans	51.2	81	163.2	-62.7	-60.6	0	0	0	121.7
482	N	31	Very low	31.1	Very low	128 Å²	128	144.5 Å²	144.5	68%	0.684	78%	0.781	S	S	*	*			trans	-76.4	165.9	144.4	-123	-69.7	0	0	0	110	N484	N482-N484 PolarHBondContact OD1-ND2 3.29Å
483	S	29.9	Very low	31.3	Very low	120 Å²	120	145.4 Å²	145.4	84%	0.839	79%	0.787	S	S	*	*				-162	137	86.8	46.2	0	0	0	0	114.9
484	N	35.6	Very low	31.2	Very low	132 Å²	132	143 Å²	143	71%	0.706	79%	0.789	S	S	*	*			trans	-81.4	157.9	161.5	-70.9	-91.2	0	0	0	110.3	N482	N482-N484 PolarHBondContact OD1-ND2 3.29Å
485	L	26	Very low	31.3	Very low	169 Å²	169	144.6 Å²	144.6	89%	0.885	79%	0.789	S	S	*	*			trans	-157.8	111	132.6	-115	172.4	0	0	0	112.8
486	L	37.1	Very low	31.2	Very low	147 Å²	147	146.2 Å²	146.2	77%	0.77	80%	0.796	S	S	*	*			trans	-84.5	134.5	159.2	-74.6	164	0	0	0	108.8
487	T	28.3	Very low	31.1	Very low	135 Å²	135	141 Å²	141	83%	0.828	79%	0.789	S	S	*	*				173.6	155.1	115.5	31.9	0	0	0	0	113.4
488	I	40.9	Very low	30.8	Very low	150 Å²	150	141.1 Å²	141.1	77%	0.769	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-87.6	132.2	177.9	-62.3	158.7	0	0	0	110.5
489	P	30.8	Very low	30.5	Very low	124 Å²	124	139.3 Å²	139.3	81%	0.805	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-90.9	124	157.9	32.8	-28.5	0	0	0	111.4
490	K	34.7	Very low	30.5	Very low	196 Å²	196	143.1 Å²	143.1	85%	0.852	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-95.7	145.5	161.7	-71	174.2	177.2	170.1	0	109.1
491	Q	25.4	Very low	29.8	Very low	201 Å²	201	144.9 Å²	144.9	94%	0.939	78%	0.78	S	S	*	*			trans	-153	177.6	141	-116.8	-172.5	22	0	0	112.6
492	R	30.6	Very low	29.7	Very low	226 Å²	226	141.8 Å²	141.8	85%	0.853	78%	0.778	S	S	*	*			trans	-153.2	144.5	-152	-145.1	-159.1	-169.3	-175.8	2.6	111.8
493	S	33.4	Very low	29.5	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	78%	0.782	S	S	*	*			trans	57.8	138.6	147.6	-60.3	0	0	0	0	121.9
494	S	29	Very low	29.4	Very low	116 Å²	116	141.4 Å²	141.4	81%	0.811	78%	0.784	S	S	*	*				-152.4	162.3	123.1	82.1	0	0	0	0	107.9
495	S	29.1	Very low	29	Very low	100 Å²	100	146.1 Å²	146.1	70%	0.699	79%	0.792	S	S	*	*			cis	-152.3	147	3.2	48.2	0	0	0	0	107.4
496	V	25.4	Very low	29	Very low	129 Å²	129	149.6 Å²	149.6	78%	0.782	79%	0.793	S	S	*	*				157.7	145.2	89.1	164.4	0	0	0	0	104.2
497	S	26.7	Very low	28.3	Very low	95 Å²	95	147.4 Å²	147.4	66%	0.664	80%	0.796	S	S	*	*			cis	-166.3	166.4	-25.5	62.6	0	0	0	0	108.8
498	L	26.3	Very low	28.1	Very low	151 Å²	151	144.2 Å²	144.2	79%	0.791	79%	0.789	S	S	*	*			trans	42.1	130.5	146.2	-102.1	66.9	0	0	0	120.6
499	T	25.7	Very low	27.3	Very low	106 Å²	106	143.1 Å²	143.1	65%	0.65	79%	0.79	S	S	*	*			cis	-167.9	153.4	43.9	24	0	0	0	0	114.4
500	H	26.6	Very low	27.1	Very low	150 Å²	150	144.9 Å²	144.9	69%	0.694	79%	0.791	S	S	*	*			trans	51.2	123.4	142.7	-65.7	-59.9	0	0	0	126.7
501	H	26.2	Very low	26.6	Very low	155 Å²	155	139.8 Å²	139.8	72%	0.718	78%	0.781	S	S	*	*			trans	71.4	115	131.1	-66.3	-54.3	0	0	0	125.2
502	V	25.6	Very low	26.7	Very low	142 Å²	142	135.2 Å²	135.2	86%	0.861	77%	0.771	S	S	*	*				53	123.2	120.4	-177.3	0	0	0	0	120.2
503	G	25.8	Very low	26.5	Very low	75 Å²	75	132.2 Å²	132.2	77%	0.773	77%	0.771	S	S	*	*			trans	-170.8	120.9	159.9	0	0	0	0	0	114.4
504	L	27.8	Very low	26.2	Very low	165 Å²	165	131.5 Å²	131.5	86%	0.864	77%	0.766	S	S	*	*			trans	-125.9	150.7	174.1	-141.1	91.9	0	0	0	109.3
505	R	26.7	Very low	26.7	Very low	231 Å²	231	131.7 Å²	131.7	87%	0.872	76%	0.764	S	S	*	*			trans	115.1	113.3	159.4	-62.7	169.5	-169.4	-135.7	1.8	118.1
506	R	26	Very low	26.8	Very low	242 Å²	242	132.6 Å²	132.6	91%	0.913	77%	0.766	S	S	*	*				34.3	132.5	117.4	-169.7	-174.6	-71.9	-179.6	-3	120.4
507	A	23.4	Very low	26.8	Very low	101 Å²	101	133.6 Å²	133.6	84%	0.835	77%	0.766	S	S	*	*			trans	74.4	148.5	166.9	0	0	0	0	0	116.6
508	G	23.2	Very low	26.9	Very low	67 Å²	67	133.6 Å²	133.6	69%	0.691	77%	0.767	S	S	*	*			cis	160.8	179.6	-8.4	0	0	0	0	0	113
509	V	24.5	Very low	28.1	Very low	128 Å²	128	131 Å²	131	78%	0.776	76%	0.758	S	S	*	*			trans	72.2	106.4	153.7	-177.6	0	0	0	0	119
510	L	26.2	Very low	28.2	Very low	160 Å²	160	131.8 Å²	131.8	84%	0.838	76%	0.759	S	S	*	*			trans	65.8	164.1	146.4	-59	177	0	0	0	117.9
511	S	26	Very low	28.3	Very low	90 Å²	90	132.8 Å²	132.8	63%	0.629	76%	0.764	S	S	*	*			cis	-164.8	176.7	-10.9	-119.9	0	0	0	0	111.6
512	S	25.8	Very low	28.3	Very low	105 Å²	105	128.7 Å²	128.7	73%	0.734	76%	0.763	S	S	*	*			trans	73.7	151.1	150	74.8	0	0	0	0	118.2
513	L	26.4	Very low	29	Very low	162 Å²	162	128.6 Å²	128.6	85%	0.848	77%	0.765	S	S	*	*			cis	-153.3	163.1	-3.7	-127.1	165.1	0	0	0	110.5
514	S	28.9	Very low	29.2	Very low	92 Å²	92	131.6 Å²	131.6	64%	0.643	77%	0.769	S	S	*	*			trans	-79.9	167	173.9	-47.6	0	0	0	0	113
515	P	38.4	Very low	29.2	Very low	119 Å²	119	128.3 Å²	128.3	77%	0.773	77%	0.765	S	S	*	*				-129	155	101.7	40	-33.1	0	0	0	111.9
516	V	30.4	Very low	29.3	Very low	120 Å²	120	121.9 Å²	121.9	73%	0.727	76%	0.761	S	S	*	*			cis	73.6	124.6	39.3	-177.2	0	0	0	0	110.2
517	N	25.8	Very low	29.4	Very low	149 Å²	149	114.1 Å²	114.1	80%	0.797	76%	0.756	S	S	*	*			cis	-147.9	-176.4	19.3	-138.3	-14.6	0	0	0	113.9
518	S	29.4	Very low	29.6	Very low	96 Å²	96	114.2 Å²	114.2	67%	0.671	75%	0.751	S	S	*	*			trans	-106.3	-158.3	175.2	62.8	0	0	0	0	111.5
519	P	52	Low	29.8	Very low	95 Å²	95	118.5 Å²	118.5	62%	0.617	76%	0.757	S	S	*	*			cis	-129	-173	-37.3	24.7	-1.5	0	0	0	112.4
520	N	26.3	Very low	30	Very low	124 Å²	124	118.5 Å²	118.5	66%	0.663	76%	0.758	S	S	*	*				160.5	144.2	118.4	-88.7	-19.8	0	0	0	119.8
521	H	28.8	Very low	30.1	Very low	171 Å²	171	118.5 Å²	118.5	79%	0.792	76%	0.759	S	S	*	*			trans	45.2	138.7	145.8	-55.5	-46.8	0	0	0	124.6
522	G	27.7	Very low	30.1	Very low	69 Å²	69	126.1 Å²	126.1	71%	0.711	77%	0.774	S	S	*	*			trans	-101.7	-161.3	160.8	0	0	0	0	0	112.9
523	P	40.7	Very low	30.3	Very low	139 Å²	139	126 Å²	126	90%	0.903	77%	0.772	S	S	*	*				-143.5	-168.1	110.8	40	-25.9	0	0	0	114.9
524	V	29.1	Very low	30.5	Very low	139 Å²	139	124.2 Å²	124.2	84%	0.842	77%	0.771	S	S	*	*			trans	-126.6	145.1	-159.4	171.2	0	0	0	0	113.9
525	A	27.2	Very low	30.5	Very low	95 Å²	95	127.7 Å²	127.7	79%	0.785	78%	0.78	S	S	*	*			trans	-153.6	126.1	145.7	0	0	0	0	0	107.6
526	A	29.8	Very low	30	Very low	96 Å²	96	130.8 Å²	130.8	79%	0.793	79%	0.785	S	S	*	*			cis	74.8	117.3	40.8	0	0	0	0	0	113.1
527	G	27.5	Very low	29.8	Very low	79 Å²	79	134.5 Å²	134.5	81%	0.814	79%	0.791	S	S	*	*			cis	-140.8	-156.9	-6.4	0	0	0	0	0	110.5
528	S	27	Very low	30.1	Very low	104 Å²	104	133.4 Å²	133.4	73%	0.727	79%	0.792	S	S	*	*			cis	-164.9	141.7	6.1	169.9	0	0	0	0	110.6
529	L	28.5	Very low	29.9	Very low	156 Å²	156	136.5 Å²	136.5	82%	0.817	80%	0.802	S	S	*	*			trans	30.9	139.7	147.5	-55.2	169.6	0	0	0	120.6
530	T	28.9	Very low	28.9	Very low	129 Å²	129	138.2 Å²	138.2	79%	0.791	81%	0.81	S	S	*	*			cis	-150.8	151.4	33.1	50.4	0	0	0	0	115.8
531	N	26.8	Very low	29	Very low	160 Å²	160	136.6 Å²	136.6	86%	0.856	81%	0.814	S	S	*	*			trans	-18	136.6	163	-67.6	-18.1	0	0	0	120.6
532	R	27.8	Very low	28.9	Very low	250 Å²	250	135.5 Å²	135.5	94%	0.943	81%	0.814	S	S	*	*				-162	157.9	89.7	-139.8	172.8	-175.2	169.3	1.1	111.7
533	S	28.9	Very low	28.8	Very low	101 Å²	101	141.5 Å²	141.5	71%	0.706	82%	0.821	S	S	*	*			trans	-108.2	143.8	-169	52.5	0	0	0	0	114.3
534	P	30.7	Very low	28.4	Very low	125 Å²	125	143 Å²	143	81%	0.812	82%	0.82	S	S	*	*			trans	-79.9	164	159.1	35.5	-33.1	0	0	0	111.3
535	I	29.6	Very low	28.2	Very low	165 Å²	165	143.2 Å²	143.2	85%	0.846	82%	0.817	S	S	*	*			trans	-117.9	141.6	167	-71.4	173.8	0	0	0	107.2
536	E	26.2	Very low	28.2	Very low	184 Å²	184	147.8 Å²	147.8	86%	0.86	82%	0.819	S	S	*	*			trans	-120.8	144.7	-168.5	-163.7	159.5	-132.9	0	0	109.9
537	F	26.3	Very low	28.5	Very low	198 Å²	198	148.5 Å²	148.5	87%	0.868	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-86.5	137.7	-179.3	-74.3	-98.1	0	0	0	110.6
538	P	32.5	Very low	28.3	Very low	126 Å²	126	149.4 Å²	149.4	82%	0.818	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-82.7	130.6	171.6	32.7	-31.6	0	0	0	111
539	D	26.5	Very low	28.2	Very low	162 Å²	162	151.9 Å²	151.9	87%	0.866	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-101.6	159.8	170.1	-138.9	-26	0	0	0	110.6
540	T	30.8	Very low	28.1	Very low	131 Å²	131	151.5 Å²	151.5	80%	0.804	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-97.5	128.1	-166.8	54.2	0	0	0	0	114.8
541	A	27.6	Very low	28	Very low	90 Å²	90	153.4 Å²	153.4	74%	0.744	82%	0.815	S	S	*	*			trans	168	124.2	130.8	0	0	0	0	0	111.9
542	D	26.7	Very low	28	Very low	148 Å²	148	154 Å²	154	79%	0.791	81%	0.812	S	S	*	*				175.2	172	116.9	-113.2	-30	0	0	0	113.3
543	F	26	Very low	27.9	Very low	195 Å²	195	154 Å²	154	86%	0.855	81%	0.813	S	S	*	*			trans	73.4	89.1	170	-61.3	-74.4	0	0	0	119.7
544	L	31.3	Very low	27.7	Very low	169 Å²	169	154.3 Å²	154.3	89%	0.885	81%	0.814	S	S	*	*			trans	-99.4	118	141	-79.3	174.1	0	0	0	109.8
545	N	26.1	Very low	27.5	Very low	145 Å²	145	156 Å²	156	78%	0.775	82%	0.816	S	S	*	*			trans	-167	73.1	156.5	-110.3	-44.4	0	0	0	115.8
546	K	26.2	Very low	27.3	Very low	190 Å²	190	151.6 Å²	151.6	83%	0.826	81%	0.811	S	S	*	*			trans	65.5	163.6	155	-63.2	177	177.9	173.1	0	118.1
547	P	36.5	Very low	27.3	Very low	111 Å²	111	149.6 Å²	149.6	72%	0.721	81%	0.806	S	S	*	*			cis	-136.5	-174.7	-48	38.6	-22.7	0	0	0	113.2
548	S	23.5	Very low	27.4	Very low	99 Å²	99	144.6 Å²	144.6	69%	0.692	80%	0.802	S	S	*	*			trans	114.8	148.7	135.2	83.3	0	0	0	0	120.9
549	I	25.1	Very low	27.6	Very low	156 Å²	156	143.7 Å²	143.7	80%	0.8	80%	0.795	S	S	*	*			trans	78.3	98.2	155.1	-64.5	159	0	0	0	119
550	I	26.1	Very low	27.5	Very low	147 Å²	147	143.5 Å²	143.5	75%	0.754	79%	0.794	S	S	*	*			trans	-41.2	143.5	151.3	-60.8	151.6	0	0	0	113.1
551	L	27.1	Very low	27.2	Very low	169 Å²	169	143.6 Å²	143.6	89%	0.885	80%	0.795	S	S	*	*			trans	-144.3	129.8	143.3	-112.9	174.2	0	0	0	111.2
552	Q	26.1	Very low	28	Very low	173 Å²	173	144 Å²	144	81%	0.808	79%	0.79	S	S	*	*			trans	-87.4	149.4	174.5	-59	169.6	-68	0	0	110.8
553	R	26	Very low	27.9	Very low	251 Å²	251	143.3 Å²	143.3	95%	0.947	79%	0.786	S	S	*	*				-157.6	151.8	125.8	-131.9	174.1	-179.1	115.6	1.8	112.1
554	S	25.3	Very low	27.9	Very low	106 Å²	106	141.7 Å²	141.7	74%	0.741	78%	0.779	S	S	*	*			trans	-137.6	162.8	-179.6	54.9	0	0	0	0	111.3
555	L	27	Very low	27.7	Very low	162 Å²	162	142.5 Å²	142.5	85%	0.848	77%	0.772	S	S	*	*			trans	69.7	133.8	158.3	-153.3	67.7	0	0	0	118.6
556	G	24.1	Very low	27.7	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	77%	0.77	S	S	*	*			trans	-172.8	107.8	174.6	0	0	0	0	0	110.3
557	N	27.4	Very low	27.7	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	77%	0.769	S	S	*	*			trans	-71.8	161.8	-165.4	-56.3	-15.5	0	0	0	114.6
558	A	28.1	Very low	27.1	Very low	93 Å²	93	145.8 Å²	145.8	77%	0.769	78%	0.78	S	S	*	*			trans	-66.4	164.9	159.3	0	0	0	0	0	111.3
559	P	36.7	Very low	27.2	Very low	106 Å²	106	151.4 Å²	151.4	69%	0.688	79%	0.787	S	S	*	*				-154.3	167.1	90.1	41.5	-23.7	0	0	0	118
560	N	23.9	Very low	27.2	Very low	158 Å²	158	150.6 Å²	150.6	85%	0.845	78%	0.784	S	S	*	*			trans	75.1	145.5	148.1	-64.3	-3.3	0	0	0	123.8
561	T	25.1	Very low	27.2	Very low	133 Å²	133	148.2 Å²	148.2	82%	0.816	78%	0.78	S	S	*	*			trans	-88.1	-173.8	175.4	14.2	0	0	0	0	112.7
562	P	43.1	Very low	27.1	Very low	100 Å²	100	147.7 Å²	147.7	65%	0.649	78%	0.778	S	S	*	*			cis	-137	-163.9	-5.2	29.1	-3.4	0	0	0	115.6
563	D	25.4	Very low	27.3	Very low	132 Å²	132	145 Å²	145	71%	0.706	78%	0.779	S	S	*	*			trans	86.7	100.3	142.5	-68.1	-18.8	0	0	0	124.6
564	F	25.4	Very low	27.6	Very low	161 Å²	161	141.3 Å²	141.3	71%	0.706	78%	0.778	S	S	*	*				79	140.2	118.4	-97.3	-76	0	0	0	126
565	Y	27	Very low	28	Very low	187 Å²	187	143.4 Å²	143.4	73%	0.733	78%	0.78	S	S	*	*			trans	90.5	112.4	149.7	-82.2	-57.8	0	0	0	124.1
566	Q	27.2	Very low	28.4	Very low	158 Å²	158	139.6 Å²	139.6	74%	0.738	77%	0.766	S	S	*	*			trans	89.3	101.8	132.7	-104.8	164.8	18.6	0	0	122.4
567	H	26.1	Very low	29.1	Very low	175 Å²	175	144.1 Å²	144.1	81%	0.81	77%	0.773	S	S	*	*			trans	32.1	120.3	133.2	-69.8	-77.1	0	0	0	120.8
568	L	23.8	Very low	29.8	Very low	181 Å²	181	145 Å²	145	95%	0.948	78%	0.778	S	S	*	*				-142.8	171.6	114.3	-141.4	70.2	0	0	0	111.6
569	R	25.1	Very low	30.6	Very low	218 Å²	218	144.7 Å²	144.7	82%	0.823	77%	0.769	S	S	*	*			trans	-110.2	138.3	-159.8	-158.4	-167.3	-154.1	168.4	5.2	110.6
570	N	24.6	Very low	31	Very low	138 Å²	138	142.7 Å²	142.7	74%	0.738	77%	0.767	S	S	*	*				159.2	145.3	125.4	-79.1	-14.2	0	0	0	115.1
571	S	27.3	Very low	31.6	Very low	97 Å²	97	144.3 Å²	144.3	68%	0.678	77%	0.769	S	S	*	*			trans	58	94.8	151.6	52.9	0	0	0	0	120.8
572	D	25	Very low	32	Very low	159 Å²	159	146.9 Å²	146.9	85%	0.85	77%	0.772	S	S	*	*				42.3	102.2	109.9	-46.3	-41.2	0	0	0	120.3
573	S	30.7	Very low	31.4	Very low	117 Å²	117	149.7 Å²	149.7	82%	0.818	78%	0.78	S	S	*	*				-173.5	114.2	125.3	56.6	0	0	0	0	111.9
574	N	30.8	Very low	31.5	Very low	173 Å²	173	151.2 Å²	151.2	93%	0.925	79%	0.787	S	S	*	*			trans	-118.4	121.1	168.3	-85.8	-31.6	0	0	0	109.3
575	L	35	Very low	31.5	Very low	149 Å²	149	151.7 Å²	151.7	78%	0.78	79%	0.789	S	S	*	*			trans	-147.6	124.3	-178.9	-134.7	160	0	0	0	109.2
576	C	34.4	Very low	31.4	Very low	83 Å²	83	153.9 Å²	153.9	56%	0.561	80%	0.798	S	S	*	*			trans	-85	120	-177.3	-173.3	0	0	0	0	111.1	N578 C579	C576-N578 PolarHBondContact O-N 3.14Å; C576-C579 PolarHBondContact O-N 3.11Å
577	N	39.3	Very low	31.3	Very low	167 Å²	167	150.8 Å²	150.8	89%	0.893	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	20.6	-170.7	-99.5	-10.1	0	0	0	116.1
578	N	42.5	Very low	31.2	Very low	160 Å²	160	147.9 Å²	147.9	86%	0.856	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.2	-1.5	173.3	-144.8	21.8	0	0	0	115.4	C576	C576-N578 PolarHBondContact O-N 3.14Å
579	C	44	Very low	31.1	Very low	87 Å²	87	145 Å²	145	59%	0.588	78%	0.779	S	S	*	*			trans	-152.5	90.3	176.3	49.7	0	0	0	0	111	C576 H581	C576-C579 PolarHBondContact O-N 3.11Å; C579-H581 PolarHBondContact O-N 3.14Å
580	G	45.3	Very low	31.1	Very low	63 Å²	63	140.4 Å²	140.4	65%	0.649	78%	0.78	S	S	*	*			trans	-78.2	71.3	-174.2	0	0	0	0	0	114.5
581	H	37.6	Very low	31	Very low	192 Å²	192	143.3 Å²	143.3	89%	0.889	79%	0.789	S	S	*	*			trans	-143.7	160.7	163.6	-107.4	61	0	0	0	111.8	C579	C579-H581 PolarHBondContact O-N 3.14Å
582	Q	32.2	Very low	30.9	Very low	188 Å²	188	144.2 Å²	144.2	88%	0.879	80%	0.796	S	S	*	*			trans	-115.5	130.6	-162.1	-165	172.5	21.4	0	0	111.3
583	I	30.9	Very low	30.9	Very low	159 Å²	159	144.6 Å²	144.6	82%	0.815	80%	0.798	S	S	*	*			trans	-86.2	126.5	177.4	-61.3	174	0	0	0	109.4
584	L	27.3	Very low	30.5	Very low	164 Å²	164	144.2 Å²	144.2	86%	0.859	80%	0.795	S	S	*	*			trans	-99.9	115.4	168.7	-165.6	74.2	0	0	0	109.4
585	K	26.1	Very low	30.2	Very low	170 Å²	170	142.2 Å²	142.2	74%	0.739	79%	0.789	S	S	*	*			trans	-90.2	147.5	167.9	-88.3	-169.8	172.1	-173.1	0	110.3	V587	K585-V587 HydrophobicContact CB-CG2 4.26Å; K585-V587 HydrophobicContact CD-CG2 4.28Å
586	Y	24.6	Very low	29.6	Very low	234 Å²	234	142.7 Å²	142.7	92%	0.918	79%	0.793	S	S	*	*			trans	-110.4	152.3	149.1	-126	-94.9	0	0	0	109
587	V	25.5	Very low	29	Very low	92 Å²	92	144 Å²	144	56%	0.558	80%	0.801	S	S	*	*			trans	-147.9	132	-168.7	173.6	0	0	0	0	110.3	K585 T589	K585-V587 HydrophobicContact CB-CG2 4.26Å; K585-V587 HydrophobicContact CD-CG2 4.28Å; V587-T589 HydrophobicContact CG1-CG2 3.82Å
588	S	23.2	Very low	28.3	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	80%	0.8	S	S	*	*			trans	-165.9	105.9	151	-78.5	0	0	0	0	106.4
589	T	22.7	Very low	27.3	Very low	121 Å²	121	140.4 Å²	140.4	74%	0.742	80%	0.8	S	S	*	*				70.6	97.8	62.7	68	0	0	0	0	115.9	V587	V587-T589 HydrophobicContact CG1-CG2 3.82Å
590	S	23.4	Very low	26.5	Very low	121 Å²	121	139.9 Å²	139.9	85%	0.846	81%	0.81	S	S	*	*			trans	-157.1	130.9	141.7	54.7	0	0	0	0	109.6
591	E	24.3	Very low	25.5	Very low	199 Å²	199	147 Å²	147	93%	0.93	82%	0.823	S	S	*	*			trans	-89.9	149.6	168.3	-63.1	170.2	132.8	0	0	109.9
592	S	24.9	Very low	25.1	Very low	117 Å²	117	143.8 Å²	143.8	82%	0.818	82%	0.822	S	S	*	*			trans	-164	130.3	149.6	58.7	0	0	0	0	109.9
593	D	23.4	Very low	24.8	Very low	167 Å²	167	138 Å²	138	89%	0.893	81%	0.813	S	S	*	*			trans	-59.9	155.3	172.8	-64.1	-72	0	0	0	112.5
594	S	23.8	Very low	24.6	Very low	109 Å²	109	139.4 Å²	139.4	76%	0.762	82%	0.816	S	S	*	*			trans	-105.5	148.7	160	60.9	0	0	0	0	110.5
595	T	23.6	Very low	24.7	Very low	131 Å²	131	139.8 Å²	139.8	80%	0.804	81%	0.813	S	S	*	*			trans	100.7	94.2	175.9	-41.7	0	0	0	0	115.2
596	D	22.9	Very low	24.6	Very low	159 Å²	159	139.3 Å²	139.3	85%	0.85	81%	0.814	S	S	*	*				-152.7	159.6	116.2	-140.8	-21.2	0	0	0	112
597	C	22.2	Very low	24.6	Very low	110 Å²	110	134.6 Å²	134.6	74%	0.743	80%	0.804	S	S	*	*			trans	-101.3	140.1	-171.9	-70.6	0	0	0	0	113
598	C	24.1	Very low	24.7	Very low	127 Å²	127	137.1 Å²	137.1	86%	0.858	81%	0.813	S	S	*	*			trans	-130.7	125.3	157.4	-78.1	0	0	0	0	108.1
599	S	22.1	Very low	24.6	Very low	124 Å²	124	140.7 Å²	140.7	87%	0.867	82%	0.815	S	S	*	*			cis	68.6	104.2	46.5	-163.7	0	0	0	0	112.5
600	G	25.7	Very low	24.6	Very low	77 Å²	77	139.1 Å²	139.1	79%	0.794	81%	0.808	S	S	*	*			trans	163.4	75	-180	0	0	0	0	0	114.3
601	K	26	Very low	24.7	Very low	213 Å²	213	142 Å²	142	93%	0.926	81%	0.806	S	S	*	*			trans	-65.1	136	-175.6	-63.4	174.3	175.2	-179	0	114.8
602	S	27.6	Very low	24.6	Very low	124 Å²	124	140.1 Å²	140.1	87%	0.867	80%	0.797	S	S	*	*			trans	-170.3	133.7	140.3	55.2	0	0	0	0	109.1
603	G	26.8	Very low	24.5	Very low	66 Å²	66	138.8 Å²	138.8	68%	0.68	79%	0.788	S	S	*	*			cis	154.9	133.7	-5.6	0	0	0	0	0	109.8
604	E	27.6	Very low	24.4	Very low	188 Å²	188	139.1 Å²	139.1	88%	0.879	78%	0.781	S	S	*	*			trans	54.1	139.9	164.2	-67.3	157	-152	0	0	119
605	E	27.5	Very low	24.3	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	78%	0.779	S	S	*	*			cis	-160.7	172.9	-24	-132	172.6	-159.3	0	0	108.9
606	E	24.7	Very low	24.2	Very low	160 Å²	160	142.3 Å²	142.3	75%	0.748	78%	0.776	S	S	*	*			trans	0.5	129.9	174	-51.7	-168.7	142.8	0	0	122.7
607	N	25.4	Very low	24.2	Very low	135 Å²	135	142.2 Å²	142.2	72%	0.722	77%	0.773	S	S	*	*				165.8	116.8	118.7	-92.7	-81.6	0	0	0	110.3
608	I	26.2	Very low	24.4	Very low	145 Å²	145	144.4 Å²	144.4	74%	0.744	77%	0.772	S	S	*	*				89.2	111	75.5	-74.9	-176	0	0	0	115.3
609	F	22.2	Very low	24.3	Very low	190 Å²	190	142.9 Å²	142.9	83%	0.833	76%	0.759	S	S	*	*			trans	76.9	129.3	150	-112.6	-121.5	0	0	0	125.8
610	S	23.1	Very low	24.3	Very low	87 Å²	87	144.9 Å²	144.9	61%	0.608	76%	0.755	S	S	*	*			trans	57.4	104.4	139.3	63	0	0	0	0	123.2
611	K	24.3	Very low	24.2	Very low	182 Å²	182	148.5 Å²	148.5	79%	0.791	75%	0.751	S	S	*	*				53.1	142.9	95.1	-144.9	-165.7	-177.3	-162.8	0	119.9
612	E	22.4	Very low	24.1	Very low	159 Å²	159	145.8 Å²	145.8	74%	0.743	74%	0.741	S	S	*	*			trans	76	152.7	169.1	-57.3	-172.7	168.4	0	0	117.2
613	S	23.4	Very low	24.1	Very low	89 Å²	89	148.4 Å²	148.4	62%	0.622	74%	0.74	S	S	*	*			cis	-170.3	175.1	-47.1	53.6	0	0	0	0	109.4
614	F	21	Very low	24	Very low	174 Å²	174	152.5 Å²	152.5	76%	0.763	74%	0.741	S	S	*	*			trans	72.7	105.9	158.9	-81.7	-63.7	0	0	0	122.3
615	K	21.9	Very low	23.8	Very low	166 Å²	166	148.6 Å²	148.6	72%	0.722	73%	0.731	S	S	*	*				98.4	144.3	113	-113.2	177	-171.8	172.3	0	123.1
616	L	21.2	Very low	23.7	Very low	141 Å²	141	147.4 Å²	147.4	74%	0.738	73%	0.725	S	S	*	*			trans	55.1	116.7	153.9	-102	53.3	0	0	0	117.3
617	M	23.7	Very low	23.8	Very low	157 Å²	157	147.7 Å²	147.7	77%	0.773	72%	0.724	S	S	*	*			cis	91.2	147.4	47.6	-176.6	-174.2	156.7	0	0	113.4
618	E	25.1	Very low	23.8	Very low	157 Å²	157	151.6 Å²	151.6	73%	0.734	73%	0.734	S	S	*	*			trans	90.7	144.9	175.1	-56.9	-153.9	150.7	0	0	116.1
619	T	22.7	Very low	23.8	Very low	95 Å²	95	151.8 Å²	151.8	58%	0.583	74%	0.737	S	S	*	*			cis	-156.9	162.9	-0.1	0.3	0	0	0	0	112
620	Q	21.9	Very low	24	Very low	165 Å²	165	147.2 Å²	147.2	77%	0.771	73%	0.728	S	S	*	*			trans	66.6	155.5	149.1	-68.8	162.1	4.4	0	0	118.8
621	Q	22.9	Very low	24.3	Very low	154 Å²	154	154.4 Å²	154.4	72%	0.72	74%	0.742	S	S	*	*			cis	-152.2	-170.7	-10.3	-128.4	-174.7	-62.9	0	0	112.9
622	E	25.1	Very low	24.5	Very low	155 Å²	155	155.8 Å²	155.8	72%	0.724	75%	0.748	S	S	*	*			trans	-64.7	167.8	179.9	-58.8	124.9	133.5	0	0	114
623	E	26.1	Very low	24.9	Very low	180 Å²	180	155 Å²	155	84%	0.841	75%	0.749	S	S	*	*				-174.6	170.3	63.1	-129.9	177.6	171.8	0	0	115.2
624	E	24.7	Very low	25.3	Very low	151 Å²	151	161.3 Å²	161.3	71%	0.706	77%	0.765	S	S	*	*			trans	60	100.6	149.6	-69.9	-117	93.8	0	0	125.5
625	T	23.5	Very low	25.8	Very low	107 Å²	107	162 Å²	162	66%	0.656	77%	0.771	S	S	*	*				59.5	125.9	116.8	57.8	0	0	0	0	126.4
626	E	26.6	Very low	26.3	Very low	147 Å²	147	161.7 Å²	161.7	69%	0.687	77%	0.772	S	S	*	*			trans	77.4	127.4	134.9	-73.8	-117.1	109.8	0	0	125.4
627	K	26.3	Very low	26.8	Very low	166 Å²	166	157.3 Å²	157.3	72%	0.722	76%	0.76	S	S	*	*			trans	59.3	95.9	144	-69.4	-177.1	172.1	75.2	0	120.6
628	K	25	Very low	27.3	Very low	216 Å²	216	156.3 Å²	156.3	94%	0.939	76%	0.758	S	S	*	*				-149.7	143.5	118.9	-146.4	166	-173.7	171.5	0	112.2
629	D	27.3	Very low	27.7	Very low	149 Å²	149	155.1 Å²	155.1	80%	0.797	76%	0.757	S	S	*	*			trans	-109.5	165.1	-167.2	-173.1	23.6	0	0	0	113.4
630	S	25.7	Very low	28.1	Very low	94 Å²	94	158.9 Å²	158.9	66%	0.657	76%	0.761	S	S	*	*			trans	88	124.3	163.2	79	0	0	0	0	119.5
631	R	29.2	Very low	28.8	Very low	239 Å²	239	157 Å²	157	90%	0.902	76%	0.755	S	S	*	*	S	Bend	trans	69.1	73.1	163.5	-54	-173	-168.2	-172.6	4.3	118.9
632	K	29.6	Very low	29.4	Very low	210 Å²	210	153.8 Å²	153.8	91%	0.913	75%	0.746	S	S	*	*			trans	-170.3	74.4	131	-109.3	-179	177.8	-168.5	0	111.3
633	L	30.4	Very low	29.9	Very low	143 Å²	143	152.8 Å²	152.8	75%	0.749	74%	0.741	S	S	*	*			trans	-154.8	74.5	172	-149.4	151.1	0	0	0	110.8
634	F	31.2	Very low	30.4	Very low	221 Å²	221	149.2 Å²	149.2	97%	0.969	73%	0.725	S	S	*	*	S	Bend	trans	-156.3	34.3	173.1	-104.8	-66.9	0	0	0	110.5
635	Q	32.7	Very low	31	Very low	189 Å²	189	144.5 Å²	144.5	88%	0.883	71%	0.712	S	S	*	*	S	Bend	trans	-154.1	30.1	-178.4	-153.9	167.4	12.7	0	0	112.4
636	E	31.5	Very low	31.5	Very low	160 Å²	160	146.2 Å²	146.2	75%	0.748	71%	0.712	S	S	*	*	S	Bend	trans	-147.6	24	-172.9	-152.9	157.5	-135.1	0	0	112
637	G	30.9	Very low	31.8	Very low	48 Å²	48	144.2 Å²	144.2	50%	0.495	71%	0.707	S	S	.	*	S	Bend	trans	-109.9	-27	178.2	0	0	0	0	0	114.6
638	D	35.2	Very low	32.4	Very low	136 Å²	136	142.6 Å²	142.6	73%	0.727	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-11.8	-166.8	-57.8	-35.5	0	0	0	114.2
639	N	33.5	Very low	32.8	Very low	132 Å²	132	139.2 Å²	139.2	71%	0.706	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-33.6	-179.7	-74.5	15.5	0	0	0	113.3	L641 T642	N639-L641 VanDerWaalsContact C-N 3.33Å; N639-L641 PolarHBondContact O-N 3.5Å; N639-T642 PolarHBondContact O-N 2.91Å
640	W	30.6	Very low	33	Very low	175 Å²	175	137.3 Å²	137.3	66%	0.663	68%	0.675	S	S	*	*	H	α-helix	trans	-61.1	-39	-175.5	-88.2	93.2	0	0	0	113	T642 E643 E644	W640-T642 PolarHBondContact O-N 2.98Å; W640-E643 PolarHBondContact O-N 2.86Å; W640-E644 PolarHBondContact O-N 3.21Å
641	L	35.9	Very low	33.3	Very low	126 Å²	126	135.9 Å²	135.9	66%	0.66	66%	0.663	S	S	*	*	H	α-helix	trans	-73.9	-5.1	-177.1	-67.1	172.1	0	0	0	114.7	N639	N639-L641 VanDerWaalsContact C-N 3.33Å; N639-L641 PolarHBondContact O-N 3.5Å
642	T	37.1	Very low	33.6	Very low	86 Å²	86	129 Å²	129	53%	0.528	64%	0.644	S	S	.	*	H	α-helix	trans	-101.9	-34.7	176.3	-49.2	0	0	0	0	111.9	N639 W640 Q646	N639-T642 PolarHBondContact O-N 2.91Å; W640-T642 PolarHBondContact O-N 2.98Å; T642-Q646 PolarHBondContact O-N 3.12Å
643	E	34.5	Very low	34	Very low	133 Å²	133	123.4 Å²	123.4	62%	0.621	62%	0.623	S	S	*	*	H	α-helix	trans	-73.2	-36	174.7	-68.1	-172	147.6	0	0	112.1	W640 Q646 N647	W640-E643 PolarHBondContact O-N 2.86Å; E643-Q646 PolarHBondContact O-N 3.16Å; E643-N647 WeakPolarHBondContact O-CB 3.4Å; E643-N647 PolarHBondContact O-N 2.83Å
644	E	36.3	Very low	34.1	Very low	105 Å²	105	122.5 Å²	122.5	49%	0.491	62%	0.615	S	S	.	*	H	α-helix	trans	-60.1	-46.9	172.5	-73.8	-176.7	138.9	0	0	111.5	W640 Q646 N647 E648	W640-E644 PolarHBondContact O-N 3.21Å; E644-Q646 VanDerWaalsContact C-N 3.29Å; E644-Q646 PolarHBondContact O-N 3.08Å; E644-N647 PolarHBondContact O-N 3.37Å; E644-E648 WeakPolarHBondContact O-CB 3.45Å; E644-E648 WeakPolarHBondContact O-CG 3.39Å; E644-E648 PolarHBondContact O-N 3.19Å
645	A	38.2	Very low	34.3	Very low	53 Å²	53	117.4 Å²	117.4	44%	0.438	59%	0.594	S	S	.	*	H	α-helix	trans	-64.6	-28.8	-179	0	0	0	0	0	114
646	Q	32.9	Very low	34.5	Very low	143 Å²	143	114.3 Å²	114.3	67%	0.668	58%	0.58	S	S	*	*	H	α-helix	trans	-84.9	-36.8	174.8	-69.5	-168.8	-23.2	0	0	112.3	T642 E643 E644 Q649 Q650	T642-Q646 PolarHBondContact O-N 3.12Å; E643-Q646 PolarHBondContact O-N 3.16Å; E644-Q646 VanDerWaalsContact C-N 3.29Å; E644-Q646 PolarHBondContact O-N 3.08Å; Q646-Q649 PolarHBondContact O-N 3.49Å; Q646-Q650 WeakPolarHBondContact O-CB 3.43Å; Q646-Q650 PolarHBondContact O-N 3.25Å
647	N	33.3	Very low	34.8	Very low	105 Å²	105	111.4 Å²	111.4	56%	0.561	57%	0.572	S	S	*	*	H	α-helix	trans	-63.9	-43.7	171.6	-96.1	-36.6	0	0	0	111.7	E643 E644 Q649 Q650 T651	E643-N647 WeakPolarHBondContact O-CB 3.4Å; E643-N647 PolarHBondContact O-N 2.83Å; E644-N647 PolarHBondContact O-N 3.37Å; N647-Q649 PolarHBondContact O-N 2.89Å; N647-Q650 PolarHBondContact O-N 3.46Å; N647-T651 WeakPolarHBondContact O-CB 3.34Å; N647-T651 VanDerWaalsContact O-CG2 3.3Å; N647-T651 WeakPolarHBondContact O-CG2 3.23Å; N647-T651 PolarHBondContact O-N 3.19Å; N647-T651 PolarHBondContact O-OG1 2.78Å
648	E	38.8	Very low	35	Very low	132 Å²	132	112.2 Å²	112.2	62%	0.617	57%	0.57	S	S	*	*	H	α-helix	trans	-57.2	-36	176.4	-78.3	-171.3	155	0	0	112.2	E644 T651 N652	E644-E648 WeakPolarHBondContact O-CB 3.45Å; E644-E648 WeakPolarHBondContact O-CG 3.39Å; E644-E648 PolarHBondContact O-N 3.19Å; E648-T651 PolarHBondContact O-OG1 3.33Å; E648-N652 WeakPolarHBondContact O-CB 3.3Å; E648-N652 PolarHBondContact O-N 2.87Å; E648-N652 VanDerWaalsContact O-N 3.07Å; E648-N652 PolarHBondContact O-ND2 2.83Å
649	Q	33.8	Very low	35.4	Very low	144 Å²	144	110.1 Å²	110.1	67%	0.673	56%	0.559	S	S	*	*	H	α-helix	trans	-81.9	-31.7	-178.7	-160.8	154.5	35	0	0	113	Q646 N647 I653	Q646-Q649 PolarHBondContact O-N 3.49Å; N647-Q649 PolarHBondContact O-N 2.89Å; Q649-I653 WeakPolarHBondContact O-CG1 3.49Å
650	Q	31.2	Very low	35.7	Very low	109 Å²	109	108.6 Å²	108.6	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-73.9	-42.2	172.9	-165.8	70	28	0	0	111.6	Q646 N647 I653 E654	Q646-Q650 WeakPolarHBondContact O-CB 3.43Å; Q646-Q650 PolarHBondContact O-N 3.25Å; N647-Q650 PolarHBondContact O-N 3.46Å; Q650-I653 PolarHBondContact O-N 3.4Å; Q650-E654 PolarHBondContact O-N 3.07Å
651	T	32.8	Very low	36	Very low	65 Å²	65	106.2 Å²	106.2	40%	0.399	55%	0.55	S	S	.	*	H	α-helix	trans	-68.4	-36.7	177.2	59.1	0	0	0	0	111.9	N647 E648 I653 E654 Q655	N647-T651 WeakPolarHBondContact O-CB 3.34Å; N647-T651 VanDerWaalsContact O-CG2 3.3Å; N647-T651 WeakPolarHBondContact O-CG2 3.23Å; N647-T651 PolarHBondContact O-N 3.19Å; N647-T651 PolarHBondContact O-OG1 2.78Å; E648-T651 PolarHBondContact O-OG1 3.33Å; T651-I653 VanDerWaalsContact C-N 3.26Å; T651-I653 PolarHBondContact O-N 3.48Å; T651-E654 PolarHBondContact O-N 3.03Å; T651-Q655 WeakPolarHBondContact O-CA 3.48Å; T651-Q655 WeakPolarHBondContact O-CB 3.45Å; T651-Q655 PolarHBondContact O-N 2.91Å
652	N	35.3	Very low	36.5	Very low	93 Å²	93	104.9 Å²	104.9	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-56.4	-40.1	172.8	-94.2	-83.8	0	0	0	112	E648 Q655 E656	E648-N652 WeakPolarHBondContact O-CB 3.3Å; E648-N652 PolarHBondContact O-N 2.87Å; E648-N652 VanDerWaalsContact O-N 3.07Å; E648-N652 PolarHBondContact O-ND2 2.83Å; N652-Q655 PolarHBondContact O-N 3.25Å; N652-E656 WeakPolarHBondContact O-CB 3.23Å; N652-E656 WeakPolarHBondContact O-CG 3.4Å; N652-E656 PolarHBondContact O-N 3.29Å
653	I	37.3	Very low	37.3	Very low	93 Å²	93	103.9 Å²	103.9	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-70.9	-44.4	-179.3	-64.9	168.7	0	0	0	111.4	Q649 Q650 T651 Q655 V657	Q649-I653 WeakPolarHBondContact O-CG1 3.49Å; Q650-I653 PolarHBondContact O-N 3.4Å; T651-I653 VanDerWaalsContact C-N 3.26Å; T651-I653 PolarHBondContact O-N 3.48Å; I653-Q655 VanDerWaalsContact C-N 3.28Å; I653-Q655 PolarHBondContact O-N 3.46Å; I653-V657 WeakPolarHBondContact O-CG2 3.47Å; I653-V657 PolarHBondContact O-N 3.12Å; I653-V657 VanDerWaalsContact O-N 3.08Å
654	E	33.6	Very low	38.3	Very low	124 Å²	124	101.4 Å²	101.4	58%	0.579	53%	0.528	S	S	*	.	H	α-helix	trans	-70.9	-26	176.5	-67.5	-179	-175.1	0	0	112.3	Q650 T651 S658	Q650-E654 PolarHBondContact O-N 3.07Å; T651-E654 PolarHBondContact O-N 3.03Å; E654-S658 WeakPolarHBondContact O-CB 3.48Å; E654-S658 PolarHBondContact O-N 3.18Å; E654-S658 VanDerWaalsContact O-N 3.09Å; E654-S658 PolarHBondContact O-OG 2.99Å
655	Q	35.1	Very low	39.4	Very low	114 Å²	114	103.6 Å²	103.6	53%	0.533	54%	0.538	S	S	.	.	H	α-helix	trans	-82.4	-32.7	176.4	-166	163.6	25.7	0	0	112.5	T651 N652 I653 S658 L659	T651-Q655 WeakPolarHBondContact O-CA 3.48Å; T651-Q655 WeakPolarHBondContact O-CB 3.45Å; T651-Q655 PolarHBondContact O-N 2.91Å; N652-Q655 PolarHBondContact O-N 3.25Å; I653-Q655 VanDerWaalsContact C-N 3.28Å; I653-Q655 PolarHBondContact O-N 3.46Å; Q655-S658 WeakPolarHBondContact CA-OG 3.31Å; Q655-S658 PolarHBondContact O-OG 3.11Å; Q655-L659 HydrophobicContact CG-CD1 4.27Å; Q655-L659 WeakPolarHBondContact O-CB 3.33Å; Q655-L659 WeakPolarHBondContact O-CD1 3.21Å; Q655-L659 WeakPolarHBondContact O-CG 3.3Å; Q655-L659 PolarHBondContact O-N 2.92Å
656	E	37.2	Very low	41.2	Very low	125 Å²	125	105.5 Å²	105.5	58%	0.584	54%	0.538	S	S	*	.	H	α-helix	trans	-63.4	-49.6	166.5	-81.5	-173.9	138.3	0	0	110.4	N652 S658 L659 D660	N652-E656 WeakPolarHBondContact O-CB 3.23Å; N652-E656 WeakPolarHBondContact O-CG 3.4Å; N652-E656 PolarHBondContact O-N 3.29Å; E656-S658 VanDerWaalsContact C-N 3.31Å; E656-S658 PolarHBondContact O-N 3.13Å; E656-L659 PolarHBondContact O-N 3.45Å; E656-D660 PolarHBondContact O-N 3.45Å
657	V	37.5	Very low	43.5	Very low	98 Å²	98	100.6 Å²	100.6	59%	0.594	51%	0.513	S	S	*	.	H	α-helix	trans	-64.3	-32.7	-179.4	171.8	0	0	0	0	112.8	I653	I653-V657 WeakPolarHBondContact O-CG2 3.47Å; I653-V657 PolarHBondContact O-N 3.12Å; I653-V657 VanDerWaalsContact O-N 3.08Å
658	S	35.4	Very low	46	Very low	65 Å²	65	100.1 Å²	100.1	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-84.9	-24.1	174.6	54.2	0	0	0	0	114	E654 Q655 E656 I662	E654-S658 WeakPolarHBondContact O-CB 3.48Å; E654-S658 PolarHBondContact O-N 3.18Å; E654-S658 VanDerWaalsContact O-N 3.09Å; E654-S658 PolarHBondContact O-OG 2.99Å; Q655-S658 WeakPolarHBondContact CA-OG 3.31Å; Q655-S658 PolarHBondContact O-OG 3.11Å; E656-S658 VanDerWaalsContact C-N 3.31Å; E656-S658 PolarHBondContact O-N 3.13Å; S658-I662 WeakPolarHBondContact O-CG1 3.5Å
659	L	43.2	Very low	48.3	Very low	92 Å²	92	95.6 Å²	95.6	48%	0.482	49%	0.494	S	S	.	.	H	α-helix	trans	-68.8	-43.2	166	-82.1	166.1	0	0	0	111.2	Q655 E656 L661 I662 L663	Q655-L659 HydrophobicContact CG-CD1 4.27Å; Q655-L659 WeakPolarHBondContact O-CB 3.33Å; Q655-L659 WeakPolarHBondContact O-CD1 3.21Å; Q655-L659 WeakPolarHBondContact O-CG 3.3Å; Q655-L659 PolarHBondContact O-N 2.92Å; E656-L659 PolarHBondContact O-N 3.45Å; L659-L661 VanDerWaalsContact C-N 3.34Å; L659-L661 PolarHBondContact O-N 3.2Å; L659-I662 PolarHBondContact O-N 3.46Å; L659-L663 HydrophobicContact CB-CD1 4.32Å; L659-L663 VanDerWaalsContact O-CB 3.3Å; L659-L663 WeakPolarHBondContact O-CB 3.3Å; L659-L663 VanDerWaalsContact O-CG 3.23Å; L659-L663 WeakPolarHBondContact O-CG 3.46Å; L659-L663 PolarHBondContact O-N 3.1Å
660	D	40.4	Very low	51	Low	100 Å²	100	89.6 Å²	89.6	54%	0.535	47%	0.467	S	S	.	.	H	α-helix	trans	-59.6	-41.1	-178.6	-101.5	-1.2	0	0	0	112.2	E656 I662 L663 V664	E656-D660 PolarHBondContact O-N 3.45Å; D660-I662 PolarHBondContact O-N 3.49Å; D660-L663 PolarHBondContact O-N 2.84Å; D660-V664 VanDerWaalsContact O-CG2 3.31Å; D660-V664 WeakPolarHBondContact O-CG2 3.1Å; D660-V664 PolarHBondContact O-N 3.32Å
661	L	37.4	Very low	53.9	Low	126 Å²	126	85.1 Å²	85.1	66%	0.66	45%	0.446	S	S	*	.	H	α-helix	trans	-63.7	-42.3	176.4	-117.4	79.3	0	0	0	112.6	L659 V664 E665	L659-L661 VanDerWaalsContact C-N 3.34Å; L659-L661 PolarHBondContact O-N 3.2Å; L661-V664 PolarHBondContact O-N 2.9Å; L661-E665 PolarHBondContact O-N 3.49Å
662	I	44.7	Very low	56.8	Low	98 Å²	98	89.1 Å²	89.1	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-70.1	-38.3	178	-64	172	0	0	0	110.4	S658 L659 D660 V664 E665 E666	S658-I662 WeakPolarHBondContact O-CG1 3.5Å; L659-I662 PolarHBondContact O-N 3.46Å; D660-I662 PolarHBondContact O-N 3.49Å; I662-V664 VanDerWaalsContact C-N 3.31Å; I662-V664 PolarHBondContact O-N 3.36Å; I662-E665 PolarHBondContact O-N 2.86Å; I662-E666 WeakPolarHBondContact O-CB 3.31Å; I662-E666 WeakPolarHBondContact O-CG 3.24Å; I662-E666 PolarHBondContact O-N 3.32Å
663	L	55.3	Low	59.5	Low	65 Å²	65	88 Å²	88	34%	0.34	45%	0.451	S	S	.	.	H	α-helix	trans	-65.4	-31.8	175	-74.8	168.3	0	0	0	112.1	L659 D660 Y667	L659-L663 HydrophobicContact CB-CD1 4.32Å; L659-L663 VanDerWaalsContact O-CB 3.3Å; L659-L663 WeakPolarHBondContact O-CB 3.3Å; L659-L663 VanDerWaalsContact O-CG 3.23Å; L659-L663 WeakPolarHBondContact O-CG 3.46Å; L659-L663 PolarHBondContact O-N 3.1Å; D660-L663 PolarHBondContact O-N 2.84Å; L663-Y667 WeakPolarHBondContact O-CA 3.32Å; L663-Y667 WeakPolarHBondContact O-CB 3.43Å; L663-Y667 PolarHBondContact O-N 3.17Å
664	V	55.3	Low	62.3	Low	80 Å²	80	83.6 Å²	83.6	49%	0.485	43%	0.428	S	S	.	.	H	α-helix	trans	-69.7	-46.1	173.8	166.6	0	0	0	0	111.4	D660 L661 I662 E666 Y667 D668	D660-V664 VanDerWaalsContact O-CG2 3.31Å; D660-V664 WeakPolarHBondContact O-CG2 3.1Å; D660-V664 PolarHBondContact O-N 3.32Å; L661-V664 PolarHBondContact O-N 2.9Å; I662-V664 VanDerWaalsContact C-N 3.31Å; I662-V664 PolarHBondContact O-N 3.36Å; V664-E666 VanDerWaalsContact C-N 3.34Å; V664-E666 PolarHBondContact O-N 2.76Å; V664-Y667 PolarHBondContact O-N 3.31Å; V664-D668 PolarHBondContact O-N 3.32Å
665	E	59.7	Low	65.2	Low	152 Å²	152	79.4 Å²	79.4	71%	0.71	41%	0.413	S	S	*	.	H	α-helix	trans	-64.5	-36.7	174.5	-69.8	-172.8	180	0	0	112.4	L661 I662 S669	L661-E665 PolarHBondContact O-N 3.49Å; I662-E665 PolarHBondContact O-N 2.86Å; E665-S669 VanDerWaalsContact O-CB 3.22Å; E665-S669 WeakPolarHBondContact O-CB 3.43Å; E665-S669 PolarHBondContact O-N 3.19Å
666	E	74.3	Confident	68	Low	93 Å²	93	77.3 Å²	77.3	44%	0.435	41%	0.405	S	S	.	.	H	α-helix	trans	-68.6	-35.9	171.8	-73.5	-170.7	158.9	0	0	112.5	I662 V664 L670	I662-E666 WeakPolarHBondContact O-CB 3.31Å; I662-E666 WeakPolarHBondContact O-CG 3.24Å; I662-E666 PolarHBondContact O-N 3.32Å; V664-E666 VanDerWaalsContact C-N 3.34Å; V664-E666 PolarHBondContact O-N 2.76Å; E666-L670 WeakPolarHBondContact O-CB 3.39Å; E666-L670 PolarHBondContact O-N 3.25Å
667	Y	81.5	Confident	70.9	Confident	39 Å²	39	71.5 Å²	71.5	15%	0.153	38%	0.377	C	S	.	.	H	α-helix	trans	-68.7	-53.3	179.2	170.3	-87.7	0	0	0	112.1	L663 V664 S669 L670 I671 T702 Q705 D706	L663-Y667 WeakPolarHBondContact O-CA 3.32Å; L663-Y667 WeakPolarHBondContact O-CB 3.43Å; L663-Y667 PolarHBondContact O-N 3.17Å; V664-Y667 PolarHBondContact O-N 3.31Å; Y667-S669 VanDerWaalsContact C-N 3.33Å; Y667-S669 PolarHBondContact O-N 3.25Å; Y667-L670 PolarHBondContact O-N 3.34Å; Y667-L670 VanDerWaalsContact O-N 3.12Å; Y667-I671 HydrophobicContact CD1-CG1 4.29Å; Y667-I671 HydrophobicContact CD2-CG1 4.31Å; Y667-I671 HydrophobicContact CE1-CG1 3.9Å; Y667-I671 HydrophobicContact CE2-CD1 4.34Å; Y667-I671 HydrophobicContact CE2-CG1 3.92Å; Y667-I671 HydrophobicContact CG-CG1 4.46Å; Y667-I671 WeakPolarHBondContact O-CB 3.38Å; Y667-I671 WeakPolarHBondContact O-CG1 3.42Å; Y667-I671 PolarHBondContact O-N 3.47Å; Y667-T702 HydrophobicContact CD2-CG2 3.83Å; Y667-T702 HydrophobicContact CE2-CG2 3.88Å; Y667-Q705 HydrophobicContact CE2-CB 3.7Å; Y667-D706 WeakPolarHBondContact OH-CA 3.45Å; Y667-D706 PolarHBondContact OH-N 2.87Å
668	D	85.6	Confident	73.8	Confident	95 Å²	95	67.7 Å²	67.7	51%	0.508	35%	0.354	S	S	.	.	H	α-helix	trans	-64.2	-41.3	-177.8	-76.7	-25.5	0	0	0	110.6	V664 L670 I671 E672	V664-D668 PolarHBondContact O-N 3.32Å; D668-L670 VanDerWaalsContact C-N 3.31Å; D668-L670 PolarHBondContact O-N 2.74Å; D668-I671 PolarHBondContact O-N 2.79Å; D668-E672 WeakPolarHBondContact O-CB 3.47Å; D668-E672 PolarHBondContact O-N 2.9Å
669	S	88.8	Confident	76.7	Confident	38 Å²	38	64.6 Å²	64.6	27%	0.266	33%	0.332	S	S	.	.	H	α-helix	trans	-63	-34.1	174	-178.5	0	0	0	0	113.2	E665 Y667 K673	E665-S669 VanDerWaalsContact O-CB 3.22Å; E665-S669 WeakPolarHBondContact O-CB 3.43Å; E665-S669 PolarHBondContact O-N 3.19Å; Y667-S669 VanDerWaalsContact C-N 3.33Å; Y667-S669 PolarHBondContact O-N 3.25Å; S669-K673 PolarHBondContact O-N 3.31Å
670	L	89.5	Confident	79.2	Confident	18 Å²	18	61.5 Å²	61.5	9%	0.094	32%	0.318	C	S	.	.	H	α-helix	trans	-75.1	-42.7	176.1	179	55.4	0	0	0	111.4	E666 Y667 D668 E672 K673 M674 F679 L684 V699 T702	E666-L670 WeakPolarHBondContact O-CB 3.39Å; E666-L670 PolarHBondContact O-N 3.25Å; Y667-L670 PolarHBondContact O-N 3.34Å; Y667-L670 VanDerWaalsContact O-N 3.12Å; D668-L670 VanDerWaalsContact C-N 3.31Å; D668-L670 PolarHBondContact O-N 2.74Å; L670-E672 PolarHBondContact O-N 2.9Å; L670-K673 PolarHBondContact O-N 3.28Å; L670-M674 HydrophobicContact CD1-CG 3.94Å; L670-M674 HydrophobicContact CD1-SD 3.82Å; L670-M674 HydrophobicContact CD2-SD 4.46Å; L670-M674 HydrophobicContact CG-CG 4.35Å; L670-M674 HydrophobicContact CG-SD 3.83Å; L670-M674 WeakPolarHBondContact O-CB 3.36Å; L670-M674 VanDerWaalsContact O-CG 3.27Å; L670-M674 WeakPolarHBondContact O-CG 3.47Å; L670-M674 PolarHBondContact O-N 3.37Å; L670-F679 HydrophobicContact CD1-CE2 4.16Å; L670-F679 HydrophobicContact CD1-CZ 4.39Å; L670-L684 HydrophobicContact CD1-CD1 4.25Å; L670-L684 HydrophobicContact CD1-CD2 3.59Å; L670-V699 HydrophobicContact CD2-CG2 4.44Å; L670-T702 HydrophobicContact CD2-CG2 4.01Å; L670-T702 HydrophobicContact CG-CG2 4.16Å
671	I	92.9	Very high	81.8	Confident	14 Å²	14	56.8 Å²	56.8	7%	0.072	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-39.1	176.9	-76.7	-66.5	0	0	0	112.1	Y667 D668 M674 S675 T702 D706	Y667-I671 HydrophobicContact CD1-CG1 4.29Å; Y667-I671 HydrophobicContact CD2-CG1 4.31Å; Y667-I671 HydrophobicContact CE1-CG1 3.9Å; Y667-I671 HydrophobicContact CE2-CD1 4.34Å; Y667-I671 HydrophobicContact CE2-CG1 3.92Å; Y667-I671 HydrophobicContact CG-CG1 4.46Å; Y667-I671 WeakPolarHBondContact O-CB 3.38Å; Y667-I671 WeakPolarHBondContact O-CG1 3.42Å; Y667-I671 PolarHBondContact O-N 3.47Å; D668-I671 PolarHBondContact O-N 2.79Å; I671-M674 PolarHBondContact O-N 3.41Å; I671-S675 WeakPolarHBondContact O-CB 3.36Å; I671-S675 PolarHBondContact O-N 3.29Å; I671-S675 PolarHBondContact O-OG 3.07Å; I671-T702 HydrophobicContact CD1-CG2 3.51Å; I671-T702 HydrophobicContact CG1-CG2 3.68Å; I671-D706 HydrophobicContact CD1-CB 3.82Å
672	E	92.3	Very high	84.6	Confident	149 Å²	149	53 Å²	53	70%	0.696	27%	0.271	S	S	*	.	H	α-helix	trans	-58.1	-53.8	172.1	-176.8	-175.4	-153.9	0	0	110.6	D668 L670 M674 S675	D668-E672 WeakPolarHBondContact O-CB 3.47Å; D668-E672 PolarHBondContact O-N 2.9Å; L670-E672 PolarHBondContact O-N 2.9Å; E672-M674 VanDerWaalsContact C-N 3.33Å; E672-M674 PolarHBondContact O-N 2.97Å; E672-S675 PolarHBondContact O-N 2.92Å
673	K	92.9	Very high	87	Confident	71 Å²	71	53.2 Å²	53.2	31%	0.309	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-38.9	178.1	-76.2	-164.2	171.6	-153.9	0	113.2	S669 L670 S675 F679 P680 E683	S669-K673 PolarHBondContact O-N 3.31Å; L670-K673 PolarHBondContact O-N 3.28Å; K673-S675 VanDerWaalsContact C-N 3.34Å; K673-F679 HydrophobicContact CB-CD2 4.29Å; K673-F679 HydrophobicContact CB-CE2 4.44Å; K673-P680 HydrophobicContact CD-CG 4.22Å; K673-E683 IonicContact NZ-OE2 3.82Å; K673-E683 PolarHBondContact NZ-OE2 3.42Å
674	M	95.2	Very high	88.8	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-74.1	-23.6	179.5	-73.9	-177.3	70.5	0	0	113	L670 I671 E672 N676 F679 V699 L703 H747 W750	L670-M674 HydrophobicContact CD1-CG 3.94Å; L670-M674 HydrophobicContact CD1-SD 3.82Å; L670-M674 HydrophobicContact CD2-SD 4.46Å; L670-M674 HydrophobicContact CG-CG 4.35Å; L670-M674 HydrophobicContact CG-SD 3.83Å; L670-M674 WeakPolarHBondContact O-CB 3.36Å; L670-M674 VanDerWaalsContact O-CG 3.27Å; L670-M674 WeakPolarHBondContact O-CG 3.47Å; L670-M674 PolarHBondContact O-N 3.37Å; I671-M674 PolarHBondContact O-N 3.41Å; E672-M674 VanDerWaalsContact C-N 3.33Å; E672-M674 PolarHBondContact O-N 2.97Å; M674-N676 PolarHBondContact O-N 2.93Å; M674-F679 HydrophobicContact CB-CD2 4.42Å; M674-F679 HydrophobicContact CG-CD2 3.71Å; M674-F679 HydrophobicContact CG-CE1 4.41Å; M674-F679 HydrophobicContact CG-CE2 3.59Å; M674-F679 HydrophobicContact CG-CG 4.2Å; M674-F679 HydrophobicContact CG-CZ 3.97Å; M674-V699 HydrophobicContact CE-CG1 3.57Å; M674-V699 HydrophobicContact SD-CG1 4.09Å; M674-V699 HydrophobicContact SD-CG2 4.39Å; M674-L703 HydrophobicContact CE-CD1 3.89Å; M674-L703 HydrophobicContact CE-CD2 3.47Å; M674-L703 VanDerWaalsContact CE-CD2 3.47Å; M674-L703 HydrophobicContact CE-CG 3.77Å; M674-L703 HydrophobicContact SD-CD2 4.46Å; M674-H747 HydrophobicContact CE-CB 4.26Å; M674-H747 PolarHBondContact O-NE2 3.14Å; M674-W750 HydrophobicContact CB-CH2 4.19Å; M674-W750 HydrophobicContact CB-CZ3 4.18Å; M674-W750 VanDerWaalsContact O-CZ3 3.29Å; M674-W750 WeakPolarHBondContact O-CZ3 3.44Å
675	S	94.7	Very high	90.6	Very high	36 Å²	36	48.6 Å²	48.6	25%	0.252	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-0.7	-180	-68.9	0	0	0	0	114.6	I671 E672 K673 R755	I671-S675 WeakPolarHBondContact O-CB 3.36Å; I671-S675 PolarHBondContact O-N 3.29Å; I671-S675 PolarHBondContact O-OG 3.07Å; E672-S675 PolarHBondContact O-N 2.92Å; K673-S675 VanDerWaalsContact C-N 3.34Å; S675-R755 PolarHBondContact OG-NH1 3.38Å; S675-R755 VanDerWaalsContact OG-NH1 3.1Å
676	N	95.4	Very high	92.2	Very high	69 Å²	69	49 Å²	49	37%	0.369	25%	0.245	S	C	.	.	S	Bend	trans	-99.5	140.4	168.5	-178.3	1.1	0	0	0	110.7	M674 N678 F679 H747 Y751	M674-N676 PolarHBondContact O-N 2.93Å; N676-N678 PolarHBondContact O-N 2.74Å; N676-N678 PolarHBondContact OD1-N 3.12Å; N676-F679 PolarHBondContact O-N 3.19Å; N676-H747 PolarHBondContact O-CE1 3.04Å; N676-H747 PolarHBondContact O-NE2 3.37Å; N676-Y751 VanDerWaalsContact C-CE2 3.47Å
677	W	97.5	Very high	93	Very high	3 Å²	3	50.4 Å²	50.4	1%	0.011	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-40.2	170.9	173.9	-114.9	0	0	0	111.6	F679 A748 Y751 L752 N939 A942 K943 L1061	W677-F679 PolarHBondContact O-N 3.4Å; W677-F679 VanDerWaalsContact O-N 3.09Å; W677-A748 HydrophobicContact CH2-CB 4.08Å; W677-A748 HydrophobicContact CZ3-CB 3.89Å; W677-Y751 HydrophobicContact CB-CD1 4.45Å; W677-Y751 HydrophobicContact CB-CE1 3.8Å; W677-Y751 HydrophobicContact CB-CE2 4.17Å; W677-Y751 HydrophobicContact CD2-CD1 4.45Å; W677-Y751 HydrophobicContact CD2-CE1 4.45Å; W677-Y751 AromaticContact CE3-CD1 3.54Å; W677-Y751 HydrophobicContact CE3-CD1 3.54Å; W677-Y751 AromaticContact CE3-CE1 3.96Å; W677-Y751 HydrophobicContact CE3-CE1 3.96Å; W677-Y751 HydrophobicContact CE3-CG 4.01Å; W677-Y751 HydrophobicContact CG-CE1 4.44Å; W677-Y751 HydrophobicContact CZ3-CD1 4.23Å; W677-Y751 PolarHBondContact N-OH 3.14Å; W677-L752 HydrophobicContact CZ3-CD1 4.48Å; W677-L752 HydrophobicContact CZ3-CD2 4.29Å; W677-L752 HydrophobicContact CZ3-CG 4.12Å; W677-N939 HydrophobicContact CH2-CB 4.1Å; W677-N939 HydrophobicContact CZ2-CB 4.21Å; W677-A942 PolarHBondContact NE1-O 3.47Å; W677-K943 HydrophobicContact CD2-CD 4.38Å; W677-K943 HydrophobicContact CZ2-CD 4.29Å; W677-K943 WeakPolarHBondContact O-CD 3.29Å; W677-K943 WeakPolarHBondContact O-CE 3.39Å; W677-L1061 HydrophobicContact CD2-CB 4.47Å; W677-L1061 HydrophobicContact CH2-CD2 3.91Å; W677-L1061 HydrophobicContact CZ2-CB 3.96Å; W677-L1061 HydrophobicContact CZ2-CD2 3.7Å; W677-L1061 HydrophobicContact CZ2-CG 4.47Å; W677-L1061 HydrophobicContact CZ3-CD2 4.42Å
678	N	97.6	Very high	93.3	Very high	19 Å²	19	50.1 Å²	50.1	10%	0.102	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	53.1	175	-61.6	-57	0	0	0	110.9	N676 P680 V944 L947 Q1060 H1064	N676-N678 PolarHBondContact O-N 2.74Å; N676-N678 PolarHBondContact OD1-N 3.12Å; N678-P680 WeakPolarHBondContact O-CD 3.47Å; N678-V944 HydrophobicContact CB-CB 4.4Å; N678-V944 HydrophobicContact CB-CG1 3.95Å; N678-V944 WeakPolarHBondContact OD1-CB 3.25Å; N678-V944 PolarHBondContact OD1-N 3.37Å; N678-L947 HydrophobicContact CB-CD1 4.3Å; N678-Q1060 PolarHBondContact ND2-NE2 3.41Å; N678-H1064 PolarHBondContact ND2-NE2 3.48Å
679	F	96.4	Very high	93.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.			trans	-54.6	120.8	171.6	163.3	-126.7	0	0	0	109.7	L670 K673 M674 N676 W677 I681 L684 H747	L670-F679 HydrophobicContact CD1-CE2 4.16Å; L670-F679 HydrophobicContact CD1-CZ 4.39Å; K673-F679 HydrophobicContact CB-CD2 4.29Å; K673-F679 HydrophobicContact CB-CE2 4.44Å; M674-F679 HydrophobicContact CB-CD2 4.42Å; M674-F679 HydrophobicContact CG-CD2 3.71Å; M674-F679 HydrophobicContact CG-CE1 4.41Å; M674-F679 HydrophobicContact CG-CE2 3.59Å; M674-F679 HydrophobicContact CG-CG 4.2Å; M674-F679 HydrophobicContact CG-CZ 3.97Å; N676-F679 PolarHBondContact O-N 3.19Å; W677-F679 PolarHBondContact O-N 3.4Å; W677-F679 VanDerWaalsContact O-N 3.09Å; F679-I681 HydrophobicContact CD1-CB 3.87Å; F679-I681 HydrophobicContact CD1-CG1 4.41Å; F679-I681 HydrophobicContact CE1-CB 3.61Å; F679-I681 HydrophobicContact CE1-CD1 4.05Å; F679-I681 HydrophobicContact CE1-CG1 3.71Å; F679-I681 HydrophobicContact CZ-CB 4.22Å; F679-I681 HydrophobicContact CZ-CG1 4.27Å; F679-I681 PolarHBondContact O-N 2.99Å; F679-L684 HydrophobicContact CE2-CD2 4.32Å; F679-L684 HydrophobicContact CZ-CB 4.43Å; F679-L684 HydrophobicContact CZ-CD2 3.76Å; F679-H747 WeakPolarHBondContact CB-CE1 3.32Å; F679-H747 HydrophobicContact CD1-CB 4.22Å; F679-H747 AromaticContact CD1-CG 3.83Å
680	P	95.2	Very high	93.6	Very high	27 Å²	27	55.5 Å²	55.5	18%	0.175	28%	0.28	C	S	.	.			trans	-79.2	70.5	-176.2	32.6	-36.5	0	0	0	110.9	K673 N678 F682 E683 L684	K673-P680 HydrophobicContact CD-CG 4.22Å; N678-P680 WeakPolarHBondContact O-CD 3.47Å; P680-F682 VanDerWaalsContact C-N 3.26Å; P680-F682 PolarHBondContact O-N 2.98Å; P680-E683 HydrophobicContact CB-CB 4.17Å; P680-E683 VanDerWaalsContact CB-CD 3.49Å; P680-E683 HydrophobicContact CB-CG 3.87Å; P680-E683 WeakPolarHBondContact O-CB 3.46Å; P680-E683 PolarHBondContact O-N 3.23Å; P680-E683 VanDerWaalsContact O-N 3.07Å; P680-L684 PolarHBondContact O-N 2.93Å
681	I	96.6	Very high	93.5	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.8	-36	-174.1	-170.5	169.2	0	0	0	113.1	F679 L684 V685 I695 I740 T743 D744 W951	F679-I681 HydrophobicContact CD1-CB 3.87Å; F679-I681 HydrophobicContact CD1-CG1 4.41Å; F679-I681 HydrophobicContact CE1-CB 3.61Å; F679-I681 HydrophobicContact CE1-CD1 4.05Å; F679-I681 HydrophobicContact CE1-CG1 3.71Å; F679-I681 HydrophobicContact CZ-CB 4.22Å; F679-I681 HydrophobicContact CZ-CG1 4.27Å; F679-I681 PolarHBondContact O-N 2.99Å; I681-L684 WeakPolarHBondContact O-CB 3.28Å; I681-L684 PolarHBondContact O-N 3.28Å; I681-L684 VanDerWaalsContact O-N 3.13Å; I681-V685 WeakPolarHBondContact O-CG2 3.47Å; I681-V685 PolarHBondContact O-N 3.18Å; I681-I695 HydrophobicContact CG1-CD1 4.11Å; I681-I740 HydrophobicContact CD1-CG2 3.65Å; I681-I740 WeakPolarHBondContact CD1-O 3.46Å; I681-I740 HydrophobicContact CG1-CG2 3.88Å; I681-T743 HydrophobicContact CD1-CG2 3.85Å; I681-D744 HydrophobicContact CD1-CB 3.87Å; I681-W951 HydrophobicContact CG2-CZ2 4.23Å
682	F	96.4	Very high	93.3	Very high	46 Å²	46	61.8 Å²	61.8	20%	0.202	31%	0.31	C	S	.	.	H	α-helix	trans	-69.9	-33	178.1	-60.7	-72.3	0	0	0	112.6	P680 L684 V685 E686 I740 L947 K950 W951	P680-F682 VanDerWaalsContact C-N 3.26Å; P680-F682 PolarHBondContact O-N 2.98Å; F682-L684 VanDerWaalsContact C-N 3.27Å; F682-L684 PolarHBondContact O-N 3.17Å; F682-V685 WeakPolarHBondContact O-CB 3.18Å; F682-V685 PolarHBondContact O-N 3.09Å; F682-E686 PolarHBondContact O-N 3.5Å; F682-I740 HydrophobicContact CE1-CG2 4.25Å; F682-L947 HydrophobicContact CD2-CD2 3.81Å; F682-L947 HydrophobicContact CE2-CD2 4.11Å; F682-K950 HydrophobicContact CD1-CG 4.32Å; F682-K950 HydrophobicContact CD2-CB 4.34Å; F682-K950 HydrophobicContact CD2-CG 3.91Å; F682-K950 HydrophobicContact CE1-CG 4.03Å; F682-K950 HydrophobicContact CE2-CB 3.87Å; F682-K950 HydrophobicContact CE2-CG 3.59Å; F682-K950 HydrophobicContact CG-CG 4.27Å; F682-K950 HydrophobicContact CZ-CB 4.27Å; F682-K950 HydrophobicContact CZ-CG 3.65Å; F682-W951 HydrophobicContact CE1-CH2 4.34Å; F682-W951 HydrophobicContact CE2-CD2 4.47Å; F682-W951 HydrophobicContact CE2-CZ2 4.22Å; F682-W951 HydrophobicContact CZ-CD2 4.01Å; F682-W951 AromaticContact CZ-CE2 3.82Å; F682-W951 HydrophobicContact CZ-CE3 4.1Å; F682-W951 AromaticContact CZ-CH2 3.84Å; F682-W951 HydrophobicContact CZ-CH2 3.84Å; F682-W951 AromaticContact CZ-CZ2 3.73Å; F682-W951 HydrophobicContact CZ-CZ2 3.73Å; F682-W951 HydrophobicContact CZ-CZ3 4.04Å
683	E	94.6	Very high	93.2	Very high	103 Å²	103	56.1 Å²	56.1	48%	0.481	29%	0.291	S	S	.	.	H	α-helix	trans	-64	-33.5	169.2	-66.3	176.8	-163.2	0	0	111.8	K673 P680 E686 K687	K673-E683 IonicContact NZ-OE2 3.82Å; K673-E683 PolarHBondContact NZ-OE2 3.42Å; P680-E683 HydrophobicContact CB-CB 4.17Å; P680-E683 VanDerWaalsContact CB-CD 3.49Å; P680-E683 HydrophobicContact CB-CG 3.87Å; P680-E683 WeakPolarHBondContact O-CB 3.46Å; P680-E683 PolarHBondContact O-N 3.23Å; P680-E683 VanDerWaalsContact O-N 3.07Å; E683-E686 PolarHBondContact O-N 3.22Å; E683-K687 VanDerWaalsContact O-CB 3.31Å; E683-K687 WeakPolarHBondContact O-CB 3.43Å; E683-K687 PolarHBondContact O-N 3.37Å
684	L	92.5	Very high	93.2	Very high	18 Å²	18	57.5 Å²	57.5	9%	0.094	30%	0.295	C	S	.	.	H	α-helix	trans	-69.7	-41.6	175.9	-177.3	63.2	0	0	0	111	L670 F679 P680 I681 F682 E686 K687 M688 I695 V699	L670-L684 HydrophobicContact CD1-CD1 4.25Å; L670-L684 HydrophobicContact CD1-CD2 3.59Å; F679-L684 HydrophobicContact CE2-CD2 4.32Å; F679-L684 HydrophobicContact CZ-CB 4.43Å; F679-L684 HydrophobicContact CZ-CD2 3.76Å; P680-L684 PolarHBondContact O-N 2.93Å; I681-L684 WeakPolarHBondContact O-CB 3.28Å; I681-L684 PolarHBondContact O-N 3.28Å; I681-L684 VanDerWaalsContact O-N 3.13Å; F682-L684 VanDerWaalsContact C-N 3.27Å; F682-L684 PolarHBondContact O-N 3.17Å; L684-E686 VanDerWaalsContact C-N 3.28Å; L684-E686 PolarHBondContact O-N 3.37Å; L684-K687 PolarHBondContact O-N 3.25Å; L684-M688 HydrophobicContact CD1-CG 4.08Å; L684-M688 HydrophobicContact CD1-SD 4.26Å; L684-M688 HydrophobicContact CG-CG 4.28Å; L684-M688 HydrophobicContact CG-SD 4.02Å; L684-M688 WeakPolarHBondContact O-CB 3.32Å; L684-M688 VanDerWaalsContact O-CG 3.23Å; L684-M688 WeakPolarHBondContact O-CG 3.42Å; L684-M688 PolarHBondContact O-N 3.27Å; L684-I695 HydrophobicContact CB-CD1 4.44Å; L684-I695 HydrophobicContact CD2-CD1 4.02Å; L684-I695 HydrophobicContact CD2-CG1 4.03Å; L684-I695 HydrophobicContact CG-CD1 4.17Å; L684-I695 HydrophobicContact CG-CG1 4.46Å; L684-V699 HydrophobicContact CD2-CG2 4.21Å
685	V	93.3	Very high	93.3	Very high	31 Å²	31	57.5 Å²	57.5	19%	0.188	30%	0.295	C	S	.	.	H	α-helix	trans	-55.5	-45.9	172.8	173.2	0	0	0	0	110.4	I681 F682 M688 G689 I695 I740	I681-V685 WeakPolarHBondContact O-CG2 3.47Å; I681-V685 PolarHBondContact O-N 3.18Å; F682-V685 WeakPolarHBondContact O-CB 3.18Å; F682-V685 PolarHBondContact O-N 3.09Å; V685-M688 PolarHBondContact O-N 2.93Å; V685-G689 PolarHBondContact O-N 2.75Å; V685-I695 HydrophobicContact CG2-CD1 3.56Å; V685-I740 HydrophobicContact CG1-CD1 4.44Å; V685-I740 HydrophobicContact CG2-CD1 3.96Å; V685-I740 HydrophobicContact CG2-CG1 4.11Å; V685-I740 HydrophobicContact CG2-CG2 4.04Å
686	E	93.1	Very high	93.4	Very high	159 Å²	159	55.8 Å²	55.8	74%	0.743	28%	0.283	S	S	*	.	H	α-helix	trans	-65.9	-47.2	175.9	-70.1	-179	-179.7	0	0	112.6	F682 E683 L684 M688 G689	F682-E686 PolarHBondContact O-N 3.5Å; E683-E686 PolarHBondContact O-N 3.22Å; L684-E686 VanDerWaalsContact C-N 3.28Å; L684-E686 PolarHBondContact O-N 3.37Å; E686-M688 PolarHBondContact O-N 3.26Å; E686-G689 PolarHBondContact O-N 3.37Å; E686-G689 VanDerWaalsContact O-N 3.07Å
687	K	91	Very high	93.5	Very high	124 Å²	124	52.5 Å²	52.5	54%	0.539	27%	0.265	S	S	.	.	H	α-helix	trans	-57.1	-35.7	176.2	-175.5	-174.3	176.4	-170.6	0	112	E683 L684	E683-K687 VanDerWaalsContact O-CB 3.31Å; E683-K687 WeakPolarHBondContact O-CB 3.43Å; E683-K687 PolarHBondContact O-N 3.37Å; L684-K687 PolarHBondContact O-N 3.25Å
688	M	88.4	Confident	93.4	Very high	33 Å²	33	54.1 Å²	54.1	16%	0.163	27%	0.273	C	S	.	.	H	α-helix	trans	-77.6	-22	179.2	-69.5	-177.9	82	0	0	113.5	L684 V685 E686 E690 K691 I695 Q698	L684-M688 HydrophobicContact CD1-CG 4.08Å; L684-M688 HydrophobicContact CD1-SD 4.26Å; L684-M688 HydrophobicContact CG-CG 4.28Å; L684-M688 HydrophobicContact CG-SD 4.02Å; L684-M688 WeakPolarHBondContact O-CB 3.32Å; L684-M688 VanDerWaalsContact O-CG 3.23Å; L684-M688 WeakPolarHBondContact O-CG 3.42Å; L684-M688 PolarHBondContact O-N 3.27Å; V685-M688 PolarHBondContact O-N 2.93Å; E686-M688 PolarHBondContact O-N 3.26Å; M688-E690 PolarHBondContact O-N 2.79Å; M688-K691 HydrophobicContact CB-CB 4.48Å; M688-K691 WeakPolarHBondContact O-CA 3.3Å; M688-K691 WeakPolarHBondContact O-CB 3.18Å; M688-K691 PolarHBondContact O-N 2.88Å; M688-I695 HydrophobicContact CE-CB 4.47Å; M688-I695 HydrophobicContact SD-CB 3.87Å; M688-I695 HydrophobicContact SD-CD1 4.49Å; M688-I695 HydrophobicContact SD-CG1 3.9Å; M688-Q698 HydrophobicContact CE-CB 4.45Å; M688-Q698 HydrophobicContact CE-CG 3.73Å
689	G	91.9	Very high	93.4	Very high	41 Å²	41	53.2 Å²	53.2	42%	0.423	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	52.4	-124.2	177.9	0	0	0	0	0	112.8	V685 E686 K691 S692	V685-G689 PolarHBondContact O-N 2.75Å; E686-G689 PolarHBondContact O-N 3.37Å; E686-G689 VanDerWaalsContact O-N 3.07Å; G689-K691 PolarHBondContact O-N 2.88Å; G689-K691 VanDerWaalsContact O-N 3.17Å; G689-S692 WeakPolarHBondContact O-CB 3.35Å; G689-S692 PolarHBondContact O-N 2.68Å; G689-S692 PolarHBondContact O-OG 3.46Å
690	E	87.4	Confident	93.4	Very high	205 Å²	205	53.2 Å²	53.2	96%	0.958	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23.6	176.1	-61	-175.4	168.6	0	0	113.8	M688 S692	M688-E690 PolarHBondContact O-N 2.79Å; E690-S692 VanDerWaalsContact C-N 3.31Å
691	K	89.1	Confident	93.5	Very high	126 Å²	126	54.2 Å²	54.2	55%	0.548	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-82	-6.1	177.2	-58.4	174.5	-177.6	171.9	0	113.1	M688 G689 G693 R694	M688-K691 HydrophobicContact CB-CB 4.48Å; M688-K691 WeakPolarHBondContact O-CA 3.3Å; M688-K691 WeakPolarHBondContact O-CB 3.18Å; M688-K691 PolarHBondContact O-N 2.88Å; G689-K691 PolarHBondContact O-N 2.88Å; G689-K691 VanDerWaalsContact O-N 3.17Å; K691-G693 PolarHBondContact O-N 3.13Å; K691-G693 VanDerWaalsContact O-N 3.12Å; K691-R694 PolarHBondContact O-N 3.16Å
692	S	88.6	Confident	93.5	Very high	38 Å²	38	54.7 Å²	54.7	27%	0.266	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-57	-25.4	-177.3	57.3	0	0	0	0	114.3	G689 E690 R694 I695	G689-S692 WeakPolarHBondContact O-CB 3.35Å; G689-S692 PolarHBondContact O-N 2.68Å; G689-S692 PolarHBondContact O-OG 3.46Å; E690-S692 VanDerWaalsContact C-N 3.31Å; S692-R694 PolarHBondContact O-N 3.12Å; S692-I695 WeakPolarHBondContact O-CB 3.46Å; S692-I695 WeakPolarHBondContact O-CG2 3.37Å; S692-I695 PolarHBondContact O-N 2.67Å; S692-I695 VanDerWaalsContact O-N 3.14Å
693	G	89.7	Confident	93.6	Very high	29 Å²	29	52.5 Å²	52.5	30%	0.299	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-58.9	-9.1	169.5	0	0	0	0	0	115	K691 R739	K691-G693 PolarHBondContact O-N 3.13Å; K691-G693 VanDerWaalsContact O-N 3.12Å; G693-R739 PolarHBondContact O-NE 3.32Å
694	R	93.1	Very high	93.7	Very high	101 Å²	101	47.6 Å²	47.6	38%	0.381	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-115.1	17.9	178.6	-50.7	-170.5	-51.1	-177.6	10.3	114.4	K691 S692 S697 Q698 E728	K691-R694 PolarHBondContact O-N 3.16Å; S692-R694 PolarHBondContact O-N 3.12Å; R694-S697 PolarHBondContact O-N 2.76Å; R694-S697 PolarHBondContact O-OG 3.5Å; R694-Q698 WeakPolarHBondContact O-CG 3.48Å; R694-Q698 PolarHBondContact O-N 3.28Å; R694-Q698 VanDerWaalsContact O-N 3.14Å; R694-E728 WeakPolarHBondContact CA-OE1 3.46Å; R694-E728 WeakPolarHBondContact CA-OE2 3.5Å
695	I	96.1	Very high	93.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.3	-44.8	-176.1	-170.9	171.6	0	0	0	113.7	I681 L684 V685 M688 S692 Q698 V699 E728 R739 T743	I681-I695 HydrophobicContact CG1-CD1 4.11Å; L684-I695 HydrophobicContact CB-CD1 4.44Å; L684-I695 HydrophobicContact CD2-CD1 4.02Å; L684-I695 HydrophobicContact CD2-CG1 4.03Å; L684-I695 HydrophobicContact CG-CD1 4.17Å; L684-I695 HydrophobicContact CG-CG1 4.46Å; V685-I695 HydrophobicContact CG2-CD1 3.56Å; M688-I695 HydrophobicContact CE-CB 4.47Å; M688-I695 HydrophobicContact SD-CB 3.87Å; M688-I695 HydrophobicContact SD-CD1 4.49Å; M688-I695 HydrophobicContact SD-CG1 3.9Å; S692-I695 WeakPolarHBondContact O-CB 3.46Å; S692-I695 WeakPolarHBondContact O-CG2 3.37Å; S692-I695 PolarHBondContact O-N 2.67Å; S692-I695 VanDerWaalsContact O-N 3.14Å; I695-Q698 PolarHBondContact O-N 2.86Å; I695-V699 HydrophobicContact CG1-CG2 4.44Å; I695-V699 WeakPolarHBondContact O-CB 3.5Å; I695-V699 WeakPolarHBondContact O-CG2 3.3Å; I695-V699 PolarHBondContact O-N 2.95Å; I695-E728 PolarHBondContact N-OE1 3.11Å; I695-E728 VanDerWaalsContact N-OE1 3.11Å; I695-R739 HydrophobicContact CG2-CG 4.08Å; I695-T743 HydrophobicContact CG1-CG2 4.25Å
696	L	97.9	Very high	93.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-69.1	-37.2	-177.7	176.8	66.7	0	0	0	111.5	M700 E728 Y731 A742 T743 L746 A819	L696-M700 HydrophobicContact CD1-CG 4.27Å; L696-M700 VanDerWaalsContact O-CB 3.22Å; L696-M700 WeakPolarHBondContact O-CB 3.43Å; L696-M700 VanDerWaalsContact O-CG 3.3Å; L696-M700 WeakPolarHBondContact O-CG 3.37Å; L696-M700 PolarHBondContact O-N 3.02Å; L696-E728 WeakPolarHBondContact CA-OE1 3.06Å; L696-E728 HydrophobicContact CB-CG 3.76Å; L696-E728 WeakPolarHBondContact CB-OE1 3.3Å; L696-E728 HydrophobicContact CD2-CG 4.14Å; L696-E728 HydrophobicContact CG-CG 4.36Å; L696-E728 PolarHBondContact N-OE1 2.84Å; L696-Y731 HydrophobicContact CD2-CE2 4.22Å; L696-A742 HydrophobicContact CD1-CB 4.42Å; L696-A742 HydrophobicContact CD2-CB 4.15Å; L696-T743 WeakPolarHBondContact CA-OG1 3.42Å; L696-T743 WeakPolarHBondContact CB-OG1 3.34Å; L696-L746 HydrophobicContact CD1-CD2 3.68Å; L696-A819 HydrophobicContact CD1-CB 4.1Å; L696-A819 HydrophobicContact CD2-CB 4.49Å
697	S	96.9	Very high	94.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-74.8	-29.2	177	63.4	0	0	0	0	112.9	R694 Y701 R725 E728	R694-S697 PolarHBondContact O-N 2.76Å; R694-S697 PolarHBondContact O-OG 3.5Å; S697-Y701 WeakPolarHBondContact O-CB 3.39Å; S697-Y701 PolarHBondContact O-N 3.34Å; S697-R725 WeakPolarHBondContact OG-CG 3.36Å; S697-E728 WeakPolarHBondContact CB-OE2 3.41Å; S697-E728 PolarHBondContact N-OE1 3.23Å; S697-E728 PolarHBondContact OG-OE2 2.91Å
698	Q	95.5	Very high	94.3	Very high	37 Å²	37	34.8 Å²	34.8	17%	0.173	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-52.7	168.6	-63.2	-37.9	-96.9	0	0	110.3	M688 R694 I695 M700 Y701 T702 M721	M688-Q698 HydrophobicContact CE-CB 4.45Å; M688-Q698 HydrophobicContact CE-CG 3.73Å; R694-Q698 WeakPolarHBondContact O-CG 3.48Å; R694-Q698 PolarHBondContact O-N 3.28Å; R694-Q698 VanDerWaalsContact O-N 3.14Å; I695-Q698 PolarHBondContact O-N 2.86Å; Q698-M700 PolarHBondContact O-N 3.33Å; Q698-Y701 WeakPolarHBondContact O-CB 3.44Å; Q698-Y701 PolarHBondContact O-N 3.3Å; Q698-T702 PolarHBondContact O-N 3.25Å; Q698-T702 PolarHBondContact O-OG1 3.39Å; Q698-T702 VanDerWaalsContact O-OG1 3.14Å; Q698-M721 VanDerWaalsContact NE2-CE 3.31Å
699	V	97	Very high	94.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-41	-178.7	172.5	0	0	0	0	112	L670 M674 L684 I695 Y701 T702 L703 T743 L746	L670-V699 HydrophobicContact CD2-CG2 4.44Å; M674-V699 HydrophobicContact CE-CG1 3.57Å; M674-V699 HydrophobicContact SD-CG1 4.09Å; M674-V699 HydrophobicContact SD-CG2 4.39Å; L684-V699 HydrophobicContact CD2-CG2 4.21Å; I695-V699 HydrophobicContact CG1-CG2 4.44Å; I695-V699 WeakPolarHBondContact O-CB 3.5Å; I695-V699 WeakPolarHBondContact O-CG2 3.3Å; I695-V699 PolarHBondContact O-N 2.95Å; V699-Y701 VanDerWaalsContact C-N 3.33Å; V699-Y701 PolarHBondContact O-N 3.42Å; V699-T702 PolarHBondContact O-N 2.85Å; V699-L703 HydrophobicContact CG1-CD1 4.03Å; V699-L703 HydrophobicContact CG1-CG 4.25Å; V699-L703 WeakPolarHBondContact O-CB 3.39Å; V699-L703 VanDerWaalsContact O-CG 3.31Å; V699-L703 WeakPolarHBondContact O-CG 3.5Å; V699-L703 PolarHBondContact O-N 2.76Å; V699-T743 HydrophobicContact CB-CG2 3.87Å; V699-T743 HydrophobicContact CG1-CG2 3.92Å; V699-T743 HydrophobicContact CG2-CG2 3.73Å; V699-L746 HydrophobicContact CG1-CD2 3.86Å; V699-L746 HydrophobicContact CG1-CG 4.48Å
700	M	97.9	Very high	95	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.4	-42.8	172.7	-84.2	-64.7	-83.6	0	0	112.4	L696 Q698 F704 F720 F724 L746 V816 A819	L696-M700 HydrophobicContact CD1-CG 4.27Å; L696-M700 VanDerWaalsContact O-CB 3.22Å; L696-M700 WeakPolarHBondContact O-CB 3.43Å; L696-M700 VanDerWaalsContact O-CG 3.3Å; L696-M700 WeakPolarHBondContact O-CG 3.37Å; L696-M700 PolarHBondContact O-N 3.02Å; Q698-M700 PolarHBondContact O-N 3.33Å; M700-F704 HydrophobicContact CE-CD2 4.25Å; M700-F704 HydrophobicContact CE-CE2 3.51Å; M700-F704 HydrophobicContact CE-CZ 3.98Å; M700-F704 WeakPolarHBondContact O-CB 3.35Å; M700-F704 WeakPolarHBondContact O-CD2 3.47Å; M700-F704 PolarHBondContact O-N 3.46Å; M700-F704 HydrophobicContact SD-CD2 4.46Å; M700-F704 HydrophobicContact SD-CE2 4.04Å; M700-F720 HydrophobicContact CB-CE1 4.17Å; M700-F720 HydrophobicContact CB-CZ 3.93Å; M700-F720 HydrophobicContact CE-CZ 4.46Å; M700-F724 HydrophobicContact CB-CG 4.45Å; M700-F724 HydrophobicContact CE-CD1 4.1Å; M700-F724 HydrophobicContact CE-CD2 4.45Å; M700-F724 HydrophobicContact CE-CE1 3.47Å; M700-F724 VanDerWaalsContact CE-CE1 3.47Å; M700-F724 HydrophobicContact CE-CE2 3.88Å; M700-F724 HydrophobicContact CE-CZ 3.36Å; M700-F724 HydrophobicContact CG-CD1 4.18Å; M700-F724 HydrophobicContact CG-CE1 4.47Å; M700-F724 HydrophobicContact CG-CG 4.43Å; M700-L746 HydrophobicContact CB-CD2 4.46Å; M700-L746 HydrophobicContact CG-CD2 3.53Å; M700-L746 HydrophobicContact SD-CD1 3.48Å; M700-L746 WeakPolarHBondContact SD-CD1 3.45Å; M700-L746 HydrophobicContact SD-CD2 3.39Å; M700-L746 WeakPolarHBondContact SD-CD2 3.32Å; M700-L746 HydrophobicContact SD-CG 4.08Å; M700-V816 HydrophobicContact CE-CG2 3.91Å; M700-A819 HydrophobicContact CE-CB 3.95Å; M700-A819 HydrophobicContact CG-CB 4.05Å; M700-A819 HydrophobicContact SD-CB 3.79Å
701	Y	97.3	Very high	95.3	Very high	47 Å²	47	27.7 Å²	27.7	18%	0.184	14%	0.137	C	C	.	.	H	α-helix	trans	-65.9	-49.8	178.7	-176.2	-115.3	0	0	0	111.6	S697 Q698 V699 L703 F704 Q705 L710 T717 F720 M721	S697-Y701 WeakPolarHBondContact O-CB 3.39Å; S697-Y701 PolarHBondContact O-N 3.34Å; Q698-Y701 WeakPolarHBondContact O-CB 3.44Å; Q698-Y701 PolarHBondContact O-N 3.3Å; V699-Y701 VanDerWaalsContact C-N 3.33Å; V699-Y701 PolarHBondContact O-N 3.42Å; Y701-L703 VanDerWaalsContact C-N 3.35Å; Y701-L703 PolarHBondContact O-N 2.94Å; Y701-F704 PolarHBondContact O-N 2.62Å; Y701-F704 VanDerWaalsContact O-N 3.13Å; Y701-Q705 VanDerWaalsContact CE1-CD 3.4Å; Y701-Q705 HydrophobicContact CE1-CG 4.3Å; Y701-Q705 VanDerWaalsContact CE1-OE1 3.23Å; Y701-Q705 HydrophobicContact CE2-CG 4.32Å; Y701-Q705 WeakPolarHBondContact O-CG 3.49Å; Y701-Q705 PolarHBondContact O-N 2.8Å; Y701-L710 HydrophobicContact CD2-CD1 4.1Å; Y701-L710 HydrophobicContact CE2-CD1 3.64Å; Y701-T717 HydrophobicContact CD2-CG2 4.22Å; Y701-T717 HydrophobicContact CE2-CG2 3.48Å; Y701-T717 VanDerWaalsContact CE2-CG2 3.48Å; Y701-F720 HydrophobicContact CD2-CD1 4.25Å; Y701-F720 HydrophobicContact CD2-CE1 4.2Å; Y701-M721 HydrophobicContact CD2-SD 4.1Å; Y701-M721 HydrophobicContact CG-SD 4.03Å
702	T	96.5	Very high	95.6	Very high	10 Å²	10	23.9 Å²	23.9	6%	0.061	12%	0.122	C	C	.	.	H	α-helix	trans	-54.5	-46.8	176.3	-61.9	0	0	0	0	112	Y667 L670 I671 Q698 V699 Q705 D706	Y667-T702 HydrophobicContact CD2-CG2 3.83Å; Y667-T702 HydrophobicContact CE2-CG2 3.88Å; L670-T702 HydrophobicContact CD2-CG2 4.01Å; L670-T702 HydrophobicContact CG-CG2 4.16Å; I671-T702 HydrophobicContact CD1-CG2 3.51Å; I671-T702 HydrophobicContact CG1-CG2 3.68Å; Q698-T702 PolarHBondContact O-N 3.25Å; Q698-T702 PolarHBondContact O-OG1 3.39Å; Q698-T702 VanDerWaalsContact O-OG1 3.14Å; V699-T702 PolarHBondContact O-N 2.85Å; T702-Q705 PolarHBondContact O-N 2.72Å; T702-D706 PolarHBondContact O-N 3.29Å
703	L	97.3	Very high	96	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-68.7	-34.7	178.1	-69.2	-175	0	0	0	113.3	M674 V699 Y701 Q705 D706 T707 L746 W750	M674-L703 HydrophobicContact CE-CD1 3.89Å; M674-L703 HydrophobicContact CE-CD2 3.47Å; M674-L703 VanDerWaalsContact CE-CD2 3.47Å; M674-L703 HydrophobicContact CE-CG 3.77Å; M674-L703 HydrophobicContact SD-CD2 4.46Å; V699-L703 HydrophobicContact CG1-CD1 4.03Å; V699-L703 HydrophobicContact CG1-CG 4.25Å; V699-L703 WeakPolarHBondContact O-CB 3.39Å; V699-L703 VanDerWaalsContact O-CG 3.31Å; V699-L703 WeakPolarHBondContact O-CG 3.5Å; V699-L703 PolarHBondContact O-N 2.76Å; Y701-L703 VanDerWaalsContact C-N 3.35Å; Y701-L703 PolarHBondContact O-N 2.94Å; L703-Q705 VanDerWaalsContact C-N 3.32Å; L703-D706 PolarHBondContact O-N 3.11Å; L703-T707 WeakPolarHBondContact O-CB 3.47Å; L703-T707 WeakPolarHBondContact O-CG2 3.36Å; L703-T707 PolarHBondContact O-N 3.39Å; L703-T707 PolarHBondContact O-OG1 2.99Å; L703-L746 HydrophobicContact CD1-CD1 3.92Å; L703-L746 HydrophobicContact CD1-CD2 4.23Å; L703-L746 HydrophobicContact CD1-CG 3.76Å; L703-W750 HydrophobicContact CD1-CB 3.91Å; L703-W750 HydrophobicContact CD1-CG 4.07Å; L703-W750 HydrophobicContact CD2-CB 4.36Å; L703-W750 HydrophobicContact CD2-CD2 3.45Å; L703-W750 VanDerWaalsContact CD2-CD2 3.45Å; L703-W750 VanDerWaalsContact CD2-CE2 3.42Å; L703-W750 HydrophobicContact CD2-CE3 4.04Å; L703-W750 HydrophobicContact CD2-CG 3.6Å; L703-W750 HydrophobicContact CD2-CH2 4.48Å; L703-W750 HydrophobicContact CD2-CZ2 3.94Å; L703-W750 HydrophobicContact CG-CG 4.37Å
704	F	97.6	Very high	96.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-73.1	-24.1	176.4	-88.6	-119.4	0	0	0	112.9	M700 Y701 G708 L709 L710 I715 F720 M812 Y815 V816	M700-F704 HydrophobicContact CE-CD2 4.25Å; M700-F704 HydrophobicContact CE-CE2 3.51Å; M700-F704 HydrophobicContact CE-CZ 3.98Å; M700-F704 WeakPolarHBondContact O-CB 3.35Å; M700-F704 WeakPolarHBondContact O-CD2 3.47Å; M700-F704 PolarHBondContact O-N 3.46Å; M700-F704 HydrophobicContact SD-CD2 4.46Å; M700-F704 HydrophobicContact SD-CE2 4.04Å; Y701-F704 PolarHBondContact O-N 2.62Å; Y701-F704 VanDerWaalsContact O-N 3.13Å; F704-G708 PolarHBondContact O-N 2.83Å; F704-L709 HydrophobicContact CB-CB 4.4Å; F704-L709 HydrophobicContact CD1-CB 3.59Å; F704-L709 HydrophobicContact CD1-CD1 4.11Å; F704-L709 HydrophobicContact CD2-CD1 4.25Å; F704-L709 HydrophobicContact CE1-CB 4Å; F704-L709 HydrophobicContact CE1-CD1 3.95Å; F704-L709 HydrophobicContact CE2-CD1 4.09Å; F704-L709 HydrophobicContact CG-CB 4.07Å; F704-L709 HydrophobicContact CG-CD1 4.26Å; F704-L709 HydrophobicContact CZ-CD1 3.93Å; F704-L709 PolarHBondContact O-N 3.38Å; F704-L710 HydrophobicContact CB-CD2 3.87Å; F704-L710 HydrophobicContact CB-CG 3.93Å; F704-L710 HydrophobicContact CD1-CD2 4.12Å; F704-L710 HydrophobicContact CG-CD2 4.48Å; F704-L710 PolarHBondContact O-N 3.41Å; F704-I715 HydrophobicContact CD1-CD1 3.86Å; F704-I715 HydrophobicContact CE1-CD1 3.81Å; F704-F720 HydrophobicContact CB-CE2 4.37Å; F704-F720 HydrophobicContact CB-CZ 4.06Å; F704-F720 HydrophobicContact CD1-CD2 4.44Å; F704-F720 AromaticContact CD1-CE2 3.51Å; F704-F720 HydrophobicContact CD1-CE2 3.51Å; F704-F720 HydrophobicContact CD1-CZ 4Å; F704-F720 HydrophobicContact CD2-CE2 4.2Å; F704-F720 AromaticContact CD2-CZ 3.99Å; F704-F720 HydrophobicContact CD2-CZ 3.99Å; F704-F720 AromaticContact CE1-CE2 3.75Å; F704-F720 HydrophobicContact CE1-CE2 3.75Å; F704-F720 HydrophobicContact CE1-CZ 4.48Å; F704-F720 HydrophobicContact CE2-CE2 4.4Å; F704-F720 HydrophobicContact CE2-CZ 4.47Å; F704-F720 AromaticContact CG-CE2 3.76Å; F704-F720 HydrophobicContact CG-CE2 3.76Å; F704-F720 AromaticContact CG-CZ 3.73Å; F704-F720 HydrophobicContact CG-CZ 3.73Å; F704-F720 HydrophobicContact CZ-CE2 4.19Å; F704-M812 HydrophobicContact CE1-CG 3.73Å; F704-M812 HydrophobicContact CE1-SD 3.92Å; F704-M812 HydrophobicContact CZ-CG 3.72Å; F704-Y815 HydrophobicContact CE2-CD2 4.42Å; F704-V816 HydrophobicContact CZ-CG2 3.78Å
705	Q	94.9	Very high	96.5	Very high	52 Å²	52	21.4 Å²	21.4	24%	0.243	10%	0.101	C	C	.	.	H	α-helix	trans	-75.5	-48.3	168	-72.5	175.9	-63.5	0	0	111.9	Y667 Y701 T702 L703 T707 G708 L710 K790	Y667-Q705 HydrophobicContact CE2-CB 3.7Å; Y701-Q705 VanDerWaalsContact CE1-CD 3.4Å; Y701-Q705 HydrophobicContact CE1-CG 4.3Å; Y701-Q705 VanDerWaalsContact CE1-OE1 3.23Å; Y701-Q705 HydrophobicContact CE2-CG 4.32Å; Y701-Q705 WeakPolarHBondContact O-CG 3.49Å; Y701-Q705 PolarHBondContact O-N 2.8Å; T702-Q705 PolarHBondContact O-N 2.72Å; L703-Q705 VanDerWaalsContact C-N 3.32Å; Q705-T707 VanDerWaalsContact C-N 3.32Å; Q705-T707 PolarHBondContact O-N 3.19Å; Q705-G708 PolarHBondContact O-N 3.46Å; Q705-L710 HydrophobicContact CG-CD1 3.77Å; Q705-K790 WeakPolarHBondContact O-CE 3.35Å; Q705-K790 PolarHBondContact O-NZ 3.31Å
706	D	95.6	Very high	96.5	Very high	1 Å²	1	23 Å²	23	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-56.8	-43.8	178.4	166.7	78.9	0	0	0	112.3	Y667 I671 T702 L703 G708 W750 S789 K790 S791	Y667-D706 WeakPolarHBondContact OH-CA 3.45Å; Y667-D706 PolarHBondContact OH-N 2.87Å; I671-D706 HydrophobicContact CD1-CB 3.82Å; T702-D706 PolarHBondContact O-N 3.29Å; L703-D706 PolarHBondContact O-N 3.11Å; D706-G708 VanDerWaalsContact C-N 3.34Å; D706-W750 PolarHBondContact OD2-NE1 3.41Å; D706-S789 PolarHBondContact OD1-OG 3.18Å; D706-S789 WeakPolarHBondContact OD2-CB 3.37Å; D706-S789 PolarHBondContact OD2-OG 3.4Å; D706-K790 WeakPolarHBondContact O-CD 3.47Å; D706-K790 VanDerWaalsContact O-CG 3.25Å; D706-K790 WeakPolarHBondContact O-CG 3.25Å; D706-K790 PolarHBondContact O-N 3.34Å; D706-K790 PolarHBondContact OD1-N 2.82Å; D706-K790 VanDerWaalsContact OD1-N 3.14Å; D706-S791 VanDerWaalsContact OD1-CB 3.23Å; D706-S791 WeakPolarHBondContact OD1-CB 3.24Å; D706-S791 PolarHBondContact OD1-N 2.83Å; D706-S791 PolarHBondContact OD1-OG 3.35Å
707	T	95.9	Very high	96.4	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.012	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-5.2	-177.7	56.5	0	0	0	0	113.9	L703 Q705 L709 T754 I787 Y815	L703-T707 WeakPolarHBondContact O-CB 3.47Å; L703-T707 WeakPolarHBondContact O-CG2 3.36Å; L703-T707 PolarHBondContact O-N 3.39Å; L703-T707 PolarHBondContact O-OG1 2.99Å; Q705-T707 VanDerWaalsContact C-N 3.32Å; Q705-T707 PolarHBondContact O-N 3.19Å; T707-L709 PolarHBondContact O-N 3.34Å; T707-L709 WeakPolarHBondContact OG1-CD1 3.47Å; T707-L709 WeakPolarHBondContact OG1-CG 3.38Å; T707-T754 HydrophobicContact CG2-CG2 4.47Å; T707-I787 HydrophobicContact CG2-CD1 3.94Å; T707-I787 WeakPolarHBondContact O-CB 2.97Å; T707-Y815 HydrophobicContact CG2-CE2 4.12Å
708	G	95.9	Very high	96.3	Very high	8 Å²	8	31.5 Å²	31.5	8%	0.082	16%	0.156	C	C	.	.			trans	69.3	10.2	-176.2	0	0	0	0	0	114.9	F704 Q705 D706 L710 E711 I712	F704-G708 PolarHBondContact O-N 2.83Å; Q705-G708 PolarHBondContact O-N 3.46Å; D706-G708 VanDerWaalsContact C-N 3.34Å; G708-L710 VanDerWaalsContact C-N 3.25Å; G708-L710 PolarHBondContact O-N 3.14Å; G708-E711 WeakPolarHBondContact O-CB 3.05Å; G708-E711 PolarHBondContact O-N 3.07Å; G708-I712 WeakPolarHBondContact O-CG1 3.42Å; G708-I712 PolarHBondContact O-N 3.03Å
709	L	97.4	Very high	96.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.9	-33.9	-177	-77.3	174.4	0	0	0	113.3	F704 T707 E711 F713 I787 A808 M812 Y815	F704-L709 HydrophobicContact CB-CB 4.4Å; F704-L709 HydrophobicContact CD1-CB 3.59Å; F704-L709 HydrophobicContact CD1-CD1 4.11Å; F704-L709 HydrophobicContact CD2-CD1 4.25Å; F704-L709 HydrophobicContact CE1-CB 4Å; F704-L709 HydrophobicContact CE1-CD1 3.95Å; F704-L709 HydrophobicContact CE2-CD1 4.09Å; F704-L709 HydrophobicContact CG-CB 4.07Å; F704-L709 HydrophobicContact CG-CD1 4.26Å; F704-L709 HydrophobicContact CZ-CD1 3.93Å; F704-L709 PolarHBondContact O-N 3.38Å; T707-L709 PolarHBondContact O-N 3.34Å; T707-L709 WeakPolarHBondContact OG1-CD1 3.47Å; T707-L709 WeakPolarHBondContact OG1-CG 3.38Å; L709-E711 VanDerWaalsContact C-N 3.31Å; L709-E711 PolarHBondContact O-N 3.07Å; L709-F713 HydrophobicContact CD2-CD2 3.94Å; L709-F713 HydrophobicContact CD2-CE2 3.69Å; L709-F713 PolarHBondContact O-N 3.13Å; L709-I787 HydrophobicContact CD2-CG2 3.57Å; L709-I787 HydrophobicContact CG-CG2 3.96Å; L709-A808 HydrophobicContact CD2-CB 4.26Å; L709-M812 HydrophobicContact CD1-CB 4.04Å; L709-M812 HydrophobicContact CD1-CG 4.12Å; L709-M812 HydrophobicContact CD2-CB 3.88Å; L709-M812 HydrophobicContact CD2-CG 4.3Å; L709-M812 HydrophobicContact CD2-SD 4.39Å; L709-Y815 HydrophobicContact CD1-CD2 3.74Å; L709-Y815 HydrophobicContact CD1-CE2 3.96Å
710	L	96.4	Very high	96.5	Very high	21 Å²	21	32.2 Å²	32.2	11%	0.11	16%	0.159	C	C	.	.	H	α-helix	trans	-59.8	-43.2	173.4	-58.2	-179.8	0	0	0	111.9	Y701 F704 Q705 G708 K714 I715 F720	Y701-L710 HydrophobicContact CD2-CD1 4.1Å; Y701-L710 HydrophobicContact CE2-CD1 3.64Å; F704-L710 HydrophobicContact CB-CD2 3.87Å; F704-L710 HydrophobicContact CB-CG 3.93Å; F704-L710 HydrophobicContact CD1-CD2 4.12Å; F704-L710 HydrophobicContact CG-CD2 4.48Å; F704-L710 PolarHBondContact O-N 3.41Å; Q705-L710 HydrophobicContact CG-CD1 3.77Å; G708-L710 VanDerWaalsContact C-N 3.25Å; G708-L710 PolarHBondContact O-N 3.14Å; L710-K714 CarbonylContact O-C 3.6Å; L710-K714 VanDerWaalsContact O-CA 3.22Å; L710-K714 WeakPolarHBondContact O-CA 3.48Å; L710-K714 PolarHBondContact O-N 3.3Å; L710-I715 HydrophobicContact CD2-CB 3.81Å; L710-I715 HydrophobicContact CD2-CD1 4.37Å; L710-I715 HydrophobicContact CD2-CG2 3.75Å; L710-I715 PolarHBondContact O-N 2.67Å; L710-F720 HydrophobicContact CD2-CD2 4.45Å
711	E	95.3	Very high	96.5	Very high	110 Å²	110	32.8 Å²	32.8	51%	0.514	16%	0.162	S	C	.	.	H	α-helix	trans	-75.1	-37.6	-176.3	-58	171.8	-124.6	0	0	112	G708 L709 K714 K790	G708-E711 WeakPolarHBondContact O-CB 3.05Å; G708-E711 PolarHBondContact O-N 3.07Å; L709-E711 VanDerWaalsContact C-N 3.31Å; L709-E711 PolarHBondContact O-N 3.07Å; E711-K714 WeakPolarHBondContact O-CD 3.42Å; E711-K714 VanDerWaalsContact O-CE 3.26Å; E711-K714 WeakPolarHBondContact O-CE 3.43Å; E711-K714 PolarHBondContact O-NZ 3.5Å; E711-K790 IonicContact OE1-NZ 3.87Å; E711-K790 PolarHBondContact OE1-NZ 3.25Å
712	I	95	Very high	96.5	Very high	46 Å²	46	32.5 Å²	32.5	24%	0.236	16%	0.164	C	C	.	.	H	α-helix	trans	-67	-52.4	-179.4	-68.1	164.7	0	0	0	110.6	G708 A785 I787 A808	G708-I712 WeakPolarHBondContact O-CG1 3.42Å; G708-I712 PolarHBondContact O-N 3.03Å; I712-A785 HydrophobicContact CG2-CB 3.67Å; I712-I787 HydrophobicContact CD1-CG2 3.94Å; I712-A808 HydrophobicContact CD1-CB 4.34Å; I712-A808 HydrophobicContact CG2-CB 4.47Å
713	F	96.1	Very high	96.6	Very high	13 Å²	13	32.1 Å²	32.1	6%	0.057	16%	0.161	C	C	.	.	H	α-helix	trans	-97.2	6.3	-174.4	-63.6	-65	0	0	0	114	L709 I715 A808 L809 M812 L874	L709-F713 HydrophobicContact CD2-CD2 3.94Å; L709-F713 HydrophobicContact CD2-CE2 3.69Å; L709-F713 PolarHBondContact O-N 3.13Å; F713-I715 VanDerWaalsContact C-N 3.28Å; F713-I715 HydrophobicContact CB-CD1 4.24Å; F713-I715 HydrophobicContact CB-CG1 4.01Å; F713-I715 PolarHBondContact O-N 3.21Å; F713-A808 HydrophobicContact CE2-CB 3.94Å; F713-A808 HydrophobicContact CZ-CB 3.99Å; F713-L809 HydrophobicContact CE1-CB 4.41Å; F713-L809 HydrophobicContact CE1-CD1 4.13Å; F713-L809 HydrophobicContact CZ-CB 3.87Å; F713-L809 HydrophobicContact CZ-CD1 4.09Å; F713-M812 HydrophobicContact CD1-CE 4.47Å; F713-M812 HydrophobicContact CD2-CE 3.57Å; F713-M812 HydrophobicContact CD2-SD 3.47Å; F713-M812 WeakPolarHBondContact CD2-SD 3.4Å; F713-M812 HydrophobicContact CE2-CB 4.42Å; F713-M812 HydrophobicContact CE2-CE 3.77Å; F713-M812 HydrophobicContact CE2-SD 3.94Å; F713-M812 HydrophobicContact CG-CE 3.95Å; F713-M812 HydrophobicContact CG-SD 4.2Å; F713-M812 HydrophobicContact CZ-CE 4.31Å; F713-L874 HydrophobicContact CB-CD2 4.24Å; F713-L874 HydrophobicContact CD1-CD2 3.41Å; F713-L874 VanDerWaalsContact CD1-CD2 3.41Å; F713-L874 HydrophobicContact CE1-CD2 4.04Å; F713-L874 HydrophobicContact CG-CD2 4.06Å
714	K	96	Very high	96.7	Very high	93 Å²	93	32.1 Å²	32.1	40%	0.404	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	45.7	-178	-54.8	-56.8	177.4	-156.3	0	112.3	L710 E711 P716 I779 H873	L710-K714 CarbonylContact O-C 3.6Å; L710-K714 VanDerWaalsContact O-CA 3.22Å; L710-K714 WeakPolarHBondContact O-CA 3.48Å; L710-K714 PolarHBondContact O-N 3.3Å; E711-K714 WeakPolarHBondContact O-CD 3.42Å; E711-K714 VanDerWaalsContact O-CE 3.26Å; E711-K714 WeakPolarHBondContact O-CE 3.43Å; E711-K714 PolarHBondContact O-NZ 3.5Å; K714-P716 WeakPolarHBondContact O-CD 3.44Å; K714-I779 HydrophobicContact CB-CD1 4.42Å; K714-I779 HydrophobicContact CG-CD1 3.98Å; K714-I779 HydrophobicContact CG-CG1 3.88Å; K714-H873 HydrophobicContact CB-CB 4.29Å; K714-H873 PolarHBondContact O-ND1 2.93Å
715	I	97.3	Very high	96.7	Very high	9 Å²	9	36.2 Å²	36.2	5%	0.046	18%	0.177	C	C	.	.			trans	-72	121.8	-178.4	-64.9	169.4	0	0	0	108.9	F704 L710 F713 F720 M812 F870	F704-I715 HydrophobicContact CD1-CD1 3.86Å; F704-I715 HydrophobicContact CE1-CD1 3.81Å; L710-I715 HydrophobicContact CD2-CB 3.81Å; L710-I715 HydrophobicContact CD2-CD1 4.37Å; L710-I715 HydrophobicContact CD2-CG2 3.75Å; L710-I715 PolarHBondContact O-N 2.67Å; F713-I715 VanDerWaalsContact C-N 3.28Å; F713-I715 HydrophobicContact CB-CD1 4.24Å; F713-I715 HydrophobicContact CB-CG1 4.01Å; F713-I715 PolarHBondContact O-N 3.21Å; I715-F720 HydrophobicContact CG2-CB 3.87Å; I715-F720 HydrophobicContact CG2-CD2 3.75Å; I715-F720 HydrophobicContact CG2-CG 4.16Å; I715-M812 HydrophobicContact CD1-SD 3.8Å; I715-F870 HydrophobicContact CD1-CD2 4.28Å; I715-F870 HydrophobicContact CD1-CE2 4.41Å; I715-F870 HydrophobicContact CG1-CD2 4.3Å; I715-F870 HydrophobicContact CG2-CB 4.04Å; I715-F870 HydrophobicContact CG2-CD2 3.71Å; I715-F870 HydrophobicContact CG2-CG 4.31Å
716	P	96.4	Very high	96.8	Very high	35 Å²	35	34.5 Å²	34.5	23%	0.227	17%	0.172	C	C	.	.			trans	-79.5	124.7	177.2	32.1	-32.6	0	0	0	110.7	K714 Q718 Q719 F720 F870 L872	K714-P716 WeakPolarHBondContact O-CD 3.44Å; P716-Q718 VanDerWaalsContact C-N 3.27Å; P716-Q718 PolarHBondContact O-N 3.38Å; P716-Q719 VanDerWaalsContact CB-OE1 3.31Å; P716-Q719 HydrophobicContact CG-CB 4.25Å; P716-Q719 HydrophobicContact CG-CG 4.4Å; P716-Q719 VanDerWaalsContact CG-OE1 3.27Å; P716-Q719 PolarHBondContact O-N 3.18Å; P716-F720 PolarHBondContact O-N 3.46Å; P716-F870 WeakPolarHBondContact CD-O 3.31Å; P716-L872 HydrophobicContact CG-CD2 3.87Å
717	T	96.4	Very high	97	Very high	60 Å²	60	34.5 Å²	34.5	37%	0.368	17%	0.171	S	C	.	.	H	α-helix	trans	-54	-38.5	-174.2	-55.6	0	0	0	0	113.4	Y701 F720 M721	Y701-T717 HydrophobicContact CD2-CG2 4.22Å; Y701-T717 HydrophobicContact CE2-CG2 3.48Å; Y701-T717 VanDerWaalsContact CE2-CG2 3.48Å; T717-F720 PolarHBondContact O-N 3.4Å; T717-M721 HydrophobicContact CG2-CG 4.01Å; T717-M721 WeakPolarHBondContact O-CB 3.43Å; T717-M721 VanDerWaalsContact O-CG 3.3Å; T717-M721 WeakPolarHBondContact O-CG 3.19Å; T717-M721 PolarHBondContact O-N 3.46Å
718	Q	95.4	Very high	97	Very high	117 Å²	117	34.4 Å²	34.4	55%	0.547	17%	0.171	S	C	.	.	H	α-helix	trans	-62	-51	-178.3	-172.8	63.1	54.3	0	0	112.2	P716 F720 M721 N722	P716-Q718 VanDerWaalsContact C-N 3.27Å; P716-Q718 PolarHBondContact O-N 3.38Å; Q718-F720 VanDerWaalsContact C-N 3.32Å; Q718-F720 PolarHBondContact O-N 2.88Å; Q718-M721 PolarHBondContact O-N 3.36Å; Q718-N722 PolarHBondContact NE2-OD1 3.22Å; Q718-N722 WeakPolarHBondContact O-CB 3.02Å; Q718-N722 PolarHBondContact O-N 2.8Å; Q718-N722 PolarHBondContact O-ND2 3.42Å; Q718-N722 PolarHBondContact O-OD1 3.07Å
719	Q	97.6	Very high	97.1	Very high	53 Å²	53	40.2 Å²	40.2	25%	0.248	20%	0.2	C	C	.	.	H	α-helix	trans	-67.6	-35.2	-179.6	-69.8	75.3	0.8	0	0	111.6	P716 Y723 E867 F870	P716-Q719 VanDerWaalsContact CB-OE1 3.31Å; P716-Q719 HydrophobicContact CG-CB 4.25Å; P716-Q719 HydrophobicContact CG-CG 4.4Å; P716-Q719 VanDerWaalsContact CG-OE1 3.27Å; P716-Q719 PolarHBondContact O-N 3.18Å; Q719-Y723 WeakPolarHBondContact O-CB 3.47Å; Q719-Y723 PolarHBondContact O-N 2.9Å; Q719-E867 WeakPolarHBondContact CA-O 3.4Å; Q719-F870 HydrophobicContact CB-CB 3.94Å
720	F	98.4	Very high	97.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.8	-54.3	174.2	-178.1	-88.5	0	0	0	110.8	M700 Y701 F704 L710 I715 P716 T717 Q718 N722 Y723 F724 F870	M700-F720 HydrophobicContact CB-CE1 4.17Å; M700-F720 HydrophobicContact CB-CZ 3.93Å; M700-F720 HydrophobicContact CE-CZ 4.46Å; Y701-F720 HydrophobicContact CD2-CD1 4.25Å; Y701-F720 HydrophobicContact CD2-CE1 4.2Å; F704-F720 HydrophobicContact CB-CE2 4.37Å; F704-F720 HydrophobicContact CB-CZ 4.06Å; F704-F720 HydrophobicContact CD1-CD2 4.44Å; F704-F720 AromaticContact CD1-CE2 3.51Å; F704-F720 HydrophobicContact CD1-CE2 3.51Å; F704-F720 HydrophobicContact CD1-CZ 4Å; F704-F720 HydrophobicContact CD2-CE2 4.2Å; F704-F720 AromaticContact CD2-CZ 3.99Å; F704-F720 HydrophobicContact CD2-CZ 3.99Å; F704-F720 AromaticContact CE1-CE2 3.75Å; F704-F720 HydrophobicContact CE1-CE2 3.75Å; F704-F720 HydrophobicContact CE1-CZ 4.48Å; F704-F720 HydrophobicContact CE2-CE2 4.4Å; F704-F720 HydrophobicContact CE2-CZ 4.47Å; F704-F720 AromaticContact CG-CE2 3.76Å; F704-F720 HydrophobicContact CG-CE2 3.76Å; F704-F720 AromaticContact CG-CZ 3.73Å; F704-F720 HydrophobicContact CG-CZ 3.73Å; F704-F720 HydrophobicContact CZ-CE2 4.19Å; L710-F720 HydrophobicContact CD2-CD2 4.45Å; I715-F720 HydrophobicContact CG2-CB 3.87Å; I715-F720 HydrophobicContact CG2-CD2 3.75Å; I715-F720 HydrophobicContact CG2-CG 4.16Å; P716-F720 PolarHBondContact O-N 3.46Å; T717-F720 PolarHBondContact O-N 3.4Å; Q718-F720 VanDerWaalsContact C-N 3.32Å; Q718-F720 PolarHBondContact O-N 2.88Å; F720-N722 VanDerWaalsContact C-N 3.33Å; F720-N722 PolarHBondContact O-N 3.3Å; F720-Y723 PolarHBondContact O-N 2.79Å; F720-F724 AromaticContact CD1-CD2 3.99Å; F720-F724 HydrophobicContact CD1-CD2 3.99Å; F720-F724 AromaticContact CD2-CD2 3.84Å; F720-F724 HydrophobicContact CD2-CD2 3.84Å; F720-F724 AromaticContact CD2-CE2 3.58Å; F720-F724 HydrophobicContact CD2-CE2 3.58Å; F720-F724 AromaticContact CE1-CD2 3.88Å; F720-F724 HydrophobicContact CE1-CD2 3.88Å; F720-F724 HydrophobicContact CE1-CE2 4.37Å; F720-F724 AromaticContact CE2-CD2 3.77Å; F720-F724 HydrophobicContact CE2-CD2 3.77Å; F720-F724 AromaticContact CE2-CE2 3.4Å; F720-F724 HydrophobicContact CE2-CE2 3.4Å; F720-F724 VanDerWaalsContact CE2-CE2 3.4Å; F720-F724 HydrophobicContact CE2-CZ 4.43Å; F720-F724 AromaticContact CG-CD2 3.97Å; F720-F724 HydrophobicContact CG-CD2 3.97Å; F720-F724 HydrophobicContact CG-CE2 4.18Å; F720-F724 AromaticContact CZ-CD2 3.79Å; F720-F724 HydrophobicContact CZ-CD2 3.79Å; F720-F724 AromaticContact CZ-CE2 3.84Å; F720-F724 HydrophobicContact CZ-CE2 3.84Å; F720-F724 VanDerWaalsContact O-CD2 3.28Å; F720-F724 WeakPolarHBondContact O-CD2 3.43Å; F720-F724 PolarHBondContact O-N 2.98Å; F720-F870 HydrophobicContact CB-CB 4.05Å; F720-F870 HydrophobicContact CB-CG 4.38Å; F720-F870 AromaticContact CD2-CD2 3.86Å; F720-F870 HydrophobicContact CD2-CD2 3.86Å; F720-F870 HydrophobicContact CD2-CE2 4.08Å; F720-F870 HydrophobicContact CD2-CG 4.19Å; F720-F870 HydrophobicContact CE2-CE2 4.47Å
721	M	97.9	Very high	97.2	Very high	11 Å²	11	40 Å²	40	5%	0.054	20%	0.202	C	C	.	.	H	α-helix	trans	-65.7	-34.6	179.1	-65.7	-50.9	-66.8	0	0	112.6	Q698 Y701 T717 Q718 R725	Q698-M721 VanDerWaalsContact NE2-CE 3.31Å; Y701-M721 HydrophobicContact CD2-SD 4.1Å; Y701-M721 HydrophobicContact CG-SD 4.03Å; T717-M721 HydrophobicContact CG2-CG 4.01Å; T717-M721 WeakPolarHBondContact O-CB 3.43Å; T717-M721 VanDerWaalsContact O-CG 3.3Å; T717-M721 WeakPolarHBondContact O-CG 3.19Å; T717-M721 PolarHBondContact O-N 3.46Å; Q718-M721 PolarHBondContact O-N 3.36Å; M721-R725 WeakPolarHBondContact O-CB 3.45Å; M721-R725 VanDerWaalsContact O-CD 3.28Å; M721-R725 WeakPolarHBondContact O-CD 3.3Å; M721-R725 WeakPolarHBondContact O-CG 3.05Å; M721-R725 PolarHBondContact O-N 3.06Å; M721-R725 VanDerWaalsContact O-N 3.08Å
722	N	97.5	Very high	97.3	Very high	42 Å²	42	39.3 Å²	39.3	23%	0.225	20%	0.195	C	C	.	.	H	α-helix	trans	-60.1	-49.5	172.6	-71.7	-13.3	0	0	0	111.3	Q718 F720 A726 E867 Y868	Q718-N722 PolarHBondContact NE2-OD1 3.22Å; Q718-N722 WeakPolarHBondContact O-CB 3.02Å; Q718-N722 PolarHBondContact O-N 2.8Å; Q718-N722 PolarHBondContact O-ND2 3.42Å; Q718-N722 PolarHBondContact O-OD1 3.07Å; F720-N722 VanDerWaalsContact C-N 3.33Å; F720-N722 PolarHBondContact O-N 3.3Å; N722-A726 WeakPolarHBondContact O-CB 3.22Å; N722-A726 PolarHBondContact O-N 3.29Å; N722-A726 VanDerWaalsContact O-N 3.08Å; N722-E867 VanDerWaalsContact CB-O 3.29Å; N722-E867 WeakPolarHBondContact CB-O 3.48Å; N722-E867 PolarHBondContact ND2-O 2.93Å; N722-Y868 HydrophobicContact CB-CD1 3.8Å; N722-Y868 HydrophobicContact CB-CE1 4.05Å; N722-Y868 WeakPolarHBondContact O-CE1 3.43Å
723	Y	98.7	Very high	97.5	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-66.5	-50.9	-177.8	178.2	-112.1	0	0	0	111.9	Q719 F720 R725 A726 L727 M820 A858 L861 Y862 Y868 F870	Q719-Y723 WeakPolarHBondContact O-CB 3.47Å; Q719-Y723 PolarHBondContact O-N 2.9Å; F720-Y723 PolarHBondContact O-N 2.79Å; Y723-R725 PolarHBondContact O-N 3.38Å; Y723-A726 WeakPolarHBondContact O-CA 3.33Å; Y723-A726 WeakPolarHBondContact O-CB 3.37Å; Y723-A726 PolarHBondContact O-N 3.33Å; Y723-L727 HydrophobicContact CE1-CD2 4.37Å; Y723-L727 WeakPolarHBondContact O-CB 3.43Å; Y723-L727 PolarHBondContact O-N 2.69Å; Y723-M820 HydrophobicContact CE1-CE 4.17Å; Y723-M820 VanDerWaalsContact OH-CE 3.25Å; Y723-M820 WeakPolarHBondContact OH-CE 3.45Å; Y723-A858 PolarHBondContact OH-O 3.44Å; Y723-L861 HydrophobicContact CD2-CD2 4.45Å; Y723-L861 HydrophobicContact CD2-CG 4.4Å; Y723-L861 HydrophobicContact CE2-CB 4.35Å; Y723-L861 HydrophobicContact CE2-CD2 3.99Å; Y723-L861 HydrophobicContact CE2-CG 3.99Å; Y723-Y862 HydrophobicContact CD1-CD2 4.35Å; Y723-Y862 HydrophobicContact CD2-CD2 4.09Å; Y723-Y862 HydrophobicContact CE1-CD2 4.23Å; Y723-Y862 VanDerWaalsContact CE2-CA 3.49Å; Y723-Y862 AromaticContact CE2-CD2 3.98Å; Y723-Y862 HydrophobicContact CE2-CD2 3.98Å; Y723-Y862 HydrophobicContact CE2-CG 4.31Å; Y723-Y862 HydrophobicContact CG-CD2 4.25Å; Y723-Y868 HydrophobicContact CD2-CD2 4.39Å; Y723-Y868 HydrophobicContact CD2-CG 4.08Å; Y723-F870 HydrophobicContact CD1-CD1 4.02Å; Y723-F870 AromaticContact CD1-CE1 3.52Å; Y723-F870 HydrophobicContact CD1-CE1 3.52Å; Y723-F870 HydrophobicContact CE1-CE1 4.03Å; Y723-F870 HydrophobicContact CG-CD1 4.28Å; Y723-F870 HydrophobicContact CG-CE1 4.2Å
724	F	98.4	Very high	97.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-68.7	-32.6	-176.3	-72.2	-68	0	0	0	112.6	M700 F720 A726 L727 E728 V816 A819 F870	M700-F724 HydrophobicContact CB-CG 4.45Å; M700-F724 HydrophobicContact CE-CD1 4.1Å; M700-F724 HydrophobicContact CE-CD2 4.45Å; M700-F724 HydrophobicContact CE-CE1 3.47Å; M700-F724 VanDerWaalsContact CE-CE1 3.47Å; M700-F724 HydrophobicContact CE-CE2 3.88Å; M700-F724 HydrophobicContact CE-CZ 3.36Å; M700-F724 HydrophobicContact CG-CD1 4.18Å; M700-F724 HydrophobicContact CG-CE1 4.47Å; M700-F724 HydrophobicContact CG-CG 4.43Å; F720-F724 AromaticContact CD1-CD2 3.99Å; F720-F724 HydrophobicContact CD1-CD2 3.99Å; F720-F724 AromaticContact CD2-CD2 3.84Å; F720-F724 HydrophobicContact CD2-CD2 3.84Å; F720-F724 AromaticContact CD2-CE2 3.58Å; F720-F724 HydrophobicContact CD2-CE2 3.58Å; F720-F724 AromaticContact CE1-CD2 3.88Å; F720-F724 HydrophobicContact CE1-CD2 3.88Å; F720-F724 HydrophobicContact CE1-CE2 4.37Å; F720-F724 AromaticContact CE2-CD2 3.77Å; F720-F724 HydrophobicContact CE2-CD2 3.77Å; F720-F724 AromaticContact CE2-CE2 3.4Å; F720-F724 HydrophobicContact CE2-CE2 3.4Å; F720-F724 VanDerWaalsContact CE2-CE2 3.4Å; F720-F724 HydrophobicContact CE2-CZ 4.43Å; F720-F724 AromaticContact CG-CD2 3.97Å; F720-F724 HydrophobicContact CG-CD2 3.97Å; F720-F724 HydrophobicContact CG-CE2 4.18Å; F720-F724 AromaticContact CZ-CD2 3.79Å; F720-F724 HydrophobicContact CZ-CD2 3.79Å; F720-F724 AromaticContact CZ-CE2 3.84Å; F720-F724 HydrophobicContact CZ-CE2 3.84Å; F720-F724 VanDerWaalsContact O-CD2 3.28Å; F720-F724 WeakPolarHBondContact O-CD2 3.43Å; F720-F724 PolarHBondContact O-N 2.98Å; F724-A726 VanDerWaalsContact C-N 3.34Å; F724-A726 PolarHBondContact O-N 3.43Å; F724-L727 HydrophobicContact CD1-CD2 3.63Å; F724-L727 HydrophobicContact CE1-CD2 3.81Å; F724-L727 WeakPolarHBondContact O-CB 3.26Å; F724-L727 PolarHBondContact O-N 3.44Å; F724-E728 VanDerWaalsContact O-CG 3.3Å; F724-E728 WeakPolarHBondContact O-CG 3.43Å; F724-E728 PolarHBondContact O-N 3.06Å; F724-V816 HydrophobicContact CZ-CG1 4.31Å; F724-V816 HydrophobicContact CZ-CG2 4.13Å; F724-A819 HydrophobicContact CD1-CB 4.48Å; F724-A819 HydrophobicContact CE1-CB 4.13Å; F724-F870 HydrophobicContact CE2-CD1 4.27Å; F724-F870 AromaticContact CE2-CE1 3.67Å; F724-F870 HydrophobicContact CE2-CE1 3.67Å; F724-F870 HydrophobicContact CE2-CE2 4.32Å; F724-F870 AromaticContact CE2-CZ 3.7Å; F724-F870 HydrophobicContact CE2-CZ 3.7Å; F724-F870 AromaticContact CZ-CE1 3.86Å; F724-F870 HydrophobicContact CZ-CE1 3.86Å; F724-F870 AromaticContact CZ-CZ 3.76Å; F724-F870 HydrophobicContact CZ-CZ 3.76Å
725	R	97.8	Very high	97.7	Very high	86 Å²	86	42.7 Å²	42.7	33%	0.325	22%	0.22	S	C	.	.	H	α-helix	trans	-66.4	-33.3	168.7	-69	169.5	-175.3	161.6	2	112.8	S697 M721 Y723 E728 N729	S697-R725 WeakPolarHBondContact OG-CG 3.36Å; M721-R725 WeakPolarHBondContact O-CB 3.45Å; M721-R725 VanDerWaalsContact O-CD 3.28Å; M721-R725 WeakPolarHBondContact O-CD 3.3Å; M721-R725 WeakPolarHBondContact O-CG 3.05Å; M721-R725 PolarHBondContact O-N 3.06Å; M721-R725 VanDerWaalsContact O-N 3.08Å; Y723-R725 PolarHBondContact O-N 3.38Å; R725-E728 WeakPolarHBondContact CA-OE2 3.42Å; R725-N729 PolarHBondContact O-ND2 3.3Å
726	A	98.3	Very high	97.7	Very high	17 Å²	17	43 Å²	43	14%	0.14	22%	0.221	C	C	.	.	H	α-helix	trans	-70.6	-38.5	173.7	0	0	0	0	0	111.6	N722 Y723 F724 N729 G730 L861 Y868	N722-A726 WeakPolarHBondContact O-CB 3.22Å; N722-A726 PolarHBondContact O-N 3.29Å; N722-A726 VanDerWaalsContact O-N 3.08Å; Y723-A726 WeakPolarHBondContact O-CA 3.33Å; Y723-A726 WeakPolarHBondContact O-CB 3.37Å; Y723-A726 PolarHBondContact O-N 3.33Å; F724-A726 VanDerWaalsContact C-N 3.34Å; F724-A726 PolarHBondContact O-N 3.43Å; A726-N729 PolarHBondContact O-N 3.2Å; A726-G730 PolarHBondContact O-N 2.87Å; A726-L861 HydrophobicContact CB-CD1 4.21Å; A726-L861 HydrophobicContact CB-CD2 4.04Å; A726-Y868 HydrophobicContact CB-CE1 3.78Å; A726-Y868 HydrophobicContact CB-CE2 4.3Å; A726-Y868 WeakPolarHBondContact CB-OH 3.48Å
727	L	98.5	Very high	97.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-45.2	175.9	-164.4	74.8	0	0	0	111.5	Y723 F724 N729 G730 Y731 A819 M820 Y823 A858 L861	Y723-L727 HydrophobicContact CE1-CD2 4.37Å; Y723-L727 WeakPolarHBondContact O-CB 3.43Å; Y723-L727 PolarHBondContact O-N 2.69Å; F724-L727 HydrophobicContact CD1-CD2 3.63Å; F724-L727 HydrophobicContact CE1-CD2 3.81Å; F724-L727 WeakPolarHBondContact O-CB 3.26Å; F724-L727 PolarHBondContact O-N 3.44Å; L727-N729 PolarHBondContact O-N 2.91Å; L727-G730 PolarHBondContact O-N 3.1Å; L727-G730 VanDerWaalsContact O-N 3.07Å; L727-Y731 PolarHBondContact O-N 2.89Å; L727-A819 HydrophobicContact CD2-CB 4.41Å; L727-A819 WeakPolarHBondContact CD2-O 3.29Å; L727-M820 HydrophobicContact CD1-CB 4.01Å; L727-M820 HydrophobicContact CD2-CB 4.02Å; L727-Y823 HydrophobicContact CD1-CD2 3.4Å; L727-Y823 HydrophobicContact CD1-CE2 3.8Å; L727-Y823 HydrophobicContact CD1-CG 4Å; L727-Y823 HydrophobicContact CG-CD2 3.91Å; L727-Y823 HydrophobicContact CG-CE2 4.34Å; L727-Y823 WeakPolarHBondContact O-CD2 3.37Å; L727-Y823 VanDerWaalsContact O-CE2 3.29Å; L727-Y823 WeakPolarHBondContact O-CE2 3.31Å; L727-A858 HydrophobicContact CD1-CB 3.92Å; L727-L861 HydrophobicContact CB-CD2 4.38Å; L727-L861 HydrophobicContact CD1-CD2 4.19Å
728	E	96.9	Very high	98	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-57.6	-30.2	175	-79	179.6	126.7	0	0	115.2	R694 I695 L696 S697 F724 R725 R739	R694-E728 WeakPolarHBondContact CA-OE1 3.46Å; R694-E728 WeakPolarHBondContact CA-OE2 3.5Å; I695-E728 PolarHBondContact N-OE1 3.11Å; I695-E728 VanDerWaalsContact N-OE1 3.11Å; L696-E728 WeakPolarHBondContact CA-OE1 3.06Å; L696-E728 HydrophobicContact CB-CG 3.76Å; L696-E728 WeakPolarHBondContact CB-OE1 3.3Å; L696-E728 HydrophobicContact CD2-CG 4.14Å; L696-E728 HydrophobicContact CG-CG 4.36Å; L696-E728 PolarHBondContact N-OE1 2.84Å; S697-E728 WeakPolarHBondContact CB-OE2 3.41Å; S697-E728 PolarHBondContact N-OE1 3.23Å; S697-E728 PolarHBondContact OG-OE2 2.91Å; F724-E728 VanDerWaalsContact O-CG 3.3Å; F724-E728 WeakPolarHBondContact O-CG 3.43Å; F724-E728 PolarHBondContact O-N 3.06Å; R725-E728 WeakPolarHBondContact CA-OE2 3.42Å; E728-R739 PolarHBondContact O-NE 3.35Å; E728-R739 PolarHBondContact O-NH2 3.03Å
729	N	97.3	Very high	98.1	Very high	130 Å²	130	37.4 Å²	37.4	70%	0.695	19%	0.186	S	C	*	.	H	α-helix	trans	-83.1	-14.6	179.8	-73.8	-50.9	0	0	0	112.8	R725 A726 L727	R725-N729 PolarHBondContact O-ND2 3.3Å; A726-N729 PolarHBondContact O-N 3.2Å; L727-N729 PolarHBondContact O-N 2.91Å
730	G	97.8	Very high	98.1	Very high	13 Å²	13	36.5 Å²	36.5	13%	0.134	18%	0.183	C	C	.	.	H	α-helix	trans	-89.8	-13.4	170.1	0	0	0	0	0	114	A726 L727 R732 D824	A726-G730 PolarHBondContact O-N 2.87Å; L727-G730 PolarHBondContact O-N 3.1Å; L727-G730 VanDerWaalsContact O-N 3.07Å; G730-R732 PolarHBondContact O-N 3.36Å; G730-D824 VanDerWaalsContact O-CA 3.3Å; G730-D824 WeakPolarHBondContact O-CA 3.4Å; G730-D824 PolarHBondContact O-N 3.36Å
731	Y	98.7	Very high	98.1	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.016	18%	0.183	C	C	.	.	S	Bend	trans	-70.1	121.8	165.2	-85.6	-83	0	0	0	110.3	L696 L727 N738 R739 A742 A819 M820 D822 Y823	L696-Y731 HydrophobicContact CD2-CE2 4.22Å; L727-Y731 PolarHBondContact O-N 2.89Å; Y731-N738 VanDerWaalsContact CD1-C 3.49Å; Y731-R739 HydrophobicContact CG-CB 4.32Å; Y731-R739 PolarHBondContact O-NH2 3.47Å; Y731-R739 VanDerWaalsContact O-NH2 3.11Å; Y731-A742 HydrophobicContact CE1-CB 3.79Å; Y731-A742 HydrophobicContact CE2-CB 4.02Å; Y731-A742 VanDerWaalsContact CZ-CB 3.48Å; Y731-A742 WeakPolarHBondContact OH-CB 3.37Å; Y731-A819 PolarHBondContact OH-O 2.91Å; Y731-M820 WeakPolarHBondContact OH-CA 3.44Å; Y731-D822 HydrophobicContact CE1-CB 3.68Å; Y731-D822 WeakPolarHBondContact CE1-O 3.37Å; Y731-D822 PolarHBondContact OH-N 2.91Å; Y731-Y823 HydrophobicContact CD2-CD2 4.41Å; Y731-Y823 HydrophobicContact CE2-CD2 4.4Å; Y731-Y823 PolarHBondContact OH-N 3.19Å
732	R	98.1	Very high	98.2	Very high	95 Å²	95	36 Å²	36	36%	0.358	18%	0.181	S	C	.	.			trans	-73.5	157.6	-177	-56.9	-164.9	-172.1	170.3	8.4	111.4	G730 I734 N738 D824 H825	G730-R732 PolarHBondContact O-N 3.36Å; R732-I734 HydrophobicContact CB-CD1 4.45Å; R732-I734 HydrophobicContact CB-CG1 4.27Å; R732-I734 HydrophobicContact CB-CG2 4.13Å; R732-I734 PolarHBondContact O-N 3.22Å; R732-N738 WeakPolarHBondContact O-CB 3.49Å; R732-D824 IonicContact CZ-OD1 3.2Å; R732-D824 IonicContact NE-OD1 3.25Å; R732-D824 PolarHBondContact NE-OD1 3.46Å; R732-D824 IonicContact NH2-OD1 3.74Å; R732-D824 PolarHBondContact NH2-OD1 2.67Å; R732-D824 IonicContact NH2-OD2 3.96Å; R732-D824 PolarHBondContact NH2-OD2 3.05Å; R732-D824 VanDerWaalsContact NH2-OD2 3.16Å; R732-H825 VanDerWaalsContact CD-O 3.23Å; R732-H825 WeakPolarHBondContact CD-O 3.31Å
733	D	97.8	Very high	98.3	Very high	156 Å²	156	34 Å²	34	83%	0.834	17%	0.17	S	C	*	.	S	Bend	trans	-85.4	81.3	173.7	-156.5	41.9	0	0	0	108.4
734	I	98.1	Very high	98.3	Very high	25 Å²	25	34 Å²	34	13%	0.128	17%	0.17	C	C	.	.			trans	-133.2	156.6	-176.8	55.6	173.8	0	0	0	110.7	R732 Y736 H737 N738 H825	R732-I734 HydrophobicContact CB-CD1 4.45Å; R732-I734 HydrophobicContact CB-CG1 4.27Å; R732-I734 HydrophobicContact CB-CG2 4.13Å; R732-I734 PolarHBondContact O-N 3.22Å; I734-Y736 PolarHBondContact O-N 2.75Å; I734-H737 HydrophobicContact CD1-CB 4.1Å; I734-H737 WeakPolarHBondContact CD1-O 3.3Å; I734-N738 PolarHBondContact O-ND2 2.97Å; I734-H825 HydrophobicContact CD1-CB 4.3Å; I734-H825 WeakPolarHBondContact CD1-O 3.36Å
735	P	98.2	Very high	98.3	Very high	42 Å²	42	34 Å²	34	27%	0.273	17%	0.17	S	C	.	.	S	Bend	trans	-62.9	-29.1	-164.8	-26.1	35.7	0	0	0	116.5	G954 N957 E958	P735-G954 WeakPolarHBondContact CB-O 3.4Å; P735-G954 WeakPolarHBondContact O-CA 3.48Å; P735-N957 HydrophobicContact CB-CB 3.88Å; P735-N957 HydrophobicContact CG-CB 4.12Å; P735-E958 HydrophobicContact CB-CB 4.15Å; P735-E958 HydrophobicContact CG-CB 4.26Å
736	Y	98.6	Very high	98.3	Very high	15 Å²	15	29.9 Å²	29.9	6%	0.059	15%	0.154	C	C	.	.	S	Bend	trans	-122.4	-63.4	179.5	-175.7	-112.5	0	0	0	114.4	I734 N738 H741 W951 I955 E958	I734-Y736 PolarHBondContact O-N 2.75Å; Y736-N738 PolarHBondContact O-N 3Å; Y736-N738 PolarHBondContact O-ND2 3.06Å; Y736-H741 AromaticContact CE2-CE1 3.76Å; Y736-H741 AromaticContact CE2-ND1 3.99Å; Y736-H741 AromaticContact CZ-CE1 3.57Å; Y736-H741 AromaticContact CZ-ND1 3.55Å; Y736-H741 AromaticContact CZ-NE2 3.7Å; Y736-H741 VanDerWaalsContact O-CB 3.24Å; Y736-H741 WeakPolarHBondContact O-CB 3.39Å; Y736-H741 PolarHBondContact OH-CE1 3.47Å; Y736-H741 PolarHBondContact OH-ND1 3.19Å; Y736-H741 PolarHBondContact OH-NE2 3.32Å; Y736-W951 AromaticContact CD2-CE3 3.66Å; Y736-W951 HydrophobicContact CD2-CE3 3.66Å; Y736-W951 HydrophobicContact CD2-CZ3 4.16Å; Y736-W951 HydrophobicContact CE2-CB 4.33Å; Y736-W951 HydrophobicContact CE2-CD2 4.12Å; Y736-W951 AromaticContact CE2-CE3 3.52Å; Y736-W951 HydrophobicContact CE2-CE3 3.52Å; Y736-W951 HydrophobicContact CE2-CG 4.48Å; Y736-W951 HydrophobicContact CE2-CZ3 4.18Å; Y736-I955 HydrophobicContact CD1-CG1 3.86Å; Y736-I955 HydrophobicContact CD2-CD1 4.26Å; Y736-I955 HydrophobicContact CD2-CG1 3.45Å; Y736-I955 VanDerWaalsContact CD2-CG1 3.45Å; Y736-I955 HydrophobicContact CE1-CD1 4.4Å; Y736-I955 HydrophobicContact CE1-CG1 3.98Å; Y736-I955 HydrophobicContact CE2-CD1 3.88Å; Y736-I955 HydrophobicContact CE2-CG1 3.58Å; Y736-I955 HydrophobicContact CG-CG1 3.59Å; Y736-E958 PolarHBondContact N-OE2 3.06Å
737	H	98.7	Very high	98.4	Very high	39 Å²	39	29.1 Å²	29.1	18%	0.181	15%	0.148	C	C	.	.	S	Bend	trans	-79	63.3	-168.5	-52.5	91.6	0	0	0	112.3	I734 D822 H825 E958	I734-H737 HydrophobicContact CD1-CB 4.1Å; I734-H737 WeakPolarHBondContact CD1-O 3.3Å; H737-D822 IonicContact CD2-OD2 3.77Å; H737-D822 PolarHBondContact CD2-OD2 2.95Å; H737-D822 IonicContact CG-OD2 2.84Å; H737-H825 HydrophobicContact CB-CB 3.74Å; H737-H825 VanDerWaalsContact CB-CG 3.5Å; H737-H825 VanDerWaalsContact CB-ND1 3.3Å; H737-H825 WeakPolarHBondContact CB-ND1 3.21Å; H737-H825 AromaticContact CE1-CE1 3.56Å; H737-H825 AromaticContact CG-CE1 3.56Å; H737-H825 AromaticContact CG-CG 3.83Å; H737-H825 AromaticContact CG-ND1 3.4Å; H737-H825 AromaticContact ND1-CE1 3.22Å; H737-H825 PolarHBondContact ND1-CE1 3.29Å; H737-H825 AromaticContact ND1-ND1 3.37Å; H737-H825 PolarHBondContact ND1-ND1 3.5Å; H737-E958 IonicContact CE1-OE1 3.46Å; H737-E958 PolarHBondContact CE1-OE1 2.98Å; H737-E958 IonicContact CG-OE1 2.73Å; H737-E958 PolarHBondContact N-OE2 3.14Å; H737-E958 VanDerWaalsContact N-OE2 3.11Å; H737-E958 VanDerWaalsContact ND1-CD 3.28Å; H737-E958 IonicContact ND1-OE1 3.89Å; H737-E958 PolarHBondContact ND1-OE1 3.19Å; H737-E958 IonicContact ND1-OE2 3.48Å; H737-E958 PolarHBondContact ND1-OE2 2.94Å
738	N	98.5	Very high	98.4	Very high	16 Å²	16	29.1 Å²	29.1	9%	0.086	15%	0.148	C	C	.	.	S	Bend	trans	-121.6	-176.9	-173.3	66.4	52	0	0	0	111.8	Y731 R732 I734 Y736 I740 H741 A742	Y731-N738 VanDerWaalsContact CD1-C 3.49Å; R732-N738 WeakPolarHBondContact O-CB 3.49Å; I734-N738 PolarHBondContact O-ND2 2.97Å; Y736-N738 PolarHBondContact O-N 3Å; Y736-N738 PolarHBondContact O-ND2 3.06Å; N738-I740 PolarHBondContact O-N 2.82Å; N738-I740 VanDerWaalsContact O-N 3.12Å; N738-I740 WeakPolarHBondContact OD1-CA 3.21Å; N738-I740 VanDerWaalsContact OD1-CB 3.25Å; N738-I740 WeakPolarHBondContact OD1-CB 3.41Å; N738-I740 WeakPolarHBondContact OD1-CG1 3.47Å; N738-I740 PolarHBondContact OD1-N 3.45Å; N738-H741 PolarHBondContact O-N 3.28Å; N738-H741 VanDerWaalsContact O-N 3.16Å; N738-H741 PolarHBondContact OD1-N 2.89Å; N738-A742 PolarHBondContact O-N 3.03Å; N738-A742 VanDerWaalsContact O-N 3.13Å
739	R	98.3	Very high	98.5	Very high	40 Å²	40	29 Å²	29	15%	0.151	15%	0.147	C	C	.	.	H	α-helix	trans	-59.4	-24.6	-177.4	70.5	-179.7	61.1	69.5	13.5	114.4	G693 I695 E728 Y731 T743	G693-R739 PolarHBondContact O-NE 3.32Å; I695-R739 HydrophobicContact CG2-CG 4.08Å; E728-R739 PolarHBondContact O-NE 3.35Å; E728-R739 PolarHBondContact O-NH2 3.03Å; Y731-R739 HydrophobicContact CG-CB 4.32Å; Y731-R739 PolarHBondContact O-NH2 3.47Å; Y731-R739 VanDerWaalsContact O-NH2 3.11Å; R739-T743 WeakPolarHBondContact O-CB 3.22Å; R739-T743 PolarHBondContact O-N 3.13Å; R739-T743 PolarHBondContact O-OG1 3.03Å
740	I	98.5	Very high	98.5	Very high	34 Å²	34	22.9 Å²	22.9	17%	0.174	11%	0.114	C	C	.	.	H	α-helix	trans	-76.5	-43.7	179.7	-47.8	168.9	0	0	0	109.1	I681 F682 V685 N738 T743 D744 W951	I681-I740 HydrophobicContact CD1-CG2 3.65Å; I681-I740 WeakPolarHBondContact CD1-O 3.46Å; I681-I740 HydrophobicContact CG1-CG2 3.88Å; F682-I740 HydrophobicContact CE1-CG2 4.25Å; V685-I740 HydrophobicContact CG1-CD1 4.44Å; V685-I740 HydrophobicContact CG2-CD1 3.96Å; V685-I740 HydrophobicContact CG2-CG1 4.11Å; V685-I740 HydrophobicContact CG2-CG2 4.04Å; N738-I740 PolarHBondContact O-N 2.82Å; N738-I740 VanDerWaalsContact O-N 3.12Å; N738-I740 WeakPolarHBondContact OD1-CA 3.21Å; N738-I740 VanDerWaalsContact OD1-CB 3.25Å; N738-I740 WeakPolarHBondContact OD1-CB 3.41Å; N738-I740 WeakPolarHBondContact OD1-CG1 3.47Å; N738-I740 PolarHBondContact OD1-N 3.45Å; I740-T743 WeakPolarHBondContact O-CB 3.31Å; I740-T743 PolarHBondContact O-N 3.17Å; I740-T743 VanDerWaalsContact O-N 3.11Å; I740-D744 PolarHBondContact O-N 3.39Å; I740-W951 HydrophobicContact CB-CH2 4.17Å; I740-W951 HydrophobicContact CG2-CH2 3.84Å; I740-W951 HydrophobicContact CG2-CZ2 4.41Å
741	H	98.8	Very high	98.6	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-59.9	-48.9	173.5	171.9	59.5	0	0	0	111.1	Y736 N738 T743 D744 V745 H821 D822 D937 W951	Y736-H741 AromaticContact CE2-CE1 3.76Å; Y736-H741 AromaticContact CE2-ND1 3.99Å; Y736-H741 AromaticContact CZ-CE1 3.57Å; Y736-H741 AromaticContact CZ-ND1 3.55Å; Y736-H741 AromaticContact CZ-NE2 3.7Å; Y736-H741 VanDerWaalsContact O-CB 3.24Å; Y736-H741 WeakPolarHBondContact O-CB 3.39Å; Y736-H741 PolarHBondContact OH-CE1 3.47Å; Y736-H741 PolarHBondContact OH-ND1 3.19Å; Y736-H741 PolarHBondContact OH-NE2 3.32Å; N738-H741 PolarHBondContact O-N 3.28Å; N738-H741 VanDerWaalsContact O-N 3.16Å; N738-H741 PolarHBondContact OD1-N 2.89Å; H741-T743 PolarHBondContact O-N 3.25Å; H741-T743 VanDerWaalsContact O-N 3.1Å; H741-D744 PolarHBondContact O-N 3.38Å; H741-V745 VanDerWaalsContact NE2-CG2 3.32Å; H741-V745 WeakPolarHBondContact NE2-CG2 3.37Å; H741-V745 WeakPolarHBondContact O-CG2 3.36Å; H741-V745 PolarHBondContact O-N 3.09Å; H741-H821 AromaticContact CD2-NE2 3.84Å; H741-D822 IonicContact CD2-OD2 2.78Å; H741-D822 PolarHBondContact CD2-OD2 2.97Å; H741-D822 VanDerWaalsContact CD2-OD2 3.25Å; H741-D937 VanDerWaalsContact NE2-C 3.33Å; H741-D937 PolarHBondContact NE2-O 3.06Å; H741-D937 IonicContact NE2-OD1 2.72Å; H741-D937 PolarHBondContact NE2-OD1 3.43Å; H741-W951 HydrophobicContact CB-CH2 4.09Å; H741-W951 HydrophobicContact CB-CZ3 4.04Å
742	A	98.8	Very high	98.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-55.9	-30.4	174.5	0	0	0	0	0	113.7	L696 Y731 N738 L746	L696-A742 HydrophobicContact CD1-CB 4.42Å; L696-A742 HydrophobicContact CD2-CB 4.15Å; Y731-A742 HydrophobicContact CE1-CB 3.79Å; Y731-A742 HydrophobicContact CE2-CB 4.02Å; Y731-A742 VanDerWaalsContact CZ-CB 3.48Å; Y731-A742 WeakPolarHBondContact OH-CB 3.37Å; N738-A742 PolarHBondContact O-N 3.03Å; N738-A742 VanDerWaalsContact O-N 3.13Å; A742-L746 WeakPolarHBondContact O-CB 3.42Å; A742-L746 PolarHBondContact O-N 2.77Å; A742-L746 VanDerWaalsContact O-N 3.17Å
743	T	98.8	Very high	98.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-76.3	-37.8	175.5	-57.8	0	0	0	0	112.4	I681 I695 L696 V699 R739 I740 H741 L746 H747	I681-T743 HydrophobicContact CD1-CG2 3.85Å; I695-T743 HydrophobicContact CG1-CG2 4.25Å; L696-T743 WeakPolarHBondContact CA-OG1 3.42Å; L696-T743 WeakPolarHBondContact CB-OG1 3.34Å; V699-T743 HydrophobicContact CB-CG2 3.87Å; V699-T743 HydrophobicContact CG1-CG2 3.92Å; V699-T743 HydrophobicContact CG2-CG2 3.73Å; R739-T743 WeakPolarHBondContact O-CB 3.22Å; R739-T743 PolarHBondContact O-N 3.13Å; R739-T743 PolarHBondContact O-OG1 3.03Å; I740-T743 WeakPolarHBondContact O-CB 3.31Å; I740-T743 PolarHBondContact O-N 3.17Å; I740-T743 VanDerWaalsContact O-N 3.11Å; H741-T743 PolarHBondContact O-N 3.25Å; H741-T743 VanDerWaalsContact O-N 3.1Å; T743-L746 WeakPolarHBondContact O-CB 3.49Å; T743-L746 PolarHBondContact O-N 3.2Å; T743-H747 WeakPolarHBondContact O-CB 3.46Å; T743-H747 PolarHBondContact O-N 3.19Å
744	D	98.8	Very high	98.5	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-71.2	-38.6	177.6	-167.8	68.6	0	0	0	112	I681 I740 H741 H747 A748 N939 K943 W951	I681-D744 HydrophobicContact CD1-CB 3.87Å; I740-D744 PolarHBondContact O-N 3.39Å; H741-D744 PolarHBondContact O-N 3.38Å; D744-H747 PolarHBondContact O-N 3.13Å; D744-A748 VanDerWaalsContact O-CB 3.31Å; D744-A748 WeakPolarHBondContact O-CB 3.36Å; D744-A748 PolarHBondContact O-N 2.99Å; D744-N939 PolarHBondContact OD2-ND2 3.27Å; D744-N939 PolarHBondContact OD2-OD1 3.3Å; D744-K943 IonicContact OD1-NZ 2.75Å; D744-K943 PolarHBondContact OD1-NZ 3.3Å; D744-K943 IonicContact OD2-NZ 3.16Å; D744-K943 PolarHBondContact OD2-NZ 3.16Å; D744-W951 HydrophobicContact CB-CH2 4.49Å; D744-W951 HydrophobicContact CB-CZ2 3.67Å; D744-W951 PolarHBondContact OD2-NE1 2.79Å
745	V	98.9	Very high	98.4	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-64.5	-42	172.2	-179.3	0	0	0	0	110.8	H741 A748 V749 A818 I933 A936	H741-V745 VanDerWaalsContact NE2-CG2 3.32Å; H741-V745 WeakPolarHBondContact NE2-CG2 3.37Å; H741-V745 WeakPolarHBondContact O-CG2 3.36Å; H741-V745 PolarHBondContact O-N 3.09Å; V745-A748 PolarHBondContact O-N 2.98Å; V745-V749 WeakPolarHBondContact O-CG2 3.35Å; V745-V749 PolarHBondContact O-N 2.92Å; V745-A818 HydrophobicContact CG1-CB 4.07Å; V745-I933 HydrophobicContact CG1-CG1 4.31Å; V745-A936 HydrophobicContact CG1-CB 3.99Å
746	L	98.9	Very high	98.2	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-59.9	-48.6	173.5	167.5	65.3	0	0	0	112.4	L696 V699 M700 L703 A742 T743 A748 V749 W750 A818	L696-L746 HydrophobicContact CD1-CD2 3.68Å; V699-L746 HydrophobicContact CG1-CD2 3.86Å; V699-L746 HydrophobicContact CG1-CG 4.48Å; M700-L746 HydrophobicContact CB-CD2 4.46Å; M700-L746 HydrophobicContact CG-CD2 3.53Å; M700-L746 HydrophobicContact SD-CD1 3.48Å; M700-L746 WeakPolarHBondContact SD-CD1 3.45Å; M700-L746 HydrophobicContact SD-CD2 3.39Å; M700-L746 WeakPolarHBondContact SD-CD2 3.32Å; M700-L746 HydrophobicContact SD-CG 4.08Å; L703-L746 HydrophobicContact CD1-CD1 3.92Å; L703-L746 HydrophobicContact CD1-CD2 4.23Å; L703-L746 HydrophobicContact CD1-CG 3.76Å; A742-L746 WeakPolarHBondContact O-CB 3.42Å; A742-L746 PolarHBondContact O-N 2.77Å; A742-L746 VanDerWaalsContact O-N 3.17Å; T743-L746 WeakPolarHBondContact O-CB 3.49Å; T743-L746 PolarHBondContact O-N 3.2Å; L746-A748 VanDerWaalsContact C-N 3.33Å; L746-A748 PolarHBondContact O-N 2.9Å; L746-V749 VanDerWaalsContact O-CG2 3.25Å; L746-V749 WeakPolarHBondContact O-CG2 3.28Å; L746-V749 PolarHBondContact O-N 3.43Å; L746-W750 PolarHBondContact O-N 2.94Å; L746-W750 VanDerWaalsContact O-N 3.17Å; L746-A818 HydrophobicContact CB-CB 4.27Å
747	H	98.8	Very high	98.1	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-58.3	-46.9	174.7	166.1	-100.3	0	0	0	110.8	M674 N676 F679 T743 D744 V749 W750 Y751	M674-H747 HydrophobicContact CE-CB 4.26Å; M674-H747 PolarHBondContact O-NE2 3.14Å; N676-H747 PolarHBondContact O-CE1 3.04Å; N676-H747 PolarHBondContact O-NE2 3.37Å; F679-H747 WeakPolarHBondContact CB-CE1 3.32Å; F679-H747 HydrophobicContact CD1-CB 4.22Å; F679-H747 AromaticContact CD1-CG 3.83Å; T743-H747 WeakPolarHBondContact O-CB 3.46Å; T743-H747 PolarHBondContact O-N 3.19Å; D744-H747 PolarHBondContact O-N 3.13Å; H747-V749 PolarHBondContact O-N 2.94Å; H747-W750 AromaticContact CD2-CE3 3.91Å; H747-W750 AromaticContact CD2-CZ3 3.8Å; H747-W750 AromaticContact NE2-CZ3 3.91Å; H747-W750 PolarHBondContact O-N 3.41Å; H747-Y751 WeakPolarHBondContact O-CB 3.47Å; H747-Y751 PolarHBondContact O-N 3.06Å
748	A	98.8	Very high	97.9	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-62.8	-43.5	-179.3	0	0	0	0	0	112.7	W677 D744 V745 L746 W750 Y751 L752 A936	W677-A748 HydrophobicContact CH2-CB 4.08Å; W677-A748 HydrophobicContact CZ3-CB 3.89Å; D744-A748 VanDerWaalsContact O-CB 3.31Å; D744-A748 WeakPolarHBondContact O-CB 3.36Å; D744-A748 PolarHBondContact O-N 2.99Å; V745-A748 PolarHBondContact O-N 2.98Å; L746-A748 VanDerWaalsContact C-N 3.33Å; L746-A748 PolarHBondContact O-N 2.9Å; A748-W750 PolarHBondContact O-N 3.1Å; A748-Y751 PolarHBondContact O-N 3.41Å; A748-L752 VanDerWaalsContact O-CB 3.3Å; A748-L752 WeakPolarHBondContact O-CB 3.42Å; A748-L752 WeakPolarHBondContact O-CD1 3.41Å; A748-L752 WeakPolarHBondContact O-CG 3.42Å; A748-L752 PolarHBondContact O-N 3.44Å; A748-A936 HydrophobicContact CB-CB 3.62Å
749	V	98.8	Very high	97.5	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-66.1	-35.7	176.1	-65.5	0	0	0	0	113	V745 L746 H747 T753 L814 Y815 A818 I933 A936	V745-V749 WeakPolarHBondContact O-CG2 3.35Å; V745-V749 PolarHBondContact O-N 2.92Å; L746-V749 VanDerWaalsContact O-CG2 3.25Å; L746-V749 WeakPolarHBondContact O-CG2 3.28Å; L746-V749 PolarHBondContact O-N 3.43Å; H747-V749 PolarHBondContact O-N 2.94Å; V749-T753 WeakPolarHBondContact O-CB 3.4Å; V749-T753 WeakPolarHBondContact O-CG2 3.32Å; V749-T753 PolarHBondContact O-N 3.46Å; V749-T753 PolarHBondContact O-OG1 3.32Å; V749-L814 HydrophobicContact CB-CD2 4.18Å; V749-L814 HydrophobicContact CB-CG 4.09Å; V749-L814 HydrophobicContact CG1-CD1 4.24Å; V749-L814 HydrophobicContact CG1-CG 4.23Å; V749-L814 HydrophobicContact CG2-CG 4.41Å; V749-Y815 HydrophobicContact CB-CD1 4.47Å; V749-Y815 HydrophobicContact CG2-CD1 3.75Å; V749-Y815 HydrophobicContact CG2-CE1 4.33Å; V749-A818 HydrophobicContact CG1-CB 4.5Å; V749-A818 HydrophobicContact CG2-CB 3.72Å; V749-I933 HydrophobicContact CG1-CB 4.16Å; V749-I933 HydrophobicContact CG1-CG1 4.32Å; V749-A936 HydrophobicContact CB-CB 4.47Å; V749-A936 HydrophobicContact CG1-CB 3.41Å; V749-A936 VanDerWaalsContact CG1-CB 3.41Å
750	W	98.7	Very high	97.2	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-68.1	-41.5	173.6	161.8	90.2	0	0	0	111.6	M674 L703 D706 L746 H747 A748 T753 T754 Y815	M674-W750 HydrophobicContact CB-CH2 4.19Å; M674-W750 HydrophobicContact CB-CZ3 4.18Å; M674-W750 VanDerWaalsContact O-CZ3 3.29Å; M674-W750 WeakPolarHBondContact O-CZ3 3.44Å; L703-W750 HydrophobicContact CD1-CB 3.91Å; L703-W750 HydrophobicContact CD1-CG 4.07Å; L703-W750 HydrophobicContact CD2-CB 4.36Å; L703-W750 HydrophobicContact CD2-CD2 3.45Å; L703-W750 VanDerWaalsContact CD2-CD2 3.45Å; L703-W750 VanDerWaalsContact CD2-CE2 3.42Å; L703-W750 HydrophobicContact CD2-CE3 4.04Å; L703-W750 HydrophobicContact CD2-CG 3.6Å; L703-W750 HydrophobicContact CD2-CH2 4.48Å; L703-W750 HydrophobicContact CD2-CZ2 3.94Å; L703-W750 HydrophobicContact CG-CG 4.37Å; D706-W750 PolarHBondContact OD2-NE1 3.41Å; L746-W750 PolarHBondContact O-N 2.94Å; L746-W750 VanDerWaalsContact O-N 3.17Å; H747-W750 AromaticContact CD2-CE3 3.91Å; H747-W750 AromaticContact CD2-CZ3 3.8Å; H747-W750 AromaticContact NE2-CZ3 3.91Å; H747-W750 PolarHBondContact O-N 3.41Å; A748-W750 PolarHBondContact O-N 3.1Å; W750-T753 PolarHBondContact O-N 3.11Å; W750-T753 PolarHBondContact O-OG1 2.93Å; W750-T754 HydrophobicContact CG-CG2 4.34Å; W750-T754 WeakPolarHBondContact O-CB 3.39Å; W750-T754 VanDerWaalsContact O-CG2 3.3Å; W750-T754 WeakPolarHBondContact O-CG2 3.36Å; W750-T754 PolarHBondContact O-N 2.95Å; W750-T754 PolarHBondContact O-OG1 3.32Å; W750-Y815 HydrophobicContact CB-CE1 4.15Å
751	Y	98.5	Very high	96.6	Very high	30 Å²	30	14.5 Å²	14.5	12%	0.118	8%	0.083	C	C	.	.	H	α-helix	trans	-64.3	-50.5	178.4	-169.6	-84.1	0	0	0	111	N676 W677 H747 A748 T753 T754 R755 P1010	N676-Y751 VanDerWaalsContact C-CE2 3.47Å; W677-Y751 HydrophobicContact CB-CD1 4.45Å; W677-Y751 HydrophobicContact CB-CE1 3.8Å; W677-Y751 HydrophobicContact CB-CE2 4.17Å; W677-Y751 HydrophobicContact CD2-CD1 4.45Å; W677-Y751 HydrophobicContact CD2-CE1 4.45Å; W677-Y751 AromaticContact CE3-CD1 3.54Å; W677-Y751 HydrophobicContact CE3-CD1 3.54Å; W677-Y751 AromaticContact CE3-CE1 3.96Å; W677-Y751 HydrophobicContact CE3-CE1 3.96Å; W677-Y751 HydrophobicContact CE3-CG 4.01Å; W677-Y751 HydrophobicContact CG-CE1 4.44Å; W677-Y751 HydrophobicContact CZ3-CD1 4.23Å; W677-Y751 PolarHBondContact N-OH 3.14Å; H747-Y751 WeakPolarHBondContact O-CB 3.47Å; H747-Y751 PolarHBondContact O-N 3.06Å; A748-Y751 PolarHBondContact O-N 3.41Å; Y751-T753 PolarHBondContact O-N 2.97Å; Y751-T753 VanDerWaalsContact O-N 3.16Å; Y751-T754 PolarHBondContact O-N 2.88Å; Y751-R755 HydrophobicContact CD1-CB 4.46Å; Y751-R755 HydrophobicContact CD1-CG 3.8Å; Y751-R755 HydrophobicContact CD2-CG 3.6Å; Y751-R755 HydrophobicContact CE1-CB 4.33Å; Y751-R755 HydrophobicContact CE1-CG 3.83Å; Y751-R755 HydrophobicContact CE2-CG 3.61Å; Y751-R755 HydrophobicContact CG-CG 3.7Å; Y751-R755 WeakPolarHBondContact O-CB 3.41Å; Y751-R755 VanDerWaalsContact O-CG 3.24Å; Y751-R755 WeakPolarHBondContact O-CG 3.26Å; Y751-R755 PolarHBondContact O-N 3.01Å; Y751-R755 VanDerWaalsContact O-N 3.13Å; Y751-P1010 HydrophobicContact CE1-CB 4.3Å
752	L	98.4	Very high	95.7	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62	-21.7	179.4	-69.1	166.9	0	0	0	113.6	W677 A748 L935 A936 L1009 P1010 L1061	W677-L752 HydrophobicContact CZ3-CD1 4.48Å; W677-L752 HydrophobicContact CZ3-CD2 4.29Å; W677-L752 HydrophobicContact CZ3-CG 4.12Å; A748-L752 VanDerWaalsContact O-CB 3.3Å; A748-L752 WeakPolarHBondContact O-CB 3.42Å; A748-L752 WeakPolarHBondContact O-CD1 3.41Å; A748-L752 WeakPolarHBondContact O-CG 3.42Å; A748-L752 PolarHBondContact O-N 3.44Å; L752-L935 HydrophobicContact CD1-CD2 3.79Å; L752-L935 HydrophobicContact CD2-CD2 4.27Å; L752-A936 HydrophobicContact CD1-CB 4.35Å; L752-L1009 HydrophobicContact CD2-CD2 4.15Å; L752-P1010 HydrophobicContact CD2-CG 4.46Å; L752-L1061 HydrophobicContact CD2-CD2 4.01Å
753	T	98	Very high	94.6	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-104.2	-19.9	-179.2	56	0	0	0	0	115.1	V749 W750 Y751 L802 S803 L811 L814 Y815	V749-T753 WeakPolarHBondContact O-CB 3.4Å; V749-T753 WeakPolarHBondContact O-CG2 3.32Å; V749-T753 PolarHBondContact O-N 3.46Å; V749-T753 PolarHBondContact O-OG1 3.32Å; W750-T753 PolarHBondContact O-N 3.11Å; W750-T753 PolarHBondContact O-OG1 2.93Å; Y751-T753 PolarHBondContact O-N 2.97Å; Y751-T753 VanDerWaalsContact O-N 3.16Å; T753-L802 HydrophobicContact CG2-CB 4.33Å; T753-L802 HydrophobicContact CG2-CD2 4.18Å; T753-L802 PolarHBondContact O-N 3.35Å; T753-S803 PolarHBondContact O-N 3.45Å; T753-L811 HydrophobicContact CG2-CD2 3.76Å; T753-L814 HydrophobicContact CG2-CD2 3.95Å; T753-Y815 PolarHBondContact OG1-OH 2.76Å
754	T	96.7	Very high	93	Very high	7 Å²	7	26.2 Å²	26.2	4%	0.043	14%	0.14	C	C	.	.	H	α-helix	trans	-104.8	-28.5	-177.8	62.2	0	0	0	0	115.2	T707 W750 Y751	T707-T754 HydrophobicContact CG2-CG2 4.47Å; W750-T754 HydrophobicContact CG-CG2 4.34Å; W750-T754 WeakPolarHBondContact O-CB 3.39Å; W750-T754 VanDerWaalsContact O-CG2 3.3Å; W750-T754 WeakPolarHBondContact O-CG2 3.36Å; W750-T754 PolarHBondContact O-N 2.95Å; W750-T754 PolarHBondContact O-OG1 3.32Å; Y751-T754 PolarHBondContact O-N 2.88Å
755	R	95.7	Very high	90.6	Very high	10 Å²	10	31 Å²	31	4%	0.038	17%	0.166	C	C	.	.	S	Bend	trans	-76.8	161.2	-174.3	-60.4	-62.4	109.1	157.3	-2.4	112.3	S675 Y751 S789 S791 P1010	S675-R755 PolarHBondContact OG-NH1 3.38Å; S675-R755 VanDerWaalsContact OG-NH1 3.1Å; Y751-R755 HydrophobicContact CD1-CB 4.46Å; Y751-R755 HydrophobicContact CD1-CG 3.8Å; Y751-R755 HydrophobicContact CD2-CG 3.6Å; Y751-R755 HydrophobicContact CE1-CB 4.33Å; Y751-R755 HydrophobicContact CE1-CG 3.83Å; Y751-R755 HydrophobicContact CE2-CG 3.61Å; Y751-R755 HydrophobicContact CG-CG 3.7Å; Y751-R755 WeakPolarHBondContact O-CB 3.41Å; Y751-R755 VanDerWaalsContact O-CG 3.24Å; Y751-R755 WeakPolarHBondContact O-CG 3.26Å; Y751-R755 PolarHBondContact O-N 3.01Å; Y751-R755 VanDerWaalsContact O-N 3.13Å; R755-S789 PolarHBondContact NH2-OG 2.99Å; R755-S791 PolarHBondContact NH2-OG 3.27Å; R755-P1010 HydrophobicContact CB-CB 3.9Å; R755-P1010 HydrophobicContact CB-CG 4.1Å
756	P	95.4	Very high	88.3	Confident	24 Å²	24	34.5 Å²	34.5	16%	0.156	20%	0.201	C	C	.	.			trans	-67.1	132.7	-177.2	-20.7	34.6	0	0	0	112.8	Y799 G800 P1010 G1011	P756-Y799 HydrophobicContact CB-CD1 3.64Å; P756-Y799 HydrophobicContact CB-CE1 4.31Å; P756-Y799 HydrophobicContact CB-CG 4.13Å; P756-G800 CarbonylContact C-O 3.59Å; P756-G800 WeakPolarHBondContact CA-O 3Å; P756-P1010 VanDerWaalsContact O-CA 3.26Å; P756-P1010 WeakPolarHBondContact O-CA 3.32Å; P756-G1011 PolarHBondContact O-N 2.87Å
757	V	95.8	Very high	85	Confident	0 Å²	0	40 Å²	40	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	115	179.2	-179.5	0	0	0	0	108.6	G759 L760 Y799 G800 L802 G1007 P1010	V757-G759 PolarHBondContact O-N 3.44Å; V757-L760 HydrophobicContact CB-CB 3.88Å; V757-L760 HydrophobicContact CB-CD2 3.88Å; V757-L760 HydrophobicContact CG1-CB 3.75Å; V757-L760 HydrophobicContact CG1-CD2 4.07Å; V757-L760 HydrophobicContact CG1-CG 4.5Å; V757-L760 HydrophobicContact CG2-CD2 4.18Å; V757-L760 PolarHBondContact O-N 3.35Å; V757-Y799 WeakPolarHBondContact O-CA 3.23Å; V757-G800 PolarHBondContact N-O 3.37Å; V757-G800 PolarHBondContact O-N 3.01Å; V757-L802 HydrophobicContact CG2-CD1 3.94Å; V757-G1007 WeakPolarHBondContact CG1-O 3.35Å; V757-P1010 HydrophobicContact CG2-CG 4.32Å
758	P	94.2	Very high	81.9	Confident	9 Å²	9	42.1 Å²	42.1	6%	0.058	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	126.6	-179	-24.9	33.1	0	0	0	112.9	L760 Y799 W1013 I1057	P758-L760 VanDerWaalsContact C-N 3.26Å; P758-L760 PolarHBondContact O-N 2.83Å; P758-Y799 HydrophobicContact CB-CD1 4.43Å; P758-Y799 HydrophobicContact CB-CE1 4.31Å; P758-Y799 HydrophobicContact CG-CD1 4.17Å; P758-Y799 HydrophobicContact CG-CE1 3.83Å; P758-W1013 HydrophobicContact CB-CD2 4.18Å; P758-W1013 HydrophobicContact CB-CH2 4.25Å; P758-W1013 HydrophobicContact CB-CZ2 3.77Å; P758-I1057 HydrophobicContact CB-CD1 3.98Å; P758-I1057 HydrophobicContact CB-CG1 4.08Å; P758-I1057 HydrophobicContact CB-CG2 4.48Å; P758-I1057 HydrophobicContact CG-CG1 4.48Å; P758-I1057 HydrophobicContact CG-CG2 4.01Å
759	G	89.8	Confident	78.8	Confident	49 Å²	49	48.8 Å²	48.8	51%	0.505	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	0.8	174.9	0	0	0	0	0	116.5	V757 Q761 S798	V757-G759 PolarHBondContact O-N 3.44Å; G759-Q761 PolarHBondContact O-N 3.12Å; G759-S798 PolarHBondContact N-O 2.92Å
760	L	92.5	Very high	75.6	Confident	19 Å²	19	51.7 Å²	51.7	10%	0.099	33%	0.331	C	S	.	.			trans	-69.6	121.5	179	177.2	61	0	0	0	111.6	V757 P758 Q762 G800 L802 W919 L1008	V757-L760 HydrophobicContact CB-CB 3.88Å; V757-L760 HydrophobicContact CB-CD2 3.88Å; V757-L760 HydrophobicContact CG1-CB 3.75Å; V757-L760 HydrophobicContact CG1-CD2 4.07Å; V757-L760 HydrophobicContact CG1-CG 4.5Å; V757-L760 HydrophobicContact CG2-CD2 4.18Å; V757-L760 PolarHBondContact O-N 3.35Å; P758-L760 VanDerWaalsContact C-N 3.26Å; P758-L760 PolarHBondContact O-N 2.83Å; L760-Q762 PolarHBondContact O-N 3.43Å; L760-G800 WeakPolarHBondContact O-CA 3.32Å; L760-G800 PolarHBondContact O-N 3.4Å; L760-L802 HydrophobicContact CD2-CD1 3.81Å; L760-W919 HydrophobicContact CD1-CZ2 3.97Å; L760-L1008 HydrophobicContact CD1-CD2 4.29Å
761	Q	85.8	Confident	72.8	Confident	154 Å²	154	58.6 Å²	58.6	72%	0.72	37%	0.368	S	S	*	.			trans	-74.3	117.2	-178.9	-65.4	-175.5	5	0	0	112.3	G759 I763 N805	G759-Q761 PolarHBondContact O-N 3.12Å; Q761-I763 PolarHBondContact O-N 3.35Å; Q761-N805 PolarHBondContact O-ND2 3.36Å
762	Q	79.6	Confident	69.6	Low	54 Å²	54	65.2 Å²	65.2	25%	0.252	40%	0.4	S	S	.	.			trans	-78.9	106.9	172.4	-62.1	-168.2	-67.7	0	0	110.8	L760 N765 S804	L760-Q762 PolarHBondContact O-N 3.43Å; Q762-N765 WeakPolarHBondContact CB-OD1 3.29Å; Q762-N765 PolarHBondContact OE1-OD1 2.9Å; Q762-S804 PolarHBondContact NE2-OG 3.02Å
763	I	75.3	Confident	66.8	Low	94 Å²	94	70.9 Å²	70.9	48%	0.482	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-24.9	179.1	-71	166.7	0	0	0	111.6	Q761 W919	Q761-I763 PolarHBondContact O-N 3.35Å; I763-W919 HydrophobicContact CD1-CB 3.93Å; I763-W919 HydrophobicContact CD1-CG 4.07Å
764	H	65	Low	63.8	Low	99 Å²	99	76.7 Å²	76.7	46%	0.458	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	66.6	176.2	-60.2	-53.4	0	0	0	112	G766 Y786	H764-G766 PolarHBondContact O-N 2.85Å; H764-Y786 AromaticContact CD2-CE1 3.96Å; H764-Y786 AromaticContact CD2-CE2 3.97Å; H764-Y786 AromaticContact CD2-CZ 3.44Å; H764-Y786 VanDerWaalsContact CD2-CZ 3.44Å; H764-Y786 PolarHBondContact CD2-OH 3.36Å; H764-Y786 PolarHBondContact NE2-OH 3.04Å
765	N	49.1	Very low	61.1	Low	102 Å²	102	82 Å²	82	55%	0.545	50%	0.503	S	S	.	.			trans	-52.1	138.2	161.4	-84.4	14.1	0	0	0	110	Q762 C767	Q762-N765 WeakPolarHBondContact CB-OD1 3.29Å; Q762-N765 PolarHBondContact OE1-OD1 2.9Å; N765-C767 VanDerWaalsContact C-N 3.28Å; N765-C767 PolarHBondContact O-N 3.29Å
766	G	49.9	Very low	58.6	Low	72 Å²	72	87.2 Å²	87.2	74%	0.742	53%	0.532	S	S	*	.			trans	-67	66.5	-166.4	0	0	0	0	0	116.3	H764 G768	H764-G766 PolarHBondContact O-N 2.85Å; G766-G768 VanDerWaalsContact C-N 3.26Å; G766-G768 PolarHBondContact O-N 3.5Å
767	C	30.7	Very low	56.7	Low	115 Å²	115	89.6 Å²	89.6	78%	0.777	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	80.1	169.3	-166.5	0	0	0	0	109.4	N765 R783	N765-C767 VanDerWaalsContact C-N 3.28Å; N765-C767 PolarHBondContact O-N 3.29Å; C767-R783 PolarHBondContact O-NH2 2.65Å
768	G	32.9	Very low	54.8	Low	45 Å²	45	99 Å²	99	46%	0.464	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-158.2	-18.3	-169.4	0	0	0	0	0	116.6	G766 G770	G766-G768 VanDerWaalsContact C-N 3.26Å; G766-G768 PolarHBondContact O-N 3.5Å; G768-G770 PolarHBondContact O-N 3.36Å
769	T	34.6	Very low	53.3	Low	140 Å²	140	100.3 Å²	100.3	86%	0.859	60%	0.603	S	S	*	*			trans	-76.9	47.4	176.7	-33.5	0	0	0	0	112.4
770	G	30.1	Very low	51.8	Low	61 Å²	61	103.8 Å²	103.8	63%	0.629	61%	0.61	S	S	*	*			trans	-97.1	114.2	166.8	0	0	0	0	0	108.6	G768 E772	G768-G770 PolarHBondContact O-N 3.36Å; G770-E772 PolarHBondContact O-N 2.83Å
771	N	39.9	Very low	50.2	Low	146 Å²	146	111.1 Å²	111.1	78%	0.781	64%	0.636	S	S	*	*			trans	-70.3	92.4	179.7	-69.4	-16.1	0	0	0	111
772	E	33.1	Very low	49	Very low	168 Å²	168	108 Å²	108	79%	0.785	65%	0.645	S	S	*	*			trans	-108.6	97	152	-73.3	-68.1	178.9	0	0	107.4	G770 D774	G770-E772 PolarHBondContact O-N 2.83Å; E772-D774 PolarHBondContact O-N 3.01Å
773	T	39.4	Very low	49	Very low	120 Å²	120	113.8 Å²	113.8	74%	0.736	66%	0.664	S	S	*	*			trans	-78.9	66.6	176	51.4	0	0	0	0	110.4	S775	T773-S775 PolarHBondContact O-N 3.06Å; T773-S775 PolarHBondContact O-OG 2.84Å
774	D	34.7	Very low	49.7	Very low	122 Å²	122	114.6 Å²	114.6	65%	0.652	67%	0.669	S	S	*	*			trans	-58.1	103.2	160.9	-90.8	-23.6	0	0	0	107.3	E772 D776	E772-D774 PolarHBondContact O-N 3.01Å; D774-D776 PolarHBondContact O-N 3.42Å
775	S	40.7	Very low	51	Low	119 Å²	119	111.8 Å²	111.8	83%	0.832	66%	0.662	S	S	*	*			trans	-74.5	9.8	-177.1	-59	0	0	0	0	113.1	T773	T773-S775 PolarHBondContact O-N 3.06Å; T773-S775 PolarHBondContact O-OG 2.84Å
776	D	42.3	Very low	53.1	Low	120 Å²	120	110 Å²	110	64%	0.642	65%	0.649	S	S	*	*	S	Bend	trans	-89.1	121.8	174.4	-83	7.2	0	0	0	109.5	D774 R778	D774-D776 PolarHBondContact O-N 3.42Å; D776-R778 HydrophobicContact CB-CB 4.44Å; D776-R778 PolarHBondContact O-N 3.09Å
777	G	55.5	Low	55.2	Low	74 Å²	74	107 Å²	107	76%	0.763	62%	0.615	S	S	*	*			trans	-67	25.7	176.1	0	0	0	0	0	115.8
778	R	56.8	Low	58.2	Low	196 Å²	196	105.8 Å²	105.8	74%	0.74	61%	0.608	S	S	*	*			trans	-84.4	121.3	-175.9	174.5	178.6	-80.7	-178.1	-2.8	110.5	D776 N780	D776-R778 HydrophobicContact CB-CB 4.44Å; D776-R778 PolarHBondContact O-N 3.09Å; R778-N780 PolarHBondContact O-N 3.08Å
779	I	60.6	Low	61	Low	37 Å²	37	103.9 Å²	103.9	19%	0.19	59%	0.588	C	S	.	*			trans	-57.5	127	173.3	-60.4	173.3	0	0	0	109.9	K714 R781 H873	K714-I779 HydrophobicContact CB-CD1 4.42Å; K714-I779 HydrophobicContact CG-CD1 3.98Å; K714-I779 HydrophobicContact CG-CG1 3.88Å; I779-R781 HydrophobicContact CB-CG 4.39Å; I779-R781 HydrophobicContact CG2-CG 4.07Å; I779-R781 PolarHBondContact O-N 3.08Å; I779-H873 HydrophobicContact CD1-CB 4.13Å
780	N	60	Low	63.7	Low	123 Å²	123	103.1 Å²	103.1	66%	0.658	57%	0.573	S	S	*	*			trans	-79.9	66.9	179.5	-102.8	-38.9	0	0	0	111.6	R778 G782 R783	R778-N780 PolarHBondContact O-N 3.08Å; N780-G782 PolarHBondContact O-N 3.36Å; N780-R783 PolarHBondContact O-N 3.15Å
781	R	57.9	Low	66.4	Low	173 Å²	173	101.9 Å²	101.9	65%	0.653	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-5	-172.5	-68.6	171.2	-179.1	159	-0.4	117.3	I779	I779-R781 HydrophobicContact CB-CG 4.39Å; I779-R781 HydrophobicContact CG2-CG 4.07Å; I779-R781 PolarHBondContact O-N 3.08Å
782	G	60.8	Low	68.4	Low	87 Å²	87	96.7 Å²	96.7	90%	0.897	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-9.1	175.6	0	0	0	0	0	115	N780	N780-G782 PolarHBondContact O-N 3.36Å
783	R	80.2	Confident	70.6	Confident	176 Å²	176	93.5 Å²	93.5	66%	0.664	53%	0.525	S	S	*	.	S	Bend	trans	-118.3	128.4	-176.2	-168.1	178.2	-172.7	-178.2	4.5	110.9	C767 N780 A785	C767-R783 PolarHBondContact O-NH2 2.65Å; N780-R783 PolarHBondContact O-N 3.15Å; R783-A785 PolarHBondContact O-N 3.26Å
784	I	88.6	Confident	72.5	Confident	112 Å²	112	90.6 Å²	90.6	57%	0.574	50%	0.504	S	S	*	.			trans	-64.9	122.5	171.6	-58.8	177.3	0	0	0	108.6	Y786 P807	I784-Y786 HydrophobicContact CB-CE2 4.19Å; I784-Y786 HydrophobicContact CG2-CD2 4.31Å; I784-Y786 HydrophobicContact CG2-CE2 3.63Å; I784-P807 HydrophobicContact CG2-CB 3.74Å; I784-P807 HydrophobicContact CG2-CG 3.84Å
785	A	92.7	Very high	74.5	Confident	39 Å²	39	88.9 Å²	88.9	32%	0.322	50%	0.5	S	S	.	.			trans	-84.8	148.3	173.3	0	0	0	0	0	111.2	I712 R783 A808	I712-A785 HydrophobicContact CG2-CB 3.67Å; R783-A785 PolarHBondContact O-N 3.26Å; A785-A808 HydrophobicContact CB-CB 4.14Å; A785-A808 WeakPolarHBondContact O-CB 3.36Å; A785-A808 PolarHBondContact O-N 3.28Å
786	Y	93.9	Very high	76.6	Confident	66 Å²	66	86.9 Å²	86.9	26%	0.259	48%	0.48	S	S	.	.			trans	-127	150.7	172.7	-70.1	-94.9	0	0	0	107.9	H764 I784 I806 P807	H764-Y786 AromaticContact CD2-CE1 3.96Å; H764-Y786 AromaticContact CD2-CE2 3.97Å; H764-Y786 AromaticContact CD2-CZ 3.44Å; H764-Y786 VanDerWaalsContact CD2-CZ 3.44Å; H764-Y786 PolarHBondContact CD2-OH 3.36Å; H764-Y786 PolarHBondContact NE2-OH 3.04Å; I784-Y786 HydrophobicContact CB-CE2 4.19Å; I784-Y786 HydrophobicContact CG2-CD2 4.31Å; I784-Y786 HydrophobicContact CG2-CE2 3.63Å; Y786-I806 WeakPolarHBondContact CD1-O 3.26Å; Y786-P807 HydrophobicContact CE1-CG 4.15Å
787	I	94.3	Very high	78.6	Confident	7 Å²	7	90.5 Å²	90.5	4%	0.036	49%	0.493	C	S	.	.			trans	-92.8	153.8	178	67.3	-175.7	0	0	0	110.6	T707 L709 I712 S803 A808 L811 Y815	T707-I787 HydrophobicContact CG2-CD1 3.94Å; T707-I787 WeakPolarHBondContact O-CB 2.97Å; L709-I787 HydrophobicContact CD2-CG2 3.57Å; L709-I787 HydrophobicContact CG-CG2 3.96Å; I712-I787 HydrophobicContact CD1-CG2 3.94Å; I787-S803 WeakPolarHBondContact O-CB 3.43Å; I787-S803 PolarHBondContact O-OG 2.62Å; I787-A808 HydrophobicContact CG2-CB 3.6Å; I787-L811 HydrophobicContact CD1-CB 3.98Å; I787-L811 HydrophobicContact CD1-CD1 3.62Å; I787-L811 HydrophobicContact CD1-CG 4.45Å; I787-L811 HydrophobicContact CG1-CD1 3.98Å; I787-Y815 HydrophobicContact CD1-CE2 3.92Å; I787-Y815 VanDerWaalsContact CD1-OH 3.31Å; I787-Y815 WeakPolarHBondContact CD1-OH 3.46Å
788	S	92.2	Very high	80.2	Confident	90 Å²	90	88.3 Å²	88.3	63%	0.629	47%	0.466	S	S	*	.			trans	-129.3	132.7	163	-169.9	0	0	0	0	107.6
789	S	92.5	Very high	81.9	Confident	6 Å²	6	80.2 Å²	80.2	4%	0.042	44%	0.436	C	S	.	.			trans	-75.5	123.4	175.1	-178	0	0	0	0	109.3	D706 R755 S791 C792	D706-S789 PolarHBondContact OD1-OG 3.18Å; D706-S789 WeakPolarHBondContact OD2-CB 3.37Å; D706-S789 PolarHBondContact OD2-OG 3.4Å; R755-S789 PolarHBondContact NH2-OG 2.99Å; S789-S791 PolarHBondContact O-N 2.87Å; S789-S791 PolarHBondContact OG-OG 2.95Å; S789-C792 PolarHBondContact O-N 3.11Å
790	K	91.1	Very high	83.4	Confident	124 Å²	124	78.5 Å²	78.5	54%	0.539	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.9	178.4	-71.1	163.3	-173.9	169.9	0	111.7	Q705 D706 E711	Q705-K790 WeakPolarHBondContact O-CE 3.35Å; Q705-K790 PolarHBondContact O-NZ 3.31Å; D706-K790 WeakPolarHBondContact O-CD 3.47Å; D706-K790 VanDerWaalsContact O-CG 3.25Å; D706-K790 WeakPolarHBondContact O-CG 3.25Å; D706-K790 PolarHBondContact O-N 3.34Å; D706-K790 PolarHBondContact OD1-N 2.82Å; D706-K790 VanDerWaalsContact OD1-N 3.14Å; E711-K790 IonicContact OE1-NZ 3.87Å; E711-K790 PolarHBondContact OE1-NZ 3.25Å
791	S	86.6	Confident	85.1	Confident	34 Å²	34	73 Å²	73	24%	0.238	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	2.7	-178.6	58.2	0	0	0	0	116.1	D706 R755 S789	D706-S791 VanDerWaalsContact OD1-CB 3.23Å; D706-S791 WeakPolarHBondContact OD1-CB 3.24Å; D706-S791 PolarHBondContact OD1-N 2.83Å; D706-S791 PolarHBondContact OD1-OG 3.35Å; R755-S791 PolarHBondContact NH2-OG 3.27Å; S789-S791 PolarHBondContact O-N 2.87Å; S789-S791 PolarHBondContact OG-OG 2.95Å
792	C	83.6	Confident	86.9	Confident	37 Å²	37	64.7 Å²	64.7	25%	0.25	37%	0.367	C	S	.	.			trans	-150.6	123.4	176	-166.7	0	0	0	0	113.5	S789	S789-C792 PolarHBondContact O-N 3.11Å
793	S	77.3	Confident	88.5	Confident	101 Å²	101	60.7 Å²	60.7	71%	0.706	33%	0.325	S	S	*	.			trans	-95.2	139.8	168	56.4	0	0	0	0	111.1
794	I	79.6	Confident	89.1	Confident	59 Å²	59	53.2 Å²	53.2	30%	0.303	30%	0.3	S	S	.	.			trans	-66.9	129.5	171.8	-59.8	175.2	0	0	0	108.9
795	P	77.5	Confident	89.4	Confident	86 Å²	86	48 Å²	48	56%	0.558	27%	0.272	S	S	*	.			trans	-66.2	-45.7	-173.4	-23.3	34	0	0	0	114.3	Y799	P795-Y799 HydrophobicContact CB-CD2 4.31Å; P795-Y799 HydrophobicContact CB-CE2 4.3Å; P795-Y799 HydrophobicContact CG-CD2 4.18Å; P795-Y799 HydrophobicContact CG-CE2 4.2Å
796	D	84.6	Confident	89.7	Confident	78 Å²	78	46.1 Å²	46.1	42%	0.417	26%	0.257	S	S	.	.	S	Bend	trans	-161.3	173.2	-176.4	73.5	-78.6	0	0	0	111.1	S798 Y799	D796-S798 VanDerWaalsContact CG-OG 3.27Å; D796-S798 PolarHBondContact O-N 3.2Å; D796-S798 PolarHBondContact OD1-OG 3.38Å; D796-S798 WeakPolarHBondContact OD2-CA 3.36Å; D796-S798 WeakPolarHBondContact OD2-CB 3.31Å; D796-S798 PolarHBondContact OD2-N 3.35Å; D796-S798 PolarHBondContact OD2-OG 2.81Å; D796-Y799 PolarHBondContact O-N 2.57Å; D796-Y799 VanDerWaalsContact O-N 3.12Å; D796-Y799 VanDerWaalsContact OD1-CD2 3.27Å; D796-Y799 WeakPolarHBondContact OD1-CD2 3.44Å; D796-Y799 VanDerWaalsContact OD1-CE2 3.27Å; D796-Y799 WeakPolarHBondContact OD1-CE2 3.25Å
797	E	84.9	Confident	89.8	Confident	195 Å²	195	43.4 Å²	43.4	91%	0.911	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-9.7	-178.4	-60.8	-172.7	155.2	0	0	114.7	Y799	E797-Y799 PolarHBondContact O-N 3.43Å
798	S	88.5	Confident	90	Very high	29 Å²	29	43.1 Å²	43.1	20%	0.203	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	4.5	173.1	76.6	0	0	0	0	114.8	G759 D796 W1013	G759-S798 PolarHBondContact N-O 2.92Å; D796-S798 VanDerWaalsContact CG-OG 3.27Å; D796-S798 PolarHBondContact O-N 3.2Å; D796-S798 PolarHBondContact OD1-OG 3.38Å; D796-S798 WeakPolarHBondContact OD2-CA 3.36Å; D796-S798 WeakPolarHBondContact OD2-CB 3.31Å; D796-S798 PolarHBondContact OD2-N 3.35Å; D796-S798 PolarHBondContact OD2-OG 2.81Å; S798-W1013 PolarHBondContact O-NE1 2.89Å; S798-W1013 PolarHBondContact OG-NE1 3.1Å; S798-W1013 VanDerWaalsContact OG-NE1 3.15Å
799	Y	92.6	Very high	90.2	Very high	26 Å²	26	39.8 Å²	39.8	10%	0.102	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	152.6	174.5	-65.9	-96.3	0	0	0	111.9	P756 V757 P758 P795 D796 E797 G1011 W1013	P756-Y799 HydrophobicContact CB-CD1 3.64Å; P756-Y799 HydrophobicContact CB-CE1 4.31Å; P756-Y799 HydrophobicContact CB-CG 4.13Å; V757-Y799 WeakPolarHBondContact O-CA 3.23Å; P758-Y799 HydrophobicContact CB-CD1 4.43Å; P758-Y799 HydrophobicContact CB-CE1 4.31Å; P758-Y799 HydrophobicContact CG-CD1 4.17Å; P758-Y799 HydrophobicContact CG-CE1 3.83Å; P795-Y799 HydrophobicContact CB-CD2 4.31Å; P795-Y799 HydrophobicContact CB-CE2 4.3Å; P795-Y799 HydrophobicContact CG-CD2 4.18Å; P795-Y799 HydrophobicContact CG-CE2 4.2Å; D796-Y799 PolarHBondContact O-N 2.57Å; D796-Y799 VanDerWaalsContact O-N 3.12Å; D796-Y799 VanDerWaalsContact OD1-CD2 3.27Å; D796-Y799 WeakPolarHBondContact OD1-CD2 3.44Å; D796-Y799 VanDerWaalsContact OD1-CE2 3.27Å; D796-Y799 WeakPolarHBondContact OD1-CE2 3.25Å; E797-Y799 PolarHBondContact O-N 3.43Å; Y799-G1011 WeakPolarHBondContact CE1-O 3.35Å; Y799-W1013 AromaticContact CE2-CD1 3.64Å; Y799-W1013 AromaticContact CZ-CD1 3.52Å; Y799-W1013 PolarHBondContact OH-N 3.17Å; Y799-W1013 VanDerWaalsContact OH-N 3.08Å
800	G	92.9	Very high	90.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	-170.3	164.2	0	0	0	0	0	111.5	P756 V757 L760	P756-G800 CarbonylContact C-O 3.59Å; P756-G800 WeakPolarHBondContact CA-O 3Å; V757-G800 PolarHBondContact N-O 3.37Å; V757-G800 PolarHBondContact O-N 3.01Å; L760-G800 WeakPolarHBondContact O-CA 3.32Å; L760-G800 PolarHBondContact O-N 3.4Å
801	C	94.1	Very high	90.9	Very high	7 Å²	7	34 Å²	34	5%	0.047	20%	0.196	C	C	.	.			trans	-151.7	151.3	168.4	60.3	0	0	0	0	109.9	S803 S804	C801-S803 PolarHBondContact O-N 2.88Å; C801-S803 PolarHBondContact SG-OG 3.46Å; C801-S804 PolarHBondContact O-N 3.48Å; C801-S804 VanDerWaalsContact O-N 3.09Å; C801-S804 PolarHBondContact SG-OG 3.08Å; C801-S804 VanDerWaalsContact SG-OG 3.34Å
802	L	95.6	Very high	91.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-63.9	-26.8	-175.5	-77.7	68.5	0	0	0	112	T753 V757 L760 S804 N805 I806 W919 V928 Y1003	T753-L802 HydrophobicContact CG2-CB 4.33Å; T753-L802 HydrophobicContact CG2-CD2 4.18Å; T753-L802 PolarHBondContact O-N 3.35Å; V757-L802 HydrophobicContact CG2-CD1 3.94Å; L760-L802 HydrophobicContact CD2-CD1 3.81Å; L802-S804 PolarHBondContact O-N 3.11Å; L802-S804 VanDerWaalsContact O-N 3.14Å; L802-N805 CarbonylContact O-C 3.56Å; L802-N805 PolarHBondContact O-N 2.97Å; L802-I806 HydrophobicContact CB-CD1 4.11Å; L802-I806 HydrophobicContact CD2-CD1 4.13Å; L802-I806 HydrophobicContact CG-CD1 4.46Å; L802-I806 PolarHBondContact O-N 2.85Å; L802-W919 HydrophobicContact CG-CH2 4.25Å; L802-V928 HydrophobicContact CD2-CG1 3.77Å; L802-Y1003 WeakPolarHBondContact CD2-OH 3.32Å
803	S	95.2	Very high	92.2	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.021	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-62.6	-15.9	175.1	67.4	0	0	0	0	115.2	T753 I787 C801	T753-S803 PolarHBondContact O-N 3.45Å; I787-S803 WeakPolarHBondContact O-CB 3.43Å; I787-S803 PolarHBondContact O-OG 2.62Å; C801-S803 PolarHBondContact O-N 2.88Å; C801-S803 PolarHBondContact SG-OG 3.46Å
804	S	93.4	Very high	93.2	Very high	19 Å²	19	26 Å²	26	13%	0.133	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-88.4	-11.1	172.1	-54.7	0	0	0	0	113.6	Q762 C801 L802	Q762-S804 PolarHBondContact NE2-OG 3.02Å; C801-S804 PolarHBondContact O-N 3.48Å; C801-S804 VanDerWaalsContact O-N 3.09Å; C801-S804 PolarHBondContact SG-OG 3.08Å; C801-S804 VanDerWaalsContact SG-OG 3.34Å; L802-S804 PolarHBondContact O-N 3.11Å; L802-S804 VanDerWaalsContact O-N 3.14Å
805	N	95.3	Very high	94.2	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-21.2	-174.7	-67.9	43.9	0	0	0	112.3	Q761 L802 W919 R925	Q761-N805 PolarHBondContact O-ND2 3.36Å; L802-N805 CarbonylContact O-C 3.56Å; L802-N805 PolarHBondContact O-N 2.97Å; N805-W919 HydrophobicContact CB-CB 4.39Å; N805-W919 HydrophobicContact CB-CD2 3.62Å; N805-W919 HydrophobicContact CB-CE3 3.59Å; N805-W919 HydrophobicContact CB-CG 3.98Å; N805-W919 HydrophobicContact CB-CZ3 4.14Å; N805-W919 PolarHBondContact ND2-NE1 3.36Å; N805-R925 WeakPolarHBondContact O-CD 3.28Å
806	I	97.1	Very high	95.2	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.099	C	C	.	.	S	Bend	trans	-110.6	123.4	177.7	-53	179.6	0	0	0	110	Y786 L802 E810 L811 W919 V928	Y786-I806 WeakPolarHBondContact CD1-O 3.26Å; L802-I806 HydrophobicContact CB-CD1 4.11Å; L802-I806 HydrophobicContact CD2-CD1 4.13Å; L802-I806 HydrophobicContact CG-CD1 4.46Å; L802-I806 PolarHBondContact O-N 2.85Å; I806-E810 HydrophobicContact CG2-CB 3.66Å; I806-L811 HydrophobicContact CB-CD1 4.21Å; I806-L811 HydrophobicContact CB-CD2 4.11Å; I806-L811 HydrophobicContact CB-CG 4Å; I806-L811 HydrophobicContact CD1-CD2 4.21Å; I806-L811 HydrophobicContact CG2-CD2 3.86Å; I806-L811 HydrophobicContact CG2-CG 3.77Å; I806-W919 HydrophobicContact CD1-CZ3 4.04Å; I806-W919 HydrophobicContact CG1-CE3 4.16Å; I806-W919 HydrophobicContact CG1-CZ3 3.8Å; I806-V928 HydrophobicContact CD1-CG1 4.06Å
807	P	96.9	Very high	95.9	Very high	9 Å²	9	15.4 Å²	15.4	6%	0.058	8%	0.079	C	C	.	.			trans	-53.5	149.2	178.1	-29.9	36	0	0	0	115	I784 Y786 L809 E810 L811	I784-P807 HydrophobicContact CG2-CB 3.74Å; I784-P807 HydrophobicContact CG2-CG 3.84Å; Y786-P807 HydrophobicContact CE1-CG 4.15Å; P807-L809 PolarHBondContact O-N 2.8Å; P807-L809 VanDerWaalsContact O-N 3.14Å; P807-E810 WeakPolarHBondContact CD-OE2 3.47Å; P807-E810 PolarHBondContact O-N 2.99Å; P807-L811 PolarHBondContact O-N 3.17Å; P807-L811 VanDerWaalsContact O-N 3.07Å
808	A	97.8	Very high	96.5	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-56	-33.5	179.3	0	0	0	0	0	113.5	L709 I712 F713 A785 I787 E810 M812	L709-A808 HydrophobicContact CD2-CB 4.26Å; I712-A808 HydrophobicContact CD1-CB 4.34Å; I712-A808 HydrophobicContact CG2-CB 4.47Å; F713-A808 HydrophobicContact CE2-CB 3.94Å; F713-A808 HydrophobicContact CZ-CB 3.99Å; A785-A808 HydrophobicContact CB-CB 4.14Å; A785-A808 WeakPolarHBondContact O-CB 3.36Å; A785-A808 PolarHBondContact O-N 3.28Å; I787-A808 HydrophobicContact CG2-CB 3.6Å; A808-E810 VanDerWaalsContact C-N 3.33Å; A808-M812 WeakPolarHBondContact O-CB 3.27Å; A808-M812 PolarHBondContact O-N 2.87Å
809	L	98.1	Very high	97	Very high	21 Å²	21	4.8 Å²	4.8	11%	0.11	3%	0.026	C	C	.	.	H	α-helix	trans	-69.9	-31.1	177.9	-173.1	62.5	0	0	0	112.4	F713 P807 M812 A813 L874 E878 F882	F713-L809 HydrophobicContact CE1-CB 4.41Å; F713-L809 HydrophobicContact CE1-CD1 4.13Å; F713-L809 HydrophobicContact CZ-CB 3.87Å; F713-L809 HydrophobicContact CZ-CD1 4.09Å; P807-L809 PolarHBondContact O-N 2.8Å; P807-L809 VanDerWaalsContact O-N 3.14Å; L809-M812 HydrophobicContact CD1-CE 3.8Å; L809-A813 WeakPolarHBondContact O-CB 3.22Å; L809-A813 PolarHBondContact O-N 2.97Å; L809-L874 HydrophobicContact CD1-CD1 4.2Å; L809-L874 HydrophobicContact CD1-CD2 4.48Å; L809-E878 HydrophobicContact CD2-CB 4.26Å; L809-E878 HydrophobicContact CD2-CG 4.44Å; L809-F882 HydrophobicContact CD1-CB 4.07Å; L809-F882 HydrophobicContact CD1-CD2 4.11Å
810	E	98.6	Very high	97.3	Very high	8 Å²	8	3.6 Å²	3.6	4%	0.037	2%	0.022	C	C	.	.	H	α-helix	trans	-80	-40.1	179	-75.9	166.7	-157.5	0	0	110.9	I806 P807 A808 A813 L814 R881 L885 R925	I806-E810 HydrophobicContact CG2-CB 3.66Å; P807-E810 WeakPolarHBondContact CD-OE2 3.47Å; P807-E810 PolarHBondContact O-N 2.99Å; A808-E810 VanDerWaalsContact C-N 3.33Å; E810-A813 WeakPolarHBondContact O-CB 3.18Å; E810-A813 PolarHBondContact O-N 3.41Å; E810-L814 PolarHBondContact O-N 2.97Å; E810-R881 IonicContact OE1-CZ 3.23Å; E810-R881 IonicContact OE1-NE 2.77Å; E810-R881 PolarHBondContact OE1-NE 3.39Å; E810-R881 IonicContact OE1-NH2 2.79Å; E810-R881 PolarHBondContact OE1-NH2 2.92Å; E810-L885 HydrophobicContact CB-CD1 4.37Å; E810-L885 HydrophobicContact CG-CD1 3.54Å; E810-L885 HydrophobicContact CG-CD2 4.28Å; E810-R925 IonicContact OE1-CZ 3.5Å; E810-R925 IonicContact OE1-NE 2.82Å; E810-R925 IonicContact OE1-NH2 3.21Å; E810-R925 PolarHBondContact OE1-NH2 2.62Å; E810-R925 IonicContact OE2-CZ 2.68Å; E810-R925 IonicContact OE2-NE 2.67Å; E810-R925 PolarHBondContact OE2-NE 3.04Å; E810-R925 IonicContact OE2-NH2 3.87Å; E810-R925 PolarHBondContact OE2-NH2 3.4Å
811	L	98.6	Very high	97.6	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-71	-36.4	172.5	-66.8	-179.4	0	0	0	113	T753 I787 I806 P807 A813 L814 Y815	T753-L811 HydrophobicContact CG2-CD2 3.76Å; I787-L811 HydrophobicContact CD1-CB 3.98Å; I787-L811 HydrophobicContact CD1-CD1 3.62Å; I787-L811 HydrophobicContact CD1-CG 4.45Å; I787-L811 HydrophobicContact CG1-CD1 3.98Å; I806-L811 HydrophobicContact CB-CD1 4.21Å; I806-L811 HydrophobicContact CB-CD2 4.11Å; I806-L811 HydrophobicContact CB-CG 4Å; I806-L811 HydrophobicContact CD1-CD2 4.21Å; I806-L811 HydrophobicContact CG2-CD2 3.86Å; I806-L811 HydrophobicContact CG2-CG 3.77Å; P807-L811 PolarHBondContact O-N 3.17Å; P807-L811 VanDerWaalsContact O-N 3.07Å; L811-A813 VanDerWaalsContact C-N 3.27Å; L811-A813 PolarHBondContact O-N 3.01Å; L811-L814 HydrophobicContact CD2-CD2 4Å; L811-L814 WeakPolarHBondContact O-CB 3.39Å; L811-L814 PolarHBondContact O-N 3.37Å; L811-Y815 HydrophobicContact CB-CE2 4.35Å; L811-Y815 WeakPolarHBondContact O-CD1 3.43Å; L811-Y815 WeakPolarHBondContact O-CD2 3.17Å; L811-Y815 PolarHBondContact O-N 3.3Å
812	M	98.8	Very high	97.8	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-60.4	-39.2	170.3	-170.1	174.7	60.6	0	0	111.4	F704 L709 F713 I715 A808 L809 V816 L871 L874 F882	F704-M812 HydrophobicContact CE1-CG 3.73Å; F704-M812 HydrophobicContact CE1-SD 3.92Å; F704-M812 HydrophobicContact CZ-CG 3.72Å; L709-M812 HydrophobicContact CD1-CB 4.04Å; L709-M812 HydrophobicContact CD1-CG 4.12Å; L709-M812 HydrophobicContact CD2-CB 3.88Å; L709-M812 HydrophobicContact CD2-CG 4.3Å; L709-M812 HydrophobicContact CD2-SD 4.39Å; F713-M812 HydrophobicContact CD1-CE 4.47Å; F713-M812 HydrophobicContact CD2-CE 3.57Å; F713-M812 HydrophobicContact CD2-SD 3.47Å; F713-M812 WeakPolarHBondContact CD2-SD 3.4Å; F713-M812 HydrophobicContact CE2-CB 4.42Å; F713-M812 HydrophobicContact CE2-CE 3.77Å; F713-M812 HydrophobicContact CE2-SD 3.94Å; F713-M812 HydrophobicContact CG-CE 3.95Å; F713-M812 HydrophobicContact CG-SD 4.2Å; F713-M812 HydrophobicContact CZ-CE 4.31Å; I715-M812 HydrophobicContact CD1-SD 3.8Å; A808-M812 WeakPolarHBondContact O-CB 3.27Å; A808-M812 PolarHBondContact O-N 2.87Å; L809-M812 HydrophobicContact CD1-CE 3.8Å; M812-V816 HydrophobicContact CG-CG2 4.45Å; M812-V816 WeakPolarHBondContact O-CB 3.34Å; M812-V816 VanDerWaalsContact O-CG2 3.27Å; M812-V816 WeakPolarHBondContact O-CG2 3.4Å; M812-V816 PolarHBondContact O-N 2.98Å; M812-L871 HydrophobicContact CE-CD2 3.96Å; M812-L871 HydrophobicContact SD-CD2 4.33Å; M812-L874 HydrophobicContact CE-CD1 4.37Å; M812-F882 HydrophobicContact CB-CE2 4.28Å; M812-F882 HydrophobicContact CE-CD2 3.82Å; M812-F882 HydrophobicContact CE-CE2 3.8Å; M812-F882 HydrophobicContact CG-CE2 3.91Å
813	A	98.9	Very high	98	Very high	1 Å²	1	5.2 Å²	5.2	1%	0.008	3%	0.028	C	C	.	.	H	α-helix	trans	-65.6	-39.6	175	0	0	0	0	0	112	L809 E810 L811 A817 F882 L885 V886	L809-A813 WeakPolarHBondContact O-CB 3.22Å; L809-A813 PolarHBondContact O-N 2.97Å; E810-A813 WeakPolarHBondContact O-CB 3.18Å; E810-A813 PolarHBondContact O-N 3.41Å; L811-A813 VanDerWaalsContact C-N 3.27Å; L811-A813 PolarHBondContact O-N 3.01Å; A813-A817 WeakPolarHBondContact O-CB 3.45Å; A813-A817 PolarHBondContact O-N 3.38Å; A813-F882 HydrophobicContact CB-CD2 3.84Å; A813-F882 HydrophobicContact CB-CE2 3.95Å; A813-L885 HydrophobicContact CB-CB 3.54Å; A813-L885 HydrophobicContact CB-CD1 4.2Å; A813-V886 HydrophobicContact CB-CG2 3.9Å
814	L	98.9	Very high	98.1	Very high	2 Å²	2	6.9 Å²	6.9	1%	0.01	4%	0.037	C	C	.	.	H	α-helix	trans	-62	-46.3	175.2	-176.8	62.5	0	0	0	112.3	V749 T753 E810 L811 A817 A818 C929 I933	V749-L814 HydrophobicContact CB-CD2 4.18Å; V749-L814 HydrophobicContact CB-CG 4.09Å; V749-L814 HydrophobicContact CG1-CD1 4.24Å; V749-L814 HydrophobicContact CG1-CG 4.23Å; V749-L814 HydrophobicContact CG2-CG 4.41Å; T753-L814 HydrophobicContact CG2-CD2 3.95Å; E810-L814 PolarHBondContact O-N 2.97Å; L811-L814 HydrophobicContact CD2-CD2 4Å; L811-L814 WeakPolarHBondContact O-CB 3.39Å; L811-L814 PolarHBondContact O-N 3.37Å; L814-A817 PolarHBondContact O-N 3.29Å; L814-A818 PolarHBondContact O-N 2.94Å; L814-C929 HydrophobicContact CD1-CB 4.26Å; L814-C929 WeakPolarHBondContact CD1-O 3.45Å; L814-I933 HydrophobicContact CD1-CB 3.78Å; L814-I933 HydrophobicContact CD1-CG2 4.32Å
815	Y	98.9	Very high	98.4	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-68.4	-41.8	179.8	-54.8	-20.1	0	0	0	112	F704 T707 L709 V749 W750 T753 I787 L811 A817 A818 A819	F704-Y815 HydrophobicContact CE2-CD2 4.42Å; T707-Y815 HydrophobicContact CG2-CE2 4.12Å; L709-Y815 HydrophobicContact CD1-CD2 3.74Å; L709-Y815 HydrophobicContact CD1-CE2 3.96Å; V749-Y815 HydrophobicContact CB-CD1 4.47Å; V749-Y815 HydrophobicContact CG2-CD1 3.75Å; V749-Y815 HydrophobicContact CG2-CE1 4.33Å; W750-Y815 HydrophobicContact CB-CE1 4.15Å; T753-Y815 PolarHBondContact OG1-OH 2.76Å; I787-Y815 HydrophobicContact CD1-CE2 3.92Å; I787-Y815 VanDerWaalsContact CD1-OH 3.31Å; I787-Y815 WeakPolarHBondContact CD1-OH 3.46Å; L811-Y815 HydrophobicContact CB-CE2 4.35Å; L811-Y815 WeakPolarHBondContact O-CD1 3.43Å; L811-Y815 WeakPolarHBondContact O-CD2 3.17Å; L811-Y815 PolarHBondContact O-N 3.3Å; Y815-A817 VanDerWaalsContact C-N 3.34Å; Y815-A818 PolarHBondContact O-N 2.81Å; Y815-A819 PolarHBondContact O-N 2.43Å
816	V	98.9	Very high	98.5	Very high	2 Å²	2	7.3 Å²	7.3	1%	0.012	4%	0.038	C	C	.	.	H	α-helix	trans	-68.7	-34.1	176.4	174.5	0	0	0	0	111.5	M700 F704 F724 M812 A819 M820 F870 F882 V886	M700-V816 HydrophobicContact CE-CG2 3.91Å; F704-V816 HydrophobicContact CZ-CG2 3.78Å; F724-V816 HydrophobicContact CZ-CG1 4.31Å; F724-V816 HydrophobicContact CZ-CG2 4.13Å; M812-V816 HydrophobicContact CG-CG2 4.45Å; M812-V816 WeakPolarHBondContact O-CB 3.34Å; M812-V816 VanDerWaalsContact O-CG2 3.27Å; M812-V816 WeakPolarHBondContact O-CG2 3.4Å; M812-V816 PolarHBondContact O-N 2.98Å; V816-A819 PolarHBondContact O-N 3.46Å; V816-M820 HydrophobicContact CG1-CE 3.46Å; V816-M820 VanDerWaalsContact CG1-CE 3.46Å; V816-M820 WeakPolarHBondContact O-CG 3.15Å; V816-M820 PolarHBondContact O-N 3.23Å; V816-F870 HydrophobicContact CG2-CZ 4.36Å; V816-F882 HydrophobicContact CB-CE2 4.46Å; V816-F882 HydrophobicContact CB-CZ 3.84Å; V816-F882 HydrophobicContact CG1-CE1 4.46Å; V816-F882 HydrophobicContact CG1-CZ 3.87Å; V816-F882 HydrophobicContact CG2-CE2 4.43Å; V816-F882 HydrophobicContact CG2-CZ 3.94Å; V816-V886 HydrophobicContact CG1-CG2 4.45Å
817	A	98.9	Very high	98.6	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-62.4	-49.5	170.9	0	0	0	0	0	111.7	A813 L814 Y815 A819 M820 H821 V886 A889 I890 I933	A813-A817 WeakPolarHBondContact O-CB 3.45Å; A813-A817 PolarHBondContact O-N 3.38Å; L814-A817 PolarHBondContact O-N 3.29Å; Y815-A817 VanDerWaalsContact C-N 3.34Å; A817-A819 VanDerWaalsContact C-N 3.27Å; A817-A819 PolarHBondContact O-N 3.05Å; A817-M820 CarbonylContact O-C 3.58Å; A817-M820 PolarHBondContact O-N 2.74Å; A817-H821 WeakPolarHBondContact O-CB 3.32Å; A817-H821 PolarHBondContact O-N 3.49Å; A817-V886 HydrophobicContact CB-CG1 4.3Å; A817-A889 HydrophobicContact CB-CB 3.61Å; A817-I890 HydrophobicContact CB-CG1 3.99Å; A817-I933 HydrophobicContact CB-CD1 4.19Å
818	A	98.9	Very high	98.6	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-56.3	-40.5	176.7	0	0	0	0	0	112.3	V745 L746 V749 L814 Y815 M820 H821 I933	V745-A818 HydrophobicContact CG1-CB 4.07Å; L746-A818 HydrophobicContact CB-CB 4.27Å; V749-A818 HydrophobicContact CG1-CB 4.5Å; V749-A818 HydrophobicContact CG2-CB 3.72Å; L814-A818 PolarHBondContact O-N 2.94Å; Y815-A818 PolarHBondContact O-N 2.81Å; A818-M820 PolarHBondContact O-N 2.84Å; A818-H821 PolarHBondContact O-ND1 3.5Å; A818-I933 HydrophobicContact CB-CD1 4.29Å
819	A	98.8	Very high	98.7	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.2	176.3	0	0	0	0	0	115.2	L696 M700 F724 L727 Y731 Y815 V816 A817	L696-A819 HydrophobicContact CD1-CB 4.1Å; L696-A819 HydrophobicContact CD2-CB 4.49Å; M700-A819 HydrophobicContact CE-CB 3.95Å; M700-A819 HydrophobicContact CG-CB 4.05Å; M700-A819 HydrophobicContact SD-CB 3.79Å; F724-A819 HydrophobicContact CD1-CB 4.48Å; F724-A819 HydrophobicContact CE1-CB 4.13Å; L727-A819 HydrophobicContact CD2-CB 4.41Å; L727-A819 WeakPolarHBondContact CD2-O 3.29Å; Y731-A819 PolarHBondContact OH-O 2.91Å; Y815-A819 PolarHBondContact O-N 2.43Å; V816-A819 PolarHBondContact O-N 3.46Å; A817-A819 VanDerWaalsContact C-N 3.27Å; A817-A819 PolarHBondContact O-N 3.05Å
820	M	98.6	Very high	98.7	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.005	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132	2.3	-177.3	75.1	179.7	51.8	0	0	115.7	Y723 L727 Y731 V816 A817 A818 D822 Y823 A858 V886 I890	Y723-M820 HydrophobicContact CE1-CE 4.17Å; Y723-M820 VanDerWaalsContact OH-CE 3.25Å; Y723-M820 WeakPolarHBondContact OH-CE 3.45Å; L727-M820 HydrophobicContact CD1-CB 4.01Å; L727-M820 HydrophobicContact CD2-CB 4.02Å; Y731-M820 WeakPolarHBondContact OH-CA 3.44Å; V816-M820 HydrophobicContact CG1-CE 3.46Å; V816-M820 VanDerWaalsContact CG1-CE 3.46Å; V816-M820 WeakPolarHBondContact O-CG 3.15Å; V816-M820 PolarHBondContact O-N 3.23Å; A817-M820 CarbonylContact O-C 3.58Å; A817-M820 PolarHBondContact O-N 2.74Å; A818-M820 PolarHBondContact O-N 2.84Å; M820-D822 PolarHBondContact O-N 3.41Å; M820-D822 VanDerWaalsContact O-N 3.09Å; M820-Y823 WeakPolarHBondContact O-CB 3.39Å; M820-Y823 PolarHBondContact O-N 3.39Å; M820-Y823 VanDerWaalsContact O-N 3.09Å; M820-A858 HydrophobicContact CB-CB 3.8Å; M820-A858 HydrophobicContact CE-CB 4.14Å; M820-A858 HydrophobicContact CG-CB 4.07Å; M820-A858 HydrophobicContact SD-CB 3.57Å; M820-A858 VanDerWaalsContact SD-CB 3.57Å; M820-V886 HydrophobicContact SD-CG1 3.72Å; M820-I890 HydrophobicContact CG-CD1 3.56Å; M820-I890 HydrophobicContact CG-CG1 4.46Å; M820-I890 HydrophobicContact SD-CD1 3.83Å
821	H	98.8	Very high	98.6	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-25.8	-168	71.7	-78.5	0	0	0	114.4	H741 A817 A818 H854 I890 T893	H741-H821 AromaticContact CD2-NE2 3.84Å; A817-H821 WeakPolarHBondContact O-CB 3.32Å; A817-H821 PolarHBondContact O-N 3.49Å; A818-H821 PolarHBondContact O-ND1 3.5Å; H821-H854 WeakPolarHBondContact O-CB 3.46Å; H821-H854 PolarHBondContact O-CD2 3.43Å; H821-I890 HydrophobicContact CB-CG1 4.28Å; H821-I890 HydrophobicContact CB-CG2 4.4Å; H821-T893 HydrophobicContact CB-CG2 4.29Å
822	D	98.8	Very high	98.6	Very high	12 Å²	12	12.9 Å²	12.9	6%	0.064	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117	18.4	-179.6	-87.5	-6.3	0	0	0	113.3	Y731 H737 H741 M820 D824 H825 H854	Y731-D822 HydrophobicContact CE1-CB 3.68Å; Y731-D822 WeakPolarHBondContact CE1-O 3.37Å; Y731-D822 PolarHBondContact OH-N 2.91Å; H737-D822 IonicContact CD2-OD2 3.77Å; H737-D822 PolarHBondContact CD2-OD2 2.95Å; H737-D822 IonicContact CG-OD2 2.84Å; H741-D822 IonicContact CD2-OD2 2.78Å; H741-D822 PolarHBondContact CD2-OD2 2.97Å; H741-D822 VanDerWaalsContact CD2-OD2 3.25Å; M820-D822 PolarHBondContact O-N 3.41Å; M820-D822 VanDerWaalsContact O-N 3.09Å; D822-D824 PolarHBondContact O-N 3.33Å; D822-H825 HydrophobicContact CB-CB 4.35Å; D822-H825 WeakPolarHBondContact O-CB 3.41Å; D822-H825 PolarHBondContact O-N 3.35Å; D822-H854 IonicContact OD1-CD2 3.65Å
823	Y	98.8	Very high	98.6	Very high	30 Å²	30	13.3 Å²	13.3	12%	0.118	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	122.3	-175.3	174.7	-91.4	0	0	0	112.2	L727 Y731 M820 H854 A858 L861	L727-Y823 HydrophobicContact CD1-CD2 3.4Å; L727-Y823 HydrophobicContact CD1-CE2 3.8Å; L727-Y823 HydrophobicContact CD1-CG 4Å; L727-Y823 HydrophobicContact CG-CD2 3.91Å; L727-Y823 HydrophobicContact CG-CE2 4.34Å; L727-Y823 WeakPolarHBondContact O-CD2 3.37Å; L727-Y823 VanDerWaalsContact O-CE2 3.29Å; L727-Y823 WeakPolarHBondContact O-CE2 3.31Å; Y731-Y823 HydrophobicContact CD2-CD2 4.41Å; Y731-Y823 HydrophobicContact CE2-CD2 4.4Å; Y731-Y823 PolarHBondContact OH-N 3.19Å; M820-Y823 WeakPolarHBondContact O-CB 3.39Å; M820-Y823 PolarHBondContact O-N 3.39Å; M820-Y823 VanDerWaalsContact O-N 3.09Å; Y823-H854 PolarHBondContact O-ND1 3.13Å; Y823-A858 HydrophobicContact CD1-CB 4.21Å; Y823-A858 HydrophobicContact CG-CB 4.19Å; Y823-L861 HydrophobicContact CE2-CD2 4.1Å
824	D	98.6	Very high	98.6	Very high	38 Å²	38	15.5 Å²	15.5	20%	0.203	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	33.9	-171.6	-169.3	48	0	0	0	114.8	G730 R732 D822 H853	G730-D824 VanDerWaalsContact O-CA 3.3Å; G730-D824 WeakPolarHBondContact O-CA 3.4Å; G730-D824 PolarHBondContact O-N 3.36Å; R732-D824 IonicContact CZ-OD1 3.2Å; R732-D824 IonicContact NE-OD1 3.25Å; R732-D824 PolarHBondContact NE-OD1 3.46Å; R732-D824 IonicContact NH2-OD1 3.74Å; R732-D824 PolarHBondContact NH2-OD1 2.67Å; R732-D824 IonicContact NH2-OD2 3.96Å; R732-D824 PolarHBondContact NH2-OD2 3.05Å; R732-D824 VanDerWaalsContact NH2-OD2 3.16Å; D822-D824 PolarHBondContact O-N 3.33Å; D824-H853 IonicContact OD2-CD2 2.67Å; D824-H853 IonicContact OD2-CE1 2.75Å; D824-H853 IonicContact OD2-NE2 3.82Å; D824-H853 PolarHBondContact OD2-NE2 3.5Å
825	H	98.7	Very high	98.5	Very high	5 Å²	5	18.5 Å²	18.5	2%	0.023	11%	0.113	C	C	.	.			trans	-56.7	131.2	171.6	-167.7	-96.6	0	0	0	112.3	R732 I734 H737 D822 G827 H854 E958	R732-H825 VanDerWaalsContact CD-O 3.23Å; R732-H825 WeakPolarHBondContact CD-O 3.31Å; I734-H825 HydrophobicContact CD1-CB 4.3Å; I734-H825 WeakPolarHBondContact CD1-O 3.36Å; H737-H825 HydrophobicContact CB-CB 3.74Å; H737-H825 VanDerWaalsContact CB-CG 3.5Å; H737-H825 VanDerWaalsContact CB-ND1 3.3Å; H737-H825 WeakPolarHBondContact CB-ND1 3.21Å; H737-H825 AromaticContact CE1-CE1 3.56Å; H737-H825 AromaticContact CG-CE1 3.56Å; H737-H825 AromaticContact CG-CG 3.83Å; H737-H825 AromaticContact CG-ND1 3.4Å; H737-H825 AromaticContact ND1-CE1 3.22Å; H737-H825 PolarHBondContact ND1-CE1 3.29Å; H737-H825 AromaticContact ND1-ND1 3.37Å; H737-H825 PolarHBondContact ND1-ND1 3.5Å; D822-H825 HydrophobicContact CB-CB 4.35Å; D822-H825 WeakPolarHBondContact O-CB 3.41Å; D822-H825 PolarHBondContact O-N 3.35Å; H825-G827 PolarHBondContact ND1-N 2.85Å; H825-G827 PolarHBondContact O-N 2.89Å; H825-H854 AromaticContact CD2-CE1 3.95Å; H825-H854 AromaticContact CD2-NE2 3.7Å; H825-E958 IonicContact CE1-OE1 3.51Å; H825-E958 PolarHBondContact CE1-OE1 3.42Å; H825-E958 IonicContact ND1-OE1 2.7Å
826	P	98.3	Very high	98.4	Very high	23 Å²	23	20.8 Å²	20.8	15%	0.149	13%	0.128	C	C	.	.			trans	-87.6	1.9	-170	35.3	-37	0	0	0	115.1	R828 L850	P826-R828 HydrophobicContact CG-CB 4.23Å; P826-L850 HydrophobicContact CG-CD2 3.69Å
827	G	98.1	Very high	98.4	Very high	2 Å²	2	26.3 Å²	26.3	2%	0.021	16%	0.157	C	C	.	.	S	Bend	trans	81.8	14.1	-171.9	0	0	0	0	0	113.8	H825 E958	H825-G827 PolarHBondContact ND1-N 2.85Å; H825-G827 PolarHBondContact O-N 2.89Å; G827-E958 WeakPolarHBondContact CA-OE1 3.43Å
828	R	98.4	Very high	98.3	Very high	33 Å²	33	27 Å²	27	13%	0.125	16%	0.162	C	C	.	.	S	Bend	trans	-146.8	136.3	-165.1	-58.5	-65.9	177	-99.7	0.9	111.8	P826 F832 E961 E965	P826-R828 HydrophobicContact CG-CB 4.23Å; R828-F832 HydrophobicContact CB-CD1 3.71Å; R828-F832 HydrophobicContact CB-CE1 4.25Å; R828-F832 HydrophobicContact CB-CG 4.31Å; R828-F832 HydrophobicContact CG-CD1 3.92Å; R828-F832 HydrophobicContact CG-CE1 3.95Å; R828-E961 PolarHBondContact NH2-O 3.29Å; R828-E961 VanDerWaalsContact NH2-O 3.16Å; R828-E965 IonicContact CZ-OE2 2.62Å; R828-E965 VanDerWaalsContact CZ-OE2 3.23Å; R828-E965 IonicContact NE-OE2 2.74Å; R828-E965 PolarHBondContact NE-OE2 3.14Å; R828-E965 IonicContact NH2-OE2 3.5Å; R828-E965 PolarHBondContact NH2-OE2 2.89Å
829	T	98.4	Very high	98.3	Very high	40 Å²	40	32.1 Å²	32.1	25%	0.245	20%	0.196	C	C	.	.			trans	-67.5	155.9	-176.7	58.9	0	0	0	0	114.6	A831 F832 L833 Q962 M977	T829-A831 PolarHBondContact O-N 3.48Å; T829-A831 VanDerWaalsContact O-N 3.13Å; T829-F832 WeakPolarHBondContact O-CB 3.13Å; T829-F832 PolarHBondContact O-N 3.17Å; T829-F832 PolarHBondContact OG1-N 2.96Å; T829-L833 PolarHBondContact O-N 3.25Å; T829-L833 VanDerWaalsContact O-N 3.12Å; T829-Q962 PolarHBondContact OG1-NE2 3.32Å; T829-Q962 PolarHBondContact OG1-OE1 3.34Å; T829-M977 HydrophobicContact CG2-CE 4.03Å
830	N	98.1	Very high	98.2	Very high	28 Å²	28	33.9 Å²	33.9	15%	0.15	20%	0.204	C	C	.	.	H	α-helix	trans	-48.2	-37.3	167.9	-95	-35.9	0	0	0	113	V834 V849 L850 E851	N830-V834 WeakPolarHBondContact O-CG2 3.4Å; N830-V834 PolarHBondContact O-N 3.25Å; N830-V849 WeakPolarHBondContact OD1-CA 3.19Å; N830-V849 VanDerWaalsContact OD1-CB 3.26Å; N830-V849 WeakPolarHBondContact OD1-CB 3.34Å; N830-V849 PolarHBondContact OD1-N 3.09Å; N830-L850 HydrophobicContact CB-CD1 4.32Å; N830-L850 PolarHBondContact OD1-N 3.34Å; N830-E851 PolarHBondContact ND2-OE1 3.02Å; N830-E851 PolarHBondContact ND2-OE2 2.79Å
831	A	97.6	Very high	98.2	Very high	43 Å²	43	33.9 Å²	33.9	36%	0.355	20%	0.204	S	C	.	.	H	α-helix	trans	-67.3	-44.5	178.8	0	0	0	0	0	112.2	T829 V834 A835	T829-A831 PolarHBondContact O-N 3.48Å; T829-A831 VanDerWaalsContact O-N 3.13Å; A831-V834 PolarHBondContact O-N 3.33Å; A831-A835 WeakPolarHBondContact O-CB 3.41Å; A831-A835 PolarHBondContact O-N 3.07Å
832	F	98.4	Very high	98.2	Very high	10 Å²	10	38.4 Å²	38.4	4%	0.044	23%	0.232	C	C	.	.	H	α-helix	trans	-61.1	-45.6	175.9	178.8	-91.5	0	0	0	112.1	R828 T829 V834 A835 T836 Q962 E965 E966 L969	R828-F832 HydrophobicContact CB-CD1 3.71Å; R828-F832 HydrophobicContact CB-CE1 4.25Å; R828-F832 HydrophobicContact CB-CG 4.31Å; R828-F832 HydrophobicContact CG-CD1 3.92Å; R828-F832 HydrophobicContact CG-CE1 3.95Å; T829-F832 WeakPolarHBondContact O-CB 3.13Å; T829-F832 PolarHBondContact O-N 3.17Å; T829-F832 PolarHBondContact OG1-N 2.96Å; F832-V834 VanDerWaalsContact C-N 3.31Å; F832-V834 PolarHBondContact O-N 2.75Å; F832-A835 PolarHBondContact O-N 2.76Å; F832-T836 HydrophobicContact CD1-CG2 4.2Å; F832-T836 HydrophobicContact CD2-CG2 4.23Å; F832-T836 HydrophobicContact CE1-CG2 3.85Å; F832-T836 HydrophobicContact CE2-CG2 3.89Å; F832-T836 HydrophobicContact CG-CG2 4.38Å; F832-T836 HydrophobicContact CZ-CG2 3.68Å; F832-T836 WeakPolarHBondContact O-CB 3.27Å; F832-T836 WeakPolarHBondContact O-CG2 3.35Å; F832-T836 PolarHBondContact O-N 2.98Å; F832-T836 PolarHBondContact O-OG1 3.22Å; F832-Q962 HydrophobicContact CB-CG 4.37Å; F832-Q962 HydrophobicContact CD2-CG 3.75Å; F832-Q962 HydrophobicContact CE2-CG 4.29Å; F832-Q962 HydrophobicContact CG-CG 4.15Å; F832-E965 HydrophobicContact CE2-CB 4.49Å; F832-E965 HydrophobicContact CE2-CG 4.42Å; F832-E965 HydrophobicContact CZ-CB 4.37Å; F832-E965 HydrophobicContact CZ-CG 3.92Å; F832-E966 HydrophobicContact CD2-CG 3.66Å; F832-E966 HydrophobicContact CE2-CG 3.69Å; F832-L969 HydrophobicContact CE2-CD1 4.19Å; F832-L969 HydrophobicContact CZ-CD1 3.96Å
833	L	98.4	Very high	98.2	Very high	9 Å²	9	43 Å²	43	5%	0.047	26%	0.256	C	S	.	.	H	α-helix	trans	-61.3	-38.5	178.8	-63.7	-179	0	0	0	112.3	T829 T836 N837 A838 A841 V849 L850	T829-L833 PolarHBondContact O-N 3.25Å; T829-L833 VanDerWaalsContact O-N 3.12Å; L833-T836 PolarHBondContact O-OG1 3.14Å; L833-N837 PolarHBondContact O-N 3.3Å; L833-A838 HydrophobicContact CB-CB 4.06Å; L833-A838 HydrophobicContact CD2-CB 3.73Å; L833-A838 HydrophobicContact CG-CB 4.49Å; L833-A838 WeakPolarHBondContact O-CB 3.39Å; L833-A838 PolarHBondContact O-N 2.75Å; L833-A841 HydrophobicContact CB-CB 4.23Å; L833-A841 WeakPolarHBondContact O-CB 3.34Å; L833-V849 HydrophobicContact CD1-CG1 3.96Å; L833-L850 HydrophobicContact CD1-CD2 3.65Å; L833-L850 HydrophobicContact CD1-CG 3.97Å
834	V	98.3	Very high	98.1	Very high	48 Å²	48	43.9 Å²	43.9	29%	0.291	26%	0.259	S	S	.	.	H	α-helix	trans	-71.7	-43.8	175.8	172.1	0	0	0	0	111.4	N830 A831 F832 N837 A841 D846 V849	N830-V834 WeakPolarHBondContact O-CG2 3.4Å; N830-V834 PolarHBondContact O-N 3.25Å; A831-V834 PolarHBondContact O-N 3.33Å; F832-V834 VanDerWaalsContact C-N 3.31Å; F832-V834 PolarHBondContact O-N 2.75Å; V834-N837 PolarHBondContact O-N 3.45Å; V834-N837 PolarHBondContact O-ND2 2.82Å; V834-A841 HydrophobicContact CG2-CB 4.06Å; V834-D846 HydrophobicContact CG1-CB 4.31Å; V834-D846 HydrophobicContact CG2-CB 3.95Å; V834-V849 HydrophobicContact CG2-CG2 4.34Å
835	A	97.6	Very high	98.1	Very high	64 Å²	64	47.6 Å²	47.6	53%	0.529	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-45.8	179	0	0	0	0	0	112.3	A831 F832 N837	A831-A835 WeakPolarHBondContact O-CB 3.41Å; A831-A835 PolarHBondContact O-N 3.07Å; F832-A835 PolarHBondContact O-N 2.76Å; A835-N837 PolarHBondContact O-N 3.32Å; A835-N837 PolarHBondContact O-ND2 3.33Å; A835-N837 VanDerWaalsContact O-ND2 3.12Å
836	T	97.8	Very high	98.1	Very high	49 Å²	49	50.6 Å²	50.6	30%	0.301	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-8.4	177.2	56	0	0	0	0	113.9	F832 L833 A838 L969 L971	F832-T836 HydrophobicContact CD1-CG2 4.2Å; F832-T836 HydrophobicContact CD2-CG2 4.23Å; F832-T836 HydrophobicContact CE1-CG2 3.85Å; F832-T836 HydrophobicContact CE2-CG2 3.89Å; F832-T836 HydrophobicContact CG-CG2 4.38Å; F832-T836 HydrophobicContact CZ-CG2 3.68Å; F832-T836 WeakPolarHBondContact O-CB 3.27Å; F832-T836 WeakPolarHBondContact O-CG2 3.35Å; F832-T836 PolarHBondContact O-N 2.98Å; F832-T836 PolarHBondContact O-OG1 3.22Å; L833-T836 PolarHBondContact O-OG1 3.14Å; T836-A838 VanDerWaalsContact C-N 3.26Å; T836-A838 PolarHBondContact O-N 2.94Å; T836-L969 HydrophobicContact CG2-CD1 3.9Å; T836-L971 HydrophobicContact CG2-CD1 4.09Å
837	N	97.7	Very high	98	Very high	117 Å²	117	58.3 Å²	58.3	63%	0.626	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	41	-172	-67.3	-115.2	0	0	0	111.9	L833 V834 A835	L833-N837 PolarHBondContact O-N 3.3Å; V834-N837 PolarHBondContact O-N 3.45Å; V834-N837 PolarHBondContact O-ND2 2.82Å; A835-N837 PolarHBondContact O-N 3.32Å; A835-N837 PolarHBondContact O-ND2 3.33Å; A835-N837 VanDerWaalsContact O-ND2 3.12Å
838	A	98	Very high	98	Very high	14 Å²	14	59.1 Å²	59.1	12%	0.116	33%	0.327	C	S	.	.			trans	-55.5	148.4	178.3	0	0	0	0	0	111.6	L833 T836 Q840 A841 V842	L833-A838 HydrophobicContact CB-CB 4.06Å; L833-A838 HydrophobicContact CD2-CB 3.73Å; L833-A838 HydrophobicContact CG-CB 4.49Å; L833-A838 WeakPolarHBondContact O-CB 3.39Å; L833-A838 PolarHBondContact O-N 2.75Å; T836-A838 VanDerWaalsContact C-N 3.26Å; T836-A838 PolarHBondContact O-N 2.94Å; A838-Q840 PolarHBondContact O-N 2.84Å; A838-Q840 VanDerWaalsContact O-N 3.13Å; A838-A841 WeakPolarHBondContact O-CB 3.18Å; A838-A841 PolarHBondContact O-N 2.75Å; A838-V842 PolarHBondContact O-N 3.4Å; A838-V842 VanDerWaalsContact O-N 3.11Å
839	P	98.4	Very high	98	Very high	109 Å²	109	57.5 Å²	57.5	71%	0.708	32%	0.321	S	S	*	.	H	α-helix	trans	-59.9	-30.3	-174.9	23.1	-33.8	0	0	0	113.4	L843	P839-L843 WeakPolarHBondContact O-CB 3.07Å; P839-L843 PolarHBondContact O-N 2.88Å
840	Q	96.8	Very high	98	Very high	36 Å²	36	56.1 Å²	56.1	17%	0.168	31%	0.311	C	S	.	.	H	α-helix	trans	-65.3	-43.1	172	-71	160.3	-63.1	0	0	111.9	A838 V842 L843 Y844 V849 H853	A838-Q840 PolarHBondContact O-N 2.84Å; A838-Q840 VanDerWaalsContact O-N 3.13Å; Q840-V842 VanDerWaalsContact C-N 3.35Å; Q840-V842 PolarHBondContact O-N 3.21Å; Q840-L843 WeakPolarHBondContact O-CB 3.47Å; Q840-L843 PolarHBondContact O-N 2.66Å; Q840-Y844 VanDerWaalsContact O-CD2 3.3Å; Q840-Y844 WeakPolarHBondContact O-CD2 3.19Å; Q840-Y844 PolarHBondContact O-N 3.02Å; Q840-V849 VanDerWaalsContact C-CG1 3.41Å; Q840-V849 HydrophobicContact CB-CG1 3.77Å; Q840-H853 PolarHBondContact NE2-CD2 3.1Å; Q840-H853 VanDerWaalsContact NE2-CD2 3.32Å; Q840-H853 PolarHBondContact NE2-CE1 2.95Å; Q840-H853 PolarHBondContact NE2-ND1 3.05Å; Q840-H853 VanDerWaalsContact NE2-ND1 3.17Å; Q840-H853 PolarHBondContact NE2-NE2 3Å
841	A	98.2	Very high	98.1	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.008	31%	0.308	C	S	.	.	H	α-helix	trans	-65.3	-39.3	178.7	0	0	0	0	0	112	L833 V834 A838 N845 D846 V849	L833-A841 HydrophobicContact CB-CB 4.23Å; L833-A841 WeakPolarHBondContact O-CB 3.34Å; V834-A841 HydrophobicContact CG2-CB 4.06Å; A838-A841 WeakPolarHBondContact O-CB 3.18Å; A838-A841 PolarHBondContact O-N 2.75Å; A841-N845 WeakPolarHBondContact O-CA 3.34Å; A841-N845 PolarHBondContact O-N 2.93Å; A841-D846 PolarHBondContact O-N 3.2Å; A841-V849 VanDerWaalsContact CA-CG1 3.5Å; A841-V849 HydrophobicContact CB-CG1 4.11Å; A841-V849 HydrophobicContact CB-CG2 4.16Å
842	V	98.3	Very high	98.1	Very high	95 Å²	95	55.8 Å²	55.8	58%	0.576	30%	0.303	S	S	*	.	H	α-helix	trans	-65.5	-37.7	173.4	-179.5	0	0	0	0	111.5	A838 Q840	A838-V842 PolarHBondContact O-N 3.4Å; A838-V842 VanDerWaalsContact O-N 3.11Å; Q840-V842 VanDerWaalsContact C-N 3.35Å; Q840-V842 PolarHBondContact O-N 3.21Å
843	L	98.3	Very high	98.1	Very high	109 Å²	109	56.4 Å²	56.4	57%	0.571	31%	0.306	S	S	*	.	H	α-helix	trans	-66.4	-46.7	176.5	179.4	63.1	0	0	0	112.2	P839 Q840 N845	P839-L843 WeakPolarHBondContact O-CB 3.07Å; P839-L843 PolarHBondContact O-N 2.88Å; Q840-L843 WeakPolarHBondContact O-CB 3.47Å; Q840-L843 PolarHBondContact O-N 2.66Å; L843-N845 PolarHBondContact O-ND2 3.43Å
844	Y	98.4	Very high	98.2	Very high	49 Å²	49	56 Å²	56	19%	0.192	30%	0.304	C	S	.	.	H	α-helix	trans	-93.6	7	-177	-60.4	-61.6	0	0	0	114.4	Q840 D846 R847 V849 N852 H853	Q840-Y844 VanDerWaalsContact O-CD2 3.3Å; Q840-Y844 WeakPolarHBondContact O-CD2 3.19Å; Q840-Y844 PolarHBondContact O-N 3.02Å; Y844-D846 PolarHBondContact O-N 3.24Å; Y844-R847 PolarHBondContact O-N 2.76Å; Y844-V849 HydrophobicContact CD2-CG1 4.22Å; Y844-V849 WeakPolarHBondContact CD2-O 3.37Å; Y844-N852 HydrophobicContact CD1-CB 3.54Å; Y844-N852 HydrophobicContact CD2-CB 4.18Å; Y844-N852 HydrophobicContact CE1-CB 3.73Å; Y844-N852 HydrophobicContact CE2-CB 4.34Å; Y844-N852 HydrophobicContact CG-CB 3.8Å; Y844-H853 HydrophobicContact CE2-CB 3.83Å
845	N	98.3	Very high	98.2	Very high	115 Å²	115	54 Å²	54	62%	0.615	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	45.7	170.6	-61.5	-108.7	0	0	0	113.7	A841 L843 R847	A841-N845 WeakPolarHBondContact O-CA 3.34Å; A841-N845 PolarHBondContact O-N 2.93Å; L843-N845 PolarHBondContact O-ND2 3.43Å; N845-R847 PolarHBondContact O-N 3.03Å
846	D	97.9	Very high	98.2	Very high	68 Å²	68	53 Å²	53	36%	0.364	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	20.7	179.6	-40.4	-38.2	0	0	0	115.8	V834 A841 Y844 K896	V834-D846 HydrophobicContact CG1-CB 4.31Å; V834-D846 HydrophobicContact CG2-CB 3.95Å; A841-D846 PolarHBondContact O-N 3.2Å; Y844-D846 PolarHBondContact O-N 3.24Å; D846-K896 PolarHBondContact O-NZ 3.47Å
847	R	97.4	Very high	98.3	Very high	186 Å²	186	52 Å²	52	70%	0.702	28%	0.279	S	S	*	.	S	Bend	trans	-117.4	117.2	-179.8	-62.6	174.4	-172.4	-150.2	1.3	110.1	Y844 N845 V849 N852	Y844-R847 PolarHBondContact O-N 2.76Å; N845-R847 PolarHBondContact O-N 3.03Å; R847-V849 PolarHBondContact O-N 3.36Å; R847-V849 VanDerWaalsContact O-N 3.1Å; R847-N852 PolarHBondContact O-ND2 2.9Å
848	S	97.4	Very high	98.3	Very high	18 Å²	18	46.4 Å²	46.4	13%	0.126	25%	0.249	C	C	.	.	S	Bend	trans	38	57.8	172.3	-40.8	0	0	0	0	111.3	E851 N852 D894	S848-E851 WeakPolarHBondContact CA-OE2 3.34Å; S848-E851 WeakPolarHBondContact CB-OE2 3.39Å; S848-E851 PolarHBondContact O-N 3.37Å; S848-N852 WeakPolarHBondContact O-CB 3.28Å; S848-N852 PolarHBondContact O-N 3.11Å; S848-N852 PolarHBondContact O-ND2 3.3Å; S848-D894 VanDerWaalsContact CB-OD2 3.29Å; S848-D894 WeakPolarHBondContact CB-OD2 3.29Å; S848-D894 PolarHBondContact OG-OD2 3.24Å
849	V	98.7	Very high	98.4	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-69.5	-40.9	-159.9	173.4	0	0	0	0	110.3	N830 L833 V834 Q840 A841 Y844 R847 E851 H853	N830-V849 WeakPolarHBondContact OD1-CA 3.19Å; N830-V849 VanDerWaalsContact OD1-CB 3.26Å; N830-V849 WeakPolarHBondContact OD1-CB 3.34Å; N830-V849 PolarHBondContact OD1-N 3.09Å; L833-V849 HydrophobicContact CD1-CG1 3.96Å; V834-V849 HydrophobicContact CG2-CG2 4.34Å; Q840-V849 VanDerWaalsContact C-CG1 3.41Å; Q840-V849 HydrophobicContact CB-CG1 3.77Å; A841-V849 VanDerWaalsContact CA-CG1 3.5Å; A841-V849 HydrophobicContact CB-CG1 4.11Å; A841-V849 HydrophobicContact CB-CG2 4.16Å; Y844-V849 HydrophobicContact CD2-CG1 4.22Å; Y844-V849 WeakPolarHBondContact CD2-O 3.37Å; R847-V849 PolarHBondContact O-N 3.36Å; R847-V849 VanDerWaalsContact O-N 3.1Å; V849-E851 PolarHBondContact N-OE2 2.99Å; V849-H853 VanDerWaalsContact O-CB 3.31Å; V849-H853 WeakPolarHBondContact O-CB 3.17Å; V849-H853 PolarHBondContact O-N 3.1Å
850	L	98.7	Very high	98.4	Very high	10 Å²	10	46.3 Å²	46.3	5%	0.052	24%	0.241	C	C	.	.	H	α-helix	trans	-65.3	-54.8	172.8	-72.3	172.6	0	0	0	110.7	P826 N830 L833 N852 H853 H854	P826-L850 HydrophobicContact CG-CD2 3.69Å; N830-L850 HydrophobicContact CB-CD1 4.32Å; N830-L850 PolarHBondContact OD1-N 3.34Å; L833-L850 HydrophobicContact CD1-CD2 3.65Å; L833-L850 HydrophobicContact CD1-CG 3.97Å; L850-N852 VanDerWaalsContact C-N 3.34Å; L850-N852 PolarHBondContact O-N 3.38Å; L850-H853 CarbonylContact O-C 3.54Å; L850-H853 VanDerWaalsContact O-CA 3.3Å; L850-H853 WeakPolarHBondContact O-CA 3.48Å; L850-H853 VanDerWaalsContact O-CB 3.24Å; L850-H853 WeakPolarHBondContact O-CB 3.5Å; L850-H853 PolarHBondContact O-N 3.45Å; L850-H854 WeakPolarHBondContact CB-NE2 3.5Å; L850-H854 PolarHBondContact O-CD2 2.89Å; L850-H854 PolarHBondContact O-N 3.34Å; L850-H854 PolarHBondContact O-NE2 2.89Å
851	E	98.8	Very high	98.5	Very high	15 Å²	15	45.7 Å²	45.7	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-36.7	-172.1	-53.8	81.6	174.9	0	0	111.9	N830 S848 V849 A855 I890 L891 D894	N830-E851 PolarHBondContact ND2-OE1 3.02Å; N830-E851 PolarHBondContact ND2-OE2 2.79Å; S848-E851 WeakPolarHBondContact CA-OE2 3.34Å; S848-E851 WeakPolarHBondContact CB-OE2 3.39Å; S848-E851 PolarHBondContact O-N 3.37Å; V849-E851 PolarHBondContact N-OE2 2.99Å; E851-A855 WeakPolarHBondContact O-CB 3.46Å; E851-A855 PolarHBondContact O-N 3.15Å; E851-I890 HydrophobicContact CB-CG2 4.44Å; E851-I890 WeakPolarHBondContact O-CG2 3.22Å; E851-L891 HydrophobicContact CB-CD2 3.91Å; E851-D894 HydrophobicContact CG-CB 3.92Å; E851-D894 VanDerWaalsContact OE1-CA 3.23Å; E851-D894 WeakPolarHBondContact OE1-CA 3.41Å; E851-D894 VanDerWaalsContact OE1-CB 3.31Å; E851-D894 WeakPolarHBondContact OE1-CB 3.39Å
852	N	98.7	Very high	98.5	Very high	50 Å²	50	45.9 Å²	45.9	27%	0.267	24%	0.239	S	C	.	.	H	α-helix	trans	-66.5	-38.9	168.5	-81.2	-88.1	0	0	0	112	Y844 R847 S848 L850 A856	Y844-N852 HydrophobicContact CD1-CB 3.54Å; Y844-N852 HydrophobicContact CD2-CB 4.18Å; Y844-N852 HydrophobicContact CE1-CB 3.73Å; Y844-N852 HydrophobicContact CE2-CB 4.34Å; Y844-N852 HydrophobicContact CG-CB 3.8Å; R847-N852 PolarHBondContact O-ND2 2.9Å; S848-N852 WeakPolarHBondContact O-CB 3.28Å; S848-N852 PolarHBondContact O-N 3.11Å; S848-N852 PolarHBondContact O-ND2 3.3Å; L850-N852 VanDerWaalsContact C-N 3.34Å; L850-N852 PolarHBondContact O-N 3.38Å; N852-A856 WeakPolarHBondContact O-CB 3.45Å; N852-A856 PolarHBondContact O-N 3.26Å
853	H	98.8	Very high	98.5	Very high	22 Å²	22	46.3 Å²	46.3	10%	0.102	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-44.2	177.7	-179.3	79.1	0	0	0	112.1	D824 Q840 Y844 V849 L850 S857	D824-H853 IonicContact OD2-CD2 2.67Å; D824-H853 IonicContact OD2-CE1 2.75Å; D824-H853 IonicContact OD2-NE2 3.82Å; D824-H853 PolarHBondContact OD2-NE2 3.5Å; Q840-H853 PolarHBondContact NE2-CD2 3.1Å; Q840-H853 VanDerWaalsContact NE2-CD2 3.32Å; Q840-H853 PolarHBondContact NE2-CE1 2.95Å; Q840-H853 PolarHBondContact NE2-ND1 3.05Å; Q840-H853 VanDerWaalsContact NE2-ND1 3.17Å; Q840-H853 PolarHBondContact NE2-NE2 3Å; Y844-H853 HydrophobicContact CE2-CB 3.83Å; V849-H853 VanDerWaalsContact O-CB 3.31Å; V849-H853 WeakPolarHBondContact O-CB 3.17Å; V849-H853 PolarHBondContact O-N 3.1Å; L850-H853 CarbonylContact O-C 3.54Å; L850-H853 VanDerWaalsContact O-CA 3.3Å; L850-H853 WeakPolarHBondContact O-CA 3.48Å; L850-H853 VanDerWaalsContact O-CB 3.24Å; L850-H853 WeakPolarHBondContact O-CB 3.5Å; L850-H853 PolarHBondContact O-N 3.45Å; H853-S857 PolarHBondContact CE1-OG 3.4Å; H853-S857 VanDerWaalsContact CE1-OG 3.32Å; H853-S857 WeakPolarHBondContact O-CB 3.48Å; H853-S857 PolarHBondContact O-N 2.95Å; H853-S857 PolarHBondContact O-OG 3.49Å
854	H	98.8	Very high	98.4	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-61.1	-56.1	178.6	-54.9	-35.2	0	0	0	110.5	H821 D822 Y823 H825 L850 A856 S857 A858 I890	H821-H854 WeakPolarHBondContact O-CB 3.46Å; H821-H854 PolarHBondContact O-CD2 3.43Å; D822-H854 IonicContact OD1-CD2 3.65Å; Y823-H854 PolarHBondContact O-ND1 3.13Å; H825-H854 AromaticContact CD2-CE1 3.95Å; H825-H854 AromaticContact CD2-NE2 3.7Å; L850-H854 WeakPolarHBondContact CB-NE2 3.5Å; L850-H854 PolarHBondContact O-CD2 2.89Å; L850-H854 PolarHBondContact O-N 3.34Å; L850-H854 PolarHBondContact O-NE2 2.89Å; H854-A856 PolarHBondContact O-N 3.39Å; H854-S857 PolarHBondContact O-N 3.21Å; H854-A858 VanDerWaalsContact O-CB 3.29Å; H854-A858 WeakPolarHBondContact O-CB 3.41Å; H854-A858 PolarHBondContact O-N 3.42Å; H854-I890 HydrophobicContact CB-CG2 4.43Å
855	A	98.7	Very high	98.4	Very high	5 Å²	5	45.8 Å²	45.8	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-59.2	-47.5	177.4	0	0	0	0	0	112.4	E851 S857 W859 I890	E851-A855 WeakPolarHBondContact O-CB 3.46Å; E851-A855 PolarHBondContact O-N 3.15Å; A855-S857 PolarHBondContact O-N 3.24Å; A855-W859 WeakPolarHBondContact O-CB 3.18Å; A855-W859 PolarHBondContact O-N 3.08Å; A855-I890 HydrophobicContact CB-CB 4.29Å; A855-I890 HydrophobicContact CB-CD1 3.81Å; A855-I890 HydrophobicContact CB-CG2 4.07Å
856	A	98.7	Very high	98.3	Very high	45 Å²	45	45.5 Å²	45.5	37%	0.372	25%	0.245	S	C	.	.	H	α-helix	trans	-66	-39.1	-178.8	0	0	0	0	0	112.5	N852 H854 N860	N852-A856 WeakPolarHBondContact O-CB 3.45Å; N852-A856 PolarHBondContact O-N 3.26Å; H854-A856 PolarHBondContact O-N 3.39Å; A856-N860 WeakPolarHBondContact O-CB 3.28Å; A856-N860 PolarHBondContact O-N 2.66Å
857	S	98.7	Very high	98.3	Very high	26 Å²	26	46.1 Å²	46.1	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-76.3	-38.9	-177.4	-57.7	0	0	0	0	112.1	H853 H854 A855 N860 L861	H853-S857 PolarHBondContact CE1-OG 3.4Å; H853-S857 VanDerWaalsContact CE1-OG 3.32Å; H853-S857 WeakPolarHBondContact O-CB 3.48Å; H853-S857 PolarHBondContact O-N 2.95Å; H853-S857 PolarHBondContact O-OG 3.49Å; H854-S857 PolarHBondContact O-N 3.21Å; A855-S857 PolarHBondContact O-N 3.24Å; S857-N860 PolarHBondContact O-N 2.92Å; S857-L861 WeakPolarHBondContact O-CB 3.32Å; S857-L861 PolarHBondContact O-N 3.39Å
858	A	98.7	Very high	98.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.9	-38.4	174	0	0	0	0	0	112.5	Y723 L727 M820 Y823 H854 L861 Y862	Y723-A858 PolarHBondContact OH-O 3.44Å; L727-A858 HydrophobicContact CD1-CB 3.92Å; M820-A858 HydrophobicContact CB-CB 3.8Å; M820-A858 HydrophobicContact CE-CB 4.14Å; M820-A858 HydrophobicContact CG-CB 4.07Å; M820-A858 HydrophobicContact SD-CB 3.57Å; M820-A858 VanDerWaalsContact SD-CB 3.57Å; Y823-A858 HydrophobicContact CD1-CB 4.21Å; Y823-A858 HydrophobicContact CG-CB 4.19Å; H854-A858 VanDerWaalsContact O-CB 3.29Å; H854-A858 WeakPolarHBondContact O-CB 3.41Å; H854-A858 PolarHBondContact O-N 3.42Å; A858-L861 PolarHBondContact O-N 2.91Å; A858-Y862 PolarHBondContact O-N 2.74Å
859	W	98.8	Very high	98.4	Very high	6 Å²	6	41.2 Å²	41.2	2%	0.023	23%	0.229	C	C	.	.	H	α-helix	trans	-70.5	-33.9	171.6	-84.1	108.3	0	0	0	113.1	A855 Y862 L863 F879 F882 R883 V886	A855-W859 WeakPolarHBondContact O-CB 3.18Å; A855-W859 PolarHBondContact O-N 3.08Å; W859-Y862 HydrophobicContact CE3-CD1 4.09Å; W859-Y862 HydrophobicContact CE3-CG 4.25Å; W859-Y862 AromaticContact CZ3-CD1 3.78Å; W859-Y862 HydrophobicContact CZ3-CD1 3.78Å; W859-Y862 HydrophobicContact CZ3-CE1 4.21Å; W859-Y862 HydrophobicContact CZ3-CG 4.08Å; W859-Y862 PolarHBondContact O-N 2.9Å; W859-L863 WeakPolarHBondContact O-CB 3.45Å; W859-L863 VanDerWaalsContact O-CG 3.3Å; W859-L863 WeakPolarHBondContact O-CG 3.28Å; W859-L863 PolarHBondContact O-N 3.23Å; W859-L863 VanDerWaalsContact O-N 3.1Å; W859-F879 HydrophobicContact CH2-CE2 4.2Å; W859-F879 HydrophobicContact CH2-CZ 4.28Å; W859-F879 AromaticContact CZ3-CE2 3.92Å; W859-F879 HydrophobicContact CZ3-CE2 3.92Å; W859-F879 AromaticContact CZ3-CZ 3.7Å; W859-F879 HydrophobicContact CZ3-CZ 3.7Å; W859-F882 AromaticContact CH2-CD1 3.83Å; W859-F882 HydrophobicContact CH2-CD1 3.83Å; W859-F882 AromaticContact CH2-CE1 3.73Å; W859-F882 HydrophobicContact CH2-CE1 3.73Å; W859-F882 HydrophobicContact CZ2-CD1 4.1Å; W859-F882 AromaticContact CZ2-CE1 3.91Å; W859-F882 HydrophobicContact CZ2-CE1 3.91Å; W859-R883 HydrophobicContact CD2-CG 4.04Å; W859-R883 HydrophobicContact CE3-CG 4.41Å; W859-R883 HydrophobicContact CH2-CB 3.86Å; W859-R883 HydrophobicContact CH2-CG 4.13Å; W859-R883 HydrophobicContact CZ2-CB 3.71Å; W859-R883 HydrophobicContact CZ2-CG 3.73Å; W859-R883 HydrophobicContact CZ3-CB 4.48Å; W859-R883 HydrophobicContact CZ3-CG 4.45Å; W859-V886 HydrophobicContact CZ2-CB 4.16Å; W859-V886 HydrophobicContact CZ2-CG1 4.19Å; W859-V886 HydrophobicContact CZ2-CG2 4.29Å
860	N	98.7	Very high	98.3	Very high	115 Å²	115	41.3 Å²	41.3	62%	0.615	23%	0.229	S	C	*	.	H	α-helix	trans	-67.2	-39.6	172.2	178.6	86.1	0	0	0	111.4	A856 S857 L863 S864	A856-N860 WeakPolarHBondContact O-CB 3.28Å; A856-N860 PolarHBondContact O-N 2.66Å; S857-N860 PolarHBondContact O-N 2.92Å; N860-L863 PolarHBondContact O-N 2.87Å; N860-S864 WeakPolarHBondContact O-CB 3.43Å; N860-S864 PolarHBondContact O-N 3.39Å; N860-S864 VanDerWaalsContact O-N 3.08Å
861	L	98.6	Very high	98.3	Very high	23 Å²	23	41.1 Å²	41.1	12%	0.12	23%	0.228	C	C	.	.	H	α-helix	trans	-59	-52.6	171.5	178.5	66.4	0	0	0	110.3	Y723 A726 L727 Y823 S857 A858 L863 S864 Y868	Y723-L861 HydrophobicContact CD2-CD2 4.45Å; Y723-L861 HydrophobicContact CD2-CG 4.4Å; Y723-L861 HydrophobicContact CE2-CB 4.35Å; Y723-L861 HydrophobicContact CE2-CD2 3.99Å; Y723-L861 HydrophobicContact CE2-CG 3.99Å; A726-L861 HydrophobicContact CB-CD1 4.21Å; A726-L861 HydrophobicContact CB-CD2 4.04Å; L727-L861 HydrophobicContact CB-CD2 4.38Å; L727-L861 HydrophobicContact CD1-CD2 4.19Å; Y823-L861 HydrophobicContact CE2-CD2 4.1Å; S857-L861 WeakPolarHBondContact O-CB 3.32Å; S857-L861 PolarHBondContact O-N 3.39Å; A858-L861 PolarHBondContact O-N 2.91Å; L861-L863 PolarHBondContact O-N 3.1Å; L861-S864 WeakPolarHBondContact O-CB 3.29Å; L861-S864 PolarHBondContact O-N 3.3Å; L861-S864 PolarHBondContact O-OG 2.82Å; L861-Y868 HydrophobicContact CD1-CD2 4.44Å; L861-Y868 HydrophobicContact CD1-CE2 3.75Å; L861-Y868 HydrophobicContact CG-CE2 4.28Å; L861-Y868 VanDerWaalsContact O-CD2 3.31Å; L861-Y868 WeakPolarHBondContact O-CD2 3.44Å
862	Y	98.7	Very high	98.2	Very high	6 Å²	6	44.4 Å²	44.4	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-53.5	-41.8	180	-177.2	-87.1	0	0	0	112.7	Y723 A858 W859 Y868 N869 F870 L871 F879	Y723-Y862 HydrophobicContact CD1-CD2 4.35Å; Y723-Y862 HydrophobicContact CD2-CD2 4.09Å; Y723-Y862 HydrophobicContact CE1-CD2 4.23Å; Y723-Y862 VanDerWaalsContact CE2-CA 3.49Å; Y723-Y862 AromaticContact CE2-CD2 3.98Å; Y723-Y862 HydrophobicContact CE2-CD2 3.98Å; Y723-Y862 HydrophobicContact CE2-CG 4.31Å; Y723-Y862 HydrophobicContact CG-CD2 4.25Å; A858-Y862 PolarHBondContact O-N 2.74Å; W859-Y862 HydrophobicContact CE3-CD1 4.09Å; W859-Y862 HydrophobicContact CE3-CG 4.25Å; W859-Y862 AromaticContact CZ3-CD1 3.78Å; W859-Y862 HydrophobicContact CZ3-CD1 3.78Å; W859-Y862 HydrophobicContact CZ3-CE1 4.21Å; W859-Y862 HydrophobicContact CZ3-CG 4.08Å; W859-Y862 PolarHBondContact O-N 2.9Å; Y862-Y868 WeakPolarHBondContact CE2-O 3.2Å; Y862-N869 WeakPolarHBondContact OH-CA 3.38Å; Y862-N869 PolarHBondContact OH-OD1 3.24Å; Y862-F870 HydrophobicContact CD2-CD1 4.32Å; Y862-F870 HydrophobicContact CD2-CE1 4.06Å; Y862-F870 AromaticContact CE2-CD1 3.63Å; Y862-F870 HydrophobicContact CE2-CD1 3.63Å; Y862-F870 AromaticContact CE2-CE1 3.61Å; Y862-F870 HydrophobicContact CE2-CE1 3.61Å; Y862-F870 HydrophobicContact CE2-CG 4.49Å; Y862-F870 HydrophobicContact CE2-CZ 4.48Å; Y862-F870 PolarHBondContact OH-N 2.97Å; Y862-L871 HydrophobicContact CE2-CD1 4.32Å; Y862-L871 HydrophobicContact CE2-CG 4.46Å; Y862-L871 VanDerWaalsContact OH-CB 3.31Å; Y862-L871 WeakPolarHBondContact OH-CB 3.38Å; Y862-L871 PolarHBondContact OH-N 3.33Å; Y862-L871 VanDerWaalsContact OH-N 3.14Å; Y862-F879 AromaticContact CE1-CE2 3.8Å; Y862-F879 HydrophobicContact CE1-CE2 3.8Å; Y862-F879 HydrophobicContact CE1-CZ 4.05Å
863	L	98	Very high	98.1	Very high	104 Å²	104	45.9 Å²	45.9	55%	0.545	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.4	-177.9	-64.3	172.2	0	0	0	114.2	W859 N860 L861	W859-L863 WeakPolarHBondContact O-CB 3.45Å; W859-L863 VanDerWaalsContact O-CG 3.3Å; W859-L863 WeakPolarHBondContact O-CG 3.28Å; W859-L863 PolarHBondContact O-N 3.23Å; W859-L863 VanDerWaalsContact O-N 3.1Å; N860-L863 PolarHBondContact O-N 2.87Å; L861-L863 PolarHBondContact O-N 3.1Å
864	S	98	Very high	97.9	Very high	60 Å²	60	45.6 Å²	45.6	42%	0.42	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-28.4	-174.8	66.3	0	0	0	0	114.1	N860 L861	N860-S864 WeakPolarHBondContact O-CB 3.43Å; N860-S864 PolarHBondContact O-N 3.39Å; N860-S864 VanDerWaalsContact O-N 3.08Å; L861-S864 WeakPolarHBondContact O-CB 3.29Å; L861-S864 PolarHBondContact O-N 3.3Å; L861-S864 PolarHBondContact O-OG 2.82Å
865	H	96.8	Very high	97.7	Very high	87 Å²	87	48.4 Å²	48.4	40%	0.403	27%	0.265	S	S	.	.			trans	-144.9	128.6	-168.6	-89.1	-100.9	0	0	0	110.4	E867 Y868	H865-E867 HydrophobicContact CB-CG 4.18Å; H865-E867 WeakPolarHBondContact CB-OE2 3.36Å; H865-E867 IonicContact CE1-OE1 2.7Å; H865-E867 IonicContact CG-OE1 3.51Å; H865-E867 IonicContact CG-OE2 3.69Å; H865-E867 VanDerWaalsContact ND1-CD 3.32Å; H865-E867 IonicContact ND1-OE1 3.94Å; H865-E867 PolarHBondContact ND1-OE1 2.94Å; H865-E867 IonicContact ND1-OE2 3.91Å; H865-E867 PolarHBondContact O-N 3.12Å; H865-Y868 HydrophobicContact CB-CD2 3.65Å; H865-Y868 HydrophobicContact CB-CE2 3.72Å; H865-Y868 HydrophobicContact CB-CG 4.25Å; H865-Y868 PolarHBondContact O-N 3.38Å; H865-Y868 VanDerWaalsContact O-N 3.11Å
866	P	97.3	Very high	97.5	Very high	109 Å²	109	56.5 Å²	56.5	71%	0.708	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-62.6	-26.4	-179.1	26.2	-35.5	0	0	0	113.4	Y868 N869	P866-Y868 PolarHBondContact O-N 3.12Å; P866-Y868 VanDerWaalsContact O-N 3.17Å; P866-N869 WeakPolarHBondContact O-CB 3.27Å; P866-N869 PolarHBondContact O-N 3.41Å; P866-N869 VanDerWaalsContact O-N 3.07Å
867	E	97.3	Very high	97.4	Very high	81 Å²	81	59.6 Å²	59.6	38%	0.379	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-69.2	-1	175	64.4	-92.5	-141.2	0	0	114.6	Q719 N722 H865	Q719-E867 WeakPolarHBondContact CA-O 3.4Å; N722-E867 VanDerWaalsContact CB-O 3.29Å; N722-E867 WeakPolarHBondContact CB-O 3.48Å; N722-E867 PolarHBondContact ND2-O 2.93Å; H865-E867 HydrophobicContact CB-CG 4.18Å; H865-E867 WeakPolarHBondContact CB-OE2 3.36Å; H865-E867 IonicContact CE1-OE1 2.7Å; H865-E867 IonicContact CG-OE1 3.51Å; H865-E867 IonicContact CG-OE2 3.69Å; H865-E867 VanDerWaalsContact ND1-CD 3.32Å; H865-E867 IonicContact ND1-OE1 3.94Å; H865-E867 PolarHBondContact ND1-OE1 2.94Å; H865-E867 IonicContact ND1-OE2 3.91Å; H865-E867 PolarHBondContact O-N 3.12Å
868	Y	98.3	Very high	97.3	Very high	42 Å²	42	60.2 Å²	60.2	17%	0.165	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-102.3	-6.2	168.7	-60.7	-29.9	0	0	0	113.9	N722 Y723 A726 L861 Y862 H865 P866 F870	N722-Y868 HydrophobicContact CB-CD1 3.8Å; N722-Y868 HydrophobicContact CB-CE1 4.05Å; N722-Y868 WeakPolarHBondContact O-CE1 3.43Å; Y723-Y868 HydrophobicContact CD2-CD2 4.39Å; Y723-Y868 HydrophobicContact CD2-CG 4.08Å; A726-Y868 HydrophobicContact CB-CE1 3.78Å; A726-Y868 HydrophobicContact CB-CE2 4.3Å; A726-Y868 WeakPolarHBondContact CB-OH 3.48Å; L861-Y868 HydrophobicContact CD1-CD2 4.44Å; L861-Y868 HydrophobicContact CD1-CE2 3.75Å; L861-Y868 HydrophobicContact CG-CE2 4.28Å; L861-Y868 VanDerWaalsContact O-CD2 3.31Å; L861-Y868 WeakPolarHBondContact O-CD2 3.44Å; Y862-Y868 WeakPolarHBondContact CE2-O 3.2Å; H865-Y868 HydrophobicContact CB-CD2 3.65Å; H865-Y868 HydrophobicContact CB-CE2 3.72Å; H865-Y868 HydrophobicContact CB-CG 4.25Å; H865-Y868 PolarHBondContact O-N 3.38Å; H865-Y868 VanDerWaalsContact O-N 3.11Å; P866-Y868 PolarHBondContact O-N 3.12Å; P866-Y868 VanDerWaalsContact O-N 3.17Å; Y868-F870 PolarHBondContact O-N 3.4Å
869	N	98	Very high	97.2	Very high	59 Å²	59	62.5 Å²	62.5	32%	0.316	33%	0.326	S	S	.	.			trans	-77	66.5	-172.3	-172.8	26.1	0	0	0	112.6	Y862 P866 L871 L872	Y862-N869 WeakPolarHBondContact OH-CA 3.38Å; Y862-N869 PolarHBondContact OH-OD1 3.24Å; P866-N869 WeakPolarHBondContact O-CB 3.27Å; P866-N869 PolarHBondContact O-N 3.41Å; P866-N869 VanDerWaalsContact O-N 3.07Å; N869-L871 PolarHBondContact O-N 2.92Å; N869-L872 WeakPolarHBondContact ND2-CB 3.15Å; N869-L872 WeakPolarHBondContact O-CB 3.4Å; N869-L872 WeakPolarHBondContact O-CD2 3.29Å; N869-L872 PolarHBondContact O-N 2.94Å
870	F	98.4	Very high	97.2	Very high	2 Å²	2	69.9 Å²	69.9	1%	0.009	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-11.8	-177.6	76.7	-97.5	0	0	0	113.8	I715 P716 Q719 F720 Y723 F724 V816 Y862 Y868	I715-F870 HydrophobicContact CD1-CD2 4.28Å; I715-F870 HydrophobicContact CD1-CE2 4.41Å; I715-F870 HydrophobicContact CG1-CD2 4.3Å; I715-F870 HydrophobicContact CG2-CB 4.04Å; I715-F870 HydrophobicContact CG2-CD2 3.71Å; I715-F870 HydrophobicContact CG2-CG 4.31Å; P716-F870 WeakPolarHBondContact CD-O 3.31Å; Q719-F870 HydrophobicContact CB-CB 3.94Å; F720-F870 HydrophobicContact CB-CB 4.05Å; F720-F870 HydrophobicContact CB-CG 4.38Å; F720-F870 AromaticContact CD2-CD2 3.86Å; F720-F870 HydrophobicContact CD2-CD2 3.86Å; F720-F870 HydrophobicContact CD2-CE2 4.08Å; F720-F870 HydrophobicContact CD2-CG 4.19Å; F720-F870 HydrophobicContact CE2-CE2 4.47Å; Y723-F870 HydrophobicContact CD1-CD1 4.02Å; Y723-F870 AromaticContact CD1-CE1 3.52Å; Y723-F870 HydrophobicContact CD1-CE1 3.52Å; Y723-F870 HydrophobicContact CE1-CE1 4.03Å; Y723-F870 HydrophobicContact CG-CD1 4.28Å; Y723-F870 HydrophobicContact CG-CE1 4.2Å; F724-F870 HydrophobicContact CE2-CD1 4.27Å; F724-F870 AromaticContact CE2-CE1 3.67Å; F724-F870 HydrophobicContact CE2-CE1 3.67Å; F724-F870 HydrophobicContact CE2-CE2 4.32Å; F724-F870 AromaticContact CE2-CZ 3.7Å; F724-F870 HydrophobicContact CE2-CZ 3.7Å; F724-F870 AromaticContact CZ-CE1 3.86Å; F724-F870 HydrophobicContact CZ-CE1 3.86Å; F724-F870 AromaticContact CZ-CZ 3.76Å; F724-F870 HydrophobicContact CZ-CZ 3.76Å; V816-F870 HydrophobicContact CG2-CZ 4.36Å; Y862-F870 HydrophobicContact CD2-CD1 4.32Å; Y862-F870 HydrophobicContact CD2-CE1 4.06Å; Y862-F870 AromaticContact CE2-CD1 3.63Å; Y862-F870 HydrophobicContact CE2-CD1 3.63Å; Y862-F870 AromaticContact CE2-CE1 3.61Å; Y862-F870 HydrophobicContact CE2-CE1 3.61Å; Y862-F870 HydrophobicContact CE2-CG 4.49Å; Y862-F870 HydrophobicContact CE2-CZ 4.48Å; Y862-F870 PolarHBondContact OH-N 2.97Å; Y868-F870 PolarHBondContact O-N 3.4Å
871	L	97.9	Very high	97.2	Very high	6 Å²	6	67.3 Å²	67.3	3%	0.031	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	17.3	177.2	-56.2	170.4	0	0	0	113.3	M812 Y862 N869 H873 L874 F879 F882	M812-L871 HydrophobicContact CE-CD2 3.96Å; M812-L871 HydrophobicContact SD-CD2 4.33Å; Y862-L871 HydrophobicContact CE2-CD1 4.32Å; Y862-L871 HydrophobicContact CE2-CG 4.46Å; Y862-L871 VanDerWaalsContact OH-CB 3.31Å; Y862-L871 WeakPolarHBondContact OH-CB 3.38Å; Y862-L871 PolarHBondContact OH-N 3.33Å; Y862-L871 VanDerWaalsContact OH-N 3.14Å; N869-L871 PolarHBondContact O-N 2.92Å; L871-H873 PolarHBondContact O-N 3.2Å; L871-L874 HydrophobicContact CB-CD1 4.06Å; L871-L874 HydrophobicContact CB-CG 4.19Å; L871-L874 HydrophobicContact CD1-CD1 4.44Å; L871-L874 HydrophobicContact CD2-CD1 4.04Å; L871-L874 HydrophobicContact CD2-CG 4.46Å; L871-L874 HydrophobicContact CG-CD1 4.42Å; L871-L874 WeakPolarHBondContact O-CB 3.49Å; L871-L874 PolarHBondContact O-N 2.85Å; L871-F879 HydrophobicContact CB-CD2 4.19Å; L871-F879 HydrophobicContact CB-CE2 4.49Å; L871-F879 HydrophobicContact CD1-CD2 4.11Å; L871-F879 HydrophobicContact CD1-CE2 4.09Å; L871-F882 HydrophobicContact CD1-CD1 3.6Å; L871-F882 HydrophobicContact CD1-CE1 3.34Å; L871-F882 HydrophobicContact CD1-CG 4.42Å; L871-F882 HydrophobicContact CD1-CZ 3.96Å
872	L	96.4	Very high	97.2	Very high	84 Å²	84	66.3 Å²	66.3	44%	0.44	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.9	-172.5	78.3	106	0	0	0	115.7	P716 N869	P716-L872 HydrophobicContact CG-CD2 3.87Å; N869-L872 WeakPolarHBondContact ND2-CB 3.15Å; N869-L872 WeakPolarHBondContact O-CB 3.4Å; N869-L872 WeakPolarHBondContact O-CD2 3.29Å; N869-L872 PolarHBondContact O-N 2.94Å
873	H	96.1	Very high	97.2	Very high	81 Å²	81	70.7 Å²	70.7	38%	0.375	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-10.3	178	-64.3	126.5	0	0	0	114.3	K714 I779 L871	K714-H873 HydrophobicContact CB-CB 4.29Å; K714-H873 PolarHBondContact O-ND1 2.93Å; I779-H873 HydrophobicContact CD1-CB 4.13Å; L871-H873 PolarHBondContact O-N 3.2Å
874	L	95.5	Very high	97.2	Very high	16 Å²	16	70.6 Å²	70.6	8%	0.084	35%	0.346	C	S	.	.	S	Bend	trans	-67.4	144.4	166.5	-64.4	-168.6	0	0	0	110.1	F713 L809 M812 L871 E878 F879 F882	F713-L874 HydrophobicContact CB-CD2 4.24Å; F713-L874 HydrophobicContact CD1-CD2 3.41Å; F713-L874 VanDerWaalsContact CD1-CD2 3.41Å; F713-L874 HydrophobicContact CE1-CD2 4.04Å; F713-L874 HydrophobicContact CG-CD2 4.06Å; L809-L874 HydrophobicContact CD1-CD1 4.2Å; L809-L874 HydrophobicContact CD1-CD2 4.48Å; M812-L874 HydrophobicContact CE-CD1 4.37Å; L871-L874 HydrophobicContact CB-CD1 4.06Å; L871-L874 HydrophobicContact CB-CG 4.19Å; L871-L874 HydrophobicContact CD1-CD1 4.44Å; L871-L874 HydrophobicContact CD2-CD1 4.04Å; L871-L874 HydrophobicContact CD2-CG 4.46Å; L871-L874 HydrophobicContact CG-CD1 4.42Å; L871-L874 WeakPolarHBondContact O-CB 3.49Å; L871-L874 PolarHBondContact O-N 2.85Å; L874-E878 WeakPolarHBondContact CA-OE2 3.17Å; L874-E878 HydrophobicContact CB-CB 4.01Å; L874-E878 HydrophobicContact CD1-CB 4.39Å; L874-E878 HydrophobicContact CD2-CB 4.24Å; L874-E878 HydrophobicContact CG-CB 4.45Å; L874-F879 HydrophobicContact CB-CB 4.29Å; L874-F879 HydrophobicContact CD1-CB 4.48Å; L874-F882 HydrophobicContact CD1-CB 4.42Å
875	D	93.8	Very high	97.3	Very high	60 Å²	60	68.2 Å²	68.2	32%	0.321	33%	0.329	S	S	.	.			trans	-75.8	171	168.3	86.6	24.5	0	0	0	112.5	V877 E878 F879	D875-V877 PolarHBondContact O-N 3.11Å; D875-V877 VanDerWaalsContact OD1-CA 3.32Å; D875-V877 WeakPolarHBondContact OD1-CA 3.37Å; D875-V877 VanDerWaalsContact OD1-CB 3.28Å; D875-V877 WeakPolarHBondContact OD1-CB 3.45Å; D875-V877 PolarHBondContact OD1-N 3.04Å; D875-E878 PolarHBondContact N-OE2 2.97Å; D875-E878 PolarHBondContact O-N 3.27Å; D875-E878 PolarHBondContact OD1-N 2.75Å; D875-F879 WeakPolarHBondContact O-CB 3.44Å; D875-F879 PolarHBondContact O-N 3.5Å
876	H	95.1	Very high	97.4	Very high	175 Å²	175	64.1 Å²	64.1	81%	0.81	31%	0.31	S	S	*	.	H	α-helix	trans	-68.1	-17.9	-177	-67.4	-36.1	0	0	0	114.5	K880	H876-K880 WeakPolarHBondContact O-CB 3.39Å; H876-K880 PolarHBondContact O-N 3.49Å
877	V	96.4	Very high	97.4	Very high	110 Å²	110	61 Å²	61	67%	0.667	29%	0.287	S	S	*	.	H	α-helix	trans	-82.9	-47.8	173.4	-173.2	0	0	0	0	109.4	D875 K880 R881	D875-V877 PolarHBondContact O-N 3.11Å; D875-V877 VanDerWaalsContact OD1-CA 3.32Å; D875-V877 WeakPolarHBondContact OD1-CA 3.37Å; D875-V877 VanDerWaalsContact OD1-CB 3.28Å; D875-V877 WeakPolarHBondContact OD1-CB 3.45Å; D875-V877 PolarHBondContact OD1-N 3.04Å; V877-K880 PolarHBondContact O-N 3.07Å; V877-R881 WeakPolarHBondContact O-CB 3.4Å; V877-R881 PolarHBondContact O-N 2.99Å
878	E	96.2	Very high	97.5	Very high	39 Å²	39	59.9 Å²	59.9	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-57.7	-51.6	175.3	-67.3	177.5	126.4	0	0	111.4	L809 L874 D875 K880 R881 F882	L809-E878 HydrophobicContact CD2-CB 4.26Å; L809-E878 HydrophobicContact CD2-CG 4.44Å; L874-E878 WeakPolarHBondContact CA-OE2 3.17Å; L874-E878 HydrophobicContact CB-CB 4.01Å; L874-E878 HydrophobicContact CD1-CB 4.39Å; L874-E878 HydrophobicContact CD2-CB 4.24Å; L874-E878 HydrophobicContact CG-CB 4.45Å; D875-E878 PolarHBondContact N-OE2 2.97Å; D875-E878 PolarHBondContact O-N 3.27Å; D875-E878 PolarHBondContact OD1-N 2.75Å; E878-K880 VanDerWaalsContact C-N 3.33Å; E878-K880 PolarHBondContact O-N 3.19Å; E878-R881 PolarHBondContact O-N 3.18Å; E878-F882 VanDerWaalsContact O-CB 3.28Å; E878-F882 WeakPolarHBondContact O-CB 3.35Å; E878-F882 PolarHBondContact O-N 3.3Å
879	F	98.1	Very high	97.5	Very high	48 Å²	48	58 Å²	58	21%	0.211	28%	0.275	C	S	.	.	H	α-helix	trans	-61.9	-38.2	178.2	179.6	-96.6	0	0	0	112.4	W859 Y862 L871 L874 D875 R883	W859-F879 HydrophobicContact CH2-CE2 4.2Å; W859-F879 HydrophobicContact CH2-CZ 4.28Å; W859-F879 AromaticContact CZ3-CE2 3.92Å; W859-F879 HydrophobicContact CZ3-CE2 3.92Å; W859-F879 AromaticContact CZ3-CZ 3.7Å; W859-F879 HydrophobicContact CZ3-CZ 3.7Å; Y862-F879 AromaticContact CE1-CE2 3.8Å; Y862-F879 HydrophobicContact CE1-CE2 3.8Å; Y862-F879 HydrophobicContact CE1-CZ 4.05Å; L871-F879 HydrophobicContact CB-CD2 4.19Å; L871-F879 HydrophobicContact CB-CE2 4.49Å; L871-F879 HydrophobicContact CD1-CD2 4.11Å; L871-F879 HydrophobicContact CD1-CE2 4.09Å; L874-F879 HydrophobicContact CB-CB 4.29Å; L874-F879 HydrophobicContact CD1-CB 4.48Å; D875-F879 WeakPolarHBondContact O-CB 3.44Å; D875-F879 PolarHBondContact O-N 3.5Å; F879-R883 WeakPolarHBondContact O-CB 3.31Å; F879-R883 PolarHBondContact O-N 2.88Å
880	K	98.1	Very high	97.6	Very high	160 Å²	160	55.2 Å²	55.2	70%	0.696	26%	0.26	S	S	*	.	H	α-helix	trans	-68.1	-41.2	176.4	-176.6	-175.1	175.7	-168.7	0	111.6	H876 V877 E878 F884	H876-K880 WeakPolarHBondContact O-CB 3.39Å; H876-K880 PolarHBondContact O-N 3.49Å; V877-K880 PolarHBondContact O-N 3.07Å; E878-K880 VanDerWaalsContact C-N 3.33Å; E878-K880 PolarHBondContact O-N 3.19Å; K880-F884 PolarHBondContact O-N 3.14Å; K880-F884 VanDerWaalsContact O-N 3.1Å
881	R	98	Very high	97.6	Very high	62 Å²	62	56.5 Å²	56.5	23%	0.234	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-51	174.8	-175.4	-176.7	-176.1	75.8	6.7	110.4	E810 V877 E878 R883 F884 L885 E922	E810-R881 IonicContact OE1-CZ 3.23Å; E810-R881 IonicContact OE1-NE 2.77Å; E810-R881 PolarHBondContact OE1-NE 3.39Å; E810-R881 IonicContact OE1-NH2 2.79Å; E810-R881 PolarHBondContact OE1-NH2 2.92Å; V877-R881 WeakPolarHBondContact O-CB 3.4Å; V877-R881 PolarHBondContact O-N 2.99Å; E878-R881 PolarHBondContact O-N 3.18Å; R881-R883 VanDerWaalsContact C-N 3.34Å; R881-R883 PolarHBondContact O-N 3.07Å; R881-F884 WeakPolarHBondContact O-CB 3.26Å; R881-F884 PolarHBondContact O-N 3.08Å; R881-F884 VanDerWaalsContact O-N 3.12Å; R881-L885 HydrophobicContact CG-CD1 3.79Å; R881-L885 HydrophobicContact CG-CG 4.31Å; R881-L885 VanDerWaalsContact O-CG 3.29Å; R881-L885 WeakPolarHBondContact O-CG 3.25Å; R881-L885 PolarHBondContact O-N 3.3Å; R881-E922 IonicContact CZ-OE1 3.43Å; R881-E922 IonicContact CZ-OE2 2.99Å; R881-E922 VanDerWaalsContact CZ-OE2 3.28Å; R881-E922 VanDerWaalsContact NH1-CD 3.3Å; R881-E922 IonicContact NH1-OE1 3.16Å; R881-E922 PolarHBondContact NH1-OE1 2.73Å; R881-E922 IonicContact NH1-OE2 2.74Å; R881-E922 PolarHBondContact NH1-OE2 2.74Å; R881-E922 IonicContact NH2-OE1 3.25Å; R881-E922 PolarHBondContact NH2-OE1 3.35Å; R881-E922 IonicContact NH2-OE2 2.67Å; R881-E922 PolarHBondContact NH2-OE2 3.25Å
882	F	98.8	Very high	97.6	Very high	1 Å²	1	56.2 Å²	56.2	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-52.3	-50.6	176.3	176.6	-93.6	0	0	0	111.8	L809 M812 A813 V816 W859 L871 L874 E878 F884 L885 V886	L809-F882 HydrophobicContact CD1-CB 4.07Å; L809-F882 HydrophobicContact CD1-CD2 4.11Å; M812-F882 HydrophobicContact CB-CE2 4.28Å; M812-F882 HydrophobicContact CE-CD2 3.82Å; M812-F882 HydrophobicContact CE-CE2 3.8Å; M812-F882 HydrophobicContact CG-CE2 3.91Å; A813-F882 HydrophobicContact CB-CD2 3.84Å; A813-F882 HydrophobicContact CB-CE2 3.95Å; V816-F882 HydrophobicContact CB-CE2 4.46Å; V816-F882 HydrophobicContact CB-CZ 3.84Å; V816-F882 HydrophobicContact CG1-CE1 4.46Å; V816-F882 HydrophobicContact CG1-CZ 3.87Å; V816-F882 HydrophobicContact CG2-CE2 4.43Å; V816-F882 HydrophobicContact CG2-CZ 3.94Å; W859-F882 AromaticContact CH2-CD1 3.83Å; W859-F882 HydrophobicContact CH2-CD1 3.83Å; W859-F882 AromaticContact CH2-CE1 3.73Å; W859-F882 HydrophobicContact CH2-CE1 3.73Å; W859-F882 HydrophobicContact CZ2-CD1 4.1Å; W859-F882 AromaticContact CZ2-CE1 3.91Å; W859-F882 HydrophobicContact CZ2-CE1 3.91Å; L871-F882 HydrophobicContact CD1-CD1 3.6Å; L871-F882 HydrophobicContact CD1-CE1 3.34Å; L871-F882 HydrophobicContact CD1-CG 4.42Å; L871-F882 HydrophobicContact CD1-CZ 3.96Å; L874-F882 HydrophobicContact CD1-CB 4.42Å; E878-F882 VanDerWaalsContact O-CB 3.28Å; E878-F882 WeakPolarHBondContact O-CB 3.35Å; E878-F882 PolarHBondContact O-N 3.3Å; F882-F884 VanDerWaalsContact C-N 3.33Å; F882-F884 PolarHBondContact O-N 3.28Å; F882-L885 PolarHBondContact O-N 3.4Å; F882-V886 HydrophobicContact CD1-CG2 4.21Å; F882-V886 HydrophobicContact CE1-CG2 3.76Å; F882-V886 HydrophobicContact CE2-CG2 4.15Å; F882-V886 HydrophobicContact CZ-CG2 3.74Å; F882-V886 WeakPolarHBondContact O-CG2 3.33Å; F882-V886 PolarHBondContact O-N 3.02Å
883	R	98.8	Very high	97.7	Very high	98 Å²	98	52.5 Å²	52.5	37%	0.37	25%	0.246	S	C	.	.	H	α-helix	trans	-61.7	-38.2	178.2	176.9	166	-179.7	-166	-0.6	113.3	W859 F879 R881 I887	W859-R883 HydrophobicContact CD2-CG 4.04Å; W859-R883 HydrophobicContact CE3-CG 4.41Å; W859-R883 HydrophobicContact CH2-CB 3.86Å; W859-R883 HydrophobicContact CH2-CG 4.13Å; W859-R883 HydrophobicContact CZ2-CB 3.71Å; W859-R883 HydrophobicContact CZ2-CG 3.73Å; W859-R883 HydrophobicContact CZ3-CB 4.48Å; W859-R883 HydrophobicContact CZ3-CG 4.45Å; F879-R883 WeakPolarHBondContact O-CB 3.31Å; F879-R883 PolarHBondContact O-N 2.88Å; R881-R883 VanDerWaalsContact C-N 3.34Å; R881-R883 PolarHBondContact O-N 3.07Å; R883-I887 HydrophobicContact CG-CD1 3.9Å; R883-I887 WeakPolarHBondContact O-CD1 3.39Å; R883-I887 VanDerWaalsContact O-CG1 3.26Å; R883-I887 WeakPolarHBondContact O-CG1 3.5Å; R883-I887 PolarHBondContact O-N 3.14Å
884	F	98.8	Very high	97.8	Very high	102 Å²	102	49 Å²	49	45%	0.447	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-50.5	173.9	164.8	-106.2	0	0	0	111.2	K880 R881 F882 V886 I887 E888 L926	K880-F884 PolarHBondContact O-N 3.14Å; K880-F884 VanDerWaalsContact O-N 3.1Å; R881-F884 WeakPolarHBondContact O-CB 3.26Å; R881-F884 PolarHBondContact O-N 3.08Å; R881-F884 VanDerWaalsContact O-N 3.12Å; F882-F884 VanDerWaalsContact C-N 3.33Å; F882-F884 PolarHBondContact O-N 3.28Å; F884-V886 PolarHBondContact O-N 3.45Å; F884-I887 PolarHBondContact O-N 3.14Å; F884-I887 VanDerWaalsContact O-N 3.12Å; F884-E888 HydrophobicContact CD2-CG 3.88Å; F884-E888 HydrophobicContact CE1-CG 4.29Å; F884-E888 HydrophobicContact CE2-CG 3.38Å; F884-E888 HydrophobicContact CZ-CG 3.63Å; F884-E888 PolarHBondContact O-N 3.27Å; F884-L926 HydrophobicContact CE1-CD2 4.16Å; F884-L926 HydrophobicContact CZ-CD2 4.19Å
885	L	98.8	Very high	97.7	Very high	11 Å²	11	51.9 Å²	51.9	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-42.7	-179.9	-65.5	165	0	0	0	112.6	E810 A813 R881 F882 I887 E888 A889 L926	E810-L885 HydrophobicContact CB-CD1 4.37Å; E810-L885 HydrophobicContact CG-CD1 3.54Å; E810-L885 HydrophobicContact CG-CD2 4.28Å; A813-L885 HydrophobicContact CB-CB 3.54Å; A813-L885 HydrophobicContact CB-CD1 4.2Å; R881-L885 HydrophobicContact CG-CD1 3.79Å; R881-L885 HydrophobicContact CG-CG 4.31Å; R881-L885 VanDerWaalsContact O-CG 3.29Å; R881-L885 WeakPolarHBondContact O-CG 3.25Å; R881-L885 PolarHBondContact O-N 3.3Å; F882-L885 PolarHBondContact O-N 3.4Å; L885-I887 VanDerWaalsContact C-N 3.34Å; L885-I887 PolarHBondContact O-N 2.94Å; L885-E888 PolarHBondContact O-N 3.27Å; L885-A889 WeakPolarHBondContact O-CB 3.41Å; L885-A889 PolarHBondContact O-N 3.49Å; L885-L926 HydrophobicContact CD2-CD1 4Å
886	V	98.9	Very high	97.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-44.4	174.6	170	0	0	0	0	111.1	A813 V816 A817 M820 W859 F882 F884 A889 I890	A813-V886 HydrophobicContact CB-CG2 3.9Å; V816-V886 HydrophobicContact CG1-CG2 4.45Å; A817-V886 HydrophobicContact CB-CG1 4.3Å; M820-V886 HydrophobicContact SD-CG1 3.72Å; W859-V886 HydrophobicContact CZ2-CB 4.16Å; W859-V886 HydrophobicContact CZ2-CG1 4.19Å; W859-V886 HydrophobicContact CZ2-CG2 4.29Å; F882-V886 HydrophobicContact CD1-CG2 4.21Å; F882-V886 HydrophobicContact CE1-CG2 3.76Å; F882-V886 HydrophobicContact CE2-CG2 4.15Å; F882-V886 HydrophobicContact CZ-CG2 3.74Å; F882-V886 WeakPolarHBondContact O-CG2 3.33Å; F882-V886 PolarHBondContact O-N 3.02Å; F884-V886 PolarHBondContact O-N 3.45Å; V886-A889 PolarHBondContact O-N 3.34Å; V886-I890 HydrophobicContact CG1-CD1 3.77Å; V886-I890 WeakPolarHBondContact O-CD1 3.3Å; V886-I890 VanDerWaalsContact O-CG1 3.25Å; V886-I890 WeakPolarHBondContact O-CG1 3.25Å; V886-I890 PolarHBondContact O-N 3.36Å; V886-I890 VanDerWaalsContact O-N 3.11Å
887	I	98.8	Very high	97.6	Very high	43 Å²	43	49.1 Å²	49.1	22%	0.221	23%	0.228	C	C	.	.	H	α-helix	trans	-67.3	-43.7	180	-70.1	167.2	0	0	0	111.2	R883 F884 L885 A889 I890 L891	R883-I887 HydrophobicContact CG-CD1 3.9Å; R883-I887 WeakPolarHBondContact O-CD1 3.39Å; R883-I887 VanDerWaalsContact O-CG1 3.26Å; R883-I887 WeakPolarHBondContact O-CG1 3.5Å; R883-I887 PolarHBondContact O-N 3.14Å; F884-I887 PolarHBondContact O-N 3.14Å; F884-I887 VanDerWaalsContact O-N 3.12Å; L885-I887 VanDerWaalsContact C-N 3.34Å; L885-I887 PolarHBondContact O-N 2.94Å; I887-A889 VanDerWaalsContact C-N 3.32Å; I887-A889 PolarHBondContact O-N 2.99Å; I887-I890 PolarHBondContact O-N 3.27Å; I887-L891 HydrophobicContact CG2-CD1 3.68Å; I887-L891 HydrophobicContact CG2-CG 4.19Å; I887-L891 WeakPolarHBondContact O-CB 3.49Å; I887-L891 WeakPolarHBondContact O-CG 3.34Å; I887-L891 PolarHBondContact O-N 3.42Å
888	E	98.6	Very high	97.5	Very high	58 Å²	58	44 Å²	44	27%	0.271	20%	0.197	S	C	.	.	H	α-helix	trans	-67.7	-30.3	178.7	-69.5	-57.3	138	0	0	113	F884 L885 A892 L926 Q930	F884-E888 HydrophobicContact CD2-CG 3.88Å; F884-E888 HydrophobicContact CE1-CG 4.29Å; F884-E888 HydrophobicContact CE2-CG 3.38Å; F884-E888 HydrophobicContact CZ-CG 3.63Å; F884-E888 PolarHBondContact O-N 3.27Å; L885-E888 PolarHBondContact O-N 3.27Å; E888-A892 WeakPolarHBondContact O-CB 3.43Å; E888-A892 PolarHBondContact O-N 2.86Å; E888-L926 HydrophobicContact CB-CD1 4.05Å; E888-L926 HydrophobicContact CB-CD2 4.28Å; E888-L926 HydrophobicContact CG-CD2 4.36Å; E888-Q930 PolarHBondContact O-NE2 2.92Å
889	A	98.7	Very high	97.5	Very high	3 Å²	3	47.9 Å²	47.9	3%	0.025	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-45.5	172.4	0	0	0	0	0	112	A817 L885 V886 I887 A892 I933	A817-A889 HydrophobicContact CB-CB 3.61Å; L885-A889 WeakPolarHBondContact O-CB 3.41Å; L885-A889 PolarHBondContact O-N 3.49Å; V886-A889 PolarHBondContact O-N 3.34Å; I887-A889 VanDerWaalsContact C-N 3.32Å; I887-A889 PolarHBondContact O-N 2.99Å; A889-A892 WeakPolarHBondContact O-CB 3.16Å; A889-A892 PolarHBondContact O-N 3.01Å; A889-I933 HydrophobicContact CB-CD1 4.48Å; A889-I933 HydrophobicContact CB-CG2 4.38Å
890	I	98.8	Very high	97.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.7	-44	178.1	-59.7	162.6	0	0	0	110.8	A817 M820 H821 E851 H854 A855 V886 I887 A892 T893	A817-I890 HydrophobicContact CB-CG1 3.99Å; M820-I890 HydrophobicContact CG-CD1 3.56Å; M820-I890 HydrophobicContact CG-CG1 4.46Å; M820-I890 HydrophobicContact SD-CD1 3.83Å; H821-I890 HydrophobicContact CB-CG1 4.28Å; H821-I890 HydrophobicContact CB-CG2 4.4Å; E851-I890 HydrophobicContact CB-CG2 4.44Å; E851-I890 WeakPolarHBondContact O-CG2 3.22Å; H854-I890 HydrophobicContact CB-CG2 4.43Å; A855-I890 HydrophobicContact CB-CB 4.29Å; A855-I890 HydrophobicContact CB-CD1 3.81Å; A855-I890 HydrophobicContact CB-CG2 4.07Å; V886-I890 HydrophobicContact CG1-CD1 3.77Å; V886-I890 WeakPolarHBondContact O-CD1 3.3Å; V886-I890 VanDerWaalsContact O-CG1 3.25Å; V886-I890 WeakPolarHBondContact O-CG1 3.25Å; V886-I890 PolarHBondContact O-N 3.36Å; V886-I890 VanDerWaalsContact O-N 3.11Å; I887-I890 PolarHBondContact O-N 3.27Å; I890-A892 PolarHBondContact O-N 2.98Å; I890-T893 PolarHBondContact O-N 3.31Å; I890-T893 VanDerWaalsContact O-N 3.08Å; I890-T893 PolarHBondContact O-OG1 3.34Å
891	L	98.7	Very high	97.4	Very high	29 Å²	29	43.7 Å²	43.7	15%	0.152	20%	0.2	C	C	.	.	H	α-helix	trans	-70.9	4.3	175.6	-64	-179.4	0	0	0	113.9	E851 I887 K897	E851-L891 HydrophobicContact CB-CD2 3.91Å; I887-L891 HydrophobicContact CG2-CD1 3.68Å; I887-L891 HydrophobicContact CG2-CG 4.19Å; I887-L891 WeakPolarHBondContact O-CB 3.49Å; I887-L891 WeakPolarHBondContact O-CG 3.34Å; I887-L891 PolarHBondContact O-N 3.42Å; L891-K897 PolarHBondContact O-NZ 2.91Å
892	A	98.4	Very high	97.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-92.7	-23.1	167.6	0	0	0	0	0	113.7	E888 A889 I890 D894 F901 Q930 K934	E888-A892 WeakPolarHBondContact O-CB 3.43Å; E888-A892 PolarHBondContact O-N 2.86Å; A889-A892 WeakPolarHBondContact O-CB 3.16Å; A889-A892 PolarHBondContact O-N 3.01Å; I890-A892 PolarHBondContact O-N 2.98Å; A892-D894 VanDerWaalsContact C-N 3.32Å; A892-D894 PolarHBondContact O-N 2.67Å; A892-F901 HydrophobicContact CB-CE1 4.22Å; A892-F901 HydrophobicContact CB-CE2 3.82Å; A892-F901 HydrophobicContact CB-CZ 3.57Å; A892-Q930 HydrophobicContact CB-CB 3.83Å; A892-Q930 HydrophobicContact CB-CG 3.78Å; A892-K934 HydrophobicContact CB-CG 4.38Å; A892-K934 WeakPolarHBondContact O-CD 3.33Å; A892-K934 WeakPolarHBondContact O-CE 3.39Å; A892-K934 WeakPolarHBondContact O-CG 3.49Å; A892-K934 PolarHBondContact O-NZ 2.98Å
893	T	98.6	Very high	97.2	Very high	7 Å²	7	44.5 Å²	44.5	4%	0.043	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-37.4	-178.1	60.3	0	0	0	0	111.9	H821 I890 L895 I933 K934 D937	H821-T893 HydrophobicContact CB-CG2 4.29Å; I890-T893 PolarHBondContact O-N 3.31Å; I890-T893 VanDerWaalsContact O-N 3.08Å; I890-T893 PolarHBondContact O-OG1 3.34Å; T893-L895 PolarHBondContact O-N 3.39Å; T893-I933 HydrophobicContact CG2-CD1 4.47Å; T893-I933 HydrophobicContact CG2-CG1 4.42Å; T893-K934 PolarHBondContact O-NZ 2.83Å; T893-D937 WeakPolarHBondContact CB-OD2 3.3Å
894	D	98.2	Very high	97	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.032	23%	0.225	C	C	.	.			trans	-38.6	104.1	177.4	-174.4	-1	0	0	0	113.1	S848 E851 A892 K896 K897	S848-D894 VanDerWaalsContact CB-OD2 3.29Å; S848-D894 WeakPolarHBondContact CB-OD2 3.29Å; S848-D894 PolarHBondContact OG-OD2 3.24Å; E851-D894 HydrophobicContact CG-CB 3.92Å; E851-D894 VanDerWaalsContact OE1-CA 3.23Å; E851-D894 WeakPolarHBondContact OE1-CA 3.41Å; E851-D894 VanDerWaalsContact OE1-CB 3.31Å; E851-D894 WeakPolarHBondContact OE1-CB 3.39Å; A892-D894 VanDerWaalsContact C-N 3.32Å; A892-D894 PolarHBondContact O-N 2.67Å; D894-K896 PolarHBondContact O-N 3.33Å; D894-K896 VanDerWaalsContact O-N 3.11Å; D894-K896 WeakPolarHBondContact OD1-CB 3.37Å; D894-K896 PolarHBondContact OD1-N 3.37Å; D894-K897 PolarHBondContact O-N 2.97Å
895	L	93.4	Very high	97	Very high	77 Å²	77	40.4 Å²	40.4	40%	0.403	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-64	-18.5	-176.4	-64.5	178.6	0	0	0	112.4	T893 K897 H898 I938 I995	T893-L895 PolarHBondContact O-N 3.39Å; L895-K897 PolarHBondContact O-N 3.24Å; L895-H898 WeakPolarHBondContact O-CB 3.31Å; L895-H898 PolarHBondContact O-N 2.72Å; L895-I938 HydrophobicContact CD2-CG2 4.29Å; L895-I995 HydrophobicContact CD2-CG2 4.47Å
896	K	93.1	Very high	96.8	Very high	118 Å²	118	42.2 Å²	42.2	51%	0.513	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-61.6	-26.3	171.6	-172.4	177.5	176.3	-179.9	0	113	P320 D846 D894	P320-K896 HydrophobicContact CG-CG 4.24Å; D846-K896 PolarHBondContact O-NZ 3.47Å; D894-K896 PolarHBondContact O-N 3.33Å; D894-K896 VanDerWaalsContact O-N 3.11Å; D894-K896 WeakPolarHBondContact OD1-CB 3.37Å; D894-K896 PolarHBondContact OD1-N 3.37Å
897	K	93.1	Very high	96.5	Very high	60 Å²	60	45 Å²	45	26%	0.261	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-97.4	2.9	176.1	-65.9	173.6	61.1	-163.2	0	113.1	L891 D894 L895 F899 D900 F901	L891-K897 PolarHBondContact O-NZ 2.91Å; D894-K897 PolarHBondContact O-N 2.97Å; L895-K897 PolarHBondContact O-N 3.24Å; K897-F899 PolarHBondContact O-N 2.89Å; K897-D900 WeakPolarHBondContact O-CB 3.24Å; K897-D900 PolarHBondContact O-N 3.29Å; K897-D900 VanDerWaalsContact O-N 3.1Å; K897-F901 HydrophobicContact CB-CD2 3.92Å; K897-F901 HydrophobicContact CB-CE2 3.84Å; K897-F901 HydrophobicContact CD-CE2 4.23Å; K897-F901 VanDerWaalsContact CE-CE2 3.43Å; K897-F901 VanDerWaalsContact NZ-CZ 3.3Å; K897-F901 WeakPolarHBondContact O-CD2 3.43Å; K897-F901 PolarHBondContact O-N 3.41Å
898	H	94.9	Very high	96.3	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.009	24%	0.24	C	C	.	.	H	α-helix	trans	-53.4	-50.4	-171.7	177.1	104.3	0	0	0	112.7	L895 D900 F901 L902 I995	L895-H898 WeakPolarHBondContact O-CB 3.31Å; L895-H898 PolarHBondContact O-N 2.72Å; H898-D900 VanDerWaalsContact C-N 3.33Å; H898-D900 PolarHBondContact O-N 2.93Å; H898-F901 PolarHBondContact O-N 2.99Å; H898-L902 WeakPolarHBondContact O-CB 3.49Å; H898-L902 PolarHBondContact O-N 3.26Å; H898-I995 VanDerWaalsContact CE1-CG2 3.41Å; H898-I995 WeakPolarHBondContact CE1-CG2 3.49Å; H898-I995 PolarHBondContact CE1-O 2.85Å; H898-I995 VanDerWaalsContact CE1-O 3.27Å; H898-I995 PolarHBondContact NE2-O 3.26Å
899	F	96	Very high	95.9	Very high	120 Å²	120	44.3 Å²	44.3	53%	0.526	24%	0.235	S	C	.	.	H	α-helix	trans	-70.9	-25.7	-178.8	-60	-67.7	0	0	0	113.8	K897 A903 I995	K897-F899 PolarHBondContact O-N 2.89Å; F899-A903 VanDerWaalsContact O-CB 3.28Å; F899-A903 WeakPolarHBondContact O-CB 3.23Å; F899-A903 PolarHBondContact O-N 3.35Å; F899-I995 HydrophobicContact CE2-CD1 4.35Å; F899-I995 HydrophobicContact CZ-CD1 3.89Å
900	D	96.6	Very high	95.5	Very high	108 Å²	108	46.2 Å²	46.2	58%	0.578	24%	0.244	S	C	*	.	H	α-helix	trans	-65.8	-52.4	174.6	-60.9	-38.2	0	0	0	109.8	K897 H898 L902 A903 E904	K897-D900 WeakPolarHBondContact O-CB 3.24Å; K897-D900 PolarHBondContact O-N 3.29Å; K897-D900 VanDerWaalsContact O-N 3.1Å; H898-D900 VanDerWaalsContact C-N 3.33Å; H898-D900 PolarHBondContact O-N 2.93Å; D900-L902 VanDerWaalsContact C-N 3.34Å; D900-L902 PolarHBondContact O-N 3.1Å; D900-A903 PolarHBondContact O-N 3.4Å; D900-E904 PolarHBondContact O-N 2.91Å
901	F	96.9	Very high	94.9	Very high	13 Å²	13	49.9 Å²	49.9	6%	0.057	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-40.6	175.9	-75.8	-68.5	0	0	0	112.4	A892 K897 H898 A903 E904 F905 L927 Q930 K934	A892-F901 HydrophobicContact CB-CE1 4.22Å; A892-F901 HydrophobicContact CB-CE2 3.82Å; A892-F901 HydrophobicContact CB-CZ 3.57Å; K897-F901 HydrophobicContact CB-CD2 3.92Å; K897-F901 HydrophobicContact CB-CE2 3.84Å; K897-F901 HydrophobicContact CD-CE2 4.23Å; K897-F901 VanDerWaalsContact CE-CE2 3.43Å; K897-F901 VanDerWaalsContact NZ-CZ 3.3Å; K897-F901 WeakPolarHBondContact O-CD2 3.43Å; K897-F901 PolarHBondContact O-N 3.41Å; H898-F901 PolarHBondContact O-N 2.99Å; F901-A903 VanDerWaalsContact C-N 3.34Å; F901-A903 PolarHBondContact O-N 3.23Å; F901-E904 PolarHBondContact O-N 3.14Å; F901-F905 VanDerWaalsContact O-CB 3.26Å; F901-F905 WeakPolarHBondContact O-CB 3.29Å; F901-F905 PolarHBondContact O-N 2.64Å; F901-L927 HydrophobicContact CD1-CD1 4.19Å; F901-Q930 HydrophobicContact CE1-CB 4.34Å; F901-Q930 HydrophobicContact CE1-CG 4.48Å; F901-K934 HydrophobicContact CB-CD 4.43Å; F901-K934 HydrophobicContact CD2-CD 4.1Å; F901-K934 HydrophobicContact CG-CD 4.43Å
902	L	96.2	Very high	94	Very high	16 Å²	16	55.3 Å²	55.3	8%	0.084	30%	0.298	C	S	.	.	H	α-helix	trans	-66.3	-37.3	-179.8	-167.1	64.8	0	0	0	111.8	H898 D900 N906 P998 L999 S1002	H898-L902 WeakPolarHBondContact O-CB 3.49Å; H898-L902 PolarHBondContact O-N 3.26Å; D900-L902 VanDerWaalsContact C-N 3.34Å; D900-L902 PolarHBondContact O-N 3.1Å; L902-N906 WeakPolarHBondContact O-CB 3.35Å; L902-N906 PolarHBondContact O-N 2.83Å; L902-N906 VanDerWaalsContact O-N 3.08Å; L902-N906 PolarHBondContact O-ND2 3.5Å; L902-P998 HydrophobicContact CD2-CB 3.75Å; L902-L999 HydrophobicContact CD1-CD1 4Å; L902-S1002 WeakPolarHBondContact CD1-OG 3.5Å
903	A	96.1	Very high	93.2	Very high	63 Å²	63	62.5 Å²	62.5	52%	0.521	34%	0.337	S	S	.	.	H	α-helix	trans	-69.6	-44	174.5	0	0	0	0	0	112	F899 D900 F901 N906 A907	F899-A903 VanDerWaalsContact O-CB 3.28Å; F899-A903 WeakPolarHBondContact O-CB 3.23Å; F899-A903 PolarHBondContact O-N 3.35Å; D900-A903 PolarHBondContact O-N 3.4Å; F901-A903 VanDerWaalsContact C-N 3.34Å; F901-A903 PolarHBondContact O-N 3.23Å; A903-N906 PolarHBondContact O-N 2.62Å; A903-A907 WeakPolarHBondContact O-CB 3.32Å; A903-A907 PolarHBondContact O-N 3.39Å
904	E	96.1	Very high	92.5	Very high	114 Å²	114	64.1 Å²	64.1	53%	0.533	35%	0.348	S	S	.	.	H	α-helix	trans	-63	-42.9	177.6	-170.8	170.4	-177.1	0	0	111.8	D900 F901 A907 K908 L927	D900-E904 PolarHBondContact O-N 2.91Å; F901-E904 PolarHBondContact O-N 3.14Å; E904-A907 PolarHBondContact O-N 3.04Å; E904-K908 WeakPolarHBondContact O-CG 3.44Å; E904-K908 PolarHBondContact O-N 2.87Å; E904-L927 HydrophobicContact CG-CD1 4.37Å; E904-L927 HydrophobicContact CG-CD2 3.98Å
905	F	97.2	Very high	91.6	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-64.6	-46.7	176.1	-178.7	-103.4	0	0	0	112.6	F901 A907 K908 A909 I917 L927 V928 V931 Y1003 A1006 L1008	F901-F905 VanDerWaalsContact O-CB 3.26Å; F901-F905 WeakPolarHBondContact O-CB 3.29Å; F901-F905 PolarHBondContact O-N 2.64Å; F905-A907 VanDerWaalsContact C-N 3.33Å; F905-A907 PolarHBondContact O-N 2.92Å; F905-K908 PolarHBondContact O-N 2.82Å; F905-A909 HydrophobicContact CE1-CB 4.1Å; F905-A909 HydrophobicContact CE2-CB 4.12Å; F905-A909 HydrophobicContact CZ-CB 3.89Å; F905-A909 PolarHBondContact O-N 3.1Å; F905-I917 HydrophobicContact CE2-CD1 4.42Å; F905-L927 HydrophobicContact CB-CD2 4.41Å; F905-L927 HydrophobicContact CB-CG 4.42Å; F905-L927 HydrophobicContact CD2-CG 4.26Å; F905-V928 HydrophobicContact CE2-CG2 4.22Å; F905-V931 HydrophobicContact CB-CG2 3.84Å; F905-V931 HydrophobicContact CD1-CG1 4.39Å; F905-V931 HydrophobicContact CD1-CG2 4.49Å; F905-V931 HydrophobicContact CD2-CB 4.29Å; F905-V931 HydrophobicContact CD2-CG1 4.48Å; F905-V931 HydrophobicContact CD2-CG2 3.79Å; F905-V931 HydrophobicContact CE1-CG1 4.43Å; F905-V931 HydrophobicContact CE2-CG2 4.48Å; F905-V931 HydrophobicContact CG-CG1 4.41Å; F905-V931 HydrophobicContact CG-CG2 3.78Å; F905-V931 HydrophobicContact CZ-CG1 4.49Å; F905-Y1003 HydrophobicContact CE1-CD2 4.39Å; F905-Y1003 AromaticContact CZ-CD2 3.94Å; F905-Y1003 HydrophobicContact CZ-CD2 3.94Å; F905-A1006 HydrophobicContact CE1-CB 3.84Å; F905-A1006 HydrophobicContact CZ-CB 3.54Å; F905-L1008 HydrophobicContact CE2-CD1 4.19Å; F905-L1008 HydrophobicContact CZ-CD1 3.93Å
906	N	95.4	Very high	91.3	Very high	50 Å²	50	69.7 Å²	69.7	27%	0.267	38%	0.384	S	S	.	.	H	α-helix	trans	-62.6	-39.6	177.5	-84.4	-71.3	0	0	0	112.3	L902 A903 K908 N910 D911 S1002	L902-N906 WeakPolarHBondContact O-CB 3.35Å; L902-N906 PolarHBondContact O-N 2.83Å; L902-N906 VanDerWaalsContact O-N 3.08Å; L902-N906 PolarHBondContact O-ND2 3.5Å; A903-N906 PolarHBondContact O-N 2.62Å; N906-K908 PolarHBondContact O-N 2.8Å; N906-N910 CarbonylContact O-C 3.59Å; N906-N910 PolarHBondContact O-N 2.98Å; N906-N910 PolarHBondContact OD1-ND2 2.95Å; N906-D911 PolarHBondContact O-N 2.83Å; N906-S1002 WeakPolarHBondContact ND2-CB 3.5Å; N906-S1002 PolarHBondContact ND2-OG 3.26Å
907	A	93.8	Very high	91.3	Very high	57 Å²	57	65.3 Å²	65.3	47%	0.471	37%	0.366	S	S	.	.	H	α-helix	trans	-64.4	-17	175.2	0	0	0	0	0	113.8	A903 E904 F905	A903-A907 WeakPolarHBondContact O-CB 3.32Å; A903-A907 PolarHBondContact O-N 3.39Å; E904-A907 PolarHBondContact O-N 3.04Å; F905-A907 VanDerWaalsContact C-N 3.33Å; F905-A907 PolarHBondContact O-N 2.92Å
908	K	92.7	Very high	91.3	Very high	70 Å²	70	67.5 Å²	67.5	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-98.7	-53.6	176.7	-76.3	-62.4	-160.9	129.5	0	113.2	E904 F905 N906 S914 G916 I917 D924 L927	E904-K908 WeakPolarHBondContact O-CG 3.44Å; E904-K908 PolarHBondContact O-N 2.87Å; F905-K908 PolarHBondContact O-N 2.82Å; N906-K908 PolarHBondContact O-N 2.8Å; K908-S914 WeakPolarHBondContact O-CB 3.34Å; K908-S914 PolarHBondContact O-OG 3.19Å; K908-G916 CarbonylContact O-C 3.56Å; K908-I917 HydrophobicContact CB-CD1 4.29Å; K908-D924 WeakPolarHBondContact CE-OD1 3.44Å; K908-D924 IonicContact NZ-OD1 2.96Å; K908-D924 PolarHBondContact NZ-OD1 3.29Å; K908-D924 IonicContact NZ-OD2 3.85Å; K908-D924 PolarHBondContact NZ-OD2 2.69Å; K908-L927 HydrophobicContact CB-CD2 4.36Å; K908-L927 HydrophobicContact CG-CD2 4.08Å
909	A	91.6	Very high	91.2	Very high	18 Å²	18	68.7 Å²	68.7	15%	0.149	38%	0.381	C	S	.	.	H	α-helix	trans	-82.7	-40.9	-173.3	0	0	0	0	0	113.3	F905 I917 A1006	F905-A909 HydrophobicContact CE1-CB 4.1Å; F905-A909 HydrophobicContact CE2-CB 4.12Å; F905-A909 HydrophobicContact CZ-CB 3.89Å; F905-A909 PolarHBondContact O-N 3.1Å; A909-I917 HydrophobicContact CB-CD1 4.04Å; A909-I917 HydrophobicContact CB-CG1 4.12Å; A909-A1006 HydrophobicContact CB-CB 3.67Å
910	N	88.9	Confident	91.1	Very high	42 Å²	42	67.1 Å²	67.1	23%	0.225	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-10.3	-158.2	-62.3	-19.9	0	0	0	114.5	N906 V912 S1002 A1006	N906-N910 CarbonylContact O-C 3.59Å; N906-N910 PolarHBondContact O-N 2.98Å; N906-N910 PolarHBondContact OD1-ND2 2.95Å; N910-V912 PolarHBondContact O-N 3.45Å; N910-S1002 PolarHBondContact ND2-O 3.12Å; N910-A1006 WeakPolarHBondContact OD1-CA 3.39Å; N910-A1006 WeakPolarHBondContact OD1-CB 3.33Å; N910-A1006 PolarHBondContact OD1-N 2.92Å; N910-A1006 VanDerWaalsContact OD1-N 3.12Å
911	D	87.5	Confident	91	Very high	78 Å²	78	63.8 Å²	63.8	42%	0.417	37%	0.368	S	S	.	.			trans	-67.2	128.6	174.1	-171	-11.3	0	0	0	110.6	N906 N913 S914	N906-D911 PolarHBondContact O-N 2.83Å; D911-N913 PolarHBondContact O-N 3.21Å; D911-N913 VanDerWaalsContact O-N 3.1Å; D911-N913 PolarHBondContact OD1-N 2.82Å; D911-S914 WeakPolarHBondContact O-CB 3.39Å; D911-S914 PolarHBondContact O-N 3.13Å
912	V	80.2	Confident	90.9	Very high	143 Å²	143	67.9 Å²	67.9	87%	0.867	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-21.3	175.6	-176.4	0	0	0	0	112.1	N910	N910-V912 PolarHBondContact O-N 3.45Å
913	N	81.4	Confident	90.9	Very high	151 Å²	151	72.7 Å²	72.7	81%	0.807	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-2.9	175.2	-83.1	95.5	0	0	0	114.6	D911	D911-N913 PolarHBondContact O-N 3.21Å; D911-N913 VanDerWaalsContact O-N 3.1Å; D911-N913 PolarHBondContact OD1-N 2.82Å
914	S	84.1	Confident	91	Very high	41 Å²	41	70.1 Å²	70.1	29%	0.287	39%	0.39	S	S	.	.	S	Bend	trans	-90.3	163.4	174.3	-171.8	0	0	0	0	112.2	K908 D911 G916	K908-S914 WeakPolarHBondContact O-CB 3.34Å; K908-S914 PolarHBondContact O-OG 3.19Å; D911-S914 WeakPolarHBondContact O-CB 3.39Å; D911-S914 PolarHBondContact O-N 3.13Å; S914-G916 VanDerWaalsContact C-N 3.31Å; S914-G916 PolarHBondContact OG-N 2.89Å
915	N	78.8	Confident	91	Very high	175 Å²	175	65.5 Å²	65.5	94%	0.936	37%	0.368	S	S	*	.			trans	-89.8	4.9	168.9	-67.2	-24.9	0	0	0	112.6
916	G	87.7	Confident	91.1	Very high	24 Å²	24	66.6 Å²	66.6	25%	0.247	37%	0.374	C	S	.	.			trans	81.3	-165	-169.3	0	0	0	0	0	112.9	K908 S914 E918	K908-G916 CarbonylContact O-C 3.56Å; S914-G916 VanDerWaalsContact C-N 3.31Å; S914-G916 PolarHBondContact OG-N 2.89Å; G916-E918 PolarHBondContact O-N 3.29Å
917	I	92.1	Very high	91.2	Very high	26 Å²	26	64.5 Å²	64.5	13%	0.133	36%	0.363	C	S	.	.			trans	-72.8	117.3	179.3	-63.4	-61.7	0	0	0	110.8	F905 K908 A909 W919 D924 V928	F905-I917 HydrophobicContact CE2-CD1 4.42Å; K908-I917 HydrophobicContact CB-CD1 4.29Å; A909-I917 HydrophobicContact CB-CD1 4.04Å; A909-I917 HydrophobicContact CB-CG1 4.12Å; I917-W919 HydrophobicContact CB-CZ2 4.39Å; I917-W919 HydrophobicContact CG2-CD2 3.79Å; I917-W919 HydrophobicContact CG2-CE3 4.04Å; I917-W919 HydrophobicContact CG2-CG 4.3Å; I917-W919 HydrophobicContact CG2-CH2 4.19Å; I917-W919 HydrophobicContact CG2-CZ2 3.95Å; I917-W919 HydrophobicContact CG2-CZ3 4.23Å; I917-W919 PolarHBondContact O-N 3.39Å; I917-D924 HydrophobicContact CG2-CB 4.4Å; I917-V928 HydrophobicContact CD1-CG2 4Å; I917-V928 HydrophobicContact CG1-CG2 4.14Å; I917-V928 HydrophobicContact CG2-CG2 4.12Å
918	E	92.5	Very high	91.5	Very high	107 Å²	107	61.8 Å²	61.8	50%	0.5	34%	0.34	S	S	.	.			trans	-86.3	95.7	172.7	-163.4	-154.8	127.1	0	0	110.3	G916 S920 N921	G916-E918 PolarHBondContact O-N 3.29Å; E918-S920 WeakPolarHBondContact CG-OG 3.47Å; E918-S920 PolarHBondContact O-N 3.22Å; E918-S920 WeakPolarHBondContact OE1-CB 3.22Å; E918-S920 PolarHBondContact OE1-OG 3.43Å; E918-N921 HydrophobicContact CB-CB 4.26Å; E918-N921 WeakPolarHBondContact O-CB 3.49Å; E918-N921 PolarHBondContact O-N 3.31Å
919	W	93.9	Very high	91.7	Very high	26 Å²	26	58.9 Å²	58.9	10%	0.098	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17	-175.4	-58.1	96	0	0	0	115.1	L760 I763 L802 N805 I806 I917 R925 V928 L1008	L760-W919 HydrophobicContact CD1-CZ2 3.97Å; I763-W919 HydrophobicContact CD1-CB 3.93Å; I763-W919 HydrophobicContact CD1-CG 4.07Å; L802-W919 HydrophobicContact CG-CH2 4.25Å; N805-W919 HydrophobicContact CB-CB 4.39Å; N805-W919 HydrophobicContact CB-CD2 3.62Å; N805-W919 HydrophobicContact CB-CE3 3.59Å; N805-W919 HydrophobicContact CB-CG 3.98Å; N805-W919 HydrophobicContact CB-CZ3 4.14Å; N805-W919 PolarHBondContact ND2-NE1 3.36Å; I806-W919 HydrophobicContact CD1-CZ3 4.04Å; I806-W919 HydrophobicContact CG1-CE3 4.16Å; I806-W919 HydrophobicContact CG1-CZ3 3.8Å; I917-W919 HydrophobicContact CB-CZ2 4.39Å; I917-W919 HydrophobicContact CG2-CD2 3.79Å; I917-W919 HydrophobicContact CG2-CE3 4.04Å; I917-W919 HydrophobicContact CG2-CG 4.3Å; I917-W919 HydrophobicContact CG2-CH2 4.19Å; I917-W919 HydrophobicContact CG2-CZ2 3.95Å; I917-W919 HydrophobicContact CG2-CZ3 4.23Å; I917-W919 PolarHBondContact O-N 3.39Å; W919-R925 HydrophobicContact CE3-CG 4.22Å; W919-R925 WeakPolarHBondContact O-CD 3.46Å; W919-R925 WeakPolarHBondContact O-CG 3.4Å; W919-R925 PolarHBondContact O-NH1 3.06Å; W919-V928 HydrophobicContact CH2-CG1 4.18Å; W919-V928 HydrophobicContact CH2-CG2 4.27Å; W919-V928 HydrophobicContact CZ3-CG1 4.18Å; W919-V928 HydrophobicContact CZ3-CG2 4.32Å; W919-L1008 HydrophobicContact CH2-CD2 3.88Å; W919-L1008 HydrophobicContact CZ2-CD2 3.77Å
920	S	92.8	Very high	92.1	Very high	88 Å²	88	58.7 Å²	58.7	62%	0.615	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-30.5	169.1	23.1	0	0	0	0	113.2	E918 R925	E918-S920 WeakPolarHBondContact CG-OG 3.47Å; E918-S920 PolarHBondContact O-N 3.22Å; E918-S920 WeakPolarHBondContact OE1-CB 3.22Å; E918-S920 PolarHBondContact OE1-OG 3.43Å; S920-R925 PolarHBondContact O-NH1 2.73Å
921	N	94.9	Very high	92.5	Very high	38 Å²	38	56.7 Å²	56.7	20%	0.203	31%	0.314	C	S	.	.			trans	-78.8	120.8	-178.1	174	9.2	0	0	0	111.4	E918 N923 D924 R925	E918-N921 HydrophobicContact CB-CB 4.26Å; E918-N921 WeakPolarHBondContact O-CB 3.49Å; E918-N921 PolarHBondContact O-N 3.31Å; N921-N923 VanDerWaalsContact C-N 3.29Å; N921-N923 PolarHBondContact O-N 2.89Å; N921-N923 PolarHBondContact OD1-N 2.98Å; N921-N923 PolarHBondContact OD1-ND2 2.92Å; N921-D924 HydrophobicContact CB-CB 4.31Å; N921-D924 PolarHBondContact ND2-OD1 3.33Å; N921-D924 PolarHBondContact ND2-OD2 2.8Å; N921-D924 PolarHBondContact O-N 2.9Å; N921-R925 PolarHBondContact O-N 3.27Å
922	E	95.6	Very high	93.1	Very high	99 Å²	99	53 Å²	53	46%	0.463	29%	0.294	S	S	.	.	H	α-helix	trans	-63	-32.5	-177.6	-50.2	-164.6	157	0	0	113.7	R881 L926	R881-E922 IonicContact CZ-OE1 3.43Å; R881-E922 IonicContact CZ-OE2 2.99Å; R881-E922 VanDerWaalsContact CZ-OE2 3.28Å; R881-E922 VanDerWaalsContact NH1-CD 3.3Å; R881-E922 IonicContact NH1-OE1 3.16Å; R881-E922 PolarHBondContact NH1-OE1 2.73Å; R881-E922 IonicContact NH1-OE2 2.74Å; R881-E922 PolarHBondContact NH1-OE2 2.74Å; R881-E922 IonicContact NH2-OE1 3.25Å; R881-E922 PolarHBondContact NH2-OE1 3.35Å; R881-E922 IonicContact NH2-OE2 2.67Å; R881-E922 PolarHBondContact NH2-OE2 3.25Å; E922-L926 WeakPolarHBondContact O-CB 3.23Å; E922-L926 PolarHBondContact O-N 3.34Å
923	N	96.6	Very high	94	Very high	116 Å²	116	46.2 Å²	46.2	62%	0.62	25%	0.253	S	S	*	.	H	α-helix	trans	-71.7	-37.1	-179.1	-53.4	-74.3	0	0	0	111	N921 L926 L927	N921-N923 VanDerWaalsContact C-N 3.29Å; N921-N923 PolarHBondContact O-N 2.89Å; N921-N923 PolarHBondContact OD1-N 2.98Å; N921-N923 PolarHBondContact OD1-ND2 2.92Å; N923-L926 PolarHBondContact O-N 2.84Å; N923-L927 WeakPolarHBondContact O-CB 3.39Å; N923-L927 PolarHBondContact O-N 3.18Å
924	D	96.7	Very high	94.8	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.053	22%	0.215	C	C	.	.	H	α-helix	trans	-74	-35.6	-178.7	-64.5	6.6	0	0	0	110	K908 I917 N921 L927 V928	K908-D924 WeakPolarHBondContact CE-OD1 3.44Å; K908-D924 IonicContact NZ-OD1 2.96Å; K908-D924 PolarHBondContact NZ-OD1 3.29Å; K908-D924 IonicContact NZ-OD2 3.85Å; K908-D924 PolarHBondContact NZ-OD2 2.69Å; I917-D924 HydrophobicContact CG2-CB 4.4Å; N921-D924 HydrophobicContact CB-CB 4.31Å; N921-D924 PolarHBondContact ND2-OD1 3.33Å; N921-D924 PolarHBondContact ND2-OD2 2.8Å; N921-D924 PolarHBondContact O-N 2.9Å; D924-L927 PolarHBondContact O-N 3.1Å; D924-V928 WeakPolarHBondContact O-CG2 3.38Å; D924-V928 PolarHBondContact O-N 3.44Å
925	R	97.6	Very high	95.5	Very high	17 Å²	17	37.3 Å²	37.3	6%	0.064	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-42.2	168.5	-65.3	-159.8	-53.7	-80.3	-3.9	112.9	N805 E810 W919 S920 N921 L927 V928 C929	N805-R925 WeakPolarHBondContact O-CD 3.28Å; E810-R925 IonicContact OE1-CZ 3.5Å; E810-R925 IonicContact OE1-NE 2.82Å; E810-R925 IonicContact OE1-NH2 3.21Å; E810-R925 PolarHBondContact OE1-NH2 2.62Å; E810-R925 IonicContact OE2-CZ 2.68Å; E810-R925 IonicContact OE2-NE 2.67Å; E810-R925 PolarHBondContact OE2-NE 3.04Å; E810-R925 IonicContact OE2-NH2 3.87Å; E810-R925 PolarHBondContact OE2-NH2 3.4Å; W919-R925 HydrophobicContact CE3-CG 4.22Å; W919-R925 WeakPolarHBondContact O-CD 3.46Å; W919-R925 WeakPolarHBondContact O-CG 3.4Å; W919-R925 PolarHBondContact O-NH1 3.06Å; S920-R925 PolarHBondContact O-NH1 2.73Å; N921-R925 PolarHBondContact O-N 3.27Å; R925-L927 VanDerWaalsContact C-N 3.35Å; R925-V928 PolarHBondContact O-N 3.3Å; R925-C929 PolarHBondContact O-N 2.84Å; R925-C929 PolarHBondContact O-SG 2.82Å
926	L	98.3	Very high	96.4	Very high	22 Å²	22	29 Å²	29	12%	0.115	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-43.7	175.6	175.1	57.9	0	0	0	111.2	F884 L885 E888 E922 N923 V928 C929 Q930	F884-L926 HydrophobicContact CE1-CD2 4.16Å; F884-L926 HydrophobicContact CZ-CD2 4.19Å; L885-L926 HydrophobicContact CD2-CD1 4Å; E888-L926 HydrophobicContact CB-CD1 4.05Å; E888-L926 HydrophobicContact CB-CD2 4.28Å; E888-L926 HydrophobicContact CG-CD2 4.36Å; E922-L926 WeakPolarHBondContact O-CB 3.23Å; E922-L926 PolarHBondContact O-N 3.34Å; N923-L926 PolarHBondContact O-N 2.84Å; L926-V928 PolarHBondContact O-N 3.47Å; L926-C929 CarbonylContact O-C 3.6Å; L926-C929 WeakPolarHBondContact O-CB 3.37Å; L926-C929 PolarHBondContact O-N 2.94Å; L926-C929 VanDerWaalsContact O-N 3.13Å; L926-Q930 HydrophobicContact CD1-CG 4.1Å; L926-Q930 HydrophobicContact CG-CG 4.43Å; L926-Q930 WeakPolarHBondContact O-CG 3.46Å; L926-Q930 PolarHBondContact O-N 3.46Å
927	L	98.4	Very high	97	Very high	7 Å²	7	28.7 Å²	28.7	4%	0.037	15%	0.15	C	C	.	.	H	α-helix	trans	-62.8	-40.2	177.2	-175	61.8	0	0	0	111.9	F901 E904 F905 K908 N923 D924 R925 Q930 V931	F901-L927 HydrophobicContact CD1-CD1 4.19Å; E904-L927 HydrophobicContact CG-CD1 4.37Å; E904-L927 HydrophobicContact CG-CD2 3.98Å; F905-L927 HydrophobicContact CB-CD2 4.41Å; F905-L927 HydrophobicContact CB-CG 4.42Å; F905-L927 HydrophobicContact CD2-CG 4.26Å; K908-L927 HydrophobicContact CB-CD2 4.36Å; K908-L927 HydrophobicContact CG-CD2 4.08Å; N923-L927 WeakPolarHBondContact O-CB 3.39Å; N923-L927 PolarHBondContact O-N 3.18Å; D924-L927 PolarHBondContact O-N 3.1Å; R925-L927 VanDerWaalsContact C-N 3.35Å; L927-Q930 PolarHBondContact O-N 3.35Å; L927-V931 WeakPolarHBondContact O-CG2 3.36Å; L927-V931 PolarHBondContact O-N 3.47Å
928	V	98.4	Very high	97.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.7	-45	170.5	169.4	0	0	0	0	111.3	L802 I806 F905 I917 W919 D924 R925 L926 Q930 V931 C932 L1008	L802-V928 HydrophobicContact CD2-CG1 3.77Å; I806-V928 HydrophobicContact CD1-CG1 4.06Å; F905-V928 HydrophobicContact CE2-CG2 4.22Å; I917-V928 HydrophobicContact CD1-CG2 4Å; I917-V928 HydrophobicContact CG1-CG2 4.14Å; I917-V928 HydrophobicContact CG2-CG2 4.12Å; W919-V928 HydrophobicContact CH2-CG1 4.18Å; W919-V928 HydrophobicContact CH2-CG2 4.27Å; W919-V928 HydrophobicContact CZ3-CG1 4.18Å; W919-V928 HydrophobicContact CZ3-CG2 4.32Å; D924-V928 WeakPolarHBondContact O-CG2 3.38Å; D924-V928 PolarHBondContact O-N 3.44Å; R925-V928 PolarHBondContact O-N 3.3Å; L926-V928 PolarHBondContact O-N 3.47Å; V928-Q930 VanDerWaalsContact C-N 3.35Å; V928-Q930 PolarHBondContact O-N 3.38Å; V928-V931 PolarHBondContact O-N 2.91Å; V928-C932 VanDerWaalsContact O-CB 3.22Å; V928-C932 WeakPolarHBondContact O-CB 3.45Å; V928-C932 PolarHBondContact O-N 3.31Å; V928-L1008 HydrophobicContact CG1-CD1 4.07Å; V928-L1008 HydrophobicContact CG2-CD1 4Å
929	C	98.8	Very high	97.5	Very high	9 Å²	9	22.9 Å²	22.9	6%	0.061	12%	0.123	C	C	.	.	H	α-helix	trans	-62.1	-41	176.5	-66.5	0	0	0	0	112.2	L814 R925 L926 C932 I933	L814-C929 HydrophobicContact CD1-CB 4.26Å; L814-C929 WeakPolarHBondContact CD1-O 3.45Å; R925-C929 PolarHBondContact O-N 2.84Å; R925-C929 PolarHBondContact O-SG 2.82Å; L926-C929 CarbonylContact O-C 3.6Å; L926-C929 WeakPolarHBondContact O-CB 3.37Å; L926-C929 PolarHBondContact O-N 2.94Å; L926-C929 VanDerWaalsContact O-N 3.13Å; C929-C932 PolarHBondContact O-N 3.24Å; C929-I933 PolarHBondContact O-N 2.72Å
930	Q	98.8	Very high	97.7	Very high	13 Å²	13	21.9 Å²	21.9	6%	0.061	12%	0.12	C	C	.	.	H	α-helix	trans	-65	-46.2	177.1	-74.4	175.6	-46.3	0	0	111.4	E888 A892 F901 L926 L927 V928 C932 I933 K934	E888-Q930 PolarHBondContact O-NE2 2.92Å; A892-Q930 HydrophobicContact CB-CB 3.83Å; A892-Q930 HydrophobicContact CB-CG 3.78Å; F901-Q930 HydrophobicContact CE1-CB 4.34Å; F901-Q930 HydrophobicContact CE1-CG 4.48Å; L926-Q930 HydrophobicContact CD1-CG 4.1Å; L926-Q930 HydrophobicContact CG-CG 4.43Å; L926-Q930 WeakPolarHBondContact O-CG 3.46Å; L926-Q930 PolarHBondContact O-N 3.46Å; L927-Q930 PolarHBondContact O-N 3.35Å; V928-Q930 VanDerWaalsContact C-N 3.35Å; V928-Q930 PolarHBondContact O-N 3.38Å; Q930-C932 VanDerWaalsContact C-N 3.31Å; Q930-C932 PolarHBondContact O-N 2.96Å; Q930-I933 VanDerWaalsContact O-CG2 3.27Å; Q930-I933 WeakPolarHBondContact O-CG2 3.36Å; Q930-I933 PolarHBondContact O-N 3.13Å; Q930-K934 WeakPolarHBondContact O-CB 3.38Å; Q930-K934 VanDerWaalsContact O-CG 3.29Å; Q930-K934 WeakPolarHBondContact O-CG 3.35Å; Q930-K934 PolarHBondContact O-N 2.95Å
931	V	98.6	Very high	98	Very high	1 Å²	1	18 Å²	18	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-66.4	-34.9	175.8	175.8	0	0	0	0	111.5	F905 L927 V928 K934 L935 L999 Y1003	F905-V931 HydrophobicContact CB-CG2 3.84Å; F905-V931 HydrophobicContact CD1-CG1 4.39Å; F905-V931 HydrophobicContact CD1-CG2 4.49Å; F905-V931 HydrophobicContact CD2-CB 4.29Å; F905-V931 HydrophobicContact CD2-CG1 4.48Å; F905-V931 HydrophobicContact CD2-CG2 3.79Å; F905-V931 HydrophobicContact CE1-CG1 4.43Å; F905-V931 HydrophobicContact CE2-CG2 4.48Å; F905-V931 HydrophobicContact CG-CG1 4.41Å; F905-V931 HydrophobicContact CG-CG2 3.78Å; F905-V931 HydrophobicContact CZ-CG1 4.49Å; L927-V931 WeakPolarHBondContact O-CG2 3.36Å; L927-V931 PolarHBondContact O-N 3.47Å; V928-V931 PolarHBondContact O-N 2.91Å; V931-K934 PolarHBondContact O-N 2.98Å; V931-L935 PolarHBondContact O-N 3.17Å; V931-L999 HydrophobicContact CG1-CD1 3.91Å; V931-Y1003 HydrophobicContact CB-CD2 4.46Å; V931-Y1003 HydrophobicContact CG1-CD2 3.56Å; V931-Y1003 HydrophobicContact CG1-CE2 4.16Å; V931-Y1003 HydrophobicContact CG1-CG 4.43Å
932	C	98.8	Very high	98.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.8	-48.4	174.7	-175.3	0	0	0	0	112.6	V928 C929 Q930 K934 L935 A936	V928-C932 VanDerWaalsContact O-CB 3.22Å; V928-C932 WeakPolarHBondContact O-CB 3.45Å; V928-C932 PolarHBondContact O-N 3.31Å; C929-C932 PolarHBondContact O-N 3.24Å; Q930-C932 VanDerWaalsContact C-N 3.31Å; Q930-C932 PolarHBondContact O-N 2.96Å; C932-K934 VanDerWaalsContact C-N 3.32Å; C932-K934 PolarHBondContact O-N 3.46Å; C932-L935 PolarHBondContact O-N 2.95Å; C932-A936 WeakPolarHBondContact O-CB 3.42Å; C932-A936 PolarHBondContact O-N 3.41Å
933	I	98.8	Very high	98.3	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-65.7	-36.1	175.1	-169.5	167.2	0	0	0	111.2	V745 V749 L814 A817 A818 A889 T893 C929 Q930 L935 A936 D937	V745-I933 HydrophobicContact CG1-CG1 4.31Å; V749-I933 HydrophobicContact CG1-CB 4.16Å; V749-I933 HydrophobicContact CG1-CG1 4.32Å; L814-I933 HydrophobicContact CD1-CB 3.78Å; L814-I933 HydrophobicContact CD1-CG2 4.32Å; A817-I933 HydrophobicContact CB-CD1 4.19Å; A818-I933 HydrophobicContact CB-CD1 4.29Å; A889-I933 HydrophobicContact CB-CD1 4.48Å; A889-I933 HydrophobicContact CB-CG2 4.38Å; T893-I933 HydrophobicContact CG2-CD1 4.47Å; T893-I933 HydrophobicContact CG2-CG1 4.42Å; C929-I933 PolarHBondContact O-N 2.72Å; Q930-I933 VanDerWaalsContact O-CG2 3.27Å; Q930-I933 WeakPolarHBondContact O-CG2 3.36Å; Q930-I933 PolarHBondContact O-N 3.13Å; I933-L935 VanDerWaalsContact C-N 3.33Å; I933-L935 PolarHBondContact O-N 2.85Å; I933-A936 PolarHBondContact O-N 3.46Å; I933-D937 WeakPolarHBondContact O-CB 3.22Å; I933-D937 PolarHBondContact O-N 3.28Å
934	K	98.7	Very high	98.4	Very high	3 Å²	3	8.2 Å²	8.2	1%	0.013	5%	0.045	C	C	.	.	H	α-helix	trans	-63.4	-35.1	173.8	-71.1	-165.8	76.6	56.3	0	113.2	A892 T893 F901 Q930 V931 C932 I938 L999	A892-K934 HydrophobicContact CB-CG 4.38Å; A892-K934 WeakPolarHBondContact O-CD 3.33Å; A892-K934 WeakPolarHBondContact O-CE 3.39Å; A892-K934 WeakPolarHBondContact O-CG 3.49Å; A892-K934 PolarHBondContact O-NZ 2.98Å; T893-K934 PolarHBondContact O-NZ 2.83Å; F901-K934 HydrophobicContact CB-CD 4.43Å; F901-K934 HydrophobicContact CD2-CD 4.1Å; F901-K934 HydrophobicContact CG-CD 4.43Å; Q930-K934 WeakPolarHBondContact O-CB 3.38Å; Q930-K934 VanDerWaalsContact O-CG 3.29Å; Q930-K934 WeakPolarHBondContact O-CG 3.35Å; Q930-K934 PolarHBondContact O-N 2.95Å; V931-K934 PolarHBondContact O-N 2.98Å; C932-K934 VanDerWaalsContact C-N 3.32Å; C932-K934 PolarHBondContact O-N 3.46Å; K934-I938 VanDerWaalsContact O-CG1 3.26Å; K934-I938 WeakPolarHBondContact O-CG1 3.35Å; K934-L999 HydrophobicContact CB-CD2 4.22Å
935	L	98.7	Very high	98.4	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.016	6%	0.064	C	C	.	.	H	α-helix	trans	-73.7	-37.6	175.7	-164.7	154.1	0	0	0	111	L752 V931 C932 I933 N939 L999 Y1003 L1009 L1061	L752-L935 HydrophobicContact CD1-CD2 3.79Å; L752-L935 HydrophobicContact CD2-CD2 4.27Å; V931-L935 PolarHBondContact O-N 3.17Å; C932-L935 PolarHBondContact O-N 2.95Å; I933-L935 VanDerWaalsContact C-N 3.33Å; I933-L935 PolarHBondContact O-N 2.85Å; L935-N939 WeakPolarHBondContact O-CA 3.33Å; L935-N939 WeakPolarHBondContact O-CB 3.46Å; L935-N939 PolarHBondContact O-N 3.4Å; L935-L999 HydrophobicContact CB-CD2 4.17Å; L935-L999 HydrophobicContact CB-CG 4.46Å; L935-Y1003 HydrophobicContact CD1-CD1 3.86Å; L935-Y1003 HydrophobicContact CD1-CG 4.03Å; L935-L1009 HydrophobicContact CD1-CD2 4.38Å; L935-L1061 HydrophobicContact CD2-CD2 4.16Å
936	A	98.8	Very high	98.4	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-67.6	-38	176.2	0	0	0	0	0	113.7	V745 A748 V749 L752 C932 I933 N939	V745-A936 HydrophobicContact CG1-CB 3.99Å; A748-A936 HydrophobicContact CB-CB 3.62Å; V749-A936 HydrophobicContact CB-CB 4.47Å; V749-A936 HydrophobicContact CG1-CB 3.41Å; V749-A936 VanDerWaalsContact CG1-CB 3.41Å; L752-A936 HydrophobicContact CD1-CB 4.35Å; C932-A936 WeakPolarHBondContact O-CB 3.42Å; C932-A936 PolarHBondContact O-N 3.41Å; I933-A936 PolarHBondContact O-N 3.46Å; A936-N939 WeakPolarHBondContact O-CB 3.39Å; A936-N939 PolarHBondContact O-ND2 2.97Å
937	D	98.8	Very high	98.4	Very high	17 Å²	17	18 Å²	18	9%	0.091	9%	0.09	C	C	.	.	H	α-helix	trans	-56.8	-60.2	176.1	172.6	12.1	0	0	0	110.7	H741 T893 I933 N939	H741-D937 VanDerWaalsContact NE2-C 3.33Å; H741-D937 PolarHBondContact NE2-O 3.06Å; H741-D937 IonicContact NE2-OD1 2.72Å; H741-D937 PolarHBondContact NE2-OD1 3.43Å; T893-D937 WeakPolarHBondContact CB-OD2 3.3Å; I933-D937 WeakPolarHBondContact O-CB 3.22Å; I933-D937 PolarHBondContact O-N 3.28Å; D937-N939 VanDerWaalsContact C-N 3.31Å; D937-N939 PolarHBondContact O-N 3.31Å
938	I	98.4	Very high	98.4	Very high	10 Å²	10	17.8 Å²	17.8	5%	0.051	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	33.4	-179.2	59.7	169.5	0	0	0	113.5	L895 K934 G940 F991 I995 V996 L999	L895-I938 HydrophobicContact CD2-CG2 4.29Å; K934-I938 VanDerWaalsContact O-CG1 3.26Å; K934-I938 WeakPolarHBondContact O-CG1 3.35Å; I938-G940 VanDerWaalsContact C-N 3.27Å; I938-G940 PolarHBondContact O-N 3.1Å; I938-F991 HydrophobicContact CB-CE1 4.3Å; I938-F991 HydrophobicContact CB-CZ 3.9Å; I938-F991 HydrophobicContact CD1-CZ 4.35Å; I938-F991 HydrophobicContact CG2-CZ 3.74Å; I938-I995 HydrophobicContact CD1-CG2 3.51Å; I938-V996 HydrophobicContact CD1-CG2 4.06Å; I938-L999 HydrophobicContact CD1-CD2 3.91Å; I938-L999 HydrophobicContact CG1-CD2 4.23Å
939	N	98.4	Very high	98.3	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.011	10%	0.103	C	C	.	.			trans	-69.1	-19	-172.2	81.5	72.7	0	0	0	114.9	W677 D744 L935 A936 D937 A942 K943	W677-N939 HydrophobicContact CH2-CB 4.1Å; W677-N939 HydrophobicContact CZ2-CB 4.21Å; D744-N939 PolarHBondContact OD2-ND2 3.27Å; D744-N939 PolarHBondContact OD2-OD1 3.3Å; L935-N939 WeakPolarHBondContact O-CA 3.33Å; L935-N939 WeakPolarHBondContact O-CB 3.46Å; L935-N939 PolarHBondContact O-N 3.4Å; A936-N939 WeakPolarHBondContact O-CB 3.39Å; A936-N939 PolarHBondContact O-ND2 2.97Å; D937-N939 VanDerWaalsContact C-N 3.31Å; D937-N939 PolarHBondContact O-N 3.31Å; N939-A942 WeakPolarHBondContact O-CA 3.47Å; N939-A942 WeakPolarHBondContact O-CB 3.39Å; N939-A942 PolarHBondContact O-N 3.21Å; N939-K943 PolarHBondContact O-N 2.97Å; N939-K943 WeakPolarHBondContact OD1-CE 3.44Å; N939-K943 WeakPolarHBondContact OD1-CG 3.31Å; N939-K943 PolarHBondContact OD1-NZ 3.44Å
940	G	97.9	Very high	98.3	Very high	4 Å²	4	24.6 Å²	24.6	4%	0.041	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-47.3	-52.9	-167.6	0	0	0	0	0	114.6	I938 A942 K943 H948	I938-G940 VanDerWaalsContact C-N 3.27Å; I938-G940 PolarHBondContact O-N 3.1Å; G940-A942 PolarHBondContact O-N 2.64Å; G940-A942 VanDerWaalsContact O-N 3.1Å; G940-K943 WeakPolarHBondContact O-CB 3.39Å; G940-K943 PolarHBondContact O-N 3.48Å; G940-H948 WeakPolarHBondContact O-CB 3.35Å
941	P	98.4	Very high	98.3	Very high	7 Å²	7	24.4 Å²	24.4	5%	0.045	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-65.4	-9.6	177.5	-24.7	36.9	0	0	0	115.9	H948 F991 I992 V996 L1065 N1068	P941-H948 VanDerWaalsContact CA-ND1 3.34Å; P941-H948 WeakPolarHBondContact CA-ND1 3.22Å; P941-F991 HydrophobicContact CG-CD1 4.35Å; P941-F991 HydrophobicContact CG-CE1 4.4Å; P941-I992 HydrophobicContact CB-CD1 3.92Å; P941-I992 HydrophobicContact CB-CG1 3.7Å; P941-I992 HydrophobicContact CG-CG1 4.13Å; P941-V996 HydrophobicContact CG-CG2 4.18Å; P941-L1065 HydrophobicContact CB-CD1 3.91Å; P941-L1065 WeakPolarHBondContact O-CA 3.49Å; P941-N1068 PolarHBondContact O-ND2 3.24Å
942	A	98.3	Very high	98.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-102.9	3.3	173.9	0	0	0	0	0	113.3	W677 N939 G940 L1061 H1064 L1065	W677-A942 PolarHBondContact NE1-O 3.47Å; N939-A942 WeakPolarHBondContact O-CA 3.47Å; N939-A942 WeakPolarHBondContact O-CB 3.39Å; N939-A942 PolarHBondContact O-N 3.21Å; G940-A942 PolarHBondContact O-N 2.64Å; G940-A942 VanDerWaalsContact O-N 3.1Å; A942-L1061 HydrophobicContact CB-CB 4.06Å; A942-L1061 HydrophobicContact CB-CD1 4.02Å; A942-H1064 VanDerWaalsContact O-CB 3.32Å; A942-H1064 WeakPolarHBondContact O-CB 3.24Å; A942-L1065 HydrophobicContact CB-CB 4.27Å; A942-L1065 HydrophobicContact CB-CD1 4.49Å
943	K	98.3	Very high	98.3	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-89.7	167	166.8	-63.9	-85.1	175.9	64.9	0	110.4	W677 D744 N939 G940 L947 N1068	W677-K943 HydrophobicContact CD2-CD 4.38Å; W677-K943 HydrophobicContact CZ2-CD 4.29Å; W677-K943 WeakPolarHBondContact O-CD 3.29Å; W677-K943 WeakPolarHBondContact O-CE 3.39Å; D744-K943 IonicContact OD1-NZ 2.75Å; D744-K943 PolarHBondContact OD1-NZ 3.3Å; D744-K943 IonicContact OD2-NZ 3.16Å; D744-K943 PolarHBondContact OD2-NZ 3.16Å; N939-K943 PolarHBondContact O-N 2.97Å; N939-K943 WeakPolarHBondContact OD1-CE 3.44Å; N939-K943 WeakPolarHBondContact OD1-CG 3.31Å; N939-K943 PolarHBondContact OD1-NZ 3.44Å; G940-K943 WeakPolarHBondContact O-CB 3.39Å; G940-K943 PolarHBondContact O-N 3.48Å; K943-L947 HydrophobicContact CB-CB 3.93Å; K943-L947 HydrophobicContact CB-CD1 4.29Å; K943-L947 HydrophobicContact CD-CD1 4.18Å; K943-N1068 PolarHBondContact O-ND2 3.4Å
944	V	98.2	Very high	98.2	Very high	47 Å²	47	29.5 Å²	29.5	29%	0.285	15%	0.145	S	C	.	.			trans	-54	147.8	173.3	67.2	0	0	0	0	111.6	N678 D946 L947 H948	N678-V944 HydrophobicContact CB-CB 4.4Å; N678-V944 HydrophobicContact CB-CG1 3.95Å; N678-V944 WeakPolarHBondContact OD1-CB 3.25Å; N678-V944 PolarHBondContact OD1-N 3.37Å; V944-D946 PolarHBondContact O-N 2.91Å; V944-L947 HydrophobicContact CG1-CB 4.24Å; V944-L947 HydrophobicContact CG1-CD1 4.01Å; V944-L947 HydrophobicContact CG1-CG 3.92Å; V944-L947 PolarHBondContact O-N 3.42Å; V944-H948 PolarHBondContact O-N 3.11Å
945	R	97.6	Very high	98.2	Very high	121 Å²	121	30.8 Å²	30.8	46%	0.457	15%	0.151	S	C	.	.	H	α-helix	trans	-41.9	-46	-173.2	178.5	180	172.4	129	4.1	113.7	H948 L949 I1071	R945-H948 PolarHBondContact O-N 2.7Å; R945-L949 HydrophobicContact CG-CD1 3.75Å; R945-L949 HydrophobicContact CG-CG 4.22Å; R945-L949 WeakPolarHBondContact O-CB 3.4Å; R945-L949 VanDerWaalsContact O-CG 3.28Å; R945-L949 WeakPolarHBondContact O-CG 3.31Å; R945-L949 PolarHBondContact O-N 3.13Å; R945-I1071 HydrophobicContact CG-CD1 4.01Å; R945-I1071 VanDerWaalsContact NH1-CD1 3.25Å
946	D	97	Very high	98.1	Very high	117 Å²	117	31.2 Å²	31.2	63%	0.626	15%	0.154	S	C	*	.	H	α-helix	trans	-70.9	-37.8	-173.5	-51.3	-46.2	0	0	0	112.4	V944 K950	V944-D946 PolarHBondContact O-N 2.91Å; D946-K950 WeakPolarHBondContact O-CB 3.37Å; D946-K950 PolarHBondContact O-N 2.81Å
947	L	97.9	Very high	98.1	Very high	17 Å²	17	34.1 Å²	34.1	9%	0.089	17%	0.17	C	C	.	.	H	α-helix	trans	-68.4	-42.7	171.2	-66.9	-179.3	0	0	0	111.2	N678 F682 K943 V944 K950 W951	N678-L947 HydrophobicContact CB-CD1 4.3Å; F682-L947 HydrophobicContact CD2-CD2 3.81Å; F682-L947 HydrophobicContact CE2-CD2 4.11Å; K943-L947 HydrophobicContact CB-CB 3.93Å; K943-L947 HydrophobicContact CB-CD1 4.29Å; K943-L947 HydrophobicContact CD-CD1 4.18Å; V944-L947 HydrophobicContact CG1-CB 4.24Å; V944-L947 HydrophobicContact CG1-CD1 4.01Å; V944-L947 HydrophobicContact CG1-CG 3.92Å; V944-L947 PolarHBondContact O-N 3.42Å; L947-K950 PolarHBondContact O-N 3.07Å; L947-W951 VanDerWaalsContact O-CD1 3.29Å; L947-W951 PolarHBondContact O-N 3.3Å
948	H	98.4	Very high	98.1	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.009	17%	0.166	C	C	.	.	H	α-helix	trans	-58.3	-50	176.3	169.7	47.7	0	0	0	111.8	G940 P941 V944 R945 K950 W951 T952 W1072	G940-H948 WeakPolarHBondContact O-CB 3.35Å; P941-H948 VanDerWaalsContact CA-ND1 3.34Å; P941-H948 WeakPolarHBondContact CA-ND1 3.22Å; V944-H948 PolarHBondContact O-N 3.11Å; R945-H948 PolarHBondContact O-N 2.7Å; H948-K950 VanDerWaalsContact C-N 3.33Å; H948-K950 PolarHBondContact O-N 2.74Å; H948-W951 PolarHBondContact O-N 2.91Å; H948-T952 PolarHBondContact CE1-OG1 3.39Å; H948-T952 WeakPolarHBondContact O-CB 3.28Å; H948-T952 PolarHBondContact O-N 3.5Å; H948-T952 PolarHBondContact O-OG1 3.21Å; H948-W1072 AromaticContact CD2-NE1 3.94Å; H948-W1072 AromaticContact CE1-NE1 3.89Å; H948-W1072 AromaticContact NE2-CE2 3.54Å; H948-W1072 AromaticContact NE2-CZ2 3.52Å; H948-W1072 AromaticContact NE2-NE1 3Å; H948-W1072 PolarHBondContact NE2-NE1 3.46Å
949	L	97.9	Very high	98.1	Very high	56 Å²	56	35.1 Å²	35.1	29%	0.293	17%	0.173	S	C	.	.	H	α-helix	trans	-64.4	-36.7	178.9	-70.6	176.5	0	0	0	111.9	R945 T952 E953 W1072	R945-L949 HydrophobicContact CG-CD1 3.75Å; R945-L949 HydrophobicContact CG-CG 4.22Å; R945-L949 WeakPolarHBondContact O-CB 3.4Å; R945-L949 VanDerWaalsContact O-CG 3.28Å; R945-L949 WeakPolarHBondContact O-CG 3.31Å; R945-L949 PolarHBondContact O-N 3.13Å; L949-T952 WeakPolarHBondContact O-CB 3.43Å; L949-T952 PolarHBondContact O-N 3.47Å; L949-E953 PolarHBondContact O-N 3.35Å; L949-W1072 HydrophobicContact CD2-CH2 3.77Å; L949-W1072 HydrophobicContact CD2-CZ2 3.66Å
950	K	98.1	Very high	98.1	Very high	97 Å²	97	36.2 Å²	36.2	42%	0.422	18%	0.177	S	C	.	.	H	α-helix	trans	-68.4	-39.2	176.9	-166	66.2	-173.7	168.3	0	112.7	F682 D946 L947 H948 E953 G954	F682-K950 HydrophobicContact CD1-CG 4.32Å; F682-K950 HydrophobicContact CD2-CB 4.34Å; F682-K950 HydrophobicContact CD2-CG 3.91Å; F682-K950 HydrophobicContact CE1-CG 4.03Å; F682-K950 HydrophobicContact CE2-CB 3.87Å; F682-K950 HydrophobicContact CE2-CG 3.59Å; F682-K950 HydrophobicContact CG-CG 4.27Å; F682-K950 HydrophobicContact CZ-CB 4.27Å; F682-K950 HydrophobicContact CZ-CG 3.65Å; D946-K950 WeakPolarHBondContact O-CB 3.37Å; D946-K950 PolarHBondContact O-N 2.81Å; L947-K950 PolarHBondContact O-N 3.07Å; H948-K950 VanDerWaalsContact C-N 3.33Å; H948-K950 PolarHBondContact O-N 2.74Å; K950-E953 WeakPolarHBondContact CD-OE2 3.21Å; K950-E953 WeakPolarHBondContact CE-OE2 3.45Å; K950-E953 IonicContact NZ-OE2 3.4Å; K950-E953 PolarHBondContact NZ-OE2 3.05Å; K950-G954 PolarHBondContact O-N 3.43Å
951	W	98.5	Very high	98.1	Very high	9 Å²	9	39.7 Å²	39.7	3%	0.034	19%	0.192	C	C	.	.	H	α-helix	trans	-67.1	-41.1	171.6	-75.1	130.1	0	0	0	112.4	I681 F682 Y736 I740 H741 D744 L947 H948 E953 G954 I955	I681-W951 HydrophobicContact CG2-CZ2 4.23Å; F682-W951 HydrophobicContact CE1-CH2 4.34Å; F682-W951 HydrophobicContact CE2-CD2 4.47Å; F682-W951 HydrophobicContact CE2-CZ2 4.22Å; F682-W951 HydrophobicContact CZ-CD2 4.01Å; F682-W951 AromaticContact CZ-CE2 3.82Å; F682-W951 HydrophobicContact CZ-CE3 4.1Å; F682-W951 AromaticContact CZ-CH2 3.84Å; F682-W951 HydrophobicContact CZ-CH2 3.84Å; F682-W951 AromaticContact CZ-CZ2 3.73Å; F682-W951 HydrophobicContact CZ-CZ2 3.73Å; F682-W951 HydrophobicContact CZ-CZ3 4.04Å; Y736-W951 AromaticContact CD2-CE3 3.66Å; Y736-W951 HydrophobicContact CD2-CE3 3.66Å; Y736-W951 HydrophobicContact CD2-CZ3 4.16Å; Y736-W951 HydrophobicContact CE2-CB 4.33Å; Y736-W951 HydrophobicContact CE2-CD2 4.12Å; Y736-W951 AromaticContact CE2-CE3 3.52Å; Y736-W951 HydrophobicContact CE2-CE3 3.52Å; Y736-W951 HydrophobicContact CE2-CG 4.48Å; Y736-W951 HydrophobicContact CE2-CZ3 4.18Å; I740-W951 HydrophobicContact CB-CH2 4.17Å; I740-W951 HydrophobicContact CG2-CH2 3.84Å; I740-W951 HydrophobicContact CG2-CZ2 4.41Å; H741-W951 HydrophobicContact CB-CH2 4.09Å; H741-W951 HydrophobicContact CB-CZ3 4.04Å; D744-W951 HydrophobicContact CB-CH2 4.49Å; D744-W951 HydrophobicContact CB-CZ2 3.67Å; D744-W951 PolarHBondContact OD2-NE1 2.79Å; L947-W951 VanDerWaalsContact O-CD1 3.29Å; L947-W951 PolarHBondContact O-N 3.3Å; H948-W951 PolarHBondContact O-N 2.91Å; W951-E953 VanDerWaalsContact C-N 3.33Å; W951-E953 PolarHBondContact O-N 3.46Å; W951-G954 PolarHBondContact O-N 3.17Å; W951-G954 VanDerWaalsContact O-N 3.14Å; W951-I955 WeakPolarHBondContact O-CG1 3.38Å; W951-I955 PolarHBondContact O-N 3.01Å
952	T	98.3	Very high	98.1	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-57.4	-43.2	174.8	-66.4	0	0	0	0	112.1	H948 L949 G954 I955 V956 L984 Q988 W1072	H948-T952 PolarHBondContact CE1-OG1 3.39Å; H948-T952 WeakPolarHBondContact O-CB 3.28Å; H948-T952 PolarHBondContact O-N 3.5Å; H948-T952 PolarHBondContact O-OG1 3.21Å; L949-T952 WeakPolarHBondContact O-CB 3.43Å; L949-T952 PolarHBondContact O-N 3.47Å; T952-G954 PolarHBondContact O-N 3.16Å; T952-I955 PolarHBondContact O-N 3.09Å; T952-V956 WeakPolarHBondContact O-CG2 3.41Å; T952-V956 PolarHBondContact O-N 3.21Å; T952-L984 HydrophobicContact CG2-CD1 3.53Å; T952-Q988 HydrophobicContact CG2-CG 3.97Å; T952-W1072 HydrophobicContact CG2-CH2 4.2Å; T952-W1072 HydrophobicContact CG2-CZ2 4.09Å
953	E	98	Very high	98.1	Very high	94 Å²	94	39.5 Å²	39.5	44%	0.439	19%	0.191	S	C	.	.	H	α-helix	trans	-58.4	-45.3	174.1	179.2	-177.3	-142.7	0	0	111.7	L949 K950 W951 N957	L949-E953 PolarHBondContact O-N 3.35Å; K950-E953 WeakPolarHBondContact CD-OE2 3.21Å; K950-E953 WeakPolarHBondContact CE-OE2 3.45Å; K950-E953 IonicContact NZ-OE2 3.4Å; K950-E953 PolarHBondContact NZ-OE2 3.05Å; W951-E953 VanDerWaalsContact C-N 3.33Å; W951-E953 PolarHBondContact O-N 3.46Å; E953-N957 WeakPolarHBondContact CG-ND2 3.38Å; E953-N957 WeakPolarHBondContact O-CB 3.27Å; E953-N957 PolarHBondContact O-N 2.82Å; E953-N957 VanDerWaalsContact O-N 3.14Å; E953-N957 PolarHBondContact O-ND2 2.67Å
954	G	98	Very high	98.1	Very high	9 Å²	9	42.4 Å²	42.4	9%	0.093	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-52	175.5	0	0	0	0	0	112.2	P735 K950 W951 T952 V956 N957 E958	P735-G954 WeakPolarHBondContact CB-O 3.4Å; P735-G954 WeakPolarHBondContact O-CA 3.48Å; K950-G954 PolarHBondContact O-N 3.43Å; W951-G954 PolarHBondContact O-N 3.17Å; W951-G954 VanDerWaalsContact O-N 3.14Å; T952-G954 PolarHBondContact O-N 3.16Å; G954-V956 PolarHBondContact O-N 2.86Å; G954-N957 PolarHBondContact O-N 3.09Å; G954-E958 PolarHBondContact O-N 3.42Å; G954-E958 VanDerWaalsContact O-N 3.11Å
955	I	97.7	Very high	98.1	Very high	30 Å²	30	43.6 Å²	43.6	15%	0.154	21%	0.209	C	C	.	.	H	α-helix	trans	-56.8	-49.9	-178.2	-65	165.8	0	0	0	111	Y736 W951 T952 E958 F959	Y736-I955 HydrophobicContact CD1-CG1 3.86Å; Y736-I955 HydrophobicContact CD2-CD1 4.26Å; Y736-I955 HydrophobicContact CD2-CG1 3.45Å; Y736-I955 VanDerWaalsContact CD2-CG1 3.45Å; Y736-I955 HydrophobicContact CE1-CD1 4.4Å; Y736-I955 HydrophobicContact CE1-CG1 3.98Å; Y736-I955 HydrophobicContact CE2-CD1 3.88Å; Y736-I955 HydrophobicContact CE2-CG1 3.58Å; Y736-I955 HydrophobicContact CG-CG1 3.59Å; W951-I955 WeakPolarHBondContact O-CG1 3.38Å; W951-I955 PolarHBondContact O-N 3.01Å; T952-I955 PolarHBondContact O-N 3.09Å; I955-E958 PolarHBondContact O-N 3.47Å; I955-F959 HydrophobicContact CG2-CD1 4.22Å; I955-F959 HydrophobicContact CG2-CD2 4.39Å; I955-F959 HydrophobicContact CG2-CE1 3.88Å; I955-F959 HydrophobicContact CG2-CE2 4.07Å; I955-F959 HydrophobicContact CG2-CG 4.47Å; I955-F959 HydrophobicContact CG2-CZ 3.8Å; I955-F959 WeakPolarHBondContact O-CD1 3.41Å; I955-F959 WeakPolarHBondContact O-CG 3.36Å; I955-F959 PolarHBondContact O-N 3.25Å
956	V	97.4	Very high	98.1	Very high	12 Å²	12	38.2 Å²	38.2	7%	0.073	19%	0.189	C	C	.	.	H	α-helix	trans	-71.9	-32.1	-175.9	-59.1	0	0	0	0	113.1	T952 G954 F959 Y960 L984 L987	T952-V956 WeakPolarHBondContact O-CG2 3.41Å; T952-V956 PolarHBondContact O-N 3.21Å; G954-V956 PolarHBondContact O-N 2.86Å; V956-F959 PolarHBondContact O-N 3.07Å; V956-Y960 HydrophobicContact CB-CD2 4.49Å; V956-Y960 HydrophobicContact CB-CE2 3.94Å; V956-Y960 HydrophobicContact CG2-CE2 3.97Å; V956-Y960 WeakPolarHBondContact O-CB 3.41Å; V956-Y960 WeakPolarHBondContact O-CD2 3.26Å; V956-Y960 PolarHBondContact O-N 2.8Å; V956-L984 HydrophobicContact CG1-CD1 3.71Å; V956-L987 HydrophobicContact CG1-CD2 3.84Å
957	N	98.3	Very high	98.2	Very high	61 Å²	61	35.2 Å²	35.2	33%	0.326	18%	0.181	S	C	.	.	H	α-helix	trans	-63.6	-41.9	173.2	-78.8	-49.5	0	0	0	111.8	P735 E953 G954 Y960 E961	P735-N957 HydrophobicContact CB-CB 3.88Å; P735-N957 HydrophobicContact CG-CB 4.12Å; E953-N957 WeakPolarHBondContact CG-ND2 3.38Å; E953-N957 WeakPolarHBondContact O-CB 3.27Å; E953-N957 PolarHBondContact O-N 2.82Å; E953-N957 VanDerWaalsContact O-N 3.14Å; E953-N957 PolarHBondContact O-ND2 2.67Å; G954-N957 PolarHBondContact O-N 3.09Å; N957-Y960 PolarHBondContact O-N 3.05Å; N957-E961 PolarHBondContact O-N 2.89Å
958	E	98.3	Very high	98.2	Very high	5 Å²	5	41.2 Å²	41.2	2%	0.023	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-38.8	176	-159.8	179.4	124	0	0	112.2	P735 Y736 H737 H825 G827 G954 I955 Y960 E961 Q962	P735-E958 HydrophobicContact CB-CB 4.15Å; P735-E958 HydrophobicContact CG-CB 4.26Å; Y736-E958 PolarHBondContact N-OE2 3.06Å; H737-E958 IonicContact CE1-OE1 3.46Å; H737-E958 PolarHBondContact CE1-OE1 2.98Å; H737-E958 IonicContact CG-OE1 2.73Å; H737-E958 PolarHBondContact N-OE2 3.14Å; H737-E958 VanDerWaalsContact N-OE2 3.11Å; H737-E958 VanDerWaalsContact ND1-CD 3.28Å; H737-E958 IonicContact ND1-OE1 3.89Å; H737-E958 PolarHBondContact ND1-OE1 3.19Å; H737-E958 IonicContact ND1-OE2 3.48Å; H737-E958 PolarHBondContact ND1-OE2 2.94Å; H825-E958 IonicContact CE1-OE1 3.51Å; H825-E958 PolarHBondContact CE1-OE1 3.42Å; H825-E958 IonicContact ND1-OE1 2.7Å; G827-E958 WeakPolarHBondContact CA-OE1 3.43Å; G954-E958 PolarHBondContact O-N 3.42Å; G954-E958 VanDerWaalsContact O-N 3.11Å; I955-E958 PolarHBondContact O-N 3.47Å; E958-Y960 PolarHBondContact O-N 3.32Å; E958-E961 PolarHBondContact O-N 3.48Å; E958-Q962 PolarHBondContact O-N 3.4Å
959	F	98.3	Very high	98.1	Very high	43 Å²	43	45.9 Å²	45.9	19%	0.189	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-43.9	171.7	-79.9	15.6	0	0	0	111.7	I955 V956 E961 Q962 G963 M977 L987	I955-F959 HydrophobicContact CG2-CD1 4.22Å; I955-F959 HydrophobicContact CG2-CD2 4.39Å; I955-F959 HydrophobicContact CG2-CE1 3.88Å; I955-F959 HydrophobicContact CG2-CE2 4.07Å; I955-F959 HydrophobicContact CG2-CG 4.47Å; I955-F959 HydrophobicContact CG2-CZ 3.8Å; I955-F959 WeakPolarHBondContact O-CD1 3.41Å; I955-F959 WeakPolarHBondContact O-CG 3.36Å; I955-F959 PolarHBondContact O-N 3.25Å; V956-F959 PolarHBondContact O-N 3.07Å; F959-E961 VanDerWaalsContact C-N 3.31Å; F959-E961 PolarHBondContact O-N 3.35Å; F959-Q962 WeakPolarHBondContact O-CB 3.29Å; F959-Q962 PolarHBondContact O-N 3.45Å; F959-Q962 VanDerWaalsContact O-N 3.11Å; F959-G963 PolarHBondContact O-N 3.04Å; F959-M977 HydrophobicContact CB-CB 4.47Å; F959-M977 HydrophobicContact CB-CE 4.41Å; F959-M977 HydrophobicContact CB-CG 3.94Å; F959-M977 HydrophobicContact CB-SD 4.29Å; F959-M977 HydrophobicContact CD1-CE 3.86Å; F959-M977 HydrophobicContact CD2-CE 3.96Å; F959-M977 HydrophobicContact CD2-CG 4.25Å; F959-M977 HydrophobicContact CE1-CE 4.06Å; F959-M977 HydrophobicContact CE2-CE 4.15Å; F959-M977 HydrophobicContact CG-CE 3.81Å; F959-M977 HydrophobicContact CG-CG 4.2Å; F959-M977 HydrophobicContact CG-SD 4.34Å; F959-M977 HydrophobicContact CZ-CE 4.2Å; F959-M977 WeakPolarHBondContact O-CB 3.43Å; F959-L987 HydrophobicContact CD2-CD2 4.17Å; F959-L987 HydrophobicContact CE2-CD1 4.25Å; F959-L987 HydrophobicContact CE2-CD2 4.06Å
960	Y	98.4	Very high	98.1	Very high	26 Å²	26	46.4 Å²	46.4	10%	0.102	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-31.3	177.2	-63.1	-30.7	0	0	0	112.9	V956 N957 E958 G963 D964 R979 P982	V956-Y960 HydrophobicContact CB-CD2 4.49Å; V956-Y960 HydrophobicContact CB-CE2 3.94Å; V956-Y960 HydrophobicContact CG2-CE2 3.97Å; V956-Y960 WeakPolarHBondContact O-CB 3.41Å; V956-Y960 WeakPolarHBondContact O-CD2 3.26Å; V956-Y960 PolarHBondContact O-N 2.8Å; N957-Y960 PolarHBondContact O-N 3.05Å; E958-Y960 PolarHBondContact O-N 3.32Å; Y960-G963 PolarHBondContact O-N 2.88Å; Y960-D964 PolarHBondContact O-N 2.81Å; Y960-R979 HydrophobicContact CD1-CB 3.79Å; Y960-R979 HydrophobicContact CD2-CB 4.05Å; Y960-R979 HydrophobicContact CE1-CB 4.31Å; Y960-R979 HydrophobicContact CG-CB 3.66Å; Y960-R979 PolarHBondContact O-NH2 2.95Å; Y960-P982 WeakPolarHBondContact OH-CB 3.3Å
961	E	98.4	Very high	98	Very high	76 Å²	76	44.9 Å²	44.9	36%	0.355	25%	0.253	S	S	.	.	H	α-helix	trans	-67.3	-36.1	169.1	-72.5	-178.9	-163.3	0	0	112.7	R828 N957 E958 F959 E965	R828-E961 PolarHBondContact NH2-O 3.29Å; R828-E961 VanDerWaalsContact NH2-O 3.16Å; N957-E961 PolarHBondContact O-N 2.89Å; E958-E961 PolarHBondContact O-N 3.48Å; F959-E961 VanDerWaalsContact C-N 3.31Å; F959-E961 PolarHBondContact O-N 3.35Å; E961-E965 PolarHBondContact O-N 2.99Å
962	Q	98.4	Very high	97.9	Very high	2 Å²	2	50 Å²	50	1%	0.009	29%	0.287	C	S	.	.	H	α-helix	trans	-65.3	-46.3	171.2	-178.2	178.2	-57.4	0	0	110.9	T829 F832 E958 F959 D964 E965 E966 M977	T829-Q962 PolarHBondContact OG1-NE2 3.32Å; T829-Q962 PolarHBondContact OG1-OE1 3.34Å; F832-Q962 HydrophobicContact CB-CG 4.37Å; F832-Q962 HydrophobicContact CD2-CG 3.75Å; F832-Q962 HydrophobicContact CE2-CG 4.29Å; F832-Q962 HydrophobicContact CG-CG 4.15Å; E958-Q962 PolarHBondContact O-N 3.4Å; F959-Q962 WeakPolarHBondContact O-CB 3.29Å; F959-Q962 PolarHBondContact O-N 3.45Å; F959-Q962 VanDerWaalsContact O-N 3.11Å; Q962-D964 VanDerWaalsContact C-N 3.35Å; Q962-D964 PolarHBondContact O-N 3.33Å; Q962-E965 WeakPolarHBondContact O-CA 3.44Å; Q962-E965 PolarHBondContact O-N 2.96Å; Q962-E966 HydrophobicContact CG-CG 4.24Å; Q962-E966 PolarHBondContact NE2-OE1 3.19Å; Q962-E966 WeakPolarHBondContact O-CG 3.24Å; Q962-E966 PolarHBondContact O-N 2.68Å; Q962-M977 HydrophobicContact CB-SD 3.91Å; Q962-M977 VanDerWaalsContact CD-SD 3.52Å; Q962-M977 HydrophobicContact CG-SD 3.91Å; Q962-M977 PolarHBondContact NE2-SD 3.43Å
963	G	98.3	Very high	97.9	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-63.5	-37.3	-178.6	0	0	0	0	0	113.5	F959 Y960 E965 E966 A967 M977	F959-G963 PolarHBondContact O-N 3.04Å; Y960-G963 PolarHBondContact O-N 2.88Å; G963-E965 VanDerWaalsContact C-N 3.33Å; G963-E965 PolarHBondContact O-N 2.81Å; G963-E966 PolarHBondContact O-N 3.13Å; G963-A967 WeakPolarHBondContact O-CB 3.26Å; G963-A967 PolarHBondContact O-N 3.08Å; G963-M977 WeakPolarHBondContact CA-O 3.48Å
964	D	98.3	Very high	97.8	Very high	62 Å²	62	49.8 Å²	49.8	33%	0.332	29%	0.291	S	S	.	.	H	α-helix	trans	-60.4	-41.8	169.9	-71.4	-15.3	0	0	0	111.4	Y960 Q962 A967 N968 R979	Y960-D964 PolarHBondContact O-N 2.81Å; Q962-D964 VanDerWaalsContact C-N 3.35Å; Q962-D964 PolarHBondContact O-N 3.33Å; D964-A967 PolarHBondContact O-N 3.49Å; D964-N968 WeakPolarHBondContact O-CB 3.41Å; D964-N968 PolarHBondContact O-N 3.3Å; D964-N968 PolarHBondContact O-ND2 2.84Å; D964-R979 VanDerWaalsContact CG-NE 3.29Å; D964-R979 IonicContact OD1-CZ 2.66Å; D964-R979 IonicContact OD1-NE 3.33Å; D964-R979 PolarHBondContact OD1-NE 2.98Å; D964-R979 IonicContact OD1-NH2 2.69Å; D964-R979 IonicContact OD2-CZ 2.84Å; D964-R979 IonicContact OD2-NE 2.75Å; D964-R979 PolarHBondContact OD2-NE 3.34Å; D964-R979 IonicContact OD2-NH2 2.66Å; D964-R979 PolarHBondContact OD2-NH2 3.21Å
965	E	98.4	Very high	97.7	Very high	72 Å²	72	52.3 Å²	52.3	34%	0.336	31%	0.305	S	S	.	.	H	α-helix	trans	-70	-41	178.8	-166.4	174.5	162.7	0	0	112	R828 F832 E961 Q962 G963 A967 N968 L969	R828-E965 IonicContact CZ-OE2 2.62Å; R828-E965 VanDerWaalsContact CZ-OE2 3.23Å; R828-E965 IonicContact NE-OE2 2.74Å; R828-E965 PolarHBondContact NE-OE2 3.14Å; R828-E965 IonicContact NH2-OE2 3.5Å; R828-E965 PolarHBondContact NH2-OE2 2.89Å; F832-E965 HydrophobicContact CE2-CB 4.49Å; F832-E965 HydrophobicContact CE2-CG 4.42Å; F832-E965 HydrophobicContact CZ-CB 4.37Å; F832-E965 HydrophobicContact CZ-CG 3.92Å; E961-E965 PolarHBondContact O-N 2.99Å; Q962-E965 WeakPolarHBondContact O-CA 3.44Å; Q962-E965 PolarHBondContact O-N 2.96Å; G963-E965 VanDerWaalsContact C-N 3.33Å; G963-E965 PolarHBondContact O-N 2.81Å; E965-A967 VanDerWaalsContact C-N 3.34Å; E965-A967 PolarHBondContact O-N 2.82Å; E965-N968 PolarHBondContact O-N 2.93Å; E965-L969 HydrophobicContact CG-CD1 4.09Å; E965-L969 HydrophobicContact CG-CG 4.44Å; E965-L969 WeakPolarHBondContact O-CB 3.36Å; E965-L969 VanDerWaalsContact O-CG 3.26Å; E965-L969 WeakPolarHBondContact O-CG 3.49Å; E965-L969 PolarHBondContact O-N 2.92Å
966	E	98.4	Very high	97.6	Very high	7 Å²	7	53.1 Å²	53.1	3%	0.033	31%	0.308	C	S	.	.	H	α-helix	trans	-56.7	-47.6	172	-70.9	171.1	159.1	0	0	111.1	F832 Q962 G963 N968 L969 G970 L971 I973 S974	F832-E966 HydrophobicContact CD2-CG 3.66Å; F832-E966 HydrophobicContact CE2-CG 3.69Å; Q962-E966 HydrophobicContact CG-CG 4.24Å; Q962-E966 PolarHBondContact NE2-OE1 3.19Å; Q962-E966 WeakPolarHBondContact O-CG 3.24Å; Q962-E966 PolarHBondContact O-N 2.68Å; G963-E966 PolarHBondContact O-N 3.13Å; E966-N968 PolarHBondContact O-N 3.26Å; E966-L969 CarbonylContact O-C 3.5Å; E966-L969 PolarHBondContact O-N 3.34Å; E966-G970 PolarHBondContact O-N 3.09Å; E966-G970 VanDerWaalsContact O-N 3.09Å; E966-L971 HydrophobicContact CB-CB 4.21Å; E966-L971 PolarHBondContact O-N 2.84Å; E966-I973 WeakPolarHBondContact OE2-CA 3.18Å; E966-S974 WeakPolarHBondContact OE1-CB 3.47Å; E966-S974 PolarHBondContact OE1-OG 2.82Å; E966-S974 WeakPolarHBondContact OE2-CB 3.47Å; E966-S974 PolarHBondContact OE2-N 3.34Å; E966-S974 PolarHBondContact OE2-OG 3.2Å
967	A	97.4	Very high	97.6	Very high	54 Å²	54	53.2 Å²	53.2	45%	0.446	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-42.7	175.9	0	0	0	0	0	112.6	G963 D964 E965 L969 G970 I973	G963-A967 WeakPolarHBondContact O-CB 3.26Å; G963-A967 PolarHBondContact O-N 3.08Å; D964-A967 PolarHBondContact O-N 3.49Å; E965-A967 VanDerWaalsContact C-N 3.34Å; E965-A967 PolarHBondContact O-N 2.82Å; A967-L969 VanDerWaalsContact C-N 3.31Å; A967-L969 PolarHBondContact O-N 2.82Å; A967-G970 PolarHBondContact O-N 3.24Å; A967-G970 VanDerWaalsContact O-N 3.13Å; A967-I973 HydrophobicContact CB-CD1 3.99Å; A967-I973 HydrophobicContact CB-CG1 4.06Å
968	N	98.3	Very high	97.5	Very high	144 Å²	144	52.5 Å²	52.5	77%	0.77	30%	0.304	S	S	*	.	H	α-helix	trans	-66.2	-31.1	176.6	-81.6	-64.2	0	0	0	112.9	D964 E965 E966 G970	D964-N968 WeakPolarHBondContact O-CB 3.41Å; D964-N968 PolarHBondContact O-N 3.3Å; D964-N968 PolarHBondContact O-ND2 2.84Å; E965-N968 PolarHBondContact O-N 2.93Å; E966-N968 PolarHBondContact O-N 3.26Å; N968-G970 VanDerWaalsContact C-N 3.3Å
969	L	97.4	Very high	97.3	Very high	99 Å²	99	57.6 Å²	57.6	52%	0.518	32%	0.323	S	S	.	.	H	α-helix	trans	-80.7	-7.5	173.8	-68.7	172.4	0	0	0	113.3	F832 T836 E965 E966 A967 L971	F832-L969 HydrophobicContact CE2-CD1 4.19Å; F832-L969 HydrophobicContact CZ-CD1 3.96Å; T836-L969 HydrophobicContact CG2-CD1 3.9Å; E965-L969 HydrophobicContact CG-CD1 4.09Å; E965-L969 HydrophobicContact CG-CG 4.44Å; E965-L969 WeakPolarHBondContact O-CB 3.36Å; E965-L969 VanDerWaalsContact O-CG 3.26Å; E965-L969 WeakPolarHBondContact O-CG 3.49Å; E965-L969 PolarHBondContact O-N 2.92Å; E966-L969 CarbonylContact O-C 3.5Å; E966-L969 PolarHBondContact O-N 3.34Å; A967-L969 VanDerWaalsContact C-N 3.31Å; A967-L969 PolarHBondContact O-N 2.82Å; L969-L971 VanDerWaalsContact C-N 3.31Å; L969-L971 HydrophobicContact CB-CD1 4.26Å; L969-L971 HydrophobicContact CB-CG 4.08Å; L969-L971 HydrophobicContact CD1-CD1 4.32Å
970	G	96.9	Very high	97.1	Very high	68 Å²	68	60.3 Å²	60.3	70%	0.701	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	22.3	-176	0	0	0	0	0	113.8	E966 A967 N968	E966-G970 PolarHBondContact O-N 3.09Å; E966-G970 VanDerWaalsContact O-N 3.09Å; A967-G970 PolarHBondContact O-N 3.24Å; A967-G970 VanDerWaalsContact O-N 3.13Å; N968-G970 VanDerWaalsContact C-N 3.3Å
971	L	96.8	Very high	96.8	Very high	65 Å²	65	62.2 Å²	62.2	34%	0.34	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-83.4	156.5	171.1	-59.9	177	0	0	0	110	T836 E966 L969 I973	T836-L971 HydrophobicContact CG2-CD1 4.09Å; E966-L971 HydrophobicContact CB-CB 4.21Å; E966-L971 PolarHBondContact O-N 2.84Å; L969-L971 VanDerWaalsContact C-N 3.31Å; L969-L971 HydrophobicContact CB-CD1 4.26Å; L969-L971 HydrophobicContact CB-CG 4.08Å; L969-L971 HydrophobicContact CD1-CD1 4.32Å; L971-I973 PolarHBondContact O-N 3.22Å
972	P	97.1	Very high	96.4	Very high	116 Å²	116	62 Å²	62	75%	0.753	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-61	130.3	163.8	-16.4	30.7	0	0	0	109.3	S974	P972-S974 PolarHBondContact O-N 3.04Å
973	I	97.3	Very high	96.1	Very high	63 Å²	63	66 Å²	66	32%	0.323	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-64.1	133.5	174.9	-55.3	173.8	0	0	0	108.9	E966 A967 L971 M977 D978	E966-I973 WeakPolarHBondContact OE2-CA 3.18Å; A967-I973 HydrophobicContact CB-CD1 3.99Å; A967-I973 HydrophobicContact CB-CG1 4.06Å; L971-I973 PolarHBondContact O-N 3.22Å; I973-M977 HydrophobicContact CG2-CB 4.07Å; I973-D978 HydrophobicContact CD1-CB 4.3Å; I973-D978 HydrophobicContact CG2-CB 3.93Å
974	S	95.9	Very high	95.9	Very high	31 Å²	31	68.8 Å²	68.8	22%	0.217	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-63.3	149.5	179.6	-77.2	0	0	0	0	111.8	E966 P972 F976 M977	E966-S974 WeakPolarHBondContact OE1-CB 3.47Å; E966-S974 PolarHBondContact OE1-OG 2.82Å; E966-S974 WeakPolarHBondContact OE2-CB 3.47Å; E966-S974 PolarHBondContact OE2-N 3.34Å; E966-S974 PolarHBondContact OE2-OG 3.2Å; P972-S974 PolarHBondContact O-N 3.04Å; S974-F976 PolarHBondContact O-N 3.23Å; S974-M977 WeakPolarHBondContact O-CB 3.5Å; S974-M977 PolarHBondContact O-N 3.47Å
975	P	95.6	Very high	95.7	Very high	62 Å²	62	65.9 Å²	65.9	40%	0.403	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	136.8	176.4	-26.8	35	0	0	0	112.1	M977	P975-M977 PolarHBondContact O-N 2.87Å
976	F	95.3	Very high	95.5	Very high	47 Å²	47	66.6 Å²	66.6	21%	0.206	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	1.7	-176.7	-41.7	-79	0	0	0	116.3	S974 Q983 K986 L987	S974-F976 PolarHBondContact O-N 3.23Å; F976-Q983 HydrophobicContact CD1-CB 3.91Å; F976-Q983 HydrophobicContact CE1-CB 4.23Å; F976-K986 HydrophobicContact CE1-CB 4.32Å; F976-K986 HydrophobicContact CE1-CG 4.14Å; F976-L987 HydrophobicContact CB-CB 4.22Å; F976-L987 HydrophobicContact CB-CD1 4.11Å; F976-L987 HydrophobicContact CB-CD2 4.14Å; F976-L987 HydrophobicContact CB-CG 4.38Å; F976-L987 HydrophobicContact CD1-CB 3.68Å; F976-L987 HydrophobicContact CD1-CD1 4.46Å; F976-L987 HydrophobicContact CD2-CD1 3.85Å; F976-L987 HydrophobicContact CE1-CB 4.16Å; F976-L987 HydrophobicContact CE2-CD1 4.39Å; F976-L987 HydrophobicContact CG-CB 3.92Å; F976-L987 HydrophobicContact CG-CD1 3.89Å; F976-L987 HydrophobicContact CG-CG 4.35Å
977	M	97.6	Very high	95.3	Very high	13 Å²	13	67.2 Å²	67.2	6%	0.064	39%	0.393	C	S	.	.			trans	-98.7	-0.6	-177.7	-54.7	-156	176.5	0	0	114.4	T829 F959 Q962 G963 I973 S974 P975 R979	T829-M977 HydrophobicContact CG2-CE 4.03Å; F959-M977 HydrophobicContact CB-CB 4.47Å; F959-M977 HydrophobicContact CB-CE 4.41Å; F959-M977 HydrophobicContact CB-CG 3.94Å; F959-M977 HydrophobicContact CB-SD 4.29Å; F959-M977 HydrophobicContact CD1-CE 3.86Å; F959-M977 HydrophobicContact CD2-CE 3.96Å; F959-M977 HydrophobicContact CD2-CG 4.25Å; F959-M977 HydrophobicContact CE1-CE 4.06Å; F959-M977 HydrophobicContact CE2-CE 4.15Å; F959-M977 HydrophobicContact CG-CE 3.81Å; F959-M977 HydrophobicContact CG-CG 4.2Å; F959-M977 HydrophobicContact CG-SD 4.34Å; F959-M977 HydrophobicContact CZ-CE 4.2Å; F959-M977 WeakPolarHBondContact O-CB 3.43Å; Q962-M977 HydrophobicContact CB-SD 3.91Å; Q962-M977 VanDerWaalsContact CD-SD 3.52Å; Q962-M977 HydrophobicContact CG-SD 3.91Å; Q962-M977 PolarHBondContact NE2-SD 3.43Å; G963-M977 WeakPolarHBondContact CA-O 3.48Å; I973-M977 HydrophobicContact CG2-CB 4.07Å; S974-M977 WeakPolarHBondContact O-CB 3.5Å; S974-M977 PolarHBondContact O-N 3.47Å; P975-M977 PolarHBondContact O-N 2.87Å; M977-R979 PolarHBondContact O-N 3.36Å
978	D	96.5	Very high	95.3	Very high	47 Å²	47	64.9 Å²	64.9	25%	0.251	37%	0.373	S	S	.	.			trans	-86.8	105.3	176.7	-176.3	-3.4	0	0	0	111.6	I973 S980 S981	I973-D978 HydrophobicContact CD1-CB 4.3Å; I973-D978 HydrophobicContact CG2-CB 3.93Å; D978-S980 PolarHBondContact O-N 3.2Å; D978-S980 VanDerWaalsContact O-N 3.16Å; D978-S980 WeakPolarHBondContact OD1-CA 3.37Å; D978-S980 WeakPolarHBondContact OD1-CB 3.48Å; D978-S980 PolarHBondContact OD1-N 2.79Å; D978-S980 PolarHBondContact OD1-OG 3.23Å; D978-S980 PolarHBondContact OD2-OG 2.96Å; D978-S981 CarbonylContact O-C 3.56Å; D978-S981 VanDerWaalsContact O-C 3.25Å; D978-S981 PolarHBondContact O-N 2.88Å; D978-S981 VanDerWaalsContact O-N 3.07Å; D978-S981 PolarHBondContact OD1-N 3.26Å; D978-S981 WeakPolarHBondContact OD2-CB 3.49Å
979	R	94.9	Very high	95.2	Very high	111 Å²	111	59.6 Å²	59.6	42%	0.419	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.1	175.8	66.1	169.8	79.3	-114.1	7.3	114.5	Y960 D964 M977	Y960-R979 HydrophobicContact CD1-CB 3.79Å; Y960-R979 HydrophobicContact CD2-CB 4.05Å; Y960-R979 HydrophobicContact CE1-CB 4.31Å; Y960-R979 HydrophobicContact CG-CB 3.66Å; Y960-R979 PolarHBondContact O-NH2 2.95Å; D964-R979 VanDerWaalsContact CG-NE 3.29Å; D964-R979 IonicContact OD1-CZ 2.66Å; D964-R979 IonicContact OD1-NE 3.33Å; D964-R979 PolarHBondContact OD1-NE 2.98Å; D964-R979 IonicContact OD1-NH2 2.69Å; D964-R979 IonicContact OD2-CZ 2.84Å; D964-R979 IonicContact OD2-NE 2.75Å; D964-R979 PolarHBondContact OD2-NE 3.34Å; D964-R979 IonicContact OD2-NH2 2.66Å; D964-R979 PolarHBondContact OD2-NH2 3.21Å; M977-R979 PolarHBondContact O-N 3.36Å
980	S	93.9	Very high	95.1	Very high	101 Å²	101	56 Å²	56	71%	0.706	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-13.3	175.4	77.3	0	0	0	0	113.5	D978	D978-S980 PolarHBondContact O-N 3.2Å; D978-S980 VanDerWaalsContact O-N 3.16Å; D978-S980 WeakPolarHBondContact OD1-CA 3.37Å; D978-S980 WeakPolarHBondContact OD1-CB 3.48Å; D978-S980 PolarHBondContact OD1-N 2.79Å; D978-S980 PolarHBondContact OD1-OG 3.23Å; D978-S980 PolarHBondContact OD2-OG 2.96Å
981	S	90.8	Very high	95.1	Very high	66 Å²	66	55.1 Å²	55.1	46%	0.462	30%	0.303	S	S	.	.	S	Bend	trans	-136.3	58.7	176.2	-159.7	0	0	0	0	111	D978	D978-S981 CarbonylContact O-C 3.56Å; D978-S981 VanDerWaalsContact O-C 3.25Å; D978-S981 PolarHBondContact O-N 2.88Å; D978-S981 VanDerWaalsContact O-N 3.07Å; D978-S981 PolarHBondContact OD1-N 3.26Å; D978-S981 WeakPolarHBondContact OD2-CB 3.49Å
982	P	91.2	Very high	95.2	Very high	71 Å²	71	52.1 Å²	52.1	46%	0.461	29%	0.288	S	S	.	.			trans	-65.7	140.9	-173.7	29.2	-36.6	0	0	0	111.6	Y960	Y960-P982 WeakPolarHBondContact OH-CB 3.3Å
983	Q	91.8	Very high	95.2	Very high	87 Å²	87	48.8 Å²	48.8	41%	0.407	27%	0.266	S	S	.	.			trans	-132.4	49	177	-68	-179.6	33.4	0	0	110.1	F976 A985 K986 L987	F976-Q983 HydrophobicContact CD1-CB 3.91Å; F976-Q983 HydrophobicContact CE1-CB 4.23Å; Q983-A985 PolarHBondContact O-N 3Å; Q983-K986 HydrophobicContact CB-CB 4.47Å; Q983-K986 PolarHBondContact O-N 2.99Å; Q983-L987 PolarHBondContact O-N 3.27Å
984	L	93.5	Very high	95.1	Very high	58 Å²	58	50.4 Å²	50.4	30%	0.304	27%	0.271	S	S	.	.	H	α-helix	trans	-57.3	-49.6	-169.7	169.8	61	0	0	0	113.1	T952 V956 K986 L987 Q988 W1072	T952-L984 HydrophobicContact CG2-CD1 3.53Å; V956-L984 HydrophobicContact CG1-CD1 3.71Å; L984-K986 VanDerWaalsContact C-N 3.31Å; L984-K986 PolarHBondContact O-N 2.67Å; L984-L987 WeakPolarHBondContact O-CB 3.41Å; L984-L987 PolarHBondContact O-N 3.04Å; L984-Q988 HydrophobicContact CD1-CG 4Å; L984-Q988 PolarHBondContact O-N 3.39Å; L984-Q988 VanDerWaalsContact O-N 3.07Å; L984-W1072 HydrophobicContact CD1-CH2 4.27Å; L984-W1072 HydrophobicContact CD2-CH2 4.05Å; L984-W1072 HydrophobicContact CD2-CZ3 4.08Å; L984-W1072 HydrophobicContact CG-CH2 4.01Å; L984-W1072 HydrophobicContact CG-CZ3 3.88Å
985	A	94.2	Very high	95.1	Very high	2 Å²	2	50.3 Å²	50.3	2%	0.017	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-39.5	-177.6	0	0	0	0	0	111.7	Q983 Q988 E989 W1072 I1075 I1076	Q983-A985 PolarHBondContact O-N 3Å; A985-Q988 PolarHBondContact O-N 2.83Å; A985-E989 WeakPolarHBondContact O-CB 3.21Å; A985-E989 PolarHBondContact O-N 2.84Å; A985-W1072 HydrophobicContact CB-CE3 3.78Å; A985-W1072 HydrophobicContact CB-CZ3 4.44Å; A985-I1075 HydrophobicContact CB-CB 4.06Å; A985-I1075 HydrophobicContact CB-CG2 3.62Å; A985-I1076 HydrophobicContact CB-CD1 4.44Å; A985-I1076 HydrophobicContact CB-CG1 3.8Å
986	K	94.2	Very high	95.3	Very high	86 Å²	86	47.5 Å²	47.5	37%	0.374	25%	0.25	S	C	.	.	H	α-helix	trans	-67.9	-35	175.3	-173	168.3	-177	164.8	0	113.4	M327 F976 Q983 L984 S990	M327-K986 PolarHBondContact SD-NZ 3.25Å; F976-K986 HydrophobicContact CE1-CB 4.32Å; F976-K986 HydrophobicContact CE1-CG 4.14Å; Q983-K986 HydrophobicContact CB-CB 4.47Å; Q983-K986 PolarHBondContact O-N 2.99Å; L984-K986 VanDerWaalsContact C-N 3.31Å; L984-K986 PolarHBondContact O-N 2.67Å; K986-S990 WeakPolarHBondContact O-CB 3.33Å; K986-S990 PolarHBondContact O-N 3.47Å; K986-S990 VanDerWaalsContact O-N 3.14Å
987	L	94.4	Very high	95.4	Very high	21 Å²	21	45.7 Å²	45.7	11%	0.11	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-50.2	171.3	170.9	62.4	0	0	0	110.4	V956 F959 F976 Q983 L984 F991	V956-L987 HydrophobicContact CG1-CD2 3.84Å; F959-L987 HydrophobicContact CD2-CD2 4.17Å; F959-L987 HydrophobicContact CE2-CD1 4.25Å; F959-L987 HydrophobicContact CE2-CD2 4.06Å; F976-L987 HydrophobicContact CB-CB 4.22Å; F976-L987 HydrophobicContact CB-CD1 4.11Å; F976-L987 HydrophobicContact CB-CD2 4.14Å; F976-L987 HydrophobicContact CB-CG 4.38Å; F976-L987 HydrophobicContact CD1-CB 3.68Å; F976-L987 HydrophobicContact CD1-CD1 4.46Å; F976-L987 HydrophobicContact CD2-CD1 3.85Å; F976-L987 HydrophobicContact CE1-CB 4.16Å; F976-L987 HydrophobicContact CE2-CD1 4.39Å; F976-L987 HydrophobicContact CG-CB 3.92Å; F976-L987 HydrophobicContact CG-CD1 3.89Å; F976-L987 HydrophobicContact CG-CG 4.35Å; Q983-L987 PolarHBondContact O-N 3.27Å; L984-L987 WeakPolarHBondContact O-CB 3.41Å; L984-L987 PolarHBondContact O-N 3.04Å; L987-F991 WeakPolarHBondContact O-CB 3.19Å; L987-F991 PolarHBondContact O-N 3.33Å
988	Q	96.9	Very high	95.4	Very high	4 Å²	4	47 Å²	47	2%	0.019	25%	0.254	C	S	.	.	H	α-helix	trans	-73.8	-41.9	-173.9	-65.1	-62.2	-36.4	0	0	112.9	T952 L984 A985 S990 F991 I992 W1072	T952-Q988 HydrophobicContact CG2-CG 3.97Å; L984-Q988 HydrophobicContact CD1-CG 4Å; L984-Q988 PolarHBondContact O-N 3.39Å; L984-Q988 VanDerWaalsContact O-N 3.07Å; A985-Q988 PolarHBondContact O-N 2.83Å; Q988-S990 PolarHBondContact O-N 3.06Å; Q988-F991 PolarHBondContact O-N 3Å; Q988-I992 WeakPolarHBondContact O-CB 3.42Å; Q988-I992 WeakPolarHBondContact O-CD1 3.49Å; Q988-I992 VanDerWaalsContact O-CG1 3.24Å; Q988-I992 WeakPolarHBondContact O-CG1 3.13Å; Q988-I992 PolarHBondContact O-N 3.43Å; Q988-W1072 HydrophobicContact CB-CD2 3.67Å; Q988-W1072 VanDerWaalsContact CB-CE2 3.49Å; Q988-W1072 HydrophobicContact CB-CE3 4.43Å; Q988-W1072 HydrophobicContact CB-CG 3.71Å; Q988-W1072 HydrophobicContact CB-CZ2 4.09Å; Q988-W1072 HydrophobicContact CG-CD2 4.23Å; Q988-W1072 HydrophobicContact CG-CH2 4.31Å; Q988-W1072 HydrophobicContact CG-CZ2 3.78Å
989	E	96.7	Very high	95.5	Very high	34 Å²	34	45 Å²	45	16%	0.159	24%	0.243	C	C	.	.	H	α-helix	trans	-57.9	-49.9	172.6	-170.5	-73.7	147.2	0	0	110.8	A985 F991 I992 T993 H1069 W1072 K1073 I1076	A985-E989 WeakPolarHBondContact O-CB 3.21Å; A985-E989 PolarHBondContact O-N 2.84Å; E989-F991 VanDerWaalsContact C-N 3.34Å; E989-F991 PolarHBondContact O-N 3.46Å; E989-I992 PolarHBondContact O-N 2.88Å; E989-T993 VanDerWaalsContact O-CB 3.31Å; E989-T993 WeakPolarHBondContact O-CB 3.25Å; E989-T993 PolarHBondContact O-N 3.19Å; E989-T993 PolarHBondContact O-OG1 3.42Å; E989-T993 PolarHBondContact OE1-OG1 3.12Å; E989-H1069 IonicContact OE1-NE2 3.2Å; E989-H1069 PolarHBondContact OE1-NE2 3.4Å; E989-W1072 HydrophobicContact CB-CB 4.21Å; E989-K1073 HydrophobicContact CG-CD 4.44Å; E989-K1073 HydrophobicContact CG-CG 3.87Å; E989-K1073 VanDerWaalsContact OE1-CE 3.22Å; E989-K1073 WeakPolarHBondContact OE1-CE 3.47Å; E989-K1073 IonicContact OE1-NZ 2.95Å; E989-K1073 PolarHBondContact OE1-NZ 3.32Å; E989-I1076 HydrophobicContact CB-CD1 3.71Å; E989-I1076 HydrophobicContact CG-CD1 4Å
990	S	96	Very high	95.6	Very high	24 Å²	24	39.7 Å²	39.7	17%	0.168	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-36.7	-177.4	-167	0	0	0	0	112.2	K986 Q988 H994	K986-S990 WeakPolarHBondContact O-CB 3.33Å; K986-S990 PolarHBondContact O-N 3.47Å; K986-S990 VanDerWaalsContact O-N 3.14Å; Q988-S990 PolarHBondContact O-N 3.06Å; S990-H994 WeakPolarHBondContact O-CB 3.45Å; S990-H994 PolarHBondContact O-CD2 3.23Å; S990-H994 VanDerWaalsContact O-CD2 3.3Å; S990-H994 PolarHBondContact O-N 3.01Å; S990-H994 PolarHBondContact OG-CD2 3.02Å; S990-H994 VanDerWaalsContact OG-CD2 3.31Å
991	F	97.1	Very high	95.7	Very high	48 Å²	48	39.1 Å²	39.1	21%	0.211	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-41.9	175.6	-174.6	-110.6	0	0	0	112.5	I938 P941 L987 Q988 E989 I995 V996	I938-F991 HydrophobicContact CB-CE1 4.3Å; I938-F991 HydrophobicContact CB-CZ 3.9Å; I938-F991 HydrophobicContact CD1-CZ 4.35Å; I938-F991 HydrophobicContact CG2-CZ 3.74Å; P941-F991 HydrophobicContact CG-CD1 4.35Å; P941-F991 HydrophobicContact CG-CE1 4.4Å; L987-F991 WeakPolarHBondContact O-CB 3.19Å; L987-F991 PolarHBondContact O-N 3.33Å; Q988-F991 PolarHBondContact O-N 3Å; E989-F991 VanDerWaalsContact C-N 3.34Å; E989-F991 PolarHBondContact O-N 3.46Å; F991-I995 HydrophobicContact CD2-CB 4.02Å; F991-I995 HydrophobicContact CD2-CG1 3.83Å; F991-I995 HydrophobicContact CE2-CB 4.03Å; F991-I995 HydrophobicContact CE2-CG1 4.11Å; F991-I995 HydrophobicContact CE2-CG2 4.02Å; F991-I995 WeakPolarHBondContact O-CA 3.27Å; F991-I995 WeakPolarHBondContact O-CB 3.27Å; F991-I995 PolarHBondContact O-N 3.16Å; F991-V996 HydrophobicContact CD1-CG2 3.67Å; F991-V996 HydrophobicContact CE1-CG2 3.43Å; F991-V996 VanDerWaalsContact CE1-CG2 3.43Å; F991-V996 HydrophobicContact CZ-CG2 4.11Å; F991-V996 PolarHBondContact O-N 3.34Å; F991-V996 VanDerWaalsContact O-N 3.1Å
992	I	97.6	Very high	96	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	20%	0.195	C	C	.	.	I	π-helix	trans	-65.3	-49.4	174.2	-68.3	165.9	0	0	0	110.3	P941 Q988 E989 H994 G997 L1065 H1069	P941-I992 HydrophobicContact CB-CD1 3.92Å; P941-I992 HydrophobicContact CB-CG1 3.7Å; P941-I992 HydrophobicContact CG-CG1 4.13Å; Q988-I992 WeakPolarHBondContact O-CB 3.42Å; Q988-I992 WeakPolarHBondContact O-CD1 3.49Å; Q988-I992 VanDerWaalsContact O-CG1 3.24Å; Q988-I992 WeakPolarHBondContact O-CG1 3.13Å; Q988-I992 PolarHBondContact O-N 3.43Å; E989-I992 PolarHBondContact O-N 2.88Å; I992-H994 PolarHBondContact O-N 2.83Å; I992-G997 WeakPolarHBondContact O-CA 3.42Å; I992-G997 PolarHBondContact O-N 2.73Å; I992-L1065 HydrophobicContact CG1-CD1 4.43Å; I992-L1065 HydrophobicContact CG2-CD1 3.93Å; I992-L1065 HydrophobicContact CG2-CG 4.48Å; I992-H1069 HydrophobicContact CG2-CB 3.98Å
993	T	97.3	Very high	96.3	Very high	47 Å²	47	33.2 Å²	33.2	29%	0.288	17%	0.173	S	C	.	.	I	π-helix	trans	-66.2	-33.1	-176.1	-70.9	0	0	0	0	113.3	E989 H1069	E989-T993 VanDerWaalsContact O-CB 3.31Å; E989-T993 WeakPolarHBondContact O-CB 3.25Å; E989-T993 PolarHBondContact O-N 3.19Å; E989-T993 PolarHBondContact O-OG1 3.42Å; E989-T993 PolarHBondContact OE1-OG1 3.12Å; T993-H1069 PolarHBondContact OG1-CE1 2.85Å; T993-H1069 PolarHBondContact OG1-NE2 3.15Å
994	H	95.1	Very high	96.5	Very high	96 Å²	96	32.2 Å²	32.2	44%	0.444	17%	0.17	S	C	.	.	I	π-helix	trans	-109.2	-19.5	-174.2	-58.3	-42.7	0	0	0	116.1	S990 I992	S990-H994 WeakPolarHBondContact O-CB 3.45Å; S990-H994 PolarHBondContact O-CD2 3.23Å; S990-H994 VanDerWaalsContact O-CD2 3.3Å; S990-H994 PolarHBondContact O-N 3.01Å; S990-H994 PolarHBondContact OG-CD2 3.02Å; S990-H994 VanDerWaalsContact OG-CD2 3.31Å; I992-H994 PolarHBondContact O-N 2.83Å
995	I	97.4	Very high	96.6	Very high	30 Å²	30	32.9 Å²	32.9	15%	0.154	18%	0.184	C	C	.	.	I	π-helix	trans	-120.6	-61.1	-175	-46.8	-64.6	0	0	0	111.1	L895 H898 F899 I938 F991 L999	L895-I995 HydrophobicContact CD2-CG2 4.47Å; H898-I995 VanDerWaalsContact CE1-CG2 3.41Å; H898-I995 WeakPolarHBondContact CE1-CG2 3.49Å; H898-I995 PolarHBondContact CE1-O 2.85Å; H898-I995 VanDerWaalsContact CE1-O 3.27Å; H898-I995 PolarHBondContact NE2-O 3.26Å; F899-I995 HydrophobicContact CE2-CD1 4.35Å; F899-I995 HydrophobicContact CZ-CD1 3.89Å; I938-I995 HydrophobicContact CD1-CG2 3.51Å; F991-I995 HydrophobicContact CD2-CB 4.02Å; F991-I995 HydrophobicContact CD2-CG1 3.83Å; F991-I995 HydrophobicContact CE2-CB 4.03Å; F991-I995 HydrophobicContact CE2-CG1 4.11Å; F991-I995 HydrophobicContact CE2-CG2 4.02Å; F991-I995 WeakPolarHBondContact O-CA 3.27Å; F991-I995 WeakPolarHBondContact O-CB 3.27Å; F991-I995 PolarHBondContact O-N 3.16Å; I995-L999 WeakPolarHBondContact O-CB 3.33Å; I995-L999 PolarHBondContact O-N 3.34Å
996	V	97.9	Very high	96.6	Very high	2 Å²	2	34 Å²	34	1%	0.012	19%	0.193	C	C	.	.	I	π-helix	trans	-72.9	-47.4	-172.8	-169.1	0	0	0	0	111.6	I938 P941 F991 L999 C1000 L1065	I938-V996 HydrophobicContact CD1-CG2 4.06Å; P941-V996 HydrophobicContact CG-CG2 4.18Å; F991-V996 HydrophobicContact CD1-CG2 3.67Å; F991-V996 HydrophobicContact CE1-CG2 3.43Å; F991-V996 VanDerWaalsContact CE1-CG2 3.43Å; F991-V996 HydrophobicContact CZ-CG2 4.11Å; F991-V996 PolarHBondContact O-N 3.34Å; F991-V996 VanDerWaalsContact O-N 3.1Å; V996-L999 PolarHBondContact O-N 3.38Å; V996-C1000 WeakPolarHBondContact O-CB 3.37Å; V996-C1000 PolarHBondContact O-N 3.42Å; V996-C1000 PolarHBondContact O-SG 3.18Å; V996-L1065 HydrophobicContact CB-CD1 4.16Å; V996-L1065 HydrophobicContact CG1-CD1 3.61Å; V996-L1065 HydrophobicContact CG1-CD2 4.14Å
997	G	97.4	Very high	96.6	Very high	10 Å²	10	31.6 Å²	31.6	10%	0.103	19%	0.193	C	C	.	.	H	α-helix	trans	-56.9	-55.8	179.2	0	0	0	0	0	113.3	I992 L999 C1000 N1001	I992-G997 WeakPolarHBondContact O-CA 3.42Å; I992-G997 PolarHBondContact O-N 2.73Å; G997-L999 VanDerWaalsContact C-N 3.27Å; G997-L999 PolarHBondContact O-N 3.45Å; G997-C1000 PolarHBondContact O-N 2.86Å; G997-N1001 VanDerWaalsContact O-CB 3.24Å; G997-N1001 WeakPolarHBondContact O-CB 3.1Å; G997-N1001 PolarHBondContact O-N 3.01Å; G997-N1001 PolarHBondContact O-ND2 3.3Å; G997-N1001 PolarHBondContact O-OD1 3.44Å
998	P	98.2	Very high	96.7	Very high	40 Å²	40	30.7 Å²	30.7	26%	0.26	19%	0.188	S	C	.	.	H	α-helix	trans	-58	-36	177.6	-28.3	37.9	0	0	0	113.8	L902 S1002	L902-P998 HydrophobicContact CD2-CB 3.75Å; P998-S1002 WeakPolarHBondContact O-CB 3.33Å; P998-S1002 PolarHBondContact O-N 3.39Å; P998-S1002 VanDerWaalsContact O-N 3.13Å; P998-S1002 PolarHBondContact O-OG 3.35Å
999	L	98	Very high	96.7	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-67.8	-54.1	176.5	-177	63.2	0	0	0	112.1	L902 V931 K934 L935 I938 I995 V996 G997 N1001 S1002 Y1003	L902-L999 HydrophobicContact CD1-CD1 4Å; V931-L999 HydrophobicContact CG1-CD1 3.91Å; K934-L999 HydrophobicContact CB-CD2 4.22Å; L935-L999 HydrophobicContact CB-CD2 4.17Å; L935-L999 HydrophobicContact CB-CG 4.46Å; I938-L999 HydrophobicContact CD1-CD2 3.91Å; I938-L999 HydrophobicContact CG1-CD2 4.23Å; I995-L999 WeakPolarHBondContact O-CB 3.33Å; I995-L999 PolarHBondContact O-N 3.34Å; V996-L999 PolarHBondContact O-N 3.38Å; G997-L999 VanDerWaalsContact C-N 3.27Å; G997-L999 PolarHBondContact O-N 3.45Å; L999-N1001 PolarHBondContact O-N 3.27Å; L999-S1002 PolarHBondContact O-N 2.99Å; L999-Y1003 PolarHBondContact O-N 2.83Å
1000	C	97.8	Very high	96.7	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-44.9	178.4	-69.8	0	0	0	0	111.6	V996 G997 S1002 Y1003 D1004 L1061 M1062 L1065	V996-C1000 WeakPolarHBondContact O-CB 3.37Å; V996-C1000 PolarHBondContact O-N 3.42Å; V996-C1000 PolarHBondContact O-SG 3.18Å; G997-C1000 PolarHBondContact O-N 2.86Å; C1000-S1002 VanDerWaalsContact C-N 3.28Å; C1000-S1002 PolarHBondContact O-N 3.44Å; C1000-Y1003 PolarHBondContact O-N 3.17Å; C1000-D1004 VanDerWaalsContact O-CB 3.29Å; C1000-D1004 WeakPolarHBondContact O-CB 3.5Å; C1000-D1004 PolarHBondContact O-N 3.01Å; C1000-L1061 HydrophobicContact CB-CD1 4.47Å; C1000-M1062 HydrophobicContact CB-CE 4.03Å; C1000-L1065 HydrophobicContact CB-CD2 3.72Å
1001	N	96.9	Very high	96.6	Very high	89 Å²	89	29.7 Å²	29.7	48%	0.476	19%	0.188	S	C	.	.	H	α-helix	trans	-60.9	-36.7	177.7	-68.6	-9.7	0	0	0	112.3	G997 L999 A1005 M1062	G997-N1001 VanDerWaalsContact O-CB 3.24Å; G997-N1001 WeakPolarHBondContact O-CB 3.1Å; G997-N1001 PolarHBondContact O-N 3.01Å; G997-N1001 PolarHBondContact O-ND2 3.3Å; G997-N1001 PolarHBondContact O-OD1 3.44Å; L999-N1001 PolarHBondContact O-N 3.27Å; N1001-A1005 VanDerWaalsContact O-CB 3.25Å; N1001-A1005 WeakPolarHBondContact O-CB 3.32Å; N1001-A1005 PolarHBondContact O-N 3.27Å; N1001-M1062 WeakPolarHBondContact OD1-CE 3.21Å
1002	S	97.2	Very high	96.4	Very high	13 Å²	13	32.6 Å²	32.6	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-70.7	-40.5	177.4	-58.8	0	0	0	0	111.7	L902 N906 N910 P998 L999 C1000 A1006	L902-S1002 WeakPolarHBondContact CD1-OG 3.5Å; N906-S1002 WeakPolarHBondContact ND2-CB 3.5Å; N906-S1002 PolarHBondContact ND2-OG 3.26Å; N910-S1002 PolarHBondContact ND2-O 3.12Å; P998-S1002 WeakPolarHBondContact O-CB 3.33Å; P998-S1002 PolarHBondContact O-N 3.39Å; P998-S1002 VanDerWaalsContact O-N 3.13Å; P998-S1002 PolarHBondContact O-OG 3.35Å; L999-S1002 PolarHBondContact O-N 2.99Å; C1000-S1002 VanDerWaalsContact C-N 3.28Å; C1000-S1002 PolarHBondContact O-N 3.44Å; S1002-A1006 WeakPolarHBondContact O-CB 3.49Å; S1002-A1006 PolarHBondContact O-N 3.41Å; S1002-A1006 VanDerWaalsContact O-N 3.15Å
1003	Y	97.4	Very high	96	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-75.2	-29	-179.7	-163.1	-102	0	0	0	112.6	L802 F905 V931 L935 L999 C1000 L1008 L1009	L802-Y1003 WeakPolarHBondContact CD2-OH 3.32Å; F905-Y1003 HydrophobicContact CE1-CD2 4.39Å; F905-Y1003 AromaticContact CZ-CD2 3.94Å; F905-Y1003 HydrophobicContact CZ-CD2 3.94Å; V931-Y1003 HydrophobicContact CB-CD2 4.46Å; V931-Y1003 HydrophobicContact CG1-CD2 3.56Å; V931-Y1003 HydrophobicContact CG1-CE2 4.16Å; V931-Y1003 HydrophobicContact CG1-CG 4.43Å; L935-Y1003 HydrophobicContact CD1-CD1 3.86Å; L935-Y1003 HydrophobicContact CD1-CG 4.03Å; L999-Y1003 PolarHBondContact O-N 2.83Å; C1000-Y1003 PolarHBondContact O-N 3.17Å; Y1003-L1008 HydrophobicContact CD1-CB 3.99Å; Y1003-L1008 HydrophobicContact CD2-CB 4.17Å; Y1003-L1008 HydrophobicContact CD2-CD1 4.06Å; Y1003-L1008 HydrophobicContact CE1-CB 3.6Å; Y1003-L1008 VanDerWaalsContact CE1-O 3.3Å; Y1003-L1008 WeakPolarHBondContact CE1-O 3.47Å; Y1003-L1008 HydrophobicContact CE2-CB 3.82Å; Y1003-L1008 HydrophobicContact CE2-CD1 3.65Å; Y1003-L1008 HydrophobicContact CE2-CG 4.39Å; Y1003-L1008 HydrophobicContact CG-CB 4.26Å; Y1003-L1008 PolarHBondContact O-N 2.85Å; Y1003-L1009 HydrophobicContact CD1-CD2 3.58Å; Y1003-L1009 HydrophobicContact CD1-CG 3.84Å; Y1003-L1009 HydrophobicContact CE1-CD2 4.02Å; Y1003-L1009 HydrophobicContact CE1-CG 4.48Å
1004	D	96.1	Very high	95.6	Very high	66 Å²	66	36.6 Å²	36.6	35%	0.353	22%	0.216	S	C	.	.	H	α-helix	trans	-68.2	-48.9	168.8	-168.8	46.1	0	0	0	111.7	C1000 A1006 G1007 L1009 M1062	C1000-D1004 VanDerWaalsContact O-CB 3.29Å; C1000-D1004 WeakPolarHBondContact O-CB 3.5Å; C1000-D1004 PolarHBondContact O-N 3.01Å; D1004-A1006 PolarHBondContact O-N 3.15Å; D1004-G1007 WeakPolarHBondContact O-CA 3.39Å; D1004-G1007 PolarHBondContact O-N 3.08Å; D1004-L1009 HydrophobicContact CB-CD1 3.59Å; D1004-L1009 HydrophobicContact CB-CG 4.34Å; D1004-M1062 HydrophobicContact CB-CE 3.68Å
1005	A	94.2	Very high	94.5	Very high	71 Å²	71	38.5 Å²	38.5	59%	0.587	23%	0.225	S	C	*	.	H	α-helix	trans	-60	-27.9	176.4	0	0	0	0	0	113.3	N1001 G1007	N1001-A1005 VanDerWaalsContact O-CB 3.25Å; N1001-A1005 WeakPolarHBondContact O-CB 3.32Å; N1001-A1005 PolarHBondContact O-N 3.27Å; A1005-G1007 PolarHBondContact O-N 3.48Å
1006	A	94.6	Very high	92.3	Very high	26 Å²	26	39.6 Å²	39.6	22%	0.215	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-6.9	173.9	0	0	0	0	0	113.9	F905 A909 N910 S1002 D1004 L1008	F905-A1006 HydrophobicContact CE1-CB 3.84Å; F905-A1006 HydrophobicContact CZ-CB 3.54Å; A909-A1006 HydrophobicContact CB-CB 3.67Å; N910-A1006 WeakPolarHBondContact OD1-CA 3.39Å; N910-A1006 WeakPolarHBondContact OD1-CB 3.33Å; N910-A1006 PolarHBondContact OD1-N 2.92Å; N910-A1006 VanDerWaalsContact OD1-N 3.12Å; S1002-A1006 WeakPolarHBondContact O-CB 3.49Å; S1002-A1006 PolarHBondContact O-N 3.41Å; S1002-A1006 VanDerWaalsContact O-N 3.15Å; D1004-A1006 PolarHBondContact O-N 3.15Å; A1006-L1008 HydrophobicContact CB-CD1 4.13Å; A1006-L1008 HydrophobicContact CB-CG 3.91Å
1007	G	94.6	Very high	89.6	Confident	35 Å²	35	48 Å²	48	36%	0.361	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	33.4	-177.2	0	0	0	0	0	113.5	V757 D1004 A1005	V757-G1007 WeakPolarHBondContact CG1-O 3.35Å; D1004-G1007 WeakPolarHBondContact O-CA 3.39Å; D1004-G1007 PolarHBondContact O-N 3.08Å; A1005-G1007 PolarHBondContact O-N 3.48Å
1008	L	96.4	Very high	87	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.016	32%	0.315	C	S	.	.			trans	-109.5	-2.8	-176	-56.8	-175	0	0	0	114.2	L760 F905 W919 V928 Y1003 A1006	L760-L1008 HydrophobicContact CD1-CD2 4.29Å; F905-L1008 HydrophobicContact CE2-CD1 4.19Å; F905-L1008 HydrophobicContact CZ-CD1 3.93Å; W919-L1008 HydrophobicContact CH2-CD2 3.88Å; W919-L1008 HydrophobicContact CZ2-CD2 3.77Å; V928-L1008 HydrophobicContact CG1-CD1 4.07Å; V928-L1008 HydrophobicContact CG2-CD1 4Å; Y1003-L1008 HydrophobicContact CD1-CB 3.99Å; Y1003-L1008 HydrophobicContact CD2-CB 4.17Å; Y1003-L1008 HydrophobicContact CD2-CD1 4.06Å; Y1003-L1008 HydrophobicContact CE1-CB 3.6Å; Y1003-L1008 VanDerWaalsContact CE1-O 3.3Å; Y1003-L1008 WeakPolarHBondContact CE1-O 3.47Å; Y1003-L1008 HydrophobicContact CE2-CB 3.82Å; Y1003-L1008 HydrophobicContact CE2-CD1 3.65Å; Y1003-L1008 HydrophobicContact CE2-CG 4.39Å; Y1003-L1008 HydrophobicContact CG-CB 4.26Å; Y1003-L1008 PolarHBondContact O-N 2.85Å; A1006-L1008 HydrophobicContact CB-CD1 4.13Å; A1006-L1008 HydrophobicContact CB-CG 3.91Å
1009	L	97	Very high	84	Confident	7 Å²	7	61.6 Å²	61.6	4%	0.037	34%	0.34	C	S	.	.	S	Bend	trans	-81.6	131.7	177.9	-80.1	-176.7	0	0	0	112.6	L752 L935 Y1003 D1004 L1061 M1062	L752-L1009 HydrophobicContact CD2-CD2 4.15Å; L935-L1009 HydrophobicContact CD1-CD2 4.38Å; Y1003-L1009 HydrophobicContact CD1-CD2 3.58Å; Y1003-L1009 HydrophobicContact CD1-CG 3.84Å; Y1003-L1009 HydrophobicContact CE1-CD2 4.02Å; Y1003-L1009 HydrophobicContact CE1-CG 4.48Å; D1004-L1009 HydrophobicContact CB-CD1 3.59Å; D1004-L1009 HydrophobicContact CB-CG 4.34Å; L1009-L1061 HydrophobicContact CD1-CD1 4.12Å; L1009-L1061 HydrophobicContact CD1-CG 4.47Å; L1009-L1061 HydrophobicContact CD2-CD1 4.13Å; L1009-L1061 HydrophobicContact CD2-CD2 3.7Å; L1009-L1061 HydrophobicContact CD2-CG 4.1Å; L1009-M1062 HydrophobicContact CD1-CE 4.26Å
1010	P	96.3	Very high	81.1	Confident	12 Å²	12	67.8 Å²	67.8	8%	0.078	37%	0.373	C	S	.	.			trans	-58.9	141.9	165.7	-23.8	34.2	0	0	0	112	Y751 L752 R755 P756 V757 C1059	Y751-P1010 HydrophobicContact CE1-CB 4.3Å; L752-P1010 HydrophobicContact CD2-CG 4.46Å; R755-P1010 HydrophobicContact CB-CB 3.9Å; R755-P1010 HydrophobicContact CB-CG 4.1Å; P756-P1010 VanDerWaalsContact O-CA 3.26Å; P756-P1010 WeakPolarHBondContact O-CA 3.32Å; V757-P1010 HydrophobicContact CG2-CG 4.32Å; P1010-C1059 PolarHBondContact O-SG 2.82Å
1011	G	93.8	Very high	78.3	Confident	21 Å²	21	75.1 Å²	75.1	22%	0.216	41%	0.412	C	S	.	.			trans	-178.1	-171.7	-174.4	0	0	0	0	0	111.7	P756 Y799 F1058	P756-G1011 PolarHBondContact O-N 2.87Å; Y799-G1011 WeakPolarHBondContact CE1-O 3.35Å; G1011-F1058 CarbonylContact C-O 3.57Å; G1011-F1058 WeakPolarHBondContact CA-O 3.47Å
1012	Q	92.3	Very high	75.9	Confident	110 Å²	110	76.7 Å²	76.7	51%	0.514	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.1	179.6	63.3	-172.8	5.4	0	0	111.5	I1014 F1058	Q1012-I1014 PolarHBondContact O-N 3.23Å; Q1012-F1058 HydrophobicContact CG-CB 4.02Å; Q1012-F1058 HydrophobicContact CG-CD1 4.26Å; Q1012-F1058 PolarHBondContact N-O 2.58Å; Q1012-F1058 PolarHBondContact O-N 2.68Å
1013	W	90.9	Very high	73.3	Confident	66 Å²	66	84.9 Å²	84.9	25%	0.25	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127	168.1	-63.8	113.5	0	0	0	110	P758 S798 Y799 R1055 Q1056 I1057	P758-W1013 HydrophobicContact CB-CD2 4.18Å; P758-W1013 HydrophobicContact CB-CH2 4.25Å; P758-W1013 HydrophobicContact CB-CZ2 3.77Å; S798-W1013 PolarHBondContact O-NE1 2.89Å; S798-W1013 PolarHBondContact OG-NE1 3.1Å; S798-W1013 VanDerWaalsContact OG-NE1 3.15Å; Y799-W1013 AromaticContact CE2-CD1 3.64Å; Y799-W1013 AromaticContact CZ-CD1 3.52Å; Y799-W1013 PolarHBondContact OH-N 3.17Å; Y799-W1013 VanDerWaalsContact OH-N 3.08Å; W1013-R1055 HydrophobicContact CD2-CB 4.27Å; W1013-R1055 HydrophobicContact CE3-CB 3.54Å; W1013-R1055 HydrophobicContact CZ3-CB 3.95Å; W1013-Q1056 WeakPolarHBondContact CA-O 3.28Å; W1013-I1057 HydrophobicContact CD2-CG1 4.49Å; W1013-I1057 HydrophobicContact CE3-CD1 4.47Å; W1013-I1057 HydrophobicContact CE3-CG1 3.63Å; W1013-I1057 HydrophobicContact CH2-CD1 4Å; W1013-I1057 HydrophobicContact CH2-CG1 4.05Å; W1013-I1057 HydrophobicContact CZ3-CD1 3.8Å; W1013-I1057 HydrophobicContact CZ3-CG1 3.39Å
1014	I	88.1	Confident	70.2	Confident	66 Å²	66	90.8 Å²	90.8	34%	0.338	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	124	158	-67.4	173.6	0	0	0	106.7	Q1012 A1016 Q1056 F1058	Q1012-I1014 PolarHBondContact O-N 3.23Å; I1014-A1016 PolarHBondContact O-N 3.36Å; I1014-Q1056 HydrophobicContact CB-CB 4.31Å; I1014-Q1056 PolarHBondContact N-O 3.46Å; I1014-Q1056 PolarHBondContact O-N 3.39Å; I1014-F1058 HydrophobicContact CD1-CB 3.85Å; I1014-F1058 HydrophobicContact CD1-CD2 4.49Å; I1014-F1058 HydrophobicContact CG1-CB 3.98Å
1015	E	72.7	Confident	67.2	Low	136 Å²	136	90.8 Å²	90.8	64%	0.636	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-70.8	120.4	160.4	-55.4	-147.9	121.7	0	0	107	E1017 R1055	E1015-E1017 PolarHBondContact O-N 2.64Å; E1015-R1055 IonicContact OE1-CZ 2.92Å; E1015-R1055 IonicContact OE1-NH2 3.93Å; E1015-R1055 PolarHBondContact OE1-NH2 2.89Å
1016	A	50.1	Low	64.3	Low	53 Å²	53	94.9 Å²	94.9	44%	0.438	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-63.6	121.5	170.8	0	0	0	0	0	106.8	I1014 E1018	I1014-A1016 PolarHBondContact O-N 3.36Å; A1016-E1018 PolarHBondContact O-N 2.87Å
1017	E	41.1	Very low	61.4	Low	179 Å²	179	100.5 Å²	100.5	84%	0.836	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-53.6	127.9	171.3	-63.6	-173.7	155.5	0	0	107.6	E1015 D1019	E1015-E1017 PolarHBondContact O-N 2.64Å; E1017-D1019 PolarHBondContact O-N 2.96Å
1018	E	42.9	Very low	58.6	Low	190 Å²	190	107 Å²	107	89%	0.888	58%	0.579	S	S	*	*			trans	-71.3	105	173.7	-65.8	-166.8	136.7	0	0	106.6	A1016 N1020	A1016-E1018 PolarHBondContact O-N 2.87Å; E1018-N1020 PolarHBondContact O-N 3.41Å
1019	D	36.3	Very low	55.6	Low	146 Å²	146	115 Å²	115	78%	0.781	62%	0.621	S	S	*	*			trans	-46.2	105.5	-179.2	-69.6	-55.7	0	0	0	109.8	E1017 D1021	E1017-D1019 PolarHBondContact O-N 2.96Å; D1019-D1021 PolarHBondContact O-N 3.42Å
1020	N	35.7	Very low	52.6	Low	134 Å²	134	118.5 Å²	118.5	72%	0.717	66%	0.659	S	S	*	*			trans	-81	41.7	-171	-165.9	41.1	0	0	0	112.3	E1018 T1022	E1018-N1020 PolarHBondContact O-N 3.41Å; N1020-T1022 PolarHBondContact O-N 3.41Å
1021	D	40.6	Very low	49.7	Very low	155 Å²	155	127.2 Å²	127.2	83%	0.829	70%	0.698	S	S	*	*			trans	-72.2	56.1	170.4	-83.7	-15.8	0	0	0	110	D1019	D1019-D1021 PolarHBondContact O-N 3.42Å
1022	T	45.3	Very low	46.8	Very low	122 Å²	122	135.1 Å²	135.1	75%	0.748	73%	0.73	S	S	*	*			trans	-144.3	27.7	174.5	-50.8	0	0	0	0	111.8	N1020	N1020-T1022 PolarHBondContact O-N 3.41Å
1023	E	42.8	Very low	44	Very low	184 Å²	184	136.6 Å²	136.6	86%	0.86	74%	0.74	S	S	*	*			trans	-148.2	68.5	165.1	-130.4	167.4	-119.6	0	0	113.4
1024	S	33.7	Very low	41.1	Very low	124 Å²	124	139.4 Å²	139.4	87%	0.867	76%	0.76	S	S	*	*			trans	-127.5	72.5	156.8	71.1	0	0	0	0	109.5
1025	G	32.7	Very low	38.5	Very low	67 Å²	67	143 Å²	143	69%	0.691	79%	0.786	S	S	*	*			trans	-88.9	119.1	171.3	0	0	0	0	0	110.5
1026	D	33.5	Very low	36.5	Very low	156 Å²	156	143.3 Å²	143.3	83%	0.834	79%	0.792	S	S	*	*			trans	-172.4	131.1	163.2	-84.7	-23.2	0	0	0	103.5
1027	D	33.7	Very low	35.8	Very low	145 Å²	145	148.2 Å²	148.2	78%	0.775	81%	0.811	S	S	*	*			cis	-161.8	-172.5	-8.6	-145.2	-13	0	0	0	108.6
1028	E	35.2	Very low	35.5	Very low	172 Å²	172	148.3 Å²	148.3	80%	0.804	81%	0.811	S	S	*	*			trans	68.4	99.2	164.9	-64.2	-172.3	151.7	0	0	120.7
1029	D	33.7	Very low	35	Very low	170 Å²	170	147.3 Å²	147.3	91%	0.909	81%	0.807	S	S	*	*				51.1	130	120.8	-64.1	-5.7	0	0	0	123.6
1030	G	33.1	Very low	34.9	Very low	80 Å²	80	148.1 Å²	148.1	83%	0.825	81%	0.808	S	S	*	*			trans	175.6	68	167.4	0	0	0	0	0	116.3
1031	E	35.1	Very low	34.8	Very low	195 Å²	195	150 Å²	150	91%	0.911	81%	0.812	S	S	*	*			trans	-83.7	123.5	166.6	-71.8	-168.2	169.6	0	0	111.9
1032	E	34.3	Very low	34.3	Very low	188 Å²	188	149.9 Å²	149.9	88%	0.879	81%	0.811	S	S	*	*			trans	176.1	151.1	149.5	-99.5	-175	175	0	0	106.6
1033	L	32.1	Very low	33.7	Very low	140 Å²	140	150.9 Å²	150.9	73%	0.733	81%	0.812	S	S	*	*			cis	-179.2	146.9	-26.9	-156.1	89.9	0	0	0	104.2
1034	D	29.5	Very low	33.4	Very low	125 Å²	125	150.5 Å²	150.5	67%	0.668	82%	0.815	S	S	*	*			trans	17.1	128.2	158.7	-49.9	-16	0	0	0	121.6
1035	T	33.8	Very low	33.3	Very low	143 Å²	143	151.5 Å²	151.5	88%	0.877	81%	0.811	S	S	*	*				-169.1	155.7	101.4	17.1	0	0	0	0	113
1036	D	32.2	Very low	33.5	Very low	142 Å²	142	154 Å²	154	76%	0.759	82%	0.815	S	S	*	*			trans	-93.3	173.5	-164.6	-57.9	-79.3	0	0	0	116.7
1037	D	33.5	Very low	33.4	Very low	156 Å²	156	155.9 Å²	155.9	83%	0.834	82%	0.815	S	S	*	*			trans	104.2	144.2	136.9	-83.9	-32	0	0	0	123.8
1038	E	36.5	Very low	33.3	Very low	180 Å²	180	154.5 Å²	154.5	84%	0.841	81%	0.814	S	S	*	*			trans	72.5	105	168.8	-52.8	-150.8	166.3	0	0	121.9
1039	E	32.2	Very low	33.4	Very low	170 Å²	170	152.1 Å²	152.1	79%	0.794	81%	0.814	S	S	*	*			trans	7.6	145.3	140.4	-47.7	-172.5	167.3	0	0	119.7
1040	M	33.6	Very low	33.4	Very low	163 Å²	163	155.6 Å²	155.6	80%	0.803	81%	0.814	S	S	*	*			cis	-165.2	168.6	40.7	-160.7	178	-73	0	0	112.2
1041	E	33.9	Very low	33.4	Very low	174 Å²	174	161.6 Å²	161.6	81%	0.813	81%	0.812	S	S	*	*			trans	-55.4	144.1	-174.5	-52	-177.7	132.9	0	0	116.7
1042	N	29.6	Very low	33.5	Very low	151 Å²	151	162 Å²	162	81%	0.807	81%	0.811	S	S	*	*			trans	-168.5	155.1	130.7	-112.7	-78	0	0	0	113.9
1043	N	32.2	Very low	33.7	Very low	144 Å²	144	157.8 Å²	157.8	77%	0.77	80%	0.802	S	S	*	*			trans	74.5	84	174.7	-54.8	-74	0	0	0	118.5	N1045	N1043-N1045 PolarHBondContact O-N 3.45Å
1044	L	36.8	Very low	34.8	Very low	175 Å²	175	162.3 Å²	162.3	92%	0.916	81%	0.809	S	S	*	*			trans	-69.1	116	149.6	-76.6	167.9	0	0	0	110.2
1045	N	32.7	Very low	36.7	Very low	146 Å²	146	162.6 Å²	162.6	78%	0.781	80%	0.801	S	S	*	*			trans	-157.1	109.7	158	-111.8	-34.6	0	0	0	109.6	N1043 K1047	N1043-N1045 PolarHBondContact O-N 3.45Å; N1045-K1047 PolarHBondContact O-N 3.21Å
1046	P	36.9	Very low	38.9	Very low	120 Å²	120	161.7 Å²	161.7	78%	0.779	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.7	135.9	176.3	27.8	-33	0	0	0	110.1
1047	K	29.9	Very low	41.6	Very low	194 Å²	194	158.8 Å²	158.8	84%	0.843	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-58.7	136.9	173.5	-64.9	175.2	-179.1	171.3	0	108.9	N1045	N1045-K1047 PolarHBondContact O-N 3.21Å
1048	P	33.1	Very low	44.4	Very low	116 Å²	116	154.7 Å²	154.7	75%	0.753	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-60.9	144.6	175.5	26.9	-34.3	0	0	0	109.8
1049	P	35.6	Very low	47.1	Very low	122 Å²	122	146.7 Å²	146.7	79%	0.792	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-59.7	146.4	-178.7	24.7	-34	0	0	0	111.1	R1051	P1049-R1051 PolarHBondContact O-N 3.25Å
1050	R	34.5	Very low	50.1	Low	244 Å²	244	141.5 Å²	141.5	92%	0.921	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-51.6	136.3	172.6	-76.6	176.9	167.3	165.9	-7	109	K1052	R1050-K1052 PolarHBondContact O-N 3.06Å
1051	R	34.3	Very low	53	Low	205 Å²	205	134 Å²	134	77%	0.774	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-58.1	127.3	175.8	-71.2	177.5	173.3	173.5	-3.2	108.2	P1049 S1053	P1049-R1051 PolarHBondContact O-N 3.25Å; R1051-S1053 PolarHBondContact O-N 2.92Å
1052	K	36.1	Very low	56	Low	203 Å²	203	127.3 Å²	127.3	88%	0.883	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-54.3	139.4	168.3	-67.8	-170.9	174.7	-168.5	0	108.9	R1050	R1050-K1052 PolarHBondContact O-N 3.06Å
1053	S	39.1	Very low	59.2	Low	100 Å²	100	124.3 Å²	124.3	70%	0.699	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-58	146.7	170.3	-166.9	0	0	0	0	109.8	R1051 R1055	R1051-S1053 PolarHBondContact O-N 2.92Å; S1053-R1055 PolarHBondContact O-N 2.85Å
1054	R	55.7	Low	62.4	Low	235 Å²	235	118.8 Å²	118.8	89%	0.887	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-78.3	118.8	171.5	-83.9	-178.7	164.9	-177.2	-7.5	107.3	Q1056	R1054-Q1056 PolarHBondContact O-N 2.84Å
1055	R	67.8	Low	65.3	Low	131 Å²	131	110.8 Å²	110.8	49%	0.494	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-52.2	134.8	167.6	-73.6	-179.9	163.1	179	-11.5	109.2	W1013 E1015 S1053	W1013-R1055 HydrophobicContact CD2-CB 4.27Å; W1013-R1055 HydrophobicContact CE3-CB 3.54Å; W1013-R1055 HydrophobicContact CZ3-CB 3.95Å; E1015-R1055 IonicContact OE1-CZ 2.92Å; E1015-R1055 IonicContact OE1-NH2 3.93Å; E1015-R1055 PolarHBondContact OE1-NH2 2.89Å; S1053-R1055 PolarHBondContact O-N 2.85Å
1056	Q	80.6	Confident	68.4	Low	125 Å²	125	107.2 Å²	107.2	58%	0.584	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	150.6	178.5	-177	167.2	-13.5	0	0	109.3	W1013 I1014 R1054	W1013-Q1056 WeakPolarHBondContact CA-O 3.28Å; I1014-Q1056 HydrophobicContact CB-CB 4.31Å; I1014-Q1056 PolarHBondContact N-O 3.46Å; I1014-Q1056 PolarHBondContact O-N 3.39Å; R1054-Q1056 PolarHBondContact O-N 2.84Å
1057	I	89.1	Confident	71.2	Confident	80 Å²	80	104.5 Å²	104.5	41%	0.41	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.4	175.1	-64	168.7	0	0	0	108.5	P758 W1013	P758-I1057 HydrophobicContact CB-CD1 3.98Å; P758-I1057 HydrophobicContact CB-CG1 4.08Å; P758-I1057 HydrophobicContact CB-CG2 4.48Å; P758-I1057 HydrophobicContact CG-CG1 4.48Å; P758-I1057 HydrophobicContact CG-CG2 4.01Å; W1013-I1057 HydrophobicContact CD2-CG1 4.49Å; W1013-I1057 HydrophobicContact CE3-CD1 4.47Å; W1013-I1057 HydrophobicContact CE3-CG1 3.63Å; W1013-I1057 HydrophobicContact CH2-CD1 4Å; W1013-I1057 HydrophobicContact CH2-CG1 4.05Å; W1013-I1057 HydrophobicContact CZ3-CD1 3.8Å; W1013-I1057 HydrophobicContact CZ3-CG1 3.39Å
1058	F	92.6	Very high	74.5	Confident	70 Å²	70	95.4 Å²	95.4	31%	0.307	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.6	164.2	-178.3	-99.7	0	0	0	109.9	G1011 Q1012 I1014 Q1060 H1063	G1011-F1058 CarbonylContact C-O 3.57Å; G1011-F1058 WeakPolarHBondContact CA-O 3.47Å; Q1012-F1058 HydrophobicContact CG-CB 4.02Å; Q1012-F1058 HydrophobicContact CG-CD1 4.26Å; Q1012-F1058 PolarHBondContact N-O 2.58Å; Q1012-F1058 PolarHBondContact O-N 2.68Å; I1014-F1058 HydrophobicContact CD1-CB 3.85Å; I1014-F1058 HydrophobicContact CD1-CD2 4.49Å; I1014-F1058 HydrophobicContact CG1-CB 3.98Å; F1058-Q1060 HydrophobicContact CE1-CB 4.11Å; F1058-H1063 HydrophobicContact CE2-CB 4.09Å; F1058-H1063 HydrophobicContact CZ-CB 4.12Å
1059	C	93.6	Very high	77.6	Confident	12 Å²	12	91.8 Å²	91.8	8%	0.081	42%	0.42	C	S	.	.			trans	-111.1	118.4	168	-175.8	0	0	0	0	110.3	P1010 L1061 M1062 H1063	P1010-C1059 PolarHBondContact O-SG 2.82Å; C1059-L1061 PolarHBondContact O-N 3.21Å; C1059-M1062 HydrophobicContact CB-CB 4.06Å; C1059-M1062 PolarHBondContact O-N 2.62Å; C1059-H1063 PolarHBondContact O-N 3.4Å; C1059-H1063 VanDerWaalsContact O-N 3.16Å
1060	Q	94.1	Very high	80.5	Confident	61 Å²	61	90.3 Å²	90.3	29%	0.285	40%	0.401	S	S	.	.	H	α-helix	trans	-60.1	-41.6	-175.9	-173.6	180	20.6	0	0	112.7	N678 F1058 H1063 H1064	N678-Q1060 PolarHBondContact ND2-NE2 3.41Å; F1058-Q1060 HydrophobicContact CE1-CB 4.11Å; Q1060-H1063 PolarHBondContact O-N 3.28Å; Q1060-H1064 PolarHBondContact O-CD2 3.43Å; Q1060-H1064 PolarHBondContact O-N 3.49Å
1061	L	95.3	Very high	83.4	Confident	7 Å²	7	79.7 Å²	79.7	4%	0.037	36%	0.362	C	S	.	.	H	α-helix	trans	-73.4	-30	-177.7	80.5	76.4	0	0	0	112.6	W677 L752 L935 A942 C1000 L1009 C1059 H1064 L1065	W677-L1061 HydrophobicContact CD2-CB 4.47Å; W677-L1061 HydrophobicContact CH2-CD2 3.91Å; W677-L1061 HydrophobicContact CZ2-CB 3.96Å; W677-L1061 HydrophobicContact CZ2-CD2 3.7Å; W677-L1061 HydrophobicContact CZ2-CG 4.47Å; W677-L1061 HydrophobicContact CZ3-CD2 4.42Å; L752-L1061 HydrophobicContact CD2-CD2 4.01Å; L935-L1061 HydrophobicContact CD2-CD2 4.16Å; A942-L1061 HydrophobicContact CB-CB 4.06Å; A942-L1061 HydrophobicContact CB-CD1 4.02Å; C1000-L1061 HydrophobicContact CB-CD1 4.47Å; L1009-L1061 HydrophobicContact CD1-CD1 4.12Å; L1009-L1061 HydrophobicContact CD1-CG 4.47Å; L1009-L1061 HydrophobicContact CD2-CD1 4.13Å; L1009-L1061 HydrophobicContact CD2-CD2 3.7Å; L1009-L1061 HydrophobicContact CD2-CG 4.1Å; C1059-L1061 PolarHBondContact O-N 3.21Å; L1061-H1064 PolarHBondContact O-N 3.35Å; L1061-L1065 VanDerWaalsContact O-CB 3.31Å; L1061-L1065 WeakPolarHBondContact O-CB 3.46Å; L1061-L1065 PolarHBondContact O-N 2.85Å
1062	M	96.9	Very high	86.3	Confident	32 Å²	32	70.4 Å²	70.4	16%	0.158	33%	0.327	C	S	.	.	H	α-helix	trans	-70.4	-37.7	174.9	-169	61.9	77.5	0	0	111.6	C1000 N1001 D1004 L1009 C1059 L1065 T1066	C1000-M1062 HydrophobicContact CB-CE 4.03Å; N1001-M1062 WeakPolarHBondContact OD1-CE 3.21Å; D1004-M1062 HydrophobicContact CB-CE 3.68Å; L1009-M1062 HydrophobicContact CD1-CE 4.26Å; C1059-M1062 HydrophobicContact CB-CB 4.06Å; C1059-M1062 PolarHBondContact O-N 2.62Å; M1062-L1065 HydrophobicContact SD-CD2 4.44Å; M1062-T1066 PolarHBondContact O-N 3Å; M1062-T1066 VanDerWaalsContact O-N 3.09Å; M1062-T1066 PolarHBondContact O-OG1 3.44Å
1063	H	96.9	Very high	89.1	Confident	89 Å²	89	64.7 Å²	64.7	41%	0.412	30%	0.302	S	S	.	.	H	α-helix	trans	-61	-51.7	170.2	176.3	-87.6	0	0	0	111.2	F1058 C1059 Q1060 L1065 T1066 E1067	F1058-H1063 HydrophobicContact CE2-CB 4.09Å; F1058-H1063 HydrophobicContact CZ-CB 4.12Å; C1059-H1063 PolarHBondContact O-N 3.4Å; C1059-H1063 VanDerWaalsContact O-N 3.16Å; Q1060-H1063 PolarHBondContact O-N 3.28Å; H1063-L1065 VanDerWaalsContact C-N 3.32Å; H1063-L1065 PolarHBondContact O-N 2.95Å; H1063-T1066 WeakPolarHBondContact O-CB 3.49Å; H1063-T1066 PolarHBondContact O-N 3.38Å; H1063-T1066 VanDerWaalsContact O-N 3.09Å; H1063-E1067 PolarHBondContact O-N 3.41Å
1064	H	97.9	Very high	91.8	Very high	28 Å²	28	65.1 Å²	65.1	13%	0.13	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-40.8	177.6	-71.9	-47.8	0	0	0	113.4	N678 A942 Q1060 L1061 T1066 E1067 N1068	N678-H1064 PolarHBondContact ND2-NE2 3.48Å; A942-H1064 VanDerWaalsContact O-CB 3.32Å; A942-H1064 WeakPolarHBondContact O-CB 3.24Å; Q1060-H1064 PolarHBondContact O-CD2 3.43Å; Q1060-H1064 PolarHBondContact O-N 3.49Å; L1061-H1064 PolarHBondContact O-N 3.35Å; H1064-T1066 VanDerWaalsContact C-N 3.27Å; H1064-T1066 PolarHBondContact O-N 3.5Å; H1064-E1067 PolarHBondContact O-N 3.48Å; H1064-N1068 WeakPolarHBondContact O-CB 3.48Å; H1064-N1068 PolarHBondContact O-N 2.86Å; H1064-N1068 PolarHBondContact O-ND2 3.38Å
1065	L	97.9	Very high	93.6	Very high	7 Å²	7	56.6 Å²	56.6	4%	0.037	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-36.8	175.8	-171.3	61.2	0	0	0	112.3	P941 A942 I992 V996 C1000 L1061 M1062 H1063 H1069	P941-L1065 HydrophobicContact CB-CD1 3.91Å; P941-L1065 WeakPolarHBondContact O-CA 3.49Å; A942-L1065 HydrophobicContact CB-CB 4.27Å; A942-L1065 HydrophobicContact CB-CD1 4.49Å; I992-L1065 HydrophobicContact CG1-CD1 4.43Å; I992-L1065 HydrophobicContact CG2-CD1 3.93Å; I992-L1065 HydrophobicContact CG2-CG 4.48Å; V996-L1065 HydrophobicContact CB-CD1 4.16Å; V996-L1065 HydrophobicContact CG1-CD1 3.61Å; V996-L1065 HydrophobicContact CG1-CD2 4.14Å; C1000-L1065 HydrophobicContact CB-CD2 3.72Å; L1061-L1065 VanDerWaalsContact O-CB 3.31Å; L1061-L1065 WeakPolarHBondContact O-CB 3.46Å; L1061-L1065 PolarHBondContact O-N 2.85Å; M1062-L1065 HydrophobicContact SD-CD2 4.44Å; H1063-L1065 VanDerWaalsContact C-N 3.32Å; H1063-L1065 PolarHBondContact O-N 2.95Å; L1065-H1069 VanDerWaalsContact O-CB 3.29Å; L1065-H1069 WeakPolarHBondContact O-CB 3.45Å; L1065-H1069 PolarHBondContact O-N 3.33Å
1066	T	97.4	Very high	94.8	Very high	70 Å²	70	52 Å²	52	43%	0.429	25%	0.25	S	C	.	.	H	α-helix	trans	-67.8	-46.1	175.4	-56.4	0	0	0	0	111.6	M1062 H1063 H1064 H1069 K1070	M1062-T1066 PolarHBondContact O-N 3Å; M1062-T1066 VanDerWaalsContact O-N 3.09Å; M1062-T1066 PolarHBondContact O-OG1 3.44Å; H1063-T1066 WeakPolarHBondContact O-CB 3.49Å; H1063-T1066 PolarHBondContact O-N 3.38Å; H1063-T1066 VanDerWaalsContact O-N 3.09Å; H1064-T1066 VanDerWaalsContact C-N 3.27Å; H1064-T1066 PolarHBondContact O-N 3.5Å; T1066-H1069 WeakPolarHBondContact O-CB 3.49Å; T1066-H1069 PolarHBondContact O-N 3.44Å; T1066-K1070 PolarHBondContact O-N 2.96Å
1067	E	97.7	Very high	95.3	Very high	63 Å²	63	52.6 Å²	52.6	29%	0.294	25%	0.252	S	S	.	.	H	α-helix	trans	-69.1	-41.7	-179.8	-60	-43.8	100.1	0	0	112.7	H1063 H1064 H1069 K1070 I1071	H1063-E1067 PolarHBondContact O-N 3.41Å; H1064-E1067 PolarHBondContact O-N 3.48Å; E1067-H1069 PolarHBondContact O-N 3.37Å; E1067-K1070 PolarHBondContact O-N 3.05Å; E1067-K1070 VanDerWaalsContact OE1-CE 3.31Å; E1067-K1070 WeakPolarHBondContact OE1-CE 3.42Å; E1067-K1070 IonicContact OE1-NZ 2.98Å; E1067-K1070 PolarHBondContact OE1-NZ 3.16Å; E1067-K1070 IonicContact OE2-NZ 3.28Å; E1067-K1070 PolarHBondContact OE2-NZ 3.35Å; E1067-I1071 WeakPolarHBondContact O-CG1 3.4Å; E1067-I1071 PolarHBondContact O-N 3.09Å
1068	N	98.1	Very high	95.4	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-31.6	175.8	-71.3	-36.1	0	0	0	112.1	P941 K943 H1064	P941-N1068 PolarHBondContact O-ND2 3.24Å; K943-N1068 PolarHBondContact O-ND2 3.4Å; H1064-N1068 WeakPolarHBondContact O-CB 3.48Å; H1064-N1068 PolarHBondContact O-N 2.86Å; H1064-N1068 PolarHBondContact O-ND2 3.38Å
1069	H	97.4	Very high	95.2	Very high	40 Å²	40	55.2 Å²	55.2	19%	0.185	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-43.5	174.5	-164.7	166.6	0	0	0	112.3	E989 I992 T993 L1065 T1066 E1067 I1071 W1072 K1073	E989-H1069 IonicContact OE1-NE2 3.2Å; E989-H1069 PolarHBondContact OE1-NE2 3.4Å; I992-H1069 HydrophobicContact CG2-CB 3.98Å; T993-H1069 PolarHBondContact OG1-CE1 2.85Å; T993-H1069 PolarHBondContact OG1-NE2 3.15Å; L1065-H1069 VanDerWaalsContact O-CB 3.29Å; L1065-H1069 WeakPolarHBondContact O-CB 3.45Å; L1065-H1069 PolarHBondContact O-N 3.33Å; T1066-H1069 WeakPolarHBondContact O-CB 3.49Å; T1066-H1069 PolarHBondContact O-N 3.44Å; E1067-H1069 PolarHBondContact O-N 3.37Å; H1069-I1071 VanDerWaalsContact C-N 3.34Å; H1069-I1071 PolarHBondContact O-N 3.37Å; H1069-W1072 PolarHBondContact O-N 2.9Å; H1069-K1073 PolarHBondContact CE1-NZ 3.27Å; H1069-K1073 WeakPolarHBondContact NE2-CE 3.46Å; H1069-K1073 PolarHBondContact NE2-NZ 2.72Å; H1069-K1073 PolarHBondContact O-N 3.3Å
1070	K	96.8	Very high	95	Very high	92 Å²	92	60.8 Å²	60.8	40%	0.4	29%	0.289	S	S	.	.	H	α-helix	trans	-56	-48.8	177	-67.7	171.3	-176	167.9	0	111.5	T1066 E1067 W1072 K1073 E1074	T1066-K1070 PolarHBondContact O-N 2.96Å; E1067-K1070 PolarHBondContact O-N 3.05Å; E1067-K1070 VanDerWaalsContact OE1-CE 3.31Å; E1067-K1070 WeakPolarHBondContact OE1-CE 3.42Å; E1067-K1070 IonicContact OE1-NZ 2.98Å; E1067-K1070 PolarHBondContact OE1-NZ 3.16Å; E1067-K1070 IonicContact OE2-NZ 3.28Å; E1067-K1070 PolarHBondContact OE2-NZ 3.35Å; K1070-W1072 VanDerWaalsContact C-N 3.29Å; K1070-W1072 PolarHBondContact O-N 3.35Å; K1070-K1073 PolarHBondContact O-N 2.93Å; K1070-E1074 WeakPolarHBondContact O-CG 3.44Å; K1070-E1074 PolarHBondContact O-N 3.37Å
1071	I	95.8	Very high	94.7	Very high	20 Å²	20	64.5 Å²	64.5	10%	0.103	30%	0.304	C	S	.	.	H	α-helix	trans	-53.1	-44.8	-177.9	-65.4	163.9	0	0	0	111.7	R945 E1067 H1069 I1075	R945-I1071 HydrophobicContact CG-CD1 4.01Å; R945-I1071 VanDerWaalsContact NH1-CD1 3.25Å; E1067-I1071 WeakPolarHBondContact O-CG1 3.4Å; E1067-I1071 PolarHBondContact O-N 3.09Å; H1069-I1071 VanDerWaalsContact C-N 3.34Å; H1069-I1071 PolarHBondContact O-N 3.37Å; I1071-I1075 HydrophobicContact CG2-CD1 3.88Å; I1071-I1075 WeakPolarHBondContact O-CD1 3.49Å; I1071-I1075 VanDerWaalsContact O-CG1 3.22Å; I1071-I1075 WeakPolarHBondContact O-CG1 3.47Å; I1071-I1075 PolarHBondContact O-N 3.19Å; I1071-I1075 VanDerWaalsContact O-N 3.11Å
1072	W	96.4	Very high	94.1	Very high	11 Å²	11	68.6 Å²	68.6	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-74.6	-28.2	-180	-60	116.8	0	0	0	113.6	H948 L949 T952 L984 A985 Q988 E989 H1069 K1070 I1075 I1076	H948-W1072 AromaticContact CD2-NE1 3.94Å; H948-W1072 AromaticContact CE1-NE1 3.89Å; H948-W1072 AromaticContact NE2-CE2 3.54Å; H948-W1072 AromaticContact NE2-CZ2 3.52Å; H948-W1072 AromaticContact NE2-NE1 3Å; H948-W1072 PolarHBondContact NE2-NE1 3.46Å; L949-W1072 HydrophobicContact CD2-CH2 3.77Å; L949-W1072 HydrophobicContact CD2-CZ2 3.66Å; T952-W1072 HydrophobicContact CG2-CH2 4.2Å; T952-W1072 HydrophobicContact CG2-CZ2 4.09Å; L984-W1072 HydrophobicContact CD1-CH2 4.27Å; L984-W1072 HydrophobicContact CD2-CH2 4.05Å; L984-W1072 HydrophobicContact CD2-CZ3 4.08Å; L984-W1072 HydrophobicContact CG-CH2 4.01Å; L984-W1072 HydrophobicContact CG-CZ3 3.88Å; A985-W1072 HydrophobicContact CB-CE3 3.78Å; A985-W1072 HydrophobicContact CB-CZ3 4.44Å; Q988-W1072 HydrophobicContact CB-CD2 3.67Å; Q988-W1072 VanDerWaalsContact CB-CE2 3.49Å; Q988-W1072 HydrophobicContact CB-CE3 4.43Å; Q988-W1072 HydrophobicContact CB-CG 3.71Å; Q988-W1072 HydrophobicContact CB-CZ2 4.09Å; Q988-W1072 HydrophobicContact CG-CD2 4.23Å; Q988-W1072 HydrophobicContact CG-CH2 4.31Å; Q988-W1072 HydrophobicContact CG-CZ2 3.78Å; E989-W1072 HydrophobicContact CB-CB 4.21Å; H1069-W1072 PolarHBondContact O-N 2.9Å; K1070-W1072 VanDerWaalsContact C-N 3.29Å; K1070-W1072 PolarHBondContact O-N 3.35Å; W1072-I1075 HydrophobicContact CE3-CD1 3.75Å; W1072-I1075 HydrophobicContact CZ3-CD1 3.91Å; W1072-I1076 WeakPolarHBondContact O-CD1 3.21Å; W1072-I1076 WeakPolarHBondContact O-CG1 3.42Å; W1072-I1076 PolarHBondContact O-N 3.39Å
1073	K	94.8	Very high	93.4	Very high	83 Å²	83	72.4 Å²	72.4	36%	0.361	35%	0.348	S	S	.	.	H	α-helix	trans	-70.7	-45.3	173.2	-81.4	179	162.7	152.8	0	111.9	E989 H1069 K1070 I1075 I1076 E1077	E989-K1073 HydrophobicContact CG-CD 4.44Å; E989-K1073 HydrophobicContact CG-CG 3.87Å; E989-K1073 VanDerWaalsContact OE1-CE 3.22Å; E989-K1073 WeakPolarHBondContact OE1-CE 3.47Å; E989-K1073 IonicContact OE1-NZ 2.95Å; E989-K1073 PolarHBondContact OE1-NZ 3.32Å; H1069-K1073 PolarHBondContact CE1-NZ 3.27Å; H1069-K1073 WeakPolarHBondContact NE2-CE 3.46Å; H1069-K1073 PolarHBondContact NE2-NZ 2.72Å; H1069-K1073 PolarHBondContact O-N 3.3Å; K1070-K1073 PolarHBondContact O-N 2.93Å; K1073-I1075 VanDerWaalsContact C-N 3.31Å; K1073-I1075 PolarHBondContact O-N 3.46Å; K1073-I1076 PolarHBondContact O-N 3.46Å; K1073-I1076 VanDerWaalsContact O-N 3.1Å; K1073-E1077 WeakPolarHBondContact O-CG 3.44Å; K1073-E1077 PolarHBondContact O-N 2.94Å
1074	E	94.9	Very high	92.4	Very high	109 Å²	109	70.4 Å²	70.4	51%	0.509	35%	0.347	S	S	.	.	H	α-helix	trans	-54.6	-46.9	172.8	-69.8	161.3	-169.2	0	0	110.9	K1070 I1076 E1077 E1078	K1070-E1074 WeakPolarHBondContact O-CG 3.44Å; K1070-E1074 PolarHBondContact O-N 3.37Å; E1074-I1076 PolarHBondContact O-N 3.01Å; E1074-E1077 PolarHBondContact O-N 3.11Å; E1074-E1078 WeakPolarHBondContact O-CG 3.27Å; E1074-E1078 PolarHBondContact O-N 3.14Å
1075	I	93.1	Very high	91.3	Very high	55 Å²	55	72.1 Å²	72.1	28%	0.282	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-37.7	177	-65.7	163.3	0	0	0	112.3	A985 I1071 W1072 K1073 E1079	A985-I1075 HydrophobicContact CB-CB 4.06Å; A985-I1075 HydrophobicContact CB-CG2 3.62Å; I1071-I1075 HydrophobicContact CG2-CD1 3.88Å; I1071-I1075 WeakPolarHBondContact O-CD1 3.49Å; I1071-I1075 VanDerWaalsContact O-CG1 3.22Å; I1071-I1075 WeakPolarHBondContact O-CG1 3.47Å; I1071-I1075 PolarHBondContact O-N 3.19Å; I1071-I1075 VanDerWaalsContact O-N 3.11Å; W1072-I1075 HydrophobicContact CE3-CD1 3.75Å; W1072-I1075 HydrophobicContact CZ3-CD1 3.91Å; K1073-I1075 VanDerWaalsContact C-N 3.31Å; K1073-I1075 PolarHBondContact O-N 3.46Å; I1075-E1079 VanDerWaalsContact O-CB 3.28Å; I1075-E1079 WeakPolarHBondContact O-CB 3.41Å; I1075-E1079 PolarHBondContact O-N 3.14Å
1076	I	92.6	Very high	89.8	Confident	36 Å²	36	73.3 Å²	73.3	19%	0.185	37%	0.371	C	S	.	.	H	α-helix	trans	-65.2	-43.9	175.1	-71.7	162.3	0	0	0	110.8	A985 E989 W1072 K1073 E1074 E1079 E1080	A985-I1076 HydrophobicContact CB-CD1 4.44Å; A985-I1076 HydrophobicContact CB-CG1 3.8Å; E989-I1076 HydrophobicContact CB-CD1 3.71Å; E989-I1076 HydrophobicContact CG-CD1 4Å; W1072-I1076 WeakPolarHBondContact O-CD1 3.21Å; W1072-I1076 WeakPolarHBondContact O-CG1 3.42Å; W1072-I1076 PolarHBondContact O-N 3.39Å; K1073-I1076 PolarHBondContact O-N 3.46Å; K1073-I1076 VanDerWaalsContact O-N 3.1Å; E1074-I1076 PolarHBondContact O-N 3.01Å; I1076-E1079 WeakPolarHBondContact O-CB 3.39Å; I1076-E1079 PolarHBondContact O-N 3.24Å; I1076-E1080 WeakPolarHBondContact O-CG 3.38Å; I1076-E1080 PolarHBondContact O-N 2.81Å
1077	E	92.2	Very high	88.2	Confident	137 Å²	137	74.7 Å²	74.7	64%	0.64	38%	0.376	S	S	*	.	H	α-helix	trans	-65.2	-40.4	178.6	-71.1	177.2	-157.3	0	0	111.8	K1073 E1074 K1081	K1073-E1077 WeakPolarHBondContact O-CG 3.44Å; K1073-E1077 PolarHBondContact O-N 2.94Å; E1074-E1077 PolarHBondContact O-N 3.11Å; E1077-K1081 VanDerWaalsContact O-CB 3.23Å; E1077-K1081 WeakPolarHBondContact O-CB 3.37Å; E1077-K1081 PolarHBondContact O-N 2.9Å
1078	E	90.8	Very high	86.4	Confident	134 Å²	134	77.6 Å²	77.6	63%	0.626	39%	0.387	S	S	*	.	H	α-helix	trans	-62.9	-46.2	170.8	-73	-169.4	155.1	0	0	112	E1074 E1080 K1081 C1082	E1074-E1078 WeakPolarHBondContact O-CG 3.27Å; E1074-E1078 PolarHBondContact O-N 3.14Å; E1078-E1080 PolarHBondContact O-N 3.18Å; E1078-K1081 PolarHBondContact O-N 3.23Å; E1078-C1082 WeakPolarHBondContact O-CB 3.4Å; E1078-C1082 PolarHBondContact O-N 2.87Å; E1078-C1082 PolarHBondContact O-SG 3.42Å
1079	E	89.1	Confident	84.3	Confident	71 Å²	71	82.2 Å²	82.2	33%	0.332	41%	0.411	S	S	.	.	H	α-helix	trans	-58.2	-44.2	176.5	-95.5	-161.8	-131.8	0	0	112.4	I1075 I1076 K1083	I1075-E1079 VanDerWaalsContact O-CB 3.28Å; I1075-E1079 WeakPolarHBondContact O-CB 3.41Å; I1075-E1079 PolarHBondContact O-N 3.14Å; I1076-E1079 WeakPolarHBondContact O-CB 3.39Å; I1076-E1079 PolarHBondContact O-N 3.24Å; E1079-K1083 WeakPolarHBondContact O-CD 3.09Å; E1079-K1083 VanDerWaalsContact O-CE 3.29Å; E1079-K1083 WeakPolarHBondContact O-CE 3.25Å; E1079-K1083 WeakPolarHBondContact O-CG 3.28Å; E1079-K1083 PolarHBondContact O-N 2.96Å; E1079-K1083 VanDerWaalsContact O-N 3.13Å; E1079-K1083 IonicContact OE2-NZ 2.64Å; E1079-K1083 PolarHBondContact OE2-NZ 2.95Å
1080	E	88.8	Confident	82.2	Confident	129 Å²	129	87.3 Å²	87.3	60%	0.603	44%	0.435	S	S	*	.	H	α-helix	trans	-71.3	-37.9	178.7	-70.8	-163.3	165.8	0	0	112.4	I1076 E1078 K1083 A1084	I1076-E1080 WeakPolarHBondContact O-CG 3.38Å; I1076-E1080 PolarHBondContact O-N 2.81Å; E1078-E1080 PolarHBondContact O-N 3.18Å; E1080-K1083 PolarHBondContact O-N 2.96Å; E1080-A1084 WeakPolarHBondContact O-CB 3.35Å; E1080-A1084 PolarHBondContact O-N 3.36Å
1081	K	88	Confident	80.1	Confident	139 Å²	139	87.7 Å²	87.7	60%	0.604	45%	0.445	S	S	*	.	H	α-helix	trans	-61.6	-46.3	173.1	-174.2	178.3	-179.4	-178.4	0	111.9	E1077 E1078 K1083 A1084 D1085	E1077-K1081 VanDerWaalsContact O-CB 3.23Å; E1077-K1081 WeakPolarHBondContact O-CB 3.37Å; E1077-K1081 PolarHBondContact O-N 2.9Å; E1078-K1081 PolarHBondContact O-N 3.23Å; K1081-K1083 VanDerWaalsContact C-N 3.31Å; K1081-K1083 PolarHBondContact O-N 3.1Å; K1081-A1084 PolarHBondContact O-N 3.35Å; K1081-A1084 VanDerWaalsContact O-N 3.15Å; K1081-D1085 PolarHBondContact O-N 3Å
1082	C	82.7	Confident	77.9	Confident	93 Å²	93	93.1 Å²	93.1	63%	0.628	47%	0.47	S	S	*	.	H	α-helix	trans	-61.2	-37.4	174.9	-75.3	0	0	0	0	112.7	E1078 G1086	E1078-C1082 WeakPolarHBondContact O-CB 3.4Å; E1078-C1082 PolarHBondContact O-N 2.87Å; E1078-C1082 PolarHBondContact O-SG 3.42Å; C1082-G1086 PolarHBondContact O-N 3.23Å
1083	K	81.8	Confident	75.6	Confident	111 Å²	111	99 Å²	99	48%	0.483	50%	0.502	S	S	.	.	H	α-helix	trans	-66.9	-40.3	173.8	-68.2	157.2	-159.9	164	0	111.4	E1079 E1080 K1081 N1087	E1079-K1083 WeakPolarHBondContact O-CD 3.09Å; E1079-K1083 VanDerWaalsContact O-CE 3.29Å; E1079-K1083 WeakPolarHBondContact O-CE 3.25Å; E1079-K1083 WeakPolarHBondContact O-CG 3.28Å; E1079-K1083 PolarHBondContact O-N 2.96Å; E1079-K1083 VanDerWaalsContact O-N 3.13Å; E1079-K1083 IonicContact OE2-NZ 2.64Å; E1079-K1083 PolarHBondContact OE2-NZ 2.95Å; E1080-K1083 PolarHBondContact O-N 2.96Å; K1081-K1083 VanDerWaalsContact C-N 3.31Å; K1081-K1083 PolarHBondContact O-N 3.1Å; K1083-N1087 WeakPolarHBondContact O-CB 3.38Å; K1083-N1087 PolarHBondContact O-N 3.02Å; K1083-N1087 VanDerWaalsContact O-N 3.08Å; K1083-N1087 PolarHBondContact O-ND2 3.46Å
1084	A	76.9	Confident	73.3	Confident	48 Å²	48	99.4 Å²	99.4	40%	0.397	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-43.9	177	0	0	0	0	0	112.7	E1080 K1081 N1087 K1088	E1080-A1084 WeakPolarHBondContact O-CB 3.35Å; E1080-A1084 PolarHBondContact O-N 3.36Å; K1081-A1084 PolarHBondContact O-N 3.35Å; K1081-A1084 VanDerWaalsContact O-N 3.15Å; A1084-N1087 PolarHBondContact O-N 3.05Å; A1084-K1088 PolarHBondContact O-N 2.83Å
1085	D	75.2	Confident	70.9	Confident	63 Å²	63	98.4 Å²	98.4	34%	0.337	52%	0.521	S	S	.	.	H	α-helix	trans	-74.3	-34.6	179.2	-69.8	-28.3	0	0	0	112.5	K1081 N1087 K1088 L1089	K1081-D1085 PolarHBondContact O-N 3Å; D1085-N1087 VanDerWaalsContact C-N 3.3Å; D1085-N1087 PolarHBondContact O-N 3.46Å; D1085-K1088 PolarHBondContact O-N 3.27Å; D1085-K1088 WeakPolarHBondContact OD1-CE 3.47Å; D1085-K1088 IonicContact OD1-NZ 2.74Å; D1085-K1088 PolarHBondContact OD1-NZ 3.11Å; D1085-L1089 PolarHBondContact O-N 3.5Å; D1085-L1089 VanDerWaalsContact O-N 3.11Å
1086	G	66.4	Low	68.3	Low	32 Å²	32	103 Å²	103	33%	0.33	55%	0.545	S	S	.	.	H	α-helix	trans	-60.5	-37.5	169.5	0	0	0	0	0	113.1	C1082 L1089 Q1090	C1082-G1086 PolarHBondContact O-N 3.23Å; G1086-L1089 PolarHBondContact O-N 2.97Å; G1086-Q1090 PolarHBondContact O-N 2.69Å; G1086-Q1090 VanDerWaalsContact O-N 3.09Å
1087	N	63.7	Low	65.9	Low	99 Å²	99	107.3 Å²	107.3	53%	0.529	58%	0.575	S	S	.	*	H	α-helix	trans	-67.4	-38.5	174.7	-72.5	-21.3	0	0	0	112.3	K1083 A1084 D1085 L1089 Q1090 V1091	K1083-N1087 WeakPolarHBondContact O-CB 3.38Å; K1083-N1087 PolarHBondContact O-N 3.02Å; K1083-N1087 VanDerWaalsContact O-N 3.08Å; K1083-N1087 PolarHBondContact O-ND2 3.46Å; A1084-N1087 PolarHBondContact O-N 3.05Å; D1085-N1087 VanDerWaalsContact C-N 3.3Å; D1085-N1087 PolarHBondContact O-N 3.46Å; N1087-L1089 VanDerWaalsContact C-N 3.35Å; N1087-L1089 PolarHBondContact O-N 2.9Å; N1087-Q1090 PolarHBondContact O-N 2.94Å; N1087-V1091 WeakPolarHBondContact O-CG2 3.5Å; N1087-V1091 PolarHBondContact O-N 2.98Å; N1087-V1091 VanDerWaalsContact O-N 3.08Å
1088	K	59.5	Low	63.2	Low	124 Å²	124	110.1 Å²	110.1	54%	0.539	59%	0.589	S	S	.	*	H	α-helix	trans	-59.7	-46	173.5	-65.5	169.4	-166.5	164.4	0	111.2	A1084 D1085 Q1090 V1091 E1092	A1084-K1088 PolarHBondContact O-N 2.83Å; D1085-K1088 PolarHBondContact O-N 3.27Å; D1085-K1088 WeakPolarHBondContact OD1-CE 3.47Å; D1085-K1088 IonicContact OD1-NZ 2.74Å; D1085-K1088 PolarHBondContact OD1-NZ 3.11Å; K1088-Q1090 VanDerWaalsContact C-N 3.3Å; K1088-Q1090 PolarHBondContact O-N 3.09Å; K1088-V1091 WeakPolarHBondContact O-CB 3.45Å; K1088-V1091 PolarHBondContact O-N 3.26Å; K1088-V1091 VanDerWaalsContact O-N 3.08Å; K1088-E1092 PolarHBondContact O-N 3.15Å
1089	L	54.5	Low	60.8	Low	100 Å²	100	107.5 Å²	107.5	52%	0.524	59%	0.589	S	S	.	*	H	α-helix	trans	-63.1	-32.3	177.5	-75.3	164.7	0	0	0	113	D1085 G1086 N1087 N1093	D1085-L1089 PolarHBondContact O-N 3.5Å; D1085-L1089 VanDerWaalsContact O-N 3.11Å; G1086-L1089 PolarHBondContact O-N 2.97Å; N1087-L1089 VanDerWaalsContact C-N 3.35Å; N1087-L1089 PolarHBondContact O-N 2.9Å; L1089-N1093 WeakPolarHBondContact O-CB 3.36Å; L1089-N1093 PolarHBondContact O-N 2.67Å; L1089-N1093 PolarHBondContact O-ND2 3.36Å
1090	Q	51.4	Low	58.3	Low	147 Å²	147	111.4 Å²	111.4	69%	0.687	61%	0.613	S	S	*	*	H	α-helix	trans	-70.3	-36.8	171.3	-75.2	-166.8	-2.8	0	0	112.8	G1086 N1087 K1088 S1094	G1086-Q1090 PolarHBondContact O-N 2.69Å; G1086-Q1090 VanDerWaalsContact O-N 3.09Å; N1087-Q1090 PolarHBondContact O-N 2.94Å; K1088-Q1090 VanDerWaalsContact C-N 3.3Å; K1088-Q1090 PolarHBondContact O-N 3.09Å; Q1090-S1094 PolarHBondContact O-N 3.07Å; Q1090-S1094 VanDerWaalsContact O-N 3.15Å
1091	V	54	Low	55.8	Low	100 Å²	100	114.3 Å²	114.3	61%	0.606	63%	0.626	S	S	*	*	H	α-helix	trans	-64.2	-48.2	175.7	173	0	0	0	0	110.7	N1087 K1088 N1093 S1094	N1087-V1091 WeakPolarHBondContact O-CG2 3.5Å; N1087-V1091 PolarHBondContact O-N 2.98Å; N1087-V1091 VanDerWaalsContact O-N 3.08Å; K1088-V1091 WeakPolarHBondContact O-CB 3.45Å; K1088-V1091 PolarHBondContact O-N 3.26Å; K1088-V1091 VanDerWaalsContact O-N 3.08Å; V1091-N1093 VanDerWaalsContact C-N 3.35Å; V1091-N1093 PolarHBondContact O-N 2.82Å; V1091-S1094 WeakPolarHBondContact O-CB 3.3Å; V1091-S1094 PolarHBondContact O-N 3.34Å; V1091-S1094 PolarHBondContact O-OG 3.42Å
1092	E	50	Low	53.2	Low	135 Å²	135	114.7 Å²	114.7	63%	0.631	63%	0.633	S	S	*	*	H	α-helix	trans	-63.2	-37.3	178.7	-68.5	-175.6	140.7	0	0	112.9	K1088 S1094 S1095	K1088-E1092 PolarHBondContact O-N 3.15Å; E1092-S1094 PolarHBondContact O-N 3.1Å; E1092-S1095 PolarHBondContact O-N 3.11Å; E1092-S1095 PolarHBondContact O-OG 3.19Å
1093	N	47.7	Very low	51.3	Low	133 Å²	133	119.5 Å²	119.5	71%	0.711	65%	0.647	S	S	*	*	H	α-helix	trans	-73.7	-11.5	174.9	-78.8	-78.6	0	0	0	113.9	L1089 V1091	L1089-N1093 WeakPolarHBondContact O-CB 3.36Å; L1089-N1093 PolarHBondContact O-N 2.67Å; L1089-N1093 PolarHBondContact O-ND2 3.36Å; V1091-N1093 VanDerWaalsContact C-N 3.35Å; V1091-N1093 PolarHBondContact O-N 2.82Å
1094	S	46	Very low	49	Very low	92 Å²	92	120 Å²	120	64%	0.643	66%	0.658	S	S	*	*	H	α-helix	trans	-82.9	-18.2	172.4	77	0	0	0	0	113.2	Q1090 V1091 E1092 L1096	Q1090-S1094 PolarHBondContact O-N 3.07Å; Q1090-S1094 VanDerWaalsContact O-N 3.15Å; V1091-S1094 WeakPolarHBondContact O-CB 3.3Å; V1091-S1094 PolarHBondContact O-N 3.34Å; V1091-S1094 PolarHBondContact O-OG 3.42Å; E1092-S1094 PolarHBondContact O-N 3.1Å; S1094-L1096 PolarHBondContact O-N 3.16Å
1095	S	45.5	Very low	46.9	Very low	88 Å²	88	124 Å²	124	62%	0.615	67%	0.672	S	S	*	*			trans	-91.5	72.9	179.7	45	0	0	0	0	113.6	E1092	E1092-S1095 PolarHBondContact O-N 3.11Å; E1092-S1095 PolarHBondContact O-OG 3.19Å
1096	L	36.7	Very low	45	Very low	153 Å²	153	130.6 Å²	130.6	80%	0.801	70%	0.701	S	S	*	*			trans	-115.4	140.4	158.3	-87.5	168.2	0	0	0	109.8	S1094 Q1098	S1094-L1096 PolarHBondContact O-N 3.16Å; L1096-Q1098 PolarHBondContact O-N 3.41Å
1097	P	44.1	Very low	43.5	Very low	125 Å²	125	137.9 Å²	137.9	81%	0.812	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-77.5	122.4	-160.8	29.3	-35.1	0	0	0	112.8
1098	Q	35.5	Very low	42.1	Very low	197 Å²	197	137.6 Å²	137.6	92%	0.921	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-96.1	133	159.8	-162.9	166.2	12.7	0	0	108.5	L1096	L1096-Q1098 PolarHBondContact O-N 3.41Å
1099	A	38.7	Very low	40.9	Very low	78 Å²	78	140 Å²	140	65%	0.645	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-98	154.2	-164.4	0	0	0	0	0	114.4
1100	D	37.5	Very low	40	Very low	154 Å²	154	144.2 Å²	144.2	82%	0.824	77%	0.774	S	S	*	*			trans	68.1	137.9	154.5	-55.4	-29.5	0	0	0	121.6
1101	E	35.7	Very low	39.1	Very low	189 Å²	189	146.4 Å²	146.4	88%	0.883	78%	0.784	S	S	*	*			trans	54.9	127.2	164.3	-65.3	-171.8	141	0	0	118.2
1102	I	34.6	Very low	38.2	Very low	147 Å²	147	149.9 Å²	149.9	75%	0.754	79%	0.794	S	S	*	*			cis	-147	147.2	44	-74.5	169.4	0	0	0	111.1	V1104	I1102-V1104 HydrophobicContact CG2-CG2 3.89Å
1103	Q	41.1	Very low	37.4	Very low	194 Å²	194	149.5 Å²	149.5	91%	0.907	79%	0.792	S	S	*	*			trans	-95.2	134.7	164.1	-71.1	-178.7	-27.9	0	0	111.4
1104	V	34.1	Very low	36.9	Very low	121 Å²	121	152.5 Å²	152.5	73%	0.733	79%	0.793	S	S	*	*			trans	-137.8	100.6	162.4	-177.7	0	0	0	0	110.3	I1102	I1102-V1104 HydrophobicContact CG2-CG2 3.89Å
1105	I	33	Very low	36.4	Very low	134 Å²	134	155.6 Å²	155.6	69%	0.687	80%	0.797	S	S	*	*			trans	44.5	113.6	140	-54.1	173.1	0	0	0	117.8	E1107	I1105-E1107 HydrophobicContact CG2-CB 4.49Å; I1105-E1107 HydrophobicContact CG2-CG 3.91Å
1106	E	36.3	Very low	35.9	Very low	200 Å²	200	160 Å²	160	94%	0.935	81%	0.806	S	S	*	*			trans	-75.8	123.6	147.3	-64.9	176.6	127.8	0	0	108.9
1107	E	33	Very low	35.7	Very low	185 Å²	185	164.7 Å²	164.7	86%	0.864	82%	0.823	S	S	*	*			trans	-113.6	128.5	157.1	-93.6	178.5	160.7	0	0	107.5	I1105	I1105-E1107 HydrophobicContact CG2-CB 4.49Å; I1105-E1107 HydrophobicContact CG2-CG 3.91Å
1108	A	35.7	Very low	35.2	Very low	94 Å²	94	166.7 Å²	166.7	78%	0.777	82%	0.824	S	S	*	*			trans	-103.6	140.2	171.5	0	0	0	0	0	108.5
1109	D	34.3	Very low	35.2	Very low	173 Å²	173	165.1 Å²	165.1	93%	0.925	82%	0.819	S	S	*	*			trans	-147.3	143	153.9	-99.9	-34.3	0	0	0	109
1110	E	35.6	Very low	35	Very low	189 Å²	189	169.9 Å²	169.9	88%	0.883	83%	0.829	S	S	*	*			trans	-92.8	131.9	173	-55	176.7	127.9	0	0	108.3
1111	E	32	Very low	34.9	Very low	194 Å²	194	170.8 Å²	170.8	91%	0.907	83%	0.829	S	S	*	*			trans	-161.2	176.4	148.6	-119.9	170.6	-153.3	0	0	113.7
1112	E	35.5	Very low	34.8	Very low	173 Å²	173	169.7 Å²	169.7	81%	0.808	83%	0.826	S	S	*	*			trans	-86.2	169.2	-146.4	-59	-176.1	121.4	0	0	117.6
1113	E	33.6	Very low	34.9	Very low	126 Å²	126	171.2 Å²	171.2	59%	0.589	83%	0.83	S	S	*	*			trans	7.1	143.8	141.3	-63.8	-144.1	112.4	0	0	121.6
1114	R	35.8	Very low	34.4	Very low	197 Å²	197	169.6 Å²	169.6	74%	0.743	83%	0.825	S	S	*	*			trans	45.6	123.3	140.7	-52.9	172.6	-147.5	168.3	11.7	116.6
1115	Q	36	Very low	34.4	Very low	157 Å²	157	173.3 Å²	173.3	73%	0.734	83%	0.832	S	S	*	*				-166.8	141.1	62.1	-74.3	176	24.4	0	0	110.9
1116	F	34.9	Very low	34.6	Very low	180 Å²	180	176.6 Å²	176.6	79%	0.789	84%	0.844	S	S	*	*			trans	64.7	137.8	172.2	-59.7	-74.7	0	0	0	115.6
1117	E	32.2	Very low	34.4	Very low	251 Å²	251	174.5 Å²	174.5	100%	1.173	84%	0.836	S	S	*	*			cis	-147.5	0	-6.3	-167.2	165.7	-141.8	0	0	110

Retrieved 1,117 of 1,117 residues in 188.6 ms (Link to these results)

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